A0A5K4F0A3_SCHMA Loading...

Cation-transporting ATPase

AlphaFold DB , UniProt , Accession A0A5K4F0A3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,424 aa.

						>A0A5K4F0A3_SCHMA|A0A5K4F0A3
MTFLPCGNIKKSRSHKISCEGSTSDIEGYKFSYVRYICVIIGCVLSGGLLRLLFHWFPHWMLSCTHKSCDLSEANKVKIKDVSGIYIHKVQYPTRGKSRSQYDSSTTDAFLENQTKRPYIIHKKLKYIWNFESENFELLQNWDERPYDEVLNAPTLTTDLIETRRNLYGINKIDVSLTPIMRLVLNGCLTPFHCFQVFSCVIWFCVEYEIYATCIAVFSVTSLIFQVYELRKNERALKKTVCISSKVNVCRRRDGEDDFMLVDSTELVPGDLIAIPSSGCLMQCDAVLLMGNCIVNESSLTGESLPITKIPLPNGQYENTTFDFRSCPRHILFSGTSVIQTRGDINKRVLAVVIRTGFMTTKGELVRSIMFPKPMKFKFTQDAYQFLGALCGVALVGLCVSVYLMYWNKKDLYYIILRPLDLVTIVIPPILPVAMSVGIVFAQRRLRNHGIYCINPSVMNVCGVINLTCFDKTGTLTEDGLDLWGVVPNRDGILGKPEFEPSKLDYGPLIECMATCHSLTRIDGVLSGDPLDVKMFQSTKWEFIEVISEDQHNFDLVISAIVRPKEDEYGDIFEKIPYEIGIVRQFPFSSSVQRMSVITRTLNESQFHIYTKGAPETIEVLCRRDTIPTNFHSNLLEFTREGFRVLALAWRPIKASYLRIMRISRDRVEHNLLFLGLLVMENRLKPESGPVIKTLRQANIRPVMVTGDHMLTSLSVARDCEMIDELDRVVIVTARPPPCPGNDFASEVLNENQPIPVPNTGFSTETNPSKIQDPINAGDNKNFSDDLINSLVQFHYAEDLHRPVTEVATTNIQLKRNLTKTDNRETSKPSFFKRMETRFGFGRLQSSSKVLTALPTLVNSAIYHADSEKVDNHTDYEKCLFDKLDKHLDKSDTFKYKDSIENRYSLSIRMIDRPDFHLAISGKTWSVIQEHYPWLIPKLVVKGTVFARFSPEQKAQVIEALQSVGYFVSMCGDGANDCGALKVAHAGISLSEAEASIASPFTSKKQNISCVPMLIREGRCALVTSFGTFKFMAGYSLIQSFSTIILFVIGSNLSEWEFLYCDFVIITTLSLTFGYTHAYPHLSAEPPTMRLLSMVTMISLFGQVIIGFIIQATAFILIRFQSWYMPLYSYSNTAEYQNYENAAVFMVSTYQYIILAIAFSKGAPYRKSILTNYAFVLNILVCFVFSLYLTTYPVNWILERLQLVRIPSVWFILILHSMVLANFMASYIVESIVDGVSFRRRIRRIRRALFPRRVERKAYERIREEIDRSAGVWPPLLRSASLQALPRDLFTDENLDVTTRPRSRRLSSAVSNDTDVEVASVQSEITDRRQLPFSSTDGDIGLHKVVGKHFTNQMSVNENQNPTFTLGGSLKKRNLSVDTLQHHTVYDPDVFDHSSVSSTPSDLEFPVIEKMSSHLRNGYGENRE
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.1	Very low	30.7	Very low	237 Å²	237	161.1 Å²	161.1	100%	1.167	86%	0.862	S	S	*	*				0	134.6	0	-79.7	174.9	169.8	0	0	108.1
2	T	29.4	Very low	31.7	Very low	138 Å²	138	155.3 Å²	155.3	85%	0.847	84%	0.843	S	S	*	*			trans	-66.4	135.1	-168.2	22.4	0	0	0	0	112.8	L4	T2-L4 PolarHBondContact O-N 3.43Å
3	F	29.3	Very low	33	Very low	216 Å²	216	158 Å²	158	95%	0.947	83%	0.834	S	S	*	*			trans	-69.6	113	171.8	-75.5	-95.8	0	0	0	109.5
4	L	31.4	Very low	34.5	Very low	157 Å²	157	153.1 Å²	153.1	82%	0.822	82%	0.819	S	S	*	*			trans	-77	139.9	163.5	-80	164.2	0	0	0	109.3	T2	T2-L4 PolarHBondContact O-N 3.43Å
5	P	32.3	Very low	36.6	Very low	118 Å²	118	145.5 Å²	145.5	77%	0.766	78%	0.776	S	S	*	*			trans	-72.1	139.3	-172.6	28.9	-34.7	0	0	0	111.9	G7	P5-G7 PolarHBondContact O-N 3.22Å
6	C	27.3	Very low	39	Very low	126 Å²	126	143 Å²	143	85%	0.851	76%	0.756	S	S	*	*			trans	-69.6	94.1	173.6	-75.1	0	0	0	0	110.9	N8	C6-N8 PolarHBondContact O-N 3.08Å
7	G	29.1	Very low	40.9	Very low	68 Å²	68	134.9 Å²	134.9	70%	0.701	71%	0.714	S	S	*	*			trans	-74.9	115.6	171	0	0	0	0	0	112.2	P5 I9	P5-G7 PolarHBondContact O-N 3.22Å; G7-I9 PolarHBondContact O-N 3.4Å
8	N	26.9	Very low	42.1	Very low	160 Å²	160	132 Å²	132	86%	0.856	71%	0.706	S	S	*	*			trans	28.8	82.5	161	-71.2	-12.2	0	0	0	117.1	C6 K10	C6-N8 PolarHBondContact O-N 3.08Å; N8-K10 PolarHBondContact O-N 3.06Å
9	I	33.1	Very low	43	Very low	154 Å²	154	125.3 Å²	125.3	79%	0.79	67%	0.671	S	S	*	*			trans	-69	96.4	162	-59.6	172.5	0	0	0	108.1	G7 K11	G7-I9 PolarHBondContact O-N 3.4Å; I9-K11 PolarHBondContact O-N 3.38Å
10	K	34	Very low	43.6	Very low	189 Å²	189	123.7 Å²	123.7	82%	0.822	66%	0.659	S	S	*	*			trans	-53.8	135.7	153.5	-76.7	-170.2	174.2	-169.4	0	107.1	N8 S12	N8-K10 PolarHBondContact O-N 3.06Å; K10-S12 VanDerWaalsContact C-N 3.27Å; K10-S12 PolarHBondContact O-N 3.32Å
11	K	36.2	Very low	44.1	Very low	209 Å²	209	121.8 Å²	121.8	91%	0.909	67%	0.669	S	S	*	*			trans	-58.6	90.3	172.8	-77.3	-178.1	175.2	178.9	0	109.5	I9 R13	I9-K11 PolarHBondContact O-N 3.38Å; K11-R13 PolarHBondContact O-N 3.13Å
12	S	42.2	Very low	45.4	Very low	92 Å²	92	112.1 Å²	112.1	64%	0.643	62%	0.624	S	S	*	*			trans	-61	121.1	164.7	168.7	0	0	0	0	106.6	K10 S14	K10-S12 VanDerWaalsContact C-N 3.27Å; K10-S12 PolarHBondContact O-N 3.32Å; S12-S14 PolarHBondContact O-N 3.23Å; S12-S14 VanDerWaalsContact O-N 3.1Å
13	R	48.6	Very low	47.2	Very low	190 Å²	190	109.8 Å²	109.8	72%	0.717	61%	0.61	S	S	*	*			trans	-58.5	115	164.5	-76.7	177.9	169.9	173.1	-4.8	105.8	K11 H15	K11-R13 PolarHBondContact O-N 3.13Å; R13-H15 VanDerWaalsContact C-N 3.28Å; R13-H15 PolarHBondContact O-CD2 2.99Å; R13-H15 PolarHBondContact O-N 3.18Å
14	S	54.4	Low	49.5	Very low	89 Å²	89	99.6 Å²	99.6	62%	0.622	57%	0.565	S	S	*	*			trans	-75.7	87.6	175	57.5	0	0	0	0	108	S12	S12-S14 PolarHBondContact O-N 3.23Å; S12-S14 VanDerWaalsContact O-N 3.1Å
15	H	65.5	Low	52	Low	40 Å²	40	94.8 Å²	94.8	19%	0.185	54%	0.541	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	146.2	172.8	-66.2	-101.2	0	0	0	108.8	R13 I26 L71	R13-H15 VanDerWaalsContact C-N 3.28Å; R13-H15 PolarHBondContact O-CD2 2.99Å; R13-H15 PolarHBondContact O-N 3.18Å; H15-I26 HydrophobicContact CB-CG2 3.57Å; H15-I26 WeakPolarHBondContact O-CG2 3.46Å; H15-I26 PolarHBondContact O-N 2.78Å; H15-L71 HydrophobicContact CB-CD1 3.75Å; H15-L71 WeakPolarHBondContact CD2-CD1 3.36Å; H15-L71 VanDerWaalsContact CG-CD1 3.43Å
16	K	74.9	Confident	54.6	Low	105 Å²	105	89.4 Å²	89.4	46%	0.457	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	147.2	179.4	-71.4	-178.2	170.7	-167.3	0	109.8	S24 N135	K16-S24 VanDerWaalsContact CA-O 3.31Å; K16-S24 WeakPolarHBondContact CA-O 3.4Å; K16-N135 PolarHBondContact O-ND2 3.49Å
17	I	71.9	Confident	57.5	Low	6 Å²	6	86.1 Å²	86.1	3%	0.031	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	137.1	167.9	-31.2	174.4	0	0	0	107.9	T23 S24 I26 I79 Y127	I17-T23 WeakPolarHBondContact O-CA 3.28Å; I17-S24 PolarHBondContact N-O 2.94Å; I17-S24 PolarHBondContact O-N 3.27Å; I17-I26 HydrophobicContact CD1-CB 4.05Å; I17-I26 HydrophobicContact CD1-CD1 3.45Å; I17-I26 VanDerWaalsContact CD1-CD1 3.45Å; I17-I26 HydrophobicContact CD1-CG1 4.08Å; I17-I26 HydrophobicContact CG1-CB 3.85Å; I17-I26 HydrophobicContact CG1-CD1 3.88Å; I17-I26 HydrophobicContact CG1-CG1 4.37Å; I17-I26 HydrophobicContact CG1-CG2 3.93Å; I17-I79 HydrophobicContact CD1-CD1 3.74Å; I17-I79 HydrophobicContact CD1-CG1 4.02Å; I17-I79 HydrophobicContact CD1-CG2 4.45Å; I17-Y127 HydrophobicContact CG2-CD1 3.59Å; I17-Y127 HydrophobicContact CG2-CE1 3.3Å
18	S	62.5	Low	60.3	Low	82 Å²	82	83 Å²	83	57%	0.573	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	136.1	165.3	45.3	0	0	0	0	110.4	S22	S18-S22 WeakPolarHBondContact CA-O 3.36Å
19	C	59	Low	63.3	Low	5 Å²	5	76.1 Å²	76.1	3%	0.034	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	112.7	174	-173.5	0	0	0	0	107.5	G21 S22 Y127	C19-G21 VanDerWaalsContact C-N 3.26Å; C19-G21 PolarHBondContact O-N 3.31Å; C19-S22 PolarHBondContact N-O 3.46Å; C19-S22 PolarHBondContact O-N 3.48Å; C19-S22 PolarHBondContact O-OG 3.14Å; C19-S22 VanDerWaalsContact O-OG 3.11Å; C19-Y127 WeakPolarHBondContact CB-OH 3.38Å; C19-Y127 PolarHBondContact SG-OH 2.99Å; C19-Y127 VanDerWaalsContact SG-OH 3.34Å
20	E	55.8	Low	66.1	Low	93 Å²	93	72.7 Å²	72.7	44%	0.435	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.1	41.9	-179.7	-60.4	172.2	-166.3	0	0	113.4	S22 R367	E20-S22 PolarHBondContact O-N 3.28Å; E20-R367 IonicContact OE1-CZ 2.98Å; E20-R367 IonicContact OE1-NE 2.82Å; E20-R367 PolarHBondContact OE1-NE 3.13Å; E20-R367 IonicContact OE1-NH2 2.73Å; E20-R367 PolarHBondContact OE1-NH2 3.05Å
21	G	53.9	Low	68.8	Low	84 Å²	84	68 Å²	68	87%	0.866	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	-7.1	-177.5	0	0	0	0	0	115.8	C19	C19-G21 VanDerWaalsContact C-N 3.26Å; C19-G21 PolarHBondContact O-N 3.31Å
22	S	55.5	Low	71.4	Confident	34 Å²	34	59.6 Å²	59.6	24%	0.238	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	138.7	170.1	82.2	0	0	0	0	111.4	S18 C19 E20	S18-S22 WeakPolarHBondContact CA-O 3.36Å; C19-S22 PolarHBondContact N-O 3.46Å; C19-S22 PolarHBondContact O-N 3.48Å; C19-S22 PolarHBondContact O-OG 3.14Å; C19-S22 VanDerWaalsContact O-OG 3.11Å; E20-S22 PolarHBondContact O-N 3.28Å
23	T	67.6	Low	73.7	Confident	88 Å²	88	63.1 Å²	63.1	54%	0.54	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	122.2	171.8	61.1	0	0	0	0	110	I17	I17-T23 WeakPolarHBondContact O-CA 3.28Å
24	S	77.3	Confident	75.7	Confident	2 Å²	2	59.1 Å²	59.1	1%	0.014	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	136.7	176.2	-62.5	0	0	0	0	110.3	K16 I17 K80 D81	K16-S24 VanDerWaalsContact CA-O 3.31Å; K16-S24 WeakPolarHBondContact CA-O 3.4Å; I17-S24 PolarHBondContact N-O 2.94Å; I17-S24 PolarHBondContact O-N 3.27Å; S24-K80 WeakPolarHBondContact CA-O 3.44Å; S24-D81 WeakPolarHBondContact OG-CB 3.32Å; S24-D81 PolarHBondContact OG-OD1 3.29Å
25	D	84.3	Confident	77.5	Confident	57 Å²	57	60.1 Å²	60.1	31%	0.305	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	136	175.3	-58.1	-38.1	0	0	0	109.6	I79 K80	D25-I79 WeakPolarHBondContact O-CA 3.44Å; D25-K80 HydrophobicContact CB-CB 4.42Å; D25-K80 PolarHBondContact N-O 3.4Å; D25-K80 PolarHBondContact O-N 2.85Å; D25-K80 IonicContact OD2-NZ 2.61Å
26	I	87.2	Confident	78.7	Confident	5 Å²	5	62.6 Å²	62.6	3%	0.026	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	132.5	179.4	-166.7	177.5	0	0	0	112	H15 I17 L71 V77 I79 I120 F136	H15-I26 HydrophobicContact CB-CG2 3.57Å; H15-I26 WeakPolarHBondContact O-CG2 3.46Å; H15-I26 PolarHBondContact O-N 2.78Å; I17-I26 HydrophobicContact CD1-CB 4.05Å; I17-I26 HydrophobicContact CD1-CD1 3.45Å; I17-I26 VanDerWaalsContact CD1-CD1 3.45Å; I17-I26 HydrophobicContact CD1-CG1 4.08Å; I17-I26 HydrophobicContact CG1-CB 3.85Å; I17-I26 HydrophobicContact CG1-CD1 3.88Å; I17-I26 HydrophobicContact CG1-CG1 4.37Å; I17-I26 HydrophobicContact CG1-CG2 3.93Å; I26-L71 HydrophobicContact CB-CD2 4.45Å; I26-L71 HydrophobicContact CD1-CD2 3.6Å; I26-L71 HydrophobicContact CG1-CD2 3.79Å; I26-L71 HydrophobicContact CG2-CD2 3.91Å; I26-V77 HydrophobicContact CD1-CB 4.48Å; I26-V77 HydrophobicContact CD1-CG1 3.47Å; I26-V77 VanDerWaalsContact CD1-CG1 3.47Å; I26-V77 HydrophobicContact CG1-CB 4.49Å; I26-V77 HydrophobicContact CG1-CG1 3.27Å; I26-I79 HydrophobicContact CD1-CG1 4.29Å; I26-I79 HydrophobicContact CG1-CG1 4.03Å; I26-I120 HydrophobicContact CD1-CD1 4.22Å; I26-F136 HydrophobicContact CD1-CB 4.48Å; I26-F136 HydrophobicContact CD1-CD2 4.02Å
27	E	88.1	Confident	79.5	Confident	56 Å²	56	60.9 Å²	60.9	26%	0.262	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	131.1	-179.4	-67.6	170.8	-149.8	0	0	111.7	Y29 V77 K78	E27-Y29 HydrophobicContact CB-CD2 4.39Å; E27-Y29 HydrophobicContact CB-CE2 3.66Å; E27-Y29 WeakPolarHBondContact O-CD2 3.38Å; E27-Y29 WeakPolarHBondContact OE2-CE2 3.44Å; E27-Y29 PolarHBondContact OE2-OH 3.34Å; E27-V77 WeakPolarHBondContact O-CA 3.45Å; E27-V77 VanDerWaalsContact O-CG1 3.24Å; E27-V77 WeakPolarHBondContact O-CG1 3.28Å; E27-K78 HydrophobicContact CB-CB 4.34Å; E27-K78 PolarHBondContact N-O 3.26Å; E27-K78 PolarHBondContact O-N 2.96Å; E27-K78 IonicContact OE1-NZ 3.89Å; E27-K78 PolarHBondContact OE1-NZ 3.48Å; E27-K78 WeakPolarHBondContact OE2-CD 3.41Å; E27-K78 WeakPolarHBondContact OE2-CE 3.23Å; E27-K78 IonicContact OE2-NZ 3.34Å; E27-K78 PolarHBondContact OE2-NZ 3.43Å
28	G	87.9	Confident	80.4	Confident	2 Å²	2	64.4 Å²	64.4	2%	0.021	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	139.9	177.7	0	0	0	0	0	114.4	S68 C69	G28-S68 WeakPolarHBondContact O-CA 3.44Å; G28-C69 CarbonylContact C-O 3.58Å; G28-C69 VanDerWaalsContact C-SG 3.6Å; G28-C69 WeakPolarHBondContact CA-O 3.4Å; G28-C69 PolarHBondContact O-N 2.92Å; G28-C69 VanDerWaalsContact O-O 3.12Å
29	Y	90.5	Very high	81.8	Confident	17 Å²	17	61.2 Å²	61.2	7%	0.067	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	124.1	179.2	-73	-97	0	0	0	112.6	E27 L62 H66 K67 C69 N75 K76 K78	E27-Y29 HydrophobicContact CB-CD2 4.39Å; E27-Y29 HydrophobicContact CB-CE2 3.66Å; E27-Y29 WeakPolarHBondContact O-CD2 3.38Å; E27-Y29 WeakPolarHBondContact OE2-CE2 3.44Å; E27-Y29 PolarHBondContact OE2-OH 3.34Å; Y29-L62 HydrophobicContact CD1-CD2 4.17Å; Y29-L62 HydrophobicContact CD1-CG 3.92Å; Y29-L62 HydrophobicContact CD2-CD2 3.71Å; Y29-L62 HydrophobicContact CD2-CG 4.31Å; Y29-L62 HydrophobicContact CE1-CD2 4.34Å; Y29-L62 HydrophobicContact CE1-CG 4.28Å; Y29-L62 HydrophobicContact CE2-CD2 3.92Å; Y29-L62 HydrophobicContact CG-CD1 4.25Å; Y29-L62 HydrophobicContact CG-CD2 3.86Å; Y29-L62 HydrophobicContact CG-CG 3.94Å; Y29-H66 HydrophobicContact CD1-CB 4.03Å; Y29-H66 HydrophobicContact CG-CB 4.44Å; Y29-K67 WeakPolarHBondContact CA-O 3.47Å; Y29-C69 VanDerWaalsContact C-SG 3.59Å; Y29-N75 PolarHBondContact O-N 3.49Å; Y29-K76 PolarHBondContact N-O 3.31Å; Y29-K76 PolarHBondContact O-N 2.88Å; Y29-K78 HydrophobicContact CD2-CB 4.14Å; Y29-K78 HydrophobicContact CE2-CB 3.78Å; Y29-K78 HydrophobicContact CE2-CD 4.03Å
30	K	91.4	Very high	83.3	Confident	81 Å²	81	64.5 Å²	64.5	35%	0.352	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	136.6	176.5	-165	166.3	-174.9	167.7	0	110.5	H66 K67 C69 E73 N75	K30-H66 CarbonylContact O-C 3.35Å; K30-H66 WeakPolarHBondContact O-CA 3.46Å; K30-H66 VanDerWaalsContact O-CB 3.3Å; K30-H66 WeakPolarHBondContact O-CB 3.29Å; K30-K67 PolarHBondContact N-O 3.1Å; K30-K67 PolarHBondContact O-N 2.94Å; K30-C69 HydrophobicContact CB-CB 4.03Å; K30-C69 PolarHBondContact N-SG 2.69Å; K30-C69 VanDerWaalsContact N-SG 3.4Å; K30-E73 HydrophobicContact CD-CB 4.22Å; K30-E73 WeakPolarHBondContact CD-OE2 3.35Å; K30-E73 IonicContact NZ-OE1 3.88Å; K30-E73 PolarHBondContact NZ-OE1 3.28Å; K30-E73 VanDerWaalsContact NZ-OE1 3.1Å; K30-E73 IonicContact NZ-OE2 2.88Å; K30-E73 PolarHBondContact NZ-OE2 2.81Å; K30-N75 WeakPolarHBondContact CA-OD1 3.45Å
31	F	90.4	Very high	85	Confident	91 Å²	91	64.4 Å²	64.4	40%	0.399	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	140.3	-178.8	-179	-108.8	0	0	0	111.4	Y33 Y36 H66 N75	F31-Y33 HydrophobicContact CE1-CD2 4.17Å; F31-Y36 HydrophobicContact CE2-CD1 4.44Å; F31-Y36 AromaticContact CE2-CD2 3.98Å; F31-Y36 HydrophobicContact CE2-CD2 3.98Å; F31-Y36 AromaticContact CE2-CG 3.82Å; F31-Y36 HydrophobicContact CE2-CG 3.82Å; F31-Y36 AromaticContact CZ-CD1 3.9Å; F31-Y36 HydrophobicContact CZ-CD1 3.9Å; F31-Y36 HydrophobicContact CZ-CD2 4.26Å; F31-Y36 AromaticContact CZ-CG 3.7Å; F31-Y36 HydrophobicContact CZ-CG 3.7Å; F31-H66 AromaticContact CD2-CE1 3.73Å; F31-H66 AromaticContact CD2-NE2 3.8Å; F31-N75 PolarHBondContact N-OD1 3.43Å
32	S	90.6	Very high	86.8	Confident	32 Å²	32	61.4 Å²	61.4	22%	0.224	31%	0.313	C	S	.	.			trans	-129.7	112.7	179.1	177.2	0	0	0	0	110.4	V34 R35 Y36 T65	S32-V34 PolarHBondContact O-N 3.06Å; S32-R35 PolarHBondContact O-N 2.98Å; S32-Y36 WeakPolarHBondContact O-CB 3.32Å; S32-Y36 PolarHBondContact O-N 3.36Å; S32-T65 PolarHBondContact N-O 2.98Å
33	Y	90.1	Very high	88.5	Confident	166 Å²	166	60.8 Å²	60.8	65%	0.651	31%	0.308	S	S	*	.	H	α-helix	trans	-61.3	-43.2	-174.2	-164.7	-110	0	0	0	112.7	F31 R35 Y36 I37	F31-Y33 HydrophobicContact CE1-CD2 4.17Å; Y33-R35 PolarHBondContact O-N 3.02Å; Y33-Y36 PolarHBondContact O-N 3.39Å; Y33-I37 HydrophobicContact CD1-CD1 3.7Å; Y33-I37 HydrophobicContact CE1-CD1 3.4Å; Y33-I37 VanDerWaalsContact CE1-CD1 3.4Å; Y33-I37 HydrophobicContact CE1-CG1 4.35Å; Y33-I37 WeakPolarHBondContact O-CG1 3.27Å; Y33-I37 PolarHBondContact O-N 2.92Å
34	V	91.2	Very high	89.7	Confident	107 Å²	107	61.9 Å²	61.9	65%	0.648	31%	0.314	S	S	*	.	H	α-helix	trans	-59.3	-49.3	176.6	-177.6	0	0	0	0	111.2	S32 Y36 I37 C38	S32-V34 PolarHBondContact O-N 3.06Å; V34-Y36 VanDerWaalsContact C-N 3.32Å; V34-Y36 PolarHBondContact O-N 3.42Å; V34-I37 PolarHBondContact O-N 3.15Å; V34-C38 PolarHBondContact O-N 3.09Å; V34-C38 PolarHBondContact O-SG 3.41Å
35	R	92.1	Very high	90.4	Very high	109 Å²	109	68.7 Å²	68.7	41%	0.411	35%	0.35	S	S	.	.	H	α-helix	trans	-59.6	-42.1	177.1	-80	-170.9	177	-153.5	-8.6	112.2	S32 Y33 C38 V39 S63 C64 H66	S32-R35 PolarHBondContact O-N 2.98Å; Y33-R35 PolarHBondContact O-N 3.02Å; R35-C38 PolarHBondContact O-N 3.41Å; R35-V39 WeakPolarHBondContact O-CG2 3.32Å; R35-V39 PolarHBondContact O-N 3.48Å; R35-S63 PolarHBondContact NH1-O 3.43Å; R35-C64 WeakPolarHBondContact CB-O 3.5Å; R35-H66 PolarHBondContact NH1-O 3.47Å
36	Y	90.8	Very high	90.7	Very high	92 Å²	92	67.8 Å²	67.8	36%	0.361	35%	0.348	S	S	.	.	H	α-helix	trans	-63.3	-42.4	176.6	-178.7	-109.4	0	0	0	112.7	F31 S32 Y33 V34 V39 I40 T65	F31-Y36 HydrophobicContact CE2-CD1 4.44Å; F31-Y36 AromaticContact CE2-CD2 3.98Å; F31-Y36 HydrophobicContact CE2-CD2 3.98Å; F31-Y36 AromaticContact CE2-CG 3.82Å; F31-Y36 HydrophobicContact CE2-CG 3.82Å; F31-Y36 AromaticContact CZ-CD1 3.9Å; F31-Y36 HydrophobicContact CZ-CD1 3.9Å; F31-Y36 HydrophobicContact CZ-CD2 4.26Å; F31-Y36 AromaticContact CZ-CG 3.7Å; F31-Y36 HydrophobicContact CZ-CG 3.7Å; S32-Y36 WeakPolarHBondContact O-CB 3.32Å; S32-Y36 PolarHBondContact O-N 3.36Å; Y33-Y36 PolarHBondContact O-N 3.39Å; V34-Y36 VanDerWaalsContact C-N 3.32Å; V34-Y36 PolarHBondContact O-N 3.42Å; Y36-V39 PolarHBondContact O-N 3.18Å; Y36-I40 HydrophobicContact CD1-CD1 3.93Å; Y36-I40 HydrophobicContact CE1-CD1 3.39Å; Y36-I40 HydrophobicContact CE1-CG1 4.35Å; Y36-I40 HydrophobicContact CE2-CD1 4.39Å; Y36-I40 PolarHBondContact O-N 2.69Å; Y36-T65 HydrophobicContact CD2-CG2 4.04Å
37	I	91.5	Very high	90.7	Very high	69 Å²	69	71.3 Å²	71.3	35%	0.354	39%	0.385	S	S	.	.	H	α-helix	trans	-62.2	-47.2	174.5	-72.2	173	0	0	0	111.2	Y33 V34 V39 I40 I41	Y33-I37 HydrophobicContact CD1-CD1 3.7Å; Y33-I37 HydrophobicContact CE1-CD1 3.4Å; Y33-I37 VanDerWaalsContact CE1-CD1 3.4Å; Y33-I37 HydrophobicContact CE1-CG1 4.35Å; Y33-I37 WeakPolarHBondContact O-CG1 3.27Å; Y33-I37 PolarHBondContact O-N 2.92Å; V34-I37 PolarHBondContact O-N 3.15Å; I37-V39 PolarHBondContact O-N 3.34Å; I37-I40 PolarHBondContact O-N 2.85Å; I37-I40 VanDerWaalsContact O-N 3.07Å; I37-I41 HydrophobicContact CG2-CD1 3.72Å; I37-I41 HydrophobicContact CG2-CG1 4.32Å; I37-I41 WeakPolarHBondContact O-CG1 3.3Å; I37-I41 PolarHBondContact O-N 2.85Å
38	C	91.4	Very high	90.6	Very high	80 Å²	80	70 Å²	70	54%	0.541	39%	0.388	S	S	.	.	H	α-helix	trans	-57.1	-38.6	176.3	-63.9	0	0	0	0	112.1	V34 R35 G42	V34-C38 PolarHBondContact O-N 3.09Å; V34-C38 PolarHBondContact O-SG 3.41Å; R35-C38 PolarHBondContact O-N 3.41Å; C38-G42 PolarHBondContact O-N 3.42Å
39	V	90.8	Very high	90.4	Very high	15 Å²	15	75.9 Å²	75.9	9%	0.091	42%	0.418	C	S	.	.	H	α-helix	trans	-66.3	-41.4	174.7	161.1	0	0	0	0	112.3	R35 Y36 I37 G42 C43 F54 C64 T65	R35-V39 WeakPolarHBondContact O-CG2 3.32Å; R35-V39 PolarHBondContact O-N 3.48Å; Y36-V39 PolarHBondContact O-N 3.18Å; I37-V39 PolarHBondContact O-N 3.34Å; V39-G42 PolarHBondContact O-N 3.13Å; V39-C43 WeakPolarHBondContact O-CB 3.32Å; V39-C43 PolarHBondContact O-N 2.93Å; V39-C43 PolarHBondContact O-SG 3.44Å; V39-F54 HydrophobicContact CG1-CD2 4.28Å; V39-F54 HydrophobicContact CG1-CE2 3.75Å; V39-F54 HydrophobicContact CG2-CE2 4.22Å; V39-F54 HydrophobicContact CG2-CZ 4.38Å; V39-C64 HydrophobicContact CG2-CB 3.64Å; V39-T65 HydrophobicContact CB-CG2 3.93Å; V39-T65 HydrophobicContact CG1-CG2 3.82Å; V39-T65 HydrophobicContact CG2-CG2 3.81Å
40	I	91	Very high	90.3	Very high	75 Å²	75	77.6 Å²	77.6	39%	0.385	43%	0.428	S	S	.	.	H	α-helix	trans	-61.4	-49.3	174.5	-72.3	173.3	0	0	0	110.4	Y36 I37 G42 C43 V44	Y36-I40 HydrophobicContact CD1-CD1 3.93Å; Y36-I40 HydrophobicContact CE1-CD1 3.39Å; Y36-I40 HydrophobicContact CE1-CG1 4.35Å; Y36-I40 HydrophobicContact CE2-CD1 4.39Å; Y36-I40 PolarHBondContact O-N 2.69Å; I37-I40 PolarHBondContact O-N 2.85Å; I37-I40 VanDerWaalsContact O-N 3.07Å; I40-G42 VanDerWaalsContact C-N 3.31Å; I40-G42 PolarHBondContact O-N 3.37Å; I40-C43 WeakPolarHBondContact O-CA 3.38Å; I40-C43 WeakPolarHBondContact O-CB 3.24Å; I40-C43 PolarHBondContact O-N 2.8Å; I40-V44 HydrophobicContact CG2-CG2 4.42Å; I40-V44 WeakPolarHBondContact O-CG2 3.44Å; I40-V44 PolarHBondContact O-N 2.72Å
41	I	92.2	Very high	90.2	Very high	91 Å²	91	79.7 Å²	79.7	47%	0.467	43%	0.433	S	S	.	.	H	α-helix	trans	-57.6	-46	178.7	-66.1	169.2	0	0	0	110.1	I37 C43 V44 L45	I37-I41 HydrophobicContact CG2-CD1 3.72Å; I37-I41 HydrophobicContact CG2-CG1 4.32Å; I37-I41 WeakPolarHBondContact O-CG1 3.3Å; I37-I41 PolarHBondContact O-N 2.85Å; I41-C43 VanDerWaalsContact C-N 3.32Å; I41-C43 PolarHBondContact O-N 3.31Å; I41-V44 PolarHBondContact O-N 3.45Å; I41-L45 HydrophobicContact CG2-CD1 3.74Å; I41-L45 HydrophobicContact CG2-CG 4.22Å; I41-L45 WeakPolarHBondContact O-CB 3.35Å; I41-L45 WeakPolarHBondContact O-CG 3.44Å; I41-L45 PolarHBondContact O-N 3.14Å
42	G	91.4	Very high	90	Very high	21 Å²	21	77.1 Å²	77.1	22%	0.216	42%	0.423	C	S	.	.	H	α-helix	trans	-62.7	-33	174.5	0	0	0	0	0	114.2	C38 V39 I40 S46	C38-G42 PolarHBondContact O-N 3.42Å; V39-G42 PolarHBondContact O-N 3.13Å; I40-G42 VanDerWaalsContact C-N 3.31Å; I40-G42 PolarHBondContact O-N 3.37Å; G42-S46 VanDerWaalsContact O-CB 3.3Å; G42-S46 WeakPolarHBondContact O-CB 3.46Å; G42-S46 PolarHBondContact O-N 3.42Å; G42-S46 VanDerWaalsContact O-N 3.16Å; G42-S46 PolarHBondContact O-OG 3.2Å
43	C	90.6	Very high	89.8	Confident	21 Å²	21	78.6 Å²	78.6	14%	0.142	43%	0.428	C	S	.	.	H	α-helix	trans	-70.3	-38.7	174.1	-68.3	0	0	0	0	112.1	V39 I40 I41 S46 G47 G48 R51	V39-C43 WeakPolarHBondContact O-CB 3.32Å; V39-C43 PolarHBondContact O-N 2.93Å; V39-C43 PolarHBondContact O-SG 3.44Å; I40-C43 WeakPolarHBondContact O-CA 3.38Å; I40-C43 WeakPolarHBondContact O-CB 3.24Å; I40-C43 PolarHBondContact O-N 2.8Å; I41-C43 VanDerWaalsContact C-N 3.32Å; I41-C43 PolarHBondContact O-N 3.31Å; C43-S46 PolarHBondContact O-OG 3.27Å; C43-G47 PolarHBondContact O-N 3.39Å; C43-G48 PolarHBondContact O-N 3.08Å; C43-R51 HydrophobicContact CB-CB 4.35Å
44	V	92.2	Very high	89.7	Confident	110 Å²	110	71.1 Å²	71.1	67%	0.667	40%	0.399	S	S	*	.	H	α-helix	trans	-69	-49.7	176.2	175.1	0	0	0	0	110.8	I40 I41 S46 G47	I40-V44 HydrophobicContact CG2-CG2 4.42Å; I40-V44 WeakPolarHBondContact O-CG2 3.44Å; I40-V44 PolarHBondContact O-N 2.72Å; I41-V44 PolarHBondContact O-N 3.45Å; V44-S46 PolarHBondContact O-N 2.99Å; V44-G47 PolarHBondContact O-N 3.06Å
45	L	92.5	Very high	89.5	Confident	146 Å²	146	69.6 Å²	69.6	76%	0.764	39%	0.385	S	S	*	.	H	α-helix	trans	-62	-26	179.1	-70.6	174.7	0	0	0	113.7	I41	I41-L45 HydrophobicContact CG2-CD1 3.74Å; I41-L45 HydrophobicContact CG2-CG 4.22Å; I41-L45 WeakPolarHBondContact O-CB 3.35Å; I41-L45 WeakPolarHBondContact O-CG 3.44Å; I41-L45 PolarHBondContact O-N 3.14Å
46	S	90.6	Very high	89	Confident	38 Å²	38	68.5 Å²	68.5	27%	0.266	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	8.2	176.1	61	0	0	0	0	114.1	G42 C43 V44 G48 L49 L50	G42-S46 VanDerWaalsContact O-CB 3.3Å; G42-S46 WeakPolarHBondContact O-CB 3.46Å; G42-S46 PolarHBondContact O-N 3.42Å; G42-S46 VanDerWaalsContact O-N 3.16Å; G42-S46 PolarHBondContact O-OG 3.2Å; C43-S46 PolarHBondContact O-OG 3.27Å; V44-S46 PolarHBondContact O-N 2.99Å; S46-G48 PolarHBondContact O-N 3.33Å; S46-G48 VanDerWaalsContact O-N 3.12Å; S46-L49 WeakPolarHBondContact O-CB 3.48Å; S46-L49 PolarHBondContact O-N 2.99Å; S46-L50 WeakPolarHBondContact OG-CB 3.38Å; S46-L50 PolarHBondContact OG-N 3.02Å; S46-L50 VanDerWaalsContact OG-N 3.08Å
47	G	86.7	Confident	88.7	Confident	78 Å²	78	68.4 Å²	68.4	80%	0.804	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	25.3	-177.1	0	0	0	0	0	113.7	C43 V44	C43-G47 PolarHBondContact O-N 3.39Å; V44-G47 PolarHBondContact O-N 3.06Å
48	G	85.8	Confident	88.3	Confident	30 Å²	30	68.3 Å²	68.3	31%	0.309	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.2	-7.9	-176.1	0	0	0	0	0	116	C43 S46 L50 R51 L52	C43-G48 PolarHBondContact O-N 3.08Å; S46-G48 PolarHBondContact O-N 3.33Å; S46-G48 VanDerWaalsContact O-N 3.12Å; G48-L50 VanDerWaalsContact C-N 3.31Å; G48-L50 PolarHBondContact O-N 3.46Å; G48-R51 WeakPolarHBondContact O-CA 3.47Å; G48-R51 WeakPolarHBondContact O-CB 3.5Å; G48-R51 PolarHBondContact O-N 3.36Å; G48-L52 PolarHBondContact O-N 2.96Å
49	L	84.7	Confident	88	Confident	124 Å²	124	67 Å²	67	65%	0.649	37%	0.373	S	S	*	.	H	α-helix	trans	-57.3	-41.2	177.7	-94.4	156.7	0	0	0	112.7	S46 R51 L52 L53	S46-L49 WeakPolarHBondContact O-CB 3.48Å; S46-L49 PolarHBondContact O-N 2.99Å; L49-R51 VanDerWaalsContact C-N 3.28Å; L49-R51 PolarHBondContact O-N 3.01Å; L49-L52 WeakPolarHBondContact O-CB 3.3Å; L49-L52 PolarHBondContact O-N 2.84Å; L49-L53 PolarHBondContact O-N 3.3Å
50	L	88.6	Confident	87.9	Confident	53 Å²	53	72.4 Å²	72.4	28%	0.277	39%	0.391	S	S	.	.	H	α-helix	trans	-64.7	-34.4	175.8	-173.3	66.9	0	0	0	111.8	S46 G48 L53 F54	S46-L50 WeakPolarHBondContact OG-CB 3.38Å; S46-L50 PolarHBondContact OG-N 3.02Å; S46-L50 VanDerWaalsContact OG-N 3.08Å; G48-L50 VanDerWaalsContact C-N 3.31Å; G48-L50 PolarHBondContact O-N 3.46Å; L50-L53 PolarHBondContact O-N 3.42Å; L50-F54 HydrophobicContact CD1-CE1 4.47Å; L50-F54 HydrophobicContact CD1-CE2 3.98Å; L50-F54 HydrophobicContact CD1-CZ 3.92Å; L50-F54 HydrophobicContact CD2-CE2 3.81Å; L50-F54 HydrophobicContact CD2-CZ 4.25Å; L50-F54 HydrophobicContact CG-CD2 4.02Å; L50-F54 HydrophobicContact CG-CE2 3.52Å; L50-F54 HydrophobicContact CG-CZ 3.98Å; L50-F54 WeakPolarHBondContact O-CB 3.46Å; L50-F54 VanDerWaalsContact O-CD2 3.24Å; L50-F54 WeakPolarHBondContact O-CD2 3.24Å; L50-F54 WeakPolarHBondContact O-CG 3.43Å; L50-F54 PolarHBondContact O-N 3.29Å
51	R	89.4	Confident	87.8	Confident	126 Å²	126	71.2 Å²	71.2	48%	0.475	39%	0.385	S	S	.	.	H	α-helix	trans	-68.4	-37.6	177.1	-176.8	62.8	-177.4	116	-4.3	111.8	C43 G48 L49 F54 H55 M61	C43-R51 HydrophobicContact CB-CB 4.35Å; G48-R51 WeakPolarHBondContact O-CA 3.47Å; G48-R51 WeakPolarHBondContact O-CB 3.5Å; G48-R51 PolarHBondContact O-N 3.36Å; L49-R51 VanDerWaalsContact C-N 3.28Å; L49-R51 PolarHBondContact O-N 3.01Å; R51-F54 PolarHBondContact O-N 3.33Å; R51-H55 PolarHBondContact O-N 3.46Å; R51-M61 PolarHBondContact NH1-SD 3.44Å
52	L	86.1	Confident	87.6	Confident	36 Å²	36	67.1 Å²	67.1	19%	0.188	36%	0.364	C	S	.	.	H	α-helix	trans	-65.3	-44.5	173.3	-175.4	69.8	0	0	0	111.2	G48 L49 F54 H55 W56 L189 C194	G48-L52 PolarHBondContact O-N 2.96Å; L49-L52 WeakPolarHBondContact O-CB 3.3Å; L49-L52 PolarHBondContact O-N 2.84Å; L52-F54 VanDerWaalsContact C-N 3.3Å; L52-F54 PolarHBondContact O-N 3.19Å; L52-H55 WeakPolarHBondContact O-CA 3.47Å; L52-H55 VanDerWaalsContact O-CB 3.25Å; L52-H55 WeakPolarHBondContact O-CB 3.33Å; L52-H55 PolarHBondContact O-N 2.95Å; L52-W56 HydrophobicContact CD1-CZ2 4.02Å; L52-W56 HydrophobicContact CD2-CH2 3.68Å; L52-W56 HydrophobicContact CD2-CZ2 3.71Å; L52-W56 HydrophobicContact CD2-CZ3 4.49Å; L52-W56 HydrophobicContact CG-CH2 3.94Å; L52-W56 HydrophobicContact CG-CZ2 3.67Å; L52-W56 PolarHBondContact O-N 3.42Å; L52-L189 HydrophobicContact CD1-CB 4.38Å; L52-L189 HydrophobicContact CD1-CD2 3.67Å; L52-C194 HydrophobicContact CD2-CB 4.39Å
53	L	86.5	Confident	87.4	Confident	63 Å²	63	68.7 Å²	68.7	33%	0.33	37%	0.371	S	S	.	.	H	α-helix	trans	-63.3	-38.1	177.3	-158.2	150.9	0	0	0	111.5	L49 L50 H55 W56 F57 W60	L49-L53 PolarHBondContact O-N 3.3Å; L50-L53 PolarHBondContact O-N 3.42Å; L53-H55 VanDerWaalsContact C-N 3.3Å; L53-H55 PolarHBondContact O-N 2.91Å; L53-W56 PolarHBondContact O-N 3.4Å; L53-F57 HydrophobicContact CD2-CD2 4.02Å; L53-F57 HydrophobicContact CG-CD2 4.48Å; L53-F57 PolarHBondContact O-N 2.98Å; L53-W60 HydrophobicContact CD2-CE3 3.5Å; L53-W60 VanDerWaalsContact CD2-CE3 3.5Å; L53-W60 HydrophobicContact CD2-CZ3 3.58Å
54	F	88.1	Confident	87.3	Confident	9 Å²	9	70.3 Å²	70.3	4%	0.039	38%	0.382	C	S	.	.	H	α-helix	trans	-68.9	-19.4	170.1	-73.5	-31.5	0	0	0	114.9	V39 L50 R51 L52 F57 P58 W60 M61 C64	V39-F54 HydrophobicContact CG1-CD2 4.28Å; V39-F54 HydrophobicContact CG1-CE2 3.75Å; V39-F54 HydrophobicContact CG2-CE2 4.22Å; V39-F54 HydrophobicContact CG2-CZ 4.38Å; L50-F54 HydrophobicContact CD1-CE1 4.47Å; L50-F54 HydrophobicContact CD1-CE2 3.98Å; L50-F54 HydrophobicContact CD1-CZ 3.92Å; L50-F54 HydrophobicContact CD2-CE2 3.81Å; L50-F54 HydrophobicContact CD2-CZ 4.25Å; L50-F54 HydrophobicContact CG-CD2 4.02Å; L50-F54 HydrophobicContact CG-CE2 3.52Å; L50-F54 HydrophobicContact CG-CZ 3.98Å; L50-F54 WeakPolarHBondContact O-CB 3.46Å; L50-F54 VanDerWaalsContact O-CD2 3.24Å; L50-F54 WeakPolarHBondContact O-CD2 3.24Å; L50-F54 WeakPolarHBondContact O-CG 3.43Å; L50-F54 PolarHBondContact O-N 3.29Å; R51-F54 PolarHBondContact O-N 3.33Å; L52-F54 VanDerWaalsContact C-N 3.3Å; L52-F54 PolarHBondContact O-N 3.19Å; F54-F57 CarbonylContact O-C 3.59Å; F54-P58 WeakPolarHBondContact O-CA 3.38Å; F54-W60 HydrophobicContact CD1-CB 4.05Å; F54-W60 HydrophobicContact CE1-CB 4.04Å; F54-M61 HydrophobicContact CB-CB 3.83Å; F54-M61 HydrophobicContact CB-CG 3.97Å; F54-M61 HydrophobicContact CB-SD 4.38Å; F54-M61 HydrophobicContact CD1-CB 3.89Å; F54-M61 HydrophobicContact CD1-CG 4.44Å; F54-M61 HydrophobicContact CD2-CG 4.21Å; F54-M61 HydrophobicContact CG-CB 3.84Å; F54-M61 HydrophobicContact CG-CG 3.97Å; F54-C64 HydrophobicContact CE1-CB 4.18Å; F54-C64 HydrophobicContact CZ-CB 3.84Å
55	H	85.7	Confident	87.2	Confident	75 Å²	75	65.3 Å²	65.3	35%	0.347	35%	0.352	S	S	.	.	H	α-helix	trans	-73.5	-41.6	170.9	177.8	-100.9	0	0	0	111	R51 L52 L53	R51-H55 PolarHBondContact O-N 3.46Å; L52-H55 WeakPolarHBondContact O-CA 3.47Å; L52-H55 VanDerWaalsContact O-CB 3.25Å; L52-H55 WeakPolarHBondContact O-CB 3.33Å; L52-H55 PolarHBondContact O-N 2.95Å; L53-H55 VanDerWaalsContact C-N 3.3Å; L53-H55 PolarHBondContact O-N 2.91Å
56	W	82.7	Confident	87.1	Confident	87 Å²	87	58.6 Å²	58.6	33%	0.33	32%	0.317	S	S	.	.	H	α-helix	trans	-72.2	-36.9	175.5	-57.6	-30.5	0	0	0	113.2	L52 L53 P58 L189 P191 C194	L52-W56 HydrophobicContact CD1-CZ2 4.02Å; L52-W56 HydrophobicContact CD2-CH2 3.68Å; L52-W56 HydrophobicContact CD2-CZ2 3.71Å; L52-W56 HydrophobicContact CD2-CZ3 4.49Å; L52-W56 HydrophobicContact CG-CH2 3.94Å; L52-W56 HydrophobicContact CG-CZ2 3.67Å; L52-W56 PolarHBondContact O-N 3.42Å; L53-W56 PolarHBondContact O-N 3.4Å; W56-P58 VanDerWaalsContact C-CD 3.43Å; W56-P58 VanDerWaalsContact O-CD 3.23Å; W56-P58 WeakPolarHBondContact O-CD 3.4Å; W56-L189 PolarHBondContact NE1-O 3.3Å; W56-P191 HydrophobicContact CD2-CG 4.12Å; W56-P191 HydrophobicContact CH2-CB 4.21Å; W56-P191 HydrophobicContact CH2-CG 4.31Å; W56-P191 HydrophobicContact CZ2-CB 4.08Å; W56-P191 HydrophobicContact CZ2-CG 3.9Å; W56-C194 HydrophobicContact CZ2-CB 4.34Å
57	F	85.3	Confident	87.1	Confident	89 Å²	89	63.4 Å²	63.4	39%	0.39	33%	0.333	S	S	.	.			trans	-117.7	73.3	179.6	-57.5	-69.6	0	0	0	111	L53 F54 H59 W60 M61	L53-F57 HydrophobicContact CD2-CD2 4.02Å; L53-F57 HydrophobicContact CG-CD2 4.48Å; L53-F57 PolarHBondContact O-N 2.98Å; F54-F57 CarbonylContact O-C 3.59Å; F57-H59 PolarHBondContact O-N 3.18Å; F57-H59 VanDerWaalsContact O-N 3.11Å; F57-W60 HydrophobicContact CB-CB 4.16Å; F57-W60 HydrophobicContact CB-CD2 3.97Å; F57-W60 HydrophobicContact CB-CE3 4.49Å; F57-W60 HydrophobicContact CB-CG 3.82Å; F57-W60 HydrophobicContact CG-CD2 4.41Å; F57-W60 WeakPolarHBondContact O-CB 3.26Å; F57-W60 PolarHBondContact O-N 3.26Å; F57-M61 PolarHBondContact O-N 2.96Å
58	P	82.5	Confident	87.1	Confident	67 Å²	67	63.1 Å²	63.1	44%	0.435	32%	0.319	S	S	.	.	H	α-helix	trans	-63	-23.7	-176.1	25.5	-35.5	0	0	0	113.2	F54 W56 M61 L62 I87	F54-P58 WeakPolarHBondContact O-CA 3.38Å; W56-P58 VanDerWaalsContact C-CD 3.43Å; W56-P58 VanDerWaalsContact O-CD 3.23Å; W56-P58 WeakPolarHBondContact O-CD 3.4Å; P58-M61 WeakPolarHBondContact O-CB 3.45Å; P58-M61 PolarHBondContact O-N 3.27Å; P58-L62 PolarHBondContact O-N 3.48Å; P58-L62 VanDerWaalsContact O-N 3.1Å; P58-I87 HydrophobicContact CB-CD1 4.12Å; P58-I87 WeakPolarHBondContact O-CD1 3.33Å
59	H	85.1	Confident	87.2	Confident	54 Å²	54	62.9 Å²	62.9	25%	0.25	31%	0.312	C	S	.	.	H	α-helix	trans	-69.2	-31.4	172.7	72.3	-74.7	0	0	0	113	F57 L62 S63 I85	F57-H59 PolarHBondContact O-N 3.18Å; F57-H59 VanDerWaalsContact O-N 3.11Å; H59-L62 WeakPolarHBondContact O-CB 3.34Å; H59-L62 PolarHBondContact O-N 2.95Å; H59-S63 PolarHBondContact O-N 2.95Å; H59-S63 PolarHBondContact O-OG 2.97Å; H59-I85 HydrophobicContact CB-CG2 4.22Å
60	W	88	Confident	87.3	Confident	127 Å²	127	62.7 Å²	62.7	48%	0.481	31%	0.311	S	S	.	.	H	α-helix	trans	-68.3	-40.8	171.9	-67	11.4	0	0	0	110.3	L53 F54 F57 L62 S63 C64	L53-W60 HydrophobicContact CD2-CE3 3.5Å; L53-W60 VanDerWaalsContact CD2-CE3 3.5Å; L53-W60 HydrophobicContact CD2-CZ3 3.58Å; F54-W60 HydrophobicContact CD1-CB 4.05Å; F54-W60 HydrophobicContact CE1-CB 4.04Å; F57-W60 HydrophobicContact CB-CB 4.16Å; F57-W60 HydrophobicContact CB-CD2 3.97Å; F57-W60 HydrophobicContact CB-CE3 4.49Å; F57-W60 HydrophobicContact CB-CG 3.82Å; F57-W60 HydrophobicContact CG-CD2 4.41Å; F57-W60 WeakPolarHBondContact O-CB 3.26Å; F57-W60 PolarHBondContact O-N 3.26Å; W60-L62 VanDerWaalsContact C-N 3.26Å; W60-L62 PolarHBondContact O-N 3.37Å; W60-S63 PolarHBondContact O-N 3Å; W60-C64 WeakPolarHBondContact O-CB 3.45Å; W60-C64 PolarHBondContact O-N 3.46Å; W60-C64 PolarHBondContact O-SG 3.31Å
61	M	89.4	Confident	87.1	Confident	50 Å²	50	60.6 Å²	60.6	25%	0.246	30%	0.301	C	S	.	.	H	α-helix	trans	-57.1	-41.6	173.9	-163.3	-172.6	176.3	0	0	111.5	R51 F54 F57 P58 T65	R51-M61 PolarHBondContact NH1-SD 3.44Å; F54-M61 HydrophobicContact CB-CB 3.83Å; F54-M61 HydrophobicContact CB-CG 3.97Å; F54-M61 HydrophobicContact CB-SD 4.38Å; F54-M61 HydrophobicContact CD1-CB 3.89Å; F54-M61 HydrophobicContact CD1-CG 4.44Å; F54-M61 HydrophobicContact CD2-CG 4.21Å; F54-M61 HydrophobicContact CG-CB 3.84Å; F54-M61 HydrophobicContact CG-CG 3.97Å; F57-M61 PolarHBondContact O-N 2.96Å; P58-M61 WeakPolarHBondContact O-CB 3.45Å; P58-M61 PolarHBondContact O-N 3.27Å; M61-T65 HydrophobicContact CG-CG2 4.44Å; M61-T65 WeakPolarHBondContact O-CB 3.27Å; M61-T65 WeakPolarHBondContact O-CG2 3.3Å; M61-T65 PolarHBondContact O-N 3.05Å; M61-T65 PolarHBondContact O-OG1 3.42Å
62	L	86.8	Confident	86.8	Confident	5 Å²	5	57.9 Å²	57.9	3%	0.026	30%	0.301	C	S	.	.	H	α-helix	trans	-62.7	-51.8	176	-173.1	68.8	0	0	0	111.3	Y29 P58 H59 W60 C64 T65 H66 K76 K78 I87	Y29-L62 HydrophobicContact CD1-CD2 4.17Å; Y29-L62 HydrophobicContact CD1-CG 3.92Å; Y29-L62 HydrophobicContact CD2-CD2 3.71Å; Y29-L62 HydrophobicContact CD2-CG 4.31Å; Y29-L62 HydrophobicContact CE1-CD2 4.34Å; Y29-L62 HydrophobicContact CE1-CG 4.28Å; Y29-L62 HydrophobicContact CE2-CD2 3.92Å; Y29-L62 HydrophobicContact CG-CD1 4.25Å; Y29-L62 HydrophobicContact CG-CD2 3.86Å; Y29-L62 HydrophobicContact CG-CG 3.94Å; P58-L62 PolarHBondContact O-N 3.48Å; P58-L62 VanDerWaalsContact O-N 3.1Å; H59-L62 WeakPolarHBondContact O-CB 3.34Å; H59-L62 PolarHBondContact O-N 2.95Å; W60-L62 VanDerWaalsContact C-N 3.26Å; W60-L62 PolarHBondContact O-N 3.37Å; L62-C64 VanDerWaalsContact C-N 3.29Å; L62-C64 PolarHBondContact O-N 3.3Å; L62-T65 PolarHBondContact O-N 2.86Å; L62-H66 HydrophobicContact CD1-CB 4.19Å; L62-H66 WeakPolarHBondContact O-CB 3.32Å; L62-H66 PolarHBondContact O-N 3.32Å; L62-K76 HydrophobicContact CD1-CB 4.21Å; L62-K76 HydrophobicContact CD1-CD 3.91Å; L62-K78 HydrophobicContact CD2-CB 3.9Å; L62-K78 HydrophobicContact CD2-CD 4.48Å; L62-I87 HydrophobicContact CB-CD1 4.15Å; L62-I87 HydrophobicContact CD1-CG2 4.28Å; L62-I87 HydrophobicContact CD2-CD1 4.2Å; L62-I87 HydrophobicContact CD2-CG1 4.27Å; L62-I87 HydrophobicContact CD2-CG2 4.19Å
63	S	87.4	Confident	86.7	Confident	54 Å²	54	61 Å²	61	38%	0.378	31%	0.314	S	S	.	.	H	α-helix	trans	-60.5	-35	178.6	-59.3	0	0	0	0	113.4	R35 H59 W60	R35-S63 PolarHBondContact NH1-O 3.43Å; H59-S63 PolarHBondContact O-N 2.95Å; H59-S63 PolarHBondContact O-OG 2.97Å; W60-S63 PolarHBondContact O-N 3Å
64	C	89.1	Confident	86.7	Confident	56 Å²	56	58 Å²	58	38%	0.378	30%	0.299	S	S	.	.	H	α-helix	trans	-79.6	-24.4	178.7	-67.3	0	0	0	0	113.9	R35 V39 F54 W60 L62	R35-C64 WeakPolarHBondContact CB-O 3.5Å; V39-C64 HydrophobicContact CG2-CB 3.64Å; F54-C64 HydrophobicContact CE1-CB 4.18Å; F54-C64 HydrophobicContact CZ-CB 3.84Å; W60-C64 WeakPolarHBondContact O-CB 3.45Å; W60-C64 PolarHBondContact O-N 3.46Å; W60-C64 PolarHBondContact O-SG 3.31Å; L62-C64 VanDerWaalsContact C-N 3.29Å; L62-C64 PolarHBondContact O-N 3.3Å
65	T	89.5	Confident	86.7	Confident	5 Å²	5	60.6 Å²	60.6	3%	0.031	31%	0.313	C	S	.	.	H	α-helix	trans	-106.5	-22	-177	56	0	0	0	0	114.6	S32 Y36 V39 M61 L62	S32-T65 PolarHBondContact N-O 2.98Å; Y36-T65 HydrophobicContact CD2-CG2 4.04Å; V39-T65 HydrophobicContact CB-CG2 3.93Å; V39-T65 HydrophobicContact CG1-CG2 3.82Å; V39-T65 HydrophobicContact CG2-CG2 3.81Å; M61-T65 HydrophobicContact CG-CG2 4.44Å; M61-T65 WeakPolarHBondContact O-CB 3.27Å; M61-T65 WeakPolarHBondContact O-CG2 3.3Å; M61-T65 PolarHBondContact O-N 3.05Å; M61-T65 PolarHBondContact O-OG1 3.42Å; L62-T65 PolarHBondContact O-N 2.86Å
66	H	90.9	Very high	87	Confident	5 Å²	5	60.4 Å²	60.4	2%	0.023	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	163.8	-177.6	-63.3	54.5	0	0	0	110.3	Y29 K30 F31 R35 L62 K76	Y29-H66 HydrophobicContact CD1-CB 4.03Å; Y29-H66 HydrophobicContact CG-CB 4.44Å; K30-H66 CarbonylContact O-C 3.35Å; K30-H66 WeakPolarHBondContact O-CA 3.46Å; K30-H66 VanDerWaalsContact O-CB 3.3Å; K30-H66 WeakPolarHBondContact O-CB 3.29Å; F31-H66 AromaticContact CD2-CE1 3.73Å; F31-H66 AromaticContact CD2-NE2 3.8Å; R35-H66 PolarHBondContact NH1-O 3.47Å; L62-H66 HydrophobicContact CD1-CB 4.19Å; L62-H66 WeakPolarHBondContact O-CB 3.32Å; L62-H66 PolarHBondContact O-N 3.32Å; H66-K76 WeakPolarHBondContact NE2-CD 3.26Å; H66-K76 WeakPolarHBondContact NE2-CE 3.37Å
67	K	90.5	Very high	87.4	Confident	138 Å²	138	56.3 Å²	56.3	60%	0.6	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.2	139.5	170.3	-172	-175.1	175.1	-173.7	0	108.3	Y29 K30 C69	Y29-K67 WeakPolarHBondContact CA-O 3.47Å; K30-K67 PolarHBondContact N-O 3.1Å; K30-K67 PolarHBondContact O-N 2.94Å; K67-C69 PolarHBondContact O-N 2.94Å
68	S	87.9	Confident	87.6	Confident	73 Å²	73	53.4 Å²	53.4	51%	0.51	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	136.1	171.5	-157.4	0	0	0	0	109.6	G28	G28-S68 WeakPolarHBondContact O-CA 3.44Å
69	C	88.1	Confident	87.9	Confident	24 Å²	24	50.2 Å²	50.2	16%	0.162	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	170.2	178.1	66.9	0	0	0	0	110.3	G28 Y29 K30 K67	G28-C69 CarbonylContact C-O 3.58Å; G28-C69 VanDerWaalsContact C-SG 3.6Å; G28-C69 WeakPolarHBondContact CA-O 3.4Å; G28-C69 PolarHBondContact O-N 2.92Å; G28-C69 VanDerWaalsContact O-O 3.12Å; Y29-C69 VanDerWaalsContact C-SG 3.59Å; K30-C69 HydrophobicContact CB-CB 4.03Å; K30-C69 PolarHBondContact N-SG 2.69Å; K30-C69 VanDerWaalsContact N-SG 3.4Å; K67-C69 PolarHBondContact O-N 2.94Å
70	D	85.1	Confident	87.9	Confident	120 Å²	120	52.5 Å²	52.5	64%	0.642	27%	0.271	S	S	*	.			trans	-67.1	156	169.5	-52.8	-51.8	0	0	0	110.1	S72 E73	D70-S72 VanDerWaalsContact C-N 3.29Å; D70-S72 PolarHBondContact O-N 2.82Å; D70-E73 PolarHBondContact O-N 3.11Å
71	L	84.6	Confident	87.3	Confident	10 Å²	10	47.5 Å²	47.5	5%	0.052	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-66.2	-29	-168.4	-75.3	109.9	0	0	0	114	H15 I26 E73 A74 V77 W129 F136	H15-L71 HydrophobicContact CB-CD1 3.75Å; H15-L71 WeakPolarHBondContact CD2-CD1 3.36Å; H15-L71 VanDerWaalsContact CG-CD1 3.43Å; I26-L71 HydrophobicContact CB-CD2 4.45Å; I26-L71 HydrophobicContact CD1-CD2 3.6Å; I26-L71 HydrophobicContact CG1-CD2 3.79Å; I26-L71 HydrophobicContact CG2-CD2 3.91Å; L71-E73 VanDerWaalsContact C-N 3.29Å; L71-E73 PolarHBondContact O-N 3.02Å; L71-A74 VanDerWaalsContact O-CB 3.32Å; L71-A74 WeakPolarHBondContact O-CB 3.48Å; L71-A74 PolarHBondContact O-N 2.78Å; L71-V77 HydrophobicContact CD2-CG1 4.11Å; L71-W129 HydrophobicContact CB-CH2 3.67Å; L71-W129 HydrophobicContact CB-CZ3 3.58Å; L71-F136 HydrophobicContact CD2-CD2 3.94Å; L71-F136 HydrophobicContact CD2-CE2 4.21Å
72	S	83.2	Confident	86.2	Confident	68 Å²	68	49.6 Å²	49.6	48%	0.476	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-61	-33.9	178.3	53.1	0	0	0	0	113.3	D70	D70-S72 VanDerWaalsContact C-N 3.29Å; D70-S72 PolarHBondContact O-N 2.82Å
73	E	84.7	Confident	85.1	Confident	101 Å²	101	50.4 Å²	50.4	47%	0.472	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-93.8	0.8	178.3	-60	-156.9	136.8	0	0	114.3	K30 D70 L71 N75	K30-E73 HydrophobicContact CD-CB 4.22Å; K30-E73 WeakPolarHBondContact CD-OE2 3.35Å; K30-E73 IonicContact NZ-OE1 3.88Å; K30-E73 PolarHBondContact NZ-OE1 3.28Å; K30-E73 VanDerWaalsContact NZ-OE1 3.1Å; K30-E73 IonicContact NZ-OE2 2.88Å; K30-E73 PolarHBondContact NZ-OE2 2.81Å; D70-E73 PolarHBondContact O-N 3.11Å; L71-E73 VanDerWaalsContact C-N 3.29Å; L71-E73 PolarHBondContact O-N 3.02Å; E73-N75 PolarHBondContact O-N 3.4Å
74	A	86.4	Confident	84.4	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.272	C	S	.	.			trans	-74	120.3	-167.4	0	0	0	0	0	112.9	L71 V90 Y92	L71-A74 VanDerWaalsContact O-CB 3.32Å; L71-A74 WeakPolarHBondContact O-CB 3.48Å; L71-A74 PolarHBondContact O-N 2.78Å; A74-V90 WeakPolarHBondContact O-CB 3.31Å; A74-V90 WeakPolarHBondContact O-CG2 3.49Å; A74-Y92 PolarHBondContact O-OH 2.88Å
75	N	88.9	Confident	84.1	Confident	64 Å²	64	50.1 Å²	50.1	34%	0.342	27%	0.272	S	S	.	.	S	Bend	trans	-77.4	-28.4	169.6	-53.6	114.3	0	0	0	112	Y29 K30 F31 E73 V90	Y29-N75 PolarHBondContact O-N 3.49Å; K30-N75 WeakPolarHBondContact CA-OD1 3.45Å; F31-N75 PolarHBondContact N-OD1 3.43Å; E73-N75 PolarHBondContact O-N 3.4Å; N75-V90 PolarHBondContact O-N 3.15Å
76	K	91.1	Very high	83.9	Confident	72 Å²	72	52.9 Å²	52.9	31%	0.313	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	151.5	175.7	-66.9	-170.2	-172.2	176.3	0	109.9	Y29 L62 H66 I87 H88	Y29-K76 PolarHBondContact N-O 3.31Å; Y29-K76 PolarHBondContact O-N 2.88Å; L62-K76 HydrophobicContact CD1-CB 4.21Å; L62-K76 HydrophobicContact CD1-CD 3.91Å; H66-K76 WeakPolarHBondContact NE2-CD 3.26Å; H66-K76 WeakPolarHBondContact NE2-CE 3.37Å; K76-I87 HydrophobicContact CD-CG2 4.32Å; K76-H88 CarbonylContact C-O 3.51Å; K76-H88 VanDerWaalsContact CA-O 3.25Å; K76-H88 WeakPolarHBondContact CA-O 3.14Å; K76-H88 WeakPolarHBondContact CB-O 3.31Å
77	V	90.4	Very high	83.7	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	136	179.6	-145.8	0	0	0	0	109.6	I26 E27 L71 I87 H88 V90 I120 F136	I26-V77 HydrophobicContact CD1-CB 4.48Å; I26-V77 HydrophobicContact CD1-CG1 3.47Å; I26-V77 VanDerWaalsContact CD1-CG1 3.47Å; I26-V77 HydrophobicContact CG1-CB 4.49Å; I26-V77 HydrophobicContact CG1-CG1 3.27Å; E27-V77 WeakPolarHBondContact O-CA 3.45Å; E27-V77 VanDerWaalsContact O-CG1 3.24Å; E27-V77 WeakPolarHBondContact O-CG1 3.28Å; L71-V77 HydrophobicContact CD2-CG1 4.11Å; V77-I87 WeakPolarHBondContact O-CA 3.48Å; V77-H88 PolarHBondContact N-O 3.15Å; V77-H88 PolarHBondContact O-N 2.98Å; V77-V90 HydrophobicContact CG2-CG2 3.33Å; V77-I120 HydrophobicContact CG2-CG2 4.03Å; V77-F136 HydrophobicContact CG2-CE2 4.3Å
78	K	90.7	Very high	83.7	Confident	28 Å²	28	50.7 Å²	50.7	12%	0.122	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	119.5	174.5	172.1	-174	151.2	-148.6	0	107.5	E27 Y29 L62 I85 Y86	E27-K78 HydrophobicContact CB-CB 4.34Å; E27-K78 PolarHBondContact N-O 3.26Å; E27-K78 PolarHBondContact O-N 2.96Å; E27-K78 IonicContact OE1-NZ 3.89Å; E27-K78 PolarHBondContact OE1-NZ 3.48Å; E27-K78 WeakPolarHBondContact OE2-CD 3.41Å; E27-K78 WeakPolarHBondContact OE2-CE 3.23Å; E27-K78 IonicContact OE2-NZ 3.34Å; E27-K78 PolarHBondContact OE2-NZ 3.43Å; Y29-K78 HydrophobicContact CD2-CB 4.14Å; Y29-K78 HydrophobicContact CE2-CB 3.78Å; Y29-K78 HydrophobicContact CE2-CD 4.03Å; L62-K78 HydrophobicContact CD2-CB 3.9Å; L62-K78 HydrophobicContact CD2-CD 4.48Å; K78-I85 HydrophobicContact CD-CG2 4.3Å; K78-I85 HydrophobicContact CG-CG2 3.83Å; K78-Y86 WeakPolarHBondContact CA-O 3.32Å
79	I	88.9	Confident	83.8	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	129.2	176.2	-61	172.3	0	0	0	107.6	I17 D25 I26 I85 Y86 I120 H122	I17-I79 HydrophobicContact CD1-CD1 3.74Å; I17-I79 HydrophobicContact CD1-CG1 4.02Å; I17-I79 HydrophobicContact CD1-CG2 4.45Å; D25-I79 WeakPolarHBondContact O-CA 3.44Å; I26-I79 HydrophobicContact CD1-CG1 4.29Å; I26-I79 HydrophobicContact CG1-CG1 4.03Å; I79-I85 WeakPolarHBondContact O-CA 3.22Å; I79-Y86 PolarHBondContact N-O 2.93Å; I79-Y86 PolarHBondContact O-N 3.06Å; I79-I120 HydrophobicContact CD1-CD1 4.13Å; I79-H122 HydrophobicContact CD1-CB 3.82Å
80	K	84.4	Confident	83.8	Confident	102 Å²	102	53.6 Å²	53.6	44%	0.443	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	116.2	177.7	179.6	-169.4	167	-147.4	0	109	S24 D25 I85	S24-K80 WeakPolarHBondContact CA-O 3.44Å; D25-K80 HydrophobicContact CB-CB 4.42Å; D25-K80 PolarHBondContact N-O 3.4Å; D25-K80 PolarHBondContact O-N 2.85Å; D25-K80 IonicContact OD2-NZ 2.61Å; K80-I85 HydrophobicContact CG-CG1 4.36Å
81	D	75.4	Confident	84	Confident	22 Å²	22	52.1 Å²	52.1	12%	0.118	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	172	179.1	-177.9	28	0	0	0	109.6	S24 S83 G84 K123	S24-D81 WeakPolarHBondContact OG-CB 3.32Å; S24-D81 PolarHBondContact OG-OD1 3.29Å; D81-S83 PolarHBondContact O-N 2.88Å; D81-S83 VanDerWaalsContact O-N 3.16Å; D81-S83 PolarHBondContact OD2-N 3.37Å; D81-S83 PolarHBondContact OD2-OG 2.71Å; D81-S83 VanDerWaalsContact OD2-OG 3.04Å; D81-G84 PolarHBondContact N-O 3.33Å; D81-G84 PolarHBondContact O-N 2.74Å; D81-G84 VanDerWaalsContact O-N 3.09Å; D81-K123 IonicContact OD2-NZ 2.7Å; D81-K123 PolarHBondContact OD2-NZ 3.46Å
82	V	66.5	Low	83.9	Confident	95 Å²	95	57.1 Å²	57.1	58%	0.576	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.8	-34.1	164.2	-171	0	0	0	0	110.7	P374	V82-P374 WeakPolarHBondContact O-CG 3.45Å
83	S	64.5	Low	83.4	Confident	21 Å²	21	56.1 Å²	56.1	15%	0.147	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-18.3	-179.6	74.7	0	0	0	0	116.2	D81 Y86 P374	D81-S83 PolarHBondContact O-N 2.88Å; D81-S83 VanDerWaalsContact O-N 3.16Å; D81-S83 PolarHBondContact OD2-N 3.37Å; D81-S83 PolarHBondContact OD2-OG 2.71Å; D81-S83 VanDerWaalsContact OD2-OG 3.04Å; S83-Y86 WeakPolarHBondContact CB-OH 3.22Å; S83-Y86 WeakPolarHBondContact OG-CE2 3.15Å; S83-Y86 PolarHBondContact OG-OH 2.74Å; S83-P374 VanDerWaalsContact CA-CD 3.44Å
84	G	72.5	Confident	82.4	Confident	29 Å²	29	57.9 Å²	57.9	30%	0.299	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	142.7	-159.1	178.5	0	0	0	0	0	113.7	D81	D81-G84 PolarHBondContact N-O 3.33Å; D81-G84 PolarHBondContact O-N 2.74Å; D81-G84 VanDerWaalsContact O-N 3.09Å
85	I	81.7	Confident	80.8	Confident	76 Å²	76	70 Å²	70	39%	0.39	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	120.3	176.8	-57	173.5	0	0	0	108.5	H59 K78 I79 K80	H59-I85 HydrophobicContact CB-CG2 4.22Å; K78-I85 HydrophobicContact CD-CG2 4.3Å; K78-I85 HydrophobicContact CG-CG2 3.83Å; I79-I85 WeakPolarHBondContact O-CA 3.22Å; K80-I85 HydrophobicContact CG-CG1 4.36Å
86	Y	85.2	Confident	78.9	Confident	63 Å²	63	69.8 Å²	69.8	25%	0.247	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	146.1	178.3	-58.1	-96.1	0	0	0	110.1	K78 I79 S83 H88 H122	K78-Y86 WeakPolarHBondContact CA-O 3.32Å; I79-Y86 PolarHBondContact N-O 2.93Å; I79-Y86 PolarHBondContact O-N 3.06Å; S83-Y86 WeakPolarHBondContact CB-OH 3.22Å; S83-Y86 WeakPolarHBondContact OG-CE2 3.15Å; S83-Y86 PolarHBondContact OG-OH 2.74Å; Y86-H88 WeakPolarHBondContact CB-NE2 2.91Å; Y86-H122 AromaticContact CD2-CE1 3.81Å; Y86-H122 AromaticContact CG-CE1 3.89Å
87	I	87.3	Confident	76.4	Confident	58 Å²	58	76.2 Å²	76.2	30%	0.297	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	115.7	-179.7	-56.6	172.6	0	0	0	107.8	P58 L62 K76 V77	P58-I87 HydrophobicContact CB-CD1 4.12Å; P58-I87 WeakPolarHBondContact O-CD1 3.33Å; L62-I87 HydrophobicContact CB-CD1 4.15Å; L62-I87 HydrophobicContact CD1-CG2 4.28Å; L62-I87 HydrophobicContact CD2-CD1 4.2Å; L62-I87 HydrophobicContact CD2-CG1 4.27Å; L62-I87 HydrophobicContact CD2-CG2 4.19Å; K76-I87 HydrophobicContact CD-CG2 4.32Å; V77-I87 WeakPolarHBondContact O-CA 3.48Å
88	H	89.5	Confident	74	Confident	38 Å²	38	81.6 Å²	81.6	18%	0.176	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	149.3	-178.9	-64.5	-90	0	0	0	110.3	K76 V77 Y86 I121 H122	K76-H88 CarbonylContact C-O 3.51Å; K76-H88 VanDerWaalsContact CA-O 3.25Å; K76-H88 WeakPolarHBondContact CA-O 3.14Å; K76-H88 WeakPolarHBondContact CB-O 3.31Å; V77-H88 PolarHBondContact N-O 3.15Å; V77-H88 PolarHBondContact O-N 2.98Å; Y86-H88 WeakPolarHBondContact CB-NE2 2.91Å; H88-I121 PolarHBondContact CE1-O 3.05Å; H88-I121 PolarHBondContact ND1-O 2.87Å; H88-H122 AromaticContact CD2-ND1 3.74Å; H88-H122 AromaticContact CE1-ND1 3.73Å; H88-H122 AromaticContact NE2-CE1 3.94Å; H88-H122 AromaticContact NE2-CG 3.91Å; H88-H122 AromaticContact NE2-ND1 2.97Å; H88-H122 PolarHBondContact NE2-ND1 3.23Å
89	K	90.5	Very high	71.3	Confident	156 Å²	156	91.4 Å²	91.4	68%	0.678	46%	0.455	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.1	134.5	169.7	-174.7	-170.5	173.1	-172.8	0	107.9
90	V	89.1	Confident	68.9	Low	3 Å²	3	95.7 Å²	95.7	2%	0.018	48%	0.484	C	S	.	.	P	Polyproline II helix	trans	-71.3	129.8	170.2	-177.6	0	0	0	0	108.8	A74 N75 V77 Y92 P118 I120 F136	A74-V90 WeakPolarHBondContact O-CB 3.31Å; A74-V90 WeakPolarHBondContact O-CG2 3.49Å; N75-V90 PolarHBondContact O-N 3.15Å; V77-V90 HydrophobicContact CG2-CG2 3.33Å; V90-Y92 HydrophobicContact CB-CE2 4.02Å; V90-Y92 HydrophobicContact CG1-CD2 4.3Å; V90-Y92 HydrophobicContact CG1-CE1 4.28Å; V90-Y92 HydrophobicContact CG1-CE2 3.74Å; V90-P118 HydrophobicContact CG1-CB 4.03Å; V90-I120 HydrophobicContact CB-CG2 4.43Å; V90-I120 HydrophobicContact CG2-CG2 3.92Å; V90-F136 HydrophobicContact CG1-CZ 4.18Å; V90-F136 HydrophobicContact CG2-CZ 4.11Å
91	Q	88.5	Confident	66.5	Low	88 Å²	88	100.5 Å²	100.5	41%	0.411	51%	0.509	S	S	.	.	B	Isolated β-bridge	trans	-100.3	126.1	175.5	-63.9	-170.9	-4.2	0	0	108.7	P118 Y119	Q91-P118 WeakPolarHBondContact O-CA 3.48Å; Q91-Y119 HydrophobicContact CB-CD1 4.46Å; Q91-Y119 HydrophobicContact CB-CD2 4.38Å; Q91-Y119 HydrophobicContact CB-CE1 4.16Å; Q91-Y119 HydrophobicContact CB-CE2 4.08Å; Q91-Y119 PolarHBondContact N-O 2.8Å; Q91-Y119 PolarHBondContact O-N 3.32Å; Q91-Y119 VanDerWaalsContact OE1-CZ 3.27Å; Q91-Y119 PolarHBondContact OE1-OH 3.24Å; Q91-Y119 VanDerWaalsContact OE1-OH 3.06Å
92	Y	82	Confident	64.6	Low	116 Å²	116	109.2 Å²	109.2	46%	0.455	54%	0.541	S	S	.	.			trans	-105.2	119.2	174.3	-62.2	-90.8	0	0	0	106.8	A74 V90 T94 P118	A74-Y92 PolarHBondContact O-OH 2.88Å; V90-Y92 HydrophobicContact CB-CE2 4.02Å; V90-Y92 HydrophobicContact CG1-CD2 4.3Å; V90-Y92 HydrophobicContact CG1-CE1 4.28Å; V90-Y92 HydrophobicContact CG1-CE2 3.74Å; Y92-T94 PolarHBondContact O-N 3.29Å; Y92-P118 HydrophobicContact CD1-CB 3.97Å; Y92-P118 HydrophobicContact CD1-CG 3.81Å; Y92-P118 HydrophobicContact CE1-CB 3.97Å; Y92-P118 HydrophobicContact CE1-CG 3.84Å
93	P	73.8	Confident	63.1	Low	47 Å²	47	112.8 Å²	112.8	31%	0.305	56%	0.557	S	S	.	*			trans	-61.8	135.2	175.4	25.2	-32.2	0	0	0	109.6	R95 T115 K116 R117	P93-R95 PolarHBondContact O-N 2.86Å; P93-T115 WeakPolarHBondContact CG-O 3.28Å; P93-K116 VanDerWaalsContact CG-O 3.28Å; P93-K116 WeakPolarHBondContact CG-O 3.18Å; P93-R117 WeakPolarHBondContact CD-O 3.19Å
94	T	62.8	Low	61.9	Low	137 Å²	137	115.5 Å²	115.5	84%	0.84	58%	0.576	S	S	*	*			trans	-63.6	129.7	175.6	37.3	0	0	0	0	109.9	Y92 G96	Y92-T94 PolarHBondContact O-N 3.29Å; T94-G96 PolarHBondContact O-N 3.15Å
95	R	52.3	Low	60.5	Low	255 Å²	255	116.7 Å²	116.7	96%	0.962	58%	0.58	S	S	*	*			trans	-58.3	99.7	169.9	-90.1	-176.1	169.1	177	-4.3	109.4	P93	P93-R95 PolarHBondContact O-N 2.86Å
96	G	49.9	Very low	59.2	Low	60 Å²	60	119.5 Å²	119.5	62%	0.619	60%	0.601	S	S	*	*			trans	-59.4	149.2	163.3	0	0	0	0	0	109.8	T94 S98	T94-G96 PolarHBondContact O-N 3.15Å; G96-S98 PolarHBondContact O-N 3.33Å
97	K	39.6	Very low	57.5	Low	207 Å²	207	118.9 Å²	118.9	90%	0.9	60%	0.604	S	S	*	*			trans	-66.6	105.5	171.6	-71.3	179.1	176.4	178.7	0	107.9	R99	K97-R99 PolarHBondContact O-N 3.21Å
98	S	38.4	Very low	55.8	Low	112 Å²	112	119.1 Å²	119.1	78%	0.783	61%	0.606	S	S	*	*			trans	-52.2	127	172.3	-70.1	0	0	0	0	109.9	G96	G96-S98 PolarHBondContact O-N 3.33Å
99	R	35.5	Very low	54.1	Low	235 Å²	235	119 Å²	119	89%	0.887	61%	0.612	S	S	*	*			trans	-128.7	138.7	170	-153.8	175.4	-170.2	-178.2	0.5	108.1	K97	K97-R99 PolarHBondContact O-N 3.21Å
100	S	37	Very low	52.7	Low	89 Å²	89	116.7 Å²	116.7	62%	0.622	60%	0.601	S	S	*	*			trans	54.2	95.8	173.5	46.3	0	0	0	0	117.5	Y102	S100-Y102 PolarHBondContact O-N 3.33Å
101	Q	34.9	Very low	51.4	Low	203 Å²	203	117 Å²	117	95%	0.949	60%	0.603	S	S	*	*			trans	-30.2	114	133.9	-178.1	176.4	4.7	0	0	111.9
102	Y	35.9	Very low	50.2	Low	205 Å²	205	117.2 Å²	117.2	80%	0.804	60%	0.604	S	S	*	*			trans	-139.8	147.4	167.8	-103.6	-79.5	0	0	0	108.2	S100 S104	S100-Y102 PolarHBondContact O-N 3.33Å; Y102-S104 PolarHBondContact O-N 2.83Å; Y102-S104 VanDerWaalsContact O-N 3.08Å
103	D	33.8	Very low	49.5	Very low	170 Å²	170	116.1 Å²	116.1	91%	0.909	61%	0.606	S	S	*	*			trans	-62.7	110.3	-173.8	-71.6	-48.3	0	0	0	111.6
104	S	38.9	Very low	49.2	Very low	78 Å²	78	115 Å²	115	55%	0.545	60%	0.597	S	S	.	*			trans	-81.6	124.9	-175.9	61.7	0	0	0	0	111.4	Y102	Y102-S104 PolarHBondContact O-N 2.83Å; Y102-S104 VanDerWaalsContact O-N 3.08Å
105	S	44.9	Very low	49.4	Very low	55 Å²	55	110 Å²	110	39%	0.385	57%	0.566	S	S	.	*			trans	-53.8	141.9	147.2	90.5	0	0	0	0	108.2	T107 D108	S105-T107 PolarHBondContact O-N 3.41Å; S105-T107 PolarHBondContact OG-OG1 3.01Å; S105-D108 PolarHBondContact O-N 3.05Å; S105-D108 PolarHBondContact OG-OD2 3.32Å
106	T	52.9	Low	50.6	Low	135 Å²	135	102.6 Å²	102.6	83%	0.828	54%	0.541	S	S	*	.	H	α-helix	trans	-56.9	-26.5	-175.2	17.4	0	0	0	0	113
107	T	50.8	Low	52.2	Low	50 Å²	50	102.2 Å²	102.2	31%	0.307	52%	0.521	S	S	.	.	H	α-helix	trans	-67.5	-39.8	175.6	15.5	0	0	0	0	114.6	S105 F110 L111	S105-T107 PolarHBondContact O-N 3.41Å; S105-T107 PolarHBondContact OG-OG1 3.01Å; T107-F110 PolarHBondContact O-N 3.45Å; T107-L111 PolarHBondContact O-N 3Å
108	D	50.9	Low	54.5	Low	63 Å²	63	93.5 Å²	93.5	34%	0.337	49%	0.485	S	S	.	.	H	α-helix	trans	-76.3	-40	-170.3	-61.7	-47.9	0	0	0	111.6	S105 F110 L111 E112	S105-D108 PolarHBondContact O-N 3.05Å; S105-D108 PolarHBondContact OG-OD2 3.32Å; D108-F110 VanDerWaalsContact C-N 3.25Å; D108-F110 PolarHBondContact O-N 3.35Å; D108-L111 PolarHBondContact O-N 3.14Å; D108-E112 PolarHBondContact O-N 2.97Å
109	A	53.3	Low	56.9	Low	36 Å²	36	90.7 Å²	90.7	30%	0.298	46%	0.458	S	S	.	.	H	α-helix	trans	-62.7	-30.4	174.6	0	0	0	0	0	113	N113	A109-N113 WeakPolarHBondContact O-CB 3.47Å; A109-N113 PolarHBondContact O-N 2.91Å; A109-N113 PolarHBondContact O-ND2 2.69Å
110	F	62	Low	59.6	Low	106 Å²	106	79.5 Å²	79.5	47%	0.465	42%	0.416	S	S	.	.	H	α-helix	trans	-70.5	-46.8	174.9	-178.6	-101.8	0	0	0	111.6	T107 D108 N113 Q114	T107-F110 PolarHBondContact O-N 3.45Å; D108-F110 VanDerWaalsContact C-N 3.25Å; D108-F110 PolarHBondContact O-N 3.35Å; F110-N113 PolarHBondContact O-N 3.4Å; F110-Q114 HydrophobicContact CE1-CG 4.38Å; F110-Q114 PolarHBondContact O-N 3.49Å
111	L	60.5	Low	62	Low	9 Å²	9	79 Å²	79	5%	0.047	41%	0.406	C	S	.	.	H	α-helix	trans	-59	-47	175	-96.7	138.9	0	0	0	112	T107 D108 N113 Q114 T115 L160 T163 R164 L167	T107-L111 PolarHBondContact O-N 3Å; D108-L111 PolarHBondContact O-N 3.14Å; L111-N113 VanDerWaalsContact C-N 3.28Å; L111-N113 PolarHBondContact O-N 3.08Å; L111-Q114 PolarHBondContact O-N 2.71Å; L111-Q114 VanDerWaalsContact O-N 3.14Å; L111-T115 PolarHBondContact O-N 2.93Å; L111-T115 VanDerWaalsContact O-N 3.16Å; L111-L160 HydrophobicContact CD1-CD1 4.45Å; L111-T163 HydrophobicContact CB-CG2 4.4Å; L111-R164 HydrophobicContact CD2-CG 3.98Å; L111-L167 HydrophobicContact CD2-CD2 3.67Å
112	E	63.1	Low	64.5	Low	93 Å²	93	69.5 Å²	69.5	44%	0.435	36%	0.361	S	S	.	.	H	α-helix	trans	-66.3	-30.8	180	-146.8	-141.1	163.4	0	0	112.4	D108 T115 K116	D108-E112 PolarHBondContact O-N 2.97Å; E112-T115 PolarHBondContact O-OG1 2.8Å; E112-K116 WeakPolarHBondContact O-CD 3.49Å; E112-K116 WeakPolarHBondContact O-CG 3.42Å; E112-K116 VanDerWaalsContact OE1-CE 3.27Å; E112-K116 WeakPolarHBondContact OE1-CE 3.32Å; E112-K116 IonicContact OE1-NZ 2.88Å; E112-K116 PolarHBondContact OE1-NZ 3.41Å; E112-K116 IonicContact OE2-NZ 2.69Å; E112-K116 PolarHBondContact OE2-NZ 2.91Å
113	N	67.3	Low	66.8	Low	94 Å²	94	60.7 Å²	60.7	50%	0.503	33%	0.327	S	S	.	.	H	α-helix	trans	-71.3	-36	171.7	-86.3	-46	0	0	0	112.7	A109 F110 L111 K116 R117	A109-N113 WeakPolarHBondContact O-CB 3.47Å; A109-N113 PolarHBondContact O-N 2.91Å; A109-N113 PolarHBondContact O-ND2 2.69Å; F110-N113 PolarHBondContact O-N 3.4Å; L111-N113 VanDerWaalsContact C-N 3.28Å; L111-N113 PolarHBondContact O-N 3.08Å; N113-K116 PolarHBondContact O-N 2.67Å; N113-R117 WeakPolarHBondContact O-CG 3.42Å
114	Q	68	Low	69.4	Low	23 Å²	23	55.8 Å²	55.8	11%	0.107	30%	0.297	C	S	.	.	H	α-helix	trans	-66.6	-39.9	176.7	-72.8	-160.2	2.1	0	0	112.8	F110 L111 K116 R117 L167	F110-Q114 HydrophobicContact CE1-CG 4.38Å; F110-Q114 PolarHBondContact O-N 3.49Å; L111-Q114 PolarHBondContact O-N 2.71Å; L111-Q114 VanDerWaalsContact O-N 3.14Å; Q114-K116 PolarHBondContact O-N 3.28Å; Q114-R117 PolarHBondContact O-N 2.99Å; Q114-R117 VanDerWaalsContact O-N 3.14Å; Q114-L167 HydrophobicContact CB-CD1 3.89Å; Q114-L167 HydrophobicContact CB-CD2 4.4Å
115	T	68.3	Low	71.7	Confident	33 Å²	33	52.2 Å²	52.2	20%	0.202	27%	0.272	C	S	.	.	H	α-helix	trans	-63.1	-23.9	179.2	60.2	0	0	0	0	113.3	P93 L111 E112 T163 N166 L167	P93-T115 WeakPolarHBondContact CG-O 3.28Å; L111-T115 PolarHBondContact O-N 2.93Å; L111-T115 VanDerWaalsContact O-N 3.16Å; E112-T115 PolarHBondContact O-OG1 2.8Å; T115-T163 HydrophobicContact CG2-CG2 4.14Å; T115-N166 HydrophobicContact CG2-CB 4.49Å; T115-L167 HydrophobicContact CG2-CB 3.97Å; T115-L167 HydrophobicContact CG2-CD1 4.3Å
116	K	76.6	Confident	73.7	Confident	98 Å²	98	51.3 Å²	51.3	43%	0.426	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-2.7	179.2	-65.2	167.2	-169.7	167.1	0	113.9	P93 E112 N113 Q114	P93-K116 VanDerWaalsContact CG-O 3.28Å; P93-K116 WeakPolarHBondContact CG-O 3.18Å; E112-K116 WeakPolarHBondContact O-CD 3.49Å; E112-K116 WeakPolarHBondContact O-CG 3.42Å; E112-K116 VanDerWaalsContact OE1-CE 3.27Å; E112-K116 WeakPolarHBondContact OE1-CE 3.32Å; E112-K116 IonicContact OE1-NZ 2.88Å; E112-K116 PolarHBondContact OE1-NZ 3.41Å; E112-K116 IonicContact OE2-NZ 2.69Å; E112-K116 PolarHBondContact OE2-NZ 2.91Å; N113-K116 PolarHBondContact O-N 2.67Å; Q114-K116 PolarHBondContact O-N 3.28Å
117	R	83.5	Confident	75.4	Confident	53 Å²	53	44.9 Å²	44.9	20%	0.2	22%	0.222	C	C	.	.	S	Bend	trans	-82.4	148.8	-179.4	-58.8	-163.3	-175	-172.5	-0.3	112.7	P93 N113 Q114 I128 W129 F131	P93-R117 WeakPolarHBondContact CD-O 3.19Å; N113-R117 WeakPolarHBondContact O-CG 3.42Å; Q114-R117 PolarHBondContact O-N 2.99Å; Q114-R117 VanDerWaalsContact O-N 3.14Å; R117-I128 HydrophobicContact CB-CG2 3.53Å; R117-I128 HydrophobicContact CG-CG2 4.21Å; R117-W129 WeakPolarHBondContact CD-O 3.29Å; R117-W129 PolarHBondContact NH1-O 2.92Å; R117-F131 HydrophobicContact CG-CE2 3.98Å
118	P	87.2	Confident	77.2	Confident	24 Å²	24	43.2 Å²	43.2	16%	0.156	21%	0.211	C	C	.	.			trans	-59.3	144.9	169.1	-19.4	30.7	0	0	0	111.6	V90 Q91 Y92 W129	V90-P118 HydrophobicContact CG1-CB 4.03Å; Q91-P118 WeakPolarHBondContact O-CA 3.48Å; Y92-P118 HydrophobicContact CD1-CB 3.97Å; Y92-P118 HydrophobicContact CD1-CG 3.81Å; Y92-P118 HydrophobicContact CE1-CB 3.97Å; Y92-P118 HydrophobicContact CE1-CG 3.84Å; P118-W129 HydrophobicContact CB-CB 4.23Å; P118-W129 HydrophobicContact CG-CB 4.38Å; P118-W129 WeakPolarHBondContact O-CB 3.09Å; P118-W129 PolarHBondContact O-N 2.97Å
119	Y	89.7	Confident	79	Confident	52 Å²	52	41 Å²	41	20%	0.204	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	161.4	179.2	68.3	-89.9	0	0	0	113.5	Q91 I121 K126 Y127	Q91-Y119 HydrophobicContact CB-CD1 4.46Å; Q91-Y119 HydrophobicContact CB-CD2 4.38Å; Q91-Y119 HydrophobicContact CB-CE1 4.16Å; Q91-Y119 HydrophobicContact CB-CE2 4.08Å; Q91-Y119 PolarHBondContact N-O 2.8Å; Q91-Y119 PolarHBondContact O-N 3.32Å; Q91-Y119 VanDerWaalsContact OE1-CZ 3.27Å; Q91-Y119 PolarHBondContact OE1-OH 3.24Å; Q91-Y119 VanDerWaalsContact OE1-OH 3.06Å; Y119-I121 HydrophobicContact CD2-CG1 4.24Å; Y119-I121 HydrophobicContact CE2-CD1 4.21Å; Y119-I121 HydrophobicContact CE2-CG1 4.22Å; Y119-K126 HydrophobicContact CD2-CD 4.29Å; Y119-K126 HydrophobicContact CD2-CG 4.02Å; Y119-K126 HydrophobicContact CG-CG 4.44Å; Y119-Y127 CarbonylContact C-O 3.46Å; Y119-Y127 VanDerWaalsContact CA-O 3.22Å; Y119-Y127 WeakPolarHBondContact CA-O 3.39Å; Y119-Y127 VanDerWaalsContact CB-O 3.25Å; Y119-Y127 WeakPolarHBondContact CB-O 3.27Å
120	I	91.1	Very high	80.5	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	150.6	171	61.3	-179.9	0	0	0	109.8	I26 V77 I79 V90 Y127 F136	I26-I120 HydrophobicContact CD1-CD1 4.22Å; V77-I120 HydrophobicContact CG2-CG2 4.03Å; I79-I120 HydrophobicContact CD1-CD1 4.13Å; V90-I120 HydrophobicContact CB-CG2 4.43Å; V90-I120 HydrophobicContact CG2-CG2 3.92Å; I120-Y127 PolarHBondContact N-O 3.05Å; I120-Y127 PolarHBondContact O-N 2.95Å; I120-F136 HydrophobicContact CD1-CB 4.05Å; I120-F136 HydrophobicContact CD1-CD1 4.1Å; I120-F136 HydrophobicContact CD1-CD2 4.16Å; I120-F136 HydrophobicContact CD1-CG 3.83Å; I120-F136 HydrophobicContact CG1-CB 4.49Å; I120-F136 HydrophobicContact CG1-CD1 3.92Å; I120-F136 HydrophobicContact CG1-CE1 4.37Å; I120-F136 HydrophobicContact CG1-CG 4.16Å; I120-F136 HydrophobicContact CG2-CD1 4.42Å; I120-F136 HydrophobicContact CG2-CE1 4.03Å; I120-F136 HydrophobicContact CG2-CZ 4.15Å
121	I	88.8	Confident	81.4	Confident	80 Å²	80	41.6 Å²	41.6	41%	0.41	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	107.3	172.7	-58.2	176.6	0	0	0	108.4	H88 Y119 L125	H88-I121 PolarHBondContact CE1-O 3.05Å; H88-I121 PolarHBondContact ND1-O 2.87Å; Y119-I121 HydrophobicContact CD2-CG1 4.24Å; Y119-I121 HydrophobicContact CE2-CD1 4.21Å; Y119-I121 HydrophobicContact CE2-CG1 4.22Å; I121-L125 CarbonylContact C-O 3.49Å; I121-L125 VanDerWaalsContact CA-O 3.26Å; I121-L125 WeakPolarHBondContact CA-O 3.27Å
122	H	87.6	Confident	82.4	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.009	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	131	178.5	-179.6	67.3	0	0	0	109.9	I79 Y86 H88 K124 L125 Y127	I79-H122 HydrophobicContact CD1-CB 3.82Å; Y86-H122 AromaticContact CD2-CE1 3.81Å; Y86-H122 AromaticContact CG-CE1 3.89Å; H88-H122 AromaticContact CD2-ND1 3.74Å; H88-H122 AromaticContact CE1-ND1 3.73Å; H88-H122 AromaticContact NE2-CE1 3.94Å; H88-H122 AromaticContact NE2-CG 3.91Å; H88-H122 AromaticContact NE2-ND1 2.97Å; H88-H122 PolarHBondContact NE2-ND1 3.23Å; H122-K124 PolarHBondContact O-N 3.25Å; H122-K124 VanDerWaalsContact O-N 3.09Å; H122-L125 PolarHBondContact N-O 3.25Å; H122-L125 WeakPolarHBondContact O-CB 3.26Å; H122-L125 PolarHBondContact O-N 3.41Å; H122-Y127 HydrophobicContact CB-CD2 4.15Å; H122-Y127 HydrophobicContact CB-CE2 3.93Å
123	K	84.4	Confident	83.2	Confident	21 Å²	21	47.8 Å²	47.8	9%	0.091	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	46.1	36.7	-173.2	-63	176.9	-174.3	176.9	0	114.2	D81 L125 R367 F371	D81-K123 IonicContact OD2-NZ 2.7Å; D81-K123 PolarHBondContact OD2-NZ 3.46Å; K123-L125 PolarHBondContact O-N 2.69Å; K123-R367 HydrophobicContact CB-CG 4.46Å; K123-R367 WeakPolarHBondContact O-CD 3.31Å; K123-R367 VanDerWaalsContact O-CG 3.29Å; K123-R367 WeakPolarHBondContact O-CG 3.46Å; K123-F371 HydrophobicContact CB-CD2 3.85Å; K123-F371 HydrophobicContact CB-CE2 4.02Å; K123-F371 HydrophobicContact CB-CG 4.27Å; K123-F371 HydrophobicContact CD-CB 4.37Å; K123-F371 HydrophobicContact CG-CB 4.38Å; K123-F371 HydrophobicContact CG-CD1 4.36Å; K123-F371 HydrophobicContact CG-CD2 4.15Å; K123-F371 HydrophobicContact CG-CG 4.04Å
124	K	86.8	Confident	84	Confident	66 Å²	66	48.2 Å²	48.2	29%	0.287	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	0.7	-174.7	-54.2	-86.9	-174.6	158.3	0	116	H122 D174 F358 M370 F371	H122-K124 PolarHBondContact O-N 3.25Å; H122-K124 VanDerWaalsContact O-N 3.09Å; K124-D174 PolarHBondContact NZ-O 3.18Å; K124-F358 HydrophobicContact CB-CB 4.31Å; K124-F358 HydrophobicContact CB-CD1 4.04Å; K124-F358 HydrophobicContact CB-CD2 3.76Å; K124-F358 HydrophobicContact CB-CE1 4.32Å; K124-F358 HydrophobicContact CB-CE2 4.07Å; K124-F358 HydrophobicContact CB-CG 3.75Å; K124-F358 HydrophobicContact CB-CZ 4.34Å; K124-F358 HydrophobicContact CD-CD2 4.31Å; K124-F358 HydrophobicContact CD-CE2 3.78Å; K124-F358 HydrophobicContact CD-CZ 3.96Å; K124-F358 HydrophobicContact CG-CD1 4.44Å; K124-F358 HydrophobicContact CG-CD2 4.32Å; K124-F358 HydrophobicContact CG-CE1 4.24Å; K124-F358 HydrophobicContact CG-CE2 4.11Å; K124-F358 HydrophobicContact CG-CG 4.49Å; K124-F358 HydrophobicContact CG-CZ 4.06Å; K124-M370 HydrophobicContact CG-CE 4.05Å; K124-F371 HydrophobicContact CG-CE2 4.01Å; K124-F371 HydrophobicContact CG-CZ 4.33Å
125	L	87.1	Confident	84.8	Confident	4 Å²	4	48.3 Å²	48.3	2%	0.021	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	141.6	167.6	-69.9	175.3	0	0	0	110.9	I121 H122 K123 Y127 L138 M359 R367	I121-L125 CarbonylContact C-O 3.49Å; I121-L125 VanDerWaalsContact CA-O 3.26Å; I121-L125 WeakPolarHBondContact CA-O 3.27Å; H122-L125 PolarHBondContact N-O 3.25Å; H122-L125 WeakPolarHBondContact O-CB 3.26Å; H122-L125 PolarHBondContact O-N 3.41Å; K123-L125 PolarHBondContact O-N 2.69Å; L125-Y127 HydrophobicContact CB-CD2 4.31Å; L125-Y127 HydrophobicContact CB-CE2 3.65Å; L125-Y127 HydrophobicContact CD1-CE2 4.47Å; L125-L138 HydrophobicContact CB-CD1 3.86Å; L125-L138 HydrophobicContact CD1-CD1 4Å; L125-L138 HydrophobicContact CD2-CD1 4.14Å; L125-L138 HydrophobicContact CG-CD1 4.23Å; L125-M359 HydrophobicContact CD2-CE 4.01Å; L125-M359 HydrophobicContact CD2-SD 3.27Å; L125-M359 WeakPolarHBondContact CD2-SD 3.31Å; L125-R367 VanDerWaalsContact CD2-NH1 3.28Å
126	K	88.4	Confident	85.7	Confident	35 Å²	35	46.9 Å²	46.9	15%	0.152	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	121	175.3	-172.1	174	178.3	180	0	109.2	Y119 I128 L139 N166 L167	Y119-K126 HydrophobicContact CD2-CD 4.29Å; Y119-K126 HydrophobicContact CD2-CG 4.02Å; Y119-K126 HydrophobicContact CG-CG 4.44Å; K126-I128 HydrophobicContact CG-CG1 4.44Å; K126-L139 HydrophobicContact CD-CD2 4.38Å; K126-L139 WeakPolarHBondContact O-CB 3.27Å; K126-L139 PolarHBondContact O-N 3.06Å; K126-N166 PolarHBondContact NZ-O 3.45Å; K126-N166 VanDerWaalsContact NZ-O 3.12Å; K126-L167 WeakPolarHBondContact CD-O 3.37Å; K126-L167 PolarHBondContact NZ-O 3.35Å
127	Y	88.1	Confident	86	Confident	1 Å²	1	46 Å²	46	0%	0.004	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	129.3	173.7	-64.4	-102.9	0	0	0	109	I17 C19 Y119 I120 H122 L125 E137 L138	I17-Y127 HydrophobicContact CG2-CD1 3.59Å; I17-Y127 HydrophobicContact CG2-CE1 3.3Å; C19-Y127 WeakPolarHBondContact CB-OH 3.38Å; C19-Y127 PolarHBondContact SG-OH 2.99Å; C19-Y127 VanDerWaalsContact SG-OH 3.34Å; Y119-Y127 CarbonylContact C-O 3.46Å; Y119-Y127 VanDerWaalsContact CA-O 3.22Å; Y119-Y127 WeakPolarHBondContact CA-O 3.39Å; Y119-Y127 VanDerWaalsContact CB-O 3.25Å; Y119-Y127 WeakPolarHBondContact CB-O 3.27Å; I120-Y127 PolarHBondContact N-O 3.05Å; I120-Y127 PolarHBondContact O-N 2.95Å; H122-Y127 HydrophobicContact CB-CD2 4.15Å; H122-Y127 HydrophobicContact CB-CE2 3.93Å; L125-Y127 HydrophobicContact CB-CD2 4.31Å; L125-Y127 HydrophobicContact CB-CE2 3.65Å; L125-Y127 HydrophobicContact CD1-CE2 4.47Å; Y127-E137 CarbonylContact C-O 3.56Å; Y127-E137 WeakPolarHBondContact CA-O 3.37Å; Y127-E137 WeakPolarHBondContact CB-O 3.47Å; Y127-L138 HydrophobicContact CD1-CB 4.12Å; Y127-L138 HydrophobicContact CD1-CD1 4.34Å; Y127-L138 HydrophobicContact CE1-CB 3.94Å; Y127-L138 HydrophobicContact CE1-CD1 4Å; Y127-L138 HydrophobicContact CE2-CD1 4.24Å
128	I	89	Confident	86	Confident	15 Å²	15	46.7 Å²	46.7	8%	0.077	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	145.3	-176.4	-59.3	-170.7	0	0	0	109.1	R117 K126 N130 E137 L139 L167	R117-I128 HydrophobicContact CB-CG2 3.53Å; R117-I128 HydrophobicContact CG-CG2 4.21Å; K126-I128 HydrophobicContact CG-CG1 4.44Å; I128-N130 PolarHBondContact O-N 3.46Å; I128-E137 PolarHBondContact N-O 3Å; I128-E137 PolarHBondContact O-N 3.18Å; I128-L139 HydrophobicContact CD1-CB 4.29Å; I128-L139 HydrophobicContact CD1-CD1 3.74Å; I128-L139 HydrophobicContact CD1-CG 4.43Å; I128-L139 HydrophobicContact CG1-CB 4.38Å; I128-L167 HydrophobicContact CD1-CD1 3.73Å
129	W	87.4	Confident	85.8	Confident	16 Å²	16	46.1 Å²	46.1	6%	0.061	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	122.8	172.9	-174.3	-103.6	0	0	0	111.2	L71 R117 P118 F131 E134 F136	L71-W129 HydrophobicContact CB-CH2 3.67Å; L71-W129 HydrophobicContact CB-CZ3 3.58Å; R117-W129 WeakPolarHBondContact CD-O 3.29Å; R117-W129 PolarHBondContact NH1-O 2.92Å; P118-W129 HydrophobicContact CB-CB 4.23Å; P118-W129 HydrophobicContact CG-CB 4.38Å; P118-W129 WeakPolarHBondContact O-CB 3.09Å; P118-W129 PolarHBondContact O-N 2.97Å; W129-F131 AromaticContact CD1-CD1 3.61Å; W129-F131 AromaticContact CD1-CE1 3.6Å; W129-F131 AromaticContact CD1-CG 3.98Å; W129-F131 AromaticContact CD1-CZ 3.97Å; W129-F131 AromaticContact NE1-CD1 3.52Å; W129-F131 AromaticContact NE1-CE1 3.81Å; W129-E134 HydrophobicContact CH2-CB 4.31Å; W129-E134 WeakPolarHBondContact CH2-O 3.4Å; W129-E134 HydrophobicContact CZ2-CB 4.2Å; W129-F136 HydrophobicContact CB-CD1 4.45Å; W129-F136 HydrophobicContact CB-CE1 4.14Å; W129-F136 HydrophobicContact CE3-CD1 4.21Å; W129-F136 AromaticContact CE3-CD2 3.78Å; W129-F136 HydrophobicContact CE3-CD2 3.78Å; W129-F136 HydrophobicContact CE3-CE1 4.06Å; W129-F136 AromaticContact CE3-CE2 3.61Å; W129-F136 HydrophobicContact CE3-CE2 3.61Å; W129-F136 HydrophobicContact CE3-CG 4.08Å; W129-F136 AromaticContact CE3-CZ 3.76Å; W129-F136 HydrophobicContact CE3-CZ 3.76Å; W129-F136 AromaticContact CZ3-CD2 3.91Å; W129-F136 HydrophobicContact CZ3-CD2 3.91Å; W129-F136 AromaticContact CZ3-CE2 3.8Å; W129-F136 HydrophobicContact CZ3-CE2 3.8Å; W129-F136 HydrophobicContact CZ3-CZ 4.38Å
130	N	84.9	Confident	85	Confident	26 Å²	26	48.1 Å²	48.1	14%	0.139	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	127.4	165.2	-171.9	-3.3	0	0	0	109.4	I128 E132 S133 E134 N135 E137	I128-N130 PolarHBondContact O-N 3.46Å; N130-E132 PolarHBondContact OD1-N 3.33Å; N130-S133 WeakPolarHBondContact CB-OG 3.46Å; N130-E134 PolarHBondContact O-N 3.36Å; N130-N135 PolarHBondContact N-O 2.81Å; N130-N135 PolarHBondContact O-N 3.48Å; N130-E137 HydrophobicContact CB-CG 4.39Å; N130-E137 VanDerWaalsContact CB-OE2 3.28Å; N130-E137 WeakPolarHBondContact CB-OE2 3.05Å; N130-E137 PolarHBondContact ND2-OE1 3.11Å; N130-E137 PolarHBondContact ND2-OE2 3.05Å
131	F	82	Confident	84.1	Confident	128 Å²	128	49.7 Å²	49.7	56%	0.561	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-23.9	-179.7	-66.7	-78.3	0	0	0	112.8	R117 W129	R117-F131 HydrophobicContact CG-CE2 3.98Å; W129-F131 AromaticContact CD1-CD1 3.61Å; W129-F131 AromaticContact CD1-CE1 3.6Å; W129-F131 AromaticContact CD1-CG 3.98Å; W129-F131 AromaticContact CD1-CZ 3.97Å; W129-F131 AromaticContact NE1-CD1 3.52Å; W129-F131 AromaticContact NE1-CE1 3.81Å
132	E	81.4	Confident	83.5	Confident	181 Å²	181	46.3 Å²	46.3	85%	0.846	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-41.4	-177.5	-66.5	172.3	-167.2	0	0	112.1	N130	N130-E132 PolarHBondContact OD1-N 3.33Å
133	S	80	Confident	82.6	Confident	51 Å²	51	46.5 Å²	46.5	36%	0.357	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-2.9	179	65.7	0	0	0	0	114.2	N130 N135 E137	N130-S133 WeakPolarHBondContact CB-OG 3.46Å; S133-N135 PolarHBondContact O-N 3.37Å; S133-E137 VanDerWaalsContact CB-OE1 3.22Å; S133-E137 WeakPolarHBondContact CB-OE1 3.49Å; S133-E137 PolarHBondContact OG-OE1 3.25Å
134	E	83.5	Confident	81.9	Confident	103 Å²	103	50.2 Å²	50.2	48%	0.481	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.5	41.5	-172.6	-60.3	-169.4	132.5	0	0	113.2	W129 N130	W129-E134 HydrophobicContact CH2-CB 4.31Å; W129-E134 WeakPolarHBondContact CH2-O 3.4Å; W129-E134 HydrophobicContact CZ2-CB 4.2Å; N130-E134 PolarHBondContact O-N 3.36Å
135	N	84.7	Confident	81.3	Confident	25 Å²	25	49.4 Å²	49.4	13%	0.134	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	164.1	-174.2	-158.4	10	0	0	0	112.5	K16 N130 S133	K16-N135 PolarHBondContact O-ND2 3.49Å; N130-N135 PolarHBondContact N-O 2.81Å; N130-N135 PolarHBondContact O-N 3.48Å; S133-N135 PolarHBondContact O-N 3.37Å
136	F	86.9	Confident	80.7	Confident	4 Å²	4	51.7 Å²	51.7	2%	0.018	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	111.4	168.8	-75.6	-79.3	0	0	0	109.4	I26 L71 V77 V90 I120 W129	I26-F136 HydrophobicContact CD1-CB 4.48Å; I26-F136 HydrophobicContact CD1-CD2 4.02Å; L71-F136 HydrophobicContact CD2-CD2 3.94Å; L71-F136 HydrophobicContact CD2-CE2 4.21Å; V77-F136 HydrophobicContact CG2-CE2 4.3Å; V90-F136 HydrophobicContact CG1-CZ 4.18Å; V90-F136 HydrophobicContact CG2-CZ 4.11Å; I120-F136 HydrophobicContact CD1-CB 4.05Å; I120-F136 HydrophobicContact CD1-CD1 4.1Å; I120-F136 HydrophobicContact CD1-CD2 4.16Å; I120-F136 HydrophobicContact CD1-CG 3.83Å; I120-F136 HydrophobicContact CG1-CB 4.49Å; I120-F136 HydrophobicContact CG1-CD1 3.92Å; I120-F136 HydrophobicContact CG1-CE1 4.37Å; I120-F136 HydrophobicContact CG1-CG 4.16Å; I120-F136 HydrophobicContact CG2-CD1 4.42Å; I120-F136 HydrophobicContact CG2-CE1 4.03Å; I120-F136 HydrophobicContact CG2-CZ 4.15Å; W129-F136 HydrophobicContact CB-CD1 4.45Å; W129-F136 HydrophobicContact CB-CE1 4.14Å; W129-F136 HydrophobicContact CE3-CD1 4.21Å; W129-F136 AromaticContact CE3-CD2 3.78Å; W129-F136 HydrophobicContact CE3-CD2 3.78Å; W129-F136 HydrophobicContact CE3-CE1 4.06Å; W129-F136 AromaticContact CE3-CE2 3.61Å; W129-F136 HydrophobicContact CE3-CE2 3.61Å; W129-F136 HydrophobicContact CE3-CG 4.08Å; W129-F136 AromaticContact CE3-CZ 3.76Å; W129-F136 HydrophobicContact CE3-CZ 3.76Å; W129-F136 AromaticContact CZ3-CD2 3.91Å; W129-F136 HydrophobicContact CZ3-CD2 3.91Å; W129-F136 AromaticContact CZ3-CE2 3.8Å; W129-F136 HydrophobicContact CZ3-CE2 3.8Å; W129-F136 HydrophobicContact CZ3-CZ 4.38Å
137	E	83.9	Confident	80.1	Confident	80 Å²	80	50.4 Å²	50.4	37%	0.374	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	153.3	177.6	-74.2	168.1	-173.9	0	0	110.1	Y127 I128 N130 S133	Y127-E137 CarbonylContact C-O 3.56Å; Y127-E137 WeakPolarHBondContact CA-O 3.37Å; Y127-E137 WeakPolarHBondContact CB-O 3.47Å; I128-E137 PolarHBondContact N-O 3Å; I128-E137 PolarHBondContact O-N 3.18Å; N130-E137 HydrophobicContact CB-CG 4.39Å; N130-E137 VanDerWaalsContact CB-OE2 3.28Å; N130-E137 WeakPolarHBondContact CB-OE2 3.05Å; N130-E137 PolarHBondContact ND2-OE1 3.11Å; N130-E137 PolarHBondContact ND2-OE2 3.05Å; S133-E137 VanDerWaalsContact CB-OE1 3.22Å; S133-E137 WeakPolarHBondContact CB-OE1 3.49Å; S133-E137 PolarHBondContact OG-OE1 3.25Å
138	L	83.5	Confident	79.6	Confident	67 Å²	67	53 Å²	53	35%	0.351	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	138.7	175.3	-175.6	61.4	0	0	0	108.6	L125 Y127 Q140	L125-L138 HydrophobicContact CB-CD1 3.86Å; L125-L138 HydrophobicContact CD1-CD1 4Å; L125-L138 HydrophobicContact CD2-CD1 4.14Å; L125-L138 HydrophobicContact CG-CD1 4.23Å; Y127-L138 HydrophobicContact CD1-CB 4.12Å; Y127-L138 HydrophobicContact CD1-CD1 4.34Å; Y127-L138 HydrophobicContact CE1-CB 3.94Å; Y127-L138 HydrophobicContact CE1-CD1 4Å; Y127-L138 HydrophobicContact CE2-CD1 4.24Å; L138-Q140 PolarHBondContact O-N 3.24Å
139	L	82.9	Confident	79.1	Confident	12 Å²	12	55.9 Å²	55.9	6%	0.063	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-53.7	119.1	172.8	166.7	58.5	0	0	0	108.8	K126 I128 N141 L167 Y168	K126-L139 HydrophobicContact CD-CD2 4.38Å; K126-L139 WeakPolarHBondContact O-CB 3.27Å; K126-L139 PolarHBondContact O-N 3.06Å; I128-L139 HydrophobicContact CD1-CB 4.29Å; I128-L139 HydrophobicContact CD1-CD1 3.74Å; I128-L139 HydrophobicContact CD1-CG 4.43Å; I128-L139 HydrophobicContact CG1-CB 4.38Å; L139-N141 PolarHBondContact O-N 3.19Å; L139-L167 HydrophobicContact CD1-CD1 4.03Å; L139-L167 HydrophobicContact CD1-CD2 4.21Å; L139-L167 HydrophobicContact CD1-CG 4.01Å; L139-L167 HydrophobicContact CD2-CG 4.32Å; L139-Y168 HydrophobicContact CD1-CE1 4.28Å; L139-Y168 HydrophobicContact CD2-CD1 3.6Å; L139-Y168 HydrophobicContact CD2-CE1 3.86Å; L139-Y168 HydrophobicContact CD2-CG 4.34Å; L139-Y168 HydrophobicContact CG-CD1 4.28Å; L139-Y168 HydrophobicContact CG-CE1 4.04Å
140	Q	73.6	Confident	78.8	Confident	94 Å²	94	55.1 Å²	55.1	44%	0.439	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-58	134.3	179.1	-158.6	173.9	15.2	0	0	109.8	L138 E144	L138-Q140 PolarHBondContact O-N 3.24Å; Q140-E144 HydrophobicContact CG-CB 4.43Å; Q140-E144 WeakPolarHBondContact CG-OE2 3.22Å; Q140-E144 PolarHBondContact NE2-OE2 2.96Å
141	N	71.9	Confident	78.6	Confident	32 Å²	32	55.1 Å²	55.1	17%	0.171	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-76.7	154.9	-177.1	-63.8	-40.4	0	0	0	110.6	L139 D143 E144 M359	L139-N141 PolarHBondContact O-N 3.19Å; N141-D143 WeakPolarHBondContact CB-OD1 3.45Å; N141-D143 PolarHBondContact O-N 3.17Å; N141-E144 PolarHBondContact O-N 3.47Å; N141-M359 WeakPolarHBondContact OD1-CE 3.39Å
142	W	74.9	Confident	78.6	Confident	10 Å²	10	54.5 Å²	54.5	4%	0.038	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-18.8	178.2	-168.6	89	0	0	0	113	R145 V150 A153 P269 V352 I354	W142-R145 WeakPolarHBondContact O-CD 3.43Å; W142-R145 WeakPolarHBondContact O-CG 3.14Å; W142-V150 HydrophobicContact CH2-CG2 4.48Å; W142-V150 HydrophobicContact CZ3-CG1 4.33Å; W142-V150 HydrophobicContact CZ3-CG2 4.13Å; W142-A153 HydrophobicContact CH2-CB 4.33Å; W142-P269 HydrophobicContact CB-CB 3.56Å; W142-P269 HydrophobicContact CD2-CB 4.42Å; W142-P269 HydrophobicContact CG-CB 3.76Å; W142-V352 HydrophobicContact CH2-CG2 3.94Å; W142-V352 HydrophobicContact CZ3-CG2 4.11Å; W142-I354 HydrophobicContact CE3-CB 4.49Å; W142-I354 HydrophobicContact CE3-CG2 3.9Å; W142-I354 HydrophobicContact CZ3-CG2 3.93Å
143	D	69.2	Low	78.5	Confident	5 Å²	5	46.5 Å²	46.5	3%	0.027	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-10.6	179.5	59.4	-4.5	0	0	0	114.3	N141 R145 F322 F324 I354 R355	N141-D143 WeakPolarHBondContact CB-OD1 3.45Å; N141-D143 PolarHBondContact O-N 3.17Å; D143-R145 PolarHBondContact O-N 2.94Å; D143-F322 HydrophobicContact CB-CD1 3.95Å; D143-F322 HydrophobicContact CB-CE1 4.09Å; D143-F322 WeakPolarHBondContact O-CD1 3.35Å; D143-F322 VanDerWaalsContact O-O 3.08Å; D143-F324 WeakPolarHBondContact OD2-CB 3.5Å; D143-F324 VanDerWaalsContact OD2-CD2 3.29Å; D143-F324 WeakPolarHBondContact OD2-CD2 3.48Å; D143-I354 HydrophobicContact CB-CB 4.35Å; D143-R355 IonicContact OD1-NH2 3.28Å; D143-R355 IonicContact OD2-CZ 2.68Å; D143-R355 IonicContact OD2-NE 3.36Å; D143-R355 PolarHBondContact OD2-NE 2.91Å; D143-R355 IonicContact OD2-NH2 3.73Å; D143-R355 PolarHBondContact OD2-NH2 3.32Å
144	E	69.7	Low	78.6	Confident	100 Å²	100	48 Å²	48	47%	0.467	25%	0.245	S	C	.	.	S	Bend	trans	-76.1	24.3	174.1	-64.8	178	-149.8	0	0	113.7	Q140 N141	Q140-E144 HydrophobicContact CG-CB 4.43Å; Q140-E144 WeakPolarHBondContact CG-OE2 3.22Å; Q140-E144 PolarHBondContact NE2-OE2 2.96Å; N141-E144 PolarHBondContact O-N 3.47Å
145	R	73.5	Confident	78.6	Confident	48 Å²	48	43.9 Å²	43.9	18%	0.181	23%	0.227	C	C	.	.	S	Bend	trans	-91.9	163.4	-177	-82.7	-179.9	176	-117.7	-1.7	112.9	W142 D143 E149 V150 F322	W142-R145 WeakPolarHBondContact O-CD 3.43Å; W142-R145 WeakPolarHBondContact O-CG 3.14Å; D143-R145 PolarHBondContact O-N 2.94Å; R145-E149 WeakPolarHBondContact CD-OE2 3.41Å; R145-E149 IonicContact CZ-OE2 3.75Å; R145-E149 IonicContact NE-OE2 2.66Å; R145-E149 IonicContact NH1-OE2 2.67Å; R145-E149 PolarHBondContact NH1-OE2 2.91Å; R145-V150 HydrophobicContact CB-CG2 4.2Å; R145-F322 PolarHBondContact O-N 2.92Å
146	P	74.8	Confident	78.7	Confident	52 Å²	52	42.8 Å²	42.8	34%	0.338	22%	0.221	S	C	.	.	B	Isolated β-bridge	trans	-55.7	140.9	167.7	-21.4	33	0	0	0	111.3	D148 E149 V150 T320	P146-D148 PolarHBondContact O-N 2.92Å; P146-E149 HydrophobicContact CB-CG 4.37Å; P146-E149 HydrophobicContact CG-CG 4.34Å; P146-E149 PolarHBondContact O-N 3.22Å; P146-E149 VanDerWaalsContact O-N 3.08Å; P146-V150 PolarHBondContact O-N 3.36Å; P146-T320 WeakPolarHBondContact CA-O 3.29Å
147	Y	77.4	Confident	78.7	Confident	8 Å²	8	45.4 Å²	45.4	3%	0.031	24%	0.238	C	C	.	.	H	α-helix	trans	-50	-43.3	-179.7	-174.4	-93	0	0	0	112.5	E149 V150 L151 L312 P313 Y317 T320 F322	Y147-E149 VanDerWaalsContact C-N 3.32Å; Y147-E149 PolarHBondContact O-N 3.15Å; Y147-V150 PolarHBondContact O-N 3.16Å; Y147-V150 VanDerWaalsContact O-N 3.15Å; Y147-L151 HydrophobicContact CE1-CD2 4.32Å; Y147-L151 PolarHBondContact O-N 3.49Å; Y147-L312 HydrophobicContact CD2-CD2 4.35Å; Y147-L312 HydrophobicContact CE1-CD2 4.41Å; Y147-L312 HydrophobicContact CE2-CD1 4.48Å; Y147-L312 HydrophobicContact CE2-CD2 3.75Å; Y147-L312 HydrophobicContact CE2-CG 3.95Å; Y147-P313 VanDerWaalsContact OH-CD 3.32Å; Y147-P313 WeakPolarHBondContact OH-CD 3.44Å; Y147-P313 PolarHBondContact OH-O 3.42Å; Y147-Y317 HydrophobicContact CE2-CD2 4.39Å; Y147-T320 WeakPolarHBondContact CB-O 3.14Å; Y147-T320 PolarHBondContact N-O 2.79Å; Y147-F322 HydrophobicContact CD2-CD2 4.38Å
148	D	76.9	Confident	78.8	Confident	57 Å²	57	46.1 Å²	46.1	31%	0.305	25%	0.248	S	C	.	.	H	α-helix	trans	-68.9	-26.9	-175.6	-54.2	-55.3	0	0	0	113.3	P146 N152 N319	P146-D148 PolarHBondContact O-N 2.92Å; D148-N152 WeakPolarHBondContact O-CB 3.45Å; D148-N152 PolarHBondContact O-N 2.9Å; D148-N152 VanDerWaalsContact O-N 3.07Å; D148-N152 PolarHBondContact O-ND2 3.36Å; D148-N152 VanDerWaalsContact O-ND2 3.14Å; D148-N319 PolarHBondContact OD2-N 3.46Å
149	E	78.5	Confident	78.8	Confident	75 Å²	75	48.8 Å²	48.8	35%	0.35	26%	0.262	S	S	.	.	H	α-helix	trans	-74.8	-30.8	173	-70.4	-171.1	-166	0	0	112.6	R145 P146 Y147 A153	R145-E149 WeakPolarHBondContact CD-OE2 3.41Å; R145-E149 IonicContact CZ-OE2 3.75Å; R145-E149 IonicContact NE-OE2 2.66Å; R145-E149 IonicContact NH1-OE2 2.67Å; R145-E149 PolarHBondContact NH1-OE2 2.91Å; P146-E149 HydrophobicContact CB-CG 4.37Å; P146-E149 HydrophobicContact CG-CG 4.34Å; P146-E149 PolarHBondContact O-N 3.22Å; P146-E149 VanDerWaalsContact O-N 3.08Å; Y147-E149 VanDerWaalsContact C-N 3.32Å; Y147-E149 PolarHBondContact O-N 3.15Å; E149-A153 WeakPolarHBondContact O-CA 3.5Å; E149-A153 PolarHBondContact O-N 3.47Å
150	V	80.2	Confident	78.9	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-77	-41	176.6	-179.5	0	0	0	0	110	W142 R145 P146 Y147 V287 F322 V352	W142-V150 HydrophobicContact CH2-CG2 4.48Å; W142-V150 HydrophobicContact CZ3-CG1 4.33Å; W142-V150 HydrophobicContact CZ3-CG2 4.13Å; R145-V150 HydrophobicContact CB-CG2 4.2Å; P146-V150 PolarHBondContact O-N 3.36Å; Y147-V150 PolarHBondContact O-N 3.16Å; Y147-V150 VanDerWaalsContact O-N 3.15Å; V150-V287 HydrophobicContact CG1-CG1 4.41Å; V150-F322 HydrophobicContact CG2-CB 4.22Å; V150-F322 HydrophobicContact CG2-CG 4.44Å; V150-V352 HydrophobicContact CG1-CG1 4.19Å
151	L	80.9	Confident	79.6	Confident	25 Å²	25	45.7 Å²	45.7	13%	0.131	25%	0.249	C	C	.	.	H	α-helix	trans	-64.8	-46.3	177.9	-173.1	70.4	0	0	0	112	Y147 L312	Y147-L151 HydrophobicContact CE1-CD2 4.32Å; Y147-L151 PolarHBondContact O-N 3.49Å; L151-L312 HydrophobicContact CB-CD2 4.49Å; L151-L312 HydrophobicContact CD1-CB 3.93Å; L151-L312 HydrophobicContact CD1-CD2 4.17Å
152	N	81.5	Confident	80.2	Confident	116 Å²	116	50.1 Å²	50.1	62%	0.62	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	41.8	-179.2	-57	-65.9	0	0	0	111.8	D148 P154	D148-N152 WeakPolarHBondContact O-CB 3.45Å; D148-N152 PolarHBondContact O-N 2.9Å; D148-N152 VanDerWaalsContact O-N 3.07Å; D148-N152 PolarHBondContact O-ND2 3.36Å; D148-N152 VanDerWaalsContact O-ND2 3.14Å; N152-P154 WeakPolarHBondContact O-CD 3.36Å
153	A	80.6	Confident	80.7	Confident	12 Å²	12	51.5 Å²	51.5	10%	0.099	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-57.7	119.4	-178.1	0	0	0	0	0	111.2	W142 E149 V352	W142-A153 HydrophobicContact CH2-CB 4.33Å; E149-A153 WeakPolarHBondContact O-CA 3.5Å; E149-A153 PolarHBondContact O-N 3.47Å; A153-V352 HydrophobicContact CB-CB 4.27Å; A153-V352 HydrophobicContact CB-CG2 3.79Å
154	P	81.1	Confident	81.6	Confident	82 Å²	82	51.8 Å²	51.8	53%	0.532	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-74	148.1	179.9	30	-34.8	0	0	0	111.2	N152	N152-P154 WeakPolarHBondContact O-CD 3.36Å
155	T	84.6	Confident	82.4	Confident	17 Å²	17	51.1 Å²	51.1	10%	0.104	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-60	136.8	170.3	50.3	0	0	0	0	110.8	C250 R252 D257 L272	T155-C250 HydrophobicContact CG2-CB 4.38Å; T155-R252 PolarHBondContact OG1-NE 2.88Å; T155-R252 PolarHBondContact OG1-NH2 3.14Å; T155-D257 VanDerWaalsContact CB-OD1 3.29Å; T155-D257 WeakPolarHBondContact CB-OD1 3.33Å; T155-D257 HydrophobicContact CG2-CB 4.3Å; T155-D257 VanDerWaalsContact OG1-CG 3.24Å; T155-D257 PolarHBondContact OG1-OD1 3.37Å; T155-D257 PolarHBondContact OG1-OD2 3.19Å; T155-L272 HydrophobicContact CG2-CD1 3.69Å
156	L	86.9	Confident	82.9	Confident	2 Å²	2	53.7 Å²	53.7	1%	0.01	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	138.1	-173.3	-54	-174.9	0	0	0	111.7	L160 I161 R252 V268 G270	L156-L160 HydrophobicContact CD2-CD2 3.84Å; L156-L160 HydrophobicContact CD2-CG 4.43Å; L156-I161 HydrophobicContact CB-CD1 4.04Å; L156-I161 HydrophobicContact CB-CG1 3.69Å; L156-I161 HydrophobicContact CD1-CG1 4.12Å; L156-R252 PolarHBondContact O-N 3.01Å; L156-V268 HydrophobicContact CD1-CG2 3.81Å; L156-G270 WeakPolarHBondContact CG-O 3.39Å
157	T	87.1	Confident	83.4	Confident	60 Å²	60	51.2 Å²	51.2	37%	0.368	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	157.4	168.3	57.1	0	0	0	0	111.1	D159 L160 I161 R252	T157-D159 VanDerWaalsContact C-N 3.3Å; T157-D159 PolarHBondContact O-N 3.41Å; T157-L160 PolarHBondContact O-N 3.26Å; T157-L160 VanDerWaalsContact O-N 3.16Å; T157-I161 WeakPolarHBondContact O-CG1 3.36Å; T157-I161 PolarHBondContact O-N 3.49Å; T157-R252 HydrophobicContact CG2-CB 4.32Å
158	T	85.3	Confident	83.8	Confident	94 Å²	94	53.2 Å²	53.2	58%	0.577	28%	0.281	S	S	*	.	H	α-helix	trans	-53.9	-43.1	-178.2	-34.7	0	0	0	0	113.2	L160 I161 E162	T158-L160 PolarHBondContact O-N 2.87Å; T158-I161 WeakPolarHBondContact O-CB 3.46Å; T158-I161 PolarHBondContact O-N 2.93Å; T158-E162 PolarHBondContact O-N 3.01Å
159	D	83.8	Confident	84.3	Confident	123 Å²	123	51.8 Å²	51.8	66%	0.658	28%	0.279	S	S	*	.	H	α-helix	trans	-67.7	-37.2	-178.4	-56	-27.9	0	0	0	112.3	T157 E162 T163	T157-D159 VanDerWaalsContact C-N 3.3Å; T157-D159 PolarHBondContact O-N 3.41Å; D159-E162 PolarHBondContact O-N 3.47Å; D159-T163 WeakPolarHBondContact O-CB 3.45Å; D159-T163 PolarHBondContact O-N 2.8Å; D159-T163 PolarHBondContact O-OG1 3.38Å
160	L	85.6	Confident	84.8	Confident	25 Å²	25	52.8 Å²	52.8	13%	0.131	29%	0.286	C	S	.	.	H	α-helix	trans	-71.5	-35.9	176.7	-176.4	55.9	0	0	0	111.1	L111 L156 T157 T158 T163 R164	L111-L160 HydrophobicContact CD1-CD1 4.45Å; L156-L160 HydrophobicContact CD2-CD2 3.84Å; L156-L160 HydrophobicContact CD2-CG 4.43Å; T157-L160 PolarHBondContact O-N 3.26Å; T157-L160 VanDerWaalsContact O-N 3.16Å; T158-L160 PolarHBondContact O-N 2.87Å; L160-T163 PolarHBondContact O-N 3.05Å; L160-R164 HydrophobicContact CD1-CG 4.31Å; L160-R164 WeakPolarHBondContact O-CB 3.41Å; L160-R164 VanDerWaalsContact O-CG 3.31Å; L160-R164 WeakPolarHBondContact O-CG 3.43Å; L160-R164 PolarHBondContact O-N 3.46Å
161	I	86.6	Confident	85.3	Confident	16 Å²	16	53.3 Å²	53.3	8%	0.082	29%	0.289	C	S	.	.	H	α-helix	trans	-61.7	-47.5	172	-66.6	158.8	0	0	0	110.2	L156 T157 T158 T163 R164 R165 R251 V268	L156-I161 HydrophobicContact CB-CD1 4.04Å; L156-I161 HydrophobicContact CB-CG1 3.69Å; L156-I161 HydrophobicContact CD1-CG1 4.12Å; T157-I161 WeakPolarHBondContact O-CG1 3.36Å; T157-I161 PolarHBondContact O-N 3.49Å; T158-I161 WeakPolarHBondContact O-CB 3.46Å; T158-I161 PolarHBondContact O-N 2.93Å; I161-T163 PolarHBondContact O-N 2.88Å; I161-R164 PolarHBondContact O-N 3.05Å; I161-R165 VanDerWaalsContact O-CB 3.25Å; I161-R165 WeakPolarHBondContact O-CB 3.46Å; I161-R165 PolarHBondContact O-N 2.94Å; I161-R251 HydrophobicContact CD1-CB 4.39Å; I161-R251 HydrophobicContact CD1-CG 3.89Å; I161-V268 HydrophobicContact CG1-CG2 4.35Å; I161-V268 HydrophobicContact CG2-CG1 4.47Å; I161-V268 HydrophobicContact CG2-CG2 4.19Å
162	E	86.2	Confident	85.6	Confident	125 Å²	125	57.3 Å²	57.3	58%	0.584	31%	0.306	S	S	*	.	H	α-helix	trans	-63.8	-40.5	178	-171.8	169	-165.7	0	0	111.8	T158 D159 R165 N166	T158-E162 PolarHBondContact O-N 3.01Å; D159-E162 PolarHBondContact O-N 3.47Å; E162-R165 PolarHBondContact O-N 3.41Å; E162-N166 WeakPolarHBondContact O-CB 3.49Å; E162-N166 PolarHBondContact O-N 3.46Å; E162-N166 PolarHBondContact O-ND2 3.36Å
163	T	84.9	Confident	85.6	Confident	39 Å²	39	52.7 Å²	52.7	24%	0.239	28%	0.28	C	S	.	.	H	α-helix	trans	-60.9	-46.1	175	-58.7	0	0	0	0	111.7	L111 T115 D159 L160 I161 N166 L167	L111-T163 HydrophobicContact CB-CG2 4.4Å; T115-T163 HydrophobicContact CG2-CG2 4.14Å; D159-T163 WeakPolarHBondContact O-CB 3.45Å; D159-T163 PolarHBondContact O-N 2.8Å; D159-T163 PolarHBondContact O-OG1 3.38Å; L160-T163 PolarHBondContact O-N 3.05Å; I161-T163 PolarHBondContact O-N 2.88Å; T163-N166 PolarHBondContact O-N 3.15Å; T163-L167 PolarHBondContact O-N 2.86Å
164	R	87.3	Confident	85.6	Confident	12 Å²	12	54.8 Å²	54.8	5%	0.045	29%	0.29	C	S	.	.	H	α-helix	trans	-68.7	-36.2	176.7	-69.9	-178.3	-172.3	-171.9	7.1	112.3	L111 L160 I161 N166 L167 Y168 V268 P269	L111-R164 HydrophobicContact CD2-CG 3.98Å; L160-R164 HydrophobicContact CD1-CG 4.31Å; L160-R164 WeakPolarHBondContact O-CB 3.41Å; L160-R164 VanDerWaalsContact O-CG 3.31Å; L160-R164 WeakPolarHBondContact O-CG 3.43Å; L160-R164 PolarHBondContact O-N 3.46Å; I161-R164 PolarHBondContact O-N 3.05Å; R164-N166 VanDerWaalsContact C-N 3.31Å; R164-N166 PolarHBondContact O-N 2.98Å; R164-L167 PolarHBondContact O-N 3.28Å; R164-L167 VanDerWaalsContact O-N 3.15Å; R164-Y168 HydrophobicContact CB-CD2 4.35Å; R164-Y168 WeakPolarHBondContact O-CD2 3.21Å; R164-Y168 PolarHBondContact O-N 3.47Å; R164-V268 HydrophobicContact CB-CB 4.02Å; R164-V268 HydrophobicContact CB-CG1 4.31Å; R164-V268 HydrophobicContact CB-CG2 4.21Å; R164-P269 VanDerWaalsContact CD-O 3.26Å; R164-P269 WeakPolarHBondContact CD-O 3.5Å; R164-P269 PolarHBondContact NH1-O 3.43Å
165	R	87.3	Confident	85.3	Confident	85 Å²	85	51.5 Å²	51.5	32%	0.321	27%	0.268	S	S	.	.	H	α-helix	trans	-63	-36.6	174	-167	176.2	-170.6	160.4	6.8	111.5	I161 E162 G169 E266 V268	I161-R165 VanDerWaalsContact O-CB 3.25Å; I161-R165 WeakPolarHBondContact O-CB 3.46Å; I161-R165 PolarHBondContact O-N 2.94Å; E162-R165 PolarHBondContact O-N 3.41Å; R165-G169 CarbonylContact O-C 3.6Å; R165-G169 WeakPolarHBondContact O-CA 3.44Å; R165-G169 PolarHBondContact O-N 2.96Å; R165-E266 IonicContact CZ-OE1 2.87Å; R165-E266 IonicContact NH1-OE1 3.88Å; R165-E266 PolarHBondContact NH1-OE1 3.06Å; R165-E266 IonicContact NH2-OE1 3.73Å; R165-E266 PolarHBondContact NH2-OE1 2.99Å; R165-V268 HydrophobicContact CB-CG1 4.02Å
166	N	84.2	Confident	84.9	Confident	102 Å²	102	54.1 Å²	54.1	55%	0.545	29%	0.287	S	S	.	.	H	α-helix	trans	-71.9	-32.1	172.8	-74.8	-42.8	0	0	0	113.1	T115 K126 E162 T163 R164	T115-N166 HydrophobicContact CG2-CB 4.49Å; K126-N166 PolarHBondContact NZ-O 3.45Å; K126-N166 VanDerWaalsContact NZ-O 3.12Å; E162-N166 WeakPolarHBondContact O-CB 3.49Å; E162-N166 PolarHBondContact O-N 3.46Å; E162-N166 PolarHBondContact O-ND2 3.36Å; T163-N166 PolarHBondContact O-N 3.15Å; R164-N166 VanDerWaalsContact C-N 3.31Å; R164-N166 PolarHBondContact O-N 2.98Å
167	L	84.9	Confident	84.7	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-76.9	-58.2	177.7	-170.8	60.6	0	0	0	112.7	L111 Q114 T115 K126 I128 L139 T163 R164	L111-L167 HydrophobicContact CD2-CD2 3.67Å; Q114-L167 HydrophobicContact CB-CD1 3.89Å; Q114-L167 HydrophobicContact CB-CD2 4.4Å; T115-L167 HydrophobicContact CG2-CB 3.97Å; T115-L167 HydrophobicContact CG2-CD1 4.3Å; K126-L167 WeakPolarHBondContact CD-O 3.37Å; K126-L167 PolarHBondContact NZ-O 3.35Å; I128-L167 HydrophobicContact CD1-CD1 3.73Å; L139-L167 HydrophobicContact CD1-CD1 4.03Å; L139-L167 HydrophobicContact CD1-CD2 4.21Å; L139-L167 HydrophobicContact CD1-CG 4.01Å; L139-L167 HydrophobicContact CD2-CG 4.32Å; T163-L167 PolarHBondContact O-N 2.86Å; R164-L167 PolarHBondContact O-N 3.28Å; R164-L167 VanDerWaalsContact O-N 3.15Å
168	Y	85.9	Confident	84.5	Confident	50 Å²	50	56 Å²	56	20%	0.196	30%	0.296	C	S	.	.	H	α-helix	trans	-88.4	-24.9	-174.1	-64.8	-78.7	0	0	0	113.7	L139 R164 P269	L139-Y168 HydrophobicContact CD1-CE1 4.28Å; L139-Y168 HydrophobicContact CD2-CD1 3.6Å; L139-Y168 HydrophobicContact CD2-CE1 3.86Å; L139-Y168 HydrophobicContact CD2-CG 4.34Å; L139-Y168 HydrophobicContact CG-CD1 4.28Å; L139-Y168 HydrophobicContact CG-CE1 4.04Å; R164-Y168 HydrophobicContact CB-CD2 4.35Å; R164-Y168 WeakPolarHBondContact O-CD2 3.21Å; R164-Y168 PolarHBondContact O-N 3.47Å; Y168-P269 HydrophobicContact CD1-CG 4.1Å; Y168-P269 HydrophobicContact CD2-CB 4.5Å; Y168-P269 HydrophobicContact CD2-CG 3.84Å; Y168-P269 HydrophobicContact CE1-CG 4.38Å; Y168-P269 HydrophobicContact CE2-CB 4.38Å; Y168-P269 HydrophobicContact CE2-CG 4.14Å; Y168-P269 HydrophobicContact CG-CG 3.82Å
169	G	86.9	Confident	84.7	Confident	26 Å²	26	55.1 Å²	55.1	27%	0.268	29%	0.293	S	S	.	.			trans	93.3	-168.5	-175	0	0	0	0	0	113.6	R165	R165-G169 CarbonylContact O-C 3.6Å; R165-G169 WeakPolarHBondContact O-CA 3.44Å; R165-G169 PolarHBondContact O-N 2.96Å
170	I	89.3	Confident	85	Confident	97 Å²	97	53.4 Å²	53.4	50%	0.497	28%	0.283	S	S	.	.			trans	-82.5	138.8	178.9	-58.9	175	0	0	0	108.8	K172 T265	I170-K172 HydrophobicContact CG2-CB 4.07Å; I170-K172 PolarHBondContact O-N 3.15Å; I170-T265 WeakPolarHBondContact CG2-O 3.42Å
171	N	90.4	Very high	85.2	Confident	10 Å²	10	59.2 Å²	59.2	5%	0.053	31%	0.311	C	S	.	.	S	Bend	trans	-73	71.1	175.5	-177.3	39.4	0	0	0	111.6	S264 T265 L267 Q283 T356 G357	N171-S264 WeakPolarHBondContact CB-O 3.27Å; N171-S264 PolarHBondContact ND2-O 2.89Å; N171-T265 PolarHBondContact N-O 3.2Å; N171-T265 WeakPolarHBondContact O-CA 3.31Å; N171-L267 HydrophobicContact CB-CB 4.25Å; N171-L267 WeakPolarHBondContact CB-O 3.34Å; N171-Q283 PolarHBondContact ND2-O 2.93Å; N171-Q283 PolarHBondContact OD1-O 3.17Å; N171-T356 HydrophobicContact CB-CG2 4.06Å; N171-T356 WeakPolarHBondContact OD1-CA 3.39Å; N171-T356 VanDerWaalsContact OD1-CB 3.31Å; N171-T356 WeakPolarHBondContact OD1-CB 3.35Å; N171-G357 PolarHBondContact OD1-N 2.61Å
172	K	87	Confident	85.2	Confident	110 Å²	110	66 Å²	66	48%	0.478	34%	0.335	S	S	.	.			trans	-145.6	119.6	-178.8	-171.7	172.2	-174.9	162.6	0	112	I170 D174 T265	I170-K172 HydrophobicContact CG2-CB 4.07Å; I170-K172 PolarHBondContact O-N 3.15Å; K172-D174 HydrophobicContact CG-CB 4.33Å; K172-D174 PolarHBondContact O-N 3.49Å; K172-T265 HydrophobicContact CB-CG2 4.35Å; K172-T265 HydrophobicContact CD-CG2 4.27Å
173	I	82.8	Confident	85.2	Confident	18 Å²	18	60.7 Å²	60.7	9%	0.092	31%	0.311	C	S	.	.			trans	-78.1	72	172.7	-51.7	175.1	0	0	0	108.7	V175 V241 C242 F358 K362 V366	I173-V175 PolarHBondContact O-N 2.87Å; I173-V241 HydrophobicContact CB-CG1 4.02Å; I173-V241 HydrophobicContact CG2-CG1 3.47Å; I173-V241 VanDerWaalsContact CG2-CG1 3.47Å; I173-C242 PolarHBondContact O-SG 3.25Å; I173-F358 HydrophobicContact CB-CE1 4.5Å; I173-F358 HydrophobicContact CB-CZ 4.43Å; I173-F358 HydrophobicContact CG2-CD1 4.07Å; I173-F358 HydrophobicContact CG2-CE1 3.45Å; I173-F358 VanDerWaalsContact CG2-CE1 3.45Å; I173-F358 HydrophobicContact CG2-CE2 4.5Å; I173-F358 HydrophobicContact CG2-CZ 3.71Å; I173-K362 HydrophobicContact CD1-CG 4.03Å; I173-V366 HydrophobicContact CG2-CB 4.03Å; I173-V366 HydrophobicContact CG2-CG1 3.7Å; I173-V366 HydrophobicContact CG2-CG2 4.31Å
174	D	79.1	Confident	85.4	Confident	56 Å²	56	61.3 Å²	61.3	30%	0.299	31%	0.314	S	S	.	.			trans	-80.2	106	-178.1	-172.6	53.1	0	0	0	112.6	K124 K172 S176 K238	K124-D174 PolarHBondContact NZ-O 3.18Å; K172-D174 HydrophobicContact CG-CB 4.33Å; K172-D174 PolarHBondContact O-N 3.49Å; D174-S176 PolarHBondContact O-N 3.45Å; D174-K238 IonicContact OD1-NZ 3.66Å; D174-K238 PolarHBondContact OD1-NZ 2.72Å
175	V	75.6	Confident	85.4	Confident	13 Å²	13	65.5 Å²	65.5	8%	0.079	34%	0.337	C	S	.	.			trans	-75.8	97.8	163	-174.5	0	0	0	0	107.8	I173 L177 L237 K238 V241 V366 M370	I173-V175 PolarHBondContact O-N 2.87Å; V175-L177 PolarHBondContact O-N 3.4Å; V175-L177 VanDerWaalsContact O-N 3.11Å; V175-L237 HydrophobicContact CG1-CD2 4.42Å; V175-K238 HydrophobicContact CB-CB 4.46Å; V175-K238 WeakPolarHBondContact O-CD 3.22Å; V175-K238 PolarHBondContact O-NZ 3Å; V175-V241 HydrophobicContact CG2-CB 4.1Å; V175-V241 HydrophobicContact CG2-CG1 3.77Å; V175-V241 HydrophobicContact CG2-CG2 4.45Å; V175-V366 HydrophobicContact CG2-CG1 4.41Å; V175-M370 HydrophobicContact CG1-SD 4.26Å; V175-M370 HydrophobicContact CG2-SD 4.09Å
176	S	77	Confident	85.2	Confident	72 Å²	72	65.1 Å²	65.1	50%	0.503	34%	0.341	S	S	.	.			trans	-71.5	102	-179.5	52	0	0	0	0	110.3	D174 T178	D174-S176 PolarHBondContact O-N 3.45Å; S176-T178 PolarHBondContact O-N 2.95Å
177	L	81.3	Confident	85.1	Confident	57 Å²	57	60.7 Å²	60.7	30%	0.298	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-53.7	127.4	174.2	-76.5	-176.6	0	0	0	111	V175 E234 R235 K238	V175-L177 PolarHBondContact O-N 3.4Å; V175-L177 VanDerWaalsContact O-N 3.11Å; L177-E234 HydrophobicContact CD2-CB 3.79Å; L177-R235 HydrophobicContact CD2-CG 4.41Å; L177-K238 HydrophobicContact CD1-CD 4.05Å; L177-K238 HydrophobicContact CD2-CB 4.36Å; L177-K238 HydrophobicContact CD2-CD 4.23Å; L177-K238 HydrophobicContact CG-CD 3.77Å
178	T	82.8	Confident	85.2	Confident	44 Å²	44	63.1 Å²	63.1	27%	0.27	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-66.8	141.8	176.7	56.4	0	0	0	0	110.6	S176 L183 R231 E234	S176-T178 PolarHBondContact O-N 2.95Å; T178-L183 WeakPolarHBondContact OG1-CD1 3.17Å; T178-L183 WeakPolarHBondContact OG1-CD2 3.33Å; T178-L183 WeakPolarHBondContact OG1-CG 3.28Å; T178-R231 PolarHBondContact O-NH1 3.43Å; T178-R231 PolarHBondContact O-NH2 3.07Å; T178-E234 WeakPolarHBondContact CB-OE1 3.26Å; T178-E234 VanDerWaalsContact CG2-OE1 3.28Å; T178-E234 WeakPolarHBondContact CG2-OE1 3.47Å; T178-E234 PolarHBondContact N-OE1 3.04Å; T178-E234 VanDerWaalsContact OG1-CD 3.26Å; T178-E234 PolarHBondContact OG1-OE1 3.2Å; T178-E234 PolarHBondContact OG1-OE2 2.89Å
179	P	90	Very high	85.2	Confident	77 Å²	77	63.2 Å²	63.2	50%	0.5	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-64	139.5	176	-23.6	34.1	0	0	0	110.9	M181 R182 L183	P179-M181 VanDerWaalsContact C-N 3.26Å; P179-M181 PolarHBondContact O-N 2.98Å; P179-R182 HydrophobicContact CB-CB 4.17Å; P179-R182 HydrophobicContact CG-CB 4.41Å; P179-R182 WeakPolarHBondContact O-CA 3.15Å; P179-R182 WeakPolarHBondContact O-CB 3.21Å; P179-R182 PolarHBondContact O-N 3.25Å; P179-L183 PolarHBondContact O-N 2.91Å
180	I	90	Very high	85	Confident	87 Å²	87	64.3 Å²	64.3	45%	0.446	34%	0.342	S	S	.	.	H	α-helix	trans	-56.6	-42.7	-178.8	-61.3	172.6	0	0	0	110.7	R182 L183 V184 V227	I180-R182 PolarHBondContact O-N 3.35Å; I180-L183 WeakPolarHBondContact O-CB 3.45Å; I180-L183 PolarHBondContact O-N 3.28Å; I180-L183 VanDerWaalsContact O-N 3.08Å; I180-V184 HydrophobicContact CG2-CG2 4.32Å; I180-V184 WeakPolarHBondContact O-CG2 3.48Å; I180-V184 PolarHBondContact O-N 2.9Å; I180-V227 HydrophobicContact CG2-CG1 4.41Å
181	M	89.5	Confident	84.5	Confident	146 Å²	146	62.4 Å²	62.4	72%	0.719	34%	0.336	S	S	*	.	H	α-helix	trans	-60	-31.8	175.3	-64.1	-57.5	171.4	0	0	113.1	P179 L185	P179-M181 VanDerWaalsContact C-N 3.26Å; P179-M181 PolarHBondContact O-N 2.98Å; M181-L185 VanDerWaalsContact O-CB 3.27Å; M181-L185 WeakPolarHBondContact O-CB 3.3Å; M181-L185 WeakPolarHBondContact O-CD1 3.45Å; M181-L185 WeakPolarHBondContact O-CG 3.49Å; M181-L185 PolarHBondContact O-N 3.39Å
182	R	87.9	Confident	83.9	Confident	159 Å²	159	63.6 Å²	63.6	60%	0.6	34%	0.34	S	S	*	.	H	α-helix	trans	-75.4	-35.4	175.4	-162.8	176.1	-164.5	162.1	5.6	112	P179 I180 N186	P179-R182 HydrophobicContact CB-CB 4.17Å; P179-R182 HydrophobicContact CG-CB 4.41Å; P179-R182 WeakPolarHBondContact O-CA 3.15Å; P179-R182 WeakPolarHBondContact O-CB 3.21Å; P179-R182 PolarHBondContact O-N 3.25Å; I180-R182 PolarHBondContact O-N 3.35Å; R182-N186 VanDerWaalsContact O-CB 3.25Å; R182-N186 WeakPolarHBondContact O-CB 3.39Å; R182-N186 PolarHBondContact O-N 3.28Å; R182-N186 PolarHBondContact O-OD1 3.34Å
183	L	84.5	Confident	83.8	Confident	14 Å²	14	59.8 Å²	59.8	7%	0.073	32%	0.324	C	S	.	.	H	α-helix	trans	-63.6	-48.3	171.7	-70.4	178.6	0	0	0	111.3	T178 P179 I180 N186 G187 V227 L230 R231	T178-L183 WeakPolarHBondContact OG1-CD1 3.17Å; T178-L183 WeakPolarHBondContact OG1-CD2 3.33Å; T178-L183 WeakPolarHBondContact OG1-CG 3.28Å; P179-L183 PolarHBondContact O-N 2.91Å; I180-L183 WeakPolarHBondContact O-CB 3.45Å; I180-L183 PolarHBondContact O-N 3.28Å; I180-L183 VanDerWaalsContact O-N 3.08Å; L183-N186 PolarHBondContact O-N 3.11Å; L183-G187 PolarHBondContact O-N 2.95Å; L183-V227 HydrophobicContact CB-CG1 3.94Å; L183-V227 HydrophobicContact CB-CG2 4.38Å; L183-V227 HydrophobicContact CD1-CG1 4.32Å; L183-L230 HydrophobicContact CD2-CD2 3.66Å; L183-L230 HydrophobicContact CD2-CG 4.36Å; L183-R231 HydrophobicContact CD1-CB 4.43Å
184	V	89.4	Confident	83.9	Confident	51 Å²	51	60.3 Å²	60.3	31%	0.309	33%	0.329	S	S	.	.	H	α-helix	trans	-59.6	-50.4	176.1	174.3	0	0	0	0	110.5	I180 N186 G187 C188 V227	I180-V184 HydrophobicContact CG2-CG2 4.32Å; I180-V184 WeakPolarHBondContact O-CG2 3.48Å; I180-V184 PolarHBondContact O-N 2.9Å; V184-N186 PolarHBondContact O-N 3.47Å; V184-G187 PolarHBondContact O-N 3.43Å; V184-G187 VanDerWaalsContact O-N 3.15Å; V184-C188 PolarHBondContact O-N 3.15Å; V184-C188 PolarHBondContact O-SG 3.28Å; V184-C188 VanDerWaalsContact O-SG 3.34Å; V184-V227 HydrophobicContact CG2-CG1 4.18Å; V184-V227 HydrophobicContact CG2-CG2 4.25Å
185	L	88.6	Confident	84.1	Confident	100 Å²	100	59.9 Å²	59.9	52%	0.524	33%	0.325	S	S	.	.	H	α-helix	trans	-58.7	-45.1	176.4	-77.3	168.3	0	0	0	112.3	M181 G187 C188 L189	M181-L185 VanDerWaalsContact O-CB 3.27Å; M181-L185 WeakPolarHBondContact O-CB 3.3Å; M181-L185 WeakPolarHBondContact O-CD1 3.45Å; M181-L185 WeakPolarHBondContact O-CG 3.49Å; M181-L185 PolarHBondContact O-N 3.39Å; L185-G187 VanDerWaalsContact C-N 3.27Å; L185-G187 PolarHBondContact O-N 2.98Å; L185-C188 PolarHBondContact O-N 3.14Å; L185-L189 HydrophobicContact CB-CD1 4.47Å; L185-L189 WeakPolarHBondContact O-CB 3.38Å; L185-L189 WeakPolarHBondContact O-CG 3.37Å; L185-L189 PolarHBondContact O-N 2.89Å
186	N	82.8	Confident	84.6	Confident	77 Å²	77	59.8 Å²	59.8	41%	0.412	32%	0.324	S	S	.	.	H	α-helix	trans	-61.8	-35.2	177.6	-75	-3.1	0	0	0	112.2	R182 L183 V184	R182-N186 VanDerWaalsContact O-CB 3.25Å; R182-N186 WeakPolarHBondContact O-CB 3.39Å; R182-N186 PolarHBondContact O-N 3.28Å; R182-N186 PolarHBondContact O-OD1 3.34Å; L183-N186 PolarHBondContact O-N 3.11Å; V184-N186 PolarHBondContact O-N 3.47Å
187	G	82.2	Confident	85.1	Confident	9 Å²	9	61 Å²	61	9%	0.093	33%	0.328	C	S	.	.	H	α-helix	trans	-71.4	-52	175	0	0	0	0	0	113	L183 V184 L185 L189 T190 H193	L183-G187 PolarHBondContact O-N 2.95Å; V184-G187 PolarHBondContact O-N 3.43Å; V184-G187 VanDerWaalsContact O-N 3.15Å; L185-G187 VanDerWaalsContact C-N 3.27Å; L185-G187 PolarHBondContact O-N 2.98Å; G187-L189 VanDerWaalsContact C-N 3.26Å; G187-L189 PolarHBondContact O-N 3.23Å; G187-T190 WeakPolarHBondContact O-CB 3.36Å; G187-T190 WeakPolarHBondContact O-CG2 3.38Å; G187-T190 PolarHBondContact O-N 2.86Å; G187-T190 PolarHBondContact O-OG1 2.94Å; G187-H193 PolarHBondContact O-ND1 2.89Å
188	C	85.8	Confident	85.4	Confident	52 Å²	52	62.7 Å²	62.7	35%	0.351	33%	0.333	S	S	.	.	H	α-helix	trans	-57.2	-38.1	175.9	-68.3	0	0	0	0	112.7	V184 L185 T190 H193 L223	V184-C188 PolarHBondContact O-N 3.15Å; V184-C188 PolarHBondContact O-SG 3.28Å; V184-C188 VanDerWaalsContact O-SG 3.34Å; L185-C188 PolarHBondContact O-N 3.14Å; C188-T190 PolarHBondContact O-N 2.88Å; C188-H193 WeakPolarHBondContact O-CB 3.44Å; C188-L223 WeakPolarHBondContact SG-CD2 3.43Å
189	L	87	Confident	85.7	Confident	53 Å²	53	60.8 Å²	60.8	28%	0.277	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	19.9	179.6	-58.3	172.4	0	0	0	112.5	L52 W56 L185 G187	L52-L189 HydrophobicContact CD1-CB 4.38Å; L52-L189 HydrophobicContact CD1-CD2 3.67Å; W56-L189 PolarHBondContact NE1-O 3.3Å; L185-L189 HydrophobicContact CB-CD1 4.47Å; L185-L189 WeakPolarHBondContact O-CB 3.38Å; L185-L189 WeakPolarHBondContact O-CG 3.37Å; L185-L189 PolarHBondContact O-N 2.89Å; G187-L189 VanDerWaalsContact C-N 3.26Å; G187-L189 PolarHBondContact O-N 3.23Å
190	T	81.4	Confident	85.7	Confident	49 Å²	49	57.7 Å²	57.7	30%	0.301	30%	0.301	S	S	.	.	S	Bend	trans	-73.3	144.3	164.2	52.3	0	0	0	0	109.8	G187 C188 F192 H193 C194	G187-T190 WeakPolarHBondContact O-CB 3.36Å; G187-T190 WeakPolarHBondContact O-CG2 3.38Å; G187-T190 PolarHBondContact O-N 2.86Å; G187-T190 PolarHBondContact O-OG1 2.94Å; C188-T190 PolarHBondContact O-N 2.88Å; T190-F192 PolarHBondContact O-N 2.91Å; T190-H193 PolarHBondContact O-N 3.49Å; T190-H193 VanDerWaalsContact O-N 3.09Å; T190-H193 PolarHBondContact OG1-ND1 2.74Å; T190-C194 PolarHBondContact O-N 3.11Å; T190-C194 PolarHBondContact O-SG 3.1Å; T190-C194 VanDerWaalsContact O-SG 3.35Å
191	P	79.7	Confident	85.8	Confident	57 Å²	57	57.5 Å²	57.5	37%	0.37	30%	0.304	S	S	.	.	H	α-helix	trans	-52.7	-32.3	-179.8	-27.8	34.1	0	0	0	113.9	W56 F195	W56-P191 HydrophobicContact CD2-CG 4.12Å; W56-P191 HydrophobicContact CH2-CB 4.21Å; W56-P191 HydrophobicContact CH2-CG 4.31Å; W56-P191 HydrophobicContact CZ2-CB 4.08Å; W56-P191 HydrophobicContact CZ2-CG 3.9Å; P191-F195 WeakPolarHBondContact O-CB 3.3Å; P191-F195 PolarHBondContact O-N 3.33Å
192	F	78.4	Confident	85.8	Confident	34 Å²	34	51.2 Å²	51.2	15%	0.149	27%	0.273	C	S	.	.	H	α-helix	trans	-67.1	-52	176.7	-171	-90.6	0	0	0	113	T190 C194 F195 Q196 P428 P429 L431 P432	T190-F192 PolarHBondContact O-N 2.91Å; F192-C194 VanDerWaalsContact C-N 3.3Å; F192-C194 PolarHBondContact O-N 3.32Å; F192-F195 WeakPolarHBondContact O-CB 3.41Å; F192-F195 PolarHBondContact O-N 3.47Å; F192-F195 VanDerWaalsContact O-N 3.15Å; F192-Q196 WeakPolarHBondContact O-CB 3.44Å; F192-Q196 PolarHBondContact O-N 3.41Å; F192-P428 WeakPolarHBondContact CZ-O 3.39Å; F192-P429 WeakPolarHBondContact CE1-O 3.33Å; F192-P429 WeakPolarHBondContact CZ-O 3.29Å; F192-L431 HydrophobicContact CE2-CB 4.17Å; F192-P432 HydrophobicContact CB-CG 4.39Å; F192-P432 HydrophobicContact CD1-CG 3.48Å; F192-P432 VanDerWaalsContact CD1-CG 3.48Å; F192-P432 HydrophobicContact CD2-CG 3.72Å; F192-P432 HydrophobicContact CE1-CG 3.55Å; F192-P432 HydrophobicContact CE2-CG 3.81Å; F192-P432 HydrophobicContact CG-CG 3.56Å; F192-P432 HydrophobicContact CZ-CG 3.72Å
193	H	83.9	Confident	85.9	Confident	30 Å²	30	44.1 Å²	44.1	14%	0.139	25%	0.246	C	C	.	.	H	α-helix	trans	-65.5	-35.1	178	-74.4	93.2	0	0	0	111.5	G187 C188 T190 F195 Q196 V197	G187-H193 PolarHBondContact O-ND1 2.89Å; C188-H193 WeakPolarHBondContact O-CB 3.44Å; T190-H193 PolarHBondContact O-N 3.49Å; T190-H193 VanDerWaalsContact O-N 3.09Å; T190-H193 PolarHBondContact OG1-ND1 2.74Å; H193-F195 PolarHBondContact O-N 2.91Å; H193-Q196 PolarHBondContact O-N 3.23Å; H193-V197 WeakPolarHBondContact O-CG2 3.4Å; H193-V197 PolarHBondContact O-N 3.15Å
194	C	84.8	Confident	86.2	Confident	30 Å²	30	47.9 Å²	47.9	20%	0.203	26%	0.262	C	S	.	.	H	α-helix	trans	-61.9	-41.8	172	-60.8	0	0	0	0	112.2	L52 W56 T190 F192 F198	L52-C194 HydrophobicContact CD2-CB 4.39Å; W56-C194 HydrophobicContact CZ2-CB 4.34Å; T190-C194 PolarHBondContact O-N 3.11Å; T190-C194 PolarHBondContact O-SG 3.1Å; T190-C194 VanDerWaalsContact O-SG 3.35Å; F192-C194 VanDerWaalsContact C-N 3.3Å; F192-C194 PolarHBondContact O-N 3.32Å; C194-F198 PolarHBondContact O-N 3.31Å
195	F	83.8	Confident	86.2	Confident	47 Å²	47	48.3 Å²	48.3	21%	0.206	27%	0.267	C	S	.	.	H	α-helix	trans	-66.8	-36.9	174.1	179.5	-95.2	0	0	0	112.5	P191 F192 H193 F198 S199 I427	P191-F195 WeakPolarHBondContact O-CB 3.3Å; P191-F195 PolarHBondContact O-N 3.33Å; F192-F195 WeakPolarHBondContact O-CB 3.41Å; F192-F195 PolarHBondContact O-N 3.47Å; F192-F195 VanDerWaalsContact O-N 3.15Å; H193-F195 PolarHBondContact O-N 2.91Å; F195-F198 HydrophobicContact CD2-CD1 4.36Å; F195-F198 HydrophobicContact CE2-CD1 4.3Å; F195-F198 WeakPolarHBondContact O-CB 3.39Å; F195-F198 PolarHBondContact O-N 3.29Å; F195-S199 WeakPolarHBondContact CE1-OG 3.41Å; F195-S199 WeakPolarHBondContact O-CB 3.25Å; F195-S199 PolarHBondContact O-N 3.18Å; F195-S199 PolarHBondContact O-OG 2.95Å; F195-I427 HydrophobicContact CD1-CB 4.43Å; F195-I427 HydrophobicContact CD1-CG2 3.96Å; F195-I427 HydrophobicContact CE1-CB 3.62Å; F195-I427 HydrophobicContact CE1-CD1 4Å; F195-I427 HydrophobicContact CE1-CG1 4.36Å; F195-I427 HydrophobicContact CE1-CG2 3.64Å; F195-I427 HydrophobicContact CE2-CD1 3.95Å; F195-I427 HydrophobicContact CZ-CB 3.96Å; F195-I427 HydrophobicContact CZ-CD1 3.62Å; F195-I427 HydrophobicContact CZ-CG1 4.25Å; F195-I427 HydrophobicContact CZ-CG2 4.35Å
196	Q	86.4	Confident	86.1	Confident	11 Å²	11	44 Å²	44	5%	0.051	25%	0.245	C	C	.	.	H	α-helix	trans	-67.9	-41	177.6	-167.4	166.8	18.2	0	0	111.8	F192 H193 S199 C200 I215	F192-Q196 WeakPolarHBondContact O-CB 3.44Å; F192-Q196 PolarHBondContact O-N 3.41Å; H193-Q196 PolarHBondContact O-N 3.23Å; Q196-S199 PolarHBondContact O-N 3.45Å; Q196-C200 PolarHBondContact O-N 3.17Å; Q196-C200 PolarHBondContact O-SG 3.2Å; Q196-I215 HydrophobicContact CG-CG2 4.29Å
197	V	87.8	Confident	86.2	Confident	98 Å²	98	47.6 Å²	47.6	59%	0.594	26%	0.259	S	S	*	.	H	α-helix	trans	-61.9	-44.8	171.5	170.8	0	0	0	0	111	H193 S199 C200 V201	H193-V197 WeakPolarHBondContact O-CG2 3.4Å; H193-V197 PolarHBondContact O-N 3.15Å; V197-S199 VanDerWaalsContact C-N 3.31Å; V197-S199 PolarHBondContact O-N 3.46Å; V197-C200 PolarHBondContact O-N 3.19Å; V197-V201 WeakPolarHBondContact O-CG2 3.46Å; V197-V201 PolarHBondContact O-N 3.36Å
198	F	87.8	Confident	86.4	Confident	92 Å²	92	47.3 Å²	47.3	40%	0.404	26%	0.255	S	S	.	.	H	α-helix	trans	-57.5	-43.6	173.5	168.5	-99.7	0	0	0	111.9	C194 F195 V201 I202	C194-F198 PolarHBondContact O-N 3.31Å; F195-F198 HydrophobicContact CD2-CD1 4.36Å; F195-F198 HydrophobicContact CE2-CD1 4.3Å; F195-F198 WeakPolarHBondContact O-CB 3.39Å; F195-F198 PolarHBondContact O-N 3.29Å; F198-V201 PolarHBondContact O-N 3.43Å; F198-I202 HydrophobicContact CE1-CG1 4.2Å; F198-I202 HydrophobicContact CE2-CD1 4.29Å; F198-I202 HydrophobicContact CE2-CG1 4.18Å; F198-I202 HydrophobicContact CZ-CD1 4.19Å; F198-I202 HydrophobicContact CZ-CG1 3.93Å; F198-I202 PolarHBondContact O-N 2.79Å; F198-I202 VanDerWaalsContact O-N 3.09Å
199	S	89.3	Confident	86.6	Confident	3 Å²	3	50.8 Å²	50.8	2%	0.021	27%	0.266	C	S	.	.	H	α-helix	trans	-63.4	-45.1	177.9	-55	0	0	0	0	111.7	F195 Q196 V197 V201 I202 W203	F195-S199 WeakPolarHBondContact CE1-OG 3.41Å; F195-S199 WeakPolarHBondContact O-CB 3.25Å; F195-S199 PolarHBondContact O-N 3.18Å; F195-S199 PolarHBondContact O-OG 2.95Å; Q196-S199 PolarHBondContact O-N 3.45Å; V197-S199 VanDerWaalsContact C-N 3.31Å; V197-S199 PolarHBondContact O-N 3.46Å; S199-V201 VanDerWaalsContact C-N 3.31Å; S199-V201 PolarHBondContact O-N 2.81Å; S199-I202 PolarHBondContact O-N 2.8Å; S199-I202 VanDerWaalsContact O-N 3.15Å; S199-W203 VanDerWaalsContact O-CD2 3.29Å; S199-W203 VanDerWaalsContact O-CG 3.31Å; S199-W203 PolarHBondContact O-N 3.11Å
200	C	89.6	Confident	86.8	Confident	13 Å²	13	51.5 Å²	51.5	9%	0.088	27%	0.27	C	S	.	.	H	α-helix	trans	-60.8	-37.5	175.6	-65.8	0	0	0	0	112.7	Q196 V197 W203 F204	Q196-C200 PolarHBondContact O-N 3.17Å; Q196-C200 PolarHBondContact O-SG 3.2Å; V197-C200 PolarHBondContact O-N 3.19Å; C200-W203 HydrophobicContact CB-CE3 4.45Å; C200-W203 PolarHBondContact O-N 3.44Å; C200-F204 WeakPolarHBondContact O-CD2 3.37Å; C200-F204 PolarHBondContact O-N 2.84Å
201	V	90.9	Very high	87.2	Confident	82 Å²	82	49.7 Å²	49.7	50%	0.497	26%	0.257	S	S	.	.	H	α-helix	trans	-63.4	-44.4	174.3	172.1	0	0	0	0	111.1	V197 F198 S199 W203 F204 C205	V197-V201 WeakPolarHBondContact O-CG2 3.46Å; V197-V201 PolarHBondContact O-N 3.36Å; F198-V201 PolarHBondContact O-N 3.43Å; S199-V201 VanDerWaalsContact C-N 3.31Å; S199-V201 PolarHBondContact O-N 2.81Å; V201-W203 PolarHBondContact O-N 3.03Å; V201-F204 PolarHBondContact O-N 3.45Å; V201-C205 PolarHBondContact O-N 2.94Å; V201-C205 PolarHBondContact O-SG 2.97Å
202	I	90.3	Very high	87.7	Confident	14 Å²	14	47 Å²	47	7%	0.072	24%	0.24	C	C	.	.	H	α-helix	trans	-60	-45.6	174.5	-65	-64.6	0	0	0	110.7	F198 S199 F204 C205 V206 L420 T424	F198-I202 HydrophobicContact CE1-CG1 4.2Å; F198-I202 HydrophobicContact CE2-CD1 4.29Å; F198-I202 HydrophobicContact CE2-CG1 4.18Å; F198-I202 HydrophobicContact CZ-CD1 4.19Å; F198-I202 HydrophobicContact CZ-CG1 3.93Å; F198-I202 PolarHBondContact O-N 2.79Å; F198-I202 VanDerWaalsContact O-N 3.09Å; S199-I202 PolarHBondContact O-N 2.8Å; S199-I202 VanDerWaalsContact O-N 3.15Å; I202-F204 PolarHBondContact O-N 2.89Å; I202-C205 CarbonylContact O-C 3.57Å; I202-C205 PolarHBondContact O-N 3.23Å; I202-C205 VanDerWaalsContact O-N 3.09Å; I202-V206 HydrophobicContact CG2-CG2 4.19Å; I202-V206 VanDerWaalsContact O-CG2 3.26Å; I202-V206 WeakPolarHBondContact O-CG2 3.08Å; I202-V206 PolarHBondContact O-N 3.1Å; I202-L420 HydrophobicContact CD1-CD1 4.38Å; I202-T424 HydrophobicContact CB-CG2 4.49Å; I202-T424 HydrophobicContact CG2-CG2 4.46Å
203	W	90.4	Very high	88.3	Confident	10 Å²	10	48.6 Å²	48.6	4%	0.038	25%	0.252	C	S	.	.	H	α-helix	trans	-63.3	-39.5	179.2	-64.2	-32.7	0	0	0	113.6	S199 C200 V201 C205 V206 E207 Y208 Y211 A212 I215 D421 T424	S199-W203 VanDerWaalsContact O-CD2 3.29Å; S199-W203 VanDerWaalsContact O-CG 3.31Å; S199-W203 PolarHBondContact O-N 3.11Å; C200-W203 HydrophobicContact CB-CE3 4.45Å; C200-W203 PolarHBondContact O-N 3.44Å; V201-W203 PolarHBondContact O-N 3.03Å; W203-C205 VanDerWaalsContact C-N 3.33Å; W203-C205 PolarHBondContact O-N 3.07Å; W203-V206 CarbonylContact O-C 3.55Å; W203-V206 PolarHBondContact O-N 3.37Å; W203-E207 PolarHBondContact O-N 2.74Å; W203-Y208 PolarHBondContact O-N 3.32Å; W203-Y211 HydrophobicContact CD2-CD1 4.02Å; W203-Y211 AromaticContact CD2-CE1 3.73Å; W203-Y211 HydrophobicContact CD2-CE1 3.73Å; W203-Y211 AromaticContact CE2-CE1 3.69Å; W203-Y211 HydrophobicContact CE3-CD1 4.14Å; W203-Y211 AromaticContact CE3-CE1 3.83Å; W203-Y211 HydrophobicContact CE3-CE1 3.83Å; W203-Y211 HydrophobicContact CG-CD1 4.31Å; W203-Y211 HydrophobicContact CG-CE1 4.4Å; W203-Y211 AromaticContact CH2-CE1 3.92Å; W203-Y211 HydrophobicContact CH2-CE1 3.92Å; W203-Y211 AromaticContact CZ2-CE1 3.79Å; W203-Y211 HydrophobicContact CZ2-CE1 3.79Å; W203-Y211 AromaticContact CZ3-CE1 3.93Å; W203-Y211 HydrophobicContact CZ3-CE1 3.93Å; W203-A212 HydrophobicContact CB-CB 3.83Å; W203-A212 HydrophobicContact CE3-CB 4.48Å; W203-I215 HydrophobicContact CZ3-CB 4.25Å; W203-I215 HydrophobicContact CZ3-CG1 4.32Å; W203-I215 HydrophobicContact CZ3-CG2 3.99Å; W203-D421 VanDerWaalsContact CD1-OD1 3.26Å; W203-D421 PolarHBondContact NE1-OD1 3.31Å; W203-T424 VanDerWaalsContact CZ2-OG1 3.31Å; W203-T424 WeakPolarHBondContact CZ2-OG1 3.31Å; W203-T424 PolarHBondContact NE1-OG1 2.7Å
204	F	90.9	Very high	88.6	Confident	94 Å²	94	49 Å²	49	41%	0.412	26%	0.259	S	S	.	.	H	α-helix	trans	-63.5	-37.7	171.1	-76.9	-60.6	0	0	0	112.2	C200 V201 I202 V206 E207 E209 A212	C200-F204 WeakPolarHBondContact O-CD2 3.37Å; C200-F204 PolarHBondContact O-N 2.84Å; V201-F204 PolarHBondContact O-N 3.45Å; I202-F204 PolarHBondContact O-N 2.89Å; F204-V206 VanDerWaalsContact C-N 3.28Å; F204-V206 PolarHBondContact O-N 3.08Å; F204-E207 PolarHBondContact O-N 2.87Å; F204-E209 HydrophobicContact CD1-CB 4.4Å; F204-E209 HydrophobicContact CD1-CG 4.29Å; F204-E209 HydrophobicContact CE1-CB 4.32Å; F204-A212 HydrophobicContact CD1-CB 4.18Å; F204-A212 HydrophobicContact CD2-CB 4.06Å; F204-A212 HydrophobicContact CE1-CB 3.93Å; F204-A212 HydrophobicContact CE2-CB 3.81Å; F204-A212 HydrophobicContact CG-CB 4.23Å; F204-A212 HydrophobicContact CZ-CB 3.73Å
205	C	89.5	Confident	88.7	Confident	60 Å²	60	48 Å²	48	41%	0.405	25%	0.251	S	S	.	.	H	α-helix	trans	-70.8	-20.9	174.2	-64.2	0	0	0	0	113.8	V201 I202 W203 Y413 L417	V201-C205 PolarHBondContact O-N 2.94Å; V201-C205 PolarHBondContact O-SG 2.97Å; I202-C205 CarbonylContact O-C 3.57Å; I202-C205 PolarHBondContact O-N 3.23Å; I202-C205 VanDerWaalsContact O-N 3.09Å; W203-C205 VanDerWaalsContact C-N 3.33Å; W203-C205 PolarHBondContact O-N 3.07Å; C205-Y413 PolarHBondContact O-OH 3.06Å; C205-Y413 VanDerWaalsContact O-OH 3.07Å; C205-L417 HydrophobicContact CB-CD1 4.33Å; C205-L417 HydrophobicContact CB-CD2 3.82Å; C205-L417 WeakPolarHBondContact O-CD2 3.41Å
206	V	84.8	Confident	89	Confident	9 Å²	9	47.3 Å²	47.3	6%	0.055	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96	11.4	178.3	178.4	0	0	0	0	111.7	I202 W203 F204 Y208 L417	I202-V206 HydrophobicContact CG2-CG2 4.19Å; I202-V206 VanDerWaalsContact O-CG2 3.26Å; I202-V206 WeakPolarHBondContact O-CG2 3.08Å; I202-V206 PolarHBondContact O-N 3.1Å; W203-V206 CarbonylContact O-C 3.55Å; W203-V206 PolarHBondContact O-N 3.37Å; F204-V206 VanDerWaalsContact C-N 3.28Å; F204-V206 PolarHBondContact O-N 3.08Å; V206-Y208 VanDerWaalsContact C-N 3.27Å; V206-Y208 HydrophobicContact CB-CD2 4.43Å; V206-Y208 HydrophobicContact CG1-CD2 3.94Å; V206-Y208 HydrophobicContact CG1-CE1 4.5Å; V206-Y208 HydrophobicContact CG1-CE2 3.76Å; V206-Y208 HydrophobicContact CG1-CG 4.37Å; V206-Y208 PolarHBondContact O-N 3.12Å; V206-L417 HydrophobicContact CG2-CD2 3.56Å; V206-L417 HydrophobicContact CG2-CG 3.89Å
207	E	85.5	Confident	89.1	Confident	152 Å²	152	51 Å²	51	71%	0.71	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.7	20.9	179.9	-52.7	-178.1	165.5	0	0	114.8	W203 F204 E209	W203-E207 PolarHBondContact O-N 2.74Å; F204-E207 PolarHBondContact O-N 2.87Å; E207-E209 VanDerWaalsContact C-N 3.28Å; E207-E209 PolarHBondContact O-N 2.99Å
208	Y	87.2	Confident	89	Confident	4 Å²	4	49 Å²	49	2%	0.016	26%	0.26	C	S	.	.			trans	-90.2	52.2	175	-65.5	-23	0	0	0	112	W203 V206 I210 Y211 A212 R418 N1052 L1053 E1055 F1058	W203-Y208 PolarHBondContact O-N 3.32Å; V206-Y208 VanDerWaalsContact C-N 3.27Å; V206-Y208 HydrophobicContact CB-CD2 4.43Å; V206-Y208 HydrophobicContact CG1-CD2 3.94Å; V206-Y208 HydrophobicContact CG1-CE1 4.5Å; V206-Y208 HydrophobicContact CG1-CE2 3.76Å; V206-Y208 HydrophobicContact CG1-CG 4.37Å; V206-Y208 PolarHBondContact O-N 3.12Å; Y208-I210 PolarHBondContact O-N 3.09Å; Y208-Y211 PolarHBondContact O-N 3.26Å; Y208-A212 WeakPolarHBondContact O-CB 3.43Å; Y208-A212 PolarHBondContact O-N 3.15Å; Y208-R418 PolarHBondContact OH-NH1 2.7Å; Y208-N1052 PolarHBondContact OH-ND2 2.59Å; Y208-L1053 PolarHBondContact OH-O 2.82Å; Y208-E1055 HydrophobicContact CD1-CB 3.78Å; Y208-E1055 HydrophobicContact CE1-CB 4.35Å; Y208-E1055 HydrophobicContact CG-CB 4.32Å; Y208-F1058 HydrophobicContact CE2-CD2 4.23Å; Y208-F1058 AromaticContact CE2-CE2 3.99Å; Y208-F1058 HydrophobicContact CE2-CE2 3.99Å
209	E	89.7	Confident	88.8	Confident	125 Å²	125	45.5 Å²	45.5	58%	0.584	25%	0.247	S	C	*	.	H	α-helix	trans	-60.6	-43.1	-170	-60.3	-166.1	156.7	0	0	113.7	F204 E207 T213	F204-E209 HydrophobicContact CD1-CB 4.4Å; F204-E209 HydrophobicContact CD1-CG 4.29Å; F204-E209 HydrophobicContact CE1-CB 4.32Å; E207-E209 VanDerWaalsContact C-N 3.28Å; E207-E209 PolarHBondContact O-N 2.99Å; E209-T213 VanDerWaalsContact O-CB 3.31Å; E209-T213 WeakPolarHBondContact O-CB 3.36Å; E209-T213 PolarHBondContact O-N 2.66Å; E209-T213 PolarHBondContact O-OG1 2.82Å
210	I	91.3	Very high	88.7	Confident	68 Å²	68	49.3 Å²	49.3	35%	0.349	27%	0.27	S	S	.	.	H	α-helix	trans	-71.4	-44.3	-175	-58.3	-176.7	0	0	0	109.8	Y208 T213 C214 E1055 W1056	Y208-I210 PolarHBondContact O-N 3.09Å; I210-T213 PolarHBondContact O-N 3.41Å; I210-C214 PolarHBondContact O-N 2.77Å; I210-C214 PolarHBondContact O-SG 3.25Å; I210-E1055 WeakPolarHBondContact CB-OE2 3.24Å; I210-E1055 PolarHBondContact N-OE2 3.27Å; I210-W1056 HydrophobicContact CD1-CH2 4.36Å; I210-W1056 HydrophobicContact CD1-CZ2 3.5Å; I210-W1056 VanDerWaalsContact CD1-CZ2 3.5Å; I210-W1056 HydrophobicContact CG2-CH2 4.29Å; I210-W1056 HydrophobicContact CG2-CZ2 4.26Å
211	Y	88.6	Confident	88.6	Confident	10 Å²	10	52.7 Å²	52.7	4%	0.039	29%	0.291	C	S	.	.	H	α-helix	trans	-61.6	-49.3	177	176.4	-111.1	0	0	0	111.7	W203 Y208 T213 C214 I215 F1058 L1059 D1062	W203-Y211 HydrophobicContact CD2-CD1 4.02Å; W203-Y211 AromaticContact CD2-CE1 3.73Å; W203-Y211 HydrophobicContact CD2-CE1 3.73Å; W203-Y211 AromaticContact CE2-CE1 3.69Å; W203-Y211 HydrophobicContact CE3-CD1 4.14Å; W203-Y211 AromaticContact CE3-CE1 3.83Å; W203-Y211 HydrophobicContact CE3-CE1 3.83Å; W203-Y211 HydrophobicContact CG-CD1 4.31Å; W203-Y211 HydrophobicContact CG-CE1 4.4Å; W203-Y211 AromaticContact CH2-CE1 3.92Å; W203-Y211 HydrophobicContact CH2-CE1 3.92Å; W203-Y211 AromaticContact CZ2-CE1 3.79Å; W203-Y211 HydrophobicContact CZ2-CE1 3.79Å; W203-Y211 AromaticContact CZ3-CE1 3.93Å; W203-Y211 HydrophobicContact CZ3-CE1 3.93Å; Y208-Y211 PolarHBondContact O-N 3.26Å; Y211-T213 VanDerWaalsContact C-N 3.3Å; Y211-T213 PolarHBondContact O-N 3.06Å; Y211-C214 PolarHBondContact O-N 2.97Å; Y211-I215 HydrophobicContact CD2-CG1 4.27Å; Y211-I215 HydrophobicContact CE1-CG1 4.38Å; Y211-I215 HydrophobicContact CE2-CD1 4.04Å; Y211-I215 HydrophobicContact CE2-CG1 3.79Å; Y211-I215 WeakPolarHBondContact O-CG1 3.28Å; Y211-I215 PolarHBondContact O-N 2.7Å; Y211-F1058 HydrophobicContact CD2-CB 4.24Å; Y211-F1058 HydrophobicContact CE2-CB 4.3Å; Y211-F1058 HydrophobicContact CG-CB 4.47Å; Y211-L1059 HydrophobicContact CD2-CB 4.38Å; Y211-L1059 HydrophobicContact CD2-CD1 4.19Å; Y211-D1062 HydrophobicContact CE2-CB 4.39Å
212	A	91	Very high	88.1	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-57.9	-42.7	177	0	0	0	0	0	112.1	W203 F204 Y208 A216	W203-A212 HydrophobicContact CB-CB 3.83Å; W203-A212 HydrophobicContact CE3-CB 4.48Å; F204-A212 HydrophobicContact CD1-CB 4.18Å; F204-A212 HydrophobicContact CD2-CB 4.06Å; F204-A212 HydrophobicContact CE1-CB 3.93Å; F204-A212 HydrophobicContact CE2-CB 3.81Å; F204-A212 HydrophobicContact CG-CB 4.23Å; F204-A212 HydrophobicContact CZ-CB 3.73Å; Y208-A212 WeakPolarHBondContact O-CB 3.43Å; Y208-A212 PolarHBondContact O-N 3.15Å; A212-A216 VanDerWaalsContact O-CB 3.31Å; A212-A216 WeakPolarHBondContact O-CB 3.37Å; A212-A216 PolarHBondContact O-N 3Å
213	T	91.9	Very high	87.8	Confident	68 Å²	68	51 Å²	51	42%	0.417	28%	0.283	S	S	.	.	H	α-helix	trans	-64.7	-44.2	178.3	-58.5	0	0	0	0	112	E209 I210 Y211 A216 V217	E209-T213 VanDerWaalsContact O-CB 3.31Å; E209-T213 WeakPolarHBondContact O-CB 3.36Å; E209-T213 PolarHBondContact O-N 2.66Å; E209-T213 PolarHBondContact O-OG1 2.82Å; I210-T213 PolarHBondContact O-N 3.41Å; Y211-T213 VanDerWaalsContact C-N 3.3Å; Y211-T213 PolarHBondContact O-N 3.06Å; T213-A216 PolarHBondContact O-N 3.43Å; T213-V217 WeakPolarHBondContact O-CG2 3.22Å; T213-V217 PolarHBondContact O-N 3.39Å
214	C	90	Very high	87.6	Confident	40 Å²	40	55.8 Å²	55.8	27%	0.27	31%	0.308	S	S	.	.	H	α-helix	trans	-63.2	-44.2	178.3	-68.4	0	0	0	0	112.3	I210 Y211 V217 F218 L1059 F1063	I210-C214 PolarHBondContact O-N 2.77Å; I210-C214 PolarHBondContact O-SG 3.25Å; Y211-C214 PolarHBondContact O-N 2.97Å; C214-V217 PolarHBondContact O-N 3.4Å; C214-F218 PolarHBondContact O-N 3.12Å; C214-L1059 HydrophobicContact CB-CD1 3.82Å; C214-F1063 HydrophobicContact CB-CD2 4.41Å; C214-F1063 HydrophobicContact CB-CE2 3.86Å; C214-F1063 HydrophobicContact CB-CZ 4.4Å
215	I	87	Confident	87.2	Confident	8 Å²	8	57.8 Å²	57.8	4%	0.041	32%	0.316	C	S	.	.	H	α-helix	trans	-65.9	-39.2	176.6	-63.3	-67.5	0	0	0	111.2	Q196 W203 Y211 F218 S219 P429 F1063	Q196-I215 HydrophobicContact CG-CG2 4.29Å; W203-I215 HydrophobicContact CZ3-CB 4.25Å; W203-I215 HydrophobicContact CZ3-CG1 4.32Å; W203-I215 HydrophobicContact CZ3-CG2 3.99Å; Y211-I215 HydrophobicContact CD2-CG1 4.27Å; Y211-I215 HydrophobicContact CE1-CG1 4.38Å; Y211-I215 HydrophobicContact CE2-CD1 4.04Å; Y211-I215 HydrophobicContact CE2-CG1 3.79Å; Y211-I215 WeakPolarHBondContact O-CG1 3.28Å; Y211-I215 PolarHBondContact O-N 2.7Å; I215-F218 PolarHBondContact O-N 2.95Å; I215-S219 WeakPolarHBondContact O-CB 3.35Å; I215-S219 PolarHBondContact O-N 3.4Å; I215-P429 HydrophobicContact CD1-CG 4.2Å; I215-P429 HydrophobicContact CG2-CB 4.22Å; I215-F1063 HydrophobicContact CD1-CD2 4.24Å; I215-F1063 HydrophobicContact CD1-CE2 4.05Å
216	A	88.6	Confident	86.5	Confident	32 Å²	32	60 Å²	60	26%	0.264	32%	0.321	S	S	.	.	H	α-helix	trans	-60.3	-50.6	175.4	0	0	0	0	0	111.7	A212 T213 F218 S219 V220	A212-A216 VanDerWaalsContact O-CB 3.31Å; A212-A216 WeakPolarHBondContact O-CB 3.37Å; A212-A216 PolarHBondContact O-N 3Å; T213-A216 PolarHBondContact O-N 3.43Å; A216-F218 VanDerWaalsContact C-N 3.31Å; A216-F218 PolarHBondContact O-N 3.34Å; A216-S219 PolarHBondContact O-N 2.83Å; A216-S219 PolarHBondContact O-OG 3.04Å; A216-V220 WeakPolarHBondContact O-CG2 3.27Å; A216-V220 PolarHBondContact O-N 2.62Å
217	V	90.1	Very high	86.5	Confident	88 Å²	88	60.3 Å²	60.3	53%	0.533	32%	0.322	S	S	.	.	H	α-helix	trans	-58.7	-41.8	177.6	171.3	0	0	0	0	111.5	T213 C214 T221	T213-V217 WeakPolarHBondContact O-CG2 3.22Å; T213-V217 PolarHBondContact O-N 3.39Å; C214-V217 PolarHBondContact O-N 3.4Å; V217-T221 WeakPolarHBondContact O-CB 3.5Å; V217-T221 PolarHBondContact O-N 2.93Å; V217-T221 PolarHBondContact O-OG1 3.05Å
218	F	84.5	Confident	86.5	Confident	57 Å²	57	60.4 Å²	60.4	25%	0.25	32%	0.318	C	S	.	.	H	α-helix	trans	-63.2	-45.4	176.3	-176.5	-100.6	0	0	0	112.3	C214 I215 A216 V220 T221 S222 I430 V433 F1063	C214-F218 PolarHBondContact O-N 3.12Å; I215-F218 PolarHBondContact O-N 2.95Å; A216-F218 VanDerWaalsContact C-N 3.31Å; A216-F218 PolarHBondContact O-N 3.34Å; F218-V220 PolarHBondContact O-N 2.85Å; F218-T221 PolarHBondContact O-N 3.39Å; F218-S222 WeakPolarHBondContact O-CB 3.28Å; F218-S222 PolarHBondContact O-N 2.91Å; F218-I430 HydrophobicContact CE1-CD1 4.17Å; F218-I430 HydrophobicContact CE1-CG1 4.31Å; F218-I430 HydrophobicContact CZ-CD1 3.97Å; F218-I430 HydrophobicContact CZ-CG1 4.48Å; F218-V433 HydrophobicContact CE1-CG2 4.5Å; F218-F1063 HydrophobicContact CB-CE2 4.44Å; F218-F1063 HydrophobicContact CB-CZ 3.96Å; F218-F1063 HydrophobicContact CD2-CZ 4.28Å; F218-F1063 HydrophobicContact CG-CZ 4.32Å
219	S	84.4	Confident	85.8	Confident	19 Å²	19	63.5 Å²	63.5	13%	0.133	33%	0.332	C	S	.	.	H	α-helix	trans	-62.4	-44.3	179.8	75.9	0	0	0	0	112.2	I215 A216 S222 L223	I215-S219 WeakPolarHBondContact O-CB 3.35Å; I215-S219 PolarHBondContact O-N 3.4Å; A216-S219 PolarHBondContact O-N 2.83Å; A216-S219 PolarHBondContact O-OG 3.04Å; S219-S222 PolarHBondContact O-N 2.89Å; S219-L223 WeakPolarHBondContact O-CB 3.36Å; S219-L223 PolarHBondContact O-N 3.19Å
220	V	87.6	Confident	85.1	Confident	82 Å²	82	61.7 Å²	61.7	50%	0.497	33%	0.326	S	S	.	.	H	α-helix	trans	-62	-46	176.2	171.5	0	0	0	0	110.8	A216 F218 S222 L223 I224	A216-V220 WeakPolarHBondContact O-CG2 3.27Å; A216-V220 PolarHBondContact O-N 2.62Å; F218-V220 PolarHBondContact O-N 2.85Å; V220-S222 PolarHBondContact O-N 3.02Å; V220-L223 PolarHBondContact O-N 3.3Å; V220-I224 HydrophobicContact CG1-CD1 3.82Å; V220-I224 VanDerWaalsContact O-CG1 3.31Å; V220-I224 WeakPolarHBondContact O-CG1 3.47Å; V220-I224 PolarHBondContact O-N 2.97Å
221	T	86.2	Confident	84.7	Confident	85 Å²	85	60.2 Å²	60.2	52%	0.521	32%	0.316	S	S	.	.	H	α-helix	trans	-61.2	-45	178.2	-51.2	0	0	0	0	111.7	V217 F218 L223 I224 F225	V217-T221 WeakPolarHBondContact O-CB 3.5Å; V217-T221 PolarHBondContact O-N 2.93Å; V217-T221 PolarHBondContact O-OG1 3.05Å; F218-T221 PolarHBondContact O-N 3.39Å; T221-L223 PolarHBondContact O-N 3.44Å; T221-I224 PolarHBondContact O-N 3.45Å; T221-F225 PolarHBondContact O-N 3.48Å; T221-F225 VanDerWaalsContact O-N 3.1Å
222	S	80.6	Confident	84.3	Confident	45 Å²	45	65.9 Å²	65.9	32%	0.315	34%	0.341	S	S	.	.	H	α-helix	trans	-62.7	-41	177.1	-175.7	0	0	0	0	112.3	F218 S219 V220 F225 Q226	F218-S222 WeakPolarHBondContact O-CB 3.28Å; F218-S222 PolarHBondContact O-N 2.91Å; S219-S222 PolarHBondContact O-N 2.89Å; V220-S222 PolarHBondContact O-N 3.02Å; S222-F225 PolarHBondContact O-N 3.36Å; S222-Q226 WeakPolarHBondContact O-CB 3.47Å; S222-Q226 PolarHBondContact O-N 3.01Å
223	L	83.6	Confident	83.3	Confident	16 Å²	16	69.6 Å²	69.6	8%	0.084	36%	0.361	C	S	.	.	H	α-helix	trans	-65.4	-43.4	177.1	176.7	64.6	0	0	0	111.9	C188 S219 V220 T221 F225 Q226 V227	C188-L223 WeakPolarHBondContact SG-CD2 3.43Å; S219-L223 WeakPolarHBondContact O-CB 3.36Å; S219-L223 PolarHBondContact O-N 3.19Å; V220-L223 PolarHBondContact O-N 3.3Å; T221-L223 PolarHBondContact O-N 3.44Å; L223-F225 VanDerWaalsContact C-N 3.32Å; L223-F225 PolarHBondContact O-N 3.39Å; L223-Q226 PolarHBondContact O-N 3.02Å; L223-V227 HydrophobicContact CD1-CG2 4.04Å; L223-V227 HydrophobicContact CG-CG2 4.44Å; L223-V227 WeakPolarHBondContact O-CG2 3.36Å; L223-V227 PolarHBondContact O-N 3.42Å
224	I	86.9	Confident	82.4	Confident	110 Å²	110	68.1 Å²	68.1	56%	0.564	35%	0.349	S	S	*	.	H	α-helix	trans	-58.1	-46.3	176.1	-70.9	164.1	0	0	0	110.4	V220 T221 V227 Y228	V220-I224 HydrophobicContact CG1-CD1 3.82Å; V220-I224 VanDerWaalsContact O-CG1 3.31Å; V220-I224 WeakPolarHBondContact O-CG1 3.47Å; V220-I224 PolarHBondContact O-N 2.97Å; T221-I224 PolarHBondContact O-N 3.45Å; I224-V227 PolarHBondContact O-N 3.13Å; I224-Y228 WeakPolarHBondContact O-CB 3.36Å; I224-Y228 PolarHBondContact O-N 3.27Å
225	F	82.1	Confident	81.9	Confident	136 Å²	136	73.1 Å²	73.1	60%	0.596	36%	0.362	S	S	*	.	H	α-helix	trans	-61.5	-46.2	178.1	-168.4	-87.3	0	0	0	111.9	T221 S222 L223 V227 Y228 E229	T221-F225 PolarHBondContact O-N 3.48Å; T221-F225 VanDerWaalsContact O-N 3.1Å; S222-F225 PolarHBondContact O-N 3.36Å; L223-F225 VanDerWaalsContact C-N 3.32Å; L223-F225 PolarHBondContact O-N 3.39Å; F225-V227 PolarHBondContact O-N 2.99Å; F225-Y228 PolarHBondContact O-N 2.85Å; F225-E229 PolarHBondContact O-N 3.26Å
226	Q	75.8	Confident	81	Confident	106 Å²	106	75.4 Å²	75.4	50%	0.495	38%	0.382	S	S	.	.	H	α-helix	trans	-61.7	-42.9	178.1	-177.2	175.4	69	0	0	112.6	S222 L223 L230	S222-Q226 WeakPolarHBondContact O-CB 3.47Å; S222-Q226 PolarHBondContact O-N 3.01Å; L223-Q226 PolarHBondContact O-N 3.02Å; Q226-L230 WeakPolarHBondContact O-CB 3.33Å; Q226-L230 PolarHBondContact O-N 2.91Å
227	V	84.5	Confident	80	Confident	15 Å²	15	76 Å²	76	9%	0.091	38%	0.381	C	S	.	.	H	α-helix	trans	-67.5	-39.3	177.1	171	0	0	0	0	111.2	I180 L183 V184 L223 I224 F225 R231	I180-V227 HydrophobicContact CG2-CG1 4.41Å; L183-V227 HydrophobicContact CB-CG1 3.94Å; L183-V227 HydrophobicContact CB-CG2 4.38Å; L183-V227 HydrophobicContact CD1-CG1 4.32Å; V184-V227 HydrophobicContact CG2-CG1 4.18Å; V184-V227 HydrophobicContact CG2-CG2 4.25Å; L223-V227 HydrophobicContact CD1-CG2 4.04Å; L223-V227 HydrophobicContact CG-CG2 4.44Å; L223-V227 WeakPolarHBondContact O-CG2 3.36Å; L223-V227 PolarHBondContact O-N 3.42Å; I224-V227 PolarHBondContact O-N 3.13Å; F225-V227 PolarHBondContact O-N 2.99Å; V227-R231 WeakPolarHBondContact O-CB 3.3Å; V227-R231 PolarHBondContact O-N 3.32Å
228	Y	84.7	Confident	79.4	Confident	155 Å²	155	74.5 Å²	74.5	61%	0.608	37%	0.367	S	S	*	.	H	α-helix	trans	-62.3	-47.4	175.6	175.7	-91.2	0	0	0	111.9	I224 F225 R231 K232	I224-Y228 WeakPolarHBondContact O-CB 3.36Å; I224-Y228 PolarHBondContact O-N 3.27Å; F225-Y228 PolarHBondContact O-N 2.85Å; Y228-R231 PolarHBondContact O-N 3.28Å; Y228-K232 WeakPolarHBondContact O-CB 3.49Å; Y228-K232 PolarHBondContact O-N 3.3Å
229	E	73.7	Confident	78.8	Confident	69 Å²	69	80.2 Å²	80.2	32%	0.322	39%	0.392	S	S	.	.	H	α-helix	trans	-63.8	-47.1	179.4	-173.5	171.9	-165.6	0	0	111.7	F225 R231 K232 N233	F225-E229 PolarHBondContact O-N 3.26Å; E229-R231 VanDerWaalsContact C-N 3.29Å; E229-R231 PolarHBondContact O-N 2.94Å; E229-K232 WeakPolarHBondContact O-CB 3.15Å; E229-K232 PolarHBondContact O-N 3.44Å; E229-N233 VanDerWaalsContact O-CG 3.31Å; E229-N233 PolarHBondContact O-N 3Å; E229-N233 VanDerWaalsContact O-N 3.09Å
230	L	73.6	Confident	77.9	Confident	87 Å²	87	82.3 Å²	82.3	46%	0.455	40%	0.404	S	S	.	.	H	α-helix	trans	-58.9	-41.3	175.1	-178.5	57.4	0	0	0	111.7	L183 Q226 N233 E234	L183-L230 HydrophobicContact CD2-CD2 3.66Å; L183-L230 HydrophobicContact CD2-CG 4.36Å; Q226-L230 WeakPolarHBondContact O-CB 3.33Å; Q226-L230 PolarHBondContact O-N 2.91Å; L230-N233 PolarHBondContact O-N 3.37Å; L230-E234 PolarHBondContact O-N 3Å
231	R	83.7	Confident	77	Confident	36 Å²	36	78.8 Å²	78.8	14%	0.136	38%	0.383	C	S	.	.	H	α-helix	trans	-68.2	-35.1	178	-175.4	50.8	161	-158.9	-10.2	113.2	T178 L183 V227 Y228 E229 N233 E234 R235	T178-R231 PolarHBondContact O-NH1 3.43Å; T178-R231 PolarHBondContact O-NH2 3.07Å; L183-R231 HydrophobicContact CD1-CB 4.43Å; V227-R231 WeakPolarHBondContact O-CB 3.3Å; V227-R231 PolarHBondContact O-N 3.32Å; Y228-R231 PolarHBondContact O-N 3.28Å; E229-R231 VanDerWaalsContact C-N 3.29Å; E229-R231 PolarHBondContact O-N 2.94Å; R231-N233 VanDerWaalsContact C-N 3.33Å; R231-E234 IonicContact CZ-OE2 3.83Å; R231-E234 IonicContact NH1-OE2 3.44Å; R231-E234 PolarHBondContact NH1-OE2 3.47Å; R231-R235 WeakPolarHBondContact O-CB 3.41Å; R231-R235 WeakPolarHBondContact O-CG 3.36Å; R231-R235 PolarHBondContact O-N 2.95Å; R231-R235 VanDerWaalsContact O-N 3.14Å
232	K	79	Confident	76	Confident	130 Å²	130	76.7 Å²	76.7	57%	0.565	37%	0.371	S	S	*	.	H	α-helix	trans	-61.8	-44.5	173.5	-176.7	178.1	177.6	176.6	0	110.4	Y228 E229 R235 A236	Y228-K232 WeakPolarHBondContact O-CB 3.49Å; Y228-K232 PolarHBondContact O-N 3.3Å; E229-K232 WeakPolarHBondContact O-CB 3.15Å; E229-K232 PolarHBondContact O-N 3.44Å; K232-R235 PolarHBondContact O-N 3.1Å; K232-A236 PolarHBondContact O-N 2.84Å
233	N	70	Confident	75.6	Confident	78 Å²	78	78.4 Å²	78.4	42%	0.417	38%	0.376	S	S	.	.	H	α-helix	trans	-67.1	-44.1	-179.6	-62.6	-12.5	0	0	0	112.1	E229 L230 R231 R235 A236 L237	E229-N233 VanDerWaalsContact O-CG 3.31Å; E229-N233 PolarHBondContact O-N 3Å; E229-N233 VanDerWaalsContact O-N 3.09Å; L230-N233 PolarHBondContact O-N 3.37Å; R231-N233 VanDerWaalsContact C-N 3.33Å; N233-R235 VanDerWaalsContact C-N 3.31Å; N233-R235 PolarHBondContact O-N 3.06Å; N233-A236 PolarHBondContact O-N 3.17Å; N233-L237 PolarHBondContact O-N 3Å; N233-L237 VanDerWaalsContact O-N 3.12Å
234	E	73.7	Confident	75.4	Confident	37 Å²	37	81.1 Å²	81.1	17%	0.173	40%	0.396	C	S	.	.	H	α-helix	trans	-57.8	-41.1	172.9	-75.8	-170.4	147	0	0	112.9	L177 T178 L230 R231 K238	L177-E234 HydrophobicContact CD2-CB 3.79Å; T178-E234 WeakPolarHBondContact CB-OE1 3.26Å; T178-E234 VanDerWaalsContact CG2-OE1 3.28Å; T178-E234 WeakPolarHBondContact CG2-OE1 3.47Å; T178-E234 PolarHBondContact N-OE1 3.04Å; T178-E234 VanDerWaalsContact OG1-CD 3.26Å; T178-E234 PolarHBondContact OG1-OE1 3.2Å; T178-E234 PolarHBondContact OG1-OE2 2.89Å; L230-E234 PolarHBondContact O-N 3Å; R231-E234 IonicContact CZ-OE2 3.83Å; R231-E234 IonicContact NH1-OE2 3.44Å; R231-E234 PolarHBondContact NH1-OE2 3.47Å; E234-K238 PolarHBondContact O-N 3.12Å
235	R	79	Confident	75.3	Confident	145 Å²	145	77.7 Å²	77.7	55%	0.547	38%	0.382	S	S	.	.	H	α-helix	trans	-68.5	-38.3	179.7	-80.5	177.5	166.3	177	-3.8	112.5	L177 R231 K232 N233 K238 K239	L177-R235 HydrophobicContact CD2-CG 4.41Å; R231-R235 WeakPolarHBondContact O-CB 3.41Å; R231-R235 WeakPolarHBondContact O-CG 3.36Å; R231-R235 PolarHBondContact O-N 2.95Å; R231-R235 VanDerWaalsContact O-N 3.14Å; K232-R235 PolarHBondContact O-N 3.1Å; N233-R235 VanDerWaalsContact C-N 3.31Å; N233-R235 PolarHBondContact O-N 3.06Å; R235-K238 PolarHBondContact O-N 3.17Å; R235-K239 PolarHBondContact O-N 3.03Å; R235-K239 VanDerWaalsContact O-N 3.13Å
236	A	68.8	Low	75.7	Confident	56 Å²	56	78.8 Å²	78.8	46%	0.463	39%	0.386	S	S	.	.	H	α-helix	trans	-61.2	-51.6	174.9	0	0	0	0	0	110.5	K232 N233 K238 K239 T240	K232-A236 PolarHBondContact O-N 2.84Å; N233-A236 PolarHBondContact O-N 3.17Å; A236-K238 VanDerWaalsContact C-N 3.32Å; A236-K238 PolarHBondContact O-N 3.42Å; A236-K239 PolarHBondContact O-N 3.36Å; A236-T240 PolarHBondContact O-N 3.37Å; A236-T240 PolarHBondContact O-OG1 3.4Å
237	L	67.5	Low	76.3	Confident	45 Å²	45	74.9 Å²	74.9	24%	0.236	37%	0.37	C	S	.	.	H	α-helix	trans	-56.7	-44.1	176.9	-176.9	65.6	0	0	0	112.2	V175 N233 K239 T240 V241 I369 I997	V175-L237 HydrophobicContact CG1-CD2 4.42Å; N233-L237 PolarHBondContact O-N 3Å; N233-L237 VanDerWaalsContact O-N 3.12Å; L237-K239 PolarHBondContact O-N 2.96Å; L237-T240 PolarHBondContact O-N 3.11Å; L237-V241 HydrophobicContact CD1-CG2 4.2Å; L237-V241 WeakPolarHBondContact O-CG2 3.28Å; L237-V241 PolarHBondContact O-N 2.92Å; L237-I369 HydrophobicContact CD1-CG2 4.09Å; L237-I997 HydrophobicContact CD1-CG2 4.14Å
238	K	78.1	Confident	76.7	Confident	55 Å²	55	76.6 Å²	76.6	24%	0.239	38%	0.379	C	S	.	.	H	α-helix	trans	-62.4	-40.1	179.1	-176.9	164.5	-169.5	132.7	0	113	D174 V175 L177 E234 R235 A236 T240 V241 C242	D174-K238 IonicContact OD1-NZ 3.66Å; D174-K238 PolarHBondContact OD1-NZ 2.72Å; V175-K238 HydrophobicContact CB-CB 4.46Å; V175-K238 WeakPolarHBondContact O-CD 3.22Å; V175-K238 PolarHBondContact O-NZ 3Å; L177-K238 HydrophobicContact CD1-CD 4.05Å; L177-K238 HydrophobicContact CD2-CB 4.36Å; L177-K238 HydrophobicContact CD2-CD 4.23Å; L177-K238 HydrophobicContact CG-CD 3.77Å; E234-K238 PolarHBondContact O-N 3.12Å; R235-K238 PolarHBondContact O-N 3.17Å; A236-K238 VanDerWaalsContact C-N 3.32Å; A236-K238 PolarHBondContact O-N 3.42Å; K238-T240 VanDerWaalsContact C-N 3.33Å; K238-T240 PolarHBondContact O-N 2.95Å; K238-V241 PolarHBondContact O-N 3.15Å; K238-C242 HydrophobicContact CG-CB 4.4Å; K238-C242 WeakPolarHBondContact O-CB 3.44Å; K238-C242 PolarHBondContact O-N 3.49Å
239	K	71.4	Confident	77.1	Confident	178 Å²	178	69.2 Å²	69.2	77%	0.774	35%	0.35	S	S	*	.	H	α-helix	trans	-63.4	-38.5	179.6	-79.6	-171.6	173.2	-163.4	0	112.4	R235 A236 L237	R235-K239 PolarHBondContact O-N 3.03Å; R235-K239 VanDerWaalsContact O-N 3.13Å; A236-K239 PolarHBondContact O-N 3.36Å; L237-K239 PolarHBondContact O-N 2.96Å
240	T	66.5	Low	77.9	Confident	62 Å²	62	66.4 Å²	66.4	38%	0.38	34%	0.337	S	S	.	.	H	α-helix	trans	-74	-31.9	-179.4	-43.7	0	0	0	0	112.4	A236 L237 K238 I997	A236-T240 PolarHBondContact O-N 3.37Å; A236-T240 PolarHBondContact O-OG1 3.4Å; L237-T240 PolarHBondContact O-N 3.11Å; K238-T240 VanDerWaalsContact C-N 3.33Å; K238-T240 PolarHBondContact O-N 2.95Å; T240-I997 HydrophobicContact CG2-CD1 3.58Å
241	V	67.8	Low	78.7	Confident	9 Å²	9	63.2 Å²	63.2	6%	0.055	32%	0.319	C	S	.	.	H	α-helix	trans	-90.3	-41.1	-173.4	169.9	0	0	0	0	113.8	I173 V175 L237 K238 I243 V366	I173-V241 HydrophobicContact CB-CG1 4.02Å; I173-V241 HydrophobicContact CG2-CG1 3.47Å; I173-V241 VanDerWaalsContact CG2-CG1 3.47Å; V175-V241 HydrophobicContact CG2-CB 4.1Å; V175-V241 HydrophobicContact CG2-CG1 3.77Å; V175-V241 HydrophobicContact CG2-CG2 4.45Å; L237-V241 HydrophobicContact CD1-CG2 4.2Å; L237-V241 WeakPolarHBondContact O-CG2 3.28Å; L237-V241 PolarHBondContact O-N 2.92Å; K238-V241 PolarHBondContact O-N 3.15Å; V241-I243 PolarHBondContact O-N 3.21Å; V241-V366 HydrophobicContact CG1-CB 4.47Å; V241-V366 HydrophobicContact CG1-CG1 3.78Å; V241-V366 HydrophobicContact CG1-CG2 3.93Å; V241-V366 HydrophobicContact CG2-CG1 4.08Å; V241-V366 HydrophobicContact CG2-CG2 3.81Å
242	C	65.9	Low	78.8	Confident	41 Å²	41	65.9 Å²	65.9	28%	0.277	33%	0.329	S	S	.	.			trans	-92	74.3	-169.6	-62.1	0	0	0	0	112.2	I173 K238	I173-C242 PolarHBondContact O-SG 3.25Å; K238-C242 HydrophobicContact CG-CB 4.4Å; K238-C242 WeakPolarHBondContact O-CB 3.44Å; K238-C242 PolarHBondContact O-N 3.49Å
243	I	72.5	Confident	78.9	Confident	80 Å²	80	66.4 Å²	66.4	41%	0.41	33%	0.328	S	S	.	.			trans	-99	145	170.7	-51.8	175.5	0	0	0	108.9	V241 L281	V241-I243 PolarHBondContact O-N 3.21Å; I243-L281 HydrophobicContact CD1-CD2 4.47Å; I243-L281 HydrophobicContact CG2-CD2 3.95Å
244	S	79	Confident	79.2	Confident	74 Å²	74	70.6 Å²	70.6	52%	0.517	35%	0.35	S	S	.	.			trans	-142.1	141	174.6	53.3	0	0	0	0	109.6	S264	S244-S264 WeakPolarHBondContact CA-OG 3.32Å; S244-S264 WeakPolarHBondContact CB-OG 3.33Å
245	S	84.6	Confident	79.3	Confident	37 Å²	37	71.8 Å²	71.8	26%	0.259	37%	0.372	S	S	.	.			trans	-136	161.9	180	49.7	0	0	0	0	111	S264 Q283	S245-S264 PolarHBondContact N-OG 2.96Å; S245-S264 WeakPolarHBondContact O-CB 3.29Å; S245-S264 PolarHBondContact O-N 2.68Å; S245-S264 PolarHBondContact O-OG 3.18Å; S245-Q283 WeakPolarHBondContact OG-CG 3.34Å; S245-Q283 PolarHBondContact OG-NE2 2.94Å; S245-Q283 VanDerWaalsContact OG-NE2 3.13Å
246	K	89.2	Confident	79.4	Confident	159 Å²	159	72.5 Å²	72.5	69%	0.691	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.3	138.8	171.4	-64.1	-168.8	-177.8	-177.2	0	110	L261 V262	K246-L261 HydrophobicContact CB-CD1 4.23Å; K246-L261 HydrophobicContact CB-CD2 4.09Å; K246-L261 HydrophobicContact CB-CG 3.99Å; K246-L261 HydrophobicContact CD-CD2 3.6Å; K246-L261 HydrophobicContact CD-CG 4.19Å; K246-L261 HydrophobicContact CG-CD2 4.48Å; K246-V262 CarbonylContact C-O 3.55Å; K246-V262 WeakPolarHBondContact CA-O 3.1Å
247	V	89.9	Confident	80.2	Confident	24 Å²	24	73.3 Å²	73.3	15%	0.145	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	141	-177.2	-177.3	0	0	0	0	108.4	V249 V262 L267 I273	V247-V249 HydrophobicContact CG1-CG2 4.32Å; V247-V262 PolarHBondContact N-O 3.3Å; V247-V262 PolarHBondContact O-N 3.15Å; V247-L267 HydrophobicContact CB-CD1 4.48Å; V247-L267 HydrophobicContact CG1-CD1 4.44Å; V247-L267 HydrophobicContact CG1-CD2 4.44Å; V247-L267 HydrophobicContact CG2-CD1 4.24Å; V247-I273 HydrophobicContact CG1-CB 4.04Å; V247-I273 HydrophobicContact CG1-CG2 3.8Å
248	N	92.1	Very high	81.1	Confident	52 Å²	52	75.5 Å²	75.5	28%	0.278	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	118	-179.5	-148.6	9.2	0	0	0	109	M260 L261 I273 A274	N248-M260 PolarHBondContact OD1-O 3.16Å; N248-L261 HydrophobicContact CB-CD1 4.19Å; N248-I273 WeakPolarHBondContact O-CA 3.48Å; N248-A274 HydrophobicContact CB-CB 4.43Å; N248-A274 PolarHBondContact O-N 3.44Å
249	V	92.5	Very high	81.6	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	132.8	-167.5	-163.7	0	0	0	0	110.2	V247 R251 F259 M260 V262 L267 D271 L272 I273	V247-V249 HydrophobicContact CG1-CG2 4.32Å; V249-R251 HydrophobicContact CG1-CG 3.97Å; V249-F259 WeakPolarHBondContact O-CA 3.48Å; V249-M260 PolarHBondContact N-O 3.37Å; V249-M260 PolarHBondContact O-N 3.27Å; V249-V262 HydrophobicContact CB-CG2 4.1Å; V249-V262 HydrophobicContact CG2-CB 3.98Å; V249-V262 HydrophobicContact CG2-CG2 3.79Å; V249-L267 HydrophobicContact CG1-CD2 4.48Å; V249-L267 HydrophobicContact CG2-CD2 3.68Å; V249-D271 HydrophobicContact CG1-CB 3.91Å; V249-L272 CarbonylContact C-O 3.57Å; V249-L272 WeakPolarHBondContact CA-O 3.47Å; V249-L272 VanDerWaalsContact CG1-O 3.28Å; V249-L272 WeakPolarHBondContact CG1-O 3.42Å; V249-I273 HydrophobicContact CG1-CG2 4.33Å; V249-I273 HydrophobicContact CG2-CG2 4.25Å
250	C	91.1	Very high	82.6	Confident	9 Å²	9	69.2 Å²	69.2	6%	0.061	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	119.6	172.2	-165.7	0	0	0	0	110	T155 D258 F259 L272	T155-C250 HydrophobicContact CG2-CB 4.38Å; C250-D258 WeakPolarHBondContact CA-O 3.19Å; C250-F259 HydrophobicContact CB-CD1 3.89Å; C250-F259 HydrophobicContact CB-CE1 3.57Å; C250-F259 HydrophobicContact CB-CE2 4.24Å; C250-F259 HydrophobicContact CB-CG 4.36Å; C250-F259 HydrophobicContact CB-CZ 3.76Å; C250-L272 HydrophobicContact CB-CB 3.96Å; C250-L272 PolarHBondContact N-O 2.9Å
251	R	90.6	Very high	83.7	Confident	21 Å²	21	71.5 Å²	71.5	8%	0.079	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	144.1	-179.1	-69	177	165.9	175.7	-2	109.9	I161 V249 D258 M260 E266 D271	I161-R251 HydrophobicContact CD1-CB 4.39Å; I161-R251 HydrophobicContact CD1-CG 3.89Å; V249-R251 HydrophobicContact CG1-CG 3.97Å; R251-D258 PolarHBondContact N-O 3.43Å; R251-D258 PolarHBondContact O-N 3.38Å; R251-D258 VanDerWaalsContact O-N 3.12Å; R251-M260 HydrophobicContact CB-CE 4.03Å; R251-M260 HydrophobicContact CB-SD 4.35Å; R251-E266 PolarHBondContact NH2-O 2.77Å; R251-D271 IonicContact CZ-OD1 3.5Å; R251-D271 IonicContact CZ-OD2 2.92Å; R251-D271 IonicContact NE-OD1 3.26Å; R251-D271 PolarHBondContact NE-OD1 2.86Å; R251-D271 IonicContact NE-OD2 2.75Å; R251-D271 IonicContact NH2-OD1 2.65Å; R251-D271 PolarHBondContact NH2-OD1 2.9Å; R251-D271 IonicContact NH2-OD2 3.53Å; R251-D271 PolarHBondContact NH2-OD2 2.86Å
252	R	86.2	Confident	84.9	Confident	91 Å²	91	71.7 Å²	71.7	34%	0.343	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	116.6	-179.3	-169.7	164.2	-70.1	156.7	-5.1	110.4	T155 L156 T157 E256 D257	T155-R252 PolarHBondContact OG1-NE 2.88Å; T155-R252 PolarHBondContact OG1-NH2 3.14Å; L156-R252 PolarHBondContact O-N 3.01Å; T157-R252 HydrophobicContact CG2-CB 4.32Å; R252-E256 CarbonylContact C-O 3.51Å; R252-E256 VanDerWaalsContact CA-O 3.3Å; R252-E256 WeakPolarHBondContact CA-O 3.39Å; R252-D257 WeakPolarHBondContact CB-OD1 3.26Å; R252-D257 IonicContact CZ-OD1 3.33Å; R252-D257 IonicContact CZ-OD2 3.65Å; R252-D257 IonicContact NE-OD1 2.75Å; R252-D257 PolarHBondContact NE-OD1 3.05Å; R252-D257 IonicContact NE-OD2 3.7Å; R252-D257 IonicContact NH2-OD1 3.21Å; R252-D257 PolarHBondContact NH2-OD1 3.22Å; R252-D257 IonicContact NH2-OD2 2.76Å; R252-D257 PolarHBondContact NH2-OD2 3.27Å
253	R	80.4	Confident	86.1	Confident	142 Å²	142	72.6 Å²	72.6	54%	0.536	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	133	174.6	-179	-178.9	-72.5	174.7	-0.6	108.7	G255 E256	R253-G255 PolarHBondContact O-N 3.22Å; R253-E256 PolarHBondContact N-O 2.93Å; R253-E256 PolarHBondContact O-N 3.06Å; R253-E256 VanDerWaalsContact O-O 3.14Å
254	D	76.2	Confident	87	Confident	166 Å²	166	68.9 Å²	68.9	89%	0.888	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	20.8	177.4	-51.6	-32.5	0	0	0	115.2
255	G	76.3	Confident	87.5	Confident	61 Å²	61	66.4 Å²	66.4	63%	0.629	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.1	-18.7	179.5	0	0	0	0	0	114.9	R253	R253-G255 PolarHBondContact O-N 3.22Å
256	E	80.8	Confident	87.8	Confident	160 Å²	160	67.9 Å²	67.9	75%	0.748	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	154	-178.9	-64.5	-166.2	155	0	0	112.7	R252 R253	R252-E256 CarbonylContact C-O 3.51Å; R252-E256 VanDerWaalsContact CA-O 3.3Å; R252-E256 WeakPolarHBondContact CA-O 3.39Å; R253-E256 PolarHBondContact N-O 2.93Å; R253-E256 PolarHBondContact O-N 3.06Å; R253-E256 VanDerWaalsContact O-O 3.14Å
257	D	84.7	Confident	88	Confident	74 Å²	74	60.3 Å²	60.3	40%	0.396	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	107.3	-178.1	-69.4	-32.1	0	0	0	110.7	T155 R252	T155-D257 VanDerWaalsContact CB-OD1 3.29Å; T155-D257 WeakPolarHBondContact CB-OD1 3.33Å; T155-D257 HydrophobicContact CG2-CB 4.3Å; T155-D257 VanDerWaalsContact OG1-CG 3.24Å; T155-D257 PolarHBondContact OG1-OD1 3.37Å; T155-D257 PolarHBondContact OG1-OD2 3.19Å; R252-D257 WeakPolarHBondContact CB-OD1 3.26Å; R252-D257 IonicContact CZ-OD1 3.33Å; R252-D257 IonicContact CZ-OD2 3.65Å; R252-D257 IonicContact NE-OD1 2.75Å; R252-D257 PolarHBondContact NE-OD1 3.05Å; R252-D257 IonicContact NE-OD2 3.7Å; R252-D257 IonicContact NH2-OD1 3.21Å; R252-D257 PolarHBondContact NH2-OD1 3.22Å; R252-D257 IonicContact NH2-OD2 2.76Å; R252-D257 PolarHBondContact NH2-OD2 3.27Å
258	D	88.3	Confident	88.1	Confident	91 Å²	91	59.2 Å²	59.2	49%	0.487	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	148.1	-177.7	-176.2	29.1	0	0	0	112	C250 R251	C250-D258 WeakPolarHBondContact CA-O 3.19Å; R251-D258 PolarHBondContact N-O 3.43Å; R251-D258 PolarHBondContact O-N 3.38Å; R251-D258 VanDerWaalsContact O-N 3.12Å
259	F	88.3	Confident	88.1	Confident	60 Å²	60	56.9 Å²	56.9	26%	0.263	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	107.1	176.9	-80	-89.3	0	0	0	110.9	V249 C250 A274 R348 L350	V249-F259 WeakPolarHBondContact O-CA 3.48Å; C250-F259 HydrophobicContact CB-CD1 3.89Å; C250-F259 HydrophobicContact CB-CE1 3.57Å; C250-F259 HydrophobicContact CB-CE2 4.24Å; C250-F259 HydrophobicContact CB-CG 4.36Å; C250-F259 HydrophobicContact CB-CZ 3.76Å; F259-A274 HydrophobicContact CD1-CB 4.05Å; F259-A274 HydrophobicContact CE1-CB 3.74Å; F259-R348 VanDerWaalsContact CD2-NH1 3.3Å; F259-L350 HydrophobicContact CE1-CD2 3.85Å; F259-L350 HydrophobicContact CZ-CD2 3.81Å
260	M	90.8	Very high	87.9	Confident	41 Å²	41	56.9 Å²	56.9	20%	0.202	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	144.2	-177.7	59.6	-176	72.3	0	0	112.4	N248 V249 R251 V262	N248-M260 PolarHBondContact OD1-O 3.16Å; V249-M260 PolarHBondContact N-O 3.37Å; V249-M260 PolarHBondContact O-N 3.27Å; R251-M260 HydrophobicContact CB-CE 4.03Å; R251-M260 HydrophobicContact CB-SD 4.35Å; M260-V262 HydrophobicContact CG-CG2 3.73Å; M260-V262 PolarHBondContact O-N 2.93Å; M260-V262 HydrophobicContact SD-CG2 4.29Å
261	L	91.3	Very high	87.9	Confident	110 Å²	110	56.5 Å²	56.5	58%	0.576	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86	104.4	178.2	-164.2	78	0	0	0	110.5	K246 N248	K246-L261 HydrophobicContact CB-CD1 4.23Å; K246-L261 HydrophobicContact CB-CD2 4.09Å; K246-L261 HydrophobicContact CB-CG 3.99Å; K246-L261 HydrophobicContact CD-CD2 3.6Å; K246-L261 HydrophobicContact CD-CG 4.19Å; K246-L261 HydrophobicContact CG-CD2 4.48Å; N248-L261 HydrophobicContact CB-CD1 4.19Å
262	V	91.4	Very high	88	Confident	13 Å²	13	56.4 Å²	56.4	8%	0.079	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	155.1	-175.1	-164.6	0	0	0	0	110.2	K246 V247 V249 M260 E266	K246-V262 CarbonylContact C-O 3.55Å; K246-V262 WeakPolarHBondContact CA-O 3.1Å; V247-V262 PolarHBondContact N-O 3.3Å; V247-V262 PolarHBondContact O-N 3.15Å; V249-V262 HydrophobicContact CB-CG2 4.1Å; V249-V262 HydrophobicContact CG2-CB 3.98Å; V249-V262 HydrophobicContact CG2-CG2 3.79Å; M260-V262 HydrophobicContact CG-CG2 3.73Å; M260-V262 PolarHBondContact O-N 2.93Å; M260-V262 HydrophobicContact SD-CG2 4.29Å; V262-E266 HydrophobicContact CG1-CB 3.69Å; V262-E266 HydrophobicContact CG1-CG 4.03Å
263	D	91.6	Very high	88.4	Confident	59 Å²	59	52.1 Å²	52.1	32%	0.316	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	136.5	165.5	176.9	27.5	0	0	0	110.5	T265 E266	D263-T265 PolarHBondContact O-N 3.5Å; D263-T265 WeakPolarHBondContact OD2-CB 3.42Å; D263-T265 VanDerWaalsContact OD2-CG2 3.24Å; D263-T265 WeakPolarHBondContact OD2-CG2 3.2Å; D263-T265 PolarHBondContact OD2-OG1 3.32Å; D263-E266 PolarHBondContact O-N 2.96Å
264	S	91.3	Very high	89	Confident	3 Å²	3	45.8 Å²	45.8	2%	0.021	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-40.2	-30.9	169.9	54.5	0	0	0	0	115.3	N171 S244 S245 E266 L267	N171-S264 WeakPolarHBondContact CB-O 3.27Å; N171-S264 PolarHBondContact ND2-O 2.89Å; S244-S264 WeakPolarHBondContact CA-OG 3.32Å; S244-S264 WeakPolarHBondContact CB-OG 3.33Å; S245-S264 PolarHBondContact N-OG 2.96Å; S245-S264 WeakPolarHBondContact O-CB 3.29Å; S245-S264 PolarHBondContact O-N 2.68Å; S245-S264 PolarHBondContact O-OG 3.18Å; S264-E266 VanDerWaalsContact C-N 3.27Å; S264-E266 PolarHBondContact O-N 2.93Å; S264-L267 WeakPolarHBondContact O-CG 3.25Å; S264-L267 PolarHBondContact O-N 3.2Å
265	T	91	Very high	89.8	Confident	21 Å²	21	38.3 Å²	38.3	13%	0.129	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-69.3	-20.6	179.9	67.6	0	0	0	0	114.3	I170 N171 K172 D263	I170-T265 WeakPolarHBondContact CG2-O 3.42Å; N171-T265 PolarHBondContact N-O 3.2Å; N171-T265 WeakPolarHBondContact O-CA 3.31Å; K172-T265 HydrophobicContact CB-CG2 4.35Å; K172-T265 HydrophobicContact CD-CG2 4.27Å; D263-T265 PolarHBondContact O-N 3.5Å; D263-T265 WeakPolarHBondContact OD2-CB 3.42Å; D263-T265 VanDerWaalsContact OD2-CG2 3.24Å; D263-T265 WeakPolarHBondContact OD2-CG2 3.2Å; D263-T265 PolarHBondContact OD2-OG1 3.32Å
266	E	90.9	Very high	90.4	Very high	68 Å²	68	38.1 Å²	38.1	32%	0.318	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-95	3.7	180	-46.9	-147.3	118.6	0	0	114.4	R165 R251 V262 D263 S264	R165-E266 IonicContact CZ-OE1 2.87Å; R165-E266 IonicContact NH1-OE1 3.88Å; R165-E266 PolarHBondContact NH1-OE1 3.06Å; R165-E266 IonicContact NH2-OE1 3.73Å; R165-E266 PolarHBondContact NH2-OE1 2.99Å; R251-E266 PolarHBondContact NH2-O 2.77Å; V262-E266 HydrophobicContact CG1-CB 3.69Å; V262-E266 HydrophobicContact CG1-CG 4.03Å; D263-E266 PolarHBondContact O-N 2.96Å; S264-E266 VanDerWaalsContact C-N 3.27Å; S264-E266 PolarHBondContact O-N 2.93Å
267	L	92.9	Very high	90.4	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.005	19%	0.193	C	C	.	.			trans	-66.9	135.8	175.1	-65.5	174.3	0	0	0	110.7	N171 V247 V249 S264 D271 I273 C284	N171-L267 HydrophobicContact CB-CB 4.25Å; N171-L267 WeakPolarHBondContact CB-O 3.34Å; V247-L267 HydrophobicContact CB-CD1 4.48Å; V247-L267 HydrophobicContact CG1-CD1 4.44Å; V247-L267 HydrophobicContact CG1-CD2 4.44Å; V247-L267 HydrophobicContact CG2-CD1 4.24Å; V249-L267 HydrophobicContact CG1-CD2 4.48Å; V249-L267 HydrophobicContact CG2-CD2 3.68Å; S264-L267 WeakPolarHBondContact O-CG 3.25Å; S264-L267 PolarHBondContact O-N 3.2Å; L267-D271 WeakPolarHBondContact CA-OD2 3.39Å; L267-D271 HydrophobicContact CD2-CB 4.43Å; L267-I273 HydrophobicContact CD2-CG2 3.92Å; L267-C284 HydrophobicContact CD1-CB 4.42Å
268	V	92.3	Very high	90.2	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.006	21%	0.21	C	C	.	.			trans	-121.1	154.9	172.8	-64.8	0	0	0	0	110.6	L156 I161 R164 R165 G270 D271	L156-V268 HydrophobicContact CD1-CG2 3.81Å; I161-V268 HydrophobicContact CG1-CG2 4.35Å; I161-V268 HydrophobicContact CG2-CG1 4.47Å; I161-V268 HydrophobicContact CG2-CG2 4.19Å; R164-V268 HydrophobicContact CB-CB 4.02Å; R164-V268 HydrophobicContact CB-CG1 4.31Å; R164-V268 HydrophobicContact CB-CG2 4.21Å; R165-V268 HydrophobicContact CB-CG1 4.02Å; V268-G270 PolarHBondContact O-N 2.77Å; V268-D271 WeakPolarHBondContact CG2-OD2 3.39Å; V268-D271 PolarHBondContact N-OD2 2.81Å; V268-D271 WeakPolarHBondContact O-CB 3.27Å; V268-D271 PolarHBondContact O-N 3.12Å
269	P	90.4	Very high	90	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.013	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	133.6	171.9	-26.4	36.2	0	0	0	111.8	W142 R164 Y168 V353 T356	W142-P269 HydrophobicContact CB-CB 3.56Å; W142-P269 HydrophobicContact CD2-CB 4.42Å; W142-P269 HydrophobicContact CG-CB 3.76Å; R164-P269 VanDerWaalsContact CD-O 3.26Å; R164-P269 WeakPolarHBondContact CD-O 3.5Å; R164-P269 PolarHBondContact NH1-O 3.43Å; Y168-P269 HydrophobicContact CD1-CG 4.1Å; Y168-P269 HydrophobicContact CD2-CB 4.5Å; Y168-P269 HydrophobicContact CD2-CG 3.84Å; Y168-P269 HydrophobicContact CE1-CG 4.38Å; Y168-P269 HydrophobicContact CE2-CB 4.38Å; Y168-P269 HydrophobicContact CE2-CG 4.14Å; Y168-P269 HydrophobicContact CG-CG 3.82Å; P269-V353 CarbonylContact C-O 3.46Å; P269-T356 HydrophobicContact CG-CG2 4.36Å
270	G	89.1	Confident	90	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.01	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.6	4.2	-172.6	0	0	0	0	0	116.4	L156 V268 V353	L156-G270 WeakPolarHBondContact CG-O 3.39Å; V268-G270 PolarHBondContact O-N 2.77Å; G270-V353 PolarHBondContact N-O 3.03Å
271	D	91.7	Very high	89.9	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	20%	0.199	C	C	.	.			trans	-62.7	136.9	165.7	-92.3	-42.9	0	0	0	109.7	V249 R251 L267 V268 V352 V353	V249-D271 HydrophobicContact CG1-CB 3.91Å; R251-D271 IonicContact CZ-OD1 3.5Å; R251-D271 IonicContact CZ-OD2 2.92Å; R251-D271 IonicContact NE-OD1 3.26Å; R251-D271 PolarHBondContact NE-OD1 2.86Å; R251-D271 IonicContact NE-OD2 2.75Å; R251-D271 IonicContact NH2-OD1 2.65Å; R251-D271 PolarHBondContact NH2-OD1 2.9Å; R251-D271 IonicContact NH2-OD2 3.53Å; R251-D271 PolarHBondContact NH2-OD2 2.86Å; L267-D271 WeakPolarHBondContact CA-OD2 3.39Å; L267-D271 HydrophobicContact CD2-CB 4.43Å; V268-D271 WeakPolarHBondContact CG2-OD2 3.39Å; V268-D271 PolarHBondContact N-OD2 2.81Å; V268-D271 WeakPolarHBondContact O-CB 3.27Å; V268-D271 PolarHBondContact O-N 3.12Å; D271-V352 WeakPolarHBondContact O-CA 3.45Å; D271-V353 HydrophobicContact CB-CB 4.39Å; D271-V353 HydrophobicContact CB-CG2 4.03Å; D271-V353 WeakPolarHBondContact O-CG2 3.26Å; D271-V353 PolarHBondContact O-N 2.99Å
272	L	92.8	Very high	89.9	Confident	19 Å²	19	27.8 Å²	27.8	10%	0.099	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	121.1	171.3	-91.7	159.7	0	0	0	109.6	T155 V249 C250 L289	T155-L272 HydrophobicContact CG2-CD1 3.69Å; V249-L272 CarbonylContact C-O 3.57Å; V249-L272 WeakPolarHBondContact CA-O 3.47Å; V249-L272 VanDerWaalsContact CG1-O 3.28Å; V249-L272 WeakPolarHBondContact CG1-O 3.42Å; C250-L272 HydrophobicContact CB-CB 3.96Å; C250-L272 PolarHBondContact N-O 2.9Å; L272-L289 HydrophobicContact CD2-CD1 3.77Å
273	I	94.1	Very high	89.8	Confident	2 Å²	2	28.2 Å²	28.2	1%	0.01	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	140.2	-179.4	61.9	172.1	0	0	0	111.3	V247 N248 V249 L267 I275 M282 A286 L350 A351 V353	V247-I273 HydrophobicContact CG1-CB 4.04Å; V247-I273 HydrophobicContact CG1-CG2 3.8Å; N248-I273 WeakPolarHBondContact O-CA 3.48Å; V249-I273 HydrophobicContact CG1-CG2 4.33Å; V249-I273 HydrophobicContact CG2-CG2 4.25Å; L267-I273 HydrophobicContact CD2-CG2 3.92Å; I273-I275 HydrophobicContact CD1-CD1 3.86Å; I273-I275 HydrophobicContact CG1-CD1 4.12Å; I273-M282 HydrophobicContact CD1-CE 4.12Å; I273-A286 HydrophobicContact CD1-CB 3.99Å; I273-L350 WeakPolarHBondContact O-CA 3.21Å; I273-A351 HydrophobicContact CD1-CB 4.46Å; I273-A351 HydrophobicContact CG1-CB 4.02Å; I273-A351 WeakPolarHBondContact CG1-O 3.32Å; I273-A351 PolarHBondContact N-O 2.87Å; I273-A351 PolarHBondContact O-N 3.33Å; I273-V353 HydrophobicContact CD1-CG2 4.32Å; I273-V353 HydrophobicContact CG2-CG2 3.85Å
274	A	92.8	Very high	89.8	Confident	8 Å²	8	25.5 Å²	25.5	7%	0.066	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	126	170.8	0	0	0	0	0	110.4	N248 F259 V349 L350	N248-A274 HydrophobicContact CB-CB 4.43Å; N248-A274 PolarHBondContact O-N 3.44Å; F259-A274 HydrophobicContact CD1-CB 4.05Å; F259-A274 HydrophobicContact CE1-CB 3.74Å; A274-V349 WeakPolarHBondContact CA-O 3.36Å; A274-L350 HydrophobicContact CB-CD2 4.07Å
275	I	92.2	Very high	89.9	Confident	10 Å²	10	25.3 Å²	25.3	5%	0.051	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	122.5	179.7	-49	-57.6	0	0	0	108.9	I273 M282 L332 V338 T341 V349	I273-I275 HydrophobicContact CD1-CD1 3.86Å; I273-I275 HydrophobicContact CG1-CD1 4.12Å; I275-M282 HydrophobicContact CD1-SD 4.15Å; I275-L332 HydrophobicContact CD1-CD1 4.01Å; I275-L332 HydrophobicContact CG1-CD1 4.09Å; I275-V338 HydrophobicContact CG2-CB 4.27Å; I275-V338 HydrophobicContact CG2-CG1 3.92Å; I275-V338 HydrophobicContact CG2-CG2 4.09Å; I275-T341 HydrophobicContact CB-CG2 3.95Å; I275-T341 HydrophobicContact CG2-CG2 3.45Å; I275-T341 VanDerWaalsContact CG2-CG2 3.45Å; I275-V349 HydrophobicContact CB-CB 4.47Å; I275-V349 HydrophobicContact CB-CG1 4.19Å; I275-V349 HydrophobicContact CG1-CG1 4.41Å; I275-V349 PolarHBondContact N-O 3.47Å
276	P	89	Confident	90	Very high	56 Å²	56	24.3 Å²	24.3	36%	0.364	15%	0.153	S	C	.	.	P	Polyproline II helix	trans	-70.8	147.7	-178.2	30.1	-36	0	0	0	112.1	S278 G279 C280 T341	P276-S278 VanDerWaalsContact C-N 3.27Å; P276-S278 PolarHBondContact O-N 3.35Å; P276-G279 WeakPolarHBondContact CG-O 3.14Å; P276-G279 PolarHBondContact O-N 3.36Å; P276-G279 VanDerWaalsContact O-N 3.16Å; P276-C280 HydrophobicContact CG-CB 3.85Å; P276-T341 WeakPolarHBondContact O-CG2 3.42Å
277	S	82.2	Confident	90	Very high	93 Å²	93	21.1 Å²	21.1	65%	0.65	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-27.8	178.8	47.7	0	0	0	0	114.1	G279 T341	S277-G279 PolarHBondContact O-N 3.32Å; S277-T341 WeakPolarHBondContact CA-OG1 3.28Å
278	S	80.5	Confident	89.9	Confident	106 Å²	106	21 Å²	21	74%	0.741	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.1	4.5	174.4	63.9	0	0	0	0	114.7	P276	P276-S278 VanDerWaalsContact C-N 3.27Å; P276-S278 PolarHBondContact O-N 3.35Å
279	G	82.8	Confident	89.8	Confident	13 Å²	13	22.3 Å²	22.3	13%	0.134	14%	0.144	C	C	.	.			trans	78	164.7	-174.3	0	0	0	0	0	114.5	P276 S277 V338 I339	P276-G279 WeakPolarHBondContact CG-O 3.14Å; P276-G279 PolarHBondContact O-N 3.36Å; P276-G279 VanDerWaalsContact O-N 3.16Å; S277-G279 PolarHBondContact O-N 3.32Å; G279-V338 CarbonylContact C-O 3.59Å; G279-V338 WeakPolarHBondContact CA-O 3.45Å; G279-I339 WeakPolarHBondContact CA-O 3.37Å
280	C	89.5	Confident	89.5	Confident	39 Å²	39	26.2 Å²	26.2	26%	0.264	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	157.7	177.8	66.3	0	0	0	0	112.8	P276 V338	P276-C280 HydrophobicContact CG-CB 3.85Å; C280-V338 PolarHBondContact N-O 3.47Å; C280-V338 PolarHBondContact O-N 3Å
281	L	88.3	Confident	89.3	Confident	63 Å²	63	27.2 Å²	27.2	33%	0.33	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	124	168.8	-176	68.7	0	0	0	110.8	I243	I243-L281 HydrophobicContact CD1-CD2 4.47Å; I243-L281 HydrophobicContact CG2-CD2 3.95Å
282	M	91.5	Very high	89	Confident	6 Å²	6	30 Å²	30	3%	0.03	19%	0.188	C	C	.	.			trans	-72.9	124.1	178.6	-70.6	-60.3	-58.3	0	0	111.8	I273 I275 A286 L332 F333 G335 T336 V338	I273-M282 HydrophobicContact CD1-CE 4.12Å; I275-M282 HydrophobicContact CD1-SD 4.15Å; M282-A286 HydrophobicContact CE-CB 3.91Å; M282-L332 HydrophobicContact CE-CB 3.65Å; M282-L332 HydrophobicContact CE-CD1 4.15Å; M282-L332 HydrophobicContact CG-CB 4.17Å; M282-L332 HydrophobicContact SD-CB 4.05Å; M282-L332 HydrophobicContact SD-CD1 4.05Å; M282-F333 WeakPolarHBondContact CB-O 3.3Å; M282-G335 PolarHBondContact O-N 3.31Å; M282-T336 WeakPolarHBondContact CB-O 3.16Å; M282-T336 PolarHBondContact N-O 3.06Å; M282-V338 HydrophobicContact CG-CG2 4.08Å; M282-V338 HydrophobicContact SD-CG2 4.13Å
283	Q	89.2	Confident	88.7	Confident	21 Å²	21	29.1 Å²	29.1	10%	0.098	18%	0.183	C	C	.	.			trans	-105.5	5.7	179.1	-57.7	-64.8	-2	0	0	114	N171 S245	N171-Q283 PolarHBondContact ND2-O 2.93Å; N171-Q283 PolarHBondContact OD1-O 3.17Å; S245-Q283 WeakPolarHBondContact OG-CG 3.34Å; S245-Q283 PolarHBondContact OG-NE2 2.94Å; S245-Q283 VanDerWaalsContact OG-NE2 3.13Å
284	C	91.7	Very high	88.3	Confident	2 Å²	2	29.1 Å²	29.1	1%	0.014	18%	0.183	C	C	.	.	S	Bend	trans	-151.1	166.2	178.7	57.3	0	0	0	0	108.7	L267 S334 V353 R355 T356	L267-C284 HydrophobicContact CD1-CB 4.42Å; C284-S334 WeakPolarHBondContact O-CA 3.03Å; C284-S334 PolarHBondContact O-N 3.2Å; C284-V353 HydrophobicContact CB-CG1 3.95Å; C284-R355 WeakPolarHBondContact CB-O 3.49Å; C284-T356 HydrophobicContact CB-CG2 4.48Å
285	D	92.2	Very high	88	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	129.1	166	-56.1	-19.1	0	0	0	107.4	F324 L332 S334 I354 R355 T360 T361	D285-F324 HydrophobicContact CB-CE2 4.5Å; D285-L332 CarbonylContact C-O 3.58Å; D285-L332 WeakPolarHBondContact CA-O 3.42Å; D285-S334 VanDerWaalsContact OD1-CB 3.25Å; D285-S334 WeakPolarHBondContact OD1-CB 3.13Å; D285-S334 PolarHBondContact OD1-N 2.7Å; D285-I354 HydrophobicContact CB-CD1 4.36Å; D285-I354 HydrophobicContact CB-CG1 4.09Å; D285-I354 WeakPolarHBondContact O-CG1 3.36Å; D285-I354 PolarHBondContact O-N 3.31Å; D285-R355 HydrophobicContact CB-CB 4.08Å; D285-R355 PolarHBondContact N-O 3.44Å; D285-R355 VanDerWaalsContact N-O 3.16Å; D285-R355 PolarHBondContact O-N 3.47Å; D285-T360 WeakPolarHBondContact OD1-CB 3.21Å; D285-T360 WeakPolarHBondContact OD2-CA 3.5Å; D285-T360 WeakPolarHBondContact OD2-CB 3.23Å; D285-T361 PolarHBondContact OD2-N 3.44Å; D285-T361 PolarHBondContact OD2-OG1 2.86Å
286	A	93	Very high	87.5	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	147	-176.6	0	0	0	0	0	111.9	I273 M282 I331 L332 A351 V352	I273-A286 HydrophobicContact CD1-CB 3.99Å; M282-A286 HydrophobicContact CE-CB 3.91Å; A286-I331 CarbonylContact O-C 3.56Å; A286-I331 WeakPolarHBondContact O-CA 3.42Å; A286-L332 PolarHBondContact N-O 3.26Å; A286-L332 PolarHBondContact O-N 2.8Å; A286-A351 HydrophobicContact CB-CB 4.1Å; A286-V352 CarbonylContact C-O 3.41Å; A286-V352 WeakPolarHBondContact CA-O 3.45Å; A286-V352 WeakPolarHBondContact CB-O 3.44Å
287	V	92.1	Very high	87	Confident	0 Å²	0	28 Å²	28	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	127.9	176.7	175.7	0	0	0	0	109.6	V150 L312 F322 H330 I331 A351 V352 I354	V150-V287 HydrophobicContact CG1-CG1 4.41Å; V287-L312 HydrophobicContact CG1-CB 4.46Å; V287-L312 HydrophobicContact CG1-CD1 3.75Å; V287-L312 HydrophobicContact CG1-CD2 4.18Å; V287-L312 HydrophobicContact CG1-CG 4.35Å; V287-F322 HydrophobicContact CG2-CE1 4.22Å; V287-F322 HydrophobicContact CG2-CE2 4.35Å; V287-F322 HydrophobicContact CG2-CZ 3.68Å; V287-H330 CarbonylContact C-O 3.55Å; V287-H330 WeakPolarHBondContact CA-O 3.3Å; V287-I331 HydrophobicContact CG2-CG1 4.19Å; V287-A351 CarbonylContact O-C 3.57Å; V287-A351 WeakPolarHBondContact O-CA 3.32Å; V287-A351 VanDerWaalsContact O-CB 3.27Å; V287-A351 WeakPolarHBondContact O-CB 3.44Å; V287-V352 HydrophobicContact CB-CG1 3.97Å; V287-V352 PolarHBondContact N-O 2.72Å; V287-V352 PolarHBondContact O-N 2.74Å; V287-I354 HydrophobicContact CB-CG2 4.41Å; V287-I354 HydrophobicContact CG2-CD1 3.82Å; V287-I354 HydrophobicContact CG2-CG1 4.2Å; V287-I354 HydrophobicContact CG2-CG2 3.65Å
288	L	91.6	Very high	86.1	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	125.7	-179.2	-168.9	58.6	0	0	0	110.4	G291 C293 K309 P311 L312 H330 L332 V349 A351	L288-G291 VanDerWaalsContact CD2-O 3.28Å; L288-G291 WeakPolarHBondContact CD2-O 3.46Å; L288-G291 WeakPolarHBondContact CG-O 3.34Å; L288-C293 HydrophobicContact CD2-CB 4.28Å; L288-K309 HydrophobicContact CD2-CB 4Å; L288-P311 HydrophobicContact CG-CB 4.48Å; L288-P311 CarbonylContact O-C 3.52Å; L288-P311 WeakPolarHBondContact O-CA 3.35Å; L288-L312 PolarHBondContact O-N 2.73Å; L288-H330 PolarHBondContact N-O 3.35Å; L288-L332 HydrophobicContact CD1-CD1 4.42Å; L288-V349 HydrophobicContact CD1-CG1 3.82Å; L288-A351 HydrophobicContact CD1-CB 4.38Å
289	L	88.5	Confident	85.3	Confident	28 Å²	28	21.1 Å²	21.1	15%	0.147	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	-37.6	-175.9	-62.4	179.3	0	0	0	112.7	L272 P311 L350 V352	L272-L289 HydrophobicContact CD2-CD1 3.77Å; L289-P311 VanDerWaalsContact O-CB 3.32Å; L289-P311 WeakPolarHBondContact O-CB 3.19Å; L289-L350 PolarHBondContact N-O 3.26Å; L289-V352 HydrophobicContact CD1-CB 3.97Å; L289-V352 HydrophobicContact CD1-CG1 3.99Å; L289-V352 HydrophobicContact CD2-CG1 4.17Å; L289-V352 HydrophobicContact CG-CG1 4.15Å
290	M	85.8	Confident	84.4	Confident	84 Å²	84	21.5 Å²	21.5	41%	0.414	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	138.9	178.5	-78.9	178.9	70.6	0	0	111.1	K347 V349 L350	M290-K347 HydrophobicContact CE-CB 4.31Å; M290-K347 HydrophobicContact CE-CD 3.84Å; M290-K347 HydrophobicContact CE-CG 4.44Å; M290-V349 CarbonylContact O-C 3.52Å; M290-V349 VanDerWaalsContact O-CA 3.27Å; M290-V349 WeakPolarHBondContact O-CA 3.36Å; M290-V349 VanDerWaalsContact O-CG1 3.25Å; M290-V349 WeakPolarHBondContact O-CG1 3.4Å; M290-L350 HydrophobicContact CB-CB 4.35Å; M290-L350 PolarHBondContact N-O 3.19Å; M290-L350 VanDerWaalsContact N-O 3.13Å; M290-L350 PolarHBondContact O-N 3.01Å; M290-L350 HydrophobicContact SD-CD1 4.26Å
291	G	83.4	Confident	83	Confident	21 Å²	21	21.2 Å²	21.2	22%	0.216	12%	0.121	C	C	.	.	S	Bend	trans	77.2	161.8	-176.2	0	0	0	0	0	113	L288 P311	L288-G291 VanDerWaalsContact CD2-O 3.28Å; L288-G291 WeakPolarHBondContact CD2-O 3.46Å; L288-G291 WeakPolarHBondContact CG-O 3.34Å; G291-P311 WeakPolarHBondContact O-CD 3.4Å
292	N	85.1	Confident	81.3	Confident	60 Å²	60	19 Å²	19	32%	0.321	11%	0.113	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	152.3	175.7	-59.8	-37.3	0	0	0	110	K309 P311 T341 R342	N292-K309 WeakPolarHBondContact CA-O 3.41Å; N292-K309 WeakPolarHBondContact CB-O 3.33Å; N292-P311 WeakPolarHBondContact OD1-CD 3.22Å; N292-T341 WeakPolarHBondContact O-CA 3.36Å; N292-R342 HydrophobicContact CB-CB 4.3Å; N292-R342 PolarHBondContact N-O 2.74Å; N292-R342 PolarHBondContact O-N 3.12Å
293	C	87.3	Confident	79.8	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	137.5	174.7	-67.3	0	0	0	0	110.3	L288 V295 T308 K309 L332 V338	L288-C293 HydrophobicContact CD2-CB 4.28Å; C293-V295 HydrophobicContact CB-CG2 3.91Å; C293-T308 CarbonylContact O-C 3.56Å; C293-T308 WeakPolarHBondContact O-CA 3.38Å; C293-K309 HydrophobicContact CB-CB 4.37Å; C293-K309 PolarHBondContact N-O 2.93Å; C293-K309 PolarHBondContact O-N 3.4Å; C293-L332 HydrophobicContact CB-CD2 3.94Å; C293-V338 HydrophobicContact CB-CG1 4.12Å
294	I	85.5	Confident	78.2	Confident	1 Å²	1	26.9 Å²	26.9	1%	0.005	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	123	164.5	-62.5	-178.7	0	0	0	107.5	P306 V338 I339 Q340 T520 I522	I294-P306 HydrophobicContact CG2-CB 3.77Å; I294-V338 CarbonylContact O-C 3.58Å; I294-V338 WeakPolarHBondContact O-CA 3.39Å; I294-I339 HydrophobicContact CG2-CB 4.42Å; I294-I339 HydrophobicContact CG2-CD1 4.2Å; I294-I339 PolarHBondContact O-N 2.92Å; I294-Q340 PolarHBondContact N-O 3.4Å; I294-T520 HydrophobicContact CD1-CG2 4.2Å; I294-I522 HydrophobicContact CG2-CD1 3.93Å
295	V	87.1	Confident	76.9	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	128.3	-170.5	-169.3	0	0	0	0	110.4	C293 E297 P306 I307 K309 L332 T336 S337 V338	C293-V295 HydrophobicContact CB-CG2 3.91Å; V295-E297 HydrophobicContact CB-CG 4.35Å; V295-E297 HydrophobicContact CG1-CG 3.92Å; V295-P306 CarbonylContact O-C 3.59Å; V295-P306 WeakPolarHBondContact O-CA 3.22Å; V295-I307 PolarHBondContact N-O 3.03Å; V295-I307 PolarHBondContact O-N 3.35Å; V295-K309 HydrophobicContact CB-CG 4.37Å; V295-K309 HydrophobicContact CG2-CB 4.45Å; V295-K309 HydrophobicContact CG2-CG 3.67Å; V295-L332 HydrophobicContact CG2-CD2 3.64Å; V295-T336 VanDerWaalsContact CG1-OG1 3.28Å; V295-T336 WeakPolarHBondContact CG1-OG1 3.48Å; V295-S337 CarbonylContact C-O 3.58Å; V295-S337 WeakPolarHBondContact CA-O 3.42Å; V295-V338 HydrophobicContact CG2-CG2 4.27Å
296	N	80.4	Confident	76	Confident	42 Å²	42	30.3 Å²	30.3	23%	0.225	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	111.2	165.2	-177	-3.5	0	0	0	109.1	S298 T336 S337 I339	N296-S298 WeakPolarHBondContact OD1-CB 3.41Å; N296-S298 PolarHBondContact OD1-N 2.99Å; N296-S298 PolarHBondContact OD1-OG 2.82Å; N296-T336 WeakPolarHBondContact O-CB 3.27Å; N296-S337 PolarHBondContact N-O 2.77Å; N296-S337 PolarHBondContact O-N 3.29Å; N296-S337 VanDerWaalsContact O-N 3.11Å; N296-I339 HydrophobicContact CB-CD1 4.12Å; N296-I339 HydrophobicContact CB-CG1 4.24Å
297	E	79.1	Confident	75.3	Confident	9 Å²	9	32.8 Å²	32.8	4%	0.042	19%	0.192	C	C	.	.			trans	-95	2.9	-180	-50.4	-151.3	129.7	0	0	113.3	V295 S299 L300 T301 I307 K309 F333 T336	V295-E297 HydrophobicContact CB-CG 4.35Å; V295-E297 HydrophobicContact CG1-CG 3.92Å; E297-S299 PolarHBondContact O-N 3.39Å; E297-L300 WeakPolarHBondContact O-CA 3.33Å; E297-L300 PolarHBondContact O-N 3.14Å; E297-T301 HydrophobicContact CB-CG2 3.86Å; E297-T301 PolarHBondContact O-N 2.88Å; E297-T301 PolarHBondContact O-OG1 3.07Å; E297-T301 VanDerWaalsContact O-OG1 3.06Å; E297-I307 HydrophobicContact CB-CD1 4.46Å; E297-I307 HydrophobicContact CG-CD1 4.18Å; E297-K309 VanDerWaalsContact CD-CE 3.46Å; E297-K309 WeakPolarHBondContact OE1-CE 3.04Å; E297-K309 IonicContact OE1-NZ 2.77Å; E297-K309 PolarHBondContact OE1-NZ 3.37Å; E297-K309 IonicContact OE2-NZ 3.9Å; E297-K309 PolarHBondContact OE2-NZ 3.45Å; E297-F333 WeakPolarHBondContact OE1-CD2 3.46Å; E297-T336 HydrophobicContact CB-CG2 3.91Å; E297-T336 HydrophobicContact CG-CG2 3.94Å
298	S	64.6	Low	74.7	Confident	34 Å²	34	35.7 Å²	35.7	24%	0.238	21%	0.21	C	C	.	.	H	α-helix	trans	-56.6	-26.8	-171.2	76.4	0	0	0	0	115.3	N296 L300 G302 E303	N296-S298 WeakPolarHBondContact OD1-CB 3.41Å; N296-S298 PolarHBondContact OD1-N 2.99Å; N296-S298 PolarHBondContact OD1-OG 2.82Å; S298-L300 VanDerWaalsContact C-N 3.33Å; S298-G302 WeakPolarHBondContact O-CA 3.49Å; S298-G302 PolarHBondContact O-N 3.06Å; S298-E303 WeakPolarHBondContact CA-O 3.29Å; S298-E303 WeakPolarHBondContact CB-O 3.34Å; S298-E303 PolarHBondContact N-O 3.42Å
299	S	63.3	Low	74.5	Confident	21 Å²	21	35.9 Å²	35.9	15%	0.147	21%	0.211	C	C	.	.	H	α-helix	trans	-61	-42.8	171.9	49.6	0	0	0	0	111.8	E297 G335 E994 A995	E297-S299 PolarHBondContact O-N 3.39Å; S299-G335 WeakPolarHBondContact CB-O 3.39Å; S299-G335 PolarHBondContact OG-O 3.22Å; S299-E994 WeakPolarHBondContact O-CB 3.23Å; S299-A995 PolarHBondContact O-N 3.13Å
300	L	63.8	Low	74.3	Confident	21 Å²	21	37.7 Å²	37.7	11%	0.11	22%	0.22	C	C	.	.	H	α-helix	trans	-94.9	-42.1	-174.4	-163.9	80.8	0	0	0	112.7	E297 S298 F333 T336 T361 K362 A975	E297-L300 WeakPolarHBondContact O-CA 3.33Å; E297-L300 PolarHBondContact O-N 3.14Å; S298-L300 VanDerWaalsContact C-N 3.33Å; L300-F333 HydrophobicContact CD2-CB 3.54Å; L300-F333 HydrophobicContact CD2-CD1 4.49Å; L300-F333 HydrophobicContact CD2-CD2 4.18Å; L300-F333 HydrophobicContact CD2-CG 3.85Å; L300-T336 HydrophobicContact CB-CG2 4.13Å; L300-T336 HydrophobicContact CD2-CG2 4.43Å; L300-T361 HydrophobicContact CD1-CG2 4.1Å; L300-T361 HydrophobicContact CD2-CG2 3.88Å; L300-T361 HydrophobicContact CG-CG2 4.28Å; L300-K362 HydrophobicContact CD1-CB 4.22Å; L300-A975 WeakPolarHBondContact O-CB 3.48Å
301	T	60.5	Low	74.3	Confident	32 Å²	32	35.1 Å²	35.1	20%	0.196	21%	0.21	C	C	.	.	H	α-helix	trans	-97.2	-14.2	-175.3	63	0	0	0	0	113.5	E297 E303 A975	E297-T301 HydrophobicContact CB-CG2 3.86Å; E297-T301 PolarHBondContact O-N 2.88Å; E297-T301 PolarHBondContact O-OG1 3.07Å; E297-T301 VanDerWaalsContact O-OG1 3.06Å; T301-E303 PolarHBondContact O-N 2.8Å; T301-E303 PolarHBondContact OG1-N 3.45Å; T301-A975 WeakPolarHBondContact O-CA 3.42Å; T301-A975 WeakPolarHBondContact O-CB 3.34Å; T301-A975 PolarHBondContact O-N 2.91Å
302	G	51.8	Low	74.2	Confident	16 Å²	16	34.4 Å²	34.4	17%	0.165	20%	0.201	C	C	.	.			trans	72.6	-18.1	-173.2	0	0	0	0	0	114.1	S298 S304	S298-G302 WeakPolarHBondContact O-CA 3.49Å; S298-G302 PolarHBondContact O-N 3.06Å; G302-S304 PolarHBondContact O-N 2.77Å
303	E	59.9	Low	73.8	Confident	98 Å²	98	33.5 Å²	33.5	46%	0.458	20%	0.198	S	C	.	.			trans	-73.2	121.4	179	-62.8	178.3	177.4	0	0	109.6	S298 T301 L305	S298-E303 WeakPolarHBondContact CA-O 3.29Å; S298-E303 WeakPolarHBondContact CB-O 3.34Å; S298-E303 PolarHBondContact N-O 3.42Å; T301-E303 PolarHBondContact O-N 2.8Å; T301-E303 PolarHBondContact OG1-N 3.45Å; E303-L305 PolarHBondContact O-N 3.34Å; E303-L305 VanDerWaalsContact O-N 3.1Å
304	S	55	Low	72.9	Confident	95 Å²	95	39.9 Å²	39.9	66%	0.664	23%	0.232	S	C	*	.			trans	-73.2	3	-174.5	53.1	0	0	0	0	115	G302	G302-S304 PolarHBondContact O-N 2.77Å
305	L	65.3	Low	71.8	Confident	51 Å²	51	42.7 Å²	42.7	27%	0.267	26%	0.262	S	S	.	.	S	Bend	trans	-97.9	133.1	-165.8	-53.6	174.4	0	0	0	110.9	E303 P530	E303-L305 PolarHBondContact O-N 3.34Å; E303-L305 VanDerWaalsContact O-N 3.1Å; L305-P530 HydrophobicContact CD1-CG 4.01Å; L305-P530 HydrophobicContact CD2-CG 3.69Å; L305-P530 HydrophobicContact CG-CG 4.45Å
306	P	72.5	Confident	70.3	Confident	23 Å²	23	49 Å²	49	15%	0.149	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	132.2	174.4	28.7	-31.6	0	0	0	110.8	I294 V295 I339 I522 S527	I294-P306 HydrophobicContact CG2-CB 3.77Å; V295-P306 CarbonylContact O-C 3.59Å; V295-P306 WeakPolarHBondContact O-CA 3.22Å; P306-I339 HydrophobicContact CB-CD1 3.88Å; P306-I522 HydrophobicContact CB-CD1 4.16Å; P306-I522 HydrophobicContact CG-CD1 3.91Å; P306-S527 VanDerWaalsContact CG-OG 3.23Å; P306-S527 WeakPolarHBondContact CG-OG 3.38Å
307	I	77.9	Confident	69.2	Low	53 Å²	53	53 Å²	53	27%	0.272	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	129.8	-178.1	-61	171.7	0	0	0	109.1	V295 E297 K309	V295-I307 PolarHBondContact N-O 3.03Å; V295-I307 PolarHBondContact O-N 3.35Å; E297-I307 HydrophobicContact CB-CD1 4.46Å; E297-I307 HydrophobicContact CG-CD1 4.18Å; I307-K309 HydrophobicContact CG2-CD 4.42Å
308	T	80.7	Confident	67.9	Low	61 Å²	61	59.5 Å²	59.5	37%	0.374	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	121	171.6	-50.8	0	0	0	0	110.5	C293	C293-T308 CarbonylContact O-C 3.56Å; C293-T308 WeakPolarHBondContact O-CA 3.38Å
309	K	86.3	Confident	67.5	Low	4 Å²	4	65.1 Å²	65.1	2%	0.017	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	141.2	173.4	-57.1	-71.7	178.2	145.5	0	109.8	L288 N292 C293 V295 E297 I307 P328 R329 I331 L332	L288-K309 HydrophobicContact CD2-CB 4Å; N292-K309 WeakPolarHBondContact CA-O 3.41Å; N292-K309 WeakPolarHBondContact CB-O 3.33Å; C293-K309 HydrophobicContact CB-CB 4.37Å; C293-K309 PolarHBondContact N-O 2.93Å; C293-K309 PolarHBondContact O-N 3.4Å; V295-K309 HydrophobicContact CB-CG 4.37Å; V295-K309 HydrophobicContact CG2-CB 4.45Å; V295-K309 HydrophobicContact CG2-CG 3.67Å; E297-K309 VanDerWaalsContact CD-CE 3.46Å; E297-K309 WeakPolarHBondContact OE1-CE 3.04Å; E297-K309 IonicContact OE1-NZ 2.77Å; E297-K309 PolarHBondContact OE1-NZ 3.37Å; E297-K309 IonicContact OE2-NZ 3.9Å; E297-K309 PolarHBondContact OE2-NZ 3.45Å; I307-K309 HydrophobicContact CG2-CD 4.42Å; K309-P328 PolarHBondContact NZ-O 3.36Å; K309-R329 VanDerWaalsContact CA-O 3.29Å; K309-R329 WeakPolarHBondContact CA-O 3.38Å; K309-R329 WeakPolarHBondContact CD-O 3.27Å; K309-I331 WeakPolarHBondContact CD-O 3.34Å; K309-I331 WeakPolarHBondContact CE-O 3.25Å; K309-I331 PolarHBondContact NZ-O 3.17Å; K309-L332 HydrophobicContact CB-CD2 4.13Å; K309-L332 HydrophobicContact CG-CD2 4Å
310	I	84.3	Confident	67.8	Low	65 Å²	65	67 Å²	67	33%	0.333	37%	0.372	S	S	.	.			trans	-120.5	142.7	-169	-51.8	174.8	0	0	0	107.4	R329 H330	I310-R329 PolarHBondContact N-O 3.36Å; I310-H330 WeakPolarHBondContact O-CA 3.18Å; I310-H330 PolarHBondContact O-ND1 3.29Å
311	P	86.2	Confident	67.9	Low	31 Å²	31	70.9 Å²	70.9	20%	0.201	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-62.7	158.9	177	26.6	-34.3	0	0	0	111.8	L288 L289 G291 N292 H330	L288-P311 HydrophobicContact CG-CB 4.48Å; L288-P311 CarbonylContact O-C 3.52Å; L288-P311 WeakPolarHBondContact O-CA 3.35Å; L289-P311 VanDerWaalsContact O-CB 3.32Å; L289-P311 WeakPolarHBondContact O-CB 3.19Å; G291-P311 WeakPolarHBondContact O-CD 3.4Å; N292-P311 WeakPolarHBondContact OD1-CD 3.22Å; P311-H330 PolarHBondContact O-CE1 2.78Å; P311-H330 PolarHBondContact O-ND1 3.1Å; P311-H330 VanDerWaalsContact O-ND1 3.08Å
312	L	81.7	Confident	68.5	Low	5 Å²	5	69.8 Å²	69.8	3%	0.026	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-60.6	129.2	177.7	-143	70.8	0	0	0	110.5	Y147 L151 V287 L288 F322 H330	Y147-L312 HydrophobicContact CD2-CD2 4.35Å; Y147-L312 HydrophobicContact CE1-CD2 4.41Å; Y147-L312 HydrophobicContact CE2-CD1 4.48Å; Y147-L312 HydrophobicContact CE2-CD2 3.75Å; Y147-L312 HydrophobicContact CE2-CG 3.95Å; L151-L312 HydrophobicContact CB-CD2 4.49Å; L151-L312 HydrophobicContact CD1-CB 3.93Å; L151-L312 HydrophobicContact CD1-CD2 4.17Å; V287-L312 HydrophobicContact CG1-CB 4.46Å; V287-L312 HydrophobicContact CG1-CD1 3.75Å; V287-L312 HydrophobicContact CG1-CD2 4.18Å; V287-L312 HydrophobicContact CG1-CG 4.35Å; L288-L312 PolarHBondContact O-N 2.73Å; L312-F322 HydrophobicContact CD1-CE2 4.03Å; L312-H330 HydrophobicContact CD1-CB 3.52Å
313	P	76.5	Confident	69.5	Low	42 Å²	42	72.8 Å²	72.8	27%	0.273	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-76.2	131.3	-174.4	27.5	-33.6	0	0	0	113	Y147	Y147-P313 VanDerWaalsContact OH-CD 3.32Å; Y147-P313 WeakPolarHBondContact OH-CD 3.44Å; Y147-P313 PolarHBondContact OH-O 3.42Å
314	N	69.5	Low	70.1	Confident	133 Å²	133	69.2 Å²	69.2	71%	0.711	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	132.2	174.2	-66.8	9	0	0	0	111.1
315	G	61.5	Low	70.8	Confident	61 Å²	61	75.2 Å²	75.2	63%	0.629	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.4	17.2	162.1	0	0	0	0	0	118.1
316	Q	56.4	Low	70.9	Confident	131 Å²	131	76.5 Å²	76.5	61%	0.612	41%	0.407	S	S	*	.	S	Bend	trans	-94.3	-19.7	174.1	-75.3	-167.9	-29.1	0	0	115
317	Y	56.2	Low	70.9	Confident	126 Å²	126	76.5 Å²	76.5	49%	0.494	41%	0.407	S	S	.	.			trans	-146.4	38.6	-162.2	-62.9	-69.7	0	0	0	115.4	Y147 N319 T320	Y147-Y317 HydrophobicContact CE2-CD2 4.39Å; Y317-N319 PolarHBondContact O-N 2.96Å; Y317-T320 WeakPolarHBondContact CB-OG1 3.49Å; Y317-T320 PolarHBondContact O-N 3.31Å; Y317-T320 PolarHBondContact O-OG1 2.73Å
318	E	51.9	Low	70.8	Confident	146 Å²	146	76.8 Å²	76.8	68%	0.682	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	133.9	176	-64.8	-178.2	169.6	0	0	111.8	T320	E318-T320 VanDerWaalsContact C-N 3.31Å; E318-T320 PolarHBondContact O-N 2.69Å
319	N	57.2	Low	70.7	Confident	153 Å²	153	78.5 Å²	78.5	82%	0.818	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	18.3	-178.1	-63.3	-63.2	0	0	0	117.4	D148 Y317	D148-N319 PolarHBondContact OD2-N 3.46Å; Y317-N319 PolarHBondContact O-N 2.96Å
320	T	68.5	Low	70.7	Confident	60 Å²	60	79.8 Å²	79.8	37%	0.368	42%	0.418	S	S	.	.			trans	-96	152.6	168.4	67.8	0	0	0	0	112.1	P146 Y147 Y317 E318	P146-T320 WeakPolarHBondContact CA-O 3.29Å; Y147-T320 WeakPolarHBondContact CB-O 3.14Å; Y147-T320 PolarHBondContact N-O 2.79Å; Y317-T320 WeakPolarHBondContact CB-OG1 3.49Å; Y317-T320 PolarHBondContact O-N 3.31Å; Y317-T320 PolarHBondContact O-OG1 2.73Å; E318-T320 VanDerWaalsContact C-N 3.31Å; E318-T320 PolarHBondContact O-N 2.69Å
321	T	67	Low	71	Confident	103 Å²	103	76.7 Å²	76.7	63%	0.632	40%	0.402	S	S	*	.	B	Isolated β-bridge	trans	-75	135.4	168.9	49.3	0	0	0	0	110.1	D323	T321-D323 PolarHBondContact O-N 3.23Å
322	F	71.6	Confident	71.2	Confident	8 Å²	8	75.2 Å²	75.2	4%	0.035	39%	0.392	C	S	.	.			trans	-64.3	115	175.3	175.7	-96	0	0	0	110.7	D143 R145 Y147 V150 V287 L312 F324 C327 I331	D143-F322 HydrophobicContact CB-CD1 3.95Å; D143-F322 HydrophobicContact CB-CE1 4.09Å; D143-F322 WeakPolarHBondContact O-CD1 3.35Å; D143-F322 VanDerWaalsContact O-O 3.08Å; R145-F322 PolarHBondContact O-N 2.92Å; Y147-F322 HydrophobicContact CD2-CD2 4.38Å; V150-F322 HydrophobicContact CG2-CB 4.22Å; V150-F322 HydrophobicContact CG2-CG 4.44Å; V287-F322 HydrophobicContact CG2-CE1 4.22Å; V287-F322 HydrophobicContact CG2-CE2 4.35Å; V287-F322 HydrophobicContact CG2-CZ 3.68Å; L312-F322 HydrophobicContact CD1-CE2 4.03Å; F322-F324 HydrophobicContact CE1-CB 4.26Å; F322-C327 HydrophobicContact CE2-CB 3.91Å; F322-C327 HydrophobicContact CZ-CB 4.11Å; F322-I331 HydrophobicContact CZ-CD1 4.31Å
323	D	72.4	Confident	71.6	Confident	79 Å²	79	76 Å²	76	42%	0.422	40%	0.396	S	S	.	.			trans	-95.5	104.9	170.8	175.1	22.9	0	0	0	110.8	T321 R325 S326 C327	T321-D323 PolarHBondContact O-N 3.23Å; D323-R325 PolarHBondContact O-N 3.46Å; D323-R325 VanDerWaalsContact O-N 3.1Å; D323-R325 WeakPolarHBondContact OD1-CB 3.5Å; D323-R325 PolarHBondContact OD1-N 3.08Å; D323-S326 PolarHBondContact O-N 3.17Å; D323-S326 PolarHBondContact O-OG 3.2Å; D323-S326 PolarHBondContact OD2-N 3.35Å; D323-C327 PolarHBondContact O-N 2.84Å
324	F	74.3	Confident	72.2	Confident	24 Å²	24	74.1 Å²	74.1	11%	0.105	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-44.8	-37.9	171.6	-179.5	-87.1	0	0	0	113.8	D143 D285 F322 I331 F333 I354 R355	D143-F324 WeakPolarHBondContact OD2-CB 3.5Å; D143-F324 VanDerWaalsContact OD2-CD2 3.29Å; D143-F324 WeakPolarHBondContact OD2-CD2 3.48Å; D285-F324 HydrophobicContact CB-CE2 4.5Å; F322-F324 HydrophobicContact CE1-CB 4.26Å; F324-I331 HydrophobicContact CD2-CD1 3.79Å; F324-I331 HydrophobicContact CE2-CD1 4Å; F324-I331 HydrophobicContact CE2-CG2 4.35Å; F324-I331 HydrophobicContact CG-CD1 4.14Å; F324-I331 WeakPolarHBondContact O-CD1 3.48Å; F324-F333 HydrophobicContact CE1-CE1 4.23Å; F324-F333 HydrophobicContact CZ-CD1 4.26Å; F324-F333 AromaticContact CZ-CE1 3.76Å; F324-F333 HydrophobicContact CZ-CE1 3.76Å; F324-I354 HydrophobicContact CD2-CD1 3.47Å; F324-I354 VanDerWaalsContact CD2-CD1 3.47Å; F324-I354 HydrophobicContact CE2-CD1 3.48Å; F324-I354 VanDerWaalsContact CE2-CD1 3.48Å; F324-R355 VanDerWaalsContact CG-NH2 3.32Å
325	R	68.2	Low	72.7	Confident	220 Å²	220	68 Å²	68	83%	0.83	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-29.5	-176.4	-65.3	-179.1	172.4	177.6	-2	112.7	D323	D323-R325 PolarHBondContact O-N 3.46Å; D323-R325 VanDerWaalsContact O-N 3.1Å; D323-R325 WeakPolarHBondContact OD1-CB 3.5Å; D323-R325 PolarHBondContact OD1-N 3.08Å
326	S	67.2	Low	73.9	Confident	79 Å²	79	65.1 Å²	65.1	55%	0.552	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-20.4	178.5	73.7	0	0	0	0	114.2	D323 P328	D323-S326 PolarHBondContact O-N 3.17Å; D323-S326 PolarHBondContact O-OG 3.2Å; D323-S326 PolarHBondContact OD2-N 3.35Å; S326-P328 VanDerWaalsContact O-CD 3.29Å; S326-P328 WeakPolarHBondContact O-CD 3.22Å
327	C	73.8	Confident	75.3	Confident	22 Å²	22	60.9 Å²	60.9	15%	0.149	31%	0.307	C	S	.	.			trans	-111.6	31.3	-167.4	-72.9	0	0	0	0	117.4	F322 D323 R329 H330 I331	F322-C327 HydrophobicContact CE2-CB 3.91Å; F322-C327 HydrophobicContact CZ-CB 4.11Å; D323-C327 PolarHBondContact O-N 2.84Å; C327-R329 PolarHBondContact O-N 3.36Å; C327-H330 PolarHBondContact O-N 3.17Å; C327-I331 HydrophobicContact CB-CD1 4.48Å
328	P	75.2	Confident	76.9	Confident	59 Å²	59	55.1 Å²	55.1	38%	0.383	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-14.7	-172	29	-36.6	0	0	0	114.9	K309 S326 H330 F333	K309-P328 PolarHBondContact NZ-O 3.36Å; S326-P328 VanDerWaalsContact O-CD 3.29Å; S326-P328 WeakPolarHBondContact O-CD 3.22Å; P328-H330 VanDerWaalsContact C-N 3.28Å; P328-F333 HydrophobicContact CB-CE2 4.49Å; P328-F333 HydrophobicContact CB-CZ 4.09Å
329	R	78.4	Confident	78.4	Confident	97 Å²	97	50.8 Å²	50.8	37%	0.366	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-19.1	174.1	-66.8	-175.7	178.5	-149.2	-13.3	113.8	K309 I310 C327 F588	K309-R329 VanDerWaalsContact CA-O 3.29Å; K309-R329 WeakPolarHBondContact CA-O 3.38Å; K309-R329 WeakPolarHBondContact CD-O 3.27Å; I310-R329 PolarHBondContact N-O 3.36Å; C327-R329 PolarHBondContact O-N 3.36Å; R329-F588 VanDerWaalsContact CZ-O 3.3Å; R329-F588 PolarHBondContact NH1-O 3.29Å; R329-F588 PolarHBondContact NH2-O 3.29Å
330	H	87	Confident	79.6	Confident	32 Å²	32	46.5 Å²	46.5	15%	0.148	24%	0.24	C	C	.	.	S	Bend	trans	-105.5	-1.3	-178.9	-50.2	-67.4	0	0	0	111.9	V287 L288 I310 P311 L312 C327 P328	V287-H330 CarbonylContact C-O 3.55Å; V287-H330 WeakPolarHBondContact CA-O 3.3Å; L288-H330 PolarHBondContact N-O 3.35Å; I310-H330 WeakPolarHBondContact O-CA 3.18Å; I310-H330 PolarHBondContact O-ND1 3.29Å; P311-H330 PolarHBondContact O-CE1 2.78Å; P311-H330 PolarHBondContact O-ND1 3.1Å; P311-H330 VanDerWaalsContact O-ND1 3.08Å; L312-H330 HydrophobicContact CD1-CB 3.52Å; C327-H330 PolarHBondContact O-N 3.17Å; P328-H330 VanDerWaalsContact C-N 3.28Å
331	I	89.9	Confident	80.3	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	129.4	-175.5	-59.9	165.3	0	0	0	110.3	A286 V287 K309 F322 F324 C327 F333	A286-I331 CarbonylContact O-C 3.56Å; A286-I331 WeakPolarHBondContact O-CA 3.42Å; V287-I331 HydrophobicContact CG2-CG1 4.19Å; K309-I331 WeakPolarHBondContact CD-O 3.34Å; K309-I331 WeakPolarHBondContact CE-O 3.25Å; K309-I331 PolarHBondContact NZ-O 3.17Å; F322-I331 HydrophobicContact CZ-CD1 4.31Å; F324-I331 HydrophobicContact CD2-CD1 3.79Å; F324-I331 HydrophobicContact CE2-CD1 4Å; F324-I331 HydrophobicContact CE2-CG2 4.35Å; F324-I331 HydrophobicContact CG-CD1 4.14Å; F324-I331 WeakPolarHBondContact O-CD1 3.48Å; C327-I331 HydrophobicContact CB-CD1 4.48Å; I331-F333 HydrophobicContact CB-CE1 4.09Å; I331-F333 HydrophobicContact CB-CZ 4.05Å; I331-F333 HydrophobicContact CG2-CD1 3.62Å; I331-F333 HydrophobicContact CG2-CE1 3.46Å; I331-F333 VanDerWaalsContact CG2-CE1 3.46Å; I331-F333 HydrophobicContact CG2-CE2 4.47Å; I331-F333 HydrophobicContact CG2-CG 4.2Å; I331-F333 HydrophobicContact CG2-CZ 3.92Å
332	L	91.7	Very high	80.6	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	112.5	165.9	-55.7	176.9	0	0	0	107.6	I275 M282 D285 A286 L288 C293 V295 K309 A351	I275-L332 HydrophobicContact CD1-CD1 4.01Å; I275-L332 HydrophobicContact CG1-CD1 4.09Å; M282-L332 HydrophobicContact CE-CB 3.65Å; M282-L332 HydrophobicContact CE-CD1 4.15Å; M282-L332 HydrophobicContact CG-CB 4.17Å; M282-L332 HydrophobicContact SD-CB 4.05Å; M282-L332 HydrophobicContact SD-CD1 4.05Å; D285-L332 CarbonylContact C-O 3.58Å; D285-L332 WeakPolarHBondContact CA-O 3.42Å; A286-L332 PolarHBondContact N-O 3.26Å; A286-L332 PolarHBondContact O-N 2.8Å; L288-L332 HydrophobicContact CD1-CD1 4.42Å; C293-L332 HydrophobicContact CB-CD2 3.94Å; V295-L332 HydrophobicContact CG2-CD2 3.64Å; K309-L332 HydrophobicContact CB-CD2 4.13Å; K309-L332 HydrophobicContact CG-CD2 4Å; L332-A351 HydrophobicContact CD1-CB 4.14Å
333	F	89.8	Confident	80.5	Confident	22 Å²	22	45.3 Å²	45.3	10%	0.096	24%	0.235	C	C	.	.			trans	-87.4	148.6	-175.9	-58.9	-75.1	0	0	0	113.5	M282 E297 L300 F324 P328 I331 G335 T336	M282-F333 WeakPolarHBondContact CB-O 3.3Å; E297-F333 WeakPolarHBondContact OE1-CD2 3.46Å; L300-F333 HydrophobicContact CD2-CB 3.54Å; L300-F333 HydrophobicContact CD2-CD1 4.49Å; L300-F333 HydrophobicContact CD2-CD2 4.18Å; L300-F333 HydrophobicContact CD2-CG 3.85Å; F324-F333 HydrophobicContact CE1-CE1 4.23Å; F324-F333 HydrophobicContact CZ-CD1 4.26Å; F324-F333 AromaticContact CZ-CE1 3.76Å; F324-F333 HydrophobicContact CZ-CE1 3.76Å; P328-F333 HydrophobicContact CB-CE2 4.49Å; P328-F333 HydrophobicContact CB-CZ 4.09Å; I331-F333 HydrophobicContact CB-CE1 4.09Å; I331-F333 HydrophobicContact CB-CZ 4.05Å; I331-F333 HydrophobicContact CG2-CD1 3.62Å; I331-F333 HydrophobicContact CG2-CE1 3.46Å; I331-F333 VanDerWaalsContact CG2-CE1 3.46Å; I331-F333 HydrophobicContact CG2-CE2 4.47Å; I331-F333 HydrophobicContact CG2-CG 4.2Å; I331-F333 HydrophobicContact CG2-CZ 3.92Å; F333-G335 PolarHBondContact O-N 3.02Å; F333-T336 HydrophobicContact CB-CG2 3.99Å; F333-T336 PolarHBondContact O-N 3.48Å; F333-T336 PolarHBondContact O-OG1 3.44Å
334	S	87.6	Confident	80.1	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.014	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	130.7	172.9	-176	0	0	0	0	111.2	C284 D285 K362	C284-S334 WeakPolarHBondContact O-CA 3.03Å; C284-S334 PolarHBondContact O-N 3.2Å; D285-S334 VanDerWaalsContact OD1-CB 3.25Å; D285-S334 WeakPolarHBondContact OD1-CB 3.13Å; D285-S334 PolarHBondContact OD1-N 2.7Å; S334-K362 WeakPolarHBondContact O-CB 3.32Å
335	G	81.2	Confident	79.5	Confident	4 Å²	4	53 Å²	53	4%	0.041	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	94.5	-13.6	-178.4	0	0	0	0	0	115.3	M282 S299 F333	M282-G335 PolarHBondContact O-N 3.31Å; S299-G335 WeakPolarHBondContact CB-O 3.39Å; S299-G335 PolarHBondContact OG-O 3.22Å; F333-G335 PolarHBondContact O-N 3.02Å
336	T	85.6	Confident	79.4	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-83.6	151.9	176.5	71.7	0	0	0	0	110.8	M282 V295 N296 E297 L300 F333	M282-T336 WeakPolarHBondContact CB-O 3.16Å; M282-T336 PolarHBondContact N-O 3.06Å; V295-T336 VanDerWaalsContact CG1-OG1 3.28Å; V295-T336 WeakPolarHBondContact CG1-OG1 3.48Å; N296-T336 WeakPolarHBondContact O-CB 3.27Å; E297-T336 HydrophobicContact CB-CG2 3.91Å; E297-T336 HydrophobicContact CG-CG2 3.94Å; L300-T336 HydrophobicContact CB-CG2 4.13Å; L300-T336 HydrophobicContact CD2-CG2 4.43Å; F333-T336 HydrophobicContact CB-CG2 3.99Å; F333-T336 PolarHBondContact O-N 3.48Å; F333-T336 PolarHBondContact O-OG1 3.44Å
337	S	86.1	Confident	79.7	Confident	43 Å²	43	52 Å²	52	30%	0.301	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	120.1	175.3	51.3	0	0	0	0	110.8	V295 N296 I339	V295-S337 CarbonylContact C-O 3.58Å; V295-S337 WeakPolarHBondContact CA-O 3.42Å; N296-S337 PolarHBondContact N-O 2.77Å; N296-S337 PolarHBondContact O-N 3.29Å; N296-S337 VanDerWaalsContact O-N 3.11Å; S337-I339 PolarHBondContact O-N 2.77Å
338	V	89.3	Confident	80.1	Confident	4 Å²	4	57.5 Å²	57.5	2%	0.024	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	120.3	162.5	-175.1	0	0	0	0	106.8	I275 G279 C280 M282 C293 I294 V295 T341	I275-V338 HydrophobicContact CG2-CB 4.27Å; I275-V338 HydrophobicContact CG2-CG1 3.92Å; I275-V338 HydrophobicContact CG2-CG2 4.09Å; G279-V338 CarbonylContact C-O 3.59Å; G279-V338 WeakPolarHBondContact CA-O 3.45Å; C280-V338 PolarHBondContact N-O 3.47Å; C280-V338 PolarHBondContact O-N 3Å; M282-V338 HydrophobicContact CG-CG2 4.08Å; M282-V338 HydrophobicContact SD-CG2 4.13Å; C293-V338 HydrophobicContact CB-CG1 4.12Å; I294-V338 CarbonylContact O-C 3.58Å; I294-V338 WeakPolarHBondContact O-CA 3.39Å; V295-V338 HydrophobicContact CG2-CG2 4.27Å; V338-T341 HydrophobicContact CG1-CG2 4.02Å
339	I	84.7	Confident	80.8	Confident	55 Å²	55	55 Å²	55	28%	0.282	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	-50.9	177.1	-56.1	175.6	0	0	0	109.3	G279 I294 N296 P306 S337 I522	G279-I339 WeakPolarHBondContact CA-O 3.37Å; I294-I339 HydrophobicContact CG2-CB 4.42Å; I294-I339 HydrophobicContact CG2-CD1 4.2Å; I294-I339 PolarHBondContact O-N 2.92Å; N296-I339 HydrophobicContact CB-CD1 4.12Å; N296-I339 HydrophobicContact CB-CG1 4.24Å; P306-I339 HydrophobicContact CB-CD1 3.88Å; S337-I339 PolarHBondContact O-N 2.77Å; I339-I522 HydrophobicContact CD1-CD1 4.15Å; I339-I522 HydrophobicContact CG2-CG2 3.83Å
340	Q	82.7	Confident	81.4	Confident	63 Å²	63	52 Å²	52	29%	0.294	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	148	-173	-165.1	-170.2	28.4	0	0	109.4	I294	I294-Q340 PolarHBondContact N-O 3.4Å
341	T	83.1	Confident	81.7	Confident	20 Å²	20	50.5 Å²	50.5	12%	0.123	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	150.9	166.7	69.4	0	0	0	0	111.2	I275 P276 S277 N292 V338 V349	I275-T341 HydrophobicContact CB-CG2 3.95Å; I275-T341 HydrophobicContact CG2-CG2 3.45Å; I275-T341 VanDerWaalsContact CG2-CG2 3.45Å; P276-T341 WeakPolarHBondContact O-CG2 3.42Å; S277-T341 WeakPolarHBondContact CA-OG1 3.28Å; N292-T341 WeakPolarHBondContact O-CA 3.36Å; V338-T341 HydrophobicContact CG1-CG2 4.02Å; T341-V349 HydrophobicContact CG2-CB 4.32Å; T341-V349 HydrophobicContact CG2-CG1 4.19Å; T341-V349 HydrophobicContact CG2-CG2 4.44Å
342	R	73.6	Confident	81.8	Confident	75 Å²	75	50.5 Å²	50.5	28%	0.283	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	121.4	179.8	-64.2	-178.4	175.8	-159.7	-5.5	109.4	N292 E545	N292-R342 HydrophobicContact CB-CB 4.3Å; N292-R342 PolarHBondContact N-O 2.74Å; N292-R342 PolarHBondContact O-N 3.12Å; R342-E545 IonicContact CZ-OE1 2.74Å; R342-E545 VanDerWaalsContact CZ-OE1 3.3Å; R342-E545 IonicContact CZ-OE2 3.02Å; R342-E545 IonicContact NH1-OE1 3.43Å; R342-E545 PolarHBondContact NH1-OE1 3.04Å; R342-E545 IonicContact NH1-OE2 3.3Å; R342-E545 VanDerWaalsContact NH2-CD 3.25Å; R342-E545 IonicContact NH2-OE1 3.52Å; R342-E545 PolarHBondContact NH2-OE1 2.92Å; R342-E545 IonicContact NH2-OE2 3.87Å; R342-E545 PolarHBondContact NH2-OE2 3.22Å
343	G	68.3	Low	81.9	Confident	51 Å²	51	50.5 Å²	50.5	53%	0.526	26%	0.26	S	S	.	.	S	Bend	trans	-174.4	173.3	179	0	0	0	0	0	110.9	I345	G343-I345 PolarHBondContact O-N 2.98Å
344	D	65	Low	82	Confident	96 Å²	96	49.5 Å²	49.5	51%	0.513	26%	0.256	S	S	.	.			trans	-52.6	133.3	176.1	-56.4	-14.4	0	0	0	110.2	N346 K347	D344-N346 PolarHBondContact O-N 3.5Å; D344-K347 HydrophobicContact CB-CB 4.23Å; D344-K347 HydrophobicContact CB-CD 4.19Å; D344-K347 HydrophobicContact CB-CG 4.22Å; D344-K347 PolarHBondContact O-N 3.31Å; D344-K347 WeakPolarHBondContact OD2-CD 3.44Å; D344-K347 VanDerWaalsContact OD2-CE 3.29Å; D344-K347 WeakPolarHBondContact OD2-CE 3.36Å; D344-K347 IonicContact OD2-NZ 3.8Å; D344-K347 PolarHBondContact OD2-NZ 3.14Å
345	I	61	Low	82.1	Confident	168 Å²	168	51.2 Å²	51.2	86%	0.862	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-32.6	-177	-62.9	169.2	0	0	0	112.2	G343	G343-I345 PolarHBondContact O-N 2.98Å
346	N	66.7	Low	82.6	Confident	160 Å²	160	51.3 Å²	51.3	86%	0.856	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	1.8	-178.6	-66.5	-23.2	0	0	0	114.9	D344	D344-N346 PolarHBondContact O-N 3.5Å
347	K	72.6	Confident	82.8	Confident	118 Å²	118	51.6 Å²	51.6	51%	0.513	27%	0.265	S	S	.	.	S	Bend	trans	-124.3	128.8	-178.8	-64.6	178.2	-168.8	151.4	0	111.5	M290 D344	M290-K347 HydrophobicContact CE-CB 4.31Å; M290-K347 HydrophobicContact CE-CD 3.84Å; M290-K347 HydrophobicContact CE-CG 4.44Å; D344-K347 HydrophobicContact CB-CB 4.23Å; D344-K347 HydrophobicContact CB-CD 4.19Å; D344-K347 HydrophobicContact CB-CG 4.22Å; D344-K347 PolarHBondContact O-N 3.31Å; D344-K347 WeakPolarHBondContact OD2-CD 3.44Å; D344-K347 VanDerWaalsContact OD2-CE 3.29Å; D344-K347 WeakPolarHBondContact OD2-CE 3.36Å; D344-K347 IonicContact OD2-NZ 3.8Å; D344-K347 PolarHBondContact OD2-NZ 3.14Å
348	R	82.8	Confident	82.8	Confident	138 Å²	138	50.7 Å²	50.7	52%	0.521	26%	0.256	S	S	.	.			trans	-69.6	143	174.2	-63.4	-178.1	-178.4	-177.1	0.9	110.2	F259 L350	F259-R348 VanDerWaalsContact CD2-NH1 3.3Å; R348-L350 HydrophobicContact CB-CD2 4.22Å
349	V	88.9	Confident	82.7	Confident	8 Å²	8	52.5 Å²	52.5	5%	0.048	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	120.8	171.1	176.3	0	0	0	0	108.3	A274 I275 L288 M290 T341	A274-V349 WeakPolarHBondContact CA-O 3.36Å; I275-V349 HydrophobicContact CB-CB 4.47Å; I275-V349 HydrophobicContact CB-CG1 4.19Å; I275-V349 HydrophobicContact CG1-CG1 4.41Å; I275-V349 PolarHBondContact N-O 3.47Å; L288-V349 HydrophobicContact CD1-CG1 3.82Å; M290-V349 CarbonylContact O-C 3.52Å; M290-V349 VanDerWaalsContact O-CA 3.27Å; M290-V349 WeakPolarHBondContact O-CA 3.36Å; M290-V349 VanDerWaalsContact O-CG1 3.25Å; M290-V349 WeakPolarHBondContact O-CG1 3.4Å; T341-V349 HydrophobicContact CG2-CB 4.32Å; T341-V349 HydrophobicContact CG2-CG1 4.19Å; T341-V349 HydrophobicContact CG2-CG2 4.44Å
350	L	91.5	Very high	82.8	Confident	33 Å²	33	49.9 Å²	49.9	17%	0.173	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	139	-170.5	-61.4	178.7	0	0	0	111.2	F259 I273 A274 L289 M290 R348	F259-L350 HydrophobicContact CE1-CD2 3.85Å; F259-L350 HydrophobicContact CZ-CD2 3.81Å; I273-L350 WeakPolarHBondContact O-CA 3.21Å; A274-L350 HydrophobicContact CB-CD2 4.07Å; L289-L350 PolarHBondContact N-O 3.26Å; M290-L350 HydrophobicContact CB-CB 4.35Å; M290-L350 PolarHBondContact N-O 3.19Å; M290-L350 VanDerWaalsContact N-O 3.13Å; M290-L350 PolarHBondContact O-N 3.01Å; M290-L350 HydrophobicContact SD-CD1 4.26Å; R348-L350 HydrophobicContact CB-CD2 4.22Å
351	A	92.9	Very high	82.7	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	154.8	172.2	0	0	0	0	0	110.7	I273 A286 V287 L288 L332	I273-A351 HydrophobicContact CD1-CB 4.46Å; I273-A351 HydrophobicContact CG1-CB 4.02Å; I273-A351 WeakPolarHBondContact CG1-O 3.32Å; I273-A351 PolarHBondContact N-O 2.87Å; I273-A351 PolarHBondContact O-N 3.33Å; A286-A351 HydrophobicContact CB-CB 4.1Å; V287-A351 CarbonylContact O-C 3.57Å; V287-A351 WeakPolarHBondContact O-CA 3.32Å; V287-A351 VanDerWaalsContact O-CB 3.27Å; V287-A351 WeakPolarHBondContact O-CB 3.44Å; L288-A351 HydrophobicContact CD1-CB 4.38Å; L332-A351 HydrophobicContact CD1-CB 4.14Å
352	V	93.2	Very high	82.5	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	129.8	175	60.3	0	0	0	0	110.7	W142 V150 A153 D271 A286 V287 L289 I354	W142-V352 HydrophobicContact CH2-CG2 3.94Å; W142-V352 HydrophobicContact CZ3-CG2 4.11Å; V150-V352 HydrophobicContact CG1-CG1 4.19Å; A153-V352 HydrophobicContact CB-CB 4.27Å; A153-V352 HydrophobicContact CB-CG2 3.79Å; D271-V352 WeakPolarHBondContact O-CA 3.45Å; A286-V352 CarbonylContact C-O 3.41Å; A286-V352 WeakPolarHBondContact CA-O 3.45Å; A286-V352 WeakPolarHBondContact CB-O 3.44Å; V287-V352 HydrophobicContact CB-CG1 3.97Å; V287-V352 PolarHBondContact N-O 2.72Å; V287-V352 PolarHBondContact O-N 2.74Å; L289-V352 HydrophobicContact CD1-CB 3.97Å; L289-V352 HydrophobicContact CD1-CG1 3.99Å; L289-V352 HydrophobicContact CD2-CG1 4.17Å; L289-V352 HydrophobicContact CG-CG1 4.15Å; V352-I354 PolarHBondContact O-N 2.97Å
353	V	93.7	Very high	82.9	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	129.3	177.9	179.9	0	0	0	0	109.8	P269 G270 D271 I273 C284 T356	P269-V353 CarbonylContact C-O 3.46Å; G270-V353 PolarHBondContact N-O 3.03Å; D271-V353 HydrophobicContact CB-CB 4.39Å; D271-V353 HydrophobicContact CB-CG2 4.03Å; D271-V353 WeakPolarHBondContact O-CG2 3.26Å; D271-V353 PolarHBondContact O-N 2.99Å; I273-V353 HydrophobicContact CD1-CG2 4.32Å; I273-V353 HydrophobicContact CG2-CG2 3.85Å; C284-V353 HydrophobicContact CB-CG1 3.95Å; V353-T356 HydrophobicContact CG1-CG2 3.68Å
354	I	91	Very high	83.3	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	-35.7	179.1	50.9	159.4	0	0	0	113.2	W142 D143 D285 V287 F324 V352	W142-I354 HydrophobicContact CE3-CB 4.49Å; W142-I354 HydrophobicContact CE3-CG2 3.9Å; W142-I354 HydrophobicContact CZ3-CG2 3.93Å; D143-I354 HydrophobicContact CB-CB 4.35Å; D285-I354 HydrophobicContact CB-CD1 4.36Å; D285-I354 HydrophobicContact CB-CG1 4.09Å; D285-I354 WeakPolarHBondContact O-CG1 3.36Å; D285-I354 PolarHBondContact O-N 3.31Å; V287-I354 HydrophobicContact CB-CG2 4.41Å; V287-I354 HydrophobicContact CG2-CD1 3.82Å; V287-I354 HydrophobicContact CG2-CG1 4.2Å; V287-I354 HydrophobicContact CG2-CG2 3.65Å; F324-I354 HydrophobicContact CD2-CD1 3.47Å; F324-I354 VanDerWaalsContact CD2-CD1 3.47Å; F324-I354 HydrophobicContact CE2-CD1 3.48Å; F324-I354 VanDerWaalsContact CE2-CD1 3.48Å; V352-I354 PolarHBondContact O-N 2.97Å
355	R	90.5	Very high	83.6	Confident	37 Å²	37	42.5 Å²	42.5	14%	0.14	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	146.3	179.7	-54.8	-177.9	178.3	-176.2	0.5	111.3	D143 C284 D285 F324 M359 T360	D143-R355 IonicContact OD1-NH2 3.28Å; D143-R355 IonicContact OD2-CZ 2.68Å; D143-R355 IonicContact OD2-NE 3.36Å; D143-R355 PolarHBondContact OD2-NE 2.91Å; D143-R355 IonicContact OD2-NH2 3.73Å; D143-R355 PolarHBondContact OD2-NH2 3.32Å; C284-R355 WeakPolarHBondContact CB-O 3.49Å; D285-R355 HydrophobicContact CB-CB 4.08Å; D285-R355 PolarHBondContact N-O 3.44Å; D285-R355 VanDerWaalsContact N-O 3.16Å; D285-R355 PolarHBondContact O-N 3.47Å; F324-R355 VanDerWaalsContact CG-NH2 3.32Å; R355-M359 HydrophobicContact CB-CB 4.3Å; R355-M359 WeakPolarHBondContact CD-O 3.35Å; R355-T360 HydrophobicContact CB-CG2 4.22Å; R355-T360 VanDerWaalsContact O-CG2 3.31Å; R355-T360 WeakPolarHBondContact O-CG2 3.1Å
356	T	91.9	Very high	84.4	Confident	7 Å²	7	34.7 Å²	34.7	4%	0.043	17%	0.165	C	C	.	.			trans	-136.3	156.5	-177.2	57.5	0	0	0	0	112.3	N171 P269 C284 V353 F358 M359	N171-T356 HydrophobicContact CB-CG2 4.06Å; N171-T356 WeakPolarHBondContact OD1-CA 3.39Å; N171-T356 VanDerWaalsContact OD1-CB 3.31Å; N171-T356 WeakPolarHBondContact OD1-CB 3.35Å; P269-T356 HydrophobicContact CG-CG2 4.36Å; C284-T356 HydrophobicContact CB-CG2 4.48Å; V353-T356 HydrophobicContact CG1-CG2 3.68Å; T356-F358 PolarHBondContact O-N 3.12Å; T356-M359 WeakPolarHBondContact O-CB 3.47Å; T356-M359 PolarHBondContact O-N 2.98Å; T356-M359 VanDerWaalsContact O-N 3.08Å
357	G	88.5	Confident	84.9	Confident	5 Å²	5	27.6 Å²	27.6	5%	0.052	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	58.4	-126.6	173.7	0	0	0	0	0	113.5	N171 M359 T360 G363	N171-G357 PolarHBondContact OD1-N 2.61Å; G357-M359 PolarHBondContact O-N 2.68Å; G357-T360 PolarHBondContact O-N 3.4Å; G357-T360 PolarHBondContact O-OG1 3.42Å; G357-G363 WeakPolarHBondContact O-CA 3.35Å
358	F	86.5	Confident	84.6	Confident	25 Å²	25	22.4 Å²	22.4	11%	0.11	11%	0.105	C	C	.	.	G	3₁₀ helix	trans	-75.2	-2.1	179.7	-72.5	-76.9	0	0	0	114.3	K124 I173 T356 V366 R367 M370	K124-F358 HydrophobicContact CB-CB 4.31Å; K124-F358 HydrophobicContact CB-CD1 4.04Å; K124-F358 HydrophobicContact CB-CD2 3.76Å; K124-F358 HydrophobicContact CB-CE1 4.32Å; K124-F358 HydrophobicContact CB-CE2 4.07Å; K124-F358 HydrophobicContact CB-CG 3.75Å; K124-F358 HydrophobicContact CB-CZ 4.34Å; K124-F358 HydrophobicContact CD-CD2 4.31Å; K124-F358 HydrophobicContact CD-CE2 3.78Å; K124-F358 HydrophobicContact CD-CZ 3.96Å; K124-F358 HydrophobicContact CG-CD1 4.44Å; K124-F358 HydrophobicContact CG-CD2 4.32Å; K124-F358 HydrophobicContact CG-CE1 4.24Å; K124-F358 HydrophobicContact CG-CE2 4.11Å; K124-F358 HydrophobicContact CG-CG 4.49Å; K124-F358 HydrophobicContact CG-CZ 4.06Å; I173-F358 HydrophobicContact CB-CE1 4.5Å; I173-F358 HydrophobicContact CB-CZ 4.43Å; I173-F358 HydrophobicContact CG2-CD1 4.07Å; I173-F358 HydrophobicContact CG2-CE1 3.45Å; I173-F358 VanDerWaalsContact CG2-CE1 3.45Å; I173-F358 HydrophobicContact CG2-CE2 4.5Å; I173-F358 HydrophobicContact CG2-CZ 3.71Å; T356-F358 PolarHBondContact O-N 3.12Å; F358-V366 HydrophobicContact CE1-CG1 4.32Å; F358-R367 HydrophobicContact CD1-CB 4.4Å; F358-R367 PolarHBondContact O-NH1 3.35Å; F358-M370 HydrophobicContact CD1-CE 4.32Å; F358-M370 HydrophobicContact CE1-CE 3.39Å; F358-M370 HydrophobicContact CZ-CE 3.87Å
359	M	86.9	Confident	83.9	Confident	41 Å²	41	17.6 Å²	17.6	20%	0.202	9%	0.089	C	C	.	.	G	3₁₀ helix	trans	-89.3	-17.1	175.7	-53.9	-54.2	-70.2	0	0	112.9	L125 N141 R355 T356 G357	L125-M359 HydrophobicContact CD2-CE 4.01Å; L125-M359 HydrophobicContact CD2-SD 3.27Å; L125-M359 WeakPolarHBondContact CD2-SD 3.31Å; N141-M359 WeakPolarHBondContact OD1-CE 3.39Å; R355-M359 HydrophobicContact CB-CB 4.3Å; R355-M359 WeakPolarHBondContact CD-O 3.35Å; T356-M359 WeakPolarHBondContact O-CB 3.47Å; T356-M359 PolarHBondContact O-N 2.98Å; T356-M359 VanDerWaalsContact O-N 3.08Å; G357-M359 PolarHBondContact O-N 2.68Å
360	T	87.4	Confident	83.1	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.097	C	C	.	.	S	Bend	trans	-69.6	162	178.6	65.2	0	0	0	0	111.8	D285 R355 G357 K362 G363 E364	D285-T360 WeakPolarHBondContact OD1-CB 3.21Å; D285-T360 WeakPolarHBondContact OD2-CA 3.5Å; D285-T360 WeakPolarHBondContact OD2-CB 3.23Å; R355-T360 HydrophobicContact CB-CG2 4.22Å; R355-T360 VanDerWaalsContact O-CG2 3.31Å; R355-T360 WeakPolarHBondContact O-CG2 3.1Å; G357-T360 PolarHBondContact O-N 3.4Å; G357-T360 PolarHBondContact O-OG1 3.42Å; T360-K362 VanDerWaalsContact C-N 3.26Å; T360-K362 PolarHBondContact O-N 3.2Å; T360-G363 CarbonylContact O-C 3.42Å; T360-G363 WeakPolarHBondContact O-CA 3.09Å; T360-G363 PolarHBondContact O-N 2.84Å; T360-G363 PolarHBondContact OG1-N 3.41Å; T360-E364 PolarHBondContact O-N 3.18Å
361	T	80.8	Confident	82.1	Confident	39 Å²	39	20.8 Å²	20.8	24%	0.239	10%	0.102	C	C	.	.	H	α-helix	trans	-57.2	-39.7	175.5	-45.7	0	0	0	0	112	D285 L300 E364 L365	D285-T361 PolarHBondContact OD2-N 3.44Å; D285-T361 PolarHBondContact OD2-OG1 2.86Å; L300-T361 HydrophobicContact CD1-CG2 4.1Å; L300-T361 HydrophobicContact CD2-CG2 3.88Å; L300-T361 HydrophobicContact CG-CG2 4.28Å; T361-E364 PolarHBondContact O-N 3.2Å; T361-L365 PolarHBondContact O-N 2.65Å; T361-L365 VanDerWaalsContact O-N 3.08Å
362	K	79.6	Confident	80.5	Confident	10 Å²	10	24.1 Å²	24.1	4%	0.043	12%	0.124	C	C	.	.	H	α-helix	trans	-65.9	-40.4	170.7	178.8	161	-177	153.6	0	112.8	I173 L300 S334 T360 E364 L365 V366 E994	I173-K362 HydrophobicContact CD1-CG 4.03Å; L300-K362 HydrophobicContact CD1-CB 4.22Å; S334-K362 WeakPolarHBondContact O-CB 3.32Å; T360-K362 VanDerWaalsContact C-N 3.26Å; T360-K362 PolarHBondContact O-N 3.2Å; K362-E364 VanDerWaalsContact C-N 3.34Å; K362-E364 PolarHBondContact O-N 2.99Å; K362-L365 PolarHBondContact O-N 3.08Å; K362-V366 WeakPolarHBondContact O-CG2 3.48Å; K362-V366 PolarHBondContact O-N 3.05Å; K362-E994 WeakPolarHBondContact CE-OE2 3.14Å; K362-E994 IonicContact NZ-OE1 3.8Å; K362-E994 PolarHBondContact NZ-OE1 3Å; K362-E994 IonicContact NZ-OE2 2.93Å; K362-E994 PolarHBondContact NZ-OE2 2.84Å
363	G	81.3	Confident	78.9	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-61.2	-39.8	175.6	0	0	0	0	0	113.5	G357 T360 R367	G357-G363 WeakPolarHBondContact O-CA 3.35Å; T360-G363 CarbonylContact O-C 3.42Å; T360-G363 WeakPolarHBondContact O-CA 3.09Å; T360-G363 PolarHBondContact O-N 2.84Å; T360-G363 PolarHBondContact OG1-N 3.41Å; G363-R367 WeakPolarHBondContact O-CB 3.19Å; G363-R367 PolarHBondContact O-N 3.07Å
364	E	77.7	Confident	77.1	Confident	75 Å²	75	32.5 Å²	32.5	35%	0.35	17%	0.166	S	C	.	.	H	α-helix	trans	-64.5	-48.5	172.7	176.4	158	-143.8	0	0	111.3	T360 T361 K362 V366 R367 S368	T360-E364 PolarHBondContact O-N 3.18Å; T361-E364 PolarHBondContact O-N 3.2Å; K362-E364 VanDerWaalsContact C-N 3.34Å; K362-E364 PolarHBondContact O-N 2.99Å; E364-V366 VanDerWaalsContact C-N 3.31Å; E364-V366 PolarHBondContact O-N 3.3Å; E364-R367 PolarHBondContact O-N 3.43Å; E364-R367 IonicContact OE1-NH2 2.7Å; E364-R367 PolarHBondContact OE1-NH2 2.82Å; E364-S368 WeakPolarHBondContact O-CB 3.42Å; E364-S368 PolarHBondContact O-N 2.88Å
365	L	71.2	Confident	75.4	Confident	26 Å²	26	35.9 Å²	35.9	14%	0.136	18%	0.182	C	C	.	.	H	α-helix	trans	-57.8	-40.2	175.9	-175.6	138.4	0	0	0	112.5	T361 K362 S368 I369	T361-L365 PolarHBondContact O-N 2.65Å; T361-L365 VanDerWaalsContact O-N 3.08Å; K362-L365 PolarHBondContact O-N 3.08Å; L365-S368 WeakPolarHBondContact O-CB 3.25Å; L365-S368 PolarHBondContact O-N 3.46Å; L365-S368 PolarHBondContact O-OG 3.02Å; L365-I369 HydrophobicContact CD2-CD1 3.73Å; L365-I369 HydrophobicContact CG-CD1 4.47Å; L365-I369 WeakPolarHBondContact O-CD1 3.43Å; L365-I369 WeakPolarHBondContact O-CG1 3.45Å; L365-I369 PolarHBondContact O-N 2.84Å; L365-I369 VanDerWaalsContact O-N 3.12Å
366	V	76.2	Confident	73.6	Confident	4 Å²	4	42 Å²	42	2%	0.024	21%	0.21	C	C	.	.	H	α-helix	trans	-71.4	-41.8	175.5	173.3	0	0	0	0	112.6	I173 V175 V241 F358 K362 E364 S368 I369 M370	I173-V366 HydrophobicContact CG2-CB 4.03Å; I173-V366 HydrophobicContact CG2-CG1 3.7Å; I173-V366 HydrophobicContact CG2-CG2 4.31Å; V175-V366 HydrophobicContact CG2-CG1 4.41Å; V241-V366 HydrophobicContact CG1-CB 4.47Å; V241-V366 HydrophobicContact CG1-CG1 3.78Å; V241-V366 HydrophobicContact CG1-CG2 3.93Å; V241-V366 HydrophobicContact CG2-CG1 4.08Å; V241-V366 HydrophobicContact CG2-CG2 3.81Å; F358-V366 HydrophobicContact CE1-CG1 4.32Å; K362-V366 WeakPolarHBondContact O-CG2 3.48Å; K362-V366 PolarHBondContact O-N 3.05Å; E364-V366 VanDerWaalsContact C-N 3.31Å; E364-V366 PolarHBondContact O-N 3.3Å; V366-S368 PolarHBondContact O-N 3.39Å; V366-I369 PolarHBondContact O-N 3.45Å; V366-I369 VanDerWaalsContact O-N 3.13Å; V366-M370 HydrophobicContact CG1-CE 4.25Å; V366-M370 PolarHBondContact O-N 2.93Å
367	R	78	Confident	72	Confident	12 Å²	12	43 Å²	43	5%	0.045	21%	0.214	C	C	.	.	H	α-helix	trans	-57.8	-43.1	173.3	178.5	177	66.1	-121.1	6.6	110.4	E20 K123 L125 F358 G363 E364 I369 M370 F371	E20-R367 IonicContact OE1-CZ 2.98Å; E20-R367 IonicContact OE1-NE 2.82Å; E20-R367 PolarHBondContact OE1-NE 3.13Å; E20-R367 IonicContact OE1-NH2 2.73Å; E20-R367 PolarHBondContact OE1-NH2 3.05Å; K123-R367 HydrophobicContact CB-CG 4.46Å; K123-R367 WeakPolarHBondContact O-CD 3.31Å; K123-R367 VanDerWaalsContact O-CG 3.29Å; K123-R367 WeakPolarHBondContact O-CG 3.46Å; L125-R367 VanDerWaalsContact CD2-NH1 3.28Å; F358-R367 HydrophobicContact CD1-CB 4.4Å; F358-R367 PolarHBondContact O-NH1 3.35Å; G363-R367 WeakPolarHBondContact O-CB 3.19Å; G363-R367 PolarHBondContact O-N 3.07Å; E364-R367 PolarHBondContact O-N 3.43Å; E364-R367 IonicContact OE1-NH2 2.7Å; E364-R367 PolarHBondContact OE1-NH2 2.82Å; R367-I369 VanDerWaalsContact C-N 3.31Å; R367-I369 PolarHBondContact O-N 2.76Å; R367-M370 PolarHBondContact O-N 2.85Å; R367-F371 HydrophobicContact CG-CD2 3.87Å; R367-F371 HydrophobicContact CG-CE2 4.34Å; R367-F371 WeakPolarHBondContact O-CD2 3.48Å; R367-F371 PolarHBondContact O-N 3.47Å
368	S	66.6	Low	70.8	Confident	9 Å²	9	47.4 Å²	47.4	6%	0.063	23%	0.232	C	C	.	.	H	α-helix	trans	-54.1	-40.4	173.3	147.3	0	0	0	0	113.5	E364 L365 V366 K982	E364-S368 WeakPolarHBondContact O-CB 3.42Å; E364-S368 PolarHBondContact O-N 2.88Å; L365-S368 WeakPolarHBondContact O-CB 3.25Å; L365-S368 PolarHBondContact O-N 3.46Å; L365-S368 PolarHBondContact O-OG 3.02Å; V366-S368 PolarHBondContact O-N 3.39Å; S368-K982 WeakPolarHBondContact OG-CD 3.4Å; S368-K982 WeakPolarHBondContact OG-CE 3.46Å; S368-K982 PolarHBondContact OG-NZ 2.87Å
369	I	68.5	Low	69.8	Low	36 Å²	36	46.5 Å²	46.5	19%	0.185	23%	0.228	C	C	.	.	H	α-helix	trans	-74.9	-39.8	175.3	-67.9	153.7	0	0	0	112.1	L237 L365 V366 R367 I997 A998	L237-I369 HydrophobicContact CD1-CG2 4.09Å; L365-I369 HydrophobicContact CD2-CD1 3.73Å; L365-I369 HydrophobicContact CG-CD1 4.47Å; L365-I369 WeakPolarHBondContact O-CD1 3.43Å; L365-I369 WeakPolarHBondContact O-CG1 3.45Å; L365-I369 PolarHBondContact O-N 2.84Å; L365-I369 VanDerWaalsContact O-N 3.12Å; V366-I369 PolarHBondContact O-N 3.45Å; V366-I369 VanDerWaalsContact O-N 3.13Å; R367-I369 VanDerWaalsContact C-N 3.31Å; R367-I369 PolarHBondContact O-N 2.76Å; I369-I997 HydrophobicContact CD1-CB 3.9Å; I369-I997 HydrophobicContact CD1-CG2 3.62Å; I369-I997 HydrophobicContact CG1-CG2 4.44Å; I369-I997 HydrophobicContact CG2-CG2 4.46Å; I369-A998 HydrophobicContact CG1-CB 4.44Å
370	M	70.1	Confident	68.8	Low	46 Å²	46	48 Å²	48	23%	0.227	24%	0.239	C	C	.	.	H	α-helix	trans	-72.8	-28	-179.6	-71.1	-167.5	-60.4	0	0	113.9	K124 V175 F358 V366 R367 P372	K124-M370 HydrophobicContact CG-CE 4.05Å; V175-M370 HydrophobicContact CG1-SD 4.26Å; V175-M370 HydrophobicContact CG2-SD 4.09Å; F358-M370 HydrophobicContact CD1-CE 4.32Å; F358-M370 HydrophobicContact CE1-CE 3.39Å; F358-M370 HydrophobicContact CZ-CE 3.87Å; V366-M370 HydrophobicContact CG1-CE 4.25Å; V366-M370 PolarHBondContact O-N 2.93Å; R367-M370 PolarHBondContact O-N 2.85Å; M370-P372 VanDerWaalsContact C-CD 3.43Å; M370-P372 WeakPolarHBondContact O-CD 3.26Å
371	F	71.3	Confident	68.2	Low	62 Å²	62	53 Å²	53	27%	0.272	26%	0.263	S	S	.	.	S	Bend	trans	-125.8	63.8	-178	-54.4	-71.8	0	0	0	111.3	K123 K124 R367	K123-F371 HydrophobicContact CB-CD2 3.85Å; K123-F371 HydrophobicContact CB-CE2 4.02Å; K123-F371 HydrophobicContact CB-CG 4.27Å; K123-F371 HydrophobicContact CD-CB 4.37Å; K123-F371 HydrophobicContact CG-CB 4.38Å; K123-F371 HydrophobicContact CG-CD1 4.36Å; K123-F371 HydrophobicContact CG-CD2 4.15Å; K123-F371 HydrophobicContact CG-CG 4.04Å; K124-F371 HydrophobicContact CG-CE2 4.01Å; K124-F371 HydrophobicContact CG-CZ 4.33Å; R367-F371 HydrophobicContact CG-CD2 3.87Å; R367-F371 HydrophobicContact CG-CE2 4.34Å; R367-F371 WeakPolarHBondContact O-CD2 3.48Å; R367-F371 PolarHBondContact O-N 3.47Å
372	P	60.2	Low	67.9	Low	71 Å²	71	51.7 Å²	51.7	46%	0.461	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-64.9	150.2	-178.1	29.1	-35.5	0	0	0	111.4	M370 P374	M370-P372 VanDerWaalsContact C-CD 3.43Å; M370-P372 WeakPolarHBondContact O-CD 3.26Å; P372-P374 WeakPolarHBondContact O-CD 3.31Å
373	K	58.3	Low	67.6	Low	119 Å²	119	51.7 Å²	51.7	52%	0.517	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-61.9	120.5	169.4	-65.1	-172.7	-175.8	-173.9	0	107.8	M375 E959	K373-M375 PolarHBondContact O-N 2.95Å; K373-E959 IonicContact NZ-OE1 3.21Å; K373-E959 PolarHBondContact NZ-OE1 3.49Å
374	P	56.3	Low	67.4	Low	56 Å²	56	59 Å²	59	36%	0.364	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-76.9	118.5	-171.7	30.6	-36.4	0	0	0	110.9	V82 S83 P372 K376	V82-P374 WeakPolarHBondContact O-CG 3.45Å; S83-P374 VanDerWaalsContact CA-CD 3.44Å; P372-P374 WeakPolarHBondContact O-CD 3.31Å; P374-K376 PolarHBondContact O-N 3Å; P374-K376 VanDerWaalsContact O-N 3.15Å
375	M	55.7	Low	67.6	Low	73 Å²	73	60.4 Å²	60.4	36%	0.36	29%	0.291	S	S	.	.			trans	-68.1	111.2	165.2	-76.5	-164.5	-80.2	0	0	110.4	K373 F377 V458 V461 H985	K373-M375 PolarHBondContact O-N 2.95Å; M375-F377 PolarHBondContact O-N 3.2Å; M375-V458 HydrophobicContact CE-CB 4.42Å; M375-V458 HydrophobicContact CE-CG1 4.07Å; M375-V458 HydrophobicContact CE-CG2 3.78Å; M375-V461 HydrophobicContact CE-CG2 4.15Å; M375-V461 HydrophobicContact SD-CG1 4.06Å; M375-V461 HydrophobicContact SD-CG2 4.24Å; M375-H985 WeakPolarHBondContact CE-O 3.42Å; M375-H985 VanDerWaalsContact SD-CA 3.52Å; M375-H985 HydrophobicContact SD-CB 3.75Å; M375-H985 PolarHBondContact SD-CD2 3.03Å
376	K	53.5	Low	68.1	Low	165 Å²	165	59.5 Å²	59.5	72%	0.717	29%	0.286	S	S	*	.			trans	-75.1	71.2	173.9	-67.2	178.4	-176.5	169.4	0	110.5	P374 K378	P374-K376 PolarHBondContact O-N 3Å; P374-K376 VanDerWaalsContact O-N 3.15Å; K376-K378 PolarHBondContact O-N 3.35Å
377	F	57.1	Low	68.3	Low	28 Å²	28	61.4 Å²	61.4	12%	0.123	30%	0.296	C	S	.	.			trans	-70.5	113.8	178.4	-164.7	-112.1	0	0	0	110.3	M375 F379 T380 N460 V461 V464 L1022 M1089	M375-F377 PolarHBondContact O-N 3.2Å; F377-F379 HydrophobicContact CD1-CB 3.5Å; F377-F379 VanDerWaalsContact CD1-CB 3.5Å; F377-F379 HydrophobicContact CE1-CB 3.35Å; F377-F379 HydrophobicContact CE1-CG 4.18Å; F377-F379 HydrophobicContact CZ-CB 4.44Å; F377-F379 PolarHBondContact O-N 2.65Å; F377-F379 VanDerWaalsContact O-N 3.08Å; F377-T380 PolarHBondContact O-N 2.95Å; F377-T380 PolarHBondContact O-OG1 3.21Å; F377-N460 HydrophobicContact CE1-CB 3.84Å; F377-N460 HydrophobicContact CZ-CB 4.06Å; F377-V461 HydrophobicContact CD2-CG2 3.75Å; F377-V461 HydrophobicContact CE2-CB 4.44Å; F377-V461 HydrophobicContact CE2-CG2 4.03Å; F377-V461 HydrophobicContact CG-CG2 4.26Å; F377-V464 HydrophobicContact CE2-CG2 4.23Å; F377-L1022 HydrophobicContact CE1-CD1 4.15Å; F377-L1022 HydrophobicContact CZ-CD1 3.98Å; F377-M1089 HydrophobicContact CD2-CE 3.81Å; F377-M1089 HydrophobicContact CE2-CE 3.4Å; F377-M1089 VanDerWaalsContact CE2-CE 3.4Å; F377-M1089 HydrophobicContact CZ-CE 4.23Å
378	K	63.1	Low	68.5	Low	99 Å²	99	62.9 Å²	62.9	43%	0.43	32%	0.315	S	S	.	.	H	α-helix	trans	-61.6	-22.3	-169.3	-69.4	180	178.6	173.7	0	114.2	K376 T380 Q381 D382	K376-K378 PolarHBondContact O-N 3.35Å; K378-T380 PolarHBondContact O-N 3.4Å; K378-Q381 PolarHBondContact O-N 3.21Å; K378-D382 VanDerWaalsContact O-CB 3.27Å; K378-D382 WeakPolarHBondContact O-CB 3.44Å; K378-D382 VanDerWaalsContact O-CG 3.27Å; K378-D382 PolarHBondContact O-N 3.07Å
379	F	66.7	Low	69.3	Low	5 Å²	5	64.9 Å²	64.9	2%	0.022	33%	0.333	C	S	.	.	H	α-helix	trans	-55.2	-43.7	179.6	175.9	-102.2	0	0	0	114.2	F377 A383 M435 F1026 L1091	F377-F379 HydrophobicContact CD1-CB 3.5Å; F377-F379 VanDerWaalsContact CD1-CB 3.5Å; F377-F379 HydrophobicContact CE1-CB 3.35Å; F377-F379 HydrophobicContact CE1-CG 4.18Å; F377-F379 HydrophobicContact CZ-CB 4.44Å; F377-F379 PolarHBondContact O-N 2.65Å; F377-F379 VanDerWaalsContact O-N 3.08Å; F379-A383 VanDerWaalsContact O-CB 3.3Å; F379-A383 WeakPolarHBondContact O-CB 3.15Å; F379-A383 PolarHBondContact O-N 3.33Å; F379-M435 HydrophobicContact CD1-CE 4.21Å; F379-M435 HydrophobicContact CE1-CB 4.41Å; F379-M435 HydrophobicContact CE1-CE 3.64Å; F379-M435 HydrophobicContact CE1-CG 4.24Å; F379-M435 HydrophobicContact CZ-CE 4.41Å; F379-M435 HydrophobicContact CZ-CG 4.28Å; F379-F1026 AromaticContact CD2-CD2 3.96Å; F379-F1026 HydrophobicContact CD2-CD2 3.96Å; F379-F1026 AromaticContact CD2-CE2 3.24Å; F379-F1026 HydrophobicContact CD2-CE2 3.24Å; F379-F1026 AromaticContact CD2-CZ 3.76Å; F379-F1026 HydrophobicContact CD2-CZ 3.76Å; F379-F1026 AromaticContact CE2-CD2 3.59Å; F379-F1026 HydrophobicContact CE2-CD2 3.59Å; F379-F1026 AromaticContact CE2-CE2 3.39Å; F379-F1026 HydrophobicContact CE2-CE2 3.39Å; F379-F1026 HydrophobicContact CE2-CG 4.47Å; F379-F1026 HydrophobicContact CE2-CZ 4.13Å; F379-F1026 HydrophobicContact CG-CE2 4.37Å; F379-L1091 HydrophobicContact CD2-CD1 3.88Å; F379-L1091 HydrophobicContact CE2-CD1 3.51Å; F379-L1091 HydrophobicContact CZ-CD1 4.5Å
380	T	66.1	Low	70	Confident	72 Å²	72	63.5 Å²	63.5	44%	0.442	33%	0.326	S	S	.	.	H	α-helix	trans	-71	-37.4	-179.9	52.1	0	0	0	0	111.5	F377 K378 A383 Y384 M435	F377-T380 PolarHBondContact O-N 2.95Å; F377-T380 PolarHBondContact O-OG1 3.21Å; K378-T380 PolarHBondContact O-N 3.4Å; T380-A383 PolarHBondContact O-N 2.97Å; T380-Y384 WeakPolarHBondContact O-CD2 3.42Å; T380-Y384 PolarHBondContact O-N 2.93Å; T380-Y384 VanDerWaalsContact O-N 3.14Å; T380-M435 HydrophobicContact CG2-CE 4.47Å
381	Q	72.9	Confident	70.7	Confident	107 Å²	107	64 Å²	64	50%	0.5	33%	0.333	S	S	.	.	H	α-helix	trans	-67.1	-44.5	173.9	-171.7	175.9	10.3	0	0	112	K378 A383 Y384 Q385	K378-Q381 PolarHBondContact O-N 3.21Å; Q381-A383 VanDerWaalsContact C-N 3.28Å; Q381-A383 PolarHBondContact O-N 2.8Å; Q381-Y384 PolarHBondContact O-N 3.19Å; Q381-Q385 WeakPolarHBondContact O-CG 3.47Å; Q381-Q385 PolarHBondContact O-N 3.34Å
382	D	74.5	Confident	71.4	Confident	10 Å²	10	62.8 Å²	62.8	5%	0.053	34%	0.337	C	S	.	.	H	α-helix	trans	-62.8	-34.2	174.7	-75.7	14.4	0	0	0	110.9	K378 Q385 F386 R1090 L1091	K378-D382 VanDerWaalsContact O-CB 3.27Å; K378-D382 WeakPolarHBondContact O-CB 3.44Å; K378-D382 VanDerWaalsContact O-CG 3.27Å; K378-D382 PolarHBondContact O-N 3.07Å; D382-Q385 PolarHBondContact O-N 3Å; D382-F386 VanDerWaalsContact O-CB 3.26Å; D382-F386 WeakPolarHBondContact O-CB 3.13Å; D382-F386 PolarHBondContact O-N 3.48Å; D382-R1090 WeakPolarHBondContact OD2-CA 3.41Å; D382-R1090 VanDerWaalsContact OD2-CB 3.26Å; D382-R1090 WeakPolarHBondContact OD2-CB 3.21Å; D382-L1091 HydrophobicContact CB-CB 3.74Å; D382-L1091 PolarHBondContact OD2-N 2.82Å
383	A	74.4	Confident	72.6	Confident	11 Å²	11	62 Å²	62	9%	0.091	33%	0.331	C	S	.	.	H	α-helix	trans	-66.1	-42.5	174.1	0	0	0	0	0	111.8	F379 T380 Q381 F386 L387 M435 L1091	F379-A383 VanDerWaalsContact O-CB 3.3Å; F379-A383 WeakPolarHBondContact O-CB 3.15Å; F379-A383 PolarHBondContact O-N 3.33Å; T380-A383 PolarHBondContact O-N 2.97Å; Q381-A383 VanDerWaalsContact C-N 3.28Å; Q381-A383 PolarHBondContact O-N 2.8Å; A383-F386 PolarHBondContact O-N 2.99Å; A383-L387 WeakPolarHBondContact O-CB 3.37Å; A383-L387 PolarHBondContact O-N 2.98Å; A383-M435 HydrophobicContact CB-CE 4.06Å; A383-M435 HydrophobicContact CB-SD 4.44Å; A383-L1091 HydrophobicContact CB-CD2 4.06Å
384	Y	77.4	Confident	74	Confident	154 Å²	154	56.3 Å²	56.3	60%	0.604	31%	0.307	S	S	*	.	H	α-helix	trans	-65.4	-36.9	171.4	-71.5	-62.1	0	0	0	112.7	T380 Q381 L387 G388	T380-Y384 WeakPolarHBondContact O-CD2 3.42Å; T380-Y384 PolarHBondContact O-N 2.93Å; T380-Y384 VanDerWaalsContact O-N 3.14Å; Q381-Y384 PolarHBondContact O-N 3.19Å; Y384-L387 PolarHBondContact O-N 3.49Å; Y384-G388 PolarHBondContact O-N 2.88Å
385	Q	82.5	Confident	75.7	Confident	103 Å²	103	58.8 Å²	58.8	48%	0.481	32%	0.316	S	S	.	.	H	α-helix	trans	-66.8	-40.6	174.4	-72.5	179.2	-0.1	0	0	112	Q381 D382 G388 A389 L1092	Q381-Q385 WeakPolarHBondContact O-CG 3.47Å; Q381-Q385 PolarHBondContact O-N 3.34Å; D382-Q385 PolarHBondContact O-N 3Å; Q385-G388 PolarHBondContact O-N 3.14Å; Q385-A389 PolarHBondContact O-N 3.39Å; Q385-L1092 HydrophobicContact CB-CD1 3.62Å
386	F	80.1	Confident	77.4	Confident	8 Å²	8	60 Å²	60	4%	0.035	33%	0.328	C	S	.	.	H	α-helix	trans	-66.5	-41.1	175.3	-173.9	-76.4	0	0	0	111.3	D382 A383 G388 A389 L390 F1029 A1033 L1091 L1092 M1097 L1100	D382-F386 VanDerWaalsContact O-CB 3.26Å; D382-F386 WeakPolarHBondContact O-CB 3.13Å; D382-F386 PolarHBondContact O-N 3.48Å; A383-F386 PolarHBondContact O-N 2.99Å; F386-G388 VanDerWaalsContact C-N 3.29Å; F386-G388 PolarHBondContact O-N 2.84Å; F386-A389 CarbonylContact O-C 3.55Å; F386-A389 WeakPolarHBondContact O-CA 3.34Å; F386-A389 WeakPolarHBondContact O-CB 3.38Å; F386-A389 PolarHBondContact O-N 3.14Å; F386-L390 HydrophobicContact CD1-CD1 3.99Å; F386-L390 HydrophobicContact CD1-CG 3.87Å; F386-L390 HydrophobicContact CE1-CD1 3.65Å; F386-L390 HydrophobicContact CE1-CD2 3.88Å; F386-L390 HydrophobicContact CE1-CG 3.54Å; F386-L390 HydrophobicContact CZ-CD2 4.43Å; F386-L390 HydrophobicContact CZ-CG 4.48Å; F386-L390 PolarHBondContact O-N 3.03Å; F386-F1029 HydrophobicContact CB-CZ 4.31Å; F386-F1029 AromaticContact CD1-CE1 3.65Å; F386-F1029 HydrophobicContact CD1-CE1 3.65Å; F386-F1029 AromaticContact CD1-CZ 3.36Å; F386-F1029 HydrophobicContact CD1-CZ 3.36Å; F386-F1029 HydrophobicContact CD2-CE1 4.08Å; F386-F1029 HydrophobicContact CD2-CZ 4.43Å; F386-F1029 AromaticContact CE1-CE1 3.58Å; F386-F1029 HydrophobicContact CE1-CE1 3.58Å; F386-F1029 AromaticContact CE1-CZ 3.66Å; F386-F1029 HydrophobicContact CE1-CZ 3.66Å; F386-F1029 HydrophobicContact CE2-CE1 4.03Å; F386-F1029 AromaticContact CG-CE1 3.9Å; F386-F1029 HydrophobicContact CG-CE1 3.9Å; F386-F1029 AromaticContact CG-CZ 3.79Å; F386-F1029 HydrophobicContact CG-CZ 3.79Å; F386-F1029 AromaticContact CZ-CE1 3.8Å; F386-F1029 HydrophobicContact CZ-CE1 3.8Å; F386-F1029 HydrophobicContact CZ-CZ 4.34Å; F386-A1033 HydrophobicContact CE1-CB 3.68Å; F386-A1033 HydrophobicContact CZ-CB 3.68Å; F386-L1091 HydrophobicContact CB-CD2 4.07Å; F386-L1091 HydrophobicContact CG-CD2 4.34Å; F386-L1092 HydrophobicContact CB-CD2 4.22Å; F386-L1092 HydrophobicContact CB-CG 4.4Å; F386-L1092 HydrophobicContact CD2-CD2 3.76Å; F386-L1092 HydrophobicContact CD2-CG 4.42Å; F386-L1092 HydrophobicContact CG-CD2 4.44Å; F386-M1097 HydrophobicContact CD2-CE 4.28Å; F386-M1097 HydrophobicContact CD2-SD 4.06Å; F386-M1097 HydrophobicContact CE2-CE 3.71Å; F386-M1097 HydrophobicContact CE2-SD 3.73Å; F386-L1100 HydrophobicContact CE2-CD2 3.89Å; F386-L1100 HydrophobicContact CZ-CD2 3.51Å
387	L	80.3	Confident	79.1	Confident	43 Å²	43	52.5 Å²	52.5	23%	0.225	30%	0.297	C	S	.	.	H	α-helix	trans	-58.6	-42.6	172.1	-174.6	64.6	0	0	0	110.9	A383 Y384 A389 L390 C391 I427	A383-L387 WeakPolarHBondContact O-CB 3.37Å; A383-L387 PolarHBondContact O-N 2.98Å; Y384-L387 PolarHBondContact O-N 3.49Å; L387-A389 VanDerWaalsContact C-N 3.3Å; L387-A389 PolarHBondContact O-N 3.25Å; L387-L390 WeakPolarHBondContact O-CB 3.12Å; L387-L390 PolarHBondContact O-N 3.41Å; L387-C391 PolarHBondContact O-N 2.9Å; L387-C391 PolarHBondContact O-SG 3.15Å; L387-I427 HydrophobicContact CD1-CB 4.39Å; L387-I427 HydrophobicContact CD1-CD1 3.89Å; L387-I427 HydrophobicContact CD1-CG1 3.86Å; L387-I427 HydrophobicContact CD1-CG2 3.7Å
388	G	82.8	Confident	80.7	Confident	44 Å²	44	52.9 Å²	52.9	45%	0.454	30%	0.3	S	S	.	.	H	α-helix	trans	-60.6	-35	171.7	0	0	0	0	0	113.9	Y384 Q385 F386 G392	Y384-G388 PolarHBondContact O-N 2.88Å; Q385-G388 PolarHBondContact O-N 3.14Å; F386-G388 VanDerWaalsContact C-N 3.29Å; F386-G388 PolarHBondContact O-N 2.84Å; G388-G392 PolarHBondContact O-N 3.1Å; G388-G392 VanDerWaalsContact O-N 3.15Å
389	A	83.9	Confident	82.1	Confident	51 Å²	51	52 Å²	52	42%	0.421	31%	0.306	S	S	.	.	H	α-helix	trans	-70.4	-40.1	173.6	0	0	0	0	0	112.3	Q385 F386 L387 G392 V393	Q385-A389 PolarHBondContact O-N 3.39Å; F386-A389 CarbonylContact O-C 3.55Å; F386-A389 WeakPolarHBondContact O-CA 3.34Å; F386-A389 WeakPolarHBondContact O-CB 3.38Å; F386-A389 PolarHBondContact O-N 3.14Å; L387-A389 VanDerWaalsContact C-N 3.3Å; L387-A389 PolarHBondContact O-N 3.25Å; A389-G392 WeakPolarHBondContact O-CA 3.26Å; A389-G392 PolarHBondContact O-N 3.34Å; A389-G392 VanDerWaalsContact O-N 3.11Å; A389-V393 PolarHBondContact O-N 3.39Å
390	L	83.3	Confident	83.3	Confident	7 Å²	7	54.9 Å²	54.9	4%	0.037	32%	0.324	C	S	.	.	H	α-helix	trans	-60.4	-44.3	171.3	-75.8	-176.2	0	0	0	111.6	F386 L387 G392 V393 A394 V426 L1037	F386-L390 HydrophobicContact CD1-CD1 3.99Å; F386-L390 HydrophobicContact CD1-CG 3.87Å; F386-L390 HydrophobicContact CE1-CD1 3.65Å; F386-L390 HydrophobicContact CE1-CD2 3.88Å; F386-L390 HydrophobicContact CE1-CG 3.54Å; F386-L390 HydrophobicContact CZ-CD2 4.43Å; F386-L390 HydrophobicContact CZ-CG 4.48Å; F386-L390 PolarHBondContact O-N 3.03Å; L387-L390 WeakPolarHBondContact O-CB 3.12Å; L387-L390 PolarHBondContact O-N 3.41Å; L390-G392 PolarHBondContact O-N 3.37Å; L390-V393 PolarHBondContact O-N 3.19Å; L390-V393 VanDerWaalsContact O-N 3.07Å; L390-A394 WeakPolarHBondContact O-CB 3.46Å; L390-A394 PolarHBondContact O-N 3.4Å; L390-V426 HydrophobicContact CB-CG1 3.92Å; L390-V426 HydrophobicContact CD2-CG1 4.14Å; L390-V426 HydrophobicContact CG-CG1 4.46Å; L390-L1037 HydrophobicContact CD2-CD1 4.2Å; L390-L1037 HydrophobicContact CD2-CD2 3.93Å; L390-L1037 HydrophobicContact CD2-CG 4.12Å
391	C	83.8	Confident	84.5	Confident	56 Å²	56	51.4 Å²	51.4	38%	0.378	30%	0.303	S	S	.	.	H	α-helix	trans	-57.6	-34.5	172.8	-64.4	0	0	0	0	112.2	L387 L395	L387-C391 PolarHBondContact O-N 2.9Å; L387-C391 PolarHBondContact O-SG 3.15Å; C391-L395 WeakPolarHBondContact O-CB 3.26Å; C391-L395 PolarHBondContact O-N 3.19Å
392	G	86.9	Confident	85.3	Confident	36 Å²	36	49 Å²	49	37%	0.371	30%	0.295	S	S	.	.	H	α-helix	trans	-65.1	-44	173.2	0	0	0	0	0	112.9	G388 A389 L390 L395 V396	G388-G392 PolarHBondContact O-N 3.1Å; G388-G392 VanDerWaalsContact O-N 3.15Å; A389-G392 WeakPolarHBondContact O-CA 3.26Å; A389-G392 PolarHBondContact O-N 3.34Å; A389-G392 VanDerWaalsContact O-N 3.11Å; L390-G392 PolarHBondContact O-N 3.37Å; G392-L395 PolarHBondContact O-N 2.95Å; G392-V396 WeakPolarHBondContact O-CG2 3.45Å; G392-V396 PolarHBondContact O-N 3.24Å; G392-V396 VanDerWaalsContact O-N 3.17Å
393	V	86	Confident	86.1	Confident	54 Å²	54	55.2 Å²	55.2	33%	0.327	32%	0.319	S	S	.	.	H	α-helix	trans	-64.2	-44	174.2	177.3	0	0	0	0	110.9	A389 L390 L395 V396 G397 L1037	A389-V393 PolarHBondContact O-N 3.39Å; L390-V393 PolarHBondContact O-N 3.19Å; L390-V393 VanDerWaalsContact O-N 3.07Å; V393-L395 VanDerWaalsContact C-N 3.31Å; V393-L395 PolarHBondContact O-N 3.34Å; V393-V396 PolarHBondContact O-N 3.4Å; V393-G397 PolarHBondContact O-N 3Å; V393-L1037 HydrophobicContact CG1-CD2 3.96Å
394	A	87.5	Confident	86.9	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.008	32%	0.322	C	S	.	.	H	α-helix	trans	-58.6	-40.6	175.7	0	0	0	0	0	112.3	L390 G397 L398 V423 V426	L390-A394 WeakPolarHBondContact O-CB 3.46Å; L390-A394 PolarHBondContact O-N 3.4Å; A394-G397 PolarHBondContact O-N 3.41Å; A394-L398 VanDerWaalsContact O-CB 3.27Å; A394-L398 WeakPolarHBondContact O-CB 3.38Å; A394-L398 PolarHBondContact O-N 2.61Å; A394-V423 HydrophobicContact CB-CG1 4.31Å; A394-V423 HydrophobicContact CB-CG2 4.43Å; A394-V426 HydrophobicContact CB-CB 4.03Å; A394-V426 HydrophobicContact CB-CG1 4.02Å; A394-V426 HydrophobicContact CB-CG2 4.13Å
395	L	90.5	Very high	87.3	Confident	108 Å²	108	49 Å²	49	57%	0.565	29%	0.294	S	S	*	.	H	α-helix	trans	-66.2	-40.4	176.9	-170.4	72.1	0	0	0	112.3	C391 G392 V393 L398 C399	C391-L395 WeakPolarHBondContact O-CB 3.26Å; C391-L395 PolarHBondContact O-N 3.19Å; G392-L395 PolarHBondContact O-N 2.95Å; V393-L395 VanDerWaalsContact C-N 3.31Å; V393-L395 PolarHBondContact O-N 3.34Å; L395-L398 HydrophobicContact CD1-CD2 4.22Å; L395-L398 WeakPolarHBondContact O-CB 3.44Å; L395-L398 PolarHBondContact O-N 3.13Å; L395-C399 PolarHBondContact O-N 3.29Å; L395-C399 VanDerWaalsContact O-N 3.1Å; L395-C399 PolarHBondContact O-SG 3.22Å; L395-C399 VanDerWaalsContact O-SG 3.36Å
396	V	91.5	Very high	87.5	Confident	98 Å²	98	52.1 Å²	52.1	59%	0.594	30%	0.302	S	S	*	.	H	α-helix	trans	-65.1	-45.1	174.4	174.4	0	0	0	0	110.6	G392 V393 L398 C399 V400	G392-V396 WeakPolarHBondContact O-CG2 3.45Å; G392-V396 PolarHBondContact O-N 3.24Å; G392-V396 VanDerWaalsContact O-N 3.17Å; V393-V396 PolarHBondContact O-N 3.4Å; V396-L398 VanDerWaalsContact C-N 3.33Å; V396-L398 PolarHBondContact O-N 2.9Å; V396-C399 PolarHBondContact O-N 3.35Å; V396-V400 WeakPolarHBondContact O-CG2 3.48Å; V396-V400 PolarHBondContact O-N 3.11Å
397	G	89.5	Confident	87.9	Confident	8 Å²	8	60.1 Å²	60.1	8%	0.082	33%	0.333	C	S	.	.	H	α-helix	trans	-60.7	-39.3	175.1	0	0	0	0	0	113	V393 A394 V400 S401 L422	V393-G397 PolarHBondContact O-N 3Å; A394-G397 PolarHBondContact O-N 3.41Å; G397-V400 PolarHBondContact O-N 3.05Å; G397-S401 WeakPolarHBondContact O-CB 3.46Å; G397-S401 PolarHBondContact O-N 2.98Å; G397-S401 PolarHBondContact O-OG 2.7Å; G397-L422 WeakPolarHBondContact O-CD2 3.32Å
398	L	91.2	Very high	87.9	Confident	35 Å²	35	60 Å²	60	18%	0.183	33%	0.332	C	S	.	.	H	α-helix	trans	-59.2	-49.4	174.8	179	73	0	0	0	110.7	A394 L395 V396 V400 S401 V402 P419 V423	A394-L398 VanDerWaalsContact O-CB 3.27Å; A394-L398 WeakPolarHBondContact O-CB 3.38Å; A394-L398 PolarHBondContact O-N 2.61Å; L395-L398 HydrophobicContact CD1-CD2 4.22Å; L395-L398 WeakPolarHBondContact O-CB 3.44Å; L395-L398 PolarHBondContact O-N 3.13Å; V396-L398 VanDerWaalsContact C-N 3.33Å; V396-L398 PolarHBondContact O-N 2.9Å; L398-V400 PolarHBondContact O-N 2.85Å; L398-S401 PolarHBondContact O-N 3.43Å; L398-V402 WeakPolarHBondContact O-CG2 3.48Å; L398-V402 PolarHBondContact O-N 3.15Å; L398-P419 HydrophobicContact CD1-CB 3.52Å; L398-P419 WeakPolarHBondContact CD1-O 3.39Å; L398-V423 HydrophobicContact CB-CG2 4.47Å; L398-V423 HydrophobicContact CD1-CG2 4.32Å; L398-V423 HydrophobicContact CD2-CG2 4.45Å
399	C	92.5	Very high	88	Confident	82 Å²	82	66.9 Å²	66.9	55%	0.554	35%	0.349	S	S	*	.	H	α-helix	trans	-60.6	-42.6	177.2	-67.5	0	0	0	0	112.7	L395 V396 Y403	L395-C399 PolarHBondContact O-N 3.29Å; L395-C399 VanDerWaalsContact O-N 3.1Å; L395-C399 PolarHBondContact O-SG 3.22Å; L395-C399 VanDerWaalsContact O-SG 3.36Å; V396-C399 PolarHBondContact O-N 3.35Å; C399-Y403 PolarHBondContact O-N 2.96Å
400	V	92.2	Very high	87.8	Confident	64 Å²	64	66.5 Å²	66.5	39%	0.388	34%	0.338	S	S	.	.	H	α-helix	trans	-64	-43.6	175.9	172.5	0	0	0	0	111	V396 G397 L398 Y403 L404 I1044	V396-V400 WeakPolarHBondContact O-CG2 3.48Å; V396-V400 PolarHBondContact O-N 3.11Å; G397-V400 PolarHBondContact O-N 3.05Å; L398-V400 PolarHBondContact O-N 2.85Å; V400-Y403 WeakPolarHBondContact O-CB 3.46Å; V400-Y403 PolarHBondContact O-N 3.03Å; V400-L404 HydrophobicContact CG1-CD1 3.96Å; V400-L404 HydrophobicContact CG1-CG 4.37Å; V400-L404 WeakPolarHBondContact O-CG 3.31Å; V400-L404 PolarHBondContact O-N 3.39Å; V400-I1044 HydrophobicContact CG1-CG2 4.41Å
401	S	90.6	Very high	87.8	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-66.4	-42.1	-178.9	-57.7	0	0	0	0	112.2	G397 L398 Y403 L404 M405 F1047	G397-S401 WeakPolarHBondContact O-CB 3.46Å; G397-S401 PolarHBondContact O-N 2.98Å; G397-S401 PolarHBondContact O-OG 2.7Å; L398-S401 PolarHBondContact O-N 3.43Å; S401-Y403 VanDerWaalsContact C-N 3.32Å; S401-Y403 PolarHBondContact O-N 3.25Å; S401-L404 PolarHBondContact O-N 3.38Å; S401-M405 WeakPolarHBondContact O-CG 3.49Å; S401-M405 PolarHBondContact O-N 2.84Å; S401-F1047 WeakPolarHBondContact OG-CD2 3.33Å
402	V	91.1	Very high	87.9	Confident	56 Å²	56	74.9 Å²	74.9	34%	0.339	38%	0.379	S	S	.	.	H	α-helix	trans	-59	-43.2	173.1	169.7	0	0	0	0	111	L398 Y406 I415 P419	L398-V402 WeakPolarHBondContact O-CG2 3.48Å; L398-V402 PolarHBondContact O-N 3.15Å; V402-Y406 WeakPolarHBondContact O-CB 3.4Å; V402-Y406 PolarHBondContact O-N 3.24Å; V402-I415 HydrophobicContact CG1-CG2 4.11Å; V402-P419 HydrophobicContact CG2-CB 3.81Å; V402-P419 HydrophobicContact CG2-CG 3.88Å
403	Y	91.4	Very high	87.8	Confident	141 Å²	141	79.5 Å²	79.5	55%	0.553	39%	0.386	S	S	*	.	H	α-helix	trans	-63.2	-45	176	173	-101.9	0	0	0	112.5	C399 V400 S401 Y406 W407	C399-Y403 PolarHBondContact O-N 2.96Å; V400-Y403 WeakPolarHBondContact O-CB 3.46Å; V400-Y403 PolarHBondContact O-N 3.03Å; S401-Y403 VanDerWaalsContact C-N 3.32Å; S401-Y403 PolarHBondContact O-N 3.25Å; Y403-Y406 PolarHBondContact O-N 3.35Å; Y403-W407 WeakPolarHBondContact O-CB 3.43Å; Y403-W407 PolarHBondContact O-N 2.88Å
404	L	89.9	Confident	87.7	Confident	31 Å²	31	81.1 Å²	81.1	16%	0.162	39%	0.387	C	S	.	.	H	α-helix	trans	-63.8	-42.3	177.6	-69.9	172.7	0	0	0	112.4	V400 S401 W407 N408 I1044 F1047 V1048	V400-L404 HydrophobicContact CG1-CD1 3.96Å; V400-L404 HydrophobicContact CG1-CG 4.37Å; V400-L404 WeakPolarHBondContact O-CG 3.31Å; V400-L404 PolarHBondContact O-N 3.39Å; S401-L404 PolarHBondContact O-N 3.38Å; L404-W407 WeakPolarHBondContact O-CB 3.38Å; L404-W407 PolarHBondContact O-N 3.07Å; L404-N408 WeakPolarHBondContact O-CB 3.31Å; L404-N408 PolarHBondContact O-N 2.99Å; L404-N408 PolarHBondContact O-ND2 3.35Å; L404-I1044 HydrophobicContact CD1-CG2 4.39Å; L404-F1047 HydrophobicContact CD1-CB 4.44Å; L404-V1048 HydrophobicContact CD1-CG2 4.13Å; L404-V1048 HydrophobicContact CD2-CG2 4.43Å
405	M	85.3	Confident	87.6	Confident	3 Å²	3	82.1 Å²	82.1	2%	0.015	39%	0.392	C	S	.	.	H	α-helix	trans	-70.6	-33.7	178.7	-66.9	-165.2	78.5	0	0	112.9	S401 N408 K409 K410 I415 R418 P419	S401-M405 WeakPolarHBondContact O-CG 3.49Å; S401-M405 PolarHBondContact O-N 2.84Å; M405-N408 PolarHBondContact O-N 3.08Å; M405-K409 PolarHBondContact O-N 3.05Å; M405-K410 HydrophobicContact CE-CB 4.16Å; M405-K410 HydrophobicContact CE-CG 3.99Å; M405-K410 PolarHBondContact O-N 3.13Å; M405-I415 HydrophobicContact CB-CG1 3.98Å; M405-R418 HydrophobicContact CE-CB 3.91Å; M405-R418 HydrophobicContact CE-CG 4.13Å; M405-R418 HydrophobicContact SD-CB 3.71Å; M405-P419 HydrophobicContact SD-CG 3.74Å
406	Y	87.7	Confident	87.4	Confident	168 Å²	168	81.8 Å²	81.8	66%	0.659	39%	0.39	S	S	*	.	H	α-helix	trans	-63.8	-45.1	169.9	177.2	-101.4	0	0	0	111.6	V402 Y403 N408 K409	V402-Y406 WeakPolarHBondContact O-CB 3.4Å; V402-Y406 PolarHBondContact O-N 3.24Å; Y403-Y406 PolarHBondContact O-N 3.35Å; Y406-N408 VanDerWaalsContact C-N 3.29Å; Y406-N408 PolarHBondContact O-N 3.3Å; Y406-K409 PolarHBondContact O-N 3.22Å; Y406-K409 VanDerWaalsContact O-N 3.07Å
407	W	88.1	Confident	87.1	Confident	177 Å²	177	78.5 Å²	78.5	67%	0.67	37%	0.368	S	S	*	.	H	α-helix	trans	-59.2	-40.5	176	-172.1	-92.9	0	0	0	112.3	Y403 L404 K409	Y403-W407 WeakPolarHBondContact O-CB 3.43Å; Y403-W407 PolarHBondContact O-N 2.88Å; L404-W407 WeakPolarHBondContact O-CB 3.38Å; L404-W407 PolarHBondContact O-N 3.07Å; W407-K409 PolarHBondContact O-N 2.89Å
408	N	80.6	Confident	86.8	Confident	39 Å²	39	78.6 Å²	78.6	21%	0.209	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	9.1	177.4	-71.4	-22.8	0	0	0	114.5	L404 M405 Y406 K410 F1047 V1048 G1050	L404-N408 WeakPolarHBondContact O-CB 3.31Å; L404-N408 PolarHBondContact O-N 2.99Å; L404-N408 PolarHBondContact O-ND2 3.35Å; M405-N408 PolarHBondContact O-N 3.08Å; Y406-N408 VanDerWaalsContact C-N 3.29Å; Y406-N408 PolarHBondContact O-N 3.3Å; N408-K410 VanDerWaalsContact C-N 3.28Å; N408-K410 PolarHBondContact O-N 2.91Å; N408-F1047 PolarHBondContact ND2-O 3.1Å; N408-V1048 VanDerWaalsContact ND2-C 3.33Å; N408-V1048 PolarHBondContact ND2-O 3.5Å; N408-G1050 PolarHBondContact ND2-N 2.99Å
409	K	84.1	Confident	86.6	Confident	189 Å²	189	77 Å²	77	82%	0.822	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	36.8	174.1	-56.8	-174.2	179.9	-178.4	0	114.9	M405 Y406 W407	M405-K409 PolarHBondContact O-N 3.05Å; Y406-K409 PolarHBondContact O-N 3.22Å; Y406-K409 VanDerWaalsContact O-N 3.07Å; W407-K409 PolarHBondContact O-N 2.89Å
410	K	79.9	Confident	86.4	Confident	43 Å²	43	75.5 Å²	75.5	19%	0.187	34%	0.344	C	S	.	.			trans	-72.4	157.3	171.3	-67.7	-81.4	-172.6	165.4	0	110.5	M405 N408 I415 G1050 E1135	M405-K410 HydrophobicContact CE-CB 4.16Å; M405-K410 HydrophobicContact CE-CG 3.99Å; M405-K410 PolarHBondContact O-N 3.13Å; N408-K410 VanDerWaalsContact C-N 3.28Å; N408-K410 PolarHBondContact O-N 2.91Å; K410-I415 HydrophobicContact CB-CG1 4.37Å; K410-I415 WeakPolarHBondContact O-CD1 3.26Å; K410-G1050 VanDerWaalsContact CE-O 3.22Å; K410-G1050 WeakPolarHBondContact CE-O 3.49Å; K410-G1050 PolarHBondContact NZ-O 3.1Å; K410-E1135 IonicContact NZ-OE1 3.55Å; K410-E1135 PolarHBondContact NZ-OE1 2.68Å
411	D	84.7	Confident	86.1	Confident	114 Å²	114	72.5 Å²	72.5	61%	0.61	33%	0.326	S	S	*	.			trans	-65.9	154.9	178.3	-55.4	-62.2	0	0	0	112.6	Y413 Y414 I415	D411-Y413 PolarHBondContact O-N 2.91Å; D411-Y413 VanDerWaalsContact O-N 3.14Å; D411-Y414 HydrophobicContact CB-CD2 4.08Å; D411-Y414 PolarHBondContact O-N 3.2Å; D411-I415 PolarHBondContact O-N 2.86Å
412	L	86.1	Confident	86	Confident	126 Å²	126	72.6 Å²	72.6	66%	0.66	33%	0.327	S	S	*	.	H	α-helix	trans	-55.7	-35.5	-176.4	-176.1	66.3	0	0	0	113.2	I415 I416	L412-I415 PolarHBondContact O-N 3.13Å; L412-I416 HydrophobicContact CD1-CD1 4.18Å; L412-I416 HydrophobicContact CD1-CG1 4.44Å; L412-I416 HydrophobicContact CG-CD1 4.03Å; L412-I416 WeakPolarHBondContact O-CG1 3.4Å; L412-I416 PolarHBondContact O-N 3.33Å; L412-I416 VanDerWaalsContact O-N 3.07Å
413	Y	84.7	Confident	85.6	Confident	132 Å²	132	71.3 Å²	71.3	52%	0.518	32%	0.319	S	S	.	.	H	α-helix	trans	-57.6	-49.9	174.7	173.3	-103	0	0	0	111.6	C205 D411 I416 L417	C205-Y413 PolarHBondContact O-OH 3.06Å; C205-Y413 VanDerWaalsContact O-OH 3.07Å; D411-Y413 PolarHBondContact O-N 2.91Å; D411-Y413 VanDerWaalsContact O-N 3.14Å; Y413-I416 PolarHBondContact O-N 2.87Å; Y413-L417 HydrophobicContact CE1-CD2 4.39Å; Y413-L417 HydrophobicContact CE2-CD2 4.15Å; Y413-L417 WeakPolarHBondContact O-CB 3.43Å; Y413-L417 PolarHBondContact O-N 2.82Å
414	Y	82.2	Confident	85.5	Confident	88 Å²	88	64.8 Å²	64.8	35%	0.345	29%	0.293	S	S	.	.	H	α-helix	trans	-66.5	-40.2	177.1	-66.7	-74.1	0	0	0	112.2	D411 I416 L417 R418 P419	D411-Y414 HydrophobicContact CB-CD2 4.08Å; D411-Y414 PolarHBondContact O-N 3.2Å; Y414-I416 PolarHBondContact O-N 3.41Å; Y414-L417 PolarHBondContact O-N 2.91Å; Y414-R418 HydrophobicContact CD1-CG 4.17Å; Y414-R418 WeakPolarHBondContact O-CB 3.37Å; Y414-R418 PolarHBondContact O-N 2.93Å; Y414-P419 WeakPolarHBondContact O-CD 3.39Å
415	I	87	Confident	85.4	Confident	23 Å²	23	63.9 Å²	63.9	12%	0.118	29%	0.289	C	S	.	.	H	α-helix	trans	-60.4	-31.6	177.9	-67.5	173.8	0	0	0	112	V402 M405 K410 D411 L412 P419	V402-I415 HydrophobicContact CG1-CG2 4.11Å; M405-I415 HydrophobicContact CB-CG1 3.98Å; K410-I415 HydrophobicContact CB-CG1 4.37Å; K410-I415 WeakPolarHBondContact O-CD1 3.26Å; D411-I415 PolarHBondContact O-N 2.86Å; L412-I415 PolarHBondContact O-N 3.13Å; I415-P419 VanDerWaalsContact O-CD 3.22Å; I415-P419 WeakPolarHBondContact O-CD 3.5Å; I415-P419 VanDerWaalsContact O-CG 3.25Å; I415-P419 WeakPolarHBondContact O-CG 3.49Å
416	I	86.3	Confident	85.5	Confident	100 Å²	100	63.8 Å²	63.8	51%	0.513	29%	0.288	S	S	.	.	H	α-helix	trans	-84	-49.3	176.4	-65.1	169.3	0	0	0	110.7	L412 Y413 Y414 L420	L412-I416 HydrophobicContact CD1-CD1 4.18Å; L412-I416 HydrophobicContact CD1-CG1 4.44Å; L412-I416 HydrophobicContact CG-CD1 4.03Å; L412-I416 WeakPolarHBondContact O-CG1 3.4Å; L412-I416 PolarHBondContact O-N 3.33Å; L412-I416 VanDerWaalsContact O-N 3.07Å; Y413-I416 PolarHBondContact O-N 2.87Å; Y414-I416 PolarHBondContact O-N 3.41Å; I416-L420 HydrophobicContact CG2-CD1 4.43Å; I416-L420 WeakPolarHBondContact O-CD1 3.45Å
417	L	85.2	Confident	85.3	Confident	29 Å²	29	56.2 Å²	56.2	15%	0.152	26%	0.259	C	S	.	.	H	α-helix	trans	-81.9	-41.2	-165.3	-149.6	83.4	0	0	0	113.8	C205 V206 Y413 Y414 L420	C205-L417 HydrophobicContact CB-CD1 4.33Å; C205-L417 HydrophobicContact CB-CD2 3.82Å; C205-L417 WeakPolarHBondContact O-CD2 3.41Å; V206-L417 HydrophobicContact CG2-CD2 3.56Å; V206-L417 HydrophobicContact CG2-CG 3.89Å; Y413-L417 HydrophobicContact CE1-CD2 4.39Å; Y413-L417 HydrophobicContact CE2-CD2 4.15Å; Y413-L417 WeakPolarHBondContact O-CB 3.43Å; Y413-L417 PolarHBondContact O-N 2.82Å; Y414-L417 PolarHBondContact O-N 2.91Å; L417-L420 PolarHBondContact O-N 3.22Å
418	R	82.9	Confident	84.8	Confident	11 Å²	11	47.8 Å²	47.8	4%	0.042	23%	0.227	C	C	.	.	H	α-helix	trans	-67.9	-42.3	-178.2	-72.9	-69.8	-151.7	179.5	5.6	112.9	Y208 M405 Y414 L420 D421 F1047 N1052 E1135 Y1136	Y208-R418 PolarHBondContact OH-NH1 2.7Å; M405-R418 HydrophobicContact CE-CB 3.91Å; M405-R418 HydrophobicContact CE-CG 4.13Å; M405-R418 HydrophobicContact SD-CB 3.71Å; Y414-R418 HydrophobicContact CD1-CG 4.17Å; Y414-R418 WeakPolarHBondContact O-CB 3.37Å; Y414-R418 PolarHBondContact O-N 2.93Å; R418-L420 VanDerWaalsContact C-N 3.27Å; R418-L420 PolarHBondContact O-N 3.06Å; R418-D421 VanDerWaalsContact O-CB 3.31Å; R418-D421 WeakPolarHBondContact O-CB 3.25Å; R418-D421 PolarHBondContact O-N 3.29Å; R418-F1047 HydrophobicContact CB-CZ 4.49Å; R418-N1052 PolarHBondContact NH1-ND2 3.11Å; R418-E1135 IonicContact CZ-OE2 2.69Å; R418-E1135 IonicContact NE-OE2 2.66Å; R418-E1135 IonicContact NH2-OE2 2.7Å; R418-E1135 PolarHBondContact NH2-OE2 2.97Å; R418-Y1136 PolarHBondContact NH2-OH 2.9Å
419	P	86.5	Confident	84.4	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-65.7	-27.4	176.6	-28.8	41.5	0	0	0	113.7	L398 V402 M405 Y414 I415 D421 L422	L398-P419 HydrophobicContact CD1-CB 3.52Å; L398-P419 WeakPolarHBondContact CD1-O 3.39Å; V402-P419 HydrophobicContact CG2-CB 3.81Å; V402-P419 HydrophobicContact CG2-CG 3.88Å; M405-P419 HydrophobicContact SD-CG 3.74Å; Y414-P419 WeakPolarHBondContact O-CD 3.39Å; I415-P419 VanDerWaalsContact O-CD 3.22Å; I415-P419 WeakPolarHBondContact O-CD 3.5Å; I415-P419 VanDerWaalsContact O-CG 3.25Å; I415-P419 WeakPolarHBondContact O-CG 3.49Å; P419-D421 VanDerWaalsContact C-N 3.25Å; P419-D421 PolarHBondContact O-N 3.23Å; P419-L422 VanDerWaalsContact O-CB 3.29Å; P419-L422 WeakPolarHBondContact O-CB 3.36Å; P419-L422 PolarHBondContact O-N 3.25Å
420	L	88.5	Confident	83.9	Confident	52 Å²	52	38.1 Å²	38.1	27%	0.272	19%	0.186	S	C	.	.	H	α-helix	trans	-63.2	-30.9	174.5	-85.7	166.3	0	0	0	112.6	I202 I416 L417 R418 L422 V423	I202-L420 HydrophobicContact CD1-CD1 4.38Å; I416-L420 HydrophobicContact CG2-CD1 4.43Å; I416-L420 WeakPolarHBondContact O-CD1 3.45Å; L417-L420 PolarHBondContact O-N 3.22Å; R418-L420 VanDerWaalsContact C-N 3.27Å; R418-L420 PolarHBondContact O-N 3.06Å; L420-L422 VanDerWaalsContact C-N 3.27Å; L420-L422 PolarHBondContact O-N 2.92Å; L420-V423 WeakPolarHBondContact O-CB 3.31Å; L420-V423 PolarHBondContact O-N 3.47Å; L420-V423 VanDerWaalsContact O-N 3.1Å
421	D	85.3	Confident	83.6	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-61.3	-35.1	176	-172	30.3	0	0	0	112.1	W203 R418 P419 V423 T424 I425	W203-D421 VanDerWaalsContact CD1-OD1 3.26Å; W203-D421 PolarHBondContact NE1-OD1 3.31Å; R418-D421 VanDerWaalsContact O-CB 3.31Å; R418-D421 WeakPolarHBondContact O-CB 3.25Å; R418-D421 PolarHBondContact O-N 3.29Å; P419-D421 VanDerWaalsContact C-N 3.25Å; P419-D421 PolarHBondContact O-N 3.23Å; D421-V423 PolarHBondContact O-N 3.11Å; D421-V423 VanDerWaalsContact O-N 3.14Å; D421-T424 WeakPolarHBondContact O-CA 3.47Å; D421-T424 WeakPolarHBondContact O-CB 3.39Å; D421-T424 PolarHBondContact O-N 2.83Å; D421-T424 PolarHBondContact O-OG1 3.26Å; D421-T424 PolarHBondContact OD1-OG1 3.14Å; D421-I425 WeakPolarHBondContact O-CG1 3.45Å; D421-I425 PolarHBondContact O-N 3.44Å
422	L	87.8	Confident	82.8	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.01	17%	0.166	C	C	.	.	H	α-helix	trans	-57	-32.2	175	-168	76.3	0	0	0	112.6	G397 P419 L420 T424 I425 V426 S1040 I1044	G397-L422 WeakPolarHBondContact O-CD2 3.32Å; P419-L422 VanDerWaalsContact O-CB 3.29Å; P419-L422 WeakPolarHBondContact O-CB 3.36Å; P419-L422 PolarHBondContact O-N 3.25Å; L420-L422 VanDerWaalsContact C-N 3.27Å; L420-L422 PolarHBondContact O-N 2.92Å; L422-T424 VanDerWaalsContact C-N 3.31Å; L422-I425 PolarHBondContact O-N 3.39Å; L422-V426 WeakPolarHBondContact O-CG2 3.32Å; L422-V426 PolarHBondContact O-N 3.25Å; L422-S1040 WeakPolarHBondContact CD1-O 3.29Å; L422-I1044 HydrophobicContact CD1-CD1 4.32Å; L422-I1044 HydrophobicContact CD1-CG1 3.96Å; L422-I1044 HydrophobicContact CD2-CD1 4.08Å; L422-I1044 HydrophobicContact CD2-CG1 4.01Å
423	V	84.3	Confident	82	Confident	29 Å²	29	29.3 Å²	29.3	18%	0.176	15%	0.145	C	C	.	.	H	α-helix	trans	-68.9	-32.7	176.4	-174.4	0	0	0	0	111.2	A394 L398 L420 D421	A394-V423 HydrophobicContact CB-CG1 4.31Å; A394-V423 HydrophobicContact CB-CG2 4.43Å; L398-V423 HydrophobicContact CB-CG2 4.47Å; L398-V423 HydrophobicContact CD1-CG2 4.32Å; L398-V423 HydrophobicContact CD2-CG2 4.45Å; L420-V423 WeakPolarHBondContact O-CB 3.31Å; L420-V423 PolarHBondContact O-N 3.47Å; L420-V423 VanDerWaalsContact O-N 3.1Å; D421-V423 PolarHBondContact O-N 3.11Å; D421-V423 VanDerWaalsContact O-N 3.14Å
424	T	88	Confident	81.4	Confident	3 Å²	3	23 Å²	23	2%	0.018	12%	0.121	C	C	.	.	H	α-helix	trans	-72.6	-44.7	174.7	83.3	0	0	0	0	111.1	I202 W203 D421 L422 V426 I427	I202-T424 HydrophobicContact CB-CG2 4.49Å; I202-T424 HydrophobicContact CG2-CG2 4.46Å; W203-T424 VanDerWaalsContact CZ2-OG1 3.31Å; W203-T424 WeakPolarHBondContact CZ2-OG1 3.31Å; W203-T424 PolarHBondContact NE1-OG1 2.7Å; D421-T424 WeakPolarHBondContact O-CA 3.47Å; D421-T424 WeakPolarHBondContact O-CB 3.39Å; D421-T424 PolarHBondContact O-N 2.83Å; D421-T424 PolarHBondContact O-OG1 3.26Å; D421-T424 PolarHBondContact OD1-OG1 3.14Å; L422-T424 VanDerWaalsContact C-N 3.31Å; T424-V426 VanDerWaalsContact C-N 3.33Å; T424-V426 PolarHBondContact O-N 3.21Å; T424-I427 PolarHBondContact O-N 3.41Å
425	I	88.6	Confident	80.8	Confident	13 Å²	13	20.7 Å²	20.7	7%	0.067	11%	0.113	C	C	.	.	H	α-helix	trans	-60.2	-40.1	-178.4	-65.8	166.5	0	0	0	111.8	D421 L422 I427 S1036 Q1039 T1043 F1058	D421-I425 WeakPolarHBondContact O-CG1 3.45Å; D421-I425 PolarHBondContact O-N 3.44Å; L422-I425 PolarHBondContact O-N 3.39Å; I425-I427 PolarHBondContact O-N 3.06Å; I425-S1036 WeakPolarHBondContact O-CB 3.23Å; I425-Q1039 HydrophobicContact CG2-CB 4.08Å; I425-Q1039 HydrophobicContact CG2-CG 3.85Å; I425-T1043 HydrophobicContact CD1-CG2 3.88Å; I425-F1058 HydrophobicContact CD1-CE1 3.81Å; I425-F1058 HydrophobicContact CD1-CZ 3.64Å; I425-F1058 HydrophobicContact CG1-CE1 4.03Å; I425-F1058 HydrophobicContact CG1-CZ 4.3Å
426	V	87.3	Confident	80.3	Confident	1 Å²	1	22.2 Å²	22.2	1%	0.006	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-23.7	-177.9	168	0	0	0	0	113	L390 A394 L422 T424 P428 S1036	L390-V426 HydrophobicContact CB-CG1 3.92Å; L390-V426 HydrophobicContact CD2-CG1 4.14Å; L390-V426 HydrophobicContact CG-CG1 4.46Å; A394-V426 HydrophobicContact CB-CB 4.03Å; A394-V426 HydrophobicContact CB-CG1 4.02Å; A394-V426 HydrophobicContact CB-CG2 4.13Å; L422-V426 WeakPolarHBondContact O-CG2 3.32Å; L422-V426 PolarHBondContact O-N 3.25Å; T424-V426 VanDerWaalsContact C-N 3.33Å; T424-V426 PolarHBondContact O-N 3.21Å; V426-P428 WeakPolarHBondContact O-CD 3.44Å; V426-S1036 WeakPolarHBondContact O-CB 3.32Å; V426-S1036 PolarHBondContact O-OG 2.91Å
427	I	82.9	Confident	80	Confident	9 Å²	9	18 Å²	18	5%	0.046	11%	0.105	C	C	.	.	S	Bend	trans	-109.4	104.7	-175.3	-63.1	175.3	0	0	0	110.3	F195 L387 T424 I425	F195-I427 HydrophobicContact CD1-CB 4.43Å; F195-I427 HydrophobicContact CD1-CG2 3.96Å; F195-I427 HydrophobicContact CE1-CB 3.62Å; F195-I427 HydrophobicContact CE1-CD1 4Å; F195-I427 HydrophobicContact CE1-CG1 4.36Å; F195-I427 HydrophobicContact CE1-CG2 3.64Å; F195-I427 HydrophobicContact CE2-CD1 3.95Å; F195-I427 HydrophobicContact CZ-CB 3.96Å; F195-I427 HydrophobicContact CZ-CD1 3.62Å; F195-I427 HydrophobicContact CZ-CG1 4.25Å; F195-I427 HydrophobicContact CZ-CG2 4.35Å; L387-I427 HydrophobicContact CD1-CB 4.39Å; L387-I427 HydrophobicContact CD1-CD1 3.89Å; L387-I427 HydrophobicContact CD1-CG1 3.86Å; L387-I427 HydrophobicContact CD1-CG2 3.7Å; T424-I427 PolarHBondContact O-N 3.41Å; I425-I427 PolarHBondContact O-N 3.06Å
428	P	77.5	Confident	79.9	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	10%	0.098	C	C	.	.			trans	-59.9	126.4	-173.1	-23.9	31.7	0	0	0	113.6	F192 V426 I430 L431 M1032 Y1035	F192-P428 WeakPolarHBondContact CZ-O 3.39Å; V426-P428 WeakPolarHBondContact O-CD 3.44Å; P428-I430 PolarHBondContact O-N 3.35Å; P428-I430 VanDerWaalsContact O-N 3.08Å; P428-L431 HydrophobicContact CB-CB 4.24Å; P428-L431 HydrophobicContact CB-CD1 4.47Å; P428-L431 HydrophobicContact CG-CD1 4.26Å; P428-L431 WeakPolarHBondContact O-CB 3.46Å; P428-L431 PolarHBondContact O-N 3.49Å; P428-M1032 HydrophobicContact CB-CB 4.33Å; P428-M1032 HydrophobicContact CG-CB 4.07Å; P428-Y1035 HydrophobicContact CB-CE1 4.1Å; P428-Y1035 HydrophobicContact CG-CE1 4.25Å
429	P	72.2	Confident	80	Confident	20 Å²	20	17.2 Å²	17.2	13%	0.13	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-10.7	179.4	26.5	-34.7	0	0	0	113.9	F192 I215	F192-P429 WeakPolarHBondContact CE1-O 3.33Å; F192-P429 WeakPolarHBondContact CZ-O 3.29Å; I215-P429 HydrophobicContact CD1-CG 4.2Å; I215-P429 HydrophobicContact CG2-CB 4.22Å
430	I	74.6	Confident	79.9	Confident	5 Å²	5	20.8 Å²	20.8	3%	0.026	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110	5.6	-178.8	-170.7	162.5	0	0	0	113.5	F218 P428 P432 V433 A434 M1032 T1067	F218-I430 HydrophobicContact CE1-CD1 4.17Å; F218-I430 HydrophobicContact CE1-CG1 4.31Å; F218-I430 HydrophobicContact CZ-CD1 3.97Å; F218-I430 HydrophobicContact CZ-CG1 4.48Å; P428-I430 PolarHBondContact O-N 3.35Å; P428-I430 VanDerWaalsContact O-N 3.08Å; I430-P432 VanDerWaalsContact C-CD 3.49Å; I430-V433 HydrophobicContact CG1-CB 3.91Å; I430-V433 HydrophobicContact CG1-CG1 4.39Å; I430-V433 HydrophobicContact CG1-CG2 4.32Å; I430-V433 WeakPolarHBondContact O-CB 3.38Å; I430-V433 PolarHBondContact O-N 2.98Å; I430-V433 VanDerWaalsContact O-N 3.16Å; I430-A434 PolarHBondContact O-N 3.41Å; I430-A434 VanDerWaalsContact O-N 3.12Å; I430-M1032 HydrophobicContact CB-CE 4.16Å; I430-M1032 HydrophobicContact CG1-CE 4.04Å; I430-M1032 HydrophobicContact CG2-CE 3.33Å; I430-M1032 HydrophobicContact CG2-SD 3.79Å; I430-T1067 HydrophobicContact CD1-CG2 3.76Å; I430-T1067 WeakPolarHBondContact CD1-OG1 3.46Å
431	L	72.4	Confident	79.9	Confident	14 Å²	14	20.4 Å²	20.4	7%	0.073	12%	0.119	C	C	.	.	H	α-helix	trans	-53.5	-42.7	-176.2	-161.6	68.7	0	0	0	115.4	F192 P428 V433 A434 M435 F1029 M1032	F192-L431 HydrophobicContact CE2-CB 4.17Å; P428-L431 HydrophobicContact CB-CB 4.24Å; P428-L431 HydrophobicContact CB-CD1 4.47Å; P428-L431 HydrophobicContact CG-CD1 4.26Å; P428-L431 WeakPolarHBondContact O-CB 3.46Å; P428-L431 PolarHBondContact O-N 3.49Å; L431-V433 PolarHBondContact O-N 3.38Å; L431-A434 PolarHBondContact O-N 2.72Å; L431-M435 WeakPolarHBondContact O-CG 3.32Å; L431-M435 PolarHBondContact O-N 3.21Å; L431-F1029 HydrophobicContact CD1-CD2 3.8Å; L431-F1029 HydrophobicContact CD1-CE2 3.72Å; L431-F1029 HydrophobicContact CD2-CE2 4.1Å; L431-F1029 HydrophobicContact CG-CD2 4.47Å; L431-F1029 HydrophobicContact CG-CE2 4.18Å; L431-M1032 HydrophobicContact CD1-CB 3.93Å; L431-M1032 HydrophobicContact CD1-SD 4.26Å
432	P	69.3	Low	80.2	Confident	48 Å²	48	20.3 Å²	20.3	31%	0.312	12%	0.119	S	C	.	.	H	α-helix	trans	-70.7	-32.5	-179.3	-17.3	31.7	0	0	0	112.8	F192 I430 S436	F192-P432 HydrophobicContact CB-CG 4.39Å; F192-P432 HydrophobicContact CD1-CG 3.48Å; F192-P432 VanDerWaalsContact CD1-CG 3.48Å; F192-P432 HydrophobicContact CD2-CG 3.72Å; F192-P432 HydrophobicContact CE1-CG 3.55Å; F192-P432 HydrophobicContact CE2-CG 3.81Å; F192-P432 HydrophobicContact CG-CG 3.56Å; F192-P432 HydrophobicContact CZ-CG 3.72Å; I430-P432 VanDerWaalsContact C-CD 3.49Å; P432-S436 PolarHBondContact O-N 2.84Å; P432-S436 PolarHBondContact O-OG 3.24Å
433	V	69.3	Low	80.3	Confident	35 Å²	35	22.3 Å²	22.3	21%	0.212	13%	0.128	C	C	.	.	H	α-helix	trans	-64.8	-48.4	175.2	-179.7	0	0	0	0	108.6	F218 I430 L431 M435 S436 V437	F218-V433 HydrophobicContact CE1-CG2 4.5Å; I430-V433 HydrophobicContact CG1-CB 3.91Å; I430-V433 HydrophobicContact CG1-CG1 4.39Å; I430-V433 HydrophobicContact CG1-CG2 4.32Å; I430-V433 WeakPolarHBondContact O-CB 3.38Å; I430-V433 PolarHBondContact O-N 2.98Å; I430-V433 VanDerWaalsContact O-N 3.16Å; L431-V433 PolarHBondContact O-N 3.38Å; V433-M435 VanDerWaalsContact C-N 3.34Å; V433-M435 PolarHBondContact O-N 3.18Å; V433-S436 CarbonylContact O-C 3.59Å; V433-S436 WeakPolarHBondContact O-CA 3.5Å; V433-S436 PolarHBondContact O-N 2.98Å; V433-V437 HydrophobicContact CG1-CG2 3.91Å; V433-V437 VanDerWaalsContact O-CG2 3.31Å; V433-V437 WeakPolarHBondContact O-CG2 3.49Å; V433-V437 PolarHBondContact O-N 3.43Å
434	A	71.4	Confident	80.5	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.008	15%	0.148	C	C	.	.	H	α-helix	trans	-56.6	-41.6	177.2	0	0	0	0	0	114.7	I430 L431 S436 T1028 M1032	I430-A434 PolarHBondContact O-N 3.41Å; I430-A434 VanDerWaalsContact O-N 3.12Å; L431-A434 PolarHBondContact O-N 2.72Å; A434-S436 PolarHBondContact O-N 3.03Å; A434-T1028 HydrophobicContact CB-CG2 3.49Å; A434-T1028 VanDerWaalsContact CB-CG2 3.49Å; A434-M1032 HydrophobicContact CB-CE 3.51Å; A434-M1032 HydrophobicContact CB-CG 4.41Å; A434-M1032 HydrophobicContact CB-SD 3.26Å; A434-M1032 WeakPolarHBondContact CB-SD 3.38Å
435	M	70.3	Confident	80.7	Confident	39 Å²	39	29.3 Å²	29.3	19%	0.192	15%	0.151	C	C	.	.	H	α-helix	trans	-59.5	-32.7	175.8	-71.1	171.4	64.4	0	0	112	F379 T380 A383 L431 V433 S1025	F379-M435 HydrophobicContact CD1-CE 4.21Å; F379-M435 HydrophobicContact CE1-CB 4.41Å; F379-M435 HydrophobicContact CE1-CE 3.64Å; F379-M435 HydrophobicContact CE1-CG 4.24Å; F379-M435 HydrophobicContact CZ-CE 4.41Å; F379-M435 HydrophobicContact CZ-CG 4.28Å; T380-M435 HydrophobicContact CG2-CE 4.47Å; A383-M435 HydrophobicContact CB-CE 4.06Å; A383-M435 HydrophobicContact CB-SD 4.44Å; L431-M435 WeakPolarHBondContact O-CG 3.32Å; L431-M435 PolarHBondContact O-N 3.21Å; V433-M435 VanDerWaalsContact C-N 3.34Å; V433-M435 PolarHBondContact O-N 3.18Å; M435-S1025 PolarHBondContact O-OG 2.95Å
436	S	76.4	Confident	80.9	Confident	55 Å²	55	28.8 Å²	28.8	39%	0.385	15%	0.148	S	C	.	.	H	α-helix	trans	-94.5	-29.3	-171.9	-50.1	0	0	0	0	113.6	P432 V433 A434 G438 I439 V440	P432-S436 PolarHBondContact O-N 2.84Å; P432-S436 PolarHBondContact O-OG 3.24Å; V433-S436 CarbonylContact O-C 3.59Å; V433-S436 WeakPolarHBondContact O-CA 3.5Å; V433-S436 PolarHBondContact O-N 2.98Å; A434-S436 PolarHBondContact O-N 3.03Å; S436-G438 VanDerWaalsContact C-N 3.31Å; S436-G438 PolarHBondContact O-N 3.22Å; S436-I439 WeakPolarHBondContact O-CA 3.33Å; S436-I439 WeakPolarHBondContact O-CB 3.46Å; S436-I439 PolarHBondContact O-N 2.98Å; S436-V440 PolarHBondContact O-N 3.13Å
437	V	80.2	Confident	80.9	Confident	12 Å²	12	35.1 Å²	35.1	7%	0.073	17%	0.172	C	C	.	.	H	α-helix	trans	-52	-44.3	-178	156.9	0	0	0	0	112.8	V433 I439 V440 F441 L1071	V433-V437 HydrophobicContact CG1-CG2 3.91Å; V433-V437 VanDerWaalsContact O-CG2 3.31Å; V433-V437 WeakPolarHBondContact O-CG2 3.49Å; V433-V437 PolarHBondContact O-N 3.43Å; V437-I439 VanDerWaalsContact C-N 3.3Å; V437-I439 PolarHBondContact O-N 2.91Å; V437-V440 PolarHBondContact O-N 2.91Å; V437-F441 HydrophobicContact CG1-CD2 3.79Å; V437-F441 HydrophobicContact CG1-CE2 3.68Å; V437-F441 WeakPolarHBondContact O-CD2 3.42Å; V437-F441 PolarHBondContact O-N 3.11Å; V437-F441 VanDerWaalsContact O-N 3.14Å; V437-L1071 HydrophobicContact CG2-CD2 4.04Å
438	G	81.9	Confident	81.3	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.01	20%	0.2	C	C	.	.	H	α-helix	trans	-62.9	-34.5	177.5	0	0	0	0	0	113.6	S436 A442	S436-G438 VanDerWaalsContact C-N 3.31Å; S436-G438 PolarHBondContact O-N 3.22Å; G438-A442 WeakPolarHBondContact O-CB 3.47Å; G438-A442 PolarHBondContact O-N 2.96Å
439	I	84.8	Confident	81.9	Confident	22 Å²	22	45 Å²	45	11%	0.113	22%	0.222	C	C	.	.	H	α-helix	trans	-72.5	-49.1	177.8	-60.3	173.9	0	0	0	110.2	S436 V437 F441 A442 Q443 P456 M459	S436-I439 WeakPolarHBondContact O-CA 3.33Å; S436-I439 WeakPolarHBondContact O-CB 3.46Å; S436-I439 PolarHBondContact O-N 2.98Å; V437-I439 VanDerWaalsContact C-N 3.3Å; V437-I439 PolarHBondContact O-N 2.91Å; I439-F441 PolarHBondContact O-N 3.39Å; I439-A442 PolarHBondContact O-N 2.93Å; I439-Q443 WeakPolarHBondContact O-CB 3.33Å; I439-Q443 PolarHBondContact O-N 3.08Å; I439-P456 HydrophobicContact CG2-CB 3.72Å; I439-P456 WeakPolarHBondContact CG2-O 3.46Å; I439-M459 HydrophobicContact CG1-CB 4.36Å; I439-M459 HydrophobicContact CG2-CB 3.83Å; I439-M459 HydrophobicContact CG2-CG 4.2Å
440	V	85.2	Confident	82.6	Confident	74 Å²	74	44.8 Å²	44.8	45%	0.448	22%	0.223	S	C	.	.	H	α-helix	trans	-60.3	-44	-177.3	173.8	0	0	0	0	111.2	S436 V437 R444	S436-V440 PolarHBondContact O-N 3.13Å; V437-V440 PolarHBondContact O-N 2.91Å; V440-R444 PolarHBondContact O-N 2.97Å
441	F	88.3	Confident	83.4	Confident	44 Å²	44	44.7 Å²	44.7	19%	0.193	22%	0.223	C	C	.	.	H	α-helix	trans	-68.7	-38.5	176.5	-71.8	-50.3	0	0	0	113	V437 I439 R444 R445 G1074 Y1075	V437-F441 HydrophobicContact CG1-CD2 3.79Å; V437-F441 HydrophobicContact CG1-CE2 3.68Å; V437-F441 WeakPolarHBondContact O-CD2 3.42Å; V437-F441 PolarHBondContact O-N 3.11Å; V437-F441 VanDerWaalsContact O-N 3.14Å; I439-F441 PolarHBondContact O-N 3.39Å; F441-R444 PolarHBondContact O-N 3.49Å; F441-R445 WeakPolarHBondContact O-CG 3.29Å; F441-R445 PolarHBondContact O-N 3.39Å; F441-G1074 VanDerWaalsContact CD2-C 3.48Å; F441-G1074 WeakPolarHBondContact CD2-O 3.24Å; F441-Y1075 AromaticContact CD1-CD2 3.96Å; F441-Y1075 HydrophobicContact CD1-CD2 3.96Å; F441-Y1075 HydrophobicContact CD1-CE2 4.5Å; F441-Y1075 AromaticContact CE1-CD2 3.87Å; F441-Y1075 HydrophobicContact CE1-CD2 3.87Å; F441-Y1075 HydrophobicContact CE1-CE2 4.48Å; F441-Y1075 HydrophobicContact CG-CD2 4.43Å; F441-Y1075 HydrophobicContact CZ-CD2 4.23Å
442	A	90.4	Very high	84	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-63.2	-44.5	174.6	0	0	0	0	0	111.9	G438 I439 R444 R445 L446 M459 E1017 A1021	G438-A442 WeakPolarHBondContact O-CB 3.47Å; G438-A442 PolarHBondContact O-N 2.96Å; I439-A442 PolarHBondContact O-N 2.93Å; A442-R444 PolarHBondContact O-N 2.77Å; A442-R445 PolarHBondContact O-N 2.84Å; A442-L446 WeakPolarHBondContact O-CB 3.21Å; A442-L446 WeakPolarHBondContact O-CG 3.45Å; A442-L446 PolarHBondContact O-N 3.27Å; A442-M459 HydrophobicContact CB-CG 4.07Å; A442-M459 HydrophobicContact CB-SD 4.04Å; A442-E1017 HydrophobicContact CB-CB 4.49Å; A442-A1021 HydrophobicContact CB-CB 3.97Å
443	Q	89.9	Confident	84.7	Confident	43 Å²	43	47.8 Å²	47.8	20%	0.201	23%	0.23	C	C	.	.	H	α-helix	trans	-60.7	-42.4	175.2	-176.9	174.6	7.4	0	0	112	I439 R445 L446 R447 C453 M459	I439-Q443 WeakPolarHBondContact O-CB 3.33Å; I439-Q443 PolarHBondContact O-N 3.08Å; Q443-R445 PolarHBondContact O-N 3.23Å; Q443-L446 PolarHBondContact O-N 3.4Å; Q443-R447 WeakPolarHBondContact O-CB 3.39Å; Q443-R447 PolarHBondContact O-N 2.97Å; Q443-C453 HydrophobicContact CG-CB 4.07Å; Q443-C453 PolarHBondContact NE2-O 2.81Å; Q443-C453 VanDerWaalsContact NE2-O 3.14Å; Q443-M459 HydrophobicContact CB-CE 4.3Å
444	R	88.7	Confident	85	Confident	158 Å²	158	50.4 Å²	50.4	60%	0.596	24%	0.242	S	C	*	.	H	α-helix	trans	-62.5	-40.8	174.7	-172.6	174.2	179.3	166.6	0.2	111.9	V440 F441 A442 N448	V440-R444 PolarHBondContact O-N 2.97Å; F441-R444 PolarHBondContact O-N 3.49Å; A442-R444 PolarHBondContact O-N 2.77Å; R444-N448 PolarHBondContact O-N 3.43Å; R444-N448 PolarHBondContact O-OD1 3.16Å
445	R	92.5	Very high	85	Confident	22 Å²	22	53.3 Å²	53.3	8%	0.083	26%	0.257	C	S	.	.	H	α-helix	trans	-67.4	-41.8	176.4	-72.3	-170.8	-61.7	-97.6	-5.8	112.5	F441 A442 Q443 N448 H449 E1017 Y1075 H1077	F441-R445 WeakPolarHBondContact O-CG 3.29Å; F441-R445 PolarHBondContact O-N 3.39Å; A442-R445 PolarHBondContact O-N 2.84Å; Q443-R445 PolarHBondContact O-N 3.23Å; R445-N448 PolarHBondContact O-N 2.86Å; R445-H449 PolarHBondContact O-ND1 3.41Å; R445-E1017 IonicContact CZ-OE1 2.66Å; R445-E1017 IonicContact CZ-OE2 2.67Å; R445-E1017 VanDerWaalsContact CZ-OE2 3.24Å; R445-E1017 VanDerWaalsContact NE-CD 3.3Å; R445-E1017 IonicContact NE-OE1 2.73Å; R445-E1017 PolarHBondContact NE-OE1 3.18Å; R445-E1017 IonicContact NE-OE2 3.95Å; R445-E1017 PolarHBondContact NE-OE2 3.33Å; R445-E1017 IonicContact NH2-OE2 2.7Å; R445-E1017 PolarHBondContact NH2-OE2 3.01Å; R445-Y1075 PolarHBondContact NH1-O 2.82Å; R445-H1077 WeakPolarHBondContact CD-ND1 3.45Å
446	L	92.5	Very high	85.3	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-65.9	-40.8	177.6	-74.5	164.5	0	0	0	112.1	A442 Q443 N448 H449 G450 I451 M459 M1013 L1014 E1017	A442-L446 WeakPolarHBondContact O-CB 3.21Å; A442-L446 WeakPolarHBondContact O-CG 3.45Å; A442-L446 PolarHBondContact O-N 3.27Å; Q443-L446 PolarHBondContact O-N 3.4Å; L446-N448 VanDerWaalsContact C-N 3.26Å; L446-N448 PolarHBondContact O-N 3.12Å; L446-H449 CarbonylContact O-C 3.47Å; L446-H449 WeakPolarHBondContact O-CA 3.36Å; L446-H449 PolarHBondContact O-N 3.08Å; L446-G450 PolarHBondContact O-N 3.47Å; L446-I451 CarbonylContact C-O 3.56Å; L446-I451 HydrophobicContact CB-CB 4.14Å; L446-I451 HydrophobicContact CB-CG2 4.36Å; L446-I451 HydrophobicContact CD2-CB 4.33Å; L446-I451 HydrophobicContact CD2-CD1 3.87Å; L446-I451 HydrophobicContact CD2-CG2 4.34Å; L446-I451 PolarHBondContact O-N 3.26Å; L446-M459 HydrophobicContact CD1-CE 3.49Å; L446-M459 VanDerWaalsContact CD1-CE 3.49Å; L446-M459 HydrophobicContact CD1-SD 3.64Å; L446-M1013 HydrophobicContact CD2-CG 4.13Å; L446-M1013 HydrophobicContact CD2-SD 4.39Å; L446-L1014 HydrophobicContact CD1-CD1 3.71Å; L446-L1014 HydrophobicContact CD2-CD1 4.43Å; L446-E1017 HydrophobicContact CD1-CB 4.08Å; L446-E1017 HydrophobicContact CD2-CB 4.19Å; L446-E1017 HydrophobicContact CD2-CG 4.1Å; L446-E1017 HydrophobicContact CG-CB 4.15Å; L446-E1017 HydrophobicContact CG-CG 4.15Å
447	R	88.9	Confident	85	Confident	134 Å²	134	54.1 Å²	54.1	51%	0.506	27%	0.266	S	S	.	.	H	α-helix	trans	-58.1	-39	175.4	-168.2	-177.7	71.5	-168.4	6.4	112.2	Q443 H449 G450 I451 Y452	Q443-R447 WeakPolarHBondContact O-CB 3.39Å; Q443-R447 PolarHBondContact O-N 2.97Å; R447-H449 PolarHBondContact O-N 2.95Å; R447-G450 PolarHBondContact O-N 2.91Å; R447-I451 WeakPolarHBondContact CA-O 3.41Å; R447-I451 PolarHBondContact N-O 3.21Å; R447-Y452 HydrophobicContact CG-CD1 4.07Å; R447-Y452 HydrophobicContact CG-CE1 3.88Å
448	N	90.2	Very high	85.1	Confident	119 Å²	119	53.6 Å²	53.6	64%	0.636	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-14.7	175.9	-68	7.8	0	0	0	113.6	R444 R445 L446	R444-N448 PolarHBondContact O-N 3.43Å; R444-N448 PolarHBondContact O-OD1 3.16Å; R445-N448 PolarHBondContact O-N 2.86Å; L446-N448 VanDerWaalsContact C-N 3.26Å; L446-N448 PolarHBondContact O-N 3.12Å
449	H	89.5	Confident	85.4	Confident	98 Å²	98	53.6 Å²	53.6	45%	0.454	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	8.9	174.1	-64.5	84.6	0	0	0	112.8	R445 L446 R447 M1013	R445-H449 PolarHBondContact O-ND1 3.41Å; L446-H449 CarbonylContact O-C 3.47Å; L446-H449 WeakPolarHBondContact O-CA 3.36Å; L446-H449 PolarHBondContact O-N 3.08Å; R447-H449 PolarHBondContact O-N 2.95Å; H449-M1013 HydrophobicContact CB-CE 4.3Å; H449-M1013 HydrophobicContact CB-SD 3.65Å; H449-M1013 VanDerWaalsContact CD2-CE 3.5Å; H449-M1013 WeakPolarHBondContact CD2-CE 3.48Å; H449-M1013 VanDerWaalsContact CG-SD 3.55Å
450	G	88.3	Confident	85.4	Confident	15 Å²	15	52.9 Å²	52.9	16%	0.155	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.5	23.1	-175.9	0	0	0	0	0	114	L446 R447 S1003 K1004	L446-G450 PolarHBondContact O-N 3.47Å; R447-G450 PolarHBondContact O-N 2.91Å; G450-S1003 WeakPolarHBondContact O-CA 3.47Å; G450-K1004 PolarHBondContact O-N 3.39Å
451	I	90.6	Very high	85.4	Confident	4 Å²	4	49.5 Å²	49.5	2%	0.021	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	109.1	174.1	-57.9	167.1	0	0	0	108.4	L446 R447 T1002 C1010 M1013	L446-I451 CarbonylContact C-O 3.56Å; L446-I451 HydrophobicContact CB-CB 4.14Å; L446-I451 HydrophobicContact CB-CG2 4.36Å; L446-I451 HydrophobicContact CD2-CB 4.33Å; L446-I451 HydrophobicContact CD2-CD1 3.87Å; L446-I451 HydrophobicContact CD2-CG2 4.34Å; L446-I451 PolarHBondContact O-N 3.26Å; R447-I451 WeakPolarHBondContact CA-O 3.41Å; R447-I451 PolarHBondContact N-O 3.21Å; I451-T1002 CarbonylContact C-O 3.53Å; I451-T1002 WeakPolarHBondContact CA-O 3.17Å; I451-C1010 HydrophobicContact CD1-CB 3.6Å; I451-C1010 HydrophobicContact CG1-CB 4.01Å; I451-M1013 HydrophobicContact CD1-CG 4.44Å; I451-M1013 HydrophobicContact CD1-SD 3.8Å
452	Y	86.3	Confident	85.6	Confident	110 Å²	110	47.4 Å²	47.4	43%	0.431	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	141.1	-180	-59.4	-91.1	0	0	0	109.7	R447 F1001 T1002 K1004	R447-Y452 HydrophobicContact CG-CD1 4.07Å; R447-Y452 HydrophobicContact CG-CE1 3.88Å; Y452-F1001 VanDerWaalsContact O-CA 3.26Å; Y452-F1001 WeakPolarHBondContact O-CA 3.49Å; Y452-T1002 PolarHBondContact N-O 3.44Å; Y452-T1002 PolarHBondContact O-N 3.17Å; Y452-K1004 HydrophobicContact CE2-CB 4.48Å
453	C	83.2	Confident	85.5	Confident	16 Å²	16	47.4 Å²	47.4	11%	0.108	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	118.6	178.3	173.3	0	0	0	0	108.7	Q443 N455 M459 P1000 F1001	Q443-C453 HydrophobicContact CG-CB 4.07Å; Q443-C453 PolarHBondContact NE2-O 2.81Å; Q443-C453 VanDerWaalsContact NE2-O 3.14Å; C453-N455 PolarHBondContact SG-O 3.49Å; C453-M459 HydrophobicContact CB-CE 4.32Å; C453-P1000 WeakPolarHBondContact CA-O 3.46Å; C453-F1001 HydrophobicContact CB-CD1 3.72Å; C453-F1001 HydrophobicContact CB-CE1 3.71Å; C453-F1001 WeakPolarHBondContact SG-CE1 3.38Å
454	I	75.2	Confident	85.5	Confident	90 Å²	90	45.7 Å²	45.7	46%	0.462	22%	0.222	S	C	.	.	S	Bend	trans	-84.4	-35.4	177.7	-56.5	-179.3	0	0	0	110.3	P456 P1000	I454-P456 WeakPolarHBondContact O-CD 3.3Å; I454-P1000 PolarHBondContact N-O 3.16Å
455	N	72.2	Confident	85.6	Confident	62 Å²	62	38.2 Å²	38.2	33%	0.332	19%	0.194	S	C	.	.			trans	-120.6	93.9	-177.6	-174.5	-6.8	0	0	0	112.5	C453 S457 V458 P1000	C453-N455 PolarHBondContact SG-O 3.49Å; N455-S457 PolarHBondContact O-N 2.97Å; N455-S457 WeakPolarHBondContact OD1-CB 3.42Å; N455-S457 PolarHBondContact OD1-N 3.14Å; N455-S457 PolarHBondContact OD1-OG 3.49Å; N455-V458 HydrophobicContact CB-CG2 4.02Å; N455-V458 PolarHBondContact O-N 2.81Å; N455-V458 VanDerWaalsContact O-N 3.11Å; N455-P1000 HydrophobicContact CB-CB 4.21Å
456	P	75.7	Confident	85.6	Confident	38 Å²	38	38 Å²	38	25%	0.247	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-58	-25	-177.7	-25.8	34.7	0	0	0	114.8	I439 I454 V458 M459	I439-P456 HydrophobicContact CG2-CB 3.72Å; I439-P456 WeakPolarHBondContact CG2-O 3.46Å; I454-P456 WeakPolarHBondContact O-CD 3.3Å; P456-V458 PolarHBondContact O-N 3.27Å; P456-M459 VanDerWaalsContact O-CB 3.26Å; P456-M459 WeakPolarHBondContact O-CB 3.4Å; P456-M459 PolarHBondContact O-N 3.01Å; P456-M459 VanDerWaalsContact O-N 3.13Å
457	S	70.7	Confident	85.7	Confident	73 Å²	73	37.9 Å²	37.9	51%	0.51	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-63.5	-23.7	179.5	71.7	0	0	0	0	113.2	N455 M459	N455-S457 PolarHBondContact O-N 2.97Å; N455-S457 WeakPolarHBondContact OD1-CB 3.42Å; N455-S457 PolarHBondContact OD1-N 3.14Å; N455-S457 PolarHBondContact OD1-OG 3.49Å; S457-M459 VanDerWaalsContact C-N 3.33Å
458	V	82.6	Confident	86.1	Confident	2 Å²	2	31.5 Å²	31.5	1%	0.012	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-76.2	-19.9	179	-172.2	0	0	0	0	112.3	M375 N455 P456 N460 V461 C462 H985 A986 P1000 F1001	M375-V458 HydrophobicContact CE-CB 4.42Å; M375-V458 HydrophobicContact CE-CG1 4.07Å; M375-V458 HydrophobicContact CE-CG2 3.78Å; N455-V458 HydrophobicContact CB-CG2 4.02Å; N455-V458 PolarHBondContact O-N 2.81Å; N455-V458 VanDerWaalsContact O-N 3.11Å; P456-V458 PolarHBondContact O-N 3.27Å; V458-N460 VanDerWaalsContact C-N 3.29Å; V458-N460 PolarHBondContact O-N 3.49Å; V458-V461 HydrophobicContact CG1-CB 4.4Å; V458-V461 WeakPolarHBondContact O-CA 3.34Å; V458-V461 VanDerWaalsContact O-CB 3.3Å; V458-V461 WeakPolarHBondContact O-CB 3.26Å; V458-V461 PolarHBondContact O-N 3.15Å; V458-C462 PolarHBondContact O-N 3.36Å; V458-C462 PolarHBondContact O-SG 2.93Å; V458-H985 WeakPolarHBondContact CG1-O 3.34Å; V458-A986 HydrophobicContact CG1-CB 4.09Å; V458-P1000 HydrophobicContact CB-CB 4.27Å; V458-P1000 HydrophobicContact CG1-CB 4.37Å; V458-P1000 HydrophobicContact CG1-CG 4.28Å; V458-P1000 HydrophobicContact CG2-CB 3.91Å; V458-P1000 HydrophobicContact CG2-CG 4.43Å; V458-F1001 HydrophobicContact CB-CE2 4.06Å; V458-F1001 HydrophobicContact CB-CZ 4.03Å; V458-F1001 HydrophobicContact CG1-CE2 3.59Å; V458-F1001 HydrophobicContact CG1-CZ 3.99Å
459	M	87.5	Confident	86.4	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-55.3	-42.4	-178	-167.5	61.4	63.9	0	0	112.9	I439 A442 Q443 L446 C453 P456 S457 V461 C462 F1001 L1014 G1018 A1021	I439-M459 HydrophobicContact CG1-CB 4.36Å; I439-M459 HydrophobicContact CG2-CB 3.83Å; I439-M459 HydrophobicContact CG2-CG 4.2Å; A442-M459 HydrophobicContact CB-CG 4.07Å; A442-M459 HydrophobicContact CB-SD 4.04Å; Q443-M459 HydrophobicContact CB-CE 4.3Å; L446-M459 HydrophobicContact CD1-CE 3.49Å; L446-M459 VanDerWaalsContact CD1-CE 3.49Å; L446-M459 HydrophobicContact CD1-SD 3.64Å; C453-M459 HydrophobicContact CB-CE 4.32Å; P456-M459 VanDerWaalsContact O-CB 3.26Å; P456-M459 WeakPolarHBondContact O-CB 3.4Å; P456-M459 PolarHBondContact O-N 3.01Å; P456-M459 VanDerWaalsContact O-N 3.13Å; S457-M459 VanDerWaalsContact C-N 3.33Å; M459-V461 VanDerWaalsContact C-N 3.31Å; M459-V461 PolarHBondContact O-N 2.79Å; M459-C462 WeakPolarHBondContact O-CB 3.3Å; M459-C462 PolarHBondContact O-N 2.91Å; M459-F1001 HydrophobicContact CE-CE1 3.83Å; M459-F1001 HydrophobicContact CE-CZ 4.47Å; M459-L1014 HydrophobicContact SD-CD1 4.37Å; M459-G1018 VanDerWaalsContact O-CA 3.32Å; M459-G1018 WeakPolarHBondContact O-CA 3.43Å; M459-A1021 HydrophobicContact CG-CB 3.98Å
460	N	85.4	Confident	86.6	Confident	7 Å²	7	21.2 Å²	21.2	4%	0.037	12%	0.118	C	C	.	.	H	α-helix	trans	-71.9	-25.4	177.8	-82.6	-10.7	0	0	0	113	F377 V458 G463 L1022	F377-N460 HydrophobicContact CE1-CB 3.84Å; F377-N460 HydrophobicContact CZ-CB 4.06Å; V458-N460 VanDerWaalsContact C-N 3.29Å; V458-N460 PolarHBondContact O-N 3.49Å; N460-G463 PolarHBondContact O-N 3.07Å; N460-L1022 HydrophobicContact CB-CD1 3.8Å
461	V	85.3	Confident	86.8	Confident	3 Å²	3	20.7 Å²	20.7	2%	0.018	11%	0.111	C	C	.	.	H	α-helix	trans	-71.8	-34.7	173.3	-166.8	0	0	0	0	110.3	M375 F377 V458 M459 G463 V464 F967 H985	M375-V461 HydrophobicContact CE-CG2 4.15Å; M375-V461 HydrophobicContact SD-CG1 4.06Å; M375-V461 HydrophobicContact SD-CG2 4.24Å; F377-V461 HydrophobicContact CD2-CG2 3.75Å; F377-V461 HydrophobicContact CE2-CB 4.44Å; F377-V461 HydrophobicContact CE2-CG2 4.03Å; F377-V461 HydrophobicContact CG-CG2 4.26Å; V458-V461 HydrophobicContact CG1-CB 4.4Å; V458-V461 WeakPolarHBondContact O-CA 3.34Å; V458-V461 VanDerWaalsContact O-CB 3.3Å; V458-V461 WeakPolarHBondContact O-CB 3.26Å; V458-V461 PolarHBondContact O-N 3.15Å; M459-V461 VanDerWaalsContact C-N 3.31Å; M459-V461 PolarHBondContact O-N 2.79Å; V461-G463 PolarHBondContact O-N 3.09Å; V461-G463 VanDerWaalsContact O-N 3.14Å; V461-V464 WeakPolarHBondContact O-CG2 3.43Å; V461-V464 PolarHBondContact O-N 3.05Å; V461-F967 HydrophobicContact CG1-CD1 4.3Å; V461-H985 HydrophobicContact CG1-CB 3.87Å
462	C	90.8	Very high	86.6	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-60	-26.7	176.8	-61.1	0	0	0	0	112.9	V458 M459 V464 I465 F1001 L1014	V458-C462 PolarHBondContact O-N 3.36Å; V458-C462 PolarHBondContact O-SG 2.93Å; M459-C462 WeakPolarHBondContact O-CB 3.3Å; M459-C462 PolarHBondContact O-N 2.91Å; C462-V464 PolarHBondContact O-N 2.9Å; C462-I465 HydrophobicContact CB-CD1 4.09Å; C462-F1001 WeakPolarHBondContact SG-CE2 3.34Å; C462-F1001 VanDerWaalsContact SG-CZ 3.51Å; C462-L1014 HydrophobicContact CB-CG 4.17Å
463	G	88.9	Confident	86.3	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-21.3	175.4	0	0	0	0	0	115	N460 V461 G1018 R1019 P1087	N460-G463 PolarHBondContact O-N 3.07Å; V461-G463 PolarHBondContact O-N 3.09Å; V461-G463 VanDerWaalsContact O-N 3.14Å; G463-G1018 WeakPolarHBondContact CA-O 3.44Å; G463-R1019 WeakPolarHBondContact O-CG 3.31Å; G463-R1019 PolarHBondContact O-NE 3.02Å; G463-P1087 WeakPolarHBondContact O-CD 3.32Å
464	V	89.3	Confident	86.1	Confident	8 Å²	8	16.7 Å²	16.7	5%	0.048	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.6	6.2	-170	-65.9	0	0	0	0	113.8	F377 V461 C462 N466 F967 L1022 P1087 M1089	F377-V464 HydrophobicContact CE2-CG2 4.23Å; V461-V464 WeakPolarHBondContact O-CG2 3.43Å; V461-V464 PolarHBondContact O-N 3.05Å; C462-V464 PolarHBondContact O-N 2.9Å; V464-N466 PolarHBondContact O-N 3.08Å; V464-F967 HydrophobicContact CG2-CD1 4.11Å; V464-F967 HydrophobicContact CG2-CE1 4.44Å; V464-F967 HydrophobicContact CG2-CG 4.16Å; V464-F967 WeakPolarHBondContact O-CB 3.49Å; V464-L1022 HydrophobicContact CG1-CD2 3.77Å; V464-P1087 HydrophobicContact CG1-CG 4.43Å; V464-M1089 HydrophobicContact CB-CG 4.03Å; V464-M1089 HydrophobicContact CB-SD 4.15Å; V464-M1089 HydrophobicContact CG1-CG 3.44Å; V464-M1089 VanDerWaalsContact CG1-CG 3.44Å; V464-M1089 HydrophobicContact CG1-SD 4.22Å; V464-M1089 HydrophobicContact CG2-CE 4.07Å; V464-M1089 HydrophobicContact CG2-CG 4.11Å; V464-M1089 HydrophobicContact CG2-SD 3.95Å
465	I	92.1	Very high	86.7	Confident	0 Å²	0	12.4 Å²	12.4	0%	0	8%	0.076	C	C	.	.			trans	-50.9	130.3	168.5	-66.3	162.7	0	0	0	109.5	C462 L467 I700 A986 I1015	C462-I465 HydrophobicContact CB-CD1 4.09Å; I465-L467 WeakPolarHBondContact CG2-O 3.27Å; I465-I700 HydrophobicContact CG2-CG2 4.27Å; I465-A986 HydrophobicContact CD1-CB 3.9Å; I465-I1015 HydrophobicContact CB-CD1 4.4Å; I465-I1015 HydrophobicContact CB-CG1 4.4Å; I465-I1015 HydrophobicContact CD1-CD1 4.44Å; I465-I1015 HydrophobicContact CD1-CG1 3.91Å; I465-I1015 HydrophobicContact CG2-CD1 4.07Å
466	N	92	Very high	87.6	Confident	17 Å²	17	9.4 Å²	9.4	9%	0.091	6%	0.061	C	C	.	.			trans	-130	1	175	68.2	-27	0	0	0	112.9	V464 R701 Y966 F967 Y1259	V464-N466 PolarHBondContact O-N 3.08Å; N466-R701 PolarHBondContact O-N 3.35Å; N466-Y966 WeakPolarHBondContact ND2-CD1 3.48Å; N466-F967 PolarHBondContact N-O 3.39Å; N466-F967 PolarHBondContact OD1-N 2.66Å; N466-F967 PolarHBondContact OD1-O 2.9Å; N466-Y1259 PolarHBondContact ND2-OH 3.01Å; N466-Y1259 VanDerWaalsContact ND2-OH 3.13Å
467	L	95	Very high	88.1	Confident	0 Å²	0	7.6 Å²	7.6	0%	0	5%	0.049	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	135.2	173	-171.8	150.4	0	0	0	109.6	I465 C469 R701 V703 L961 Y966 F967 V968 S969	I465-L467 WeakPolarHBondContact CG2-O 3.27Å; L467-C469 VanDerWaalsContact CD2-SG 3.57Å; L467-R701 CarbonylContact C-O 3.21Å; L467-R701 VanDerWaalsContact CA-O 3.3Å; L467-R701 WeakPolarHBondContact CA-O 3.13Å; L467-R701 HydrophobicContact CB-CB 4.44Å; L467-R701 HydrophobicContact CD1-CB 4.31Å; L467-R701 HydrophobicContact CD1-CG 4.33Å; L467-R701 HydrophobicContact CG-CB 4.19Å; L467-R701 HydrophobicContact CG-CG 4.48Å; L467-V703 HydrophobicContact CD1-CG2 4.09Å; L467-V703 HydrophobicContact CD2-CG2 4.02Å; L467-V703 HydrophobicContact CG-CG2 4.07Å; L467-L961 HydrophobicContact CD1-CD2 3.76Å; L467-L961 HydrophobicContact CD2-CD1 3.93Å; L467-Y966 HydrophobicContact CB-CD1 3.87Å; L467-Y966 HydrophobicContact CB-CG 4.19Å; L467-Y966 HydrophobicContact CD1-CD1 3.84Å; L467-Y966 HydrophobicContact CD1-CD2 3.93Å; L467-Y966 HydrophobicContact CD1-CE1 4.04Å; L467-Y966 HydrophobicContact CD1-CE2 4.11Å; L467-Y966 HydrophobicContact CD1-CG 3.82Å; L467-F967 PolarHBondContact N-O 2.89Å; L467-V968 HydrophobicContact CD2-CG1 3.91Å; L467-V968 HydrophobicContact CD2-CG2 4.34Å; L467-V968 WeakPolarHBondContact O-CA 3.44Å; L467-S969 PolarHBondContact O-N 2.84Å
468	T	96.3	Very high	88.6	Confident	0 Å²	0	8.3 Å²	8.3	0%	0	4%	0.044	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	123.7	173.6	-55.7	0	0	0	0	109.7	F470 R701 P702 V703 S969 V1011	T468-F470 HydrophobicContact CG2-CD2 4.15Å; T468-F470 HydrophobicContact CG2-CE1 4.04Å; T468-F470 HydrophobicContact CG2-CE2 3.57Å; T468-F470 HydrophobicContact CG2-CZ 3.52Å; T468-R701 PolarHBondContact N-O 2.94Å; T468-P702 CarbonylContact O-C 3.59Å; T468-P702 WeakPolarHBondContact O-CA 3.18Å; T468-V703 PolarHBondContact O-N 3.02Å; T468-S969 WeakPolarHBondContact CA-O 3.42Å; T468-V1011 HydrophobicContact CG2-CG1 3.99Å
469	C	96.5	Very high	87.9	Confident	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	144.6	167.8	-63	0	0	0	0	110.3	L467 V703 V705 I958 S969 M970 C971	L467-C469 VanDerWaalsContact CD2-SG 3.57Å; C469-V703 CarbonylContact C-O 3.53Å; C469-V703 VanDerWaalsContact CA-O 3.28Å; C469-V703 WeakPolarHBondContact CA-O 3.47Å; C469-V705 HydrophobicContact CB-CG2 4.08Å; C469-I958 HydrophobicContact CB-CD1 3.78Å; C469-I958 VanDerWaalsContact SG-CD1 3.51Å; C469-S969 PolarHBondContact N-O 3.4Å; C469-M970 HydrophobicContact CB-SD 3.45Å; C469-M970 WeakPolarHBondContact CB-SD 3.17Å; C469-M970 CarbonylContact O-C 3.35Å; C469-M970 WeakPolarHBondContact O-CA 3.27Å; C469-C971 PolarHBondContact O-N 3.36Å
470	F	95.5	Very high	86.8	Confident	0 Å²	0	14 Å²	14	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	140.1	176.9	-64.4	-86.2	0	0	0	109.6	T468 T475 L476 I692 L695 P702 V703 M704 V705 C971 I1008 V1011	T468-F470 HydrophobicContact CG2-CD2 4.15Å; T468-F470 HydrophobicContact CG2-CE1 4.04Å; T468-F470 HydrophobicContact CG2-CE2 3.57Å; T468-F470 HydrophobicContact CG2-CZ 3.52Å; F470-T475 HydrophobicContact CB-CG2 4.3Å; F470-T475 HydrophobicContact CD1-CG2 4.05Å; F470-L476 HydrophobicContact CB-CD1 3.91Å; F470-L476 HydrophobicContact CB-CD2 4.43Å; F470-L476 HydrophobicContact CB-CG 4.11Å; F470-L476 HydrophobicContact CD1-CD2 4.35Å; F470-L476 HydrophobicContact CG-CD2 4.36Å; F470-I692 HydrophobicContact CD2-CD1 4.07Å; F470-I692 HydrophobicContact CE2-CD1 3.63Å; F470-I692 HydrophobicContact CZ-CD1 4.08Å; F470-L695 HydrophobicContact CE2-CD1 4.01Å; F470-L695 HydrophobicContact CZ-CD1 3.7Å; F470-P702 HydrophobicContact CE2-CB 4.31Å; F470-V703 PolarHBondContact N-O 3.4Å; F470-M704 WeakPolarHBondContact O-CA 3.47Å; F470-V705 PolarHBondContact O-N 2.84Å; F470-C971 HydrophobicContact CD1-CB 3.73Å; F470-C971 HydrophobicContact CE1-CB 3.95Å; F470-I1008 HydrophobicContact CD1-CB 4.47Å; F470-I1008 HydrophobicContact CD1-CD1 4.42Å; F470-I1008 HydrophobicContact CD1-CG2 3.8Å; F470-I1008 HydrophobicContact CE1-CB 3.88Å; F470-I1008 HydrophobicContact CE1-CD1 3.83Å; F470-I1008 HydrophobicContact CE1-CG2 3.7Å; F470-I1008 HydrophobicContact CZ-CD1 4.16Å; F470-V1011 HydrophobicContact CE1-CG2 3.96Å; F470-V1011 HydrophobicContact CZ-CG1 4.36Å; F470-V1011 HydrophobicContact CZ-CG2 4.4Å
471	D	91	Very high	86.1	Confident	4 Å²	4	14.3 Å²	14.3	2%	0.021	8%	0.083	C	C	.	.			trans	-73.6	162.5	155.8	-158.1	-0.7	0	0	0	110.1	T475 L476 T706 K954 M970 C971 N976 D977	D471-T475 WeakPolarHBondContact O-CB 3.04Å; D471-T475 WeakPolarHBondContact O-CG2 3.47Å; D471-L476 WeakPolarHBondContact O-CG 3.38Å; D471-T706 VanDerWaalsContact OD1-CA 3.29Å; D471-T706 WeakPolarHBondContact OD1-CA 3.45Å; D471-T706 WeakPolarHBondContact OD1-CB 3.43Å; D471-T706 PolarHBondContact OD1-OG1 2.91Å; D471-K954 IonicContact OD1-NZ 3.03Å; D471-K954 IonicContact OD2-NZ 3.57Å; D471-K954 PolarHBondContact OD2-NZ 3.36Å; D471-M970 HydrophobicContact CB-CE 4.42Å; D471-C971 PolarHBondContact N-O 3.23Å; D471-N976 PolarHBondContact OD2-ND2 3.08Å; D471-D977 WeakPolarHBondContact CB-OD2 3.15Å
472	K	87.8	Confident	85.7	Confident	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.093	C	C	.	.	S	Bend	trans	-89.1	-63.7	-178.8	-169.6	-122	69.1	174.7	0	110.9	L476 T477 N682 M704 T706 D708 V716	K472-L476 PolarHBondContact O-N 3.34Å; K472-T477 HydrophobicContact CD-CG2 4.3Å; K472-T477 HydrophobicContact CG-CG2 4.3Å; K472-T477 PolarHBondContact O-N 3.47Å; K472-T477 PolarHBondContact O-OG1 3.27Å; K472-N682 VanDerWaalsContact NZ-CG 3.3Å; K472-N682 PolarHBondContact NZ-ND2 2.88Å; K472-N682 PolarHBondContact NZ-OD1 2.88Å; K472-M704 HydrophobicContact CB-CE 4.5Å; K472-M704 HydrophobicContact CB-CG 4.33Å; K472-M704 HydrophobicContact CB-SD 3.98Å; K472-M704 HydrophobicContact CG-CE 4.14Å; K472-M704 HydrophobicContact CG-SD 3.97Å; K472-T706 HydrophobicContact CB-CG2 4.07Å; K472-D708 HydrophobicContact CD-CB 4.38Å; K472-D708 WeakPolarHBondContact CE-OD2 3.44Å; K472-D708 IonicContact NZ-OD2 3.53Å; K472-D708 PolarHBondContact NZ-OD2 2.86Å; K472-V716 HydrophobicContact CD-CG2 4.29Å; K472-V716 HydrophobicContact CG-CB 4.32Å; K472-V716 HydrophobicContact CG-CG1 3.93Å
473	T	79.4	Confident	85.4	Confident	45 Å²	45	18 Å²	18	28%	0.276	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	137.6	-177.3	-51.6	0	0	0	0	109.1	T475 T477	T473-T475 PolarHBondContact O-N 2.84Å; T473-T477 WeakPolarHBondContact CA-OG1 3.42Å
474	G	79	Confident	85.3	Confident	1 Å²	1	21 Å²	21	1%	0.01	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.5	-27.4	-179.4	0	0	0	0	0	116.3	T477 D479 K685	G474-T477 CarbonylContact C-O 3.45Å; G474-D479 WeakPolarHBondContact CA-OD1 3.25Å; G474-K685 PolarHBondContact O-NZ 3.35Å
475	T	87.5	Confident	85.4	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-55.6	179.1	-75.5	0	0	0	0	113.1	F470 D471 T473 C971 G972 D973 L990 I1008	F470-T475 HydrophobicContact CB-CG2 4.3Å; F470-T475 HydrophobicContact CD1-CG2 4.05Å; D471-T475 WeakPolarHBondContact O-CB 3.04Å; D471-T475 WeakPolarHBondContact O-CG2 3.47Å; T473-T475 PolarHBondContact O-N 2.84Å; T475-C971 HydrophobicContact CG2-CB 4.49Å; T475-G972 VanDerWaalsContact OG1-CA 3.29Å; T475-G972 WeakPolarHBondContact OG1-CA 3.5Å; T475-D973 WeakPolarHBondContact CB-OD1 3.41Å; T475-D973 PolarHBondContact N-OD1 2.91Å; T475-D973 PolarHBondContact OG1-N 3.39Å; T475-D973 PolarHBondContact OG1-OD1 3.23Å; T475-L990 HydrophobicContact CG2-CD1 4.13Å; T475-I1008 HydrophobicContact CG2-CG2 3.76Å
476	L	90.3	Very high	85.4	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-38.5	179.1	-71.3	171.3	0	0	0	112.1	F470 D471 K472 L684 K685 S688 I692 M704 M722 I1008	F470-L476 HydrophobicContact CB-CD1 3.91Å; F470-L476 HydrophobicContact CB-CD2 4.43Å; F470-L476 HydrophobicContact CB-CG 4.11Å; F470-L476 HydrophobicContact CD1-CD2 4.35Å; F470-L476 HydrophobicContact CG-CD2 4.36Å; D471-L476 WeakPolarHBondContact O-CG 3.38Å; K472-L476 PolarHBondContact O-N 3.34Å; L476-L684 HydrophobicContact CB-CD2 4.42Å; L476-L684 WeakPolarHBondContact O-CD2 3.45Å; L476-K685 PolarHBondContact O-N 2.91Å; L476-S688 PolarHBondContact O-OG 3.1Å; L476-I692 HydrophobicContact CD2-CD1 4.47Å; L476-M704 HydrophobicContact CD1-CE 3.8Å; L476-M722 HydrophobicContact CD1-CE 3.97Å; L476-I1008 HydrophobicContact CD2-CD1 3.78Å
477	T	86.6	Confident	85.4	Confident	0 Å²	0	20 Å²	20	0%	0	11%	0.108	C	C	.	.	B	Isolated β-bridge	trans	-96.2	165.8	173.7	68.2	0	0	0	0	110.7	K472 T473 G474 N682 R683 L684 K685 V716	K472-T477 HydrophobicContact CD-CG2 4.3Å; K472-T477 HydrophobicContact CG-CG2 4.3Å; K472-T477 PolarHBondContact O-N 3.47Å; K472-T477 PolarHBondContact O-OG1 3.27Å; T473-T477 WeakPolarHBondContact CA-OG1 3.42Å; G474-T477 CarbonylContact C-O 3.45Å; T477-N682 HydrophobicContact CG2-CB 4.24Å; T477-R683 CarbonylContact C-O 3.49Å; T477-R683 WeakPolarHBondContact CA-O 3.15Å; T477-R683 WeakPolarHBondContact CB-O 3.33Å; T477-L684 HydrophobicContact CG2-CD2 4.47Å; T477-K685 WeakPolarHBondContact O-CE 3.29Å; T477-V716 HydrophobicContact CG2-CG1 3.96Å; T477-V716 HydrophobicContact CG2-CG2 4.26Å
478	E	82.4	Confident	85.2	Confident	87 Å²	87	20.6 Å²	20.6	41%	0.407	11%	0.111	S	C	.	.			trans	-62.4	163.4	169.7	-65	-177.4	159.4	0	0	111.7	G480 R683 K685	E478-G480 PolarHBondContact O-N 2.83Å; E478-R683 PolarHBondContact N-O 3.21Å; E478-K685 HydrophobicContact CG-CG 3.91Å
479	D	67.5	Low	84.8	Confident	93 Å²	93	21.9 Å²	21.9	50%	0.497	12%	0.119	S	C	.	.	S	Bend	trans	-81.6	112.7	178.7	-74	-60	0	0	0	110	G474 K685	G474-D479 WeakPolarHBondContact CA-OD1 3.25Å; D479-K685 IonicContact OD2-NZ 3.9Å
480	G	64.3	Low	84.2	Confident	28 Å²	28	29 Å²	29	29%	0.289	15%	0.145	S	C	.	.	S	Bend	trans	104	-172.5	-177.2	0	0	0	0	0	113.8	E478	E478-G480 PolarHBondContact O-N 2.83Å
481	L	70.6	Confident	83.2	Confident	15 Å²	15	37.1 Å²	37.1	8%	0.079	19%	0.189	C	C	.	.			trans	-127.2	133.8	178.2	-76.8	126.3	0	0	0	108.9	L531 K534 R644 M680 N682	L481-L531 HydrophobicContact CD1-CD1 4.49Å; L481-K534 WeakPolarHBondContact O-CG 3.44Å; L481-R644 HydrophobicContact CD2-CB 3.83Å; L481-R644 HydrophobicContact CD2-CG 4.32Å; L481-M680 HydrophobicContact CB-CB 4.33Å; L481-M680 HydrophobicContact CB-SD 4.34Å; L481-M680 HydrophobicContact CD2-CB 3.94Å; L481-N682 WeakPolarHBondContact CD2-OD1 3.31Å
482	D	77.5	Confident	82.4	Confident	43 Å²	43	38 Å²	38	23%	0.23	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	140.9	170.4	-95.3	-12.6	0	0	0	109.8	W484 K534 M680 E681 R683	D482-W484 PolarHBondContact O-N 3.22Å; D482-K534 IonicContact OD1-NZ 3.33Å; D482-K534 PolarHBondContact OD1-NZ 3.47Å; D482-M680 CarbonylContact O-C 3.56Å; D482-M680 VanDerWaalsContact O-CA 3.24Å; D482-M680 WeakPolarHBondContact O-CA 3.4Å; D482-M680 WeakPolarHBondContact O-CB 3.46Å; D482-E681 PolarHBondContact N-O 3.2Å; D482-E681 PolarHBondContact O-N 2.67Å; D482-R683 IonicContact OD2-CZ 3.67Å; D482-R683 IonicContact OD2-NH1 2.79Å; D482-R683 PolarHBondContact OD2-NH1 2.56Å; D482-R683 IonicContact OD2-NH2 3.57Å
483	L	84.6	Confident	82.1	Confident	36 Å²	36	43.8 Å²	43.8	19%	0.188	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	124.5	172.3	-175	69.3	0	0	0	109.2	P501 M513 S538 L678 V679 M680	L483-P501 HydrophobicContact CD2-CG 3.49Å; L483-P501 VanDerWaalsContact CD2-CG 3.49Å; L483-M513 HydrophobicContact CD2-CE 4.36Å; L483-S538 WeakPolarHBondContact CD2-OG 3.33Å; L483-L678 HydrophobicContact CD1-CD1 3.44Å; L483-L678 VanDerWaalsContact CD1-CD1 3.44Å; L483-L678 HydrophobicContact CD1-CG 3.87Å; L483-V679 WeakPolarHBondContact CD1-O 3.49Å; L483-M680 HydrophobicContact CD1-CG 4.07Å
484	W	86.7	Confident	82.2	Confident	65 Å²	65	42.6 Å²	42.6	25%	0.246	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-43.1	173.5	-177.6	88.3	0	0	0	110.8	D482 P497 F499 F638 F643 V679	D482-W484 PolarHBondContact O-N 3.22Å; W484-P497 HydrophobicContact CE3-CB 4.44Å; W484-P497 HydrophobicContact CH2-CB 3.97Å; W484-P497 HydrophobicContact CH2-CG 3.79Å; W484-P497 HydrophobicContact CZ3-CB 3.55Å; W484-P497 HydrophobicContact CZ3-CG 3.7Å; W484-F499 HydrophobicContact CD2-CE1 4.15Å; W484-F499 AromaticContact CE2-CE1 3.76Å; W484-F499 HydrophobicContact CE3-CE1 4.39Å; W484-F499 HydrophobicContact CH2-CE1 4.03Å; W484-F499 HydrophobicContact CH2-CZ 4.22Å; W484-F499 AromaticContact CZ2-CE1 3.71Å; W484-F499 HydrophobicContact CZ2-CE1 3.71Å; W484-F499 HydrophobicContact CZ2-CZ 4.15Å; W484-F499 HydrophobicContact CZ3-CE1 4.36Å; W484-F499 VanDerWaalsContact O-CD1 3.26Å; W484-F499 WeakPolarHBondContact O-CD1 3.47Å; W484-F638 AromaticContact CH2-CE1 3.93Å; W484-F638 HydrophobicContact CH2-CE1 3.93Å; W484-F638 HydrophobicContact CZ3-CD1 4.47Å; W484-F638 AromaticContact CZ3-CE1 3.69Å; W484-F638 HydrophobicContact CZ3-CE1 3.69Å; W484-F638 HydrophobicContact CZ3-CZ 4.39Å; W484-F643 HydrophobicContact CB-CD1 4.38Å; W484-F643 HydrophobicContact CB-CE1 4.21Å; W484-F643 AromaticContact CD1-CE1 3.54Å; W484-F643 AromaticContact CD1-CZ 3.83Å; W484-F643 HydrophobicContact CD2-CE1 4.27Å; W484-F643 HydrophobicContact CD2-CZ 4.27Å; W484-F643 AromaticContact CE2-CZ 3.93Å; W484-F643 HydrophobicContact CG-CD1 4.32Å; W484-F643 AromaticContact CG-CE1 3.77Å; W484-F643 HydrophobicContact CG-CE1 3.77Å; W484-F643 HydrophobicContact CG-CZ 4.2Å; W484-F643 AromaticContact NE1-CE1 3.88Å; W484-F643 AromaticContact NE1-CZ 3.65Å; W484-V679 HydrophobicContact CB-CG1 4.34Å; W484-V679 WeakPolarHBondContact CB-O 3.4Å; W484-V679 HydrophobicContact CD2-CG1 4.29Å; W484-V679 HydrophobicContact CE3-CB 3.93Å; W484-V679 HydrophobicContact CE3-CG1 3.72Å; W484-V679 HydrophobicContact CZ3-CG1 4.35Å; W484-V679 PolarHBondContact N-O 2.74Å
485	G	90.4	Very high	82.3	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.8	178.9	174.4	0	0	0	0	0	114.1	E498 V679	G485-E498 CarbonylContact C-O 3.13Å; G485-E498 WeakPolarHBondContact CA-O 3.36Å; G485-V679 PolarHBondContact N-O 3.44Å; G485-V679 VanDerWaalsContact N-O 3.13Å; G485-V679 PolarHBondContact O-N 2.79Å
486	V	91.8	Very high	82.2	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	131.7	176.7	-177.6	0	0	0	0	108.7	P488 P497 E498 P501 L504 L509 M513 L677 L678	V486-P488 WeakPolarHBondContact O-CD 3.44Å; V486-P497 WeakPolarHBondContact O-CA 3.33Å; V486-E498 PolarHBondContact N-O 3.29Å; V486-E498 PolarHBondContact O-N 2.91Å; V486-P501 HydrophobicContact CG2-CB 4.22Å; V486-P501 HydrophobicContact CG2-CG 3.81Å; V486-L504 HydrophobicContact CB-CD1 4.35Å; V486-L504 HydrophobicContact CG1-CD1 4.27Å; V486-L504 HydrophobicContact CG2-CD1 4.4Å; V486-L509 HydrophobicContact CG1-CD1 4.01Å; V486-L509 HydrophobicContact CG1-CD2 3.86Å; V486-L509 HydrophobicContact CG1-CG 4.17Å; V486-M513 HydrophobicContact CG1-SD 4.39Å; V486-M513 HydrophobicContact CG2-CE 3.69Å; V486-M513 HydrophobicContact CG2-SD 3.49Å; V486-M513 WeakPolarHBondContact CG2-SD 3.48Å; V486-L677 CarbonylContact C-O 3.38Å; V486-L677 WeakPolarHBondContact CA-O 3.39Å; V486-L678 HydrophobicContact CG2-CD1 3.78Å
487	V	92.3	Very high	82	Confident	3 Å²	3	54.4 Å²	54.4	2%	0.018	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	98.3	175.2	-168.9	0	0	0	0	108.3	L494 G495 P497 F638 G676 L677 V679	V487-L494 HydrophobicContact CB-CD2 4.31Å; V487-L494 HydrophobicContact CG1-CB 4Å; V487-L494 HydrophobicContact CG1-CD2 3.74Å; V487-L494 HydrophobicContact CG1-CG 4.4Å; V487-G495 WeakPolarHBondContact CG1-O 3.37Å; V487-P497 HydrophobicContact CG2-CB 4.26Å; V487-P497 HydrophobicContact CG2-CG 4.26Å; V487-F638 HydrophobicContact CG2-CE2 3.93Å; V487-F638 HydrophobicContact CG2-CZ 3.78Å; V487-G676 CarbonylContact O-C 3.55Å; V487-G676 WeakPolarHBondContact O-CA 3.43Å; V487-L677 HydrophobicContact CB-CB 4.23Å; V487-L677 PolarHBondContact N-O 3.35Å; V487-L677 PolarHBondContact O-N 2.94Å; V487-V679 HydrophobicContact CG2-CG2 4.01Å
488	P	90.9	Very high	82.1	Confident	12 Å²	12	58.4 Å²	58.4	8%	0.078	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	143.3	-176.9	28.5	-34.9	0	0	0	111.7	V486 G495 K496 L509	V486-P488 WeakPolarHBondContact O-CD 3.44Å; P488-G495 PolarHBondContact O-N 2.93Å; P488-K496 WeakPolarHBondContact CD-O 3.26Å; P488-L509 HydrophobicContact CB-CD2 3.67Å
489	N	89.1	Confident	82.3	Confident	28 Å²	28	60.6 Å²	60.6	15%	0.15	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	119.1	165.1	-174.8	32.4	0	0	0	109.3	G492 I493 T626 F674 L675	N489-G492 VanDerWaalsContact OD1-CA 3.28Å; N489-G492 WeakPolarHBondContact OD1-CA 3.31Å; N489-G492 PolarHBondContact OD1-N 2.97Å; N489-I493 PolarHBondContact OD1-N 3.23Å; N489-I493 PolarHBondContact OD1-O 3.39Å; N489-T626 PolarHBondContact ND2-O 3.02Å; N489-F674 HydrophobicContact CB-CD1 3.98Å; N489-F674 HydrophobicContact CB-CE1 4.05Å; N489-F674 WeakPolarHBondContact ND2-CD1 3.48Å; N489-F674 PolarHBondContact ND2-O 3.26Å; N489-L675 VanDerWaalsContact CB-O 3.31Å; N489-L675 WeakPolarHBondContact CB-O 3.41Å; N489-L675 PolarHBondContact N-O 3.22Å
490	R	82.3	Confident	83.2	Confident	150 Å²	150	59.6 Å²	59.6	57%	0.566	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.2	114.2	172.3	-67.9	-177.1	174.5	-172.5	-7.1	107.7	G492 I493 D505	R490-G492 VanDerWaalsContact C-N 3.28Å; R490-G492 PolarHBondContact O-N 3.47Å; R490-I493 PolarHBondContact N-O 3.42Å; R490-I493 PolarHBondContact O-N 3.28Å; R490-D505 IonicContact NH2-OD2 3.61Å; R490-D505 PolarHBondContact NH2-OD2 3.42Å
491	D	74.6	Confident	84.1	Confident	170 Å²	170	58.4 Å²	58.4	91%	0.909	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	39.7	178.2	-54.2	-42.8	0	0	0	115.2
492	G	74.8	Confident	84.8	Confident	21 Å²	21	58.7 Å²	58.7	22%	0.216	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.6	13	-179.5	0	0	0	0	0	114.3	N489 R490 P628	N489-G492 VanDerWaalsContact OD1-CA 3.28Å; N489-G492 WeakPolarHBondContact OD1-CA 3.31Å; N489-G492 PolarHBondContact OD1-N 2.97Å; R490-G492 VanDerWaalsContact C-N 3.28Å; R490-G492 PolarHBondContact O-N 3.47Å; G492-P628 WeakPolarHBondContact O-CA 3.3Å; G492-P628 VanDerWaalsContact O-CB 3.25Å; G492-P628 WeakPolarHBondContact O-CB 3.48Å
493	I	80.8	Confident	85	Confident	123 Å²	123	63.5 Å²	63.5	63%	0.631	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.6	128.6	174.5	-54.8	178.4	0	0	0	109.1	N489 R490 G495	N489-I493 PolarHBondContact OD1-N 3.23Å; N489-I493 PolarHBondContact OD1-O 3.39Å; R490-I493 PolarHBondContact N-O 3.42Å; R490-I493 PolarHBondContact O-N 3.28Å; I493-G495 PolarHBondContact O-N 3.37Å
494	L	83.1	Confident	85	Confident	19 Å²	19	62.7 Å²	62.7	10%	0.099	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	122.2	170.4	-76.3	160.2	0	0	0	109.5	V487 P628 N634 F674 L677	V487-L494 HydrophobicContact CB-CD2 4.31Å; V487-L494 HydrophobicContact CG1-CB 4Å; V487-L494 HydrophobicContact CG1-CD2 3.74Å; V487-L494 HydrophobicContact CG1-CG 4.4Å; L494-P628 HydrophobicContact CD1-CB 4.45Å; L494-P628 HydrophobicContact CD1-CG 4.17Å; L494-P628 HydrophobicContact CG-CB 4.44Å; L494-P628 HydrophobicContact CG-CG 3.86Å; L494-N634 HydrophobicContact CD1-CB 4.01Å; L494-N634 WeakPolarHBondContact CD1-ND2 3.42Å; L494-F674 HydrophobicContact CD2-CE1 4.23Å; L494-L677 HydrophobicContact CD1-CD1 4.28Å; L494-L677 HydrophobicContact CD2-CD1 4.45Å; L494-L677 HydrophobicContact CD2-CG 4.32Å
495	G	81.2	Confident	84.7	Confident	33 Å²	33	65.1 Å²	65.1	34%	0.34	33%	0.326	S	S	.	.			trans	-74	-169.6	176.6	0	0	0	0	0	113.3	V487 P488 I493	V487-G495 WeakPolarHBondContact CG1-O 3.37Å; P488-G495 PolarHBondContact O-N 2.93Å; I493-G495 PolarHBondContact O-N 3.37Å
496	K	84	Confident	84.1	Confident	181 Å²	181	71.7 Å²	71.7	79%	0.787	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-72.6	152.4	169.4	-68.2	-177.4	178.5	179.8	0	110.2	P488 E498	P488-K496 WeakPolarHBondContact CD-O 3.26Å; K496-E498 PolarHBondContact O-N 2.68Å
497	P	86	Confident	83.8	Confident	35 Å²	35	72.3 Å²	72.3	23%	0.227	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-63.8	129.6	172.5	-17.4	30.4	0	0	0	111.3	W484 V486 V487 F499 F638	W484-P497 HydrophobicContact CE3-CB 4.44Å; W484-P497 HydrophobicContact CH2-CB 3.97Å; W484-P497 HydrophobicContact CH2-CG 3.79Å; W484-P497 HydrophobicContact CZ3-CB 3.55Å; W484-P497 HydrophobicContact CZ3-CG 3.7Å; V486-P497 WeakPolarHBondContact O-CA 3.33Å; V487-P497 HydrophobicContact CG2-CB 4.26Å; V487-P497 HydrophobicContact CG2-CG 4.26Å; P497-F499 HydrophobicContact CB-CE2 4.49Å; P497-F499 HydrophobicContact CB-CZ 4.31Å; P497-F638 HydrophobicContact CG-CZ 4.46Å
498	E	88.5	Confident	83.7	Confident	85 Å²	85	73.9 Å²	73.9	40%	0.397	37%	0.368	S	S	.	.	B	Isolated β-bridge	trans	-95	116.1	167.3	-72.8	-60	161.1	0	0	109.6	G485 V486 K496 L504	G485-E498 CarbonylContact C-O 3.13Å; G485-E498 WeakPolarHBondContact CA-O 3.36Å; V486-E498 PolarHBondContact N-O 3.29Å; V486-E498 PolarHBondContact O-N 2.91Å; K496-E498 PolarHBondContact O-N 2.68Å; E498-L504 HydrophobicContact CB-CD2 4.14Å; E498-L504 HydrophobicContact CG-CD2 3.96Å
499	F	88.1	Confident	83.8	Confident	132 Å²	132	74.4 Å²	74.4	58%	0.579	37%	0.37	S	S	*	.	S	Bend	trans	-80.7	-15.7	-175.9	-60.7	-86.3	0	0	0	113.2	W484 P497	W484-F499 HydrophobicContact CD2-CE1 4.15Å; W484-F499 AromaticContact CE2-CE1 3.76Å; W484-F499 HydrophobicContact CE3-CE1 4.39Å; W484-F499 HydrophobicContact CH2-CE1 4.03Å; W484-F499 HydrophobicContact CH2-CZ 4.22Å; W484-F499 AromaticContact CZ2-CE1 3.71Å; W484-F499 HydrophobicContact CZ2-CE1 3.71Å; W484-F499 HydrophobicContact CZ2-CZ 4.15Å; W484-F499 HydrophobicContact CZ3-CE1 4.36Å; W484-F499 VanDerWaalsContact O-CD1 3.26Å; W484-F499 WeakPolarHBondContact O-CD1 3.47Å; P497-F499 HydrophobicContact CB-CE2 4.49Å; P497-F499 HydrophobicContact CB-CZ 4.31Å
500	E	86.2	Confident	83.9	Confident	72 Å²	72	73.2 Å²	73.2	34%	0.336	36%	0.364	S	S	.	.			trans	-129.7	90.8	-178.6	-165.6	176.8	-177.2	0	0	110.5	S502 K503 K540	E500-S502 PolarHBondContact O-N 3.19Å; E500-S502 VanDerWaalsContact O-N 3.08Å; E500-K503 HydrophobicContact CB-CD 4.35Å; E500-K503 PolarHBondContact O-N 2.72Å; E500-K503 WeakPolarHBondContact OE2-CE 3.13Å; E500-K503 IonicContact OE2-NZ 2.68Å; E500-K503 PolarHBondContact OE2-NZ 3.19Å; E500-K540 IonicContact OE1-NZ 2.73Å; E500-K540 PolarHBondContact OE1-NZ 3.1Å
501	P	83.5	Confident	84.4	Confident	4 Å²	4	66.8 Å²	66.8	3%	0.026	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-61.1	-22.2	-170.1	-27.2	36.3	0	0	0	115.5	L483 V486 K503 L504 M513	L483-P501 HydrophobicContact CD2-CG 3.49Å; L483-P501 VanDerWaalsContact CD2-CG 3.49Å; V486-P501 HydrophobicContact CG2-CB 4.22Å; V486-P501 HydrophobicContact CG2-CG 3.81Å; P501-K503 PolarHBondContact O-N 2.81Å; P501-K503 VanDerWaalsContact O-N 3.13Å; P501-L504 HydrophobicContact CB-CD1 4.11Å; P501-L504 WeakPolarHBondContact O-CB 3.2Å; P501-L504 WeakPolarHBondContact O-CG 3.41Å; P501-L504 PolarHBondContact O-N 2.9Å; P501-L504 VanDerWaalsContact O-N 3.09Å; P501-M513 HydrophobicContact CB-CE 3.69Å; P501-M513 HydrophobicContact CB-SD 4.27Å; P501-M513 HydrophobicContact CG-CE 3.8Å
502	S	83.9	Confident	85.3	Confident	20 Å²	20	58.7 Å²	58.7	14%	0.14	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-64.9	-10	174.2	81.5	0	0	0	0	113.8	E500 S538 T539 K540	E500-S502 PolarHBondContact O-N 3.19Å; E500-S502 VanDerWaalsContact O-N 3.08Å; S502-S538 PolarHBondContact N-O 2.62Å; S502-T539 WeakPolarHBondContact CB-O 3.09Å; S502-K540 WeakPolarHBondContact OG-CE 3.42Å; S502-K540 PolarHBondContact OG-NZ 2.82Å
503	K	82.9	Confident	86.1	Confident	145 Å²	145	57.7 Å²	57.7	63%	0.63	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-96	1	174.9	-69.4	174.1	173.8	156.8	0	113.4	E500 P501	E500-K503 HydrophobicContact CB-CD 4.35Å; E500-K503 PolarHBondContact O-N 2.72Å; E500-K503 WeakPolarHBondContact OE2-CE 3.13Å; E500-K503 IonicContact OE2-NZ 2.68Å; E500-K503 PolarHBondContact OE2-NZ 3.19Å; P501-K503 PolarHBondContact O-N 2.81Å; P501-K503 VanDerWaalsContact O-N 3.13Å
504	L	83.3	Confident	86.6	Confident	19 Å²	19	51.8 Å²	51.8	10%	0.099	26%	0.257	C	S	.	.	S	Bend	trans	-69.8	141.9	174.3	-69.5	168.3	0	0	0	110.3	V486 E498 P501 L509 I510 M513	V486-L504 HydrophobicContact CB-CD1 4.35Å; V486-L504 HydrophobicContact CG1-CD1 4.27Å; V486-L504 HydrophobicContact CG2-CD1 4.4Å; E498-L504 HydrophobicContact CB-CD2 4.14Å; E498-L504 HydrophobicContact CG-CD2 3.96Å; P501-L504 HydrophobicContact CB-CD1 4.11Å; P501-L504 WeakPolarHBondContact O-CB 3.2Å; P501-L504 WeakPolarHBondContact O-CG 3.41Å; P501-L504 PolarHBondContact O-N 2.9Å; P501-L504 VanDerWaalsContact O-N 3.09Å; L504-L509 HydrophobicContact CD1-CD2 4.08Å; L504-L509 HydrophobicContact CD1-CG 4.32Å; L504-L509 HydrophobicContact CD2-CD2 4.27Å; L504-I510 HydrophobicContact CB-CB 4.48Å; L504-M513 HydrophobicContact CD1-SD 4.49Å
505	D	80.5	Confident	87.1	Confident	116 Å²	116	50.9 Å²	50.9	62%	0.62	25%	0.252	S	S	*	.	P	Polyproline II helix	trans	-54.9	138.7	172.8	-52.8	-63	0	0	0	110.6	R490 G507	R490-D505 IonicContact NH2-OD2 3.61Å; R490-D505 PolarHBondContact NH2-OD2 3.42Å; D505-G507 PolarHBondContact O-N 2.88Å
506	Y	79.3	Confident	87.6	Confident	138 Å²	138	49.3 Å²	49.3	54%	0.541	24%	0.236	S	C	.	.	S	Bend	trans	-57.3	125.8	174	-70.3	-72.8	0	0	0	110.4	W541 P564	Y506-W541 AromaticContact CD1-CZ2 3.96Å; Y506-W541 HydrophobicContact CD1-CZ2 3.96Å; Y506-W541 AromaticContact CE1-CZ2 3.92Å; Y506-W541 HydrophobicContact CE1-CZ2 3.92Å; Y506-P564 HydrophobicContact CE1-CB 4.44Å; Y506-P564 HydrophobicContact CE1-CG 3.94Å
507	G	85.5	Confident	87.9	Confident	13 Å²	13	40.7 Å²	40.7	13%	0.134	20%	0.198	C	C	.	.	S	Bend	trans	161.7	-176.4	-175.4	0	0	0	0	0	113	D505 L509 I510 E511	D505-G507 PolarHBondContact O-N 2.88Å; G507-L509 PolarHBondContact O-N 3.19Å; G507-I510 WeakPolarHBondContact O-CG2 3.49Å; G507-I510 PolarHBondContact O-N 3.36Å; G507-I510 VanDerWaalsContact O-N 3.15Å; G507-E511 WeakPolarHBondContact CA-OE1 3.43Å; G507-E511 WeakPolarHBondContact O-CG 3.39Å; G507-E511 PolarHBondContact O-N 3.5Å; G507-E511 VanDerWaalsContact O-N 3.09Å
508	P	89.9	Confident	87.7	Confident	35 Å²	35	40.9 Å²	40.9	23%	0.227	20%	0.2	C	C	.	.	H	α-helix	trans	-53.7	-26.5	-167.3	-33.7	38.6	0	0	0	116.9	E511 C512 Y610 W650 L675	P508-E511 WeakPolarHBondContact CA-OE2 3.44Å; P508-C512 WeakPolarHBondContact O-CB 3.16Å; P508-C512 PolarHBondContact O-N 2.96Å; P508-Y610 HydrophobicContact CB-CE1 4.45Å; P508-W650 HydrophobicContact CB-CD2 3.6Å; P508-W650 HydrophobicContact CB-CE3 3.89Å; P508-W650 HydrophobicContact CB-CG 3.97Å; P508-W650 HydrophobicContact CB-CH2 4.37Å; P508-W650 HydrophobicContact CB-CZ2 4.12Å; P508-W650 HydrophobicContact CB-CZ3 4.25Å; P508-W650 HydrophobicContact CG-CD2 3.86Å; P508-W650 HydrophobicContact CG-CE3 3.91Å; P508-W650 HydrophobicContact CG-CH2 3.53Å; P508-W650 HydrophobicContact CG-CZ2 3.47Å; P508-W650 VanDerWaalsContact CG-CZ2 3.47Å; P508-W650 HydrophobicContact CG-CZ3 3.74Å; P508-L675 HydrophobicContact CB-CD1 4.1Å; P508-L675 HydrophobicContact CB-CD2 3.69Å; P508-L675 WeakPolarHBondContact O-CD1 3.3Å
509	L	91.4	Very high	87.6	Confident	23 Å²	23	36.9 Å²	36.9	12%	0.12	18%	0.182	C	C	.	.	H	α-helix	trans	-72.8	-50.9	179.8	-177.9	62.9	0	0	0	112.5	V486 P488 L504 G507 C512 M513 L648 L675	V486-L509 HydrophobicContact CG1-CD1 4.01Å; V486-L509 HydrophobicContact CG1-CD2 3.86Å; V486-L509 HydrophobicContact CG1-CG 4.17Å; P488-L509 HydrophobicContact CB-CD2 3.67Å; L504-L509 HydrophobicContact CD1-CD2 4.08Å; L504-L509 HydrophobicContact CD1-CG 4.32Å; L504-L509 HydrophobicContact CD2-CD2 4.27Å; G507-L509 PolarHBondContact O-N 3.19Å; L509-C512 WeakPolarHBondContact O-CB 3.42Å; L509-C512 PolarHBondContact O-N 2.84Å; L509-M513 PolarHBondContact O-N 3.14Å; L509-M513 VanDerWaalsContact O-N 3.17Å; L509-L648 HydrophobicContact CD1-CD1 3.73Å; L509-L675 HydrophobicContact CD1-CB 4.09Å
510	I	91.6	Very high	87.2	Confident	3 Å²	3	31.1 Å²	31.1	2%	0.015	16%	0.157	C	C	.	.	H	α-helix	trans	-72.1	-35.1	177.5	-167.3	170.1	0	0	0	110.8	L504 G507 C512 M513 A514 T539 W541	L504-I510 HydrophobicContact CB-CB 4.48Å; G507-I510 WeakPolarHBondContact O-CG2 3.49Å; G507-I510 PolarHBondContact O-N 3.36Å; G507-I510 VanDerWaalsContact O-N 3.15Å; I510-C512 VanDerWaalsContact C-N 3.35Å; I510-C512 PolarHBondContact O-N 2.99Å; I510-M513 PolarHBondContact O-N 3.37Å; I510-A514 VanDerWaalsContact O-CB 3.3Å; I510-A514 WeakPolarHBondContact O-CB 3.46Å; I510-A514 PolarHBondContact O-N 3.38Å; I510-T539 HydrophobicContact CG1-CG2 4.07Å; I510-W541 HydrophobicContact CD1-CZ2 4.46Å; I510-W541 HydrophobicContact CG1-CZ2 4.34Å; I510-W541 HydrophobicContact CG2-CZ2 4.27Å
511	E	92.5	Very high	86.9	Confident	15 Å²	15	32.7 Å²	32.7	7%	0.07	16%	0.16	C	C	.	.	H	α-helix	trans	-58.7	-43.8	171.2	-64.4	161	-158.2	0	0	111.7	G507 P508 A514 T515 Y578 I580 Y610	G507-E511 WeakPolarHBondContact CA-OE1 3.43Å; G507-E511 WeakPolarHBondContact O-CG 3.39Å; G507-E511 PolarHBondContact O-N 3.5Å; G507-E511 VanDerWaalsContact O-N 3.09Å; P508-E511 WeakPolarHBondContact CA-OE2 3.44Å; E511-A514 PolarHBondContact O-N 3.44Å; E511-T515 WeakPolarHBondContact O-CB 3.42Å; E511-T515 WeakPolarHBondContact O-CG2 3.48Å; E511-T515 PolarHBondContact O-N 2.99Å; E511-T515 PolarHBondContact O-OG1 3.45Å; E511-Y578 PolarHBondContact OE1-OH 3.47Å; E511-I580 HydrophobicContact CB-CD1 4.15Å; E511-I580 HydrophobicContact CG-CD1 3.78Å; E511-Y610 HydrophobicContact CB-CE1 3.93Å; E511-Y610 HydrophobicContact CB-CE2 4.38Å; E511-Y610 PolarHBondContact OE2-OH 3.39Å
512	C	93.7	Very high	86.3	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-61	-44.8	175.4	-176.5	0	0	0	0	111.6	P508 L509 I510 T515 C516 Y610 L675	P508-C512 WeakPolarHBondContact O-CB 3.16Å; P508-C512 PolarHBondContact O-N 2.96Å; L509-C512 WeakPolarHBondContact O-CB 3.42Å; L509-C512 PolarHBondContact O-N 2.84Å; I510-C512 VanDerWaalsContact C-N 3.35Å; I510-C512 PolarHBondContact O-N 2.99Å; C512-T515 PolarHBondContact O-N 3.06Å; C512-C516 WeakPolarHBondContact O-CA 3.44Å; C512-C516 WeakPolarHBondContact O-CB 3.45Å; C512-C516 PolarHBondContact O-N 3.05Å; C512-Y610 HydrophobicContact CB-CD1 3.69Å; C512-Y610 HydrophobicContact CB-CE1 4.43Å; C512-Y610 HydrophobicContact CB-CG 4.18Å; C512-L675 HydrophobicContact CB-CD1 3.99Å
513	M	92.7	Very high	85.7	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-66.7	-35.3	176.6	-68.6	178.1	64.5	0	0	112.9	L483 V486 P501 L504 L509 I510 M535 S538 T539 L648 L678	L483-M513 HydrophobicContact CD2-CE 4.36Å; V486-M513 HydrophobicContact CG1-SD 4.39Å; V486-M513 HydrophobicContact CG2-CE 3.69Å; V486-M513 HydrophobicContact CG2-SD 3.49Å; V486-M513 WeakPolarHBondContact CG2-SD 3.48Å; P501-M513 HydrophobicContact CB-CE 3.69Å; P501-M513 HydrophobicContact CB-SD 4.27Å; P501-M513 HydrophobicContact CG-CE 3.8Å; L504-M513 HydrophobicContact CD1-SD 4.49Å; L509-M513 PolarHBondContact O-N 3.14Å; L509-M513 VanDerWaalsContact O-N 3.17Å; I510-M513 PolarHBondContact O-N 3.37Å; M513-M535 HydrophobicContact CB-CG 4.04Å; M513-M535 HydrophobicContact CB-SD 4.43Å; M513-M535 HydrophobicContact CE-CG 3.99Å; M513-M535 HydrophobicContact CG-CG 4.17Å; M513-M535 HydrophobicContact CG-SD 4.42Å; M513-M535 VanDerWaalsContact O-CE 3.29Å; M513-M535 WeakPolarHBondContact O-CE 3.33Å; M513-S538 WeakPolarHBondContact CE-OG 3.46Å; M513-T539 HydrophobicContact CB-CG2 3.78Å; M513-T539 HydrophobicContact CE-CG2 4.41Å; M513-L648 HydrophobicContact CG-CD1 3.88Å; M513-L678 HydrophobicContact CE-CD1 3.77Å; M513-L678 HydrophobicContact SD-CD1 4.21Å
514	A	91.7	Very high	85.2	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-78.9	-21.2	179.9	0	0	0	0	0	113.7	I510 E511 H517 F536 T539 W541 V562	I510-A514 VanDerWaalsContact O-CB 3.3Å; I510-A514 WeakPolarHBondContact O-CB 3.46Å; I510-A514 PolarHBondContact O-N 3.38Å; E511-A514 PolarHBondContact O-N 3.44Å; A514-H517 PolarHBondContact O-NE2 2.83Å; A514-H517 VanDerWaalsContact O-NE2 3.12Å; A514-F536 WeakPolarHBondContact O-CE2 3.47Å; A514-T539 HydrophobicContact CB-CG2 4.49Å; A514-W541 HydrophobicContact CB-CD2 3.92Å; A514-W541 HydrophobicContact CB-CE3 3.72Å; A514-W541 HydrophobicContact CB-CG 4.4Å; A514-W541 HydrophobicContact CB-CZ3 4.05Å; A514-V562 HydrophobicContact CB-CG1 4.21Å; A514-V562 WeakPolarHBondContact O-CG1 3.31Å
515	T	91.9	Very high	85.1	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-121.9	-27.1	-172.3	63.9	0	0	0	0	115.3	E511 C512 H517 V562 I580 T599 Y610	E511-T515 WeakPolarHBondContact O-CB 3.42Å; E511-T515 WeakPolarHBondContact O-CG2 3.48Å; E511-T515 PolarHBondContact O-N 2.99Å; E511-T515 PolarHBondContact O-OG1 3.45Å; C512-T515 PolarHBondContact O-N 3.06Å; T515-H517 PolarHBondContact O-N 3.28Å; T515-V562 HydrophobicContact CG2-CB 4.47Å; T515-V562 HydrophobicContact CG2-CG2 3.98Å; T515-I580 HydrophobicContact CG2-CB 4.2Å; T515-I580 HydrophobicContact CG2-CD1 4.39Å; T515-I580 HydrophobicContact CG2-CG2 3.8Å; T515-T599 HydrophobicContact CG2-CG2 4.21Å; T515-Y610 WeakPolarHBondContact OG1-CD2 3.43Å
516	C	92.6	Very high	85.1	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.195	C	C	.	.	S	Bend	trans	-83.2	61.8	-174.5	-161	0	0	0	0	111.2	C512 Y610 K612	C512-C516 WeakPolarHBondContact O-CA 3.44Å; C512-C516 WeakPolarHBondContact O-CB 3.45Å; C512-C516 PolarHBondContact O-N 3.05Å; C516-Y610 PolarHBondContact SG-O 3.5Å; C516-K612 WeakPolarHBondContact O-CD 3.43Å; C516-K612 VanDerWaalsContact O-CE 3.3Å; C516-K612 WeakPolarHBondContact O-CE 3.35Å; C516-K612 PolarHBondContact O-NZ 3.04Å
517	H	89.8	Confident	85.1	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.179	C	C	.	.	S	Bend	trans	-146.1	162.6	-176.7	64.1	42.2	0	0	0	112.6	A514 T515 L519 D532 M535 F536 F543 Q585	A514-H517 PolarHBondContact O-NE2 2.83Å; A514-H517 VanDerWaalsContact O-NE2 3.12Å; T515-H517 PolarHBondContact O-N 3.28Å; H517-L519 HydrophobicContact CB-CD1 4.48Å; H517-L519 HydrophobicContact CB-CG 4.08Å; H517-D532 WeakPolarHBondContact CA-OD2 3.33Å; H517-D532 HydrophobicContact CB-CB 4.03Å; H517-D532 WeakPolarHBondContact CB-OD2 3.21Å; H517-M535 HydrophobicContact CB-CE 4.07Å; H517-F536 AromaticContact CD2-CD2 3.55Å; H517-F536 AromaticContact NE2-CD2 3.27Å; H517-F536 VanDerWaalsContact NE2-CD2 3.27Å; H517-F536 WeakPolarHBondContact NE2-CD2 3.43Å; H517-F536 AromaticContact NE2-CE2 3.67Å; H517-F543 AromaticContact CE1-CD2 3.8Å; H517-F543 AromaticContact CE1-CE2 3.59Å; H517-Q585 PolarHBondContact O-NE2 2.86Å; H517-Q585 PolarHBondContact O-OE1 3.2Å
518	S	83.2	Confident	84.6	Confident	38 Å²	38	30.4 Å²	30.4	27%	0.266	18%	0.178	S	C	.	.			trans	-110.7	35	174.3	-68.4	0	0	0	0	112.9	D532 Q585	S518-D532 PolarHBondContact N-OD2 2.88Å; S518-Q585 PolarHBondContact OG-OE1 3.41Å
519	L	86.3	Confident	83.9	Confident	2 Å²	2	32.3 Å²	32.3	1%	0.01	19%	0.186	C	C	.	.			trans	-67.2	151.4	173.5	-58.8	-178.3	0	0	0	112.2	H517 L526 D532 V533 F536 F543	H517-L519 HydrophobicContact CB-CD1 4.48Å; H517-L519 HydrophobicContact CB-CG 4.08Å; L519-L526 HydrophobicContact CB-CD1 4.15Å; L519-L526 HydrophobicContact CB-CG 4.46Å; L519-L526 HydrophobicContact CD1-CD1 4.28Å; L519-L526 HydrophobicContact CD1-CD2 3.77Å; L519-L526 HydrophobicContact CD1-CG 4.04Å; L519-D532 HydrophobicContact CD1-CB 4.43Å; L519-D532 HydrophobicContact CD2-CB 3.55Å; L519-D532 HydrophobicContact CG-CB 3.94Å; L519-V533 HydrophobicContact CD2-CB 4.44Å; L519-V533 HydrophobicContact CD2-CG2 3.53Å; L519-F536 HydrophobicContact CD1-CB 3.51Å; L519-F536 HydrophobicContact CD1-CD1 4.47Å; L519-F536 HydrophobicContact CD1-CD2 4.42Å; L519-F536 HydrophobicContact CD1-CG 3.88Å; L519-F543 WeakPolarHBondContact O-CZ 3.43Å
520	T	79.7	Confident	83.1	Confident	11 Å²	11	33.1 Å²	33.1	7%	0.067	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	162.4	177	58.1	0	0	0	0	109.2	I294 S527	I294-T520 HydrophobicContact CD1-CG2 4.2Å; T520-S527 PolarHBondContact N-O 3.37Å; T520-S527 PolarHBondContact O-N 3.39Å; T520-S527 PolarHBondContact OG1-O 3.05Å
521	R	79.2	Confident	82.6	Confident	105 Å²	105	33.2 Å²	33.2	40%	0.396	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	109.4	177.2	-159.5	167.6	-175.2	177.4	-9.3	109.4	G524 V525 F543 E545	R521-G524 PolarHBondContact NE-O 3.33Å; R521-V525 CarbonylContact C-O 3.54Å; R521-V525 WeakPolarHBondContact CA-O 3.11Å; R521-F543 HydrophobicContact CB-CD1 4.49Å; R521-F543 HydrophobicContact CB-CE1 4.46Å; R521-F543 PolarHBondContact NH1-O 2.74Å; R521-F543 VanDerWaalsContact NH1-O 3.11Å; R521-E545 PolarHBondContact N-OE2 2.99Å
522	I	70.9	Confident	82.3	Confident	23 Å²	23	32.9 Å²	32.9	12%	0.118	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	121.2	-178.3	-55.2	177.6	0	0	0	107	I294 P306 I339 G524 V525	I294-I522 HydrophobicContact CG2-CD1 3.93Å; P306-I522 HydrophobicContact CB-CD1 4.16Å; P306-I522 HydrophobicContact CG-CD1 3.91Å; I339-I522 HydrophobicContact CD1-CD1 4.15Å; I339-I522 HydrophobicContact CG2-CG2 3.83Å; I522-G524 PolarHBondContact O-N 3.19Å; I522-G524 VanDerWaalsContact O-N 3.1Å; I522-V525 PolarHBondContact N-O 2.93Å; I522-V525 PolarHBondContact O-N 3.49Å
523	D	70.9	Confident	81.9	Confident	158 Å²	158	33.9 Å²	33.9	85%	0.845	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.1	38.7	-178.5	-54.5	-34.2	0	0	0	113.6	V525	D523-V525 PolarHBondContact O-N 2.95Å
524	G	73.6	Confident	81.6	Confident	46 Å²	46	37.9 Å²	37.9	47%	0.474	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.7	-13.9	-177.9	0	0	0	0	0	115.3	R521 I522	R521-G524 PolarHBondContact NE-O 3.33Å; I522-G524 PolarHBondContact O-N 3.19Å; I522-G524 VanDerWaalsContact O-N 3.1Å
525	V	79.8	Confident	81.5	Confident	100 Å²	100	38 Å²	38	61%	0.606	22%	0.216	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-90.4	137.4	179.7	-176.4	0	0	0	0	111	R521 I522 D523	R521-V525 CarbonylContact C-O 3.54Å; R521-V525 WeakPolarHBondContact CA-O 3.11Å; I522-V525 PolarHBondContact N-O 2.93Å; I522-V525 PolarHBondContact O-N 3.49Å; D523-V525 PolarHBondContact O-N 2.95Å
526	L	81.9	Confident	81.5	Confident	38 Å²	38	38.4 Å²	38.4	20%	0.199	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	125.8	175.7	-164	71.3	0	0	0	110.2	L519 F536 F543	L519-L526 HydrophobicContact CB-CD1 4.15Å; L519-L526 HydrophobicContact CB-CG 4.46Å; L519-L526 HydrophobicContact CD1-CD1 4.28Å; L519-L526 HydrophobicContact CD1-CD2 3.77Å; L519-L526 HydrophobicContact CD1-CG 4.04Å; L526-F536 HydrophobicContact CD2-CB 4.48Å; L526-F536 HydrophobicContact CD2-CD1 3.47Å; L526-F536 VanDerWaalsContact CD2-CD1 3.47Å; L526-F536 HydrophobicContact CD2-CE1 4.1Å; L526-F536 HydrophobicContact CD2-CG 4.19Å; L526-F543 HydrophobicContact CD1-CB 4.03Å; L526-F543 HydrophobicContact CD1-CD1 3.41Å; L526-F543 VanDerWaalsContact CD1-CD1 3.41Å; L526-F543 HydrophobicContact CD1-CE1 4.11Å; L526-F543 HydrophobicContact CD1-CG 3.96Å
527	S	77.6	Confident	81.3	Confident	31 Å²	31	43.6 Å²	43.6	22%	0.217	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	141.1	-172.1	-150.8	0	0	0	0	112.7	P306 T520	P306-S527 VanDerWaalsContact CG-OG 3.23Å; P306-S527 WeakPolarHBondContact CG-OG 3.38Å; T520-S527 PolarHBondContact N-O 3.37Å; T520-S527 PolarHBondContact O-N 3.39Å; T520-S527 PolarHBondContact OG1-O 3.05Å
528	G	75.7	Confident	81.2	Confident	10 Å²	10	44.7 Å²	44.7	10%	0.103	25%	0.25	C	C	.	.	S	Bend	trans	157.3	-160.5	-175.2	0	0	0	0	0	111
529	D	75.5	Confident	81.5	Confident	75 Å²	75	43 Å²	43	40%	0.401	24%	0.238	S	C	.	.			trans	-58	130	176.4	-170.8	-36.9	0	0	0	110.5	L531 D532 V533	D529-L531 PolarHBondContact O-N 2.98Å; D529-L531 VanDerWaalsContact O-N 3.12Å; D529-L531 WeakPolarHBondContact OD1-CB 3.13Å; D529-L531 PolarHBondContact OD1-N 3.33Å; D529-D532 HydrophobicContact CB-CB 4.18Å; D529-D532 WeakPolarHBondContact O-CA 3.13Å; D529-D532 WeakPolarHBondContact O-CB 3.43Å; D529-D532 PolarHBondContact O-N 2.95Å; D529-V533 WeakPolarHBondContact O-CG2 3.23Å; D529-V533 PolarHBondContact O-N 2.87Å
530	P	73.8	Confident	81.6	Confident	40 Å²	40	47.2 Å²	47.2	26%	0.26	26%	0.256	S	S	.	.	H	α-helix	trans	-52.5	-33.3	176.7	-29.4	35.7	0	0	0	113.4	L305 V533 K534	L305-P530 HydrophobicContact CD1-CG 4.01Å; L305-P530 HydrophobicContact CD2-CG 3.69Å; L305-P530 HydrophobicContact CG-CG 4.45Å; P530-V533 PolarHBondContact O-N 3.47Å; P530-K534 VanDerWaalsContact O-CB 3.26Å; P530-K534 WeakPolarHBondContact O-CB 3.35Å; P530-K534 WeakPolarHBondContact O-CG 3.45Å; P530-K534 PolarHBondContact O-N 3.09Å
531	L	81.2	Confident	82.1	Confident	5 Å²	5	47.4 Å²	47.4	3%	0.026	26%	0.256	C	S	.	.	H	α-helix	trans	-60.6	-48.8	173.7	-175.7	154.6	0	0	0	110.9	L481 D529 M535 L646 M680	L481-L531 HydrophobicContact CD1-CD1 4.49Å; D529-L531 PolarHBondContact O-N 2.98Å; D529-L531 VanDerWaalsContact O-N 3.12Å; D529-L531 WeakPolarHBondContact OD1-CB 3.13Å; D529-L531 PolarHBondContact OD1-N 3.33Å; L531-M535 WeakPolarHBondContact O-CB 3.2Å; L531-M535 PolarHBondContact O-N 3.27Å; L531-L646 HydrophobicContact CD1-CD1 3.96Å; L531-L646 HydrophobicContact CD2-CD1 3.83Å; L531-L646 HydrophobicContact CG-CD1 4.45Å; L531-M680 HydrophobicContact CD1-CE 3.73Å; L531-M680 HydrophobicContact CD1-SD 3.71Å; L531-M680 HydrophobicContact CD2-SD 4.44Å; L531-M680 HydrophobicContact CG-CE 4.18Å; L531-M680 HydrophobicContact CG-SD 3.57Å; L531-M680 VanDerWaalsContact CG-SD 3.57Å
532	D	87	Confident	82.5	Confident	9 Å²	9	45 Å²	45	5%	0.048	25%	0.249	C	C	.	.	H	α-helix	trans	-66.6	-42.9	178.6	-76.4	23.1	0	0	0	110.6	H517 S518 L519 D529 M535 F536 K612	H517-D532 WeakPolarHBondContact CA-OD2 3.33Å; H517-D532 HydrophobicContact CB-CB 4.03Å; H517-D532 WeakPolarHBondContact CB-OD2 3.21Å; S518-D532 PolarHBondContact N-OD2 2.88Å; L519-D532 HydrophobicContact CD1-CB 4.43Å; L519-D532 HydrophobicContact CD2-CB 3.55Å; L519-D532 HydrophobicContact CG-CB 3.94Å; D529-D532 HydrophobicContact CB-CB 4.18Å; D529-D532 WeakPolarHBondContact O-CA 3.13Å; D529-D532 WeakPolarHBondContact O-CB 3.43Å; D529-D532 PolarHBondContact O-N 2.95Å; D532-M535 PolarHBondContact O-N 2.95Å; D532-F536 VanDerWaalsContact O-CB 3.3Å; D532-F536 WeakPolarHBondContact O-CB 3.46Å; D532-F536 PolarHBondContact O-N 2.86Å; D532-K612 WeakPolarHBondContact OD1-CE 3.38Å; D532-K612 IonicContact OD1-NZ 2.61Å; D532-K612 PolarHBondContact OD1-NZ 2.9Å; D532-K612 IonicContact OD2-NZ 3.83Å; D532-K612 PolarHBondContact OD2-NZ 3.47Å
533	V	85.1	Confident	83.3	Confident	21 Å²	21	44.3 Å²	44.3	13%	0.127	25%	0.245	C	C	.	.	H	α-helix	trans	-61.2	-47.1	178.4	173.3	0	0	0	0	110.5	L519 D529 P530 F536 Q537	L519-V533 HydrophobicContact CD2-CB 4.44Å; L519-V533 HydrophobicContact CD2-CG2 3.53Å; D529-V533 WeakPolarHBondContact O-CG2 3.23Å; D529-V533 PolarHBondContact O-N 2.87Å; P530-V533 PolarHBondContact O-N 3.47Å; V533-F536 PolarHBondContact O-N 3.44Å; V533-Q537 HydrophobicContact CG1-CG 4.28Å; V533-Q537 VanDerWaalsContact O-CB 3.28Å; V533-Q537 WeakPolarHBondContact O-CB 3.42Å; V533-Q537 WeakPolarHBondContact O-CG 3.31Å; V533-Q537 PolarHBondContact O-N 3.41Å
534	K	86.2	Confident	83.8	Confident	84 Å²	84	39 Å²	39	37%	0.365	22%	0.217	S	C	.	.	H	α-helix	trans	-68.2	-42.4	179.2	-71.5	-88.5	-176.8	160.9	0	111.9	L481 D482 P530 F536 S538	L481-K534 WeakPolarHBondContact O-CG 3.44Å; D482-K534 IonicContact OD1-NZ 3.33Å; D482-K534 PolarHBondContact OD1-NZ 3.47Å; P530-K534 VanDerWaalsContact O-CB 3.26Å; P530-K534 WeakPolarHBondContact O-CB 3.35Å; P530-K534 WeakPolarHBondContact O-CG 3.45Å; P530-K534 PolarHBondContact O-N 3.09Å; K534-F536 PolarHBondContact O-N 3.09Å; K534-S538 WeakPolarHBondContact O-CB 3.25Å; K534-S538 PolarHBondContact O-N 3.35Å
535	M	90	Very high	83.8	Confident	3 Å²	3	38.5 Å²	38.5	2%	0.015	20%	0.202	C	C	.	.	H	α-helix	trans	-57.7	-47.8	173.5	-176.9	-173.2	67.1	0	0	110.8	M513 H517 L531 D532 S538 K612 L678	M513-M535 HydrophobicContact CB-CG 4.04Å; M513-M535 HydrophobicContact CB-SD 4.43Å; M513-M535 HydrophobicContact CE-CG 3.99Å; M513-M535 HydrophobicContact CG-CG 4.17Å; M513-M535 HydrophobicContact CG-SD 4.42Å; M513-M535 VanDerWaalsContact O-CE 3.29Å; M513-M535 WeakPolarHBondContact O-CE 3.33Å; H517-M535 HydrophobicContact CB-CE 4.07Å; L531-M535 WeakPolarHBondContact O-CB 3.2Å; L531-M535 PolarHBondContact O-N 3.27Å; D532-M535 PolarHBondContact O-N 2.95Å; M535-S538 PolarHBondContact O-N 2.8Å; M535-S538 PolarHBondContact O-OG 3.1Å; M535-K612 HydrophobicContact CE-CD 4.28Å; M535-K612 VanDerWaalsContact CE-NZ 3.28Å; M535-K612 HydrophobicContact SD-CD 4.14Å; M535-L678 HydrophobicContact CB-CD2 4.5Å; M535-L678 HydrophobicContact CG-CD2 4.02Å; M535-L678 HydrophobicContact SD-CD2 3.82Å
536	F	90.8	Very high	82.9	Confident	8 Å²	8	34.9 Å²	34.9	4%	0.035	18%	0.18	C	C	.	.	H	α-helix	trans	-67.2	-48.4	178.6	-173.5	-90.9	0	0	0	112.8	A514 H517 L519 L526 D532 V533 K534 S538 T539 W541 F543 V562	A514-F536 WeakPolarHBondContact O-CE2 3.47Å; H517-F536 AromaticContact CD2-CD2 3.55Å; H517-F536 AromaticContact NE2-CD2 3.27Å; H517-F536 VanDerWaalsContact NE2-CD2 3.27Å; H517-F536 WeakPolarHBondContact NE2-CD2 3.43Å; H517-F536 AromaticContact NE2-CE2 3.67Å; L519-F536 HydrophobicContact CD1-CB 3.51Å; L519-F536 HydrophobicContact CD1-CD1 4.47Å; L519-F536 HydrophobicContact CD1-CD2 4.42Å; L519-F536 HydrophobicContact CD1-CG 3.88Å; L526-F536 HydrophobicContact CD2-CB 4.48Å; L526-F536 HydrophobicContact CD2-CD1 3.47Å; L526-F536 VanDerWaalsContact CD2-CD1 3.47Å; L526-F536 HydrophobicContact CD2-CE1 4.1Å; L526-F536 HydrophobicContact CD2-CG 4.19Å; D532-F536 VanDerWaalsContact O-CB 3.3Å; D532-F536 WeakPolarHBondContact O-CB 3.46Å; D532-F536 PolarHBondContact O-N 2.86Å; V533-F536 PolarHBondContact O-N 3.44Å; K534-F536 PolarHBondContact O-N 3.09Å; F536-S538 PolarHBondContact O-N 3.25Å; F536-S538 VanDerWaalsContact O-N 3.16Å; F536-T539 PolarHBondContact O-N 2.96Å; F536-T539 PolarHBondContact O-OG1 2.94Å; F536-W541 VanDerWaalsContact CE1-O 3.29Å; F536-W541 WeakPolarHBondContact CE1-O 3.43Å; F536-W541 HydrophobicContact CE2-CB 4.44Å; F536-W541 HydrophobicContact CZ-CB 4.11Å; F536-F543 HydrophobicContact CE1-CB 3.93Å; F536-F543 HydrophobicContact CE2-CB 4.21Å; F536-F543 HydrophobicContact CZ-CB 3.58Å; F536-V562 HydrophobicContact CE2-CG1 3.54Å; F536-V562 HydrophobicContact CZ-CG1 3.95Å
537	Q	89.1	Confident	81.7	Confident	109 Å²	109	40 Å²	40	51%	0.509	21%	0.206	S	C	.	.	H	α-helix	trans	-58	-31.8	177.6	-75.6	173.5	-8.4	0	0	112.2	V533 T539 K540	V533-Q537 HydrophobicContact CG1-CG 4.28Å; V533-Q537 VanDerWaalsContact O-CB 3.28Å; V533-Q537 WeakPolarHBondContact O-CB 3.42Å; V533-Q537 WeakPolarHBondContact O-CG 3.31Å; V533-Q537 PolarHBondContact O-N 3.41Å; Q537-T539 VanDerWaalsContact C-N 3.32Å; Q537-T539 PolarHBondContact O-N 3.5Å; Q537-K540 PolarHBondContact O-N 3.32Å
538	S	88.2	Confident	80.5	Confident	23 Å²	23	41.2 Å²	41.2	16%	0.161	21%	0.214	C	C	.	.	H	α-helix	trans	-68.9	-23.2	178.3	79	0	0	0	0	114.7	L483 S502 M513 K534 M535 F536 K540	L483-S538 WeakPolarHBondContact CD2-OG 3.33Å; S502-S538 PolarHBondContact N-O 2.62Å; M513-S538 WeakPolarHBondContact CE-OG 3.46Å; K534-S538 WeakPolarHBondContact O-CB 3.25Å; K534-S538 PolarHBondContact O-N 3.35Å; M535-S538 PolarHBondContact O-N 2.8Å; M535-S538 PolarHBondContact O-OG 3.1Å; F536-S538 PolarHBondContact O-N 3.25Å; F536-S538 VanDerWaalsContact O-N 3.16Å; S538-K540 VanDerWaalsContact C-N 3.34Å
539	T	89.7	Confident	79.3	Confident	3 Å²	3	48.9 Å²	48.9	2%	0.018	25%	0.247	C	C	.	.	H	α-helix	trans	-78.8	-21.3	173.7	72.4	0	0	0	0	112	S502 I510 M513 A514 F536 Q537 W541	S502-T539 WeakPolarHBondContact CB-O 3.09Å; I510-T539 HydrophobicContact CG1-CG2 4.07Å; M513-T539 HydrophobicContact CB-CG2 3.78Å; M513-T539 HydrophobicContact CE-CG2 4.41Å; A514-T539 HydrophobicContact CB-CG2 4.49Å; F536-T539 PolarHBondContact O-N 2.96Å; F536-T539 PolarHBondContact O-OG1 2.94Å; Q537-T539 VanDerWaalsContact C-N 3.32Å; Q537-T539 PolarHBondContact O-N 3.5Å; T539-W541 VanDerWaalsContact O-CD1 3.27Å; T539-W541 PolarHBondContact O-N 3.35Å; T539-W541 PolarHBondContact OG1-N 2.93Å
540	K	87.6	Confident	77.9	Confident	89 Å²	89	52.8 Å²	52.8	39%	0.387	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	11.2	-173	-55.4	173.9	-173.6	153.2	0	115.4	E500 S502 Q537 S538 K565	E500-K540 IonicContact OE1-NZ 2.73Å; E500-K540 PolarHBondContact OE1-NZ 3.1Å; S502-K540 WeakPolarHBondContact OG-CE 3.42Å; S502-K540 PolarHBondContact OG-NZ 2.82Å; Q537-K540 PolarHBondContact O-N 3.32Å; S538-K540 VanDerWaalsContact C-N 3.34Å; K540-K565 WeakPolarHBondContact O-CD 3.48Å; K540-K565 WeakPolarHBondContact O-CE 3.39Å; K540-K565 WeakPolarHBondContact O-CG 3.48Å
541	W	89.4	Confident	76.5	Confident	15 Å²	15	57.3 Å²	57.3	6%	0.057	29%	0.286	C	S	.	.			trans	-71.4	168.1	177.9	-72.2	32.7	0	0	0	112.6	Y506 I510 A514 F536 T539 V562 R563 P564 Y578 I580	Y506-W541 AromaticContact CD1-CZ2 3.96Å; Y506-W541 HydrophobicContact CD1-CZ2 3.96Å; Y506-W541 AromaticContact CE1-CZ2 3.92Å; Y506-W541 HydrophobicContact CE1-CZ2 3.92Å; I510-W541 HydrophobicContact CD1-CZ2 4.46Å; I510-W541 HydrophobicContact CG1-CZ2 4.34Å; I510-W541 HydrophobicContact CG2-CZ2 4.27Å; A514-W541 HydrophobicContact CB-CD2 3.92Å; A514-W541 HydrophobicContact CB-CE3 3.72Å; A514-W541 HydrophobicContact CB-CG 4.4Å; A514-W541 HydrophobicContact CB-CZ3 4.05Å; F536-W541 VanDerWaalsContact CE1-O 3.29Å; F536-W541 WeakPolarHBondContact CE1-O 3.43Å; F536-W541 HydrophobicContact CE2-CB 4.44Å; F536-W541 HydrophobicContact CZ-CB 4.11Å; T539-W541 VanDerWaalsContact O-CD1 3.27Å; T539-W541 PolarHBondContact O-N 3.35Å; T539-W541 PolarHBondContact OG1-N 2.93Å; W541-V562 HydrophobicContact CB-CG1 4.41Å; W541-V562 HydrophobicContact CE3-CB 4.43Å; W541-V562 HydrophobicContact CE3-CG1 3.94Å; W541-R563 WeakPolarHBondContact CB-O 3.36Å; W541-P564 HydrophobicContact CD2-CG 4.36Å; W541-P564 HydrophobicContact CH2-CG 4.47Å; W541-P564 HydrophobicContact CZ2-CG 4.24Å; W541-Y578 HydrophobicContact CH2-CD1 4.36Å; W541-Y578 AromaticContact CH2-CE1 3.91Å; W541-Y578 HydrophobicContact CH2-CE1 3.91Å; W541-I580 HydrophobicContact CH2-CD1 4.21Å; W541-I580 HydrophobicContact CZ3-CD1 4.03Å
542	E	87.9	Confident	75.2	Confident	56 Å²	56	59.7 Å²	59.7	26%	0.262	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	139.5	174.4	-175.4	173.2	-142	0	0	111.5	I544 V562 R563	E542-I544 HydrophobicContact CG-CD1 4.47Å; E542-I544 HydrophobicContact CG-CG1 4.09Å; E542-V562 WeakPolarHBondContact O-CA 3.13Å; E542-V562 WeakPolarHBondContact O-CG1 3.15Å; E542-R563 HydrophobicContact CB-CG 4.2Å; E542-R563 PolarHBondContact N-O 3.06Å; E542-R563 PolarHBondContact O-N 3.36Å; E542-R563 VanDerWaalsContact O-N 3.11Å; E542-R563 IonicContact OE2-CZ 2.81Å; E542-R563 VanDerWaalsContact OE2-CZ 3.26Å; E542-R563 IonicContact OE2-NE 2.9Å; E542-R563 PolarHBondContact OE2-NE 3.04Å; E542-R563 IonicContact OE2-NH2 3.84Å; E542-R563 PolarHBondContact OE2-NH2 2.9Å
543	F	87.4	Confident	73.6	Confident	7 Å²	7	64.1 Å²	64.1	3%	0.031	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	125.5	177	178.4	-106.6	0	0	0	110.8	H517 L519 R521 L526 F536 E545 A560 V562 I582	H517-F543 AromaticContact CE1-CD2 3.8Å; H517-F543 AromaticContact CE1-CE2 3.59Å; L519-F543 WeakPolarHBondContact O-CZ 3.43Å; R521-F543 HydrophobicContact CB-CD1 4.49Å; R521-F543 HydrophobicContact CB-CE1 4.46Å; R521-F543 PolarHBondContact NH1-O 2.74Å; R521-F543 VanDerWaalsContact NH1-O 3.11Å; L526-F543 HydrophobicContact CD1-CB 4.03Å; L526-F543 HydrophobicContact CD1-CD1 3.41Å; L526-F543 VanDerWaalsContact CD1-CD1 3.41Å; L526-F543 HydrophobicContact CD1-CE1 4.11Å; L526-F543 HydrophobicContact CD1-CG 3.96Å; F536-F543 HydrophobicContact CE1-CB 3.93Å; F536-F543 HydrophobicContact CE2-CB 4.21Å; F536-F543 HydrophobicContact CZ-CB 3.58Å; F543-E545 HydrophobicContact CD1-CG 4.46Å; F543-E545 HydrophobicContact CE1-CG 3.5Å; F543-E545 VanDerWaalsContact CE1-CG 3.5Å; F543-E545 HydrophobicContact CZ-CG 3.6Å; F543-A560 HydrophobicContact CD2-CB 4.33Å; F543-A560 HydrophobicContact CE2-CB 3.4Å; F543-A560 HydrophobicContact CZ-CB 3.67Å; F543-V562 HydrophobicContact CD2-CG2 4.46Å; F543-I582 HydrophobicContact CE2-CD1 4.48Å
544	I	83.1	Confident	72	Confident	48 Å²	48	63.8 Å²	63.8	25%	0.246	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	114.3	-176.2	-55.7	177.6	0	0	0	108.4	E542 A560 I561	E542-I544 HydrophobicContact CG-CD1 4.47Å; E542-I544 HydrophobicContact CG-CG1 4.09Å; I544-A560 CarbonylContact O-C 3.59Å; I544-A560 WeakPolarHBondContact O-CA 3.5Å; I544-I561 PolarHBondContact N-O 3.32Å; I544-I561 PolarHBondContact O-N 2.86Å
545	E	72.7	Confident	70.6	Confident	34 Å²	34	67 Å²	67	16%	0.159	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	124.2	166.8	-74	-172.8	128.1	0	0	109.1	R342 R521 F543 A560	R342-E545 IonicContact CZ-OE1 2.74Å; R342-E545 VanDerWaalsContact CZ-OE1 3.3Å; R342-E545 IonicContact CZ-OE2 3.02Å; R342-E545 IonicContact NH1-OE1 3.43Å; R342-E545 PolarHBondContact NH1-OE1 3.04Å; R342-E545 IonicContact NH1-OE2 3.3Å; R342-E545 VanDerWaalsContact NH2-CD 3.25Å; R342-E545 IonicContact NH2-OE1 3.52Å; R342-E545 PolarHBondContact NH2-OE1 2.92Å; R342-E545 IonicContact NH2-OE2 3.87Å; R342-E545 PolarHBondContact NH2-OE2 3.22Å; R521-E545 PolarHBondContact N-OE2 2.99Å; F543-E545 HydrophobicContact CD1-CG 4.46Å; F543-E545 HydrophobicContact CE1-CG 3.5Å; F543-E545 VanDerWaalsContact CE1-CG 3.5Å; F543-E545 HydrophobicContact CZ-CG 3.6Å; E545-A560 HydrophobicContact CG-CB 4.17Å
546	V	61.9	Low	69.3	Low	24 Å²	24	68.3 Å²	68.3	15%	0.145	35%	0.345	C	S	.	.			trans	-90	116.9	-178.1	-172.3	0	0	0	0	108.7	S548 Q551 H552 I561	V546-S548 VanDerWaalsContact CG1-O 3.3Å; V546-S548 WeakPolarHBondContact CG1-O 3.47Å; V546-Q551 HydrophobicContact CG1-CB 4.22Å; V546-H552 VanDerWaalsContact CG1-CE1 3.47Å; V546-H552 WeakPolarHBondContact CG1-CE1 3.44Å; V546-I561 HydrophobicContact CG2-CD1 3.79Å; V546-I561 HydrophobicContact CG2-CG1 4.05Å
547	I	56.7	Low	68	Low	147 Å²	147	72.5 Å²	72.5	75%	0.754	37%	0.371	S	S	*	.			trans	-99.5	-14.1	-175.2	-59	174.9	0	0	0	111.7
548	S	51.8	Low	66.8	Low	55 Å²	55	67.5 Å²	67.5	39%	0.385	35%	0.348	S	S	.	.	S	Bend	trans	-132.4	138.6	-175.4	46.6	0	0	0	0	112.3	V546 D550	V546-S548 VanDerWaalsContact CG1-O 3.3Å; V546-S548 WeakPolarHBondContact CG1-O 3.47Å; S548-D550 PolarHBondContact O-N 2.85Å; S548-D550 VanDerWaalsContact O-N 3.13Å
549	E	50.5	Low	65.8	Low	171 Å²	171	69.9 Å²	69.9	80%	0.799	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-61	-23.1	-177.2	-61.6	-178	148.6	0	0	113	Q551 H552	E549-Q551 VanDerWaalsContact C-N 3.29Å; E549-Q551 PolarHBondContact O-N 3.42Å; E549-H552 PolarHBondContact O-CD2 3.27Å
550	D	45	Very low	65.4	Low	158 Å²	158	69.8 Å²	69.8	85%	0.845	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-75.7	-1.1	-173.6	-57.7	-46.8	0	0	0	115.8	S548	S548-D550 PolarHBondContact O-N 2.85Å; S548-D550 VanDerWaalsContact O-N 3.13Å
551	Q	46.1	Very low	65.3	Low	135 Å²	135	66 Å²	66	63%	0.631	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-112.3	12.9	-175.4	-74.4	-167.4	-23	0	0	115.3	V546 E549 N553	V546-Q551 HydrophobicContact CG1-CB 4.22Å; E549-Q551 VanDerWaalsContact C-N 3.29Å; E549-Q551 PolarHBondContact O-N 3.42Å; Q551-N553 PolarHBondContact O-N 3.32Å
552	H	51.9	Low	65.2	Low	54 Å²	54	65.3 Å²	65.3	25%	0.25	35%	0.346	C	S	.	.			trans	-87.6	111.8	-176.3	-64.2	-56	0	0	0	113.6	V546 E549 F554	V546-H552 VanDerWaalsContact CG1-CE1 3.47Å; V546-H552 WeakPolarHBondContact CG1-CE1 3.44Å; E549-H552 PolarHBondContact O-CD2 3.27Å; H552-F554 WeakPolarHBondContact CB-O 3.47Å; H552-F554 PolarHBondContact O-N 3.15Å; H552-F554 VanDerWaalsContact O-N 3.13Å
553	N	54.1	Low	65.2	Low	103 Å²	103	65.5 Å²	65.5	55%	0.551	34%	0.344	S	S	*	.	S	Bend	trans	-66.4	1.4	160.1	-72.1	-26.9	0	0	0	113.3	Q551 E579 L602	Q551-N553 PolarHBondContact O-N 3.32Å; N553-E579 PolarHBondContact ND2-OE2 3.43Å; N553-L602 HydrophobicContact CB-CD1 3.76Å; N553-L602 WeakPolarHBondContact O-CD1 3.26Å
554	F	52.6	Low	65	Low	13 Å²	13	66.4 Å²	66.4	6%	0.057	35%	0.351	C	S	.	.	S	Bend	trans	-125.1	136.4	-171.8	-66	-101.2	0	0	0	110.2	H552 L556 I558 I561 E579 R600 L602	H552-F554 WeakPolarHBondContact CB-O 3.47Å; H552-F554 PolarHBondContact O-N 3.15Å; H552-F554 VanDerWaalsContact O-N 3.13Å; F554-L556 PolarHBondContact O-N 2.91Å; F554-I558 HydrophobicContact CB-CD1 3.35Å; F554-I558 HydrophobicContact CD1-CD1 3.57Å; F554-I558 HydrophobicContact CD2-CD1 3.53Å; F554-I558 HydrophobicContact CE1-CD1 4.15Å; F554-I558 HydrophobicContact CE2-CD1 4.13Å; F554-I558 HydrophobicContact CG-CD1 3.22Å; F554-I558 HydrophobicContact CZ-CD1 4.4Å; F554-I561 HydrophobicContact CD2-CD1 4.39Å; F554-I561 HydrophobicContact CE2-CD1 4.2Å; F554-I561 HydrophobicContact CE2-CG1 4.45Å; F554-E579 HydrophobicContact CE2-CB 4.3Å; F554-E579 HydrophobicContact CZ-CB 4.2Å; F554-R600 WeakPolarHBondContact CE1-O 3.47Å; F554-L602 HydrophobicContact CD1-CD1 3.95Å; F554-L602 HydrophobicContact CD2-CD1 3.88Å; F554-L602 HydrophobicContact CE1-CB 4.05Å; F554-L602 HydrophobicContact CE1-CD1 3.78Å; F554-L602 HydrophobicContact CE2-CD1 3.68Å; F554-L602 HydrophobicContact CG-CD1 4.01Å; F554-L602 HydrophobicContact CZ-CB 3.83Å; F554-L602 HydrophobicContact CZ-CD1 3.64Å; F554-L602 HydrophobicContact CZ-CG 4.35Å
555	D	56.4	Low	64.7	Low	151 Å²	151	70 Å²	70	81%	0.807	37%	0.365	S	S	*	.	S	Bend	trans	-68.9	19.3	178.6	-44.3	-57	0	0	0	115.1
556	L	62.9	Low	64.1	Low	31 Å²	31	74.8 Å²	74.8	16%	0.162	39%	0.387	C	S	.	.	S	Bend	trans	-142.1	146.4	-168.7	-61	176.3	0	0	0	111.3	F554 I558 F607 Y657	F554-L556 PolarHBondContact O-N 2.91Å; L556-I558 PolarHBondContact O-N 3.42Å; L556-F607 HydrophobicContact CD1-CE1 4Å; L556-F607 HydrophobicContact CD1-CZ 3.86Å; L556-Y657 HydrophobicContact CB-CD2 4.43Å; L556-Y657 HydrophobicContact CB-CE2 4.2Å; L556-Y657 HydrophobicContact CD1-CD2 3.93Å; L556-Y657 HydrophobicContact CD1-CE2 4.44Å; L556-Y657 HydrophobicContact CD2-CD1 4.09Å; L556-Y657 HydrophobicContact CD2-CD2 3.65Å; L556-Y657 HydrophobicContact CD2-CE2 4.11Å; L556-Y657 HydrophobicContact CD2-CG 3.62Å; L556-Y657 HydrophobicContact CG-CD2 4.23Å; L556-Y657 HydrophobicContact CG-CE2 4.5Å
557	V	63	Low	63.7	Low	96 Å²	96	81.1 Å²	81.1	58%	0.582	42%	0.42	S	S	*	.			trans	-65.7	118	171.1	-174	0	0	0	0	109.4
558	I	63.2	Low	63.4	Low	5 Å²	5	80.5 Å²	80.5	3%	0.026	41%	0.414	C	S	.	.			trans	-119.6	135	-177.9	-76.2	163.7	0	0	0	108.8	F554 L556 A560 I561	F554-I558 HydrophobicContact CB-CD1 3.35Å; F554-I558 HydrophobicContact CD1-CD1 3.57Å; F554-I558 HydrophobicContact CD2-CD1 3.53Å; F554-I558 HydrophobicContact CE1-CD1 4.15Å; F554-I558 HydrophobicContact CE2-CD1 4.13Å; F554-I558 HydrophobicContact CG-CD1 3.22Å; F554-I558 HydrophobicContact CZ-CD1 4.4Å; L556-I558 PolarHBondContact O-N 3.42Å; I558-A560 WeakPolarHBondContact CG2-O 3.41Å; I558-I561 HydrophobicContact CG2-CG1 3.94Å
559	S	67.6	Low	63.1	Low	72 Å²	72	85 Å²	85	50%	0.503	42%	0.423	S	S	.	.	S	Bend	trans	-76.9	-35.6	-177.4	-57.9	0	0	0	0	113	I582	S559-I582 PolarHBondContact N-O 3.02Å
560	A	80.9	Confident	62.6	Low	2 Å²	2	79.5 Å²	79.5	2%	0.017	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	152.4	177.5	0	0	0	0	0	110.5	F543 I544 E545 I558 I582	F543-A560 HydrophobicContact CD2-CB 4.33Å; F543-A560 HydrophobicContact CE2-CB 3.4Å; F543-A560 HydrophobicContact CZ-CB 3.67Å; I544-A560 CarbonylContact O-C 3.59Å; I544-A560 WeakPolarHBondContact O-CA 3.5Å; E545-A560 HydrophobicContact CG-CB 4.17Å; I558-A560 WeakPolarHBondContact CG2-O 3.41Å; A560-I582 HydrophobicContact CB-CD1 4.5Å; A560-I582 PolarHBondContact O-N 3.25Å
561	I	85.2	Confident	62.4	Low	10 Å²	10	80.1 Å²	80.1	5%	0.051	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	141.7	176.7	-61.3	173.5	0	0	0	108.7	I544 V546 F554 I558 E579	I544-I561 PolarHBondContact N-O 3.32Å; I544-I561 PolarHBondContact O-N 2.86Å; V546-I561 HydrophobicContact CG2-CD1 3.79Å; V546-I561 HydrophobicContact CG2-CG1 4.05Å; F554-I561 HydrophobicContact CD2-CD1 4.39Å; F554-I561 HydrophobicContact CE2-CD1 4.2Å; F554-I561 HydrophobicContact CE2-CG1 4.45Å; I558-I561 HydrophobicContact CG2-CG1 3.94Å; I561-E579 HydrophobicContact CG2-CB 4.05Å
562	V	88.7	Confident	62.5	Low	0 Å²	0	80.4 Å²	80.4	0%	0	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	134.8	175.5	-150.3	0	0	0	0	109.5	A514 T515 F536 W541 E542 F543 I580 I582	A514-V562 HydrophobicContact CB-CG1 4.21Å; A514-V562 WeakPolarHBondContact O-CG1 3.31Å; T515-V562 HydrophobicContact CG2-CB 4.47Å; T515-V562 HydrophobicContact CG2-CG2 3.98Å; F536-V562 HydrophobicContact CE2-CG1 3.54Å; F536-V562 HydrophobicContact CZ-CG1 3.95Å; W541-V562 HydrophobicContact CB-CG1 4.41Å; W541-V562 HydrophobicContact CE3-CB 4.43Å; W541-V562 HydrophobicContact CE3-CG1 3.94Å; E542-V562 WeakPolarHBondContact O-CA 3.13Å; E542-V562 WeakPolarHBondContact O-CG1 3.15Å; F543-V562 HydrophobicContact CD2-CG2 4.46Å; V562-I580 PolarHBondContact N-O 3.4Å; V562-I580 PolarHBondContact O-N 3.27Å; V562-I582 HydrophobicContact CG2-CD1 3.92Å; V562-I582 HydrophobicContact CG2-CG1 4.23Å
563	R	87.2	Confident	62.1	Low	59 Å²	59	85.2 Å²	85.2	22%	0.223	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	153.2	-178.8	65.8	-175.8	-168.2	139.8	13.2	112.5	W541 E542 E566 E579	W541-R563 WeakPolarHBondContact CB-O 3.36Å; E542-R563 HydrophobicContact CB-CG 4.2Å; E542-R563 PolarHBondContact N-O 3.06Å; E542-R563 PolarHBondContact O-N 3.36Å; E542-R563 VanDerWaalsContact O-N 3.11Å; E542-R563 IonicContact OE2-CZ 2.81Å; E542-R563 VanDerWaalsContact OE2-CZ 3.26Å; E542-R563 IonicContact OE2-NE 2.9Å; E542-R563 PolarHBondContact OE2-NE 3.04Å; E542-R563 IonicContact OE2-NH2 3.84Å; E542-R563 PolarHBondContact OE2-NH2 2.9Å; R563-E566 IonicContact CZ-OE1 3.73Å; R563-E566 VanDerWaalsContact CZ-OE1 3.28Å; R563-E566 IonicContact NH1-OE1 2.69Å; R563-E566 PolarHBondContact NH1-OE1 3.09Å; R563-E566 IonicContact NH2-OE1 2.77Å; R563-E566 PolarHBondContact NH2-OE1 3.28Å; R563-E579 HydrophobicContact CB-CG 4.3Å
564	P	84.2	Confident	61.5	Low	26 Å²	26	89.8 Å²	89.8	17%	0.169	46%	0.459	C	S	.	.			trans	-61.4	158.6	167.4	-18.4	31.8	0	0	0	111.4	Y506 W541 Y578	Y506-P564 HydrophobicContact CE1-CB 4.44Å; Y506-P564 HydrophobicContact CE1-CG 3.94Å; W541-P564 HydrophobicContact CD2-CG 4.36Å; W541-P564 HydrophobicContact CH2-CG 4.47Å; W541-P564 HydrophobicContact CZ2-CG 4.24Å; P564-Y578 WeakPolarHBondContact CD-O 3.42Å; P564-Y578 HydrophobicContact CG-CD1 4.31Å
565	K	75.9	Confident	61.3	Low	124 Å²	124	97 Å²	97	54%	0.539	49%	0.49	S	S	.	.			trans	-77.4	147.3	171	-72.9	-176.6	178.7	-174.8	0	111	K540 D567	K540-K565 WeakPolarHBondContact O-CD 3.48Å; K540-K565 WeakPolarHBondContact O-CE 3.39Å; K540-K565 WeakPolarHBondContact O-CG 3.48Å; K565-D567 VanDerWaalsContact C-N 3.26Å; K565-D567 PolarHBondContact O-N 3.31Å
566	E	60.7	Low	61.1	Low	134 Å²	134	94.6 Å²	94.6	63%	0.626	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-69.3	-18.2	-168.4	-67.5	168.8	-171	0	0	113.9	R563 E568	R563-E566 IonicContact CZ-OE1 3.73Å; R563-E566 VanDerWaalsContact CZ-OE1 3.28Å; R563-E566 IonicContact NH1-OE1 2.69Å; R563-E566 PolarHBondContact NH1-OE1 3.09Å; R563-E566 IonicContact NH2-OE1 2.77Å; R563-E566 PolarHBondContact NH2-OE1 3.28Å; E566-E568 PolarHBondContact O-N 3.24Å
567	D	52.9	Low	61.1	Low	158 Å²	158	96.6 Å²	96.6	85%	0.845	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-76	-6.5	-172.6	-63.6	-42	0	0	0	116.4	K565	K565-D567 VanDerWaalsContact C-N 3.26Å; K565-D567 PolarHBondContact O-N 3.31Å
568	E	49.7	Very low	61.8	Low	134 Å²	134	95.8 Å²	95.8	63%	0.626	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-101.8	11	-177.9	-73.2	-173.6	159.1	0	0	114.5	E566 G570	E566-E568 PolarHBondContact O-N 3.24Å; E568-G570 PolarHBondContact O-N 2.9Å
569	Y	46.2	Very low	62.9	Low	149 Å²	149	96.4 Å²	96.4	58%	0.584	48%	0.481	S	S	*	.			trans	-76.8	87.6	179.4	-112.5	-85.3	0	0	0	113.6	F573	Y569-F573 WeakPolarHBondContact CE1-O 3.41Å
570	G	41	Very low	63.8	Low	56 Å²	56	93 Å²	93	58%	0.577	46%	0.457	S	S	*	.			trans	-86.4	99.8	166	0	0	0	0	0	113	E568 I572	E568-G570 PolarHBondContact O-N 2.9Å; G570-I572 VanDerWaalsContact C-N 3.27Å; G570-I572 PolarHBondContact O-N 3.27Å
571	D	40.4	Very low	64.2	Low	171 Å²	171	92.9 Å²	92.9	91%	0.914	46%	0.456	S	S	*	.	S	Bend	trans	43.6	2.4	152	-76.4	-9	0	0	0	122.8
572	I	48	Very low	64.3	Low	141 Å²	141	92.4 Å²	92.4	72%	0.723	45%	0.454	S	S	*	.	S	Bend	trans	-104.8	-19.1	-168.7	-61.7	179.7	0	0	0	115	G570	G570-I572 VanDerWaalsContact C-N 3.27Å; G570-I572 PolarHBondContact O-N 3.27Å
573	F	43.1	Very low	64.2	Low	155 Å²	155	92.6 Å²	92.6	68%	0.68	46%	0.455	S	S	*	.			trans	-138.8	109	175.5	-83.1	-80.1	0	0	0	114.8	Y569 K575	Y569-F573 WeakPolarHBondContact CE1-O 3.41Å; F573-K575 PolarHBondContact O-N 3.22Å; F573-K575 VanDerWaalsContact O-N 3.13Å
574	E	42.2	Very low	64.1	Low	198 Å²	198	93 Å²	93	93%	0.925	46%	0.457	S	S	*	.			trans	-79.7	20.3	179.1	-153.5	-179.9	-150.1	0	0	113.8
575	K	48.5	Very low	64.2	Low	164 Å²	164	94.7 Å²	94.7	71%	0.713	46%	0.462	S	S	*	.	S	Bend	trans	-146.3	121.5	-166.6	-73.7	-178.2	179.9	165.9	0	115.4	F573	F573-K575 PolarHBondContact O-N 3.22Å; F573-K575 VanDerWaalsContact O-N 3.13Å
576	I	52	Low	64.7	Low	102 Å²	102	89.8 Å²	89.8	52%	0.523	44%	0.441	S	S	.	.			trans	76.4	126.1	162.2	-55.4	167.7	0	0	0	114.8	Y578 L602 N603	I576-Y578 PolarHBondContact O-N 2.95Å; I576-L602 HydrophobicContact CG2-CD2 4.32Å; I576-N603 VanDerWaalsContact CG2-ND2 3.29Å; I576-N603 WeakPolarHBondContact CG2-ND2 3.41Å
577	P	62.9	Low	65.6	Low	72 Å²	72	85.5 Å²	85.5	47%	0.468	43%	0.425	S	S	.	.			trans	-67.8	130.6	173	29.2	-33.8	0	0	0	110.7	E579 L602	P577-E579 HydrophobicContact CB-CG 4.2Å; P577-E579 PolarHBondContact O-N 2.85Å; P577-L602 HydrophobicContact CG-CD2 3.88Å; P577-L602 WeakPolarHBondContact O-CD2 3.4Å
578	Y	77.6	Confident	66.9	Low	79 Å²	79	82.1 Å²	82.1	31%	0.31	40%	0.403	S	S	.	.			trans	-86.6	90.6	-178.9	-170.9	-94.6	0	0	0	110.2	E511 W541 P564 I576 I580 T601	E511-Y578 PolarHBondContact OE1-OH 3.47Å; W541-Y578 HydrophobicContact CH2-CD1 4.36Å; W541-Y578 AromaticContact CH2-CE1 3.91Å; W541-Y578 HydrophobicContact CH2-CE1 3.91Å; P564-Y578 WeakPolarHBondContact CD-O 3.42Å; P564-Y578 HydrophobicContact CG-CD1 4.31Å; I576-Y578 PolarHBondContact O-N 2.95Å; Y578-I580 HydrophobicContact CE1-CD1 4.11Å; Y578-I580 HydrophobicContact CE1-CG1 4.37Å; Y578-T601 HydrophobicContact CD2-CG2 4.49Å; Y578-T601 HydrophobicContact CE2-CG2 3.93Å
579	E	84.9	Confident	68	Low	19 Å²	19	76.9 Å²	76.9	9%	0.089	38%	0.381	C	S	.	.			trans	-116	140.8	-176.7	-57.7	-176.3	149.4	0	0	111	N553 F554 I561 R563 P577 L602	N553-E579 PolarHBondContact ND2-OE2 3.43Å; F554-E579 HydrophobicContact CE2-CB 4.3Å; F554-E579 HydrophobicContact CZ-CB 4.2Å; I561-E579 HydrophobicContact CG2-CB 4.05Å; R563-E579 HydrophobicContact CB-CG 4.3Å; P577-E579 HydrophobicContact CB-CG 4.2Å; P577-E579 PolarHBondContact O-N 2.85Å; E579-L602 HydrophobicContact CB-CB 4.26Å; E579-L602 PolarHBondContact O-N 2.93Å
580	I	88.3	Confident	68.9	Low	0 Å²	0	73.6 Å²	73.6	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	118.7	175.9	-53.7	175.7	0	0	0	109.7	E511 T515 W541 V562 Y578 T599 T601	E511-I580 HydrophobicContact CB-CD1 4.15Å; E511-I580 HydrophobicContact CG-CD1 3.78Å; T515-I580 HydrophobicContact CG2-CB 4.2Å; T515-I580 HydrophobicContact CG2-CD1 4.39Å; T515-I580 HydrophobicContact CG2-CG2 3.8Å; W541-I580 HydrophobicContact CH2-CD1 4.21Å; W541-I580 HydrophobicContact CZ3-CD1 4.03Å; V562-I580 PolarHBondContact N-O 3.4Å; V562-I580 PolarHBondContact O-N 3.27Å; Y578-I580 HydrophobicContact CE1-CD1 4.11Å; Y578-I580 HydrophobicContact CE1-CG1 4.37Å; I580-T599 HydrophobicContact CG2-CG2 4.22Å; I580-T601 HydrophobicContact CG1-CG2 4.28Å
581	G	88.2	Confident	70.1	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	127.1	175.7	0	0	0	0	0	112.4	V583 T599 R600	G581-V583 PolarHBondContact O-N 3.46Å; G581-T599 CarbonylContact O-C 3.44Å; G581-T599 WeakPolarHBondContact O-CA 3.48Å; G581-T599 WeakPolarHBondContact O-CB 3.44Å; G581-R600 PolarHBondContact N-O 3.14Å; G581-R600 PolarHBondContact O-N 3.34Å
582	I	87.9	Confident	72	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	111.5	170.4	-63.3	174.2	0	0	0	109.1	F543 S559 A560 V562 Q585 V597 T599	F543-I582 HydrophobicContact CE2-CD1 4.48Å; S559-I582 PolarHBondContact N-O 3.02Å; A560-I582 HydrophobicContact CB-CD1 4.5Å; A560-I582 PolarHBondContact O-N 3.25Å; V562-I582 HydrophobicContact CG2-CD1 3.92Å; V562-I582 HydrophobicContact CG2-CG1 4.23Å; I582-Q585 HydrophobicContact CG2-CG 3.83Å; I582-V597 HydrophobicContact CB-CG1 4.49Å; I582-V597 HydrophobicContact CG1-CG1 4.37Å; I582-V597 HydrophobicContact CG2-CG1 3.59Å; I582-T599 HydrophobicContact CG1-CG2 4.36Å
583	V	86.2	Confident	73.6	Confident	4 Å²	4	63.2 Å²	63.2	2%	0.024	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-45.4	-173.7	-178.8	0	0	0	0	111.5	G581 I598 R600 F607 Y657 I660 M661	G581-V583 PolarHBondContact O-N 3.46Å; V583-I598 WeakPolarHBondContact CB-O 3.04Å; V583-I598 PolarHBondContact N-O 3.01Å; V583-R600 HydrophobicContact CG2-CB 4.15Å; V583-F607 HydrophobicContact CG1-CE1 4.46Å; V583-F607 HydrophobicContact CG2-CD1 4.23Å; V583-F607 HydrophobicContact CG2-CE1 4.12Å; V583-Y657 HydrophobicContact CG1-CD2 4.31Å; V583-Y657 HydrophobicContact CG1-CE2 3.96Å; V583-I660 HydrophobicContact CG1-CG2 4.33Å; V583-M661 HydrophobicContact CG1-CE 3.76Å
584	R	85.2	Confident	75.8	Confident	67 Å²	67	57 Å²	57	25%	0.253	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	131.6	-178	-169.3	175.9	-178.8	-151.7	-3.6	111.6	I598 I660 M661 I663	R584-I598 HydrophobicContact CB-CB 4.41Å; R584-I598 PolarHBondContact N-O 3.27Å; R584-I598 VanDerWaalsContact N-O 3.14Å; R584-I598 PolarHBondContact O-N 3.08Å; R584-I660 PolarHBondContact NH1-O 3.21Å; R584-M661 HydrophobicContact CB-SD 4.46Å; R584-M661 VanDerWaalsContact CZ-O 3.28Å; R584-M661 PolarHBondContact NH1-O 2.84Å; R584-I663 PolarHBondContact NH1-O 2.94Å
585	Q	85.6	Confident	78.2	Confident	62 Å²	62	47.7 Å²	47.7	29%	0.29	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	137.4	176.4	-58	-176.3	13.3	0	0	111.4	H517 S518 I582 V597	H517-Q585 PolarHBondContact O-NE2 2.86Å; H517-Q585 PolarHBondContact O-OE1 3.2Å; S518-Q585 PolarHBondContact OG-OE1 3.41Å; I582-Q585 HydrophobicContact CG2-CG 3.83Å; Q585-V597 HydrophobicContact CB-CG2 4.42Å; Q585-V597 HydrophobicContact CG-CG1 4.18Å; Q585-V597 HydrophobicContact CG-CG2 4.08Å
586	F	86.9	Confident	80.4	Confident	20 Å²	20	39.9 Å²	39.9	9%	0.088	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	97.3	162	-64.6	-87.5	0	0	0	107	M595 S596 I598 R665 V668	F586-M595 WeakPolarHBondContact O-CA 3.25Å; F586-M595 WeakPolarHBondContact O-CB 3.35Å; F586-S596 WeakPolarHBondContact CA-O 3.44Å; F586-S596 WeakPolarHBondContact CB-O 3.48Å; F586-S596 PolarHBondContact N-O 2.93Å; F586-S596 PolarHBondContact O-N 3.36Å; F586-I598 HydrophobicContact CE2-CD1 4Å; F586-I598 HydrophobicContact CE2-CG1 4.31Å; F586-R665 HydrophobicContact CD1-CB 3.93Å; F586-R665 HydrophobicContact CD1-CG 4.02Å; F586-R665 HydrophobicContact CE1-CB 3.95Å; F586-R665 HydrophobicContact CE1-CG 4.48Å; F586-R665 HydrophobicContact CG-CG 4.44Å; F586-V668 HydrophobicContact CD2-CG1 4.45Å; F586-V668 HydrophobicContact CE2-CB 4.31Å; F586-V668 HydrophobicContact CE2-CG1 4.17Å; F586-V668 HydrophobicContact CE2-CG2 3.86Å; F586-V668 HydrophobicContact CZ-CG2 4.05Å
587	P	79.5	Confident	82.3	Confident	45 Å²	45	35 Å²	35	29%	0.292	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62	158.4	-171.8	25.1	-34.7	0	0	0	111.9	S589 R665	P587-S589 PolarHBondContact O-N 2.9Å; P587-R665 PolarHBondContact O-NH1 3.1Å
588	F	81.4	Confident	83.7	Confident	86 Å²	86	31.7 Å²	31.7	38%	0.377	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.8	139.3	175	-174.5	-93.8	0	0	0	110.1	R329 R594 M595	R329-F588 VanDerWaalsContact CZ-O 3.3Å; R329-F588 PolarHBondContact NH1-O 3.29Å; R329-F588 PolarHBondContact NH2-O 3.29Å; F588-R594 WeakPolarHBondContact CA-O 3.34Å; F588-M595 HydrophobicContact CB-CB 4.03Å
589	S	72.1	Confident	84.4	Confident	24 Å²	24	27.9 Å²	27.9	17%	0.168	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	123.6	174.6	178.7	0	0	0	0	109.2	P587 S591 V592 Q593 R594	P587-S589 PolarHBondContact O-N 2.9Å; S589-S591 PolarHBondContact O-N 2.7Å; S589-S591 PolarHBondContact OG-OG 3.3Å; S589-S591 VanDerWaalsContact OG-OG 3.05Å; S589-V592 CarbonylContact O-C 3.55Å; S589-V592 PolarHBondContact O-N 3.15Å; S589-Q593 PolarHBondContact O-N 3.23Å; S589-R594 PolarHBondContact N-O 2.86Å
590	S	64.5	Low	84.6	Confident	81 Å²	81	29 Å²	29	57%	0.566	16%	0.157	S	C	*	.	G	3₁₀ helix	trans	-57	-36.4	-172.9	-45.2	0	0	0	0	112.7	V592 Q593	S590-V592 VanDerWaalsContact C-N 3.28Å; S590-V592 PolarHBondContact O-N 2.92Å; S590-Q593 VanDerWaalsContact O-CG 3.23Å; S590-Q593 WeakPolarHBondContact O-CG 3.43Å; S590-Q593 PolarHBondContact O-N 2.68Å
591	S	67.4	Low	84.6	Confident	88 Å²	88	29.3 Å²	29.3	62%	0.615	16%	0.159	S	C	*	.	G	3₁₀ helix	trans	-63.9	-23.9	177.4	52.5	0	0	0	0	115.3	S589	S589-S591 PolarHBondContact O-N 2.7Å; S589-S591 PolarHBondContact OG-OG 3.3Å; S589-S591 VanDerWaalsContact OG-OG 3.05Å
592	V	79.7	Confident	84.3	Confident	47 Å²	47	30.3 Å²	30.3	29%	0.285	16%	0.164	S	C	.	.	G	3₁₀ helix	trans	-120.5	4.4	178.8	-93.7	0	0	0	0	112.7	S589 S590 R594	S589-V592 CarbonylContact O-C 3.55Å; S589-V592 PolarHBondContact O-N 3.15Å; S590-V592 VanDerWaalsContact C-N 3.28Å; S590-V592 PolarHBondContact O-N 2.92Å; V592-R594 WeakPolarHBondContact O-CG 3.44Å; V592-R594 PolarHBondContact O-N 3.48Å; V592-R594 PolarHBondContact O-NH1 2.87Å
593	Q	81	Confident	83.8	Confident	15 Å²	15	36 Å²	36	7%	0.07	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.9	25.7	170.9	-58.1	-173.2	-18.6	0	0	116.6	S589 S590 G613 A614 D1292	S589-Q593 PolarHBondContact O-N 3.23Å; S590-Q593 VanDerWaalsContact O-CG 3.23Å; S590-Q593 WeakPolarHBondContact O-CG 3.43Å; S590-Q593 PolarHBondContact O-N 2.68Å; Q593-G613 CarbonylContact O-C 3.57Å; Q593-G613 VanDerWaalsContact O-CA 3.29Å; Q593-G613 WeakPolarHBondContact O-CA 3.28Å; Q593-A614 HydrophobicContact CB-CB 3.9Å; Q593-A614 PolarHBondContact O-N 3.05Å; Q593-D1292 VanDerWaalsContact NE2-CG 3.35Å; Q593-D1292 PolarHBondContact NE2-OD2 3.23Å
594	R	90.6	Very high	83.6	Confident	23 Å²	23	38.3 Å²	38.3	9%	0.087	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	164.9	-177.1	72.2	-159.9	175.4	-114.9	7.1	113.9	F588 S589 V592 K612 T617 I618 R665 E669	F588-R594 WeakPolarHBondContact CA-O 3.34Å; S589-R594 PolarHBondContact N-O 2.86Å; V592-R594 WeakPolarHBondContact O-CG 3.44Å; V592-R594 PolarHBondContact O-N 3.48Å; V592-R594 PolarHBondContact O-NH1 2.87Å; R594-K612 CarbonylContact C-O 3.6Å; R594-K612 WeakPolarHBondContact CA-O 3.5Å; R594-K612 WeakPolarHBondContact CB-O 3.33Å; R594-T617 VanDerWaalsContact NH1-CG2 3.35Å; R594-I618 HydrophobicContact CB-CD1 4.24Å; R594-R665 PolarHBondContact O-NH2 2.88Å; R594-E669 IonicContact CZ-OE2 2.93Å; R594-E669 VanDerWaalsContact NE-CD 3.29Å; R594-E669 IonicContact NE-OE1 3.24Å; R594-E669 IonicContact NE-OE2 2.97Å; R594-E669 PolarHBondContact NE-OE2 3.29Å; R594-E669 IonicContact NH2-OE2 2.65Å; R594-E669 PolarHBondContact NH2-OE2 3.03Å
595	M	92.1	Very high	83.3	Confident	3 Å²	3	39.7 Å²	39.7	2%	0.015	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	155.2	167.2	74.4	175.5	-74.9	0	0	111.4	F586 F588 V597 T611 K612	F586-M595 WeakPolarHBondContact O-CA 3.25Å; F586-M595 WeakPolarHBondContact O-CB 3.35Å; F588-M595 HydrophobicContact CB-CB 4.03Å; M595-V597 HydrophobicContact CE-CG2 3.91Å; M595-T611 WeakPolarHBondContact O-CA 3.41Å; M595-T611 WeakPolarHBondContact O-CG2 3.37Å; M595-K612 HydrophobicContact CG-CD 4.33Å; M595-K612 HydrophobicContact CG-CG 3.65Å; M595-K612 PolarHBondContact N-O 3.48Å; M595-K612 PolarHBondContact O-N 3.38Å; M595-K612 HydrophobicContact SD-CD 4.39Å; M595-K612 WeakPolarHBondContact SD-CE 3.43Å; M595-K612 HydrophobicContact SD-CG 4.33Å
596	S	94	Very high	83.4	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	145	179.5	-60.4	0	0	0	0	111	F586 Y610 T611 E669	F586-S596 WeakPolarHBondContact CA-O 3.44Å; F586-S596 WeakPolarHBondContact CB-O 3.48Å; F586-S596 PolarHBondContact N-O 2.93Å; F586-S596 PolarHBondContact O-N 3.36Å; S596-Y610 CarbonylContact C-O 3.51Å; S596-Y610 VanDerWaalsContact CA-O 3.32Å; S596-Y610 WeakPolarHBondContact CA-O 3.46Å; S596-T611 WeakPolarHBondContact OG-CG2 3.32Å; S596-T611 PolarHBondContact OG-OG1 3.3Å; S596-E669 VanDerWaalsContact OG-CG 3.25Å; S596-E669 WeakPolarHBondContact OG-CG 3.49Å; S596-E669 PolarHBondContact OG-OE1 3.19Å
597	V	92.9	Very high	83.6	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	133.9	178.4	-177.6	0	0	0	0	109	I582 Q585 M595 T599 I609 Y610	I582-V597 HydrophobicContact CB-CG1 4.49Å; I582-V597 HydrophobicContact CG1-CG1 4.37Å; I582-V597 HydrophobicContact CG2-CG1 3.59Å; Q585-V597 HydrophobicContact CB-CG2 4.42Å; Q585-V597 HydrophobicContact CG-CG1 4.18Å; Q585-V597 HydrophobicContact CG-CG2 4.08Å; M595-V597 HydrophobicContact CE-CG2 3.91Å; V597-T599 HydrophobicContact CG1-CG2 3.87Å; V597-I609 WeakPolarHBondContact O-CA 3.13Å; V597-Y610 PolarHBondContact N-O 2.81Å; V597-Y610 PolarHBondContact O-N 3.06Å
598	I	92.8	Very high	84.2	Confident	2 Å²	2	36.8 Å²	36.8	1%	0.01	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	128.9	170.9	-51.2	-177.8	0	0	0	107.7	V583 R584 F586 F607 I609 I660 I663 V668	V583-I598 WeakPolarHBondContact CB-O 3.04Å; V583-I598 PolarHBondContact N-O 3.01Å; R584-I598 HydrophobicContact CB-CB 4.41Å; R584-I598 PolarHBondContact N-O 3.27Å; R584-I598 VanDerWaalsContact N-O 3.14Å; R584-I598 PolarHBondContact O-N 3.08Å; F586-I598 HydrophobicContact CE2-CD1 4Å; F586-I598 HydrophobicContact CE2-CG1 4.31Å; I598-F607 HydrophobicContact CG2-CB 4.13Å; I598-F607 HydrophobicContact CG2-CD1 4.32Å; I598-I609 HydrophobicContact CG1-CG1 4.36Å; I598-I660 HydrophobicContact CD1-CG2 3.91Å; I598-I660 HydrophobicContact CG2-CD1 4.41Å; I598-I660 HydrophobicContact CG2-CG2 3.91Å; I598-I663 HydrophobicContact CD1-CG2 4.17Å; I598-V668 HydrophobicContact CD1-CG1 4.36Å; I598-V668 HydrophobicContact CD1-CG2 3.99Å; I598-V668 HydrophobicContact CG1-CG1 4.31Å
599	T	92.1	Very high	84.9	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	168.1	-175.4	64.4	0	0	0	0	111.2	T515 I580 G581 I582 V597 F607 H608 Y610	T515-T599 HydrophobicContact CG2-CG2 4.21Å; I580-T599 HydrophobicContact CG2-CG2 4.22Å; G581-T599 CarbonylContact O-C 3.44Å; G581-T599 WeakPolarHBondContact O-CA 3.48Å; G581-T599 WeakPolarHBondContact O-CB 3.44Å; I582-T599 HydrophobicContact CG1-CG2 4.36Å; V597-T599 HydrophobicContact CG1-CG2 3.87Å; T599-F607 CarbonylContact O-C 3.58Å; T599-F607 VanDerWaalsContact O-CA 3.3Å; T599-F607 WeakPolarHBondContact O-CA 3.32Å; T599-F607 WeakPolarHBondContact O-CB 3.2Å; T599-H608 PolarHBondContact N-O 3.43Å; T599-H608 PolarHBondContact O-N 3.03Å; T599-H608 PolarHBondContact OG1-O 3.41Å; T599-Y610 HydrophobicContact CG2-CD2 3.84Å; T599-Y610 HydrophobicContact CG2-CE2 3.97Å; T599-Y610 WeakPolarHBondContact OG1-CE2 3.4Å
600	R	89.2	Confident	86	Confident	42 Å²	42	31.6 Å²	31.6	16%	0.158	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	123.2	169.2	-174.8	178.7	179	-155.7	-6.3	109.1	F554 G581 V583 E604 F607	F554-R600 WeakPolarHBondContact CE1-O 3.47Å; G581-R600 PolarHBondContact N-O 3.14Å; G581-R600 PolarHBondContact O-N 3.34Å; V583-R600 HydrophobicContact CG2-CB 4.15Å; R600-E604 PolarHBondContact NE-O 3.21Å; R600-E604 PolarHBondContact NH2-O 3.43Å; R600-F607 HydrophobicContact CB-CD1 3.92Å; R600-F607 HydrophobicContact CB-CE1 4.1Å; R600-F607 HydrophobicContact CG-CD1 4.45Å; R600-F607 HydrophobicContact CG-CE1 4.44Å
601	T	87.2	Confident	87.5	Confident	7 Å²	7	27.7 Å²	27.7	4%	0.043	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	145.3	170.2	-34.9	0	0	0	0	109.7	Y578 I580 N603 E604 H608	Y578-T601 HydrophobicContact CD2-CG2 4.49Å; Y578-T601 HydrophobicContact CE2-CG2 3.93Å; I580-T601 HydrophobicContact CG1-CG2 4.28Å; T601-N603 PolarHBondContact O-N 2.92Å; T601-E604 WeakPolarHBondContact CB-OE2 3.45Å; T601-E604 PolarHBondContact O-N 3.38Å; T601-E604 VanDerWaalsContact O-N 3.16Å; T601-E604 PolarHBondContact OG1-OE2 3.39Å; T601-H608 PolarHBondContact OG1-CD2 3.39Å
602	L	81.4	Confident	88.8	Confident	21 Å²	21	23.9 Å²	23.9	11%	0.11	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	136.2	175	-166.1	70.9	0	0	0	110.2	N553 F554 I576 P577 E579 E604	N553-L602 HydrophobicContact CB-CD1 3.76Å; N553-L602 WeakPolarHBondContact O-CD1 3.26Å; F554-L602 HydrophobicContact CD1-CD1 3.95Å; F554-L602 HydrophobicContact CD2-CD1 3.88Å; F554-L602 HydrophobicContact CE1-CB 4.05Å; F554-L602 HydrophobicContact CE1-CD1 3.78Å; F554-L602 HydrophobicContact CE2-CD1 3.68Å; F554-L602 HydrophobicContact CG-CD1 4.01Å; F554-L602 HydrophobicContact CZ-CB 3.83Å; F554-L602 HydrophobicContact CZ-CD1 3.64Å; F554-L602 HydrophobicContact CZ-CG 4.35Å; I576-L602 HydrophobicContact CG2-CD2 4.32Å; P577-L602 HydrophobicContact CG-CD2 3.88Å; P577-L602 WeakPolarHBondContact O-CD2 3.4Å; E579-L602 HydrophobicContact CB-CB 4.26Å; E579-L602 PolarHBondContact O-N 2.93Å; L602-E604 PolarHBondContact O-N 3.34Å; L602-E604 VanDerWaalsContact O-N 3.11Å
603	N	77.7	Confident	89.3	Confident	118 Å²	118	21.7 Å²	21.7	63%	0.631	11%	0.114	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.5	2.3	-176.3	-57.8	-43.4	0	0	0	117.3	I576 T601	I576-N603 VanDerWaalsContact CG2-ND2 3.29Å; I576-N603 WeakPolarHBondContact CG2-ND2 3.41Å; T601-N603 PolarHBondContact O-N 2.92Å
604	E	81.3	Confident	89.6	Confident	54 Å²	54	22 Å²	22	25%	0.252	12%	0.119	S	C	.	.			trans	-81.9	145.9	168.2	-79.6	-162.6	95.1	0	0	112.9	R600 T601 L602 Q606 H608	R600-E604 PolarHBondContact NE-O 3.21Å; R600-E604 PolarHBondContact NH2-O 3.43Å; T601-E604 WeakPolarHBondContact CB-OE2 3.45Å; T601-E604 PolarHBondContact O-N 3.38Å; T601-E604 VanDerWaalsContact O-N 3.16Å; T601-E604 PolarHBondContact OG1-OE2 3.39Å; L602-E604 PolarHBondContact O-N 3.34Å; L602-E604 VanDerWaalsContact O-N 3.11Å; E604-Q606 WeakPolarHBondContact OE1-CG 3.42Å; E604-Q606 PolarHBondContact OE1-NE2 2.96Å; E604-H608 IonicContact OE1-CE1 3.83Å; E604-H608 IonicContact OE1-NE2 3.36Å; E604-H608 PolarHBondContact OE1-NE2 3.06Å; E604-H608 IonicContact OE2-CD2 2.72Å; E604-H608 IonicContact OE2-CE1 2.87Å; E604-H608 IonicContact OE2-NE2 3.81Å; E604-H608 PolarHBondContact OE2-NE2 3.27Å
605	S	79.1	Confident	89.5	Confident	96 Å²	96	21.2 Å²	21.2	67%	0.671	12%	0.117	S	C	*	.	S	Bend	trans	-91	-11.3	175	59.1	0	0	0	0	113.8
606	Q	88.1	Confident	89.1	Confident	50 Å²	50	23.2 Å²	23.2	23%	0.234	13%	0.126	C	C	.	.	S	Bend	trans	-106	157.2	179	63.4	-170.4	-4.5	0	0	110.6	E604 K654	E604-Q606 WeakPolarHBondContact OE1-CG 3.42Å; E604-Q606 PolarHBondContact OE1-NE2 2.96Å; Q606-K654 HydrophobicContact CB-CG 3.99Å
607	F	91	Very high	88.8	Confident	9 Å²	9	24.3 Å²	24.3	4%	0.039	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	146.8	174.5	-65.5	-100.9	0	0	0	109.1	L556 V583 I598 T599 R600 I653 A655 I660	L556-F607 HydrophobicContact CD1-CE1 4Å; L556-F607 HydrophobicContact CD1-CZ 3.86Å; V583-F607 HydrophobicContact CG1-CE1 4.46Å; V583-F607 HydrophobicContact CG2-CD1 4.23Å; V583-F607 HydrophobicContact CG2-CE1 4.12Å; I598-F607 HydrophobicContact CG2-CB 4.13Å; I598-F607 HydrophobicContact CG2-CD1 4.32Å; T599-F607 CarbonylContact O-C 3.58Å; T599-F607 VanDerWaalsContact O-CA 3.3Å; T599-F607 WeakPolarHBondContact O-CA 3.32Å; T599-F607 WeakPolarHBondContact O-CB 3.2Å; R600-F607 HydrophobicContact CB-CD1 3.92Å; R600-F607 HydrophobicContact CB-CE1 4.1Å; R600-F607 HydrophobicContact CG-CD1 4.45Å; R600-F607 HydrophobicContact CG-CE1 4.44Å; F607-I653 HydrophobicContact CB-CG2 3.95Å; F607-I653 PolarHBondContact N-O 2.92Å; F607-I653 PolarHBondContact O-N 2.84Å; F607-A655 WeakPolarHBondContact CE2-O 3.37Å; F607-I660 HydrophobicContact CB-CD1 3.69Å; F607-I660 HydrophobicContact CD1-CD1 3.55Å; F607-I660 HydrophobicContact CD2-CD1 3.2Å; F607-I660 HydrophobicContact CE1-CD1 3.88Å; F607-I660 HydrophobicContact CE2-CD1 3.58Å; F607-I660 HydrophobicContact CG-CD1 3.18Å; F607-I660 HydrophobicContact CZ-CD1 3.89Å
608	H	93.2	Very high	88.8	Confident	6 Å²	6	24.3 Å²	24.3	3%	0.028	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	129.8	177.9	-59.9	-62.7	0	0	0	110.4	T599 T601 E604 Y610 W650	T599-H608 PolarHBondContact N-O 3.43Å; T599-H608 PolarHBondContact O-N 3.03Å; T599-H608 PolarHBondContact OG1-O 3.41Å; T601-H608 PolarHBondContact OG1-CD2 3.39Å; E604-H608 IonicContact OE1-CE1 3.83Å; E604-H608 IonicContact OE1-NE2 3.36Å; E604-H608 PolarHBondContact OE1-NE2 3.06Å; E604-H608 IonicContact OE2-CD2 2.72Å; E604-H608 IonicContact OE2-CE1 2.87Å; E604-H608 IonicContact OE2-NE2 3.81Å; E604-H608 PolarHBondContact OE2-NE2 3.27Å; H608-Y610 HydrophobicContact CB-CE2 3.82Å; H608-W650 AromaticContact CE1-CZ3 3.85Å; H608-W650 AromaticContact ND1-CZ3 3.46Å; H608-W650 WeakPolarHBondContact ND1-CZ3 3.26Å
609	I	94.6	Very high	88.6	Confident	1 Å²	1	26.4 Å²	26.4	1%	0.005	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	120.7	173.1	-59.2	163.6	0	0	0	106.7	V597 I598 W650 R651 I653 V668 L672	V597-I609 WeakPolarHBondContact O-CA 3.13Å; I598-I609 HydrophobicContact CG1-CG1 4.36Å; I609-W650 CarbonylContact O-C 3.5Å; I609-W650 WeakPolarHBondContact O-CA 3.15Å; I609-W650 WeakPolarHBondContact O-CB 3.41Å; I609-R651 WeakPolarHBondContact CB-O 3.47Å; I609-R651 PolarHBondContact N-O 3.37Å; I609-R651 PolarHBondContact O-N 3.33Å; I609-I653 HydrophobicContact CD1-CB 4.18Å; I609-I653 HydrophobicContact CD1-CD1 4.35Å; I609-I653 HydrophobicContact CD1-CG2 3.88Å; I609-I653 HydrophobicContact CG1-CG2 4.07Å; I609-V668 HydrophobicContact CB-CG1 4.45Å; I609-V668 HydrophobicContact CD1-CG1 3.99Å; I609-V668 HydrophobicContact CG1-CG1 4.11Å; I609-V668 HydrophobicContact CG2-CG1 3.49Å; I609-V668 VanDerWaalsContact CG2-CG1 3.49Å; I609-L672 HydrophobicContact CG2-CD2 4.41Å
610	Y	96.1	Very high	88.5	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	135.1	169.4	-58.5	-72.9	0	0	0	109.4	P508 E511 C512 T515 C516 S596 V597 T599 H608 W650	P508-Y610 HydrophobicContact CB-CE1 4.45Å; E511-Y610 HydrophobicContact CB-CE1 3.93Å; E511-Y610 HydrophobicContact CB-CE2 4.38Å; E511-Y610 PolarHBondContact OE2-OH 3.39Å; C512-Y610 HydrophobicContact CB-CD1 3.69Å; C512-Y610 HydrophobicContact CB-CE1 4.43Å; C512-Y610 HydrophobicContact CB-CG 4.18Å; T515-Y610 WeakPolarHBondContact OG1-CD2 3.43Å; C516-Y610 PolarHBondContact SG-O 3.5Å; S596-Y610 CarbonylContact C-O 3.51Å; S596-Y610 VanDerWaalsContact CA-O 3.32Å; S596-Y610 WeakPolarHBondContact CA-O 3.46Å; V597-Y610 PolarHBondContact N-O 2.81Å; V597-Y610 PolarHBondContact O-N 3.06Å; T599-Y610 HydrophobicContact CG2-CD2 3.84Å; T599-Y610 HydrophobicContact CG2-CE2 3.97Å; T599-Y610 WeakPolarHBondContact OG1-CE2 3.4Å; H608-Y610 HydrophobicContact CB-CE2 3.82Å; Y610-W650 HydrophobicContact CD1-CB 3.67Å; Y610-W650 HydrophobicContact CE1-CB 4.04Å; Y610-W650 HydrophobicContact CE1-CE3 4.01Å
611	T	95.2	Very high	88.7	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	135	-177.6	-62.2	0	0	0	0	109.6	M595 S596 I618 A649 L672	M595-T611 WeakPolarHBondContact O-CA 3.41Å; M595-T611 WeakPolarHBondContact O-CG2 3.37Å; S596-T611 WeakPolarHBondContact OG-CG2 3.32Å; S596-T611 PolarHBondContact OG-OG1 3.3Å; T611-I618 HydrophobicContact CG2-CD1 3.56Å; T611-A649 PolarHBondContact N-O 2.89Å; T611-A649 PolarHBondContact O-N 3.21Å; T611-L672 HydrophobicContact CG2-CD1 4Å
612	K	94.7	Very high	88.9	Confident	8 Å²	8	31 Å²	31	4%	0.035	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	147	169.8	76.5	-178.6	-167.5	-149.3	0	111.5	C516 D532 M535 R594 M595 A647 L648	C516-K612 WeakPolarHBondContact O-CD 3.43Å; C516-K612 VanDerWaalsContact O-CE 3.3Å; C516-K612 WeakPolarHBondContact O-CE 3.35Å; C516-K612 PolarHBondContact O-NZ 3.04Å; D532-K612 WeakPolarHBondContact OD1-CE 3.38Å; D532-K612 IonicContact OD1-NZ 2.61Å; D532-K612 PolarHBondContact OD1-NZ 2.9Å; D532-K612 IonicContact OD2-NZ 3.83Å; D532-K612 PolarHBondContact OD2-NZ 3.47Å; M535-K612 HydrophobicContact CE-CD 4.28Å; M535-K612 VanDerWaalsContact CE-NZ 3.28Å; M535-K612 HydrophobicContact SD-CD 4.14Å; R594-K612 CarbonylContact C-O 3.6Å; R594-K612 WeakPolarHBondContact CA-O 3.5Å; R594-K612 WeakPolarHBondContact CB-O 3.33Å; M595-K612 HydrophobicContact CG-CD 4.33Å; M595-K612 HydrophobicContact CG-CG 3.65Å; M595-K612 PolarHBondContact N-O 3.48Å; M595-K612 PolarHBondContact O-N 3.38Å; M595-K612 HydrophobicContact SD-CD 4.39Å; M595-K612 WeakPolarHBondContact SD-CE 3.43Å; M595-K612 HydrophobicContact SD-CG 4.33Å; K612-A647 WeakPolarHBondContact CA-O 3.45Å; K612-L648 HydrophobicContact CB-CD2 3.49Å; K612-L648 VanDerWaalsContact CB-CD2 3.49Å
613	G	91.4	Very high	89.3	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.01	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.9	-169	-179.4	0	0	0	0	0	114.1	Q593 L646 A647	Q593-G613 CarbonylContact O-C 3.57Å; Q593-G613 VanDerWaalsContact O-CA 3.29Å; Q593-G613 WeakPolarHBondContact O-CA 3.28Å; G613-L646 WeakPolarHBondContact O-CA 3.23Å; G613-L646 WeakPolarHBondContact O-CD2 3.31Å; G613-A647 PolarHBondContact N-O 3.44Å; G613-A647 VanDerWaalsContact N-O 3.16Å; G613-A647 PolarHBondContact O-N 3.4Å
614	A	86.4	Confident	89.7	Confident	20 Å²	20	40.7 Å²	40.7	17%	0.165	20%	0.2	C	C	.	.			trans	-58.4	135	172.9	0	0	0	0	0	110.5	Q593 E616 T617 I618	Q593-A614 HydrophobicContact CB-CB 3.9Å; Q593-A614 PolarHBondContact O-N 3.05Å; A614-E616 PolarHBondContact O-N 2.96Å; A614-T617 WeakPolarHBondContact O-CB 3.33Å; A614-T617 PolarHBondContact O-N 3.18Å; A614-I618 PolarHBondContact O-N 3Å
615	P	88.9	Confident	90	Very high	7 Å²	7	43.2 Å²	43.2	5%	0.045	22%	0.216	C	C	.	.	H	α-helix	trans	-52.6	-47.3	-176.4	-31.7	39.3	0	0	0	114.1	T617 I618 E619 F631 L635 V645 A647	P615-T617 VanDerWaalsContact C-N 3.27Å; P615-T617 PolarHBondContact O-N 3.44Å; P615-I618 PolarHBondContact O-N 3.29Å; P615-E619 WeakPolarHBondContact O-CB 3.47Å; P615-E619 PolarHBondContact O-N 2.87Å; P615-F631 HydrophobicContact CB-CZ 3.93Å; P615-L635 HydrophobicContact CB-CD1 3.78Å; P615-L635 HydrophobicContact CB-CD2 3.63Å; P615-L635 HydrophobicContact CB-CG 4.35Å; P615-L635 HydrophobicContact CG-CD1 3.65Å; P615-L635 HydrophobicContact CG-CD2 4.39Å; P615-V645 WeakPolarHBondContact CD-O 3.41Å; P615-V645 HydrophobicContact CG-CB 4.24Å; P615-V645 HydrophobicContact CG-CG1 4Å; P615-A647 HydrophobicContact CB-CB 4.28Å; P615-A647 HydrophobicContact CG-CB 4.4Å
616	E	83.8	Confident	90.4	Very high	46 Å²	46	39.7 Å²	39.7	22%	0.215	19%	0.19	C	C	.	.	H	α-helix	trans	-55.9	-40.5	176.2	-9.9	-67.8	140.6	0	0	112.2	A614 V620 T1291	A614-E616 PolarHBondContact O-N 2.96Å; E616-V620 WeakPolarHBondContact O-CG2 3.5Å; E616-V620 PolarHBondContact O-N 2.83Å; E616-T1291 HydrophobicContact CB-CG2 3.88Å; E616-T1291 HydrophobicContact CG-CG2 3.8Å
617	T	88.3	Confident	90.3	Very high	22 Å²	22	38.8 Å²	38.8	14%	0.135	19%	0.187	C	C	.	.	H	α-helix	trans	-72.6	-40	-178.9	-46.8	0	0	0	0	111.6	R594 A614 P615 V620 L621	R594-T617 VanDerWaalsContact NH1-CG2 3.35Å; A614-T617 WeakPolarHBondContact O-CB 3.33Å; A614-T617 PolarHBondContact O-N 3.18Å; P615-T617 VanDerWaalsContact C-N 3.27Å; P615-T617 PolarHBondContact O-N 3.44Å; T617-V620 PolarHBondContact O-N 2.71Å; T617-L621 HydrophobicContact CG2-CD1 4.31Å; T617-L621 VanDerWaalsContact O-CG 3.28Å; T617-L621 WeakPolarHBondContact O-CG 3.37Å
618	I	91.5	Very high	90.1	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-70.4	-35.1	178.6	-59.4	-55.1	0	0	0	111.1	R594 T611 A614 P615 V620 L621 C622 A647 A649 F674	R594-I618 HydrophobicContact CB-CD1 4.24Å; T611-I618 HydrophobicContact CG2-CD1 3.56Å; A614-I618 PolarHBondContact O-N 3Å; P615-I618 PolarHBondContact O-N 3.29Å; I618-V620 VanDerWaalsContact C-N 3.31Å; I618-V620 PolarHBondContact O-N 2.86Å; I618-L621 PolarHBondContact O-N 2.82Å; I618-L621 VanDerWaalsContact O-N 3.16Å; I618-C622 WeakPolarHBondContact O-CB 3.49Å; I618-C622 PolarHBondContact O-N 3.3Å; I618-C622 PolarHBondContact O-SG 3.04Å; I618-A647 HydrophobicContact CB-CB 3.57Å; I618-A647 HydrophobicContact CG1-CB 3.77Å; I618-A647 HydrophobicContact CG2-CB 3.77Å; I618-A649 HydrophobicContact CG2-CB 3.69Å; I618-F674 HydrophobicContact CG2-CD2 4.4Å
619	E	90.4	Very high	89.7	Confident	46 Å²	46	45.1 Å²	45.1	22%	0.215	23%	0.227	C	C	.	.	H	α-helix	trans	-51.7	-48.3	172.6	-170.9	-163.5	155.2	0	0	111.3	P615 L621 C622 I627 F631 R1287	P615-E619 WeakPolarHBondContact O-CB 3.47Å; P615-E619 PolarHBondContact O-N 2.87Å; E619-L621 VanDerWaalsContact C-N 3.3Å; E619-L621 PolarHBondContact O-N 2.98Å; E619-C622 PolarHBondContact O-N 2.94Å; E619-I627 HydrophobicContact CG-CD1 3.93Å; E619-I627 VanDerWaalsContact O-CD1 3.29Å; E619-I627 WeakPolarHBondContact O-CD1 3.25Å; E619-F631 HydrophobicContact CB-CE1 3.92Å; E619-F631 HydrophobicContact CB-CZ 4.26Å; E619-F631 HydrophobicContact CG-CD1 4.32Å; E619-F631 HydrophobicContact CG-CE1 3.96Å; E619-R1287 IonicContact OE1-NH1 2.93Å; E619-R1287 IonicContact OE2-NH1 2.76Å
620	V	89.9	Confident	89.1	Confident	107 Å²	107	49.6 Å²	49.6	65%	0.648	25%	0.251	S	S	*	.	H	α-helix	trans	-66.7	-28.6	-178.2	175	0	0	0	0	113.1	E616 T617 I618	E616-V620 WeakPolarHBondContact O-CG2 3.5Å; E616-V620 PolarHBondContact O-N 2.83Å; T617-V620 PolarHBondContact O-N 2.71Å; I618-V620 VanDerWaalsContact C-N 3.31Å; I618-V620 PolarHBondContact O-N 2.86Å
621	L	92	Very high	88.6	Confident	30 Å²	30	49.9 Å²	49.9	16%	0.157	25%	0.252	C	S	.	.	H	α-helix	trans	-93.9	-16.9	-176.2	-54.9	171.5	0	0	0	113	T617 I618 E619 E669 N671 L672	T617-L621 HydrophobicContact CG2-CD1 4.31Å; T617-L621 VanDerWaalsContact O-CG 3.28Å; T617-L621 WeakPolarHBondContact O-CG 3.37Å; I618-L621 PolarHBondContact O-N 2.82Å; I618-L621 VanDerWaalsContact O-N 3.16Å; E619-L621 VanDerWaalsContact C-N 3.3Å; E619-L621 PolarHBondContact O-N 2.98Å; L621-E669 HydrophobicContact CD1-CB 4.39Å; L621-E669 WeakPolarHBondContact CD2-O 3.14Å; L621-N671 PolarHBondContact O-N 3.14Å; L621-N671 VanDerWaalsContact O-N 3.16Å; L621-L672 HydrophobicContact CB-CD1 4.22Å; L621-L672 PolarHBondContact O-N 3.48Å
622	C	92.3	Very high	88.1	Confident	9 Å²	9	52.8 Å²	52.8	6%	0.061	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-81.7	154.1	176.1	-69.5	0	0	0	0	112	I618 E619 R624 I627 A649 L672 F674	I618-C622 WeakPolarHBondContact O-CB 3.49Å; I618-C622 PolarHBondContact O-N 3.3Å; I618-C622 PolarHBondContact O-SG 3.04Å; E619-C622 PolarHBondContact O-N 2.94Å; C622-R624 PolarHBondContact O-N 3.44Å; C622-I627 HydrophobicContact CB-CD1 3.99Å; C622-I627 HydrophobicContact CB-CG1 4.08Å; C622-A649 VanDerWaalsContact SG-CB 3.54Å; C622-L672 CarbonylContact C-O 3.58Å; C622-L672 VanDerWaalsContact CA-O 3.24Å; C622-L672 WeakPolarHBondContact CA-O 3.43Å; C622-F674 HydrophobicContact CB-CB 4.25Å
623	R	90.5	Very high	87.6	Confident	111 Å²	111	55.2 Å²	55.2	42%	0.419	28%	0.284	S	S	.	.			trans	-70.1	130.8	169.4	-59.4	170.3	43.5	160.4	-2.5	109.4	D625 T626 N671 L672	R623-D625 WeakPolarHBondContact CB-OD1 3.27Å; R623-D625 IonicContact CZ-OD1 2.71Å; R623-D625 IonicContact CZ-OD2 2.8Å; R623-D625 IonicContact NE-OD1 3.15Å; R623-D625 PolarHBondContact NE-OD1 3.37Å; R623-D625 IonicContact NE-OD2 2.99Å; R623-D625 IonicContact NH2-OD1 3.95Å; R623-D625 PolarHBondContact NH2-OD1 3.1Å; R623-D625 IonicContact NH2-OD2 3.32Å; R623-D625 PolarHBondContact NH2-OD2 3.37Å; R623-D625 PolarHBondContact O-N 3.48Å; R623-D625 VanDerWaalsContact O-N 3.11Å; R623-T626 PolarHBondContact O-N 3.02Å; R623-T626 PolarHBondContact O-OG1 2.78Å; R623-N671 HydrophobicContact CG-CB 4.01Å; R623-L672 PolarHBondContact N-O 3.35Å
624	R	85.6	Confident	87.2	Confident	231 Å²	231	57.1 Å²	57.1	87%	0.872	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-56.5	-28.7	-176.1	-68.2	-176.3	177.2	177.7	-1	114.4	C622 T626 I627	C622-R624 PolarHBondContact O-N 3.44Å; R624-T626 PolarHBondContact O-N 2.96Å; R624-I627 PolarHBondContact O-N 3.48Å
625	D	86.2	Confident	87.1	Confident	107 Å²	107	56.4 Å²	56.4	57%	0.572	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-72.6	-14	177.7	60.4	-47.6	0	0	0	114	R623	R623-D625 WeakPolarHBondContact CB-OD1 3.27Å; R623-D625 IonicContact CZ-OD1 2.71Å; R623-D625 IonicContact CZ-OD2 2.8Å; R623-D625 IonicContact NE-OD1 3.15Å; R623-D625 PolarHBondContact NE-OD1 3.37Å; R623-D625 IonicContact NE-OD2 2.99Å; R623-D625 IonicContact NH2-OD1 3.95Å; R623-D625 PolarHBondContact NH2-OD1 3.1Å; R623-D625 IonicContact NH2-OD2 3.32Å; R623-D625 PolarHBondContact NH2-OD2 3.37Å; R623-D625 PolarHBondContact O-N 3.48Å; R623-D625 VanDerWaalsContact O-N 3.11Å
626	T	87.7	Confident	86.6	Confident	22 Å²	22	57.1 Å²	57.1	14%	0.135	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-94.9	-9.9	173.9	63.8	0	0	0	0	113.9	N489 R623 R624 L673 F674	N489-T626 PolarHBondContact ND2-O 3.02Å; R623-T626 PolarHBondContact O-N 3.02Å; R623-T626 PolarHBondContact O-OG1 2.78Å; R624-T626 PolarHBondContact O-N 2.96Å; T626-L673 HydrophobicContact CG2-CB 4.26Å; T626-L673 HydrophobicContact CG2-CD2 3.59Å; T626-F674 PolarHBondContact OG1-N 3.24Å; T626-F674 VanDerWaalsContact OG1-N 3.1Å
627	I	87.4	Confident	86.6	Confident	32 Å²	32	60.6 Å²	60.6	16%	0.164	31%	0.306	C	S	.	.	S	Bend	trans	-91.4	123.6	-173.7	-56.4	174.1	0	0	0	109.1	E619 C622 R624 F631 F674	E619-I627 HydrophobicContact CG-CD1 3.93Å; E619-I627 VanDerWaalsContact O-CD1 3.29Å; E619-I627 WeakPolarHBondContact O-CD1 3.25Å; C622-I627 HydrophobicContact CB-CD1 3.99Å; C622-I627 HydrophobicContact CB-CG1 4.08Å; R624-I627 PolarHBondContact O-N 3.48Å; I627-F631 HydrophobicContact CG2-CB 3.9Å; I627-F631 HydrophobicContact CG2-CD1 4.33Å; I627-F631 HydrophobicContact CG2-CD2 4.37Å; I627-F631 HydrophobicContact CG2-CG 3.96Å; I627-F674 HydrophobicContact CG1-CB 4.43Å
628	P	86.5	Confident	86.4	Confident	8 Å²	8	60.6 Å²	60.6	5%	0.052	30%	0.304	C	S	.	.			trans	-58	140.1	177	-22.3	29	0	0	0	113.1	G492 L494 N630 F631 F674	G492-P628 WeakPolarHBondContact O-CA 3.3Å; G492-P628 VanDerWaalsContact O-CB 3.25Å; G492-P628 WeakPolarHBondContact O-CB 3.48Å; L494-P628 HydrophobicContact CD1-CB 4.45Å; L494-P628 HydrophobicContact CD1-CG 4.17Å; L494-P628 HydrophobicContact CG-CB 4.44Å; L494-P628 HydrophobicContact CG-CG 3.86Å; P628-N630 PolarHBondContact O-N 3.04Å; P628-N630 VanDerWaalsContact O-N 3.09Å; P628-F631 HydrophobicContact CB-CB 4.39Å; P628-F631 WeakPolarHBondContact O-CB 3.45Å; P628-F631 PolarHBondContact O-N 2.93Å; P628-F674 HydrophobicContact CG-CD1 4.36Å; P628-F674 HydrophobicContact CG-CE1 4.14Å
629	T	83.4	Confident	85.5	Confident	140 Å²	140	61.4 Å²	61.4	86%	0.859	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-27.7	175.9	57.9	0	0	0	0	112.9
630	N	83.1	Confident	84.6	Confident	94 Å²	94	63.5 Å²	63.5	50%	0.503	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	9.7	-178.4	-59.9	2.9	0	0	0	112.9	P628 H632 S633 N634	P628-N630 PolarHBondContact O-N 3.04Å; P628-N630 VanDerWaalsContact O-N 3.09Å; N630-H632 PolarHBondContact O-N 2.98Å; N630-S633 WeakPolarHBondContact O-CB 3.41Å; N630-S633 PolarHBondContact O-N 2.83Å; N630-S633 VanDerWaalsContact O-N 3.12Å; N630-N634 PolarHBondContact O-N 3.11Å
631	F	86.4	Confident	84	Confident	6 Å²	6	64 Å²	64	3%	0.026	31%	0.311	C	S	.	.	H	α-helix	trans	-50.5	-52.4	-175.3	172	-98.8	0	0	0	112.9	P615 E619 I627 P628 S633 N634 L635 F674 L677	P615-F631 HydrophobicContact CB-CZ 3.93Å; E619-F631 HydrophobicContact CB-CE1 3.92Å; E619-F631 HydrophobicContact CB-CZ 4.26Å; E619-F631 HydrophobicContact CG-CD1 4.32Å; E619-F631 HydrophobicContact CG-CE1 3.96Å; I627-F631 HydrophobicContact CG2-CB 3.9Å; I627-F631 HydrophobicContact CG2-CD1 4.33Å; I627-F631 HydrophobicContact CG2-CD2 4.37Å; I627-F631 HydrophobicContact CG2-CG 3.96Å; P628-F631 HydrophobicContact CB-CB 4.39Å; P628-F631 WeakPolarHBondContact O-CB 3.45Å; P628-F631 PolarHBondContact O-N 2.93Å; F631-S633 VanDerWaalsContact C-N 3.34Å; F631-S633 PolarHBondContact O-N 3.34Å; F631-N634 PolarHBondContact O-N 3.07Å; F631-L635 HydrophobicContact CE1-CD2 4.4Å; F631-L635 VanDerWaalsContact O-CB 3.31Å; F631-L635 WeakPolarHBondContact O-CB 3.49Å; F631-L635 PolarHBondContact O-N 3.13Å; F631-F674 HydrophobicContact CD2-CE1 4.13Å; F631-F674 HydrophobicContact CD2-CE2 4.39Å; F631-F674 AromaticContact CD2-CZ 3.85Å; F631-F674 HydrophobicContact CD2-CZ 3.85Å; F631-F674 HydrophobicContact CE2-CE1 4.29Å; F631-F674 AromaticContact CE2-CE2 3.74Å; F631-F674 HydrophobicContact CE2-CE2 3.74Å; F631-F674 AromaticContact CE2-CZ 3.58Å; F631-F674 HydrophobicContact CE2-CZ 3.58Å; F631-L677 HydrophobicContact CE2-CD2 3.91Å
632	H	84.1	Confident	83	Confident	62 Å²	62	63 Å²	63	29%	0.287	31%	0.308	S	S	.	.	H	α-helix	trans	-67.8	-32.4	-178.3	-169.7	71.7	0	0	0	112.8	N630 L636	N630-H632 PolarHBondContact O-N 2.98Å; H632-L636 WeakPolarHBondContact O-CB 3.13Å; H632-L636 PolarHBondContact O-N 3.03Å
633	S	82.7	Confident	82.4	Confident	59 Å²	59	63.6 Å²	63.6	41%	0.413	31%	0.309	S	S	.	.	H	α-helix	trans	-66.7	-48.6	176.4	-54.9	0	0	0	0	111.7	N630 F631 L636 E637	N630-S633 WeakPolarHBondContact O-CB 3.41Å; N630-S633 PolarHBondContact O-N 2.83Å; N630-S633 VanDerWaalsContact O-N 3.12Å; F631-S633 VanDerWaalsContact C-N 3.34Å; F631-S633 PolarHBondContact O-N 3.34Å; S633-L636 WeakPolarHBondContact O-CB 3.09Å; S633-L636 PolarHBondContact O-N 3.47Å; S633-E637 PolarHBondContact O-N 3.22Å
634	N	84	Confident	81.9	Confident	41 Å²	41	62.3 Å²	62.3	22%	0.219	30%	0.304	C	S	.	.	H	α-helix	trans	-66.9	-38.5	178.7	-67.8	13.4	0	0	0	111.3	L494 N630 F631 L636 E637 F638	L494-N634 HydrophobicContact CD1-CB 4.01Å; L494-N634 WeakPolarHBondContact CD1-ND2 3.42Å; N630-N634 PolarHBondContact O-N 3.11Å; F631-N634 PolarHBondContact O-N 3.07Å; N634-L636 VanDerWaalsContact C-N 3.31Å; N634-L636 PolarHBondContact O-N 3.19Å; N634-E637 PolarHBondContact O-N 3.4Å; N634-F638 WeakPolarHBondContact O-CD2 3.39Å; N634-F638 PolarHBondContact O-N 3.07Å
635	L	84	Confident	82	Confident	5 Å²	5	51.9 Å²	51.9	3%	0.026	27%	0.266	C	S	.	.	H	α-helix	trans	-60	-42.3	172.8	175.3	62	0	0	0	111.7	P615 F631 E637 T639 V645	P615-L635 HydrophobicContact CB-CD1 3.78Å; P615-L635 HydrophobicContact CB-CD2 3.63Å; P615-L635 HydrophobicContact CB-CG 4.35Å; P615-L635 HydrophobicContact CG-CD1 3.65Å; P615-L635 HydrophobicContact CG-CD2 4.39Å; F631-L635 HydrophobicContact CE1-CD2 4.4Å; F631-L635 VanDerWaalsContact O-CB 3.31Å; F631-L635 WeakPolarHBondContact O-CB 3.49Å; F631-L635 PolarHBondContact O-N 3.13Å; L635-E637 VanDerWaalsContact C-N 3.35Å; L635-T639 HydrophobicContact CD1-CG2 3.99Å; L635-T639 WeakPolarHBondContact O-CB 3.31Å; L635-T639 WeakPolarHBondContact O-CG2 3.4Å; L635-T639 PolarHBondContact O-N 2.89Å; L635-T639 PolarHBondContact O-OG1 3.18Å; L635-V645 HydrophobicContact CD1-CB 3.92Å; L635-V645 HydrophobicContact CD1-CG1 3.93Å; L635-V645 HydrophobicContact CD1-CG2 4.24Å
636	L	79	Confident	82.2	Confident	22 Å²	22	47.6 Å²	47.6	12%	0.115	24%	0.243	C	C	.	.	H	α-helix	trans	-65.5	-38.3	178	-163.7	75	0	0	0	111.8	H632 S633 N634 T639 R640 L1282 Q1283	H632-L636 WeakPolarHBondContact O-CB 3.13Å; H632-L636 PolarHBondContact O-N 3.03Å; S633-L636 WeakPolarHBondContact O-CB 3.09Å; S633-L636 PolarHBondContact O-N 3.47Å; N634-L636 VanDerWaalsContact C-N 3.31Å; N634-L636 PolarHBondContact O-N 3.19Å; L636-T639 WeakPolarHBondContact CA-OG1 3.31Å; L636-T639 PolarHBondContact O-OG1 3.32Å; L636-R640 WeakPolarHBondContact O-CB 3.48Å; L636-R640 PolarHBondContact O-N 3.03Å; L636-L1282 HydrophobicContact CD1-CB 3.94Å; L636-L1282 HydrophobicContact CD1-CD1 4.18Å; L636-L1282 HydrophobicContact CD1-CD2 4.2Å; L636-L1282 HydrophobicContact CD1-CG 4.33Å; L636-L1282 HydrophobicContact CD2-CB 4.06Å; L636-Q1283 HydrophobicContact CD2-CG 4.02Å
637	E	83	Confident	82.4	Confident	119 Å²	119	46.5 Å²	46.5	56%	0.556	24%	0.237	S	C	*	.	H	α-helix	trans	-59.6	-57.3	176.2	-170.4	168.2	-155.9	0	0	111.2	S633 N634 L635 T639 R640 E641	S633-E637 PolarHBondContact O-N 3.22Å; N634-E637 PolarHBondContact O-N 3.4Å; L635-E637 VanDerWaalsContact C-N 3.35Å; E637-T639 VanDerWaalsContact C-N 3.35Å; E637-T639 PolarHBondContact O-N 3.33Å; E637-R640 PolarHBondContact O-N 3.37Å; E637-E641 PolarHBondContact O-N 3.1Å
638	F	83.7	Confident	82.8	Confident	21 Å²	21	45 Å²	45	9%	0.092	23%	0.229	C	C	.	.	H	α-helix	trans	-60.5	-39.8	178.6	-67.9	-59.3	0	0	0	113.3	W484 V487 P497 N634 E641 G642 F643 V645 V679	W484-F638 AromaticContact CH2-CE1 3.93Å; W484-F638 HydrophobicContact CH2-CE1 3.93Å; W484-F638 HydrophobicContact CZ3-CD1 4.47Å; W484-F638 AromaticContact CZ3-CE1 3.69Å; W484-F638 HydrophobicContact CZ3-CE1 3.69Å; W484-F638 HydrophobicContact CZ3-CZ 4.39Å; V487-F638 HydrophobicContact CG2-CE2 3.93Å; V487-F638 HydrophobicContact CG2-CZ 3.78Å; P497-F638 HydrophobicContact CG-CZ 4.46Å; N634-F638 WeakPolarHBondContact O-CD2 3.39Å; N634-F638 PolarHBondContact O-N 3.07Å; F638-E641 PolarHBondContact O-N 3.38Å; F638-G642 PolarHBondContact O-N 3.18Å; F638-F643 HydrophobicContact CB-CB 4.44Å; F638-F643 HydrophobicContact CB-CD2 4.44Å; F638-F643 HydrophobicContact CD1-CD2 4.16Å; F638-F643 WeakPolarHBondContact O-CB 3.47Å; F638-F643 WeakPolarHBondContact O-CD2 3.48Å; F638-F643 PolarHBondContact O-N 3.04Å; F638-V645 HydrophobicContact CB-CG2 3.6Å; F638-V645 HydrophobicContact CG-CG2 4.44Å; F638-V679 HydrophobicContact CD1-CG1 4.04Å; F638-V679 HydrophobicContact CD1-CG2 4.33Å; F638-V679 HydrophobicContact CD2-CG2 4.27Å; F638-V679 HydrophobicContact CE1-CG2 4.42Å; F638-V679 HydrophobicContact CE2-CG2 4.36Å; F638-V679 HydrophobicContact CG-CG1 4.38Å; F638-V679 HydrophobicContact CG-CG2 4.27Å; F638-V679 HydrophobicContact CZ-CG2 4.44Å
639	T	74.5	Confident	83.2	Confident	17 Å²	17	44.6 Å²	44.6	10%	0.104	23%	0.226	C	C	.	.	H	α-helix	trans	-74.1	-26	179.3	53.5	0	0	0	0	113.3	L635 L636 E637 G642 V645	L635-T639 HydrophobicContact CD1-CG2 3.99Å; L635-T639 WeakPolarHBondContact O-CB 3.31Å; L635-T639 WeakPolarHBondContact O-CG2 3.4Å; L635-T639 PolarHBondContact O-N 2.89Å; L635-T639 PolarHBondContact O-OG1 3.18Å; L636-T639 WeakPolarHBondContact CA-OG1 3.31Å; L636-T639 PolarHBondContact O-OG1 3.32Å; E637-T639 VanDerWaalsContact C-N 3.35Å; E637-T639 PolarHBondContact O-N 3.33Å; T639-G642 PolarHBondContact O-N 3.24Å; T639-V645 HydrophobicContact CG2-CG2 4.12Å
640	R	71.3	Confident	83.8	Confident	91 Å²	91	40.2 Å²	40.2	34%	0.343	19%	0.194	S	C	.	.	H	α-helix	trans	-74.5	-28	172.8	-177	178.6	-179.5	157.1	5.5	112.2	L636 E637 D799 H801	L636-R640 WeakPolarHBondContact O-CB 3.48Å; L636-R640 PolarHBondContact O-N 3.03Å; E637-R640 PolarHBondContact O-N 3.37Å; R640-D799 WeakPolarHBondContact CD-O 3.49Å; R640-D799 VanDerWaalsContact CZ-C 3.46Å; R640-D799 PolarHBondContact NE-O 2.98Å; R640-D799 PolarHBondContact NH1-O 3.27Å; R640-D799 IonicContact NH1-OD1 3.91Å; R640-D799 PolarHBondContact NH2-O 2.95Å; R640-H801 PolarHBondContact NH2-O 3.31Å
641	E	75.9	Confident	84.3	Confident	117 Å²	117	37.6 Å²	37.6	55%	0.547	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	3.7	168	-64.2	-166.3	138.4	0	0	113.6	E637 F638 F643	E637-E641 PolarHBondContact O-N 3.1Å; F638-E641 PolarHBondContact O-N 3.38Å; E641-F643 HydrophobicContact CB-CD2 3.79Å; E641-F643 HydrophobicContact CB-CE2 3.73Å; E641-F643 PolarHBondContact O-N 2.99Å; E641-F643 WeakPolarHBondContact OE2-CE2 3.47Å
642	G	70.8	Confident	84.6	Confident	9 Å²	9	39.8 Å²	39.8	9%	0.093	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.6	1.5	174	0	0	0	0	0	115.3	F638 T639 S715	F638-G642 PolarHBondContact O-N 3.18Å; T639-G642 PolarHBondContact O-N 3.24Å; G642-S715 VanDerWaalsContact CA-CB 3.48Å
643	F	81.6	Confident	84.8	Confident	21 Å²	21	38.4 Å²	38.4	9%	0.092	19%	0.187	C	C	.	.			trans	-66.9	145.8	176.4	-61.5	-69.2	0	0	0	112.1	W484 F638 E641 V679 M680 E681	W484-F643 HydrophobicContact CB-CD1 4.38Å; W484-F643 HydrophobicContact CB-CE1 4.21Å; W484-F643 AromaticContact CD1-CE1 3.54Å; W484-F643 AromaticContact CD1-CZ 3.83Å; W484-F643 HydrophobicContact CD2-CE1 4.27Å; W484-F643 HydrophobicContact CD2-CZ 4.27Å; W484-F643 AromaticContact CE2-CZ 3.93Å; W484-F643 HydrophobicContact CG-CD1 4.32Å; W484-F643 AromaticContact CG-CE1 3.77Å; W484-F643 HydrophobicContact CG-CE1 3.77Å; W484-F643 HydrophobicContact CG-CZ 4.2Å; W484-F643 AromaticContact NE1-CE1 3.88Å; W484-F643 AromaticContact NE1-CZ 3.65Å; F638-F643 HydrophobicContact CB-CB 4.44Å; F638-F643 HydrophobicContact CB-CD2 4.44Å; F638-F643 HydrophobicContact CD1-CD2 4.16Å; F638-F643 WeakPolarHBondContact O-CB 3.47Å; F638-F643 WeakPolarHBondContact O-CD2 3.48Å; F638-F643 PolarHBondContact O-N 3.04Å; E641-F643 HydrophobicContact CB-CD2 3.79Å; E641-F643 HydrophobicContact CB-CE2 3.73Å; E641-F643 PolarHBondContact O-N 2.99Å; E641-F643 WeakPolarHBondContact OE2-CE2 3.47Å; F643-V679 HydrophobicContact CB-CG1 3.6Å; F643-V679 HydrophobicContact CD1-CG1 4.09Å; F643-V679 HydrophobicContact CD2-CG1 4.22Å; F643-V679 HydrophobicContact CG-CG1 3.71Å; F643-M680 CarbonylContact C-O 3.59Å; F643-M680 WeakPolarHBondContact CA-O 3.29Å; F643-M680 WeakPolarHBondContact CB-O 3.41Å; F643-E681 HydrophobicContact CD1-CB 4.16Å; F643-E681 HydrophobicContact CD1-CG 4.46Å; F643-E681 HydrophobicContact CE1-CB 4.09Å; F643-E681 HydrophobicContact CE1-CG 4.11Å
644	R	79.1	Confident	85	Confident	84 Å²	84	43.4 Å²	43.4	32%	0.317	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	113	168.4	-177.2	177.2	175.5	169.9	-9.8	107.9	L481 M680	L481-R644 HydrophobicContact CD2-CB 3.83Å; L481-R644 HydrophobicContact CD2-CG 4.32Å; R644-M680 HydrophobicContact CB-CB 4.45Å; R644-M680 HydrophobicContact CB-CE 4.31Å; R644-M680 HydrophobicContact CG-CE 3.96Å; R644-M680 PolarHBondContact N-O 3.47Å; R644-M680 WeakPolarHBondContact O-CE 3.38Å; R644-M680 PolarHBondContact O-N 3.48Å
645	V	87	Confident	85	Confident	12 Å²	12	42.7 Å²	42.7	7%	0.073	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	135.5	-179.3	-171.5	0	0	0	0	110.1	P615 L635 F638 T639 L677 L678	P615-V645 WeakPolarHBondContact CD-O 3.41Å; P615-V645 HydrophobicContact CG-CB 4.24Å; P615-V645 HydrophobicContact CG-CG1 4Å; L635-V645 HydrophobicContact CD1-CB 3.92Å; L635-V645 HydrophobicContact CD1-CG1 3.93Å; L635-V645 HydrophobicContact CD1-CG2 4.24Å; F638-V645 HydrophobicContact CB-CG2 3.6Å; F638-V645 HydrophobicContact CG-CG2 4.44Å; T639-V645 HydrophobicContact CG2-CG2 4.12Å; V645-L677 HydrophobicContact CG1-CB 3.94Å; V645-L677 HydrophobicContact CG1-CD1 4.18Å; V645-L677 HydrophobicContact CG1-CD2 3.92Å; V645-L677 HydrophobicContact CG1-CG 4.23Å; V645-L678 CarbonylContact C-O 3.6Å; V645-L678 WeakPolarHBondContact CA-O 3.45Å
646	L	90.3	Very high	85	Confident	17 Å²	17	46 Å²	46	9%	0.089	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	153.2	163.5	-64.9	179.6	0	0	0	109.7	L531 G613 L677 L678 M680	L531-L646 HydrophobicContact CD1-CD1 3.96Å; L531-L646 HydrophobicContact CD2-CD1 3.83Å; L531-L646 HydrophobicContact CG-CD1 4.45Å; G613-L646 WeakPolarHBondContact O-CA 3.23Å; G613-L646 WeakPolarHBondContact O-CD2 3.31Å; L646-L677 CarbonylContact O-C 3.5Å; L646-L677 WeakPolarHBondContact O-CA 3.48Å; L646-L678 HydrophobicContact CB-CB 4.31Å; L646-L678 HydrophobicContact CD1-CD2 4.41Å; L646-L678 PolarHBondContact N-O 2.86Å; L646-L678 PolarHBondContact O-N 3.15Å; L646-M680 HydrophobicContact CD1-CE 4.02Å; L646-M680 HydrophobicContact CG-CE 3.89Å
647	A	93.4	Very high	85	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	143.2	170.1	0	0	0	0	0	110.6	K612 G613 P615 I618 F674 L677	K612-A647 WeakPolarHBondContact CA-O 3.45Å; G613-A647 PolarHBondContact N-O 3.44Å; G613-A647 VanDerWaalsContact N-O 3.16Å; G613-A647 PolarHBondContact O-N 3.4Å; P615-A647 HydrophobicContact CB-CB 4.28Å; P615-A647 HydrophobicContact CG-CB 4.4Å; I618-A647 HydrophobicContact CB-CB 3.57Å; I618-A647 HydrophobicContact CG1-CB 3.77Å; I618-A647 HydrophobicContact CG2-CB 3.77Å; A647-F674 HydrophobicContact CB-CE2 3.91Å; A647-L677 HydrophobicContact CB-CD2 4.16Å
648	L	95.3	Very high	84.8	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	139.4	175.7	-56.4	-179	0	0	0	109.4	L509 M513 K612 L675 G676 L678	L509-L648 HydrophobicContact CD1-CD1 3.73Å; M513-L648 HydrophobicContact CG-CD1 3.88Å; K612-L648 HydrophobicContact CB-CD2 3.49Å; K612-L648 VanDerWaalsContact CB-CD2 3.49Å; L648-L675 HydrophobicContact CB-CB 4.17Å; L648-L675 WeakPolarHBondContact O-CB 3.14Å; L648-L675 PolarHBondContact O-N 3.03Å; L648-G676 PolarHBondContact N-O 3.46Å; L648-L678 HydrophobicContact CD1-CB 4.43Å; L648-L678 HydrophobicContact CG-CB 4.48Å
649	A	95.2	Very high	84.8	Confident	0 Å²	0	55 Å²	55	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	159	177.8	0	0	0	0	0	111.4	T611 I618 C622 L672 L673	T611-A649 PolarHBondContact N-O 2.89Å; T611-A649 PolarHBondContact O-N 3.21Å; I618-A649 HydrophobicContact CG2-CB 3.69Å; C622-A649 VanDerWaalsContact SG-CB 3.54Å; A649-L672 HydrophobicContact CB-CB 3.96Å; A649-L672 HydrophobicContact CB-CD1 4.17Å; A649-L673 CarbonylContact C-O 3.47Å; A649-L673 VanDerWaalsContact CA-O 3.23Å; A649-L673 WeakPolarHBondContact CA-O 3.37Å; A649-L673 WeakPolarHBondContact CB-O 3.37Å
650	W	95.3	Very high	85.3	Confident	48 Å²	48	54.3 Å²	54.3	18%	0.182	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	166.6	178.4	83.6	-51.5	0	0	0	114	P508 H608 I609 Y610 L673 L675	P508-W650 HydrophobicContact CB-CD2 3.6Å; P508-W650 HydrophobicContact CB-CE3 3.89Å; P508-W650 HydrophobicContact CB-CG 3.97Å; P508-W650 HydrophobicContact CB-CH2 4.37Å; P508-W650 HydrophobicContact CB-CZ2 4.12Å; P508-W650 HydrophobicContact CB-CZ3 4.25Å; P508-W650 HydrophobicContact CG-CD2 3.86Å; P508-W650 HydrophobicContact CG-CE3 3.91Å; P508-W650 HydrophobicContact CG-CH2 3.53Å; P508-W650 HydrophobicContact CG-CZ2 3.47Å; P508-W650 VanDerWaalsContact CG-CZ2 3.47Å; P508-W650 HydrophobicContact CG-CZ3 3.74Å; H608-W650 AromaticContact CE1-CZ3 3.85Å; H608-W650 AromaticContact ND1-CZ3 3.46Å; H608-W650 WeakPolarHBondContact ND1-CZ3 3.26Å; I609-W650 CarbonylContact O-C 3.5Å; I609-W650 WeakPolarHBondContact O-CA 3.15Å; I609-W650 WeakPolarHBondContact O-CB 3.41Å; Y610-W650 HydrophobicContact CD1-CB 3.67Å; Y610-W650 HydrophobicContact CE1-CB 4.04Å; Y610-W650 HydrophobicContact CE1-CE3 4.01Å; W650-L673 HydrophobicContact CZ2-CD1 4.41Å; W650-L673 PolarHBondContact N-O 3.46Å; W650-L673 WeakPolarHBondContact O-CB 3.34Å; W650-L673 PolarHBondContact O-N 3Å; W650-L675 HydrophobicContact CB-CD1 3.8Å; W650-L675 HydrophobicContact CB-CG 4.38Å; W650-L675 VanDerWaalsContact CD1-CD2 3.42Å; W650-L675 HydrophobicContact CG-CD1 3.98Å; W650-L675 HydrophobicContact CG-CD2 4.16Å; W650-L675 HydrophobicContact CG-CG 4.2Å
651	R	93.4	Very high	85.6	Confident	38 Å²	38	53.1 Å²	53.1	14%	0.143	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	127.2	171.4	-175.3	178.7	63.7	158.3	-1.5	111.8	I609 R667 V668 H670 N671 L672	I609-R651 WeakPolarHBondContact CB-O 3.47Å; I609-R651 PolarHBondContact N-O 3.37Å; I609-R651 PolarHBondContact O-N 3.33Å; R651-R667 PolarHBondContact NH2-O 2.9Å; R651-V668 PolarHBondContact NH2-O 2.85Å; R651-H670 WeakPolarHBondContact CD-O 3.17Å; R651-H670 PolarHBondContact NE-O 3.33Å; R651-H670 PolarHBondContact NH1-O 3.46Å; R651-N671 WeakPolarHBondContact CD-O 3.44Å; R651-L672 HydrophobicContact CB-CD2 3.74Å
652	P	92.3	Very high	85.9	Confident	52 Å²	52	58.1 Å²	58.1	34%	0.338	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	141.2	168.4	29.9	-34	0	0	0	111.1
653	I	89.9	Confident	86.6	Confident	34 Å²	34	58.9 Å²	58.9	17%	0.174	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	129.4	177.1	-167.3	170.9	0	0	0	111.4	F607 I609 A655 I663	F607-I653 HydrophobicContact CB-CG2 3.95Å; F607-I653 PolarHBondContact N-O 2.92Å; F607-I653 PolarHBondContact O-N 2.84Å; I609-I653 HydrophobicContact CD1-CB 4.18Å; I609-I653 HydrophobicContact CD1-CD1 4.35Å; I609-I653 HydrophobicContact CD1-CG2 3.88Å; I609-I653 HydrophobicContact CG1-CG2 4.07Å; I653-A655 HydrophobicContact CG1-CB 4.44Å; I653-I663 HydrophobicContact CD1-CD1 4.35Å
654	K	86.7	Confident	86.8	Confident	164 Å²	164	60.5 Å²	60.5	71%	0.713	28%	0.284	S	S	*	.			trans	-96.4	107.6	170.5	-69.6	-176.8	178.3	-178.8	0	109.1	Q606	Q606-K654 HydrophobicContact CB-CG 3.99Å
655	A	83.7	Confident	87.1	Confident	26 Å²	26	58.7 Å²	58.7	22%	0.215	28%	0.277	C	S	.	.			trans	-152.6	156.5	179	0	0	0	0	0	110.3	F607 I653 I660	F607-A655 WeakPolarHBondContact CE2-O 3.37Å; I653-A655 HydrophobicContact CG1-CB 4.44Å; A655-I660 HydrophobicContact CB-CD1 4.19Å; A655-I660 HydrophobicContact CB-CG1 4.01Å
656	S	83.9	Confident	87	Confident	73 Å²	73	63.7 Å²	63.7	51%	0.51	30%	0.303	S	S	.	.			trans	-72.1	151.2	171.9	61.8	0	0	0	0	111.5	L658 R659 I660	S656-L658 VanDerWaalsContact C-N 3.32Å; S656-L658 PolarHBondContact O-N 2.89Å; S656-R659 WeakPolarHBondContact O-CA 3.47Å; S656-R659 WeakPolarHBondContact O-CB 3.42Å; S656-R659 PolarHBondContact O-N 3.06Å; S656-I660 PolarHBondContact O-N 3.42Å; S656-I660 VanDerWaalsContact O-N 3.09Å
657	Y	79	Confident	86.9	Confident	61 Å²	61	71.1 Å²	71.1	24%	0.239	33%	0.33	C	S	.	.	H	α-helix	trans	-53.4	-44.5	-180	176.2	-108.1	0	0	0	113.3	L556 V583 R659 I660 M661	L556-Y657 HydrophobicContact CB-CD2 4.43Å; L556-Y657 HydrophobicContact CB-CE2 4.2Å; L556-Y657 HydrophobicContact CD1-CD2 3.93Å; L556-Y657 HydrophobicContact CD1-CE2 4.44Å; L556-Y657 HydrophobicContact CD2-CD1 4.09Å; L556-Y657 HydrophobicContact CD2-CD2 3.65Å; L556-Y657 HydrophobicContact CD2-CE2 4.11Å; L556-Y657 HydrophobicContact CD2-CG 3.62Å; L556-Y657 HydrophobicContact CG-CD2 4.23Å; L556-Y657 HydrophobicContact CG-CE2 4.5Å; V583-Y657 HydrophobicContact CG1-CD2 4.31Å; V583-Y657 HydrophobicContact CG1-CE2 3.96Å; Y657-R659 VanDerWaalsContact C-N 3.28Å; Y657-R659 PolarHBondContact O-N 3.28Å; Y657-I660 PolarHBondContact O-N 2.64Å; Y657-I660 VanDerWaalsContact O-N 3.09Å; Y657-M661 HydrophobicContact CD2-CE 4.49Å; Y657-M661 HydrophobicContact CE1-CG 4.37Å; Y657-M661 HydrophobicContact CE2-CE 3.52Å; Y657-M661 HydrophobicContact CE2-CG 4.32Å; Y657-M661 PolarHBondContact O-N 3.31Å; Y657-M661 WeakPolarHBondContact OH-CE 3.44Å
658	L	79.1	Confident	86.6	Confident	126 Å²	126	71.1 Å²	71.1	66%	0.66	33%	0.33	S	S	*	.	H	α-helix	trans	-59.7	-36.2	176.2	-67.1	175.9	0	0	0	112.9	S656 R662	S656-L658 VanDerWaalsContact C-N 3.32Å; S656-L658 PolarHBondContact O-N 2.89Å; L658-R662 PolarHBondContact O-N 2.69Å
659	R	83.9	Confident	86.4	Confident	166 Å²	166	71.3 Å²	71.3	63%	0.626	33%	0.331	S	S	*	.	H	α-helix	trans	-70.8	-35.8	176.4	-173.5	173.2	177.6	168.8	-0.9	111.3	S656 Y657 R662 I663	S656-R659 WeakPolarHBondContact O-CA 3.47Å; S656-R659 WeakPolarHBondContact O-CB 3.42Å; S656-R659 PolarHBondContact O-N 3.06Å; Y657-R659 VanDerWaalsContact C-N 3.28Å; Y657-R659 PolarHBondContact O-N 3.28Å; R659-R662 PolarHBondContact O-N 3.02Å; R659-I663 WeakPolarHBondContact O-CB 3.24Å; R659-I663 PolarHBondContact O-N 3.49Å
660	I	84	Confident	86.1	Confident	2 Å²	2	75.8 Å²	75.8	1%	0.01	35%	0.352	C	S	.	.	H	α-helix	trans	-69.3	-36	176.3	-76	177.1	0	0	0	112.4	V583 R584 I598 F607 A655 S656 Y657 R662 I663	V583-I660 HydrophobicContact CG1-CG2 4.33Å; R584-I660 PolarHBondContact NH1-O 3.21Å; I598-I660 HydrophobicContact CD1-CG2 3.91Å; I598-I660 HydrophobicContact CG2-CD1 4.41Å; I598-I660 HydrophobicContact CG2-CG2 3.91Å; F607-I660 HydrophobicContact CB-CD1 3.69Å; F607-I660 HydrophobicContact CD1-CD1 3.55Å; F607-I660 HydrophobicContact CD2-CD1 3.2Å; F607-I660 HydrophobicContact CE1-CD1 3.88Å; F607-I660 HydrophobicContact CE2-CD1 3.58Å; F607-I660 HydrophobicContact CG-CD1 3.18Å; F607-I660 HydrophobicContact CZ-CD1 3.89Å; A655-I660 HydrophobicContact CB-CD1 4.19Å; A655-I660 HydrophobicContact CB-CG1 4.01Å; S656-I660 PolarHBondContact O-N 3.42Å; S656-I660 VanDerWaalsContact O-N 3.09Å; Y657-I660 PolarHBondContact O-N 2.64Å; Y657-I660 VanDerWaalsContact O-N 3.09Å; I660-R662 VanDerWaalsContact C-N 3.28Å; I660-R662 PolarHBondContact O-N 2.86Å; I660-I663 WeakPolarHBondContact O-CG2 3.45Å
661	M	78.6	Confident	85.9	Confident	65 Å²	65	77.5 Å²	77.5	32%	0.32	37%	0.365	S	S	.	.	H	α-helix	trans	-70.9	-23.3	174.5	-70.3	-57.3	-175	0	0	113.3	V583 R584 Y657	V583-M661 HydrophobicContact CG1-CE 3.76Å; R584-M661 HydrophobicContact CB-SD 4.46Å; R584-M661 VanDerWaalsContact CZ-O 3.28Å; R584-M661 PolarHBondContact NH1-O 2.84Å; Y657-M661 HydrophobicContact CD2-CE 4.49Å; Y657-M661 HydrophobicContact CE1-CG 4.37Å; Y657-M661 HydrophobicContact CE2-CE 3.52Å; Y657-M661 HydrophobicContact CE2-CG 4.32Å; Y657-M661 PolarHBondContact O-N 3.31Å; Y657-M661 WeakPolarHBondContact OH-CE 3.44Å
662	R	80.9	Confident	85.9	Confident	222 Å²	222	75.7 Å²	75.7	84%	0.838	36%	0.358	S	S	*	.	H	α-helix	trans	-101.3	-8.3	178.3	-66.3	-176.4	-179.9	-178.6	0.9	115.4	L658 R659 I660	L658-R662 PolarHBondContact O-N 2.69Å; R659-R662 PolarHBondContact O-N 3.02Å; I660-R662 VanDerWaalsContact C-N 3.28Å; I660-R662 PolarHBondContact O-N 2.86Å
663	I	85.3	Confident	86	Confident	25 Å²	25	75.5 Å²	75.5	13%	0.128	35%	0.353	C	S	.	.			trans	-64	140.4	-177.1	-160	167.4	0	0	0	111.2	R584 I598 I653 R659 I660 R667 V668	R584-I663 PolarHBondContact NH1-O 2.94Å; I598-I663 HydrophobicContact CD1-CG2 4.17Å; I653-I663 HydrophobicContact CD1-CD1 4.35Å; R659-I663 WeakPolarHBondContact O-CB 3.24Å; R659-I663 PolarHBondContact O-N 3.49Å; I660-I663 WeakPolarHBondContact O-CG2 3.45Å; I663-R667 HydrophobicContact CD1-CB 4.06Å; I663-R667 HydrophobicContact CG1-CB 3.83Å; I663-V668 HydrophobicContact CB-CG2 4.34Å; I663-V668 HydrophobicContact CD1-CG2 4.01Å; I663-V668 HydrophobicContact CG1-CG2 4.07Å; I663-V668 HydrophobicContact CG2-CG2 3.36Å
664	S	86.3	Confident	86.2	Confident	55 Å²	55	74.2 Å²	74.2	39%	0.385	35%	0.347	S	S	.	.			trans	-77.9	153.6	174.3	62.2	0	0	0	0	111.4	D666 R667 V668	S664-D666 VanDerWaalsContact C-N 3.32Å; S664-D666 PolarHBondContact O-N 3.09Å; S664-R667 PolarHBondContact O-N 3.44Å; S664-V668 PolarHBondContact O-N 2.83Å
665	R	86	Confident	86.5	Confident	47 Å²	47	67.3 Å²	67.3	18%	0.177	32%	0.318	C	S	.	.	H	α-helix	trans	-54.2	-46.6	-178.9	-176.7	173.9	-177.4	143.4	16.4	112.2	F586 P587 R594 R667 V668 E669	F586-R665 HydrophobicContact CD1-CB 3.93Å; F586-R665 HydrophobicContact CD1-CG 4.02Å; F586-R665 HydrophobicContact CE1-CB 3.95Å; F586-R665 HydrophobicContact CE1-CG 4.48Å; F586-R665 HydrophobicContact CG-CG 4.44Å; P587-R665 PolarHBondContact O-NH1 3.1Å; R594-R665 PolarHBondContact O-NH2 2.88Å; R665-R667 VanDerWaalsContact C-N 3.26Å; R665-R667 PolarHBondContact O-N 2.93Å; R665-V668 WeakPolarHBondContact O-CB 3.38Å; R665-V668 PolarHBondContact O-N 3.26Å; R665-E669 HydrophobicContact CG-CG 4.29Å; R665-E669 VanDerWaalsContact CG-OE2 3.25Å; R665-E669 WeakPolarHBondContact CG-OE2 3.09Å; R665-E669 IonicContact CZ-OE1 2.8Å; R665-E669 IonicContact CZ-OE2 3.1Å; R665-E669 VanDerWaalsContact NE-CD 3.28Å; R665-E669 IonicContact NE-OE1 2.78Å; R665-E669 PolarHBondContact NE-OE1 3.06Å; R665-E669 IonicContact NE-OE2 3.01Å; R665-E669 PolarHBondContact NE-OE2 2.93Å; R665-E669 IonicContact NH2-OE1 3.26Å; R665-E669 PolarHBondContact NH2-OE1 3Å; R665-E669 IonicContact NH2-OE2 3.28Å; R665-E669 PolarHBondContact O-N 3.35Å
666	D	85	Confident	86.9	Confident	116 Å²	116	66.1 Å²	66.1	62%	0.62	31%	0.307	S	S	*	.	H	α-helix	trans	-65.5	-26.6	-176.3	-40.7	-56.5	0	0	0	113.4	S664	S664-D666 VanDerWaalsContact C-N 3.32Å; S664-D666 PolarHBondContact O-N 3.09Å
667	R	87.2	Confident	87.4	Confident	174 Å²	174	62.6 Å²	62.6	66%	0.657	28%	0.283	S	S	*	.	H	α-helix	trans	-80	-25.7	175.1	-73.6	-176.8	173.6	-171.9	-1.4	112.7	R651 I663 S664 R665	R651-R667 PolarHBondContact NH2-O 2.9Å; I663-R667 HydrophobicContact CD1-CB 4.06Å; I663-R667 HydrophobicContact CG1-CB 3.83Å; S664-R667 PolarHBondContact O-N 3.44Å; R665-R667 VanDerWaalsContact C-N 3.26Å; R665-R667 PolarHBondContact O-N 2.93Å
668	V	88.4	Confident	88	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-75	-44.8	173.4	174.9	0	0	0	0	109.8	F586 I598 I609 R651 I663 S664 R665 H670	F586-V668 HydrophobicContact CD2-CG1 4.45Å; F586-V668 HydrophobicContact CE2-CB 4.31Å; F586-V668 HydrophobicContact CE2-CG1 4.17Å; F586-V668 HydrophobicContact CE2-CG2 3.86Å; F586-V668 HydrophobicContact CZ-CG2 4.05Å; I598-V668 HydrophobicContact CD1-CG1 4.36Å; I598-V668 HydrophobicContact CD1-CG2 3.99Å; I598-V668 HydrophobicContact CG1-CG1 4.31Å; I609-V668 HydrophobicContact CB-CG1 4.45Å; I609-V668 HydrophobicContact CD1-CG1 3.99Å; I609-V668 HydrophobicContact CG1-CG1 4.11Å; I609-V668 HydrophobicContact CG2-CG1 3.49Å; I609-V668 VanDerWaalsContact CG2-CG1 3.49Å; R651-V668 PolarHBondContact NH2-O 2.85Å; I663-V668 HydrophobicContact CB-CG2 4.34Å; I663-V668 HydrophobicContact CD1-CG2 4.01Å; I663-V668 HydrophobicContact CG1-CG2 4.07Å; I663-V668 HydrophobicContact CG2-CG2 3.36Å; S664-V668 PolarHBondContact O-N 2.83Å; R665-V668 WeakPolarHBondContact O-CB 3.38Å; R665-V668 PolarHBondContact O-N 3.26Å; V668-H670 VanDerWaalsContact C-N 3.32Å; V668-H670 PolarHBondContact O-N 3.36Å; V668-H670 VanDerWaalsContact O-N 3.14Å
669	E	90.1	Very high	88.5	Confident	4 Å²	4	53.8 Å²	53.8	2%	0.019	24%	0.241	C	C	.	.	S	Bend	trans	-88.9	54.7	-174.3	-63.1	-178.8	156.5	0	0	112.1	R594 S596 L621 R665	R594-E669 IonicContact CZ-OE2 2.93Å; R594-E669 VanDerWaalsContact NE-CD 3.29Å; R594-E669 IonicContact NE-OE1 3.24Å; R594-E669 IonicContact NE-OE2 2.97Å; R594-E669 PolarHBondContact NE-OE2 3.29Å; R594-E669 IonicContact NH2-OE2 2.65Å; R594-E669 PolarHBondContact NH2-OE2 3.03Å; S596-E669 VanDerWaalsContact OG-CG 3.25Å; S596-E669 WeakPolarHBondContact OG-CG 3.49Å; S596-E669 PolarHBondContact OG-OE1 3.19Å; L621-E669 HydrophobicContact CD1-CB 4.39Å; L621-E669 WeakPolarHBondContact CD2-O 3.14Å; R665-E669 HydrophobicContact CG-CG 4.29Å; R665-E669 VanDerWaalsContact CG-OE2 3.25Å; R665-E669 WeakPolarHBondContact CG-OE2 3.09Å; R665-E669 IonicContact CZ-OE1 2.8Å; R665-E669 IonicContact CZ-OE2 3.1Å; R665-E669 VanDerWaalsContact NE-CD 3.28Å; R665-E669 IonicContact NE-OE1 2.78Å; R665-E669 PolarHBondContact NE-OE1 3.06Å; R665-E669 IonicContact NE-OE2 3.01Å; R665-E669 PolarHBondContact NE-OE2 2.93Å; R665-E669 IonicContact NH2-OE1 3.26Å; R665-E669 PolarHBondContact NH2-OE1 3Å; R665-E669 IonicContact NH2-OE2 3.28Å; R665-E669 PolarHBondContact O-N 3.35Å
670	H	89.2	Confident	88.6	Confident	93 Å²	93	46.1 Å²	46.1	43%	0.431	21%	0.212	S	C	.	.	S	Bend	trans	-143.1	138.3	-174.8	160.2	65.9	0	0	0	112	R651 V668 L672	R651-H670 WeakPolarHBondContact CD-O 3.17Å; R651-H670 PolarHBondContact NE-O 3.33Å; R651-H670 PolarHBondContact NH1-O 3.46Å; V668-H670 VanDerWaalsContact C-N 3.32Å; V668-H670 PolarHBondContact O-N 3.36Å; V668-H670 VanDerWaalsContact O-N 3.14Å; H670-L672 VanDerWaalsContact C-N 3.28Å; H670-L672 PolarHBondContact O-N 3.18Å
671	N	90.9	Very high	88.4	Confident	85 Å²	85	48.9 Å²	48.9	46%	0.455	23%	0.225	S	C	.	.	S	Bend	trans	51.1	45.9	178.7	-78	-1.3	0	0	0	112.7	L621 R623 R651	L621-N671 PolarHBondContact O-N 3.14Å; L621-N671 VanDerWaalsContact O-N 3.16Å; R623-N671 HydrophobicContact CG-CB 4.01Å; R651-N671 WeakPolarHBondContact CD-O 3.44Å
672	L	93.7	Very high	88.2	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	21%	0.213	C	C	.	.	B	Isolated β-bridge	trans	-72.3	161.3	177.2	-55.1	176.7	0	0	0	111.1	I609 T611 L621 C622 R623 A649 R651 H670	I609-L672 HydrophobicContact CG2-CD2 4.41Å; T611-L672 HydrophobicContact CG2-CD1 4Å; L621-L672 HydrophobicContact CB-CD1 4.22Å; L621-L672 PolarHBondContact O-N 3.48Å; C622-L672 CarbonylContact C-O 3.58Å; C622-L672 VanDerWaalsContact CA-O 3.24Å; C622-L672 WeakPolarHBondContact CA-O 3.43Å; R623-L672 PolarHBondContact N-O 3.35Å; A649-L672 HydrophobicContact CB-CB 3.96Å; A649-L672 HydrophobicContact CB-CD1 4.17Å; R651-L672 HydrophobicContact CB-CD2 3.74Å; H670-L672 VanDerWaalsContact C-N 3.28Å; H670-L672 PolarHBondContact O-N 3.18Å
673	L	94	Very high	88.3	Confident	47 Å²	47	41.1 Å²	41.1	25%	0.246	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	124.1	172.7	-55.3	170.7	0	0	0	108	T626 A649 W650	T626-L673 HydrophobicContact CG2-CB 4.26Å; T626-L673 HydrophobicContact CG2-CD2 3.59Å; A649-L673 CarbonylContact C-O 3.47Å; A649-L673 VanDerWaalsContact CA-O 3.23Å; A649-L673 WeakPolarHBondContact CA-O 3.37Å; A649-L673 WeakPolarHBondContact CB-O 3.37Å; W650-L673 HydrophobicContact CZ2-CD1 4.41Å; W650-L673 PolarHBondContact N-O 3.46Å; W650-L673 WeakPolarHBondContact O-CB 3.34Å; W650-L673 PolarHBondContact O-N 3Å
674	F	94.6	Very high	88.4	Confident	8 Å²	8	42.3 Å²	42.3	4%	0.035	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	126.3	-178.4	178.5	-109.3	0	0	0	111.7	N489 L494 I618 C622 T626 I627 P628 F631 A647 G676 L677	N489-F674 HydrophobicContact CB-CD1 3.98Å; N489-F674 HydrophobicContact CB-CE1 4.05Å; N489-F674 WeakPolarHBondContact ND2-CD1 3.48Å; N489-F674 PolarHBondContact ND2-O 3.26Å; L494-F674 HydrophobicContact CD2-CE1 4.23Å; I618-F674 HydrophobicContact CG2-CD2 4.4Å; C622-F674 HydrophobicContact CB-CB 4.25Å; T626-F674 PolarHBondContact OG1-N 3.24Å; T626-F674 VanDerWaalsContact OG1-N 3.1Å; I627-F674 HydrophobicContact CG1-CB 4.43Å; P628-F674 HydrophobicContact CG-CD1 4.36Å; P628-F674 HydrophobicContact CG-CE1 4.14Å; F631-F674 HydrophobicContact CD2-CE1 4.13Å; F631-F674 HydrophobicContact CD2-CE2 4.39Å; F631-F674 AromaticContact CD2-CZ 3.85Å; F631-F674 HydrophobicContact CD2-CZ 3.85Å; F631-F674 HydrophobicContact CE2-CE1 4.29Å; F631-F674 AromaticContact CE2-CE2 3.74Å; F631-F674 HydrophobicContact CE2-CE2 3.74Å; F631-F674 AromaticContact CE2-CZ 3.58Å; F631-F674 HydrophobicContact CE2-CZ 3.58Å; A647-F674 HydrophobicContact CB-CE2 3.91Å; F674-G676 VanDerWaalsContact CE2-O 3.32Å; F674-G676 WeakPolarHBondContact CE2-O 3.49Å; F674-G676 WeakPolarHBondContact CZ-O 3.34Å; F674-L677 HydrophobicContact CE2-CD2 4.24Å; F674-L677 HydrophobicContact CZ-CD2 3.89Å; F674-L677 HydrophobicContact CZ-CG 4.16Å
675	L	92.9	Very high	88.5	Confident	19 Å²	19	40.5 Å²	40.5	10%	0.099	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	-28.4	-175	-72.5	176.3	0	0	0	114.5	N489 P508 L509 C512 L648 W650	N489-L675 VanDerWaalsContact CB-O 3.31Å; N489-L675 WeakPolarHBondContact CB-O 3.41Å; N489-L675 PolarHBondContact N-O 3.22Å; P508-L675 HydrophobicContact CB-CD1 4.1Å; P508-L675 HydrophobicContact CB-CD2 3.69Å; P508-L675 WeakPolarHBondContact O-CD1 3.3Å; L509-L675 HydrophobicContact CD1-CB 4.09Å; C512-L675 HydrophobicContact CB-CD1 3.99Å; L648-L675 HydrophobicContact CB-CB 4.17Å; L648-L675 WeakPolarHBondContact O-CB 3.14Å; L648-L675 PolarHBondContact O-N 3.03Å; W650-L675 HydrophobicContact CB-CD1 3.8Å; W650-L675 HydrophobicContact CB-CG 4.38Å; W650-L675 VanDerWaalsContact CD1-CD2 3.42Å; W650-L675 HydrophobicContact CG-CD1 3.98Å; W650-L675 HydrophobicContact CG-CD2 4.16Å; W650-L675 HydrophobicContact CG-CG 4.2Å
676	G	93.2	Very high	88.8	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	148.2	-172.1	-175.9	0	0	0	0	0	113.8	V487 L648 F674	V487-G676 CarbonylContact O-C 3.55Å; V487-G676 WeakPolarHBondContact O-CA 3.43Å; L648-G676 PolarHBondContact N-O 3.46Å; F674-G676 VanDerWaalsContact CE2-O 3.32Å; F674-G676 WeakPolarHBondContact CE2-O 3.49Å; F674-G676 WeakPolarHBondContact CZ-O 3.34Å
677	L	93	Very high	89.1	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	140.1	179.2	-58.5	175.1	0	0	0	110.9	V486 V487 L494 F631 V645 L646 A647 F674	V486-L677 CarbonylContact C-O 3.38Å; V486-L677 WeakPolarHBondContact CA-O 3.39Å; V487-L677 HydrophobicContact CB-CB 4.23Å; V487-L677 PolarHBondContact N-O 3.35Å; V487-L677 PolarHBondContact O-N 2.94Å; L494-L677 HydrophobicContact CD1-CD1 4.28Å; L494-L677 HydrophobicContact CD2-CD1 4.45Å; L494-L677 HydrophobicContact CD2-CG 4.32Å; F631-L677 HydrophobicContact CE2-CD2 3.91Å; V645-L677 HydrophobicContact CG1-CB 3.94Å; V645-L677 HydrophobicContact CG1-CD1 4.18Å; V645-L677 HydrophobicContact CG1-CD2 3.92Å; V645-L677 HydrophobicContact CG1-CG 4.23Å; L646-L677 CarbonylContact O-C 3.5Å; L646-L677 WeakPolarHBondContact O-CA 3.48Å; A647-L677 HydrophobicContact CB-CD2 4.16Å; F674-L677 HydrophobicContact CE2-CD2 4.24Å; F674-L677 HydrophobicContact CZ-CD2 3.89Å; F674-L677 HydrophobicContact CZ-CG 4.16Å
678	L	91.9	Very high	89.5	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.005	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	118.1	170.5	-174.2	75.8	0	0	0	107.9	L483 V486 M513 M535 V645 L646 L648	L483-L678 HydrophobicContact CD1-CD1 3.44Å; L483-L678 VanDerWaalsContact CD1-CD1 3.44Å; L483-L678 HydrophobicContact CD1-CG 3.87Å; V486-L678 HydrophobicContact CG2-CD1 3.78Å; M513-L678 HydrophobicContact CE-CD1 3.77Å; M513-L678 HydrophobicContact SD-CD1 4.21Å; M535-L678 HydrophobicContact CB-CD2 4.5Å; M535-L678 HydrophobicContact CG-CD2 4.02Å; M535-L678 HydrophobicContact SD-CD2 3.82Å; V645-L678 CarbonylContact C-O 3.6Å; V645-L678 WeakPolarHBondContact CA-O 3.45Å; L646-L678 HydrophobicContact CB-CB 4.31Å; L646-L678 HydrophobicContact CD1-CD2 4.41Å; L646-L678 PolarHBondContact N-O 2.86Å; L646-L678 PolarHBondContact O-N 3.15Å; L648-L678 HydrophobicContact CD1-CB 4.43Å; L648-L678 HydrophobicContact CG-CB 4.48Å
679	V	89.9	Confident	89.7	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	127.2	-172	-175.4	0	0	0	0	109.7	L483 W484 G485 V487 F638 F643	L483-V679 WeakPolarHBondContact CD1-O 3.49Å; W484-V679 HydrophobicContact CB-CG1 4.34Å; W484-V679 WeakPolarHBondContact CB-O 3.4Å; W484-V679 HydrophobicContact CD2-CG1 4.29Å; W484-V679 HydrophobicContact CE3-CB 3.93Å; W484-V679 HydrophobicContact CE3-CG1 3.72Å; W484-V679 HydrophobicContact CZ3-CG1 4.35Å; W484-V679 PolarHBondContact N-O 2.74Å; G485-V679 PolarHBondContact N-O 3.44Å; G485-V679 VanDerWaalsContact N-O 3.13Å; G485-V679 PolarHBondContact O-N 2.79Å; V487-V679 HydrophobicContact CG2-CG2 4.01Å; F638-V679 HydrophobicContact CD1-CG1 4.04Å; F638-V679 HydrophobicContact CD1-CG2 4.33Å; F638-V679 HydrophobicContact CD2-CG2 4.27Å; F638-V679 HydrophobicContact CE1-CG2 4.42Å; F638-V679 HydrophobicContact CE2-CG2 4.36Å; F638-V679 HydrophobicContact CG-CG1 4.38Å; F638-V679 HydrophobicContact CG-CG2 4.27Å; F638-V679 HydrophobicContact CZ-CG2 4.44Å; F643-V679 HydrophobicContact CB-CG1 3.6Å; F643-V679 HydrophobicContact CD1-CG1 4.09Å; F643-V679 HydrophobicContact CD2-CG1 4.22Å; F643-V679 HydrophobicContact CG-CG1 3.71Å
680	M	85.2	Confident	90	Very high	5 Å²	5	36.9 Å²	36.9	3%	0.025	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	148.2	-176.9	-63.8	164.4	-73.2	0	0	112.5	L481 D482 L483 L531 F643 R644 L646	L481-M680 HydrophobicContact CB-CB 4.33Å; L481-M680 HydrophobicContact CB-SD 4.34Å; L481-M680 HydrophobicContact CD2-CB 3.94Å; D482-M680 CarbonylContact O-C 3.56Å; D482-M680 VanDerWaalsContact O-CA 3.24Å; D482-M680 WeakPolarHBondContact O-CA 3.4Å; D482-M680 WeakPolarHBondContact O-CB 3.46Å; L483-M680 HydrophobicContact CD1-CG 4.07Å; L531-M680 HydrophobicContact CD1-CE 3.73Å; L531-M680 HydrophobicContact CD1-SD 3.71Å; L531-M680 HydrophobicContact CD2-SD 4.44Å; L531-M680 HydrophobicContact CG-CE 4.18Å; L531-M680 HydrophobicContact CG-SD 3.57Å; L531-M680 VanDerWaalsContact CG-SD 3.57Å; F643-M680 CarbonylContact C-O 3.59Å; F643-M680 WeakPolarHBondContact CA-O 3.29Å; F643-M680 WeakPolarHBondContact CB-O 3.41Å; R644-M680 HydrophobicContact CB-CB 4.45Å; R644-M680 HydrophobicContact CB-CE 4.31Å; R644-M680 HydrophobicContact CG-CE 3.96Å; R644-M680 PolarHBondContact N-O 3.47Å; R644-M680 WeakPolarHBondContact O-CE 3.38Å; R644-M680 PolarHBondContact O-N 3.48Å; L646-M680 HydrophobicContact CD1-CE 4.02Å; L646-M680 HydrophobicContact CG-CE 3.89Å
681	E	80.2	Confident	90.3	Very high	60 Å²	60	33 Å²	33	28%	0.28	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	136.2	-179.2	-168	-177.1	-168	0	0	111.2	D482 F643 R683	D482-E681 PolarHBondContact N-O 3.2Å; D482-E681 PolarHBondContact O-N 2.67Å; F643-E681 HydrophobicContact CD1-CB 4.16Å; F643-E681 HydrophobicContact CD1-CG 4.46Å; F643-E681 HydrophobicContact CE1-CB 4.09Å; F643-E681 HydrophobicContact CE1-CG 4.11Å; E681-R683 HydrophobicContact CG-CG 3.91Å; E681-R683 IonicContact OE1-NE 2.69Å; E681-R683 IonicContact OE2-CZ 3.71Å; E681-R683 VanDerWaalsContact OE2-CZ 3.28Å; E681-R683 IonicContact OE2-NE 3.93Å; E681-R683 PolarHBondContact OE2-NE 2.14Å; E681-R683 IonicContact OE2-NH2 3.2Å; E681-R683 PolarHBondContact OE2-NH2 3.12Å
682	N	75.5	Confident	90.5	Very high	14 Å²	14	29 Å²	29	8%	0.075	15%	0.154	C	C	.	.			trans	-102.3	91.2	166.4	-81.3	-71.1	0	0	0	108.7	K472 T477 L481	K472-N682 VanDerWaalsContact NZ-CG 3.3Å; K472-N682 PolarHBondContact NZ-ND2 2.88Å; K472-N682 PolarHBondContact NZ-OD1 2.88Å; T477-N682 HydrophobicContact CG2-CB 4.24Å; L481-N682 WeakPolarHBondContact CD2-OD1 3.31Å
683	R	81.7	Confident	90.5	Very high	110 Å²	110	33.1 Å²	33.1	42%	0.415	17%	0.172	S	C	.	.	P	Polyproline II helix	trans	-68	134.3	-176	-72.1	-173.6	177.6	139.5	15.9	112.6	T477 E478 D482 E681	T477-R683 CarbonylContact C-O 3.49Å; T477-R683 WeakPolarHBondContact CA-O 3.15Å; T477-R683 WeakPolarHBondContact CB-O 3.33Å; E478-R683 PolarHBondContact N-O 3.21Å; D482-R683 IonicContact OD2-CZ 3.67Å; D482-R683 IonicContact OD2-NH1 2.79Å; D482-R683 PolarHBondContact OD2-NH1 2.56Å; D482-R683 IonicContact OD2-NH2 3.57Å; E681-R683 HydrophobicContact CG-CG 3.91Å; E681-R683 IonicContact OE1-NE 2.69Å; E681-R683 IonicContact OE2-CZ 3.71Å; E681-R683 VanDerWaalsContact OE2-CZ 3.28Å; E681-R683 IonicContact OE2-NE 3.93Å; E681-R683 PolarHBondContact OE2-NE 2.14Å; E681-R683 IonicContact OE2-NH2 3.2Å; E681-R683 PolarHBondContact OE2-NH2 3.12Å
684	L	86.7	Confident	90.6	Very high	50 Å²	50	33.1 Å²	33.1	26%	0.262	18%	0.175	S	C	.	.	B	Isolated β-bridge	trans	-72.3	136.4	172.4	-91.5	169.5	0	0	0	111.1	L476 T477 V716 D719 C720	L476-L684 HydrophobicContact CB-CD2 4.42Å; L476-L684 WeakPolarHBondContact O-CD2 3.45Å; T477-L684 HydrophobicContact CG2-CD2 4.47Å; L684-V716 HydrophobicContact CD2-CG1 3.82Å; L684-V716 HydrophobicContact CG-CG1 4.29Å; L684-D719 HydrophobicContact CD1-CB 3.4Å; L684-D719 VanDerWaalsContact CD1-CB 3.4Å; L684-C720 HydrophobicContact CD1-CB 4.09Å; L684-C720 HydrophobicContact CD2-CB 4.01Å
685	K	89.8	Confident	90.6	Very high	18 Å²	18	32.8 Å²	32.8	8%	0.078	17%	0.173	C	C	.	.	P	Polyproline II helix	trans	-62.9	136.6	169	-70.9	178	173.8	176.8	0	109.5	G474 L476 T477 E478 D479 E687 S688 Q1006	G474-K685 PolarHBondContact O-NZ 3.35Å; L476-K685 PolarHBondContact O-N 2.91Å; T477-K685 WeakPolarHBondContact O-CE 3.29Å; E478-K685 HydrophobicContact CG-CG 3.91Å; D479-K685 IonicContact OD2-NZ 3.9Å; K685-E687 PolarHBondContact O-N 2.88Å; K685-E687 VanDerWaalsContact O-N 3.1Å; K685-S688 VanDerWaalsContact O-CB 3.29Å; K685-S688 WeakPolarHBondContact O-CB 3.47Å; K685-S688 PolarHBondContact O-N 2.98Å; K685-S688 PolarHBondContact O-OG 3.37Å; K685-Q1006 WeakPolarHBondContact CD-O 3.46Å; K685-Q1006 WeakPolarHBondContact CE-O 3.29Å; K685-Q1006 PolarHBondContact NZ-O 2.88Å
686	P	91.2	Very high	90.6	Very high	101 Å²	101	35.5 Å²	35.5	66%	0.656	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-22.6	-171.5	24	-33.7	0	0	0	113.6	P690	P686-P690 WeakPolarHBondContact O-CD 3.27Å
687	E	92.7	Very high	90.5	Very high	69 Å²	69	40.9 Å²	40.9	32%	0.322	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-15	175.9	-51.3	90.6	155.9	0	0	114.1	K685 P690 V691 N1007	K685-E687 PolarHBondContact O-N 2.88Å; K685-E687 VanDerWaalsContact O-N 3.1Å; E687-P690 WeakPolarHBondContact O-CD 3.35Å; E687-V691 WeakPolarHBondContact O-CB 3.42Å; E687-V691 VanDerWaalsContact O-CG2 3.25Å; E687-V691 WeakPolarHBondContact O-CG2 3.42Å; E687-V691 PolarHBondContact O-N 3.34Å; E687-N1007 PolarHBondContact OE1-ND2 3.01Å
688	S	93.9	Very high	90.4	Very high	1 Å²	1	41 Å²	41	1%	0.007	21%	0.208	C	C	.	.	H	α-helix	trans	-60.7	-56	-171.7	-70.8	0	0	0	0	112.3	L476 K685 V691 I692	L476-S688 PolarHBondContact O-OG 3.1Å; K685-S688 VanDerWaalsContact O-CB 3.29Å; K685-S688 WeakPolarHBondContact O-CB 3.47Å; K685-S688 PolarHBondContact O-N 2.98Å; K685-S688 PolarHBondContact O-OG 3.37Å; S688-V691 PolarHBondContact O-N 2.98Å; S688-I692 VanDerWaalsContact O-CG1 3.3Å; S688-I692 WeakPolarHBondContact O-CG1 3.05Å; S688-I692 PolarHBondContact O-N 3.24Å
689	G	93.4	Very high	90.3	Very high	15 Å²	15	46.9 Å²	46.9	16%	0.155	24%	0.239	C	C	.	.	H	α-helix	trans	-56	-54.9	177.7	0	0	0	0	0	113.7	V691 I692 K693	G689-V691 VanDerWaalsContact C-N 3.27Å; G689-V691 PolarHBondContact O-N 2.99Å; G689-I692 PolarHBondContact O-N 3.03Å; G689-K693 WeakPolarHBondContact O-CB 3.29Å; G689-K693 PolarHBondContact O-N 2.9Å
690	P	95.5	Very high	90.5	Very high	79 Å²	79	47 Å²	47	51%	0.513	24%	0.24	S	C	.	.	H	α-helix	trans	-55.8	-36.3	177.3	-28.7	35.6	0	0	0	114.6	P686 E687 T694	P686-P690 WeakPolarHBondContact O-CD 3.27Å; E687-P690 WeakPolarHBondContact O-CD 3.35Å; P690-T694 WeakPolarHBondContact O-CB 3.34Å; P690-T694 PolarHBondContact O-N 3.32Å; P690-T694 VanDerWaalsContact O-N 3.11Å; P690-T694 PolarHBondContact O-OG1 3.18Å
691	V	96	Very high	90.9	Very high	11 Å²	11	48.5 Å²	48.5	7%	0.067	25%	0.246	C	C	.	.	H	α-helix	trans	-72.6	-46.1	177.1	170.5	0	0	0	0	111.5	E687 S688 G689 K693 T694 L695 I1008 P1012	E687-V691 WeakPolarHBondContact O-CB 3.42Å; E687-V691 VanDerWaalsContact O-CG2 3.25Å; E687-V691 WeakPolarHBondContact O-CG2 3.42Å; E687-V691 PolarHBondContact O-N 3.34Å; S688-V691 PolarHBondContact O-N 2.98Å; G689-V691 VanDerWaalsContact C-N 3.27Å; G689-V691 PolarHBondContact O-N 2.99Å; V691-K693 VanDerWaalsContact C-N 3.32Å; V691-K693 PolarHBondContact O-N 2.72Å; V691-T694 WeakPolarHBondContact O-CB 3.17Å; V691-T694 PolarHBondContact O-N 2.91Å; V691-T694 VanDerWaalsContact O-N 3.12Å; V691-L695 HydrophobicContact CG1-CD1 4.27Å; V691-L695 WeakPolarHBondContact O-CG 3.35Å; V691-L695 PolarHBondContact O-N 2.7Å; V691-I1008 HydrophobicContact CB-CD1 3.74Å; V691-I1008 HydrophobicContact CB-CG1 3.91Å; V691-I1008 HydrophobicContact CG1-CB 4.46Å; V691-I1008 HydrophobicContact CG1-CD1 3.53Å; V691-I1008 HydrophobicContact CG1-CG1 3.81Å; V691-I1008 HydrophobicContact CG2-CG1 4.25Å; V691-P1012 HydrophobicContact CG1-CG 3.94Å; V691-P1012 HydrophobicContact CG2-CG 4.34Å
692	I	95.8	Very high	91.7	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-59.8	-43.6	177	-67	-64.7	0	0	0	110.8	F470 L476 S688 G689 T694 L695 R696 P702 C720 M722 I1008	F470-I692 HydrophobicContact CD2-CD1 4.07Å; F470-I692 HydrophobicContact CE2-CD1 3.63Å; F470-I692 HydrophobicContact CZ-CD1 4.08Å; L476-I692 HydrophobicContact CD2-CD1 4.47Å; S688-I692 VanDerWaalsContact O-CG1 3.3Å; S688-I692 WeakPolarHBondContact O-CG1 3.05Å; S688-I692 PolarHBondContact O-N 3.24Å; G689-I692 PolarHBondContact O-N 3.03Å; I692-T694 VanDerWaalsContact C-N 3.33Å; I692-T694 PolarHBondContact O-N 3.41Å; I692-L695 PolarHBondContact O-N 3.45Å; I692-L695 VanDerWaalsContact O-N 3.11Å; I692-R696 PolarHBondContact O-N 3.49Å; I692-P702 HydrophobicContact CD1-CB 3.86Å; I692-P702 HydrophobicContact CG2-CB 4.41Å; I692-P702 HydrophobicContact CG2-CG 4.18Å; I692-C720 WeakPolarHBondContact CB-O 3.45Å; I692-C720 VanDerWaalsContact CG2-O 3.32Å; I692-C720 WeakPolarHBondContact CG2-O 3.47Å; I692-M722 HydrophobicContact CD1-CE 4.1Å; I692-M722 HydrophobicContact CG2-CB 4.07Å; I692-I1008 HydrophobicContact CD1-CD1 4.25Å; I692-I1008 HydrophobicContact CG1-CD1 4.25Å
693	K	94.1	Very high	92.6	Very high	87 Å²	87	45.4 Å²	45.4	38%	0.378	23%	0.231	S	C	.	.	H	α-helix	trans	-56.8	-44.2	173	-162.5	-177.6	-157.6	85.2	0	112	G689 V691 L695 R696 Q697 E721	G689-K693 WeakPolarHBondContact O-CB 3.29Å; G689-K693 PolarHBondContact O-N 2.9Å; V691-K693 VanDerWaalsContact C-N 3.32Å; V691-K693 PolarHBondContact O-N 2.72Å; K693-L695 VanDerWaalsContact C-N 3.33Å; K693-L695 PolarHBondContact O-N 3.43Å; K693-R696 PolarHBondContact O-N 2.81Å; K693-Q697 WeakPolarHBondContact O-CB 3.37Å; K693-Q697 VanDerWaalsContact O-CG 3.28Å; K693-Q697 WeakPolarHBondContact O-CG 3.35Å; K693-Q697 PolarHBondContact O-N 3.13Å; K693-E721 WeakPolarHBondContact CG-OE2 3.32Å; K693-E721 IonicContact NZ-OE1 3.78Å; K693-E721 PolarHBondContact NZ-OE1 2.75Å; K693-E721 IonicContact NZ-OE2 2.95Å; K693-E721 PolarHBondContact NZ-OE2 3.5Å
694	T	94.5	Very high	93.3	Very high	48 Å²	48	40.2 Å²	40.2	29%	0.294	21%	0.212	S	C	.	.	H	α-helix	trans	-62.5	-37.4	175.8	-58.3	0	0	0	0	112.3	P690 V691 I692 A698 P1012 L1082	P690-T694 WeakPolarHBondContact O-CB 3.34Å; P690-T694 PolarHBondContact O-N 3.32Å; P690-T694 VanDerWaalsContact O-N 3.11Å; P690-T694 PolarHBondContact O-OG1 3.18Å; V691-T694 WeakPolarHBondContact O-CB 3.17Å; V691-T694 PolarHBondContact O-N 2.91Å; V691-T694 VanDerWaalsContact O-N 3.12Å; I692-T694 VanDerWaalsContact C-N 3.33Å; I692-T694 PolarHBondContact O-N 3.41Å; T694-A698 WeakPolarHBondContact O-CB 3.44Å; T694-A698 PolarHBondContact O-N 2.84Å; T694-P1012 HydrophobicContact CG2-CB 4.35Å; T694-L1082 HydrophobicContact CG2-CB 4.48Å
695	L	95.2	Very high	93.6	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-71.2	-45.2	177.1	-66.1	173.6	0	0	0	111.8	F470 V691 I692 K693 Q697 A698 N699 I700 V1011 I1015 L1082	F470-L695 HydrophobicContact CE2-CD1 4.01Å; F470-L695 HydrophobicContact CZ-CD1 3.7Å; V691-L695 HydrophobicContact CG1-CD1 4.27Å; V691-L695 WeakPolarHBondContact O-CG 3.35Å; V691-L695 PolarHBondContact O-N 2.7Å; I692-L695 PolarHBondContact O-N 3.45Å; I692-L695 VanDerWaalsContact O-N 3.11Å; K693-L695 VanDerWaalsContact C-N 3.33Å; K693-L695 PolarHBondContact O-N 3.43Å; L695-Q697 PolarHBondContact O-N 2.69Å; L695-A698 CarbonylContact O-C 3.54Å; L695-A698 WeakPolarHBondContact O-CA 3.44Å; L695-A698 PolarHBondContact O-N 2.84Å; L695-N699 PolarHBondContact O-N 2.95Å; L695-I700 CarbonylContact C-O 3.59Å; L695-I700 HydrophobicContact CB-CB 4.3Å; L695-I700 HydrophobicContact CD2-CB 4.24Å; L695-I700 HydrophobicContact CD2-CD1 4.15Å; L695-I700 HydrophobicContact CD2-CG2 4.25Å; L695-I700 PolarHBondContact O-N 3.09Å; L695-I700 VanDerWaalsContact O-O 3.11Å; L695-V1011 HydrophobicContact CD1-CG1 4.27Å; L695-V1011 HydrophobicContact CD2-CG1 4.43Å; L695-I1015 HydrophobicContact CD2-CD1 4.04Å; L695-L1082 HydrophobicContact CD2-CD2 4.11Å
696	R	92.3	Very high	93.5	Very high	76 Å²	76	37.1 Å²	37.1	29%	0.287	20%	0.196	S	C	.	.	H	α-helix	trans	-57.1	-48.5	174.2	-74	-179.3	73.7	-157.3	-1.3	111.1	I692 K693 A698 N699 P702 E721 D724	I692-R696 PolarHBondContact O-N 3.49Å; K693-R696 PolarHBondContact O-N 2.81Å; R696-A698 PolarHBondContact O-N 3.38Å; R696-N699 PolarHBondContact O-N 3.03Å; R696-P702 HydrophobicContact CG-CG 4.09Å; R696-E721 WeakPolarHBondContact CD-O 3.22Å; R696-E721 PolarHBondContact NH1-O 3.48Å; R696-D724 IonicContact CZ-OD2 2.67Å; R696-D724 IonicContact NH1-OD2 3.15Å; R696-D724 PolarHBondContact NH1-OD2 2.63Å; R696-D724 IonicContact NH2-OD2 2.77Å; R696-D724 PolarHBondContact NH2-OD2 2.67Å
697	Q	91.5	Very high	92.8	Very high	113 Å²	113	33.8 Å²	33.8	53%	0.528	18%	0.181	S	C	.	.	H	α-helix	trans	-59.6	-28.9	175.8	-72.9	175.2	0.4	0	0	113.5	K693 L695 N699	K693-Q697 WeakPolarHBondContact O-CB 3.37Å; K693-Q697 VanDerWaalsContact O-CG 3.28Å; K693-Q697 WeakPolarHBondContact O-CG 3.35Å; K693-Q697 PolarHBondContact O-N 3.13Å; L695-Q697 PolarHBondContact O-N 2.69Å; Q697-N699 VanDerWaalsContact C-N 3.31Å
698	A	91.6	Very high	92	Very high	2 Å²	2	32 Å²	32	2%	0.017	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87	10	176.4	0	0	0	0	0	114.4	T694 L695 R696 I700 L1082 A1084	T694-A698 WeakPolarHBondContact O-CB 3.44Å; T694-A698 PolarHBondContact O-N 2.84Å; L695-A698 CarbonylContact O-C 3.54Å; L695-A698 WeakPolarHBondContact O-CA 3.44Å; L695-A698 PolarHBondContact O-N 2.84Å; R696-A698 PolarHBondContact O-N 3.38Å; A698-I700 HydrophobicContact CB-CD1 4.38Å; A698-I700 HydrophobicContact CB-CG1 4.08Å; A698-I700 PolarHBondContact O-N 3.19Å; A698-L1082 HydrophobicContact CB-CB 4.11Å; A698-L1082 HydrophobicContact CB-CD2 3.5Å; A698-L1082 VanDerWaalsContact CB-CD2 3.5Å; A698-L1082 HydrophobicContact CB-CG 3.52Å; A698-A1084 WeakPolarHBondContact O-CA 3.3Å
699	N	90.1	Very high	91.1	Very high	125 Å²	125	33.8 Å²	33.8	67%	0.668	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.7	31	-172.2	-73.1	-29.7	0	0	0	113.5	L695 R696 Q697	L695-N699 PolarHBondContact O-N 2.95Å; R696-N699 PolarHBondContact O-N 3.03Å; Q697-N699 VanDerWaalsContact C-N 3.31Å
700	I	93.8	Very high	90.5	Very high	2 Å²	2	33.2 Å²	33.2	1%	0.01	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-99.5	118.9	170.9	-53.6	-170.8	0	0	0	106.9	I465 L695 A698 P702 I1015 L1082	I465-I700 HydrophobicContact CG2-CG2 4.27Å; L695-I700 CarbonylContact C-O 3.59Å; L695-I700 HydrophobicContact CB-CB 4.3Å; L695-I700 HydrophobicContact CD2-CB 4.24Å; L695-I700 HydrophobicContact CD2-CD1 4.15Å; L695-I700 HydrophobicContact CD2-CG2 4.25Å; L695-I700 PolarHBondContact O-N 3.09Å; L695-I700 VanDerWaalsContact O-O 3.11Å; A698-I700 HydrophobicContact CB-CD1 4.38Å; A698-I700 HydrophobicContact CB-CG1 4.08Å; A698-I700 PolarHBondContact O-N 3.19Å; I700-P702 WeakPolarHBondContact O-CD 3.31Å; I700-I1015 HydrophobicContact CD1-CD1 3.76Å; I700-I1015 HydrophobicContact CD1-CG2 3.84Å; I700-L1082 HydrophobicContact CD1-CD2 3.85Å
701	R	93.7	Very high	89.7	Confident	38 Å²	38	30.1 Å²	30.1	14%	0.143	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	117	-175.2	-178.9	172.3	180	-117.7	-3.5	110.6	N466 L467 T468 V703 V940 K942 G943 T944	N466-R701 PolarHBondContact O-N 3.35Å; L467-R701 CarbonylContact C-O 3.21Å; L467-R701 VanDerWaalsContact CA-O 3.3Å; L467-R701 WeakPolarHBondContact CA-O 3.13Å; L467-R701 HydrophobicContact CB-CB 4.44Å; L467-R701 HydrophobicContact CD1-CB 4.31Å; L467-R701 HydrophobicContact CD1-CG 4.33Å; L467-R701 HydrophobicContact CG-CB 4.19Å; L467-R701 HydrophobicContact CG-CG 4.48Å; T468-R701 PolarHBondContact N-O 2.94Å; R701-V703 HydrophobicContact CG-CG2 4.21Å; R701-V940 PolarHBondContact NH1-O 3.48Å; R701-K942 PolarHBondContact NH2-O 2.88Å; R701-G943 PolarHBondContact NH2-O 3.47Å; R701-T944 PolarHBondContact NH2-OG1 3.21Å
702	P	95.8	Very high	88.9	Confident	9 Å²	9	30 Å²	30	6%	0.058	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	146.8	165.8	34.5	-36.2	0	0	0	110.3	T468 F470 I692 R696 I700 M722	T468-P702 CarbonylContact O-C 3.59Å; T468-P702 WeakPolarHBondContact O-CA 3.18Å; F470-P702 HydrophobicContact CE2-CB 4.31Å; I692-P702 HydrophobicContact CD1-CB 3.86Å; I692-P702 HydrophobicContact CG2-CB 4.41Å; I692-P702 HydrophobicContact CG2-CG 4.18Å; R696-P702 HydrophobicContact CG-CG 4.09Å; I700-P702 WeakPolarHBondContact O-CD 3.31Å; P702-M722 HydrophobicContact CB-CE 4.3Å; P702-M722 HydrophobicContact CB-CG 3.78Å; P702-M722 HydrophobicContact CB-SD 4.23Å; P702-M722 HydrophobicContact CG-CG 3.63Å
703	V	96.2	Very high	88.3	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	138.5	173.9	177.4	0	0	0	0	107.9	L467 T468 C469 F470 R701 V705 F946	L467-V703 HydrophobicContact CD1-CG2 4.09Å; L467-V703 HydrophobicContact CD2-CG2 4.02Å; L467-V703 HydrophobicContact CG-CG2 4.07Å; T468-V703 PolarHBondContact O-N 3.02Å; C469-V703 CarbonylContact C-O 3.53Å; C469-V703 VanDerWaalsContact CA-O 3.28Å; C469-V703 WeakPolarHBondContact CA-O 3.47Å; F470-V703 PolarHBondContact N-O 3.4Å; R701-V703 HydrophobicContact CG-CG2 4.21Å; V703-V705 HydrophobicContact CG1-CG2 3.98Å; V703-F946 HydrophobicContact CG1-CD2 3.72Å; V703-F946 HydrophobicContact CG1-CE2 3.68Å
704	M	95.2	Very high	88	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	130.8	172.7	-171.3	-175.6	-72	0	0	109.8	F470 K472 L476 T706 V716 A717 M722 T944 V945 F946	F470-M704 WeakPolarHBondContact O-CA 3.47Å; K472-M704 HydrophobicContact CB-CE 4.5Å; K472-M704 HydrophobicContact CB-CG 4.33Å; K472-M704 HydrophobicContact CB-SD 3.98Å; K472-M704 HydrophobicContact CG-CE 4.14Å; K472-M704 HydrophobicContact CG-SD 3.97Å; L476-M704 HydrophobicContact CD1-CE 3.8Å; M704-T706 HydrophobicContact CG-CG2 4.32Å; M704-T706 HydrophobicContact SD-CG2 4.28Å; M704-V716 HydrophobicContact CE-CB 4.2Å; M704-V716 HydrophobicContact CE-CG1 3.9Å; M704-A717 HydrophobicContact CE-CB 3.94Å; M704-M722 HydrophobicContact CB-CE 4.11Å; M704-M722 HydrophobicContact CB-SD 3.94Å; M704-M722 HydrophobicContact CE-CE 4.34Å; M704-T944 PolarHBondContact N-O 3.24Å; M704-V945 HydrophobicContact CB-CG2 4.36Å; M704-F946 PolarHBondContact O-N 2.89Å
705	V	93.4	Very high	87.4	Confident	2 Å²	2	24.1 Å²	24.1	1%	0.012	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	103.3	177.4	-168.7	0	0	0	0	108.8	C469 F470 V703 F946 K954 V957	C469-V705 HydrophobicContact CB-CG2 4.08Å; F470-V705 PolarHBondContact O-N 2.84Å; V703-V705 HydrophobicContact CG1-CG2 3.98Å; V705-F946 WeakPolarHBondContact CA-O 3.29Å; V705-F946 HydrophobicContact CB-CB 4.46Å; V705-F946 HydrophobicContact CG1-CB 4.09Å; V705-F946 HydrophobicContact CG2-CB 4.38Å; V705-F946 HydrophobicContact CG2-CD2 4.1Å; V705-K954 HydrophobicContact CG1-CB 4.23Å; V705-K954 HydrophobicContact CG1-CG 3.95Å; V705-V957 HydrophobicContact CG2-CG1 4.31Å
706	T	87.3	Confident	87	Confident	1 Å²	1	24.4 Å²	24.4	1%	0.006	13%	0.127	C	C	.	.			trans	-141	158.1	-167	-166.5	0	0	0	0	113.9	D471 K472 M704 D708 S713 F946 A947 R948 F949	D471-T706 VanDerWaalsContact OD1-CA 3.29Å; D471-T706 WeakPolarHBondContact OD1-CA 3.45Å; D471-T706 WeakPolarHBondContact OD1-CB 3.43Å; D471-T706 PolarHBondContact OD1-OG1 2.91Å; K472-T706 HydrophobicContact CB-CG2 4.07Å; M704-T706 HydrophobicContact CG-CG2 4.32Å; M704-T706 HydrophobicContact SD-CG2 4.28Å; T706-D708 VanDerWaalsContact C-N 3.32Å; T706-D708 HydrophobicContact CG2-CB 4.01Å; T706-D708 PolarHBondContact OG1-N 3.47Å; T706-S713 VanDerWaalsContact CG2-OG 3.29Å; T706-S713 WeakPolarHBondContact CG2-OG 3.38Å; T706-F946 PolarHBondContact N-O 3.24Å; T706-A947 CarbonylContact O-C 3.59Å; T706-A947 WeakPolarHBondContact O-CA 3.21Å; T706-R948 PolarHBondContact O-N 3.04Å; T706-R948 VanDerWaalsContact O-N 3.11Å; T706-F949 PolarHBondContact O-N 3.29Å
707	G	77.1	Confident	86.9	Confident	32 Å²	32	20.8 Å²	20.8	33%	0.33	11%	0.113	S	C	.	.	S	Bend	trans	-80.8	-10.6	172.7	0	0	0	0	0	114	R948	G707-R948 WeakPolarHBondContact O-CA 3.41Å; G707-R948 WeakPolarHBondContact O-CD 3.25Å
708	D	75.9	Confident	86.8	Confident	31 Å²	31	17.2 Å²	17.2	17%	0.166	10%	0.095	C	C	.	.	S	Bend	trans	-73.3	170.3	-174.8	-100.6	31.5	0	0	0	114.3	K472 T706 R948	K472-D708 HydrophobicContact CD-CB 4.38Å; K472-D708 WeakPolarHBondContact CE-OD2 3.44Å; K472-D708 IonicContact NZ-OD2 3.53Å; K472-D708 PolarHBondContact NZ-OD2 2.86Å; T706-D708 VanDerWaalsContact C-N 3.32Å; T706-D708 HydrophobicContact CG2-CB 4.01Å; T706-D708 PolarHBondContact OG1-N 3.47Å; D708-R948 PolarHBondContact O-N 3.41Å
709	H	74.3	Confident	86.6	Confident	38 Å²	38	21.2 Å²	21.2	18%	0.176	12%	0.116	C	C	.	.			trans	-66	145.8	178.8	-169.2	-116.3	0	0	0	112.3	L711 S713 F1290	H709-L711 PolarHBondContact O-N 2.92Å; H709-S713 WeakPolarHBondContact O-CB 3.5Å; H709-S713 PolarHBondContact O-N 2.82Å; H709-S713 PolarHBondContact O-OG 3.45Å; H709-F1290 AromaticContact CE1-CD1 3.74Å; H709-F1290 AromaticContact NE2-CD1 3.47Å; H709-F1290 WeakPolarHBondContact NE2-CD1 3.45Å
710	M	81.8	Confident	86.6	Confident	4 Å²	4	15.3 Å²	15.3	2%	0.02	8%	0.084	C	C	.	.	H	α-helix	trans	-65.4	-39.6	-171.2	-174.8	169.8	58.4	0	0	113.5	S713 L714 I731 A919 A947 L1289 F1290	M710-S713 PolarHBondContact O-N 3.05Å; M710-L714 HydrophobicContact CG-CD1 4.11Å; M710-L714 WeakPolarHBondContact O-CB 3.28Å; M710-L714 WeakPolarHBondContact O-CG 3.27Å; M710-L714 PolarHBondContact O-N 2.69Å; M710-I731 HydrophobicContact CE-CD1 3.93Å; M710-I731 HydrophobicContact CE-CG1 4.14Å; M710-I731 HydrophobicContact CE-CG2 3.67Å; M710-I731 HydrophobicContact SD-CG1 4.39Å; M710-I731 HydrophobicContact SD-CG2 4.14Å; M710-A919 HydrophobicContact CG-CB 4.34Å; M710-A919 HydrophobicContact SD-CB 3.96Å; M710-A947 HydrophobicContact CB-CB 3.89Å; M710-A947 HydrophobicContact CG-CB 4.23Å; M710-L1289 HydrophobicContact CE-CD2 4.16Å; M710-F1290 HydrophobicContact CE-CD1 4.33Å; M710-F1290 HydrophobicContact CE-CE1 3.68Å; M710-F1290 HydrophobicContact CE-CZ 4.46Å
711	L	79.2	Confident	86.4	Confident	13 Å²	13	18.6 Å²	18.6	7%	0.068	10%	0.1	C	C	.	.	H	α-helix	trans	-67.6	-47.2	-179.9	-60.4	179.6	0	0	0	111.8	H709 S713 L714 S715 L800 L1282 F1290	H709-L711 PolarHBondContact O-N 2.92Å; L711-S713 VanDerWaalsContact C-N 3.29Å; L711-S713 PolarHBondContact O-N 3.3Å; L711-L714 WeakPolarHBondContact O-CB 3.41Å; L711-L714 PolarHBondContact O-N 3.44Å; L711-L714 VanDerWaalsContact O-N 3.1Å; L711-S715 PolarHBondContact O-N 3.24Å; L711-L800 HydrophobicContact CD2-CD1 4.2Å; L711-L1282 HydrophobicContact CD1-CD2 4.27Å; L711-L1282 HydrophobicContact CD2-CD2 3.97Å; L711-F1290 HydrophobicContact CD1-CE1 4.28Å; L711-F1290 HydrophobicContact CD2-CE1 4.12Å; L711-F1290 HydrophobicContact CG-CE1 4.07Å
712	T	77.6	Confident	86.3	Confident	8 Å²	8	16.9 Å²	16.9	5%	0.049	9%	0.093	C	C	.	.	H	α-helix	trans	-56.7	-44	172.9	-51	0	0	0	0	111.4	L714 S715 V716	T712-L714 VanDerWaalsContact C-N 3.32Å; T712-L714 PolarHBondContact O-N 2.93Å; T712-S715 PolarHBondContact O-N 2.58Å; T712-V716 WeakPolarHBondContact O-CG2 3.46Å; T712-V716 PolarHBondContact O-N 2.98Å
713	S	84	Confident	86	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-63	-37.5	176.9	-55.6	0	0	0	0	112.3	T706 H709 M710 L711 A717	T706-S713 VanDerWaalsContact CG2-OG 3.29Å; T706-S713 WeakPolarHBondContact CG2-OG 3.38Å; H709-S713 WeakPolarHBondContact O-CB 3.5Å; H709-S713 PolarHBondContact O-N 2.82Å; H709-S713 PolarHBondContact O-OG 3.45Å; M710-S713 PolarHBondContact O-N 3.05Å; L711-S713 VanDerWaalsContact C-N 3.29Å; L711-S713 PolarHBondContact O-N 3.3Å; S713-A717 WeakPolarHBondContact O-CB 3.49Å; S713-A717 PolarHBondContact O-N 2.88Å
714	L	86.7	Confident	85.5	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-71	-36.6	176.4	-79.5	168.2	0	0	0	113.3	M710 L711 T712 R718 I723 V729 L800 A919 V945	M710-L714 HydrophobicContact CG-CD1 4.11Å; M710-L714 WeakPolarHBondContact O-CB 3.28Å; M710-L714 WeakPolarHBondContact O-CG 3.27Å; M710-L714 PolarHBondContact O-N 2.69Å; L711-L714 WeakPolarHBondContact O-CB 3.41Å; L711-L714 PolarHBondContact O-N 3.44Å; L711-L714 VanDerWaalsContact O-N 3.1Å; T712-L714 VanDerWaalsContact C-N 3.32Å; T712-L714 PolarHBondContact O-N 2.93Å; L714-R718 PolarHBondContact O-N 3.37Å; L714-I723 HydrophobicContact CD2-CD1 3.79Å; L714-V729 HydrophobicContact CD1-CG1 3.95Å; L714-V729 HydrophobicContact CD2-CG1 3.66Å; L714-V729 HydrophobicContact CD2-CG2 4.16Å; L714-V729 HydrophobicContact CG-CG1 4.48Å; L714-L800 HydrophobicContact CB-CD2 4.31Å; L714-L800 HydrophobicContact CD1-CD1 4.34Å; L714-A919 HydrophobicContact CD1-CB 4.22Å; L714-A919 HydrophobicContact CD2-CB 4.16Å; L714-A919 HydrophobicContact CG-CB 4.47Å; L714-V945 HydrophobicContact CD2-CB 4.37Å; L714-V945 HydrophobicContact CD2-CG2 4.04Å
715	S	83.7	Confident	84.6	Confident	13 Å²	13	25.5 Å²	25.5	9%	0.091	14%	0.135	C	C	.	.	H	α-helix	trans	-62	-57.7	171.6	-165.3	0	0	0	0	109.9	G642 L711 T712 A717 R718 D719	G642-S715 VanDerWaalsContact CA-CB 3.48Å; L711-S715 PolarHBondContact O-N 3.24Å; T712-S715 PolarHBondContact O-N 2.58Å; S715-A717 PolarHBondContact O-N 3Å; S715-A717 VanDerWaalsContact O-N 3.1Å; S715-R718 WeakPolarHBondContact O-CA 3.47Å; S715-R718 WeakPolarHBondContact O-CB 3.23Å; S715-R718 PolarHBondContact O-N 2.71Å; S715-D719 PolarHBondContact O-N 3.04Å; S715-D719 PolarHBondContact OG-OD2 2.98Å
716	V	86.7	Confident	83.7	Confident	5 Å²	5	31.6 Å²	31.6	3%	0.03	17%	0.167	C	C	.	.	H	α-helix	trans	-56.1	-36.3	-179.6	175.8	0	0	0	0	111.8	K472 T477 L684 M704 T712 R718 D719 C720	K472-V716 HydrophobicContact CD-CG2 4.29Å; K472-V716 HydrophobicContact CG-CB 4.32Å; K472-V716 HydrophobicContact CG-CG1 3.93Å; T477-V716 HydrophobicContact CG2-CG1 3.96Å; T477-V716 HydrophobicContact CG2-CG2 4.26Å; L684-V716 HydrophobicContact CD2-CG1 3.82Å; L684-V716 HydrophobicContact CG-CG1 4.29Å; M704-V716 HydrophobicContact CE-CB 4.2Å; M704-V716 HydrophobicContact CE-CG1 3.9Å; T712-V716 WeakPolarHBondContact O-CG2 3.46Å; T712-V716 PolarHBondContact O-N 2.98Å; V716-R718 VanDerWaalsContact C-N 3.32Å; V716-R718 PolarHBondContact O-N 3.38Å; V716-D719 PolarHBondContact O-N 3.46Å; V716-C720 PolarHBondContact O-N 2.8Å; V716-C720 VanDerWaalsContact O-N 3.09Å; V716-C720 PolarHBondContact O-SG 3.14Å
717	A	90.5	Very high	83.4	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-65.1	-29.4	174.7	0	0	0	0	0	113.7	M704 S713 S715 M722 I723 V945	M704-A717 HydrophobicContact CE-CB 3.94Å; S713-A717 WeakPolarHBondContact O-CB 3.49Å; S713-A717 PolarHBondContact O-N 2.88Å; S715-A717 PolarHBondContact O-N 3Å; S715-A717 VanDerWaalsContact O-N 3.1Å; A717-M722 HydrophobicContact CB-CB 4.32Å; A717-M722 CarbonylContact O-C 3.59Å; A717-M722 VanDerWaalsContact O-CA 3.29Å; A717-M722 WeakPolarHBondContact O-CA 3.44Å; A717-M722 WeakPolarHBondContact O-CB 3.29Å; A717-M722 PolarHBondContact O-N 2.63Å; A717-I723 HydrophobicContact CB-CD1 3.94Å; A717-I723 HydrophobicContact CB-CG1 4.15Å; A717-I723 PolarHBondContact O-N 3.32Å; A717-V945 HydrophobicContact CB-CG2 3.87Å
718	R	88.3	Confident	83.6	Confident	38 Å²	38	36.3 Å²	36.3	14%	0.143	18%	0.176	C	C	.	.	H	α-helix	trans	-83.3	-41.9	172.1	-76.7	175.9	169.3	160.8	-13.9	112.7	L714 S715 V716 C720 E721 I723 L800	L714-R718 PolarHBondContact O-N 3.37Å; S715-R718 WeakPolarHBondContact O-CA 3.47Å; S715-R718 WeakPolarHBondContact O-CB 3.23Å; S715-R718 PolarHBondContact O-N 2.71Å; V716-R718 VanDerWaalsContact C-N 3.32Å; V716-R718 PolarHBondContact O-N 3.38Å; R718-C720 PolarHBondContact O-N 2.9Å; R718-E721 WeakPolarHBondContact O-CA 3.25Å; R718-E721 PolarHBondContact O-N 3.34Å; R718-I723 HydrophobicContact CG-CB 3.96Å; R718-I723 HydrophobicContact CG-CG2 4.18Å; R718-L800 PolarHBondContact NH1-O 3.4Å; R718-L800 PolarHBondContact NH2-O 3.05Å
719	D	87.3	Confident	84	Confident	87 Å²	87	35 Å²	35	47%	0.465	17%	0.169	S	C	.	.	H	α-helix	trans	-62	-27.1	-179	-58.4	-40.9	0	0	0	111.6	L684 S715 V716	L684-D719 HydrophobicContact CD1-CB 3.4Å; L684-D719 VanDerWaalsContact CD1-CB 3.4Å; S715-D719 PolarHBondContact O-N 3.04Å; S715-D719 PolarHBondContact OG-OD2 2.98Å; V716-D719 PolarHBondContact O-N 3.46Å
720	C	90.4	Very high	84.5	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	12.8	170.4	73.4	0	0	0	0	115.6	L684 I692 V716 R718 M722	L684-C720 HydrophobicContact CD1-CB 4.09Å; L684-C720 HydrophobicContact CD2-CB 4.01Å; I692-C720 WeakPolarHBondContact CB-O 3.45Å; I692-C720 VanDerWaalsContact CG2-O 3.32Å; I692-C720 WeakPolarHBondContact CG2-O 3.47Å; V716-C720 PolarHBondContact O-N 2.8Å; V716-C720 VanDerWaalsContact O-N 3.09Å; V716-C720 PolarHBondContact O-SG 3.14Å; R718-C720 PolarHBondContact O-N 2.9Å; C720-M722 PolarHBondContact O-N 3.47Å
721	E	90	Very high	84.7	Confident	72 Å²	72	33.1 Å²	33.1	34%	0.336	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	25.4	-176	-54.5	-178.1	-173.6	0	0	115.3	K693 R696 R718	K693-E721 WeakPolarHBondContact CG-OE2 3.32Å; K693-E721 IonicContact NZ-OE1 3.78Å; K693-E721 PolarHBondContact NZ-OE1 2.75Å; K693-E721 IonicContact NZ-OE2 2.95Å; K693-E721 PolarHBondContact NZ-OE2 3.5Å; R696-E721 WeakPolarHBondContact CD-O 3.22Å; R696-E721 PolarHBondContact NH1-O 3.48Å; R718-E721 WeakPolarHBondContact O-CA 3.25Å; R718-E721 PolarHBondContact O-N 3.34Å
722	M	91.7	Very high	85	Confident	2 Å²	2	32.5 Å²	32.5	1%	0.01	16%	0.157	C	C	.	.	S	Bend	trans	-72.4	-38.1	173.5	-168	-174.9	-59.5	0	0	111.6	L476 I692 P702 M704 A717 C720 T944	L476-M722 HydrophobicContact CD1-CE 3.97Å; I692-M722 HydrophobicContact CD1-CE 4.1Å; I692-M722 HydrophobicContact CG2-CB 4.07Å; P702-M722 HydrophobicContact CB-CE 4.3Å; P702-M722 HydrophobicContact CB-CG 3.78Å; P702-M722 HydrophobicContact CB-SD 4.23Å; P702-M722 HydrophobicContact CG-CG 3.63Å; M704-M722 HydrophobicContact CB-CE 4.11Å; M704-M722 HydrophobicContact CB-SD 3.94Å; M704-M722 HydrophobicContact CE-CE 4.34Å; A717-M722 HydrophobicContact CB-CB 4.32Å; A717-M722 CarbonylContact O-C 3.59Å; A717-M722 VanDerWaalsContact O-CA 3.29Å; A717-M722 WeakPolarHBondContact O-CA 3.44Å; A717-M722 WeakPolarHBondContact O-CB 3.29Å; A717-M722 PolarHBondContact O-N 2.63Å; C720-M722 PolarHBondContact O-N 3.47Å; M722-T944 HydrophobicContact CG-CG2 4.18Å; M722-T944 HydrophobicContact SD-CG2 4.16Å
723	I	89.5	Confident	85.3	Confident	2 Å²	2	32.9 Å²	32.9	1%	0.01	16%	0.16	C	C	.	.	S	Bend	trans	-111.8	133.9	166.8	-58.7	175.1	0	0	0	106.4	L714 A717 R718 D727 V729 H917 T944 V945	L714-I723 HydrophobicContact CD2-CD1 3.79Å; A717-I723 HydrophobicContact CB-CD1 3.94Å; A717-I723 HydrophobicContact CB-CG1 4.15Å; A717-I723 PolarHBondContact O-N 3.32Å; R718-I723 HydrophobicContact CG-CB 3.96Å; R718-I723 HydrophobicContact CG-CG2 4.18Å; I723-D727 HydrophobicContact CG2-CB 4.17Å; I723-V729 HydrophobicContact CD1-CG2 4.41Å; I723-V729 HydrophobicContact CG2-CG2 4.3Å; I723-H917 HydrophobicContact CD1-CB 4.3Å; I723-H917 HydrophobicContact CG1-CB 4.4Å; I723-T944 HydrophobicContact CG1-CG2 4.08Å; I723-V945 HydrophobicContact CD1-CG2 4.08Å
724	D	84.7	Confident	85.3	Confident	63 Å²	63	33.6 Å²	33.6	34%	0.337	17%	0.165	S	C	.	.			trans	-74.8	155.9	177.8	-132.1	-71.6	0	0	0	111.7	R696 L726 D727	R696-D724 IonicContact CZ-OD2 2.67Å; R696-D724 IonicContact NH1-OD2 3.15Å; R696-D724 PolarHBondContact NH1-OD2 2.63Å; R696-D724 IonicContact NH2-OD2 2.77Å; R696-D724 PolarHBondContact NH2-OD2 2.67Å; D724-L726 PolarHBondContact O-N 2.77Å; D724-D727 HydrophobicContact CB-CB 4.01Å; D724-D727 VanDerWaalsContact CB-OD2 3.23Å; D724-D727 WeakPolarHBondContact CB-OD2 3.48Å; D724-D727 PolarHBondContact O-N 2.85Å; D724-D727 VanDerWaalsContact O-N 3.14Å
725	E	76.5	Confident	84.9	Confident	124 Å²	124	40.1 Å²	40.1	58%	0.579	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-31	-178.7	-65.5	-168.2	142.3	0	0	112.1	H801 R802	E725-H801 PolarHBondContact O-ND1 3.06Å; E725-H801 VanDerWaalsContact O-ND1 3.15Å; E725-R802 IonicContact OE1-NH1 2.71Å
726	L	75.6	Confident	84.7	Confident	131 Å²	131	42.5 Å²	42.5	69%	0.686	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-15.6	178.9	-59.2	177.3	0	0	0	113.7	D724	D724-L726 PolarHBondContact O-N 2.77Å
727	D	80.7	Confident	84.3	Confident	22 Å²	22	45 Å²	45	12%	0.118	22%	0.221	C	C	.	.	S	Bend	trans	-78.4	142.8	-175.6	-79.1	-22.4	0	0	0	111.2	I723 D724 H801 D915 H917	I723-D727 HydrophobicContact CG2-CB 4.17Å; D724-D727 HydrophobicContact CB-CB 4.01Å; D724-D727 VanDerWaalsContact CB-OD2 3.23Å; D724-D727 WeakPolarHBondContact CB-OD2 3.48Å; D724-D727 PolarHBondContact O-N 2.85Å; D724-D727 VanDerWaalsContact O-N 3.14Å; D727-H801 PolarHBondContact O-CE1 3.12Å; D727-D915 PolarHBondContact OD1-N 3.46Å; D727-H917 IonicContact OD2-NE2 2.7Å; D727-H917 PolarHBondContact OD2-NE2 3.07Å
728	R	80.6	Confident	83.3	Confident	110 Å²	110	49.6 Å²	49.6	42%	0.415	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	132.8	-172	-69.6	-175.3	-178.1	173.4	3.1	111.4	Y796 P914 D915 F916 H917	R728-Y796 HydrophobicContact CB-CE2 3.81Å; R728-Y796 HydrophobicContact CG-CE2 3.8Å; R728-P914 HydrophobicContact CG-CB 4.5Å; R728-P914 HydrophobicContact CG-CG 4.15Å; R728-D915 PolarHBondContact N-O 3.01Å; R728-F916 HydrophobicContact CB-CB 4.05Å; R728-F916 CarbonylContact O-C 2.91Å; R728-F916 VanDerWaalsContact O-CA 3.26Å; R728-F916 WeakPolarHBondContact O-CA 3.35Å; R728-H917 PolarHBondContact O-N 3.31Å
729	V	83.8	Confident	81.8	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.012	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	129.3	173.4	-178.4	0	0	0	0	109.9	L714 I723 A797 A919	L714-V729 HydrophobicContact CD1-CG1 3.95Å; L714-V729 HydrophobicContact CD2-CG1 3.66Å; L714-V729 HydrophobicContact CD2-CG2 4.16Å; L714-V729 HydrophobicContact CG-CG1 4.48Å; I723-V729 HydrophobicContact CD1-CG2 4.41Å; I723-V729 HydrophobicContact CG2-CG2 4.3Å; V729-A797 PolarHBondContact O-N 3.15Å; V729-A919 HydrophobicContact CG1-CB 4.38Å
730	V	85.1	Confident	79.5	Confident	3 Å²	3	55 Å²	55	2%	0.018	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	121.2	175.4	177.3	0	0	0	0	108.7	F794 H795 Y796 H917 L918 A919 L1276	V730-F794 HydrophobicContact CG1-CB 3.81Å; V730-F794 HydrophobicContact CG1-CD1 4.13Å; V730-F794 HydrophobicContact CG1-CG 4.49Å; V730-H795 CarbonylContact C-O 3.52Å; V730-H795 WeakPolarHBondContact CA-O 3.39Å; V730-Y796 HydrophobicContact CG2-CD2 4.49Å; V730-H917 PolarHBondContact N-O 3Å; V730-L918 HydrophobicContact CB-CD2 3.82Å; V730-L918 HydrophobicContact CG1-CD2 3.94Å; V730-L918 CarbonylContact O-C 3.57Å; V730-L918 WeakPolarHBondContact O-CA 3.34Å; V730-A919 PolarHBondContact O-N 2.83Å; V730-L1276 HydrophobicContact CG1-CD2 3.91Å; V730-L1276 HydrophobicContact CG2-CD2 3.85Å
731	I	85.7	Confident	76.9	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	128	178	-64.8	168.9	0	0	0	108.2	M710 H795 A797 A919 L1285 L1289	M710-I731 HydrophobicContact CE-CD1 3.93Å; M710-I731 HydrophobicContact CE-CG1 4.14Å; M710-I731 HydrophobicContact CE-CG2 3.67Å; M710-I731 HydrophobicContact SD-CG1 4.39Å; M710-I731 HydrophobicContact SD-CG2 4.14Å; I731-H795 PolarHBondContact N-O 3.4Å; I731-H795 PolarHBondContact O-N 2.93Å; I731-A797 HydrophobicContact CD1-CB 4.26Å; I731-A919 HydrophobicContact CG1-CB 4.41Å; I731-L1285 HydrophobicContact CD1-CD1 4.02Å; I731-L1289 HydrophobicContact CG2-CD2 3.61Å
732	V	85.6	Confident	74.2	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	135.4	177.9	-171.1	0	0	0	0	109.6	V792 F794 L918 A919 I920 T924 I928 L939	V732-V792 HydrophobicContact CG1-CG1 4.28Å; V732-F794 HydrophobicContact CG1-CD1 4.45Å; V732-F794 HydrophobicContact CG1-CE1 4.09Å; V732-F794 HydrophobicContact CG1-CZ 4.39Å; V732-F794 HydrophobicContact CG2-CD1 3.88Å; V732-F794 HydrophobicContact CG2-CE1 3.83Å; V732-L918 HydrophobicContact CG2-CB 4.16Å; V732-L918 HydrophobicContact CG2-CD1 4.33Å; V732-L918 HydrophobicContact CG2-CD2 4.17Å; V732-L918 HydrophobicContact CG2-CG 4.45Å; V732-A919 PolarHBondContact N-O 3.14Å; V732-I920 HydrophobicContact CB-CG1 4.16Å; V732-I920 HydrophobicContact CG2-CD1 4.39Å; V732-I920 HydrophobicContact CG2-CG1 4.03Å; V732-T924 HydrophobicContact CG1-CG2 4.48Å; V732-I928 HydrophobicContact CG1-CD1 4.18Å; V732-L939 HydrophobicContact CG1-CD2 4.25Å; V732-L939 HydrophobicContact CG2-CD2 4.14Å
733	T	83.3	Confident	71.2	Confident	17 Å²	17	67.2 Å²	67.2	10%	0.104	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	152.3	169.7	50.7	0	0	0	0	110.1	V792 Q793 H795 L1289	T733-V792 CarbonylContact O-C 3.57Å; T733-V792 VanDerWaalsContact O-CA 3.31Å; T733-V792 WeakPolarHBondContact O-CA 3.42Å; T733-V792 WeakPolarHBondContact O-CG1 3.41Å; T733-Q793 PolarHBondContact N-O 2.98Å; T733-Q793 PolarHBondContact O-N 3.45Å; T733-Q793 WeakPolarHBondContact OG1-CB 3.43Å; T733-Q793 PolarHBondContact OG1-O 3.43Å; T733-Q793 VanDerWaalsContact OG1-O 3.12Å; T733-H795 WeakPolarHBondContact CB-NE2 3.46Å; T733-H795 WeakPolarHBondContact CG2-NE2 3.24Å; T733-H795 PolarHBondContact OG1-CD2 3.16Å; T733-H795 PolarHBondContact OG1-NE2 2.59Å; T733-L1289 HydrophobicContact CG2-CD1 3.79Å; T733-L1289 HydrophobicContact CG2-CD2 3.43Å; T733-L1289 VanDerWaalsContact CG2-CD2 3.43Å; T733-L1289 HydrophobicContact CG2-CG 3.64Å
734	A	83.8	Confident	68.6	Low	14 Å²	14	77.7 Å²	77.7	12%	0.116	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	141.6	171	0	0	0	0	0	109.9	L791 V792 T924 V927 I928	A734-L791 CarbonylContact C-O 3.57Å; A734-L791 WeakPolarHBondContact CA-O 3.34Å; A734-V792 HydrophobicContact CB-CG1 4.45Å; A734-V792 HydrophobicContact CB-CG2 4.01Å; A734-T924 HydrophobicContact CB-CG2 4.03Å; A734-V927 HydrophobicContact CB-CB 4.33Å; A734-V927 HydrophobicContact CB-CG1 3.87Å; A734-I928 HydrophobicContact CB-CD1 3.98Å; A734-I928 HydrophobicContact CB-CG1 3.52Å
735	R	80.1	Confident	65.9	Low	138 Å²	138	78.7 Å²	78.7	52%	0.521	44%	0.442	S	S	.	.			trans	-112.8	145.2	168.9	-68.7	179.7	172.9	172.6	-3.8	109	L791 Y932	R735-L791 HydrophobicContact CB-CD2 4.46Å; R735-L791 PolarHBondContact N-O 2.99Å; R735-Y932 WeakPolarHBondContact O-CE2 3.45Å; R735-Y932 PolarHBondContact O-OH 2.97Å
736	P	79.2	Confident	63.6	Low	63 Å²	63	78.7 Å²	78.7	41%	0.409	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-61.3	148.6	171.3	28.4	-34.9	0	0	0	109.9
737	P	77.3	Confident	61.3	Low	57 Å²	57	81.2 Å²	81.2	37%	0.37	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-63.9	143.1	174.3	28.2	-33.3	0	0	0	109.8	C739 L791 H931	P737-C739 PolarHBondContact O-N 3.35Å; P737-L791 HydrophobicContact CB-CD1 4.46Å; P737-H931 HydrophobicContact CG-CB 4.47Å
738	P	69.3	Low	59	Low	97 Å²	97	86.3 Å²	86.3	63%	0.63	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-59.4	132.2	177.8	24.4	-33.2	0	0	0	110.4
739	C	57.3	Low	56.6	Low	98 Å²	98	88.1 Å²	88.1	66%	0.662	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-58.6	130.6	-179.3	-67.8	0	0	0	0	110.4	P737 G741	P737-C739 PolarHBondContact O-N 3.35Å; C739-G741 VanDerWaalsContact C-N 3.33Å; C739-G741 PolarHBondContact O-N 3.42Å
740	P	39.9	Very low	53.9	Low	141 Å²	141	95.2 Å²	95.2	92%	0.916	55%	0.55	S	S	*	*	S	Bend	trans	-69.5	91.3	176.8	28	-33.7	0	0	0	110.2
741	G	34.6	Very low	51.2	Low	59 Å²	59	103.8 Å²	103.8	61%	0.608	59%	0.59	S	S	*	*	S	Bend	trans	131.2	78.1	179.9	0	0	0	0	0	113.3	C739	C739-G741 VanDerWaalsContact C-N 3.33Å; C739-G741 PolarHBondContact O-N 3.42Å
742	N	34	Very low	48.6	Very low	125 Å²	125	111 Å²	111	67%	0.668	63%	0.629	S	S	*	*	S	Bend	trans	-167.8	-24.7	144.5	-99.7	-15.4	0	0	0	113.4	F744	N742-F744 PolarHBondContact O-N 2.87Å
743	D	29.3	Very low	45.9	Very low	146 Å²	146	120.3 Å²	120.3	78%	0.781	67%	0.672	S	S	*	*	S	Bend	trans	-93.2	71.5	-179.7	-64.5	-37.1	0	0	0	113.1
744	F	34	Very low	43.4	Very low	221 Å²	221	124.8 Å²	124.8	97%	0.969	70%	0.702	S	S	*	*	S	Bend	trans	-148.6	33.3	159.4	-111.5	-72.8	0	0	0	111.3	N742	N742-F744 PolarHBondContact O-N 2.87Å
745	A	29.2	Very low	40.8	Very low	85 Å²	85	131.7 Å²	131.7	70%	0.702	74%	0.735	S	S	*	*	S	Bend	trans	-156.7	47.6	-176.7	0	0	0	0	0	114
746	S	27.4	Very low	38.4	Very low	123 Å²	123	130.6 Å²	130.6	86%	0.86	75%	0.746	S	S	*	*	S	Bend	trans	-156.2	41.2	170.2	-80.7	0	0	0	0	114.1
747	E	28	Very low	36	Very low	185 Å²	185	133.7 Å²	133.7	86%	0.864	76%	0.764	S	S	*	*	S	Bend	trans	-148.4	140.6	159	-122	171.3	-168.6	0	0	109.3
748	V	31.1	Very low	33.8	Very low	128 Å²	128	136.9 Å²	136.9	78%	0.776	78%	0.784	S	S	*	*	S	Bend	trans	81.1	109.2	175.4	-170.3	0	0	0	0	118.1
749	L	29.5	Very low	31.8	Very low	148 Å²	148	139.4 Å²	139.4	78%	0.775	79%	0.792	S	S	*	*			trans	81.1	111.7	149.6	-73	166.8	0	0	0	123.4
750	N	28.7	Very low	30.5	Very low	151 Å²	151	141.9 Å²	141.9	81%	0.807	81%	0.805	S	S	*	*			trans	26	127.9	132.5	-71	-7.7	0	0	0	121.2	N752	N750-N752 PolarHBondContact O-N 3.35Å
751	E	28.2	Very low	30	Very low	183 Å²	183	138.2 Å²	138.2	86%	0.855	79%	0.792	S	S	*	*			trans	-63	126.8	160.8	-61.7	176.7	132.4	0	0	112
752	N	30.4	Very low	29.5	Very low	153 Å²	153	145.6 Å²	145.6	82%	0.818	81%	0.808	S	S	*	*				163.4	97.4	123.6	-85.9	-47.6	0	0	0	112.8	N750	N750-N752 PolarHBondContact O-N 3.35Å
753	Q	29.8	Very low	29.1	Very low	194 Å²	194	144.9 Å²	144.9	91%	0.907	81%	0.813	S	S	*	*				167.2	146.7	129.1	-91.2	176.7	6.3	0	0	111.5
754	P	31.1	Very low	28.9	Very low	112 Å²	112	144.1 Å²	144.1	73%	0.727	81%	0.813	S	S	*	*			trans	-106.2	-170.2	-173.1	38.8	-31.4	0	0	0	115.1
755	I	29	Very low	28.3	Very low	159 Å²	159	142 Å²	142	82%	0.815	81%	0.807	S	S	*	*			trans	99.2	138.9	167.8	-50.7	150.1	0	0	0	114.2
756	P	29.1	Very low	28.4	Very low	114 Å²	114	145 Å²	145	74%	0.74	82%	0.816	S	S	*	*			cis	-134.2	-175.2	-46.9	39.9	-19.5	0	0	0	113.5
757	V	29.5	Very low	28.3	Very low	129 Å²	129	146.3 Å²	146.3	78%	0.782	81%	0.814	S	S	*	*			trans	-96.4	150.7	174.7	-165.5	0	0	0	0	111.8
758	P	30	Very low	28.4	Very low	124 Å²	124	143.8 Å²	143.8	81%	0.805	81%	0.813	S	S	*	*			trans	-128.8	151.9	142.9	33.8	-21.2	0	0	0	114.8
759	N	27.8	Very low	28	Very low	149 Å²	149	142.6 Å²	142.6	80%	0.797	81%	0.811	S	S	*	*			trans	-89	176.8	-171.5	-82.2	-37.2	0	0	0	115.3
760	T	31	Very low	27.7	Very low	151 Å²	151	145.4 Å²	145.4	93%	0.926	82%	0.817	S	S	*	*			trans	109.5	135.7	159.4	67.3	0	0	0	0	115.6
761	G	27.6	Very low	27.8	Very low	63 Å²	63	146.5 Å²	146.5	65%	0.649	82%	0.821	S	S	*	*			cis	166	143	-13	0	0	0	0	0	113.2
762	F	24.6	Very low	27.6	Very low	214 Å²	214	146.3 Å²	146.3	94%	0.939	82%	0.82	S	S	*	*			trans	62.4	158.8	170.7	-72.9	-88.1	0	0	0	117
763	S	26.4	Very low	27.5	Very low	110 Å²	110	146 Å²	146	77%	0.769	82%	0.818	S	S	*	*			cis	-154.9	-172.6	-1.4	40.2	0	0	0	0	111.5
764	T	24.1	Very low	27.7	Very low	130 Å²	130	142.4 Å²	142.4	80%	0.798	81%	0.812	S	S	*	*			trans	-85.7	170.7	-163.4	44.1	0	0	0	0	118.6
765	E	23.1	Very low	27.6	Very low	177 Å²	177	144.3 Å²	144.3	83%	0.827	81%	0.814	S	S	*	*			trans	96.2	120.3	158.8	-57	-161	159.6	0	0	120.2
766	T	30.6	Very low	27.5	Very low	148 Å²	148	144.1 Å²	144.1	91%	0.908	82%	0.815	S	S	*	*				-170.3	151.3	126.8	15.9	0	0	0	0	113
767	N	25.7	Very low	27.6	Very low	151 Å²	151	143.5 Å²	143.5	81%	0.807	82%	0.82	S	S	*	*			trans	-83.2	143	-173.6	-73.5	-80.3	0	0	0	114.5
768	P	28.9	Very low	27.5	Very low	131 Å²	131	140.3 Å²	140.3	85%	0.851	81%	0.813	S	S	*	*			trans	-94.5	98.9	165	34.3	-28.8	0	0	0	111.7
769	S	22.3	Very low	27.3	Very low	103 Å²	103	142.5 Å²	142.5	72%	0.72	82%	0.818	S	S	*	*			trans	-148.2	75	166.9	63.1	0	0	0	0	113.6
770	K	24.8	Very low	27.5	Very low	207 Å²	207	142.4 Å²	142.4	90%	0.9	82%	0.817	S	S	*	*			trans	177.5	99.9	158.4	-103.2	164.6	-178.9	-177.1	0	109.9
771	I	30.4	Very low	27.6	Very low	175 Å²	175	142.5 Å²	142.5	90%	0.897	81%	0.805	S	S	*	*			trans	-137	110.1	153.7	-60.8	-176.5	0	0	0	106.8
772	Q	24.5	Very low	27.8	Very low	179 Å²	179	145.8 Å²	145.8	84%	0.836	81%	0.807	S	S	*	*			trans	-152.2	105.6	173.6	-160	168.4	16.3	0	0	106.3
773	D	26.5	Very low	28.2	Very low	146 Å²	146	144.7 Å²	144.7	78%	0.781	80%	0.803	S	S	*	*			trans	63.1	142.6	-175	-52.8	-33.6	0	0	0	114.7
774	P	35.6	Very low	29	Very low	118 Å²	118	142.1 Å²	142.1	77%	0.766	78%	0.784	S	S	*	*				-141	151.2	71.9	36.8	-19.1	0	0	0	117
775	I	29	Very low	30	Very low	152 Å²	152	139.7 Å²	139.7	78%	0.779	77%	0.766	S	S	*	*			trans	-86.7	145	150.4	-67.6	170.4	0	0	0	107.3
776	N	26.4	Very low	31.1	Very low	155 Å²	155	136.7 Å²	136.7	83%	0.829	76%	0.756	S	S	*	*			trans	88.5	87	-177.5	-57.8	-21	0	0	0	116.7
777	A	31.3	Very low	32	Very low	102 Å²	102	135.2 Å²	135.2	84%	0.843	74%	0.742	S	S	*	*			trans	-141.2	138.4	142.3	0	0	0	0	0	107.7
778	G	26	Very low	33.2	Very low	62 Å²	62	130.3 Å²	130.3	64%	0.639	72%	0.715	S	S	*	*			trans	-85.2	170.1	-177.2	0	0	0	0	0	114	N780	G778-N780 PolarHBondContact O-N 3.09Å
779	D	27.6	Very low	34.4	Very low	170 Å²	170	127.1 Å²	127.1	91%	0.909	69%	0.691	S	S	*	*	S	Bend	trans	57.4	40.5	151.5	-52.5	-18	0	0	0	118.6
780	N	30.7	Very low	36.2	Very low	146 Å²	146	125.1 Å²	125.1	78%	0.781	68%	0.677	S	S	*	*			trans	-147.1	21.1	166.4	-111.9	-21.6	0	0	0	115.7	G778	G778-N780 PolarHBondContact O-N 3.09Å
781	K	33.6	Very low	38.3	Very low	153 Å²	153	116.6 Å²	116.6	67%	0.665	64%	0.641	S	S	*	*			trans	-85.3	-28	-176.5	-78.2	-168.1	171.1	-170.7	0	116.1	F783 S784 D785	K781-F783 PolarHBondContact O-N 3.12Å; K781-S784 PolarHBondContact O-N 3.43Å; K781-S784 PolarHBondContact O-OG 3.33Å; K781-S784 VanDerWaalsContact O-OG 3.06Å; K781-D785 PolarHBondContact O-N 3Å
782	N	32.2	Very low	40.2	Very low	132 Å²	132	108.5 Å²	108.5	71%	0.706	60%	0.6	S	S	*	*	H	α-helix	trans	-70.6	-31.5	-167	-63.4	4.3	0	0	0	112.9	D786	N782-D786 PolarHBondContact O-N 2.73Å
783	F	32	Very low	42.7	Very low	192 Å²	192	101.7 Å²	101.7	84%	0.842	57%	0.568	S	S	*	*	H	α-helix	trans	-77.5	-26.8	-177.1	-130.4	-89.2	0	0	0	113.8	K781	K781-F783 PolarHBondContact O-N 3.12Å
784	S	44.3	Very low	45.1	Very low	55 Å²	55	94.9 Å²	94.9	39%	0.385	53%	0.532	S	S	.	.	H	α-helix	trans	-78.8	-39.8	174.1	55.1	0	0	0	0	112	K781 L787 I788	K781-S784 PolarHBondContact O-N 3.43Å; K781-S784 PolarHBondContact O-OG 3.33Å; K781-S784 VanDerWaalsContact O-OG 3.06Å; S784-L787 PolarHBondContact O-N 3.11Å; S784-I788 WeakPolarHBondContact O-CB 3.3Å; S784-I788 WeakPolarHBondContact O-CD1 3.3Å; S784-I788 VanDerWaalsContact O-CG1 3.23Å; S784-I788 WeakPolarHBondContact O-CG1 3.37Å; S784-I788 PolarHBondContact O-N 2.85Å
785	D	44.5	Very low	47	Very low	79 Å²	79	90.3 Å²	90.3	42%	0.422	50%	0.5	S	S	.	.	H	α-helix	trans	-68	-37.8	-174.7	-73.3	-4.6	0	0	0	111.4	K781 I788 N789	K781-D785 PolarHBondContact O-N 3Å; D785-I788 PolarHBondContact O-N 2.97Å; D785-N789 VanDerWaalsContact O-CB 3.31Å; D785-N789 WeakPolarHBondContact O-CB 3.34Å; D785-N789 PolarHBondContact O-N 2.86Å; D785-N789 PolarHBondContact O-ND2 2.8Å
786	D	46.5	Very low	48.9	Very low	115 Å²	115	84.8 Å²	84.8	62%	0.615	47%	0.469	S	S	*	.	H	α-helix	trans	-67.8	-40.2	176.6	-76.9	-20.6	0	0	0	113.1	N782 N789 S790	N782-D786 PolarHBondContact O-N 2.73Å; D786-N789 PolarHBondContact O-N 3.3Å; D786-S790 PolarHBondContact O-N 2.94Å
787	L	48.9	Very low	50.9	Low	116 Å²	116	77.6 Å²	77.6	61%	0.607	43%	0.432	S	S	*	.	H	α-helix	trans	-65.7	-39.7	175	-166.9	73.2	0	0	0	111.3	S784 S790 L791	S784-L787 PolarHBondContact O-N 3.11Å; L787-S790 WeakPolarHBondContact O-CB 3.23Å; L787-S790 PolarHBondContact O-N 3.14Å; L787-S790 PolarHBondContact O-OG 3.27Å; L787-L791 WeakPolarHBondContact O-CG 3.18Å; L787-L791 PolarHBondContact O-N 2.73Å
788	I	52.3	Low	52.2	Low	48 Å²	48	77.1 Å²	77.1	25%	0.246	41%	0.412	C	S	.	.	H	α-helix	trans	-67.2	-40.7	176.5	-68.8	165.4	0	0	0	111	S784 D785 S790 L791 V792 W934	S784-I788 WeakPolarHBondContact O-CB 3.3Å; S784-I788 WeakPolarHBondContact O-CD1 3.3Å; S784-I788 VanDerWaalsContact O-CG1 3.23Å; S784-I788 WeakPolarHBondContact O-CG1 3.37Å; S784-I788 PolarHBondContact O-N 2.85Å; D785-I788 PolarHBondContact O-N 2.97Å; I788-S790 PolarHBondContact O-N 3Å; I788-L791 PolarHBondContact O-N 2.88Å; I788-L791 VanDerWaalsContact O-N 3.1Å; I788-V792 PolarHBondContact O-N 3.01Å; I788-W934 HydrophobicContact CD1-CZ2 4.35Å; I788-W934 HydrophobicContact CG2-CZ2 4.35Å
789	N	53.5	Low	53.6	Low	65 Å²	65	76.3 Å²	76.3	35%	0.348	39%	0.393	S	S	.	.	H	α-helix	trans	-63.7	-26.6	174.1	-70.6	-29.6	0	0	0	112.4	D785 D786	D785-N789 VanDerWaalsContact O-CB 3.31Å; D785-N789 WeakPolarHBondContact O-CB 3.34Å; D785-N789 PolarHBondContact O-N 2.86Å; D785-N789 PolarHBondContact O-ND2 2.8Å; D786-N789 PolarHBondContact O-N 3.3Å
790	S	58.9	Low	55	Low	60 Å²	60	68.8 Å²	68.8	42%	0.42	35%	0.353	S	S	.	.	H	α-helix	trans	-73.2	-29.6	172.7	84.9	0	0	0	0	113.5	D786 L787 I788 Q793	D786-S790 PolarHBondContact O-N 2.94Å; L787-S790 WeakPolarHBondContact O-CB 3.23Å; L787-S790 PolarHBondContact O-N 3.14Å; L787-S790 PolarHBondContact O-OG 3.27Å; I788-S790 PolarHBondContact O-N 3Å; S790-Q793 WeakPolarHBondContact O-CG 3.34Å; S790-Q793 PolarHBondContact O-NE2 3.19Å
791	L	69.5	Low	56	Low	29 Å²	29	64.1 Å²	64.1	15%	0.152	33%	0.326	C	S	.	.	H	α-helix	trans	-89.5	-29.9	-175.8	-68.9	168.1	0	0	0	113	A734 R735 P737 L787 I788 Y932	A734-L791 CarbonylContact C-O 3.57Å; A734-L791 WeakPolarHBondContact CA-O 3.34Å; R735-L791 HydrophobicContact CB-CD2 4.46Å; R735-L791 PolarHBondContact N-O 2.99Å; P737-L791 HydrophobicContact CB-CD1 4.46Å; L787-L791 WeakPolarHBondContact O-CG 3.18Å; L787-L791 PolarHBondContact O-N 2.73Å; I788-L791 PolarHBondContact O-N 2.88Å; I788-L791 VanDerWaalsContact O-N 3.1Å; L791-Y932 WeakPolarHBondContact CD1-OH 3.18Å
792	V	70	Confident	56.5	Low	4 Å²	4	65.6 Å²	65.6	2%	0.024	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	101.7	172.9	-175.5	0	0	0	0	109.6	V732 T733 A734 I788 F794 Y932 L935	V732-V792 HydrophobicContact CG1-CG1 4.28Å; T733-V792 CarbonylContact O-C 3.57Å; T733-V792 VanDerWaalsContact O-CA 3.31Å; T733-V792 WeakPolarHBondContact O-CA 3.42Å; T733-V792 WeakPolarHBondContact O-CG1 3.41Å; A734-V792 HydrophobicContact CB-CG1 4.45Å; A734-V792 HydrophobicContact CB-CG2 4.01Å; I788-V792 PolarHBondContact O-N 3.01Å; V792-F794 HydrophobicContact CG1-CE2 4.09Å; V792-F794 HydrophobicContact CG1-CZ 4.35Å; V792-Y932 HydrophobicContact CG2-CD1 4.1Å; V792-Y932 HydrophobicContact CG2-CD2 3.93Å; V792-Y932 HydrophobicContact CG2-CE1 4.24Å; V792-Y932 HydrophobicContact CG2-CE2 4.07Å; V792-Y932 HydrophobicContact CG2-CG 3.97Å; V792-L935 HydrophobicContact CG1-CD2 3.77Å
793	Q	77.5	Confident	56.6	Low	36 Å²	36	64 Å²	64	17%	0.168	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	143.9	-171.4	-52.9	174.3	2.6	0	0	111.6	T733 S790 H795 L1277	T733-Q793 PolarHBondContact N-O 2.98Å; T733-Q793 PolarHBondContact O-N 3.45Å; T733-Q793 WeakPolarHBondContact OG1-CB 3.43Å; T733-Q793 PolarHBondContact OG1-O 3.43Å; T733-Q793 VanDerWaalsContact OG1-O 3.12Å; S790-Q793 WeakPolarHBondContact O-CG 3.34Å; S790-Q793 PolarHBondContact O-NE2 3.19Å; Q793-H795 VanDerWaalsContact CB-NE2 3.31Å; Q793-H795 WeakPolarHBondContact CB-NE2 3.28Å; Q793-H795 PolarHBondContact OE1-CE1 3.48Å; Q793-H795 PolarHBondContact OE1-NE2 3.35Å; Q793-L1277 HydrophobicContact CB-CD1 3.92Å; Q793-L1277 HydrophobicContact CG-CD1 4.09Å
794	F	77.6	Confident	56.3	Low	4 Å²	4	61.2 Å²	61.2	2%	0.018	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	105.3	179.6	-65.3	-97.8	0	0	0	109.2	V730 V732 V792 L918 L935 L939 W1273 P1274 P1275 L1276 L1277	V730-F794 HydrophobicContact CG1-CB 3.81Å; V730-F794 HydrophobicContact CG1-CD1 4.13Å; V730-F794 HydrophobicContact CG1-CG 4.49Å; V732-F794 HydrophobicContact CG1-CD1 4.45Å; V732-F794 HydrophobicContact CG1-CE1 4.09Å; V732-F794 HydrophobicContact CG1-CZ 4.39Å; V732-F794 HydrophobicContact CG2-CD1 3.88Å; V732-F794 HydrophobicContact CG2-CE1 3.83Å; V792-F794 HydrophobicContact CG1-CE2 4.09Å; V792-F794 HydrophobicContact CG1-CZ 4.35Å; F794-L918 HydrophobicContact CD1-CD2 4.34Å; F794-L935 HydrophobicContact CZ-CD2 4.13Å; F794-L939 HydrophobicContact CE1-CD2 4.2Å; F794-L939 HydrophobicContact CZ-CD2 4.48Å; F794-W1273 HydrophobicContact CE1-CZ2 4.27Å; F794-W1273 HydrophobicContact CZ-CZ2 4.35Å; F794-P1274 HydrophobicContact CB-CB 3.9Å; F794-P1274 HydrophobicContact CD1-CB 3.49Å; F794-P1274 VanDerWaalsContact CD1-CB 3.49Å; F794-P1274 HydrophobicContact CD2-CB 4.26Å; F794-P1274 HydrophobicContact CE1-CB 4.04Å; F794-P1274 HydrophobicContact CG-CB 3.62Å; F794-P1275 HydrophobicContact CD2-CG 3.79Å; F794-P1275 HydrophobicContact CE2-CG 4.09Å; F794-L1276 HydrophobicContact CB-CD2 4.33Å; F794-L1277 PolarHBondContact O-N 3Å
795	H	74.1	Confident	55.4	Low	21 Å²	21	63.8 Å²	63.8	10%	0.097	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	125.8	-176.1	-54.9	-84.1	0	0	0	110.4	V730 I731 T733 Q793 L1285	V730-H795 CarbonylContact C-O 3.52Å; V730-H795 WeakPolarHBondContact CA-O 3.39Å; I731-H795 PolarHBondContact N-O 3.4Å; I731-H795 PolarHBondContact O-N 2.93Å; T733-H795 WeakPolarHBondContact CB-NE2 3.46Å; T733-H795 WeakPolarHBondContact CG2-NE2 3.24Å; T733-H795 PolarHBondContact OG1-CD2 3.16Å; T733-H795 PolarHBondContact OG1-NE2 2.59Å; Q793-H795 VanDerWaalsContact CB-NE2 3.31Å; Q793-H795 WeakPolarHBondContact CB-NE2 3.28Å; Q793-H795 PolarHBondContact OE1-CE1 3.48Å; Q793-H795 PolarHBondContact OE1-NE2 3.35Å; H795-L1285 HydrophobicContact CB-CD2 3.5Å; H795-L1285 VanDerWaalsContact CB-CD2 3.5Å; H795-L1285 VanDerWaalsContact CG-CD2 3.47Å
796	Y	69.5	Low	54.6	Low	36 Å²	36	69 Å²	69	14%	0.141	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	124.2	173.5	179.2	-132.4	0	0	0	110.3	R728 V730 E798 H801	R728-Y796 HydrophobicContact CB-CE2 3.81Å; R728-Y796 HydrophobicContact CG-CE2 3.8Å; V730-Y796 HydrophobicContact CG2-CD2 4.49Å; Y796-E798 HydrophobicContact CD1-CG 3.45Å; Y796-E798 VanDerWaalsContact CD1-CG 3.45Å; Y796-E798 HydrophobicContact CE1-CG 3.24Å; Y796-E798 WeakPolarHBondContact CE1-OE1 3.2Å; Y796-E798 HydrophobicContact CG-CG 4.42Å; Y796-E798 PolarHBondContact O-N 3.41Å; Y796-H801 PolarHBondContact OH-NE2 2.88Å
797	A	68.2	Low	53.7	Low	5 Å²	5	69.4 Å²	69.4	4%	0.041	37%	0.365	C	S	.	.			trans	-94.7	81.5	-176.2	0	0	0	0	0	111.5	V729 I731 D799 L800	V729-A797 PolarHBondContact O-N 3.15Å; I731-A797 HydrophobicContact CD1-CB 4.26Å; A797-D799 VanDerWaalsContact C-N 3.32Å; A797-D799 PolarHBondContact O-N 3.2Å; A797-L800 HydrophobicContact CB-CB 4.35Å; A797-L800 HydrophobicContact CB-CD1 3.69Å; A797-L800 PolarHBondContact O-N 3.29Å
798	E	59.5	Low	52.6	Low	92 Å²	92	68 Å²	68	43%	0.43	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-60.6	-42.2	178.5	-73.5	179.8	170	0	0	111.8	Y796 L800 H801 S1279	Y796-E798 HydrophobicContact CD1-CG 3.45Å; Y796-E798 VanDerWaalsContact CD1-CG 3.45Å; Y796-E798 HydrophobicContact CE1-CG 3.24Å; Y796-E798 WeakPolarHBondContact CE1-OE1 3.2Å; Y796-E798 HydrophobicContact CG-CG 4.42Å; Y796-E798 PolarHBondContact O-N 3.41Å; E798-L800 PolarHBondContact O-N 3Å; E798-H801 PolarHBondContact O-N 2.96Å; E798-H801 VanDerWaalsContact O-N 3.08Å; E798-S1279 VanDerWaalsContact OE2-CB 3.27Å; E798-S1279 WeakPolarHBondContact OE2-CB 3.38Å
799	D	54.8	Low	51.2	Low	45 Å²	45	71.1 Å²	71.1	24%	0.241	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-68.9	17.5	176.1	-71.2	-42.5	0	0	0	115	R640 A797 S1281 L1282	R640-D799 WeakPolarHBondContact CD-O 3.49Å; R640-D799 VanDerWaalsContact CZ-C 3.46Å; R640-D799 PolarHBondContact NE-O 2.98Å; R640-D799 PolarHBondContact NH1-O 3.27Å; R640-D799 IonicContact NH1-OD1 3.91Å; R640-D799 PolarHBondContact NH2-O 2.95Å; A797-D799 VanDerWaalsContact C-N 3.32Å; A797-D799 PolarHBondContact O-N 3.2Å; D799-S1281 WeakPolarHBondContact OD2-CA 3.2Å; D799-S1281 WeakPolarHBondContact OD2-CB 3.27Å; D799-L1282 HydrophobicContact CB-CB 3.87Å; D799-L1282 HydrophobicContact CB-CD1 3.9Å; D799-L1282 HydrophobicContact CB-CG 4.23Å; D799-L1282 PolarHBondContact OD2-N 3.38Å
800	L	56.1	Low	49.9	Very low	12 Å²	12	73.6 Å²	73.6	6%	0.063	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-109.6	-16.8	166.8	-96.5	135.1	0	0	0	112.2	L711 L714 R718 A797 E798 L1282	L711-L800 HydrophobicContact CD2-CD1 4.2Å; L714-L800 HydrophobicContact CB-CD2 4.31Å; L714-L800 HydrophobicContact CD1-CD1 4.34Å; R718-L800 PolarHBondContact NH1-O 3.4Å; R718-L800 PolarHBondContact NH2-O 3.05Å; A797-L800 HydrophobicContact CB-CB 4.35Å; A797-L800 HydrophobicContact CB-CD1 3.69Å; A797-L800 PolarHBondContact O-N 3.29Å; E798-L800 PolarHBondContact O-N 3Å; L800-L1282 HydrophobicContact CD1-CD1 3.87Å; L800-L1282 HydrophobicContact CG-CD1 4.17Å
801	H	53.4	Low	48.3	Very low	48 Å²	48	77.3 Å²	77.3	22%	0.222	42%	0.424	C	S	.	.	S	Bend	trans	-67.5	139.6	169.7	-75.8	-56.3	0	0	0	110.5	R640 E725 D727 Y796 E798	R640-H801 PolarHBondContact NH2-O 3.31Å; E725-H801 PolarHBondContact O-ND1 3.06Å; E725-H801 VanDerWaalsContact O-ND1 3.15Å; D727-H801 PolarHBondContact O-CE1 3.12Å; Y796-H801 PolarHBondContact OH-NE2 2.88Å; E798-H801 PolarHBondContact O-N 2.96Å; E798-H801 VanDerWaalsContact O-N 3.08Å
802	R	44	Very low	46.2	Very low	184 Å²	184	83.4 Å²	83.4	69%	0.694	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-65.2	134.6	158.9	-82.3	-178	169.5	157.7	-2.4	107.3	E725 V804	E725-R802 IonicContact OE1-NH1 2.71Å; R802-V804 PolarHBondContact O-N 3.31Å
803	P	32.5	Very low	44.3	Very low	97 Å²	97	91 Å²	91	63%	0.63	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-62	137.5	175.8	27	-33.7	0	0	0	109.6	T805	P803-T805 PolarHBondContact O-N 3.13Å
804	V	27.1	Very low	41.8	Very low	135 Å²	135	97 Å²	97	82%	0.818	52%	0.523	S	S	*	.	S	Bend	trans	-77.9	65.5	178.4	-173.6	0	0	0	0	109.3	R802	R802-V804 PolarHBondContact O-N 3.31Å
805	T	25.8	Very low	39.3	Very low	108 Å²	108	107.1 Å²	107.1	66%	0.663	57%	0.566	S	S	*	*			trans	-146.8	59.2	-178.5	53.5	0	0	0	0	111.4	P803	P803-T805 PolarHBondContact O-N 3.13Å
806	E	27.4	Very low	37	Very low	189 Å²	189	116.7 Å²	116.7	88%	0.883	60%	0.602	S	S	*	*			trans	-165.8	61.7	141.8	-111.1	177	-152.1	0	0	111.2	A808	E806-A808 PolarHBondContact O-N 3.04Å; E806-A808 VanDerWaalsContact O-N 3.16Å
807	V	26	Very low	34.9	Very low	124 Å²	124	121.8 Å²	121.8	75%	0.752	63%	0.631	S	S	*	*			trans	-64.3	112.2	143.5	173.3	0	0	0	0	104.8	T809	V807-T809 VanDerWaalsContact C-N 3.26Å; V807-T809 PolarHBondContact O-N 2.99Å
808	A	25.9	Very low	33.1	Very low	85 Å²	85	129.2 Å²	129.2	70%	0.702	67%	0.67	S	S	*	*			trans	-59.8	91.2	175	0	0	0	0	0	109.8	E806 T810	E806-A808 PolarHBondContact O-N 3.04Å; E806-A808 VanDerWaalsContact O-N 3.16Å; A808-T810 PolarHBondContact O-N 2.86Å
809	T	24.6	Very low	31.5	Very low	114 Å²	114	130.1 Å²	130.1	70%	0.699	68%	0.682	S	S	*	*			trans	-65.8	92	164.4	37.9	0	0	0	0	106.9	V807 N811	V807-T809 VanDerWaalsContact C-N 3.26Å; V807-T809 PolarHBondContact O-N 2.99Å; T809-N811 PolarHBondContact O-N 2.93Å
810	T	26	Very low	30.2	Very low	118 Å²	118	137 Å²	137	72%	0.724	71%	0.709	S	S	*	*			trans	-53.7	109.7	163.5	34.2	0	0	0	0	107.4	A808 I812	A808-T810 PolarHBondContact O-N 2.86Å; T810-I812 PolarHBondContact O-N 3.32Å
811	N	24.6	Very low	29	Very low	137 Å²	137	141.9 Å²	141.9	73%	0.733	74%	0.74	S	S	*	*			trans	-65.3	82.1	-178.3	-98.2	-45.9	0	0	0	110.2	T809 Q813	T809-N811 PolarHBondContact O-N 2.93Å; N811-Q813 PolarHBondContact O-N 3.43Å; N811-Q813 VanDerWaalsContact O-N 3.15Å
812	I	26.2	Very low	27.8	Very low	158 Å²	158	145.9 Å²	145.9	81%	0.81	76%	0.763	S	S	*	*			trans	-85.4	67.1	159.7	-53.5	-177.1	0	0	0	106.9	T810 L814	T810-I812 PolarHBondContact O-N 3.32Å; I812-L814 PolarHBondContact O-N 3.13Å
813	Q	28.6	Very low	27	Very low	163 Å²	163	143.3 Å²	143.3	76%	0.762	76%	0.763	S	S	*	*			trans	-67.5	104	162.9	-83.8	-171.1	-20.1	0	0	108.6	N811 K815	N811-Q813 PolarHBondContact O-N 3.43Å; N811-Q813 VanDerWaalsContact O-N 3.15Å; Q813-K815 PolarHBondContact O-N 3.3Å
814	L	25	Very low	26.8	Very low	163 Å²	163	148.6 Å²	148.6	85%	0.853	77%	0.77	S	S	*	*			trans	21.3	88.3	135.3	-91.1	149.5	0	0	0	116.2	I812	I812-L814 PolarHBondContact O-N 3.13Å
815	K	25.5	Very low	26.9	Very low	215 Å²	215	148.4 Å²	148.4	94%	0.935	76%	0.761	S	S	*	*			trans	-131	85.6	145.2	-108.1	-177	-179.7	177.6	0	110.3	Q813	Q813-K815 PolarHBondContact O-N 3.3Å
816	R	26.7	Very low	27.1	Very low	223 Å²	223	149.8 Å²	149.8	84%	0.842	77%	0.769	S	S	*	*			trans	-124.7	103	166.1	-135.9	-178.4	-169.8	160.4	3.1	108.8
817	N	25.4	Very low	27.2	Very low	143 Å²	143	146.4 Å²	146.4	77%	0.765	77%	0.766	S	S	*	*			trans	140.5	110.7	140.8	-69.7	-10.3	0	0	0	112.7
818	L	29.8	Very low	27.2	Very low	161 Å²	161	149.9 Å²	149.9	84%	0.843	77%	0.771	S	S	*	*			trans	164.7	77	150.2	-90.6	160.7	0	0	0	104.1
819	T	25.6	Very low	27.6	Very low	111 Å²	111	151.2 Å²	151.2	68%	0.681	77%	0.772	S	S	*	*				56.1	127	90.5	68.3	0	0	0	0	114.8
820	K	28.1	Very low	27.8	Very low	189 Å²	189	150.5 Å²	150.5	82%	0.822	77%	0.772	S	S	*	*			trans	98	122.4	159.6	-65.3	-175.5	174	179.9	0	118.9
821	T	30	Very low	28	Very low	115 Å²	115	153.7 Å²	153.7	71%	0.706	78%	0.776	S	S	*	*			trans	76.8	102.8	137	51.7	0	0	0	0	120.5
822	D	28.5	Very low	28.3	Very low	131 Å²	131	155.5 Å²	155.5	70%	0.701	78%	0.778	S	S	*	*				80.6	109.5	114.3	-71.7	22.4	0	0	0	122.1
823	N	27.3	Very low	28.3	Very low	130 Å²	130	156.5 Å²	156.5	70%	0.695	78%	0.777	S	S	*	*				91.6	130.7	118.2	-77.3	-35.1	0	0	0	121.6
824	R	29.3	Very low	28.3	Very low	208 Å²	208	158.4 Å²	158.4	79%	0.785	78%	0.777	S	S	*	*			trans	71.8	146.2	152	-67.5	179.8	155	150.8	3.3	117.3
825	E	29.3	Very low	28.5	Very low	132 Å²	132	156.6 Å²	156.6	62%	0.617	77%	0.765	S	S	*	*			cis	-161.8	147.7	-5.6	-121.6	155.9	-162.3	0	0	111
826	T	28.4	Very low	28.5	Very low	137 Å²	137	153.7 Å²	153.7	84%	0.84	76%	0.755	S	S	*	*			trans	58.7	147.5	156.5	61.7	0	0	0	0	119.6
827	S	30.4	Very low	28.6	Very low	117 Å²	117	148.2 Å²	148.2	82%	0.818	75%	0.747	S	S	*	*			cis	-147.4	153.4	20	53.9	0	0	0	0	114.3
828	K	26	Very low	28.6	Very low	197 Å²	197	152.1 Å²	152.1	86%	0.857	75%	0.751	S	S	*	*			trans	-101.1	174	164.9	-89.4	-179.9	-178.6	175.8	0	108.4
829	P	35.2	Very low	28.6	Very low	113 Å²	113	155 Å²	155	73%	0.734	76%	0.757	S	S	*	*			cis	-138.8	163.9	40.8	22.8	4.9	0	0	0	115.6
830	S	28.2	Very low	28.5	Very low	99 Å²	99	152.3 Å²	152.3	69%	0.692	75%	0.751	S	S	*	*			cis	84.4	120.2	47.7	103.9	0	0	0	0	116.2
831	F	29.7	Very low	28.7	Very low	185 Å²	185	154.2 Å²	154.2	81%	0.811	76%	0.759	S	S	*	*			trans	-179.3	137.3	149.5	-120.4	-108.2	0	0	0	107.3
832	F	30.9	Very low	28.6	Very low	175 Å²	175	151.8 Å²	151.8	77%	0.768	76%	0.757	S	S	*	*			cis	-151.8	179.1	-8.4	-144.7	-113.1	0	0	0	111.8
833	K	27.2	Very low	28.5	Very low	180 Å²	180	157.1 Å²	157.1	78%	0.783	77%	0.767	S	S	*	*			trans	-124.1	175.8	-165	-160.6	-177.5	-175.5	179	0	113
834	R	28.6	Very low	28.6	Very low	203 Å²	203	157.2 Å²	157.2	77%	0.766	77%	0.767	S	S	*	*			trans	77.5	158.9	159	-106	179.2	172	170.4	-4.6	116.8
835	M	27.4	Very low	28.6	Very low	124 Å²	124	155.9 Å²	155.9	61%	0.611	77%	0.77	S	S	*	*			cis	-150.5	138.9	-4.1	-156.2	149.9	177.7	0	0	107.7
836	E	26	Very low	28.6	Very low	154 Å²	154	155.1 Å²	155.1	72%	0.72	78%	0.779	S	S	*	*				71.1	123.1	67.5	-123.8	-170.4	165.2	0	0	118.4
837	T	28.5	Very low	28.6	Very low	109 Å²	109	153.9 Å²	153.9	67%	0.669	78%	0.776	S	S	*	*			trans	91.8	117.8	152.4	61.6	0	0	0	0	125.9
838	R	25.3	Very low	28.6	Very low	224 Å²	224	153.2 Å²	153.2	85%	0.845	77%	0.771	S	S	*	*			trans	67.9	110.7	130.7	-70.4	-179.1	173.9	175.6	-0.9	123.3
839	F	30.1	Very low	28.7	Very low	223 Å²	223	153.6 Å²	153.6	98%	0.978	77%	0.773	S	S	*	*				-168.8	169.4	114.5	-91.7	-64.1	0	0	0	108.6
840	G	24.6	Very low	28.3	Very low	53 Å²	53	154.6 Å²	154.6	55%	0.546	78%	0.777	S	S	.	*			cis	167.5	122	-12.1	0	0	0	0	0	112.9
841	F	31.4	Very low	28.1	Very low	229 Å²	229	157.2 Å²	157.2	100%	1.004	78%	0.782	S	S	*	*			trans	61.4	145	179.7	-67.3	-92.4	0	0	0	117.4
842	G	28.2	Very low	27.8	Very low	64 Å²	64	154.3 Å²	154.3	66%	0.66	78%	0.78	S	S	*	*			cis	168.1	140.2	-12.9	0	0	0	0	0	113.9
843	R	27.3	Very low	27.6	Very low	243 Å²	243	150.7 Å²	150.7	92%	0.917	78%	0.782	S	S	*	*			trans	68.9	146.7	173.1	-65	179.9	170.1	174.4	-2.8	116.5
844	L	28.4	Very low	27.3	Very low	132 Å²	132	149.6 Å²	149.6	69%	0.691	78%	0.784	S	S	*	*			cis	-156.9	148.4	-1.9	-121.3	161.2	0	0	0	111.6
845	Q	29.4	Very low	27.4	Very low	181 Å²	181	146 Å²	146	85%	0.846	79%	0.787	S	S	*	*			trans	73.6	141.2	152.1	-97.1	166	-11.7	0	0	124.2
846	S	29.6	Very low	27.3	Very low	116 Å²	116	145.4 Å²	145.4	81%	0.811	79%	0.79	S	S	*	*			trans	81.3	112.3	166.5	-153	0	0	0	0	120.9
847	S	28.7	Very low	27.3	Very low	111 Å²	111	145.6 Å²	145.6	78%	0.776	80%	0.795	S	S	*	*			trans	-41.2	149.1	153.1	-160.9	0	0	0	0	112.2
848	S	30.4	Very low	27.2	Very low	102 Å²	102	145.2 Å²	145.2	71%	0.713	79%	0.793	S	S	*	*			cis	-154.1	148.1	30.9	170.9	0	0	0	0	111
849	K	26.7	Very low	27.2	Very low	206 Å²	206	141.6 Å²	141.6	90%	0.896	79%	0.79	S	S	*	*			trans	-78.9	135.3	-179.5	-70.8	177.7	177.5	176.8	0	112.3
850	V	27.1	Very low	27.1	Very low	133 Å²	133	136.9 Å²	136.9	81%	0.806	79%	0.785	S	S	*	*			trans	-135	111.1	162.6	177.8	0	0	0	0	109.2
851	L	24.9	Very low	27.3	Very low	154 Å²	154	138.5 Å²	138.5	81%	0.806	79%	0.793	S	S	*	*			trans	-160.5	135.1	151.9	-139.5	85.5	0	0	0	111.2
852	T	23.5	Very low	27	Very low	125 Å²	125	133.8 Å²	133.8	77%	0.767	78%	0.777	S	S	*	*			trans	44.6	115.6	154	48.5	0	0	0	0	121
853	A	25.9	Very low	26.9	Very low	98 Å²	98	139.6 Å²	139.6	81%	0.81	78%	0.78	S	S	*	*				-173.1	161.8	115.7	0	0	0	0	0	112.2
854	L	21.9	Very low	26.9	Very low	157 Å²	157	136.2 Å²	136.2	82%	0.822	78%	0.775	S	S	*	*			trans	-58.4	160.3	168.6	-82.9	67.2	0	0	0	112
855	P	30.9	Very low	26.8	Very low	127 Å²	127	133.2 Å²	133.2	83%	0.825	77%	0.769	S	S	*	*				-141.5	154.6	122.6	37.5	-25.6	0	0	0	115.3
856	T	24.7	Very low	26.7	Very low	112 Å²	112	131.9 Å²	131.9	69%	0.687	77%	0.768	S	S	*	*			trans	-129	132.6	166.5	32.7	0	0	0	0	109.5
857	L	25.5	Very low	26.6	Very low	158 Å²	158	130.9 Å²	130.9	83%	0.827	76%	0.761	S	S	*	*			trans	58.4	145.6	146	-82.8	86.9	0	0	0	118.9
858	V	26.4	Very low	26.6	Very low	101 Å²	101	133 Å²	133	61%	0.612	76%	0.758	S	S	*	*			cis	-165.9	156.5	6.6	91.6	0	0	0	0	112.3
859	N	25	Very low	26.5	Very low	148 Å²	148	135.4 Å²	135.4	79%	0.791	76%	0.756	S	S	*	*			trans	56	161.6	158.5	-59.6	-16.9	0	0	0	119.6
860	S	29.6	Very low	26.6	Very low	124 Å²	124	131.1 Å²	131.1	87%	0.867	75%	0.747	S	S	*	*			cis	-143.4	-175.4	11.1	53.1	0	0	0	0	113
861	A	27	Very low	26.7	Very low	87 Å²	87	131.3 Å²	131.3	72%	0.719	74%	0.743	S	S	*	*			trans	-101.1	147.4	-162.9	0	0	0	0	0	117.1
862	I	25.4	Very low	26.8	Very low	131 Å²	131	129.9 Å²	129.9	67%	0.672	74%	0.736	S	S	*	*			trans	20.1	120.3	140	-29.7	172.1	0	0	0	119.1
863	Y	27.1	Very low	27.3	Very low	185 Å²	185	131.5 Å²	131.5	73%	0.725	74%	0.735	S	S	*	*				173.1	131.5	101.8	-97.1	-60.7	0	0	0	117.1
864	H	26.7	Very low	27.4	Very low	172 Å²	172	131.5 Å²	131.5	80%	0.796	73%	0.725	S	S	*	*			trans	55.3	151.3	153.3	-70.1	-52.6	0	0	0	120.4
865	A	27.4	Very low	27.8	Very low	69 Å²	69	130.6 Å²	130.6	57%	0.57	72%	0.721	S	S	*	*			cis	-149.9	169.2	10.5	0	0	0	0	0	113.4
866	D	27.1	Very low	27.8	Very low	154 Å²	154	133.9 Å²	133.9	82%	0.824	72%	0.719	S	S	*	*			trans	64.2	147	146	-57.6	-18.4	0	0	0	121.5
867	S	26.7	Very low	28	Very low	95 Å²	95	134.6 Å²	134.6	66%	0.664	71%	0.714	S	S	*	*			cis	-167.8	166.2	-13	53.8	0	0	0	0	111.3
868	E	28.3	Very low	28	Very low	154 Å²	154	135.4 Å²	135.4	72%	0.72	71%	0.711	S	S	*	*			trans	65.8	152.8	165	-61.6	-163.9	139.3	0	0	118.1
869	K	29	Very low	28.2	Very low	153 Å²	153	136.3 Å²	136.3	67%	0.665	72%	0.72	S	S	*	*			cis	-154.1	129.3	3	-121.3	153.5	-175.8	148.6	0	106.8
870	V	29	Very low	28.2	Very low	117 Å²	117	136.8 Å²	136.8	71%	0.709	72%	0.722	S	S	*	*				98.5	145.1	86.6	158.2	0	0	0	0	114.4
871	D	29.6	Very low	28	Very low	136 Å²	136	140.4 Å²	140.4	73%	0.727	72%	0.722	S	S	*	*			trans	72.5	146	169.6	-68.9	-27.9	0	0	0	120.7
872	N	27.3	Very low	28	Very low	124 Å²	124	143.1 Å²	143.1	66%	0.663	73%	0.725	S	S	*	*			cis	-167.9	179.4	-34.4	-132.7	-41.3	0	0	0	110
873	H	32.1	Very low	28.3	Very low	160 Å²	160	145.6 Å²	145.6	74%	0.741	73%	0.731	S	S	*	*			trans	73.3	110.5	172.5	-69.6	-70.8	0	0	0	117.6
874	T	27.9	Very low	28.4	Very low	98 Å²	98	144.8 Å²	144.8	60%	0.601	74%	0.738	S	S	*	*				91	112.1	51.9	63.1	0	0	0	0	114.1
875	D	32.2	Very low	28.4	Very low	138 Å²	138	142.7 Å²	142.7	74%	0.738	73%	0.733	S	S	*	*				-179.9	136	105.7	-87.9	-21.3	0	0	0	114.9
876	Y	29.5	Very low	28.5	Very low	196 Å²	196	146.9 Å²	146.9	77%	0.769	74%	0.738	S	S	*	*			trans	9.4	160.9	146.6	-65.6	-91.9	0	0	0	122
877	E	28.4	Very low	28.8	Very low	127 Å²	127	147.5 Å²	147.5	59%	0.593	74%	0.736	S	S	*	*			cis	179.3	149.5	-33.5	-114.2	-156.5	139.8	0	0	106.1
878	K	26.7	Very low	28.7	Very low	175 Å²	175	150 Å²	150	76%	0.761	74%	0.741	S	S	*	*			trans	38.3	123.7	142.6	-67.7	175	178.3	147.1	0	122.6
879	C	29.5	Very low	28.8	Very low	120 Å²	120	148 Å²	148	81%	0.811	74%	0.735	S	S	*	*				-163.9	141	102.1	-137.8	0	0	0	0	107.2
880	L	25.5	Very low	28.9	Very low	158 Å²	158	148.2 Å²	148.2	83%	0.827	74%	0.736	S	S	*	*			cis	-154.5	123	47.5	-175.3	77.4	0	0	0	110.8
881	F	25.2	Very low	28.7	Very low	199 Å²	199	147.1 Å²	147.1	87%	0.873	73%	0.733	S	S	*	*			trans	-88.1	148.4	148.5	-100.3	-103.8	0	0	0	107
882	D	27.6	Very low	28.8	Very low	144 Å²	144	147.7 Å²	147.7	77%	0.77	74%	0.737	S	S	*	*				-179.6	165.2	106.4	-141.5	-15.7	0	0	0	113.9
883	K	32.4	Very low	28.6	Very low	183 Å²	183	147.7 Å²	147.7	80%	0.796	74%	0.741	S	S	*	*			trans	76.1	125.1	177.6	-57.4	177.8	-178.6	176.5	0	115
884	L	28.6	Very low	28.5	Very low	169 Å²	169	149.1 Å²	149.1	89%	0.885	75%	0.745	S	S	*	*			cis	-140.9	159.4	11.7	-151.7	75.3	0	0	0	112
885	D	25.7	Very low	28.4	Very low	127 Å²	127	153.1 Å²	153.1	68%	0.679	75%	0.754	S	S	*	*			trans	-124.5	172.5	-164.2	175.1	36.9	0	0	0	111.7
886	K	30.6	Very low	28	Very low	157 Å²	157	157.4 Å²	157.4	68%	0.683	76%	0.762	S	S	*	*			trans	78.8	140.6	170.1	-46.6	172.2	-176.6	175.2	0	115.6
887	H	32.1	Very low	27.8	Very low	168 Å²	168	156.7 Å²	156.7	78%	0.778	76%	0.763	S	S	*	*			cis	-135.1	146.1	13.5	-85.9	-95.5	0	0	0	109
888	L	25.6	Very low	27.9	Very low	148 Å²	148	157.1 Å²	157.1	78%	0.775	77%	0.769	S	S	*	*				55.1	108.9	57.3	-82	164	0	0	0	113.6
889	D	29.6	Very low	28.1	Very low	110 Å²	110	154.1 Å²	154.1	59%	0.588	77%	0.77	S	S	*	*				-178.8	158.5	72.5	-134.9	-14.4	0	0	0	112.9
890	K	31.4	Very low	28	Very low	159 Å²	159	156 Å²	156	69%	0.691	77%	0.771	S	S	*	*			trans	51.5	123	151.9	-70.2	148.6	-167.9	154.5	0	121.3
891	S	25.4	Very low	28.2	Very low	93 Å²	93	157.2 Å²	157.2	65%	0.65	77%	0.772	S	S	*	*				68.5	132.1	75.9	101.7	0	0	0	0	112.9
892	D	31.2	Very low	28.2	Very low	149 Å²	149	154.2 Å²	154.2	80%	0.797	77%	0.765	S	S	*	*			cis	-142.8	168.9	16.2	-82.5	-67.9	0	0	0	114.6
893	T	24.3	Very low	28.2	Very low	123 Å²	123	159 Å²	159	76%	0.755	77%	0.773	S	S	*	*			trans	-68.2	147.1	-173.3	45.9	0	0	0	0	117.2
894	F	30.3	Very low	28	Very low	190 Å²	190	159.9 Å²	159.9	83%	0.833	77%	0.772	S	S	*	*			trans	-154.2	118.3	131	-114.4	-79.1	0	0	0	114.2
895	K	25	Very low	27.8	Very low	182 Å²	182	157.3 Å²	157.3	79%	0.791	77%	0.768	S	S	*	*			trans	3.5	121.9	163.9	-59.8	173.9	178.5	178.1	0	119.9
896	Y	24.4	Very low	27.8	Very low	228 Å²	228	157.9 Å²	157.9	89%	0.894	77%	0.77	S	S	*	*				179.9	94.7	102.9	-154.5	-88.3	0	0	0	112.5
897	K	25.2	Very low	27.5	Very low	182 Å²	182	155.8 Å²	155.8	79%	0.791	78%	0.776	S	S	*	*			trans	-175.5	157.6	143.9	-114.8	-170.3	171.1	-169.1	0	115.6
898	D	29.1	Very low	27.2	Very low	135 Å²	135	153.5 Å²	153.5	72%	0.722	77%	0.768	S	S	*	*			trans	68.2	109.9	159.5	-58.8	-7	0	0	0	119.4
899	S	31.4	Very low	27.1	Very low	112 Å²	112	157.5 Å²	157.5	78%	0.783	77%	0.773	S	S	*	*			trans	-67.8	153.1	173.7	42.9	0	0	0	0	113.6	E901	S899-E901 PolarHBondContact O-N 3.37Å
900	I	26.6	Very low	26.9	Very low	160 Å²	160	159.3 Å²	159.3	82%	0.821	78%	0.779	S	S	*	*			trans	-48.5	126.9	163.4	-62.9	154.2	0	0	0	110.6
901	E	30.1	Very low	26.8	Very low	183 Å²	183	159.4 Å²	159.4	86%	0.855	79%	0.786	S	S	*	*			trans	-150.5	139.7	154	-130.5	172.3	-145	0	0	112.4	S899 R903	S899-E901 PolarHBondContact O-N 3.37Å; E901-R903 PolarHBondContact O-N 2.92Å
902	N	26.8	Very low	27.3	Very low	136 Å²	136	162 Å²	162	73%	0.727	79%	0.792	S	S	*	*			trans	-70.7	115.5	-169.6	-75.2	-48.8	0	0	0	112.2	Y904	N902-Y904 VanDerWaalsContact C-N 3.27Å; N902-Y904 HydrophobicContact CB-CD2 4.22Å; N902-Y904 HydrophobicContact CB-CE2 4.27Å; N902-Y904 PolarHBondContact O-N 2.96Å
903	R	26.6	Very low	28	Very low	246 Å²	246	163 Å²	163	93%	0.928	79%	0.785	S	S	*	*			trans	-75.6	80.5	165.1	-67	-169.3	-160.6	167	8.4	111.2	E901 S905	E901-R903 PolarHBondContact O-N 2.92Å; R903-S905 PolarHBondContact O-N 3.11Å
904	Y	27.5	Very low	29.4	Very low	200 Å²	200	159.5 Å²	159.5	78%	0.784	76%	0.764	S	S	*	*			trans	-61.3	112.5	145.3	-74.4	-83.6	0	0	0	107.3	N902 L906	N902-Y904 VanDerWaalsContact C-N 3.27Å; N902-Y904 HydrophobicContact CB-CD2 4.22Å; N902-Y904 HydrophobicContact CB-CE2 4.27Å; N902-Y904 PolarHBondContact O-N 2.96Å; Y904-L906 PolarHBondContact O-N 3.08Å
905	S	25.9	Very low	31.2	Very low	115 Å²	115	152.9 Å²	152.9	80%	0.804	74%	0.738	S	S	*	*			trans	-72.6	75.4	170.1	61	0	0	0	0	108.8	R903 S907	R903-S905 PolarHBondContact O-N 3.11Å; S905-S907 VanDerWaalsContact C-N 3.28Å; S905-S907 PolarHBondContact O-N 2.98Å
906	L	23.8	Very low	33.9	Very low	139 Å²	139	145.8 Å²	145.8	73%	0.728	71%	0.707	S	S	*	*			trans	-65.6	92.5	174	-163.5	77.9	0	0	0	107.4	Y904 I908	Y904-L906 PolarHBondContact O-N 3.08Å; L906-I908 HydrophobicContact CD2-CD1 3.78Å; L906-I908 HydrophobicContact CD2-CG1 3.79Å; L906-I908 HydrophobicContact CG-CG1 4Å; L906-I908 PolarHBondContact O-N 3.02Å
907	S	24.2	Very low	36.9	Very low	113 Å²	113	136.2 Å²	136.2	79%	0.79	67%	0.67	S	S	*	*			trans	-73.7	70.8	177.5	64.1	0	0	0	0	109.5	S905 R909	S905-S907 VanDerWaalsContact C-N 3.28Å; S905-S907 PolarHBondContact O-N 2.98Å; S907-R909 PolarHBondContact O-N 3.46Å
908	I	26.4	Very low	40	Very low	121 Å²	121	127.6 Å²	127.6	62%	0.621	63%	0.633	S	S	*	*			trans	-63.2	91.2	162.3	-56.7	178.2	0	0	0	105.8	L906 M910	L906-I908 HydrophobicContact CD2-CD1 3.78Å; L906-I908 HydrophobicContact CD2-CG1 3.79Å; L906-I908 HydrophobicContact CG-CG1 4Å; L906-I908 PolarHBondContact O-N 3.02Å; I908-M910 HydrophobicContact CG2-CG 3.97Å; I908-M910 PolarHBondContact O-N 3.29Å
909	R	24.2	Very low	43	Very low	232 Å²	232	121.2 Å²	121.2	88%	0.875	60%	0.599	S	S	*	*			trans	-58.7	99.2	146.4	-80.3	-174	176.1	-179.2	0.5	104.7	S907 I911	S907-R909 PolarHBondContact O-N 3.46Å; R909-I911 PolarHBondContact O-N 2.67Å
910	M	25.5	Very low	45.8	Very low	147 Å²	147	115.9 Å²	115.9	72%	0.724	56%	0.561	S	S	*	*			trans	-57	110.3	164.1	-74.7	-168.9	-69.5	0	0	105.3	I908 D912	I908-M910 HydrophobicContact CG2-CG 3.97Å; I908-M910 PolarHBondContact O-N 3.29Å; M910-D912 PolarHBondContact O-N 3.21Å
911	I	29.4	Very low	48.8	Very low	161 Å²	161	108.7 Å²	108.7	83%	0.826	53%	0.525	S	S	*	.			trans	-53.1	136.1	164.1	-66.7	171	0	0	0	105.8	R909 R913	R909-I911 PolarHBondContact O-N 2.67Å; I911-R913 PolarHBondContact O-N 3.16Å
912	D	35.5	Very low	51.4	Low	148 Å²	148	100 Å²	100	79%	0.791	49%	0.485	S	S	*	.			trans	-44.1	134.8	-169.8	-70.7	-67.3	0	0	0	111.7	M910	M910-D912 PolarHBondContact O-N 3.21Å
913	R	46.1	Very low	54	Low	170 Å²	170	97.7 Å²	97.7	64%	0.642	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-55.7	126.1	170.3	-69.1	179.5	174.6	-178.2	-3.6	106.8	I911 D915 A1270	I911-R913 PolarHBondContact O-N 3.16Å; R913-D915 PolarHBondContact O-N 2.88Å; R913-A1270 VanDerWaalsContact NH1-CB 3.34Å; R913-A1270 PolarHBondContact NH1-O 2.67Å
914	P	52.8	Low	57	Low	49 Å²	49	86.5 Å²	86.5	32%	0.318	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-56	136.5	179	23.3	-33.6	0	0	0	109	R728	R728-P914 HydrophobicContact CG-CB 4.5Å; R728-P914 HydrophobicContact CG-CG 4.15Å
915	D	69.2	Low	60	Low	51 Å²	51	77 Å²	77	27%	0.273	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-67.2	155	178.9	-151	-9.9	0	0	0	107.8	D727 R728 R913 K942 R1263	D727-D915 PolarHBondContact OD1-N 3.46Å; R728-D915 PolarHBondContact N-O 3.01Å; R913-D915 PolarHBondContact O-N 2.88Å; D915-K942 IonicContact OD1-NZ 2.62Å; D915-K942 PolarHBondContact OD1-NZ 3.36Å; D915-K942 IonicContact OD2-NZ 2.69Å; D915-R1263 IonicContact OD2-CZ 3.2Å; D915-R1263 IonicContact OD2-NH2 2.69Å; D915-R1263 PolarHBondContact OD2-NH2 3.28Å
916	F	80.9	Confident	62.8	Low	34 Å²	34	74.1 Å²	74.1	15%	0.149	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	140.7	-176.4	71.4	-88.9	0	0	0	111.4	R728 L918 K942 I1266 W1273 P1274	R728-F916 HydrophobicContact CB-CB 4.05Å; R728-F916 CarbonylContact O-C 2.91Å; R728-F916 VanDerWaalsContact O-CA 3.26Å; R728-F916 WeakPolarHBondContact O-CA 3.35Å; F916-L918 HydrophobicContact CD2-CD2 4.08Å; F916-L918 HydrophobicContact CE2-CD2 4.01Å; F916-L918 HydrophobicContact CE2-CG 4.45Å; F916-K942 HydrophobicContact CE2-CB 4.42Å; F916-K942 HydrophobicContact CE2-CD 4.25Å; F916-K942 HydrophobicContact CE2-CG 4.2Å; F916-K942 HydrophobicContact CZ-CD 4.19Å; F916-K942 HydrophobicContact CZ-CG 4.29Å; F916-I1266 HydrophobicContact CE1-CG2 4.23Å; F916-I1266 HydrophobicContact CZ-CG2 3.81Å; F916-W1273 HydrophobicContact CE2-CZ3 4.08Å; F916-W1273 HydrophobicContact CZ-CE3 4.21Å; F916-W1273 AromaticContact CZ-CZ3 3.84Å; F916-W1273 HydrophobicContact CZ-CZ3 3.84Å; F916-P1274 HydrophobicContact CD2-CG 4.41Å; F916-P1274 HydrophobicContact CE2-CG 3.94Å; F916-P1274 VanDerWaalsContact CZ-CD 3.47Å; F916-P1274 HydrophobicContact CZ-CG 4.26Å
917	H	87.8	Confident	65.8	Low	27 Å²	27	68.8 Å²	68.8	13%	0.125	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	132.7	-178.4	-65.8	-106.6	0	0	0	108.9	I723 D727 R728 V730 T944	I723-H917 HydrophobicContact CD1-CB 4.3Å; I723-H917 HydrophobicContact CG1-CB 4.4Å; D727-H917 IonicContact OD2-NE2 2.7Å; D727-H917 PolarHBondContact OD2-NE2 3.07Å; R728-H917 PolarHBondContact O-N 3.31Å; V730-H917 PolarHBondContact N-O 3Å; H917-T944 WeakPolarHBondContact ND1-CB 3.15Å; H917-T944 WeakPolarHBondContact ND1-CG2 3.47Å; H917-T944 PolarHBondContact ND1-OG1 3.4Å
918	L	90.6	Very high	68.8	Low	1 Å²	1	63.4 Å²	63.4	1%	0.005	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	139.1	171.9	-52.9	176.2	0	0	0	110.2	V730 V732 F794 F916 L939 K942 G943 T944 V945 W1273	V730-L918 HydrophobicContact CB-CD2 3.82Å; V730-L918 HydrophobicContact CG1-CD2 3.94Å; V730-L918 CarbonylContact O-C 3.57Å; V730-L918 WeakPolarHBondContact O-CA 3.34Å; V732-L918 HydrophobicContact CG2-CB 4.16Å; V732-L918 HydrophobicContact CG2-CD1 4.33Å; V732-L918 HydrophobicContact CG2-CD2 4.17Å; V732-L918 HydrophobicContact CG2-CG 4.45Å; F794-L918 HydrophobicContact CD1-CD2 4.34Å; F916-L918 HydrophobicContact CD2-CD2 4.08Å; F916-L918 HydrophobicContact CE2-CD2 4.01Å; F916-L918 HydrophobicContact CE2-CG 4.45Å; L918-L939 HydrophobicContact CD1-CD2 3.79Å; L918-K942 HydrophobicContact CD1-CB 3.94Å; L918-K942 HydrophobicContact CG-CB 3.93Å; L918-K942 PolarHBondContact N-O 2.82Å; L918-K942 VanDerWaalsContact N-O 3.15Å; L918-G943 WeakPolarHBondContact O-CA 3.49Å; L918-T944 PolarHBondContact O-N 3.23Å; L918-V945 PolarHBondContact O-N 2.95Å; L918-W1273 HydrophobicContact CD1-CH2 4.04Å
919	A	91.2	Very high	71.7	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	135.1	167.3	0	0	0	0	0	109.6	M710 L714 V729 V730 I731 V732 V945	M710-A919 HydrophobicContact CG-CB 4.34Å; M710-A919 HydrophobicContact SD-CB 3.96Å; L714-A919 HydrophobicContact CD1-CB 4.22Å; L714-A919 HydrophobicContact CD2-CB 4.16Å; L714-A919 HydrophobicContact CG-CB 4.47Å; V729-A919 HydrophobicContact CG1-CB 4.38Å; V730-A919 PolarHBondContact O-N 2.83Å; I731-A919 HydrophobicContact CG1-CB 4.41Å; V732-A919 PolarHBondContact N-O 3.14Å; A919-V945 WeakPolarHBondContact CA-O 3.15Å; A919-V945 HydrophobicContact CB-CB 4.44Å
920	I	91.6	Very high	74.6	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	134.8	-172.5	-49.2	-176	0	0	0	109.5	V732 T924 W925 L939 V945 F946 A947	V732-I920 HydrophobicContact CB-CG1 4.16Å; V732-I920 HydrophobicContact CG2-CD1 4.39Å; V732-I920 HydrophobicContact CG2-CG1 4.03Å; I920-T924 HydrophobicContact CG2-CG2 4.16Å; I920-W925 HydrophobicContact CG2-CB 4.42Å; I920-L939 HydrophobicContact CD1-CB 3.91Å; I920-L939 HydrophobicContact CD1-CD1 4.32Å; I920-L939 HydrophobicContact CD1-CD2 4.03Å; I920-L939 HydrophobicContact CD1-CG 4.3Å; I920-V945 PolarHBondContact N-O 3.03Å; I920-F946 HydrophobicContact CB-CD1 4.26Å; I920-F946 HydrophobicContact CD1-CE1 4Å; I920-F946 WeakPolarHBondContact O-CA 3.45Å; I920-A947 PolarHBondContact O-N 3.08Å
921	S	88.8	Confident	77.4	Confident	9 Å²	9	53.2 Å²	53.2	6%	0.063	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	151.3	173.5	65.2	0	0	0	0	112.7	K923 T924 W925 A947	S921-K923 VanDerWaalsContact C-N 3.29Å; S921-K923 PolarHBondContact O-N 2.91Å; S921-T924 WeakPolarHBondContact O-CB 3.49Å; S921-T924 PolarHBondContact O-N 2.71Å; S921-T924 VanDerWaalsContact O-N 3.13Å; S921-T924 WeakPolarHBondContact OG-CB 3.49Å; S921-T924 PolarHBondContact OG-OG1 3.08Å; S921-W925 PolarHBondContact O-N 2.88Å; S921-A947 CarbonylContact C-O 3.57Å; S921-A947 VanDerWaalsContact CA-O 3.27Å; S921-A947 WeakPolarHBondContact CA-O 3.44Å
922	G	84.1	Confident	80.1	Confident	2 Å²	2	45.9 Å²	45.9	2%	0.021	23%	0.225	C	C	.	.	H	α-helix	trans	-57	-37.3	178.3	0	0	0	0	0	114	W925 S926 A947 R948 Q953	G922-W925 PolarHBondContact O-N 2.67Å; G922-S926 PolarHBondContact O-N 2.89Å; G922-S926 VanDerWaalsContact O-N 3.11Å; G922-S926 PolarHBondContact O-OG 3.25Å; G922-A947 PolarHBondContact N-O 3.23Å; G922-R948 WeakPolarHBondContact CA-O 3.47Å; G922-Q953 PolarHBondContact O-NE2 3.42Å
923	K	82.7	Confident	82.5	Confident	87 Å²	87	42 Å²	42	38%	0.378	21%	0.208	S	C	.	.	H	α-helix	trans	-60.3	-49.1	173.6	-170.9	177.9	-172.5	176.1	0	111.5	S921 W925 S926 V927 E1293	S921-K923 VanDerWaalsContact C-N 3.29Å; S921-K923 PolarHBondContact O-N 2.91Å; K923-W925 VanDerWaalsContact C-N 3.31Å; K923-W925 PolarHBondContact O-N 2.79Å; K923-S926 PolarHBondContact O-N 2.98Å; K923-V927 PolarHBondContact O-N 3.43Å; K923-E1293 PolarHBondContact NZ-O 2.65Å
924	T	88.6	Confident	84.4	Confident	10 Å²	10	40.9 Å²	40.9	6%	0.061	20%	0.204	C	C	.	.	H	α-helix	trans	-60.7	-40.7	175.9	-59.4	0	0	0	0	111.8	V732 A734 I920 S921 V927 I928	V732-T924 HydrophobicContact CG1-CG2 4.48Å; A734-T924 HydrophobicContact CB-CG2 4.03Å; I920-T924 HydrophobicContact CG2-CG2 4.16Å; S921-T924 WeakPolarHBondContact O-CB 3.49Å; S921-T924 PolarHBondContact O-N 2.71Å; S921-T924 VanDerWaalsContact O-N 3.13Å; S921-T924 WeakPolarHBondContact OG-CB 3.49Å; S921-T924 PolarHBondContact OG-OG1 3.08Å; T924-V927 PolarHBondContact O-N 3.01Å; T924-I928 HydrophobicContact CG2-CD1 3.65Å; T924-I928 HydrophobicContact CG2-CG1 4.35Å; T924-I928 VanDerWaalsContact O-CG1 3.3Å; T924-I928 WeakPolarHBondContact O-CG1 3.5Å; T924-I928 PolarHBondContact O-N 3.28Å
925	W	90	Very high	85.9	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.008	19%	0.194	C	C	.	.	H	α-helix	trans	-62	-43.8	178.8	178.4	-91.7	0	0	0	112.7	I920 S921 G922 K923 I928 Q929 I936 V940 F946 F949 V957 A960	I920-W925 HydrophobicContact CG2-CB 4.42Å; S921-W925 PolarHBondContact O-N 2.88Å; G922-W925 PolarHBondContact O-N 2.67Å; K923-W925 VanDerWaalsContact C-N 3.31Å; K923-W925 PolarHBondContact O-N 2.79Å; W925-I928 PolarHBondContact O-N 3.31Å; W925-Q929 VanDerWaalsContact NE1-OE1 3.15Å; W925-Q929 WeakPolarHBondContact O-CB 3.42Å; W925-Q929 PolarHBondContact O-N 3.31Å; W925-I936 HydrophobicContact CH2-CG2 3.8Å; W925-I936 HydrophobicContact CZ2-CG2 4.48Å; W925-I936 HydrophobicContact CZ3-CG2 4.46Å; W925-V940 HydrophobicContact CH2-CG1 3.69Å; W925-V940 HydrophobicContact CZ3-CG1 3.96Å; W925-F946 HydrophobicContact CE3-CE1 4.29Å; W925-F946 HydrophobicContact CZ3-CE1 4.09Å; W925-F949 HydrophobicContact CB-CE1 4Å; W925-F949 HydrophobicContact CB-CE2 4.37Å; W925-F949 HydrophobicContact CB-CZ 3.5Å; W925-F949 AromaticContact CD1-CE1 3.91Å; W925-F949 HydrophobicContact CD2-CE1 4.01Å; W925-F949 HydrophobicContact CD2-CZ 4Å; W925-F949 HydrophobicContact CE3-CZ 4.33Å; W925-F949 AromaticContact CG-CE1 3.68Å; W925-F949 HydrophobicContact CG-CE1 3.68Å; W925-F949 AromaticContact CG-CZ 3.64Å; W925-F949 HydrophobicContact CG-CZ 3.64Å; W925-V957 HydrophobicContact CD2-CG2 4.43Å; W925-V957 HydrophobicContact CH2-CG2 4.2Å; W925-V957 HydrophobicContact CZ2-CG2 4Å; W925-A960 HydrophobicContact CH2-CB 4.05Å; W925-A960 HydrophobicContact CZ2-CB 4.29Å
926	S	85.3	Confident	86.9	Confident	53 Å²	53	38.3 Å²	38.3	37%	0.371	19%	0.187	S	C	.	.	H	α-helix	trans	-58.4	-48.7	175.5	-65	0	0	0	0	112.2	G922 K923 I928 Q929 E930 Q953	G922-S926 PolarHBondContact O-N 2.89Å; G922-S926 VanDerWaalsContact O-N 3.11Å; G922-S926 PolarHBondContact O-OG 3.25Å; K923-S926 PolarHBondContact O-N 2.98Å; S926-I928 VanDerWaalsContact C-N 3.3Å; S926-I928 PolarHBondContact O-N 2.68Å; S926-Q929 PolarHBondContact O-N 3.37Å; S926-Q929 VanDerWaalsContact O-N 3.14Å; S926-E930 PolarHBondContact O-N 3.32Å; S926-Q953 PolarHBondContact OG-NE2 3.41Å
927	V	86.8	Confident	87.3	Confident	28 Å²	28	38.8 Å²	38.8	17%	0.17	19%	0.194	C	C	.	.	H	α-helix	trans	-59.4	-41.2	178	176.2	0	0	0	0	111.4	A734 K923 T924 H931 Y932	A734-V927 HydrophobicContact CB-CB 4.33Å; A734-V927 HydrophobicContact CB-CG1 3.87Å; K923-V927 PolarHBondContact O-N 3.43Å; T924-V927 PolarHBondContact O-N 3.01Å; V927-H931 PolarHBondContact O-N 2.88Å; V927-Y932 HydrophobicContact CG1-CE2 4.39Å
928	I	88.4	Confident	87.2	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-69.1	-38.1	176.9	-68.9	172.9	0	0	0	111.6	V732 A734 T924 W925 S926 Y932 P933 L935 I936 L939	V732-I928 HydrophobicContact CG1-CD1 4.18Å; A734-I928 HydrophobicContact CB-CD1 3.98Å; A734-I928 HydrophobicContact CB-CG1 3.52Å; T924-I928 HydrophobicContact CG2-CD1 3.65Å; T924-I928 HydrophobicContact CG2-CG1 4.35Å; T924-I928 VanDerWaalsContact O-CG1 3.3Å; T924-I928 WeakPolarHBondContact O-CG1 3.5Å; T924-I928 PolarHBondContact O-N 3.28Å; W925-I928 PolarHBondContact O-N 3.31Å; S926-I928 VanDerWaalsContact C-N 3.3Å; S926-I928 PolarHBondContact O-N 2.68Å; I928-Y932 CarbonylContact O-C 3.54Å; I928-Y932 VanDerWaalsContact O-CA 3.23Å; I928-Y932 WeakPolarHBondContact O-CA 3.11Å; I928-Y932 PolarHBondContact O-N 3.12Å; I928-P933 VanDerWaalsContact O-N 3.15Å; I928-L935 HydrophobicContact CG2-CB 4.32Å; I928-I936 HydrophobicContact CG2-CG1 4.15Å; I928-L939 HydrophobicContact CD1-CD1 3.72Å; I928-L939 HydrophobicContact CG2-CD1 3.78Å
929	Q	86.2	Confident	87.2	Confident	77 Å²	77	39.8 Å²	39.8	36%	0.36	20%	0.198	S	C	.	.	H	α-helix	trans	-68	-36.7	179.2	-176.7	174.6	-15.9	0	0	112.4	W925 S926 I936	W925-Q929 VanDerWaalsContact NE1-OE1 3.15Å; W925-Q929 WeakPolarHBondContact O-CB 3.42Å; W925-Q929 PolarHBondContact O-N 3.31Å; S926-Q929 PolarHBondContact O-N 3.37Å; S926-Q929 VanDerWaalsContact O-N 3.14Å; Q929-I936 HydrophobicContact CB-CD1 4.47Å; Q929-I936 HydrophobicContact CG-CD1 4.48Å
930	E	84.7	Confident	87.2	Confident	145 Å²	145	39.8 Å²	39.8	68%	0.678	20%	0.198	S	C	*	.	H	α-helix	trans	-78.2	-50	179.6	-170.4	171.3	172.9	0	0	112.6	S926	S926-E930 PolarHBondContact O-N 3.32Å
931	H	85.3	Confident	87.1	Confident	63 Å²	63	39.8 Å²	39.8	29%	0.292	20%	0.198	S	C	.	.	H	α-helix	trans	-104.9	-24.2	-170.6	-54.3	-58.2	0	0	0	114.8	P737 V927 W934	P737-H931 HydrophobicContact CG-CB 4.47Å; V927-H931 PolarHBondContact O-N 2.88Å; H931-W934 VanDerWaalsContact O-CZ3 3.28Å; H931-W934 WeakPolarHBondContact O-CZ3 3.49Å
932	Y	86.7	Confident	87.1	Confident	8 Å²	8	39.7 Å²	39.7	3%	0.031	20%	0.196	C	C	.	.			trans	-128.3	41.7	-172.1	-52.6	-79	0	0	0	114.6	R735 L791 V792 V927 I928 W934 L935	R735-Y932 WeakPolarHBondContact O-CE2 3.45Å; R735-Y932 PolarHBondContact O-OH 2.97Å; L791-Y932 WeakPolarHBondContact CD1-OH 3.18Å; V792-Y932 HydrophobicContact CG2-CD1 4.1Å; V792-Y932 HydrophobicContact CG2-CD2 3.93Å; V792-Y932 HydrophobicContact CG2-CE1 4.24Å; V792-Y932 HydrophobicContact CG2-CE2 4.07Å; V792-Y932 HydrophobicContact CG2-CG 3.97Å; V927-Y932 HydrophobicContact CG1-CE2 4.39Å; I928-Y932 CarbonylContact O-C 3.54Å; I928-Y932 VanDerWaalsContact O-CA 3.23Å; I928-Y932 WeakPolarHBondContact O-CA 3.11Å; I928-Y932 PolarHBondContact O-N 3.12Å; Y932-W934 AromaticContact CD1-CH2 3.53Å; Y932-W934 HydrophobicContact CD1-CH2 3.53Å; Y932-W934 AromaticContact CD1-CZ2 3.66Å; Y932-W934 HydrophobicContact CD1-CZ2 3.66Å; Y932-W934 HydrophobicContact CD1-CZ3 4.39Å; Y932-W934 HydrophobicContact CE1-CH2 4.25Å; Y932-W934 HydrophobicContact CE1-CZ2 4.49Å; Y932-W934 HydrophobicContact CG-CH2 4.36Å; Y932-W934 PolarHBondContact O-N 3.32Å; Y932-L935 WeakPolarHBondContact O-CB 3.17Å; Y932-L935 PolarHBondContact O-N 2.89Å
933	P	85.5	Confident	87.5	Confident	66 Å²	66	39.6 Å²	39.6	43%	0.429	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-63	-19.2	-168	24.9	-35.9	0	0	0	114.6	I928 L935 I936	I928-P933 VanDerWaalsContact O-N 3.15Å; P933-L935 PolarHBondContact O-N 3.03Å; P933-I936 HydrophobicContact CB-CD1 4.25Å; P933-I936 WeakPolarHBondContact O-CB 3.41Å; P933-I936 PolarHBondContact O-N 3.14Å
934	W	85	Confident	88	Confident	147 Å²	147	35.7 Å²	35.7	56%	0.557	18%	0.179	S	C	*	.	G	3₁₀ helix	trans	-69.8	-16.7	175.3	67.2	89.2	0	0	0	113.8	I788 H931 Y932 P937	I788-W934 HydrophobicContact CD1-CZ2 4.35Å; I788-W934 HydrophobicContact CG2-CZ2 4.35Å; H931-W934 VanDerWaalsContact O-CZ3 3.28Å; H931-W934 WeakPolarHBondContact O-CZ3 3.49Å; Y932-W934 AromaticContact CD1-CH2 3.53Å; Y932-W934 HydrophobicContact CD1-CH2 3.53Å; Y932-W934 AromaticContact CD1-CZ2 3.66Å; Y932-W934 HydrophobicContact CD1-CZ2 3.66Å; Y932-W934 HydrophobicContact CD1-CZ3 4.39Å; Y932-W934 HydrophobicContact CE1-CH2 4.25Å; Y932-W934 HydrophobicContact CE1-CZ2 4.49Å; Y932-W934 HydrophobicContact CG-CH2 4.36Å; Y932-W934 PolarHBondContact O-N 3.32Å; W934-P937 WeakPolarHBondContact O-CD 3.43Å
935	L	85.7	Confident	88.2	Confident	21 Å²	21	35.3 Å²	35.3	11%	0.11	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-78.7	-28.6	175.8	-120.9	78.6	0	0	0	112.6	V792 F794 I928 Y932 P933 P937 K938 L939	V792-L935 HydrophobicContact CG1-CD2 3.77Å; F794-L935 HydrophobicContact CZ-CD2 4.13Å; I928-L935 HydrophobicContact CG2-CB 4.32Å; Y932-L935 WeakPolarHBondContact O-CB 3.17Å; Y932-L935 PolarHBondContact O-N 2.89Å; P933-L935 PolarHBondContact O-N 3.03Å; L935-P937 VanDerWaalsContact C-CD 3.43Å; L935-P937 VanDerWaalsContact C-N 3.33Å; L935-P937 VanDerWaalsContact O-N 3.16Å; L935-K938 PolarHBondContact O-N 2.95Å; L935-L939 HydrophobicContact CB-CD1 4.06Å; L935-L939 HydrophobicContact CB-CG 4.4Å; L935-L939 HydrophobicContact CD2-CD1 4.24Å; L935-L939 HydrophobicContact CD2-CD2 4.48Å; L935-L939 HydrophobicContact CD2-CG 4.45Å; L935-L939 WeakPolarHBondContact O-CG 3.33Å; L935-L939 PolarHBondContact O-N 3.4Å; L935-L939 VanDerWaalsContact O-N 3.08Å
936	I	89.6	Confident	88.5	Confident	25 Å²	25	35.2 Å²	35.2	13%	0.128	18%	0.176	C	C	.	.	H	α-helix	trans	-46.6	-47.8	-174.9	-64.8	172.4	0	0	0	112.6	W925 I928 Q929 P933 K938 L939 V940 A960	W925-I936 HydrophobicContact CH2-CG2 3.8Å; W925-I936 HydrophobicContact CZ2-CG2 4.48Å; W925-I936 HydrophobicContact CZ3-CG2 4.46Å; I928-I936 HydrophobicContact CG2-CG1 4.15Å; Q929-I936 HydrophobicContact CB-CD1 4.47Å; Q929-I936 HydrophobicContact CG-CD1 4.48Å; P933-I936 HydrophobicContact CB-CD1 4.25Å; P933-I936 WeakPolarHBondContact O-CB 3.41Å; P933-I936 PolarHBondContact O-N 3.14Å; I936-K938 VanDerWaalsContact C-N 3.3Å; I936-K938 PolarHBondContact O-N 3.29Å; I936-L939 PolarHBondContact O-N 2.86Å; I936-V940 HydrophobicContact CG2-CG1 4.12Å; I936-V940 WeakPolarHBondContact O-CG2 3.4Å; I936-V940 PolarHBondContact O-N 2.89Å; I936-A960 HydrophobicContact CG2-CB 3.82Å
937	P	88.6	Confident	88.5	Confident	44 Å²	44	32.7 Å²	32.7	29%	0.286	16%	0.158	S	C	.	.	H	α-helix	trans	-60.7	-34.2	-179	-24.5	36.3	0	0	0	114.1	W934 L935 V941 V964 I1262	W934-P937 WeakPolarHBondContact O-CD 3.43Å; L935-P937 VanDerWaalsContact C-CD 3.43Å; L935-P937 VanDerWaalsContact C-N 3.33Å; L935-P937 VanDerWaalsContact O-N 3.16Å; P937-V941 WeakPolarHBondContact O-CG2 3.49Å; P937-V964 HydrophobicContact CB-CG1 3.83Å; P937-I1262 HydrophobicContact CB-CD1 3.68Å
938	K	87	Confident	88.3	Confident	48 Å²	48	36.2 Å²	36.2	21%	0.209	17%	0.168	C	C	.	.	H	α-helix	trans	-75	-42.8	176.1	-66	-172	176.3	-172.9	0	111	L935 I936 V941 K942 I1262 E1265 I1266 W1273	L935-K938 PolarHBondContact O-N 2.95Å; I936-K938 VanDerWaalsContact C-N 3.3Å; I936-K938 PolarHBondContact O-N 3.29Å; K938-V941 PolarHBondContact O-N 3.18Å; K938-K942 PolarHBondContact O-N 2.93Å; K938-I1262 HydrophobicContact CB-CG2 4.5Å; K938-I1262 HydrophobicContact CG-CG2 4.04Å; K938-E1265 WeakPolarHBondContact CE-OE1 3.44Å; K938-E1265 IonicContact NZ-OE1 3.46Å; K938-E1265 PolarHBondContact NZ-OE1 2.99Å; K938-I1266 HydrophobicContact CB-CD1 4.31Å; K938-W1273 HydrophobicContact CB-CH2 3.91Å; K938-W1273 HydrophobicContact CB-CZ2 3.71Å; K938-W1273 HydrophobicContact CD-CZ2 4.21Å
939	L	89.9	Confident	88.1	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-61.5	-47.9	179.5	-65	175.1	0	0	0	111.8	V732 F794 L918 I920 I928 L935 I936 V941 K942 G943	V732-L939 HydrophobicContact CG1-CD2 4.25Å; V732-L939 HydrophobicContact CG2-CD2 4.14Å; F794-L939 HydrophobicContact CE1-CD2 4.2Å; F794-L939 HydrophobicContact CZ-CD2 4.48Å; L918-L939 HydrophobicContact CD1-CD2 3.79Å; I920-L939 HydrophobicContact CD1-CB 3.91Å; I920-L939 HydrophobicContact CD1-CD1 4.32Å; I920-L939 HydrophobicContact CD1-CD2 4.03Å; I920-L939 HydrophobicContact CD1-CG 4.3Å; I928-L939 HydrophobicContact CD1-CD1 3.72Å; I928-L939 HydrophobicContact CG2-CD1 3.78Å; L935-L939 HydrophobicContact CB-CD1 4.06Å; L935-L939 HydrophobicContact CB-CG 4.4Å; L935-L939 HydrophobicContact CD2-CD1 4.24Å; L935-L939 HydrophobicContact CD2-CD2 4.48Å; L935-L939 HydrophobicContact CD2-CG 4.45Å; L935-L939 WeakPolarHBondContact O-CG 3.33Å; L935-L939 PolarHBondContact O-N 3.4Å; L935-L939 VanDerWaalsContact O-N 3.08Å; I936-L939 PolarHBondContact O-N 2.86Å; L939-V941 VanDerWaalsContact C-N 3.27Å; L939-V941 PolarHBondContact O-N 2.94Å; L939-K942 PolarHBondContact O-N 2.81Å; L939-G943 VanDerWaalsContact O-CA 3.23Å; L939-G943 WeakPolarHBondContact O-CA 3.48Å; L939-G943 PolarHBondContact O-N 3.28Å
940	V	91.4	Very high	87.7	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-69.3	-23.4	-178.7	-58.5	0	0	0	0	113.8	R701 W925 I936 A960 L961 V964	R701-V940 PolarHBondContact NH1-O 3.48Å; W925-V940 HydrophobicContact CH2-CG1 3.69Å; W925-V940 HydrophobicContact CZ3-CG1 3.96Å; I936-V940 HydrophobicContact CG2-CG1 4.12Å; I936-V940 WeakPolarHBondContact O-CG2 3.4Å; I936-V940 PolarHBondContact O-N 2.89Å; V940-A960 HydrophobicContact CG1-CB 3.83Å; V940-L961 HydrophobicContact CB-CD2 3.73Å; V940-L961 HydrophobicContact CB-CG 4.14Å; V940-L961 HydrophobicContact CG2-CD2 4.25Å; V940-L961 WeakPolarHBondContact O-CD2 3.4Å; V940-V964 HydrophobicContact CG2-CG1 4.07Å; V940-V964 HydrophobicContact CG2-CG2 3.97Å
941	V	89.6	Confident	87.1	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.006	15%	0.152	C	C	.	.	H	α-helix	trans	-75.4	-31	178.8	168.8	0	0	0	0	112.9	P937 K938 L939 V964 Y966 I1262 R1263 I1266	P937-V941 WeakPolarHBondContact O-CG2 3.49Å; K938-V941 PolarHBondContact O-N 3.18Å; L939-V941 VanDerWaalsContact C-N 3.27Å; L939-V941 PolarHBondContact O-N 2.94Å; V941-V964 HydrophobicContact CG2-CG2 4.23Å; V941-Y966 HydrophobicContact CG2-CE2 4.19Å; V941-I1262 HydrophobicContact CB-CG2 4.05Å; V941-I1262 HydrophobicContact CG1-CG2 4.18Å; V941-I1262 HydrophobicContact CG2-CB 4.22Å; V941-I1262 HydrophobicContact CG2-CD1 4.37Å; V941-I1262 HydrophobicContact CG2-CG2 3.92Å; V941-R1263 HydrophobicContact CG1-CB 4.04Å; V941-I1266 HydrophobicContact CG1-CD1 4.38Å
942	K	89.1	Confident	86.7	Confident	7 Å²	7	33.5 Å²	33.5	3%	0.03	17%	0.166	C	C	.	.	H	α-helix	trans	-110.6	-17.3	176.4	-72.6	-78.8	-168.9	173.9	0	114.5	R701 D915 F916 L918 K938 L939 T944 I1266 D1267	R701-K942 PolarHBondContact NH2-O 2.88Å; D915-K942 IonicContact OD1-NZ 2.62Å; D915-K942 PolarHBondContact OD1-NZ 3.36Å; D915-K942 IonicContact OD2-NZ 2.69Å; F916-K942 HydrophobicContact CE2-CB 4.42Å; F916-K942 HydrophobicContact CE2-CD 4.25Å; F916-K942 HydrophobicContact CE2-CG 4.2Å; F916-K942 HydrophobicContact CZ-CD 4.19Å; F916-K942 HydrophobicContact CZ-CG 4.29Å; L918-K942 HydrophobicContact CD1-CB 3.94Å; L918-K942 HydrophobicContact CG-CB 3.93Å; L918-K942 PolarHBondContact N-O 2.82Å; L918-K942 VanDerWaalsContact N-O 3.15Å; K938-K942 PolarHBondContact O-N 2.93Å; L939-K942 PolarHBondContact O-N 2.81Å; K942-T944 PolarHBondContact O-N 3.22Å; K942-T944 PolarHBondContact O-OG1 3.09Å; K942-T944 VanDerWaalsContact O-OG1 3.1Å; K942-I1266 HydrophobicContact CG-CD1 3.98Å; K942-I1266 HydrophobicContact CG-CG2 4.4Å; K942-D1267 IonicContact NZ-OD1 2.72Å
943	G	90.8	Very high	86.6	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	112.8	179.8	0	0	0	0	0	112.6	R701 L918 L939 F946	R701-G943 PolarHBondContact NH2-O 3.47Å; L918-G943 WeakPolarHBondContact O-CA 3.49Å; L939-G943 VanDerWaalsContact O-CA 3.23Å; L939-G943 WeakPolarHBondContact O-CA 3.48Å; L939-G943 PolarHBondContact O-N 3.28Å; G943-F946 WeakPolarHBondContact O-CE2 3.28Å
944	T	93.6	Very high	86.7	Confident	5 Å²	5	31 Å²	31	3%	0.031	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	-29.4	-170.9	-55.6	0	0	0	0	111.9	R701 M704 M722 I723 H917 L918 K942	R701-T944 PolarHBondContact NH2-OG1 3.21Å; M704-T944 PolarHBondContact N-O 3.24Å; M722-T944 HydrophobicContact CG-CG2 4.18Å; M722-T944 HydrophobicContact SD-CG2 4.16Å; I723-T944 HydrophobicContact CG1-CG2 4.08Å; H917-T944 WeakPolarHBondContact ND1-CB 3.15Å; H917-T944 WeakPolarHBondContact ND1-CG2 3.47Å; H917-T944 PolarHBondContact ND1-OG1 3.4Å; L918-T944 PolarHBondContact O-N 3.23Å; K942-T944 PolarHBondContact O-N 3.22Å; K942-T944 PolarHBondContact O-OG1 3.09Å; K942-T944 VanDerWaalsContact O-OG1 3.1Å
945	V	94.3	Very high	86.7	Confident	1 Å²	1	24.8 Å²	24.8	1%	0.006	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	118.6	173.7	177.1	0	0	0	0	109	M704 L714 A717 I723 L918 A919 I920 A947	M704-V945 HydrophobicContact CB-CG2 4.36Å; L714-V945 HydrophobicContact CD2-CB 4.37Å; L714-V945 HydrophobicContact CD2-CG2 4.04Å; A717-V945 HydrophobicContact CB-CG2 3.87Å; I723-V945 HydrophobicContact CD1-CG2 4.08Å; L918-V945 PolarHBondContact O-N 2.95Å; A919-V945 WeakPolarHBondContact CA-O 3.15Å; A919-V945 HydrophobicContact CB-CB 4.44Å; I920-V945 PolarHBondContact N-O 3.03Å; V945-A947 HydrophobicContact CG1-CB 4.2Å
946	F	94.3	Very high	86.8	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	108.2	171.1	-63.4	-89.4	0	0	0	106.9	V703 M704 V705 T706 I920 W925 G943 F949 V957	V703-F946 HydrophobicContact CG1-CD2 3.72Å; V703-F946 HydrophobicContact CG1-CE2 3.68Å; M704-F946 PolarHBondContact O-N 2.89Å; V705-F946 WeakPolarHBondContact CA-O 3.29Å; V705-F946 HydrophobicContact CB-CB 4.46Å; V705-F946 HydrophobicContact CG1-CB 4.09Å; V705-F946 HydrophobicContact CG2-CB 4.38Å; V705-F946 HydrophobicContact CG2-CD2 4.1Å; T706-F946 PolarHBondContact N-O 3.24Å; I920-F946 HydrophobicContact CB-CD1 4.26Å; I920-F946 HydrophobicContact CD1-CE1 4Å; I920-F946 WeakPolarHBondContact O-CA 3.45Å; W925-F946 HydrophobicContact CE3-CE1 4.29Å; W925-F946 HydrophobicContact CZ3-CE1 4.09Å; G943-F946 WeakPolarHBondContact O-CE2 3.28Å; F946-F949 HydrophobicContact CB-CD1 4.48Å; F946-F949 HydrophobicContact CB-CD2 3.8Å; F946-F949 HydrophobicContact CB-CE1 4.37Å; F946-F949 HydrophobicContact CB-CE2 3.62Å; F946-F949 HydrophobicContact CB-CG 4.26Å; F946-F949 HydrophobicContact CB-CZ 3.94Å; F946-F949 HydrophobicContact CD1-CE1 4.25Å; F946-F949 HydrophobicContact CD1-CE2 4.05Å; F946-F949 AromaticContact CD1-CZ 3.65Å; F946-F949 HydrophobicContact CD1-CZ 3.65Å; F946-F949 HydrophobicContact CG-CE2 4.35Å; F946-F949 HydrophobicContact CG-CZ 4.26Å; F946-V957 HydrophobicContact CD1-CG1 4.41Å; F946-V957 HydrophobicContact CD1-CG2 4.06Å; F946-V957 HydrophobicContact CD2-CG1 4.13Å; F946-V957 HydrophobicContact CE1-CG1 4.31Å; F946-V957 HydrophobicContact CE1-CG2 4.32Å; F946-V957 HydrophobicContact CE2-CG1 4.03Å; F946-V957 HydrophobicContact CG-CG1 4.31Å; F946-V957 HydrophobicContact CG-CG2 4.43Å; F946-V957 HydrophobicContact CZ-CG1 4.13Å
947	A	86.9	Confident	86.9	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	154.2	-169.5	0	0	0	0	0	111.7	T706 M710 I920 S921 G922 V945 F949	T706-A947 CarbonylContact O-C 3.59Å; T706-A947 WeakPolarHBondContact O-CA 3.21Å; M710-A947 HydrophobicContact CB-CB 3.89Å; M710-A947 HydrophobicContact CG-CB 4.23Å; I920-A947 PolarHBondContact O-N 3.08Å; S921-A947 CarbonylContact C-O 3.57Å; S921-A947 VanDerWaalsContact CA-O 3.27Å; S921-A947 WeakPolarHBondContact CA-O 3.44Å; G922-A947 PolarHBondContact N-O 3.23Å; V945-A947 HydrophobicContact CG1-CB 4.2Å; A947-F949 VanDerWaalsContact C-N 3.26Å; A947-F949 VanDerWaalsContact O-CD2 3.28Å; A947-F949 WeakPolarHBondContact O-CD2 3.19Å; A947-F949 PolarHBondContact O-N 2.9Å
948	R	82.3	Confident	87.1	Confident	102 Å²	102	23.5 Å²	23.5	39%	0.385	12%	0.117	S	C	.	.	S	Bend	trans	55	36.8	-169	-57.9	-64.6	-150	173.1	7.3	113.6	T706 G707 D708 G922	T706-R948 PolarHBondContact O-N 3.04Å; T706-R948 VanDerWaalsContact O-N 3.11Å; G707-R948 WeakPolarHBondContact O-CA 3.41Å; G707-R948 WeakPolarHBondContact O-CD 3.25Å; D708-R948 PolarHBondContact O-N 3.41Å; G922-R948 WeakPolarHBondContact CA-O 3.47Å
949	F	84.6	Confident	87.2	Confident	7 Å²	7	25.2 Å²	25.2	3%	0.031	13%	0.126	C	C	.	.			trans	-87.1	132.6	178.6	-88.8	-114.8	0	0	0	112.1	T706 W925 F946 A947 Q953 K954 V957	T706-F949 PolarHBondContact O-N 3.29Å; W925-F949 HydrophobicContact CB-CE1 4Å; W925-F949 HydrophobicContact CB-CE2 4.37Å; W925-F949 HydrophobicContact CB-CZ 3.5Å; W925-F949 AromaticContact CD1-CE1 3.91Å; W925-F949 HydrophobicContact CD2-CE1 4.01Å; W925-F949 HydrophobicContact CD2-CZ 4Å; W925-F949 HydrophobicContact CE3-CZ 4.33Å; W925-F949 AromaticContact CG-CE1 3.68Å; W925-F949 HydrophobicContact CG-CE1 3.68Å; W925-F949 AromaticContact CG-CZ 3.64Å; W925-F949 HydrophobicContact CG-CZ 3.64Å; F946-F949 HydrophobicContact CB-CD1 4.48Å; F946-F949 HydrophobicContact CB-CD2 3.8Å; F946-F949 HydrophobicContact CB-CE1 4.37Å; F946-F949 HydrophobicContact CB-CE2 3.62Å; F946-F949 HydrophobicContact CB-CG 4.26Å; F946-F949 HydrophobicContact CB-CZ 3.94Å; F946-F949 HydrophobicContact CD1-CE1 4.25Å; F946-F949 HydrophobicContact CD1-CE2 4.05Å; F946-F949 AromaticContact CD1-CZ 3.65Å; F946-F949 HydrophobicContact CD1-CZ 3.65Å; F946-F949 HydrophobicContact CG-CE2 4.35Å; F946-F949 HydrophobicContact CG-CZ 4.26Å; A947-F949 VanDerWaalsContact C-N 3.26Å; A947-F949 VanDerWaalsContact O-CD2 3.28Å; A947-F949 WeakPolarHBondContact O-CD2 3.19Å; A947-F949 PolarHBondContact O-N 2.9Å; F949-Q953 HydrophobicContact CB-CB 4.28Å; F949-Q953 HydrophobicContact CD1-CB 3.38Å; F949-Q953 HydrophobicContact CE1-CB 3.96Å; F949-Q953 HydrophobicContact CG-CB 4.14Å; F949-K954 HydrophobicContact CB-CG 4.21Å; F949-V957 HydrophobicContact CD1-CG2 3.83Å; F949-V957 HydrophobicContact CE1-CG2 3.29Å; F949-V957 HydrophobicContact CZ-CG2 4.12Å
950	S	76.6	Confident	87.3	Confident	42 Å²	42	25.9 Å²	25.9	29%	0.294	13%	0.131	S	C	.	.			trans	-69.6	160.9	169	94.5	0	0	0	0	111.5	E952 Q953 K954	S950-E952 VanDerWaalsContact C-N 3.25Å; S950-E952 WeakPolarHBondContact CB-OE2 3.28Å; S950-E952 PolarHBondContact O-N 3.19Å; S950-E952 PolarHBondContact OG-N 3.33Å; S950-E952 PolarHBondContact OG-OE2 2.89Å; S950-Q953 CarbonylContact O-C 3.6Å; S950-Q953 PolarHBondContact O-N 2.9Å; S950-Q953 PolarHBondContact OG-N 2.92Å; S950-K954 WeakPolarHBondContact O-CG 3.23Å; S950-K954 PolarHBondContact O-N 3.12Å
951	P	73.2	Confident	87.4	Confident	57 Å²	57	25.9 Å²	25.9	37%	0.37	13%	0.131	S	C	.	.	H	α-helix	trans	-51.8	-40.1	175.2	-28.2	37	0	0	0	114.1	K954 A955 N976	P951-K954 WeakPolarHBondContact O-CB 3.36Å; P951-K954 PolarHBondContact O-N 3.35Å; P951-A955 PolarHBondContact O-N 3.31Å; P951-N976 WeakPolarHBondContact CA-O 3.43Å; P951-N976 WeakPolarHBondContact CB-O 3.47Å; P951-N976 HydrophobicContact CG-CB 4.14Å
952	E	76	Confident	87.4	Confident	123 Å²	123	28.3 Å²	28.3	58%	0.575	14%	0.143	S	C	*	.	H	α-helix	trans	-67	-43.9	176	-58.3	72	-158.5	0	0	111.1	S950 K954 A955 Q956	S950-E952 VanDerWaalsContact C-N 3.25Å; S950-E952 WeakPolarHBondContact CB-OE2 3.28Å; S950-E952 PolarHBondContact O-N 3.19Å; S950-E952 PolarHBondContact OG-N 3.33Å; S950-E952 PolarHBondContact OG-OE2 2.89Å; E952-K954 VanDerWaalsContact C-N 3.33Å; E952-K954 PolarHBondContact O-N 3.02Å; E952-A955 WeakPolarHBondContact O-CB 3.45Å; E952-A955 PolarHBondContact O-N 3.23Å; E952-A955 VanDerWaalsContact O-N 3.16Å; E952-Q956 WeakPolarHBondContact O-CG 3.46Å; E952-Q956 PolarHBondContact O-N 3.28Å
953	Q	84.6	Confident	87.3	Confident	20 Å²	20	32.3 Å²	32.3	9%	0.093	17%	0.172	C	C	.	.	H	α-helix	trans	-65.7	-36.1	178	-61.5	-179.3	-41.3	0	0	111.6	G922 S926 F949 S950 A955 Q956 V957	G922-Q953 PolarHBondContact O-NE2 3.42Å; S926-Q953 PolarHBondContact OG-NE2 3.41Å; F949-Q953 HydrophobicContact CB-CB 4.28Å; F949-Q953 HydrophobicContact CD1-CB 3.38Å; F949-Q953 HydrophobicContact CE1-CB 3.96Å; F949-Q953 HydrophobicContact CG-CB 4.14Å; S950-Q953 CarbonylContact O-C 3.6Å; S950-Q953 PolarHBondContact O-N 2.9Å; S950-Q953 PolarHBondContact OG-N 2.92Å; Q953-A955 VanDerWaalsContact C-N 3.29Å; Q953-A955 PolarHBondContact O-N 2.85Å; Q953-Q956 PolarHBondContact O-N 3.47Å; Q953-V957 WeakPolarHBondContact O-CG2 3.1Å; Q953-V957 PolarHBondContact O-N 2.92Å
954	K	88.1	Confident	87.2	Confident	2 Å²	2	32.5 Å²	32.5	1%	0.009	17%	0.173	C	C	.	.	H	α-helix	trans	-54.3	-48.5	171	-67	-169.9	167.6	-178.6	0	110	D471 V705 F949 S950 P951 E952 V957 I958 N976 D977 A980	D471-K954 IonicContact OD1-NZ 3.03Å; D471-K954 IonicContact OD2-NZ 3.57Å; D471-K954 PolarHBondContact OD2-NZ 3.36Å; V705-K954 HydrophobicContact CG1-CB 4.23Å; V705-K954 HydrophobicContact CG1-CG 3.95Å; F949-K954 HydrophobicContact CB-CG 4.21Å; S950-K954 WeakPolarHBondContact O-CG 3.23Å; S950-K954 PolarHBondContact O-N 3.12Å; P951-K954 WeakPolarHBondContact O-CB 3.36Å; P951-K954 PolarHBondContact O-N 3.35Å; E952-K954 VanDerWaalsContact C-N 3.33Å; E952-K954 PolarHBondContact O-N 3.02Å; K954-V957 PolarHBondContact O-N 3.17Å; K954-I958 WeakPolarHBondContact O-CG1 3.25Å; K954-I958 PolarHBondContact O-N 3.35Å; K954-N976 PolarHBondContact NZ-ND2 3.38Å; K954-D977 WeakPolarHBondContact CD-OD1 3.43Å; K954-D977 WeakPolarHBondContact CE-OD1 3.5Å; K954-D977 IonicContact NZ-OD1 3.49Å; K954-D977 PolarHBondContact NZ-OD1 3.23Å; K954-D977 IonicContact NZ-OD2 3.69Å; K954-A980 HydrophobicContact CB-CB 4.03Å
955	A	84.9	Confident	86.9	Confident	16 Å²	16	33.8 Å²	33.8	13%	0.132	19%	0.187	C	C	.	.	H	α-helix	trans	-63.9	-41.6	176.7	0	0	0	0	0	112.9	P951 E952 Q953 V957 I958 E959 V983	P951-A955 PolarHBondContact O-N 3.31Å; E952-A955 WeakPolarHBondContact O-CB 3.45Å; E952-A955 PolarHBondContact O-N 3.23Å; E952-A955 VanDerWaalsContact O-N 3.16Å; Q953-A955 VanDerWaalsContact C-N 3.29Å; Q953-A955 PolarHBondContact O-N 2.85Å; A955-V957 PolarHBondContact O-N 2.67Å; A955-I958 WeakPolarHBondContact O-CB 3.45Å; A955-I958 PolarHBondContact O-N 2.86Å; A955-E959 PolarHBondContact O-N 3.44Å; A955-V983 HydrophobicContact CB-CG2 4.47Å
956	Q	88	Confident	86.7	Confident	62 Å²	62	34.2 Å²	34.2	29%	0.29	19%	0.189	S	C	.	.	H	α-helix	trans	-59.3	-41.8	177	-70.2	168.9	-12.3	0	0	112.8	E952 Q953 I958 E959 A960	E952-Q956 WeakPolarHBondContact O-CG 3.46Å; E952-Q956 PolarHBondContact O-N 3.28Å; Q953-Q956 PolarHBondContact O-N 3.47Å; Q956-I958 VanDerWaalsContact C-N 3.32Å; Q956-I958 PolarHBondContact O-N 3.04Å; Q956-E959 PolarHBondContact O-N 3.47Å; Q956-A960 WeakPolarHBondContact O-CB 3.46Å; Q956-A960 PolarHBondContact O-N 3.24Å
957	V	92.1	Very high	86.6	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-62.1	-40.9	176.2	171	0	0	0	0	110.9	V705 W925 F946 F949 Q953 K954 A955 A960 L961	V705-V957 HydrophobicContact CG2-CG1 4.31Å; W925-V957 HydrophobicContact CD2-CG2 4.43Å; W925-V957 HydrophobicContact CH2-CG2 4.2Å; W925-V957 HydrophobicContact CZ2-CG2 4Å; F946-V957 HydrophobicContact CD1-CG1 4.41Å; F946-V957 HydrophobicContact CD1-CG2 4.06Å; F946-V957 HydrophobicContact CD2-CG1 4.13Å; F946-V957 HydrophobicContact CE1-CG1 4.31Å; F946-V957 HydrophobicContact CE1-CG2 4.32Å; F946-V957 HydrophobicContact CE2-CG1 4.03Å; F946-V957 HydrophobicContact CG-CG1 4.31Å; F946-V957 HydrophobicContact CG-CG2 4.43Å; F946-V957 HydrophobicContact CZ-CG1 4.13Å; F949-V957 HydrophobicContact CD1-CG2 3.83Å; F949-V957 HydrophobicContact CE1-CG2 3.29Å; F949-V957 HydrophobicContact CZ-CG2 4.12Å; Q953-V957 WeakPolarHBondContact O-CG2 3.1Å; Q953-V957 PolarHBondContact O-N 2.92Å; K954-V957 PolarHBondContact O-N 3.17Å; A955-V957 PolarHBondContact O-N 2.67Å; V957-A960 PolarHBondContact O-N 3.29Å; V957-L961 HydrophobicContact CG1-CD1 3.86Å; V957-L961 HydrophobicContact CG1-CG 4.41Å; V957-L961 WeakPolarHBondContact O-CB 3.19Å; V957-L961 WeakPolarHBondContact O-CD1 3.37Å; V957-L961 VanDerWaalsContact O-CG 3.27Å; V957-L961 WeakPolarHBondContact O-CG 3.15Å; V957-L961 PolarHBondContact O-N 3.25Å
958	I	92.1	Very high	86.9	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-60.9	-46.6	174.3	-58.3	-63.1	0	0	0	110.5	C469 K954 A955 Q956 A960 L961 Q962 V968 M970 A980 V983 A984	C469-I958 HydrophobicContact CB-CD1 3.78Å; C469-I958 VanDerWaalsContact SG-CD1 3.51Å; K954-I958 WeakPolarHBondContact O-CG1 3.25Å; K954-I958 PolarHBondContact O-N 3.35Å; A955-I958 WeakPolarHBondContact O-CB 3.45Å; A955-I958 PolarHBondContact O-N 2.86Å; Q956-I958 VanDerWaalsContact C-N 3.32Å; Q956-I958 PolarHBondContact O-N 3.04Å; I958-A960 PolarHBondContact O-N 3.06Å; I958-L961 PolarHBondContact O-N 2.79Å; I958-Q962 VanDerWaalsContact O-CG 3.25Å; I958-Q962 WeakPolarHBondContact O-CG 3.48Å; I958-Q962 PolarHBondContact O-N 3.34Å; I958-V968 HydrophobicContact CD1-CG1 3.69Å; I958-V968 HydrophobicContact CG2-CB 4.42Å; I958-V968 HydrophobicContact CG2-CG1 4.05Å; I958-M970 HydrophobicContact CD1-CB 4.37Å; I958-M970 HydrophobicContact CD1-SD 4.34Å; I958-A980 HydrophobicContact CG1-CB 3.98Å; I958-V983 HydrophobicContact CB-CG1 4.26Å; I958-V983 HydrophobicContact CG2-CG1 3.93Å; I958-A984 HydrophobicContact CG2-CB 4.17Å
959	E	89.6	Confident	87.5	Confident	83 Å²	83	31.6 Å²	31.6	39%	0.388	18%	0.18	S	C	.	.	H	α-helix	trans	-62.6	-40.7	177	-61.1	-160.9	154.9	0	0	112.5	K373 A955 Q956 Q962 S963 V983	K373-E959 IonicContact NZ-OE1 3.21Å; K373-E959 PolarHBondContact NZ-OE1 3.49Å; A955-E959 PolarHBondContact O-N 3.44Å; Q956-E959 PolarHBondContact O-N 3.47Å; E959-Q962 PolarHBondContact O-N 3.36Å; E959-S963 PolarHBondContact O-N 3.43Å; E959-V983 HydrophobicContact CG-CG1 3.38Å
960	A	91.3	Very high	87.9	Confident	14 Å²	14	31.3 Å²	31.3	12%	0.116	18%	0.179	C	C	.	.	H	α-helix	trans	-63.5	-42.9	177.4	0	0	0	0	0	111.7	W925 I936 V940 Q956 V957 I958 Q962 S963 V964	W925-A960 HydrophobicContact CH2-CB 4.05Å; W925-A960 HydrophobicContact CZ2-CB 4.29Å; I936-A960 HydrophobicContact CG2-CB 3.82Å; V940-A960 HydrophobicContact CG1-CB 3.83Å; Q956-A960 WeakPolarHBondContact O-CB 3.46Å; Q956-A960 PolarHBondContact O-N 3.24Å; V957-A960 PolarHBondContact O-N 3.29Å; I958-A960 PolarHBondContact O-N 3.06Å; A960-Q962 VanDerWaalsContact C-N 3.34Å; A960-Q962 PolarHBondContact O-N 2.89Å; A960-S963 WeakPolarHBondContact O-CB 3.41Å; A960-S963 PolarHBondContact O-N 3.11Å; A960-S963 PolarHBondContact O-OG 2.91Å; A960-V964 PolarHBondContact O-N 3.45Å
961	L	93.7	Very high	88.7	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.5	-38.4	173.8	-73.2	164.9	0	0	0	112.4	L467 V940 V957 I958 V964 Y966 V968	L467-L961 HydrophobicContact CD1-CD2 3.76Å; L467-L961 HydrophobicContact CD2-CD1 3.93Å; V940-L961 HydrophobicContact CB-CD2 3.73Å; V940-L961 HydrophobicContact CB-CG 4.14Å; V940-L961 HydrophobicContact CG2-CD2 4.25Å; V940-L961 WeakPolarHBondContact O-CD2 3.4Å; V957-L961 HydrophobicContact CG1-CD1 3.86Å; V957-L961 HydrophobicContact CG1-CG 4.41Å; V957-L961 WeakPolarHBondContact O-CB 3.19Å; V957-L961 WeakPolarHBondContact O-CD1 3.37Å; V957-L961 VanDerWaalsContact O-CG 3.27Å; V957-L961 WeakPolarHBondContact O-CG 3.15Å; V957-L961 PolarHBondContact O-N 3.25Å; I958-L961 PolarHBondContact O-N 2.79Å; L961-V964 WeakPolarHBondContact O-CG2 3.27Å; L961-Y966 HydrophobicContact CD2-CD2 4.11Å; L961-Y966 HydrophobicContact CD2-CE2 4.42Å; L961-Y966 WeakPolarHBondContact O-CB 3.2Å; L961-Y966 PolarHBondContact O-N 3.09Å; L961-V968 HydrophobicContact CB-CG2 3.65Å
962	Q	90.1	Very high	89.5	Confident	52 Å²	52	26.6 Å²	26.6	24%	0.243	15%	0.147	C	C	.	.	H	α-helix	trans	-67.4	-36.7	174.1	-67.2	-178.9	20.3	0	0	112.3	I958 E959 A960 V964 G965 V968 V983 H985	I958-Q962 VanDerWaalsContact O-CG 3.25Å; I958-Q962 WeakPolarHBondContact O-CG 3.48Å; I958-Q962 PolarHBondContact O-N 3.34Å; E959-Q962 PolarHBondContact O-N 3.36Å; A960-Q962 VanDerWaalsContact C-N 3.34Å; A960-Q962 PolarHBondContact O-N 2.89Å; Q962-V964 VanDerWaalsContact C-N 3.3Å; Q962-V964 PolarHBondContact O-N 3.44Å; Q962-G965 WeakPolarHBondContact O-CA 2.99Å; Q962-G965 PolarHBondContact O-N 3.11Å; Q962-V968 HydrophobicContact CG-CB 4.28Å; Q962-V968 HydrophobicContact CG-CG2 3.86Å; Q962-V983 PolarHBondContact NE2-O 3.33Å; Q962-H985 VanDerWaalsContact CD-ND1 3.27Å; Q962-H985 VanDerWaalsContact CG-CE1 3.48Å; Q962-H985 WeakPolarHBondContact CG-CE1 3.49Å; Q962-H985 PolarHBondContact NE2-ND1 3.42Å
963	S	87	Confident	89.7	Confident	91 Å²	91	22.3 Å²	22.3	64%	0.636	13%	0.128	S	C	*	.	H	α-helix	trans	-62.1	-34.9	-179.3	81.2	0	0	0	0	112.9	E959 A960 G965	E959-S963 PolarHBondContact O-N 3.43Å; A960-S963 WeakPolarHBondContact O-CB 3.41Å; A960-S963 PolarHBondContact O-N 3.11Å; A960-S963 PolarHBondContact O-OG 2.91Å; S963-G965 PolarHBondContact O-N 2.96Å
964	V	88.3	Confident	88.9	Confident	5 Å²	5	21.7 Å²	21.7	3%	0.03	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	1.1	173.6	-58.6	0	0	0	0	113.6	P937 V940 V941 A960 L961 Q962 Y966 A1258 Y1259 I1262	P937-V964 HydrophobicContact CB-CG1 3.83Å; V940-V964 HydrophobicContact CG2-CG1 4.07Å; V940-V964 HydrophobicContact CG2-CG2 3.97Å; V941-V964 HydrophobicContact CG2-CG2 4.23Å; A960-V964 PolarHBondContact O-N 3.45Å; L961-V964 WeakPolarHBondContact O-CG2 3.27Å; Q962-V964 VanDerWaalsContact C-N 3.3Å; Q962-V964 PolarHBondContact O-N 3.44Å; V964-Y966 HydrophobicContact CG2-CD2 3.57Å; V964-Y966 HydrophobicContact CG2-CE2 3.85Å; V964-A1258 WeakPolarHBondContact O-CB 3.22Å; V964-Y1259 PolarHBondContact O-N 3.45Å; V964-I1262 HydrophobicContact CB-CD1 4.32Å; V964-I1262 HydrophobicContact CG1-CD1 3.91Å
965	G	87	Confident	87.7	Confident	31 Å²	31	22.3 Å²	22.3	32%	0.32	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.1	23.7	172	0	0	0	0	0	116	Q962 S963 Y1259	Q962-G965 WeakPolarHBondContact O-CA 2.99Å; Q962-G965 PolarHBondContact O-N 3.11Å; S963-G965 PolarHBondContact O-N 2.96Å; G965-Y1259 WeakPolarHBondContact O-CE1 3.42Å
966	Y	90.8	Very high	87.1	Confident	11 Å²	11	23.7 Å²	23.7	4%	0.043	14%	0.138	C	C	.	.			trans	-77.1	145.3	164.1	-71.9	-75.1	0	0	0	111.3	N466 L467 V941 L961 V964 Y1259	N466-Y966 WeakPolarHBondContact ND2-CD1 3.48Å; L467-Y966 HydrophobicContact CB-CD1 3.87Å; L467-Y966 HydrophobicContact CB-CG 4.19Å; L467-Y966 HydrophobicContact CD1-CD1 3.84Å; L467-Y966 HydrophobicContact CD1-CD2 3.93Å; L467-Y966 HydrophobicContact CD1-CE1 4.04Å; L467-Y966 HydrophobicContact CD1-CE2 4.11Å; L467-Y966 HydrophobicContact CD1-CG 3.82Å; V941-Y966 HydrophobicContact CG2-CE2 4.19Å; L961-Y966 HydrophobicContact CD2-CD2 4.11Å; L961-Y966 HydrophobicContact CD2-CE2 4.42Å; L961-Y966 WeakPolarHBondContact O-CB 3.2Å; L961-Y966 PolarHBondContact O-N 3.09Å; V964-Y966 HydrophobicContact CG2-CD2 3.57Å; V964-Y966 HydrophobicContact CG2-CE2 3.85Å; Y966-Y1259 HydrophobicContact CD1-CD1 4.04Å; Y966-Y1259 HydrophobicContact CD1-CD2 4.48Å; Y966-Y1259 HydrophobicContact CD1-CE1 4.15Å; Y966-Y1259 HydrophobicContact CD1-CG 4.23Å; Y966-Y1259 HydrophobicContact CD2-CD1 4.35Å; Y966-Y1259 HydrophobicContact CD2-CG 4.31Å; Y966-Y1259 HydrophobicContact CE1-CD1 4.02Å; Y966-Y1259 AromaticContact CE1-CD2 3.67Å; Y966-Y1259 HydrophobicContact CE1-CD2 3.67Å; Y966-Y1259 HydrophobicContact CE1-CE1 4.23Å; Y966-Y1259 AromaticContact CE1-CE2 3.94Å; Y966-Y1259 HydrophobicContact CE1-CE2 3.94Å; Y966-Y1259 AromaticContact CE1-CG 3.75Å; Y966-Y1259 HydrophobicContact CE1-CG 3.75Å; Y966-Y1259 VanDerWaalsContact CE2-CB 3.48Å; Y966-Y1259 HydrophobicContact CE2-CD1 4.34Å; Y966-Y1259 HydrophobicContact CE2-CD2 4.36Å; Y966-Y1259 AromaticContact CE2-CG 3.85Å; Y966-Y1259 HydrophobicContact CE2-CG 3.85Å; Y966-Y1259 HydrophobicContact CG-CD1 4.19Å; Y966-Y1259 HydrophobicContact CG-CG 4.47Å; Y966-Y1259 AromaticContact CZ-CD2 3.59Å; Y966-Y1259 AromaticContact CZ-CG 3.53Å
967	F	90.7	Very high	86.6	Confident	47 Å²	47	20.7 Å²	20.7	21%	0.206	12%	0.124	C	C	.	.			trans	-92.3	100.8	163.5	-74.1	-82.6	0	0	0	107.3	V461 V464 N466 L467 H985 M1089	V461-F967 HydrophobicContact CG1-CD1 4.3Å; V464-F967 HydrophobicContact CG2-CD1 4.11Å; V464-F967 HydrophobicContact CG2-CE1 4.44Å; V464-F967 HydrophobicContact CG2-CG 4.16Å; V464-F967 WeakPolarHBondContact O-CB 3.49Å; N466-F967 PolarHBondContact N-O 3.39Å; N466-F967 PolarHBondContact OD1-N 2.66Å; N466-F967 PolarHBondContact OD1-O 2.9Å; L467-F967 PolarHBondContact N-O 2.89Å; F967-H985 AromaticContact CD1-CD2 3.59Å; F967-H985 AromaticContact CD1-NE2 3.75Å; F967-H985 AromaticContact CE1-CD2 3.97Å; F967-H985 AromaticContact CE1-NE2 3.86Å; F967-M1089 HydrophobicContact CD2-SD 4.41Å; F967-M1089 HydrophobicContact CE1-CE 3.59Å; F967-M1089 HydrophobicContact CE1-SD 4.14Å; F967-M1089 HydrophobicContact CE2-CE 4.11Å; F967-M1089 HydrophobicContact CE2-SD 3.55Å; F967-M1089 VanDerWaalsContact CE2-SD 3.55Å; F967-M1089 HydrophobicContact CZ-CE 3.31Å; F967-M1089 HydrophobicContact CZ-SD 3.4Å; F967-M1089 WeakPolarHBondContact CZ-SD 3.49Å
968	V	94.1	Very high	85.7	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	122.9	-167.2	-175	0	0	0	0	110.9	L467 I958 L961 Q962 H985 A986	L467-V968 HydrophobicContact CD2-CG1 3.91Å; L467-V968 HydrophobicContact CD2-CG2 4.34Å; L467-V968 WeakPolarHBondContact O-CA 3.44Å; I958-V968 HydrophobicContact CD1-CG1 3.69Å; I958-V968 HydrophobicContact CG2-CB 4.42Å; I958-V968 HydrophobicContact CG2-CG1 4.05Å; L961-V968 HydrophobicContact CB-CG2 3.65Å; Q962-V968 HydrophobicContact CG-CB 4.28Å; Q962-V968 HydrophobicContact CG-CG2 3.86Å; V968-H985 WeakPolarHBondContact O-CA 3.48Å; V968-H985 WeakPolarHBondContact O-CB 3.37Å; V968-H985 PolarHBondContact O-N 3.16Å; V968-A986 PolarHBondContact O-N 3.27Å
969	S	94.6	Very high	84.9	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	151	162	-176.1	0	0	0	0	110	L467 T468 C469 A986	L467-S969 PolarHBondContact O-N 2.84Å; T468-S969 WeakPolarHBondContact CA-O 3.42Å; C469-S969 PolarHBondContact N-O 3.4Å; S969-A986 WeakPolarHBondContact CA-O 3.47Å; S969-A986 WeakPolarHBondContact CB-O 3.46Å; S969-A986 PolarHBondContact OG-O 3.1Å
970	M	93.7	Very high	84.7	Confident	1 Å²	1	18.9 Å²	18.9	1%	0.005	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	136.3	170.8	177.9	63.3	-172.6	0	0	108.1	C469 D471 I958 D977 A980 L981 A984 A986 G987 I988	C469-M970 HydrophobicContact CB-SD 3.45Å; C469-M970 WeakPolarHBondContact CB-SD 3.17Å; C469-M970 CarbonylContact O-C 3.35Å; C469-M970 WeakPolarHBondContact O-CA 3.27Å; D471-M970 HydrophobicContact CB-CE 4.42Å; I958-M970 HydrophobicContact CD1-CB 4.37Å; I958-M970 HydrophobicContact CD1-SD 4.34Å; M970-D977 HydrophobicContact CE-CB 4.17Å; M970-D977 WeakPolarHBondContact CE-OD1 3.42Å; M970-A980 HydrophobicContact CE-CB 4.46Å; M970-A980 HydrophobicContact CG-CB 4.03Å; M970-A980 HydrophobicContact SD-CB 4.45Å; M970-L981 HydrophobicContact CB-CD2 4.12Å; M970-L981 HydrophobicContact CG-CD2 3.81Å; M970-L981 HydrophobicContact CG-CG 4.17Å; M970-L981 WeakPolarHBondContact O-CD2 3.48Å; M970-A984 HydrophobicContact CB-CB 3.66Å; M970-A986 PolarHBondContact N-O 3.27Å; M970-G987 CarbonylContact O-C 3.53Å; M970-G987 WeakPolarHBondContact O-CA 3.32Å; M970-I988 PolarHBondContact O-N 2.92Å
971	C	93.8	Very high	84.4	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	129.7	172.3	-167.4	0	0	0	0	108.7	C469 F470 D471 T475 I988 V1011	C469-C971 PolarHBondContact O-N 3.36Å; F470-C971 HydrophobicContact CD1-CB 3.73Å; F470-C971 HydrophobicContact CE1-CB 3.95Å; D471-C971 PolarHBondContact N-O 3.23Å; T475-C971 HydrophobicContact CG2-CB 4.49Å; C971-I988 WeakPolarHBondContact CA-O 3.5Å; C971-V1011 HydrophobicContact CB-CG2 4.15Å
972	G	88.6	Confident	83.6	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	159	-173.6	0	0	0	0	0	112	T475 D977 I988 S989 L990	T475-G972 VanDerWaalsContact OG1-CA 3.29Å; T475-G972 WeakPolarHBondContact OG1-CA 3.5Å; G972-D977 WeakPolarHBondContact CA-OD2 3.39Å; G972-I988 PolarHBondContact N-O 3.11Å; G972-I988 VanDerWaalsContact N-O 3.14Å; G972-S989 CarbonylContact O-C 3.54Å; G972-S989 VanDerWaalsContact O-CA 3.31Å; G972-S989 WeakPolarHBondContact O-CA 3.49Å; G972-L990 PolarHBondContact O-N 2.71Å
973	D	80.3	Confident	83.2	Confident	33 Å²	33	19.9 Å²	19.9	18%	0.176	13%	0.128	C	C	.	.	S	Bend	trans	-116.2	-41.1	-178.8	54.8	-78	0	0	0	112.2	T475 L990 S991	T475-D973 WeakPolarHBondContact CB-OD1 3.41Å; T475-D973 PolarHBondContact N-OD1 2.91Å; T475-D973 PolarHBondContact OG1-N 3.39Å; T475-D973 PolarHBondContact OG1-OD1 3.23Å; D973-L990 HydrophobicContact CB-CB 4.17Å; D973-S991 WeakPolarHBondContact O-CB 3.32Å
974	G	67.8	Low	83.3	Confident	7 Å²	7	15.9 Å²	15.9	7%	0.072	10%	0.1	C	C	.	.	S	Bend	trans	-78.7	163.7	176.1	0	0	0	0	0	114.2	N976 D977	G974-N976 VanDerWaalsContact C-N 3.35Å; G974-N976 VanDerWaalsContact C-OD1 3.28Å; G974-N976 WeakPolarHBondContact CA-OD1 3.39Å; G974-N976 PolarHBondContact O-OD1 3.01Å; G974-D977 WeakPolarHBondContact O-CB 3.42Å; G974-D977 PolarHBondContact O-N 3.39Å
975	A	63.5	Low	83.3	Confident	15 Å²	15	17.1 Å²	17.1	12%	0.124	11%	0.105	C	C	.	.	G	3₁₀ helix	trans	-85.5	-8.1	174.1	0	0	0	0	0	113.4	L300 T301 D977 C978 A995	L300-A975 WeakPolarHBondContact O-CB 3.48Å; T301-A975 WeakPolarHBondContact O-CA 3.42Å; T301-A975 WeakPolarHBondContact O-CB 3.34Å; T301-A975 PolarHBondContact O-N 2.91Å; A975-D977 PolarHBondContact O-N 2.97Å; A975-C978 HydrophobicContact CB-CB 4.1Å; A975-C978 WeakPolarHBondContact O-CB 3.36Å; A975-C978 PolarHBondContact O-N 3.05Å; A975-A995 HydrophobicContact CB-CB 3.36Å
976	N	71.8	Confident	83.5	Confident	44 Å²	44	15.6 Å²	15.6	24%	0.235	9%	0.09	C	C	.	.	G	3₁₀ helix	trans	-52.1	-27.9	157.6	66.1	-19.2	0	0	0	111.4	D471 P951 K954 G974	D471-N976 PolarHBondContact OD2-ND2 3.08Å; P951-N976 WeakPolarHBondContact CA-O 3.43Å; P951-N976 WeakPolarHBondContact CB-O 3.47Å; P951-N976 HydrophobicContact CG-CB 4.14Å; K954-N976 PolarHBondContact NZ-ND2 3.38Å; G974-N976 VanDerWaalsContact C-N 3.35Å; G974-N976 VanDerWaalsContact C-OD1 3.28Å; G974-N976 WeakPolarHBondContact CA-OD1 3.39Å; G974-N976 PolarHBondContact O-OD1 3.01Å
977	D	77.8	Confident	83.4	Confident	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.088	C	C	.	.	G	3₁₀ helix	trans	-87.4	-11.6	172.4	-67.4	-39.5	0	0	0	114.5	D471 K954 M970 G972 G974 A975 G979 A980 L981	D471-D977 WeakPolarHBondContact CB-OD2 3.15Å; K954-D977 WeakPolarHBondContact CD-OD1 3.43Å; K954-D977 WeakPolarHBondContact CE-OD1 3.5Å; K954-D977 IonicContact NZ-OD1 3.49Å; K954-D977 PolarHBondContact NZ-OD1 3.23Å; K954-D977 IonicContact NZ-OD2 3.69Å; M970-D977 HydrophobicContact CE-CB 4.17Å; M970-D977 WeakPolarHBondContact CE-OD1 3.42Å; G972-D977 WeakPolarHBondContact CA-OD2 3.39Å; G974-D977 WeakPolarHBondContact O-CB 3.42Å; G974-D977 PolarHBondContact O-N 3.39Å; A975-D977 PolarHBondContact O-N 2.97Å; D977-G979 PolarHBondContact O-N 2.97Å; D977-G979 VanDerWaalsContact O-N 3.12Å; D977-A980 CarbonylContact O-C 3.54Å; D977-A980 WeakPolarHBondContact O-CA 3.48Å; D977-A980 PolarHBondContact O-N 2.87Å; D977-L981 HydrophobicContact CB-CD1 3.85Å; D977-L981 HydrophobicContact CB-CG 4Å; D977-L981 WeakPolarHBondContact O-CB 3.49Å; D977-L981 WeakPolarHBondContact O-CG 3.4Å; D977-L981 PolarHBondContact O-N 3.35Å
978	C	73.3	Confident	83.5	Confident	15 Å²	15	13 Å²	13	10%	0.101	8%	0.079	C	C	.	.	H	α-helix	trans	-53.5	-41	-173.5	176.9	0	0	0	0	112.3	A975 K982 A998	A975-C978 HydrophobicContact CB-CB 4.1Å; A975-C978 WeakPolarHBondContact O-CB 3.36Å; A975-C978 PolarHBondContact O-N 3.05Å; C978-K982 VanDerWaalsContact O-CB 3.23Å; C978-K982 WeakPolarHBondContact O-CB 3.5Å; C978-K982 PolarHBondContact O-N 3.3Å; C978-A998 WeakPolarHBondContact SG-CB 3.36Å
979	G	74.7	Confident	83.2	Confident	30 Å²	30	13.1 Å²	13.1	31%	0.309	8%	0.08	S	C	.	.	H	α-helix	trans	-61.8	-46.5	173.8	0	0	0	0	0	113	D977 V983	D977-G979 PolarHBondContact O-N 2.97Å; D977-G979 VanDerWaalsContact O-N 3.12Å; G979-V983 WeakPolarHBondContact O-CB 3.2Å; G979-V983 VanDerWaalsContact O-CG2 3.22Å; G979-V983 WeakPolarHBondContact O-CG2 3.38Å; G979-V983 PolarHBondContact O-N 3.2Å; G979-V983 VanDerWaalsContact O-N 3.14Å
980	A	84.9	Confident	82.9	Confident	1 Å²	1	13.3 Å²	13.3	1%	0.008	8%	0.081	C	C	.	.	H	α-helix	trans	-69.2	-42.2	179.2	0	0	0	0	0	112.7	K954 I958 M970 D977 V983 A984	K954-A980 HydrophobicContact CB-CB 4.03Å; I958-A980 HydrophobicContact CG1-CB 3.98Å; M970-A980 HydrophobicContact CE-CB 4.46Å; M970-A980 HydrophobicContact CG-CB 4.03Å; M970-A980 HydrophobicContact SD-CB 4.45Å; D977-A980 CarbonylContact O-C 3.54Å; D977-A980 WeakPolarHBondContact O-CA 3.48Å; D977-A980 PolarHBondContact O-N 2.87Å; A980-V983 PolarHBondContact O-N 3.32Å; A980-A984 VanDerWaalsContact O-CB 3.31Å; A980-A984 WeakPolarHBondContact O-CB 3.28Å; A980-A984 PolarHBondContact O-N 2.63Å
981	L	86.1	Confident	81.9	Confident	3 Å²	3	14.5 Å²	14.5	2%	0.016	9%	0.09	C	C	.	.	H	α-helix	trans	-59.9	-44.1	176	-71.6	169.3	0	0	0	112	M970 D977 G987 I988	M970-L981 HydrophobicContact CB-CD2 4.12Å; M970-L981 HydrophobicContact CG-CD2 3.81Å; M970-L981 HydrophobicContact CG-CG 4.17Å; M970-L981 WeakPolarHBondContact O-CD2 3.48Å; D977-L981 HydrophobicContact CB-CD1 3.85Å; D977-L981 HydrophobicContact CB-CG 4Å; D977-L981 WeakPolarHBondContact O-CB 3.49Å; D977-L981 WeakPolarHBondContact O-CG 3.4Å; D977-L981 PolarHBondContact O-N 3.35Å; L981-G987 VanDerWaalsContact O-CA 3.32Å; L981-G987 WeakPolarHBondContact O-CA 3.26Å; L981-I988 VanDerWaalsContact CD2-O 3.27Å; L981-I988 WeakPolarHBondContact CD2-O 3.15Å
982	K	76.9	Confident	80.6	Confident	63 Å²	63	20.4 Å²	20.4	27%	0.274	12%	0.117	S	C	.	.	H	α-helix	trans	-65.1	-40.3	176.2	176.6	-162.3	176.5	-178.7	0	112.6	S368 C978	S368-K982 WeakPolarHBondContact OG-CD 3.4Å; S368-K982 WeakPolarHBondContact OG-CE 3.46Å; S368-K982 PolarHBondContact OG-NZ 2.87Å; C978-K982 VanDerWaalsContact O-CB 3.23Å; C978-K982 WeakPolarHBondContact O-CB 3.5Å; C978-K982 PolarHBondContact O-N 3.3Å
983	V	82.5	Confident	79.3	Confident	21 Å²	21	21.6 Å²	21.6	13%	0.127	13%	0.127	C	C	.	.	H	α-helix	trans	-80.8	-27.9	-176	168.9	0	0	0	0	112.1	A955 I958 E959 Q962 G979 A980	A955-V983 HydrophobicContact CB-CG2 4.47Å; I958-V983 HydrophobicContact CB-CG1 4.26Å; I958-V983 HydrophobicContact CG2-CG1 3.93Å; E959-V983 HydrophobicContact CG-CG1 3.38Å; Q962-V983 PolarHBondContact NE2-O 3.33Å; G979-V983 WeakPolarHBondContact O-CB 3.2Å; G979-V983 VanDerWaalsContact O-CG2 3.22Å; G979-V983 WeakPolarHBondContact O-CG2 3.38Å; G979-V983 PolarHBondContact O-N 3.2Å; G979-V983 VanDerWaalsContact O-N 3.14Å; A980-V983 PolarHBondContact O-N 3.32Å
984	A	88.8	Confident	78.1	Confident	7 Å²	7	21.9 Å²	21.9	6%	0.058	13%	0.127	C	C	.	.	S	Bend	trans	-58.2	150	175.8	0	0	0	0	0	112.4	I958 M970 A980 A986	I958-A984 HydrophobicContact CG2-CB 4.17Å; M970-A984 HydrophobicContact CB-CB 3.66Å; A980-A984 VanDerWaalsContact O-CB 3.31Å; A980-A984 WeakPolarHBondContact O-CB 3.28Å; A980-A984 PolarHBondContact O-N 2.63Å; A984-A986 PolarHBondContact O-N 3.06Å
985	H	88.3	Confident	77.3	Confident	30 Å²	30	21.9 Å²	21.9	14%	0.139	13%	0.126	C	C	.	.	S	Bend	trans	-64.2	-25.9	172.7	-75.9	76.8	0	0	0	111.8	M375 V458 V461 Q962 F967 V968	M375-H985 WeakPolarHBondContact CE-O 3.42Å; M375-H985 VanDerWaalsContact SD-CA 3.52Å; M375-H985 HydrophobicContact SD-CB 3.75Å; M375-H985 PolarHBondContact SD-CD2 3.03Å; V458-H985 WeakPolarHBondContact CG1-O 3.34Å; V461-H985 HydrophobicContact CG1-CB 3.87Å; Q962-H985 VanDerWaalsContact CD-ND1 3.27Å; Q962-H985 VanDerWaalsContact CG-CE1 3.48Å; Q962-H985 WeakPolarHBondContact CG-CE1 3.49Å; Q962-H985 PolarHBondContact NE2-ND1 3.42Å; F967-H985 AromaticContact CD1-CD2 3.59Å; F967-H985 AromaticContact CD1-NE2 3.75Å; F967-H985 AromaticContact CE1-CD2 3.97Å; F967-H985 AromaticContact CE1-NE2 3.86Å; V968-H985 WeakPolarHBondContact O-CA 3.48Å; V968-H985 WeakPolarHBondContact O-CB 3.37Å; V968-H985 PolarHBondContact O-N 3.16Å
986	A	89.7	Confident	77.3	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	95.4	169.7	0	0	0	0	0	109.7	V458 I465 V968 S969 M970 A984 F1001	V458-A986 HydrophobicContact CG1-CB 4.09Å; I465-A986 HydrophobicContact CD1-CB 3.9Å; V968-A986 PolarHBondContact O-N 3.27Å; S969-A986 WeakPolarHBondContact CA-O 3.47Å; S969-A986 WeakPolarHBondContact CB-O 3.46Å; S969-A986 PolarHBondContact OG-O 3.1Å; M970-A986 PolarHBondContact N-O 3.27Å; A984-A986 PolarHBondContact O-N 3.06Å; A986-F1001 HydrophobicContact CB-CE2 4.2Å
987	G	90.2	Very high	76.8	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	137.3	168.2	0	0	0	0	0	111.8	M970 L981 P1000 F1001	M970-G987 CarbonylContact O-C 3.53Å; M970-G987 WeakPolarHBondContact O-CA 3.32Å; L981-G987 VanDerWaalsContact O-CA 3.32Å; L981-G987 WeakPolarHBondContact O-CA 3.26Å; G987-P1000 VanDerWaalsContact O-CD 3.25Å; G987-P1000 WeakPolarHBondContact O-CD 3.16Å; G987-P1000 WeakPolarHBondContact O-CG 3.18Å; G987-F1001 PolarHBondContact O-N 2.95Å
988	I	91.7	Very high	76.1	Confident	3 Å²	3	21.9 Å²	21.9	2%	0.015	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	112.4	178.4	-53.6	165.1	0	0	0	107.7	M970 C971 G972 L981 F1001 V1011 L1014	M970-I988 PolarHBondContact O-N 2.92Å; C971-I988 WeakPolarHBondContact CA-O 3.5Å; G972-I988 PolarHBondContact N-O 3.11Å; G972-I988 VanDerWaalsContact N-O 3.14Å; L981-I988 VanDerWaalsContact CD2-O 3.27Å; L981-I988 WeakPolarHBondContact CD2-O 3.15Å; I988-F1001 CarbonylContact C-O 3.51Å; I988-F1001 WeakPolarHBondContact CA-O 3.11Å; I988-F1001 HydrophobicContact CG1-CB 4.43Å; I988-V1011 HydrophobicContact CD1-CB 4.45Å; I988-V1011 HydrophobicContact CD1-CG2 3.84Å; I988-L1014 HydrophobicContact CD1-CD2 3.64Å; I988-L1014 HydrophobicContact CG1-CD2 3.8Å
989	S	88.8	Confident	76.3	Confident	3 Å²	3	21.3 Å²	21.3	2%	0.021	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	136.7	171.6	-174.6	0	0	0	0	110.8	G972 S991 S996 S999 F1001 T1002 S1003	G972-S989 CarbonylContact O-C 3.54Å; G972-S989 VanDerWaalsContact O-CA 3.31Å; G972-S989 WeakPolarHBondContact O-CA 3.49Å; S989-S991 PolarHBondContact OG-N 2.62Å; S989-S991 PolarHBondContact OG-O 3.23Å; S989-S996 WeakPolarHBondContact OG-CB 3.39Å; S989-S999 WeakPolarHBondContact CB-OG 3.18Å; S989-F1001 PolarHBondContact N-O 2.72Å; S989-T1002 CarbonylContact O-C 3.58Å; S989-T1002 WeakPolarHBondContact O-CA 3.31Å; S989-S1003 PolarHBondContact O-N 3.44Å
990	L	87.2	Confident	76.6	Confident	3 Å²	3	20.8 Å²	20.8	2%	0.016	11%	0.114	C	C	.	.	S	Bend	trans	-94.8	4.8	174	-60.1	-179.1	0	0	0	113.4	T475 G972 D973 Q1006 I1008	T475-L990 HydrophobicContact CG2-CD1 4.13Å; G972-L990 PolarHBondContact O-N 2.71Å; D973-L990 HydrophobicContact CB-CB 4.17Å; L990-Q1006 WeakPolarHBondContact O-CG 3.08Å; L990-I1008 HydrophobicContact CD1-CG2 4.46Å
991	S	74.1	Confident	76.8	Confident	27 Å²	27	20.7 Å²	20.7	19%	0.189	11%	0.113	C	C	.	.	S	Bend	trans	-122	152.7	-177.6	178	0	0	0	0	111	D973 S989 A993 S996 T1002	D973-S991 WeakPolarHBondContact O-CB 3.32Å; S989-S991 PolarHBondContact OG-N 2.62Å; S989-S991 PolarHBondContact OG-O 3.23Å; S991-A993 PolarHBondContact OG-N 3.35Å; S991-S996 WeakPolarHBondContact O-CB 3.42Å; S991-T1002 WeakPolarHBondContact O-CG2 3.39Å
992	E	66.2	Low	76.8	Confident	124 Å²	124	21.2 Å²	21.2	58%	0.579	12%	0.116	S	C	*	.			trans	-92.2	1.9	173.9	-65.1	-170.9	176.7	0	0	113.1	K1004	E992-K1004 WeakPolarHBondContact OE1-CD 3.34Å; E992-K1004 WeakPolarHBondContact OE1-CG 3.49Å
993	A	61.5	Low	77.4	Confident	24 Å²	24	18.3 Å²	18.3	20%	0.198	10%	0.104	C	C	.	.	S	Bend	trans	-59.8	165.3	178.8	0	0	0	0	0	113.6	S991 A995 S996	S991-A993 PolarHBondContact OG-N 3.35Å; A993-A995 PolarHBondContact O-N 3.45Å; A993-A995 VanDerWaalsContact O-N 3.11Å; A993-S996 WeakPolarHBondContact O-CB 3.17Å; A993-S996 PolarHBondContact O-N 2.74Å; A993-S996 PolarHBondContact O-OG 3.09Å
994	E	53.2	Low	77.6	Confident	40 Å²	40	23.7 Å²	23.7	19%	0.187	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-60.9	-26.2	-176.8	-55.8	-169.9	135.9	0	0	113.2	S299 K362 S996 I997	S299-E994 WeakPolarHBondContact O-CB 3.23Å; K362-E994 WeakPolarHBondContact CE-OE2 3.14Å; K362-E994 IonicContact NZ-OE1 3.8Å; K362-E994 PolarHBondContact NZ-OE1 3Å; K362-E994 IonicContact NZ-OE2 2.93Å; K362-E994 PolarHBondContact NZ-OE2 2.84Å; E994-S996 PolarHBondContact O-N 3.43Å; E994-I997 HydrophobicContact CB-CD1 3.92Å; E994-I997 HydrophobicContact CG-CD1 4.44Å; E994-I997 VanDerWaalsContact O-CB 3.28Å; E994-I997 WeakPolarHBondContact O-CB 3.35Å; E994-I997 WeakPolarHBondContact O-CD1 3.36Å; E994-I997 WeakPolarHBondContact O-CG1 3.13Å; E994-I997 PolarHBondContact O-N 3.07Å; E994-I997 VanDerWaalsContact O-N 3.09Å
995	A	51.9	Low	77.5	Confident	6 Å²	6	29.1 Å²	29.1	5%	0.05	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-55.8	-30.3	169.9	0	0	0	0	0	113.8	S299 A975 A993 I997 A998	S299-A995 PolarHBondContact O-N 3.13Å; A975-A995 HydrophobicContact CB-CB 3.36Å; A993-A995 PolarHBondContact O-N 3.45Å; A993-A995 VanDerWaalsContact O-N 3.11Å; A995-I997 PolarHBondContact O-N 3.27Å; A995-A998 WeakPolarHBondContact O-CB 3.38Å; A995-A998 PolarHBondContact O-N 3.21Å
996	S	62.6	Low	77.4	Confident	11 Å²	11	33.4 Å²	33.4	8%	0.077	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-63.4	-25	177.3	75.6	0	0	0	0	113.1	S989 S991 A993 E994 A998 S999	S989-S996 WeakPolarHBondContact OG-CB 3.39Å; S991-S996 WeakPolarHBondContact O-CB 3.42Å; A993-S996 WeakPolarHBondContact O-CB 3.17Å; A993-S996 PolarHBondContact O-N 2.74Å; A993-S996 PolarHBondContact O-OG 3.09Å; E994-S996 PolarHBondContact O-N 3.43Å; S996-A998 PolarHBondContact O-N 2.64Å; S996-S999 WeakPolarHBondContact O-CB 3.28Å; S996-S999 PolarHBondContact O-N 2.95Å; S996-S999 PolarHBondContact O-OG 3.42Å
997	I	62.5	Low	77.4	Confident	35 Å²	35	34.5 Å²	34.5	18%	0.179	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-64.2	-24.7	179.8	-48.9	165.7	0	0	0	111.1	L237 T240 I369 E994 A995 S999	L237-I997 HydrophobicContact CD1-CG2 4.14Å; T240-I997 HydrophobicContact CG2-CD1 3.58Å; I369-I997 HydrophobicContact CD1-CB 3.9Å; I369-I997 HydrophobicContact CD1-CG2 3.62Å; I369-I997 HydrophobicContact CG1-CG2 4.44Å; I369-I997 HydrophobicContact CG2-CG2 4.46Å; E994-I997 HydrophobicContact CB-CD1 3.92Å; E994-I997 HydrophobicContact CG-CD1 4.44Å; E994-I997 VanDerWaalsContact O-CB 3.28Å; E994-I997 WeakPolarHBondContact O-CB 3.35Å; E994-I997 WeakPolarHBondContact O-CD1 3.36Å; E994-I997 WeakPolarHBondContact O-CG1 3.13Å; E994-I997 PolarHBondContact O-N 3.07Å; E994-I997 VanDerWaalsContact O-N 3.09Å; A995-I997 PolarHBondContact O-N 3.27Å; I997-S999 VanDerWaalsContact C-N 3.31Å
998	A	63.2	Low	77.6	Confident	14 Å²	14	34.5 Å²	34.5	12%	0.116	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-74.6	-19.1	174.2	0	0	0	0	0	113.6	I369 C978 A995 S996	I369-A998 HydrophobicContact CG1-CB 4.44Å; C978-A998 WeakPolarHBondContact SG-CB 3.36Å; A995-A998 WeakPolarHBondContact O-CB 3.38Å; A995-A998 PolarHBondContact O-N 3.21Å; S996-A998 PolarHBondContact O-N 2.64Å
999	S	77.2	Confident	77.7	Confident	3 Å²	3	36 Å²	36	2%	0.021	19%	0.185	C	C	.	.	S	Bend	trans	-90.1	141.3	179.5	76	0	0	0	0	111.6	S989 S996 I997 F1001	S989-S999 WeakPolarHBondContact CB-OG 3.18Å; S996-S999 WeakPolarHBondContact O-CB 3.28Å; S996-S999 PolarHBondContact O-N 2.95Å; S996-S999 PolarHBondContact O-OG 3.42Å; I997-S999 VanDerWaalsContact C-N 3.31Å; S999-F1001 PolarHBondContact O-N 2.99Å; S999-F1001 PolarHBondContact OG-O 2.84Å
1000	P	81.1	Confident	77.9	Confident	18 Å²	18	36.1 Å²	36.1	12%	0.117	19%	0.186	C	C	.	.	S	Bend	trans	-69.9	-18.9	175.9	25.9	-33.1	0	0	0	113.7	C453 I454 N455 V458 G987	C453-P1000 WeakPolarHBondContact CA-O 3.46Å; I454-P1000 PolarHBondContact N-O 3.16Å; N455-P1000 HydrophobicContact CB-CB 4.21Å; V458-P1000 HydrophobicContact CB-CB 4.27Å; V458-P1000 HydrophobicContact CG1-CB 4.37Å; V458-P1000 HydrophobicContact CG1-CG 4.28Å; V458-P1000 HydrophobicContact CG2-CB 3.91Å; V458-P1000 HydrophobicContact CG2-CG 4.43Å; G987-P1000 VanDerWaalsContact O-CD 3.25Å; G987-P1000 WeakPolarHBondContact O-CD 3.16Å; G987-P1000 WeakPolarHBondContact O-CG 3.18Å
1001	F	88.2	Confident	78.3	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	134.2	178.1	-54.4	-80.1	0	0	0	112.4	Y452 C453 V458 M459 C462 A986 G987 I988 S989 S999 L1014	Y452-F1001 VanDerWaalsContact O-CA 3.26Å; Y452-F1001 WeakPolarHBondContact O-CA 3.49Å; C453-F1001 HydrophobicContact CB-CD1 3.72Å; C453-F1001 HydrophobicContact CB-CE1 3.71Å; C453-F1001 WeakPolarHBondContact SG-CE1 3.38Å; V458-F1001 HydrophobicContact CB-CE2 4.06Å; V458-F1001 HydrophobicContact CB-CZ 4.03Å; V458-F1001 HydrophobicContact CG1-CE2 3.59Å; V458-F1001 HydrophobicContact CG1-CZ 3.99Å; M459-F1001 HydrophobicContact CE-CE1 3.83Å; M459-F1001 HydrophobicContact CE-CZ 4.47Å; C462-F1001 WeakPolarHBondContact SG-CE2 3.34Å; C462-F1001 VanDerWaalsContact SG-CZ 3.51Å; A986-F1001 HydrophobicContact CB-CE2 4.2Å; G987-F1001 PolarHBondContact O-N 2.95Å; I988-F1001 CarbonylContact C-O 3.51Å; I988-F1001 WeakPolarHBondContact CA-O 3.11Å; I988-F1001 HydrophobicContact CG1-CB 4.43Å; S989-F1001 PolarHBondContact N-O 2.72Å; S999-F1001 PolarHBondContact O-N 2.99Å; S999-F1001 PolarHBondContact OG-O 2.84Å; F1001-L1014 HydrophobicContact CD1-CD1 3.86Å; F1001-L1014 HydrophobicContact CD1-CD2 4.37Å; F1001-L1014 HydrophobicContact CD2-CD1 4.49Å; F1001-L1014 HydrophobicContact CD2-CD2 3.69Å; F1001-L1014 HydrophobicContact CE1-CD1 3.64Å; F1001-L1014 HydrophobicContact CE2-CD1 4.31Å; F1001-L1014 HydrophobicContact CE2-CD2 3.9Å; F1001-L1014 HydrophobicContact CG-CD1 4.28Å; F1001-L1014 HydrophobicContact CG-CD2 3.95Å; F1001-L1014 HydrophobicContact CZ-CD1 3.9Å; F1001-L1014 HydrophobicContact CZ-CD2 4.33Å
1002	T	87.9	Confident	79.3	Confident	13 Å²	13	34.9 Å²	34.9	8%	0.08	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	132.3	173.3	-46.6	0	0	0	0	109.1	I451 Y452 S989 S991	I451-T1002 CarbonylContact C-O 3.53Å; I451-T1002 WeakPolarHBondContact CA-O 3.17Å; Y452-T1002 PolarHBondContact N-O 3.44Å; Y452-T1002 PolarHBondContact O-N 3.17Å; S989-T1002 CarbonylContact O-C 3.58Å; S989-T1002 WeakPolarHBondContact O-CA 3.31Å; S991-T1002 WeakPolarHBondContact O-CG2 3.39Å
1003	S	89.2	Confident	80.6	Confident	3 Å²	3	31.1 Å²	31.1	2%	0.021	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	131.2	170.5	-160.9	0	0	0	0	111	G450 S989 K1005	G450-S1003 WeakPolarHBondContact O-CA 3.47Å; S989-S1003 PolarHBondContact O-N 3.44Å; S1003-K1005 PolarHBondContact O-N 2.92Å; S1003-K1005 PolarHBondContact OG-N 3.49Å
1004	K	85.6	Confident	82.2	Confident	133 Å²	133	30.1 Å²	30.1	58%	0.578	15%	0.152	S	C	*	.	S	Bend	trans	-72.3	-11.3	171.9	-176.1	162.5	-174.7	167.1	0	113	G450 Y452 E992	G450-K1004 PolarHBondContact O-N 3.39Å; Y452-K1004 HydrophobicContact CE2-CB 4.48Å; E992-K1004 WeakPolarHBondContact OE1-CD 3.34Å; E992-K1004 WeakPolarHBondContact OE1-CG 3.49Å
1005	K	88	Confident	84.2	Confident	121 Å²	121	28.3 Å²	28.3	53%	0.526	14%	0.143	S	C	.	.	S	Bend	trans	-99.4	121.6	175.7	-65	-171.4	178.1	-168.2	0	109.3	S1003 N1007	S1003-K1005 PolarHBondContact O-N 2.92Å; S1003-K1005 PolarHBondContact OG-N 3.49Å; K1005-N1007 PolarHBondContact O-N 3.43Å
1006	Q	85.4	Confident	86.2	Confident	121 Å²	121	31.2 Å²	31.2	57%	0.565	15%	0.153	S	C	*	.	S	Bend	trans	-75.8	48.4	178.2	-67.7	176	-38.9	0	0	112.9	K685 L990	K685-Q1006 WeakPolarHBondContact CD-O 3.46Å; K685-Q1006 WeakPolarHBondContact CE-O 3.29Å; K685-Q1006 PolarHBondContact NZ-O 2.88Å; L990-Q1006 WeakPolarHBondContact O-CG 3.08Å
1007	N	89.6	Confident	87.7	Confident	22 Å²	22	31.5 Å²	31.5	12%	0.118	15%	0.153	C	C	.	.	S	Bend	trans	-145.9	158.2	173.8	71.3	23.9	0	0	0	111.7	E687 K1005 S1009	E687-N1007 PolarHBondContact OE1-ND2 3.01Å; K1005-N1007 PolarHBondContact O-N 3.43Å; N1007-S1009 PolarHBondContact O-N 3.47Å; N1007-S1009 VanDerWaalsContact OD1-CB 3.25Å; N1007-S1009 WeakPolarHBondContact OD1-CB 3.35Å; N1007-S1009 PolarHBondContact OD1-N 2.91Å; N1007-S1009 PolarHBondContact OD1-OG 3.45Å
1008	I	93.7	Very high	89.1	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	6.6	-174.7	64.2	161	0	0	0	114.7	F470 T475 L476 V691 I692 L990 C1010 V1011 P1012	F470-I1008 HydrophobicContact CD1-CB 4.47Å; F470-I1008 HydrophobicContact CD1-CD1 4.42Å; F470-I1008 HydrophobicContact CD1-CG2 3.8Å; F470-I1008 HydrophobicContact CE1-CB 3.88Å; F470-I1008 HydrophobicContact CE1-CD1 3.83Å; F470-I1008 HydrophobicContact CE1-CG2 3.7Å; F470-I1008 HydrophobicContact CZ-CD1 4.16Å; T475-I1008 HydrophobicContact CG2-CG2 3.76Å; L476-I1008 HydrophobicContact CD2-CD1 3.78Å; V691-I1008 HydrophobicContact CB-CD1 3.74Å; V691-I1008 HydrophobicContact CB-CG1 3.91Å; V691-I1008 HydrophobicContact CG1-CB 4.46Å; V691-I1008 HydrophobicContact CG1-CD1 3.53Å; V691-I1008 HydrophobicContact CG1-CG1 3.81Å; V691-I1008 HydrophobicContact CG2-CG1 4.25Å; I692-I1008 HydrophobicContact CD1-CD1 4.25Å; I692-I1008 HydrophobicContact CG1-CD1 4.25Å; L990-I1008 HydrophobicContact CD1-CG2 4.46Å; I1008-C1010 PolarHBondContact O-N 3.12Å; I1008-C1010 VanDerWaalsContact O-N 3.14Å; I1008-V1011 HydrophobicContact CB-CG2 4.38Å; I1008-V1011 WeakPolarHBondContact O-CB 3.11Å; I1008-V1011 PolarHBondContact O-N 2.89Å; I1008-P1012 WeakPolarHBondContact O-CD 3.36Å
1009	S	94	Very high	90.5	Very high	36 Å²	36	29.5 Å²	29.5	25%	0.252	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-23.2	-179.7	74.9	0	0	0	0	113.4	N1007 V1011 P1012	N1007-S1009 PolarHBondContact O-N 3.47Å; N1007-S1009 VanDerWaalsContact OD1-CB 3.25Å; N1007-S1009 WeakPolarHBondContact OD1-CB 3.35Å; N1007-S1009 PolarHBondContact OD1-N 2.91Å; N1007-S1009 PolarHBondContact OD1-OG 3.45Å; S1009-V1011 VanDerWaalsContact C-N 3.31Å; S1009-V1011 PolarHBondContact O-N 3.44Å; S1009-P1012 WeakPolarHBondContact O-CD 3.29Å
1010	C	93.5	Very high	91.3	Very high	4 Å²	4	29.3 Å²	29.3	3%	0.027	14%	0.139	C	C	.	.	H	α-helix	trans	-63.2	-32.1	174.1	60.1	0	0	0	0	113.1	I451 I1008 M1013 L1014	I451-C1010 HydrophobicContact CD1-CB 3.6Å; I451-C1010 HydrophobicContact CG1-CB 4.01Å; I1008-C1010 PolarHBondContact O-N 3.12Å; I1008-C1010 VanDerWaalsContact O-N 3.14Å; C1010-M1013 PolarHBondContact O-N 2.85Å; C1010-L1014 WeakPolarHBondContact O-CB 3.48Å; C1010-L1014 PolarHBondContact O-N 3.1Å
1011	V	95.4	Very high	91.7	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61.3	-59.2	-175.2	-179.3	0	0	0	0	112.5	T468 F470 L695 C971 I988 I1008 S1009 M1013 L1014 I1015	T468-V1011 HydrophobicContact CG2-CG1 3.99Å; F470-V1011 HydrophobicContact CE1-CG2 3.96Å; F470-V1011 HydrophobicContact CZ-CG1 4.36Å; F470-V1011 HydrophobicContact CZ-CG2 4.4Å; L695-V1011 HydrophobicContact CD1-CG1 4.27Å; L695-V1011 HydrophobicContact CD2-CG1 4.43Å; C971-V1011 HydrophobicContact CB-CG2 4.15Å; I988-V1011 HydrophobicContact CD1-CB 4.45Å; I988-V1011 HydrophobicContact CD1-CG2 3.84Å; I1008-V1011 HydrophobicContact CB-CG2 4.38Å; I1008-V1011 WeakPolarHBondContact O-CB 3.11Å; I1008-V1011 PolarHBondContact O-N 2.89Å; S1009-V1011 VanDerWaalsContact C-N 3.31Å; S1009-V1011 PolarHBondContact O-N 3.44Å; V1011-M1013 PolarHBondContact O-N 3.19Å; V1011-L1014 PolarHBondContact O-N 3.32Å; V1011-I1015 HydrophobicContact CG1-CD1 3.95Å; V1011-I1015 WeakPolarHBondContact O-CG1 3.1Å; V1011-I1015 PolarHBondContact O-N 3.47Å; V1011-I1015 VanDerWaalsContact O-N 3.08Å
1012	P	94.9	Very high	91.7	Very high	4 Å²	4	28.5 Å²	28.5	3%	0.026	13%	0.134	C	C	.	.	H	α-helix	trans	-66.5	-24.3	179	28.5	-37.2	0	0	0	112.3	V691 T694 I1008 S1009 R1016 L1082	V691-P1012 HydrophobicContact CG1-CG 3.94Å; V691-P1012 HydrophobicContact CG2-CG 4.34Å; T694-P1012 HydrophobicContact CG2-CB 4.35Å; I1008-P1012 WeakPolarHBondContact O-CD 3.36Å; S1009-P1012 WeakPolarHBondContact O-CD 3.29Å; P1012-R1016 WeakPolarHBondContact O-CB 3.38Å; P1012-R1016 VanDerWaalsContact O-CG 3.3Å; P1012-R1016 WeakPolarHBondContact O-CG 3.47Å; P1012-R1016 PolarHBondContact O-N 3.11Å; P1012-R1016 VanDerWaalsContact O-N 3.13Å; P1012-R1016 PolarHBondContact O-NE 2.96Å; P1012-L1082 HydrophobicContact CB-CD2 4.42Å
1013	M	94.1	Very high	91.8	Very high	46 Å²	46	29.5 Å²	29.5	23%	0.227	14%	0.139	C	C	.	.	H	α-helix	trans	-69	-48.9	173.6	-174.4	-179.1	-67.7	0	0	111.5	L446 H449 I451 C1010 V1011 I1015 R1016 E1017	L446-M1013 HydrophobicContact CD2-CG 4.13Å; L446-M1013 HydrophobicContact CD2-SD 4.39Å; H449-M1013 HydrophobicContact CB-CE 4.3Å; H449-M1013 HydrophobicContact CB-SD 3.65Å; H449-M1013 VanDerWaalsContact CD2-CE 3.5Å; H449-M1013 WeakPolarHBondContact CD2-CE 3.48Å; H449-M1013 VanDerWaalsContact CG-SD 3.55Å; I451-M1013 HydrophobicContact CD1-CG 4.44Å; I451-M1013 HydrophobicContact CD1-SD 3.8Å; C1010-M1013 PolarHBondContact O-N 2.85Å; V1011-M1013 PolarHBondContact O-N 3.19Å; M1013-I1015 VanDerWaalsContact C-N 3.32Å; M1013-I1015 PolarHBondContact O-N 3.18Å; M1013-R1016 PolarHBondContact O-N 3.33Å; M1013-E1017 PolarHBondContact O-N 3.07Å
1014	L	94.9	Very high	91.8	Very high	3 Å²	3	29.3 Å²	29.3	2%	0.016	14%	0.138	C	C	.	.	H	α-helix	trans	-59.5	-42	177.4	-179	65.5	0	0	0	111.7	L446 M459 C462 I988 F1001 C1010 V1011 E1017 G1018	L446-L1014 HydrophobicContact CD1-CD1 3.71Å; L446-L1014 HydrophobicContact CD2-CD1 4.43Å; M459-L1014 HydrophobicContact SD-CD1 4.37Å; C462-L1014 HydrophobicContact CB-CG 4.17Å; I988-L1014 HydrophobicContact CD1-CD2 3.64Å; I988-L1014 HydrophobicContact CG1-CD2 3.8Å; F1001-L1014 HydrophobicContact CD1-CD1 3.86Å; F1001-L1014 HydrophobicContact CD1-CD2 4.37Å; F1001-L1014 HydrophobicContact CD2-CD1 4.49Å; F1001-L1014 HydrophobicContact CD2-CD2 3.69Å; F1001-L1014 HydrophobicContact CE1-CD1 3.64Å; F1001-L1014 HydrophobicContact CE2-CD1 4.31Å; F1001-L1014 HydrophobicContact CE2-CD2 3.9Å; F1001-L1014 HydrophobicContact CG-CD1 4.28Å; F1001-L1014 HydrophobicContact CG-CD2 3.95Å; F1001-L1014 HydrophobicContact CZ-CD1 3.9Å; F1001-L1014 HydrophobicContact CZ-CD2 4.33Å; C1010-L1014 WeakPolarHBondContact O-CB 3.48Å; C1010-L1014 PolarHBondContact O-N 3.1Å; V1011-L1014 PolarHBondContact O-N 3.32Å; L1014-E1017 PolarHBondContact O-N 3.41Å; L1014-G1018 PolarHBondContact O-N 3.13Å
1015	I	95.2	Very high	91.8	Very high	1 Å²	1	23 Å²	23	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-68.1	-39.6	177.7	-59.2	167.9	0	0	0	110.9	I465 L695 I700 V1011 M1013 R1019 L1082	I465-I1015 HydrophobicContact CB-CD1 4.4Å; I465-I1015 HydrophobicContact CB-CG1 4.4Å; I465-I1015 HydrophobicContact CD1-CD1 4.44Å; I465-I1015 HydrophobicContact CD1-CG1 3.91Å; I465-I1015 HydrophobicContact CG2-CD1 4.07Å; L695-I1015 HydrophobicContact CD2-CD1 4.04Å; I700-I1015 HydrophobicContact CD1-CD1 3.76Å; I700-I1015 HydrophobicContact CD1-CG2 3.84Å; V1011-I1015 HydrophobicContact CG1-CD1 3.95Å; V1011-I1015 WeakPolarHBondContact O-CG1 3.1Å; V1011-I1015 PolarHBondContact O-N 3.47Å; V1011-I1015 VanDerWaalsContact O-N 3.08Å; M1013-I1015 VanDerWaalsContact C-N 3.32Å; M1013-I1015 PolarHBondContact O-N 3.18Å; I1015-R1019 WeakPolarHBondContact O-CB 3.48Å; I1015-R1019 VanDerWaalsContact O-CG 3.29Å; I1015-R1019 WeakPolarHBondContact O-CG 3.23Å; I1015-R1019 PolarHBondContact O-N 3.37Å; I1015-L1082 HydrophobicContact CB-CD1 4.22Å; I1015-L1082 HydrophobicContact CG2-CD1 3.68Å
1016	R	94.1	Very high	91.7	Very high	67 Å²	67	18 Å²	18	25%	0.253	9%	0.089	S	C	.	.	H	α-helix	trans	-61.3	-47.8	174	-82.4	174.1	-74.7	180	0.1	111.7	P1012 M1013 R1019 C1020 A1078 P1080 L1082	P1012-R1016 WeakPolarHBondContact O-CB 3.38Å; P1012-R1016 VanDerWaalsContact O-CG 3.3Å; P1012-R1016 WeakPolarHBondContact O-CG 3.47Å; P1012-R1016 PolarHBondContact O-N 3.11Å; P1012-R1016 VanDerWaalsContact O-N 3.13Å; P1012-R1016 PolarHBondContact O-NE 2.96Å; M1013-R1016 PolarHBondContact O-N 3.33Å; R1016-R1019 PolarHBondContact O-N 2.86Å; R1016-C1020 WeakPolarHBondContact O-CB 3.43Å; R1016-C1020 PolarHBondContact O-N 2.67Å; R1016-A1078 HydrophobicContact CB-CB 4.38Å; R1016-P1080 WeakPolarHBondContact CD-O 3.49Å; R1016-P1080 PolarHBondContact NH1-O 3.1Å; R1016-L1082 HydrophobicContact CG-CB 4.12Å; R1016-L1082 HydrophobicContact CG-CD1 3.81Å
1017	E	93.7	Very high	91.8	Very high	18 Å²	18	12.6 Å²	12.6	8%	0.084	7%	0.065	C	C	.	.	H	α-helix	trans	-67.4	-40.4	177.9	-78	-66.6	163.8	0	0	112.3	A442 R445 L446 M1013 L1014 R1019 C1020 A1021 A1078	A442-E1017 HydrophobicContact CB-CB 4.49Å; R445-E1017 IonicContact CZ-OE1 2.66Å; R445-E1017 IonicContact CZ-OE2 2.67Å; R445-E1017 VanDerWaalsContact CZ-OE2 3.24Å; R445-E1017 VanDerWaalsContact NE-CD 3.3Å; R445-E1017 IonicContact NE-OE1 2.73Å; R445-E1017 PolarHBondContact NE-OE1 3.18Å; R445-E1017 IonicContact NE-OE2 3.95Å; R445-E1017 PolarHBondContact NE-OE2 3.33Å; R445-E1017 IonicContact NH2-OE2 2.7Å; R445-E1017 PolarHBondContact NH2-OE2 3.01Å; L446-E1017 HydrophobicContact CD1-CB 4.08Å; L446-E1017 HydrophobicContact CD2-CB 4.19Å; L446-E1017 HydrophobicContact CD2-CG 4.1Å; L446-E1017 HydrophobicContact CG-CB 4.15Å; L446-E1017 HydrophobicContact CG-CG 4.15Å; M1013-E1017 PolarHBondContact O-N 3.07Å; L1014-E1017 PolarHBondContact O-N 3.41Å; E1017-R1019 VanDerWaalsContact C-N 3.35Å; E1017-R1019 PolarHBondContact O-N 2.84Å; E1017-C1020 CarbonylContact O-C 3.59Å; E1017-C1020 WeakPolarHBondContact O-CB 3.47Å; E1017-C1020 PolarHBondContact O-N 3.2Å; E1017-A1021 WeakPolarHBondContact O-CB 3.42Å; E1017-A1021 PolarHBondContact O-N 3.39Å; E1017-A1078 HydrophobicContact CG-CB 4.43Å
1018	G	93.2	Very high	91.8	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-62.6	-37.4	173.6	0	0	0	0	0	113.2	M459 G463 L1014 A1021 L1022	M459-G1018 VanDerWaalsContact O-CA 3.32Å; M459-G1018 WeakPolarHBondContact O-CA 3.43Å; G463-G1018 WeakPolarHBondContact CA-O 3.44Å; L1014-G1018 PolarHBondContact O-N 3.13Å; G1018-A1021 PolarHBondContact O-N 3.25Å; G1018-L1022 WeakPolarHBondContact O-CB 3.4Å; G1018-L1022 PolarHBondContact O-N 2.85Å
1019	R	92	Very high	91.4	Very high	6 Å²	6	11.8 Å²	11.8	2%	0.023	6%	0.061	C	C	.	.	H	α-helix	trans	-66.2	-42.5	172.7	-77.2	-179.2	-176.9	178.2	8.9	111.5	G463 I1015 R1016 E1017 V1023 S1083 P1087 Y1165	G463-R1019 WeakPolarHBondContact O-CG 3.31Å; G463-R1019 PolarHBondContact O-NE 3.02Å; I1015-R1019 WeakPolarHBondContact O-CB 3.48Å; I1015-R1019 VanDerWaalsContact O-CG 3.29Å; I1015-R1019 WeakPolarHBondContact O-CG 3.23Å; I1015-R1019 PolarHBondContact O-N 3.37Å; R1016-R1019 PolarHBondContact O-N 2.86Å; E1017-R1019 VanDerWaalsContact C-N 3.35Å; E1017-R1019 PolarHBondContact O-N 2.84Å; R1019-V1023 WeakPolarHBondContact O-CG2 3.48Å; R1019-V1023 PolarHBondContact O-N 3.38Å; R1019-V1023 VanDerWaalsContact O-N 3.08Å; R1019-S1083 PolarHBondContact NH1-O 2.76Å; R1019-S1083 PolarHBondContact NH1-OG 2.91Å; R1019-P1087 HydrophobicContact CB-CG 4.49Å; R1019-P1087 HydrophobicContact CG-CG 4.1Å; R1019-Y1165 HydrophobicContact CB-CD1 4.11Å; R1019-Y1165 HydrophobicContact CG-CD1 4.45Å
1020	C	92.7	Very high	91.1	Very high	0 Å²	0	11 Å²	11	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-62.4	-46	174.7	-176	0	0	0	0	111.7	R1016 E1017 T1024 T1076 A1078	R1016-C1020 WeakPolarHBondContact O-CB 3.43Å; R1016-C1020 PolarHBondContact O-N 2.67Å; E1017-C1020 CarbonylContact O-C 3.59Å; E1017-C1020 WeakPolarHBondContact O-CB 3.47Å; E1017-C1020 PolarHBondContact O-N 3.2Å; C1020-T1024 WeakPolarHBondContact O-CB 3.42Å; C1020-T1024 PolarHBondContact O-N 2.61Å; C1020-T1024 PolarHBondContact O-OG1 3.34Å; C1020-T1076 PolarHBondContact SG-O 2.69Å; C1020-T1076 VanDerWaalsContact SG-O 3.4Å; C1020-A1078 HydrophobicContact CB-CB 3.6Å; C1020-A1078 PolarHBondContact SG-N 2.7Å
1021	A	91.1	Very high	91	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-59.2	-50.8	177.5	0	0	0	0	0	111.2	A442 M459 E1017 G1018 V1023 T1024 S1025	A442-A1021 HydrophobicContact CB-CB 3.97Å; M459-A1021 HydrophobicContact CG-CB 3.98Å; E1017-A1021 WeakPolarHBondContact O-CB 3.42Å; E1017-A1021 PolarHBondContact O-N 3.39Å; G1018-A1021 PolarHBondContact O-N 3.25Å; A1021-V1023 PolarHBondContact O-N 3.01Å; A1021-T1024 WeakPolarHBondContact O-CB 3.44Å; A1021-T1024 PolarHBondContact O-N 3.34Å; A1021-S1025 PolarHBondContact O-N 2.94Å; A1021-S1025 PolarHBondContact O-OG 3.34Å
1022	L	88.1	Confident	90.7	Very high	1 Å²	1	10.9 Å²	10.9	1%	0.005	5%	0.052	C	C	.	.	H	α-helix	trans	-62	-46.8	-179.3	-167.8	72.5	0	0	0	112	F377 N460 V464 G1018 T1024 S1025 F1026 P1087	F377-L1022 HydrophobicContact CE1-CD1 4.15Å; F377-L1022 HydrophobicContact CZ-CD1 3.98Å; N460-L1022 HydrophobicContact CB-CD1 3.8Å; V464-L1022 HydrophobicContact CG1-CD2 3.77Å; G1018-L1022 WeakPolarHBondContact O-CB 3.4Å; G1018-L1022 PolarHBondContact O-N 2.85Å; L1022-T1024 VanDerWaalsContact C-N 3.29Å; L1022-T1024 PolarHBondContact O-N 2.87Å; L1022-S1025 PolarHBondContact O-N 2.92Å; L1022-F1026 HydrophobicContact CD1-CD2 4.11Å; L1022-F1026 HydrophobicContact CD1-CE2 3.79Å; L1022-F1026 HydrophobicContact CG-CD2 4.06Å; L1022-F1026 HydrophobicContact CG-CE2 4.01Å; L1022-F1026 WeakPolarHBondContact O-CB 3.49Å; L1022-F1026 VanDerWaalsContact O-CD2 3.25Å; L1022-F1026 WeakPolarHBondContact O-CD2 3.49Å; L1022-F1026 PolarHBondContact O-N 3.33Å; L1022-P1087 HydrophobicContact CD2-CB 4.16Å; L1022-P1087 HydrophobicContact CD2-CG 3.8Å
1023	V	88.8	Confident	90.3	Very high	33 Å²	33	10.7 Å²	10.7	20%	0.2	5%	0.051	C	C	.	.	H	α-helix	trans	-66.1	-33.7	177.7	176.7	0	0	0	0	111.4	R1019 A1021 G1027 P1087 Y1165 R1166	R1019-V1023 WeakPolarHBondContact O-CG2 3.48Å; R1019-V1023 PolarHBondContact O-N 3.38Å; R1019-V1023 VanDerWaalsContact O-N 3.08Å; A1021-V1023 PolarHBondContact O-N 3.01Å; V1023-G1027 PolarHBondContact O-N 2.91Å; V1023-P1087 HydrophobicContact CG2-CB 3.68Å; V1023-P1087 HydrophobicContact CG2-CG 4.35Å; V1023-Y1165 HydrophobicContact CG2-CD2 3.73Å; V1023-Y1165 HydrophobicContact CG2-CE2 4.38Å; V1023-Y1165 HydrophobicContact CG2-CG 3.82Å; V1023-R1166 HydrophobicContact CG1-CG 4.35Å
1024	T	90.2	Very high	90.2	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-64.5	-54.6	173.7	-59.7	0	0	0	0	110.6	C1020 A1021 L1022 F1026 G1027 T1028 F1073 R1166	C1020-T1024 WeakPolarHBondContact O-CB 3.42Å; C1020-T1024 PolarHBondContact O-N 2.61Å; C1020-T1024 PolarHBondContact O-OG1 3.34Å; A1021-T1024 WeakPolarHBondContact O-CB 3.44Å; A1021-T1024 PolarHBondContact O-N 3.34Å; L1022-T1024 VanDerWaalsContact C-N 3.29Å; L1022-T1024 PolarHBondContact O-N 2.87Å; T1024-F1026 VanDerWaalsContact C-N 3.29Å; T1024-F1026 PolarHBondContact O-N 2.88Å; T1024-G1027 PolarHBondContact O-N 3.16Å; T1024-T1028 PolarHBondContact O-N 3.21Å; T1024-T1028 PolarHBondContact O-OG1 3.41Å; T1024-F1073 HydrophobicContact CG2-CD1 4.31Å; T1024-F1073 HydrophobicContact CG2-CE1 4.34Å; T1024-R1166 PolarHBondContact OG1-NE 3.36Å; T1024-R1166 PolarHBondContact OG1-NH2 3.06Å; T1024-R1166 VanDerWaalsContact OG1-NH2 3.12Å
1025	S	86.2	Confident	90.1	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-60	-37	179	-64.1	0	0	0	0	112.5	M435 A1021 L1022 F1029	M435-S1025 PolarHBondContact O-OG 2.95Å; A1021-S1025 PolarHBondContact O-N 2.94Å; A1021-S1025 PolarHBondContact O-OG 3.34Å; L1022-S1025 PolarHBondContact O-N 2.92Å; S1025-F1029 WeakPolarHBondContact O-CB 3.38Å; S1025-F1029 PolarHBondContact O-N 3.39Å
1026	F	85.4	Confident	89.9	Confident	17 Å²	17	8.4 Å²	8.4	8%	0.075	4%	0.039	C	C	.	.	H	α-helix	trans	-66.7	-41.8	172.1	-91.5	-113.1	0	0	0	112.9	F379 L1022 T1024 F1029 K1030 T1088 R1090 L1091	F379-F1026 AromaticContact CD2-CD2 3.96Å; F379-F1026 HydrophobicContact CD2-CD2 3.96Å; F379-F1026 AromaticContact CD2-CE2 3.24Å; F379-F1026 HydrophobicContact CD2-CE2 3.24Å; F379-F1026 AromaticContact CD2-CZ 3.76Å; F379-F1026 HydrophobicContact CD2-CZ 3.76Å; F379-F1026 AromaticContact CE2-CD2 3.59Å; F379-F1026 HydrophobicContact CE2-CD2 3.59Å; F379-F1026 AromaticContact CE2-CE2 3.39Å; F379-F1026 HydrophobicContact CE2-CE2 3.39Å; F379-F1026 HydrophobicContact CE2-CG 4.47Å; F379-F1026 HydrophobicContact CE2-CZ 4.13Å; F379-F1026 HydrophobicContact CG-CE2 4.37Å; L1022-F1026 HydrophobicContact CD1-CD2 4.11Å; L1022-F1026 HydrophobicContact CD1-CE2 3.79Å; L1022-F1026 HydrophobicContact CG-CD2 4.06Å; L1022-F1026 HydrophobicContact CG-CE2 4.01Å; L1022-F1026 WeakPolarHBondContact O-CB 3.49Å; L1022-F1026 VanDerWaalsContact O-CD2 3.25Å; L1022-F1026 WeakPolarHBondContact O-CD2 3.49Å; L1022-F1026 PolarHBondContact O-N 3.33Å; T1024-F1026 VanDerWaalsContact C-N 3.29Å; T1024-F1026 PolarHBondContact O-N 2.88Å; F1026-F1029 PolarHBondContact O-N 3.36Å; F1026-K1030 WeakPolarHBondContact O-CG 3.47Å; F1026-K1030 PolarHBondContact O-N 3.4Å; F1026-T1088 WeakPolarHBondContact CE1-O 3.43Å; F1026-T1088 WeakPolarHBondContact CZ-O 3.49Å; F1026-R1090 WeakPolarHBondContact CE1-O 3.44Å; F1026-L1091 HydrophobicContact CD1-CD1 4.08Å; F1026-L1091 HydrophobicContact CE1-CD1 3.92Å; F1026-L1091 HydrophobicContact CE2-CD1 4.4Å; F1026-L1091 HydrophobicContact CG-CD1 4.39Å; F1026-L1091 HydrophobicContact CZ-CD1 4.08Å
1027	G	88	Confident	89.8	Confident	6 Å²	6	5.4 Å²	5.4	6%	0.062	3%	0.028	C	C	.	.	H	α-helix	trans	-65.2	-47.8	178.4	0	0	0	0	0	112.1	V1023 T1024 F1029 K1030 F1031	V1023-G1027 PolarHBondContact O-N 2.91Å; T1024-G1027 PolarHBondContact O-N 3.16Å; G1027-F1029 VanDerWaalsContact C-N 3.3Å; G1027-F1029 PolarHBondContact O-N 3.47Å; G1027-K1030 PolarHBondContact O-N 3.12Å; G1027-F1031 WeakPolarHBondContact O-CB 3.3Å; G1027-F1031 PolarHBondContact O-N 2.97Å
1028	T	88	Confident	89.8	Confident	0 Å²	0	4.6 Å²	4.6	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-63	-37.4	174.5	-43.1	0	0	0	0	111	A434 T1024 F1031 M1032 S1070 F1073	A434-T1028 HydrophobicContact CB-CG2 3.49Å; A434-T1028 VanDerWaalsContact CB-CG2 3.49Å; T1024-T1028 PolarHBondContact O-N 3.21Å; T1024-T1028 PolarHBondContact O-OG1 3.41Å; T1028-F1031 PolarHBondContact O-N 3.13Å; T1028-M1032 HydrophobicContact CG2-CE 4.24Å; T1028-M1032 WeakPolarHBondContact O-CB 3.32Å; T1028-M1032 WeakPolarHBondContact O-CG 3.29Å; T1028-M1032 PolarHBondContact O-N 3.22Å; T1028-S1070 WeakPolarHBondContact CG2-OG 3.29Å; T1028-F1073 VanDerWaalsContact OG1-CD1 3.3Å; T1028-F1073 WeakPolarHBondContact OG1-CD1 3.44Å; T1028-F1073 WeakPolarHBondContact OG1-CE1 3.43Å
1029	F	86	Confident	89.8	Confident	6 Å²	6	4.9 Å²	4.9	3%	0.026	3%	0.026	C	C	.	.	H	α-helix	trans	-63.6	-46.7	173.8	-172.3	-82.7	0	0	0	112.6	F386 L431 S1025 F1026 G1027 F1031 M1032 A1033 L1091	F386-F1029 HydrophobicContact CB-CZ 4.31Å; F386-F1029 AromaticContact CD1-CE1 3.65Å; F386-F1029 HydrophobicContact CD1-CE1 3.65Å; F386-F1029 AromaticContact CD1-CZ 3.36Å; F386-F1029 HydrophobicContact CD1-CZ 3.36Å; F386-F1029 HydrophobicContact CD2-CE1 4.08Å; F386-F1029 HydrophobicContact CD2-CZ 4.43Å; F386-F1029 AromaticContact CE1-CE1 3.58Å; F386-F1029 HydrophobicContact CE1-CE1 3.58Å; F386-F1029 AromaticContact CE1-CZ 3.66Å; F386-F1029 HydrophobicContact CE1-CZ 3.66Å; F386-F1029 HydrophobicContact CE2-CE1 4.03Å; F386-F1029 AromaticContact CG-CE1 3.9Å; F386-F1029 HydrophobicContact CG-CE1 3.9Å; F386-F1029 AromaticContact CG-CZ 3.79Å; F386-F1029 HydrophobicContact CG-CZ 3.79Å; F386-F1029 AromaticContact CZ-CE1 3.8Å; F386-F1029 HydrophobicContact CZ-CE1 3.8Å; F386-F1029 HydrophobicContact CZ-CZ 4.34Å; L431-F1029 HydrophobicContact CD1-CD2 3.8Å; L431-F1029 HydrophobicContact CD1-CE2 3.72Å; L431-F1029 HydrophobicContact CD2-CE2 4.1Å; L431-F1029 HydrophobicContact CG-CD2 4.47Å; L431-F1029 HydrophobicContact CG-CE2 4.18Å; S1025-F1029 WeakPolarHBondContact O-CB 3.38Å; S1025-F1029 PolarHBondContact O-N 3.39Å; F1026-F1029 PolarHBondContact O-N 3.36Å; G1027-F1029 VanDerWaalsContact C-N 3.3Å; G1027-F1029 PolarHBondContact O-N 3.47Å; F1029-F1031 VanDerWaalsContact C-N 3.3Å; F1029-F1031 PolarHBondContact O-N 2.95Å; F1029-M1032 PolarHBondContact O-N 3.29Å; F1029-A1033 HydrophobicContact CE1-CB 4.24Å; F1029-A1033 PolarHBondContact O-N 2.99Å; F1029-L1091 HydrophobicContact CB-CD1 4.44Å; F1029-L1091 HydrophobicContact CD1-CD1 3.85Å; F1029-L1091 HydrophobicContact CD1-CD2 3.87Å; F1029-L1091 HydrophobicContact CD1-CG 3.98Å; F1029-L1091 HydrophobicContact CD2-CD2 4.17Å; F1029-L1091 HydrophobicContact CE1-CD1 4.29Å; F1029-L1091 HydrophobicContact CE1-CD2 3.47Å; F1029-L1091 VanDerWaalsContact CE1-CD2 3.47Å; F1029-L1091 HydrophobicContact CE1-CG 3.93Å; F1029-L1091 HydrophobicContact CE2-CD2 3.78Å; F1029-L1091 HydrophobicContact CG-CD1 4Å; F1029-L1091 HydrophobicContact CG-CD2 4.22Å; F1029-L1091 HydrophobicContact CG-CG 4.5Å; F1029-L1091 HydrophobicContact CZ-CD2 3.43Å; F1029-L1091 VanDerWaalsContact CZ-CD2 3.43Å; F1029-L1091 HydrophobicContact CZ-CG 4.37Å
1030	K	87.5	Confident	89.8	Confident	20 Å²	20	4.7 Å²	4.7	9%	0.087	3%	0.026	C	C	.	.	H	α-helix	trans	-58.8	-43.5	174.7	-75.5	-157.6	-58.3	177.9	0	111.2	F1026 G1027 M1032 G1034 T1096 S1099 L1100 F1159 E1230	F1026-K1030 WeakPolarHBondContact O-CG 3.47Å; F1026-K1030 PolarHBondContact O-N 3.4Å; G1027-K1030 PolarHBondContact O-N 3.12Å; K1030-M1032 VanDerWaalsContact C-N 3.35Å; K1030-M1032 PolarHBondContact O-N 3.03Å; K1030-G1034 WeakPolarHBondContact O-CA 3.4Å; K1030-G1034 PolarHBondContact O-N 2.72Å; K1030-T1096 HydrophobicContact CD-CG2 3.83Å; K1030-T1096 HydrophobicContact CG-CG2 3.88Å; K1030-S1099 PolarHBondContact NZ-OG 2.66Å; K1030-L1100 WeakPolarHBondContact O-CD1 3.39Å; K1030-F1159 VanDerWaalsContact C-CE2 3.45Å; K1030-F1159 HydrophobicContact CB-CD1 4.19Å; K1030-F1159 HydrophobicContact CB-CD2 3.74Å; K1030-F1159 HydrophobicContact CB-CE1 4.27Å; K1030-F1159 HydrophobicContact CB-CE2 3.82Å; K1030-F1159 HydrophobicContact CB-CG 3.91Å; K1030-F1159 HydrophobicContact CB-CZ 4.08Å; K1030-F1159 HydrophobicContact CD-CD1 4.13Å; K1030-F1159 HydrophobicContact CD-CE1 4.09Å; K1030-F1159 VanDerWaalsContact CE-CD1 3.41Å; K1030-F1159 VanDerWaalsContact O-CE2 3.25Å; K1030-F1159 WeakPolarHBondContact O-CE2 3.42Å; K1030-E1230 IonicContact NZ-OE1 2.67Å; K1030-E1230 PolarHBondContact NZ-OE1 3.18Å
1031	F	90.8	Very high	89.8	Confident	0 Å²	0	7.3 Å²	7.3	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-58.9	-45.3	175.3	170.4	-123.8	0	0	0	111.7	G1027 T1028 F1029 G1034 Y1035 I1066 L1069 Y1152 L1155 A1156 F1159	G1027-F1031 WeakPolarHBondContact O-CB 3.3Å; G1027-F1031 PolarHBondContact O-N 2.97Å; T1028-F1031 PolarHBondContact O-N 3.13Å; F1029-F1031 VanDerWaalsContact C-N 3.3Å; F1029-F1031 PolarHBondContact O-N 2.95Å; F1031-G1034 PolarHBondContact O-N 3.11Å; F1031-Y1035 PolarHBondContact O-N 2.91Å; F1031-I1066 HydrophobicContact CE1-CD1 4.42Å; F1031-I1066 HydrophobicContact CE1-CG2 4.23Å; F1031-I1066 HydrophobicContact CE2-CD1 3.92Å; F1031-I1066 HydrophobicContact CZ-CD1 3.56Å; F1031-I1066 HydrophobicContact CZ-CG2 4.38Å; F1031-L1069 HydrophobicContact CE1-CB 4.32Å; F1031-L1069 HydrophobicContact CZ-CB 4.13Å; F1031-Y1152 WeakPolarHBondContact CE2-O 3.13Å; F1031-L1155 HydrophobicContact CD2-CB 4Å; F1031-L1155 HydrophobicContact CE2-CB 4.39Å; F1031-A1156 HydrophobicContact CD2-CB 4.07Å; F1031-A1156 HydrophobicContact CE2-CB 3.76Å; F1031-A1156 HydrophobicContact CZ-CB 4.14Å; F1031-F1159 HydrophobicContact CB-CD2 4.09Å
1032	M	88.9	Confident	89.9	Confident	0 Å²	0	7.3 Å²	7.3	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-67.1	-49.9	180	-74.1	-164.2	174	0	0	114.4	P428 I430 L431 A434 T1028 F1029 K1030 G1034 Y1035 S1036 S1070	P428-M1032 HydrophobicContact CB-CB 4.33Å; P428-M1032 HydrophobicContact CG-CB 4.07Å; I430-M1032 HydrophobicContact CB-CE 4.16Å; I430-M1032 HydrophobicContact CG1-CE 4.04Å; I430-M1032 HydrophobicContact CG2-CE 3.33Å; I430-M1032 HydrophobicContact CG2-SD 3.79Å; L431-M1032 HydrophobicContact CD1-CB 3.93Å; L431-M1032 HydrophobicContact CD1-SD 4.26Å; A434-M1032 HydrophobicContact CB-CE 3.51Å; A434-M1032 HydrophobicContact CB-CG 4.41Å; A434-M1032 HydrophobicContact CB-SD 3.26Å; A434-M1032 WeakPolarHBondContact CB-SD 3.38Å; T1028-M1032 HydrophobicContact CG2-CE 4.24Å; T1028-M1032 WeakPolarHBondContact O-CB 3.32Å; T1028-M1032 WeakPolarHBondContact O-CG 3.29Å; T1028-M1032 PolarHBondContact O-N 3.22Å; F1029-M1032 PolarHBondContact O-N 3.29Å; K1030-M1032 VanDerWaalsContact C-N 3.35Å; K1030-M1032 PolarHBondContact O-N 3.03Å; M1032-G1034 PolarHBondContact O-N 3.38Å; M1032-Y1035 HydrophobicContact CB-CD1 4.47Å; M1032-Y1035 HydrophobicContact CB-CE1 4.19Å; M1032-Y1035 HydrophobicContact CG-CE1 4.13Å; M1032-Y1035 WeakPolarHBondContact O-CD1 3.3Å; M1032-Y1035 WeakPolarHBondContact O-CE1 3.45Å; M1032-S1036 PolarHBondContact O-N 3.21Å; M1032-S1036 VanDerWaalsContact O-N 3.17Å; M1032-S1036 PolarHBondContact O-OG 3.47Å; M1032-S1070 WeakPolarHBondContact CE-OG 3.35Å
1033	A	87.9	Confident	90.1	Very high	1 Å²	1	7.3 Å²	7.3	1%	0.008	4%	0.037	C	C	.	.	H	α-helix	trans	-65.7	-26.8	174.5	0	0	0	0	0	112.3	F386 F1029 L1037 L1100	F386-A1033 HydrophobicContact CE1-CB 3.68Å; F386-A1033 HydrophobicContact CZ-CB 3.68Å; F1029-A1033 HydrophobicContact CE1-CB 4.24Å; F1029-A1033 PolarHBondContact O-N 2.99Å; A1033-L1037 WeakPolarHBondContact O-CB 3.39Å; A1033-L1037 WeakPolarHBondContact O-CD1 3.27Å; A1033-L1037 VanDerWaalsContact O-CG 3.22Å; A1033-L1037 WeakPolarHBondContact O-CG 3.3Å; A1033-L1037 PolarHBondContact O-N 3.36Å; A1033-L1100 HydrophobicContact CB-CD1 4.22Å; A1033-L1100 HydrophobicContact CB-CD2 3.96Å
1034	G	91.5	Very high	90.3	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-70.5	-49.9	177.8	0	0	0	0	0	112.1	K1030 F1031 M1032 I1038 L1155	K1030-G1034 WeakPolarHBondContact O-CA 3.4Å; K1030-G1034 PolarHBondContact O-N 2.72Å; F1031-G1034 PolarHBondContact O-N 3.11Å; M1032-G1034 PolarHBondContact O-N 3.38Å; G1034-I1038 WeakPolarHBondContact O-CG1 3.49Å; G1034-I1038 PolarHBondContact O-N 3.31Å; G1034-I1038 VanDerWaalsContact O-N 3.09Å; G1034-L1155 VanDerWaalsContact C-CD1 3.47Å
1035	Y	92.3	Very high	90.4	Very high	1 Å²	1	7.7 Å²	7.7	0%	0.004	4%	0.038	C	C	.	.	H	α-helix	trans	-66.9	-43.2	179.1	94.4	-98.3	0	0	0	111.1	P428 F1031 M1032 L1037 I1038 Q1039 D1062 I1066	P428-Y1035 HydrophobicContact CB-CE1 4.1Å; P428-Y1035 HydrophobicContact CG-CE1 4.25Å; F1031-Y1035 PolarHBondContact O-N 2.91Å; M1032-Y1035 HydrophobicContact CB-CD1 4.47Å; M1032-Y1035 HydrophobicContact CB-CE1 4.19Å; M1032-Y1035 HydrophobicContact CG-CE1 4.13Å; M1032-Y1035 WeakPolarHBondContact O-CD1 3.3Å; M1032-Y1035 WeakPolarHBondContact O-CE1 3.45Å; Y1035-L1037 VanDerWaalsContact C-N 3.31Å; Y1035-L1037 PolarHBondContact O-N 2.77Å; Y1035-I1038 PolarHBondContact O-N 3.38Å; Y1035-I1038 VanDerWaalsContact O-N 3.15Å; Y1035-Q1039 VanDerWaalsContact O-CB 3.27Å; Y1035-Q1039 WeakPolarHBondContact O-CB 3.1Å; Y1035-Q1039 PolarHBondContact O-N 3.34Å; Y1035-D1062 PolarHBondContact OH-OD2 2.85Å; Y1035-D1062 VanDerWaalsContact OH-OD2 3.07Å; Y1035-I1066 HydrophobicContact CD1-CD1 3.78Å; Y1035-I1066 HydrophobicContact CD1-CG1 4.06Å; Y1035-I1066 HydrophobicContact CD1-CG2 3.78Å; Y1035-I1066 HydrophobicContact CD2-CD1 3.94Å; Y1035-I1066 HydrophobicContact CD2-CG1 3.85Å; Y1035-I1066 HydrophobicContact CE1-CB 4.48Å; Y1035-I1066 HydrophobicContact CE1-CD1 4.48Å; Y1035-I1066 HydrophobicContact CE1-CG1 4.29Å; Y1035-I1066 HydrophobicContact CE1-CG2 3.47Å; Y1035-I1066 VanDerWaalsContact CE1-CG2 3.47Å; Y1035-I1066 HydrophobicContact CE2-CG1 4.02Å; Y1035-I1066 HydrophobicContact CE2-CG2 4.45Å; Y1035-I1066 HydrophobicContact CG-CD1 3.52Å; Y1035-I1066 HydrophobicContact CG-CG1 3.89Å; Y1035-I1066 HydrophobicContact CG-CG2 4.46Å
1036	S	91.8	Very high	90.6	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-65.1	-36.1	-176.5	68.8	0	0	0	0	112.6	I425 V426 M1032 S1040	I425-S1036 WeakPolarHBondContact O-CB 3.23Å; V426-S1036 WeakPolarHBondContact O-CB 3.32Å; V426-S1036 PolarHBondContact O-OG 2.91Å; M1032-S1036 PolarHBondContact O-N 3.21Å; M1032-S1036 VanDerWaalsContact O-N 3.17Å; M1032-S1036 PolarHBondContact O-OG 3.47Å; S1036-S1040 WeakPolarHBondContact O-CB 3.21Å; S1036-S1040 PolarHBondContact O-N 2.93Å; S1036-S1040 PolarHBondContact O-OG 2.92Å
1037	L	91.7	Very high	90.7	Very high	4 Å²	4	7 Å²	7	2%	0.021	4%	0.035	C	C	.	.	H	α-helix	trans	-66.4	-48	171.6	-71.9	173.3	0	0	0	111.5	L390 V393 A1033 Y1035 Q1039 S1040 F1041 F1101 V1104	L390-L1037 HydrophobicContact CD2-CD1 4.2Å; L390-L1037 HydrophobicContact CD2-CD2 3.93Å; L390-L1037 HydrophobicContact CD2-CG 4.12Å; V393-L1037 HydrophobicContact CG1-CD2 3.96Å; A1033-L1037 WeakPolarHBondContact O-CB 3.39Å; A1033-L1037 WeakPolarHBondContact O-CD1 3.27Å; A1033-L1037 VanDerWaalsContact O-CG 3.22Å; A1033-L1037 WeakPolarHBondContact O-CG 3.3Å; A1033-L1037 PolarHBondContact O-N 3.36Å; Y1035-L1037 VanDerWaalsContact C-N 3.31Å; Y1035-L1037 PolarHBondContact O-N 2.77Å; L1037-Q1039 VanDerWaalsContact C-N 3.32Å; L1037-Q1039 PolarHBondContact O-N 2.92Å; L1037-S1040 PolarHBondContact O-N 2.7Å; L1037-S1040 PolarHBondContact O-OG 2.69Å; L1037-F1041 WeakPolarHBondContact O-CD2 3.09Å; L1037-F1041 PolarHBondContact O-N 3.28Å; L1037-F1101 HydrophobicContact CD1-CE1 4.41Å; L1037-V1104 HydrophobicContact CB-CG1 3.96Å; L1037-V1104 HydrophobicContact CB-CG2 3.85Å; L1037-V1104 HydrophobicContact CD1-CG2 4.04Å
1038	I	93.8	Very high	90.8	Very high	2 Å²	2	9.9 Å²	9.9	1%	0.01	5%	0.051	C	C	.	.	H	α-helix	trans	-60.1	-41.1	177	-72.2	-175.3	0	0	0	111.9	G1034 Y1035 F1041 S1042 V1104 Q1111 Q1151 Y1152 L1155	G1034-I1038 WeakPolarHBondContact O-CG1 3.49Å; G1034-I1038 PolarHBondContact O-N 3.31Å; G1034-I1038 VanDerWaalsContact O-N 3.09Å; Y1035-I1038 PolarHBondContact O-N 3.38Å; Y1035-I1038 VanDerWaalsContact O-N 3.15Å; I1038-F1041 PolarHBondContact O-N 3.19Å; I1038-S1042 PolarHBondContact O-N 2.92Å; I1038-S1042 PolarHBondContact O-OG 3.19Å; I1038-S1042 VanDerWaalsContact O-OG 3.06Å; I1038-V1104 HydrophobicContact CG1-CG2 4.4Å; I1038-Q1111 VanDerWaalsContact CG2-NE2 3.29Å; I1038-Q1111 PolarHBondContact O-NE2 2.91Å; I1038-Q1151 HydrophobicContact CD1-CB 4.43Å; I1038-Q1151 HydrophobicContact CG2-CB 4.41Å; I1038-Y1152 HydrophobicContact CB-CE1 4.3Å; I1038-Y1152 HydrophobicContact CG2-CE1 3.83Å; I1038-L1155 HydrophobicContact CD1-CD1 3.8Å; I1038-L1155 HydrophobicContact CD1-CD2 4.38Å; I1038-L1155 HydrophobicContact CD1-CG 4.24Å
1039	Q	93.5	Very high	90.6	Very high	5 Å²	5	10.9 Å²	10.9	2%	0.023	6%	0.056	C	C	.	.	H	α-helix	trans	-65.5	-42.2	177.2	-168.3	173.9	19.4	0	0	111.1	I425 Y1035 L1037 F1041 S1042 T1043 F1058 D1062 Y1152	I425-Q1039 HydrophobicContact CG2-CB 4.08Å; I425-Q1039 HydrophobicContact CG2-CG 3.85Å; Y1035-Q1039 VanDerWaalsContact O-CB 3.27Å; Y1035-Q1039 WeakPolarHBondContact O-CB 3.1Å; Y1035-Q1039 PolarHBondContact O-N 3.34Å; L1037-Q1039 VanDerWaalsContact C-N 3.32Å; L1037-Q1039 PolarHBondContact O-N 2.92Å; Q1039-F1041 VanDerWaalsContact C-N 3.28Å; Q1039-F1041 PolarHBondContact O-N 2.97Å; Q1039-S1042 VanDerWaalsContact O-CB 3.24Å; Q1039-S1042 WeakPolarHBondContact O-CB 3.48Å; Q1039-S1042 PolarHBondContact O-N 2.91Å; Q1039-S1042 VanDerWaalsContact O-N 3.12Å; Q1039-T1043 PolarHBondContact O-N 3.24Å; Q1039-T1043 PolarHBondContact O-OG1 2.89Å; Q1039-F1058 HydrophobicContact CG-CE1 4.32Å; Q1039-D1062 PolarHBondContact NE2-OD1 2.93Å; Q1039-Y1152 WeakPolarHBondContact CB-OH 3.33Å
1040	S	91.7	Very high	90.4	Very high	3 Å²	3	10.7 Å²	10.7	2%	0.021	6%	0.056	C	C	.	.	H	α-helix	trans	-62	-34.8	174	77.2	0	0	0	0	112.5	L422 S1036 L1037 T1043 I1044	L422-S1040 WeakPolarHBondContact CD1-O 3.29Å; S1036-S1040 WeakPolarHBondContact O-CB 3.21Å; S1036-S1040 PolarHBondContact O-N 2.93Å; S1036-S1040 PolarHBondContact O-OG 2.92Å; L1037-S1040 PolarHBondContact O-N 2.7Å; L1037-S1040 PolarHBondContact O-OG 2.69Å; S1040-T1043 WeakPolarHBondContact CA-OG1 3.33Å; S1040-T1043 PolarHBondContact O-N 2.97Å; S1040-T1043 PolarHBondContact O-OG1 3.26Å; S1040-I1044 WeakPolarHBondContact O-CD1 3.44Å; S1040-I1044 VanDerWaalsContact O-CG1 3.27Å; S1040-I1044 WeakPolarHBondContact O-CG1 3.4Å; S1040-I1044 PolarHBondContact O-N 3.41Å
1041	F	92.5	Very high	90.3	Very high	54 Å²	54	9.8 Å²	9.8	24%	0.237	5%	0.052	C	C	.	.	H	α-helix	trans	-69.6	-37.3	172.5	-77.7	-60.4	0	0	0	112.4	L1037 I1038 Q1039 T1043 I1044 I1045 V1104 F1108	L1037-F1041 WeakPolarHBondContact O-CD2 3.09Å; L1037-F1041 PolarHBondContact O-N 3.28Å; I1038-F1041 PolarHBondContact O-N 3.19Å; Q1039-F1041 VanDerWaalsContact C-N 3.28Å; Q1039-F1041 PolarHBondContact O-N 2.97Å; F1041-T1043 VanDerWaalsContact C-N 3.31Å; F1041-T1043 PolarHBondContact O-N 3.07Å; F1041-I1044 HydrophobicContact CD1-CD1 4.36Å; F1041-I1044 PolarHBondContact O-N 2.87Å; F1041-I1045 WeakPolarHBondContact O-CB 3.12Å; F1041-I1045 VanDerWaalsContact O-CG1 3.28Å; F1041-I1045 WeakPolarHBondContact O-CG1 3.04Å; F1041-I1045 PolarHBondContact O-N 2.91Å; F1041-V1104 HydrophobicContact CD2-CG1 3.84Å; F1041-V1104 HydrophobicContact CE2-CG1 3.44Å; F1041-V1104 VanDerWaalsContact CE2-CG1 3.44Å; F1041-F1108 HydrophobicContact CB-CD2 3.96Å; F1041-F1108 AromaticContact CD1-CD2 3.69Å; F1041-F1108 HydrophobicContact CD1-CD2 3.69Å; F1041-F1108 HydrophobicContact CD1-CE2 4.04Å; F1041-F1108 HydrophobicContact CD1-CG 4.41Å; F1041-F1108 HydrophobicContact CE1-CD2 4.43Å; F1041-F1108 HydrophobicContact CG-CB 4.47Å; F1041-F1108 AromaticContact CG-CD2 3.89Å; F1041-F1108 HydrophobicContact CG-CD2 3.89Å; F1041-F1108 HydrophobicContact CG-CG 4.49Å
1042	S	94	Very high	90.1	Very high	1 Å²	1	9.8 Å²	9.8	1%	0.007	5%	0.052	C	C	.	.	H	α-helix	trans	-55.5	-47	169.9	-47.7	0	0	0	0	111.2	I1038 Q1039 I1045 L1046 Q1111 S1148	I1038-S1042 PolarHBondContact O-N 2.92Å; I1038-S1042 PolarHBondContact O-OG 3.19Å; I1038-S1042 VanDerWaalsContact O-OG 3.06Å; Q1039-S1042 VanDerWaalsContact O-CB 3.24Å; Q1039-S1042 WeakPolarHBondContact O-CB 3.48Å; Q1039-S1042 PolarHBondContact O-N 2.91Å; Q1039-S1042 VanDerWaalsContact O-N 3.12Å; S1042-I1045 PolarHBondContact O-N 2.86Å; S1042-L1046 WeakPolarHBondContact O-CG 3.21Å; S1042-L1046 PolarHBondContact O-N 3.04Å; S1042-L1046 VanDerWaalsContact O-N 3.11Å; S1042-Q1111 PolarHBondContact OG-NE2 3.19Å; S1042-S1148 PolarHBondContact OG-OG 3.29Å
1043	T	92.1	Very high	90.2	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-61	-48.8	178.2	-15.1	0	0	0	0	111.5	I425 Q1039 S1040 F1041 I1045 L1046 F1047 N1052	I425-T1043 HydrophobicContact CD1-CG2 3.88Å; Q1039-T1043 PolarHBondContact O-N 3.24Å; Q1039-T1043 PolarHBondContact O-OG1 2.89Å; S1040-T1043 WeakPolarHBondContact CA-OG1 3.33Å; S1040-T1043 PolarHBondContact O-N 2.97Å; S1040-T1043 PolarHBondContact O-OG1 3.26Å; F1041-T1043 VanDerWaalsContact C-N 3.31Å; F1041-T1043 PolarHBondContact O-N 3.07Å; T1043-I1045 VanDerWaalsContact C-N 3.33Å; T1043-I1045 PolarHBondContact O-N 2.94Å; T1043-L1046 PolarHBondContact O-N 2.96Å; T1043-F1047 HydrophobicContact CG2-CE1 4.27Å; T1043-F1047 HydrophobicContact CG2-CE2 4.02Å; T1043-F1047 HydrophobicContact CG2-CZ 3.76Å; T1043-F1047 WeakPolarHBondContact O-CG 3.18Å; T1043-F1047 PolarHBondContact O-N 3.25Å; T1043-N1052 WeakPolarHBondContact CG2-OD1 3.49Å
1044	I	91.9	Very high	90.2	Very high	29 Å²	29	10 Å²	10	15%	0.149	5%	0.053	C	C	.	.	H	α-helix	trans	-61.6	-40.3	180	-67.1	162.7	0	0	0	111.4	V400 L404 L422 S1040 F1041 F1047 V1048	V400-I1044 HydrophobicContact CG1-CG2 4.41Å; L404-I1044 HydrophobicContact CD1-CG2 4.39Å; L422-I1044 HydrophobicContact CD1-CD1 4.32Å; L422-I1044 HydrophobicContact CD1-CG1 3.96Å; L422-I1044 HydrophobicContact CD2-CD1 4.08Å; L422-I1044 HydrophobicContact CD2-CG1 4.01Å; S1040-I1044 WeakPolarHBondContact O-CD1 3.44Å; S1040-I1044 VanDerWaalsContact O-CG1 3.27Å; S1040-I1044 WeakPolarHBondContact O-CG1 3.4Å; S1040-I1044 PolarHBondContact O-N 3.41Å; F1041-I1044 HydrophobicContact CD1-CD1 4.36Å; F1041-I1044 PolarHBondContact O-N 2.87Å; I1044-F1047 PolarHBondContact O-N 3.43Å; I1044-V1048 PolarHBondContact O-N 3.01Å
1045	I	92.3	Very high	90.1	Very high	13 Å²	13	11.8 Å²	11.8	7%	0.067	6%	0.061	C	C	.	.	H	α-helix	trans	-62.7	-42.4	176.5	-71.8	167.8	0	0	0	110.7	F1041 S1042 T1043 V1048 F1108 Q1111 A1112 F1115 V1144	F1041-I1045 WeakPolarHBondContact O-CB 3.12Å; F1041-I1045 VanDerWaalsContact O-CG1 3.28Å; F1041-I1045 WeakPolarHBondContact O-CG1 3.04Å; F1041-I1045 PolarHBondContact O-N 2.91Å; S1042-I1045 PolarHBondContact O-N 2.86Å; T1043-I1045 VanDerWaalsContact C-N 3.33Å; T1043-I1045 PolarHBondContact O-N 2.94Å; I1045-V1048 VanDerWaalsContact O-CB 3.27Å; I1045-V1048 WeakPolarHBondContact O-CB 3.47Å; I1045-V1048 WeakPolarHBondContact O-CG2 3.45Å; I1045-V1048 PolarHBondContact O-N 2.97Å; I1045-F1108 HydrophobicContact CD1-CD2 3.97Å; I1045-F1108 HydrophobicContact CD1-CE2 3.89Å; I1045-F1108 HydrophobicContact CG1-CE2 4.07Å; I1045-Q1111 HydrophobicContact CD1-CB 3.77Å; I1045-A1112 HydrophobicContact CD1-CB 4.46Å; I1045-F1115 HydrophobicContact CG2-CB 3.88Å; I1045-F1115 HydrophobicContact CG2-CD1 4.19Å; I1045-F1115 HydrophobicContact CG2-CD2 3.37Å; I1045-F1115 HydrophobicContact CG2-CE2 3.87Å; I1045-F1115 HydrophobicContact CG2-CG 3.55Å; I1045-F1115 HydrophobicContact CG2-CZ 4.45Å; I1045-V1144 HydrophobicContact CG2-CG2 4.23Å
1046	L	90.7	Very high	90.1	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-72	-29.9	178.1	-63.7	172.6	0	0	0	112.8	S1042 T1043 V1048 I1049 G1050 S1051 L1053 E1140 N1141	S1042-L1046 WeakPolarHBondContact O-CG 3.21Å; S1042-L1046 PolarHBondContact O-N 3.04Å; S1042-L1046 VanDerWaalsContact O-N 3.11Å; T1043-L1046 PolarHBondContact O-N 2.96Å; L1046-V1048 PolarHBondContact O-N 2.88Å; L1046-I1049 WeakPolarHBondContact O-CG1 3.46Å; L1046-I1049 PolarHBondContact O-N 2.79Å; L1046-G1050 PolarHBondContact O-N 3.39Å; L1046-S1051 CarbonylContact C-O 3.53Å; L1046-S1051 WeakPolarHBondContact CB-O 3.47Å; L1046-S1051 PolarHBondContact O-N 3.3Å; L1046-L1053 HydrophobicContact CD1-CD2 4.35Å; L1046-L1053 HydrophobicContact CD1-CG 4.05Å; L1046-E1140 HydrophobicContact CD2-CB 4.4Å; L1046-N1141 HydrophobicContact CD1-CB 4.41Å; L1046-N1141 VanDerWaalsContact CD1-OD1 3.3Å; L1046-N1141 WeakPolarHBondContact CD1-OD1 3.02Å; L1046-N1141 HydrophobicContact CD2-CB 4.14Å
1047	F	88.7	Confident	90.1	Very high	3 Å²	3	15.1 Å²	15.1	1%	0.013	7%	0.074	C	C	.	.	H	α-helix	trans	-63.5	-19.1	171.7	-68.1	-26	0	0	0	113.6	S401 L404 N408 R418 T1043 I1044 I1049 G1050 S1051 N1052	S401-F1047 WeakPolarHBondContact OG-CD2 3.33Å; L404-F1047 HydrophobicContact CD1-CB 4.44Å; N408-F1047 PolarHBondContact ND2-O 3.1Å; R418-F1047 HydrophobicContact CB-CZ 4.49Å; T1043-F1047 HydrophobicContact CG2-CE1 4.27Å; T1043-F1047 HydrophobicContact CG2-CE2 4.02Å; T1043-F1047 HydrophobicContact CG2-CZ 3.76Å; T1043-F1047 WeakPolarHBondContact O-CG 3.18Å; T1043-F1047 PolarHBondContact O-N 3.25Å; I1044-F1047 PolarHBondContact O-N 3.43Å; F1047-I1049 PolarHBondContact O-N 3.29Å; F1047-G1050 PolarHBondContact O-N 2.96Å; F1047-S1051 WeakPolarHBondContact CD1-O 3.3Å; F1047-N1052 HydrophobicContact CE1-CB 4.24Å
1048	V	88.3	Confident	90.1	Very high	65 Å²	65	15.1 Å²	15.1	39%	0.394	7%	0.074	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-28.5	171.2	-178.4	0	0	0	0	112	L404 N408 I1044 I1045 L1046 F1115	L404-V1048 HydrophobicContact CD1-CG2 4.13Å; L404-V1048 HydrophobicContact CD2-CG2 4.43Å; N408-V1048 VanDerWaalsContact ND2-C 3.33Å; N408-V1048 PolarHBondContact ND2-O 3.5Å; I1044-V1048 PolarHBondContact O-N 3.01Å; I1045-V1048 VanDerWaalsContact O-CB 3.27Å; I1045-V1048 WeakPolarHBondContact O-CB 3.47Å; I1045-V1048 WeakPolarHBondContact O-CG2 3.45Å; I1045-V1048 PolarHBondContact O-N 2.97Å; L1046-V1048 PolarHBondContact O-N 2.88Å; V1048-F1115 HydrophobicContact CB-CZ 4.4Å
1049	I	85.3	Confident	89.9	Confident	21 Å²	21	16.2 Å²	16.2	11%	0.108	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	0.6	170.7	49.8	178	0	0	0	114.2	L1046 F1047 S1051 F1115 L1127 E1140	L1046-I1049 WeakPolarHBondContact O-CG1 3.46Å; L1046-I1049 PolarHBondContact O-N 2.79Å; F1047-I1049 PolarHBondContact O-N 3.29Å; I1049-S1051 VanDerWaalsContact C-N 3.31Å; I1049-F1115 HydrophobicContact CD1-CE2 4.3Å; I1049-F1115 HydrophobicContact CG2-CZ 4.32Å; I1049-L1127 HydrophobicContact CD1-CD1 4.36Å; I1049-E1140 HydrophobicContact CD1-CB 3.91Å; I1049-E1140 HydrophobicContact CD1-CG 4.19Å
1050	G	81.6	Confident	89.9	Confident	2 Å²	2	17 Å²	17	2%	0.021	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.5	34.8	-171.8	0	0	0	0	0	113.2	N408 K410 L1046 F1047	N408-G1050 PolarHBondContact ND2-N 2.99Å; K410-G1050 VanDerWaalsContact CE-O 3.22Å; K410-G1050 WeakPolarHBondContact CE-O 3.49Å; K410-G1050 PolarHBondContact NZ-O 3.1Å; L1046-G1050 PolarHBondContact O-N 3.39Å; F1047-G1050 PolarHBondContact O-N 2.96Å
1051	S	85.7	Confident	89.9	Confident	1 Å²	1	17 Å²	17	1%	0.007	8%	0.082	C	C	.	.			trans	-105.7	166.2	168.3	-179.8	0	0	0	0	109.8	L1046 F1047 I1049 E1135 N1138	L1046-S1051 CarbonylContact C-O 3.53Å; L1046-S1051 WeakPolarHBondContact CB-O 3.47Å; L1046-S1051 PolarHBondContact O-N 3.3Å; F1047-S1051 WeakPolarHBondContact CD1-O 3.3Å; I1049-S1051 VanDerWaalsContact C-N 3.31Å; S1051-E1135 PolarHBondContact OG-O 2.92Å; S1051-N1138 PolarHBondContact OG-ND2 2.83Å
1052	N	86.7	Confident	89.8	Confident	1 Å²	1	14.7 Å²	14.7	1%	0.005	7%	0.073	C	C	.	.			trans	-141.1	174.6	169.3	-160.7	4.9	0	0	0	110.4	Y208 R418 T1043 F1047 Y1136	Y208-N1052 PolarHBondContact OH-ND2 2.59Å; R418-N1052 PolarHBondContact NH1-ND2 3.11Å; T1043-N1052 WeakPolarHBondContact CG2-OD1 3.49Å; F1047-N1052 HydrophobicContact CE1-CB 4.24Å; N1052-Y1136 HydrophobicContact CB-CE1 4.46Å
1053	L	89.3	Confident	89.4	Confident	6 Å²	6	17.8 Å²	17.8	3%	0.031	9%	0.086	C	C	.	.			trans	-70.7	152	166.6	-69.6	159.9	0	0	0	110.9	Y208 L1046 E1057 F1058 N1141 F1145	Y208-L1053 PolarHBondContact OH-O 2.82Å; L1046-L1053 HydrophobicContact CD1-CD2 4.35Å; L1046-L1053 HydrophobicContact CD1-CG 4.05Å; L1053-E1057 WeakPolarHBondContact CA-OE2 3.47Å; L1053-E1057 HydrophobicContact CB-CB 4.45Å; L1053-E1057 HydrophobicContact CD2-CB 4.25Å; L1053-E1057 WeakPolarHBondContact CD2-OE2 3.48Å; L1053-F1058 HydrophobicContact CB-CD2 4Å; L1053-F1058 HydrophobicContact CB-CE2 3.55Å; L1053-F1058 HydrophobicContact CB-CZ 3.9Å; L1053-F1058 HydrophobicContact CD1-CE1 4.09Å; L1053-F1058 HydrophobicContact CD1-CE2 4.42Å; L1053-F1058 HydrophobicContact CD1-CZ 3.92Å; L1053-N1141 WeakPolarHBondContact CD2-OD1 3.44Å; L1053-F1145 HydrophobicContact CD2-CB 4.18Å; L1053-F1145 HydrophobicContact CD2-CD2 3.86Å; L1053-F1145 HydrophobicContact CD2-CG 4.45Å
1054	S	89.4	Confident	89.3	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.107	C	C	.	.			trans	-81.9	160.7	176.1	82.9	0	0	0	0	112.7	W1056 E1057 F1058 L1201	S1054-W1056 PolarHBondContact O-N 3.19Å; S1054-E1057 PolarHBondContact N-OE2 3.39Å; S1054-E1057 WeakPolarHBondContact O-CB 3.43Å; S1054-E1057 PolarHBondContact O-N 2.74Å; S1054-E1057 VanDerWaalsContact OG-CG 3.3Å; S1054-E1057 WeakPolarHBondContact OG-CG 3.23Å; S1054-E1057 PolarHBondContact OG-N 3.01Å; S1054-F1058 WeakPolarHBondContact O-CD2 3.43Å; S1054-F1058 PolarHBondContact O-N 3.24Å; S1054-L1201 PolarHBondContact OG-O 3.06Å
1055	E	89.5	Confident	89.3	Confident	37 Å²	37	19.8 Å²	19.8	17%	0.173	10%	0.1	C	C	.	.	H	α-helix	trans	-60.2	-33.3	177.7	54	151.5	-158.6	0	0	113.1	Y208 I210 L1059	Y208-E1055 HydrophobicContact CD1-CB 3.78Å; Y208-E1055 HydrophobicContact CE1-CB 4.35Å; Y208-E1055 HydrophobicContact CG-CB 4.32Å; I210-E1055 WeakPolarHBondContact CB-OE2 3.24Å; I210-E1055 PolarHBondContact N-OE2 3.27Å; E1055-L1059 WeakPolarHBondContact O-CB 3.35Å; E1055-L1059 PolarHBondContact O-N 3.23Å
1056	W	90.7	Very high	89.3	Confident	70 Å²	70	19.2 Å²	19.2	27%	0.265	10%	0.096	S	C	.	.	H	α-helix	trans	-76.9	-31	178.7	-70.9	93.8	0	0	0	112.1	I210 S1054 L1059 Y1060 R1200 L1201	I210-W1056 HydrophobicContact CD1-CH2 4.36Å; I210-W1056 HydrophobicContact CD1-CZ2 3.5Å; I210-W1056 VanDerWaalsContact CD1-CZ2 3.5Å; I210-W1056 HydrophobicContact CG2-CH2 4.29Å; I210-W1056 HydrophobicContact CG2-CZ2 4.26Å; S1054-W1056 PolarHBondContact O-N 3.19Å; W1056-L1059 HydrophobicContact CE3-CD2 3.71Å; W1056-L1059 HydrophobicContact CH2-CD2 4.46Å; W1056-L1059 HydrophobicContact CZ3-CD2 3.6Å; W1056-Y1060 VanDerWaalsContact O-CB 3.25Å; W1056-Y1060 WeakPolarHBondContact O-CB 3.34Å; W1056-Y1060 PolarHBondContact O-N 3.46Å; W1056-R1200 VanDerWaalsContact CB-O 3.31Å; W1056-R1200 WeakPolarHBondContact CB-O 3.25Å; W1056-R1200 VanDerWaalsContact CD1-O 3.25Å; W1056-R1200 VanDerWaalsContact CG-O 3.29Å; W1056-L1201 HydrophobicContact CB-CD2 4.01Å
1057	E	93	Very high	89.1	Confident	0 Å²	0	20 Å²	20	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-64.2	-45.1	169.9	-72.9	173	155.5	0	0	110.9	L1053 S1054 C1061 N1141 F1145 L1201 L1203	L1053-E1057 WeakPolarHBondContact CA-OE2 3.47Å; L1053-E1057 HydrophobicContact CB-CB 4.45Å; L1053-E1057 HydrophobicContact CD2-CB 4.25Å; L1053-E1057 WeakPolarHBondContact CD2-OE2 3.48Å; S1054-E1057 PolarHBondContact N-OE2 3.39Å; S1054-E1057 WeakPolarHBondContact O-CB 3.43Å; S1054-E1057 PolarHBondContact O-N 2.74Å; S1054-E1057 VanDerWaalsContact OG-CG 3.3Å; S1054-E1057 WeakPolarHBondContact OG-CG 3.23Å; S1054-E1057 PolarHBondContact OG-N 3.01Å; E1057-C1061 PolarHBondContact O-N 2.86Å; E1057-C1061 PolarHBondContact O-SG 2.91Å; E1057-N1141 PolarHBondContact OE1-ND2 3.32Å; E1057-N1141 VanDerWaalsContact OE1-ND2 3.17Å; E1057-N1141 PolarHBondContact OE2-ND2 3.3Å; E1057-F1145 HydrophobicContact CB-CD2 3.79Å; E1057-F1145 HydrophobicContact CB-CE2 3.47Å; E1057-F1145 VanDerWaalsContact CB-CE2 3.47Å; E1057-F1145 HydrophobicContact CB-CZ 4.09Å; E1057-F1145 HydrophobicContact CG-CD1 4.38Å; E1057-F1145 HydrophobicContact CG-CD2 3.77Å; E1057-F1145 HydrophobicContact CG-CE1 4.23Å; E1057-F1145 HydrophobicContact CG-CE2 3.59Å; E1057-F1145 HydrophobicContact CG-CG 4.16Å; E1057-F1145 HydrophobicContact CG-CZ 3.83Å; E1057-L1201 HydrophobicContact CG-CB 4.42Å; E1057-L1201 HydrophobicContact CG-CD2 4.21Å; E1057-L1203 WeakPolarHBondContact OE1-CD2 3.37Å
1058	F	91	Very high	89.2	Confident	4 Å²	4	22 Å²	22	2%	0.018	11%	0.114	C	C	.	.	H	α-helix	trans	-61.4	-49.9	172.8	-81.5	-68.6	0	0	0	112.4	Y208 Y211 I425 Q1039 L1053 S1054 Y1060 C1061 D1062	Y208-F1058 HydrophobicContact CE2-CD2 4.23Å; Y208-F1058 AromaticContact CE2-CE2 3.99Å; Y208-F1058 HydrophobicContact CE2-CE2 3.99Å; Y211-F1058 HydrophobicContact CD2-CB 4.24Å; Y211-F1058 HydrophobicContact CE2-CB 4.3Å; Y211-F1058 HydrophobicContact CG-CB 4.47Å; I425-F1058 HydrophobicContact CD1-CE1 3.81Å; I425-F1058 HydrophobicContact CD1-CZ 3.64Å; I425-F1058 HydrophobicContact CG1-CE1 4.03Å; I425-F1058 HydrophobicContact CG1-CZ 4.3Å; Q1039-F1058 HydrophobicContact CG-CE1 4.32Å; L1053-F1058 HydrophobicContact CB-CD2 4Å; L1053-F1058 HydrophobicContact CB-CE2 3.55Å; L1053-F1058 HydrophobicContact CB-CZ 3.9Å; L1053-F1058 HydrophobicContact CD1-CE1 4.09Å; L1053-F1058 HydrophobicContact CD1-CE2 4.42Å; L1053-F1058 HydrophobicContact CD1-CZ 3.92Å; S1054-F1058 WeakPolarHBondContact O-CD2 3.43Å; S1054-F1058 PolarHBondContact O-N 3.24Å; F1058-Y1060 VanDerWaalsContact C-N 3.32Å; F1058-Y1060 PolarHBondContact O-N 2.85Å; F1058-C1061 PolarHBondContact O-N 2.82Å; F1058-D1062 PolarHBondContact O-N 3.09Å
1059	L	90.7	Very high	89.3	Confident	26 Å²	26	19 Å²	19	14%	0.136	10%	0.095	C	C	.	.	H	α-helix	trans	-57.8	-43.9	178.7	-170.3	81.4	0	0	0	111.7	Y211 C214 E1055 W1056 F1063	Y211-L1059 HydrophobicContact CD2-CB 4.38Å; Y211-L1059 HydrophobicContact CD2-CD1 4.19Å; C214-L1059 HydrophobicContact CB-CD1 3.82Å; E1055-L1059 WeakPolarHBondContact O-CB 3.35Å; E1055-L1059 PolarHBondContact O-N 3.23Å; W1056-L1059 HydrophobicContact CE3-CD2 3.71Å; W1056-L1059 HydrophobicContact CH2-CD2 4.46Å; W1056-L1059 HydrophobicContact CZ3-CD2 3.6Å; L1059-F1063 HydrophobicContact CD1-CD2 4.32Å; L1059-F1063 WeakPolarHBondContact O-CB 3.41Å; L1059-F1063 PolarHBondContact O-N 3.15Å
1060	Y	91.9	Very high	89.5	Confident	21 Å²	21	18 Å²	18	8%	0.082	9%	0.09	C	C	.	.	I	π-helix	trans	-63.3	-44.9	177.6	174.5	-103.8	0	0	0	112	W1056 F1058 V1064 I1065 F1145 T1149 F1185	W1056-Y1060 VanDerWaalsContact O-CB 3.25Å; W1056-Y1060 WeakPolarHBondContact O-CB 3.34Å; W1056-Y1060 PolarHBondContact O-N 3.46Å; F1058-Y1060 VanDerWaalsContact C-N 3.32Å; F1058-Y1060 PolarHBondContact O-N 2.85Å; Y1060-V1064 HydrophobicContact CD2-CB 3.84Å; Y1060-V1064 HydrophobicContact CD2-CG1 4.17Å; Y1060-V1064 HydrophobicContact CD2-CG2 3.98Å; Y1060-V1064 HydrophobicContact CE2-CB 4.01Å; Y1060-V1064 HydrophobicContact CE2-CG1 3.88Å; Y1060-V1064 VanDerWaalsContact O-CB 3.27Å; Y1060-V1064 WeakPolarHBondContact O-CB 3.44Å; Y1060-V1064 PolarHBondContact O-N 2.92Å; Y1060-V1064 VanDerWaalsContact O-N 3.15Å; Y1060-I1065 HydrophobicContact CD1-CD1 4.26Å; Y1060-I1065 HydrophobicContact CE1-CD1 3.48Å; Y1060-I1065 VanDerWaalsContact CE1-CD1 3.48Å; Y1060-I1065 HydrophobicContact CE1-CG1 4.02Å; Y1060-I1065 PolarHBondContact O-N 3.4Å; Y1060-F1145 HydrophobicContact CD1-CE2 4.45Å; Y1060-F1145 AromaticContact CD1-CZ 3.79Å; Y1060-F1145 HydrophobicContact CD1-CZ 3.79Å; Y1060-F1145 HydrophobicContact CE1-CZ 4.39Å; Y1060-T1149 HydrophobicContact CD1-CG2 4.34Å; Y1060-T1149 HydrophobicContact CE1-CG2 3.85Å; Y1060-F1185 HydrophobicContact CD2-CE1 4.28Å; Y1060-F1185 AromaticContact CE2-CD1 3.73Å; Y1060-F1185 HydrophobicContact CE2-CD1 3.73Å; Y1060-F1185 AromaticContact CE2-CE1 3.49Å; Y1060-F1185 HydrophobicContact CE2-CE1 3.49Å; Y1060-F1185 VanDerWaalsContact CE2-CE1 3.49Å; Y1060-F1185 HydrophobicContact CE2-CZ 4.42Å; Y1060-F1185 AromaticContact CZ-CD1 3.68Å; Y1060-F1185 AromaticContact CZ-CE1 3.77Å; Y1060-F1185 WeakPolarHBondContact OH-CD1 2.88Å
1061	C	92.1	Very high	89.7	Confident	2 Å²	2	21.3 Å²	21.3	1%	0.014	11%	0.108	C	C	.	.	I	π-helix	trans	-61.7	-59.7	177.9	-65.7	0	0	0	0	111.6	E1057 F1058 I1065 I1066 Y1152	E1057-C1061 PolarHBondContact O-N 2.86Å; E1057-C1061 PolarHBondContact O-SG 2.91Å; F1058-C1061 PolarHBondContact O-N 2.82Å; C1061-I1065 WeakPolarHBondContact O-CB 3.32Å; C1061-I1065 PolarHBondContact O-N 2.97Å; C1061-I1066 WeakPolarHBondContact O-CG1 3.06Å; C1061-I1066 PolarHBondContact O-N 3.31Å; C1061-Y1152 HydrophobicContact CB-CE2 4.1Å
1062	D	90	Very high	90	Very high	7 Å²	7	22.7 Å²	22.7	4%	0.037	12%	0.116	C	C	.	.	I	π-helix	trans	-74.9	-39.3	-168.1	-80.8	59.7	0	0	0	112.7	Y211 Y1035 Q1039 F1058 T1067	Y211-D1062 HydrophobicContact CE2-CB 4.39Å; Y1035-D1062 PolarHBondContact OH-OD2 2.85Å; Y1035-D1062 VanDerWaalsContact OH-OD2 3.07Å; Q1039-D1062 PolarHBondContact NE2-OD1 2.93Å; F1058-D1062 PolarHBondContact O-N 3.09Å; D1062-T1067 WeakPolarHBondContact O-CB 3.24Å; D1062-T1067 PolarHBondContact O-N 2.88Å; D1062-T1067 PolarHBondContact O-OG1 3.48Å
1063	F	86.6	Confident	90.1	Very high	65 Å²	65	22.7 Å²	22.7	29%	0.285	12%	0.116	S	C	.	.	I	π-helix	trans	-89.3	-43.5	-176.5	-116.4	-83.5	0	0	0	113.4	C214 I215 F218 L1059 T1067	C214-F1063 HydrophobicContact CB-CD2 4.41Å; C214-F1063 HydrophobicContact CB-CE2 3.86Å; C214-F1063 HydrophobicContact CB-CZ 4.4Å; I215-F1063 HydrophobicContact CD1-CD2 4.24Å; I215-F1063 HydrophobicContact CD1-CE2 4.05Å; F218-F1063 HydrophobicContact CB-CE2 4.44Å; F218-F1063 HydrophobicContact CB-CZ 3.96Å; F218-F1063 HydrophobicContact CD2-CZ 4.28Å; F218-F1063 HydrophobicContact CG-CZ 4.32Å; L1059-F1063 HydrophobicContact CD1-CD2 4.32Å; L1059-F1063 WeakPolarHBondContact O-CB 3.41Å; L1059-F1063 PolarHBondContact O-N 3.15Å; F1063-T1067 WeakPolarHBondContact O-CB 3.37Å
1064	V	89.1	Confident	89.9	Confident	72 Å²	72	22.5 Å²	22.5	44%	0.436	12%	0.115	S	C	.	.	I	π-helix	trans	-86	-47	-175.3	-173.4	0	0	0	0	111.5	Y1060 T1068	Y1060-V1064 HydrophobicContact CD2-CB 3.84Å; Y1060-V1064 HydrophobicContact CD2-CG1 4.17Å; Y1060-V1064 HydrophobicContact CD2-CG2 3.98Å; Y1060-V1064 HydrophobicContact CE2-CB 4.01Å; Y1060-V1064 HydrophobicContact CE2-CG1 3.88Å; Y1060-V1064 VanDerWaalsContact O-CB 3.27Å; Y1060-V1064 WeakPolarHBondContact O-CB 3.44Å; Y1060-V1064 PolarHBondContact O-N 2.92Å; Y1060-V1064 VanDerWaalsContact O-N 3.15Å; V1064-T1068 WeakPolarHBondContact O-CB 3.38Å; V1064-T1068 WeakPolarHBondContact O-CG2 3.49Å; V1064-T1068 PolarHBondContact O-OG1 3.17Å
1065	I	92.6	Very high	89.9	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.136	C	C	.	.	I	π-helix	trans	-83.4	-66.5	179.8	-60.8	179.9	0	0	0	111	Y1060 C1061 T1068 L1069 T1149 I1153	Y1060-I1065 HydrophobicContact CD1-CD1 4.26Å; Y1060-I1065 HydrophobicContact CE1-CD1 3.48Å; Y1060-I1065 VanDerWaalsContact CE1-CD1 3.48Å; Y1060-I1065 HydrophobicContact CE1-CG1 4.02Å; Y1060-I1065 PolarHBondContact O-N 3.4Å; C1061-I1065 WeakPolarHBondContact O-CB 3.32Å; C1061-I1065 PolarHBondContact O-N 2.97Å; I1065-T1068 PolarHBondContact O-OG1 3.2Å; I1065-L1069 HydrophobicContact CG2-CD1 3.61Å; I1065-L1069 VanDerWaalsContact O-CB 3.27Å; I1065-L1069 WeakPolarHBondContact O-CB 3.28Å; I1065-L1069 VanDerWaalsContact O-CG 3.26Å; I1065-L1069 WeakPolarHBondContact O-CG 3.34Å; I1065-L1069 PolarHBondContact O-N 2.86Å; I1065-T1149 HydrophobicContact CD1-CG2 4.21Å; I1065-I1153 HydrophobicContact CG2-CG1 4.38Å
1066	I	91.6	Very high	90	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.128	C	C	.	.	I	π-helix	trans	-66.1	-48.5	-166.2	-61.6	-57.3	0	0	0	112.1	F1031 Y1035 C1061 S1070 Y1152	F1031-I1066 HydrophobicContact CE1-CD1 4.42Å; F1031-I1066 HydrophobicContact CE1-CG2 4.23Å; F1031-I1066 HydrophobicContact CE2-CD1 3.92Å; F1031-I1066 HydrophobicContact CZ-CD1 3.56Å; F1031-I1066 HydrophobicContact CZ-CG2 4.38Å; Y1035-I1066 HydrophobicContact CD1-CD1 3.78Å; Y1035-I1066 HydrophobicContact CD1-CG1 4.06Å; Y1035-I1066 HydrophobicContact CD1-CG2 3.78Å; Y1035-I1066 HydrophobicContact CD2-CD1 3.94Å; Y1035-I1066 HydrophobicContact CD2-CG1 3.85Å; Y1035-I1066 HydrophobicContact CE1-CB 4.48Å; Y1035-I1066 HydrophobicContact CE1-CD1 4.48Å; Y1035-I1066 HydrophobicContact CE1-CG1 4.29Å; Y1035-I1066 HydrophobicContact CE1-CG2 3.47Å; Y1035-I1066 VanDerWaalsContact CE1-CG2 3.47Å; Y1035-I1066 HydrophobicContact CE2-CG1 4.02Å; Y1035-I1066 HydrophobicContact CE2-CG2 4.45Å; Y1035-I1066 HydrophobicContact CG-CD1 3.52Å; Y1035-I1066 HydrophobicContact CG-CG1 3.89Å; Y1035-I1066 HydrophobicContact CG-CG2 4.46Å; C1061-I1066 WeakPolarHBondContact O-CG1 3.06Å; C1061-I1066 PolarHBondContact O-N 3.31Å; I1066-S1070 WeakPolarHBondContact O-CB 2.95Å; I1066-S1070 PolarHBondContact O-N 3.02Å; I1066-Y1152 HydrophobicContact CD1-CG 4.17Å
1067	T	86.9	Confident	90	Very high	18 Å²	18	26.2 Å²	26.2	11%	0.11	13%	0.131	C	C	.	.	I	π-helix	trans	-64	-46.3	-176.6	-66.4	0	0	0	0	112	I430 D1062 F1063 S1070 L1071	I430-T1067 HydrophobicContact CD1-CG2 3.76Å; I430-T1067 WeakPolarHBondContact CD1-OG1 3.46Å; D1062-T1067 WeakPolarHBondContact O-CB 3.24Å; D1062-T1067 PolarHBondContact O-N 2.88Å; D1062-T1067 PolarHBondContact O-OG1 3.48Å; F1063-T1067 WeakPolarHBondContact O-CB 3.37Å; T1067-S1070 PolarHBondContact O-N 3.03Å; T1067-L1071 HydrophobicContact CG2-CD1 4.18Å; T1067-L1071 WeakPolarHBondContact O-CG 3.27Å; T1067-L1071 PolarHBondContact O-N 2.97Å; T1067-L1071 VanDerWaalsContact O-N 3.14Å
1068	T	90.6	Very high	90	Very high	45 Å²	45	26.7 Å²	26.7	28%	0.276	14%	0.136	S	C	.	.	H	α-helix	trans	-66.9	-44.3	-180	70.8	0	0	0	0	111.5	V1064 I1065 L1071 T1072 N1178	V1064-T1068 WeakPolarHBondContact O-CB 3.38Å; V1064-T1068 WeakPolarHBondContact O-CG2 3.49Å; V1064-T1068 PolarHBondContact O-OG1 3.17Å; I1065-T1068 PolarHBondContact O-OG1 3.2Å; T1068-L1071 PolarHBondContact O-N 3.05Å; T1068-T1072 WeakPolarHBondContact O-CB 3.42Å; T1068-T1072 PolarHBondContact O-N 3.44Å; T1068-T1072 PolarHBondContact O-OG1 3.44Å; T1068-N1178 VanDerWaalsContact CB-ND2 3.33Å; T1068-N1178 WeakPolarHBondContact CB-ND2 3.35Å; T1068-N1178 PolarHBondContact O-ND2 2.94Å; T1068-N1178 PolarHBondContact OG1-ND2 2.89Å; T1068-N1178 PolarHBondContact OG1-OD1 2.92Å
1069	L	92.2	Very high	90.1	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.8	-40.9	178	-71.6	175.1	0	0	0	111.1	F1031 I1065 L1071 T1072 F1073 I1153 A1156 F1175 N1178 I1179	F1031-L1069 HydrophobicContact CE1-CB 4.32Å; F1031-L1069 HydrophobicContact CZ-CB 4.13Å; I1065-L1069 HydrophobicContact CG2-CD1 3.61Å; I1065-L1069 VanDerWaalsContact O-CB 3.27Å; I1065-L1069 WeakPolarHBondContact O-CB 3.28Å; I1065-L1069 VanDerWaalsContact O-CG 3.26Å; I1065-L1069 WeakPolarHBondContact O-CG 3.34Å; I1065-L1069 PolarHBondContact O-N 2.86Å; L1069-L1071 PolarHBondContact O-N 2.69Å; L1069-T1072 WeakPolarHBondContact CA-OG1 3.48Å; L1069-T1072 PolarHBondContact O-N 3.38Å; L1069-T1072 PolarHBondContact O-OG1 3.04Å; L1069-F1073 WeakPolarHBondContact O-CB 3.25Å; L1069-F1073 PolarHBondContact O-N 2.84Å; L1069-I1153 HydrophobicContact CD1-CG1 4.38Å; L1069-A1156 HydrophobicContact CD1-CB 4.11Å; L1069-F1175 HydrophobicContact CD2-CD2 4.4Å; L1069-F1175 HydrophobicContact CD2-CE2 4.08Å; L1069-N1178 HydrophobicContact CD2-CB 4.39Å; L1069-N1178 PolarHBondContact N-ND2 2.9Å; L1069-I1179 HydrophobicContact CD2-CG1 3.77Å
1070	S	88.3	Confident	90	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.9	-47.6	176	174.7	0	0	0	0	112.8	T1028 M1032 I1066 T1067 G1074	T1028-S1070 WeakPolarHBondContact CG2-OG 3.29Å; M1032-S1070 WeakPolarHBondContact CE-OG 3.35Å; I1066-S1070 WeakPolarHBondContact O-CB 2.95Å; I1066-S1070 PolarHBondContact O-N 3.02Å; T1067-S1070 PolarHBondContact O-N 3.03Å; S1070-G1074 PolarHBondContact O-N 2.62Å
1071	L	86.6	Confident	89.9	Confident	73 Å²	73	38 Å²	38	38%	0.382	19%	0.192	S	C	.	.	H	α-helix	trans	-65.3	-47.9	179.4	-69.7	170.5	0	0	0	111.5	V437 T1067 T1068 L1069 G1074	V437-L1071 HydrophobicContact CG2-CD2 4.04Å; T1067-L1071 HydrophobicContact CG2-CD1 4.18Å; T1067-L1071 WeakPolarHBondContact O-CG 3.27Å; T1067-L1071 PolarHBondContact O-N 2.97Å; T1067-L1071 VanDerWaalsContact O-N 3.14Å; T1068-L1071 PolarHBondContact O-N 3.05Å; L1069-L1071 PolarHBondContact O-N 2.69Å; L1071-G1074 PolarHBondContact O-N 3.21Å
1072	T	91.1	Very high	89.8	Confident	30 Å²	30	38.2 Å²	38.2	18%	0.184	19%	0.192	C	C	.	.	H	α-helix	trans	-69.9	-35.4	-179.1	49	0	0	0	0	112.7	T1068 L1069 G1074 Y1075 N1172 A1174 N1178	T1068-T1072 WeakPolarHBondContact O-CB 3.42Å; T1068-T1072 PolarHBondContact O-N 3.44Å; T1068-T1072 PolarHBondContact O-OG1 3.44Å; L1069-T1072 WeakPolarHBondContact CA-OG1 3.48Å; L1069-T1072 PolarHBondContact O-N 3.38Å; L1069-T1072 PolarHBondContact O-OG1 3.04Å; T1072-G1074 PolarHBondContact O-N 3.49Å; T1072-Y1075 PolarHBondContact O-N 2.75Å; T1072-Y1075 VanDerWaalsContact O-N 3.17Å; T1072-N1172 PolarHBondContact O-ND2 3.36Å; T1072-A1174 HydrophobicContact CG2-CB 4.43Å; T1072-N1178 HydrophobicContact CG2-CB 4.31Å; T1072-N1178 PolarHBondContact OG1-ND2 2.83Å; T1072-N1178 VanDerWaalsContact OG1-ND2 3.15Å
1073	F	90.2	Very high	89.6	Confident	1 Å²	1	38.5 Å²	38.5	0%	0.004	20%	0.195	C	C	.	.	H	α-helix	trans	-54.5	-37.4	170.3	179.9	-74.6	0	0	0	111.7	T1024 T1028 L1069 Y1075 T1076 S1160 R1166 F1175	T1024-F1073 HydrophobicContact CG2-CD1 4.31Å; T1024-F1073 HydrophobicContact CG2-CE1 4.34Å; T1028-F1073 VanDerWaalsContact OG1-CD1 3.3Å; T1028-F1073 WeakPolarHBondContact OG1-CD1 3.44Å; T1028-F1073 WeakPolarHBondContact OG1-CE1 3.43Å; L1069-F1073 WeakPolarHBondContact O-CB 3.25Å; L1069-F1073 PolarHBondContact O-N 2.84Å; F1073-Y1075 VanDerWaalsContact C-N 3.27Å; F1073-Y1075 PolarHBondContact O-N 3.06Å; F1073-T1076 PolarHBondContact O-OG1 2.67Å; F1073-S1160 VanDerWaalsContact CE2-CA 3.5Å; F1073-R1166 PolarHBondContact O-NH2 3.2Å; F1073-F1175 HydrophobicContact CB-CD2 4.18Å; F1073-F1175 HydrophobicContact CB-CE2 3.79Å; F1073-F1175 HydrophobicContact CB-CZ 4.18Å; F1073-F1175 HydrophobicContact CD2-CE1 4.4Å; F1073-F1175 HydrophobicContact CD2-CE2 4.17Å; F1073-F1175 AromaticContact CD2-CZ 3.75Å; F1073-F1175 HydrophobicContact CD2-CZ 3.75Å; F1073-F1175 HydrophobicContact CG-CE2 4.47Å; F1073-F1175 HydrophobicContact CG-CZ 4.4Å
1074	G	85.2	Confident	89.4	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.01	20%	0.2	C	C	.	.	H	α-helix	trans	-64.1	-26.2	-179.4	0	0	0	0	0	115.1	F441 S1070 L1071 T1072 T1076	F441-G1074 VanDerWaalsContact CD2-C 3.48Å; F441-G1074 WeakPolarHBondContact CD2-O 3.24Å; S1070-G1074 PolarHBondContact O-N 2.62Å; L1071-G1074 PolarHBondContact O-N 3.21Å; T1072-G1074 PolarHBondContact O-N 3.49Å; G1074-T1076 VanDerWaalsContact C-N 3.32Å; G1074-T1076 PolarHBondContact O-N 2.67Å
1075	Y	88.6	Confident	89.1	Confident	112 Å²	112	37.9 Å²	37.9	44%	0.439	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-16.2	-169.2	-166.1	-111	0	0	0	114.3	F441 R445 T1072 F1073 H1077	F441-Y1075 AromaticContact CD1-CD2 3.96Å; F441-Y1075 HydrophobicContact CD1-CD2 3.96Å; F441-Y1075 HydrophobicContact CD1-CE2 4.5Å; F441-Y1075 AromaticContact CE1-CD2 3.87Å; F441-Y1075 HydrophobicContact CE1-CD2 3.87Å; F441-Y1075 HydrophobicContact CE1-CE2 4.48Å; F441-Y1075 HydrophobicContact CG-CD2 4.43Å; F441-Y1075 HydrophobicContact CZ-CD2 4.23Å; R445-Y1075 PolarHBondContact NH1-O 2.82Å; T1072-Y1075 PolarHBondContact O-N 2.75Å; T1072-Y1075 VanDerWaalsContact O-N 3.17Å; F1073-Y1075 VanDerWaalsContact C-N 3.27Å; F1073-Y1075 PolarHBondContact O-N 3.06Å; Y1075-H1077 PolarHBondContact O-N 2.86Å
1076	T	90.7	Very high	88.6	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.012	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-56.8	129.9	-176.2	-48.7	0	0	0	0	112.1	C1020 F1073 G1074 R1166 N1172	C1020-T1076 PolarHBondContact SG-O 2.69Å; C1020-T1076 VanDerWaalsContact SG-O 3.4Å; F1073-T1076 PolarHBondContact O-OG1 2.67Å; G1074-T1076 VanDerWaalsContact C-N 3.32Å; G1074-T1076 PolarHBondContact O-N 2.67Å; T1076-R1166 HydrophobicContact CG2-CB 4.29Å; T1076-N1172 PolarHBondContact N-ND2 3.31Å; T1076-N1172 PolarHBondContact OG1-ND2 3.13Å
1077	H	92.1	Very high	88.3	Confident	71 Å²	71	41.2 Å²	41.2	33%	0.329	22%	0.218	S	C	.	.	P	Polyproline II helix	trans	-74.9	157.8	-176.4	-74.6	-110.2	0	0	0	113.6	R445 Y1075 R1166 K1167	R445-H1077 WeakPolarHBondContact CD-ND1 3.45Å; Y1075-H1077 PolarHBondContact O-N 2.86Å; H1077-R1166 WeakPolarHBondContact O-CA 3.33Å; H1077-K1167 HydrophobicContact CB-CD 4.16Å; H1077-K1167 HydrophobicContact CB-CG 4.47Å; H1077-K1167 PolarHBondContact O-N 2.75Å
1078	A	92.5	Very high	87.8	Confident	11 Å²	11	43.5 Å²	43.5	9%	0.091	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-61.3	150.3	172.5	0	0	0	0	0	112.8	R1016 E1017 C1020 K1167	R1016-A1078 HydrophobicContact CB-CB 4.38Å; E1017-A1078 HydrophobicContact CG-CB 4.43Å; C1020-A1078 HydrophobicContact CB-CB 3.6Å; C1020-A1078 PolarHBondContact SG-N 2.7Å; A1078-K1167 WeakPolarHBondContact O-CG 3.24Å
1079	Y	91.9	Very high	87.1	Confident	96 Å²	96	43.4 Å²	43.4	38%	0.376	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-70.7	138.4	173.6	-162.6	-109.5	0	0	0	110.7	H1081 A1163 P1164 Y1165	Y1079-H1081 VanDerWaalsContact C-N 3.34Å; Y1079-H1081 HydrophobicContact CD1-CB 3.9Å; Y1079-H1081 HydrophobicContact CE1-CB 3.78Å; Y1079-H1081 PolarHBondContact O-N 2.94Å; Y1079-A1163 HydrophobicContact CD2-CB 4.41Å; Y1079-A1163 HydrophobicContact CE2-CB 4.2Å; Y1079-P1164 WeakPolarHBondContact CB-O 3.48Å; Y1079-Y1165 PolarHBondContact N-O 3.11Å
1080	P	88.9	Confident	86.4	Confident	79 Å²	79	50.1 Å²	50.1	51%	0.513	25%	0.254	S	S	.	.	S	Bend	trans	-63.8	-34.9	-175.1	-24.5	35	0	0	0	114.2	R1016	R1016-P1080 WeakPolarHBondContact CD-O 3.49Å; R1016-P1080 PolarHBondContact NH1-O 3.1Å
1081	H	90	Very high	85.7	Confident	114 Å²	114	50.2 Å²	50.2	53%	0.528	26%	0.255	S	S	.	.	S	Bend	trans	-87.5	138.5	177.9	-165.5	-70.3	0	0	0	110.8	Y1079	Y1079-H1081 VanDerWaalsContact C-N 3.34Å; Y1079-H1081 HydrophobicContact CD1-CB 3.9Å; Y1079-H1081 HydrophobicContact CE1-CB 3.78Å; Y1079-H1081 PolarHBondContact O-N 2.94Å
1082	L	89.6	Confident	85.2	Confident	5 Å²	5	49.6 Å²	49.6	3%	0.026	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-81.6	123.5	175.3	-175.2	62.2	0	0	0	109.8	T694 L695 A698 I700 P1012 I1015 R1016	T694-L1082 HydrophobicContact CG2-CB 4.48Å; L695-L1082 HydrophobicContact CD2-CD2 4.11Å; A698-L1082 HydrophobicContact CB-CB 4.11Å; A698-L1082 HydrophobicContact CB-CD2 3.5Å; A698-L1082 VanDerWaalsContact CB-CD2 3.5Å; A698-L1082 HydrophobicContact CB-CG 3.52Å; I700-L1082 HydrophobicContact CD1-CD2 3.85Å; P1012-L1082 HydrophobicContact CB-CD2 4.42Å; I1015-L1082 HydrophobicContact CB-CD1 4.22Å; I1015-L1082 HydrophobicContact CG2-CD1 3.68Å; R1016-L1082 HydrophobicContact CG-CB 4.12Å; R1016-L1082 HydrophobicContact CG-CD1 3.81Å
1083	S	86.1	Confident	84.6	Confident	14 Å²	14	49.2 Å²	49.2	10%	0.098	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-71.1	156.4	-176.7	62.4	0	0	0	0	113.2	R1019 E1085 Y1165	R1019-S1083 PolarHBondContact NH1-O 2.76Å; R1019-S1083 PolarHBondContact NH1-OG 2.91Å; S1083-E1085 PolarHBondContact OG-O 2.85Å; S1083-Y1165 WeakPolarHBondContact OG-CE1 3.47Å
1084	A	83.8	Confident	84.1	Confident	46 Å²	46	54.9 Å²	54.9	38%	0.38	28%	0.278	S	S	.	.	S	Bend	trans	-79.5	-33.8	173.2	0	0	0	0	0	113.4	A698	A698-A1084 WeakPolarHBondContact O-CA 3.3Å
1085	E	80.9	Confident	83.9	Confident	77 Å²	77	55.9 Å²	55.9	36%	0.36	28%	0.284	S	S	.	.	S	Bend	trans	-90.2	134.6	172.8	-64.5	-168.6	-177.1	0	0	110	S1083 Y1165	S1083-E1085 PolarHBondContact OG-O 2.85Å; E1085-Y1165 WeakPolarHBondContact O-CE1 3.49Å; E1085-Y1165 PolarHBondContact O-OH 3.04Å; E1085-Y1165 VanDerWaalsContact O-OH 3.12Å
1086	P	83.7	Confident	83.6	Confident	56 Å²	56	51.3 Å²	51.3	36%	0.364	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-83.7	155.2	170.3	32.6	-34	0	0	0	112.2	Y1165	P1086-Y1165 PolarHBondContact O-OH 2.96Å
1087	P	83.8	Confident	83.4	Confident	14 Å²	14	52.5 Å²	52.5	9%	0.091	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-64.4	161.6	176	27.6	-35.8	0	0	0	113.6	G463 V464 R1019 L1022 V1023 Y1165	G463-P1087 WeakPolarHBondContact O-CD 3.32Å; V464-P1087 HydrophobicContact CG1-CG 4.43Å; R1019-P1087 HydrophobicContact CB-CG 4.49Å; R1019-P1087 HydrophobicContact CG-CG 4.1Å; L1022-P1087 HydrophobicContact CD2-CB 4.16Å; L1022-P1087 HydrophobicContact CD2-CG 3.8Å; V1023-P1087 HydrophobicContact CG2-CB 3.68Å; V1023-P1087 HydrophobicContact CG2-CG 4.35Å; P1087-Y1165 HydrophobicContact CB-CE1 4.35Å; P1087-Y1165 HydrophobicContact CG-CE1 4.41Å
1088	T	78	Confident	83.2	Confident	66 Å²	66	52.5 Å²	52.5	41%	0.405	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-76.3	126.2	-179.3	48	0	0	0	0	112.3	F1026	F1026-T1088 WeakPolarHBondContact CE1-O 3.43Å; F1026-T1088 WeakPolarHBondContact CZ-O 3.49Å
1089	M	74.1	Confident	83	Confident	43 Å²	43	52 Å²	52	21%	0.212	27%	0.271	C	S	.	.			trans	-78.3	-24.4	178.7	-73.8	179.9	80.3	0	0	116.3	F377 V464 F967	F377-M1089 HydrophobicContact CD2-CE 3.81Å; F377-M1089 HydrophobicContact CE2-CE 3.4Å; F377-M1089 VanDerWaalsContact CE2-CE 3.4Å; F377-M1089 HydrophobicContact CZ-CE 4.23Å; V464-M1089 HydrophobicContact CB-CG 4.03Å; V464-M1089 HydrophobicContact CB-SD 4.15Å; V464-M1089 HydrophobicContact CG1-CG 3.44Å; V464-M1089 VanDerWaalsContact CG1-CG 3.44Å; V464-M1089 HydrophobicContact CG1-SD 4.22Å; V464-M1089 HydrophobicContact CG2-CE 4.07Å; V464-M1089 HydrophobicContact CG2-CG 4.11Å; V464-M1089 HydrophobicContact CG2-SD 3.95Å; F967-M1089 HydrophobicContact CD2-SD 4.41Å; F967-M1089 HydrophobicContact CE1-CE 3.59Å; F967-M1089 HydrophobicContact CE1-SD 4.14Å; F967-M1089 HydrophobicContact CE2-CE 4.11Å; F967-M1089 HydrophobicContact CE2-SD 3.55Å; F967-M1089 VanDerWaalsContact CE2-SD 3.55Å; F967-M1089 HydrophobicContact CZ-CE 3.31Å; F967-M1089 HydrophobicContact CZ-SD 3.4Å; F967-M1089 WeakPolarHBondContact CZ-SD 3.49Å
1090	R	78.9	Confident	82.9	Confident	142 Å²	142	47.6 Å²	47.6	54%	0.536	25%	0.254	S	S	.	.			trans	-96.2	127	-173.7	-65.3	-162.8	-163.3	-167.3	6.1	110.5	D382 F1026 S1093	D382-R1090 WeakPolarHBondContact OD2-CA 3.41Å; D382-R1090 VanDerWaalsContact OD2-CB 3.26Å; D382-R1090 WeakPolarHBondContact OD2-CB 3.21Å; F1026-R1090 WeakPolarHBondContact CE1-O 3.44Å; R1090-S1093 WeakPolarHBondContact O-CB 3.38Å; R1090-S1093 PolarHBondContact O-N 2.97Å
1091	L	73.9	Confident	83	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.01	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-48.1	179	-153.4	72.4	0	0	0	109.8	F379 D382 A383 F386 F1026 F1029 S1093 T1096	F379-L1091 HydrophobicContact CD2-CD1 3.88Å; F379-L1091 HydrophobicContact CE2-CD1 3.51Å; F379-L1091 HydrophobicContact CZ-CD1 4.5Å; D382-L1091 HydrophobicContact CB-CB 3.74Å; D382-L1091 PolarHBondContact OD2-N 2.82Å; A383-L1091 HydrophobicContact CB-CD2 4.06Å; F386-L1091 HydrophobicContact CB-CD2 4.07Å; F386-L1091 HydrophobicContact CG-CD2 4.34Å; F1026-L1091 HydrophobicContact CD1-CD1 4.08Å; F1026-L1091 HydrophobicContact CE1-CD1 3.92Å; F1026-L1091 HydrophobicContact CE2-CD1 4.4Å; F1026-L1091 HydrophobicContact CG-CD1 4.39Å; F1026-L1091 HydrophobicContact CZ-CD1 4.08Å; F1029-L1091 HydrophobicContact CB-CD1 4.44Å; F1029-L1091 HydrophobicContact CD1-CD1 3.85Å; F1029-L1091 HydrophobicContact CD1-CD2 3.87Å; F1029-L1091 HydrophobicContact CD1-CG 3.98Å; F1029-L1091 HydrophobicContact CD2-CD2 4.17Å; F1029-L1091 HydrophobicContact CE1-CD1 4.29Å; F1029-L1091 HydrophobicContact CE1-CD2 3.47Å; F1029-L1091 VanDerWaalsContact CE1-CD2 3.47Å; F1029-L1091 HydrophobicContact CE1-CG 3.93Å; F1029-L1091 HydrophobicContact CE2-CD2 3.78Å; F1029-L1091 HydrophobicContact CG-CD1 4Å; F1029-L1091 HydrophobicContact CG-CD2 4.22Å; F1029-L1091 HydrophobicContact CG-CG 4.5Å; F1029-L1091 HydrophobicContact CZ-CD2 3.43Å; F1029-L1091 VanDerWaalsContact CZ-CD2 3.43Å; F1029-L1091 HydrophobicContact CZ-CG 4.37Å; L1091-S1093 PolarHBondContact O-N 3.47Å; L1091-T1096 VanDerWaalsContact O-CB 3.23Å; L1091-T1096 WeakPolarHBondContact O-CB 3.47Å; L1091-T1096 WeakPolarHBondContact O-CG2 3.35Å; L1091-T1096 PolarHBondContact O-OG1 3.29Å
1092	L	75.7	Confident	83.2	Confident	60 Å²	60	43.6 Å²	43.6	31%	0.314	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	36.7	176	-67.2	159.9	0	0	0	112.6	Q385 F386 M1097	Q385-L1092 HydrophobicContact CB-CD1 3.62Å; F386-L1092 HydrophobicContact CB-CD2 4.22Å; F386-L1092 HydrophobicContact CB-CG 4.4Å; F386-L1092 HydrophobicContact CD2-CD2 3.76Å; F386-L1092 HydrophobicContact CD2-CG 4.42Å; F386-L1092 HydrophobicContact CG-CD2 4.44Å; L1092-M1097 HydrophobicContact CD2-CE 4.46Å; L1092-M1097 HydrophobicContact CD2-SD 3.95Å
1093	S	78	Confident	83.4	Confident	21 Å²	21	43.5 Å²	43.5	15%	0.147	23%	0.231	C	C	.	.			trans	-75.3	142.5	171.9	104.8	0	0	0	0	110.2	R1090 L1091 V1095 T1096 M1097	R1090-S1093 WeakPolarHBondContact O-CB 3.38Å; R1090-S1093 PolarHBondContact O-N 2.97Å; L1091-S1093 PolarHBondContact O-N 3.47Å; S1093-V1095 PolarHBondContact O-N 3.43Å; S1093-V1095 VanDerWaalsContact O-N 3.13Å; S1093-V1095 PolarHBondContact OG-N 2.95Å; S1093-T1096 WeakPolarHBondContact CB-OG1 3.36Å; S1093-T1096 WeakPolarHBondContact O-CB 3.46Å; S1093-T1096 PolarHBondContact O-N 3.32Å; S1093-T1096 PolarHBondContact OG-N 3.48Å; S1093-T1096 PolarHBondContact OG-OG1 3.08Å; S1093-M1097 WeakPolarHBondContact O-CG 3.42Å; S1093-M1097 PolarHBondContact O-N 3.49Å
1094	M	80	Confident	83.8	Confident	120 Å²	120	43 Å²	43	59%	0.591	23%	0.228	S	C	*	.	H	α-helix	trans	-54.1	-34.7	178	-76.2	-69.6	179.1	0	0	113	I1098	M1094-I1098 WeakPolarHBondContact O-CB 3.36Å; M1094-I1098 WeakPolarHBondContact O-CD1 3.46Å; M1094-I1098 WeakPolarHBondContact O-CG1 3.45Å; M1094-I1098 PolarHBondContact O-N 2.92Å
1095	V	81.1	Confident	84.3	Confident	22 Å²	22	45.7 Å²	45.7	13%	0.133	24%	0.235	C	C	.	.	H	α-helix	trans	-68.7	-44.7	177.7	-176	0	0	0	0	110.5	S1093 S1099 V1233 R1239	S1093-V1095 PolarHBondContact O-N 3.43Å; S1093-V1095 VanDerWaalsContact O-N 3.13Å; S1093-V1095 PolarHBondContact OG-N 2.95Å; V1095-S1099 VanDerWaalsContact O-CB 3.28Å; V1095-S1099 WeakPolarHBondContact O-CB 3.4Å; V1095-S1099 PolarHBondContact O-N 2.97Å; V1095-V1233 HydrophobicContact CG1-CG1 3.88Å; V1095-R1239 HydrophobicContact CG1-CG 4.39Å; V1095-R1239 HydrophobicContact CG2-CG 4.23Å
1096	T	81.8	Confident	85	Confident	16 Å²	16	43.3 Å²	43.3	10%	0.098	23%	0.225	C	C	.	.	H	α-helix	trans	-60.8	-45.6	176.8	-36.7	0	0	0	0	111.4	K1030 L1091 S1093 S1099 L1100	K1030-T1096 HydrophobicContact CD-CG2 3.83Å; K1030-T1096 HydrophobicContact CG-CG2 3.88Å; L1091-T1096 VanDerWaalsContact O-CB 3.23Å; L1091-T1096 WeakPolarHBondContact O-CB 3.47Å; L1091-T1096 WeakPolarHBondContact O-CG2 3.35Å; L1091-T1096 PolarHBondContact O-OG1 3.29Å; S1093-T1096 WeakPolarHBondContact CB-OG1 3.36Å; S1093-T1096 WeakPolarHBondContact O-CB 3.46Å; S1093-T1096 PolarHBondContact O-N 3.32Å; S1093-T1096 PolarHBondContact OG-N 3.48Å; S1093-T1096 PolarHBondContact OG-OG1 3.08Å; T1096-S1099 PolarHBondContact O-N 3.2Å; T1096-L1100 WeakPolarHBondContact O-CB 3.17Å; T1096-L1100 PolarHBondContact O-N 2.78Å
1097	M	85.8	Confident	85.5	Confident	28 Å²	28	40.7 Å²	40.7	14%	0.138	21%	0.208	C	C	.	.	H	α-helix	trans	-69.7	-40.6	-178.5	-59.9	-49.9	-61.2	0	0	112.4	F386 L1092 S1093 L1100 F1101	F386-M1097 HydrophobicContact CD2-CE 4.28Å; F386-M1097 HydrophobicContact CD2-SD 4.06Å; F386-M1097 HydrophobicContact CE2-CE 3.71Å; F386-M1097 HydrophobicContact CE2-SD 3.73Å; L1092-M1097 HydrophobicContact CD2-CE 4.46Å; L1092-M1097 HydrophobicContact CD2-SD 3.95Å; S1093-M1097 WeakPolarHBondContact O-CG 3.42Å; S1093-M1097 PolarHBondContact O-N 3.49Å; M1097-L1100 PolarHBondContact O-N 3.03Å; M1097-F1101 HydrophobicContact CB-CD2 4.32Å; M1097-F1101 HydrophobicContact CB-CE2 4.46Å; M1097-F1101 HydrophobicContact CE-CD2 4.07Å; M1097-F1101 HydrophobicContact CE-CE2 3.31Å; M1097-F1101 HydrophobicContact CE-CZ 3.75Å; M1097-F1101 WeakPolarHBondContact O-CB 3.16Å; M1097-F1101 VanDerWaalsContact O-CD2 3.3Å; M1097-F1101 WeakPolarHBondContact O-CD2 3.41Å; M1097-F1101 PolarHBondContact O-N 3.49Å
1098	I	88	Confident	86.1	Confident	71 Å²	71	43.9 Å²	43.9	36%	0.364	22%	0.22	S	C	.	.	H	α-helix	trans	-65.5	-41.4	175.8	-70.2	166.3	0	0	0	110.6	M1094 G1102 V1233 I1242	M1094-I1098 WeakPolarHBondContact O-CB 3.36Å; M1094-I1098 WeakPolarHBondContact O-CD1 3.46Å; M1094-I1098 WeakPolarHBondContact O-CG1 3.45Å; M1094-I1098 PolarHBondContact O-N 2.92Å; I1098-G1102 WeakPolarHBondContact O-CA 3.35Å; I1098-G1102 PolarHBondContact O-N 3.49Å; I1098-V1233 HydrophobicContact CG2-CG1 4.24Å; I1098-V1233 HydrophobicContact CG2-CG2 3.91Å; I1098-I1242 HydrophobicContact CD1-CD1 3.98Å
1099	S	89.9	Confident	87	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-58.7	-54.2	173.3	163.9	0	0	0	0	110.9	K1030 V1095 T1096 G1102 Q1103 F1159 E1230	K1030-S1099 PolarHBondContact NZ-OG 2.66Å; V1095-S1099 VanDerWaalsContact O-CB 3.28Å; V1095-S1099 WeakPolarHBondContact O-CB 3.4Å; V1095-S1099 PolarHBondContact O-N 2.97Å; T1096-S1099 PolarHBondContact O-N 3.2Å; S1099-G1102 PolarHBondContact O-N 3.45Å; S1099-Q1103 WeakPolarHBondContact O-CG 3.03Å; S1099-Q1103 PolarHBondContact O-N 3.16Å; S1099-Q1103 VanDerWaalsContact O-N 3.15Å; S1099-F1159 WeakPolarHBondContact OG-CE1 3.12Å; S1099-E1230 WeakPolarHBondContact CB-OE2 3.35Å; S1099-E1230 PolarHBondContact OG-OE1 3.19Å; S1099-E1230 PolarHBondContact OG-OE2 3.45Å
1100	L	90.1	Very high	88	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.016	22%	0.219	C	C	.	.	H	α-helix	trans	-60.9	-57.2	-178.7	179.6	66.8	0	0	0	112.7	F386 K1030 A1033 T1096 M1097 G1102 Q1103 V1104 F1159	F386-L1100 HydrophobicContact CE2-CD2 3.89Å; F386-L1100 HydrophobicContact CZ-CD2 3.51Å; K1030-L1100 WeakPolarHBondContact O-CD1 3.39Å; A1033-L1100 HydrophobicContact CB-CD1 4.22Å; A1033-L1100 HydrophobicContact CB-CD2 3.96Å; T1096-L1100 WeakPolarHBondContact O-CB 3.17Å; T1096-L1100 PolarHBondContact O-N 2.78Å; M1097-L1100 PolarHBondContact O-N 3.03Å; L1100-G1102 VanDerWaalsContact C-N 3.27Å; L1100-G1102 PolarHBondContact O-N 2.99Å; L1100-Q1103 PolarHBondContact O-N 3.37Å; L1100-V1104 HydrophobicContact CD1-CG2 4.45Å; L1100-V1104 WeakPolarHBondContact O-CG2 3.37Å; L1100-V1104 PolarHBondContact O-N 2.99Å; L1100-F1159 HydrophobicContact CD1-CZ 4.37Å
1101	F	90.8	Very high	88.8	Confident	91 Å²	91	37.4 Å²	37.4	40%	0.399	19%	0.193	S	C	.	.	H	α-helix	trans	-66	-31.2	-178	-71.6	-53.9	0	0	0	112.2	L1037 M1097 V1104 I1105	L1037-F1101 HydrophobicContact CD1-CE1 4.41Å; M1097-F1101 HydrophobicContact CB-CD2 4.32Å; M1097-F1101 HydrophobicContact CB-CE2 4.46Å; M1097-F1101 HydrophobicContact CE-CD2 4.07Å; M1097-F1101 HydrophobicContact CE-CE2 3.31Å; M1097-F1101 HydrophobicContact CE-CZ 3.75Å; M1097-F1101 WeakPolarHBondContact O-CB 3.16Å; M1097-F1101 VanDerWaalsContact O-CD2 3.3Å; M1097-F1101 WeakPolarHBondContact O-CD2 3.41Å; M1097-F1101 PolarHBondContact O-N 3.49Å; F1101-V1104 PolarHBondContact O-N 2.78Å; F1101-I1105 WeakPolarHBondContact O-CB 3.08Å; F1101-I1105 WeakPolarHBondContact O-CD1 3.28Å; F1101-I1105 WeakPolarHBondContact O-CG1 3.32Å; F1101-I1105 PolarHBondContact O-N 3.14Å
1102	G	92.6	Very high	89.9	Confident	19 Å²	19	38.4 Å²	38.4	20%	0.196	20%	0.202	C	C	.	.	H	α-helix	trans	-58.5	-48.5	172.6	0	0	0	0	0	112	I1098 S1099 L1100 I1105 I1106	I1098-G1102 WeakPolarHBondContact O-CA 3.35Å; I1098-G1102 PolarHBondContact O-N 3.49Å; S1099-G1102 PolarHBondContact O-N 3.45Å; L1100-G1102 VanDerWaalsContact C-N 3.27Å; L1100-G1102 PolarHBondContact O-N 2.99Å; G1102-I1105 PolarHBondContact O-N 2.97Å; G1102-I1106 WeakPolarHBondContact O-CD1 3.2Å; G1102-I1106 VanDerWaalsContact O-CG1 3.27Å; G1102-I1106 WeakPolarHBondContact O-CG1 3.35Å; G1102-I1106 PolarHBondContact O-N 3.16Å; G1102-I1106 VanDerWaalsContact O-N 3.16Å
1103	Q	94.5	Very high	90.8	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.009	20%	0.204	C	C	.	.	H	α-helix	trans	-64.3	-42.1	176.1	-61.9	-56.7	-24.5	0	0	112.5	S1099 L1100 I1105 I1106 G1107 L1155 F1159 S1226	S1099-Q1103 WeakPolarHBondContact O-CG 3.03Å; S1099-Q1103 PolarHBondContact O-N 3.16Å; S1099-Q1103 VanDerWaalsContact O-N 3.15Å; L1100-Q1103 PolarHBondContact O-N 3.37Å; Q1103-I1105 PolarHBondContact O-N 3.46Å; Q1103-I1106 PolarHBondContact O-N 2.73Å; Q1103-G1107 PolarHBondContact O-N 3.02Å; Q1103-L1155 HydrophobicContact CB-CD2 3.68Å; Q1103-L1155 HydrophobicContact CG-CD2 4.15Å; Q1103-F1159 HydrophobicContact CB-CZ 4.2Å; Q1103-F1159 HydrophobicContact CG-CE1 3.78Å; Q1103-F1159 HydrophobicContact CG-CZ 3.73Å; Q1103-S1226 PolarHBondContact NE2-O 3.05Å; Q1103-S1226 VanDerWaalsContact OE1-CA 3.3Å; Q1103-S1226 PolarHBondContact OE1-OG 2.97Å
1104	V	93.4	Very high	91.6	Very high	5 Å²	5	37.3 Å²	37.3	3%	0.03	20%	0.197	C	C	.	.	H	α-helix	trans	-63.3	-40.9	179.5	171.2	0	0	0	0	111.8	L1037 I1038 F1041 L1100 F1101 G1107 F1108	L1037-V1104 HydrophobicContact CB-CG1 3.96Å; L1037-V1104 HydrophobicContact CB-CG2 3.85Å; L1037-V1104 HydrophobicContact CD1-CG2 4.04Å; I1038-V1104 HydrophobicContact CG1-CG2 4.4Å; F1041-V1104 HydrophobicContact CD2-CG1 3.84Å; F1041-V1104 HydrophobicContact CE2-CG1 3.44Å; F1041-V1104 VanDerWaalsContact CE2-CG1 3.44Å; L1100-V1104 HydrophobicContact CD1-CG2 4.45Å; L1100-V1104 WeakPolarHBondContact O-CG2 3.37Å; L1100-V1104 PolarHBondContact O-N 2.99Å; F1101-V1104 PolarHBondContact O-N 2.78Å; V1104-G1107 PolarHBondContact O-N 2.81Å; V1104-F1108 PolarHBondContact O-N 3.44Å
1105	I	94.8	Very high	92.3	Very high	101 Å²	101	32.5 Å²	32.5	52%	0.518	17%	0.173	S	C	.	.	H	α-helix	trans	-65.2	-42.8	176.4	-70.7	164.6	0	0	0	111.2	F1101 G1102 Q1103 G1107 F1108 I1109	F1101-I1105 WeakPolarHBondContact O-CB 3.08Å; F1101-I1105 WeakPolarHBondContact O-CD1 3.28Å; F1101-I1105 WeakPolarHBondContact O-CG1 3.32Å; F1101-I1105 PolarHBondContact O-N 3.14Å; G1102-I1105 PolarHBondContact O-N 2.97Å; Q1103-I1105 PolarHBondContact O-N 3.46Å; I1105-G1107 VanDerWaalsContact C-N 3.35Å; I1105-F1108 PolarHBondContact O-N 3.28Å; I1105-I1109 HydrophobicContact CG2-CD1 3.79Å; I1105-I1109 VanDerWaalsContact O-CG1 3.29Å; I1105-I1109 WeakPolarHBondContact O-CG1 3.48Å; I1105-I1109 PolarHBondContact O-N 2.88Å
1106	I	95.7	Very high	92.9	Very high	28 Å²	28	35.7 Å²	35.7	14%	0.144	19%	0.188	C	C	.	.	H	α-helix	trans	-61.2	-46.2	175.2	-63.6	162.9	0	0	0	110	G1102 Q1103 F1108 I1109 I1110 N1222 A1225 V1229	G1102-I1106 WeakPolarHBondContact O-CD1 3.2Å; G1102-I1106 VanDerWaalsContact O-CG1 3.27Å; G1102-I1106 WeakPolarHBondContact O-CG1 3.35Å; G1102-I1106 PolarHBondContact O-N 3.16Å; G1102-I1106 VanDerWaalsContact O-N 3.16Å; Q1103-I1106 PolarHBondContact O-N 2.73Å; I1106-F1108 PolarHBondContact O-N 2.88Å; I1106-I1109 PolarHBondContact O-N 3.18Å; I1106-I1110 HydrophobicContact CG2-CG1 4.4Å; I1106-I1110 VanDerWaalsContact O-CG1 3.3Å; I1106-I1110 WeakPolarHBondContact O-CG1 3.46Å; I1106-I1110 PolarHBondContact O-N 3.19Å; I1106-N1222 VanDerWaalsContact CG2-OD1 3.26Å; I1106-N1222 WeakPolarHBondContact CG2-OD1 3.32Å; I1106-A1225 HydrophobicContact CG2-CB 4.18Å; I1106-V1229 HydrophobicContact CD1-CB 4.2Å; I1106-V1229 HydrophobicContact CD1-CG1 4.47Å; I1106-V1229 HydrophobicContact CD1-CG2 3.98Å
1107	G	95.5	Very high	93.5	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-54.9	-51.6	177.2	0	0	0	0	0	112.6	Q1103 V1104 I1105 I1109 I1110 Q1111 Q1151	Q1103-G1107 PolarHBondContact O-N 3.02Å; V1104-G1107 PolarHBondContact O-N 2.81Å; I1105-G1107 VanDerWaalsContact C-N 3.35Å; G1107-I1109 PolarHBondContact O-N 2.76Å; G1107-I1110 PolarHBondContact O-N 3.09Å; G1107-Q1111 WeakPolarHBondContact O-CG 3.39Å; G1107-Q1111 PolarHBondContact O-N 2.85Å; G1107-Q1151 VanDerWaalsContact CA-OE1 3.28Å; G1107-Q1151 PolarHBondContact O-NE2 2.8Å; G1107-Q1151 PolarHBondContact O-OE1 2.99Å
1108	F	95.1	Very high	93.9	Very high	81 Å²	81	36.5 Å²	36.5	36%	0.355	19%	0.192	S	C	.	.	H	α-helix	trans	-59	-45.7	177.2	175.3	-107.5	0	0	0	113	F1041 I1045 V1104 I1105 I1106 I1110 Q1111 A1112	F1041-F1108 HydrophobicContact CB-CD2 3.96Å; F1041-F1108 AromaticContact CD1-CD2 3.69Å; F1041-F1108 HydrophobicContact CD1-CD2 3.69Å; F1041-F1108 HydrophobicContact CD1-CE2 4.04Å; F1041-F1108 HydrophobicContact CD1-CG 4.41Å; F1041-F1108 HydrophobicContact CE1-CD2 4.43Å; F1041-F1108 HydrophobicContact CG-CB 4.47Å; F1041-F1108 AromaticContact CG-CD2 3.89Å; F1041-F1108 HydrophobicContact CG-CD2 3.89Å; F1041-F1108 HydrophobicContact CG-CG 4.49Å; I1045-F1108 HydrophobicContact CD1-CD2 3.97Å; I1045-F1108 HydrophobicContact CD1-CE2 3.89Å; I1045-F1108 HydrophobicContact CG1-CE2 4.07Å; V1104-F1108 PolarHBondContact O-N 3.44Å; I1105-F1108 PolarHBondContact O-N 3.28Å; I1106-F1108 PolarHBondContact O-N 2.88Å; F1108-I1110 VanDerWaalsContact C-N 3.33Å; F1108-I1110 PolarHBondContact O-N 2.95Å; F1108-Q1111 PolarHBondContact O-N 2.88Å; F1108-A1112 WeakPolarHBondContact O-CB 3.25Å; F1108-A1112 PolarHBondContact O-N 2.87Å
1109	I	96.4	Very high	94	Very high	91 Å²	91	37.4 Å²	37.4	47%	0.467	19%	0.191	S	C	.	.	H	α-helix	trans	-61.2	-43.8	179	-69.9	166.3	0	0	0	110.7	I1105 I1106 G1107 T1113	I1105-I1109 HydrophobicContact CG2-CD1 3.79Å; I1105-I1109 VanDerWaalsContact O-CG1 3.29Å; I1105-I1109 WeakPolarHBondContact O-CG1 3.48Å; I1105-I1109 PolarHBondContact O-N 2.88Å; I1106-I1109 PolarHBondContact O-N 3.18Å; G1107-I1109 PolarHBondContact O-N 2.76Å; I1109-T1113 VanDerWaalsContact O-CB 3.32Å; I1109-T1113 WeakPolarHBondContact O-CB 3.47Å; I1109-T1113 PolarHBondContact O-N 3.05Å; I1109-T1113 PolarHBondContact O-OG1 2.88Å
1110	I	96.4	Very high	94.1	Very high	24 Å²	24	45.3 Å²	45.3	12%	0.123	23%	0.225	C	C	.	.	H	α-helix	trans	-66	-42.6	178.7	-64.6	-76.1	0	0	0	110.9	I1106 G1107 F1108 T1113 A1114 V1147 M1218 N1222	I1106-I1110 HydrophobicContact CG2-CG1 4.4Å; I1106-I1110 VanDerWaalsContact O-CG1 3.3Å; I1106-I1110 WeakPolarHBondContact O-CG1 3.46Å; I1106-I1110 PolarHBondContact O-N 3.19Å; G1107-I1110 PolarHBondContact O-N 3.09Å; F1108-I1110 VanDerWaalsContact C-N 3.33Å; F1108-I1110 PolarHBondContact O-N 2.95Å; I1110-T1113 PolarHBondContact O-N 2.83Å; I1110-A1114 PolarHBondContact O-N 3.13Å; I1110-V1147 HydrophobicContact CG2-CG1 3.77Å; I1110-M1218 HydrophobicContact CG2-CE 4.23Å; I1110-M1218 WeakPolarHBondContact O-CE 3.27Å; I1110-N1222 HydrophobicContact CD1-CB 4.17Å; I1110-N1222 HydrophobicContact CG1-CB 4.04Å; I1110-N1222 HydrophobicContact CG2-CB 4.44Å
1111	Q	96.1	Very high	94.1	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.2	-49.1	176	-74.3	172.1	-23.8	0	0	112.4	I1038 S1042 I1045 G1107 F1108 T1113 A1114 F1115 V1147 S1148	I1038-Q1111 VanDerWaalsContact CG2-NE2 3.29Å; I1038-Q1111 PolarHBondContact O-NE2 2.91Å; S1042-Q1111 PolarHBondContact OG-NE2 3.19Å; I1045-Q1111 HydrophobicContact CD1-CB 3.77Å; G1107-Q1111 WeakPolarHBondContact O-CG 3.39Å; G1107-Q1111 PolarHBondContact O-N 2.85Å; F1108-Q1111 PolarHBondContact O-N 2.88Å; Q1111-T1113 VanDerWaalsContact C-N 3.27Å; Q1111-T1113 PolarHBondContact O-N 2.92Å; Q1111-A1114 PolarHBondContact O-N 3.49Å; Q1111-A1114 VanDerWaalsContact O-N 3.1Å; Q1111-F1115 WeakPolarHBondContact O-CB 3.42Å; Q1111-F1115 PolarHBondContact O-N 3.5Å; Q1111-V1147 HydrophobicContact CG-CG1 4.4Å; Q1111-S1148 PolarHBondContact NE2-OG 2.91Å
1112	A	95.3	Very high	93.9	Very high	23 Å²	23	49 Å²	49	19%	0.19	26%	0.258	C	S	.	.	H	α-helix	trans	-60.7	-38.6	177.4	0	0	0	0	0	111.4	I1045 F1108 F1115 I1116	I1045-A1112 HydrophobicContact CD1-CB 4.46Å; F1108-A1112 WeakPolarHBondContact O-CB 3.25Å; F1108-A1112 PolarHBondContact O-N 2.87Å; A1112-F1115 PolarHBondContact O-N 3.23Å; A1112-I1116 WeakPolarHBondContact O-CB 3.45Å; A1112-I1116 WeakPolarHBondContact O-CD1 3.41Å; A1112-I1116 VanDerWaalsContact O-CG1 3.24Å; A1112-I1116 WeakPolarHBondContact O-CG1 3.25Å; A1112-I1116 PolarHBondContact O-N 3.3Å
1113	T	95.6	Very high	93.7	Very high	58 Å²	58	50.7 Å²	50.7	36%	0.356	26%	0.259	S	S	.	.	H	α-helix	trans	-62.8	-41.8	173.8	-56.7	0	0	0	0	111.4	I1109 I1110 Q1111 I1116 L1117 M1218	I1109-T1113 VanDerWaalsContact O-CB 3.32Å; I1109-T1113 WeakPolarHBondContact O-CB 3.47Å; I1109-T1113 PolarHBondContact O-N 3.05Å; I1109-T1113 PolarHBondContact O-OG1 2.88Å; I1110-T1113 PolarHBondContact O-N 2.83Å; Q1111-T1113 VanDerWaalsContact C-N 3.27Å; Q1111-T1113 PolarHBondContact O-N 2.92Å; T1113-I1116 PolarHBondContact O-N 3.4Å; T1113-L1117 HydrophobicContact CG2-CD1 3.75Å; T1113-L1117 HydrophobicContact CG2-CG 4.11Å; T1113-L1117 VanDerWaalsContact O-CB 3.32Å; T1113-L1117 WeakPolarHBondContact O-CB 3.46Å; T1113-L1117 VanDerWaalsContact O-CG 3.27Å; T1113-L1117 WeakPolarHBondContact O-CG 3.41Å; T1113-L1117 PolarHBondContact O-N 2.81Å; T1113-M1218 HydrophobicContact CG2-CE 3.7Å
1114	A	95.2	Very high	93.3	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-67	-43.1	178.9	0	0	0	0	0	111.8	I1110 Q1111 I1116 L1117 I1118 V1147 L1215 M1218	I1110-A1114 PolarHBondContact O-N 3.13Å; Q1111-A1114 PolarHBondContact O-N 3.49Å; Q1111-A1114 VanDerWaalsContact O-N 3.1Å; A1114-I1116 VanDerWaalsContact C-N 3.31Å; A1114-I1116 PolarHBondContact O-N 2.97Å; A1114-L1117 PolarHBondContact O-N 3.43Å; A1114-I1118 PolarHBondContact O-N 3.11Å; A1114-I1118 VanDerWaalsContact O-N 3.13Å; A1114-V1147 HydrophobicContact CB-CG2 3.98Å; A1114-L1215 HydrophobicContact CB-CD2 4.44Å; A1114-M1218 HydrophobicContact CB-CE 3.87Å
1115	F	94.3	Very high	92.7	Very high	18 Å²	18	58.4 Å²	58.4	8%	0.079	29%	0.294	C	S	.	.	H	α-helix	trans	-59.5	-38.3	174.5	-178.9	-92.2	0	0	0	112.7	I1045 V1048 I1049 Q1111 A1112 R1119 E1140 V1144	I1045-F1115 HydrophobicContact CG2-CB 3.88Å; I1045-F1115 HydrophobicContact CG2-CD1 4.19Å; I1045-F1115 HydrophobicContact CG2-CD2 3.37Å; I1045-F1115 HydrophobicContact CG2-CE2 3.87Å; I1045-F1115 HydrophobicContact CG2-CG 3.55Å; I1045-F1115 HydrophobicContact CG2-CZ 4.45Å; V1048-F1115 HydrophobicContact CB-CZ 4.4Å; I1049-F1115 HydrophobicContact CD1-CE2 4.3Å; I1049-F1115 HydrophobicContact CG2-CZ 4.32Å; Q1111-F1115 WeakPolarHBondContact O-CB 3.42Å; Q1111-F1115 PolarHBondContact O-N 3.5Å; A1112-F1115 PolarHBondContact O-N 3.23Å; F1115-R1119 WeakPolarHBondContact O-CD 3.45Å; F1115-R1119 WeakPolarHBondContact O-CG 3.38Å; F1115-E1140 HydrophobicContact CD2-CB 3.75Å; F1115-E1140 HydrophobicContact CD2-CG 3.98Å; F1115-E1140 HydrophobicContact CE2-CB 3.75Å; F1115-E1140 HydrophobicContact CE2-CG 3.83Å; F1115-V1144 HydrophobicContact CB-CG2 4.08Å; F1115-V1144 HydrophobicContact CD2-CG2 4.19Å
1116	I	94.4	Very high	91.9	Very high	90 Å²	90	56.9 Å²	56.9	46%	0.462	29%	0.291	S	S	.	.	H	α-helix	trans	-75.4	-46.9	176.5	-69.4	166.4	0	0	0	111.2	A1112 T1113 A1114 I1118 R1119 F1120	A1112-I1116 WeakPolarHBondContact O-CB 3.45Å; A1112-I1116 WeakPolarHBondContact O-CD1 3.41Å; A1112-I1116 VanDerWaalsContact O-CG1 3.24Å; A1112-I1116 WeakPolarHBondContact O-CG1 3.25Å; A1112-I1116 PolarHBondContact O-N 3.3Å; T1113-I1116 PolarHBondContact O-N 3.4Å; A1114-I1116 VanDerWaalsContact C-N 3.31Å; A1114-I1116 PolarHBondContact O-N 2.97Å; I1116-I1118 VanDerWaalsContact C-N 3.32Å; I1116-I1118 PolarHBondContact O-N 3.11Å; I1116-R1119 WeakPolarHBondContact O-CB 3.44Å; I1116-R1119 PolarHBondContact O-N 2.91Å; I1116-F1120 HydrophobicContact CG2-CD2 3.96Å; I1116-F1120 HydrophobicContact CG2-CE2 3.49Å; I1116-F1120 VanDerWaalsContact CG2-CE2 3.49Å; I1116-F1120 WeakPolarHBondContact O-CD2 3.25Å
1117	L	94	Very high	90.6	Very high	60 Å²	60	56.7 Å²	56.7	31%	0.314	29%	0.29	S	S	.	.	H	α-helix	trans	-65.3	-31.4	-174.9	-76.7	178	0	0	0	113.6	T1113 A1114 R1119 F1120 Q1121 F1211 I1214 M1218	T1113-L1117 HydrophobicContact CG2-CD1 3.75Å; T1113-L1117 HydrophobicContact CG2-CG 4.11Å; T1113-L1117 VanDerWaalsContact O-CB 3.32Å; T1113-L1117 WeakPolarHBondContact O-CB 3.46Å; T1113-L1117 VanDerWaalsContact O-CG 3.27Å; T1113-L1117 WeakPolarHBondContact O-CG 3.41Å; T1113-L1117 PolarHBondContact O-N 2.81Å; A1114-L1117 PolarHBondContact O-N 3.43Å; L1117-R1119 VanDerWaalsContact C-N 3.29Å; L1117-R1119 PolarHBondContact O-N 2.89Å; L1117-F1120 PolarHBondContact O-N 2.86Å; L1117-Q1121 PolarHBondContact O-NE2 3.12Å; L1117-F1211 HydrophobicContact CB-CE2 4.17Å; L1117-I1214 HydrophobicContact CD1-CG2 4.31Å; L1117-M1218 HydrophobicContact CD1-SD 3.89Å
1118	I	92.8	Very high	88.9	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-68.9	-30.1	177.3	-163.5	153.7	0	0	0	112.4	A1114 I1116 F1120 Q1121 W1123 Y1124 Y1139 E1140 A1143 F1211	A1114-I1118 PolarHBondContact O-N 3.11Å; A1114-I1118 VanDerWaalsContact O-N 3.13Å; I1116-I1118 VanDerWaalsContact C-N 3.32Å; I1116-I1118 PolarHBondContact O-N 3.11Å; I1118-F1120 VanDerWaalsContact C-N 3.3Å; I1118-F1120 PolarHBondContact O-N 3.1Å; I1118-Q1121 WeakPolarHBondContact O-CB 3.29Å; I1118-Q1121 VanDerWaalsContact O-CG 3.3Å; I1118-Q1121 WeakPolarHBondContact O-CG 3.38Å; I1118-Q1121 PolarHBondContact O-N 2.98Å; I1118-W1123 HydrophobicContact CD1-CH2 3.94Å; I1118-W1123 HydrophobicContact CD1-CZ3 4.29Å; I1118-W1123 HydrophobicContact CG1-CH2 3.9Å; I1118-W1123 HydrophobicContact CG1-CZ3 4.25Å; I1118-Y1124 WeakPolarHBondContact O-CB 3.31Å; I1118-Y1139 WeakPolarHBondContact CD1-O 3.46Å; I1118-E1140 HydrophobicContact CG2-CG 4.09Å; I1118-A1143 HydrophobicContact CB-CB 4.41Å; I1118-A1143 HydrophobicContact CD1-CB 3.8Å; I1118-A1143 HydrophobicContact CG2-CB 4.35Å; I1118-F1211 HydrophobicContact CB-CE1 4.12Å; I1118-F1211 HydrophobicContact CB-CE2 4.26Å; I1118-F1211 HydrophobicContact CB-CZ 3.6Å; I1118-F1211 HydrophobicContact CD1-CD1 4.4Å; I1118-F1211 HydrophobicContact CD1-CE1 3.73Å; I1118-F1211 HydrophobicContact CD1-CZ 4.13Å; I1118-F1211 HydrophobicContact CG1-CE1 4.05Å; I1118-F1211 HydrophobicContact CG1-CZ 3.97Å
1119	R	90.4	Very high	87.1	Confident	91 Å²	91	64.6 Å²	64.6	34%	0.343	33%	0.331	S	S	.	.	H	α-helix	trans	-71.7	-23.1	178.1	-65.9	169.6	166	-123.4	-26.3	113.7	F1115 I1116 L1117 Q1121 Y1124 E1140	F1115-R1119 WeakPolarHBondContact O-CD 3.45Å; F1115-R1119 WeakPolarHBondContact O-CG 3.38Å; I1116-R1119 WeakPolarHBondContact O-CB 3.44Å; I1116-R1119 PolarHBondContact O-N 2.91Å; L1117-R1119 VanDerWaalsContact C-N 3.29Å; L1117-R1119 PolarHBondContact O-N 2.89Å; R1119-Q1121 VanDerWaalsContact C-N 3.28Å; R1119-Y1124 HydrophobicContact CB-CE1 4.42Å; R1119-Y1124 HydrophobicContact CG-CE1 4.26Å; R1119-Y1124 HydrophobicContact CG-CE2 4.04Å; R1119-E1140 IonicContact CZ-OE1 2.63Å; R1119-E1140 IonicContact NE-OE1 3.58Å; R1119-E1140 IonicContact NH2-OE1 3.67Å; R1119-E1140 PolarHBondContact NH2-OE1 3.24Å
1120	F	91.8	Very high	84.9	Confident	165 Å²	165	69.6 Å²	69.6	72%	0.724	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-0.2	174.8	-72.8	-60.1	0	0	0	113.5	I1116 L1117 I1118	I1116-F1120 HydrophobicContact CG2-CD2 3.96Å; I1116-F1120 HydrophobicContact CG2-CE2 3.49Å; I1116-F1120 VanDerWaalsContact CG2-CE2 3.49Å; I1116-F1120 WeakPolarHBondContact O-CD2 3.25Å; L1117-F1120 PolarHBondContact O-N 2.86Å; I1118-F1120 VanDerWaalsContact C-N 3.3Å; I1118-F1120 PolarHBondContact O-N 3.1Å
1121	Q	90.5	Very high	82.6	Confident	45 Å²	45	71.2 Å²	71.2	21%	0.21	36%	0.359	C	S	.	.	S	Bend	trans	-79.8	139.5	-179.8	-56.9	-57	-57	0	0	111.7	L1117 I1118 R1119 W1123 Y1124 F1211	L1117-Q1121 PolarHBondContact O-NE2 3.12Å; I1118-Q1121 WeakPolarHBondContact O-CB 3.29Å; I1118-Q1121 VanDerWaalsContact O-CG 3.3Å; I1118-Q1121 WeakPolarHBondContact O-CG 3.38Å; I1118-Q1121 PolarHBondContact O-N 2.98Å; R1119-Q1121 VanDerWaalsContact C-N 3.28Å; Q1121-W1123 HydrophobicContact CB-CD2 4.01Å; Q1121-W1123 HydrophobicContact CB-CG 4.43Å; Q1121-W1123 HydrophobicContact CB-CH2 4.27Å; Q1121-W1123 HydrophobicContact CB-CZ2 3.68Å; Q1121-W1123 HydrophobicContact CG-CH2 4.13Å; Q1121-W1123 HydrophobicContact CG-CZ2 3.56Å; Q1121-W1123 PolarHBondContact O-N 2.88Å; Q1121-W1123 VanDerWaalsContact O-N 3.13Å; Q1121-Y1124 VanDerWaalsContact O-CB 3.28Å; Q1121-Y1124 WeakPolarHBondContact O-CB 3.29Å; Q1121-Y1124 PolarHBondContact O-N 3.16Å; Q1121-Y1124 VanDerWaalsContact O-N 3.09Å; Q1121-F1211 VanDerWaalsContact CD-CD2 3.41Å; Q1121-F1211 HydrophobicContact CG-CD2 3.7Å; Q1121-F1211 HydrophobicContact CG-CE2 3.91Å; Q1121-F1211 HydrophobicContact CG-CG 4.41Å
1122	S	87.4	Confident	80.4	Confident	128 Å²	128	79.2 Å²	79.2	90%	0.895	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-17.6	-178.3	52.8	0	0	0	0	115.1
1123	W	88.2	Confident	78.4	Confident	54 Å²	54	84.1 Å²	84.1	21%	0.205	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	3.3	179	49.4	-94.2	0	0	0	113.1	I1118 Q1121 Y1139 I1206 P1207 S1208 F1211	I1118-W1123 HydrophobicContact CD1-CH2 3.94Å; I1118-W1123 HydrophobicContact CD1-CZ3 4.29Å; I1118-W1123 HydrophobicContact CG1-CH2 3.9Å; I1118-W1123 HydrophobicContact CG1-CZ3 4.25Å; Q1121-W1123 HydrophobicContact CB-CD2 4.01Å; Q1121-W1123 HydrophobicContact CB-CG 4.43Å; Q1121-W1123 HydrophobicContact CB-CH2 4.27Å; Q1121-W1123 HydrophobicContact CB-CZ2 3.68Å; Q1121-W1123 HydrophobicContact CG-CH2 4.13Å; Q1121-W1123 HydrophobicContact CG-CZ2 3.56Å; Q1121-W1123 PolarHBondContact O-N 2.88Å; Q1121-W1123 VanDerWaalsContact O-N 3.13Å; W1123-Y1139 HydrophobicContact CE3-CE1 4.22Å; W1123-Y1139 AromaticContact CZ3-CD1 3.79Å; W1123-Y1139 HydrophobicContact CZ3-CD1 3.79Å; W1123-Y1139 AromaticContact CZ3-CE1 3.86Å; W1123-Y1139 HydrophobicContact CZ3-CE1 3.86Å; W1123-Y1139 HydrophobicContact CZ3-CG 4.34Å; W1123-I1206 HydrophobicContact CH2-CG2 3.8Å; W1123-I1206 HydrophobicContact CZ2-CG2 4.17Å; W1123-I1206 HydrophobicContact CZ3-CG2 4.49Å; W1123-P1207 HydrophobicContact CB-CG 4.27Å; W1123-P1207 HydrophobicContact CD2-CG 3.63Å; W1123-P1207 HydrophobicContact CE3-CG 3.55Å; W1123-P1207 HydrophobicContact CG-CG 3.94Å; W1123-P1207 HydrophobicContact CZ3-CG 4.21Å; W1123-S1208 VanDerWaalsContact NE1-CB 3.32Å; W1123-F1211 HydrophobicContact CH2-CB 4.45Å; W1123-F1211 HydrophobicContact CH2-CD1 4.17Å; W1123-F1211 HydrophobicContact CH2-CG 4.22Å; W1123-F1211 HydrophobicContact CZ2-CB 3.73Å; W1123-F1211 HydrophobicContact CZ2-CD1 4.24Å; W1123-F1211 HydrophobicContact CZ2-CD2 4.35Å; W1123-F1211 AromaticContact CZ2-CG 3.84Å; W1123-F1211 HydrophobicContact CZ2-CG 3.84Å
1124	Y	86.7	Confident	76.6	Confident	50 Å²	50	81.8 Å²	81.8	20%	0.196	42%	0.416	C	S	.	.			trans	-67.8	137	178.8	167.5	-99.8	0	0	0	111.5	I1118 R1119 Q1121 P1126 E1140	I1118-Y1124 WeakPolarHBondContact O-CB 3.31Å; R1119-Y1124 HydrophobicContact CB-CE1 4.42Å; R1119-Y1124 HydrophobicContact CG-CE1 4.26Å; R1119-Y1124 HydrophobicContact CG-CE2 4.04Å; Q1121-Y1124 VanDerWaalsContact O-CB 3.28Å; Q1121-Y1124 WeakPolarHBondContact O-CB 3.29Å; Q1121-Y1124 PolarHBondContact O-N 3.16Å; Q1121-Y1124 VanDerWaalsContact O-N 3.09Å; Y1124-P1126 HydrophobicContact CE1-CB 4.4Å; Y1124-E1140 HydrophobicContact CE2-CG 4.36Å; Y1124-E1140 PolarHBondContact OH-OE1 2.89Å
1125	M	79.8	Confident	75.5	Confident	118 Å²	118	83.5 Å²	83.5	58%	0.581	42%	0.424	S	S	*	.			trans	-125.5	133.7	173.5	-67.9	-179.4	160.4	0	0	109.6	Y1139	M1125-Y1139 HydrophobicContact CB-CE2 4.23Å
1126	P	77.7	Confident	74.7	Confident	69 Å²	69	84.7 Å²	84.7	45%	0.448	43%	0.428	S	S	.	.			trans	-75.8	155.2	-179.6	31.9	-35.4	0	0	0	112.8	Y1124 Y1128 S1129	Y1124-P1126 HydrophobicContact CE1-CB 4.4Å; P1126-Y1128 PolarHBondContact O-N 2.78Å; P1126-S1129 PolarHBondContact O-N 2.55Å
1127	L	68.2	Low	74.2	Confident	24 Å²	24	84.6 Å²	84.6	13%	0.126	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-38.7	-44.6	-175.9	-159.9	88.4	0	0	0	115.5	I1049 S1129 N1138	I1049-L1127 HydrophobicContact CD1-CD1 4.36Å; L1127-S1129 VanDerWaalsContact C-N 3.28Å; L1127-S1129 PolarHBondContact O-N 2.68Å; L1127-N1138 HydrophobicContact CD1-CB 3.62Å; L1127-N1138 VanDerWaalsContact CD1-ND2 3.27Å; L1127-N1138 WeakPolarHBondContact CD1-ND2 3.42Å
1128	Y	61.4	Low	73.8	Confident	163 Å²	163	82 Å²	82	64%	0.639	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-80.3	2.4	-168.7	-66.5	-78.7	0	0	0	115.3	P1126	P1126-Y1128 PolarHBondContact O-N 2.78Å
1129	S	57.2	Low	73.7	Confident	85 Å²	85	84 Å²	84	59%	0.594	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-86.1	-8.7	-177.5	-66.4	0	0	0	0	115.5	P1126 L1127	P1126-S1129 PolarHBondContact O-N 2.55Å; L1127-S1129 VanDerWaalsContact C-N 3.28Å; L1127-S1129 PolarHBondContact O-N 2.68Å
1130	Y	50.1	Low	73.7	Confident	196 Å²	196	79.7 Å²	79.7	77%	0.769	40%	0.404	S	S	*	.	S	Bend	trans	-107.3	-57.4	-169.6	-138.4	-97	0	0	0	114.8
1131	S	48.4	Very low	73.7	Confident	58 Å²	58	71.8 Å²	71.8	41%	0.406	37%	0.37	S	S	.	.			trans	-175.8	155	178.8	172.6	0	0	0	0	110.5	T1133 A1134	S1131-T1133 WeakPolarHBondContact CB-OG1 3.12Å; S1131-T1133 PolarHBondContact O-N 2.91Å; S1131-T1133 VanDerWaalsContact O-N 3.12Å; S1131-T1133 PolarHBondContact OG-N 2.95Å; S1131-T1133 VanDerWaalsContact OG-N 3.11Å; S1131-T1133 PolarHBondContact OG-OG1 3.41Å; S1131-A1134 WeakPolarHBondContact O-CB 3.41Å; S1131-A1134 PolarHBondContact O-N 2.82Å; S1131-A1134 VanDerWaalsContact O-N 3.1Å
1132	N	48.2	Very low	73.8	Confident	169 Å²	169	69.7 Å²	69.7	90%	0.904	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-17.5	168.4	-84.7	-7.7	0	0	0	113.6
1133	T	53	Low	74.1	Confident	126 Å²	126	63.6 Å²	63.6	77%	0.773	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-2	177	56.4	0	0	0	0	114.1	S1131 E1135	S1131-T1133 WeakPolarHBondContact CB-OG1 3.12Å; S1131-T1133 PolarHBondContact O-N 2.91Å; S1131-T1133 VanDerWaalsContact O-N 3.12Å; S1131-T1133 PolarHBondContact OG-N 2.95Å; S1131-T1133 VanDerWaalsContact OG-N 3.11Å; S1131-T1133 PolarHBondContact OG-OG1 3.41Å; T1133-E1135 PolarHBondContact O-N 3.41Å
1134	A	59.4	Low	74.4	Confident	9 Å²	9	61 Å²	61	7%	0.074	31%	0.307	C	S	.	.			trans	-93.9	25	-169.9	0	0	0	0	0	115	S1131 Y1136 Q1137	S1131-A1134 WeakPolarHBondContact O-CB 3.41Å; S1131-A1134 PolarHBondContact O-N 2.82Å; S1131-A1134 VanDerWaalsContact O-N 3.1Å; A1134-Y1136 PolarHBondContact O-N 2.81Å; A1134-Q1137 PolarHBondContact O-N 3.18Å
1135	E	70.7	Confident	74.8	Confident	35 Å²	35	58.7 Å²	58.7	16%	0.164	30%	0.298	C	S	.	.	S	Bend	trans	-52.9	-35.3	-172.9	-174.1	169	-111.1	0	0	113.5	K410 R418 S1051 T1133 N1138	K410-E1135 IonicContact NZ-OE1 3.55Å; K410-E1135 PolarHBondContact NZ-OE1 2.68Å; R418-E1135 IonicContact CZ-OE2 2.69Å; R418-E1135 IonicContact NE-OE2 2.66Å; R418-E1135 IonicContact NH2-OE2 2.7Å; R418-E1135 PolarHBondContact NH2-OE2 2.97Å; S1051-E1135 PolarHBondContact OG-O 2.92Å; T1133-E1135 PolarHBondContact O-N 3.41Å; E1135-N1138 PolarHBondContact O-ND2 2.79Å
1136	Y	78.5	Confident	75.5	Confident	43 Å²	43	53.4 Å²	53.4	17%	0.169	27%	0.272	C	S	.	.	S	Bend	trans	-95.5	-27.4	-178.8	-48.7	-72.5	0	0	0	114.5	R418 N1052 A1134 N1138 N1141	R418-Y1136 PolarHBondContact NH2-OH 2.9Å; N1052-Y1136 HydrophobicContact CB-CE1 4.46Å; A1134-Y1136 PolarHBondContact O-N 2.81Å; Y1136-N1138 PolarHBondContact O-N 2.89Å; Y1136-N1138 VanDerWaalsContact O-N 3.08Å; Y1136-N1138 PolarHBondContact O-ND2 3.34Å; Y1136-N1141 PolarHBondContact O-ND2 3.11Å
1137	Q	83.2	Confident	76.3	Confident	88 Å²	88	50.2 Å²	50.2	41%	0.411	25%	0.251	S	S	.	.			trans	-85.9	79.5	-173	-75.2	-171.4	-12.8	0	0	111.2	A1134 Q1202 V1204	A1134-Q1137 PolarHBondContact O-N 3.18Å; Q1137-Q1202 HydrophobicContact CG-CB 3.98Å; Q1137-Q1202 WeakPolarHBondContact CG-O 3.36Å; Q1137-V1204 HydrophobicContact CB-CG2 4.17Å
1138	N	86.6	Confident	77.6	Confident	6 Å²	6	49.2 Å²	49.2	3%	0.032	25%	0.246	C	C	.	.	S	Bend	trans	-141.9	161.4	177.6	60.6	80.5	0	0	0	114.1	S1051 L1127 E1135 Y1136 N1141 A1142	S1051-N1138 PolarHBondContact OG-ND2 2.83Å; L1127-N1138 HydrophobicContact CD1-CB 3.62Å; L1127-N1138 VanDerWaalsContact CD1-ND2 3.27Å; L1127-N1138 WeakPolarHBondContact CD1-ND2 3.42Å; E1135-N1138 PolarHBondContact O-ND2 2.79Å; Y1136-N1138 PolarHBondContact O-N 2.89Å; Y1136-N1138 VanDerWaalsContact O-N 3.08Å; Y1136-N1138 PolarHBondContact O-ND2 3.34Å; N1138-N1141 VanDerWaalsContact OD1-CB 3.26Å; N1138-N1141 WeakPolarHBondContact OD1-CB 3.48Å; N1138-N1141 PolarHBondContact OD1-N 2.89Å; N1138-A1142 PolarHBondContact O-N 2.73Å; N1138-A1142 VanDerWaalsContact O-N 3.14Å
1139	Y	89.8	Confident	79.2	Confident	41 Å²	41	41.4 Å²	41.4	16%	0.161	22%	0.216	C	C	.	.	H	α-helix	trans	-67.1	-37.8	-176.6	-72.9	-67.5	0	0	0	112.1	I1118 W1123 M1125 A1142 A1143 V1204	I1118-Y1139 WeakPolarHBondContact CD1-O 3.46Å; W1123-Y1139 HydrophobicContact CE3-CE1 4.22Å; W1123-Y1139 AromaticContact CZ3-CD1 3.79Å; W1123-Y1139 HydrophobicContact CZ3-CD1 3.79Å; W1123-Y1139 AromaticContact CZ3-CE1 3.86Å; W1123-Y1139 HydrophobicContact CZ3-CE1 3.86Å; W1123-Y1139 HydrophobicContact CZ3-CG 4.34Å; M1125-Y1139 HydrophobicContact CB-CE2 4.23Å; Y1139-A1142 PolarHBondContact O-N 3.27Å; Y1139-A1143 PolarHBondContact O-N 3.41Å; Y1139-V1204 HydrophobicContact CD1-CB 4.34Å; Y1139-V1204 HydrophobicContact CD1-CG1 3.8Å; Y1139-V1204 HydrophobicContact CE1-CB 4.39Å; Y1139-V1204 HydrophobicContact CE1-CG1 3.41Å; Y1139-V1204 VanDerWaalsContact CE1-CG1 3.41Å; Y1139-V1204 HydrophobicContact CE2-CG1 4.34Å; Y1139-V1204 HydrophobicContact CG-CG1 4.43Å
1140	E	91.2	Very high	81	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-65.3	-44.7	178	-61.4	101.9	122.3	0	0	112.7	L1046 I1049 F1115 I1118 R1119 Y1124 A1142 A1143 V1144	L1046-E1140 HydrophobicContact CD2-CB 4.4Å; I1049-E1140 HydrophobicContact CD1-CB 3.91Å; I1049-E1140 HydrophobicContact CD1-CG 4.19Å; F1115-E1140 HydrophobicContact CD2-CB 3.75Å; F1115-E1140 HydrophobicContact CD2-CG 3.98Å; F1115-E1140 HydrophobicContact CE2-CB 3.75Å; F1115-E1140 HydrophobicContact CE2-CG 3.83Å; I1118-E1140 HydrophobicContact CG2-CG 4.09Å; R1119-E1140 IonicContact CZ-OE1 2.63Å; R1119-E1140 IonicContact NE-OE1 3.58Å; R1119-E1140 IonicContact NH2-OE1 3.67Å; R1119-E1140 PolarHBondContact NH2-OE1 3.24Å; Y1124-E1140 HydrophobicContact CE2-CG 4.36Å; Y1124-E1140 PolarHBondContact OH-OE1 2.89Å; E1140-A1142 VanDerWaalsContact C-N 3.35Å; E1140-A1143 PolarHBondContact O-N 2.81Å; E1140-V1144 WeakPolarHBondContact O-CB 3.26Å; E1140-V1144 WeakPolarHBondContact O-CG2 3.25Å; E1140-V1144 PolarHBondContact O-N 2.83Å
1141	N	92.1	Very high	83.2	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-57.8	-50.1	173.6	-173.9	33.5	0	0	0	110	L1046 L1053 E1057 Y1136 N1138 A1143 V1144 F1145	L1046-N1141 HydrophobicContact CD1-CB 4.41Å; L1046-N1141 VanDerWaalsContact CD1-OD1 3.3Å; L1046-N1141 WeakPolarHBondContact CD1-OD1 3.02Å; L1046-N1141 HydrophobicContact CD2-CB 4.14Å; L1053-N1141 WeakPolarHBondContact CD2-OD1 3.44Å; E1057-N1141 PolarHBondContact OE1-ND2 3.32Å; E1057-N1141 VanDerWaalsContact OE1-ND2 3.17Å; E1057-N1141 PolarHBondContact OE2-ND2 3.3Å; Y1136-N1141 PolarHBondContact O-ND2 3.11Å; N1138-N1141 VanDerWaalsContact OD1-CB 3.26Å; N1138-N1141 WeakPolarHBondContact OD1-CB 3.48Å; N1138-N1141 PolarHBondContact OD1-N 2.89Å; N1141-A1143 PolarHBondContact O-N 3.24Å; N1141-V1144 PolarHBondContact O-N 2.7Å; N1141-F1145 WeakPolarHBondContact O-CB 3.22Å; N1141-F1145 PolarHBondContact O-N 3.04Å
1142	A	92.2	Very high	85.4	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-55.7	-48.4	176.8	0	0	0	0	0	112.4	N1138 Y1139 E1140 M1146 L1203	N1138-A1142 PolarHBondContact O-N 2.73Å; N1138-A1142 VanDerWaalsContact O-N 3.14Å; Y1139-A1142 PolarHBondContact O-N 3.27Å; E1140-A1142 VanDerWaalsContact C-N 3.35Å; A1142-M1146 VanDerWaalsContact O-CB 3.31Å; A1142-M1146 WeakPolarHBondContact O-CB 3.12Å; A1142-M1146 WeakPolarHBondContact O-CG 3.46Å; A1142-M1146 PolarHBondContact O-N 2.98Å; A1142-L1203 HydrophobicContact CB-CD2 3.83Å
1143	A	93.7	Very high	87.7	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-64	-44.7	179.1	0	0	0	0	0	113.2	I1118 Y1139 E1140 N1141 V1147	I1118-A1143 HydrophobicContact CB-CB 4.41Å; I1118-A1143 HydrophobicContact CD1-CB 3.8Å; I1118-A1143 HydrophobicContact CG2-CB 4.35Å; Y1139-A1143 PolarHBondContact O-N 3.41Å; E1140-A1143 PolarHBondContact O-N 2.81Å; N1141-A1143 PolarHBondContact O-N 3.24Å; A1143-V1147 WeakPolarHBondContact O-CB 3.28Å; A1143-V1147 WeakPolarHBondContact O-CG2 3.45Å; A1143-V1147 PolarHBondContact O-N 2.76Å
1144	V	94.7	Very high	89.7	Confident	0 Å²	0	12.4 Å²	12.4	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-68.1	-44.6	-179.6	172.5	0	0	0	0	111	I1045 F1115 E1140 N1141 S1148	I1045-V1144 HydrophobicContact CG2-CG2 4.23Å; F1115-V1144 HydrophobicContact CB-CG2 4.08Å; F1115-V1144 HydrophobicContact CD2-CG2 4.19Å; E1140-V1144 WeakPolarHBondContact O-CB 3.26Å; E1140-V1144 WeakPolarHBondContact O-CG2 3.25Å; E1140-V1144 PolarHBondContact O-N 2.83Å; N1141-V1144 PolarHBondContact O-N 2.7Å; V1144-S1148 VanDerWaalsContact O-CB 3.28Å; V1144-S1148 WeakPolarHBondContact O-CB 3.35Å; V1144-S1148 PolarHBondContact O-N 3.49Å; V1144-S1148 PolarHBondContact O-OG 2.74Å
1145	F	94.9	Very high	91.4	Very high	2 Å²	2	12.2 Å²	12.2	1%	0.009	6%	0.055	C	C	.	.	H	α-helix	trans	-60.5	-53	177	175.6	-103.9	0	0	0	111.4	L1053 E1057 Y1060 N1141 V1147 S1148 T1149 L1189 L1203	L1053-F1145 HydrophobicContact CD2-CB 4.18Å; L1053-F1145 HydrophobicContact CD2-CD2 3.86Å; L1053-F1145 HydrophobicContact CD2-CG 4.45Å; E1057-F1145 HydrophobicContact CB-CD2 3.79Å; E1057-F1145 HydrophobicContact CB-CE2 3.47Å; E1057-F1145 VanDerWaalsContact CB-CE2 3.47Å; E1057-F1145 HydrophobicContact CB-CZ 4.09Å; E1057-F1145 HydrophobicContact CG-CD1 4.38Å; E1057-F1145 HydrophobicContact CG-CD2 3.77Å; E1057-F1145 HydrophobicContact CG-CE1 4.23Å; E1057-F1145 HydrophobicContact CG-CE2 3.59Å; E1057-F1145 HydrophobicContact CG-CG 4.16Å; E1057-F1145 HydrophobicContact CG-CZ 3.83Å; Y1060-F1145 HydrophobicContact CD1-CE2 4.45Å; Y1060-F1145 AromaticContact CD1-CZ 3.79Å; Y1060-F1145 HydrophobicContact CD1-CZ 3.79Å; Y1060-F1145 HydrophobicContact CE1-CZ 4.39Å; N1141-F1145 WeakPolarHBondContact O-CB 3.22Å; N1141-F1145 PolarHBondContact O-N 3.04Å; F1145-V1147 VanDerWaalsContact C-N 3.34Å; F1145-V1147 PolarHBondContact O-N 3.23Å; F1145-S1148 WeakPolarHBondContact O-CB 3.35Å; F1145-S1148 PolarHBondContact O-N 3.26Å; F1145-T1149 HydrophobicContact CD1-CG2 4.46Å; F1145-T1149 HydrophobicContact CD2-CG2 4.46Å; F1145-T1149 HydrophobicContact CE1-CG2 4.06Å; F1145-T1149 HydrophobicContact CE2-CG2 4.06Å; F1145-T1149 HydrophobicContact CZ-CG2 3.86Å; F1145-T1149 WeakPolarHBondContact O-CG2 3.08Å; F1145-T1149 PolarHBondContact O-N 2.71Å; F1145-L1189 HydrophobicContact CD1-CD2 4.36Å; F1145-L1189 HydrophobicContact CE1-CD2 3.65Å; F1145-L1203 HydrophobicContact CD1-CD1 3.95Å; F1145-L1203 HydrophobicContact CD1-CD2 3.88Å; F1145-L1203 HydrophobicContact CD1-CG 4.44Å; F1145-L1203 HydrophobicContact CE1-CD1 3.88Å; F1145-L1203 HydrophobicContact CG-CD2 4.47Å
1146	M	93.4	Very high	92.4	Very high	7 Å²	7	10.5 Å²	10.5	3%	0.034	5%	0.047	C	C	.	.	H	α-helix	trans	-53	-52.1	179.8	-66.1	-82.1	-167.6	0	0	110.7	A1142 S1148 T1149 Y1150 L1189 T1190 L1203	A1142-M1146 VanDerWaalsContact O-CB 3.31Å; A1142-M1146 WeakPolarHBondContact O-CB 3.12Å; A1142-M1146 WeakPolarHBondContact O-CG 3.46Å; A1142-M1146 PolarHBondContact O-N 2.98Å; M1146-S1148 PolarHBondContact O-N 2.84Å; M1146-T1149 PolarHBondContact O-N 2.98Å; M1146-T1149 PolarHBondContact O-OG1 2.93Å; M1146-Y1150 WeakPolarHBondContact O-CD2 3.42Å; M1146-L1189 HydrophobicContact CE-CD2 4.43Å; M1146-L1189 WeakPolarHBondContact CE-O 3.29Å; M1146-L1189 HydrophobicContact SD-CB 4.47Å; M1146-L1189 HydrophobicContact SD-CD2 3.94Å; M1146-L1189 HydrophobicContact SD-CG 4.49Å; M1146-T1190 HydrophobicContact CB-CG2 4.45Å; M1146-T1190 VanDerWaalsContact SD-CA 3.51Å; M1146-T1190 HydrophobicContact SD-CG2 4.26Å; M1146-L1203 HydrophobicContact CE-CD1 4.38Å
1147	V	95.2	Very high	93.1	Very high	1 Å²	1	10.5 Å²	10.5	1%	0.006	5%	0.049	C	C	.	.	H	α-helix	trans	-57.3	-49.2	176.5	167.2	0	0	0	0	111.2	I1110 Q1111 A1114 A1143 F1145 T1149 Y1150 Q1151 L1215	I1110-V1147 HydrophobicContact CG2-CG1 3.77Å; Q1111-V1147 HydrophobicContact CG-CG1 4.4Å; A1114-V1147 HydrophobicContact CB-CG2 3.98Å; A1143-V1147 WeakPolarHBondContact O-CB 3.28Å; A1143-V1147 WeakPolarHBondContact O-CG2 3.45Å; A1143-V1147 PolarHBondContact O-N 2.76Å; F1145-V1147 VanDerWaalsContact C-N 3.34Å; F1145-V1147 PolarHBondContact O-N 3.23Å; V1147-T1149 VanDerWaalsContact C-N 3.32Å; V1147-T1149 PolarHBondContact O-N 3.16Å; V1147-Y1150 PolarHBondContact O-N 3.33Å; V1147-Y1150 VanDerWaalsContact O-N 3.15Å; V1147-Q1151 HydrophobicContact CG1-CG 4.12Å; V1147-Q1151 VanDerWaalsContact O-CG 3.31Å; V1147-Q1151 WeakPolarHBondContact O-CG 3.22Å; V1147-Q1151 PolarHBondContact O-N 2.82Å; V1147-Q1151 VanDerWaalsContact O-N 3.15Å; V1147-L1215 HydrophobicContact CG2-CD2 3.83Å
1148	S	95.5	Very high	93.5	Very high	3 Å²	3	6.7 Å²	6.7	2%	0.021	3%	0.033	C	C	.	.	H	α-helix	trans	-58.1	-39.8	-176.7	-60	0	0	0	0	112.8	S1042 Q1111 V1144 F1145 M1146 Y1150 Q1151 Y1152	S1042-S1148 PolarHBondContact OG-OG 3.29Å; Q1111-S1148 PolarHBondContact NE2-OG 2.91Å; V1144-S1148 VanDerWaalsContact O-CB 3.28Å; V1144-S1148 WeakPolarHBondContact O-CB 3.35Å; V1144-S1148 PolarHBondContact O-N 3.49Å; V1144-S1148 PolarHBondContact O-OG 2.74Å; F1145-S1148 WeakPolarHBondContact O-CB 3.35Å; F1145-S1148 PolarHBondContact O-N 3.26Å; M1146-S1148 PolarHBondContact O-N 2.84Å; S1148-Y1150 VanDerWaalsContact C-N 3.29Å; S1148-Y1150 PolarHBondContact O-N 2.83Å; S1148-Q1151 WeakPolarHBondContact O-CB 3.14Å; S1148-Q1151 PolarHBondContact O-N 2.93Å; S1148-Y1152 VanDerWaalsContact O-CD2 3.28Å; S1148-Y1152 WeakPolarHBondContact O-CD2 3.35Å; S1148-Y1152 VanDerWaalsContact O-CG 3.31Å; S1148-Y1152 PolarHBondContact O-N 3.05Å; S1148-Y1152 VanDerWaalsContact O-N 3.08Å
1149	T	95	Very high	93.7	Very high	0 Å²	0	6.9 Å²	6.9	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-57.5	-40.5	177.6	66.7	0	0	0	0	112.6	Y1060 I1065 F1145 M1146 V1147 I1153 S1186	Y1060-T1149 HydrophobicContact CD1-CG2 4.34Å; Y1060-T1149 HydrophobicContact CE1-CG2 3.85Å; I1065-T1149 HydrophobicContact CD1-CG2 4.21Å; F1145-T1149 HydrophobicContact CD1-CG2 4.46Å; F1145-T1149 HydrophobicContact CD2-CG2 4.46Å; F1145-T1149 HydrophobicContact CE1-CG2 4.06Å; F1145-T1149 HydrophobicContact CE2-CG2 4.06Å; F1145-T1149 HydrophobicContact CZ-CG2 3.86Å; F1145-T1149 WeakPolarHBondContact O-CG2 3.08Å; F1145-T1149 PolarHBondContact O-N 2.71Å; M1146-T1149 PolarHBondContact O-N 2.98Å; M1146-T1149 PolarHBondContact O-OG1 2.93Å; V1147-T1149 VanDerWaalsContact C-N 3.32Å; V1147-T1149 PolarHBondContact O-N 3.16Å; T1149-I1153 PolarHBondContact O-N 2.99Å; T1149-S1186 PolarHBondContact OG1-OG 2.84Å
1150	Y	95.2	Very high	93.7	Very high	5 Å²	5	5.1 Å²	5.1	2%	0.02	3%	0.027	C	C	.	.	H	α-helix	trans	-70	-37	173	-61.1	-82.3	0	0	0	112.6	M1146 V1147 S1148 Y1152 I1153 I1154 F1183 S1186 L1187 T1190 H1216 V1219	M1146-Y1150 WeakPolarHBondContact O-CD2 3.42Å; V1147-Y1150 PolarHBondContact O-N 3.33Å; V1147-Y1150 VanDerWaalsContact O-N 3.15Å; S1148-Y1150 VanDerWaalsContact C-N 3.29Å; S1148-Y1150 PolarHBondContact O-N 2.83Å; Y1150-Y1152 PolarHBondContact O-N 3.29Å; Y1150-I1153 PolarHBondContact O-N 3.14Å; Y1150-I1153 VanDerWaalsContact O-N 3.15Å; Y1150-I1154 WeakPolarHBondContact O-CB 3.12Å; Y1150-I1154 VanDerWaalsContact O-CG1 3.22Å; Y1150-I1154 WeakPolarHBondContact O-CG1 3.4Å; Y1150-I1154 PolarHBondContact O-N 2.97Å; Y1150-F1183 HydrophobicContact CD1-CD2 4.11Å; Y1150-F1183 HydrophobicContact CD1-CE2 4.05Å; Y1150-F1183 HydrophobicContact CE1-CD2 4.18Å; Y1150-F1183 AromaticContact CE1-CE2 3.98Å; Y1150-F1183 HydrophobicContact CE1-CE2 3.98Å; Y1150-S1186 VanDerWaalsContact OH-C 3.26Å; Y1150-S1186 PolarHBondContact OH-O 2.79Å; Y1150-S1186 VanDerWaalsContact OH-O 3.06Å; Y1150-L1187 VanDerWaalsContact OH-CA 3.28Å; Y1150-L1187 WeakPolarHBondContact OH-CA 3.39Å; Y1150-L1187 PolarHBondContact OH-N 2.96Å; Y1150-T1190 WeakPolarHBondContact CE2-OG1 3.39Å; Y1150-T1190 WeakPolarHBondContact OH-CB 3.38Å; Y1150-T1190 PolarHBondContact OH-OG1 2.98Å; Y1150-H1216 PolarHBondContact OH-CE1 2.87Å; Y1150-H1216 VanDerWaalsContact OH-CE1 3.27Å; Y1150-V1219 HydrophobicContact CD1-CG1 3.74Å; Y1150-V1219 HydrophobicContact CD2-CB 4.43Å; Y1150-V1219 HydrophobicContact CD2-CG1 4.14Å; Y1150-V1219 HydrophobicContact CD2-CG2 3.46Å; Y1150-V1219 VanDerWaalsContact CD2-CG2 3.46Å; Y1150-V1219 HydrophobicContact CE1-CG1 4.4Å; Y1150-V1219 HydrophobicContact CE2-CG2 4.05Å; Y1150-V1219 HydrophobicContact CG-CB 4.33Å; Y1150-V1219 HydrophobicContact CG-CG1 3.58Å; Y1150-V1219 HydrophobicContact CG-CG2 3.75Å
1151	Q	96.1	Very high	93.1	Very high	2 Å²	2	8.1 Å²	8.1	1%	0.009	4%	0.04	C	C	.	.	H	α-helix	trans	-58.6	-39.6	178.5	-53.1	-159	-20.9	0	0	111.1	I1038 G1107 V1147 S1148 I1154 L1155 N1222	I1038-Q1151 HydrophobicContact CD1-CB 4.43Å; I1038-Q1151 HydrophobicContact CG2-CB 4.41Å; G1107-Q1151 VanDerWaalsContact CA-OE1 3.28Å; G1107-Q1151 PolarHBondContact O-NE2 2.8Å; G1107-Q1151 PolarHBondContact O-OE1 2.99Å; V1147-Q1151 HydrophobicContact CG1-CG 4.12Å; V1147-Q1151 VanDerWaalsContact O-CG 3.31Å; V1147-Q1151 WeakPolarHBondContact O-CG 3.22Å; V1147-Q1151 PolarHBondContact O-N 2.82Å; V1147-Q1151 VanDerWaalsContact O-N 3.15Å; S1148-Q1151 WeakPolarHBondContact O-CB 3.14Å; S1148-Q1151 PolarHBondContact O-N 2.93Å; Q1151-I1154 PolarHBondContact O-N 3.37Å; Q1151-L1155 WeakPolarHBondContact O-CG 3.43Å; Q1151-L1155 PolarHBondContact O-N 3.45Å; Q1151-N1222 WeakPolarHBondContact CG-ND2 3.46Å
1152	Y	95.3	Very high	92.7	Very high	3 Å²	3	8.9 Å²	8.9	1%	0.012	5%	0.048	C	C	.	.	H	α-helix	trans	-63.2	-42.5	175.9	-53.5	-33.8	0	0	0	112.5	F1031 I1038 Q1039 C1061 I1066 S1148 Y1150 L1155 A1156	F1031-Y1152 WeakPolarHBondContact CE2-O 3.13Å; I1038-Y1152 HydrophobicContact CB-CE1 4.3Å; I1038-Y1152 HydrophobicContact CG2-CE1 3.83Å; Q1039-Y1152 WeakPolarHBondContact CB-OH 3.33Å; C1061-Y1152 HydrophobicContact CB-CE2 4.1Å; I1066-Y1152 HydrophobicContact CD1-CG 4.17Å; S1148-Y1152 VanDerWaalsContact O-CD2 3.28Å; S1148-Y1152 WeakPolarHBondContact O-CD2 3.35Å; S1148-Y1152 VanDerWaalsContact O-CG 3.31Å; S1148-Y1152 PolarHBondContact O-N 3.05Å; S1148-Y1152 VanDerWaalsContact O-N 3.08Å; Y1150-Y1152 PolarHBondContact O-N 3.29Å; Y1152-L1155 PolarHBondContact O-N 3Å; Y1152-A1156 PolarHBondContact O-N 3.5Å
1153	I	95.5	Very high	92.2	Very high	3 Å²	3	12.2 Å²	12.2	2%	0.015	8%	0.076	C	C	.	.	H	α-helix	trans	-65.3	-41.9	175.2	-60.3	163.2	0	0	0	110.8	I1065 L1069 T1149 Y1150 A1156 I1157 I1179 C1182	I1065-I1153 HydrophobicContact CG2-CG1 4.38Å; L1069-I1153 HydrophobicContact CD1-CG1 4.38Å; T1149-I1153 PolarHBondContact O-N 2.99Å; Y1150-I1153 PolarHBondContact O-N 3.14Å; Y1150-I1153 VanDerWaalsContact O-N 3.15Å; I1153-A1156 PolarHBondContact O-N 3.08Å; I1153-I1157 HydrophobicContact CG2-CD1 4.18Å; I1153-I1157 PolarHBondContact O-N 3.37Å; I1153-I1157 VanDerWaalsContact O-N 3.15Å; I1153-I1179 HydrophobicContact CG2-CG2 4.15Å; I1153-C1182 HydrophobicContact CD1-CB 3.78Å; I1153-C1182 HydrophobicContact CG1-CB 4.06Å
1154	I	95.2	Very high	91.9	Very high	12 Å²	12	15 Å²	15	6%	0.062	9%	0.093	C	C	.	.	H	α-helix	trans	-62.5	-43.6	177.5	-68.1	164.3	0	0	0	111	Y1150 Q1151 A1156 I1157 A1158 V1219 N1222 F1223	Y1150-I1154 WeakPolarHBondContact O-CB 3.12Å; Y1150-I1154 VanDerWaalsContact O-CG1 3.22Å; Y1150-I1154 WeakPolarHBondContact O-CG1 3.4Å; Y1150-I1154 PolarHBondContact O-N 2.97Å; Q1151-I1154 PolarHBondContact O-N 3.37Å; I1154-A1156 VanDerWaalsContact C-N 3.34Å; I1154-A1156 PolarHBondContact O-N 2.76Å; I1154-I1157 PolarHBondContact O-N 3.1Å; I1154-A1158 WeakPolarHBondContact O-CB 3.16Å; I1154-A1158 PolarHBondContact O-N 2.98Å; I1154-V1219 HydrophobicContact CD1-CG1 4.35Å; I1154-N1222 HydrophobicContact CD1-CB 4.28Å; I1154-F1223 HydrophobicContact CD1-CB 4Å; I1154-F1223 HydrophobicContact CG1-CB 4.17Å; I1154-F1223 HydrophobicContact CG1-CD2 4.19Å; I1154-F1223 HydrophobicContact CG2-CD2 4.32Å
1155	L	94.8	Very high	91.7	Very high	4 Å²	4	16.1 Å²	16.1	2%	0.021	10%	0.098	C	C	.	.	H	α-helix	trans	-58.9	-43.8	175	-75.9	179.1	0	0	0	112.1	F1031 G1034 I1038 Q1103 Q1151 Y1152 I1157 A1158 F1159	F1031-L1155 HydrophobicContact CD2-CB 4Å; F1031-L1155 HydrophobicContact CE2-CB 4.39Å; G1034-L1155 VanDerWaalsContact C-CD1 3.47Å; I1038-L1155 HydrophobicContact CD1-CD1 3.8Å; I1038-L1155 HydrophobicContact CD1-CD2 4.38Å; I1038-L1155 HydrophobicContact CD1-CG 4.24Å; Q1103-L1155 HydrophobicContact CB-CD2 3.68Å; Q1103-L1155 HydrophobicContact CG-CD2 4.15Å; Q1151-L1155 WeakPolarHBondContact O-CG 3.43Å; Q1151-L1155 PolarHBondContact O-N 3.45Å; Y1152-L1155 PolarHBondContact O-N 3Å; L1155-I1157 VanDerWaalsContact C-N 3.3Å; L1155-I1157 PolarHBondContact O-N 2.88Å; L1155-A1158 PolarHBondContact O-N 3.05Å; L1155-F1159 HydrophobicContact CB-CE2 4.45Å; L1155-F1159 HydrophobicContact CD2-CE2 3.77Å; L1155-F1159 HydrophobicContact CD2-CZ 4.04Å; L1155-F1159 WeakPolarHBondContact O-CD2 3.03Å; L1155-F1159 PolarHBondContact O-N 2.81Å; L1155-F1159 VanDerWaalsContact O-N 3.07Å
1156	A	93.1	Very high	91.5	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-60.7	-39.5	178.1	0	0	0	0	0	111.6	F1031 L1069 Y1152 I1153 I1154 S1160 F1175	F1031-A1156 HydrophobicContact CD2-CB 4.07Å; F1031-A1156 HydrophobicContact CE2-CB 3.76Å; F1031-A1156 HydrophobicContact CZ-CB 4.14Å; L1069-A1156 HydrophobicContact CD1-CB 4.11Å; Y1152-A1156 PolarHBondContact O-N 3.5Å; I1153-A1156 PolarHBondContact O-N 3.08Å; I1154-A1156 VanDerWaalsContact C-N 3.34Å; I1154-A1156 PolarHBondContact O-N 2.76Å; A1156-S1160 WeakPolarHBondContact O-CB 3.43Å; A1156-S1160 PolarHBondContact O-N 3.04Å; A1156-F1175 HydrophobicContact CB-CZ 4.37Å
1157	I	93	Very high	91.4	Very high	43 Å²	43	19.4 Å²	19.4	22%	0.221	11%	0.112	C	C	.	.	H	α-helix	trans	-70.2	-50	175.2	-64.8	160	0	0	0	111.1	I1153 I1154 L1155 F1159 S1160 I1169 I1179 F1223	I1153-I1157 HydrophobicContact CG2-CD1 4.18Å; I1153-I1157 PolarHBondContact O-N 3.37Å; I1153-I1157 VanDerWaalsContact O-N 3.15Å; I1154-I1157 PolarHBondContact O-N 3.1Å; L1155-I1157 VanDerWaalsContact C-N 3.3Å; L1155-I1157 PolarHBondContact O-N 2.88Å; I1157-F1159 VanDerWaalsContact C-N 3.33Å; I1157-F1159 PolarHBondContact O-N 2.71Å; I1157-S1160 PolarHBondContact O-N 2.77Å; I1157-S1160 VanDerWaalsContact O-N 3.1Å; I1157-I1169 HydrophobicContact CG2-CD1 4.21Å; I1157-I1179 HydrophobicContact CD1-CG2 4.08Å; I1157-I1179 HydrophobicContact CG1-CD1 3.9Å; I1157-I1179 HydrophobicContact CG1-CG2 4.45Å; I1157-F1223 HydrophobicContact CD1-CE2 4.48Å; I1157-F1223 HydrophobicContact CG2-CE2 4.16Å
1158	A	91.8	Very high	91.2	Very high	8 Å²	8	22.3 Å²	22.3	7%	0.066	13%	0.132	C	C	.	.	H	α-helix	trans	-57.7	-43.8	-174.8	0	0	0	0	0	112.2	I1154 L1155 E1230	I1154-A1158 WeakPolarHBondContact O-CB 3.16Å; I1154-A1158 PolarHBondContact O-N 2.98Å; L1155-A1158 PolarHBondContact O-N 3.05Å; A1158-E1230 HydrophobicContact CB-CG 4.39Å; A1158-E1230 WeakPolarHBondContact O-CG 3.48Å
1159	F	90.9	Very high	90.9	Very high	9 Å²	9	24 Å²	24	4%	0.039	14%	0.141	C	C	.	.	H	α-helix	trans	-83.3	-10.2	179.3	-59.2	-37.8	0	0	0	114.4	K1030 F1031 S1099 L1100 Q1103 L1155 I1157 K1161 E1230	K1030-F1159 VanDerWaalsContact C-CE2 3.45Å; K1030-F1159 HydrophobicContact CB-CD1 4.19Å; K1030-F1159 HydrophobicContact CB-CD2 3.74Å; K1030-F1159 HydrophobicContact CB-CE1 4.27Å; K1030-F1159 HydrophobicContact CB-CE2 3.82Å; K1030-F1159 HydrophobicContact CB-CG 3.91Å; K1030-F1159 HydrophobicContact CB-CZ 4.08Å; K1030-F1159 HydrophobicContact CD-CD1 4.13Å; K1030-F1159 HydrophobicContact CD-CE1 4.09Å; K1030-F1159 VanDerWaalsContact CE-CD1 3.41Å; K1030-F1159 VanDerWaalsContact O-CE2 3.25Å; K1030-F1159 WeakPolarHBondContact O-CE2 3.42Å; F1031-F1159 HydrophobicContact CB-CD2 4.09Å; S1099-F1159 WeakPolarHBondContact OG-CE1 3.12Å; L1100-F1159 HydrophobicContact CD1-CZ 4.37Å; Q1103-F1159 HydrophobicContact CB-CZ 4.2Å; Q1103-F1159 HydrophobicContact CG-CE1 3.78Å; Q1103-F1159 HydrophobicContact CG-CZ 3.73Å; L1155-F1159 HydrophobicContact CB-CE2 4.45Å; L1155-F1159 HydrophobicContact CD2-CE2 3.77Å; L1155-F1159 HydrophobicContact CD2-CZ 4.04Å; L1155-F1159 WeakPolarHBondContact O-CD2 3.03Å; L1155-F1159 PolarHBondContact O-N 2.81Å; L1155-F1159 VanDerWaalsContact O-N 3.07Å; I1157-F1159 VanDerWaalsContact C-N 3.33Å; I1157-F1159 PolarHBondContact O-N 2.71Å; F1159-K1161 VanDerWaalsContact C-N 3.27Å; F1159-K1161 PolarHBondContact O-N 2.91Å; F1159-E1230 WeakPolarHBondContact CD1-OE1 3.28Å
1160	S	88.1	Confident	90.6	Very high	4 Å²	4	30 Å²	30	3%	0.028	17%	0.172	C	C	.	.			trans	-85.3	58.3	179.5	-158.2	0	0	0	0	112.9	F1073 A1156 I1157 I1169 F1175	F1073-S1160 VanDerWaalsContact CE2-CA 3.5Å; A1156-S1160 WeakPolarHBondContact O-CB 3.43Å; A1156-S1160 PolarHBondContact O-N 3.04Å; I1157-S1160 PolarHBondContact O-N 2.77Å; I1157-S1160 VanDerWaalsContact O-N 3.1Å; S1160-I1169 WeakPolarHBondContact O-CD1 3.4Å; S1160-I1169 WeakPolarHBondContact O-CG1 3.42Å; S1160-F1175 WeakPolarHBondContact OG-CE1 3.42Å
1161	K	79.1	Confident	90.4	Very high	65 Å²	65	32.5 Å²	32.5	28%	0.283	19%	0.188	S	C	.	.			trans	-74.2	142	177	-73	-176.6	-179.2	166.9	0	112.7	F1159 E1230 D1234	F1159-K1161 VanDerWaalsContact C-N 3.27Å; F1159-K1161 PolarHBondContact O-N 2.91Å; K1161-E1230 VanDerWaalsContact NZ-C 3.34Å; K1161-E1230 PolarHBondContact NZ-O 2.88Å; K1161-D1234 HydrophobicContact CD-CB 4.5Å; K1161-D1234 WeakPolarHBondContact CD-OD2 3.43Å; K1161-D1234 VanDerWaalsContact NZ-CB 3.34Å; K1161-D1234 IonicContact NZ-OD2 3.94Å; K1161-D1234 PolarHBondContact NZ-OD2 3.46Å
1162	G	83.1	Confident	90.3	Very high	16 Å²	16	32.7 Å²	32.7	17%	0.165	19%	0.189	C	C	.	.			trans	-89.2	-105.2	179.9	0	0	0	0	0	113.3	Y1165 R1166 K1167	G1162-Y1165 PolarHBondContact O-N 2.92Å; G1162-R1166 CarbonylContact C-O 3.59Å; G1162-R1166 WeakPolarHBondContact CA-O 3.46Å; G1162-R1166 PolarHBondContact O-N 3.37Å; G1162-R1166 VanDerWaalsContact O-O 3.13Å; G1162-K1167 WeakPolarHBondContact CA-O 3.29Å
1163	A	83.2	Confident	90.2	Very high	70 Å²	70	41.5 Å²	41.5	58%	0.579	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	143.2	-175.9	0	0	0	0	0	111.5	Y1079 R1166	Y1079-A1163 HydrophobicContact CD2-CB 4.41Å; Y1079-A1163 HydrophobicContact CE2-CB 4.2Å; A1163-R1166 PolarHBondContact N-O 2.85Å; A1163-R1166 VanDerWaalsContact N-O 3.11Å
1164	P	86.9	Confident	90	Very high	57 Å²	57	43.7 Å²	43.7	37%	0.37	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	cis	-95.4	2.7	13	38.1	-37.8	0	0	0	115.5	Y1079	Y1079-P1164 WeakPolarHBondContact CB-O 3.48Å
1165	Y	89.9	Confident	90	Very high	25 Å²	25	43.1 Å²	43.1	10%	0.098	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	-32.4	-171.3	-53.8	-70.6	0	0	0	114.1	R1019 V1023 Y1079 S1083 E1085 P1086 P1087 G1162	R1019-Y1165 HydrophobicContact CB-CD1 4.11Å; R1019-Y1165 HydrophobicContact CG-CD1 4.45Å; V1023-Y1165 HydrophobicContact CG2-CD2 3.73Å; V1023-Y1165 HydrophobicContact CG2-CE2 4.38Å; V1023-Y1165 HydrophobicContact CG2-CG 3.82Å; Y1079-Y1165 PolarHBondContact N-O 3.11Å; S1083-Y1165 WeakPolarHBondContact OG-CE1 3.47Å; E1085-Y1165 WeakPolarHBondContact O-CE1 3.49Å; E1085-Y1165 PolarHBondContact O-OH 3.04Å; E1085-Y1165 VanDerWaalsContact O-OH 3.12Å; P1086-Y1165 PolarHBondContact O-OH 2.96Å; P1087-Y1165 HydrophobicContact CB-CE1 4.35Å; P1087-Y1165 HydrophobicContact CG-CE1 4.41Å; G1162-Y1165 PolarHBondContact O-N 2.92Å
1166	R	91	Very high	90	Very high	1 Å²	1	45.2 Å²	45.2	0%	0.004	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-120.7	160.8	-177.9	-54.8	173.6	80.2	-155.6	12.3	109.1	V1023 T1024 F1073 T1076 H1077 G1162 A1163	V1023-R1166 HydrophobicContact CG1-CG 4.35Å; T1024-R1166 PolarHBondContact OG1-NE 3.36Å; T1024-R1166 PolarHBondContact OG1-NH2 3.06Å; T1024-R1166 VanDerWaalsContact OG1-NH2 3.12Å; F1073-R1166 PolarHBondContact O-NH2 3.2Å; T1076-R1166 HydrophobicContact CG2-CB 4.29Å; H1077-R1166 WeakPolarHBondContact O-CA 3.33Å; G1162-R1166 CarbonylContact C-O 3.59Å; G1162-R1166 WeakPolarHBondContact CA-O 3.46Å; G1162-R1166 PolarHBondContact O-N 3.37Å; G1162-R1166 VanDerWaalsContact O-O 3.13Å; A1163-R1166 PolarHBondContact N-O 2.85Å; A1163-R1166 VanDerWaalsContact N-O 3.11Å
1167	K	91.3	Very high	90.1	Very high	77 Å²	77	50.4 Å²	50.4	34%	0.335	28%	0.279	S	S	.	.			trans	-69.6	167.4	165.2	-63.2	-171.4	-177.1	179.5	0	110.6	H1077 A1078 G1162 T1171	H1077-K1167 HydrophobicContact CB-CD 4.16Å; H1077-K1167 HydrophobicContact CB-CG 4.47Å; H1077-K1167 PolarHBondContact O-N 2.75Å; A1078-K1167 WeakPolarHBondContact O-CG 3.24Å; G1162-K1167 WeakPolarHBondContact CA-O 3.29Å; K1167-T1171 HydrophobicContact CB-CG2 4.08Å; K1167-T1171 WeakPolarHBondContact CB-OG1 3.44Å; K1167-T1171 HydrophobicContact CD-CG2 4.38Å
1168	S	90.4	Very high	90.2	Very high	62 Å²	62	49.5 Å²	49.5	43%	0.434	28%	0.275	S	S	.	.			trans	-66.3	156.4	177.6	68.6	0	0	0	0	111.6	L1170 T1171	S1168-L1170 PolarHBondContact O-N 2.54Å; S1168-L1170 VanDerWaalsContact O-N 3.14Å; S1168-T1171 PolarHBondContact O-N 2.77Å; S1168-T1171 PolarHBondContact O-OG1 2.91Å
1169	I	89.9	Confident	90.4	Very high	39 Å²	39	50.2 Å²	50.2	20%	0.2	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-45.5	-44.6	174	-65.6	174.6	0	0	0	111.1	I1157 S1160 T1171 N1172 F1175 V1176	I1157-I1169 HydrophobicContact CG2-CD1 4.21Å; S1160-I1169 WeakPolarHBondContact O-CD1 3.4Å; S1160-I1169 WeakPolarHBondContact O-CG1 3.42Å; I1169-T1171 PolarHBondContact O-N 3.41Å; I1169-T1171 VanDerWaalsContact O-N 3.11Å; I1169-N1172 PolarHBondContact O-N 3.47Å; I1169-F1175 HydrophobicContact CG1-CE1 4.41Å; I1169-F1175 HydrophobicContact CG2-CD1 3.91Å; I1169-F1175 HydrophobicContact CG2-CE1 4.01Å; I1169-V1176 HydrophobicContact CG2-CG2 4.03Å; I1169-V1176 WeakPolarHBondContact O-CG2 3.17Å
1170	L	89	Confident	90.6	Very high	125 Å²	125	54.6 Å²	54.6	65%	0.654	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-60.3	-22.2	-176.9	-58.9	178.4	0	0	0	114.6	S1168 N1172 V1176	S1168-L1170 PolarHBondContact O-N 2.54Å; S1168-L1170 VanDerWaalsContact O-N 3.14Å; L1170-N1172 VanDerWaalsContact C-N 3.31Å; L1170-V1176 HydrophobicContact CD2-CG2 4.44Å
1171	T	91.2	Very high	91	Very high	57 Å²	57	58.4 Å²	58.4	35%	0.35	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-79.7	-13.4	175.9	64.4	0	0	0	0	113.7	K1167 S1168 I1169	K1167-T1171 HydrophobicContact CB-CG2 4.08Å; K1167-T1171 WeakPolarHBondContact CB-OG1 3.44Å; K1167-T1171 HydrophobicContact CD-CG2 4.38Å; S1168-T1171 PolarHBondContact O-N 2.77Å; S1168-T1171 PolarHBondContact O-OG1 2.91Å; I1169-T1171 PolarHBondContact O-N 3.41Å; I1169-T1171 VanDerWaalsContact O-N 3.11Å
1172	N	92.9	Very high	91.7	Very high	6 Å²	6	55.6 Å²	55.6	3%	0.032	31%	0.312	C	S	.	.			trans	-100.5	81.5	176.3	-177.1	-8.5	0	0	0	109	T1072 T1076 I1169 L1170 A1174 F1175 V1176	T1072-N1172 PolarHBondContact O-ND2 3.36Å; T1076-N1172 PolarHBondContact N-ND2 3.31Å; T1076-N1172 PolarHBondContact OG1-ND2 3.13Å; I1169-N1172 PolarHBondContact O-N 3.47Å; L1170-N1172 VanDerWaalsContact C-N 3.31Å; N1172-A1174 PolarHBondContact O-N 3.22Å; N1172-F1175 HydrophobicContact CB-CB 4.08Å; N1172-F1175 VanDerWaalsContact CG-CB 3.42Å; N1172-F1175 WeakPolarHBondContact ND2-CB 3.4Å; N1172-F1175 PolarHBondContact O-N 3.29Å; N1172-F1175 PolarHBondContact OD1-N 2.65Å; N1172-F1175 VanDerWaalsContact OD1-N 3.17Å; N1172-V1176 PolarHBondContact O-N 3.19Å
1173	Y	93	Very high	92.3	Very high	188 Å²	188	59 Å²	59	74%	0.737	32%	0.323	S	S	*	.	H	α-helix	trans	-55.6	-35.6	-176.8	-56.6	-62.6	0	0	0	113.1	V1176 L1177	Y1173-V1176 PolarHBondContact O-N 3.01Å; Y1173-L1177 VanDerWaalsContact O-CB 3.22Å; Y1173-L1177 WeakPolarHBondContact O-CB 3.48Å; Y1173-L1177 PolarHBondContact O-N 2.78Å
1174	A	92.7	Very high	92.9	Very high	49 Å²	49	59.5 Å²	59.5	41%	0.405	32%	0.318	S	S	.	.	H	α-helix	trans	-64.5	-41	176.9	0	0	0	0	0	112.3	T1072 N1172 N1178	T1072-A1174 HydrophobicContact CG2-CB 4.43Å; N1172-A1174 PolarHBondContact O-N 3.22Å; A1174-N1178 VanDerWaalsContact O-CB 3.32Å; A1174-N1178 WeakPolarHBondContact O-CB 3.35Å; A1174-N1178 PolarHBondContact O-N 3.03Å
1175	F	94	Very high	93.2	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-72.1	-39.4	176.7	-177.3	-126	0	0	0	112.5	L1069 F1073 A1156 S1160 I1169 N1172 N1178 I1179	L1069-F1175 HydrophobicContact CD2-CD2 4.4Å; L1069-F1175 HydrophobicContact CD2-CE2 4.08Å; F1073-F1175 HydrophobicContact CB-CD2 4.18Å; F1073-F1175 HydrophobicContact CB-CE2 3.79Å; F1073-F1175 HydrophobicContact CB-CZ 4.18Å; F1073-F1175 HydrophobicContact CD2-CE1 4.4Å; F1073-F1175 HydrophobicContact CD2-CE2 4.17Å; F1073-F1175 AromaticContact CD2-CZ 3.75Å; F1073-F1175 HydrophobicContact CD2-CZ 3.75Å; F1073-F1175 HydrophobicContact CG-CE2 4.47Å; F1073-F1175 HydrophobicContact CG-CZ 4.4Å; A1156-F1175 HydrophobicContact CB-CZ 4.37Å; S1160-F1175 WeakPolarHBondContact OG-CE1 3.42Å; I1169-F1175 HydrophobicContact CG1-CE1 4.41Å; I1169-F1175 HydrophobicContact CG2-CD1 3.91Å; I1169-F1175 HydrophobicContact CG2-CE1 4.01Å; N1172-F1175 HydrophobicContact CB-CB 4.08Å; N1172-F1175 VanDerWaalsContact CG-CB 3.42Å; N1172-F1175 WeakPolarHBondContact ND2-CB 3.4Å; N1172-F1175 PolarHBondContact O-N 3.29Å; N1172-F1175 PolarHBondContact OD1-N 2.65Å; N1172-F1175 VanDerWaalsContact OD1-N 3.17Å; F1175-N1178 PolarHBondContact O-N 2.88Å; F1175-I1179 HydrophobicContact CD1-CD1 3.88Å; F1175-I1179 HydrophobicContact CD2-CD1 4.16Å; F1175-I1179 HydrophobicContact CD2-CG1 4.4Å; F1175-I1179 HydrophobicContact CE1-CD1 3.55Å; F1175-I1179 HydrophobicContact CE2-CD1 3.88Å; F1175-I1179 HydrophobicContact CE2-CG1 4.17Å; F1175-I1179 HydrophobicContact CG-CD1 4.18Å; F1175-I1179 HydrophobicContact CZ-CD1 3.56Å; F1175-I1179 HydrophobicContact CZ-CG1 4.3Å; F1175-I1179 WeakPolarHBondContact O-CG1 3.45Å; F1175-I1179 PolarHBondContact O-N 3.1Å
1176	V	95	Very high	93.4	Very high	49 Å²	49	59.1 Å²	59.1	30%	0.297	31%	0.311	S	S	.	.	H	α-helix	trans	-63.5	-46.3	174.6	176.1	0	0	0	0	111.2	I1169 L1170 N1172 Y1173 N1178 I1179 L1180	I1169-V1176 HydrophobicContact CG2-CG2 4.03Å; I1169-V1176 WeakPolarHBondContact O-CG2 3.17Å; L1170-V1176 HydrophobicContact CD2-CG2 4.44Å; N1172-V1176 PolarHBondContact O-N 3.19Å; Y1173-V1176 PolarHBondContact O-N 3.01Å; V1176-N1178 VanDerWaalsContact C-N 3.31Å; V1176-N1178 PolarHBondContact O-N 2.8Å; V1176-I1179 PolarHBondContact O-N 3.13Å; V1176-L1180 WeakPolarHBondContact O-CB 3.16Å; V1176-L1180 PolarHBondContact O-N 3.46Å
1177	L	95.4	Very high	93.6	Very high	108 Å²	108	62.3 Å²	62.3	57%	0.565	33%	0.328	S	S	*	.	H	α-helix	trans	-59.6	-43.8	176	178.6	62	0	0	0	110.9	Y1173 L1180 V1181	Y1173-L1177 VanDerWaalsContact O-CB 3.22Å; Y1173-L1177 WeakPolarHBondContact O-CB 3.48Å; Y1173-L1177 PolarHBondContact O-N 2.78Å; L1177-L1180 PolarHBondContact O-N 2.82Å; L1177-V1181 HydrophobicContact CD1-CG2 4.31Å; L1177-V1181 WeakPolarHBondContact O-CG2 3.31Å; L1177-V1181 PolarHBondContact O-N 3.02Å
1178	N	95.2	Very high	93.7	Very high	25 Å²	25	62.7 Å²	62.7	13%	0.134	33%	0.328	C	S	.	.	H	α-helix	trans	-65.6	-44.9	179.1	-166	26.9	0	0	0	112.4	T1068 L1069 T1072 A1174 F1175 V1176 L1180 V1181 C1182	T1068-N1178 VanDerWaalsContact CB-ND2 3.33Å; T1068-N1178 WeakPolarHBondContact CB-ND2 3.35Å; T1068-N1178 PolarHBondContact O-ND2 2.94Å; T1068-N1178 PolarHBondContact OG1-ND2 2.89Å; T1068-N1178 PolarHBondContact OG1-OD1 2.92Å; L1069-N1178 HydrophobicContact CD2-CB 4.39Å; L1069-N1178 PolarHBondContact N-ND2 2.9Å; T1072-N1178 HydrophobicContact CG2-CB 4.31Å; T1072-N1178 PolarHBondContact OG1-ND2 2.83Å; T1072-N1178 VanDerWaalsContact OG1-ND2 3.15Å; A1174-N1178 VanDerWaalsContact O-CB 3.32Å; A1174-N1178 WeakPolarHBondContact O-CB 3.35Å; A1174-N1178 PolarHBondContact O-N 3.03Å; F1175-N1178 PolarHBondContact O-N 2.88Å; V1176-N1178 VanDerWaalsContact C-N 3.31Å; V1176-N1178 PolarHBondContact O-N 2.8Å; N1178-L1180 VanDerWaalsContact C-N 3.28Å; N1178-L1180 PolarHBondContact O-N 2.77Å; N1178-V1181 PolarHBondContact O-N 2.75Å; N1178-C1182 PolarHBondContact O-N 2.74Å; N1178-C1182 PolarHBondContact O-SG 3.2Å; N1178-C1182 VanDerWaalsContact O-SG 3.36Å
1179	I	95.5	Very high	93.7	Very high	23 Å²	23	59.8 Å²	59.8	12%	0.118	31%	0.308	C	S	.	.	H	α-helix	trans	-55.4	-45.3	172.3	-73.4	164.4	0	0	0	110.8	L1069 I1153 I1157 F1175 V1176 F1183	L1069-I1179 HydrophobicContact CD2-CG1 3.77Å; I1153-I1179 HydrophobicContact CG2-CG2 4.15Å; I1157-I1179 HydrophobicContact CD1-CG2 4.08Å; I1157-I1179 HydrophobicContact CG1-CD1 3.9Å; I1157-I1179 HydrophobicContact CG1-CG2 4.45Å; F1175-I1179 HydrophobicContact CD1-CD1 3.88Å; F1175-I1179 HydrophobicContact CD2-CD1 4.16Å; F1175-I1179 HydrophobicContact CD2-CG1 4.4Å; F1175-I1179 HydrophobicContact CE1-CD1 3.55Å; F1175-I1179 HydrophobicContact CE2-CD1 3.88Å; F1175-I1179 HydrophobicContact CE2-CG1 4.17Å; F1175-I1179 HydrophobicContact CG-CD1 4.18Å; F1175-I1179 HydrophobicContact CZ-CD1 3.56Å; F1175-I1179 HydrophobicContact CZ-CG1 4.3Å; F1175-I1179 WeakPolarHBondContact O-CG1 3.45Å; F1175-I1179 PolarHBondContact O-N 3.1Å; V1176-I1179 PolarHBondContact O-N 3.13Å; I1179-F1183 WeakPolarHBondContact O-CB 3.4Å; I1179-F1183 PolarHBondContact O-N 2.82Å
1180	L	95.8	Very high	93.8	Very high	100 Å²	100	58.2 Å²	58.2	52%	0.524	30%	0.3	S	S	.	.	H	α-helix	trans	-62.8	-45.6	179.6	-177.1	67.1	0	0	0	111.5	V1176 L1177 N1178 F1183 V1184	V1176-L1180 WeakPolarHBondContact O-CB 3.16Å; V1176-L1180 PolarHBondContact O-N 3.46Å; L1177-L1180 PolarHBondContact O-N 2.82Å; N1178-L1180 VanDerWaalsContact C-N 3.28Å; N1178-L1180 PolarHBondContact O-N 2.77Å; L1180-F1183 PolarHBondContact O-N 2.69Å; L1180-V1184 HydrophobicContact CD1-CG2 4.16Å; L1180-V1184 HydrophobicContact CG-CG2 4.43Å; L1180-V1184 WeakPolarHBondContact O-CB 3.35Å; L1180-V1184 VanDerWaalsContact O-CG2 3.26Å; L1180-V1184 WeakPolarHBondContact O-CG2 3.11Å; L1180-V1184 PolarHBondContact O-N 2.85Å
1181	V	95.7	Very high	93.9	Very high	85 Å²	85	55.1 Å²	55.1	52%	0.515	29%	0.286	S	S	.	.	H	α-helix	trans	-62.5	-48.5	177.8	169.7	0	0	0	0	111.1	L1177 N1178 F1183 F1185	L1177-V1181 HydrophobicContact CD1-CG2 4.31Å; L1177-V1181 WeakPolarHBondContact O-CG2 3.31Å; L1177-V1181 PolarHBondContact O-N 3.02Å; N1178-V1181 PolarHBondContact O-N 2.75Å; V1181-F1183 PolarHBondContact O-N 3.43Å; V1181-F1185 WeakPolarHBondContact O-CB 3.14Å; V1181-F1185 PolarHBondContact O-N 2.93Å
1182	C	95.4	Very high	93.7	Very high	5 Å²	5	59.8 Å²	59.8	3%	0.034	30%	0.298	C	S	.	.	H	α-helix	trans	-59.3	-46.5	175.6	-66.7	0	0	0	0	111.6	I1153 N1178 F1185 S1186	I1153-C1182 HydrophobicContact CD1-CB 3.78Å; I1153-C1182 HydrophobicContact CG1-CB 4.06Å; N1178-C1182 PolarHBondContact O-N 2.74Å; N1178-C1182 PolarHBondContact O-SG 3.2Å; N1178-C1182 VanDerWaalsContact O-SG 3.36Å; C1182-F1185 PolarHBondContact O-N 2.82Å; C1182-S1186 PolarHBondContact O-N 3.5Å; C1182-S1186 PolarHBondContact O-OG 2.64Å
1183	F	95.1	Very high	93.4	Very high	89 Å²	89	59.9 Å²	59.9	39%	0.39	30%	0.299	S	S	.	.	H	α-helix	trans	-65.1	-44.5	-178.6	-179.1	-96.1	0	0	0	112.7	Y1150 I1179 L1180 V1181 F1185 S1186 L1187	Y1150-F1183 HydrophobicContact CD1-CD2 4.11Å; Y1150-F1183 HydrophobicContact CD1-CE2 4.05Å; Y1150-F1183 HydrophobicContact CE1-CD2 4.18Å; Y1150-F1183 AromaticContact CE1-CE2 3.98Å; Y1150-F1183 HydrophobicContact CE1-CE2 3.98Å; I1179-F1183 WeakPolarHBondContact O-CB 3.4Å; I1179-F1183 PolarHBondContact O-N 2.82Å; L1180-F1183 PolarHBondContact O-N 2.69Å; V1181-F1183 PolarHBondContact O-N 3.43Å; F1183-F1185 VanDerWaalsContact C-N 3.32Å; F1183-F1185 PolarHBondContact O-N 2.99Å; F1183-S1186 PolarHBondContact O-N 3.47Å; F1183-L1187 WeakPolarHBondContact O-CB 3.14Å; F1183-L1187 PolarHBondContact O-N 2.91Å
1184	V	95.1	Very high	93.3	Very high	80 Å²	80	54.5 Å²	54.5	49%	0.485	29%	0.286	S	S	.	.	H	α-helix	trans	-64	-38.8	176.5	169.8	0	0	0	0	111	L1180 L1187 Y1188	L1180-V1184 HydrophobicContact CD1-CG2 4.16Å; L1180-V1184 HydrophobicContact CG-CG2 4.43Å; L1180-V1184 WeakPolarHBondContact O-CB 3.35Å; L1180-V1184 VanDerWaalsContact O-CG2 3.26Å; L1180-V1184 WeakPolarHBondContact O-CG2 3.11Å; L1180-V1184 PolarHBondContact O-N 2.85Å; V1184-L1187 WeakPolarHBondContact O-CB 3.38Å; V1184-L1187 PolarHBondContact O-N 2.82Å; V1184-Y1188 WeakPolarHBondContact O-CB 3.18Å; V1184-Y1188 PolarHBondContact O-N 3.05Å
1185	F	94.2	Very high	93	Very high	74 Å²	74	56.1 Å²	56.1	33%	0.325	29%	0.288	S	S	.	.	H	α-helix	trans	-68.3	-43.7	176.1	-168.9	-86.5	0	0	0	112.1	Y1060 V1181 C1182 F1183 L1187 Y1188 L1189	Y1060-F1185 HydrophobicContact CD2-CE1 4.28Å; Y1060-F1185 AromaticContact CE2-CD1 3.73Å; Y1060-F1185 HydrophobicContact CE2-CD1 3.73Å; Y1060-F1185 AromaticContact CE2-CE1 3.49Å; Y1060-F1185 HydrophobicContact CE2-CE1 3.49Å; Y1060-F1185 VanDerWaalsContact CE2-CE1 3.49Å; Y1060-F1185 HydrophobicContact CE2-CZ 4.42Å; Y1060-F1185 AromaticContact CZ-CD1 3.68Å; Y1060-F1185 AromaticContact CZ-CE1 3.77Å; Y1060-F1185 WeakPolarHBondContact OH-CD1 2.88Å; V1181-F1185 WeakPolarHBondContact O-CB 3.14Å; V1181-F1185 PolarHBondContact O-N 2.93Å; C1182-F1185 PolarHBondContact O-N 2.82Å; F1183-F1185 VanDerWaalsContact C-N 3.32Å; F1183-F1185 PolarHBondContact O-N 2.99Å; F1185-L1187 VanDerWaalsContact C-N 3.31Å; F1185-L1187 PolarHBondContact O-N 3.13Å; F1185-Y1188 PolarHBondContact O-N 2.76Å; F1185-L1189 HydrophobicContact CD1-CD1 4.32Å; F1185-L1189 HydrophobicContact CE1-CD1 3.63Å; F1185-L1189 HydrophobicContact CZ-CD1 4.15Å; F1185-L1189 WeakPolarHBondContact O-CB 3.47Å; F1185-L1189 PolarHBondContact O-N 3.06Å
1186	S	94.1	Very high	92.9	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-59.6	-40.3	172.3	-68.7	0	0	0	0	112	T1149 Y1150 C1182 F1183 L1189 T1190	T1149-S1186 PolarHBondContact OG1-OG 2.84Å; Y1150-S1186 VanDerWaalsContact OH-C 3.26Å; Y1150-S1186 PolarHBondContact OH-O 2.79Å; Y1150-S1186 VanDerWaalsContact OH-O 3.06Å; C1182-S1186 PolarHBondContact O-N 3.5Å; C1182-S1186 PolarHBondContact O-OG 2.64Å; F1183-S1186 PolarHBondContact O-N 3.47Å; S1186-L1189 PolarHBondContact O-N 2.81Å; S1186-T1190 WeakPolarHBondContact O-CB 3.38Å; S1186-T1190 PolarHBondContact O-N 2.91Å; S1186-T1190 PolarHBondContact O-OG1 2.9Å
1187	L	94	Very high	92.7	Very high	68 Å²	68	63 Å²	63	36%	0.356	31%	0.31	S	S	.	.	H	α-helix	trans	-60.1	-49.7	175.6	-167.6	83.5	0	0	0	111.5	Y1150 F1183 V1184 F1185 L1189 T1190 T1191	Y1150-L1187 VanDerWaalsContact OH-CA 3.28Å; Y1150-L1187 WeakPolarHBondContact OH-CA 3.39Å; Y1150-L1187 PolarHBondContact OH-N 2.96Å; F1183-L1187 WeakPolarHBondContact O-CB 3.14Å; F1183-L1187 PolarHBondContact O-N 2.91Å; V1184-L1187 WeakPolarHBondContact O-CB 3.38Å; V1184-L1187 PolarHBondContact O-N 2.82Å; F1185-L1187 VanDerWaalsContact C-N 3.31Å; F1185-L1187 PolarHBondContact O-N 3.13Å; L1187-L1189 VanDerWaalsContact C-N 3.34Å; L1187-L1189 PolarHBondContact O-N 3.14Å; L1187-T1190 PolarHBondContact O-N 2.82Å; L1187-T1191 PolarHBondContact O-N 2.8Å; L1187-T1191 PolarHBondContact O-OG1 3.26Å
1188	Y	93.4	Very high	92.4	Very high	85 Å²	85	58.6 Å²	58.6	33%	0.333	29%	0.287	S	S	.	.	H	α-helix	trans	-58.7	-44.1	174.6	163.8	-114.2	0	0	0	111.9	V1184 F1185 T1190 T1191 Y1192 V1194 I1197	V1184-Y1188 WeakPolarHBondContact O-CB 3.18Å; V1184-Y1188 PolarHBondContact O-N 3.05Å; F1185-Y1188 PolarHBondContact O-N 2.76Å; Y1188-T1190 VanDerWaalsContact C-N 3.29Å; Y1188-T1190 PolarHBondContact O-N 3.05Å; Y1188-T1191 PolarHBondContact O-N 2.86Å; Y1188-T1191 PolarHBondContact O-OG1 3.16Å; Y1188-Y1192 WeakPolarHBondContact CE2-O 3.48Å; Y1188-Y1192 CarbonylContact O-C 3.57Å; Y1188-Y1192 PolarHBondContact O-N 2.95Å; Y1188-Y1192 VanDerWaalsContact O-N 3.14Å; Y1188-V1194 WeakPolarHBondContact OH-CG1 3.4Å; Y1188-V1194 PolarHBondContact OH-N 3.47Å; Y1188-V1194 VanDerWaalsContact OH-N 3.11Å; Y1188-I1197 HydrophobicContact CE1-CD1 3.85Å
1189	L	91.9	Very high	92	Very high	1 Å²	1	63.7 Å²	63.7	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-63.3	-35	178.8	-147.5	102.4	0	0	0	112.5	F1145 M1146 F1185 S1186 L1187 P1193 I1197 L1201 L1203	F1145-L1189 HydrophobicContact CD1-CD2 4.36Å; F1145-L1189 HydrophobicContact CE1-CD2 3.65Å; M1146-L1189 HydrophobicContact CE-CD2 4.43Å; M1146-L1189 WeakPolarHBondContact CE-O 3.29Å; M1146-L1189 HydrophobicContact SD-CB 4.47Å; M1146-L1189 HydrophobicContact SD-CD2 3.94Å; M1146-L1189 HydrophobicContact SD-CG 4.49Å; F1185-L1189 HydrophobicContact CD1-CD1 4.32Å; F1185-L1189 HydrophobicContact CE1-CD1 3.63Å; F1185-L1189 HydrophobicContact CZ-CD1 4.15Å; F1185-L1189 WeakPolarHBondContact O-CB 3.47Å; F1185-L1189 PolarHBondContact O-N 3.06Å; S1186-L1189 PolarHBondContact O-N 2.81Å; L1187-L1189 VanDerWaalsContact C-N 3.34Å; L1187-L1189 PolarHBondContact O-N 3.14Å; L1189-P1193 VanDerWaalsContact O-CD 3.23Å; L1189-P1193 WeakPolarHBondContact O-CD 3.37Å; L1189-P1193 VanDerWaalsContact O-CG 3.32Å; L1189-P1193 WeakPolarHBondContact O-CG 3.47Å; L1189-I1197 HydrophobicContact CD1-CG2 3.76Å; L1189-L1201 HydrophobicContact CD1-CD1 3.77Å; L1189-L1201 HydrophobicContact CD2-CD1 4.03Å; L1189-L1201 HydrophobicContact CG-CD1 4.43Å; L1189-L1203 HydrophobicContact CD2-CD1 3.82Å
1190	T	91.4	Very high	91.8	Very high	5 Å²	5	68.5 Å²	68.5	3%	0.031	33%	0.327	C	S	.	.	H	α-helix	trans	-81	-32.4	-178.8	-44.7	0	0	0	0	112.8	M1146 Y1150 S1186 L1187 Y1188 I1212 L1215	M1146-T1190 HydrophobicContact CB-CG2 4.45Å; M1146-T1190 VanDerWaalsContact SD-CA 3.51Å; M1146-T1190 HydrophobicContact SD-CG2 4.26Å; Y1150-T1190 WeakPolarHBondContact CE2-OG1 3.39Å; Y1150-T1190 WeakPolarHBondContact OH-CB 3.38Å; Y1150-T1190 PolarHBondContact OH-OG1 2.98Å; S1186-T1190 WeakPolarHBondContact O-CB 3.38Å; S1186-T1190 PolarHBondContact O-N 2.91Å; S1186-T1190 PolarHBondContact O-OG1 2.9Å; L1187-T1190 PolarHBondContact O-N 2.82Å; Y1188-T1190 VanDerWaalsContact C-N 3.29Å; Y1188-T1190 PolarHBondContact O-N 3.05Å; T1190-I1212 HydrophobicContact CG2-CG2 4.5Å; T1190-L1215 HydrophobicContact CG2-CD1 4.38Å
1191	T	90.3	Very high	91.5	Very high	60 Å²	60	64.4 Å²	64.4	37%	0.368	31%	0.305	S	S	.	.	H	α-helix	trans	-86.1	-59.1	-175	43.4	0	0	0	0	113	L1187 Y1188 I1212 H1216	L1187-T1191 PolarHBondContact O-N 2.8Å; L1187-T1191 PolarHBondContact O-OG1 3.26Å; Y1188-T1191 PolarHBondContact O-N 2.86Å; Y1188-T1191 PolarHBondContact O-OG1 3.16Å; T1191-I1212 HydrophobicContact CG2-CG2 4.15Å; T1191-H1216 WeakPolarHBondContact CG2-NE2 3.46Å
1192	Y	86.9	Confident	91.1	Very high	155 Å²	155	63.4 Å²	63.4	61%	0.608	30%	0.295	S	S	*	.			trans	-159.3	74.9	-177.9	-151.5	-96.7	0	0	0	113.5	Y1188	Y1188-Y1192 WeakPolarHBondContact CE2-O 3.48Å; Y1188-Y1192 CarbonylContact O-C 3.57Å; Y1188-Y1192 PolarHBondContact O-N 2.95Å; Y1188-Y1192 VanDerWaalsContact O-N 3.14Å
1193	P	87.5	Confident	90.8	Very high	9 Å²	9	63.7 Å²	63.7	6%	0.058	30%	0.296	C	S	.	.			trans	-70.2	142.5	176.8	27.7	-33.6	0	0	0	111.9	L1189 L1198 R1205	L1189-P1193 VanDerWaalsContact O-CD 3.23Å; L1189-P1193 WeakPolarHBondContact O-CD 3.37Å; L1189-P1193 VanDerWaalsContact O-CG 3.32Å; L1189-P1193 WeakPolarHBondContact O-CG 3.47Å; P1193-L1198 HydrophobicContact CB-CG 4.19Å; P1193-L1198 HydrophobicContact CG-CD1 4.08Å; P1193-L1198 HydrophobicContact CG-CD2 3.68Å; P1193-L1198 HydrophobicContact CG-CG 3.75Å; P1193-R1205 PolarHBondContact O-NH2 3.45Å
1194	V	90.2	Very high	90.4	Very high	75 Å²	75	61 Å²	61	46%	0.455	29%	0.287	S	S	.	.			trans	-62.7	146.5	171.9	74.8	0	0	0	0	111.4	Y1188 W1196 I1197 L1198	Y1188-V1194 WeakPolarHBondContact OH-CG1 3.4Å; Y1188-V1194 PolarHBondContact OH-N 3.47Å; Y1188-V1194 VanDerWaalsContact OH-N 3.11Å; V1194-W1196 VanDerWaalsContact C-N 3.29Å; V1194-W1196 PolarHBondContact O-N 3.01Å; V1194-I1197 HydrophobicContact CG1-CB 4.2Å; V1194-I1197 HydrophobicContact CG1-CD1 3.85Å; V1194-I1197 HydrophobicContact CG1-CG1 3.75Å; V1194-I1197 PolarHBondContact O-N 3.03Å; V1194-L1198 PolarHBondContact O-N 3.19Å
1195	N	87.9	Confident	90.1	Very high	83 Å²	83	61.3 Å²	61.3	44%	0.444	28%	0.279	S	S	.	.	H	α-helix	trans	-53.6	-41.6	-172.6	-62.5	1.9	0	0	0	113.3	I1197 L1198 E1199 R1205	N1195-I1197 VanDerWaalsContact C-N 3.25Å; N1195-I1197 PolarHBondContact O-N 3.33Å; N1195-L1198 WeakPolarHBondContact O-CB 3.3Å; N1195-L1198 PolarHBondContact O-N 3.34Å; N1195-L1198 VanDerWaalsContact O-N 3.11Å; N1195-E1199 WeakPolarHBondContact O-CG 3.43Å; N1195-E1199 PolarHBondContact O-N 2.73Å; N1195-R1205 PolarHBondContact OD1-NH1 2.77Å; N1195-R1205 PolarHBondContact OD1-NH2 2.8Å
1196	W	90.6	Very high	89.8	Confident	168 Å²	168	58.4 Å²	58.4	64%	0.636	27%	0.267	S	S	*	.	H	α-helix	trans	-57.8	-34.4	177.9	175	73.1	0	0	0	113.8	V1194 R1200	V1194-W1196 VanDerWaalsContact C-N 3.29Å; V1194-W1196 PolarHBondContact O-N 3.01Å; W1196-R1200 WeakPolarHBondContact O-CB 3.05Å; W1196-R1200 VanDerWaalsContact O-CG 3.29Å; W1196-R1200 WeakPolarHBondContact O-CG 3.28Å; W1196-R1200 PolarHBondContact O-N 2.82Å; W1196-R1200 VanDerWaalsContact O-N 3.12Å
1197	I	90.5	Very high	89.4	Confident	25 Å²	25	62.2 Å²	62.2	13%	0.128	29%	0.292	C	S	.	.	H	α-helix	trans	-76.2	-40.1	177	-65.9	178.5	0	0	0	110.6	Y1188 L1189 V1194 N1195 R1200 L1201	Y1188-I1197 HydrophobicContact CE1-CD1 3.85Å; L1189-I1197 HydrophobicContact CD1-CG2 3.76Å; V1194-I1197 HydrophobicContact CG1-CB 4.2Å; V1194-I1197 HydrophobicContact CG1-CD1 3.85Å; V1194-I1197 HydrophobicContact CG1-CG1 3.75Å; V1194-I1197 PolarHBondContact O-N 3.03Å; N1195-I1197 VanDerWaalsContact C-N 3.25Å; N1195-I1197 PolarHBondContact O-N 3.33Å; I1197-R1200 PolarHBondContact O-N 2.8Å; I1197-L1201 HydrophobicContact CG2-CD1 3.76Å; I1197-L1201 HydrophobicContact CG2-CG 4.49Å; I1197-L1201 WeakPolarHBondContact O-CB 3.07Å; I1197-L1201 PolarHBondContact O-N 3.23Å
1198	L	89.2	Confident	89.3	Confident	16 Å²	16	60.2 Å²	60.2	8%	0.084	28%	0.283	C	S	.	.	H	α-helix	trans	-60.2	-48	174.3	-75.8	163.7	0	0	0	111.4	P1193 V1194 N1195 R1200 L1201 Q1202 L1203 R1205	P1193-L1198 HydrophobicContact CB-CG 4.19Å; P1193-L1198 HydrophobicContact CG-CD1 4.08Å; P1193-L1198 HydrophobicContact CG-CD2 3.68Å; P1193-L1198 HydrophobicContact CG-CG 3.75Å; V1194-L1198 PolarHBondContact O-N 3.19Å; N1195-L1198 WeakPolarHBondContact O-CB 3.3Å; N1195-L1198 PolarHBondContact O-N 3.34Å; N1195-L1198 VanDerWaalsContact O-N 3.11Å; L1198-R1200 PolarHBondContact O-N 3.12Å; L1198-L1201 PolarHBondContact O-N 3.31Å; L1198-Q1202 WeakPolarHBondContact O-CA 3.35Å; L1198-Q1202 PolarHBondContact O-N 3.19Å; L1198-L1203 HydrophobicContact CD2-CB 3.7Å; L1198-L1203 PolarHBondContact O-N 3.44Å; L1198-R1205 HydrophobicContact CD1-CB 4.16Å
1199	E	88.2	Confident	89.1	Confident	132 Å²	132	61.1 Å²	61.1	62%	0.617	30%	0.298	S	S	*	.	H	α-helix	trans	-61.2	-43.7	177.9	-73.6	165.9	-158.8	0	0	111.8	N1195 Q1202	N1195-E1199 WeakPolarHBondContact O-CG 3.43Å; N1195-E1199 PolarHBondContact O-N 2.73Å; E1199-Q1202 PolarHBondContact O-N 2.97Å
1200	R	89.5	Confident	89.2	Confident	124 Å²	124	70.5 Å²	70.5	47%	0.468	33%	0.333	S	S	.	.	H	α-helix	trans	-66.7	-43.6	178.5	-80.8	-73.3	179.3	175.3	-2.1	113.5	W1056 W1196 I1197 L1198 Q1202	W1056-R1200 VanDerWaalsContact CB-O 3.31Å; W1056-R1200 WeakPolarHBondContact CB-O 3.25Å; W1056-R1200 VanDerWaalsContact CD1-O 3.25Å; W1056-R1200 VanDerWaalsContact CG-O 3.29Å; W1196-R1200 WeakPolarHBondContact O-CB 3.05Å; W1196-R1200 VanDerWaalsContact O-CG 3.29Å; W1196-R1200 WeakPolarHBondContact O-CG 3.28Å; W1196-R1200 PolarHBondContact O-N 2.82Å; W1196-R1200 VanDerWaalsContact O-N 3.12Å; I1197-R1200 PolarHBondContact O-N 2.8Å; L1198-R1200 PolarHBondContact O-N 3.12Å; R1200-Q1202 PolarHBondContact O-N 2.79Å
1201	L	90	Very high	89.2	Confident	13 Å²	13	70.3 Å²	70.3	7%	0.068	33%	0.332	C	S	.	.	H	α-helix	trans	-77.5	-10.6	176.5	-70.1	169.3	0	0	0	113	S1054 W1056 E1057 L1189 I1197 L1198 L1203	S1054-L1201 PolarHBondContact OG-O 3.06Å; W1056-L1201 HydrophobicContact CB-CD2 4.01Å; E1057-L1201 HydrophobicContact CG-CB 4.42Å; E1057-L1201 HydrophobicContact CG-CD2 4.21Å; L1189-L1201 HydrophobicContact CD1-CD1 3.77Å; L1189-L1201 HydrophobicContact CD2-CD1 4.03Å; L1189-L1201 HydrophobicContact CG-CD1 4.43Å; I1197-L1201 HydrophobicContact CG2-CD1 3.76Å; I1197-L1201 HydrophobicContact CG2-CG 4.49Å; I1197-L1201 WeakPolarHBondContact O-CB 3.07Å; I1197-L1201 PolarHBondContact O-N 3.23Å; L1198-L1201 PolarHBondContact O-N 3.31Å; L1201-L1203 VanDerWaalsContact C-N 3.28Å; L1201-L1203 HydrophobicContact CB-CB 4.43Å; L1201-L1203 HydrophobicContact CB-CD1 3.67Å; L1201-L1203 HydrophobicContact CB-CG 3.83Å; L1201-L1203 HydrophobicContact CD1-CD1 3.7Å; L1201-L1203 HydrophobicContact CG-CD1 4.32Å
1202	Q	88.7	Confident	89.4	Confident	65 Å²	65	68.3 Å²	68.3	30%	0.304	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	35.8	-171.5	-57.5	180	-28.5	0	0	113.1	Q1137 L1198 E1199 R1200	Q1137-Q1202 HydrophobicContact CG-CB 3.98Å; Q1137-Q1202 WeakPolarHBondContact CG-O 3.36Å; L1198-Q1202 WeakPolarHBondContact O-CA 3.35Å; L1198-Q1202 PolarHBondContact O-N 3.19Å; E1199-Q1202 PolarHBondContact O-N 2.97Å; R1200-Q1202 PolarHBondContact O-N 2.79Å
1203	L	87.8	Confident	89.7	Confident	11 Å²	11	65.7 Å²	65.7	6%	0.058	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-91.3	143	-179.6	-77.7	169.3	0	0	0	112.4	E1057 A1142 F1145 M1146 L1189 L1198 L1201	E1057-L1203 WeakPolarHBondContact OE1-CD2 3.37Å; A1142-L1203 HydrophobicContact CB-CD2 3.83Å; F1145-L1203 HydrophobicContact CD1-CD1 3.95Å; F1145-L1203 HydrophobicContact CD1-CD2 3.88Å; F1145-L1203 HydrophobicContact CD1-CG 4.44Å; F1145-L1203 HydrophobicContact CE1-CD1 3.88Å; F1145-L1203 HydrophobicContact CG-CD2 4.47Å; M1146-L1203 HydrophobicContact CE-CD1 4.38Å; L1189-L1203 HydrophobicContact CD2-CD1 3.82Å; L1198-L1203 HydrophobicContact CD2-CB 3.7Å; L1198-L1203 PolarHBondContact O-N 3.44Å; L1201-L1203 VanDerWaalsContact C-N 3.28Å; L1201-L1203 HydrophobicContact CB-CB 4.43Å; L1201-L1203 HydrophobicContact CB-CD1 3.67Å; L1201-L1203 HydrophobicContact CB-CG 3.83Å; L1201-L1203 HydrophobicContact CD1-CD1 3.7Å; L1201-L1203 HydrophobicContact CG-CD1 4.32Å
1204	V	87.6	Confident	90	Very high	32 Å²	32	67.8 Å²	67.8	19%	0.194	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-90.1	134.6	172.8	-175.6	0	0	0	0	110.3	Q1137 Y1139 I1206	Q1137-V1204 HydrophobicContact CB-CG2 4.17Å; Y1139-V1204 HydrophobicContact CD1-CB 4.34Å; Y1139-V1204 HydrophobicContact CD1-CG1 3.8Å; Y1139-V1204 HydrophobicContact CE1-CB 4.39Å; Y1139-V1204 HydrophobicContact CE1-CG1 3.41Å; Y1139-V1204 VanDerWaalsContact CE1-CG1 3.41Å; Y1139-V1204 HydrophobicContact CE2-CG1 4.34Å; Y1139-V1204 HydrophobicContact CG-CG1 4.43Å; V1204-I1206 PolarHBondContact O-N 2.97Å
1205	R	87.2	Confident	90.2	Very high	86 Å²	86	64.3 Å²	64.3	33%	0.325	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-71.7	121.8	175.7	179.4	172.8	-76.7	146.2	2.2	110.4	P1193 N1195 L1198 P1207	P1193-R1205 PolarHBondContact O-NH2 3.45Å; N1195-R1205 PolarHBondContact OD1-NH1 2.77Å; N1195-R1205 PolarHBondContact OD1-NH2 2.8Å; L1198-R1205 HydrophobicContact CD1-CB 4.16Å; R1205-P1207 WeakPolarHBondContact O-CD 3.44Å
1206	I	88.7	Confident	90.5	Very high	14 Å²	14	62.2 Å²	62.2	7%	0.072	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-71.3	121.3	172.9	-66	171.1	0	0	0	109	W1123 V1204 F1211 I1212 L1215	W1123-I1206 HydrophobicContact CH2-CG2 3.8Å; W1123-I1206 HydrophobicContact CZ2-CG2 4.17Å; W1123-I1206 HydrophobicContact CZ3-CG2 4.49Å; V1204-I1206 PolarHBondContact O-N 2.97Å; I1206-F1211 HydrophobicContact CD1-CD1 4.25Å; I1206-F1211 HydrophobicContact CD1-CE1 4.47Å; I1206-F1211 HydrophobicContact CG2-CB 4.31Å; I1206-F1211 HydrophobicContact CG2-CD1 4.08Å; I1206-I1212 HydrophobicContact CB-CG1 4.38Å; I1206-I1212 HydrophobicContact CG2-CD1 4.45Å; I1206-I1212 HydrophobicContact CG2-CG1 4.01Å; I1206-L1215 HydrophobicContact CD1-CD1 3.76Å
1207	P	86.8	Confident	90.6	Very high	79 Å²	79	57.5 Å²	57.5	51%	0.513	28%	0.284	S	S	.	.			trans	-80.3	-17.9	-176	31.4	-36	0	0	0	113.8	W1123 R1205	W1123-P1207 HydrophobicContact CB-CG 4.27Å; W1123-P1207 HydrophobicContact CD2-CG 3.63Å; W1123-P1207 HydrophobicContact CE3-CG 3.55Å; W1123-P1207 HydrophobicContact CG-CG 3.94Å; W1123-P1207 HydrophobicContact CZ3-CG 4.21Å; R1205-P1207 WeakPolarHBondContact O-CD 3.44Å
1208	S	90.2	Very high	90.8	Very high	26 Å²	26	57.2 Å²	57.2	18%	0.182	28%	0.282	C	S	.	.			trans	-99.2	112.1	-176.2	177.5	0	0	0	0	112.8	W1123 W1210 F1211 I1212	W1123-S1208 VanDerWaalsContact NE1-CB 3.32Å; S1208-W1210 PolarHBondContact O-N 3.37Å; S1208-W1210 PolarHBondContact OG-N 2.91Å; S1208-F1211 PolarHBondContact O-N 3.21Å; S1208-F1211 VanDerWaalsContact O-N 3.08Å; S1208-F1211 PolarHBondContact OG-N 3.09Å; S1208-I1212 PolarHBondContact O-N 2.9Å; S1208-I1212 VanDerWaalsContact O-N 3.14Å
1209	V	90.7	Very high	91	Very high	105 Å²	105	57.1 Å²	57.1	64%	0.636	28%	0.282	S	S	*	.	H	α-helix	trans	-58.2	-35	169.8	-177.5	0	0	0	0	111.4	F1211 I1212 L1213	V1209-F1211 VanDerWaalsContact C-N 3.32Å; V1209-F1211 PolarHBondContact O-N 2.83Å; V1209-I1212 PolarHBondContact O-N 3.11Å; V1209-L1213 WeakPolarHBondContact O-CG 3.39Å; V1209-L1213 PolarHBondContact O-N 3.35Å
1210	W	92.2	Very high	91.4	Very high	198 Å²	198	56.1 Å²	56.1	75%	0.75	28%	0.281	S	S	*	.	H	α-helix	trans	-61.4	-39.2	175	-103.2	106.7	0	0	0	112.4	S1208 L1213 I1214	S1208-W1210 PolarHBondContact O-N 3.37Å; S1208-W1210 PolarHBondContact OG-N 2.91Å; W1210-L1213 PolarHBondContact O-N 3.05Å; W1210-I1214 WeakPolarHBondContact O-CG1 3.38Å; W1210-I1214 PolarHBondContact O-N 3.31Å
1211	F	92.6	Very high	91.6	Very high	1 Å²	1	52.8 Å²	52.8	0%	0.004	28%	0.28	C	S	.	.	H	α-helix	trans	-72.6	-34.9	177.2	-167.6	-96.6	0	0	0	112.3	L1117 I1118 Q1121 W1123 I1206 S1208 V1209 L1213 I1214 L1215	L1117-F1211 HydrophobicContact CB-CE2 4.17Å; I1118-F1211 HydrophobicContact CB-CE1 4.12Å; I1118-F1211 HydrophobicContact CB-CE2 4.26Å; I1118-F1211 HydrophobicContact CB-CZ 3.6Å; I1118-F1211 HydrophobicContact CD1-CD1 4.4Å; I1118-F1211 HydrophobicContact CD1-CE1 3.73Å; I1118-F1211 HydrophobicContact CD1-CZ 4.13Å; I1118-F1211 HydrophobicContact CG1-CE1 4.05Å; I1118-F1211 HydrophobicContact CG1-CZ 3.97Å; Q1121-F1211 VanDerWaalsContact CD-CD2 3.41Å; Q1121-F1211 HydrophobicContact CG-CD2 3.7Å; Q1121-F1211 HydrophobicContact CG-CE2 3.91Å; Q1121-F1211 HydrophobicContact CG-CG 4.41Å; W1123-F1211 HydrophobicContact CH2-CB 4.45Å; W1123-F1211 HydrophobicContact CH2-CD1 4.17Å; W1123-F1211 HydrophobicContact CH2-CG 4.22Å; W1123-F1211 HydrophobicContact CZ2-CB 3.73Å; W1123-F1211 HydrophobicContact CZ2-CD1 4.24Å; W1123-F1211 HydrophobicContact CZ2-CD2 4.35Å; W1123-F1211 AromaticContact CZ2-CG 3.84Å; W1123-F1211 HydrophobicContact CZ2-CG 3.84Å; I1206-F1211 HydrophobicContact CD1-CD1 4.25Å; I1206-F1211 HydrophobicContact CD1-CE1 4.47Å; I1206-F1211 HydrophobicContact CG2-CB 4.31Å; I1206-F1211 HydrophobicContact CG2-CD1 4.08Å; S1208-F1211 PolarHBondContact O-N 3.21Å; S1208-F1211 VanDerWaalsContact O-N 3.08Å; S1208-F1211 PolarHBondContact OG-N 3.09Å; V1209-F1211 VanDerWaalsContact C-N 3.32Å; V1209-F1211 PolarHBondContact O-N 2.83Å; F1211-L1213 VanDerWaalsContact C-N 3.32Å; F1211-L1213 PolarHBondContact O-N 2.94Å; F1211-I1214 HydrophobicContact CD2-CD1 4.5Å; F1211-I1214 WeakPolarHBondContact O-CB 3.35Å; F1211-I1214 PolarHBondContact O-N 2.89Å; F1211-I1214 VanDerWaalsContact O-N 3.15Å; F1211-L1215 HydrophobicContact CD1-CD1 3.96Å; F1211-L1215 HydrophobicContact CD1-CG 4.04Å; F1211-L1215 HydrophobicContact CE1-CD1 3.81Å; F1211-L1215 HydrophobicContact CE1-CD2 3.86Å; F1211-L1215 HydrophobicContact CE1-CG 3.74Å; F1211-L1215 HydrophobicContact CZ-CD2 4.25Å; F1211-L1215 HydrophobicContact CZ-CG 4.45Å; F1211-L1215 WeakPolarHBondContact O-CG 3.46Å; F1211-L1215 PolarHBondContact O-N 2.89Å
1212	I	93.6	Very high	91.9	Very high	17 Å²	17	52.4 Å²	52.4	9%	0.087	28%	0.277	C	S	.	.	H	α-helix	trans	-59.9	-42.7	171.5	-66.5	169.9	0	0	0	110.7	T1190 T1191 I1206 S1208 V1209 I1214 L1215 H1216	T1190-I1212 HydrophobicContact CG2-CG2 4.5Å; T1191-I1212 HydrophobicContact CG2-CG2 4.15Å; I1206-I1212 HydrophobicContact CB-CG1 4.38Å; I1206-I1212 HydrophobicContact CG2-CD1 4.45Å; I1206-I1212 HydrophobicContact CG2-CG1 4.01Å; S1208-I1212 PolarHBondContact O-N 2.9Å; S1208-I1212 VanDerWaalsContact O-N 3.14Å; V1209-I1212 PolarHBondContact O-N 3.11Å; I1212-I1214 VanDerWaalsContact C-N 3.35Å; I1212-I1214 PolarHBondContact O-N 3.16Å; I1212-L1215 PolarHBondContact O-N 3.42Å; I1212-H1216 PolarHBondContact O-CD2 3.16Å; I1212-H1216 PolarHBondContact O-N 3.26Å
1213	L	93.5	Very high	92.2	Very high	100 Å²	100	52.6 Å²	52.6	52%	0.524	28%	0.278	S	S	.	.	H	α-helix	trans	-63.1	-38.3	173.3	-69.4	172.4	0	0	0	112.6	V1209 W1210 F1211 H1216 S1217	V1209-L1213 WeakPolarHBondContact O-CG 3.39Å; V1209-L1213 PolarHBondContact O-N 3.35Å; W1210-L1213 PolarHBondContact O-N 3.05Å; F1211-L1213 VanDerWaalsContact C-N 3.32Å; F1211-L1213 PolarHBondContact O-N 2.94Å; L1213-H1216 PolarHBondContact O-N 2.97Å; L1213-S1217 PolarHBondContact O-N 3.02Å
1214	I	94	Very high	92.6	Very high	53 Å²	53	56.8 Å²	56.8	27%	0.272	30%	0.298	S	S	.	.	H	α-helix	trans	-61	-48.8	173.9	-69.9	166.5	0	0	0	110.2	L1117 W1210 F1211 I1212 H1216 S1217 M1218	L1117-I1214 HydrophobicContact CD1-CG2 4.31Å; W1210-I1214 WeakPolarHBondContact O-CG1 3.38Å; W1210-I1214 PolarHBondContact O-N 3.31Å; F1211-I1214 HydrophobicContact CD2-CD1 4.5Å; F1211-I1214 WeakPolarHBondContact O-CB 3.35Å; F1211-I1214 PolarHBondContact O-N 2.89Å; F1211-I1214 VanDerWaalsContact O-N 3.15Å; I1212-I1214 VanDerWaalsContact C-N 3.35Å; I1212-I1214 PolarHBondContact O-N 3.16Å; I1214-H1216 PolarHBondContact O-N 2.82Å; I1214-S1217 PolarHBondContact O-N 2.96Å; I1214-S1217 PolarHBondContact O-OG 3.43Å; I1214-M1218 HydrophobicContact CG2-CG 4.44Å; I1214-M1218 HydrophobicContact CG2-SD 4.12Å; I1214-M1218 WeakPolarHBondContact O-CG 3.32Å; I1214-M1218 PolarHBondContact O-N 2.88Å
1215	L	93.7	Very high	92.9	Very high	2 Å²	2	57 Å²	57	1%	0.01	30%	0.303	C	S	.	.	H	α-helix	trans	-56.1	-46.2	177.1	-69.9	173.8	0	0	0	112	A1114 V1147 T1190 I1206 F1211 I1212 S1217 M1218 V1219	A1114-L1215 HydrophobicContact CB-CD2 4.44Å; V1147-L1215 HydrophobicContact CG2-CD2 3.83Å; T1190-L1215 HydrophobicContact CG2-CD1 4.38Å; I1206-L1215 HydrophobicContact CD1-CD1 3.76Å; F1211-L1215 HydrophobicContact CD1-CD1 3.96Å; F1211-L1215 HydrophobicContact CD1-CG 4.04Å; F1211-L1215 HydrophobicContact CE1-CD1 3.81Å; F1211-L1215 HydrophobicContact CE1-CD2 3.86Å; F1211-L1215 HydrophobicContact CE1-CG 3.74Å; F1211-L1215 HydrophobicContact CZ-CD2 4.25Å; F1211-L1215 HydrophobicContact CZ-CG 4.45Å; F1211-L1215 WeakPolarHBondContact O-CG 3.46Å; F1211-L1215 PolarHBondContact O-N 2.89Å; I1212-L1215 PolarHBondContact O-N 3.42Å; L1215-S1217 VanDerWaalsContact C-N 3.34Å; L1215-S1217 PolarHBondContact O-N 3.38Å; L1215-M1218 PolarHBondContact O-N 2.61Å; L1215-V1219 WeakPolarHBondContact O-CG2 3.5Å; L1215-V1219 PolarHBondContact O-N 2.93Å
1216	H	94.2	Very high	93.3	Very high	40 Å²	40	53.1 Å²	53.1	19%	0.185	29%	0.289	C	S	.	.	H	α-helix	trans	-63.8	-36.2	175.8	-69.2	-56.5	0	0	0	113	Y1150 T1191 I1212 L1213 I1214 V1219 L1220	Y1150-H1216 PolarHBondContact OH-CE1 2.87Å; Y1150-H1216 VanDerWaalsContact OH-CE1 3.27Å; T1191-H1216 WeakPolarHBondContact CG2-NE2 3.46Å; I1212-H1216 PolarHBondContact O-CD2 3.16Å; I1212-H1216 PolarHBondContact O-N 3.26Å; L1213-H1216 PolarHBondContact O-N 2.97Å; I1214-H1216 PolarHBondContact O-N 2.82Å; H1216-V1219 PolarHBondContact O-N 2.83Å; H1216-L1220 PolarHBondContact O-N 2.81Å
1217	S	93.9	Very high	93.4	Very high	69 Å²	69	58.9 Å²	58.9	48%	0.483	31%	0.311	S	S	.	.	H	α-helix	trans	-68	-36.4	175.6	80.3	0	0	0	0	112.4	L1213 I1214 L1215 L1220 A1221	L1213-S1217 PolarHBondContact O-N 3.02Å; I1214-S1217 PolarHBondContact O-N 2.96Å; I1214-S1217 PolarHBondContact O-OG 3.43Å; L1215-S1217 VanDerWaalsContact C-N 3.34Å; L1215-S1217 PolarHBondContact O-N 3.38Å; S1217-L1220 PolarHBondContact O-N 2.93Å; S1217-A1221 WeakPolarHBondContact O-CB 3.32Å; S1217-A1221 PolarHBondContact O-N 2.93Å
1218	M	94.5	Very high	93.6	Very high	18 Å²	18	59.4 Å²	59.4	9%	0.089	31%	0.308	C	S	.	.	H	α-helix	trans	-64.3	-39.9	172.9	-67.6	177.5	65.7	0	0	112.1	I1110 T1113 A1114 L1117 I1214 L1215 A1221 N1222	I1110-M1218 HydrophobicContact CG2-CE 4.23Å; I1110-M1218 WeakPolarHBondContact O-CE 3.27Å; T1113-M1218 HydrophobicContact CG2-CE 3.7Å; A1114-M1218 HydrophobicContact CB-CE 3.87Å; L1117-M1218 HydrophobicContact CD1-SD 3.89Å; I1214-M1218 HydrophobicContact CG2-CG 4.44Å; I1214-M1218 HydrophobicContact CG2-SD 4.12Å; I1214-M1218 WeakPolarHBondContact O-CG 3.32Å; I1214-M1218 PolarHBondContact O-N 2.88Å; L1215-M1218 PolarHBondContact O-N 2.61Å; M1218-A1221 PolarHBondContact O-N 2.81Å; M1218-N1222 WeakPolarHBondContact O-CB 3.41Å; M1218-N1222 PolarHBondContact O-N 2.83Å
1219	V	94.4	Very high	93.6	Very high	14 Å²	14	60.4 Å²	60.4	9%	0.085	31%	0.313	C	S	.	.	H	α-helix	trans	-63.3	-42.7	174.5	168	0	0	0	0	111.4	Y1150 I1154 L1215 H1216 N1222 F1223	Y1150-V1219 HydrophobicContact CD1-CG1 3.74Å; Y1150-V1219 HydrophobicContact CD2-CB 4.43Å; Y1150-V1219 HydrophobicContact CD2-CG1 4.14Å; Y1150-V1219 HydrophobicContact CD2-CG2 3.46Å; Y1150-V1219 VanDerWaalsContact CD2-CG2 3.46Å; Y1150-V1219 HydrophobicContact CE1-CG1 4.4Å; Y1150-V1219 HydrophobicContact CE2-CG2 4.05Å; Y1150-V1219 HydrophobicContact CG-CB 4.33Å; Y1150-V1219 HydrophobicContact CG-CG1 3.58Å; Y1150-V1219 HydrophobicContact CG-CG2 3.75Å; I1154-V1219 HydrophobicContact CD1-CG1 4.35Å; L1215-V1219 WeakPolarHBondContact O-CG2 3.5Å; L1215-V1219 PolarHBondContact O-N 2.93Å; H1216-V1219 PolarHBondContact O-N 2.83Å; V1219-N1222 WeakPolarHBondContact O-CB 3.09Å; V1219-N1222 PolarHBondContact O-N 3.42Å; V1219-F1223 PolarHBondContact O-N 2.85Å
1220	L	94.8	Very high	93.5	Very high	112 Å²	112	55.5 Å²	55.5	59%	0.586	28%	0.283	S	S	*	.	H	α-helix	trans	-64.4	-43.6	175.8	-178.6	62.2	0	0	0	111.7	H1216 S1217 N1222 F1223 M1224	H1216-L1220 PolarHBondContact O-N 2.81Å; S1217-L1220 PolarHBondContact O-N 2.93Å; L1220-N1222 VanDerWaalsContact C-N 3.32Å; L1220-N1222 PolarHBondContact O-N 3.17Å; L1220-F1223 PolarHBondContact O-N 3.46Å; L1220-M1224 WeakPolarHBondContact O-CG 3.43Å; L1220-M1224 PolarHBondContact O-N 3.08Å; L1220-M1224 VanDerWaalsContact O-N 3.08Å
1221	A	95.3	Very high	93.2	Very high	54 Å²	54	48.4 Å²	48.4	45%	0.446	26%	0.264	S	S	.	.	H	α-helix	trans	-60.7	-41.7	175.3	0	0	0	0	0	111.9	S1217 M1218 M1224 A1225	S1217-A1221 WeakPolarHBondContact O-CB 3.32Å; S1217-A1221 PolarHBondContact O-N 2.93Å; M1218-A1221 PolarHBondContact O-N 2.81Å; A1221-M1224 PolarHBondContact O-N 2.88Å; A1221-A1225 WeakPolarHBondContact O-CB 3.48Å; A1221-A1225 PolarHBondContact O-N 3.47Å
1222	N	95.8	Very high	92.8	Very high	4 Å²	4	52.9 Å²	52.9	2%	0.021	29%	0.287	C	S	.	.	H	α-helix	trans	-59.8	-51.1	174.5	-173.5	20.5	0	0	0	111.6	I1106 I1110 Q1151 I1154 M1218 V1219 L1220 M1224 A1225 S1226	I1106-N1222 VanDerWaalsContact CG2-OD1 3.26Å; I1106-N1222 WeakPolarHBondContact CG2-OD1 3.32Å; I1110-N1222 HydrophobicContact CD1-CB 4.17Å; I1110-N1222 HydrophobicContact CG1-CB 4.04Å; I1110-N1222 HydrophobicContact CG2-CB 4.44Å; Q1151-N1222 WeakPolarHBondContact CG-ND2 3.46Å; I1154-N1222 HydrophobicContact CD1-CB 4.28Å; M1218-N1222 WeakPolarHBondContact O-CB 3.41Å; M1218-N1222 PolarHBondContact O-N 2.83Å; V1219-N1222 WeakPolarHBondContact O-CB 3.09Å; V1219-N1222 PolarHBondContact O-N 3.42Å; L1220-N1222 VanDerWaalsContact C-N 3.32Å; L1220-N1222 PolarHBondContact O-N 3.17Å; N1222-M1224 VanDerWaalsContact C-N 3.31Å; N1222-M1224 PolarHBondContact O-N 2.86Å; N1222-A1225 PolarHBondContact O-N 2.73Å; N1222-S1226 WeakPolarHBondContact O-CB 3.41Å; N1222-S1226 PolarHBondContact O-N 3.35Å; N1222-S1226 PolarHBondContact O-OG 2.9Å; N1222-S1226 PolarHBondContact OD1-OG 2.82Å
1223	F	95.6	Very high	92.3	Very high	70 Å²	70	52.4 Å²	52.4	31%	0.307	29%	0.285	S	S	.	.	H	α-helix	trans	-54.9	-45.6	177.7	173.9	-103.8	0	0	0	112.4	I1154 I1157 V1219 L1220 Y1227	I1154-F1223 HydrophobicContact CD1-CB 4Å; I1154-F1223 HydrophobicContact CG1-CB 4.17Å; I1154-F1223 HydrophobicContact CG1-CD2 4.19Å; I1154-F1223 HydrophobicContact CG2-CD2 4.32Å; I1157-F1223 HydrophobicContact CD1-CE2 4.48Å; I1157-F1223 HydrophobicContact CG2-CE2 4.16Å; V1219-F1223 PolarHBondContact O-N 2.85Å; L1220-F1223 PolarHBondContact O-N 3.46Å; F1223-Y1227 VanDerWaalsContact O-CB 3.3Å; F1223-Y1227 WeakPolarHBondContact O-CB 3.5Å; F1223-Y1227 PolarHBondContact O-N 2.81Å
1224	M	94.9	Very high	91.2	Very high	98 Å²	98	49.3 Å²	49.3	48%	0.483	27%	0.269	S	S	.	.	H	α-helix	trans	-64.6	-45.5	178.3	-67.1	-61.1	-69.6	0	0	112.1	L1220 A1221 N1222 Y1227 I1228	L1220-M1224 WeakPolarHBondContact O-CG 3.43Å; L1220-M1224 PolarHBondContact O-N 3.08Å; L1220-M1224 VanDerWaalsContact O-N 3.08Å; A1221-M1224 PolarHBondContact O-N 2.88Å; N1222-M1224 VanDerWaalsContact C-N 3.31Å; N1222-M1224 PolarHBondContact O-N 2.86Å; M1224-Y1227 PolarHBondContact O-N 2.94Å; M1224-I1228 WeakPolarHBondContact O-CB 3.46Å; M1224-I1228 WeakPolarHBondContact O-CD1 3.49Å; M1224-I1228 VanDerWaalsContact O-CG1 3.24Å; M1224-I1228 WeakPolarHBondContact O-CG1 3.47Å; M1224-I1228 PolarHBondContact O-N 3.15Å
1225	A	95	Very high	90.1	Very high	37 Å²	37	47.9 Å²	47.9	31%	0.306	27%	0.267	S	S	.	.	H	α-helix	trans	-62.2	-49.2	177.3	0	0	0	0	0	111.9	I1106 A1221 N1222 Y1227 I1228 V1229	I1106-A1225 HydrophobicContact CG2-CB 4.18Å; A1221-A1225 WeakPolarHBondContact O-CB 3.48Å; A1221-A1225 PolarHBondContact O-N 3.47Å; N1222-A1225 PolarHBondContact O-N 2.73Å; A1225-Y1227 VanDerWaalsContact C-N 3.35Å; A1225-Y1227 PolarHBondContact O-N 2.63Å; A1225-I1228 PolarHBondContact O-N 3.46Å; A1225-V1229 WeakPolarHBondContact O-CG2 3.43Å; A1225-V1229 PolarHBondContact O-N 3.18Å
1226	S	94.2	Very high	88.7	Confident	4 Å²	4	51.2 Å²	51.2	3%	0.028	29%	0.288	C	S	.	.	H	α-helix	trans	-55.7	-46.1	175.8	-76.4	0	0	0	0	112.4	Q1103 N1222 E1230	Q1103-S1226 PolarHBondContact NE2-O 3.05Å; Q1103-S1226 VanDerWaalsContact OE1-CA 3.3Å; Q1103-S1226 PolarHBondContact OE1-OG 2.97Å; N1222-S1226 WeakPolarHBondContact O-CB 3.41Å; N1222-S1226 PolarHBondContact O-N 3.35Å; N1222-S1226 PolarHBondContact O-OG 2.9Å; N1222-S1226 PolarHBondContact OD1-OG 2.82Å; S1226-E1230 VanDerWaalsContact O-CB 3.27Å; S1226-E1230 WeakPolarHBondContact O-CB 3.36Å; S1226-E1230 PolarHBondContact O-N 2.83Å
1227	Y	90.8	Very high	87.2	Confident	136 Å²	136	54 Å²	54	53%	0.533	31%	0.312	S	S	.	.	H	α-helix	trans	-66.2	-43.2	179.9	-174.7	-94.3	0	0	0	112.5	F1223 M1224 A1225 S1231	F1223-Y1227 VanDerWaalsContact O-CB 3.3Å; F1223-Y1227 WeakPolarHBondContact O-CB 3.5Å; F1223-Y1227 PolarHBondContact O-N 2.81Å; M1224-Y1227 PolarHBondContact O-N 2.94Å; A1225-Y1227 VanDerWaalsContact C-N 3.35Å; A1225-Y1227 PolarHBondContact O-N 2.63Å; Y1227-S1231 WeakPolarHBondContact O-CB 3.42Å; Y1227-S1231 PolarHBondContact O-N 2.84Å; Y1227-S1231 PolarHBondContact O-OG 3.14Å
1228	I	91	Very high	86	Confident	89 Å²	89	53.4 Å²	53.4	46%	0.456	30%	0.301	S	S	.	.	H	α-helix	trans	-64	-50.1	178.4	-70.1	165.9	0	0	0	110.6	M1224 A1225 E1230 S1231 I1232	M1224-I1228 WeakPolarHBondContact O-CB 3.46Å; M1224-I1228 WeakPolarHBondContact O-CD1 3.49Å; M1224-I1228 VanDerWaalsContact O-CG1 3.24Å; M1224-I1228 WeakPolarHBondContact O-CG1 3.47Å; M1224-I1228 PolarHBondContact O-N 3.15Å; A1225-I1228 PolarHBondContact O-N 3.46Å; I1228-E1230 PolarHBondContact O-N 3.05Å; I1228-S1231 PolarHBondContact O-N 3.36Å; I1228-I1232 HydrophobicContact CG2-CD1 3.8Å; I1228-I1232 WeakPolarHBondContact O-CG1 3.35Å; I1228-I1232 PolarHBondContact O-N 3.41Å
1229	V	91	Very high	84.7	Confident	47 Å²	47	55.8 Å²	55.8	29%	0.285	31%	0.309	S	S	.	.	H	α-helix	trans	-61.9	-46.8	-178.7	168.7	0	0	0	0	111.2	I1106 A1225 S1231 I1232 V1233	I1106-V1229 HydrophobicContact CD1-CB 4.2Å; I1106-V1229 HydrophobicContact CD1-CG1 4.47Å; I1106-V1229 HydrophobicContact CD1-CG2 3.98Å; A1225-V1229 WeakPolarHBondContact O-CG2 3.43Å; A1225-V1229 PolarHBondContact O-N 3.18Å; V1229-S1231 VanDerWaalsContact C-N 3.32Å; V1229-S1231 PolarHBondContact O-N 3.16Å; V1229-I1232 PolarHBondContact O-N 3.45Å; V1229-V1233 HydrophobicContact CG1-CG2 4.34Å; V1229-V1233 VanDerWaalsContact O-CG2 3.31Å; V1229-V1233 WeakPolarHBondContact O-CG2 3.33Å; V1229-V1233 PolarHBondContact O-N 2.91Å
1230	E	89.7	Confident	83.6	Confident	2 Å²	2	62.3 Å²	62.3	1%	0.009	33%	0.332	C	S	.	.	H	α-helix	trans	-65.1	-37.4	179	-164.2	55.9	-166.4	0	0	111.3	K1030 S1099 A1158 F1159 K1161 S1226 I1228 V1233 D1234	K1030-E1230 IonicContact NZ-OE1 2.67Å; K1030-E1230 PolarHBondContact NZ-OE1 3.18Å; S1099-E1230 WeakPolarHBondContact CB-OE2 3.35Å; S1099-E1230 PolarHBondContact OG-OE1 3.19Å; S1099-E1230 PolarHBondContact OG-OE2 3.45Å; A1158-E1230 HydrophobicContact CB-CG 4.39Å; A1158-E1230 WeakPolarHBondContact O-CG 3.48Å; F1159-E1230 WeakPolarHBondContact CD1-OE1 3.28Å; K1161-E1230 VanDerWaalsContact NZ-C 3.34Å; K1161-E1230 PolarHBondContact NZ-O 2.88Å; S1226-E1230 VanDerWaalsContact O-CB 3.27Å; S1226-E1230 WeakPolarHBondContact O-CB 3.36Å; S1226-E1230 PolarHBondContact O-N 2.83Å; I1228-E1230 PolarHBondContact O-N 3.05Å; E1230-V1233 PolarHBondContact O-N 3.08Å; E1230-D1234 PolarHBondContact O-N 3.42Å
1231	S	84.1	Confident	82.5	Confident	50 Å²	50	65 Å²	65	35%	0.35	33%	0.334	S	S	.	.	H	α-helix	trans	-64.3	-38.6	175.8	-64.7	0	0	0	0	112.6	Y1227 I1228 V1229 G1235	Y1227-S1231 WeakPolarHBondContact O-CB 3.42Å; Y1227-S1231 PolarHBondContact O-N 2.84Å; Y1227-S1231 PolarHBondContact O-OG 3.14Å; I1228-S1231 PolarHBondContact O-N 3.36Å; V1229-S1231 VanDerWaalsContact C-N 3.32Å; V1229-S1231 PolarHBondContact O-N 3.16Å; S1231-G1235 PolarHBondContact O-N 3.13Å
1232	I	85.5	Confident	81.4	Confident	94 Å²	94	64.2 Å²	64.2	48%	0.482	32%	0.322	S	S	.	.	H	α-helix	trans	-67.1	-49.7	174.3	-67.9	165.8	0	0	0	110.5	I1228 V1229 D1234 G1235 F1238	I1228-I1232 HydrophobicContact CG2-CD1 3.8Å; I1228-I1232 WeakPolarHBondContact O-CG1 3.35Å; I1228-I1232 PolarHBondContact O-N 3.41Å; V1229-I1232 PolarHBondContact O-N 3.45Å; I1232-D1234 PolarHBondContact O-N 3.34Å; I1232-G1235 PolarHBondContact O-N 3.25Å; I1232-F1238 HydrophobicContact CG2-CD2 4.02Å; I1232-F1238 HydrophobicContact CG2-CE2 4.41Å; I1232-F1238 WeakPolarHBondContact O-CB 3.32Å; I1232-F1238 WeakPolarHBondContact O-CG 3.27Å
1233	V	82.2	Confident	80.1	Confident	7 Å²	7	71.2 Å²	71.2	4%	0.042	35%	0.348	C	S	.	.	H	α-helix	trans	-65.6	-40.1	-170.7	172.2	0	0	0	0	113.2	V1095 I1098 V1229 E1230 G1235 F1238	V1095-V1233 HydrophobicContact CG1-CG1 3.88Å; I1098-V1233 HydrophobicContact CG2-CG1 4.24Å; I1098-V1233 HydrophobicContact CG2-CG2 3.91Å; V1229-V1233 HydrophobicContact CG1-CG2 4.34Å; V1229-V1233 VanDerWaalsContact O-CG2 3.31Å; V1229-V1233 WeakPolarHBondContact O-CG2 3.33Å; V1229-V1233 PolarHBondContact O-N 2.91Å; E1230-V1233 PolarHBondContact O-N 3.08Å; V1233-G1235 VanDerWaalsContact C-N 3.34Å; V1233-F1238 HydrophobicContact CB-CE1 4.34Å; V1233-F1238 HydrophobicContact CG1-CE1 4.19Å; V1233-F1238 HydrophobicContact CG2-CE1 4.29Å; V1233-F1238 HydrophobicContact CG2-CZ 4.45Å; V1233-F1238 WeakPolarHBondContact O-CD1 3.45Å
1234	D	70.6	Confident	78.9	Confident	35 Å²	35	76.6 Å²	76.6	19%	0.187	37%	0.366	C	S	.	.	H	α-helix	trans	-85.4	-6.9	173.1	-70.9	-42.8	0	0	0	113.6	K1161 E1230 I1232 V1236 R1239	K1161-D1234 HydrophobicContact CD-CB 4.5Å; K1161-D1234 WeakPolarHBondContact CD-OD2 3.43Å; K1161-D1234 VanDerWaalsContact NZ-CB 3.34Å; K1161-D1234 IonicContact NZ-OD2 3.94Å; K1161-D1234 PolarHBondContact NZ-OD2 3.46Å; E1230-D1234 PolarHBondContact O-N 3.42Å; I1232-D1234 PolarHBondContact O-N 3.34Å; D1234-V1236 PolarHBondContact O-N 3.04Å; D1234-R1239 PolarHBondContact O-NE 3.5Å; D1234-R1239 PolarHBondContact O-NH2 3Å
1235	G	70.5	Confident	78	Confident	23 Å²	23	76.1 Å²	76.1	24%	0.237	37%	0.365	C	S	.	.			trans	-51.5	132.6	179.2	0	0	0	0	0	111.3	S1231 I1232 V1233 S1237 F1238 R1239	S1231-G1235 PolarHBondContact O-N 3.13Å; I1232-G1235 PolarHBondContact O-N 3.25Å; V1233-G1235 VanDerWaalsContact C-N 3.34Å; G1235-S1237 PolarHBondContact O-N 3.21Å; G1235-S1237 VanDerWaalsContact O-N 3.17Å; G1235-F1238 WeakPolarHBondContact O-CB 3.35Å; G1235-F1238 PolarHBondContact O-N 3.38Å; G1235-R1239 PolarHBondContact O-N 2.85Å
1236	V	64.9	Low	76.7	Confident	72 Å²	72	80.6 Å²	80.6	44%	0.436	37%	0.374	S	S	.	.	H	α-helix	trans	-55.7	-38.3	-178.4	-178.1	0	0	0	0	110.5	D1234 R1239 R1240	D1234-V1236 PolarHBondContact O-N 3.04Å; V1236-R1239 PolarHBondContact O-N 3.13Å; V1236-R1240 WeakPolarHBondContact O-CB 3.3Å; V1236-R1240 VanDerWaalsContact O-CG 3.29Å; V1236-R1240 WeakPolarHBondContact O-CG 3.47Å; V1236-R1240 PolarHBondContact O-N 2.82Å
1237	S	61.8	Low	75.4	Confident	100 Å²	100	87.5 Å²	87.5	70%	0.699	40%	0.399	S	S	*	.	H	α-helix	trans	-58.1	-45	172.9	-53.2	0	0	0	0	113.1	G1235 R1240 R1241	G1235-S1237 PolarHBondContact O-N 3.21Å; G1235-S1237 VanDerWaalsContact O-N 3.17Å; S1237-R1240 PolarHBondContact O-N 2.92Å; S1237-R1241 WeakPolarHBondContact O-CB 3.48Å; S1237-R1241 PolarHBondContact O-N 2.87Å
1238	F	69.9	Low	74.6	Confident	56 Å²	56	84.8 Å²	84.8	25%	0.246	41%	0.405	C	S	.	.	H	α-helix	trans	-69.6	-44.6	179	-174.2	-97	0	0	0	111.6	I1232 V1233 G1235 R1240 R1241 I1242	I1232-F1238 HydrophobicContact CG2-CD2 4.02Å; I1232-F1238 HydrophobicContact CG2-CE2 4.41Å; I1232-F1238 WeakPolarHBondContact O-CB 3.32Å; I1232-F1238 WeakPolarHBondContact O-CG 3.27Å; V1233-F1238 HydrophobicContact CB-CE1 4.34Å; V1233-F1238 HydrophobicContact CG1-CE1 4.19Å; V1233-F1238 HydrophobicContact CG2-CE1 4.29Å; V1233-F1238 HydrophobicContact CG2-CZ 4.45Å; V1233-F1238 WeakPolarHBondContact O-CD1 3.45Å; G1235-F1238 WeakPolarHBondContact O-CB 3.35Å; G1235-F1238 PolarHBondContact O-N 3.38Å; F1238-R1240 VanDerWaalsContact C-N 3.31Å; F1238-R1240 PolarHBondContact O-N 2.93Å; F1238-R1241 CarbonylContact O-C 2.93Å; F1238-R1241 PolarHBondContact O-N 2.87Å; F1238-I1242 HydrophobicContact CD1-CD1 3.9Å; F1238-I1242 HydrophobicContact CD1-CG1 4.32Å; F1238-I1242 HydrophobicContact CE1-CD1 3.22Å; F1238-I1242 HydrophobicContact CE1-CG1 3.99Å; F1238-I1242 HydrophobicContact CZ-CD1 3.61Å; F1238-I1242 HydrophobicContact CZ-CG1 4.19Å; F1238-I1242 PolarHBondContact O-N 3.09Å
1239	R	67.9	Low	73.8	Confident	67 Å²	67	86.2 Å²	86.2	25%	0.253	41%	0.413	S	S	.	.	H	α-helix	trans	-58.8	-40.3	173.8	-74.3	-170.2	-90.1	-174.9	-8.5	112.1	V1095 D1234 G1235 V1236 R1243	V1095-R1239 HydrophobicContact CG1-CG 4.39Å; V1095-R1239 HydrophobicContact CG2-CG 4.23Å; D1234-R1239 PolarHBondContact O-NE 3.5Å; D1234-R1239 PolarHBondContact O-NH2 3Å; G1235-R1239 PolarHBondContact O-N 2.85Å; V1236-R1239 PolarHBondContact O-N 3.13Å; R1239-R1243 WeakPolarHBondContact O-CB 3.37Å; R1239-R1243 WeakPolarHBondContact O-CG 3.5Å; R1239-R1243 PolarHBondContact O-N 3.39Å
1240	R	69.2	Low	72.9	Confident	151 Å²	151	89.5 Å²	89.5	57%	0.57	42%	0.423	S	S	*	.	H	α-helix	trans	-66.9	-38	172.3	-72.3	176.5	-177.4	-174.5	1.9	112.5	V1236 S1237 F1238 R1243 R1244	V1236-R1240 WeakPolarHBondContact O-CB 3.3Å; V1236-R1240 VanDerWaalsContact O-CG 3.29Å; V1236-R1240 WeakPolarHBondContact O-CG 3.47Å; V1236-R1240 PolarHBondContact O-N 2.82Å; S1237-R1240 PolarHBondContact O-N 2.92Å; F1238-R1240 VanDerWaalsContact C-N 3.31Å; F1238-R1240 PolarHBondContact O-N 2.93Å; R1240-R1243 PolarHBondContact O-N 2.86Å; R1240-R1244 PolarHBondContact O-N 2.86Å
1241	R	72.5	Confident	71.4	Confident	170 Å²	170	94 Å²	94	64%	0.642	45%	0.453	S	S	*	.	H	α-helix	trans	-69.2	-45.4	177.8	-161.8	171.8	-173	163.8	1.1	111.9	S1237 F1238 R1243 R1244 I1245	S1237-R1241 WeakPolarHBondContact O-CB 3.48Å; S1237-R1241 PolarHBondContact O-N 2.87Å; F1238-R1241 CarbonylContact O-C 2.93Å; F1238-R1241 PolarHBondContact O-N 2.87Å; R1241-R1243 PolarHBondContact O-N 3.09Å; R1241-R1244 WeakPolarHBondContact O-CB 3.39Å; R1241-R1244 PolarHBondContact O-N 3.31Å; R1241-R1244 VanDerWaalsContact O-N 3.15Å; R1241-I1245 HydrophobicContact CG-CD1 4.09Å; R1241-I1245 WeakPolarHBondContact O-CG1 3.28Å; R1241-I1245 PolarHBondContact O-N 3.34Å
1242	I	72.2	Confident	69.8	Low	36 Å²	36	103.4 Å²	103.4	19%	0.185	48%	0.481	C	S	.	.	H	α-helix	trans	-59	-43.9	171	-82.3	-172.3	0	0	0	111.3	I1098 F1238 R1244 I1245 R1246	I1098-I1242 HydrophobicContact CD1-CD1 3.98Å; F1238-I1242 HydrophobicContact CD1-CD1 3.9Å; F1238-I1242 HydrophobicContact CD1-CG1 4.32Å; F1238-I1242 HydrophobicContact CE1-CD1 3.22Å; F1238-I1242 HydrophobicContact CE1-CG1 3.99Å; F1238-I1242 HydrophobicContact CZ-CD1 3.61Å; F1238-I1242 HydrophobicContact CZ-CG1 4.19Å; F1238-I1242 PolarHBondContact O-N 3.09Å; I1242-R1244 VanDerWaalsContact C-N 3.31Å; I1242-R1244 PolarHBondContact O-N 3.29Å; I1242-I1245 PolarHBondContact O-N 2.98Å; I1242-R1246 VanDerWaalsContact O-CB 3.28Å; I1242-R1246 WeakPolarHBondContact O-CB 3.42Å; I1242-R1246 PolarHBondContact O-N 2.8Å
1243	R	67.9	Low	68.2	Low	152 Å²	152	109 Å²	109	57%	0.574	50%	0.496	S	S	*	.	H	α-helix	trans	-60.1	-39.9	175.1	-79.5	-179.9	177.9	173.7	3	111.8	R1239 R1240 R1241 R1247	R1239-R1243 WeakPolarHBondContact O-CB 3.37Å; R1239-R1243 WeakPolarHBondContact O-CG 3.5Å; R1239-R1243 PolarHBondContact O-N 3.39Å; R1240-R1243 PolarHBondContact O-N 2.86Å; R1241-R1243 PolarHBondContact O-N 3.09Å; R1243-R1247 WeakPolarHBondContact O-CB 3.39Å; R1243-R1247 VanDerWaalsContact O-CG 3.26Å; R1243-R1247 WeakPolarHBondContact O-CG 3.35Å; R1243-R1247 PolarHBondContact O-N 2.98Å; R1243-R1247 VanDerWaalsContact O-N 3.1Å
1244	R	71.2	Confident	66.7	Low	183 Å²	183	111.2 Å²	111.2	69%	0.691	51%	0.509	S	S	*	.	H	α-helix	trans	-64	-52.1	173.1	-95.4	-170.3	-79.5	177.2	-6.9	112.2	R1240 R1241 I1242 R1246 R1247 A1248	R1240-R1244 PolarHBondContact O-N 2.86Å; R1241-R1244 WeakPolarHBondContact O-CB 3.39Å; R1241-R1244 PolarHBondContact O-N 3.31Å; R1241-R1244 VanDerWaalsContact O-N 3.15Å; I1242-R1244 VanDerWaalsContact C-N 3.31Å; I1242-R1244 PolarHBondContact O-N 3.29Å; R1244-R1246 VanDerWaalsContact C-N 3.32Å; R1244-R1246 PolarHBondContact O-N 2.75Å; R1244-R1247 PolarHBondContact O-N 3.34Å; R1244-R1247 VanDerWaalsContact O-N 3.15Å; R1244-A1248 PolarHBondContact O-N 3.26Å
1245	I	76	Confident	65.9	Low	87 Å²	87	117.7 Å²	117.7	45%	0.446	54%	0.539	S	S	.	.	H	α-helix	trans	-57.9	-44	179.5	-69.4	165.5	0	0	0	110.9	R1241 I1242 R1247 A1248 L1249	R1241-I1245 HydrophobicContact CG-CD1 4.09Å; R1241-I1245 WeakPolarHBondContact O-CG1 3.28Å; R1241-I1245 PolarHBondContact O-N 3.34Å; I1242-I1245 PolarHBondContact O-N 2.98Å; I1245-R1247 PolarHBondContact O-N 3.13Å; I1245-A1248 PolarHBondContact O-N 2.95Å; I1245-L1249 HydrophobicContact CG2-CD1 3.65Å; I1245-L1249 HydrophobicContact CG2-CG 4.39Å; I1245-L1249 WeakPolarHBondContact O-CB 3.43Å; I1245-L1249 PolarHBondContact O-N 3.37Å
1246	R	67.6	Low	65.4	Low	132 Å²	132	121.1 Å²	121.1	50%	0.498	54%	0.544	S	S	.	.	H	α-helix	trans	-66.1	-37.1	177.9	-167.1	-179.5	-172.3	175.4	5	112.9	I1242 R1244 A1248 F1250 V1254	I1242-R1246 VanDerWaalsContact O-CB 3.28Å; I1242-R1246 WeakPolarHBondContact O-CB 3.42Å; I1242-R1246 PolarHBondContact O-N 2.8Å; R1244-R1246 VanDerWaalsContact C-N 3.32Å; R1244-R1246 PolarHBondContact O-N 2.75Å; R1246-A1248 VanDerWaalsContact C-N 3.33Å; R1246-F1250 PolarHBondContact O-N 2.92Å; R1246-V1254 HydrophobicContact CG-CG2 3.98Å
1247	R	67	Low	65.9	Low	148 Å²	148	121.8 Å²	121.8	56%	0.558	54%	0.541	S	S	*	.	H	α-helix	trans	-65.4	-36.5	172.8	-76	175.1	-175.8	-170.5	1.3	111.7	R1243 R1244 I1245	R1243-R1247 WeakPolarHBondContact O-CB 3.39Å; R1243-R1247 VanDerWaalsContact O-CG 3.26Å; R1243-R1247 WeakPolarHBondContact O-CG 3.35Å; R1243-R1247 PolarHBondContact O-N 2.98Å; R1243-R1247 VanDerWaalsContact O-N 3.1Å; R1244-R1247 PolarHBondContact O-N 3.34Å; R1244-R1247 VanDerWaalsContact O-N 3.15Å; I1245-R1247 PolarHBondContact O-N 3.13Å
1248	A	73.6	Confident	66.7	Low	80 Å²	80	118.9 Å²	118.9	66%	0.661	52%	0.524	S	S	*	.	H	α-helix	trans	-73	-47.1	177.9	0	0	0	0	0	112.9	R1244 I1245 R1246	R1244-A1248 PolarHBondContact O-N 3.26Å; I1245-A1248 PolarHBondContact O-N 2.95Å; R1246-A1248 VanDerWaalsContact C-N 3.33Å
1249	L	74.2	Confident	67.4	Low	118 Å²	118	117.6 Å²	117.6	62%	0.618	52%	0.517	S	S	*	.	H	α-helix	trans	-75.3	-34.4	-178.2	-74.2	169.7	0	0	0	113.7	I1245 P1251	I1245-L1249 HydrophobicContact CG2-CD1 3.65Å; I1245-L1249 HydrophobicContact CG2-CG 4.39Å; I1245-L1249 WeakPolarHBondContact O-CB 3.43Å; I1245-L1249 PolarHBondContact O-N 3.37Å; L1249-P1251 VanDerWaalsContact C-CD 3.48Å
1250	F	71.8	Confident	68.2	Low	116 Å²	116	117.9 Å²	117.9	51%	0.509	52%	0.521	S	S	.	.			trans	-132.6	57	-172.6	-59	-71.1	0	0	0	113	R1246 R1252 R1253	R1246-F1250 PolarHBondContact O-N 2.92Å; F1250-R1252 PolarHBondContact O-N 2.81Å; F1250-R1252 VanDerWaalsContact O-N 3.17Å; F1250-R1253 HydrophobicContact CB-CB 4.41Å; F1250-R1253 PolarHBondContact O-N 3.33Å; F1250-R1253 VanDerWaalsContact O-N 3.08Å
1251	P	58.7	Low	68.9	Low	97 Å²	97	117.2 Å²	117.2	63%	0.63	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-56.9	-35.8	-175.9	22.1	-33.3	0	0	0	112.9	L1249 R1253	L1249-P1251 VanDerWaalsContact C-CD 3.48Å; P1251-R1253 PolarHBondContact O-N 2.77Å
1252	R	51.5	Low	69.3	Low	248 Å²	248	110.1 Å²	110.1	94%	0.936	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-77.6	-8.6	179.9	-70.5	-175.2	175.2	174.1	-1.5	115.7	F1250	F1250-R1252 PolarHBondContact O-N 2.81Å; F1250-R1252 VanDerWaalsContact O-N 3.17Å
1253	R	50.2	Low	69.8	Low	210 Å²	210	112.7 Å²	112.7	79%	0.792	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-117.7	-1.5	-174.8	-86.6	-172.9	177.6	178	0.6	115.5	F1250 P1251 E1255	F1250-R1253 HydrophobicContact CB-CB 4.41Å; F1250-R1253 PolarHBondContact O-N 3.33Å; F1250-R1253 VanDerWaalsContact O-N 3.08Å; P1251-R1253 PolarHBondContact O-N 2.77Å; R1253-E1255 PolarHBondContact O-N 3.32Å
1254	V	51.9	Low	70.3	Confident	54 Å²	54	108.4 Å²	108.4	33%	0.327	49%	0.487	S	S	.	.			trans	-88.5	81.6	172.1	-174.1	0	0	0	0	108.6	R1246 R1256	R1246-V1254 HydrophobicContact CG-CG2 3.98Å; V1254-R1256 PolarHBondContact O-N 3.46Å
1255	E	52.6	Low	70.8	Confident	172 Å²	172	103.9 Å²	103.9	80%	0.804	47%	0.474	S	S	*	.			trans	-56.7	104.8	169.8	-75.1	-174.2	127.2	0	0	109.8	R1253	R1253-E1255 PolarHBondContact O-N 3.32Å
1256	R	61.7	Low	70.9	Confident	94 Å²	94	99.8 Å²	99.8	36%	0.355	45%	0.453	S	S	.	.			trans	-65.3	139.5	162.8	-66.4	178.8	176.8	-175.9	-13	108.2	V1254 R1261 E1264	V1254-R1256 PolarHBondContact O-N 3.46Å; R1256-R1261 PolarHBondContact O-NH2 3.44Å; R1256-E1264 IonicContact CZ-OE1 2.67Å; R1256-E1264 IonicContact CZ-OE2 3.82Å; R1256-E1264 IonicContact NE-OE1 2.72Å; R1256-E1264 IonicContact NH1-OE1 3.67Å; R1256-E1264 PolarHBondContact NH1-OE1 3.25Å; R1256-E1264 IonicContact NH1-OE2 2.71Å; R1256-E1264 PolarHBondContact NH1-OE2 2.94Å; R1256-E1264 IonicContact NH2-OE1 3.84Å; R1256-E1264 IonicContact NH2-OE2 2.65Å
1257	K	74.1	Confident	71.3	Confident	87 Å²	87	97.4 Å²	97.4	38%	0.378	45%	0.45	S	S	.	.			trans	-58	146.4	177.8	-54	-176.8	-168.3	174.2	0	109.2	Y1259 E1260 R1261	K1257-Y1259 VanDerWaalsContact C-N 3.34Å; K1257-Y1259 HydrophobicContact CB-CD1 4.04Å; K1257-Y1259 HydrophobicContact CB-CE1 3.87Å; K1257-Y1259 HydrophobicContact CD-CD1 4.29Å; K1257-Y1259 HydrophobicContact CD-CE1 3.34Å; K1257-Y1259 WeakPolarHBondContact CD-OH 3.46Å; K1257-Y1259 HydrophobicContact CG-CE1 4.31Å; K1257-Y1259 PolarHBondContact NZ-OH 3.37Å; K1257-Y1259 PolarHBondContact O-N 3.06Å; K1257-E1260 HydrophobicContact CB-CG 4.09Å; K1257-E1260 PolarHBondContact O-N 3.37Å; K1257-E1260 VanDerWaalsContact O-N 3.08Å; K1257-R1261 PolarHBondContact O-N 2.94Å; K1257-R1261 VanDerWaalsContact O-N 3.1Å
1258	A	79.9	Confident	71.7	Confident	39 Å²	39	99.1 Å²	99.1	32%	0.322	46%	0.457	S	S	.	.	H	α-helix	trans	-60	-44.2	-172.7	0	0	0	0	0	111.5	V964 E1260 R1261 I1262	V964-A1258 WeakPolarHBondContact O-CB 3.22Å; A1258-E1260 VanDerWaalsContact C-N 3.32Å; A1258-E1260 PolarHBondContact O-N 2.97Å; A1258-R1261 WeakPolarHBondContact O-CB 3.26Å; A1258-R1261 PolarHBondContact O-N 3.07Å; A1258-R1261 VanDerWaalsContact O-N 3.13Å; A1258-I1262 HydrophobicContact CB-CD1 4.46Å; A1258-I1262 WeakPolarHBondContact O-CD1 3.43Å; A1258-I1262 VanDerWaalsContact O-CG1 3.25Å; A1258-I1262 WeakPolarHBondContact O-CG1 3.48Å; A1258-I1262 PolarHBondContact O-N 3.14Å
1259	Y	84.3	Confident	71.6	Confident	28 Å²	28	96.8 Å²	96.8	11%	0.11	44%	0.436	C	S	.	.	H	α-helix	trans	-59.3	-35.2	175.2	77.5	-102.7	0	0	0	114.3	N466 V964 G965 Y966 K1257 R1263	N466-Y1259 PolarHBondContact ND2-OH 3.01Å; N466-Y1259 VanDerWaalsContact ND2-OH 3.13Å; V964-Y1259 PolarHBondContact O-N 3.45Å; G965-Y1259 WeakPolarHBondContact O-CE1 3.42Å; Y966-Y1259 HydrophobicContact CD1-CD1 4.04Å; Y966-Y1259 HydrophobicContact CD1-CD2 4.48Å; Y966-Y1259 HydrophobicContact CD1-CE1 4.15Å; Y966-Y1259 HydrophobicContact CD1-CG 4.23Å; Y966-Y1259 HydrophobicContact CD2-CD1 4.35Å; Y966-Y1259 HydrophobicContact CD2-CG 4.31Å; Y966-Y1259 HydrophobicContact CE1-CD1 4.02Å; Y966-Y1259 AromaticContact CE1-CD2 3.67Å; Y966-Y1259 HydrophobicContact CE1-CD2 3.67Å; Y966-Y1259 HydrophobicContact CE1-CE1 4.23Å; Y966-Y1259 AromaticContact CE1-CE2 3.94Å; Y966-Y1259 HydrophobicContact CE1-CE2 3.94Å; Y966-Y1259 AromaticContact CE1-CG 3.75Å; Y966-Y1259 HydrophobicContact CE1-CG 3.75Å; Y966-Y1259 VanDerWaalsContact CE2-CB 3.48Å; Y966-Y1259 HydrophobicContact CE2-CD1 4.34Å; Y966-Y1259 HydrophobicContact CE2-CD2 4.36Å; Y966-Y1259 AromaticContact CE2-CG 3.85Å; Y966-Y1259 HydrophobicContact CE2-CG 3.85Å; Y966-Y1259 HydrophobicContact CG-CD1 4.19Å; Y966-Y1259 HydrophobicContact CG-CG 4.47Å; Y966-Y1259 AromaticContact CZ-CD2 3.59Å; Y966-Y1259 AromaticContact CZ-CG 3.53Å; K1257-Y1259 VanDerWaalsContact C-N 3.34Å; K1257-Y1259 HydrophobicContact CB-CD1 4.04Å; K1257-Y1259 HydrophobicContact CB-CE1 3.87Å; K1257-Y1259 HydrophobicContact CD-CD1 4.29Å; K1257-Y1259 HydrophobicContact CD-CE1 3.34Å; K1257-Y1259 WeakPolarHBondContact CD-OH 3.46Å; K1257-Y1259 HydrophobicContact CG-CE1 4.31Å; K1257-Y1259 PolarHBondContact NZ-OH 3.37Å; K1257-Y1259 PolarHBondContact O-N 3.06Å; Y1259-R1263 VanDerWaalsContact O-CB 3.31Å; Y1259-R1263 WeakPolarHBondContact O-CB 3.31Å; Y1259-R1263 PolarHBondContact O-N 3.42Å
1260	E	84.1	Confident	71	Confident	74 Å²	74	92.9 Å²	92.9	35%	0.346	42%	0.42	S	S	.	.	H	α-helix	trans	-69	-39	177.1	-63.9	172.7	177.2	0	0	110.6	K1257 A1258 E1264	K1257-E1260 HydrophobicContact CB-CG 4.09Å; K1257-E1260 PolarHBondContact O-N 3.37Å; K1257-E1260 VanDerWaalsContact O-N 3.08Å; A1258-E1260 VanDerWaalsContact C-N 3.32Å; A1258-E1260 PolarHBondContact O-N 2.97Å; E1260-E1264 PolarHBondContact O-N 3.15Å
1261	R	82.9	Confident	70.5	Confident	137 Å²	137	91 Å²	91	52%	0.517	43%	0.434	S	S	.	.	H	α-helix	trans	-67.2	-44.7	176.2	-169.3	-169.2	-48.4	175	7.2	111.5	R1256 K1257 A1258 E1264 E1265	R1256-R1261 PolarHBondContact O-NH2 3.44Å; K1257-R1261 PolarHBondContact O-N 2.94Å; K1257-R1261 VanDerWaalsContact O-N 3.1Å; A1258-R1261 WeakPolarHBondContact O-CB 3.26Å; A1258-R1261 PolarHBondContact O-N 3.07Å; A1258-R1261 VanDerWaalsContact O-N 3.13Å; R1261-E1264 PolarHBondContact O-N 3.44Å; R1261-E1265 WeakPolarHBondContact O-CB 3.4Å; R1261-E1265 PolarHBondContact O-N 3.38Å
1262	I	82.3	Confident	70.8	Confident	20 Å²	20	92 Å²	92	10%	0.103	44%	0.438	C	S	.	.	H	α-helix	trans	-65	-42.7	178	-66.8	160.2	0	0	0	110.2	P937 K938 V941 V964 A1258 E1265 I1266	P937-I1262 HydrophobicContact CB-CD1 3.68Å; K938-I1262 HydrophobicContact CB-CG2 4.5Å; K938-I1262 HydrophobicContact CG-CG2 4.04Å; V941-I1262 HydrophobicContact CB-CG2 4.05Å; V941-I1262 HydrophobicContact CG1-CG2 4.18Å; V941-I1262 HydrophobicContact CG2-CB 4.22Å; V941-I1262 HydrophobicContact CG2-CD1 4.37Å; V941-I1262 HydrophobicContact CG2-CG2 3.92Å; V964-I1262 HydrophobicContact CB-CD1 4.32Å; V964-I1262 HydrophobicContact CG1-CD1 3.91Å; A1258-I1262 HydrophobicContact CB-CD1 4.46Å; A1258-I1262 WeakPolarHBondContact O-CD1 3.43Å; A1258-I1262 VanDerWaalsContact O-CG1 3.25Å; A1258-I1262 WeakPolarHBondContact O-CG1 3.48Å; A1258-I1262 PolarHBondContact O-N 3.14Å; I1262-E1265 WeakPolarHBondContact O-CB 3.25Å; I1262-E1265 PolarHBondContact O-N 2.89Å; I1262-I1266 HydrophobicContact CG2-CD1 3.84Å; I1262-I1266 HydrophobicContact CG2-CG1 4.48Å; I1262-I1266 WeakPolarHBondContact O-CB 3.34Å; I1262-I1266 VanDerWaalsContact O-CG1 3.26Å; I1262-I1266 WeakPolarHBondContact O-CG1 3.48Å; I1262-I1266 PolarHBondContact O-N 2.86Å
1263	R	82.5	Confident	71.5	Confident	91 Å²	91	81.6 Å²	81.6	34%	0.343	40%	0.399	S	S	.	.	H	α-helix	trans	-62.4	-46.6	174.8	-171.4	169.1	179.4	145.1	4.6	111.5	D915 V941 Y1259 E1265 I1266 D1267	D915-R1263 IonicContact OD2-CZ 3.2Å; D915-R1263 IonicContact OD2-NH2 2.69Å; D915-R1263 PolarHBondContact OD2-NH2 3.28Å; V941-R1263 HydrophobicContact CG1-CB 4.04Å; Y1259-R1263 VanDerWaalsContact O-CB 3.31Å; Y1259-R1263 WeakPolarHBondContact O-CB 3.31Å; Y1259-R1263 PolarHBondContact O-N 3.42Å; R1263-E1265 VanDerWaalsContact C-N 3.29Å; R1263-E1265 PolarHBondContact O-N 2.96Å; R1263-I1266 WeakPolarHBondContact O-CB 3.42Å; R1263-I1266 PolarHBondContact O-N 3.33Å; R1263-D1267 WeakPolarHBondContact O-CB 3.42Å; R1263-D1267 PolarHBondContact O-N 2.65Å
1264	E	79	Confident	72.3	Confident	61 Å²	61	72.3 Å²	72.3	29%	0.285	37%	0.365	S	S	.	.	H	α-helix	trans	-61.7	-33.2	173	-82	-169.7	-135.4	0	0	113.4	R1256 E1260 R1261 R1268	R1256-E1264 IonicContact CZ-OE1 2.67Å; R1256-E1264 IonicContact CZ-OE2 3.82Å; R1256-E1264 IonicContact NE-OE1 2.72Å; R1256-E1264 IonicContact NH1-OE1 3.67Å; R1256-E1264 PolarHBondContact NH1-OE1 3.25Å; R1256-E1264 IonicContact NH1-OE2 2.71Å; R1256-E1264 PolarHBondContact NH1-OE2 2.94Å; R1256-E1264 IonicContact NH2-OE1 3.84Å; R1256-E1264 IonicContact NH2-OE2 2.65Å; E1260-E1264 PolarHBondContact O-N 3.15Å; R1261-E1264 PolarHBondContact O-N 3.44Å; E1264-R1268 VanDerWaalsContact O-CB 3.31Å; E1264-R1268 WeakPolarHBondContact O-CB 3.42Å; E1264-R1268 WeakPolarHBondContact O-CG 3.33Å; E1264-R1268 PolarHBondContact O-N 3.17Å; E1264-R1268 IonicContact OE2-CZ 2.59Å; E1264-R1268 IonicContact OE2-NE 3.73Å; E1264-R1268 IonicContact OE2-NH2 2.62Å; E1264-R1268 PolarHBondContact OE2-NH2 2.86Å
1265	E	81.7	Confident	73	Confident	89 Å²	89	71.2 Å²	71.2	42%	0.416	36%	0.359	S	S	.	.	H	α-helix	trans	-67.6	-43.1	175.6	-171.1	-169.1	141.1	0	0	111.2	K938 R1261 I1262 R1263 R1268 S1269	K938-E1265 WeakPolarHBondContact CE-OE1 3.44Å; K938-E1265 IonicContact NZ-OE1 3.46Å; K938-E1265 PolarHBondContact NZ-OE1 2.99Å; R1261-E1265 WeakPolarHBondContact O-CB 3.4Å; R1261-E1265 PolarHBondContact O-N 3.38Å; I1262-E1265 WeakPolarHBondContact O-CB 3.25Å; I1262-E1265 PolarHBondContact O-N 2.89Å; R1263-E1265 VanDerWaalsContact C-N 3.29Å; R1263-E1265 PolarHBondContact O-N 2.96Å; E1265-R1268 PolarHBondContact O-N 3.34Å; E1265-S1269 WeakPolarHBondContact O-CB 3.39Å; E1265-S1269 PolarHBondContact O-N 3.14Å; E1265-S1269 PolarHBondContact O-OG 3.27Å
1266	I	78.3	Confident	73.5	Confident	0 Å²	0	67 Å²	67	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-60.9	-49.8	173	-70.2	167.1	0	0	0	110.3	F916 K938 V941 K942 I1262 R1263 R1268 S1269 A1270 W1273	F916-I1266 HydrophobicContact CE1-CG2 4.23Å; F916-I1266 HydrophobicContact CZ-CG2 3.81Å; K938-I1266 HydrophobicContact CB-CD1 4.31Å; V941-I1266 HydrophobicContact CG1-CD1 4.38Å; K942-I1266 HydrophobicContact CG-CD1 3.98Å; K942-I1266 HydrophobicContact CG-CG2 4.4Å; I1262-I1266 HydrophobicContact CG2-CD1 3.84Å; I1262-I1266 HydrophobicContact CG2-CG1 4.48Å; I1262-I1266 WeakPolarHBondContact O-CB 3.34Å; I1262-I1266 VanDerWaalsContact O-CG1 3.26Å; I1262-I1266 WeakPolarHBondContact O-CG1 3.48Å; I1262-I1266 PolarHBondContact O-N 2.86Å; R1263-I1266 WeakPolarHBondContact O-CB 3.42Å; R1263-I1266 PolarHBondContact O-N 3.33Å; I1266-R1268 VanDerWaalsContact C-N 3.27Å; I1266-R1268 PolarHBondContact O-N 2.96Å; I1266-S1269 WeakPolarHBondContact CA-OG 3.29Å; I1266-S1269 CarbonylContact O-C 3.6Å; I1266-S1269 PolarHBondContact O-N 2.99Å; I1266-S1269 VanDerWaalsContact O-N 3.13Å; I1266-S1269 PolarHBondContact O-OG 3.3Å; I1266-A1270 PolarHBondContact O-N 3.39Å; I1266-W1273 HydrophobicContact CB-CE3 4.2Å; I1266-W1273 HydrophobicContact CB-CZ3 4.15Å; I1266-W1273 HydrophobicContact CD1-CE3 4.34Å; I1266-W1273 HydrophobicContact CD1-CH2 3.96Å; I1266-W1273 HydrophobicContact CD1-CZ3 3.6Å; I1266-W1273 HydrophobicContact CG1-CE3 3.73Å; I1266-W1273 HydrophobicContact CG1-CH2 4.21Å; I1266-W1273 HydrophobicContact CG1-CZ3 3.51Å; I1266-W1273 HydrophobicContact CG2-CE3 3.73Å; I1266-W1273 HydrophobicContact CG2-CZ3 3.61Å
1267	D	74.9	Confident	73.3	Confident	83 Å²	83	66.7 Å²	66.7	44%	0.444	35%	0.347	S	S	.	.	H	α-helix	trans	-66.2	-29.6	-178.2	-59	-22.5	0	0	0	111.7	K942 R1263 A1270	K942-D1267 IonicContact NZ-OD1 2.72Å; R1263-D1267 WeakPolarHBondContact O-CB 3.42Å; R1263-D1267 PolarHBondContact O-N 2.65Å; D1267-A1270 VanDerWaalsContact O-CB 3.29Å; D1267-A1270 WeakPolarHBondContact O-CB 3.37Å
1268	R	74.5	Confident	72	Confident	184 Å²	184	73.7 Å²	73.7	69%	0.694	37%	0.371	S	S	*	.	H	α-helix	trans	-78.5	-29.7	172.2	-73.5	175.2	-155.2	-169.3	8.6	114.2	E1264 E1265 I1266 A1270	E1264-R1268 VanDerWaalsContact O-CB 3.31Å; E1264-R1268 WeakPolarHBondContact O-CB 3.42Å; E1264-R1268 WeakPolarHBondContact O-CG 3.33Å; E1264-R1268 PolarHBondContact O-N 3.17Å; E1264-R1268 IonicContact OE2-CZ 2.59Å; E1264-R1268 IonicContact OE2-NE 3.73Å; E1264-R1268 IonicContact OE2-NH2 2.62Å; E1264-R1268 PolarHBondContact OE2-NH2 2.86Å; E1265-R1268 PolarHBondContact O-N 3.34Å; I1266-R1268 VanDerWaalsContact C-N 3.27Å; I1266-R1268 PolarHBondContact O-N 2.96Å; R1268-A1270 VanDerWaalsContact C-N 3.26Å
1269	S	71.6	Confident	70.4	Confident	31 Å²	31	74.7 Å²	74.7	22%	0.217	38%	0.375	C	S	.	.	S	Bend	trans	-88.1	8.7	174.7	52.5	0	0	0	0	112.7	E1265 I1266 G1271 V1272 W1273	E1265-S1269 WeakPolarHBondContact O-CB 3.39Å; E1265-S1269 PolarHBondContact O-N 3.14Å; E1265-S1269 PolarHBondContact O-OG 3.27Å; I1266-S1269 WeakPolarHBondContact CA-OG 3.29Å; I1266-S1269 CarbonylContact O-C 3.6Å; I1266-S1269 PolarHBondContact O-N 2.99Å; I1266-S1269 VanDerWaalsContact O-N 3.13Å; I1266-S1269 PolarHBondContact O-OG 3.3Å; S1269-G1271 PolarHBondContact O-N 2.79Å; S1269-V1272 PolarHBondContact O-N 2.9Å; S1269-W1273 PolarHBondContact O-N 2.97Å
1270	A	63.1	Low	68.6	Low	36 Å²	36	74.5 Å²	74.5	30%	0.298	38%	0.38	S	S	.	.	B	Isolated β-bridge	trans	-62.2	104	-177.9	0	0	0	0	0	112.1	R913 I1266 D1267 R1268	R913-A1270 VanDerWaalsContact NH1-CB 3.34Å; R913-A1270 PolarHBondContact NH1-O 2.67Å; I1266-A1270 PolarHBondContact O-N 3.39Å; D1267-A1270 VanDerWaalsContact O-CB 3.29Å; D1267-A1270 WeakPolarHBondContact O-CB 3.37Å; R1268-A1270 VanDerWaalsContact C-N 3.26Å
1271	G	60.7	Low	67	Low	77 Å²	77	73.2 Å²	73.2	79%	0.794	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	126.3	-20.6	-171.3	0	0	0	0	0	113.1	S1269	S1269-G1271 PolarHBondContact O-N 2.79Å
1272	V	64.8	Low	65.6	Low	118 Å²	118	67.1 Å²	67.1	72%	0.715	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.8	-36.6	170.8	-177.2	0	0	0	0	110.6	S1269	S1269-V1272 PolarHBondContact O-N 2.9Å
1273	W	66.1	Low	64.2	Low	29 Å²	29	71.1 Å²	71.1	11%	0.11	38%	0.375	C	S	.	.	B	Isolated β-bridge	trans	-124.4	137.8	176.1	-164.7	88.3	0	0	0	111.7	F794 F916 L918 K938 I1266 S1269	F794-W1273 HydrophobicContact CE1-CZ2 4.27Å; F794-W1273 HydrophobicContact CZ-CZ2 4.35Å; F916-W1273 HydrophobicContact CE2-CZ3 4.08Å; F916-W1273 HydrophobicContact CZ-CE3 4.21Å; F916-W1273 AromaticContact CZ-CZ3 3.84Å; F916-W1273 HydrophobicContact CZ-CZ3 3.84Å; L918-W1273 HydrophobicContact CD1-CH2 4.04Å; K938-W1273 HydrophobicContact CB-CH2 3.91Å; K938-W1273 HydrophobicContact CB-CZ2 3.71Å; K938-W1273 HydrophobicContact CD-CZ2 4.21Å; I1266-W1273 HydrophobicContact CB-CE3 4.2Å; I1266-W1273 HydrophobicContact CB-CZ3 4.15Å; I1266-W1273 HydrophobicContact CD1-CE3 4.34Å; I1266-W1273 HydrophobicContact CD1-CH2 3.96Å; I1266-W1273 HydrophobicContact CD1-CZ3 3.6Å; I1266-W1273 HydrophobicContact CG1-CE3 3.73Å; I1266-W1273 HydrophobicContact CG1-CH2 4.21Å; I1266-W1273 HydrophobicContact CG1-CZ3 3.51Å; I1266-W1273 HydrophobicContact CG2-CE3 3.73Å; I1266-W1273 HydrophobicContact CG2-CZ3 3.61Å; S1269-W1273 PolarHBondContact O-N 2.97Å
1274	P	67.7	Low	62.6	Low	14 Å²	14	69.8 Å²	69.8	9%	0.091	38%	0.383	C	S	.	.	S	Bend	cis	-62.4	145	-11.8	27.5	-34.8	0	0	0	111.2	F794 F916 L1276	F794-P1274 HydrophobicContact CB-CB 3.9Å; F794-P1274 HydrophobicContact CD1-CB 3.49Å; F794-P1274 VanDerWaalsContact CD1-CB 3.49Å; F794-P1274 HydrophobicContact CD2-CB 4.26Å; F794-P1274 HydrophobicContact CE1-CB 4.04Å; F794-P1274 HydrophobicContact CG-CB 3.62Å; F916-P1274 HydrophobicContact CD2-CG 4.41Å; F916-P1274 HydrophobicContact CE2-CG 3.94Å; F916-P1274 VanDerWaalsContact CZ-CD 3.47Å; F916-P1274 HydrophobicContact CZ-CG 4.26Å; P1274-L1276 VanDerWaalsContact C-N 3.3Å; P1274-L1276 HydrophobicContact CB-CD2 4.38Å; P1274-L1276 HydrophobicContact CG-CD2 3.85Å; P1274-L1276 HydrophobicContact CG-CG 4.2Å; P1274-L1276 PolarHBondContact O-N 3.31Å
1275	P	65.9	Low	61.6	Low	32 Å²	32	67.4 Å²	67.4	21%	0.208	37%	0.372	C	S	.	.			trans	-71.5	89.3	172.8	28.9	-33.2	0	0	0	108.8	F794 L1277	F794-P1275 HydrophobicContact CD2-CG 3.79Å; F794-P1275 HydrophobicContact CE2-CG 4.09Å; P1275-L1277 PolarHBondContact O-N 3.27Å
1276	L	62.6	Low	60.4	Low	83 Å²	83	65 Å²	65	44%	0.435	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	121.3	-176.5	-65.1	174.6	0	0	0	110.6	V730 F794 P1274	V730-L1276 HydrophobicContact CG1-CD2 3.91Å; V730-L1276 HydrophobicContact CG2-CD2 3.85Å; F794-L1276 HydrophobicContact CB-CD2 4.33Å; P1274-L1276 VanDerWaalsContact C-N 3.3Å; P1274-L1276 HydrophobicContact CB-CD2 4.38Å; P1274-L1276 HydrophobicContact CG-CD2 3.85Å; P1274-L1276 HydrophobicContact CG-CG 4.2Å; P1274-L1276 PolarHBondContact O-N 3.31Å
1277	L	58.1	Low	59.2	Low	87 Å²	87	72.1 Å²	72.1	46%	0.455	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	135.6	158.4	-82.8	102.4	0	0	0	108.9	Q793 F794 P1275 S1279	Q793-L1277 HydrophobicContact CB-CD1 3.92Å; Q793-L1277 HydrophobicContact CG-CD1 4.09Å; F794-L1277 PolarHBondContact O-N 3Å; P1275-L1277 PolarHBondContact O-N 3.27Å; L1277-S1279 PolarHBondContact O-N 3.5Å
1278	R	46.9	Very low	58.2	Low	234 Å²	234	71.8 Å²	71.8	88%	0.883	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-78.1	117.6	-168.1	-156.2	177.9	-167	171.6	3	110.7
1279	S	46.2	Very low	57.2	Low	60 Å²	60	64 Å²	64	42%	0.42	36%	0.361	S	S	.	.			trans	44.1	71.2	161.1	59.3	0	0	0	0	115.3	E798 L1277	E798-S1279 VanDerWaalsContact OE2-CB 3.27Å; E798-S1279 WeakPolarHBondContact OE2-CB 3.38Å; L1277-S1279 PolarHBondContact O-N 3.5Å
1280	A	46.2	Very low	56.5	Low	24 Å²	24	64 Å²	64	20%	0.198	36%	0.358	C	S	.	.			trans	-82.2	129.4	153.6	0	0	0	0	0	107.8	A1284	A1280-A1284 HydrophobicContact CB-CB 3.96Å
1281	S	51.3	Low	55.7	Low	47 Å²	47	63.3 Å²	63.3	33%	0.329	35%	0.35	S	S	.	.			trans	-59.8	161.3	163.3	59.2	0	0	0	0	109.5	D799 Q1283 A1284 L1285	D799-S1281 WeakPolarHBondContact OD2-CA 3.2Å; D799-S1281 WeakPolarHBondContact OD2-CB 3.27Å; S1281-Q1283 PolarHBondContact O-N 3.23Å; S1281-A1284 PolarHBondContact O-N 2.84Å; S1281-A1284 PolarHBondContact OG-N 3.16Å; S1281-L1285 PolarHBondContact O-N 3.49Å
1282	L	53.5	Low	54.7	Low	9 Å²	9	63 Å²	63	5%	0.047	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-55.7	-29.6	176.9	-118.5	160.8	0	0	0	111.8	L636 L711 D799 L800 A1284 L1285 F1290	L636-L1282 HydrophobicContact CD1-CB 3.94Å; L636-L1282 HydrophobicContact CD1-CD1 4.18Å; L636-L1282 HydrophobicContact CD1-CD2 4.2Å; L636-L1282 HydrophobicContact CD1-CG 4.33Å; L636-L1282 HydrophobicContact CD2-CB 4.06Å; L711-L1282 HydrophobicContact CD1-CD2 4.27Å; L711-L1282 HydrophobicContact CD2-CD2 3.97Å; D799-L1282 HydrophobicContact CB-CB 3.87Å; D799-L1282 HydrophobicContact CB-CD1 3.9Å; D799-L1282 HydrophobicContact CB-CG 4.23Å; D799-L1282 PolarHBondContact OD2-N 3.38Å; L800-L1282 HydrophobicContact CD1-CD1 3.87Å; L800-L1282 HydrophobicContact CG-CD1 4.17Å; L1282-A1284 VanDerWaalsContact C-N 3.35Å; L1282-L1285 HydrophobicContact CD2-CD1 3.94Å; L1282-L1285 HydrophobicContact CG-CD1 4.41Å; L1282-F1290 HydrophobicContact CD2-CZ 3.99Å
1283	Q	52	Low	53.4	Low	104 Å²	104	63.9 Å²	63.9	49%	0.486	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-74.9	-18.2	177	-56.2	177.7	-23.2	0	0	114	L636 S1281	L636-Q1283 HydrophobicContact CD2-CG 4.02Å; S1281-Q1283 PolarHBondContact O-N 3.23Å
1284	A	49.9	Very low	51.9	Low	63 Å²	63	69 Å²	69	52%	0.521	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-97.5	-0.4	178.6	0	0	0	0	0	113.2	A1280 S1281 L1282	A1280-A1284 HydrophobicContact CB-CB 3.96Å; S1281-A1284 PolarHBondContact O-N 2.84Å; S1281-A1284 PolarHBondContact OG-N 3.16Å; L1282-A1284 VanDerWaalsContact C-N 3.35Å
1285	L	57.9	Low	50.2	Low	11 Å²	11	75.3 Å²	75.3	6%	0.058	39%	0.388	C	S	.	.	S	Bend	trans	-71.4	141.9	168.8	-72.3	171.5	0	0	0	110.6	I731 H795 S1281 L1282 R1287 L1289 F1290	I731-L1285 HydrophobicContact CD1-CD1 4.02Å; H795-L1285 HydrophobicContact CB-CD2 3.5Å; H795-L1285 VanDerWaalsContact CB-CD2 3.5Å; H795-L1285 VanDerWaalsContact CG-CD2 3.47Å; S1281-L1285 PolarHBondContact O-N 3.49Å; L1282-L1285 HydrophobicContact CD2-CD1 3.94Å; L1282-L1285 HydrophobicContact CG-CD1 4.41Å; L1285-R1287 PolarHBondContact O-N 2.59Å; L1285-L1289 HydrophobicContact CB-CD1 3.84Å; L1285-L1289 HydrophobicContact CD2-CD1 3.92Å; L1285-L1289 HydrophobicContact CG-CD1 4.31Å; L1285-F1290 HydrophobicContact CB-CE2 4.07Å; L1285-F1290 HydrophobicContact CD1-CE2 4.29Å; L1285-F1290 HydrophobicContact CD1-CZ 3.93Å
1286	P	55.4	Low	48.4	Very low	38 Å²	38	80 Å²	80	25%	0.247	41%	0.411	C	S	.	.			trans	-52.9	128.4	173.6	-27	33.4	0	0	0	112	D1288 L1289	P1286-D1288 PolarHBondContact O-N 3.17Å; P1286-D1288 VanDerWaalsContact O-N 3.13Å; P1286-L1289 VanDerWaalsContact O-CB 3.29Å; P1286-L1289 WeakPolarHBondContact O-CB 3.29Å; P1286-L1289 PolarHBondContact O-N 2.82Å
1287	R	53.5	Low	46.7	Very low	150 Å²	150	81.6 Å²	81.6	57%	0.566	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-57.1	-32.6	-178.8	-61.9	-172.5	-170.8	-159.8	1.8	112.1	E619 L1285 L1289 F1290 T1291	E619-R1287 IonicContact OE1-NH1 2.93Å; E619-R1287 IonicContact OE2-NH1 2.76Å; L1285-R1287 PolarHBondContact O-N 2.59Å; R1287-L1289 PolarHBondContact O-N 3.05Å; R1287-F1290 PolarHBondContact O-N 2.93Å; R1287-T1291 PolarHBondContact O-N 3.32Å; R1287-T1291 VanDerWaalsContact O-N 3.17Å; R1287-T1291 PolarHBondContact O-OG1 3.05Å
1288	D	55.4	Low	45.1	Very low	76 Å²	76	82.7 Å²	82.7	41%	0.406	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-57.3	-12.3	176	-22.5	-29.1	0	0	0	114.9	P1286 F1290 T1291	P1286-D1288 PolarHBondContact O-N 3.17Å; P1286-D1288 VanDerWaalsContact O-N 3.13Å; D1288-F1290 VanDerWaalsContact C-N 3.28Å; D1288-T1291 WeakPolarHBondContact CA-OG1 3.37Å
1289	L	52.8	Low	44.1	Very low	20 Å²	20	77.1 Å²	77.1	11%	0.105	43%	0.427	C	S	.	.	G	3₁₀ helix	trans	-67.1	-30	168.4	-95.5	153.4	0	0	0	113	M710 I731 T733 L1285 P1286 R1287	M710-L1289 HydrophobicContact CE-CD2 4.16Å; I731-L1289 HydrophobicContact CG2-CD2 3.61Å; T733-L1289 HydrophobicContact CG2-CD1 3.79Å; T733-L1289 HydrophobicContact CG2-CD2 3.43Å; T733-L1289 VanDerWaalsContact CG2-CD2 3.43Å; T733-L1289 HydrophobicContact CG2-CG 3.64Å; L1285-L1289 HydrophobicContact CB-CD1 3.84Å; L1285-L1289 HydrophobicContact CD2-CD1 3.92Å; L1285-L1289 HydrophobicContact CG-CD1 4.31Å; P1286-L1289 VanDerWaalsContact O-CB 3.29Å; P1286-L1289 WeakPolarHBondContact O-CB 3.29Å; P1286-L1289 PolarHBondContact O-N 2.82Å; R1287-L1289 PolarHBondContact O-N 3.05Å
1290	F	56.3	Low	43	Very low	32 Å²	32	84.9 Å²	84.9	14%	0.14	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.3	-21	-168.5	-51.8	-67.1	0	0	0	111.8	H709 M710 L711 L1282 L1285 R1287 D1288	H709-F1290 AromaticContact CE1-CD1 3.74Å; H709-F1290 AromaticContact NE2-CD1 3.47Å; H709-F1290 WeakPolarHBondContact NE2-CD1 3.45Å; M710-F1290 HydrophobicContact CE-CD1 4.33Å; M710-F1290 HydrophobicContact CE-CE1 3.68Å; M710-F1290 HydrophobicContact CE-CZ 4.46Å; L711-F1290 HydrophobicContact CD1-CE1 4.28Å; L711-F1290 HydrophobicContact CD2-CE1 4.12Å; L711-F1290 HydrophobicContact CG-CE1 4.07Å; L1282-F1290 HydrophobicContact CD2-CZ 3.99Å; L1285-F1290 HydrophobicContact CB-CE2 4.07Å; L1285-F1290 HydrophobicContact CD1-CE2 4.29Å; L1285-F1290 HydrophobicContact CD1-CZ 3.93Å; R1287-F1290 PolarHBondContact O-N 2.93Å; D1288-F1290 VanDerWaalsContact C-N 3.28Å
1291	T	45.9	Very low	42	Very low	21 Å²	21	89.6 Å²	89.6	13%	0.129	48%	0.475	C	S	.	.	S	Bend	trans	-105.8	146.4	179.6	58.5	0	0	0	0	114.2	E616 R1287 D1288 E1293	E616-T1291 HydrophobicContact CB-CG2 3.88Å; E616-T1291 HydrophobicContact CG-CG2 3.8Å; R1287-T1291 PolarHBondContact O-N 3.32Å; R1287-T1291 VanDerWaalsContact O-N 3.17Å; R1287-T1291 PolarHBondContact O-OG1 3.05Å; D1288-T1291 WeakPolarHBondContact CA-OG1 3.37Å; T1291-E1293 VanDerWaalsContact C-N 3.28Å; T1291-E1293 PolarHBondContact O-N 2.66Å
1292	D	40.9	Very low	40.7	Very low	72 Å²	72	99.2 Å²	99.2	39%	0.385	50%	0.504	S	S	.	.			trans	-88.3	38.2	179.5	-73.5	-41.7	0	0	0	113.1	Q593 N1294	Q593-D1292 VanDerWaalsContact NE2-CG 3.35Å; Q593-D1292 PolarHBondContact NE2-OD2 3.23Å; D1292-N1294 PolarHBondContact O-N 2.88Å
1293	E	37.9	Very low	39.4	Very low	136 Å²	136	103.2 Å²	103.2	64%	0.636	53%	0.533	S	S	*	.			trans	-71.2	122.8	173.8	-69.1	-156.8	165.3	0	0	111.1	K923 T1291 L1295	K923-E1293 PolarHBondContact NZ-O 2.65Å; T1291-E1293 VanDerWaalsContact C-N 3.28Å; T1291-E1293 PolarHBondContact O-N 2.66Å; E1293-L1295 PolarHBondContact O-N 3.03Å
1294	N	34.4	Very low	38.1	Very low	135 Å²	135	109.8 Å²	109.8	72%	0.722	55%	0.554	S	S	*	*			trans	-73.7	113	174.5	-73	-30.4	0	0	0	109.4	D1292 D1296	D1292-N1294 PolarHBondContact O-N 2.88Å; N1294-D1296 PolarHBondContact O-N 3.12Å
1295	L	30.7	Very low	36.9	Very low	147 Å²	147	117.4 Å²	117.4	77%	0.77	57%	0.569	S	S	*	*			trans	-70.7	104	149	-93.2	105.4	0	0	0	107	E1293 V1297	E1293-L1295 PolarHBondContact O-N 3.03Å; L1295-V1297 PolarHBondContact O-N 2.76Å
1296	D	29	Very low	35.2	Very low	130 Å²	130	125 Å²	125	70%	0.695	61%	0.609	S	S	*	*			trans	-61.1	99.6	169.4	-89	-29.7	0	0	0	109.6	N1294 T1298	N1294-D1296 PolarHBondContact O-N 3.12Å; D1296-T1298 PolarHBondContact O-N 3.34Å
1297	V	26.1	Very low	33.9	Very low	118 Å²	118	128.5 Å²	128.5	72%	0.715	63%	0.634	S	S	*	*	S	Bend	trans	-76	54.7	169.6	-170.4	0	0	0	0	109.7	L1295	L1295-V1297 PolarHBondContact O-N 2.76Å
1298	T	25.9	Very low	32.4	Very low	109 Å²	109	127.1 Å²	127.1	67%	0.669	65%	0.647	S	S	*	*			trans	-146.5	71.1	160.1	48.9	0	0	0	0	110.7	D1296 R1300	D1296-T1298 PolarHBondContact O-N 3.34Å; T1298-R1300 PolarHBondContact O-N 3.21Å
1299	T	24.3	Very low	31.1	Very low	117 Å²	117	127.8 Å²	127.8	72%	0.718	66%	0.663	S	S	*	*			trans	-66.6	76.6	162.6	50.1	0	0	0	0	110.6
1300	R	24.3	Very low	29.7	Very low	223 Å²	223	133.6 Å²	133.6	84%	0.842	70%	0.699	S	S	*	*			trans	-69.7	124	157.1	-77.4	-174.5	173.9	-177	0.1	107.2	T1298 R1302	T1298-R1300 PolarHBondContact O-N 3.21Å; R1300-R1302 PolarHBondContact O-N 2.75Å
1301	P	23.7	Very low	28.5	Very low	123 Å²	123	137.4 Å²	137.4	80%	0.799	73%	0.73	S	S	*	*			trans	-67.6	110.8	179.5	27.3	-33	0	0	0	109.2	S1303	P1301-S1303 PolarHBondContact O-N 2.93Å
1302	R	25.4	Very low	27.5	Very low	249 Å²	249	143.5 Å²	143.5	94%	0.94	76%	0.762	S	S	*	*			trans	-70.7	82.2	167.6	-93.8	-174.4	168.3	169.5	-1.9	109.1	R1300 R1304	R1300-R1302 PolarHBondContact O-N 2.75Å; R1302-R1304 PolarHBondContact O-N 2.59Å
1303	S	26.5	Very low	26.9	Very low	94 Å²	94	148.2 Å²	148.2	66%	0.657	79%	0.787	S	S	*	*			trans	-49.5	121	162.3	174	0	0	0	0	109	P1301 R1305	P1301-S1303 PolarHBondContact O-N 2.93Å; S1303-R1305 PolarHBondContact O-N 2.93Å; S1303-R1305 VanDerWaalsContact O-N 3.09Å
1304	R	23.4	Very low	26.3	Very low	241 Å²	241	147.5 Å²	147.5	91%	0.909	79%	0.792	S	S	*	*			trans	-60.4	110.5	163.9	-77.9	177.2	170.8	163.6	-3.5	107.9	R1302	R1302-R1304 PolarHBondContact O-N 2.59Å
1305	R	25.4	Very low	25.9	Very low	224 Å²	224	148.6 Å²	148.6	85%	0.845	80%	0.798	S	S	*	*			trans	-111.7	117.6	155.9	-76	-168.6	176.5	-169.2	-0.8	108.8	S1303 S1307	S1303-R1305 PolarHBondContact O-N 2.93Å; S1303-R1305 VanDerWaalsContact O-N 3.09Å; R1305-S1307 PolarHBondContact O-N 2.97Å
1306	L	22.9	Very low	25.9	Very low	170 Å²	170	147.9 Å²	147.9	89%	0.89	80%	0.8	S	S	*	*			trans	-60.8	128.8	156.4	-87.4	66.4	0	0	0	107.8
1307	S	26.4	Very low	25.7	Very low	112 Å²	112	150.8 Å²	150.8	78%	0.783	81%	0.809	S	S	*	*			trans	-153.4	116.5	155.4	55.2	0	0	0	0	109.3	R1305	R1305-S1307 PolarHBondContact O-N 2.97Å
1308	S	23	Very low	25.8	Very low	120 Å²	120	151.1 Å²	151.1	84%	0.839	81%	0.811	S	S	*	*			trans	-73.6	126.2	178.1	48.4	0	0	0	0	112.8
1309	A	27.5	Very low	25.9	Very low	90 Å²	90	150.4 Å²	150.4	74%	0.744	82%	0.816	S	S	*	*			trans	-157.7	109.9	152.5	0	0	0	0	0	104.7
1310	V	24.8	Very low	25.9	Very low	142 Å²	142	149.7 Å²	149.7	86%	0.861	82%	0.816	S	S	*	*				56.5	76.9	63.1	-167.7	0	0	0	0	111.8
1311	S	29.7	Very low	26.1	Very low	112 Å²	112	145.8 Å²	145.8	78%	0.783	82%	0.816	S	S	*	*			trans	-149.7	118.4	151	55.3	0	0	0	0	107.4
1312	N	24.3	Very low	26.1	Very low	149 Å²	149	148.2 Å²	148.2	80%	0.797	82%	0.817	S	S	*	*			trans	-70.2	138.3	177.3	-64.2	-26.4	0	0	0	109.7
1313	D	28.5	Very low	26.3	Very low	171 Å²	171	142 Å²	142	91%	0.914	81%	0.812	S	S	*	*			trans	-151.1	92.5	144.6	-95.8	-28.6	0	0	0	107.1
1314	T	26.1	Very low	26.3	Very low	121 Å²	121	145.7 Å²	145.7	74%	0.742	82%	0.819	S	S	*	*			trans	-83	123.2	167.5	44.6	0	0	0	0	108.4
1315	D	25.6	Very low	26.6	Very low	159 Å²	159	141.8 Å²	141.8	85%	0.85	81%	0.814	S	S	*	*			trans	-177.8	84	145	-92.5	-14.1	0	0	0	110.9
1316	V	31.2	Very low	26.7	Very low	132 Å²	132	137 Å²	137	80%	0.8	81%	0.81	S	S	*	*			trans	-140.4	98.5	153.1	-179.5	0	0	0	0	107.5	V1318	V1316-V1318 PolarHBondContact O-N 3.32Å; V1316-V1318 VanDerWaalsContact O-N 3.17Å
1317	E	25	Very low	26.9	Very low	191 Å²	191	135.1 Å²	135.1	89%	0.893	80%	0.801	S	S	*	*			trans	-62.7	113.9	163.3	-74.6	-173.1	126.6	0	0	109.4	A1319	E1317-A1319 PolarHBondContact O-N 3.29Å
1318	V	27.9	Very low	27	Very low	124 Å²	124	139.7 Å²	139.7	75%	0.752	80%	0.801	S	S	*	*			trans	-87.5	98.6	158.5	176.9	0	0	0	0	106.3	V1316 S1320	V1316-V1318 PolarHBondContact O-N 3.32Å; V1316-V1318 VanDerWaalsContact O-N 3.17Å; V1318-S1320 VanDerWaalsContact C-N 3.26Å; V1318-S1320 PolarHBondContact O-N 3.08Å
1319	A	27.3	Very low	27.1	Very low	94 Å²	94	144.6 Å²	144.6	78%	0.777	80%	0.801	S	S	*	*			trans	-69.5	83.5	175.1	0	0	0	0	0	110.7	E1317 V1321	E1317-A1319 PolarHBondContact O-N 3.29Å; A1319-V1321 PolarHBondContact O-N 3.25Å
1320	S	26	Very low	27.1	Very low	103 Å²	103	147.7 Å²	147.7	72%	0.72	80%	0.8	S	S	*	*			trans	-70.5	111.9	164.4	52	0	0	0	0	109.4	V1318 Q1322	V1318-S1320 VanDerWaalsContact C-N 3.26Å; V1318-S1320 PolarHBondContact O-N 3.08Å; S1320-Q1322 PolarHBondContact O-N 3.02Å
1321	V	27	Very low	27.1	Very low	140 Å²	140	148.5 Å²	148.5	85%	0.848	80%	0.799	S	S	*	*			trans	-77.4	104.8	172.1	177.1	0	0	0	0	109.2	A1319	A1319-V1321 PolarHBondContact O-N 3.25Å
1322	Q	24	Very low	27.4	Very low	175 Å²	175	148 Å²	148	82%	0.818	79%	0.793	S	S	*	*			trans	-152.7	108.5	160.3	-117.3	171.7	-16.1	0	0	110	S1320	S1320-Q1322 PolarHBondContact O-N 3.02Å
1323	S	30	Very low	27.5	Very low	119 Å²	119	150.4 Å²	150.4	83%	0.832	80%	0.797	S	S	*	*			trans	-106.5	107.1	161.7	57	0	0	0	0	108
1324	E	25.7	Very low	27.3	Very low	170 Å²	170	146.9 Å²	146.9	79%	0.794	79%	0.786	S	S	*	*			trans	-77.7	179.7	169.5	-71.6	-168.1	127.1	0	0	111.8
1325	I	30.4	Very low	27.3	Very low	159 Å²	159	146 Å²	146	82%	0.815	78%	0.784	S	S	*	*			trans	105	105.7	-178	-60.7	164.6	0	0	0	110.4
1326	T	28.2	Very low	27.4	Very low	125 Å²	125	143.7 Å²	143.7	77%	0.767	78%	0.776	S	S	*	*			cis	-159.6	152.3	6.9	4.4	0	0	0	0	113.1
1327	D	26.3	Very low	27.1	Very low	129 Å²	129	145 Å²	145	69%	0.69	78%	0.778	S	S	*	*			trans	81	130.7	146.8	-123	8.3	0	0	0	123.4
1328	R	28.5	Very low	27.3	Very low	208 Å²	208	139.4 Å²	139.4	79%	0.785	77%	0.772	S	S	*	*			trans	73.8	93.5	151	-69.2	167.1	-166.5	-131	-3	123.3
1329	R	25.3	Very low	27.1	Very low	223 Å²	223	141.2 Å²	141.2	84%	0.842	78%	0.778	S	S	*	*				38.4	126.2	120.1	-72.5	-172.4	179.2	179.9	1	121.9
1330	Q	27.4	Very low	27.3	Very low	156 Å²	156	144.4 Å²	144.4	73%	0.729	78%	0.78	S	S	*	*			trans	73.9	103.6	135.5	-68.8	178.3	-40.5	0	0	121.2
1331	L	24.9	Very low	27.3	Very low	159 Å²	159	142.3 Å²	142.3	83%	0.832	78%	0.775	S	S	*	*				58.6	156.4	120.2	-68.4	172.4	0	0	0	120
1332	P	35.2	Very low	27.5	Very low	102 Å²	102	142.5 Å²	142.5	66%	0.662	77%	0.77	S	S	*	*				-130.8	-158.9	-89.3	35.7	-13	0	0	0	113.1
1333	F	27.5	Very low	27.8	Very low	199 Å²	199	140.3 Å²	140.3	87%	0.873	76%	0.76	S	S	*	*			trans	99	151.9	171.7	-79	-84.3	0	0	0	119
1334	S	23.6	Very low	27.8	Very low	97 Å²	97	142.2 Å²	142.2	68%	0.678	75%	0.753	S	S	*	*			trans	-97.3	149.9	-162	51.8	0	0	0	0	114.1
1335	S	26	Very low	28	Very low	101 Å²	101	140.3 Å²	140.3	71%	0.706	75%	0.753	S	S	*	*				159.7	146.1	112.8	50.3	0	0	0	0	114.7
1336	T	27.4	Very low	28.1	Very low	112 Å²	112	138.6 Å²	138.6	69%	0.687	75%	0.75	S	S	*	*			trans	59.4	119.7	146.6	49.5	0	0	0	0	123.3
1337	D	26.4	Very low	28.2	Very low	158 Å²	158	136 Å²	136	85%	0.845	75%	0.748	S	S	*	*				75.8	144	124.3	-54.7	-12.5	0	0	0	124.2
1338	G	27.9	Very low	28.4	Very low	74 Å²	74	138.4 Å²	138.4	76%	0.763	75%	0.752	S	S	*	*			trans	94.4	86.7	159.5	0	0	0	0	0	115.4
1339	D	24.5	Very low	28.5	Very low	162 Å²	162	135.9 Å²	135.9	87%	0.866	75%	0.749	S	S	*	*				77.7	153.6	58.5	-143.4	-0.5	0	0	0	114.5
1340	I	30.5	Very low	28.8	Very low	161 Å²	161	133.3 Å²	133.3	83%	0.826	74%	0.744	S	S	*	*			trans	81	127.2	-172.1	-46.3	159.1	0	0	0	115
1341	G	27.5	Very low	28.8	Very low	59 Å²	59	130.7 Å²	130.7	61%	0.608	74%	0.739	S	S	*	*			cis	156.9	163.8	-7.2	0	0	0	0	0	114
1342	L	30.3	Very low	29	Very low	144 Å²	144	128.8 Å²	128.8	75%	0.754	73%	0.729	S	S	*	*			trans	73.4	140.5	169.3	-70.2	83.1	0	0	0	117.8
1343	H	30.4	Very low	28.6	Very low	130 Å²	130	131.1 Å²	131.1	60%	0.602	73%	0.732	S	S	*	*			cis	-163.8	140.6	-3.6	-126	-175.6	0	0	0	114.5
1344	K	29.4	Very low	28.5	Very low	159 Å²	159	129.6 Å²	129.6	69%	0.691	73%	0.729	S	S	*	*			trans	54.7	145.7	134.7	-74	176.3	-179.5	151.1	0	120.7
1345	V	31	Very low	28.5	Very low	130 Å²	130	129.6 Å²	129.6	79%	0.788	73%	0.729	S	S	*	*				-154.2	124.3	60.1	159.6	0	0	0	0	113.4
1346	V	31.2	Very low	28.6	Very low	123 Å²	123	130.6 Å²	130.6	75%	0.745	73%	0.73	S	S	*	*			trans	50.6	139.8	131.4	-172.2	0	0	0	0	120.5
1347	G	30.4	Very low	28.6	Very low	71 Å²	71	131.4 Å²	131.4	73%	0.732	73%	0.731	S	S	*	*			cis	-171.5	-167.3	2.5	0	0	0	0	0	109.4
1348	K	31.8	Very low	28.7	Very low	178 Å²	178	131.2 Å²	131.2	77%	0.774	73%	0.725	S	S	*	*			cis	-155.1	130.3	9.7	-92.4	-177.2	175.2	175.6	0	106.9
1349	H	31	Very low	28.7	Very low	156 Å²	156	133.8 Å²	133.8	72%	0.722	72%	0.721	S	S	*	*				68.9	154	108.4	-72.9	-42.9	0	0	0	118
1350	F	30.2	Very low	28.8	Very low	168 Å²	168	134.5 Å²	134.5	74%	0.737	72%	0.719	S	S	*	*			cis	-145.8	162.5	2.8	-132.7	-78.4	0	0	0	109.7
1351	T	28	Very low	28.5	Very low	101 Å²	101	134.2 Å²	134.2	62%	0.62	72%	0.719	S	S	*	*			trans	-75.8	-166.6	-176	57.7	0	0	0	0	113.8
1352	N	29.2	Very low	28.9	Very low	119 Å²	119	136.6 Å²	136.6	64%	0.636	72%	0.724	S	S	*	*			cis	-162.8	140.2	21.9	-123	-4.3	0	0	0	108.9
1353	Q	25.6	Very low	28.6	Very low	152 Å²	152	135.2 Å²	135.2	71%	0.71	72%	0.722	S	S	*	*				72.5	139.9	94.3	-83.7	-167	-13.1	0	0	120.2
1354	M	26.5	Very low	28.4	Very low	167 Å²	167	138.1 Å²	138.1	82%	0.823	73%	0.733	S	S	*	*			trans	70.7	149.5	155.6	-74.6	179.6	166.9	0	0	119.7
1355	S	23.1	Very low	28.1	Very low	96 Å²	96	135.7 Å²	135.7	67%	0.671	73%	0.732	S	S	*	*			cis	-176.9	-178.9	-24.1	52	0	0	0	0	109.7
1356	V	28.6	Very low	27.8	Very low	122 Å²	122	137.6 Å²	137.6	74%	0.739	74%	0.737	S	S	*	*			trans	103.3	115.4	161.5	-175	0	0	0	0	118.5
1357	N	26.3	Very low	27.6	Very low	130 Å²	130	135.5 Å²	135.5	70%	0.695	74%	0.739	S	S	*	*			trans	35.5	157.5	143.1	-60.8	15.5	0	0	0	122
1358	E	29.9	Very low	27.4	Very low	154 Å²	154	135.7 Å²	135.7	72%	0.72	74%	0.742	S	S	*	*			cis	-158.9	147	17.9	-141.1	146.2	-114.7	0	0	114.1
1359	N	27	Very low	27.3	Very low	127 Å²	127	132 Å²	132	68%	0.679	74%	0.738	S	S	*	*			trans	26.5	126.2	149.9	-71.6	-30.1	0	0	0	126
1360	Q	27.7	Very low	27.2	Very low	178 Å²	178	131 Å²	131	83%	0.832	74%	0.738	S	S	*	*				75.7	134.4	124	-62	-179.3	7	0	0	123.8
1361	N	23.9	Very low	27.1	Very low	155 Å²	155	130.5 Å²	130.5	83%	0.829	74%	0.735	S	S	*	*			trans	-54.6	168.6	164.2	-67.1	-34.6	0	0	0	113.3
1362	P	35.6	Very low	27	Very low	108 Å²	108	132.8 Å²	132.8	70%	0.701	74%	0.737	S	S	*	*			cis	-153.7	-179.3	31.5	37.4	-12.4	0	0	0	120.3
1363	T	24.1	Very low	26.8	Very low	116 Å²	116	136.1 Å²	136.1	71%	0.712	74%	0.74	S	S	*	*			trans	76.8	142.8	142.2	33.7	0	0	0	0	125.5
1364	F	25.1	Very low	26.7	Very low	190 Å²	190	135.3 Å²	135.3	83%	0.833	74%	0.741	S	S	*	*			trans	77.7	118.6	147.6	-88.4	-78.5	0	0	0	123.2
1365	T	23.9	Very low	26.7	Very low	109 Å²	109	134.8 Å²	134.8	67%	0.669	74%	0.741	S	S	*	*			trans	-45.8	155.5	164.3	57	0	0	0	0	117.7
1366	L	25.1	Very low	26.7	Very low	170 Å²	170	135 Å²	135	89%	0.89	74%	0.742	S	S	*	*				173.2	156.2	101.1	-139.5	103.3	0	0	0	114
1367	G	26.4	Very low	26.8	Very low	78 Å²	78	135.3 Å²	135.3	80%	0.804	74%	0.744	S	S	*	*			trans	78.9	142.4	167.4	0	0	0	0	0	114.5
1368	G	27	Very low	26.8	Very low	76 Å²	76	136 Å²	136	78%	0.784	75%	0.747	S	S	*	*			cis	154.7	156.9	13.9	0	0	0	0	0	105.3
1369	S	28.5	Very low	26.7	Very low	100 Å²	100	134.2 Å²	134.2	70%	0.699	75%	0.747	S	S	*	*			cis	-170.8	143.8	17.2	-133.7	0	0	0	0	108.9
1370	L	29	Very low	26.8	Very low	135 Å²	135	134.5 Å²	134.5	71%	0.707	75%	0.748	S	S	*	*			trans	53.3	157.3	135.2	-53.6	174.3	0	0	0	120.1
1371	K	28.4	Very low	26.8	Very low	158 Å²	158	135.1 Å²	135.1	69%	0.687	75%	0.751	S	S	*	*			cis	-168.5	148.4	-3.8	-121.8	165.8	-177.5	159.5	0	109.6
1372	K	26.8	Very low	26.8	Very low	149 Å²	149	134.9 Å²	134.9	65%	0.648	75%	0.745	S	S	*	*			trans	37.2	124.7	133.4	-72.7	-177.7	174.7	179.8	0	122.5
1373	R	25.4	Very low	26.5	Very low	189 Å²	189	137.9 Å²	137.9	71%	0.713	75%	0.749	S	S	*	*				87.7	116.8	117.7	-75	-179.6	175.5	174.2	-7	123.1
1374	N	22	Very low	26.5	Very low	134 Å²	134	137.2 Å²	137.2	72%	0.717	75%	0.745	S	S	*	*				66.9	155.1	117.1	-58	19	0	0	0	122.6
1375	L	26.9	Very low	26.6	Very low	157 Å²	157	134.2 Å²	134.2	82%	0.822	74%	0.742	S	S	*	*			trans	73.1	119.6	-178.3	-69.4	90.9	0	0	0	114.2
1376	S	23.9	Very low	26.7	Very low	101 Å²	101	138.8 Å²	138.8	71%	0.706	75%	0.748	S	S	*	*			cis	82.9	97	30.3	86.1	0	0	0	0	115.5
1377	V	29.5	Very low	26.7	Very low	128 Å²	128	137.4 Å²	137.4	78%	0.776	74%	0.742	S	S	*	*			trans	-147.2	110.7	151.1	-178.8	0	0	0	0	107.4
1378	D	26.8	Very low	27	Very low	143 Å²	143	138.1 Å²	138.1	77%	0.765	73%	0.732	S	S	*	*				26.1	144	128.3	-47.1	-49.3	0	0	0	118.9
1379	T	28.7	Very low	27.1	Very low	118 Å²	118	141.2 Å²	141.2	72%	0.724	73%	0.731	S	S	*	*				-170	128.8	61.9	-57.5	0	0	0	0	113.7
1380	L	27.8	Very low	27.1	Very low	133 Å²	133	141.1 Å²	141.1	70%	0.696	73%	0.726	S	S	*	*			trans	29.9	124.6	149.1	-68.3	155.1	0	0	0	123.1
1381	Q	27.1	Very low	27.2	Very low	191 Å²	191	142.2 Å²	142.2	89%	0.893	73%	0.725	S	S	*	*				176.2	105.1	107.6	-93.8	178.1	-5.2	0	0	109.1
1382	H	25.6	Very low	27.1	Very low	149 Å²	149	141.5 Å²	141.5	69%	0.69	73%	0.729	S	S	*	*				66.8	111.4	75.7	-91.8	-58.1	0	0	0	118
1383	H	28.1	Very low	27.2	Very low	172 Å²	172	141.5 Å²	141.5	80%	0.796	73%	0.731	S	S	*	*			trans	150.6	120.6	138.2	-82.5	-64	0	0	0	108.3
1384	T	24.9	Very low	27.3	Very low	101 Å²	101	138.2 Å²	138.2	62%	0.62	74%	0.737	S	S	*	*				70.8	103.7	54.5	69.6	0	0	0	0	116.6
1385	V	26.2	Very low	27.6	Very low	128 Å²	128	136.9 Å²	136.9	78%	0.776	74%	0.738	S	S	*	*			trans	68.1	153.3	138.1	-172.3	0	0	0	0	118.8
1386	Y	27.3	Very low	27.5	Very low	205 Å²	205	135.7 Å²	135.7	80%	0.804	74%	0.737	S	S	*	*			trans	90.9	114.2	-174.5	-70.2	-91.7	0	0	0	113.9
1387	D	24.8	Very low	27.7	Very low	141 Å²	141	136 Å²	136	75%	0.754	74%	0.739	S	S	*	*				72.2	154.7	67.7	-94.2	-17.5	0	0	0	113.1
1388	P	32.3	Very low	27.6	Very low	92 Å²	92	135.1 Å²	135.1	60%	0.597	74%	0.738	S	S	*	*			cis	-140	-162.7	-8	31.8	-7.5	0	0	0	114.3
1389	D	28.6	Very low	27.4	Very low	141 Å²	141	134.9 Å²	134.9	75%	0.754	74%	0.743	S	S	*	*			trans	79.5	147.8	142.5	-72.4	-13.4	0	0	0	122.6
1390	V	29.9	Very low	27.5	Very low	99 Å²	99	135.4 Å²	135.4	60%	0.6	75%	0.748	S	S	*	*			cis	-169.8	146.9	-30.8	89.5	0	0	0	0	110.9
1391	F	29.5	Very low	27.3	Very low	158 Å²	158	133.5 Å²	133.5	69%	0.693	75%	0.746	S	S	*	*			trans	54.8	151.4	167.3	-70.7	-83.9	0	0	0	118.2	H1393	F1391-H1393 AromaticContact CD1-NE2 3.92Å; F1391-H1393 AromaticContact CE1-NE2 3.52Å
1392	D	27.6	Very low	27.2	Very low	143 Å²	143	131 Å²	131	77%	0.765	74%	0.738	S	S	*	*			cis	-146.7	-178.8	29.5	-145.7	-17.5	0	0	0	115.2
1393	H	27.2	Very low	27.2	Very low	148 Å²	148	130.9 Å²	130.9	69%	0.685	74%	0.742	S	S	*	*			trans	-84.8	174.1	-152.2	-78.5	-71.7	0	0	0	120.7	F1391	F1391-H1393 AromaticContact CD1-NE2 3.92Å; F1391-H1393 AromaticContact CE1-NE2 3.52Å
1394	S	27.8	Very low	27	Very low	120 Å²	120	131.1 Å²	131.1	84%	0.839	74%	0.744	S	S	*	*			trans	86.3	139.7	165.7	77.6	0	0	0	0	116.9
1395	S	28.8	Very low	27.1	Very low	106 Å²	106	134.9 Å²	134.9	74%	0.741	75%	0.752	S	S	*	*			cis	-149.3	126.9	0.5	47	0	0	0	0	109.6
1396	V	25.8	Very low	27.2	Very low	133 Å²	133	133.8 Å²	133.8	81%	0.806	75%	0.747	S	S	*	*				67.4	127.7	94	178.2	0	0	0	0	117.1
1397	S	27	Very low	27	Very low	108 Å²	108	130.4 Å²	130.4	76%	0.755	75%	0.748	S	S	*	*			trans	77.9	140	166.2	75.1	0	0	0	0	118.7
1398	S	28.7	Very low	27.2	Very low	108 Å²	108	130.9 Å²	130.9	76%	0.755	75%	0.749	S	S	*	*			cis	-165.4	130.9	-17.5	48	0	0	0	0	112.2
1399	T	22.1	Very low	26.8	Very low	139 Å²	139	135 Å²	135	85%	0.853	76%	0.76	S	S	*	*			trans	-126.2	127.5	163.2	51.2	0	0	0	0	109.4
1400	P	29.9	Very low	26.7	Very low	128 Å²	128	137.1 Å²	137.1	83%	0.831	76%	0.763	S	S	*	*			trans	-107.5	110.2	167.1	32.8	-22.9	0	0	0	110.9
1401	S	23.3	Very low	26.6	Very low	94 Å²	94	140.9 Å²	140.9	66%	0.657	78%	0.775	S	S	*	*			trans	-85.6	167.5	160.5	68.7	0	0	0	0	110.8
1402	D	25.7	Very low	26.3	Very low	137 Å²	137	138.8 Å²	138.8	73%	0.733	78%	0.781	S	S	*	*			trans	58	102.2	153.2	-51	-46.8	0	0	0	120
1403	L	25.9	Very low	26.3	Very low	147 Å²	147	136.6 Å²	136.6	77%	0.77	78%	0.777	S	S	*	*			trans	-105.9	78.1	159	-109.3	160	0	0	0	110.4	F1405	L1403-F1405 HydrophobicContact CD2-CD2 4.45Å; L1403-F1405 HydrophobicContact CD2-CE2 3.84Å; L1403-F1405 HydrophobicContact CD2-CZ 4.03Å
1404	E	24.6	Very low	26.4	Very low	177 Å²	177	137.8 Å²	137.8	83%	0.827	78%	0.782	S	S	*	*			trans	-70.4	127.2	162.2	-70.5	-158.9	132.9	0	0	110.3	P1406	E1404-P1406 WeakPolarHBondContact O-CD 3.3Å
1405	F	25.8	Very low	26.4	Very low	181 Å²	181	140 Å²	140	79%	0.794	78%	0.783	S	S	*	*			trans	-101.9	108.3	168	-85.9	-78.9	0	0	0	109.8	L1403	L1403-F1405 HydrophobicContact CD2-CD2 4.45Å; L1403-F1405 HydrophobicContact CD2-CE2 3.84Å; L1403-F1405 HydrophobicContact CD2-CZ 4.03Å
1406	P	29.3	Very low	26.5	Very low	105 Å²	105	145.4 Å²	145.4	68%	0.682	79%	0.788	S	S	*	*			trans	-74.3	145.4	-176.8	28.9	-34.2	0	0	0	112.4	E1404 I1408	E1404-P1406 WeakPolarHBondContact O-CD 3.3Å; P1406-I1408 PolarHBondContact O-N 2.94Å
1407	V	23	Very low	26.8	Very low	134 Å²	134	146.4 Å²	146.4	81%	0.812	79%	0.788	S	S	*	*			trans	-72.8	120.1	166	173.5	0	0	0	0	108.3
1408	I	28.3	Very low	27	Very low	151 Å²	151	144.1 Å²	144.1	77%	0.774	78%	0.782	S	S	*	*			trans	-122.7	106.7	165.5	-60.1	-177.1	0	0	0	109.2	P1406	P1406-I1408 PolarHBondContact O-N 2.94Å
1409	E	23.1	Very low	27.2	Very low	178 Å²	178	150.8 Å²	150.8	83%	0.832	79%	0.793	S	S	*	*			trans	-126.8	91	164	180	178.6	-129.5	0	0	106.9
1410	K	27.7	Very low	27.7	Very low	186 Å²	186	147.1 Å²	147.1	81%	0.809	78%	0.782	S	S	*	*			trans	-171.4	149.1	150.4	-111.4	166.5	-173.2	-179.6	0	114.3
1411	M	27.1	Very low	28.1	Very low	177 Å²	177	149.6 Å²	149.6	87%	0.872	78%	0.783	S	S	*	*			trans	73.8	97.5	158.4	-74.1	169.6	146.4	0	0	118.9
1412	S	23.9	Very low	28.6	Very low	115 Å²	115	151 Å²	151	80%	0.804	78%	0.783	S	S	*	*			trans	-62.4	133.3	143.7	52	0	0	0	0	112
1413	S	27.6	Very low	29	Very low	97 Å²	97	155.7 Å²	155.7	68%	0.678	79%	0.791	S	S	*	*				170	156.3	127.3	60.3	0	0	0	0	110.3
1414	H	30.1	Very low	29.4	Very low	172 Å²	172	161.6 Å²	161.6	80%	0.796	81%	0.814	S	S	*	*			trans	66.8	104.7	178.5	-54.7	81.1	0	0	0	113.3
1415	L	26.8	Very low	29.6	Very low	166 Å²	166	160.8 Å²	160.8	87%	0.869	81%	0.813	S	S	*	*			cis	57.9	73.1	35.4	-82.1	177	0	0	0	114.8
1416	R	31.3	Very low	29.8	Very low	221 Å²	221	159.7 Å²	159.7	83%	0.834	81%	0.814	S	S	*	*				173.5	144.3	117.9	-97.2	177.4	177.6	-165.5	-1	111.7
1417	N	32.5	Very low	29.9	Very low	153 Å²	153	162.8 Å²	162.8	82%	0.818	82%	0.822	S	S	*	*			trans	42.3	133.9	149	-49	-4.6	0	0	0	118.8
1418	G	30.2	Very low	30.3	Very low	61 Å²	61	164.5 Å²	164.5	63%	0.629	82%	0.822	S	S	*	*			cis	129.6	134.5	14.5	0	0	0	0	0	109.3
1419	Y	33.9	Very low	30.4	Very low	247 Å²	247	165.3 Å²	165.3	97%	0.969	83%	0.825	S	S	*	*			trans	66.3	139.7	-171.7	-56.5	-92.9	0	0	0	114.7
1420	G	32.9	Very low	30.9	Very low	62 Å²	62	164.5 Å²	164.5	64%	0.639	83%	0.825	S	S	*	*			cis	168.9	154	-8.6	0	0	0	0	0	111.1
1421	E	37.1	Very low	31.1	Very low	181 Å²	181	162.9 Å²	162.9	85%	0.846	83%	0.826	S	S	*	*			trans	62.6	161	161.8	-57.3	-159.1	116.4	0	0	118
1422	N	34.3	Very low	31.4	Very low	124 Å²	124	161.8 Å²	161.8	66%	0.663	82%	0.823	S	S	*	*			cis	-165.8	138.9	-38.5	-110.7	-38	0	0	0	106.6
1423	R	34.3	Very low	32.1	Very low	235 Å²	235	165.8 Å²	165.8	89%	0.887	82%	0.824	S	S	*	*			trans	67.5	144.8	173.5	-54.7	169.5	178.1	175.6	-1.9	114.3
1424	E	33.9	Very low	32.5	Very low	270 Å²	270	172 Å²	172	100%	1.262	84%	0.837	S	S	*	*			cis	-94.5	0	9	-61.8	-178.5	131.8	0	0	114.6

Retrieved 1,424 of 1,424 residues in 3341.8 ms (Link to these results)

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