A0A5K4EK18_SCHMA Loading...

Phospholipid-transporting ATPase AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4EK18, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,233 aa.

						>A0A5K4EK18_SCHMA|A0A5K4EK18
MIPQDVTEVRPDYTEMKSRNSNPSHPVTESCRIIQVNKPQLVNYCKNNISTAKYNFLTFIPKFVTEQFRRYANIFFLVIALLQQIPGVSPTGRFTTLVPLCIILTVSAIKEVIEDFRRHRADDATNNEETLVLRNHVWVKICWKDLEVGDLVKVLSNEGIPADLVLLASSEPQAMCYIETSNLDGETNLKLRQGLPVTTHLLTAGELSSFDAVVECEPPNRKLDEFVGVIRTADGIAHPLNPTQLILRGASLKNTKWIFGLTVYTGKESKVMLNSTAAPLKRSTVERQTNTYILCLFGVLLFLTFFTFIANLVWTSWNEKKMWYLQENVDTRSDLRRLLDFITCLILYNTIIPISLPVMLEVVRFIQALYINWVNETTLRYAINMLITSFIMYHTMVPISLQVCLEVVRLVQALLLSCDLDMYDSDSDTPAMARTSNLNEELGQVRYIFSDKTGTLTRNVMEFKRCSIGGIMYGNGTEDSNALEDQNLINKLNAGDLLVDQFFTILAVCHTVVPERSVNENNTNNNNDNINNNVAVFCNDNLNNEQLINYQASSPDEAALVKAARTMGYVFTTRTPTEVVVKIRGVEKHYGILHVLDFTSFRKRMGVVVREPNGRISVMVKGADTVIFERLASTSLFAQSTMDHLENFAKTGLRTLCIAWTEVDPAFYNKWVANFYKASTALNDREAKLELVANEIEQNLQLLGATAIEDKLQTGVPHTISNLMRAGISIWVLTGDKQETAINIGYSCQLLTQSISLLTMNTKSLDQTREQLVNLIEDFGDRIRMENDFALIVDGQTLEFALLCECREQFLDVALSCKSVICCRVSPWQKAQLVKLVRQSIKDAVTLAIGDGANDVGMIQAAHVGVGISGMEGRQAACASDYAIAQFRFLNKLLLVHGAWNYNRLTKLILYSFYKNVCLYLIQFWFAILSGFSGQIVFERWSIGLYNVIFTAAPPMALGLFDRSCSVNNCLKYPELYKDTQASASFNPKVFFCWIFNSIYHSSLLFWIPLLAFSVGTVYANGQTSSLLVLGNSVYTYVVVTVCLKAGLEHTAWTWLSHLAIWGSIGCWFLFLTIYPHVYPTLPLASDMVGMDFAVYGCGIFWFGFLLIPMIALTRDIAWKMAKRVTAGSLREQVMQMEQMQVDPGRLIRASIRPKSTDRSAFVRIMRRSMGSQALLNLCLGASVRTNTASPTPITDSRQTDHGYAFSQEEHGAVSQSQLIRAYDSTRRKPDGR
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.9	Very low	33.9	Very low	247 Å²	247	151.7 Å²	151.7	100%	1.217	80%	0.804	S	S	*	*				0	94.8	0	-88.5	173.2	166.1	0	0	108.1
2	I	35.3	Very low	33.3	Very low	144 Å²	144	150.8 Å²	150.8	74%	0.738	80%	0.8	S	S	*	*			trans	27.6	105.7	161.5	-41.4	175.7	0	0	0	118.6	Q4	I2-Q4 HydrophobicContact CG2-CG 4.11Å
3	P	40.9	Very low	33.1	Very low	132 Å²	132	155.7 Å²	155.7	86%	0.857	80%	0.803	S	S	*	*			trans	-100.3	119.9	150.7	33	-20	0	0	0	109.5
4	Q	38.1	Very low	32.8	Very low	161 Å²	161	153.3 Å²	153.3	75%	0.752	80%	0.799	S	S	*	*			trans	-105.4	131.9	175.6	-103.1	179.3	-29.8	0	0	111	I2	I2-Q4 HydrophobicContact CG2-CG 4.11Å
5	D	34.3	Very low	32.5	Very low	123 Å²	123	155.9 Å²	155.9	66%	0.658	81%	0.806	S	S	*	*			trans	84.4	86.3	144.7	-54.7	-19.7	0	0	0	120
6	V	32.9	Very low	32.4	Very low	150 Å²	150	157.8 Å²	157.8	91%	0.909	81%	0.813	S	S	*	*			trans	-73.3	108.4	143	175.4	0	0	0	0	107.4
7	T	32.7	Very low	32.3	Very low	119 Å²	119	161.2 Å²	161.2	73%	0.73	82%	0.82	S	S	*	*			trans	-106.2	125.3	169.1	38.2	0	0	0	0	111
8	E	29.7	Very low	32.1	Very low	155 Å²	155	158.5 Å²	158.5	72%	0.724	82%	0.818	S	S	*	*			trans	-48.2	127.8	170.8	-62.4	175	147.5	0	0	111.9	R10	E8-R10 VanDerWaalsContact C-N 3.32Å; E8-R10 PolarHBondContact O-N 3.04Å; E8-R10 VanDerWaalsContact O-N 3.13Å; E8-R10 IonicContact OE2-NE 3.23Å
9	V	31	Very low	32	Very low	144 Å²	144	162.7 Å²	162.7	87%	0.873	82%	0.823	S	S	*	*			trans	-81.5	86.9	161.5	-179.6	0	0	0	0	107.3
10	R	28.3	Very low	32.1	Very low	191 Å²	191	162.9 Å²	162.9	72%	0.721	83%	0.826	S	S	*	*			trans	-68.6	136.6	153.8	-71.2	-179.9	-179.8	-171.5	-3.2	107.8	E8 D12	E8-R10 VanDerWaalsContact C-N 3.32Å; E8-R10 PolarHBondContact O-N 3.04Å; E8-R10 VanDerWaalsContact O-N 3.13Å; E8-R10 IonicContact OE2-NE 3.23Å; R10-D12 PolarHBondContact O-N 2.92Å
11	P	35.2	Very low	32	Very low	103 Å²	103	160.6 Å²	160.6	67%	0.669	83%	0.825	S	S	*	*			trans	-76.5	111.3	160.9	29.7	-25.5	0	0	0	107.8	Y13	P11-Y13 HydrophobicContact CB-CD2 4.47Å; P11-Y13 HydrophobicContact CB-CE2 4.28Å; P11-Y13 PolarHBondContact O-N 3Å
12	D	26.9	Very low	32	Very low	140 Å²	140	156.2 Å²	156.2	75%	0.749	81%	0.806	S	S	*	*			trans	-53.8	118.1	167.8	-78.6	-40.4	0	0	0	110.6	R10	R10-D12 PolarHBondContact O-N 2.92Å
13	Y	30.5	Very low	31.9	Very low	215 Å²	215	155.5 Å²	155.5	84%	0.843	81%	0.811	S	S	*	*			trans	-129.2	71.2	160.9	-77.9	-80.2	0	0	0	108.5	P11	P11-Y13 HydrophobicContact CB-CD2 4.47Å; P11-Y13 HydrophobicContact CB-CE2 4.28Å; P11-Y13 PolarHBondContact O-N 3Å
14	T	28.2	Very low	31.4	Very low	122 Å²	122	154 Å²	154	75%	0.748	80%	0.804	S	S	*	*			trans	-144.4	136.2	162.4	18.8	0	0	0	0	106.8
15	E	29.2	Very low	31.2	Very low	192 Å²	192	154.8 Å²	154.8	90%	0.897	81%	0.807	S	S	*	*			trans	86.6	82.8	178.6	-53.6	-171.2	157.6	0	0	117.5
16	M	29.9	Very low	31	Very low	187 Å²	187	155 Å²	155	92%	0.921	82%	0.815	S	S	*	*			trans	-167.6	89.9	134.4	-106.5	-173.9	-162.4	0	0	110
17	K	31.5	Very low	31.1	Very low	216 Å²	216	153.2 Å²	153.2	94%	0.939	80%	0.804	S	S	*	*			trans	168.4	74.5	144	-92.4	167.7	-176.4	-176.5	0	111.5
18	S	28.4	Very low	31.3	Very low	112 Å²	112	151.8 Å²	151.8	78%	0.783	80%	0.795	S	S	*	*			trans	-114.6	94.7	155.8	63	0	0	0	0	108.2
19	R	30.1	Very low	32.4	Very low	239 Å²	239	154.2 Å²	154.2	90%	0.902	81%	0.807	S	S	*	*			trans	169.2	92.3	158.1	-97.3	162.1	-174	-171	3	110.5
20	N	33.6	Very low	34	Very low	165 Å²	165	151.8 Å²	151.8	88%	0.882	80%	0.796	S	S	*	*				172.2	102.4	126	-91.6	-6.3	0	0	0	109.3
21	S	31	Very low	36.4	Very low	115 Å²	115	145 Å²	145	80%	0.804	78%	0.777	S	S	*	*			trans	-75.3	116.2	173	48.2	0	0	0	0	110.9
22	N	33.6	Very low	38.9	Very low	156 Å²	156	140.9 Å²	140.9	83%	0.834	75%	0.748	S	S	*	*			trans	-137.3	120.1	149.4	-100	-10.7	0	0	0	107.1	S24	N22-S24 PolarHBondContact O-N 3.16Å
23	P	33.7	Very low	41.9	Very low	129 Å²	129	137.6 Å²	137.6	84%	0.838	73%	0.73	S	S	*	*			trans	-95.2	96.3	-169.3	35	-29.1	0	0	0	111.1
24	S	31.5	Very low	44.8	Very low	100 Å²	100	127.4 Å²	127.4	70%	0.699	69%	0.69	S	S	*	*	S	Bend	trans	-161.2	115.1	157.4	53.7	0	0	0	0	109.3	N22	N22-S24 PolarHBondContact O-N 3.16Å
25	H	33.9	Very low	47.7	Very low	177 Å²	177	123.8 Å²	123.8	82%	0.819	67%	0.665	S	S	*	*			trans	98.8	100	-177.3	-61	-70.5	0	0	0	117.1
26	P	29.8	Very low	50.5	Low	127 Å²	127	114.7 Å²	114.7	83%	0.825	62%	0.622	S	S	*	*			trans	-95.9	108.4	163.4	33.7	-21.4	0	0	0	109.6
27	V	34.7	Very low	53.2	Low	114 Å²	114	109.2 Å²	109.2	69%	0.691	60%	0.597	S	S	*	*			trans	-137.9	96.8	171.2	-177.5	0	0	0	0	109.6
28	T	36.4	Very low	55.7	Low	88 Å²	88	103.3 Å²	103.3	54%	0.54	57%	0.571	S	S	.	*			trans	36.9	100	146.3	45.8	0	0	0	0	119.7	S30	T28-S30 VanDerWaalsContact C-N 3.27Å; T28-S30 PolarHBondContact O-N 3.44Å
29	E	53.5	Low	58.3	Low	207 Å²	207	103.5 Å²	103.5	97%	0.967	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	3.2	165.3	-76.6	-174.6	156	0	0	114.2
30	S	64.1	Low	61.1	Low	93 Å²	93	94.3 Å²	94.3	65%	0.65	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-14.7	-172.3	55.6	0	0	0	0	116.1	T28	T28-S30 VanDerWaalsContact C-N 3.27Å; T28-S30 PolarHBondContact O-N 3.44Å
31	C	77.9	Confident	63.4	Low	48 Å²	48	93.6 Å²	93.6	32%	0.324	53%	0.533	S	S	.	.			trans	-148.6	143.9	-172.2	-178.1	0	0	0	0	111.4	C216	C31-C216 PolarHBondContact SG-O 3.34Å
32	R	88.6	Confident	66	Low	16 Å²	16	92.1 Å²	92.1	6%	0.06	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	126.6	173.8	-178	-177.9	-172.1	123	-12.2	109.5	I34 Y44 V148 E215 C216 V263 E268	R32-I34 HydrophobicContact CG-CD1 4.48Å; R32-I34 HydrophobicContact CG-CG1 4.23Å; R32-Y44 HydrophobicContact CG-CE1 4.02Å; R32-V148 VanDerWaalsContact NH2-CG2 3.27Å; R32-E215 WeakPolarHBondContact O-CA 3.43Å; R32-C216 PolarHBondContact N-O 3.01Å; R32-C216 PolarHBondContact O-N 3.24Å; R32-V263 VanDerWaalsContact CZ-O 3.3Å; R32-V263 PolarHBondContact NE-O 3.13Å; R32-V263 PolarHBondContact NH2-O 3.07Å; R32-E268 IonicContact CZ-OE2 3.76Å; R32-E268 IonicContact NH1-OE1 3.87Å; R32-E268 IonicContact NH1-OE2 2.78Å; R32-E268 PolarHBondContact NH1-OE2 3.43Å; R32-E268 IonicContact NH2-OE2 3.92Å; R32-E268 PolarHBondContact NH2-OE2 2.91Å; R32-E268 VanDerWaalsContact NH2-OE2 3.1Å
33	I	90	Very high	68.4	Low	72 Å²	72	92.6 Å²	92.6	37%	0.369	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	125	-178.5	-54.4	177.5	0	0	0	109.1	Y44 V213 V214 E215	I33-Y44 PolarHBondContact O-OH 3.04Å; I33-V213 HydrophobicContact CG2-CG1 3.64Å; I33-V214 CarbonylContact C-O 3.47Å; I33-V214 WeakPolarHBondContact CA-O 3.47Å; I33-E215 HydrophobicContact CG1-CG 4.38Å
34	I	91.1	Very high	71.1	Confident	0 Å²	0	89 Å²	89	0%	0	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	126.3	-177.9	-55.3	174.8	0	0	0	108.7	R32 V148 V214 V263	R32-I34 HydrophobicContact CG-CD1 4.48Å; R32-I34 HydrophobicContact CG-CG1 4.23Å; I34-V148 HydrophobicContact CD1-CG1 3.76Å; I34-V148 HydrophobicContact CG1-CG1 3.96Å; I34-V148 HydrophobicContact CG2-CG1 4.13Å; I34-V214 HydrophobicContact CB-CB 4.36Å; I34-V214 PolarHBondContact N-O 3.42Å; I34-V214 PolarHBondContact O-N 3.31Å; I34-V263 HydrophobicContact CD1-CB 4.02Å; I34-V263 HydrophobicContact CD1-CG1 3.68Å; I34-V263 HydrophobicContact CD1-CG2 4.11Å
35	Q	90.1	Very high	73.7	Confident	46 Å²	46	86.3 Å²	86.3	22%	0.215	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	129.4	177.3	-59	-174.7	-26.7	0	0	110.2	K38 P39 Q40	Q35-K38 HydrophobicContact CB-CB 3.87Å; Q35-P39 PolarHBondContact OE1-O 2.82Å; Q35-Q40 PolarHBondContact O-NE2 3.18Å
36	V	87.6	Confident	76.5	Confident	1 Å²	1	84.7 Å²	84.7	1%	0.006	46%	0.462	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	138.4	177.1	-174.1	0	0	0	0	109.5	K38 L151 F210 A212 L261	V36-K38 PolarHBondContact O-N 2.89Å; V36-L151 HydrophobicContact CG1-CD1 4.38Å; V36-L151 HydrophobicContact CG1-CD2 4.24Å; V36-L151 HydrophobicContact CG1-CG 4.49Å; V36-F210 HydrophobicContact CG1-CD1 4.2Å; V36-A212 HydrophobicContact CB-CB 4.37Å; V36-A212 WeakPolarHBondContact CB-O 3.43Å; V36-A212 HydrophobicContact CG2-CB 4.04Å; V36-A212 WeakPolarHBondContact CG2-O 3.5Å; V36-A212 PolarHBondContact N-O 3.25Å; V36-L261 HydrophobicContact CG1-CD1 4.26Å; V36-L261 HydrophobicContact CG2-CD1 3.89Å; V36-L261 HydrophobicContact CG2-CD2 3.61Å; V36-L261 HydrophobicContact CG2-CG 4.4Å
37	N	85.2	Confident	79.5	Confident	73 Å²	73	78.6 Å²	78.6	39%	0.39	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	57	17.4	179.9	-68.5	-41	0	0	0	115.4	L151 L207 S208 F210	N37-L151 WeakPolarHBondContact OD1-CD1 3.46Å; N37-L207 PolarHBondContact ND2-O 3.29Å; N37-S208 PolarHBondContact ND2-O 3.29Å; N37-F210 PolarHBondContact ND2-O 2.91Å
38	K	84.5	Confident	82.1	Confident	92 Å²	92	77.2 Å²	77.2	40%	0.4	41%	0.412	S	S	.	.	S	Bend	trans	-130.7	151	178	-73.4	171.6	-178	149.8	0	110.6	Q35 V36 Q40 D211	Q35-K38 HydrophobicContact CB-CB 3.87Å; V36-K38 PolarHBondContact O-N 2.89Å; K38-Q40 PolarHBondContact O-N 3.47Å; K38-Q40 PolarHBondContact O-NE2 3.39Å; K38-D211 WeakPolarHBondContact CE-OD1 3.44Å; K38-D211 IonicContact NZ-OD1 3.98Å; K38-D211 PolarHBondContact NZ-OD1 3.18Å; K38-D211 IonicContact NZ-OD2 2.95Å; K38-D211 PolarHBondContact NZ-OD2 3.33Å
39	P	84.4	Confident	84.4	Confident	115 Å²	115	74.1 Å²	74.1	75%	0.747	39%	0.391	S	S	*	.			trans	-62.6	133.5	174.6	26.3	-33.6	0	0	0	110.4	Q35	Q35-P39 PolarHBondContact OE1-O 2.82Å
40	Q	88.7	Confident	85.7	Confident	46 Å²	46	67.6 Å²	67.6	22%	0.215	37%	0.369	C	S	.	.			trans	-67.6	137.5	179.5	-56	-51.1	-40.5	0	0	111	Q35 K38 V42 Y44 V148	Q35-Q40 PolarHBondContact O-NE2 3.18Å; K38-Q40 PolarHBondContact O-N 3.47Å; K38-Q40 PolarHBondContact O-NE2 3.39Å; Q40-V42 VanDerWaalsContact C-N 3.27Å; Q40-V42 PolarHBondContact O-N 2.99Å; Q40-Y44 HydrophobicContact CB-CD2 4.17Å; Q40-Y44 HydrophobicContact CB-CE2 3.97Å; Q40-Y44 HydrophobicContact CG-CD2 4.16Å; Q40-Y44 HydrophobicContact CG-CE2 4.04Å; Q40-V148 WeakPolarHBondContact CG-O 3.4Å
41	L	81.8	Confident	86.3	Confident	151 Å²	151	67.2 Å²	67.2	79%	0.791	36%	0.362	S	S	*	.	S	Bend	trans	-74.3	-19	177.7	-62.9	172.8	0	0	0	113
42	V	85.1	Confident	86.1	Confident	83 Å²	83	65.9 Å²	65.9	50%	0.503	36%	0.355	S	S	.	.	S	Bend	trans	-116	137.7	-177.5	-178.8	0	0	0	0	109.2	Q40 Y44	Q40-V42 VanDerWaalsContact C-N 3.27Å; Q40-V42 PolarHBondContact O-N 2.99Å; V42-Y44 HydrophobicContact CB-CE1 4.36Å; V42-Y44 HydrophobicContact CB-CE2 4.27Å; V42-Y44 HydrophobicContact CG1-CE1 4.21Å; V42-Y44 WeakPolarHBondContact O-CD2 3.41Å; V42-Y44 PolarHBondContact O-N 3.13Å
43	N	84.6	Confident	85.5	Confident	167 Å²	167	68.2 Å²	68.2	89%	0.893	37%	0.366	S	S	*	.			trans	-77.7	103.3	173.8	-72.3	-20.7	0	0	0	110.2
44	Y	88.9	Confident	85	Confident	53 Å²	53	65.2 Å²	65.2	21%	0.208	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-83.3	166.2	175	-63.8	-67.4	0	0	0	112.6	R32 I33 Q40 V42 V148	R32-Y44 HydrophobicContact CG-CE1 4.02Å; I33-Y44 PolarHBondContact O-OH 3.04Å; Q40-Y44 HydrophobicContact CB-CD2 4.17Å; Q40-Y44 HydrophobicContact CB-CE2 3.97Å; Q40-Y44 HydrophobicContact CG-CD2 4.16Å; Q40-Y44 HydrophobicContact CG-CE2 4.04Å; V42-Y44 HydrophobicContact CB-CE1 4.36Å; V42-Y44 HydrophobicContact CB-CE2 4.27Å; V42-Y44 HydrophobicContact CG1-CE1 4.21Å; V42-Y44 WeakPolarHBondContact O-CD2 3.41Å; V42-Y44 PolarHBondContact O-N 3.13Å; Y44-V148 HydrophobicContact CD2-CB 3.61Å; Y44-V148 HydrophobicContact CD2-CG1 3.67Å; Y44-V148 HydrophobicContact CD2-CG2 4.08Å; Y44-V148 HydrophobicContact CE2-CB 4.29Å; Y44-V148 HydrophobicContact CE2-CG1 3.83Å; Y44-V148 HydrophobicContact CG-CB 3.93Å; Y44-V148 HydrophobicContact CG-CG1 4.13Å; Y44-V148 HydrophobicContact CG-CG2 3.84Å
45	C	87.8	Confident	84.8	Confident	43 Å²	43	70.3 Å²	70.3	29%	0.291	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-71.7	146.7	177.1	72.4	0	0	0	0	111.9	T265	C45-T265 PolarHBondContact O-OG1 3.44Å; C45-T265 PolarHBondContact SG-O 3.21Å
46	K	90.9	Very high	84.4	Confident	143 Å²	143	76.9 Å²	76.9	62%	0.622	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-71.3	156.1	173.9	-65.2	-167.4	174	-163.3	0	111	N48	K46-N48 PolarHBondContact O-N 3.36Å; K46-N48 VanDerWaalsContact O-N 3.13Å
47	N	92.6	Very high	84.4	Confident	0 Å²	0	83.7 Å²	83.7	0%	0	44%	0.441	C	S	.	.	S	Bend	trans	-78.9	8.9	-177.3	-163	43.3	0	0	0	115.2	W143 L146 P161 R248 T265 G266	N47-W143 WeakPolarHBondContact CB-O 3.24Å; N47-W143 PolarHBondContact ND2-O 3.14Å; N47-L146 HydrophobicContact CB-CB 4.19Å; N47-L146 WeakPolarHBondContact CB-O 3.31Å; N47-P161 PolarHBondContact ND2-O 3.44Å; N47-R248 PolarHBondContact O-NH1 3.43Å; N47-R248 PolarHBondContact OD1-NH1 3.36Å; N47-T265 HydrophobicContact CB-CG2 4.17Å; N47-G266 PolarHBondContact OD1-N 3.47Å
48	N	90	Very high	84.5	Confident	85 Å²	85	82.4 Å²	82.4	46%	0.455	44%	0.436	S	S	.	.			trans	-69.2	124.7	176.8	-177.3	1.2	0	0	0	112	K46 N126 K144	K46-N48 PolarHBondContact O-N 3.36Å; K46-N48 VanDerWaalsContact O-N 3.13Å; N48-N126 PolarHBondContact OD1-ND2 3.26Å; N48-K144 HydrophobicContact CB-CB 4.32Å
49	I	84.8	Confident	84.7	Confident	22 Å²	22	80 Å²	80	11%	0.113	43%	0.425	C	S	.	.			trans	-102.1	139.2	172.1	-65.8	-177.1	0	0	0	109.9	N126 M272	I49-N126 PolarHBondContact N-OD1 3.5Å; I49-N126 PolarHBondContact O-ND2 3.03Å; I49-M272 HydrophobicContact CD1-CE 4.28Å; I49-M272 HydrophobicContact CD1-CG 3.74Å; I49-M272 HydrophobicContact CD1-SD 3.57Å; I49-M272 VanDerWaalsContact CD1-SD 3.57Å; I49-M272 HydrophobicContact CG1-CG 4.25Å; I49-M272 HydrophobicContact CG1-SD 4.19Å; I49-M272 HydrophobicContact CG2-SD 4.02Å
50	S	81.4	Confident	84.9	Confident	70 Å²	70	80 Å²	80	49%	0.49	42%	0.418	S	S	.	.			trans	-137.6	123.3	168.7	-176.1	0	0	0	0	110.6	D122	S50-D122 WeakPolarHBondContact CA-OD2 3.4Å
51	T	75.4	Confident	85	Confident	85 Å²	85	81.1 Å²	81.1	52%	0.521	43%	0.429	S	S	.	.			trans	-96.4	-4.3	171.6	67.2	0	0	0	0	112.4	D122	T51-D122 WeakPolarHBondContact CB-OD1 3.32Å; T51-D122 WeakPolarHBondContact CG2-OD1 3.23Å; T51-D122 VanDerWaalsContact N-CG 3.31Å; T51-D122 PolarHBondContact N-OD1 3.02Å; T51-D122 PolarHBondContact N-OD2 2.99Å; T51-D122 VanDerWaalsContact OG1-CG 3.31Å; T51-D122 PolarHBondContact OG1-OD1 2.92Å; T51-D122 PolarHBondContact OG1-OD2 2.75Å
52	A	75.4	Confident	85.3	Confident	21 Å²	21	79 Å²	79	17%	0.174	41%	0.414	C	S	.	.			trans	-61.8	143.9	175.8	0	0	0	0	0	113.1	R118 H119 D122	A52-R118 HydrophobicContact CB-CB 4.45Å; A52-H119 WeakPolarHBondContact CB-CE1 3.45Å; A52-H119 WeakPolarHBondContact CB-NE2 3.22Å; A52-D122 PolarHBondContact N-OD2 3.23Å
53	K	75.6	Confident	85.4	Confident	65 Å²	65	75.7 Å²	75.7	28%	0.283	39%	0.393	S	S	.	.	S	Bend	trans	-77.1	-36.4	177.7	-72.5	-180	-178.6	-178.8	0	111.1	K62 E111 D115	K53-K62 PolarHBondContact O-NZ 3.48Å; K53-E111 IonicContact NZ-OE2 3.16Å; K53-D115 PolarHBondContact N-OD1 3.33Å
54	Y	80.2	Confident	85.5	Confident	8 Å²	8	70.8 Å²	70.8	3%	0.031	37%	0.368	C	S	.	.			trans	-117.7	136.7	-170.9	-45.9	-77.3	0	0	0	110.9	F59 K62 F63 E66 E111 D115 H119	Y54-F59 HydrophobicContact CD1-CD2 4.06Å; Y54-F59 HydrophobicContact CD2-CD2 4.02Å; Y54-F59 HydrophobicContact CD2-CE2 4.43Å; Y54-F59 AromaticContact CG-CD2 3.78Å; Y54-F59 HydrophobicContact CG-CD2 3.78Å; Y54-K62 HydrophobicContact CD1-CB 3.84Å; Y54-K62 HydrophobicContact CD1-CD 4.15Å; Y54-K62 HydrophobicContact CE1-CB 3.77Å; Y54-F63 HydrophobicContact CE1-CB 4.48Å; Y54-E66 PolarHBondContact OH-OE2 3.31Å; Y54-E111 HydrophobicContact CE2-CB 4.15Å; Y54-E111 PolarHBondContact OH-OE2 3.23Å; Y54-D115 WeakPolarHBondContact CB-OD2 3.3Å; Y54-D115 HydrophobicContact CD2-CB 3.9Å; Y54-D115 PolarHBondContact N-OD1 2.75Å; Y54-D115 PolarHBondContact N-OD2 2.87Å; Y54-H119 PolarHBondContact O-NE2 3.15Å; Y54-H119 VanDerWaalsContact O-NE2 3.12Å
55	N	84.9	Confident	85.5	Confident	107 Å²	107	72.4 Å²	72.4	57%	0.572	38%	0.384	S	S	*	.			trans	-99.3	157.7	154.8	-163.1	-1.9	0	0	0	108.6	L57 T58 F59	N55-L57 VanDerWaalsContact C-N 3.27Å; N55-L57 PolarHBondContact O-N 3.14Å; N55-L57 VanDerWaalsContact O-N 3.11Å; N55-T58 WeakPolarHBondContact CA-OG1 3.38Å; N55-T58 HydrophobicContact CB-CG2 4.47Å; N55-T58 PolarHBondContact N-OG1 2.91Å; N55-T58 CarbonylContact O-C 3.49Å; N55-T58 WeakPolarHBondContact O-CA 3.38Å; N55-T58 PolarHBondContact O-N 3.3Å; N55-T58 PolarHBondContact O-OG1 3.46Å; N55-F59 PolarHBondContact O-N 3.13Å
56	F	82.9	Confident	85.2	Confident	184 Å²	184	72.7 Å²	72.7	81%	0.807	38%	0.381	S	S	*	.	H	α-helix	trans	-46.8	-46.7	-175.8	-179.1	-100.5	0	0	0	113.2
57	L	86.6	Confident	84.8	Confident	144 Å²	144	65.9 Å²	65.9	75%	0.754	35%	0.352	S	S	*	.	H	α-helix	trans	-72.7	-30	178.6	-65.8	173.1	0	0	0	113.8	N55	N55-L57 VanDerWaalsContact C-N 3.27Å; N55-L57 PolarHBondContact O-N 3.14Å; N55-L57 VanDerWaalsContact O-N 3.11Å
58	T	88.9	Confident	84.5	Confident	46 Å²	46	68.2 Å²	68.2	28%	0.282	36%	0.362	S	S	.	.	H	α-helix	trans	-90.2	-11	-177.3	63.2	0	0	0	0	113.4	N55 P61 K62	N55-T58 WeakPolarHBondContact CA-OG1 3.38Å; N55-T58 HydrophobicContact CB-CG2 4.47Å; N55-T58 PolarHBondContact N-OG1 2.91Å; N55-T58 CarbonylContact O-C 3.49Å; N55-T58 WeakPolarHBondContact O-CA 3.38Å; N55-T58 PolarHBondContact O-N 3.3Å; N55-T58 PolarHBondContact O-OG1 3.46Å; T58-P61 WeakPolarHBondContact O-CD 3.41Å; T58-P61 WeakPolarHBondContact O-CG 3.38Å; T58-K62 VanDerWaalsContact O-CB 3.28Å; T58-K62 WeakPolarHBondContact O-CB 3.28Å; T58-K62 WeakPolarHBondContact O-CG 3.41Å; T58-K62 PolarHBondContact O-N 3.23Å; T58-K62 VanDerWaalsContact O-N 3.11Å
59	F	88.1	Confident	84.2	Confident	41 Å²	41	72 Å²	72	18%	0.18	37%	0.37	C	S	.	.	H	α-helix	trans	-56.5	-57.8	-177.1	174.3	-106.2	0	0	0	110.8	Y54 N55 K62 F63 A108 E111 V112	Y54-F59 HydrophobicContact CD1-CD2 4.06Å; Y54-F59 HydrophobicContact CD2-CD2 4.02Å; Y54-F59 HydrophobicContact CD2-CE2 4.43Å; Y54-F59 AromaticContact CG-CD2 3.78Å; Y54-F59 HydrophobicContact CG-CD2 3.78Å; N55-F59 PolarHBondContact O-N 3.13Å; F59-K62 PolarHBondContact O-N 3.31Å; F59-F63 HydrophobicContact CE2-CB 4.3Å; F59-F63 HydrophobicContact CE2-CD2 4.44Å; F59-F63 HydrophobicContact CE2-CG 4.46Å; F59-F63 HydrophobicContact CZ-CB 4.38Å; F59-F63 HydrophobicContact CZ-CD2 4.36Å; F59-F63 HydrophobicContact CZ-CG 4.22Å; F59-F63 WeakPolarHBondContact O-CA 3.3Å; F59-F63 WeakPolarHBondContact O-CB 3.15Å; F59-F63 PolarHBondContact O-N 2.87Å; F59-A108 HydrophobicContact CE1-CB 4.49Å; F59-A108 HydrophobicContact CZ-CB 4.06Å; F59-E111 HydrophobicContact CE2-CB 4.35Å; F59-V112 HydrophobicContact CD2-CG2 4.27Å; F59-V112 HydrophobicContact CE1-CG2 4.06Å; F59-V112 HydrophobicContact CE2-CG2 3.54Å; F59-V112 HydrophobicContact CZ-CG2 3.42Å; F59-V112 VanDerWaalsContact CZ-CG2 3.42Å
60	I	89.2	Confident	83.9	Confident	115 Å²	115	73.8 Å²	73.8	59%	0.59	38%	0.375	S	S	*	.	H	α-helix	trans	-57.4	-56.1	-177.4	-58.9	175.8	0	0	0	112.3	K62 F63 V64	I60-K62 PolarHBondContact O-N 3.36Å; I60-F63 PolarHBondContact O-N 3.5Å; I60-V64 HydrophobicContact CG2-CG2 4.23Å; I60-V64 VanDerWaalsContact O-CB 3.32Å; I60-V64 WeakPolarHBondContact O-CB 3.48Å; I60-V64 WeakPolarHBondContact O-CG2 3.19Å; I60-V64 PolarHBondContact O-N 2.9Å
61	P	91.1	Very high	83.9	Confident	71 Å²	71	77.3 Å²	77.3	46%	0.461	38%	0.379	S	S	.	.	H	α-helix	trans	-64.8	-40.1	-176.1	23.3	-33.7	0	0	0	113	T58 T65	T58-P61 WeakPolarHBondContact O-CD 3.41Å; T58-P61 WeakPolarHBondContact O-CG 3.38Å; P61-T65 WeakPolarHBondContact O-CB 3.46Å; P61-T65 PolarHBondContact O-N 2.96Å; P61-T65 VanDerWaalsContact O-N 3.1Å; P61-T65 PolarHBondContact O-OG1 3.02Å
62	K	87.5	Confident	84.1	Confident	105 Å²	105	73.6 Å²	73.6	46%	0.457	36%	0.356	S	S	.	.	H	α-helix	trans	-68.9	-45.4	177.6	-71.9	-178.7	172.3	-179.9	0	111.5	K53 Y54 T58 F59 I60 T65 E66	K53-K62 PolarHBondContact O-NZ 3.48Å; Y54-K62 HydrophobicContact CD1-CB 3.84Å; Y54-K62 HydrophobicContact CD1-CD 4.15Å; Y54-K62 HydrophobicContact CE1-CB 3.77Å; T58-K62 VanDerWaalsContact O-CB 3.28Å; T58-K62 WeakPolarHBondContact O-CB 3.28Å; T58-K62 WeakPolarHBondContact O-CG 3.41Å; T58-K62 PolarHBondContact O-N 3.23Å; T58-K62 VanDerWaalsContact O-N 3.11Å; F59-K62 PolarHBondContact O-N 3.31Å; I60-K62 PolarHBondContact O-N 3.36Å; K62-T65 PolarHBondContact O-N 2.96Å; K62-E66 WeakPolarHBondContact O-CB 3.41Å; K62-E66 PolarHBondContact O-N 3.11Å
63	F	86.6	Confident	84.5	Confident	15 Å²	15	72.7 Å²	72.7	7%	0.066	35%	0.348	C	S	.	.	H	α-helix	trans	-60.6	-48.4	179.1	173.6	-102.3	0	0	0	111.6	Y54 F59 I60 T65 E66 Q67 L104 A108 E111	Y54-F63 HydrophobicContact CE1-CB 4.48Å; F59-F63 HydrophobicContact CE2-CB 4.3Å; F59-F63 HydrophobicContact CE2-CD2 4.44Å; F59-F63 HydrophobicContact CE2-CG 4.46Å; F59-F63 HydrophobicContact CZ-CB 4.38Å; F59-F63 HydrophobicContact CZ-CD2 4.36Å; F59-F63 HydrophobicContact CZ-CG 4.22Å; F59-F63 WeakPolarHBondContact O-CA 3.3Å; F59-F63 WeakPolarHBondContact O-CB 3.15Å; F59-F63 PolarHBondContact O-N 2.87Å; I60-F63 PolarHBondContact O-N 3.5Å; F63-T65 VanDerWaalsContact C-N 3.31Å; F63-T65 PolarHBondContact O-N 3.22Å; F63-E66 PolarHBondContact O-N 3.46Å; F63-E66 VanDerWaalsContact O-N 3.16Å; F63-Q67 HydrophobicContact CD1-CG 4.32Å; F63-Q67 HydrophobicContact CD2-CG 4.09Å; F63-Q67 HydrophobicContact CE1-CG 3.84Å; F63-Q67 HydrophobicContact CE2-CG 3.59Å; F63-Q67 HydrophobicContact CG-CG 4.42Å; F63-Q67 HydrophobicContact CZ-CG 3.44Å; F63-Q67 VanDerWaalsContact CZ-CG 3.44Å; F63-Q67 WeakPolarHBondContact O-CG 3.34Å; F63-Q67 PolarHBondContact O-N 2.87Å; F63-L104 WeakPolarHBondContact CZ-O 3.45Å; F63-A108 HydrophobicContact CD1-CB 4.46Å; F63-A108 HydrophobicContact CE1-CB 3.79Å; F63-A108 HydrophobicContact CE2-CB 4.05Å; F63-A108 VanDerWaalsContact CZ-CA 3.47Å; F63-A108 HydrophobicContact CZ-CB 3.55Å; F63-E111 HydrophobicContact CD2-CB 4.37Å; F63-E111 HydrophobicContact CD2-CG 4.11Å; F63-E111 HydrophobicContact CE2-CB 4.48Å; F63-E111 HydrophobicContact CE2-CG 4.06Å
64	V	87.8	Confident	85.1	Confident	63 Å²	63	73 Å²	73	38%	0.382	35%	0.353	S	S	.	.	H	α-helix	trans	-60	-44.5	177.3	169.5	0	0	0	0	110.4	I60 E66 Q67 F68	I60-V64 HydrophobicContact CG2-CG2 4.23Å; I60-V64 VanDerWaalsContact O-CB 3.32Å; I60-V64 WeakPolarHBondContact O-CB 3.48Å; I60-V64 WeakPolarHBondContact O-CG2 3.19Å; I60-V64 PolarHBondContact O-N 2.9Å; V64-E66 VanDerWaalsContact C-N 3.34Å; V64-E66 PolarHBondContact O-N 3.07Å; V64-Q67 PolarHBondContact O-N 3.47Å; V64-F68 HydrophobicContact CG1-CD2 3.64Å; V64-F68 HydrophobicContact CG1-CE2 3.88Å; V64-F68 VanDerWaalsContact O-CD2 3.25Å; V64-F68 WeakPolarHBondContact O-CD2 3.48Å; V64-F68 PolarHBondContact O-N 2.86Å
65	T	87.8	Confident	85.5	Confident	87 Å²	87	74 Å²	74	53%	0.534	36%	0.357	S	S	.	.	H	α-helix	trans	-61.1	-42.6	175.8	-56.1	0	0	0	0	111.4	P61 K62 F63 R69	P61-T65 WeakPolarHBondContact O-CB 3.46Å; P61-T65 PolarHBondContact O-N 2.96Å; P61-T65 VanDerWaalsContact O-N 3.1Å; P61-T65 PolarHBondContact O-OG1 3.02Å; K62-T65 PolarHBondContact O-N 2.96Å; F63-T65 VanDerWaalsContact C-N 3.31Å; F63-T65 PolarHBondContact O-N 3.22Å; T65-R69 WeakPolarHBondContact O-CG 3.31Å; T65-R69 PolarHBondContact O-N 3.29Å; T65-R69 VanDerWaalsContact O-N 3.12Å
66	E	81.6	Confident	85.6	Confident	50 Å²	50	68.9 Å²	68.9	23%	0.234	33%	0.33	C	S	.	.	H	α-helix	trans	-66.5	-44.2	178.9	-175.2	166.3	177.1	0	0	112.5	Y54 K62 F63 V64 R69	Y54-E66 PolarHBondContact OH-OE2 3.31Å; K62-E66 WeakPolarHBondContact O-CB 3.41Å; K62-E66 PolarHBondContact O-N 3.11Å; F63-E66 PolarHBondContact O-N 3.46Å; F63-E66 VanDerWaalsContact O-N 3.16Å; V64-E66 VanDerWaalsContact C-N 3.34Å; V64-E66 PolarHBondContact O-N 3.07Å; E66-R69 PolarHBondContact O-N 2.88Å
67	Q	83.2	Confident	85.9	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-66.3	-42.8	179.2	-69.6	-57.3	-33.1	0	0	112	F63 V64 R69 R70 N73 L104	F63-Q67 HydrophobicContact CD1-CG 4.32Å; F63-Q67 HydrophobicContact CD2-CG 4.09Å; F63-Q67 HydrophobicContact CE1-CG 3.84Å; F63-Q67 HydrophobicContact CE2-CG 3.59Å; F63-Q67 HydrophobicContact CG-CG 4.42Å; F63-Q67 HydrophobicContact CZ-CG 3.44Å; F63-Q67 VanDerWaalsContact CZ-CG 3.44Å; F63-Q67 WeakPolarHBondContact O-CG 3.34Å; F63-Q67 PolarHBondContact O-N 2.87Å; V64-Q67 PolarHBondContact O-N 3.47Å; Q67-R69 VanDerWaalsContact C-N 3.26Å; Q67-R69 PolarHBondContact O-N 3.34Å; Q67-R70 WeakPolarHBondContact O-CB 3.37Å; Q67-R70 PolarHBondContact O-N 3.14Å; Q67-N73 WeakPolarHBondContact O-CB 3.24Å; Q67-N73 PolarHBondContact O-ND2 3.38Å; Q67-N73 PolarHBondContact OE1-ND2 2.99Å; Q67-L104 HydrophobicContact CB-CD2 3.82Å; Q67-L104 HydrophobicContact CG-CD2 3.96Å
68	F	86.1	Confident	86.1	Confident	49 Å²	49	59.6 Å²	59.6	22%	0.215	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	7.8	177.8	-66.9	-62.9	0	0	0	114	V64 N73 I74 L77 L104	V64-F68 HydrophobicContact CG1-CD2 3.64Å; V64-F68 HydrophobicContact CG1-CE2 3.88Å; V64-F68 VanDerWaalsContact O-CD2 3.25Å; V64-F68 WeakPolarHBondContact O-CD2 3.48Å; V64-F68 PolarHBondContact O-N 2.86Å; F68-N73 HydrophobicContact CD1-CB 4.01Å; F68-N73 HydrophobicContact CE1-CB 4.28Å; F68-I74 HydrophobicContact CB-CG1 4.48Å; F68-I74 WeakPolarHBondContact O-CD1 3.49Å; F68-I74 WeakPolarHBondContact O-CG1 3.28Å; F68-L77 HydrophobicContact CD1-CB 4.34Å; F68-L77 HydrophobicContact CD1-CD2 3.94Å; F68-L77 HydrophobicContact CE1-CB 3.81Å; F68-L77 HydrophobicContact CE1-CD1 4.25Å; F68-L77 HydrophobicContact CE1-CD2 3.76Å; F68-L77 HydrophobicContact CE1-CG 4.15Å; F68-L77 HydrophobicContact CG-CD2 4.47Å; F68-L77 HydrophobicContact CZ-CD1 4.2Å; F68-L77 HydrophobicContact CZ-CD2 4.1Å; F68-L104 HydrophobicContact CZ-CD1 3.98Å
69	R	84	Confident	86.2	Confident	164 Å²	164	57.5 Å²	57.5	62%	0.619	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-9	161.9	-81	173.8	79.7	-172.9	6.9	113	T65 E66 Q67	T65-R69 WeakPolarHBondContact O-CG 3.31Å; T65-R69 PolarHBondContact O-N 3.29Å; T65-R69 VanDerWaalsContact O-N 3.12Å; E66-R69 PolarHBondContact O-N 2.88Å; Q67-R69 VanDerWaalsContact C-N 3.26Å; Q67-R69 PolarHBondContact O-N 3.34Å
70	R	77.5	Confident	86.3	Confident	59 Å²	59	55.8 Å²	55.8	22%	0.223	27%	0.272	C	S	.	.	S	Bend	trans	-89.9	132.8	-180	-59.8	179.9	-179.3	-173.6	0.4	111	Q67 A72 N73 I74 E361	Q67-R70 WeakPolarHBondContact O-CB 3.37Å; Q67-R70 PolarHBondContact O-N 3.14Å; R70-A72 VanDerWaalsContact C-N 3.3Å; R70-A72 PolarHBondContact O-N 2.69Å; R70-N73 HydrophobicContact CB-CB 4.4Å; R70-N73 PolarHBondContact O-N 3.2Å; R70-I74 PolarHBondContact O-N 3.5Å; R70-I74 VanDerWaalsContact O-N 3.14Å; R70-E361 IonicContact CZ-OE1 3.66Å; R70-E361 VanDerWaalsContact NH1-CD 3.3Å; R70-E361 IonicContact NH1-OE1 2.62Å; R70-E361 PolarHBondContact NH1-OE1 3.26Å; R70-E361 IonicContact NH1-OE2 2.66Å; R70-E361 IonicContact NH2-OE1 3.04Å; R70-E361 PolarHBondContact NH2-OE1 2.98Å
71	Y	81.4	Confident	86.4	Confident	145 Å²	145	55.5 Å²	55.5	57%	0.569	27%	0.271	S	S	*	.	H	α-helix	trans	-53.9	-44.2	-178.9	-63	-64.5	0	0	0	113	F75	Y71-F75 WeakPolarHBondContact O-CB 3.46Å; Y71-F75 PolarHBondContact O-N 3.36Å
72	A	80.3	Confident	86.4	Confident	6 Å²	6	54 Å²	54	5%	0.05	26%	0.259	C	S	.	.	H	α-helix	trans	-62.8	-45.1	-179.7	0	0	0	0	0	112.6	R70 F75 F76 P357	R70-A72 VanDerWaalsContact C-N 3.3Å; R70-A72 PolarHBondContact O-N 2.69Å; A72-F75 WeakPolarHBondContact O-CB 3.17Å; A72-F75 PolarHBondContact O-N 2.96Å; A72-F76 HydrophobicContact CB-CE2 4.25Å; A72-F76 WeakPolarHBondContact O-CD2 3.43Å; A72-F76 PolarHBondContact O-N 3.48Å; A72-P357 HydrophobicContact CB-CG 3.93Å
73	N	83.1	Confident	86.6	Confident	2 Å²	2	49 Å²	49	1%	0.011	24%	0.237	C	C	.	.	H	α-helix	trans	-68.3	-39.5	-177.9	-68.7	-8.8	0	0	0	111.7	Q67 F68 R70 F75 F76 L77	Q67-N73 WeakPolarHBondContact O-CB 3.24Å; Q67-N73 PolarHBondContact O-ND2 3.38Å; Q67-N73 PolarHBondContact OE1-ND2 2.99Å; F68-N73 HydrophobicContact CD1-CB 4.01Å; F68-N73 HydrophobicContact CE1-CB 4.28Å; R70-N73 HydrophobicContact CB-CB 4.4Å; R70-N73 PolarHBondContact O-N 3.2Å; N73-F75 VanDerWaalsContact C-N 3.34Å; N73-F76 PolarHBondContact O-N 3.27Å; N73-L77 WeakPolarHBondContact O-CB 3.48Å; N73-L77 PolarHBondContact O-N 3.16Å
74	I	88.6	Confident	86.9	Confident	73 Å²	73	50.9 Å²	50.9	37%	0.374	25%	0.246	S	C	.	.	H	α-helix	trans	-60.6	-47.2	171.9	-65.7	164	0	0	0	110	F68 R70 F76 L77 V78	F68-I74 HydrophobicContact CB-CG1 4.48Å; F68-I74 WeakPolarHBondContact O-CD1 3.49Å; F68-I74 WeakPolarHBondContact O-CG1 3.28Å; R70-I74 PolarHBondContact O-N 3.5Å; R70-I74 VanDerWaalsContact O-N 3.14Å; I74-F76 PolarHBondContact O-N 3.44Å; I74-L77 WeakPolarHBondContact O-CB 3.43Å; I74-L77 PolarHBondContact O-N 3.37Å; I74-V78 HydrophobicContact CG2-CG2 4.37Å; I74-V78 WeakPolarHBondContact O-CG2 3.46Å; I74-V78 PolarHBondContact O-N 3.39Å
75	F	88.1	Confident	86.9	Confident	27 Å²	27	50.9 Å²	50.9	12%	0.118	24%	0.243	C	C	.	.	H	α-helix	trans	-56.8	-49.4	179.8	169.5	-104.9	0	0	0	111.6	Y71 A72 N73 L77 V78 I79 F297 L300 N349 I352	Y71-F75 WeakPolarHBondContact O-CB 3.46Å; Y71-F75 PolarHBondContact O-N 3.36Å; A72-F75 WeakPolarHBondContact O-CB 3.17Å; A72-F75 PolarHBondContact O-N 2.96Å; N73-F75 VanDerWaalsContact C-N 3.34Å; F75-L77 VanDerWaalsContact C-N 3.34Å; F75-L77 PolarHBondContact O-N 3.33Å; F75-V78 PolarHBondContact O-N 3.4Å; F75-I79 HydrophobicContact CD2-CG1 4.38Å; F75-I79 HydrophobicContact CE1-CG1 4.24Å; F75-I79 HydrophobicContact CE2-CD1 3.99Å; F75-I79 HydrophobicContact CE2-CG1 3.92Å; F75-I79 HydrophobicContact CZ-CD1 4.13Å; F75-I79 HydrophobicContact CZ-CG1 3.84Å; F75-I79 WeakPolarHBondContact O-CG1 3.33Å; F75-I79 PolarHBondContact O-N 3.46Å; F75-F297 HydrophobicContact CD2-CD2 4.06Å; F75-F297 AromaticContact CD2-CE2 3.78Å; F75-F297 HydrophobicContact CD2-CE2 3.78Å; F75-F297 AromaticContact CE2-CD2 3.94Å; F75-F297 HydrophobicContact CE2-CD2 3.94Å; F75-F297 AromaticContact CE2-CE2 3.69Å; F75-F297 HydrophobicContact CE2-CE2 3.69Å; F75-L300 HydrophobicContact CE2-CD2 3.83Å; F75-L300 HydrophobicContact CZ-CD2 3.52Å; F75-N349 HydrophobicContact CE1-CB 4.48Å; F75-N349 WeakPolarHBondContact CE1-O 3.27Å; F75-N349 HydrophobicContact CZ-CB 4.12Å; F75-I352 HydrophobicContact CD1-CD1 4.12Å; F75-I352 HydrophobicContact CE1-CB 4.23Å; F75-I352 HydrophobicContact CE1-CD1 3.85Å; F75-I352 HydrophobicContact CE1-CG1 4.44Å; F75-I352 HydrophobicContact CZ-CD1 4.12Å
76	F	87.3	Confident	86.7	Confident	0 Å²	0	52 Å²	52	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-69.6	-29.2	178.6	-64.3	-56.7	0	0	0	113.8	A72 N73 I74 I79 A80 T96 L100 I352 I354	A72-F76 HydrophobicContact CB-CE2 4.25Å; A72-F76 WeakPolarHBondContact O-CD2 3.43Å; A72-F76 PolarHBondContact O-N 3.48Å; N73-F76 PolarHBondContact O-N 3.27Å; I74-F76 PolarHBondContact O-N 3.44Å; F76-I79 PolarHBondContact O-N 3.26Å; F76-A80 VanDerWaalsContact O-CB 3.27Å; F76-A80 WeakPolarHBondContact O-CB 3.45Å; F76-A80 PolarHBondContact O-N 3.48Å; F76-T96 HydrophobicContact CB-CG2 4.12Å; F76-T96 HydrophobicContact CD1-CG2 4.19Å; F76-L100 HydrophobicContact CB-CD1 4.26Å; F76-I352 HydrophobicContact CE2-CG2 4.32Å; F76-I352 HydrophobicContact CZ-CB 4.01Å; F76-I352 HydrophobicContact CZ-CG2 3.83Å; F76-I352 VanDerWaalsContact CZ-O 3.3Å; F76-I352 WeakPolarHBondContact CZ-O 3.22Å; F76-I354 HydrophobicContact CD1-CD1 4.26Å; F76-I354 HydrophobicContact CD1-CG1 3.79Å; F76-I354 HydrophobicContact CD1-CG2 4.4Å; F76-I354 HydrophobicContact CD2-CB 4.35Å; F76-I354 HydrophobicContact CD2-CG1 4.4Å; F76-I354 HydrophobicContact CD2-CG2 3.89Å; F76-I354 HydrophobicContact CE1-CB 4.31Å; F76-I354 HydrophobicContact CE1-CD1 4.24Å; F76-I354 HydrophobicContact CE1-CG1 3.43Å; F76-I354 VanDerWaalsContact CE1-CG1 3.43Å; F76-I354 VanDerWaalsContact CE2-CA 3.46Å; F76-I354 HydrophobicContact CE2-CB 4.08Å; F76-I354 HydrophobicContact CE2-CG1 4.1Å; F76-I354 HydrophobicContact CE2-CG2 4.11Å; F76-I354 HydrophobicContact CG-CG1 4.29Å; F76-I354 HydrophobicContact CG-CG2 4.07Å; F76-I354 HydrophobicContact CZ-CB 4.05Å; F76-I354 HydrophobicContact CZ-CG1 3.6Å; F76-I354 HydrophobicContact CZ-CG2 4.46Å
77	L	89.3	Confident	86.5	Confident	64 Å²	64	53.9 Å²	53.9	34%	0.335	29%	0.285	S	S	.	.	H	α-helix	trans	-62.8	-46.5	170.6	-177.4	65.5	0	0	0	110.8	F68 N73 I74 F75 I79 A80 L81	F68-L77 HydrophobicContact CD1-CB 4.34Å; F68-L77 HydrophobicContact CD1-CD2 3.94Å; F68-L77 HydrophobicContact CE1-CB 3.81Å; F68-L77 HydrophobicContact CE1-CD1 4.25Å; F68-L77 HydrophobicContact CE1-CD2 3.76Å; F68-L77 HydrophobicContact CE1-CG 4.15Å; F68-L77 HydrophobicContact CG-CD2 4.47Å; F68-L77 HydrophobicContact CZ-CD1 4.2Å; F68-L77 HydrophobicContact CZ-CD2 4.1Å; N73-L77 WeakPolarHBondContact O-CB 3.48Å; N73-L77 PolarHBondContact O-N 3.16Å; I74-L77 WeakPolarHBondContact O-CB 3.43Å; I74-L77 PolarHBondContact O-N 3.37Å; F75-L77 VanDerWaalsContact C-N 3.34Å; F75-L77 PolarHBondContact O-N 3.33Å; L77-I79 VanDerWaalsContact C-N 3.34Å; L77-I79 PolarHBondContact O-N 2.81Å; L77-A80 PolarHBondContact O-N 2.9Å; L77-L81 HydrophobicContact CG-CD1 4.43Å; L77-L81 VanDerWaalsContact O-CG 3.31Å; L77-L81 WeakPolarHBondContact O-CG 3.46Å; L77-L81 PolarHBondContact O-N 3.11Å
78	V	91.4	Very high	86.4	Confident	70 Å²	70	54 Å²	54	42%	0.424	29%	0.285	S	S	.	.	H	α-helix	trans	-60	-44.8	176.3	172.7	0	0	0	0	110.6	I74 F75 A80 L81 L82	I74-V78 HydrophobicContact CG2-CG2 4.37Å; I74-V78 WeakPolarHBondContact O-CG2 3.46Å; I74-V78 PolarHBondContact O-N 3.39Å; F75-V78 PolarHBondContact O-N 3.4Å; V78-A80 PolarHBondContact O-N 3.17Å; V78-L81 PolarHBondContact O-N 3.32Å; V78-L82 HydrophobicContact CG1-CD1 4.09Å; V78-L82 HydrophobicContact CG1-CG 4.44Å; V78-L82 WeakPolarHBondContact O-CG 3.49Å; V78-L82 PolarHBondContact O-N 3.35Å
79	I	90.3	Very high	86.4	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-65.3	-40.5	177.2	-58.7	-64.6	0	0	0	111.8	F75 F76 L77 L81 L82 Q83 L345 I346 N349	F75-I79 HydrophobicContact CD2-CG1 4.38Å; F75-I79 HydrophobicContact CE1-CG1 4.24Å; F75-I79 HydrophobicContact CE2-CD1 3.99Å; F75-I79 HydrophobicContact CE2-CG1 3.92Å; F75-I79 HydrophobicContact CZ-CD1 4.13Å; F75-I79 HydrophobicContact CZ-CG1 3.84Å; F75-I79 WeakPolarHBondContact O-CG1 3.33Å; F75-I79 PolarHBondContact O-N 3.46Å; F76-I79 PolarHBondContact O-N 3.26Å; L77-I79 VanDerWaalsContact C-N 3.34Å; L77-I79 PolarHBondContact O-N 2.81Å; I79-L81 VanDerWaalsContact C-N 3.26Å; I79-L81 PolarHBondContact O-N 3.14Å; I79-L82 HydrophobicContact CD1-CD1 4.29Å; I79-L82 PolarHBondContact O-N 3.12Å; I79-Q83 HydrophobicContact CG2-CG 4.28Å; I79-Q83 WeakPolarHBondContact O-CB 3.24Å; I79-Q83 WeakPolarHBondContact O-CG 3.44Å; I79-Q83 PolarHBondContact O-N 3.26Å; I79-L345 HydrophobicContact CD1-CD2 3.94Å; I79-L345 HydrophobicContact CD1-CG 4.22Å; I79-I346 HydrophobicContact CG2-CG1 4.43Å; I79-N349 HydrophobicContact CD1-CB 4.13Å; I79-N349 HydrophobicContact CG1-CB 4.06Å; I79-N349 HydrophobicContact CG2-CB 4.06Å; I79-N349 WeakPolarHBondContact CG2-ND2 3.19Å
80	A	89.5	Confident	86.2	Confident	5 Å²	5	46.7 Å²	46.7	4%	0.041	27%	0.265	C	S	.	.	H	α-helix	trans	-62.2	-35.3	177	0	0	0	0	0	112.2	F76 L77 V78 Q84 T96 L97	F76-A80 VanDerWaalsContact O-CB 3.27Å; F76-A80 WeakPolarHBondContact O-CB 3.45Å; F76-A80 PolarHBondContact O-N 3.48Å; L77-A80 PolarHBondContact O-N 2.9Å; V78-A80 PolarHBondContact O-N 3.17Å; A80-Q84 WeakPolarHBondContact O-CG 3.45Å; A80-Q84 PolarHBondContact O-NE2 2.95Å; A80-Q84 VanDerWaalsContact O-NE2 3.08Å; A80-T96 HydrophobicContact CB-CG2 4.38Å; A80-L97 HydrophobicContact CB-CD1 4.49Å
81	L	92.3	Very high	86.4	Confident	110 Å²	110	44.2 Å²	44.2	58%	0.576	26%	0.256	S	S	*	.	H	α-helix	trans	-68.8	-45	172.3	-68	172.1	0	0	0	111.6	L77 V78 I79 Q83 Q84	L77-L81 HydrophobicContact CG-CD1 4.43Å; L77-L81 VanDerWaalsContact O-CG 3.31Å; L77-L81 WeakPolarHBondContact O-CG 3.46Å; L77-L81 PolarHBondContact O-N 3.11Å; V78-L81 PolarHBondContact O-N 3.32Å; I79-L81 VanDerWaalsContact C-N 3.26Å; I79-L81 PolarHBondContact O-N 3.14Å; L81-Q83 VanDerWaalsContact C-N 3.28Å; L81-Q83 PolarHBondContact O-N 3.06Å; L81-Q84 WeakPolarHBondContact O-CB 3.48Å; L81-Q84 PolarHBondContact O-N 3.17Å
82	L	90.8	Very high	86.6	Confident	39 Å²	39	38.4 Å²	38.4	20%	0.204	24%	0.24	C	C	.	.	H	α-helix	trans	-62	-35.3	176.5	-70.6	174	0	0	0	112.3	V78 I79 Q84 I85 I342 L345 I346	V78-L82 HydrophobicContact CG1-CD1 4.09Å; V78-L82 HydrophobicContact CG1-CG 4.44Å; V78-L82 WeakPolarHBondContact O-CG 3.49Å; V78-L82 PolarHBondContact O-N 3.35Å; I79-L82 HydrophobicContact CD1-CD1 4.29Å; I79-L82 PolarHBondContact O-N 3.12Å; L82-Q84 PolarHBondContact O-N 2.84Å; L82-I85 HydrophobicContact CD2-CD1 4.04Å; L82-I85 WeakPolarHBondContact O-CB 3.25Å; L82-I85 WeakPolarHBondContact O-CG1 3.3Å; L82-I85 PolarHBondContact O-N 3.02Å; L82-I85 VanDerWaalsContact O-N 3.17Å; L82-I342 HydrophobicContact CB-CG2 4.23Å; L82-I342 HydrophobicContact CD1-CG2 4.38Å; L82-I342 HydrophobicContact CD2-CG2 4.23Å; L82-L345 HydrophobicContact CD1-CD2 3.89Å; L82-I346 HydrophobicContact CB-CD1 4.32Å
83	Q	90.7	Very high	86.9	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.005	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-13.8	175.3	-77	-175.1	-29.7	0	0	114	I79 L81 I85 T91 T95 T96 I346	I79-Q83 HydrophobicContact CG2-CG 4.28Å; I79-Q83 WeakPolarHBondContact O-CB 3.24Å; I79-Q83 WeakPolarHBondContact O-CG 3.44Å; I79-Q83 PolarHBondContact O-N 3.26Å; L81-Q83 VanDerWaalsContact C-N 3.28Å; L81-Q83 PolarHBondContact O-N 3.06Å; Q83-I85 VanDerWaalsContact C-N 3.32Å; Q83-T91 PolarHBondContact NE2-OG1 3.3Å; Q83-T95 PolarHBondContact NE2-OG1 3.1Å; Q83-T96 PolarHBondContact NE2-OG1 2.88Å; Q83-T96 VanDerWaalsContact NE2-OG1 3.07Å; Q83-T96 PolarHBondContact OE1-OG1 2.93Å; Q83-I346 HydrophobicContact CG-CD1 4.06Å; Q83-I346 HydrophobicContact CG-CG1 4.36Å; Q83-I346 HydrophobicContact CG-CG2 3.89Å
84	Q	92.9	Very high	87.1	Confident	53 Å²	53	49.6 Å²	49.6	25%	0.248	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-13	175.3	-56.8	-44.7	-49.3	0	0	113.5	A80 L81 L82 R93	A80-Q84 WeakPolarHBondContact O-CG 3.45Å; A80-Q84 PolarHBondContact O-NE2 2.95Å; A80-Q84 VanDerWaalsContact O-NE2 3.08Å; L81-Q84 WeakPolarHBondContact O-CB 3.48Å; L81-Q84 PolarHBondContact O-N 3.17Å; L82-Q84 PolarHBondContact O-N 2.84Å; Q84-R93 PolarHBondContact NE2-O 3.48Å; Q84-R93 VanDerWaalsContact OE1-NH2 3.1Å
85	I	88.1	Confident	86.9	Confident	63 Å²	63	46.7 Å²	46.7	32%	0.323	27%	0.27	S	S	.	.	S	Bend	trans	-70.6	123.3	179.1	-55.2	173.7	0	0	0	108.8	L82 Q83 V88 L339	L82-I85 HydrophobicContact CD2-CD1 4.04Å; L82-I85 WeakPolarHBondContact O-CB 3.25Å; L82-I85 WeakPolarHBondContact O-CG1 3.3Å; L82-I85 PolarHBondContact O-N 3.02Å; L82-I85 VanDerWaalsContact O-N 3.17Å; Q83-I85 VanDerWaalsContact C-N 3.32Å; I85-V88 HydrophobicContact CB-CB 4.39Å; I85-V88 HydrophobicContact CB-CG2 3.94Å; I85-V88 HydrophobicContact CG2-CB 4.5Å; I85-V88 HydrophobicContact CG2-CG2 3.55Å; I85-L339 HydrophobicContact CG2-CD2 4.26Å
86	P	83.6	Confident	86.7	Confident	111 Å²	111	45.5 Å²	45.5	72%	0.721	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	137.2	-176.8	26.3	-33.9	0	0	0	111.3	V88	P86-V88 VanDerWaalsContact C-N 3.33Å; P86-V88 PolarHBondContact O-N 3.02Å
87	G	77.4	Confident	86.7	Confident	89 Å²	89	48.4 Å²	48.4	92%	0.918	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.7	-3.5	176.3	0	0	0	0	0	116.3
88	V	82.1	Confident	86.5	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.012	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-40.4	-173.9	-174.5	0	0	0	0	113.4	I85 P86 P90 L339 I342 T343 I346	I85-V88 HydrophobicContact CB-CB 4.39Å; I85-V88 HydrophobicContact CB-CG2 3.94Å; I85-V88 HydrophobicContact CG2-CB 4.5Å; I85-V88 HydrophobicContact CG2-CG2 3.55Å; P86-V88 VanDerWaalsContact C-N 3.33Å; P86-V88 PolarHBondContact O-N 3.02Å; V88-P90 VanDerWaalsContact O-CD 3.28Å; V88-P90 WeakPolarHBondContact O-CD 3.16Å; V88-L339 HydrophobicContact CG2-CB 4.15Å; V88-L339 HydrophobicContact CG2-CD2 3.27Å; V88-L339 HydrophobicContact CG2-CG 4.16Å; V88-I342 HydrophobicContact CG1-CB 3.72Å; V88-I342 HydrophobicContact CG1-CG2 3.49Å; V88-I342 VanDerWaalsContact CG1-CG2 3.49Å; V88-T343 WeakPolarHBondContact CG1-OG1 3.35Å; V88-T343 WeakPolarHBondContact O-CB 3.32Å; V88-T343 PolarHBondContact O-OG1 3.06Å; V88-I346 HydrophobicContact CG1-CD1 4.09Å
89	S	85	Confident	85.7	Confident	25 Å²	25	44.8 Å²	44.8	18%	0.175	26%	0.26	C	S	.	.			trans	-79.4	114.8	-170.5	-175.5	0	0	0	0	111.9	T91 G92	S89-T91 VanDerWaalsContact C-N 3.27Å; S89-T91 PolarHBondContact O-N 3.49Å; S89-G92 PolarHBondContact O-N 2.85Å; S89-G92 PolarHBondContact OG-N 2.98Å; S89-G92 PolarHBondContact OG-O 2.83Å
90	P	80.2	Confident	85.3	Confident	36 Å²	36	44.9 Å²	44.9	23%	0.234	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-23.9	177	30.3	-32.3	0	0	0	111.8	V88 T343 I346 L347 G934 I936	V88-P90 VanDerWaalsContact O-CD 3.28Å; V88-P90 WeakPolarHBondContact O-CD 3.16Å; P90-T343 HydrophobicContact CG-CG2 4.19Å; P90-I346 HydrophobicContact CG-CG2 4.49Å; P90-L347 HydrophobicContact CG-CD1 4.16Å; P90-G934 WeakPolarHBondContact CB-O 3.39Å; P90-I936 HydrophobicContact CB-CG2 4.23Å; P90-I936 WeakPolarHBondContact O-CD1 3Å
91	T	82.7	Confident	85.1	Confident	7 Å²	7	47.7 Å²	47.7	4%	0.043	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	6.4	-178	59	0	0	0	0	113	Q83 S89 T95 I936 R940 I943	Q83-T91 PolarHBondContact NE2-OG1 3.3Å; S89-T91 VanDerWaalsContact C-N 3.27Å; S89-T91 PolarHBondContact O-N 3.49Å; T91-T95 WeakPolarHBondContact CB-OG1 3.38Å; T91-T95 WeakPolarHBondContact O-CB 3.21Å; T91-T95 WeakPolarHBondContact O-CG2 3.11Å; T91-T95 PolarHBondContact O-OG1 2.95Å; T91-T95 PolarHBondContact OG1-OG1 2.86Å; T91-T95 VanDerWaalsContact OG1-OG1 3.08Å; T91-I936 HydrophobicContact CG2-CG2 4.21Å; T91-R940 WeakPolarHBondContact O-CB 3.47Å; T91-I943 HydrophobicContact CG2-CD1 4.36Å
92	G	84.3	Confident	84.3	Confident	22 Å²	22	46 Å²	46	23%	0.227	27%	0.271	C	S	.	.			trans	79	-178.9	-175.2	0	0	0	0	0	114.5	S89 T95	S89-G92 PolarHBondContact O-N 2.85Å; S89-G92 PolarHBondContact OG-N 2.98Å; S89-G92 PolarHBondContact OG-O 2.83Å; G92-T95 PolarHBondContact O-OG1 2.96Å
93	R	87.8	Confident	83.5	Confident	134 Å²	134	44.6 Å²	44.6	51%	0.506	26%	0.263	S	S	.	.	S	Bend	trans	-85.9	-23.5	-166.9	-62.6	179.6	67.8	162.8	4.6	115.1	Q84	Q84-R93 PolarHBondContact NE2-O 3.48Å; Q84-R93 VanDerWaalsContact OE1-NH2 3.1Å
94	F	87.1	Confident	83	Confident	110 Å²	110	46 Å²	46	48%	0.482	27%	0.271	S	S	.	.	S	Bend	trans	-112.4	-1.2	-168.3	-60.4	-62.6	0	0	0	113.9	T96 L97 V98	F94-T96 PolarHBondContact O-N 3.45Å; F94-L97 HydrophobicContact CD1-CD2 4.18Å; F94-L97 PolarHBondContact O-N 3.01Å; F94-V98 HydrophobicContact CB-CG2 4.12Å; F94-V98 WeakPolarHBondContact O-CB 3.4Å; F94-V98 WeakPolarHBondContact O-CG2 3.31Å; F94-V98 PolarHBondContact O-N 3.15Å
95	T	83.8	Confident	82.5	Confident	11 Å²	11	46 Å²	46	7%	0.067	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-24.3	-172.7	40.7	0	0	0	0	114.3	Q83 T91 G92 P99 R940	Q83-T95 PolarHBondContact NE2-OG1 3.1Å; T91-T95 WeakPolarHBondContact CB-OG1 3.38Å; T91-T95 WeakPolarHBondContact O-CB 3.21Å; T91-T95 WeakPolarHBondContact O-CG2 3.11Å; T91-T95 PolarHBondContact O-OG1 2.95Å; T91-T95 PolarHBondContact OG1-OG1 2.86Å; T91-T95 VanDerWaalsContact OG1-OG1 3.08Å; G92-T95 PolarHBondContact O-OG1 2.96Å; T95-P99 WeakPolarHBondContact O-CD 3.42Å; T95-P99 WeakPolarHBondContact O-CG 3.43Å; T95-R940 HydrophobicContact CG2-CB 4.23Å; T95-R940 WeakPolarHBondContact CG2-O 3.46Å
96	T	85	Confident	81.8	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.012	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-37.4	169.4	-49	0	0	0	0	111.9	F76 A80 Q83 F94 P99 L100 I354	F76-T96 HydrophobicContact CB-CG2 4.12Å; F76-T96 HydrophobicContact CD1-CG2 4.19Å; A80-T96 HydrophobicContact CB-CG2 4.38Å; Q83-T96 PolarHBondContact NE2-OG1 2.88Å; Q83-T96 VanDerWaalsContact NE2-OG1 3.07Å; Q83-T96 PolarHBondContact OE1-OG1 2.93Å; F94-T96 PolarHBondContact O-N 3.45Å; T96-P99 WeakPolarHBondContact O-CD 3.38Å; T96-L100 VanDerWaalsContact O-CB 3.28Å; T96-L100 WeakPolarHBondContact O-CB 3.32Å; T96-L100 PolarHBondContact O-N 2.98Å; T96-I354 HydrophobicContact CG2-CD1 4.34Å
97	L	86.9	Confident	81.3	Confident	62 Å²	62	40.5 Å²	40.5	33%	0.325	24%	0.241	S	C	.	.	H	α-helix	trans	-64.2	-45.2	-175.7	-174.9	65.4	0	0	0	112.3	A80 F94 L100 C101	A80-L97 HydrophobicContact CB-CD1 4.49Å; F94-L97 HydrophobicContact CD1-CD2 4.18Å; F94-L97 PolarHBondContact O-N 3.01Å; L97-L100 PolarHBondContact O-N 3.34Å; L97-C101 WeakPolarHBondContact O-CB 3.33Å; L97-C101 PolarHBondContact O-N 2.66Å; L97-C101 PolarHBondContact O-SG 2.89Å
98	V	83.8	Confident	81.5	Confident	53 Å²	53	37.1 Å²	37.1	32%	0.321	21%	0.205	S	C	.	.	H	α-helix	trans	-63.9	-51	-178.7	170.8	0	0	0	0	111.5	F94 L100 C101 I102 W941	F94-V98 HydrophobicContact CB-CG2 4.12Å; F94-V98 WeakPolarHBondContact O-CB 3.4Å; F94-V98 WeakPolarHBondContact O-CG2 3.31Å; F94-V98 PolarHBondContact O-N 3.15Å; V98-L100 VanDerWaalsContact C-N 3.32Å; V98-L100 PolarHBondContact O-N 3.35Å; V98-C101 PolarHBondContact O-N 2.98Å; V98-I102 HydrophobicContact CG1-CD1 3.97Å; V98-I102 WeakPolarHBondContact O-CG1 3.21Å; V98-I102 PolarHBondContact O-N 3.05Å; V98-W941 HydrophobicContact CG2-CH2 4.37Å
99	P	75.1	Confident	81.4	Confident	4 Å²	4	39.5 Å²	39.5	3%	0.026	22%	0.217	C	C	.	.	H	α-helix	trans	-55.8	-43.5	172	-30	38.2	0	0	0	113.4	T95 T96 C101 I102 I103 V948	T95-P99 WeakPolarHBondContact O-CD 3.42Å; T95-P99 WeakPolarHBondContact O-CG 3.43Å; T96-P99 WeakPolarHBondContact O-CD 3.38Å; P99-C101 PolarHBondContact O-N 3.04Å; P99-I102 PolarHBondContact O-N 2.85Å; P99-I103 VanDerWaalsContact O-CB 3.24Å; P99-I103 WeakPolarHBondContact O-CB 3.49Å; P99-I103 WeakPolarHBondContact O-CD1 3.47Å; P99-I103 WeakPolarHBondContact O-CG1 3.39Å; P99-I103 PolarHBondContact O-N 2.95Å; P99-V948 HydrophobicContact CB-CG2 3.91Å; P99-V948 HydrophobicContact CG-CG2 4.28Å
100	L	81.7	Confident	80.8	Confident	4 Å²	4	38.9 Å²	38.9	2%	0.021	21%	0.211	C	C	.	.	H	α-helix	trans	-61.7	-43.6	178.9	-176.2	65.4	0	0	0	111.8	F76 T96 L97 V98 I103 L104	F76-L100 HydrophobicContact CB-CD1 4.26Å; T96-L100 VanDerWaalsContact O-CB 3.28Å; T96-L100 WeakPolarHBondContact O-CB 3.32Å; T96-L100 PolarHBondContact O-N 2.98Å; L97-L100 PolarHBondContact O-N 3.34Å; V98-L100 VanDerWaalsContact C-N 3.32Å; V98-L100 PolarHBondContact O-N 3.35Å; L100-I103 WeakPolarHBondContact O-CB 3.18Å; L100-I103 PolarHBondContact O-N 2.96Å; L100-L104 HydrophobicContact CD1-CD1 4.4Å; L100-L104 HydrophobicContact CD1-CG 4.35Å; L100-L104 HydrophobicContact CG-CD1 4.1Å; L100-L104 HydrophobicContact CG-CG 4.43Å; L100-L104 WeakPolarHBondContact O-CB 3.42Å; L100-L104 VanDerWaalsContact O-CG 3.29Å; L100-L104 WeakPolarHBondContact O-CG 3.41Å; L100-L104 PolarHBondContact O-N 3.48Å
101	C	85.2	Confident	80.6	Confident	63 Å²	63	37.4 Å²	37.4	43%	0.426	20%	0.201	S	C	.	.	H	α-helix	trans	-63.1	-42.8	176.4	-71.8	0	0	0	0	112.2	L97 V98 P99 I103 L104 T105	L97-C101 WeakPolarHBondContact O-CB 3.33Å; L97-C101 PolarHBondContact O-N 2.66Å; L97-C101 PolarHBondContact O-SG 2.89Å; V98-C101 PolarHBondContact O-N 2.98Å; P99-C101 PolarHBondContact O-N 3.04Å; C101-I103 VanDerWaalsContact C-N 3.32Å; C101-I103 PolarHBondContact O-N 3.15Å; C101-L104 PolarHBondContact O-N 3.16Å; C101-T105 WeakPolarHBondContact O-CB 3.31Å; C101-T105 PolarHBondContact O-N 2.66Å; C101-T105 PolarHBondContact O-OG1 3.07Å
102	I	75.7	Confident	80.5	Confident	76 Å²	76	39.6 Å²	39.6	39%	0.39	21%	0.214	S	C	.	.	H	α-helix	trans	-59.8	-47.5	176	-67.6	167	0	0	0	109.8	V98 P99 T105 V106 V948	V98-I102 HydrophobicContact CG1-CD1 3.97Å; V98-I102 WeakPolarHBondContact O-CG1 3.21Å; V98-I102 PolarHBondContact O-N 3.05Å; P99-I102 PolarHBondContact O-N 2.85Å; I102-T105 PolarHBondContact O-N 2.54Å; I102-V106 WeakPolarHBondContact O-CG2 3.36Å; I102-V106 PolarHBondContact O-N 3.12Å; I102-V948 HydrophobicContact CD1-CG1 4.43Å
103	I	73.6	Confident	80	Confident	9 Å²	9	39.4 Å²	39.4	5%	0.046	21%	0.208	C	C	.	.	H	α-helix	trans	-59.2	-51.1	178.9	-78	169	0	0	0	111	P99 L100 C101 T105 V106 S107 I354 V358	P99-I103 VanDerWaalsContact O-CB 3.24Å; P99-I103 WeakPolarHBondContact O-CB 3.49Å; P99-I103 WeakPolarHBondContact O-CD1 3.47Å; P99-I103 WeakPolarHBondContact O-CG1 3.39Å; P99-I103 PolarHBondContact O-N 2.95Å; L100-I103 WeakPolarHBondContact O-CB 3.18Å; L100-I103 PolarHBondContact O-N 2.96Å; C101-I103 VanDerWaalsContact C-N 3.32Å; C101-I103 PolarHBondContact O-N 3.15Å; I103-T105 VanDerWaalsContact C-N 3.29Å; I103-T105 PolarHBondContact O-N 3.03Å; I103-V106 PolarHBondContact O-N 2.87Å; I103-S107 PolarHBondContact O-N 3.43Å; I103-S107 VanDerWaalsContact O-N 3.08Å; I103-S107 PolarHBondContact O-OG 3.32Å; I103-I354 HydrophobicContact CD1-CB 4.21Å; I103-I354 HydrophobicContact CD1-CG2 3.49Å; I103-I354 VanDerWaalsContact CD1-CG2 3.49Å; I103-V358 HydrophobicContact CB-CG2 3.97Å; I103-V358 HydrophobicContact CG1-CG2 4.38Å; I103-V358 HydrophobicContact CG2-CB 4.11Å; I103-V358 HydrophobicContact CG2-CG2 3.17Å
104	L	81.1	Confident	79	Confident	31 Å²	31	34.3 Å²	34.3	16%	0.162	19%	0.19	C	C	.	.	H	α-helix	trans	-63.4	-35.4	177.7	-69.1	175.5	0	0	0	112.2	F63 Q67 F68 L100 C101 S107 A108	F63-L104 WeakPolarHBondContact CZ-O 3.45Å; Q67-L104 HydrophobicContact CB-CD2 3.82Å; Q67-L104 HydrophobicContact CG-CD2 3.96Å; F68-L104 HydrophobicContact CZ-CD1 3.98Å; L100-L104 HydrophobicContact CD1-CD1 4.4Å; L100-L104 HydrophobicContact CD1-CG 4.35Å; L100-L104 HydrophobicContact CG-CD1 4.1Å; L100-L104 HydrophobicContact CG-CG 4.43Å; L100-L104 WeakPolarHBondContact O-CB 3.42Å; L100-L104 VanDerWaalsContact O-CG 3.29Å; L100-L104 WeakPolarHBondContact O-CG 3.41Å; L100-L104 PolarHBondContact O-N 3.48Å; C101-L104 PolarHBondContact O-N 3.16Å; L104-S107 PolarHBondContact O-N 3.03Å; L104-A108 VanDerWaalsContact O-CB 3.3Å; L104-A108 WeakPolarHBondContact O-CB 3.46Å; L104-A108 PolarHBondContact O-N 3.16Å
105	T	82.7	Confident	78.5	Confident	53 Å²	53	29.6 Å²	29.6	33%	0.325	17%	0.169	S	C	.	.	H	α-helix	trans	-66.3	-42.6	177	-56.6	0	0	0	0	111.2	C101 I102 I103 A108 I109	C101-T105 WeakPolarHBondContact O-CB 3.31Å; C101-T105 PolarHBondContact O-N 2.66Å; C101-T105 PolarHBondContact O-OG1 3.07Å; I102-T105 PolarHBondContact O-N 2.54Å; I103-T105 VanDerWaalsContact C-N 3.29Å; I103-T105 PolarHBondContact O-N 3.03Å; T105-A108 WeakPolarHBondContact O-CB 3.42Å; T105-A108 PolarHBondContact O-N 3.24Å; T105-I109 HydrophobicContact CG2-CD1 4.18Å; T105-I109 WeakPolarHBondContact O-CG1 3.4Å; T105-I109 PolarHBondContact O-N 3.48Å
106	V	73.4	Confident	78.2	Confident	56 Å²	56	34.7 Å²	34.7	34%	0.339	19%	0.191	S	C	.	.	H	α-helix	trans	-62.4	-44.9	176.2	172.9	0	0	0	0	111	I102 I103 A108 I109 K110 V358 V362	I102-V106 WeakPolarHBondContact O-CG2 3.36Å; I102-V106 PolarHBondContact O-N 3.12Å; I103-V106 PolarHBondContact O-N 2.87Å; V106-A108 VanDerWaalsContact C-N 3.32Å; V106-A108 PolarHBondContact O-N 3.1Å; V106-I109 PolarHBondContact O-N 3.41Å; V106-K110 PolarHBondContact O-N 3.29Å; V106-K110 VanDerWaalsContact O-N 3.11Å; V106-V358 HydrophobicContact CB-CG1 4.03Å; V106-V358 HydrophobicContact CG1-CG1 3.73Å; V106-V362 HydrophobicContact CG1-CG2 3.61Å
107	S	72.6	Confident	77.4	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.007	20%	0.202	C	C	.	.	H	α-helix	trans	-63.4	-37.2	174.4	-64.9	0	0	0	0	112.5	I103 L104 K110 E111 V358 E361	I103-S107 PolarHBondContact O-N 3.43Å; I103-S107 VanDerWaalsContact O-N 3.08Å; I103-S107 PolarHBondContact O-OG 3.32Å; L104-S107 PolarHBondContact O-N 3.03Å; S107-K110 PolarHBondContact O-N 3.1Å; S107-E111 WeakPolarHBondContact O-CG 3.32Å; S107-E111 PolarHBondContact O-N 3.24Å; S107-V358 WeakPolarHBondContact OG-CG2 3.37Å; S107-E361 WeakPolarHBondContact CB-OE2 3.49Å; S107-E361 PolarHBondContact OG-OE2 3.12Å
108	A	82.4	Confident	76.6	Confident	18 Å²	18	37.9 Å²	37.9	15%	0.149	20%	0.198	C	C	.	.	H	α-helix	trans	-63.9	-46.4	177.6	0	0	0	0	0	111.5	F59 F63 L104 T105 V106 K110 E111 V112	F59-A108 HydrophobicContact CE1-CB 4.49Å; F59-A108 HydrophobicContact CZ-CB 4.06Å; F63-A108 HydrophobicContact CD1-CB 4.46Å; F63-A108 HydrophobicContact CE1-CB 3.79Å; F63-A108 HydrophobicContact CE2-CB 4.05Å; F63-A108 VanDerWaalsContact CZ-CA 3.47Å; F63-A108 HydrophobicContact CZ-CB 3.55Å; L104-A108 VanDerWaalsContact O-CB 3.3Å; L104-A108 WeakPolarHBondContact O-CB 3.46Å; L104-A108 PolarHBondContact O-N 3.16Å; T105-A108 WeakPolarHBondContact O-CB 3.42Å; T105-A108 PolarHBondContact O-N 3.24Å; V106-A108 VanDerWaalsContact C-N 3.32Å; V106-A108 PolarHBondContact O-N 3.1Å; A108-K110 VanDerWaalsContact C-N 3.29Å; A108-K110 PolarHBondContact O-N 3.06Å; A108-E111 PolarHBondContact O-N 3.16Å; A108-V112 VanDerWaalsContact O-CG2 3.29Å; A108-V112 WeakPolarHBondContact O-CG2 3.38Å; A108-V112 PolarHBondContact O-N 2.8Å
109	I	79.6	Confident	76.4	Confident	53 Å²	53	38 Å²	38	27%	0.272	20%	0.196	S	C	.	.	H	α-helix	trans	-58.2	-45.1	176.2	-68.4	166.3	0	0	0	110.2	T105 V106 V112 I113	T105-I109 HydrophobicContact CG2-CD1 4.18Å; T105-I109 WeakPolarHBondContact O-CG1 3.4Å; T105-I109 PolarHBondContact O-N 3.48Å; V106-I109 PolarHBondContact O-N 3.41Å; I109-V112 PolarHBondContact O-N 3.24Å; I109-I113 HydrophobicContact CG2-CD1 3.84Å; I109-I113 HydrophobicContact CG2-CG1 4.5Å; I109-I113 VanDerWaalsContact O-CG1 3.3Å; I109-I113 WeakPolarHBondContact O-CG1 3.42Å; I109-I113 PolarHBondContact O-N 2.99Å
110	K	72.3	Confident	76.5	Confident	12 Å²	12	43.2 Å²	43.2	5%	0.052	22%	0.215	C	C	.	.	H	α-helix	trans	-59.7	-47.8	177.9	176.8	-101.2	176.9	-154.7	0	112.2	V106 S107 A108 V112 I113 E114 F365	V106-K110 PolarHBondContact O-N 3.29Å; V106-K110 VanDerWaalsContact O-N 3.11Å; S107-K110 PolarHBondContact O-N 3.1Å; A108-K110 VanDerWaalsContact C-N 3.29Å; A108-K110 PolarHBondContact O-N 3.06Å; K110-V112 PolarHBondContact O-N 3.08Å; K110-I113 PolarHBondContact O-N 2.8Å; K110-E114 WeakPolarHBondContact CE-OE1 3.33Å; K110-E114 IonicContact NZ-OE1 3.96Å; K110-E114 PolarHBondContact NZ-OE1 3.43Å; K110-E114 IonicContact NZ-OE2 2.72Å; K110-E114 PolarHBondContact NZ-OE2 3.18Å; K110-E114 PolarHBondContact O-N 2.73Å; K110-E114 VanDerWaalsContact O-N 3.08Å; K110-F365 HydrophobicContact CG-CD2 4.24Å; K110-F365 HydrophobicContact CG-CG 4.35Å
111	E	75.9	Confident	76	Confident	5 Å²	5	45.7 Å²	45.7	2%	0.023	24%	0.236	C	C	.	.	H	α-helix	trans	-64.5	-38.3	177.6	-72.4	-64.4	128.2	0	0	112.4	K53 Y54 F59 F63 S107 A108 E114 D115	K53-E111 IonicContact NZ-OE2 3.16Å; Y54-E111 HydrophobicContact CE2-CB 4.15Å; Y54-E111 PolarHBondContact OH-OE2 3.23Å; F59-E111 HydrophobicContact CE2-CB 4.35Å; F63-E111 HydrophobicContact CD2-CB 4.37Å; F63-E111 HydrophobicContact CD2-CG 4.11Å; F63-E111 HydrophobicContact CE2-CB 4.48Å; F63-E111 HydrophobicContact CE2-CG 4.06Å; S107-E111 WeakPolarHBondContact O-CG 3.32Å; S107-E111 PolarHBondContact O-N 3.24Å; A108-E111 PolarHBondContact O-N 3.16Å; E111-E114 PolarHBondContact O-N 3.12Å; E111-D115 WeakPolarHBondContact O-CB 3.44Å; E111-D115 PolarHBondContact O-N 3.29Å
112	V	80.3	Confident	75.8	Confident	52 Å²	52	43.2 Å²	43.2	32%	0.315	22%	0.218	S	C	.	.	H	α-helix	trans	-62.9	-42.8	175.3	170.5	0	0	0	0	111.3	F59 A108 I109 K110 D115 F116	F59-V112 HydrophobicContact CD2-CG2 4.27Å; F59-V112 HydrophobicContact CE1-CG2 4.06Å; F59-V112 HydrophobicContact CE2-CG2 3.54Å; F59-V112 HydrophobicContact CZ-CG2 3.42Å; F59-V112 VanDerWaalsContact CZ-CG2 3.42Å; A108-V112 VanDerWaalsContact O-CG2 3.29Å; A108-V112 WeakPolarHBondContact O-CG2 3.38Å; A108-V112 PolarHBondContact O-N 2.8Å; I109-V112 PolarHBondContact O-N 3.24Å; K110-V112 PolarHBondContact O-N 3.08Å; V112-D115 PolarHBondContact O-N 3.12Å; V112-F116 VanDerWaalsContact O-CB 3.28Å; V112-F116 WeakPolarHBondContact O-CB 3.3Å; V112-F116 PolarHBondContact O-N 3.3Å
113	I	73.5	Confident	76.3	Confident	18 Å²	18	43.3 Å²	43.3	9%	0.092	22%	0.219	C	C	.	.	H	α-helix	trans	-63.4	-43.7	177.4	-67.6	166.2	0	0	0	110.8	I109 K110 R117 F365	I109-I113 HydrophobicContact CG2-CD1 3.84Å; I109-I113 HydrophobicContact CG2-CG1 4.5Å; I109-I113 VanDerWaalsContact O-CG1 3.3Å; I109-I113 WeakPolarHBondContact O-CG1 3.42Å; I109-I113 PolarHBondContact O-N 2.99Å; K110-I113 PolarHBondContact O-N 2.8Å; I113-R117 WeakPolarHBondContact O-CG 3.48Å; I113-R117 PolarHBondContact O-N 3.07Å; I113-F365 HydrophobicContact CG2-CZ 4.1Å
114	E	67.8	Low	76.8	Confident	28 Å²	28	46 Å²	46	13%	0.131	24%	0.243	C	C	.	.	H	α-helix	trans	-64.3	-42	177.1	-74.9	-176.7	176.1	0	0	112.1	K110 E111 R117 R118 F365 S436	K110-E114 WeakPolarHBondContact CE-OE1 3.33Å; K110-E114 IonicContact NZ-OE1 3.96Å; K110-E114 PolarHBondContact NZ-OE1 3.43Å; K110-E114 IonicContact NZ-OE2 2.72Å; K110-E114 PolarHBondContact NZ-OE2 3.18Å; K110-E114 PolarHBondContact O-N 2.73Å; K110-E114 VanDerWaalsContact O-N 3.08Å; E111-E114 PolarHBondContact O-N 3.12Å; E114-R117 WeakPolarHBondContact O-CB 3.31Å; E114-R117 PolarHBondContact O-N 2.74Å; E114-R118 PolarHBondContact O-N 2.92Å; E114-F365 HydrophobicContact CG-CE2 4.25Å; E114-S436 PolarHBondContact OE1-OG 3.03Å
115	D	75.4	Confident	76.9	Confident	10 Å²	10	47.1 Å²	47.1	5%	0.053	25%	0.251	C	S	.	.	H	α-helix	trans	-72.6	-36.9	-179.4	-154.1	61.7	0	0	0	112.4	K53 Y54 E111 V112 R117 R118 H119	K53-D115 PolarHBondContact N-OD1 3.33Å; Y54-D115 WeakPolarHBondContact CB-OD2 3.3Å; Y54-D115 HydrophobicContact CD2-CB 3.9Å; Y54-D115 PolarHBondContact N-OD1 2.75Å; Y54-D115 PolarHBondContact N-OD2 2.87Å; E111-D115 WeakPolarHBondContact O-CB 3.44Å; E111-D115 PolarHBondContact O-N 3.29Å; V112-D115 PolarHBondContact O-N 3.12Å; D115-R117 VanDerWaalsContact C-N 3.27Å; D115-R117 PolarHBondContact O-N 3.37Å; D115-R118 WeakPolarHBondContact O-CA 3.43Å; D115-R118 WeakPolarHBondContact O-CB 3.38Å; D115-R118 PolarHBondContact O-N 2.83Å; D115-R118 IonicContact OD1-NH1 2.76Å; D115-H119 PolarHBondContact O-CD2 2.87Å; D115-H119 VanDerWaalsContact O-CD2 3.26Å; D115-H119 PolarHBondContact O-N 2.75Å; D115-H119 IonicContact OD2-CD2 3.72Å; D115-H119 IonicContact OD2-NE2 3.69Å; D115-H119 PolarHBondContact OD2-NE2 2.79Å
116	F	77.3	Confident	77.2	Confident	119 Å²	119	44.8 Å²	44.8	52%	0.522	24%	0.237	S	C	.	.	H	α-helix	trans	-60.8	-37.4	172.8	-173.5	-96.8	0	0	0	111.9	V112 R118 H119 R120	V112-F116 VanDerWaalsContact O-CB 3.28Å; V112-F116 WeakPolarHBondContact O-CB 3.3Å; V112-F116 PolarHBondContact O-N 3.3Å; F116-R118 VanDerWaalsContact C-N 3.32Å; F116-R118 PolarHBondContact O-N 3.32Å; F116-H119 PolarHBondContact O-N 3.47Å; F116-R120 PolarHBondContact O-N 3.07Å
117	R	68.9	Low	78.1	Confident	62 Å²	62	45.5 Å²	45.5	23%	0.234	24%	0.238	C	C	.	.	H	α-helix	trans	-63.4	-36.8	173	-73.3	175.9	179.8	-177.7	-0.4	112.1	I113 E114 D115 A121	I113-R117 WeakPolarHBondContact O-CG 3.48Å; I113-R117 PolarHBondContact O-N 3.07Å; E114-R117 WeakPolarHBondContact O-CB 3.31Å; E114-R117 PolarHBondContact O-N 2.74Å; D115-R117 VanDerWaalsContact C-N 3.27Å; D115-R117 PolarHBondContact O-N 3.37Å; R117-A121 PolarHBondContact O-N 3.44Å
118	R	71.1	Confident	78.9	Confident	68 Å²	68	49.6 Å²	49.6	26%	0.257	26%	0.257	S	S	.	.	H	α-helix	trans	-66.9	-48.6	174.4	-67.3	-171.9	-178.6	113.3	7.9	111.4	A52 E114 D115 F116 R120 A121 D122	A52-R118 HydrophobicContact CB-CB 4.45Å; E114-R118 PolarHBondContact O-N 2.92Å; D115-R118 WeakPolarHBondContact O-CA 3.43Å; D115-R118 WeakPolarHBondContact O-CB 3.38Å; D115-R118 PolarHBondContact O-N 2.83Å; D115-R118 IonicContact OD1-NH1 2.76Å; F116-R118 VanDerWaalsContact C-N 3.32Å; F116-R118 PolarHBondContact O-N 3.32Å; R118-R120 VanDerWaalsContact C-N 3.26Å; R118-R120 PolarHBondContact O-N 2.89Å; R118-A121 WeakPolarHBondContact O-CB 3.34Å; R118-A121 PolarHBondContact O-N 3.38Å; R118-D122 PolarHBondContact O-N 3.16Å
119	H	78.8	Confident	79.3	Confident	57 Å²	57	54.3 Å²	54.3	26%	0.264	28%	0.276	S	S	.	.	H	α-helix	trans	-55.6	-41.8	175.5	-77.9	-65	0	0	0	111.9	A52 Y54 D115 F116 A121 D122 D123	A52-H119 WeakPolarHBondContact CB-CE1 3.45Å; A52-H119 WeakPolarHBondContact CB-NE2 3.22Å; Y54-H119 PolarHBondContact O-NE2 3.15Å; Y54-H119 VanDerWaalsContact O-NE2 3.12Å; D115-H119 PolarHBondContact O-CD2 2.87Å; D115-H119 VanDerWaalsContact O-CD2 3.26Å; D115-H119 PolarHBondContact O-N 2.75Å; D115-H119 IonicContact OD2-CD2 3.72Å; D115-H119 IonicContact OD2-NE2 3.69Å; D115-H119 PolarHBondContact OD2-NE2 2.79Å; F116-H119 PolarHBondContact O-N 3.47Å; H119-A121 VanDerWaalsContact C-N 3.32Å; H119-A121 PolarHBondContact O-N 3.15Å; H119-D122 PolarHBondContact O-N 3.44Å; H119-D123 VanDerWaalsContact O-CB 3.28Å; H119-D123 WeakPolarHBondContact O-CB 3.06Å; H119-D123 PolarHBondContact O-N 2.68Å
120	R	78.1	Confident	79.9	Confident	113 Å²	113	52 Å²	52	43%	0.426	27%	0.265	S	S	.	.	H	α-helix	trans	-63.3	-36	176.6	-171.9	175.2	-179.8	-172.3	-3.6	113.3	F116 R118 A124 T378	F116-R120 PolarHBondContact O-N 3.07Å; R118-R120 VanDerWaalsContact C-N 3.26Å; R118-R120 PolarHBondContact O-N 2.89Å; R120-A124 PolarHBondContact O-N 2.87Å; R120-A124 VanDerWaalsContact O-N 3.08Å; R120-T378 PolarHBondContact NH1-OG1 3.05Å
121	A	69.8	Low	81	Confident	56 Å²	56	52.9 Å²	52.9	46%	0.463	27%	0.27	S	S	.	.	H	α-helix	trans	-71.3	-40.1	175.8	0	0	0	0	0	111.5	R117 R118 H119 A124 T125	R117-A121 PolarHBondContact O-N 3.44Å; R118-A121 WeakPolarHBondContact O-CB 3.34Å; R118-A121 PolarHBondContact O-N 3.38Å; H119-A121 VanDerWaalsContact C-N 3.32Å; H119-A121 PolarHBondContact O-N 3.15Å; A121-A124 PolarHBondContact O-N 2.94Å; A121-T125 PolarHBondContact O-N 2.83Å; A121-T125 PolarHBondContact O-OG1 2.91Å
122	D	82.5	Confident	81.8	Confident	11 Å²	11	52.6 Å²	52.6	6%	0.059	27%	0.269	C	S	.	.	H	α-helix	trans	-63.2	-44.9	173.6	-63.3	-24.3	0	0	0	110.8	S50 T51 A52 R118 H119 A124 T125 N126	S50-D122 WeakPolarHBondContact CA-OD2 3.4Å; T51-D122 WeakPolarHBondContact CB-OD1 3.32Å; T51-D122 WeakPolarHBondContact CG2-OD1 3.23Å; T51-D122 VanDerWaalsContact N-CG 3.31Å; T51-D122 PolarHBondContact N-OD1 3.02Å; T51-D122 PolarHBondContact N-OD2 2.99Å; T51-D122 VanDerWaalsContact OG1-CG 3.31Å; T51-D122 PolarHBondContact OG1-OD1 2.92Å; T51-D122 PolarHBondContact OG1-OD2 2.75Å; A52-D122 PolarHBondContact N-OD2 3.23Å; R118-D122 PolarHBondContact O-N 3.16Å; H119-D122 PolarHBondContact O-N 3.44Å; D122-A124 VanDerWaalsContact C-N 3.3Å; D122-A124 PolarHBondContact O-N 2.89Å; D122-T125 PolarHBondContact O-N 3.45Å; D122-T125 VanDerWaalsContact O-N 3.08Å; D122-N126 WeakPolarHBondContact O-CB 3.37Å; D122-N126 VanDerWaalsContact O-CG 3.28Å; D122-N126 PolarHBondContact O-N 2.84Å; D122-N126 PolarHBondContact O-ND2 3.3Å
123	D	85.6	Confident	82.3	Confident	78 Å²	78	50.7 Å²	50.7	42%	0.417	26%	0.257	S	S	.	.	H	α-helix	trans	-61.4	-37	177.6	-77	-23.1	0	0	0	111.9	H119 T125 N126 N127	H119-D123 VanDerWaalsContact O-CB 3.28Å; H119-D123 WeakPolarHBondContact O-CB 3.06Å; H119-D123 PolarHBondContact O-N 2.68Å; D123-T125 VanDerWaalsContact C-N 3.27Å; D123-T125 PolarHBondContact O-N 2.91Å; D123-N126 PolarHBondContact O-N 2.87Å; D123-N127 WeakPolarHBondContact O-CB 3.44Å; D123-N127 PolarHBondContact O-N 3.08Å; D123-N127 PolarHBondContact O-ND2 2.88Å
124	A	83.6	Confident	83	Confident	65 Å²	65	53.8 Å²	53.8	54%	0.537	27%	0.267	S	S	.	.	H	α-helix	trans	-59.7	-41.5	174.5	0	0	0	0	0	111.1	R120 A121 D122 E128	R120-A124 PolarHBondContact O-N 2.87Å; R120-A124 VanDerWaalsContact O-N 3.08Å; A121-A124 PolarHBondContact O-N 2.94Å; D122-A124 VanDerWaalsContact C-N 3.3Å; D122-A124 PolarHBondContact O-N 2.89Å; A124-E128 WeakPolarHBondContact O-CG 3.31Å
125	T	83.5	Confident	83.6	Confident	55 Å²	55	59.7 Å²	59.7	34%	0.337	30%	0.3	S	S	.	.	H	α-helix	trans	-75.8	-40.8	178	-49.7	0	0	0	0	112	A121 D122 D123 N127 E128 W143	A121-T125 PolarHBondContact O-N 2.83Å; A121-T125 PolarHBondContact O-OG1 2.91Å; D122-T125 PolarHBondContact O-N 3.45Å; D122-T125 VanDerWaalsContact O-N 3.08Å; D123-T125 VanDerWaalsContact C-N 3.27Å; D123-T125 PolarHBondContact O-N 2.91Å; T125-N127 VanDerWaalsContact C-N 3.32Å; T125-N127 PolarHBondContact O-N 2.84Å; T125-E128 PolarHBondContact O-N 3.38Å; T125-W143 HydrophobicContact CG2-CE3 4.34Å; T125-W143 HydrophobicContact CG2-CZ3 4.26Å
126	N	89.6	Confident	84	Confident	4 Å²	4	65.6 Å²	65.6	2%	0.021	33%	0.327	C	S	.	.	H	α-helix	trans	-71.9	-26	-176.9	-76.4	-34.7	0	0	0	113.4	N48 I49 D122 D123 W143 K144	N48-N126 PolarHBondContact OD1-ND2 3.26Å; I49-N126 PolarHBondContact N-OD1 3.5Å; I49-N126 PolarHBondContact O-ND2 3.03Å; D122-N126 WeakPolarHBondContact O-CB 3.37Å; D122-N126 VanDerWaalsContact O-CG 3.28Å; D122-N126 PolarHBondContact O-N 2.84Å; D122-N126 PolarHBondContact O-ND2 3.3Å; D123-N126 PolarHBondContact O-N 2.87Å; N126-W143 PolarHBondContact O-N 3.47Å; N126-K144 HydrophobicContact CB-CB 4.19Å; N126-K144 PolarHBondContact O-N 3.05Å; N126-K144 VanDerWaalsContact O-N 3.09Å
127	N	91.7	Very high	84.5	Confident	70 Å²	70	64.2 Å²	64.2	37%	0.374	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	7.1	178.2	-61.1	-44.2	0	0	0	112.9	D123 T125 K144	D123-N127 WeakPolarHBondContact O-CB 3.44Å; D123-N127 PolarHBondContact O-N 3.08Å; D123-N127 PolarHBondContact O-ND2 2.88Å; T125-N127 VanDerWaalsContact C-N 3.32Å; T125-N127 PolarHBondContact O-N 2.84Å; N127-K144 PolarHBondContact OD1-NZ 3.17Å
128	E	88.6	Confident	85.5	Confident	87 Å²	87	63.7 Å²	63.7	41%	0.407	33%	0.326	S	S	.	.			trans	-59	144.4	165	-69	-169	179.4	0	0	109.5	A124 T125 C142 W143	A124-E128 WeakPolarHBondContact O-CG 3.31Å; T125-E128 PolarHBondContact O-N 3.38Å; E128-C142 CarbonylContact O-C 3.55Å; E128-C142 WeakPolarHBondContact O-CA 3.43Å; E128-W143 VanDerWaalsContact C-CD1 3.45Å; E128-W143 HydrophobicContact CB-CD2 3.89Å; E128-W143 HydrophobicContact CB-CG 3.99Å; E128-W143 HydrophobicContact CB-CZ2 4.3Å; E128-W143 PolarHBondContact O-N 3.49Å; E128-W143 VanDerWaalsContact OE2-CH2 3.27Å; E128-W143 WeakPolarHBondContact OE2-CH2 3.25Å; E128-W143 WeakPolarHBondContact OE2-CZ2 3.44Å
129	E	91.9	Very high	86.5	Confident	117 Å²	117	63.4 Å²	63.4	55%	0.547	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	149.7	-176.7	-63.7	-174.1	164.5	0	0	110.9	K140 I141 W143	E129-K140 IonicContact OE2-NZ 3.97Å; E129-I141 CarbonylContact C-O 3.57Å; E129-I141 WeakPolarHBondContact CA-O 3.38Å; E129-W143 PolarHBondContact O-NE1 3.33Å
130	T	92.3	Very high	87.2	Confident	6 Å²	6	67.4 Å²	67.4	4%	0.037	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	153.3	169.8	-171	0	0	0	0	110.1	V132 I141 V152 P161	T130-V132 HydrophobicContact CG2-CG2 4.17Å; T130-I141 HydrophobicContact CG2-CG1 4.09Å; T130-I141 PolarHBondContact N-O 2.81Å; T130-I141 PolarHBondContact O-N 3.46Å; T130-V152 HydrophobicContact CG2-CG1 4.44Å; T130-V152 WeakPolarHBondContact OG1-CG1 3.19Å; T130-P161 HydrophobicContact CG2-CB 4.33Å; T130-P161 HydrophobicContact CG2-CG 4.26Å
131	L	93.9	Very high	87.9	Confident	29 Å²	29	62.9 Å²	62.9	15%	0.152	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	127.2	176.9	-68.2	166.7	0	0	0	110.3	W138 K140 V152 K153 L155	L131-W138 HydrophobicContact CB-CE3 4.4Å; L131-W138 HydrophobicContact CD2-CB 4.47Å; L131-K140 HydrophobicContact CD2-CD 4.49Å; L131-K140 HydrophobicContact CD2-CG 3.43Å; L131-K140 VanDerWaalsContact CD2-CG 3.43Å; L131-K140 HydrophobicContact CG-CG 4.42Å; L131-V152 CarbonylContact O-C 3.48Å; L131-V152 WeakPolarHBondContact O-CA 3.37Å; L131-V152 WeakPolarHBondContact O-CG1 3.45Å; L131-K153 HydrophobicContact CB-CB 4.02Å; L131-K153 HydrophobicContact CD1-CD 4.17Å; L131-K153 PolarHBondContact O-N 2.96Å; L131-L155 HydrophobicContact CD1-CD1 4.18Å; L131-L155 HydrophobicContact CD1-CD2 4.47Å; L131-L155 HydrophobicContact CD1-CG 4.34Å
132	V	93.4	Very high	89	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	140.6	177	178.9	0	0	0	0	110.1	T130 R134 V139 I141 L146 D150 L151 V152	T130-V132 HydrophobicContact CG2-CG2 4.17Å; V132-R134 HydrophobicContact CG1-CG 4Å; V132-R134 PolarHBondContact O-N 2.81Å; V132-V139 PolarHBondContact N-O 3.06Å; V132-V139 PolarHBondContact O-N 2.95Å; V132-I141 HydrophobicContact CB-CD1 3.98Å; V132-I141 HydrophobicContact CB-CG1 4.25Å; V132-I141 HydrophobicContact CG1-CD1 4.49Å; V132-I141 HydrophobicContact CG2-CD1 3.4Å; V132-I141 VanDerWaalsContact CG2-CD1 3.4Å; V132-I141 HydrophobicContact CG2-CG1 3.65Å; V132-L146 HydrophobicContact CG2-CD1 3.67Å; V132-D150 HydrophobicContact CG1-CB 3.79Å; V132-L151 CarbonylContact C-O 3.49Å; V132-L151 WeakPolarHBondContact CA-O 3.34Å; V132-L151 WeakPolarHBondContact CG1-O 3.42Å; V132-V152 HydrophobicContact CG2-CG2 4.2Å
133	L	91.7	Very high	89.6	Confident	12 Å²	12	61.8 Å²	61.8	6%	0.063	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	108.3	176.5	-170.9	66.2	0	0	0	109.7	W138 L151 A204 L207	L133-W138 HydrophobicContact CB-CE3 4Å; L133-W138 HydrophobicContact CB-CH2 4.03Å; L133-W138 HydrophobicContact CB-CZ3 3.65Å; L133-W138 HydrophobicContact CD1-CD2 4.13Å; L133-W138 HydrophobicContact CD1-CE3 4.29Å; L133-W138 HydrophobicContact CD1-CH2 4.39Å; L133-W138 HydrophobicContact CD1-CZ2 4.25Å; L133-W138 HydrophobicContact CD1-CZ3 4.42Å; L133-L151 HydrophobicContact CB-CB 4.1Å; L133-L151 HydrophobicContact CD2-CD1 4.11Å; L133-L151 PolarHBondContact N-O 3.26Å; L133-A204 HydrophobicContact CD1-CB 4Å; L133-L207 HydrophobicContact CD2-CB 3.7Å
134	R	86.9	Confident	89.9	Confident	82 Å²	82	61.4 Å²	61.4	31%	0.309	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	134.8	173.9	-65.1	-173.2	177	168.7	2.4	109.4	V132 H136 V137 V139 D145 D150	V132-R134 HydrophobicContact CG1-CG 4Å; V132-R134 PolarHBondContact O-N 2.81Å; R134-H136 VanDerWaalsContact C-N 3.29Å; R134-H136 PolarHBondContact O-N 2.81Å; R134-V137 PolarHBondContact N-O 3.48Å; R134-V137 PolarHBondContact O-N 3.25Å; R134-V139 HydrophobicContact CB-CG2 4.47Å; R134-D145 PolarHBondContact NH2-O 2.89Å; R134-D150 IonicContact CZ-OD2 2.62Å; R134-D150 IonicContact NE-OD1 2.76Å; R134-D150 IonicContact NE-OD2 3.92Å; R134-D150 IonicContact NH2-OD1 3.45Å; R134-D150 IonicContact NH2-OD2 3.04Å; R134-D150 PolarHBondContact NH2-OD2 3.4Å
135	N	82.2	Confident	90.4	Very high	152 Å²	152	61.8 Å²	61.8	81%	0.813	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	42.1	-178.2	-57.9	-31.2	0	0	0	113.9	V137	N135-V137 PolarHBondContact O-N 3.34Å; N135-V137 VanDerWaalsContact O-N 3.16Å
136	H	82.3	Confident	90.8	Very high	135 Å²	135	59.2 Å²	59.2	63%	0.625	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	13.4	-177.7	-47.9	-81.8	0	0	0	115.4	R134 S208	R134-H136 VanDerWaalsContact C-N 3.29Å; R134-H136 PolarHBondContact O-N 2.81Å; H136-S208 PolarHBondContact CE1-OG 3.07Å; H136-S208 WeakPolarHBondContact ND1-CB 3.14Å; H136-S208 PolarHBondContact ND1-OG 3.47Å
137	V	88.1	Confident	91	Very high	90 Å²	90	64.1 Å²	64.1	55%	0.545	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	143.3	179.1	-178.5	0	0	0	0	109.8	R134 N135 V139	R134-V137 PolarHBondContact N-O 3.48Å; R134-V137 PolarHBondContact O-N 3.25Å; N135-V137 PolarHBondContact O-N 3.34Å; N135-V137 VanDerWaalsContact O-N 3.16Å; V137-V139 PolarHBondContact O-N 2.78Å
138	W	89.8	Confident	91.1	Very high	51 Å²	51	61.2 Å²	61.2	19%	0.193	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	114.3	171	-64.5	110.5	0	0	0	110.1	L131 L133 K153 A204 L207 F259 R1233	L131-W138 HydrophobicContact CB-CE3 4.4Å; L131-W138 HydrophobicContact CD2-CB 4.47Å; L133-W138 HydrophobicContact CB-CE3 4Å; L133-W138 HydrophobicContact CB-CH2 4.03Å; L133-W138 HydrophobicContact CB-CZ3 3.65Å; L133-W138 HydrophobicContact CD1-CD2 4.13Å; L133-W138 HydrophobicContact CD1-CE3 4.29Å; L133-W138 HydrophobicContact CD1-CH2 4.39Å; L133-W138 HydrophobicContact CD1-CZ2 4.25Å; L133-W138 HydrophobicContact CD1-CZ3 4.42Å; W138-K153 HydrophobicContact CD2-CD 4.42Å; W138-K153 HydrophobicContact CE3-CB 3.86Å; W138-K153 HydrophobicContact CH2-CB 3.76Å; W138-K153 HydrophobicContact CZ2-CB 4.41Å; W138-K153 HydrophobicContact CZ2-CD 4.39Å; W138-K153 HydrophobicContact CZ3-CB 3.44Å; W138-K153 VanDerWaalsContact CZ3-CB 3.44Å; W138-A204 HydrophobicContact CZ2-CB 4.26Å; W138-L207 HydrophobicContact CH2-CD1 4.06Å; W138-L207 HydrophobicContact CZ2-CD1 4.06Å; W138-F259 AromaticContact CH2-CD1 3.67Å; W138-F259 HydrophobicContact CH2-CD1 3.67Å; W138-F259 AromaticContact CH2-CE1 3.42Å; W138-F259 HydrophobicContact CH2-CE1 3.42Å; W138-F259 VanDerWaalsContact CH2-CE1 3.42Å; W138-F259 HydrophobicContact CH2-CZ 4.29Å; W138-F259 HydrophobicContact CZ2-CD1 4.08Å; W138-F259 AromaticContact CZ2-CE1 3.35Å; W138-F259 HydrophobicContact CZ2-CE1 3.35Å; W138-F259 AromaticContact CZ2-CZ 3.84Å; W138-F259 HydrophobicContact CZ2-CZ 3.84Å; W138-F259 HydrophobicContact CZ3-CE1 4.48Å; W138-R1233 PolarHBondContact NE1-OXT 2.96Å
139	V	92.4	Very high	91.2	Very high	61 Å²	61	57.5 Å²	57.5	37%	0.37	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	131.1	178.5	-177	0	0	0	0	108.6	V132 R134 V137 I141	V132-V139 PolarHBondContact N-O 3.06Å; V132-V139 PolarHBondContact O-N 2.95Å; R134-V139 HydrophobicContact CB-CG2 4.47Å; V137-V139 PolarHBondContact O-N 2.78Å; V139-I141 HydrophobicContact CG1-CG2 4.07Å
140	K	93.1	Very high	91.2	Very high	141 Å²	141	53.1 Å²	53.1	61%	0.613	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.6	124.6	169.9	-71.9	-175.4	169.2	-159.6	0	109.5	E129 L131	E129-K140 IonicContact OE2-NZ 3.97Å; L131-K140 HydrophobicContact CD2-CD 4.49Å; L131-K140 HydrophobicContact CD2-CG 3.43Å; L131-K140 VanDerWaalsContact CD2-CG 3.43Å; L131-K140 HydrophobicContact CG-CG 4.42Å
141	I	93.3	Very high	91.3	Very high	19 Å²	19	53 Å²	53	10%	0.097	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	156.3	175.4	67.3	169.4	0	0	0	110.4	E129 T130 V132 V139 L146	E129-I141 CarbonylContact C-O 3.57Å; E129-I141 WeakPolarHBondContact CA-O 3.38Å; T130-I141 HydrophobicContact CG2-CG1 4.09Å; T130-I141 PolarHBondContact N-O 2.81Å; T130-I141 PolarHBondContact O-N 3.46Å; V132-I141 HydrophobicContact CB-CD1 3.98Å; V132-I141 HydrophobicContact CB-CG1 4.25Å; V132-I141 HydrophobicContact CG1-CD1 4.49Å; V132-I141 HydrophobicContact CG2-CD1 3.4Å; V132-I141 VanDerWaalsContact CG2-CD1 3.4Å; V132-I141 HydrophobicContact CG2-CG1 3.65Å; V139-I141 HydrophobicContact CG1-CG2 4.07Å; I141-L146 HydrophobicContact CD1-CB 4.35Å; I141-L146 HydrophobicContact CD1-CD1 4.15Å
142	C	93.7	Very high	91.3	Very high	31 Å²	31	51.7 Å²	51.7	21%	0.209	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	149.6	171.3	-61.1	0	0	0	0	110.7	E128 K144 D145	E128-C142 CarbonylContact O-C 3.55Å; E128-C142 WeakPolarHBondContact O-CA 3.43Å; C142-K144 HydrophobicContact CB-CD 4.42Å; C142-K144 HydrophobicContact CB-CG 4.03Å; C142-K144 PolarHBondContact O-N 3.36Å; C142-K144 VanDerWaalsContact O-N 3.17Å; C142-D145 PolarHBondContact O-N 3.16Å
143	W	93.9	Very high	91.3	Very high	13 Å²	13	52.8 Å²	52.8	5%	0.049	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-54.9	-37.8	178.7	-79.2	24.3	0	0	0	112.6	N47 T125 N126 E128 E129 D145 L146 G159 P161	N47-W143 WeakPolarHBondContact CB-O 3.24Å; N47-W143 PolarHBondContact ND2-O 3.14Å; T125-W143 HydrophobicContact CG2-CE3 4.34Å; T125-W143 HydrophobicContact CG2-CZ3 4.26Å; N126-W143 PolarHBondContact O-N 3.47Å; E128-W143 VanDerWaalsContact C-CD1 3.45Å; E128-W143 HydrophobicContact CB-CD2 3.89Å; E128-W143 HydrophobicContact CB-CG 3.99Å; E128-W143 HydrophobicContact CB-CZ2 4.3Å; E128-W143 PolarHBondContact O-N 3.49Å; E128-W143 VanDerWaalsContact OE2-CH2 3.27Å; E128-W143 WeakPolarHBondContact OE2-CH2 3.25Å; E128-W143 WeakPolarHBondContact OE2-CZ2 3.44Å; E129-W143 PolarHBondContact O-NE1 3.33Å; W143-D145 PolarHBondContact O-N 3.02Å; W143-L146 VanDerWaalsContact O-CB 3.3Å; W143-L146 WeakPolarHBondContact O-CB 3.5Å; W143-L146 PolarHBondContact O-N 3.11Å; W143-G159 WeakPolarHBondContact CZ2-O 3.36Å; W143-P161 HydrophobicContact CD2-CB 3.68Å; W143-P161 HydrophobicContact CE3-CB 4.31Å; W143-P161 HydrophobicContact CG-CB 3.85Å; W143-P161 HydrophobicContact CZ2-CB 4.07Å
144	K	92.5	Very high	91.4	Very high	69 Å²	69	52.2 Å²	52.2	30%	0.3	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-60.9	-25	177.9	72.2	-167.3	178.9	-163	0	114.7	N48 N126 N127 C142	N48-K144 HydrophobicContact CB-CB 4.32Å; N126-K144 HydrophobicContact CB-CB 4.19Å; N126-K144 PolarHBondContact O-N 3.05Å; N126-K144 VanDerWaalsContact O-N 3.09Å; N127-K144 PolarHBondContact OD1-NZ 3.17Å; C142-K144 HydrophobicContact CB-CD 4.42Å; C142-K144 HydrophobicContact CB-CG 4.03Å; C142-K144 PolarHBondContact O-N 3.36Å; C142-K144 VanDerWaalsContact O-N 3.17Å
145	D	93.2	Very high	91.6	Very high	74 Å²	74	51.1 Å²	51.1	40%	0.396	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-97.7	3.3	-175.7	-60	-45.8	0	0	0	112.5	R134 C142 W143	R134-D145 PolarHBondContact NH2-O 2.89Å; C142-D145 PolarHBondContact O-N 3.16Å; W143-D145 PolarHBondContact O-N 3.02Å
146	L	93	Very high	91.8	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.236	C	C	.	.			trans	-73.9	131.4	172.7	-174.3	68.6	0	0	0	110.5	N47 V132 I141 W143 D150 V152 P161 A162 T262	N47-L146 HydrophobicContact CB-CB 4.19Å; N47-L146 WeakPolarHBondContact CB-O 3.31Å; V132-L146 HydrophobicContact CG2-CD1 3.67Å; I141-L146 HydrophobicContact CD1-CB 4.35Å; I141-L146 HydrophobicContact CD1-CD1 4.15Å; W143-L146 VanDerWaalsContact O-CB 3.3Å; W143-L146 WeakPolarHBondContact O-CB 3.5Å; W143-L146 PolarHBondContact O-N 3.11Å; L146-D150 HydrophobicContact CD1-CB 3.79Å; L146-V152 HydrophobicContact CD1-CG2 3.64Å; L146-V152 HydrophobicContact CD2-CG2 4.38Å; L146-P161 HydrophobicContact CD2-CB 3.81Å; L146-P161 HydrophobicContact CD2-CG 3.81Å; L146-A162 HydrophobicContact CD2-CB 3.62Å; L146-T262 HydrophobicContact CD2-CG2 4.2Å; L146-T262 HydrophobicContact CG-CG2 4.28Å
147	E	92.9	Very high	91.8	Very high	107 Å²	107	44.8 Å²	44.8	50%	0.5	23%	0.233	S	C	.	.			trans	-117.7	161.5	-177.6	-62.6	-173	165.8	0	0	112.1	G149 D150 T262	E147-G149 PolarHBondContact O-N 3.16Å; E147-D150 PolarHBondContact N-OD2 2.81Å; E147-D150 WeakPolarHBondContact O-CB 3.33Å; E147-D150 PolarHBondContact O-N 2.79Å; E147-T262 WeakPolarHBondContact O-CB 3.27Å; E147-T262 WeakPolarHBondContact O-CG2 3.18Å
148	V	93.2	Very high	91.8	Very high	9 Å²	9	43.7 Å²	43.7	6%	0.055	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	131.2	178.1	176.6	0	0	0	0	109.6	R32 I34 Q40 Y44 V263 T265	R32-V148 VanDerWaalsContact NH2-CG2 3.27Å; I34-V148 HydrophobicContact CD1-CG1 3.76Å; I34-V148 HydrophobicContact CG1-CG1 3.96Å; I34-V148 HydrophobicContact CG2-CG1 4.13Å; Q40-V148 WeakPolarHBondContact CG-O 3.4Å; Y44-V148 HydrophobicContact CD2-CB 3.61Å; Y44-V148 HydrophobicContact CD2-CG1 3.67Å; Y44-V148 HydrophobicContact CD2-CG2 4.08Å; Y44-V148 HydrophobicContact CE2-CB 4.29Å; Y44-V148 HydrophobicContact CE2-CG1 3.83Å; Y44-V148 HydrophobicContact CG-CB 3.93Å; Y44-V148 HydrophobicContact CG-CG1 4.13Å; Y44-V148 HydrophobicContact CG-CG2 3.84Å; V148-V263 WeakPolarHBondContact CG1-O 3.26Å; V148-T265 HydrophobicContact CG2-CG2 3.77Å; V148-T265 WeakPolarHBondContact CG2-OG1 3.45Å
149	G	91.5	Very high	91.7	Very high	10 Å²	10	42.5 Å²	42.5	10%	0.103	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.7	-6.5	-174.4	0	0	0	0	0	114.9	E147 L261 T262	E147-G149 PolarHBondContact O-N 3.16Å; G149-L261 WeakPolarHBondContact O-CD1 3.41Å; G149-T262 PolarHBondContact N-O 2.87Å
150	D	92.6	Very high	91.8	Very high	24 Å²	24	39.6 Å²	39.6	13%	0.128	21%	0.208	C	C	.	.			trans	-65.7	138.1	172.3	-85.1	-27	0	0	0	110.9	V132 R134 L146 E147 T262	V132-D150 HydrophobicContact CG1-CB 3.79Å; R134-D150 IonicContact CZ-OD2 2.62Å; R134-D150 IonicContact NE-OD1 2.76Å; R134-D150 IonicContact NE-OD2 3.92Å; R134-D150 IonicContact NH2-OD1 3.45Å; R134-D150 IonicContact NH2-OD2 3.04Å; R134-D150 PolarHBondContact NH2-OD2 3.4Å; L146-D150 HydrophobicContact CD1-CB 3.79Å; E147-D150 PolarHBondContact N-OD2 2.81Å; E147-D150 WeakPolarHBondContact O-CB 3.33Å; E147-D150 PolarHBondContact O-N 2.79Å; D150-T262 WeakPolarHBondContact O-CB 3.38Å; D150-T262 PolarHBondContact O-N 3.3Å; D150-T262 PolarHBondContact O-OG1 3.49Å
151	L	94	Very high	91.8	Very high	5 Å²	5	32.9 Å²	32.9	3%	0.026	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	117.5	172.3	-69.9	172.7	0	0	0	109.7	V36 N37 V132 L133 L167 L207 L261	V36-L151 HydrophobicContact CG1-CD1 4.38Å; V36-L151 HydrophobicContact CG1-CD2 4.24Å; V36-L151 HydrophobicContact CG1-CG 4.49Å; N37-L151 WeakPolarHBondContact OD1-CD1 3.46Å; V132-L151 CarbonylContact C-O 3.49Å; V132-L151 WeakPolarHBondContact CA-O 3.34Å; V132-L151 WeakPolarHBondContact CG1-O 3.42Å; L133-L151 HydrophobicContact CB-CB 4.1Å; L133-L151 HydrophobicContact CD2-CD1 4.11Å; L133-L151 PolarHBondContact N-O 3.26Å; L151-L167 HydrophobicContact CD2-CD1 3.59Å; L151-L207 HydrophobicContact CD1-CB 4.43Å; L151-L207 HydrophobicContact CD1-CD2 4.5Å; L151-L261 HydrophobicContact CD2-CB 4.32Å; L151-L261 HydrophobicContact CD2-CD1 3.91Å
152	V	93.8	Very high	91.9	Very high	1 Å²	1	32 Å²	32	1%	0.006	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	137.3	-171.9	-171.1	0	0	0	0	110.3	T130 L131 V132 L146 V154 P161 L164 F259 G260 T262	T130-V152 HydrophobicContact CG2-CG1 4.44Å; T130-V152 WeakPolarHBondContact OG1-CG1 3.19Å; L131-V152 CarbonylContact O-C 3.48Å; L131-V152 WeakPolarHBondContact O-CA 3.37Å; L131-V152 WeakPolarHBondContact O-CG1 3.45Å; V132-V152 HydrophobicContact CG2-CG2 4.2Å; L146-V152 HydrophobicContact CD1-CG2 3.64Å; L146-V152 HydrophobicContact CD2-CG2 4.38Å; V152-V154 HydrophobicContact CG1-CG2 3.91Å; V152-P161 HydrophobicContact CG1-CG 4.15Å; V152-L164 HydrophobicContact CB-CD1 4.31Å; V152-L164 HydrophobicContact CG2-CD2 4.15Å; V152-F259 WeakPolarHBondContact O-CA 3.28Å; V152-G260 PolarHBondContact N-O 2.97Å; V152-G260 PolarHBondContact O-N 3.03Å; V152-T262 VanDerWaalsContact CG2-OG1 3.29Å; V152-T262 WeakPolarHBondContact CG2-OG1 3.47Å
153	K	93.9	Very high	91.9	Very high	23 Å²	23	30.5 Å²	30.5	10%	0.1	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	120.5	164.6	-177.8	-177.2	-168.8	174.6	0	108.8	L131 W138 L155 W257 I258 F259 G1232	L131-K153 HydrophobicContact CB-CB 4.02Å; L131-K153 HydrophobicContact CD1-CD 4.17Å; L131-K153 PolarHBondContact O-N 2.96Å; W138-K153 HydrophobicContact CD2-CD 4.42Å; W138-K153 HydrophobicContact CE3-CB 3.86Å; W138-K153 HydrophobicContact CH2-CB 3.76Å; W138-K153 HydrophobicContact CZ2-CB 4.41Å; W138-K153 HydrophobicContact CZ2-CD 4.39Å; W138-K153 HydrophobicContact CZ3-CB 3.44Å; W138-K153 VanDerWaalsContact CZ3-CB 3.44Å; K153-L155 HydrophobicContact CD-CD2 4.3Å; K153-L155 HydrophobicContact CG-CD2 4.34Å; K153-W257 HydrophobicContact CG-CB 4.48Å; K153-I258 WeakPolarHBondContact CA-O 3.44Å; K153-F259 HydrophobicContact CB-CD1 3.93Å; K153-F259 HydrophobicContact CB-CE1 3.9Å; K153-F259 HydrophobicContact CD-CE1 3.77Å; K153-F259 HydrophobicContact CG-CD1 3.98Å; K153-F259 HydrophobicContact CG-CE1 3.66Å; K153-G1232 PolarHBondContact NZ-O 2.82Å
154	V	92.9	Very high	92	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	131.3	175.7	-177.4	0	0	0	0	108.2	V152 E158 L164 L252 W257 I258	V152-V154 HydrophobicContact CG1-CG2 3.91Å; V154-E158 HydrophobicContact CG1-CB 4Å; V154-L164 HydrophobicContact CG2-CD1 4.06Å; V154-L252 HydrophobicContact CG1-CB 4.17Å; V154-L252 HydrophobicContact CG1-CD2 4.3Å; V154-W257 CarbonylContact O-C 3.57Å; V154-W257 WeakPolarHBondContact O-CA 2.98Å; V154-I258 HydrophobicContact CB-CD1 4.18Å; V154-I258 HydrophobicContact CB-CG1 3.76Å; V154-I258 HydrophobicContact CG2-CD1 4.44Å; V154-I258 HydrophobicContact CG2-CG1 4.34Å; V154-I258 PolarHBondContact N-O 3.41Å; V154-I258 VanDerWaalsContact N-O 3.08Å; V154-I258 PolarHBondContact O-N 3.49Å
155	L	91.3	Very high	92.1	Very high	59 Å²	59	26.7 Å²	26.7	31%	0.309	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	165.2	180	-54	176	0	0	0	111.8	L131 K153 N157 E158 L252 W257	L131-L155 HydrophobicContact CD1-CD1 4.18Å; L131-L155 HydrophobicContact CD1-CD2 4.47Å; L131-L155 HydrophobicContact CD1-CG 4.34Å; K153-L155 HydrophobicContact CD-CD2 4.3Å; K153-L155 HydrophobicContact CG-CD2 4.34Å; L155-N157 PolarHBondContact O-N 2.96Å; L155-E158 HydrophobicContact CB-CG 4.19Å; L155-E158 WeakPolarHBondContact CB-OE2 3.22Å; L155-E158 PolarHBondContact N-OE2 2.97Å; L155-E158 WeakPolarHBondContact O-CB 3.29Å; L155-E158 PolarHBondContact O-N 2.88Å; L155-E158 VanDerWaalsContact O-N 3.17Å; L155-L252 WeakPolarHBondContact O-CD2 3.37Å; L155-W257 HydrophobicContact CD2-CB 4.12Å
156	S	85.6	Confident	92.1	Very high	47 Å²	47	23.2 Å²	23.2	33%	0.329	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	135.5	177.5	-171.2	0	0	0	0	111.8	E158 T255 K256	S156-E158 PolarHBondContact O-N 3.44Å; S156-T255 WeakPolarHBondContact CA-O 3.13Å; S156-T255 WeakPolarHBondContact CB-O 3.14Å; S156-T255 PolarHBondContact OG-O 2.65Å; S156-K256 PolarHBondContact N-O 3.13Å
157	N	83.1	Confident	92.1	Very high	106 Å²	106	23.3 Å²	23.3	57%	0.567	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.9	11.4	-177.6	-58.1	-59.1	0	0	0	115.7	L155 L252 K253	L155-N157 PolarHBondContact O-N 2.96Å; N157-L252 WeakPolarHBondContact CA-O 3.43Å; N157-L252 PolarHBondContact N-O 3.3Å; N157-K253 VanDerWaalsContact OD1-CD 3.25Å; N157-K253 WeakPolarHBondContact OD1-CD 3.01Å; N157-K253 PolarHBondContact OD1-NZ 3.29Å
158	E	87.7	Confident	92.1	Very high	68 Å²	68	18.2 Å²	18.2	32%	0.318	11%	0.106	S	C	.	.	P	Polyproline II helix	trans	-89.2	151.9	171	-65.3	-178.9	163.4	0	0	111.6	V154 L155 S156 S251 L252	V154-E158 HydrophobicContact CG1-CB 4Å; L155-E158 HydrophobicContact CB-CG 4.19Å; L155-E158 WeakPolarHBondContact CB-OE2 3.22Å; L155-E158 PolarHBondContact N-OE2 2.97Å; L155-E158 WeakPolarHBondContact O-CB 3.29Å; L155-E158 PolarHBondContact O-N 2.88Å; L155-E158 VanDerWaalsContact O-N 3.17Å; S156-E158 PolarHBondContact O-N 3.44Å; E158-S251 WeakPolarHBondContact O-CA 3.42Å; E158-L252 PolarHBondContact O-N 2.95Å
159	G	88.8	Confident	91.9	Very high	26 Å²	26	18 Å²	18	27%	0.268	11%	0.105	S	C	.	.	B	Isolated β-bridge	trans	-74.2	147.2	171.7	0	0	0	0	0	111.4	W143	W143-G159 WeakPolarHBondContact CZ2-O 3.36Å
160	I	94.1	Very high	91.8	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.101	C	C	.	.	P	Polyproline II helix	trans	-81.5	122.6	176.9	-69	145	0	0	0	109.3	A162 L164 I178 I246 L247 R248 G249 A250	I160-A162 WeakPolarHBondContact CG2-O 3.21Å; I160-L164 HydrophobicContact CG2-CD1 4.1Å; I160-L164 HydrophobicContact CG2-CG 4.16Å; I160-I178 HydrophobicContact CD1-CG2 4.05Å; I160-I246 HydrophobicContact CB-CG2 4.39Å; I160-I246 HydrophobicContact CD1-CG2 3.11Å; I160-I246 HydrophobicContact CG1-CG2 3.76Å; I160-I246 HydrophobicContact CG2-CG2 3.98Å; I160-L247 WeakPolarHBondContact CB-O 3.44Å; I160-L247 WeakPolarHBondContact CG2-O 3.33Å; I160-R248 WeakPolarHBondContact O-CA 3.31Å; I160-G249 PolarHBondContact O-N 3.42Å; I160-A250 WeakPolarHBondContact CB-O 3.39Å; I160-A250 HydrophobicContact CD1-CB 3.59Å; I160-A250 WeakPolarHBondContact CD1-O 3.24Å; I160-A250 PolarHBondContact N-O 3.18Å
161	P	93.3	Very high	91.2	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	10%	0.097	C	C	.	.			trans	-76.7	-25.8	-167.9	28.6	-37	0	0	0	115.3	N47 T130 W143 L146 V152 R248	N47-P161 PolarHBondContact ND2-O 3.44Å; T130-P161 HydrophobicContact CG2-CB 4.33Å; T130-P161 HydrophobicContact CG2-CG 4.26Å; W143-P161 HydrophobicContact CD2-CB 3.68Å; W143-P161 HydrophobicContact CE3-CB 4.31Å; W143-P161 HydrophobicContact CG-CB 3.85Å; W143-P161 HydrophobicContact CZ2-CB 4.07Å; L146-P161 HydrophobicContact CD2-CB 3.81Å; L146-P161 HydrophobicContact CD2-CG 3.81Å; V152-P161 HydrophobicContact CG1-CG 4.15Å; P161-R248 WeakPolarHBondContact O-CD 3.42Å; P161-R248 PolarHBondContact O-NE 3.01Å
162	A	94.4	Very high	90.4	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.114	C	C	.	.	S	Bend	trans	-157.3	175.4	-174.4	0	0	0	0	0	109.5	L146 I160 L164 T262 Y264 T265	L146-A162 HydrophobicContact CD2-CB 3.62Å; I160-A162 WeakPolarHBondContact CG2-O 3.21Å; A162-L164 HydrophobicContact CB-CD2 4.35Å; A162-L164 WeakPolarHBondContact O-CG 3.27Å; A162-L164 PolarHBondContact O-N 2.92Å; A162-T262 HydrophobicContact CB-CG2 3.8Å; A162-Y264 WeakPolarHBondContact CB-O 3.25Å; A162-T265 HydrophobicContact CB-CG2 4.36Å
163	D	94.7	Very high	89.6	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	118	174.7	-62.7	-18.8	0	0	0	109	L245 I246 L247 R248 V263 Y264 S269 K270	D163-L245 HydrophobicContact CB-CD1 4.45Å; D163-I246 CarbonylContact C-O 3.55Å; D163-I246 WeakPolarHBondContact CA-O 3.32Å; D163-L247 WeakPolarHBondContact OD1-CA 3.35Å; D163-R248 PolarHBondContact OD1-N 3.33Å; D163-V263 PolarHBondContact O-N 3.19Å; D163-Y264 HydrophobicContact CB-CD2 4.01Å; D163-Y264 PolarHBondContact N-O 3.49Å; D163-Y264 PolarHBondContact O-N 2.97Å; D163-S269 WeakPolarHBondContact OD2-CA 3.32Å; D163-K270 PolarHBondContact OD2-N 2.86Å
164	L	95	Very high	89.1	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	140.8	-172.3	-52.2	-178	0	0	0	111.7	V152 V154 I160 A162 I246 L261 T262	V152-L164 HydrophobicContact CB-CD1 4.31Å; V152-L164 HydrophobicContact CG2-CD2 4.15Å; V154-L164 HydrophobicContact CG2-CD1 4.06Å; I160-L164 HydrophobicContact CG2-CD1 4.1Å; I160-L164 HydrophobicContact CG2-CG 4.16Å; A162-L164 HydrophobicContact CB-CD2 4.35Å; A162-L164 WeakPolarHBondContact O-CG 3.27Å; A162-L164 PolarHBondContact O-N 2.92Å; L164-I246 HydrophobicContact CB-CB 4.47Å; L164-I246 PolarHBondContact N-O 3.45Å; L164-I246 PolarHBondContact O-N 3.03Å; L164-L261 CarbonylContact C-O 3.58Å; L164-L261 VanDerWaalsContact CA-O 3.27Å; L164-L261 WeakPolarHBondContact CA-O 3.48Å; L164-T262 HydrophobicContact CD2-CG2 4.36Å; L164-T262 WeakPolarHBondContact CD2-OG1 3.47Å
165	V	94.6	Very high	88.8	Confident	1 Å²	1	23.2 Å²	23.2	1%	0.006	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	123.1	163.5	168.8	0	0	0	0	109.1	L167 F226 L240 L245 G260 L261 V263	V165-L167 PolarHBondContact O-N 3.4Å; V165-F226 HydrophobicContact CG2-CE1 4.2Å; V165-F226 HydrophobicContact CG2-CZ 4.15Å; V165-L240 HydrophobicContact CG1-CD1 4.29Å; V165-L240 HydrophobicContact CG1-CD2 3.91Å; V165-L240 HydrophobicContact CG2-CD1 4.28Å; V165-L245 HydrophobicContact CG2-CD1 4.38Å; V165-G260 CarbonylContact O-C 3.59Å; V165-G260 WeakPolarHBondContact O-CA 3.44Å; V165-L261 HydrophobicContact CB-CB 4.45Å; V165-L261 PolarHBondContact N-O 2.85Å; V165-L261 PolarHBondContact O-N 2.87Å; V165-V263 HydrophobicContact CB-CG2 4.34Å; V165-V263 HydrophobicContact CG2-CG2 3.54Å
166	L	94.3	Very high	88.5	Confident	1 Å²	1	20.4 Å²	20.4	1%	0.005	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	119.7	-178.9	179.8	58.1	0	0	0	111.4	A174 R192 G194 Q244 I246 I258	L166-A174 WeakPolarHBondContact CD2-O 3.33Å; L166-R192 HydrophobicContact CD2-CB 4.18Å; L166-G194 VanDerWaalsContact CD2-N 3.35Å; L166-Q244 PolarHBondContact N-O 2.95Å; L166-I246 HydrophobicContact CB-CD1 3.85Å; L166-I246 HydrophobicContact CB-CG1 4.27Å; L166-I246 HydrophobicContact CD1-CD1 3.9Å; L166-I246 HydrophobicContact CD2-CD1 4.17Å; L166-I246 HydrophobicContact CG-CD1 4.19Å; L166-I258 HydrophobicContact CD1-CB 4Å; L166-I258 HydrophobicContact CD1-CG2 4.13Å
167	L	92.5	Very high	88.4	Confident	3 Å²	3	19.1 Å²	19.1	2%	0.016	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-56.9	178.1	-60	177.2	0	0	0	111.3	L151 V165 T198 L207 F210 F259 L261	L151-L167 HydrophobicContact CD2-CD1 3.59Å; V165-L167 PolarHBondContact O-N 3.4Å; L167-T198 HydrophobicContact CD2-CG2 4.1Å; L167-T198 CarbonylContact O-C 3.52Å; L167-T198 WeakPolarHBondContact O-CB 3.5Å; L167-T198 PolarHBondContact O-OG1 3.41Å; L167-L207 HydrophobicContact CD1-CD2 4.09Å; L167-F210 HydrophobicContact CD2-CE1 4.47Å; L167-F259 PolarHBondContact N-O 2.94Å; L167-L261 HydrophobicContact CD1-CB 4.34Å
168	A	92	Very high	88.5	Confident	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	163.3	-177.3	0	0	0	0	0	111.2	L201 I258 F259	A168-L201 VanDerWaalsContact CB-O 3.31Å; A168-L201 WeakPolarHBondContact CB-O 3.23Å; A168-I258 WeakPolarHBondContact O-CA 3.34Å; A168-F259 HydrophobicContact CB-CD2 4.1Å; A168-F259 PolarHBondContact N-O 2.93Å; A168-F259 PolarHBondContact O-N 2.78Å
169	S	90.3	Very high	88.2	Confident	4 Å²	4	12.5 Å²	12.5	3%	0.028	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	166	-177.5	79.8	0	0	0	0	111.8	E171 A174 M175	S169-E171 VanDerWaalsContact C-N 3.26Å; S169-E171 PolarHBondContact O-N 2.84Å; S169-E171 PolarHBondContact OG-N 3.21Å; S169-E171 VanDerWaalsContact OG-N 3.09Å; S169-E171 PolarHBondContact OG-O 3.48Å; S169-A174 VanDerWaalsContact OG-C 3.29Å; S169-A174 VanDerWaalsContact OG-CA 3.31Å; S169-A174 WeakPolarHBondContact OG-CA 3.43Å; S169-M175 WeakPolarHBondContact CB-O 3.49Å; S169-M175 PolarHBondContact OG-N 2.9Å; S169-M175 PolarHBondContact OG-O 3.46Å
170	S	87.9	Confident	87.8	Confident	2 Å²	2	11.4 Å²	11.4	1%	0.014	6%	0.059	C	C	.	.	S	Bend	trans	-67.8	-22.1	168.8	67.8	0	0	0	0	114.6	T255 K256 W257 P1230	S170-T255 WeakPolarHBondContact OG-CG2 3.33Å; S170-K256 PolarHBondContact OG-N 3.36Å; S170-W257 PolarHBondContact N-O 3.1Å; S170-P1230 WeakPolarHBondContact O-CD 3.31Å
171	E	81.8	Confident	86.7	Confident	8 Å²	8	11.7 Å²	11.7	4%	0.037	6%	0.061	C	C	.	.	S	Bend	trans	-85.2	155.5	178.3	-52.5	-57.2	126.1	0	0	111	S169 M175 T255 Y1223 K1229	S169-E171 VanDerWaalsContact C-N 3.26Å; S169-E171 PolarHBondContact O-N 2.84Å; S169-E171 PolarHBondContact OG-N 3.21Å; S169-E171 VanDerWaalsContact OG-N 3.09Å; S169-E171 PolarHBondContact OG-O 3.48Å; E171-M175 HydrophobicContact CB-CB 4.26Å; E171-M175 VanDerWaalsContact CB-O 3.29Å; E171-M175 WeakPolarHBondContact CB-O 3.44Å; E171-T255 HydrophobicContact CG-CG2 4.17Å; E171-Y1223 WeakPolarHBondContact OE2-CE2 3.25Å; E171-Y1223 PolarHBondContact OE2-OH 3.02Å; E171-K1229 WeakPolarHBondContact OE1-CD 3.32Å; E171-K1229 VanDerWaalsContact OE1-CE 3.24Å; E171-K1229 WeakPolarHBondContact OE1-CE 3.44Å; E171-K1229 IonicContact OE1-NZ 2.71Å; E171-K1229 PolarHBondContact OE1-NZ 2.85Å; E171-K1229 WeakPolarHBondContact OE2-CE 3.48Å; E171-K1229 IonicContact OE2-NZ 3.3Å; E171-K1229 PolarHBondContact OE2-NZ 3.26Å
172	P	76.2	Confident	85.8	Confident	59 Å²	59	14.1 Å²	14.1	38%	0.383	7%	0.074	S	C	.	.	G	3₁₀ helix	trans	-57.6	152.4	175.9	22.6	-33.3	0	0	0	112	A174 M175 A1222	P172-A174 PolarHBondContact O-N 3.4Å; P172-M175 HydrophobicContact CG-CE 4.04Å; P172-M175 WeakPolarHBondContact O-CE 3.35Å; P172-M175 WeakPolarHBondContact O-CG 3.43Å; P172-M175 PolarHBondContact O-N 3.27Å; P172-A1222 WeakPolarHBondContact CG-O 3.02Å
173	Q	77.4	Confident	84.9	Confident	101 Å²	101	15.1 Å²	15.1	47%	0.472	8%	0.079	S	C	.	.	G	3₁₀ helix	trans	59	26.4	178.5	-56.8	-176.7	-24.8	0	0	115	M175	Q173-M175 HydrophobicContact CB-CG 4.28Å; Q173-M175 PolarHBondContact O-N 3.41Å
174	A	83.9	Confident	83.8	Confident	1 Å²	1	16.5 Å²	16.5	1%	0.008	9%	0.086	C	C	.	.	G	3₁₀ helix	trans	54.6	36.7	-177.6	0	0	0	0	0	112.8	L166 S169 P172 G194 T199	L166-A174 WeakPolarHBondContact CD2-O 3.33Å; S169-A174 VanDerWaalsContact OG-C 3.29Å; S169-A174 VanDerWaalsContact OG-CA 3.31Å; S169-A174 WeakPolarHBondContact OG-CA 3.43Å; P172-A174 PolarHBondContact O-N 3.4Å; A174-G194 PolarHBondContact O-N 2.77Å; A174-T199 HydrophobicContact CB-CG2 4.18Å
175	M	84.8	Confident	82.3	Confident	1 Å²	1	16.7 Å²	16.7	1%	0.005	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	144.3	177.4	-68.8	-173	-66.8	0	0	111.4	S169 E171 P172 Q173 L191 R192 Q193 V1214 L1219 A1222	S169-M175 WeakPolarHBondContact CB-O 3.49Å; S169-M175 PolarHBondContact OG-N 2.9Å; S169-M175 PolarHBondContact OG-O 3.46Å; E171-M175 HydrophobicContact CB-CB 4.26Å; E171-M175 VanDerWaalsContact CB-O 3.29Å; E171-M175 WeakPolarHBondContact CB-O 3.44Å; P172-M175 HydrophobicContact CG-CE 4.04Å; P172-M175 WeakPolarHBondContact O-CE 3.35Å; P172-M175 WeakPolarHBondContact O-CG 3.43Å; P172-M175 PolarHBondContact O-N 3.27Å; Q173-M175 HydrophobicContact CB-CG 4.28Å; Q173-M175 PolarHBondContact O-N 3.41Å; M175-L191 HydrophobicContact CB-CD1 4.1Å; M175-L191 HydrophobicContact CG-CD1 4.42Å; M175-L191 HydrophobicContact SD-CD1 4.32Å; M175-L191 HydrophobicContact SD-CD2 4.47Å; M175-R192 CarbonylContact C-O 3.52Å; M175-R192 WeakPolarHBondContact CA-O 3.44Å; M175-Q193 HydrophobicContact CG-CG 4.35Å; M175-V1214 HydrophobicContact SD-CG2 4.25Å; M175-L1219 HydrophobicContact SD-CD1 4.02Å; M175-A1222 HydrophobicContact CE-CB 3.75Å
176	C	85.8	Confident	81	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	157.7	166.2	70.6	0	0	0	0	111.3	R192 L252 T255 I258	C176-R192 PolarHBondContact N-O 3.4Å; C176-R192 PolarHBondContact O-N 3.39Å; C176-L252 HydrophobicContact CB-CD1 4Å; C176-T255 WeakPolarHBondContact CA-OG1 3.33Å; C176-T255 HydrophobicContact CB-CG2 3.92Å; C176-I258 HydrophobicContact CB-CG2 3.56Å
177	Y	83.6	Confident	79.6	Confident	20 Å²	20	22.8 Å²	22.8	8%	0.078	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	129.2	173.8	-56.7	-93.2	0	0	0	109.1	L189 K190 L191 K253 N254 T255 L1219	Y177-L189 HydrophobicContact CD1-CB 4.36Å; Y177-K190 WeakPolarHBondContact CA-O 3.41Å; Y177-L191 HydrophobicContact CD1-CD1 4Å; Y177-L191 HydrophobicContact CE1-CD1 3.68Å; Y177-L191 HydrophobicContact CE2-CD1 4.38Å; Y177-K253 WeakPolarHBondContact CB-O 3.33Å; Y177-K253 PolarHBondContact O-N 3.26Å; Y177-N254 HydrophobicContact CD2-CB 3.83Å; Y177-N254 HydrophobicContact CE2-CB 4.48Å; Y177-N254 HydrophobicContact CG-CB 4.23Å; Y177-T255 PolarHBondContact N-OG1 3.49Å; Y177-L1219 VanDerWaalsContact OH-CD1 3.3Å; Y177-L1219 WeakPolarHBondContact OH-CD1 3.33Å
178	I	85.8	Confident	78.5	Confident	1 Å²	1	24.5 Å²	24.5	1%	0.005	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	141.5	175.3	64.6	169.6	0	0	0	109.1	I160 T180 K190 R192 I246 A250 S251 L252	I160-I178 HydrophobicContact CD1-CG2 4.05Å; I178-T180 HydrophobicContact CD1-CG2 4.01Å; I178-T180 HydrophobicContact CG1-CG2 4.24Å; I178-K190 HydrophobicContact CG1-CB 4.18Å; I178-K190 PolarHBondContact N-O 3.03Å; I178-K190 PolarHBondContact O-N 3.43Å; I178-R192 HydrophobicContact CD1-CG 3.7Å; I178-R192 HydrophobicContact CG1-CG 3.94Å; I178-I246 HydrophobicContact CD1-CG2 4.46Å; I178-I246 HydrophobicContact CG2-CG2 4.14Å; I178-A250 HydrophobicContact CB-CB 4.4Å; I178-A250 HydrophobicContact CD1-CB 4.37Å; I178-S251 CarbonylContact C-O 3.39Å; I178-S251 WeakPolarHBondContact CA-O 3.1Å; I178-L252 HydrophobicContact CG2-CD1 4.4Å
179	E	81.5	Confident	77.6	Confident	35 Å²	35	26.2 Å²	26.2	16%	0.164	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	124.6	169.7	-167.9	-168.9	154.4	0	0	108.3	S181 L189 A250 S251 K253	E179-S181 WeakPolarHBondContact OE1-CB 3.48Å; E179-S181 PolarHBondContact OE1-OG 2.9Å; E179-L189 HydrophobicContact CB-CD2 3.99Å; E179-L189 HydrophobicContact CG-CD2 4.39Å; E179-A250 CarbonylContact O-C 3.57Å; E179-A250 WeakPolarHBondContact O-CA 3.08Å; E179-A250 WeakPolarHBondContact O-CB 3.06Å; E179-S251 WeakPolarHBondContact CB-OG 3.08Å; E179-S251 PolarHBondContact N-O 3.5Å; E179-S251 PolarHBondContact O-N 3.4Å; E179-S251 PolarHBondContact OE2-OG 2.8Å; E179-K253 HydrophobicContact CB-CG 3.93Å; E179-K253 WeakPolarHBondContact OE2-CE 3.4Å
180	T	79.6	Confident	76.9	Confident	3 Å²	3	26.8 Å²	26.8	2%	0.018	14%	0.141	C	C	.	.			trans	-103.6	16.4	-177.3	56.7	0	0	0	0	113.4	I178 N182 L183 D184 E186 K190 A250	I178-T180 HydrophobicContact CD1-CG2 4.01Å; I178-T180 HydrophobicContact CG1-CG2 4.24Å; T180-N182 PolarHBondContact O-N 3.28Å; T180-L183 HydrophobicContact CG2-CD1 3.92Å; T180-L183 WeakPolarHBondContact O-CA 3.34Å; T180-L183 WeakPolarHBondContact O-CB 3.44Å; T180-L183 PolarHBondContact O-N 3.06Å; T180-D184 WeakPolarHBondContact CB-OD1 3.38Å; T180-D184 PolarHBondContact O-N 3.07Å; T180-D184 PolarHBondContact OG1-OD1 2.86Å; T180-D184 PolarHBondContact OG1-OD2 2.96Å; T180-D184 VanDerWaalsContact OG1-OD2 3.05Å; T180-E186 CarbonylContact C-O 3.55Å; T180-K190 HydrophobicContact CG2-CD 3.93Å; T180-K190 WeakPolarHBondContact OG1-CD 3.38Å; T180-K190 WeakPolarHBondContact OG1-CE 3.48Å; T180-A250 HydrophobicContact CG2-CB 4.35Å
181	S	71.9	Confident	76.5	Confident	6 Å²	6	28.2 Å²	28.2	4%	0.042	15%	0.148	C	C	.	.	H	α-helix	trans	-47.1	-42.7	-178.9	51.6	0	0	0	0	113.2	E179 L183 G185 E186 E872	E179-S181 WeakPolarHBondContact OE1-CB 3.48Å; E179-S181 PolarHBondContact OE1-OG 2.9Å; S181-L183 VanDerWaalsContact C-N 3.26Å; S181-L183 PolarHBondContact O-N 3.39Å; S181-G185 WeakPolarHBondContact O-CA 3.42Å; S181-G185 PolarHBondContact O-N 3.08Å; S181-E186 VanDerWaalsContact CA-O 3.26Å; S181-E186 WeakPolarHBondContact CA-O 2.96Å; S181-E186 PolarHBondContact N-O 3.05Å; S181-E872 CarbonylContact C-O 3.55Å; S181-E872 WeakPolarHBondContact CA-O 3.3Å; S181-E872 VanDerWaalsContact CB-O 3.26Å; S181-E872 WeakPolarHBondContact CB-O 3.33Å
182	N	73.8	Confident	76.7	Confident	50 Å²	50	29.7 Å²	29.7	27%	0.267	15%	0.153	S	C	.	.	H	α-helix	trans	-72.1	-5.6	176.3	-68.2	-38.3	0	0	0	116.3	T180 G249 G873 R874 Q875	T180-N182 PolarHBondContact O-N 3.28Å; N182-G249 WeakPolarHBondContact CB-O 3.19Å; N182-G249 PolarHBondContact ND2-O 3.05Å; N182-G249 VanDerWaalsContact ND2-O 3.1Å; N182-G873 WeakPolarHBondContact OD1-CA 3.49Å; N182-R874 PolarHBondContact OD1-N 2.87Å; N182-Q875 VanDerWaalsContact O-CD 3.25Å; N182-Q875 WeakPolarHBondContact O-CG 3.43Å; N182-Q875 PolarHBondContact O-NE2 3.47Å
183	L	75.7	Confident	77.1	Confident	22 Å²	22	28.9 Å²	28.9	12%	0.115	15%	0.145	C	C	.	.	H	α-helix	trans	-107.7	-54.6	-176.3	-68.3	160.3	0	0	0	111.1	T180 S181 L223 L247 A250 V271 A853	T180-L183 HydrophobicContact CG2-CD1 3.92Å; T180-L183 WeakPolarHBondContact O-CA 3.34Å; T180-L183 WeakPolarHBondContact O-CB 3.44Å; T180-L183 PolarHBondContact O-N 3.06Å; S181-L183 VanDerWaalsContact C-N 3.26Å; S181-L183 PolarHBondContact O-N 3.39Å; L183-L223 HydrophobicContact CD2-CD2 4.31Å; L183-L247 HydrophobicContact CD1-CB 3.85Å; L183-L247 HydrophobicContact CD1-CD1 4.09Å; L183-L247 HydrophobicContact CD2-CB 4.48Å; L183-A250 HydrophobicContact CD1-CB 3.99Å; L183-V271 HydrophobicContact CD2-CB 4.19Å; L183-V271 HydrophobicContact CD2-CG1 4.24Å; L183-V271 HydrophobicContact CD2-CG2 3.18Å; L183-A853 VanDerWaalsContact O-CB 3.28Å; L183-A853 WeakPolarHBondContact O-CB 3.34Å
184	D	70.5	Confident	77.5	Confident	28 Å²	28	24.1 Å²	24.1	15%	0.15	12%	0.123	C	C	.	.	H	α-helix	trans	-118.4	-2.6	-174.1	50.3	22.3	0	0	0	112.6	T180 E186 K190 N854	T180-D184 WeakPolarHBondContact CB-OD1 3.38Å; T180-D184 PolarHBondContact O-N 3.07Å; T180-D184 PolarHBondContact OG1-OD1 2.86Å; T180-D184 PolarHBondContact OG1-OD2 2.96Å; T180-D184 VanDerWaalsContact OG1-OD2 3.05Å; D184-E186 HydrophobicContact CB-CG 4.21Å; D184-E186 PolarHBondContact O-N 2.77Å; D184-E186 WeakPolarHBondContact OD1-CB 3.46Å; D184-E186 PolarHBondContact OD1-N 3.23Å; D184-K190 IonicContact OD2-NZ 3.72Å; D184-K190 PolarHBondContact OD2-NZ 3.43Å; D184-N854 PolarHBondContact O-ND2 3.26Å; D184-N854 PolarHBondContact O-OD1 2.92Å
185	G	63.9	Low	77.7	Confident	4 Å²	4	24.8 Å²	24.8	4%	0.041	13%	0.126	C	C	.	.	S	Bend	trans	76.4	-0.2	-175	0	0	0	0	0	113.2	S181	S181-G185 WeakPolarHBondContact O-CA 3.42Å; S181-G185 PolarHBondContact O-N 3.08Å
186	E	67.1	Low	77.7	Confident	76 Å²	76	29.6 Å²	29.6	36%	0.355	16%	0.157	S	C	.	.			trans	-83.6	123.3	-178.9	-51.8	-172.1	157.6	0	0	110.1	T180 S181 D184 N188 K190	T180-E186 CarbonylContact C-O 3.55Å; S181-E186 VanDerWaalsContact CA-O 3.26Å; S181-E186 WeakPolarHBondContact CA-O 2.96Å; S181-E186 PolarHBondContact N-O 3.05Å; D184-E186 HydrophobicContact CB-CG 4.21Å; D184-E186 PolarHBondContact O-N 2.77Å; D184-E186 WeakPolarHBondContact OD1-CB 3.46Å; D184-E186 PolarHBondContact OD1-N 3.23Å; E186-N188 VanDerWaalsContact C-N 3.3Å; E186-N188 WeakPolarHBondContact CB-OD1 3.46Å; E186-N188 PolarHBondContact OE2-OD1 3.35Å; E186-K190 WeakPolarHBondContact OE2-CE 3.2Å; E186-K190 IonicContact OE2-NZ 2.67Å; E186-K190 PolarHBondContact OE2-NZ 2.97Å
187	T	65.4	Low	77.7	Confident	54 Å²	54	32.3 Å²	32.3	33%	0.331	17%	0.174	S	C	.	.			trans	-87.1	-2.1	179.5	57.4	0	0	0	0	112.9	N459 E872	T187-N459 PolarHBondContact OG1-ND2 3.1Å; T187-E872 HydrophobicContact CG2-CB 4.27Å; T187-E872 HydrophobicContact CG2-CG 3.88Å
188	N	68.9	Low	77.9	Confident	39 Å²	39	31.5 Å²	31.5	21%	0.209	17%	0.171	C	C	.	.	S	Bend	trans	-67.2	142.8	176.2	61.2	-28	0	0	0	109.9	E186 K190	E186-N188 VanDerWaalsContact C-N 3.3Å; E186-N188 WeakPolarHBondContact CB-OD1 3.46Å; E186-N188 PolarHBondContact OE2-OD1 3.35Å; N188-K190 PolarHBondContact O-N 3.07Å
189	L	74.4	Confident	77.9	Confident	37 Å²	37	33.3 Å²	33.3	19%	0.194	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	115.1	173.6	-63	-178	0	0	0	108.9	Y177 E179 K253 N254	Y177-L189 HydrophobicContact CD1-CB 4.36Å; E179-L189 HydrophobicContact CB-CD2 3.99Å; E179-L189 HydrophobicContact CG-CD2 4.39Å; L189-K253 HydrophobicContact CD1-CB 4.45Å; L189-K253 HydrophobicContact CD2-CB 3.62Å; L189-K253 HydrophobicContact CD2-CG 3.8Å; L189-N254 WeakPolarHBondContact CD1-ND2 3.45Å
190	K	75.3	Confident	78.1	Confident	16 Å²	16	36.9 Å²	36.9	7%	0.07	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	129.7	176	-60.3	-169.7	179.4	-174	0	109.4	Y177 I178 T180 D184 E186 N188 E1209	Y177-K190 WeakPolarHBondContact CA-O 3.41Å; I178-K190 HydrophobicContact CG1-CB 4.18Å; I178-K190 PolarHBondContact N-O 3.03Å; I178-K190 PolarHBondContact O-N 3.43Å; T180-K190 HydrophobicContact CG2-CD 3.93Å; T180-K190 WeakPolarHBondContact OG1-CD 3.38Å; T180-K190 WeakPolarHBondContact OG1-CE 3.48Å; D184-K190 IonicContact OD2-NZ 3.72Å; D184-K190 PolarHBondContact OD2-NZ 3.43Å; E186-K190 WeakPolarHBondContact OE2-CE 3.2Å; E186-K190 IonicContact OE2-NZ 2.67Å; E186-K190 PolarHBondContact OE2-NZ 2.97Å; N188-K190 PolarHBondContact O-N 3.07Å; K190-E1209 VanDerWaalsContact CE-OE1 3.27Å; K190-E1209 WeakPolarHBondContact CE-OE1 3.14Å; K190-E1209 IonicContact NZ-OE1 2.67Å
191	L	79.7	Confident	78.5	Confident	32 Å²	32	37 Å²	37	17%	0.168	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	129.1	177	-177	72.7	0	0	0	110	M175 Y177 V1214 L1219	M175-L191 HydrophobicContact CB-CD1 4.1Å; M175-L191 HydrophobicContact CG-CD1 4.42Å; M175-L191 HydrophobicContact SD-CD1 4.32Å; M175-L191 HydrophobicContact SD-CD2 4.47Å; Y177-L191 HydrophobicContact CD1-CD1 4Å; Y177-L191 HydrophobicContact CE1-CD1 3.68Å; Y177-L191 HydrophobicContact CE2-CD1 4.38Å; L191-V1214 HydrophobicContact CD2-CB 3.52Å; L191-V1214 HydrophobicContact CD2-CG1 4.4Å; L191-V1214 HydrophobicContact CD2-CG2 3.68Å; L191-L1219 HydrophobicContact CD1-CD1 4.1Å; L191-L1219 HydrophobicContact CD2-CD1 3.78Å
192	R	84.8	Confident	79.2	Confident	38 Å²	38	39.7 Å²	39.7	14%	0.143	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	150.9	170.7	-60.8	-67.9	173.5	175.5	-8.6	109.5	L166 M175 C176 I178 P242 T243 I246	L166-R192 HydrophobicContact CD2-CB 4.18Å; M175-R192 CarbonylContact C-O 3.52Å; M175-R192 WeakPolarHBondContact CA-O 3.44Å; C176-R192 PolarHBondContact N-O 3.4Å; C176-R192 PolarHBondContact O-N 3.39Å; I178-R192 HydrophobicContact CD1-CG 3.7Å; I178-R192 HydrophobicContact CG1-CG 3.94Å; R192-P242 PolarHBondContact NH1-O 3.24Å; R192-T243 WeakPolarHBondContact CD-O 3.28Å; R192-I246 HydrophobicContact CG-CG1 4.41Å
193	Q	84.5	Confident	79.7	Confident	43 Å²	43	40.2 Å²	40.2	20%	0.201	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	124.9	-177.2	-169.3	-175.6	6.7	0	0	110.1	M175 T243 Q244	M175-Q193 HydrophobicContact CG-CG 4.35Å; Q193-T243 PolarHBondContact N-O 3.19Å; Q193-Q244 WeakPolarHBondContact O-CG 3.41Å; Q193-Q244 PolarHBondContact O-NE2 3.4Å
194	G	87.1	Confident	80.1	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.01	22%	0.217	C	C	.	.			trans	-70.8	175.7	174	0	0	0	0	0	112.2	L166 A174	L166-G194 VanDerWaalsContact CD2-N 3.35Å; A174-G194 PolarHBondContact O-N 2.77Å
195	L	87.2	Confident	80.8	Confident	15 Å²	15	40.6 Å²	40.6	8%	0.079	23%	0.232	C	C	.	.			trans	-71.7	140.9	175.2	-71.6	169.4	0	0	0	110.7	V197 T198 T199 I230 H238 L240 Q244	L195-V197 PolarHBondContact O-N 3.01Å; L195-V197 VanDerWaalsContact O-N 3.15Å; L195-T198 HydrophobicContact CB-CG2 4.48Å; L195-T198 PolarHBondContact O-N 2.82Å; L195-T198 VanDerWaalsContact O-N 3.08Å; L195-T198 PolarHBondContact O-OG1 3.2Å; L195-T199 PolarHBondContact O-N 2.81Å; L195-T199 PolarHBondContact O-OG1 3.38Å; L195-I230 HydrophobicContact CD1-CG2 3.29Å; L195-H238 HydrophobicContact CD1-CB 4.09Å; L195-H238 HydrophobicContact CD2-CB 4.48Å; L195-L240 HydrophobicContact CD1-CD2 3.72Å; L195-L240 HydrophobicContact CG-CD2 4.23Å; L195-Q244 HydrophobicContact CD2-CG 4.42Å; L195-Q244 HydrophobicContact CG-CG 4.31Å
196	P	84.1	Confident	81.8	Confident	101 Å²	101	43.8 Å²	43.8	66%	0.656	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-56.1	-32.9	174.2	-26.7	34.8	0	0	0	112.8	T198 T199	P196-T198 VanDerWaalsContact C-N 3.34Å; P196-T198 PolarHBondContact O-N 2.67Å; P196-T199 WeakPolarHBondContact CA-OG1 3.5Å; P196-T199 WeakPolarHBondContact O-CB 3.25Å; P196-T199 PolarHBondContact O-N 3.38Å; P196-T199 PolarHBondContact O-OG1 3.03Å
197	V	86.3	Confident	82.7	Confident	58 Å²	58	40.2 Å²	40.2	35%	0.352	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-68.6	-31	-179.3	-177	0	0	0	0	112.1	L195 H200 T232	L195-V197 PolarHBondContact O-N 3.01Å; L195-V197 VanDerWaalsContact O-N 3.15Å; V197-H200 PolarHBondContact O-CE1 2.78Å; V197-H200 PolarHBondContact O-ND1 3.02Å; V197-T232 HydrophobicContact CG1-CG2 4.49Å
198	T	88.1	Confident	83.7	Confident	3 Å²	3	38.9 Å²	38.9	2%	0.018	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-93.6	-4.3	-178.7	53.5	0	0	0	0	113.1	L167 L195 P196 H200 L201 F210	L167-T198 HydrophobicContact CD2-CG2 4.1Å; L167-T198 CarbonylContact O-C 3.52Å; L167-T198 WeakPolarHBondContact O-CB 3.5Å; L167-T198 PolarHBondContact O-OG1 3.41Å; L195-T198 HydrophobicContact CB-CG2 4.48Å; L195-T198 PolarHBondContact O-N 2.82Å; L195-T198 VanDerWaalsContact O-N 3.08Å; L195-T198 PolarHBondContact O-OG1 3.2Å; P196-T198 VanDerWaalsContact C-N 3.34Å; P196-T198 PolarHBondContact O-N 2.67Å; T198-H200 PolarHBondContact O-N 2.75Å; T198-H200 VanDerWaalsContact O-N 3.14Å; T198-L201 HydrophobicContact CG2-CD1 4.15Å; T198-L201 WeakPolarHBondContact O-CB 3.47Å; T198-L201 WeakPolarHBondContact O-CG 3.36Å; T198-L201 PolarHBondContact O-N 2.98Å; T198-L201 VanDerWaalsContact O-N 3.1Å; T198-F210 HydrophobicContact CG2-CE2 4.41Å; T198-F210 HydrophobicContact CG2-CZ 3.94Å
199	T	85.2	Confident	84.5	Confident	39 Å²	39	41.3 Å²	41.3	24%	0.239	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-25.5	-174.7	-57.3	0	0	0	0	113.4	A174 L195 P196 L201	A174-T199 HydrophobicContact CB-CG2 4.18Å; L195-T199 PolarHBondContact O-N 2.81Å; L195-T199 PolarHBondContact O-OG1 3.38Å; P196-T199 WeakPolarHBondContact CA-OG1 3.5Å; P196-T199 WeakPolarHBondContact O-CB 3.25Å; P196-T199 PolarHBondContact O-N 3.38Å; P196-T199 PolarHBondContact O-OG1 3.03Å; T199-L201 VanDerWaalsContact C-N 3.33Å
200	H	86.9	Confident	85	Confident	110 Å²	110	40.7 Å²	40.7	51%	0.509	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-11.3	-179.8	69.2	-84.2	0	0	0	113.9	V197 T198 L202	V197-H200 PolarHBondContact O-CE1 2.78Å; V197-H200 PolarHBondContact O-ND1 3.02Å; T198-H200 PolarHBondContact O-N 2.75Å; T198-H200 VanDerWaalsContact O-N 3.14Å; H200-L202 VanDerWaalsContact C-N 3.25Å; H200-L202 PolarHBondContact O-N 3.16Å
201	L	87.5	Confident	85.6	Confident	5 Å²	5	42.9 Å²	42.9	3%	0.026	25%	0.25	C	S	.	.			trans	-75.4	74	-178.6	-58.4	175.2	0	0	0	110.5	A168 T198 T199 E206 L207 F210 F259	A168-L201 VanDerWaalsContact CB-O 3.31Å; A168-L201 WeakPolarHBondContact CB-O 3.23Å; T198-L201 HydrophobicContact CG2-CD1 4.15Å; T198-L201 WeakPolarHBondContact O-CB 3.47Å; T198-L201 WeakPolarHBondContact O-CG 3.36Å; T198-L201 PolarHBondContact O-N 2.98Å; T198-L201 VanDerWaalsContact O-N 3.1Å; T199-L201 VanDerWaalsContact C-N 3.33Å; L201-E206 HydrophobicContact CD2-CB 3.95Å; L201-L207 HydrophobicContact CB-CD2 4.41Å; L201-L207 HydrophobicContact CB-CG 4.38Å; L201-F210 HydrophobicContact CD1-CB 4.38Å; L201-F210 HydrophobicContact CD1-CD1 4.16Å; L201-F210 HydrophobicContact CD1-CD2 3.84Å; L201-F210 HydrophobicContact CD1-CE1 4.41Å; L201-F210 HydrophobicContact CD1-CE2 4.11Å; L201-F210 HydrophobicContact CD1-CG 3.87Å; L201-F210 HydrophobicContact CD1-CZ 4.39Å; L201-F210 HydrophobicContact CD2-CB 4.44Å; L201-F210 HydrophobicContact CD2-CD2 4.28Å; L201-F259 WeakPolarHBondContact O-CD2 3.35Å
202	L	86.2	Confident	86	Confident	62 Å²	62	41.5 Å²	41.5	33%	0.325	24%	0.244	S	C	.	.			trans	-100.4	-13.5	-172.7	-60	179.4	0	0	0	112.9	H200 E206 W257 G1232	H200-L202 VanDerWaalsContact C-N 3.25Å; H200-L202 PolarHBondContact O-N 3.16Å; L202-E206 PolarHBondContact N-OE2 3.2Å; L202-W257 HydrophobicContact CD2-CH2 3.8Å; L202-G1232 WeakPolarHBondContact O-CA 3.28Å
203	T	85.5	Confident	86.3	Confident	61 Å²	61	41.6 Å²	41.6	37%	0.374	25%	0.248	S	C	.	.	S	Bend	trans	-117.8	150.9	-178.5	62.5	0	0	0	0	112.5	G205 E206 L207 R1233	T203-G205 PolarHBondContact O-N 2.94Å; T203-E206 PolarHBondContact N-OE2 2.89Å; T203-E206 PolarHBondContact O-N 3.35Å; T203-E206 VanDerWaalsContact OG1-CG 3.24Å; T203-E206 WeakPolarHBondContact OG1-CG 3.49Å; T203-E206 PolarHBondContact OG1-N 3.44Å; T203-E206 PolarHBondContact OG1-OE2 3.07Å; T203-L207 PolarHBondContact O-N 3.33Å; T203-L207 VanDerWaalsContact O-N 3.1Å; T203-R1233 CarbonylContact C-O 3.59Å; T203-R1233 WeakPolarHBondContact CA-O 3.23Å
204	A	84	Confident	86.6	Confident	12 Å²	12	39.5 Å²	39.5	10%	0.099	24%	0.239	C	C	.	.	H	α-helix	trans	-56.1	-34.5	175.1	0	0	0	0	0	112.7	L133 W138 S208 R1233	L133-A204 HydrophobicContact CD1-CB 4Å; W138-A204 HydrophobicContact CZ2-CB 4.26Å; A204-S208 WeakPolarHBondContact O-CB 3.18Å; A204-S208 PolarHBondContact O-N 2.76Å; A204-S208 PolarHBondContact O-OG 2.83Å; A204-R1233 PolarHBondContact N-O 2.92Å
205	G	84	Confident	86.8	Confident	46 Å²	46	42.1 Å²	42.1	47%	0.474	25%	0.25	S	S	.	.	H	α-helix	trans	-61.3	-51.6	176.1	0	0	0	0	0	112.1	T203 L207 S208 S209	T203-G205 PolarHBondContact O-N 2.94Å; G205-L207 PolarHBondContact O-N 3.1Å; G205-S208 PolarHBondContact O-N 3.2Å; G205-S208 PolarHBondContact O-OG 2.81Å; G205-S209 PolarHBondContact O-N 2.97Å; G205-S209 VanDerWaalsContact O-N 3.1Å; G205-S209 PolarHBondContact O-OG 2.91Å
206	E	85.3	Confident	86.9	Confident	71 Å²	71	41.5 Å²	41.5	33%	0.332	25%	0.248	S	C	.	.	H	α-helix	trans	-60.9	-45.4	178.5	-70.4	161.7	160.5	0	0	111.7	L201 L202 T203 S208 S209 F210	L201-E206 HydrophobicContact CD2-CB 3.95Å; L202-E206 PolarHBondContact N-OE2 3.2Å; T203-E206 PolarHBondContact N-OE2 2.89Å; T203-E206 PolarHBondContact O-N 3.35Å; T203-E206 VanDerWaalsContact OG1-CG 3.24Å; T203-E206 WeakPolarHBondContact OG1-CG 3.49Å; T203-E206 PolarHBondContact OG1-N 3.44Å; T203-E206 PolarHBondContact OG1-OE2 3.07Å; E206-S208 VanDerWaalsContact C-N 3.32Å; E206-S208 PolarHBondContact O-N 3.27Å; E206-S209 WeakPolarHBondContact CA-OG 3.17Å; E206-S209 PolarHBondContact O-N 3.25Å; E206-S209 PolarHBondContact O-OG 2.72Å; E206-F210 PolarHBondContact O-N 3.32Å; E206-F210 VanDerWaalsContact O-N 3.12Å
207	L	86.9	Confident	87.1	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.01	22%	0.224	C	C	.	.	H	α-helix	trans	-59.4	-40.1	175.7	-80.6	155.8	0	0	0	113	N37 L133 W138 L151 L167 L201 T203 G205 S209 F210 F259	N37-L207 PolarHBondContact ND2-O 3.29Å; L133-L207 HydrophobicContact CD2-CB 3.7Å; W138-L207 HydrophobicContact CH2-CD1 4.06Å; W138-L207 HydrophobicContact CZ2-CD1 4.06Å; L151-L207 HydrophobicContact CD1-CB 4.43Å; L151-L207 HydrophobicContact CD1-CD2 4.5Å; L167-L207 HydrophobicContact CD1-CD2 4.09Å; L201-L207 HydrophobicContact CB-CD2 4.41Å; L201-L207 HydrophobicContact CB-CG 4.38Å; T203-L207 PolarHBondContact O-N 3.33Å; T203-L207 VanDerWaalsContact O-N 3.1Å; G205-L207 PolarHBondContact O-N 3.1Å; L207-S209 VanDerWaalsContact C-N 3.31Å; L207-S209 PolarHBondContact O-N 3.49Å; L207-F210 WeakPolarHBondContact O-CB 3.49Å; L207-F210 PolarHBondContact O-N 3.49Å; L207-F259 HydrophobicContact CD1-CB 4.39Å; L207-F259 HydrophobicContact CD1-CD1 4Å; L207-F259 HydrophobicContact CD1-CD2 3.5Å; L207-F259 HydrophobicContact CD1-CE1 4.07Å; L207-F259 HydrophobicContact CD1-CE2 3.58Å; L207-F259 HydrophobicContact CD1-CG 3.72Å; L207-F259 HydrophobicContact CD1-CZ 3.87Å; L207-F259 HydrophobicContact CD2-CB 4.23Å; L207-F259 HydrophobicContact CD2-CD2 4.44Å; L207-F259 HydrophobicContact CD2-CG 4.43Å; L207-F259 HydrophobicContact CG-CD2 4.37Å
208	S	85.6	Confident	87.3	Confident	25 Å²	25	38.9 Å²	38.9	18%	0.175	23%	0.229	C	C	.	.	H	α-helix	trans	-72.2	-25.4	179.6	70.9	0	0	0	0	113.5	N37 H136 A204 G205 E206	N37-S208 PolarHBondContact ND2-O 3.29Å; H136-S208 PolarHBondContact CE1-OG 3.07Å; H136-S208 WeakPolarHBondContact ND1-CB 3.14Å; H136-S208 PolarHBondContact ND1-OG 3.47Å; A204-S208 WeakPolarHBondContact O-CB 3.18Å; A204-S208 PolarHBondContact O-N 2.76Å; A204-S208 PolarHBondContact O-OG 2.83Å; G205-S208 PolarHBondContact O-N 3.2Å; G205-S208 PolarHBondContact O-OG 2.81Å; E206-S208 VanDerWaalsContact C-N 3.32Å; E206-S208 PolarHBondContact O-N 3.27Å
209	S	85.3	Confident	87.3	Confident	91 Å²	91	41 Å²	41	64%	0.636	24%	0.242	S	C	*	.	H	α-helix	trans	-85.4	-10.1	174.2	64.8	0	0	0	0	113.8	G205 E206 L207 D211	G205-S209 PolarHBondContact O-N 2.97Å; G205-S209 VanDerWaalsContact O-N 3.1Å; G205-S209 PolarHBondContact O-OG 2.91Å; E206-S209 WeakPolarHBondContact CA-OG 3.17Å; E206-S209 PolarHBondContact O-N 3.25Å; E206-S209 PolarHBondContact O-OG 2.72Å; L207-S209 VanDerWaalsContact C-N 3.31Å; L207-S209 PolarHBondContact O-N 3.49Å; S209-D211 PolarHBondContact O-N 3.32Å; S209-D211 VanDerWaalsContact O-N 3.16Å
210	F	85.8	Confident	87.5	Confident	24 Å²	24	40.6 Å²	40.6	11%	0.105	24%	0.239	C	C	.	.			trans	-75.7	103.3	-176.4	-175.3	-112.3	0	0	0	110.8	V36 N37 L167 T198 L201 E206 L207 A212 I230 T232	V36-F210 HydrophobicContact CG1-CD1 4.2Å; N37-F210 PolarHBondContact ND2-O 2.91Å; L167-F210 HydrophobicContact CD2-CE1 4.47Å; T198-F210 HydrophobicContact CG2-CE2 4.41Å; T198-F210 HydrophobicContact CG2-CZ 3.94Å; L201-F210 HydrophobicContact CD1-CB 4.38Å; L201-F210 HydrophobicContact CD1-CD1 4.16Å; L201-F210 HydrophobicContact CD1-CD2 3.84Å; L201-F210 HydrophobicContact CD1-CE1 4.41Å; L201-F210 HydrophobicContact CD1-CE2 4.11Å; L201-F210 HydrophobicContact CD1-CG 3.87Å; L201-F210 HydrophobicContact CD1-CZ 4.39Å; L201-F210 HydrophobicContact CD2-CB 4.44Å; L201-F210 HydrophobicContact CD2-CD2 4.28Å; E206-F210 PolarHBondContact O-N 3.32Å; E206-F210 VanDerWaalsContact O-N 3.12Å; L207-F210 WeakPolarHBondContact O-CB 3.49Å; L207-F210 PolarHBondContact O-N 3.49Å; F210-A212 HydrophobicContact CD1-CB 4.29Å; F210-A212 HydrophobicContact CE1-CB 3.65Å; F210-A212 HydrophobicContact CZ-CB 3.78Å; F210-I230 HydrophobicContact CE1-CD1 4.07Å; F210-I230 HydrophobicContact CZ-CD1 4.02Å; F210-T232 HydrophobicContact CE2-CG2 4.35Å
211	D	87.7	Confident	87.3	Confident	61 Å²	61	44 Å²	44	33%	0.326	25%	0.247	S	C	.	.			trans	-98.3	121.3	174.1	-167.1	7.1	0	0	0	109.6	K38 S209 A233	K38-D211 WeakPolarHBondContact CE-OD1 3.44Å; K38-D211 IonicContact NZ-OD1 3.98Å; K38-D211 PolarHBondContact NZ-OD1 3.18Å; K38-D211 IonicContact NZ-OD2 2.95Å; K38-D211 PolarHBondContact NZ-OD2 3.33Å; S209-D211 PolarHBondContact O-N 3.32Å; S209-D211 VanDerWaalsContact O-N 3.16Å; D211-A233 HydrophobicContact CB-CB 4.48Å; D211-A233 PolarHBondContact O-N 3.44Å; D211-A233 VanDerWaalsContact O-N 3.13Å
212	A	88.6	Confident	87	Confident	3 Å²	3	49.6 Å²	49.6	3%	0.025	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	159	-178.7	0	0	0	0	0	111.4	V36 F210 I230 R231	V36-A212 HydrophobicContact CB-CB 4.37Å; V36-A212 WeakPolarHBondContact CB-O 3.43Å; V36-A212 HydrophobicContact CG2-CB 4.04Å; V36-A212 WeakPolarHBondContact CG2-O 3.5Å; V36-A212 PolarHBondContact N-O 3.25Å; F210-A212 HydrophobicContact CD1-CB 4.29Å; F210-A212 HydrophobicContact CE1-CB 3.65Å; F210-A212 HydrophobicContact CZ-CB 3.78Å; A212-I230 HydrophobicContact CB-CD1 4.14Å; A212-I230 HydrophobicContact CB-CG1 4Å; A212-R231 CarbonylContact C-O 3.52Å; A212-R231 WeakPolarHBondContact CA-O 3.44Å; A212-R231 WeakPolarHBondContact CB-O 3.44Å
213	V	91.3	Very high	86.8	Confident	40 Å²	40	48.8 Å²	48.8	24%	0.242	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	126.9	173.3	-178.9	0	0	0	0	108.8	I33 R231	I33-V213 HydrophobicContact CG2-CG1 3.64Å; V213-R231 PolarHBondContact N-O 2.82Å; V213-R231 PolarHBondContact O-N 3.26Å
214	V	90.7	Very high	86.3	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	120.3	175.3	178.2	0	0	0	0	109.2	I33 I34 C216 V229 I230 L240 L261	I33-V214 CarbonylContact C-O 3.47Å; I33-V214 WeakPolarHBondContact CA-O 3.47Å; I34-V214 HydrophobicContact CB-CB 4.36Å; I34-V214 PolarHBondContact N-O 3.42Å; I34-V214 PolarHBondContact O-N 3.31Å; V214-C216 HydrophobicContact CG1-CB 4.5Å; V214-V229 WeakPolarHBondContact CA-O 2.89Å; V214-I230 HydrophobicContact CG2-CB 4.15Å; V214-I230 HydrophobicContact CG2-CD1 4Å; V214-I230 HydrophobicContact CG2-CG1 3.84Å; V214-L240 HydrophobicContact CG1-CD1 3.92Å; V214-L261 HydrophobicContact CB-CD2 4.43Å; V214-L261 HydrophobicContact CG2-CD2 3.58Å
215	E	90.2	Very high	86.3	Confident	55 Å²	55	55.2 Å²	55.2	26%	0.257	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	120.7	171.5	-70.6	167.9	-160.5	0	0	107.7	R32 I33 G228 V229 R231	R32-E215 WeakPolarHBondContact O-CA 3.43Å; I33-E215 HydrophobicContact CG1-CG 4.38Å; E215-G228 CarbonylContact O-C 3.56Å; E215-G228 WeakPolarHBondContact O-CA 3.35Å; E215-V229 PolarHBondContact N-O 3.26Å; E215-V229 PolarHBondContact O-N 2.82Å; E215-R231 IonicContact OE1-CZ 3.81Å; E215-R231 IonicContact OE1-NE 3.96Å; E215-R231 PolarHBondContact OE1-NE 2.78Å; E215-R231 IonicContact OE1-NH2 2.88Å; E215-R231 IonicContact OE2-CZ 2.91Å; E215-R231 IonicContact OE2-NE 3.49Å; E215-R231 PolarHBondContact OE2-NE 2.79Å; E215-R231 IonicContact OE2-NH2 3.22Å; E215-R231 PolarHBondContact OE2-NH2 2.63Å
216	C	89.4	Confident	86.4	Confident	3 Å²	3	53.1 Å²	53.1	2%	0.02	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	164.1	-177.9	60.1	0	0	0	0	112.2	C31 R32 V214 F226	C31-C216 PolarHBondContact SG-O 3.34Å; R32-C216 PolarHBondContact N-O 3.01Å; R32-C216 PolarHBondContact O-N 3.24Å; V214-C216 HydrophobicContact CG1-CB 4.5Å; C216-F226 HydrophobicContact CB-CE2 4.06Å; C216-F226 HydrophobicContact CB-CZ 4.06Å
217	E	89.2	Confident	86.5	Confident	35 Å²	35	54.2 Å²	54.2	16%	0.164	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-62.4	160.4	175.7	66.4	175.5	145.1	0	0	113.2	N220 F226 V227 Y264	E217-N220 PolarHBondContact OE1-ND2 2.63Å; E217-N220 PolarHBondContact OE2-ND2 3.2Å; E217-F226 WeakPolarHBondContact OE1-CA 3.1Å; E217-V227 PolarHBondContact N-O 3.4Å; E217-V227 VanDerWaalsContact N-O 3.1Å; E217-V227 PolarHBondContact OE1-N 3.09Å; E217-V227 VanDerWaalsContact OE1-N 3.1Å; E217-Y264 PolarHBondContact O-OH 2.93Å
218	P	89.4	Confident	86.5	Confident	69 Å²	69	54.4 Å²	54.4	45%	0.448	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-63	156.8	170.6	26.9	-35.7	0	0	0	112	N220	P218-N220 PolarHBondContact O-N 3.27Å
219	P	89.3	Confident	86.7	Confident	46 Å²	46	55.2 Å²	55.2	30%	0.299	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-54.1	124.8	179	-22.3	30.4	0	0	0	112.4	Y264 E268 L273	P219-Y264 HydrophobicContact CB-CD1 4.27Å; P219-Y264 HydrophobicContact CB-CE1 4.23Å; P219-Y264 HydrophobicContact CG-CD1 3.8Å; P219-Y264 HydrophobicContact CG-CE1 3.74Å; P219-E268 HydrophobicContact CB-CB 4.09Å; P219-E268 HydrophobicContact CB-CG 4.48Å; P219-E268 HydrophobicContact CG-CB 3.89Å; P219-E268 HydrophobicContact CG-CG 4Å; P219-L273 HydrophobicContact CB-CD1 3.94Å
220	N	88.5	Confident	86.9	Confident	31 Å²	31	50.9 Å²	50.9	17%	0.166	26%	0.26	C	S	.	.			trans	-126	162.8	179.3	78.9	45.5	0	0	0	111.1	E217 P218 K222 L273	E217-N220 PolarHBondContact OE1-ND2 2.63Å; E217-N220 PolarHBondContact OE2-ND2 3.2Å; P218-N220 PolarHBondContact O-N 3.27Å; N220-K222 PolarHBondContact OD1-N 3.36Å; N220-K222 PolarHBondContact OD1-O 2.95Å; N220-L273 WeakPolarHBondContact O-CD1 3.34Å
221	R	83.6	Confident	87	Confident	182 Å²	182	54.5 Å²	54.5	69%	0.687	27%	0.273	S	S	*	.	S	Bend	trans	-87.1	-8	-178.7	64.5	178.7	162.2	-177.1	-5	114.6	L223 L273 N274	R221-L223 PolarHBondContact O-N 2.81Å; R221-L273 HydrophobicContact CB-CB 4.24Å; R221-N274 VanDerWaalsContact O-CG 3.28Å; R221-N274 PolarHBondContact O-ND2 3.48Å; R221-N274 PolarHBondContact O-OD1 3.34Å
222	K	80.5	Confident	86.9	Confident	122 Å²	122	52.4 Å²	52.4	53%	0.53	26%	0.263	S	S	.	.			trans	-84.1	116.3	-173.1	-67.2	171.6	179.9	-178.5	0	109	N220 D224 E225 K270	N220-K222 PolarHBondContact OD1-N 3.36Å; N220-K222 PolarHBondContact OD1-O 2.95Å; K222-D224 VanDerWaalsContact C-N 3.28Å; K222-D224 PolarHBondContact O-N 3.2Å; K222-E225 HydrophobicContact CB-CB 3.93Å; K222-E225 HydrophobicContact CD-CB 4.25Å; K222-E225 WeakPolarHBondContact CD-OE2 3.33Å; K222-E225 WeakPolarHBondContact CE-OE2 3.49Å; K222-E225 IonicContact NZ-OE2 3.7Å; K222-E225 PolarHBondContact NZ-OE2 3.05Å; K222-E225 PolarHBondContact O-N 3.24Å; K222-K270 PolarHBondContact O-NZ 3.4Å
223	L	81.1	Confident	86.4	Confident	45 Å²	45	56.1 Å²	56.1	24%	0.236	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-39.5	-176.4	-65.2	170.3	0	0	0	111.6	L183 R221 L247 K270	L183-L223 HydrophobicContact CD2-CD2 4.31Å; R221-L223 PolarHBondContact O-N 2.81Å; L223-L247 HydrophobicContact CB-CD1 4.42Å; L223-L247 HydrophobicContact CD2-CD1 3.81Å; L223-K270 HydrophobicContact CD2-CB 4.12Å; L223-K270 PolarHBondContact O-NZ 2.77Å; L223-K270 VanDerWaalsContact O-NZ 3.12Å
224	D	77	Confident	85.7	Confident	134 Å²	134	60.8 Å²	60.8	72%	0.717	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-1.5	-172.9	-50.8	-43.4	0	0	0	115	K222 P242	K222-D224 VanDerWaalsContact C-N 3.28Å; K222-D224 PolarHBondContact O-N 3.2Å; D224-P242 WeakPolarHBondContact O-CB 3.26Å; D224-P242 WeakPolarHBondContact O-CG 3.24Å
225	E	82.5	Confident	85.1	Confident	74 Å²	74	63.2 Å²	63.2	35%	0.346	34%	0.342	S	S	.	.			trans	-108.9	117.1	-178.9	-170.1	171.9	177.2	0	0	110.3	K222 K270	K222-E225 HydrophobicContact CB-CB 3.93Å; K222-E225 HydrophobicContact CD-CB 4.25Å; K222-E225 WeakPolarHBondContact CD-OE2 3.33Å; K222-E225 WeakPolarHBondContact CE-OE2 3.49Å; K222-E225 IonicContact NZ-OE2 3.7Å; K222-E225 PolarHBondContact NZ-OE2 3.05Å; K222-E225 PolarHBondContact O-N 3.24Å; E225-K270 PolarHBondContact O-NZ 3.32Å
226	F	86.6	Confident	84.6	Confident	2 Å²	2	65 Å²	65	1%	0.009	35%	0.352	C	S	.	.			trans	-147.2	117.6	171.3	-177.8	-111.5	0	0	0	108.5	V165 C216 E217 L240 P242 L245 Y264	V165-F226 HydrophobicContact CG2-CE1 4.2Å; V165-F226 HydrophobicContact CG2-CZ 4.15Å; C216-F226 HydrophobicContact CB-CE2 4.06Å; C216-F226 HydrophobicContact CB-CZ 4.06Å; E217-F226 WeakPolarHBondContact OE1-CA 3.1Å; F226-L240 HydrophobicContact CD1-CB 4.39Å; F226-L240 HydrophobicContact CE1-CB 3.87Å; F226-L240 HydrophobicContact CE1-CD1 4.27Å; F226-P242 HydrophobicContact CB-CG 4.33Å; F226-P242 WeakPolarHBondContact O-CD 3.36Å; F226-L245 HydrophobicContact CB-CB 4.39Å; F226-L245 HydrophobicContact CB-CD2 3.88Å; F226-L245 HydrophobicContact CD1-CB 3.96Å; F226-L245 HydrophobicContact CD1-CD1 4.42Å; F226-L245 HydrophobicContact CD1-CD2 4.41Å; F226-L245 HydrophobicContact CD1-CG 4.5Å; F226-L245 HydrophobicContact CD2-CD1 4.29Å; F226-L245 HydrophobicContact CD2-CD2 3.82Å; F226-L245 HydrophobicContact CE1-CB 4.44Å; F226-L245 HydrophobicContact CE1-CD1 4.27Å; F226-L245 HydrophobicContact CE2-CD1 4.14Å; F226-L245 HydrophobicContact CE2-CD2 4.45Å; F226-L245 HydrophobicContact CG-CB 4.14Å; F226-L245 HydrophobicContact CG-CD1 4.42Å; F226-L245 HydrophobicContact CG-CD2 3.78Å; F226-L245 HydrophobicContact CG-CG 4.34Å; F226-L245 HydrophobicContact CZ-CD1 4.13Å; F226-Y264 HydrophobicContact CD2-CE2 4.45Å; F226-Y264 HydrophobicContact CE2-CE2 4.12Å
227	V	87.2	Confident	84.3	Confident	94 Å²	94	67.2 Å²	67.2	57%	0.57	37%	0.37	S	S	*	.			trans	-120.2	122.6	176.4	-175.5	0	0	0	0	109.4	E217	E217-V227 PolarHBondContact N-O 3.4Å; E217-V227 VanDerWaalsContact N-O 3.1Å; E217-V227 PolarHBondContact OE1-N 3.09Å; E217-V227 VanDerWaalsContact OE1-N 3.1Å
228	G	87.5	Confident	84.1	Confident	6 Å²	6	67.5 Å²	67.5	6%	0.062	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	177.2	174.5	0	0	0	0	0	113.3	E215 L240	E215-G228 CarbonylContact O-C 3.56Å; E215-G228 WeakPolarHBondContact O-CA 3.35Å; G228-L240 PolarHBondContact N-O 3.44Å; G228-L240 PolarHBondContact O-N 3.11Å
229	V	89.7	Confident	84	Confident	42 Å²	42	68.3 Å²	68.3	26%	0.255	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	131.3	178	176.7	0	0	0	0	108.2	V214 E215 R231 A237 H238	V214-V229 WeakPolarHBondContact CA-O 2.89Å; E215-V229 PolarHBondContact N-O 3.26Å; E215-V229 PolarHBondContact O-N 2.82Å; V229-R231 HydrophobicContact CG1-CG 4.27Å; V229-A237 HydrophobicContact CG1-CB 3.54Å; V229-H238 WeakPolarHBondContact CA-O 3.3Å
230	I	89.6	Confident	83.8	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.005	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	124	166.3	-170.9	166.5	0	0	0	109.2	L195 F210 A212 V214 H238 L240	L195-I230 HydrophobicContact CD1-CG2 3.29Å; F210-I230 HydrophobicContact CE1-CD1 4.07Å; F210-I230 HydrophobicContact CZ-CD1 4.02Å; A212-I230 HydrophobicContact CB-CD1 4.14Å; A212-I230 HydrophobicContact CB-CG1 4Å; V214-I230 HydrophobicContact CG2-CB 4.15Å; V214-I230 HydrophobicContact CG2-CD1 4Å; V214-I230 HydrophobicContact CG2-CG1 3.84Å; I230-H238 HydrophobicContact CG2-CB 3.81Å; I230-H238 PolarHBondContact N-O 3.4Å; I230-H238 PolarHBondContact O-N 3.35Å; I230-L240 HydrophobicContact CB-CD1 4.31Å; I230-L240 HydrophobicContact CG2-CD2 4.39Å
231	R	88.5	Confident	83.6	Confident	100 Å²	100	68.7 Å²	68.7	38%	0.377	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	116.6	173	-62	-176.2	-169.1	-93.3	-4.2	108.7	A212 V213 E215 V229 I236 A237	A212-R231 CarbonylContact C-O 3.52Å; A212-R231 WeakPolarHBondContact CA-O 3.44Å; A212-R231 WeakPolarHBondContact CB-O 3.44Å; V213-R231 PolarHBondContact N-O 2.82Å; V213-R231 PolarHBondContact O-N 3.26Å; E215-R231 IonicContact OE1-CZ 3.81Å; E215-R231 IonicContact OE1-NE 3.96Å; E215-R231 PolarHBondContact OE1-NE 2.78Å; E215-R231 IonicContact OE1-NH2 2.88Å; E215-R231 IonicContact OE2-CZ 2.91Å; E215-R231 IonicContact OE2-NE 3.49Å; E215-R231 PolarHBondContact OE2-NE 2.79Å; E215-R231 IonicContact OE2-NH2 3.22Å; E215-R231 PolarHBondContact OE2-NH2 2.63Å; V229-R231 HydrophobicContact CG1-CG 4.27Å; R231-I236 WeakPolarHBondContact CA-O 3.42Å; R231-A237 HydrophobicContact CG-CB 4.39Å
232	T	84.2	Confident	83.6	Confident	17 Å²	17	61.9 Å²	61.9	10%	0.104	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	168.7	173.7	56.9	0	0	0	0	110.8	V197 F210 D234 G235 I236	V197-T232 HydrophobicContact CG1-CG2 4.49Å; F210-T232 HydrophobicContact CE2-CG2 4.35Å; T232-D234 PolarHBondContact O-N 3.05Å; T232-D234 VanDerWaalsContact O-N 3.09Å; T232-G235 PolarHBondContact O-N 3.14Å; T232-I236 PolarHBondContact N-O 3.32Å
233	A	79.4	Confident	83.7	Confident	80 Å²	80	58 Å²	58	66%	0.661	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-28.3	174.6	0	0	0	0	0	113.8	D211 G235	D211-A233 HydrophobicContact CB-CB 4.48Å; D211-A233 PolarHBondContact O-N 3.44Å; D211-A233 VanDerWaalsContact O-N 3.13Å; A233-G235 PolarHBondContact O-N 3.18Å
234	D	76.8	Confident	84.1	Confident	138 Å²	138	56.9 Å²	56.9	74%	0.738	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-4.1	176	-56	-37.2	0	0	0	113.5	T232 I236	T232-D234 PolarHBondContact O-N 3.05Å; T232-D234 VanDerWaalsContact O-N 3.09Å; D234-I236 HydrophobicContact CB-CD1 4.31Å; D234-I236 HydrophobicContact CB-CG1 4.21Å; D234-I236 PolarHBondContact O-N 2.65Å
235	G	76.1	Confident	84.8	Confident	51 Å²	51	50.6 Å²	50.6	53%	0.526	30%	0.303	S	S	.	.			trans	79.1	0.3	-177.8	0	0	0	0	0	114.4	T232 A233 A237	T232-G235 PolarHBondContact O-N 3.14Å; A233-G235 PolarHBondContact O-N 3.18Å; G235-A237 PolarHBondContact O-N 3.44Å
236	I	81.6	Confident	85.3	Confident	93 Å²	93	47.1 Å²	47.1	48%	0.477	29%	0.286	S	S	.	.			trans	-75.6	126.5	179.9	-56	175.7	0	0	0	109.3	R231 T232 D234	R231-I236 WeakPolarHBondContact CA-O 3.42Å; T232-I236 PolarHBondContact N-O 3.32Å; D234-I236 HydrophobicContact CB-CD1 4.31Å; D234-I236 HydrophobicContact CB-CG1 4.21Å; D234-I236 PolarHBondContact O-N 2.65Å
237	A	82	Confident	85.6	Confident	49 Å²	49	47.5 Å²	47.5	41%	0.405	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	123.5	177.8	0	0	0	0	0	110.5	V229 R231 G235	V229-A237 HydrophobicContact CG1-CB 3.54Å; R231-A237 HydrophobicContact CG-CB 4.39Å; G235-A237 PolarHBondContact O-N 3.44Å
238	H	84.7	Confident	85.7	Confident	41 Å²	41	43.4 Å²	43.4	19%	0.19	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	129.3	172.6	-60.1	-75.4	0	0	0	110.1	L195 V229 I230	L195-H238 HydrophobicContact CD1-CB 4.09Å; L195-H238 HydrophobicContact CD2-CB 4.48Å; V229-H238 WeakPolarHBondContact CA-O 3.3Å; I230-H238 HydrophobicContact CG2-CB 3.81Å; I230-H238 PolarHBondContact N-O 3.4Å; I230-H238 PolarHBondContact O-N 3.35Å
239	P	87.2	Confident	85.5	Confident	87 Å²	87	44.1 Å²	44.1	57%	0.565	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.6	140.5	-179.4	29.6	-34.4	0	0	0	111.3
240	L	86.4	Confident	85.5	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	130	171.7	-64.9	170.8	0	0	0	109.3	V165 L195 V214 F226 G228 I230 Q244	V165-L240 HydrophobicContact CG1-CD1 4.29Å; V165-L240 HydrophobicContact CG1-CD2 3.91Å; V165-L240 HydrophobicContact CG2-CD1 4.28Å; L195-L240 HydrophobicContact CD1-CD2 3.72Å; L195-L240 HydrophobicContact CG-CD2 4.23Å; V214-L240 HydrophobicContact CG1-CD1 3.92Å; F226-L240 HydrophobicContact CD1-CB 4.39Å; F226-L240 HydrophobicContact CE1-CB 3.87Å; F226-L240 HydrophobicContact CE1-CD1 4.27Å; G228-L240 PolarHBondContact N-O 3.44Å; G228-L240 PolarHBondContact O-N 3.11Å; I230-L240 HydrophobicContact CB-CD1 4.31Å; I230-L240 HydrophobicContact CG2-CD2 4.39Å; L240-Q244 HydrophobicContact CD2-CB 4.06Å; L240-Q244 HydrophobicContact CD2-CG 4.19Å
241	N	83.7	Confident	85.3	Confident	83 Å²	83	43 Å²	43	44%	0.444	26%	0.264	S	S	.	.			trans	-117.4	173.5	178.7	-63.4	-6.9	0	0	0	109.3	T243 Q244	N241-T243 PolarHBondContact O-N 2.95Å; N241-Q244 PolarHBondContact O-N 3.03Å; N241-Q244 PolarHBondContact O-OE1 3.13Å; N241-Q244 VanDerWaalsContact O-OE1 3.06Å
242	P	84	Confident	85.4	Confident	39 Å²	39	38.2 Å²	38.2	25%	0.253	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-55.5	-27.1	177.1	-23.8	32.1	0	0	0	113.6	R192 D224 F226 Q244 L245	R192-P242 PolarHBondContact NH1-O 3.24Å; D224-P242 WeakPolarHBondContact O-CB 3.26Å; D224-P242 WeakPolarHBondContact O-CG 3.24Å; F226-P242 HydrophobicContact CB-CG 4.33Å; F226-P242 WeakPolarHBondContact O-CD 3.36Å; P242-Q244 PolarHBondContact O-N 3.3Å; P242-L245 PolarHBondContact O-N 3.03Å; P242-L245 VanDerWaalsContact O-N 3.13Å
243	T	82.7	Confident	85.2	Confident	41 Å²	41	39.8 Å²	39.8	25%	0.252	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-64.3	-24.6	179.1	48.9	0	0	0	0	114.2	R192 Q193 N241 A1213	R192-T243 WeakPolarHBondContact CD-O 3.28Å; Q193-T243 PolarHBondContact N-O 3.19Å; N241-T243 PolarHBondContact O-N 2.95Å; T243-A1213 HydrophobicContact CG2-CB 3.67Å
244	Q	89.5	Confident	85	Confident	20 Å²	20	36.8 Å²	36.8	9%	0.093	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-92.9	-10	176.5	-69.9	72.1	26.8	0	0	112.5	L166 Q193 L195 L240 N241 P242	L166-Q244 PolarHBondContact N-O 2.95Å; Q193-Q244 WeakPolarHBondContact O-CG 3.41Å; Q193-Q244 PolarHBondContact O-NE2 3.4Å; L195-Q244 HydrophobicContact CD2-CG 4.42Å; L195-Q244 HydrophobicContact CG-CG 4.31Å; L240-Q244 HydrophobicContact CD2-CB 4.06Å; L240-Q244 HydrophobicContact CD2-CG 4.19Å; N241-Q244 PolarHBondContact O-N 3.03Å; N241-Q244 PolarHBondContact O-OE1 3.13Å; N241-Q244 VanDerWaalsContact O-OE1 3.06Å; P242-Q244 PolarHBondContact O-N 3.3Å
245	L	91.1	Very high	85.2	Confident	3 Å²	3	30.3 Å²	30.3	2%	0.016	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	129.3	179.7	-171.4	73.8	0	0	0	110.3	D163 V165 F226 P242 L247	D163-L245 HydrophobicContact CB-CD1 4.45Å; V165-L245 HydrophobicContact CG2-CD1 4.38Å; F226-L245 HydrophobicContact CB-CB 4.39Å; F226-L245 HydrophobicContact CB-CD2 3.88Å; F226-L245 HydrophobicContact CD1-CB 3.96Å; F226-L245 HydrophobicContact CD1-CD1 4.42Å; F226-L245 HydrophobicContact CD1-CD2 4.41Å; F226-L245 HydrophobicContact CD1-CG 4.5Å; F226-L245 HydrophobicContact CD2-CD1 4.29Å; F226-L245 HydrophobicContact CD2-CD2 3.82Å; F226-L245 HydrophobicContact CE1-CB 4.44Å; F226-L245 HydrophobicContact CE1-CD1 4.27Å; F226-L245 HydrophobicContact CE2-CD1 4.14Å; F226-L245 HydrophobicContact CE2-CD2 4.45Å; F226-L245 HydrophobicContact CG-CB 4.14Å; F226-L245 HydrophobicContact CG-CD1 4.42Å; F226-L245 HydrophobicContact CG-CD2 3.78Å; F226-L245 HydrophobicContact CG-CG 4.34Å; F226-L245 HydrophobicContact CZ-CD1 4.13Å; P242-L245 PolarHBondContact O-N 3.03Å; P242-L245 VanDerWaalsContact O-N 3.13Å; L245-L247 HydrophobicContact CD2-CD2 3.53Å; L245-L247 HydrophobicContact CG-CD2 3.97Å
246	I	92.3	Very high	85.6	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	126.9	174	-60.7	178.6	0	0	0	107.3	I160 D163 L164 L166 I178 R192 I258	I160-I246 HydrophobicContact CB-CG2 4.39Å; I160-I246 HydrophobicContact CD1-CG2 3.11Å; I160-I246 HydrophobicContact CG1-CG2 3.76Å; I160-I246 HydrophobicContact CG2-CG2 3.98Å; D163-I246 CarbonylContact C-O 3.55Å; D163-I246 WeakPolarHBondContact CA-O 3.32Å; L164-I246 HydrophobicContact CB-CB 4.47Å; L164-I246 PolarHBondContact N-O 3.45Å; L164-I246 PolarHBondContact O-N 3.03Å; L166-I246 HydrophobicContact CB-CD1 3.85Å; L166-I246 HydrophobicContact CB-CG1 4.27Å; L166-I246 HydrophobicContact CD1-CD1 3.9Å; L166-I246 HydrophobicContact CD2-CD1 4.17Å; L166-I246 HydrophobicContact CG-CD1 4.19Å; I178-I246 HydrophobicContact CD1-CG2 4.46Å; I178-I246 HydrophobicContact CG2-CG2 4.14Å; R192-I246 HydrophobicContact CG-CG1 4.41Å; I246-I258 HydrophobicContact CD1-CD1 3.53Å
247	L	92.4	Very high	86.1	Confident	10 Å²	10	28.8 Å²	28.8	5%	0.052	17%	0.165	C	C	.	.			trans	-92.7	147.9	-170.6	-58.9	177.6	0	0	0	111.9	I160 D163 L183 L223 L245 A250 K270	I160-L247 WeakPolarHBondContact CB-O 3.44Å; I160-L247 WeakPolarHBondContact CG2-O 3.33Å; D163-L247 WeakPolarHBondContact OD1-CA 3.35Å; L183-L247 HydrophobicContact CD1-CB 3.85Å; L183-L247 HydrophobicContact CD1-CD1 4.09Å; L183-L247 HydrophobicContact CD2-CB 4.48Å; L223-L247 HydrophobicContact CB-CD1 4.42Å; L223-L247 HydrophobicContact CD2-CD1 3.81Å; L245-L247 HydrophobicContact CD2-CD2 3.53Å; L245-L247 HydrophobicContact CG-CD2 3.97Å; L247-A250 WeakPolarHBondContact O-CB 3.14Å; L247-A250 PolarHBondContact O-N 2.93Å; L247-K270 HydrophobicContact CD2-CB 4.33Å; L247-K270 HydrophobicContact CD2-CD 3.75Å; L247-K270 HydrophobicContact CD2-CG 4.15Å
248	R	90.8	Very high	86.6	Confident	9 Å²	9	26.4 Å²	26.4	3%	0.034	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	143.9	170.5	-179.1	175	-176.1	150.8	8.2	110.5	N47 I160 P161 D163 A250 V271	N47-R248 PolarHBondContact O-NH1 3.43Å; N47-R248 PolarHBondContact OD1-NH1 3.36Å; I160-R248 WeakPolarHBondContact O-CA 3.31Å; P161-R248 WeakPolarHBondContact O-CD 3.42Å; P161-R248 PolarHBondContact O-NE 3.01Å; D163-R248 PolarHBondContact OD1-N 3.33Å; R248-A250 PolarHBondContact O-N 3.15Å; R248-V271 HydrophobicContact CB-CG2 4.09Å; R248-V271 WeakPolarHBondContact O-CG2 3.45Å
249	G	83	Confident	87.1	Confident	20 Å²	20	24.6 Å²	24.6	21%	0.206	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.2	-12.3	174.5	0	0	0	0	0	115.5	I160 N182	I160-G249 PolarHBondContact O-N 3.42Å; N182-G249 WeakPolarHBondContact CB-O 3.19Å; N182-G249 PolarHBondContact ND2-O 3.05Å; N182-G249 VanDerWaalsContact ND2-O 3.1Å
250	A	88.8	Confident	87.4	Confident	1 Å²	1	20.5 Å²	20.5	1%	0.008	11%	0.11	C	C	.	.			trans	-66.2	157.1	160.4	0	0	0	0	0	109.8	I160 I178 E179 T180 L183 L247 R248	I160-A250 WeakPolarHBondContact CB-O 3.39Å; I160-A250 HydrophobicContact CD1-CB 3.59Å; I160-A250 WeakPolarHBondContact CD1-O 3.24Å; I160-A250 PolarHBondContact N-O 3.18Å; I178-A250 HydrophobicContact CB-CB 4.4Å; I178-A250 HydrophobicContact CD1-CB 4.37Å; E179-A250 CarbonylContact O-C 3.57Å; E179-A250 WeakPolarHBondContact O-CA 3.08Å; E179-A250 WeakPolarHBondContact O-CB 3.06Å; T180-A250 HydrophobicContact CG2-CB 4.35Å; L183-A250 HydrophobicContact CD1-CB 3.99Å; L247-A250 WeakPolarHBondContact O-CB 3.14Å; L247-A250 PolarHBondContact O-N 2.93Å; R248-A250 PolarHBondContact O-N 3.15Å
251	S	86.8	Confident	87.8	Confident	18 Å²	18	20.4 Å²	20.4	13%	0.126	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	140	175	73.3	0	0	0	0	111	E158 I178 E179 K253	E158-S251 WeakPolarHBondContact O-CA 3.42Å; I178-S251 CarbonylContact C-O 3.39Å; I178-S251 WeakPolarHBondContact CA-O 3.1Å; E179-S251 WeakPolarHBondContact CB-OG 3.08Å; E179-S251 PolarHBondContact N-O 3.5Å; E179-S251 PolarHBondContact O-N 3.4Å; E179-S251 PolarHBondContact OE2-OG 2.8Å; S251-K253 PolarHBondContact O-N 3.36Å; S251-K253 VanDerWaalsContact OG-CE 3.24Å; S251-K253 WeakPolarHBondContact OG-CE 3.3Å
252	L	89.5	Confident	88.3	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	123.9	175.9	-174.2	69.5	0	0	0	109.1	V154 L155 N157 E158 C176 I178 T255 I258	V154-L252 HydrophobicContact CG1-CB 4.17Å; V154-L252 HydrophobicContact CG1-CD2 4.3Å; L155-L252 WeakPolarHBondContact O-CD2 3.37Å; N157-L252 WeakPolarHBondContact CA-O 3.43Å; N157-L252 PolarHBondContact N-O 3.3Å; E158-L252 PolarHBondContact O-N 2.95Å; C176-L252 HydrophobicContact CB-CD1 4Å; I178-L252 HydrophobicContact CG2-CD1 4.4Å; L252-T255 HydrophobicContact CD1-CG2 4.21Å; L252-T255 HydrophobicContact CD2-CG2 4.35Å; L252-I258 HydrophobicContact CD1-CD1 4.09Å; L252-I258 HydrophobicContact CD1-CG1 4.29Å; L252-I258 HydrophobicContact CD1-CG2 3.74Å; L252-I258 HydrophobicContact CD2-CG1 4.02Å; L252-I258 HydrophobicContact CD2-CG2 4.09Å
253	K	81.4	Confident	88.8	Confident	50 Å²	50	14.6 Å²	14.6	22%	0.217	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	156.3	178	-64	-63.6	-177.4	176.6	0	109.9	N157 Y177 E179 L189 S251 T255	N157-K253 VanDerWaalsContact OD1-CD 3.25Å; N157-K253 WeakPolarHBondContact OD1-CD 3.01Å; N157-K253 PolarHBondContact OD1-NZ 3.29Å; Y177-K253 WeakPolarHBondContact CB-O 3.33Å; Y177-K253 PolarHBondContact O-N 3.26Å; E179-K253 HydrophobicContact CB-CG 3.93Å; E179-K253 WeakPolarHBondContact OE2-CE 3.4Å; L189-K253 HydrophobicContact CD1-CB 4.45Å; L189-K253 HydrophobicContact CD2-CB 3.62Å; L189-K253 HydrophobicContact CD2-CG 3.8Å; S251-K253 PolarHBondContact O-N 3.36Å; S251-K253 VanDerWaalsContact OG-CE 3.24Å; S251-K253 WeakPolarHBondContact OG-CE 3.3Å; K253-T255 PolarHBondContact O-N 2.98Å; K253-T255 PolarHBondContact O-OG1 2.77Å
254	N	73.4	Confident	89.3	Confident	18 Å²	18	12.7 Å²	12.7	10%	0.096	7%	0.065	C	C	.	.	S	Bend	trans	48.2	29.1	172.4	-56.7	-2.6	0	0	0	114.7	Y177 L189 Q551	Y177-N254 HydrophobicContact CD2-CB 3.83Å; Y177-N254 HydrophobicContact CE2-CB 4.48Å; Y177-N254 HydrophobicContact CG-CB 4.23Å; L189-N254 WeakPolarHBondContact CD1-ND2 3.45Å; N254-Q551 WeakPolarHBondContact ND2-CB 3.33Å; N254-Q551 VanDerWaalsContact ND2-CD 3.28Å; N254-Q551 VanDerWaalsContact ND2-CG 3.33Å; N254-Q551 WeakPolarHBondContact ND2-CG 3.34Å; N254-Q551 PolarHBondContact ND2-OE1 3.47Å; N254-Q551 PolarHBondContact OD1-NE2 2.54Å; N254-Q551 VanDerWaalsContact OD1-NE2 3.12Å
255	T	81.1	Confident	89.6	Confident	1 Å²	1	11.7 Å²	11.7	1%	0.006	6%	0.06	C	C	.	.			trans	-148.4	121.3	-177.5	-60.1	0	0	0	0	106.4	S156 S170 E171 C176 Y177 L252 K253 W257 I258	S156-T255 WeakPolarHBondContact CA-O 3.13Å; S156-T255 WeakPolarHBondContact CB-O 3.14Å; S156-T255 PolarHBondContact OG-O 2.65Å; S170-T255 WeakPolarHBondContact OG-CG2 3.33Å; E171-T255 HydrophobicContact CG-CG2 4.17Å; C176-T255 WeakPolarHBondContact CA-OG1 3.33Å; C176-T255 HydrophobicContact CB-CG2 3.92Å; Y177-T255 PolarHBondContact N-OG1 3.49Å; L252-T255 HydrophobicContact CD1-CG2 4.21Å; L252-T255 HydrophobicContact CD2-CG2 4.35Å; K253-T255 PolarHBondContact O-N 2.98Å; K253-T255 PolarHBondContact O-OG1 2.77Å; T255-W257 VanDerWaalsContact C-N 3.32Å; T255-W257 WeakPolarHBondContact CG2-O 3.16Å; T255-W257 PolarHBondContact O-N 2.86Å; T255-I258 HydrophobicContact CG2-CG2 3.68Å
256	K	85.1	Confident	89.5	Confident	106 Å²	106	11.6 Å²	11.6	46%	0.461	6%	0.06	S	C	.	.	S	Bend	trans	-61.7	-42.6	-174.6	-70.9	-170.8	172.4	-170.3	0	111.9	S156 S170 K1229	S156-K256 PolarHBondContact N-O 3.13Å; S170-K256 PolarHBondContact OG-N 3.36Å; K256-K1229 HydrophobicContact CD-CB 4.07Å; K256-K1229 HydrophobicContact CD-CD 4.28Å; K256-K1229 HydrophobicContact CG-CD 4.23Å
257	W	91.7	Very high	89.2	Confident	6 Å²	6	19.2 Å²	19.2	2%	0.023	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	155.8	177.7	56	-95.7	0	0	0	111.2	K153 V154 L155 S170 L202 T255 F259 P1230 D1231 G1232	K153-W257 HydrophobicContact CG-CB 4.48Å; V154-W257 CarbonylContact O-C 3.57Å; V154-W257 WeakPolarHBondContact O-CA 2.98Å; L155-W257 HydrophobicContact CD2-CB 4.12Å; S170-W257 PolarHBondContact N-O 3.1Å; L202-W257 HydrophobicContact CD2-CH2 3.8Å; T255-W257 VanDerWaalsContact C-N 3.32Å; T255-W257 WeakPolarHBondContact CG2-O 3.16Å; T255-W257 PolarHBondContact O-N 2.86Å; W257-F259 HydrophobicContact CE3-CD1 4.22Å; W257-F259 AromaticContact CE3-CD2 3.97Å; W257-F259 HydrophobicContact CE3-CD2 3.97Å; W257-F259 HydrophobicContact CE3-CE1 4.07Å; W257-F259 AromaticContact CE3-CE2 3.82Å; W257-F259 HydrophobicContact CE3-CE2 3.82Å; W257-F259 HydrophobicContact CE3-CG 4.18Å; W257-F259 AromaticContact CE3-CZ 3.87Å; W257-F259 HydrophobicContact CE3-CZ 3.87Å; W257-F259 HydrophobicContact CH2-CD2 4.12Å; W257-F259 AromaticContact CH2-CE2 3.67Å; W257-F259 HydrophobicContact CH2-CE2 3.67Å; W257-F259 HydrophobicContact CH2-CZ 4.27Å; W257-F259 HydrophobicContact CZ3-CD1 4.39Å; W257-F259 AromaticContact CZ3-CD2 3.32Å; W257-F259 HydrophobicContact CZ3-CD2 3.32Å; W257-F259 HydrophobicContact CZ3-CE1 4.28Å; W257-F259 AromaticContact CZ3-CE2 3.21Å; W257-F259 HydrophobicContact CZ3-CE2 3.21Å; W257-F259 AromaticContact CZ3-CG 3.95Å; W257-F259 HydrophobicContact CZ3-CG 3.95Å; W257-F259 AromaticContact CZ3-CZ 3.74Å; W257-F259 HydrophobicContact CZ3-CZ 3.74Å; W257-P1230 HydrophobicContact CZ2-CB 4.18Å; W257-P1230 HydrophobicContact CZ2-CG 3.97Å; W257-P1230 PolarHBondContact NE1-O 2.98Å; W257-D1231 PolarHBondContact NE1-O 2.85Å; W257-G1232 VanDerWaalsContact CE2-CA 3.41Å
258	I	93.8	Very high	89.2	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	153.6	167.8	60.6	168.7	0	0	0	110.7	K153 V154 L166 A168 C176 I246 L252 T255	K153-I258 WeakPolarHBondContact CA-O 3.44Å; V154-I258 HydrophobicContact CB-CD1 4.18Å; V154-I258 HydrophobicContact CB-CG1 3.76Å; V154-I258 HydrophobicContact CG2-CD1 4.44Å; V154-I258 HydrophobicContact CG2-CG1 4.34Å; V154-I258 PolarHBondContact N-O 3.41Å; V154-I258 VanDerWaalsContact N-O 3.08Å; V154-I258 PolarHBondContact O-N 3.49Å; L166-I258 HydrophobicContact CD1-CB 4Å; L166-I258 HydrophobicContact CD1-CG2 4.13Å; A168-I258 WeakPolarHBondContact O-CA 3.34Å; C176-I258 HydrophobicContact CB-CG2 3.56Å; I246-I258 HydrophobicContact CD1-CD1 3.53Å; L252-I258 HydrophobicContact CD1-CD1 4.09Å; L252-I258 HydrophobicContact CD1-CG1 4.29Å; L252-I258 HydrophobicContact CD1-CG2 3.74Å; L252-I258 HydrophobicContact CD2-CG1 4.02Å; L252-I258 HydrophobicContact CD2-CG2 4.09Å; T255-I258 HydrophobicContact CG2-CG2 3.68Å
259	F	94.4	Very high	89.1	Confident	2 Å²	2	20.9 Å²	20.9	1%	0.009	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	127.2	166.3	-61.2	-44	0	0	0	109.6	W138 V152 K153 L167 A168 L201 L207 W257	W138-F259 AromaticContact CH2-CD1 3.67Å; W138-F259 HydrophobicContact CH2-CD1 3.67Å; W138-F259 AromaticContact CH2-CE1 3.42Å; W138-F259 HydrophobicContact CH2-CE1 3.42Å; W138-F259 VanDerWaalsContact CH2-CE1 3.42Å; W138-F259 HydrophobicContact CH2-CZ 4.29Å; W138-F259 HydrophobicContact CZ2-CD1 4.08Å; W138-F259 AromaticContact CZ2-CE1 3.35Å; W138-F259 HydrophobicContact CZ2-CE1 3.35Å; W138-F259 AromaticContact CZ2-CZ 3.84Å; W138-F259 HydrophobicContact CZ2-CZ 3.84Å; W138-F259 HydrophobicContact CZ3-CE1 4.48Å; V152-F259 WeakPolarHBondContact O-CA 3.28Å; K153-F259 HydrophobicContact CB-CD1 3.93Å; K153-F259 HydrophobicContact CB-CE1 3.9Å; K153-F259 HydrophobicContact CD-CE1 3.77Å; K153-F259 HydrophobicContact CG-CD1 3.98Å; K153-F259 HydrophobicContact CG-CE1 3.66Å; L167-F259 PolarHBondContact N-O 2.94Å; A168-F259 HydrophobicContact CB-CD2 4.1Å; A168-F259 PolarHBondContact N-O 2.93Å; A168-F259 PolarHBondContact O-N 2.78Å; L201-F259 WeakPolarHBondContact O-CD2 3.35Å; L207-F259 HydrophobicContact CD1-CB 4.39Å; L207-F259 HydrophobicContact CD1-CD1 4Å; L207-F259 HydrophobicContact CD1-CD2 3.5Å; L207-F259 HydrophobicContact CD1-CE1 4.07Å; L207-F259 HydrophobicContact CD1-CE2 3.58Å; L207-F259 HydrophobicContact CD1-CG 3.72Å; L207-F259 HydrophobicContact CD1-CZ 3.87Å; L207-F259 HydrophobicContact CD2-CB 4.23Å; L207-F259 HydrophobicContact CD2-CD2 4.44Å; L207-F259 HydrophobicContact CD2-CG 4.43Å; L207-F259 HydrophobicContact CG-CD2 4.37Å; W257-F259 HydrophobicContact CE3-CD1 4.22Å; W257-F259 AromaticContact CE3-CD2 3.97Å; W257-F259 HydrophobicContact CE3-CD2 3.97Å; W257-F259 HydrophobicContact CE3-CE1 4.07Å; W257-F259 AromaticContact CE3-CE2 3.82Å; W257-F259 HydrophobicContact CE3-CE2 3.82Å; W257-F259 HydrophobicContact CE3-CG 4.18Å; W257-F259 AromaticContact CE3-CZ 3.87Å; W257-F259 HydrophobicContact CE3-CZ 3.87Å; W257-F259 HydrophobicContact CH2-CD2 4.12Å; W257-F259 AromaticContact CH2-CE2 3.67Å; W257-F259 HydrophobicContact CH2-CE2 3.67Å; W257-F259 HydrophobicContact CH2-CZ 4.27Å; W257-F259 HydrophobicContact CZ3-CD1 4.39Å; W257-F259 AromaticContact CZ3-CD2 3.32Å; W257-F259 HydrophobicContact CZ3-CD2 3.32Å; W257-F259 HydrophobicContact CZ3-CE1 4.28Å; W257-F259 AromaticContact CZ3-CE2 3.21Å; W257-F259 HydrophobicContact CZ3-CE2 3.21Å; W257-F259 AromaticContact CZ3-CG 3.95Å; W257-F259 HydrophobicContact CZ3-CG 3.95Å; W257-F259 AromaticContact CZ3-CZ 3.74Å; W257-F259 HydrophobicContact CZ3-CZ 3.74Å
260	G	93.9	Very high	89.3	Confident	1 Å²	1	20 Å²	20	1%	0.01	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	148.5	-178.6	0	0	0	0	0	113	V152 V165	V152-G260 PolarHBondContact N-O 2.97Å; V152-G260 PolarHBondContact O-N 3.03Å; V165-G260 CarbonylContact O-C 3.59Å; V165-G260 WeakPolarHBondContact O-CA 3.44Å
261	L	94.8	Very high	89.1	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	126.6	173.1	176.8	72.2	0	0	0	110.2	V36 G149 L151 L164 V165 L167 V214 V263	V36-L261 HydrophobicContact CG1-CD1 4.26Å; V36-L261 HydrophobicContact CG2-CD1 3.89Å; V36-L261 HydrophobicContact CG2-CD2 3.61Å; V36-L261 HydrophobicContact CG2-CG 4.4Å; G149-L261 WeakPolarHBondContact O-CD1 3.41Å; L151-L261 HydrophobicContact CD2-CB 4.32Å; L151-L261 HydrophobicContact CD2-CD1 3.91Å; L164-L261 CarbonylContact C-O 3.58Å; L164-L261 VanDerWaalsContact CA-O 3.27Å; L164-L261 WeakPolarHBondContact CA-O 3.48Å; V165-L261 HydrophobicContact CB-CB 4.45Å; V165-L261 PolarHBondContact N-O 2.85Å; V165-L261 PolarHBondContact O-N 2.87Å; L167-L261 HydrophobicContact CD1-CB 4.34Å; V214-L261 HydrophobicContact CB-CD2 4.43Å; V214-L261 HydrophobicContact CG2-CD2 3.58Å; L261-V263 PolarHBondContact O-N 2.9Å
262	T	95	Very high	88.9	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	120	-178.8	-53.3	0	0	0	0	112.3	L146 E147 G149 D150 V152 A162 L164 T265	L146-T262 HydrophobicContact CD2-CG2 4.2Å; L146-T262 HydrophobicContact CG-CG2 4.28Å; E147-T262 WeakPolarHBondContact O-CB 3.27Å; E147-T262 WeakPolarHBondContact O-CG2 3.18Å; G149-T262 PolarHBondContact N-O 2.87Å; D150-T262 WeakPolarHBondContact O-CB 3.38Å; D150-T262 PolarHBondContact O-N 3.3Å; D150-T262 PolarHBondContact O-OG1 3.49Å; V152-T262 VanDerWaalsContact CG2-OG1 3.29Å; V152-T262 WeakPolarHBondContact CG2-OG1 3.47Å; A162-T262 HydrophobicContact CB-CG2 3.8Å; L164-T262 HydrophobicContact CD2-CG2 4.36Å; L164-T262 WeakPolarHBondContact CD2-OG1 3.47Å; T262-T265 HydrophobicContact CG2-CG2 3.55Å
263	V	93.4	Very high	88.6	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	-57.6	-179	178.5	0	0	0	0	112.4	R32 I34 V148 D163 V165 L261	R32-V263 VanDerWaalsContact CZ-O 3.3Å; R32-V263 PolarHBondContact NE-O 3.13Å; R32-V263 PolarHBondContact NH2-O 3.07Å; I34-V263 HydrophobicContact CD1-CB 4.02Å; I34-V263 HydrophobicContact CD1-CG1 3.68Å; I34-V263 HydrophobicContact CD1-CG2 4.11Å; V148-V263 WeakPolarHBondContact CG1-O 3.26Å; D163-V263 PolarHBondContact O-N 3.19Å; V165-V263 HydrophobicContact CB-CG2 4.34Å; V165-V263 HydrophobicContact CG2-CG2 3.54Å; L261-V263 PolarHBondContact O-N 2.9Å
264	Y	94.3	Very high	88.4	Confident	1 Å²	1	26.7 Å²	26.7	0%	0.004	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	132.7	-179.9	-51.3	-61.2	0	0	0	111.4	A162 D163 E217 P219 F226	A162-Y264 WeakPolarHBondContact CB-O 3.25Å; D163-Y264 HydrophobicContact CB-CD2 4.01Å; D163-Y264 PolarHBondContact N-O 3.49Å; D163-Y264 PolarHBondContact O-N 2.97Å; E217-Y264 PolarHBondContact O-OH 2.93Å; P219-Y264 HydrophobicContact CB-CD1 4.27Å; P219-Y264 HydrophobicContact CB-CE1 4.23Å; P219-Y264 HydrophobicContact CG-CD1 3.8Å; P219-Y264 HydrophobicContact CG-CE1 3.74Å; F226-Y264 HydrophobicContact CD2-CE2 4.45Å; F226-Y264 HydrophobicContact CE2-CE2 4.12Å
265	T	94	Very high	88.2	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.145	C	C	.	.			trans	-119.8	154.1	-176	47.2	0	0	0	0	110.8	C45 N47 V148 A162 T262 K267 E268	C45-T265 PolarHBondContact O-OG1 3.44Å; C45-T265 PolarHBondContact SG-O 3.21Å; N47-T265 HydrophobicContact CB-CG2 4.17Å; V148-T265 HydrophobicContact CG2-CG2 3.77Å; V148-T265 WeakPolarHBondContact CG2-OG1 3.45Å; A162-T265 HydrophobicContact CB-CG2 4.36Å; T262-T265 HydrophobicContact CG2-CG2 3.55Å; T265-K267 PolarHBondContact O-N 2.92Å; T265-E268 WeakPolarHBondContact O-CB 3.46Å; T265-E268 PolarHBondContact O-N 2.95Å
266	G	88.9	Confident	87.5	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	55	-122	168.5	0	0	0	0	0	113.4	N47 E268 S269 M272	N47-G266 PolarHBondContact OD1-N 3.47Å; G266-E268 PolarHBondContact O-N 2.91Å; G266-S269 WeakPolarHBondContact O-CB 3.34Å; G266-S269 PolarHBondContact O-N 3.01Å; G266-S269 PolarHBondContact O-OG 2.96Å; G266-M272 WeakPolarHBondContact O-CG 3.29Å
267	K	87.4	Confident	86.7	Confident	161 Å²	161	32.5 Å²	32.5	70%	0.7	19%	0.185	S	C	*	.	G	3₁₀ helix	trans	-68.8	-19	-178.2	-63.1	-177.6	-178.7	179.4	0	114	T265	T265-K267 PolarHBondContact O-N 2.92Å
268	E	91.5	Very high	85.6	Confident	53 Å²	53	35.2 Å²	35.2	25%	0.248	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-86.4	-12.4	178.3	-66.1	179.6	157.5	0	0	112.6	R32 P219 T265 G266	R32-E268 IonicContact CZ-OE2 3.76Å; R32-E268 IonicContact NH1-OE1 3.87Å; R32-E268 IonicContact NH1-OE2 2.78Å; R32-E268 PolarHBondContact NH1-OE2 3.43Å; R32-E268 IonicContact NH2-OE2 3.92Å; R32-E268 PolarHBondContact NH2-OE2 2.91Å; R32-E268 VanDerWaalsContact NH2-OE2 3.1Å; P219-E268 HydrophobicContact CB-CB 4.09Å; P219-E268 HydrophobicContact CB-CG 4.48Å; P219-E268 HydrophobicContact CG-CB 3.89Å; P219-E268 HydrophobicContact CG-CG 4Å; T265-E268 WeakPolarHBondContact O-CB 3.46Å; T265-E268 PolarHBondContact O-N 2.95Å; G266-E268 PolarHBondContact O-N 2.91Å
269	S	89.5	Confident	84.6	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	23%	0.228	C	C	.	.	S	Bend	trans	-62.3	143.7	174.6	64.7	0	0	0	0	111.2	D163 G266 V271 M272 L273	D163-S269 WeakPolarHBondContact OD2-CA 3.32Å; G266-S269 WeakPolarHBondContact O-CB 3.34Å; G266-S269 PolarHBondContact O-N 3.01Å; G266-S269 PolarHBondContact O-OG 2.96Å; S269-V271 PolarHBondContact O-N 2.86Å; S269-V271 VanDerWaalsContact O-N 3.14Å; S269-M272 PolarHBondContact O-N 3.09Å; S269-M272 WeakPolarHBondContact OG-CG 3.11Å; S269-L273 PolarHBondContact O-N 2.72Å; S269-L273 VanDerWaalsContact O-N 3.09Å
270	K	87.9	Confident	83.6	Confident	1 Å²	1	44.2 Å²	44.2	0%	0.004	26%	0.26	C	S	.	.	H	α-helix	trans	-58.6	-32.7	-175.4	-64.7	-159.4	-176.5	-174.2	0	113.5	D163 K222 L223 E225 L247 L273 N274	D163-K270 PolarHBondContact OD2-N 2.86Å; K222-K270 PolarHBondContact O-NZ 3.4Å; L223-K270 HydrophobicContact CD2-CB 4.12Å; L223-K270 PolarHBondContact O-NZ 2.77Å; L223-K270 VanDerWaalsContact O-NZ 3.12Å; E225-K270 PolarHBondContact O-NZ 3.32Å; L247-K270 HydrophobicContact CD2-CB 4.33Å; L247-K270 HydrophobicContact CD2-CD 3.75Å; L247-K270 HydrophobicContact CD2-CG 4.15Å; K270-L273 PolarHBondContact O-N 3.01Å; K270-N274 WeakPolarHBondContact O-CB 3.49Å; K270-N274 PolarHBondContact O-N 3.49Å; K270-N274 PolarHBondContact O-ND2 3.44Å
271	V	83.4	Confident	82.9	Confident	20 Å²	20	45.7 Å²	45.7	12%	0.121	27%	0.266	C	S	.	.	H	α-helix	trans	-63.3	-43.7	176.6	-167.4	0	0	0	0	111.4	L183 R248 S269 N274 S275	L183-V271 HydrophobicContact CD2-CB 4.19Å; L183-V271 HydrophobicContact CD2-CG1 4.24Å; L183-V271 HydrophobicContact CD2-CG2 3.18Å; R248-V271 HydrophobicContact CB-CG2 4.09Å; R248-V271 WeakPolarHBondContact O-CG2 3.45Å; S269-V271 PolarHBondContact O-N 2.86Å; S269-V271 VanDerWaalsContact O-N 3.14Å; V271-N274 CarbonylContact O-C 3.59Å; V271-N274 PolarHBondContact O-N 3.48Å; V271-S275 WeakPolarHBondContact O-CB 3.16Å; V271-S275 PolarHBondContact O-N 2.87Å
272	M	83.8	Confident	82	Confident	50 Å²	50	53.4 Å²	53.4	25%	0.246	30%	0.295	C	S	.	.	H	α-helix	trans	-72.7	-33	-178.2	-69.5	-58.6	94.9	0	0	111.7	I49 G266 S269 N274 S275	I49-M272 HydrophobicContact CD1-CE 4.28Å; I49-M272 HydrophobicContact CD1-CG 3.74Å; I49-M272 HydrophobicContact CD1-SD 3.57Å; I49-M272 VanDerWaalsContact CD1-SD 3.57Å; I49-M272 HydrophobicContact CG1-CG 4.25Å; I49-M272 HydrophobicContact CG1-SD 4.19Å; I49-M272 HydrophobicContact CG2-SD 4.02Å; G266-M272 WeakPolarHBondContact O-CG 3.29Å; S269-M272 PolarHBondContact O-N 3.09Å; S269-M272 WeakPolarHBondContact OG-CG 3.11Å; M272-N274 VanDerWaalsContact C-N 3.31Å; M272-N274 PolarHBondContact O-N 3.45Å; M272-S275 PolarHBondContact O-N 3.49Å; M272-S275 PolarHBondContact O-OG 3.25Å
273	L	82.6	Confident	81.5	Confident	73 Å²	73	53.5 Å²	53.5	38%	0.382	30%	0.295	S	S	.	.	H	α-helix	trans	-67.6	-30.3	172	-66.9	174.3	0	0	0	112.9	P219 N220 R221 S269 K270	P219-L273 HydrophobicContact CB-CD1 3.94Å; N220-L273 WeakPolarHBondContact O-CD1 3.34Å; R221-L273 HydrophobicContact CB-CB 4.24Å; S269-L273 PolarHBondContact O-N 2.72Å; S269-L273 VanDerWaalsContact O-N 3.09Å; K270-L273 PolarHBondContact O-N 3.01Å
274	N	76.3	Confident	81.1	Confident	68 Å²	68	55 Å²	55	36%	0.364	30%	0.304	S	S	.	.	H	α-helix	trans	-86.6	-12.5	173.9	-78.3	-36.9	0	0	0	114	R221 K270 V271 M272 T276	R221-N274 VanDerWaalsContact O-CG 3.28Å; R221-N274 PolarHBondContact O-ND2 3.48Å; R221-N274 PolarHBondContact O-OD1 3.34Å; K270-N274 WeakPolarHBondContact O-CB 3.49Å; K270-N274 PolarHBondContact O-N 3.49Å; K270-N274 PolarHBondContact O-ND2 3.44Å; V271-N274 CarbonylContact O-C 3.59Å; V271-N274 PolarHBondContact O-N 3.48Å; M272-N274 VanDerWaalsContact C-N 3.31Å; M272-N274 PolarHBondContact O-N 3.45Å; N274-T276 PolarHBondContact O-N 3.36Å
275	S	69.7	Low	80.6	Confident	67 Å²	67	54.9 Å²	54.9	47%	0.469	30%	0.304	S	S	.	.			trans	-74.4	112.2	179.3	72.6	0	0	0	0	110.7	V271 M272	V271-S275 WeakPolarHBondContact O-CB 3.16Å; V271-S275 PolarHBondContact O-N 2.87Å; M272-S275 PolarHBondContact O-N 3.49Å; M272-S275 PolarHBondContact O-OG 3.25Å
276	T	67.5	Low	80.1	Confident	85 Å²	85	56.7 Å²	56.7	52%	0.521	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-84	131	172.9	48.6	0	0	0	0	110.8	N274 A278 Q860	N274-T276 PolarHBondContact O-N 3.36Å; T276-A278 PolarHBondContact O-N 3.26Å; T276-Q860 PolarHBondContact O-NE2 2.76Å; T276-Q860 PolarHBondContact OG1-NE2 3.21Å; T276-Q860 PolarHBondContact OG1-OE1 3.45Å
277	A	67.5	Low	79.9	Confident	94 Å²	94	66 Å²	66	78%	0.777	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-63.2	132.1	172.1	0	0	0	0	0	110.3
278	A	67.4	Low	79.8	Confident	64 Å²	64	61.2 Å²	61.2	53%	0.529	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-57.8	126.8	178.2	0	0	0	0	0	110.3	T276	T276-A278 PolarHBondContact O-N 3.26Å
279	P	74.6	Confident	79.5	Confident	63 Å²	63	58.9 Å²	58.9	41%	0.409	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-67	146.8	-178.5	27.1	-34.1	0	0	0	111.1	K281 Q860	P279-K281 HydrophobicContact CG-CG 4.49Å; P279-K281 PolarHBondContact O-N 3.47Å; P279-Q860 HydrophobicContact CG-CB 4.46Å
280	L	72.7	Confident	79.4	Confident	128 Å²	128	60.8 Å²	60.8	67%	0.67	33%	0.327	S	S	*	.			trans	-72	96.4	171.9	-69.8	169.2	0	0	0	109.8
281	K	79.1	Confident	79.4	Confident	32 Å²	32	64.8 Å²	64.8	14%	0.139	35%	0.352	C	S	.	.			trans	-78.8	144.7	175.2	-53.9	-170.4	-170.7	176.3	0	110.2	P279 L438 I859 A862 H863 D881	P279-K281 HydrophobicContact CG-CG 4.49Å; P279-K281 PolarHBondContact O-N 3.47Å; K281-L438 HydrophobicContact CB-CD1 4.03Å; K281-L438 HydrophobicContact CB-CD2 4.02Å; K281-L438 HydrophobicContact CD-CD1 4.06Å; K281-I859 PolarHBondContact NZ-O 3.32Å; K281-A862 VanDerWaalsContact CE-O 3.32Å; K281-A862 WeakPolarHBondContact CE-O 3.23Å; K281-A862 PolarHBondContact NZ-O 3.45Å; K281-H863 WeakPolarHBondContact CD-O 3.27Å; K281-D881 WeakPolarHBondContact CE-OD2 3.39Å; K281-D881 IonicContact NZ-OD2 2.9Å; K281-D881 PolarHBondContact NZ-OD2 2.96Å
282	R	76.6	Confident	79.7	Confident	162 Å²	162	64.5 Å²	64.5	61%	0.611	35%	0.349	S	S	*	.			trans	-119.9	137.8	175.1	-67.7	-176.2	-179.6	-179.8	-2.6	108.9
283	S	83.3	Confident	79.8	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.007	34%	0.341	C	S	.	.			trans	-73.6	151.9	176.2	70.9	0	0	0	0	112.2	V285 E286 R287 R364 E440 E441	S283-V285 VanDerWaalsContact C-N 3.31Å; S283-E286 PolarHBondContact O-N 3.42Å; S283-E286 VanDerWaalsContact OG-CB 3.23Å; S283-E286 WeakPolarHBondContact OG-CB 3.44Å; S283-E286 PolarHBondContact OG-N 3.31Å; S283-E286 VanDerWaalsContact OG-N 3.09Å; S283-R287 PolarHBondContact O-N 3.36Å; S283-R364 PolarHBondContact OG-NH2 3.49Å; S283-E440 WeakPolarHBondContact CB-OE1 3.24Å; S283-E440 PolarHBondContact OG-OE1 3.32Å; S283-E441 WeakPolarHBondContact CA-OE1 3.47Å; S283-E441 VanDerWaalsContact CB-OE1 3.28Å; S283-E441 WeakPolarHBondContact CB-OE1 3.24Å
284	T	84.8	Confident	80.1	Confident	31 Å²	31	64 Å²	64	19%	0.19	35%	0.347	C	S	.	.	H	α-helix	trans	-58.7	-42.3	170.8	63.9	0	0	0	0	111.1	E286 R287 Q288 E441 Q444 V845	T284-E286 VanDerWaalsContact C-N 3.33Å; T284-E286 PolarHBondContact O-N 2.91Å; T284-R287 WeakPolarHBondContact O-CB 3.26Å; T284-R287 PolarHBondContact O-N 3.29Å; T284-Q288 WeakPolarHBondContact O-CG 3.46Å; T284-Q288 PolarHBondContact O-N 3.43Å; T284-E441 WeakPolarHBondContact CA-OE1 3.37Å; T284-E441 WeakPolarHBondContact CB-OE1 3.15Å; T284-E441 PolarHBondContact N-OE1 2.9Å; T284-E441 PolarHBondContact OG1-OE1 3.08Å; T284-Q444 PolarHBondContact OG1-OE1 2.95Å; T284-V845 HydrophobicContact CG2-CG2 4.15Å
285	V	84.1	Confident	80.7	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-62.2	-40	176.7	178.2	0	0	0	0	111.2	S283 Q288 T289 E440 Y902 L905 I909 F986	S283-V285 VanDerWaalsContact C-N 3.31Å; V285-Q288 PolarHBondContact O-N 2.93Å; V285-T289 VanDerWaalsContact O-CB 3.31Å; V285-T289 WeakPolarHBondContact O-CB 3.46Å; V285-T289 PolarHBondContact O-N 3.29Å; V285-T289 PolarHBondContact O-OG1 2.63Å; V285-E440 HydrophobicContact CB-CG 3.94Å; V285-E440 HydrophobicContact CG2-CB 4.43Å; V285-E440 HydrophobicContact CG2-CG 3.81Å; V285-Y902 HydrophobicContact CG2-CD2 4.14Å; V285-Y902 HydrophobicContact CG2-CE2 3.84Å; V285-L905 HydrophobicContact CG1-CD2 4.21Å; V285-I909 HydrophobicContact CG1-CD1 3.57Å; V285-F986 HydrophobicContact CG1-CD1 4.3Å; V285-F986 HydrophobicContact CG1-CE1 3.98Å
286	E	82.8	Confident	81.5	Confident	38 Å²	38	60.3 Å²	60.3	18%	0.178	33%	0.325	C	S	.	.	H	α-helix	trans	-66.3	-42.1	174.5	-174	174.6	141.1	0	0	111.7	S283 T284 Q288 T289 N290 R364	S283-E286 PolarHBondContact O-N 3.42Å; S283-E286 VanDerWaalsContact OG-CB 3.23Å; S283-E286 WeakPolarHBondContact OG-CB 3.44Å; S283-E286 PolarHBondContact OG-N 3.31Å; S283-E286 VanDerWaalsContact OG-N 3.09Å; T284-E286 VanDerWaalsContact C-N 3.33Å; T284-E286 PolarHBondContact O-N 2.91Å; E286-Q288 VanDerWaalsContact C-N 3.34Å; E286-Q288 PolarHBondContact O-N 2.89Å; E286-T289 PolarHBondContact O-N 3.44Å; E286-N290 WeakPolarHBondContact O-CB 3.46Å; E286-N290 PolarHBondContact O-N 2.85Å; E286-N290 PolarHBondContact O-ND2 2.85Å; E286-N290 VanDerWaalsContact O-ND2 3.16Å; E286-R364 IonicContact OE2-CZ 2.71Å; E286-R364 IonicContact OE2-NH1 2.72Å; E286-R364 PolarHBondContact OE2-NH1 2.73Å; E286-R364 IonicContact OE2-NH2 2.67Å; E286-R364 PolarHBondContact OE2-NH2 2.91Å
287	R	85	Confident	82.6	Confident	194 Å²	194	59.7 Å²	59.7	73%	0.732	32%	0.316	S	S	*	.	H	α-helix	trans	-61.9	-42.3	176.8	-161.2	178.9	-172.4	173.1	2.5	111.8	S283 T284 T291	S283-R287 PolarHBondContact O-N 3.36Å; T284-R287 WeakPolarHBondContact O-CB 3.26Å; T284-R287 PolarHBondContact O-N 3.29Å; R287-T291 PolarHBondContact O-N 2.79Å; R287-T291 VanDerWaalsContact O-N 3.13Å; R287-T291 PolarHBondContact O-OG1 3.01Å
288	Q	86.1	Confident	83.7	Confident	62 Å²	62	57.1 Å²	57.1	29%	0.29	30%	0.298	S	S	.	.	H	α-helix	trans	-67	-42.7	174.1	-72.5	-177.5	1.5	0	0	111.8	T284 V285 E286 N290 T291 Y292 F986	T284-Q288 WeakPolarHBondContact O-CG 3.46Å; T284-Q288 PolarHBondContact O-N 3.43Å; V285-Q288 PolarHBondContact O-N 2.93Å; E286-Q288 VanDerWaalsContact C-N 3.34Å; E286-Q288 PolarHBondContact O-N 2.89Å; Q288-N290 VanDerWaalsContact C-N 3.34Å; Q288-N290 PolarHBondContact O-N 3.16Å; Q288-T291 CarbonylContact O-C 3.55Å; Q288-T291 WeakPolarHBondContact O-CA 3.35Å; Q288-T291 VanDerWaalsContact O-CB 3.27Å; Q288-T291 WeakPolarHBondContact O-CB 3.11Å; Q288-T291 PolarHBondContact O-N 2.8Å; Q288-Y292 HydrophobicContact CB-CE2 4.4Å; Q288-Y292 WeakPolarHBondContact O-CD2 3.43Å; Q288-Y292 PolarHBondContact O-N 2.93Å; Q288-F986 HydrophobicContact CB-CD1 4.44Å; Q288-F986 HydrophobicContact CB-CE1 3.8Å
289	T	85.7	Confident	84.7	Confident	4 Å²	4	57 Å²	57	3%	0.025	29%	0.291	C	S	.	.	H	α-helix	trans	-60.2	-43.2	176.2	-59.7	0	0	0	0	111.4	V285 E286 T291 Y292 I293 L356 I909 F913	V285-T289 VanDerWaalsContact O-CB 3.31Å; V285-T289 WeakPolarHBondContact O-CB 3.46Å; V285-T289 PolarHBondContact O-N 3.29Å; V285-T289 PolarHBondContact O-OG1 2.63Å; E286-T289 PolarHBondContact O-N 3.44Å; T289-T291 VanDerWaalsContact C-N 3.26Å; T289-T291 PolarHBondContact O-N 3Å; T289-Y292 PolarHBondContact O-N 2.92Å; T289-Y292 VanDerWaalsContact O-N 3.14Å; T289-I293 HydrophobicContact CG2-CD1 4.13Å; T289-I293 HydrophobicContact CG2-CG1 4.48Å; T289-I293 WeakPolarHBondContact O-CG1 3.44Å; T289-I293 PolarHBondContact O-N 2.85Å; T289-L356 HydrophobicContact CG2-CD2 3.94Å; T289-I909 HydrophobicContact CG2-CG2 4.28Å; T289-F913 HydrophobicContact CG2-CE2 4.31Å; T289-F913 HydrophobicContact CG2-CZ 4.26Å
290	N	85.7	Confident	85.5	Confident	39 Å²	39	54 Å²	54	21%	0.209	27%	0.271	C	S	.	.	H	α-helix	trans	-60.9	-36.5	173.8	-74.4	-36.8	0	0	0	112.1	E286 Q288 I293 L294	E286-N290 WeakPolarHBondContact O-CB 3.46Å; E286-N290 PolarHBondContact O-N 2.85Å; E286-N290 PolarHBondContact O-ND2 2.85Å; E286-N290 VanDerWaalsContact O-ND2 3.16Å; Q288-N290 VanDerWaalsContact C-N 3.34Å; Q288-N290 PolarHBondContact O-N 3.16Å; N290-I293 PolarHBondContact O-N 3.16Å; N290-L294 PolarHBondContact O-N 3Å
291	T	88.3	Confident	86.4	Confident	85 Å²	85	50.5 Å²	50.5	52%	0.521	25%	0.253	S	S	.	.	H	α-helix	trans	-65.8	-41.6	174.1	-52.9	0	0	0	0	111.3	R287 Q288 T289 L294 C295	R287-T291 PolarHBondContact O-N 2.79Å; R287-T291 VanDerWaalsContact O-N 3.13Å; R287-T291 PolarHBondContact O-OG1 3.01Å; Q288-T291 CarbonylContact O-C 3.55Å; Q288-T291 WeakPolarHBondContact O-CA 3.35Å; Q288-T291 VanDerWaalsContact O-CB 3.27Å; Q288-T291 WeakPolarHBondContact O-CB 3.11Å; Q288-T291 PolarHBondContact O-N 2.8Å; T289-T291 VanDerWaalsContact C-N 3.26Å; T289-T291 PolarHBondContact O-N 3Å; T291-L294 WeakPolarHBondContact O-CB 3.03Å; T291-L294 PolarHBondContact O-N 2.62Å; T291-C295 PolarHBondContact O-N 3.37Å
292	Y	89.1	Confident	87.1	Confident	15 Å²	15	55.5 Å²	55.5	6%	0.059	28%	0.275	C	S	.	.	H	α-helix	trans	-69.1	-35.4	175.2	-60.8	-34.3	0	0	0	113.2	Q288 T289 L294 C295 L296 F986 P988 F991	Q288-Y292 HydrophobicContact CB-CE2 4.4Å; Q288-Y292 WeakPolarHBondContact O-CD2 3.43Å; Q288-Y292 PolarHBondContact O-N 2.93Å; T289-Y292 PolarHBondContact O-N 2.92Å; T289-Y292 VanDerWaalsContact O-N 3.14Å; Y292-L294 VanDerWaalsContact C-N 3.34Å; Y292-C295 WeakPolarHBondContact O-CB 3.49Å; Y292-C295 PolarHBondContact O-N 2.96Å; Y292-L296 PolarHBondContact O-N 2.96Å; Y292-F986 HydrophobicContact CD2-CE1 4.34Å; Y292-F986 HydrophobicContact CD2-CE2 4.26Å; Y292-F986 AromaticContact CD2-CZ 3.72Å; Y292-F986 HydrophobicContact CD2-CZ 3.72Å; Y292-F986 HydrophobicContact CE2-CD1 4.44Å; Y292-F986 AromaticContact CE2-CE1 3.73Å; Y292-F986 HydrophobicContact CE2-CE1 3.73Å; Y292-F986 AromaticContact CE2-CE2 3.84Å; Y292-F986 HydrophobicContact CE2-CE2 3.84Å; Y292-F986 AromaticContact CE2-CZ 3.4Å; Y292-F986 HydrophobicContact CE2-CZ 3.4Å; Y292-F986 VanDerWaalsContact CE2-CZ 3.4Å; Y292-P988 HydrophobicContact CE1-CB 4.35Å; Y292-P988 HydrophobicContact CE1-CG 4.32Å; Y292-P988 WeakPolarHBondContact OH-CA 3.49Å; Y292-P988 WeakPolarHBondContact OH-CD 3.1Å; Y292-F991 HydrophobicContact CD1-CD1 4.03Å; Y292-F991 HydrophobicContact CD1-CE1 4.25Å; Y292-F991 HydrophobicContact CD1-CG 4.2Å; Y292-F991 AromaticContact CD2-CD2 3.95Å; Y292-F991 HydrophobicContact CD2-CD2 3.95Å; Y292-F991 HydrophobicContact CD2-CE2 4.28Å; Y292-F991 HydrophobicContact CD2-CG 4.23Å; Y292-F991 HydrophobicContact CE1-CB 4.41Å; Y292-F991 HydrophobicContact CE1-CD1 4.34Å; Y292-F991 HydrophobicContact CE1-CG 4.32Å; Y292-F991 HydrophobicContact CE2-CB 4.33Å; Y292-F991 HydrophobicContact CE2-CD2 4.36Å; Y292-F991 HydrophobicContact CE2-CG 4.35Å; Y292-F991 HydrophobicContact CG-CD1 4.3Å; Y292-F991 HydrophobicContact CG-CD2 4.07Å; Y292-F991 HydrophobicContact CG-CE1 4.32Å; Y292-F991 HydrophobicContact CG-CE2 4.11Å; Y292-F991 HydrophobicContact CG-CG 4.17Å; Y292-F991 HydrophobicContact CG-CZ 4.23Å
293	I	86.9	Confident	87.8	Confident	14 Å²	14	48.5 Å²	48.5	7%	0.072	25%	0.249	C	C	.	.	H	α-helix	trans	-60.9	-44.9	171.5	-69.5	168.9	0	0	0	110	T289 N290 C295 L296 F297 I352 F913	T289-I293 HydrophobicContact CG2-CD1 4.13Å; T289-I293 HydrophobicContact CG2-CG1 4.48Å; T289-I293 WeakPolarHBondContact O-CG1 3.44Å; T289-I293 PolarHBondContact O-N 2.85Å; N290-I293 PolarHBondContact O-N 3.16Å; I293-C295 VanDerWaalsContact C-N 3.34Å; I293-C295 PolarHBondContact O-N 3.4Å; I293-L296 PolarHBondContact O-N 2.77Å; I293-F297 WeakPolarHBondContact O-CB 3.46Å; I293-F297 PolarHBondContact O-N 2.94Å; I293-I352 HydrophobicContact CG2-CD1 4.43Å; I293-I352 HydrophobicContact CG2-CG2 4.05Å; I293-F913 HydrophobicContact CG1-CE1 4.19Å; I293-F913 HydrophobicContact CG1-CZ 3.87Å
294	L	88.8	Confident	88.1	Confident	98 Å²	98	48.4 Å²	48.4	51%	0.513	25%	0.249	S	C	.	.	H	α-helix	trans	-61.7	-40.6	174.5	-87	163.1	0	0	0	112.2	N290 T291 Y292 F297 G298	N290-L294 PolarHBondContact O-N 3Å; T291-L294 WeakPolarHBondContact O-CB 3.03Å; T291-L294 PolarHBondContact O-N 2.62Å; Y292-L294 VanDerWaalsContact C-N 3.34Å; L294-F297 WeakPolarHBondContact O-CB 2.95Å; L294-F297 PolarHBondContact O-N 3.07Å; L294-G298 PolarHBondContact O-N 2.86Å
295	C	89.2	Confident	88.5	Confident	51 Å²	51	52 Å²	52	35%	0.345	26%	0.262	S	S	.	.	H	α-helix	trans	-61.2	-44.9	174.1	-173.7	0	0	0	0	111.8	T291 Y292 I293 F297 G298 V299	T291-C295 PolarHBondContact O-N 3.37Å; Y292-C295 WeakPolarHBondContact O-CB 3.49Å; Y292-C295 PolarHBondContact O-N 2.96Å; I293-C295 VanDerWaalsContact C-N 3.34Å; I293-C295 PolarHBondContact O-N 3.4Å; C295-F297 VanDerWaalsContact C-N 3.33Å; C295-G298 WeakPolarHBondContact O-CA 3.45Å; C295-G298 PolarHBondContact O-N 3.42Å; C295-G298 VanDerWaalsContact O-N 3.16Å; C295-V299 PolarHBondContact O-N 2.85Å
296	L	87.2	Confident	88.9	Confident	7 Å²	7	56.6 Å²	56.6	4%	0.037	28%	0.282	C	S	.	.	H	α-helix	trans	-67.6	-32.7	176.4	-78.5	171.6	0	0	0	112.6	Y292 I293 G298 V299 L300 I351 I352 F913 V917 F991 I995	Y292-L296 PolarHBondContact O-N 2.96Å; I293-L296 PolarHBondContact O-N 2.77Å; L296-G298 VanDerWaalsContact C-N 3.3Å; L296-V299 PolarHBondContact O-N 2.87Å; L296-L300 WeakPolarHBondContact O-CB 3.36Å; L296-L300 PolarHBondContact O-N 3.03Å; L296-I351 HydrophobicContact CD2-CG2 4.04Å; L296-I352 HydrophobicContact CB-CG1 4.44Å; L296-F913 HydrophobicContact CD1-CD1 3.18Å; L296-F913 HydrophobicContact CD1-CE1 3.32Å; L296-F913 HydrophobicContact CD1-CG 4.1Å; L296-F913 HydrophobicContact CD1-CZ 4.3Å; L296-V917 HydrophobicContact CD2-CG2 4.3Å; L296-F991 HydrophobicContact CD1-CZ 4.18Å; L296-F991 HydrophobicContact CG-CZ 4.26Å; L296-I995 HydrophobicContact CD2-CD1 4.32Å
297	F	89.2	Confident	89.3	Confident	72 Å²	72	54.9 Å²	54.9	32%	0.316	27%	0.274	S	S	.	.	H	α-helix	trans	-62.6	-38.6	170.1	-177.6	-102.1	0	0	0	111.4	F75 I293 L294 C295 L300 L301 I352	F75-F297 HydrophobicContact CD2-CD2 4.06Å; F75-F297 AromaticContact CD2-CE2 3.78Å; F75-F297 HydrophobicContact CD2-CE2 3.78Å; F75-F297 AromaticContact CE2-CD2 3.94Å; F75-F297 HydrophobicContact CE2-CD2 3.94Å; F75-F297 AromaticContact CE2-CE2 3.69Å; F75-F297 HydrophobicContact CE2-CE2 3.69Å; I293-F297 WeakPolarHBondContact O-CB 3.46Å; I293-F297 PolarHBondContact O-N 2.94Å; L294-F297 WeakPolarHBondContact O-CB 2.95Å; L294-F297 PolarHBondContact O-N 3.07Å; C295-F297 VanDerWaalsContact C-N 3.33Å; F297-L300 HydrophobicContact CD2-CD2 4.04Å; F297-L300 HydrophobicContact CE2-CD2 4.39Å; F297-L300 WeakPolarHBondContact O-CB 3.49Å; F297-L300 PolarHBondContact O-N 3.48Å; F297-L301 HydrophobicContact CD1-CD1 4.09Å; F297-L301 HydrophobicContact CD1-CG 4.46Å; F297-L301 HydrophobicContact CE1-CD1 3.55Å; F297-L301 HydrophobicContact CE1-CG 4.07Å; F297-L301 HydrophobicContact CZ-CD1 4.01Å; F297-L301 HydrophobicContact CZ-CD2 4.23Å; F297-L301 HydrophobicContact CZ-CG 4.15Å; F297-L301 WeakPolarHBondContact O-CG 3.44Å; F297-L301 PolarHBondContact O-N 2.98Å; F297-I352 HydrophobicContact CB-CD1 3.98Å; F297-I352 HydrophobicContact CD2-CD1 4.1Å
298	G	91.1	Very high	89.6	Confident	39 Å²	39	47.3 Å²	47.3	40%	0.402	25%	0.247	S	C	.	.	H	α-helix	trans	-60.7	-44	170.5	0	0	0	0	0	113	L294 C295 L296 L301 F302	L294-G298 PolarHBondContact O-N 2.86Å; C295-G298 WeakPolarHBondContact O-CA 3.45Å; C295-G298 PolarHBondContact O-N 3.42Å; C295-G298 VanDerWaalsContact O-N 3.16Å; L296-G298 VanDerWaalsContact C-N 3.3Å; G298-L301 PolarHBondContact O-N 2.98Å; G298-F302 PolarHBondContact O-N 2.62Å
299	V	88.9	Confident	89.9	Confident	63 Å²	63	49 Å²	49	38%	0.382	26%	0.256	S	S	.	.	H	α-helix	trans	-63.9	-41.6	175	175.5	0	0	0	0	111.5	C295 L296 F302 L303	C295-V299 PolarHBondContact O-N 2.85Å; L296-V299 PolarHBondContact O-N 2.87Å; V299-F302 PolarHBondContact O-N 2.95Å; V299-L303 HydrophobicContact CG1-CD1 4.1Å; V299-L303 HydrophobicContact CG1-CG 4.35Å; V299-L303 WeakPolarHBondContact O-CG 3.38Å; V299-L303 PolarHBondContact O-N 3.39Å
300	L	91.3	Very high	90.2	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-57	-49.7	174.9	167.5	64.4	0	0	0	111.3	F75 L296 F297 F302 L303 T304 Y348 I352	F75-L300 HydrophobicContact CE2-CD2 3.83Å; F75-L300 HydrophobicContact CZ-CD2 3.52Å; L296-L300 WeakPolarHBondContact O-CB 3.36Å; L296-L300 PolarHBondContact O-N 3.03Å; F297-L300 HydrophobicContact CD2-CD2 4.04Å; F297-L300 HydrophobicContact CE2-CD2 4.39Å; F297-L300 WeakPolarHBondContact O-CB 3.49Å; F297-L300 PolarHBondContact O-N 3.48Å; L300-F302 VanDerWaalsContact C-N 3.34Å; L300-F302 PolarHBondContact O-N 3.22Å; L300-L303 PolarHBondContact O-N 2.89Å; L300-T304 WeakPolarHBondContact O-CB 3.44Å; L300-T304 PolarHBondContact O-N 2.92Å; L300-T304 PolarHBondContact O-OG1 3.44Å; L300-Y348 HydrophobicContact CD1-CG 4.5Å; L300-Y348 VanDerWaalsContact CD1-O 3.23Å; L300-Y348 WeakPolarHBondContact CD1-O 3.22Å; L300-I352 HydrophobicContact CD2-CD1 4.38Å
301	L	91.5	Very high	90.3	Very high	54 Å²	54	48.4 Å²	48.4	28%	0.283	26%	0.256	S	S	.	.	H	α-helix	trans	-61.5	-44.6	177	-71.4	180	0	0	0	111	F297 G298 L303 T304 F305 L345	F297-L301 HydrophobicContact CD1-CD1 4.09Å; F297-L301 HydrophobicContact CD1-CG 4.46Å; F297-L301 HydrophobicContact CE1-CD1 3.55Å; F297-L301 HydrophobicContact CE1-CG 4.07Å; F297-L301 HydrophobicContact CZ-CD1 4.01Å; F297-L301 HydrophobicContact CZ-CD2 4.23Å; F297-L301 HydrophobicContact CZ-CG 4.15Å; F297-L301 WeakPolarHBondContact O-CG 3.44Å; F297-L301 PolarHBondContact O-N 2.98Å; G298-L301 PolarHBondContact O-N 2.98Å; L301-L303 PolarHBondContact O-N 2.56Å; L301-T304 WeakPolarHBondContact O-CB 3.26Å; L301-T304 PolarHBondContact O-N 3.44Å; L301-F305 HydrophobicContact CB-CD2 4.45Å; L301-F305 WeakPolarHBondContact O-CD2 3.46Å; L301-F305 PolarHBondContact O-N 3.23Å; L301-L345 HydrophobicContact CD2-CD1 4.1Å
302	F	92.9	Very high	90.3	Very high	137 Å²	137	47.3 Å²	47.3	60%	0.601	25%	0.247	S	C	*	.	H	α-helix	trans	-57.8	-49.4	177	173.3	-96.6	0	0	0	112.2	G298 V299 L300 T304 F305 F306	G298-F302 PolarHBondContact O-N 2.62Å; V299-F302 PolarHBondContact O-N 2.95Å; L300-F302 VanDerWaalsContact C-N 3.34Å; L300-F302 PolarHBondContact O-N 3.22Å; F302-T304 VanDerWaalsContact C-N 3.31Å; F302-T304 PolarHBondContact O-N 3.37Å; F302-F305 PolarHBondContact O-N 2.95Å; F302-F306 VanDerWaalsContact O-CB 3.31Å; F302-F306 WeakPolarHBondContact O-CB 3.43Å; F302-F306 PolarHBondContact O-N 3.17Å
303	L	91.1	Very high	90.3	Very high	14 Å²	14	49.4 Å²	49.4	7%	0.073	26%	0.261	C	S	.	.	H	α-helix	trans	-60.6	-42.2	177.1	-71.5	174.9	0	0	0	111.3	V299 L300 L301 F306 T307 Y348 I351 L921 F924	V299-L303 HydrophobicContact CG1-CD1 4.1Å; V299-L303 HydrophobicContact CG1-CG 4.35Å; V299-L303 WeakPolarHBondContact O-CG 3.38Å; V299-L303 PolarHBondContact O-N 3.39Å; L300-L303 PolarHBondContact O-N 2.89Å; L301-L303 PolarHBondContact O-N 2.56Å; L303-F306 PolarHBondContact O-N 3.28Å; L303-T307 WeakPolarHBondContact O-CB 3.46Å; L303-T307 VanDerWaalsContact O-CG2 3.23Å; L303-T307 WeakPolarHBondContact O-CG2 3.23Å; L303-T307 PolarHBondContact O-N 3.42Å; L303-T307 PolarHBondContact O-OG1 3.13Å; L303-Y348 HydrophobicContact CB-CD2 4.21Å; L303-Y348 HydrophobicContact CB-CE2 4.43Å; L303-I351 HydrophobicContact CD1-CD1 3.65Å; L303-L921 HydrophobicContact CD1-CD1 4.47Å; L303-F924 HydrophobicContact CD2-CD2 3.93Å; L303-F924 HydrophobicContact CD2-CE2 3.89Å; L303-F924 HydrophobicContact CD2-CG 4.43Å; L303-F924 HydrophobicContact CD2-CZ 4.35Å
304	T	91.3	Very high	90.4	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.5	-48.5	177.8	-58.1	0	0	0	0	111.8	L300 L301 F302 T307 F308 F341 C344 L345	L300-T304 WeakPolarHBondContact O-CB 3.44Å; L300-T304 PolarHBondContact O-N 2.92Å; L300-T304 PolarHBondContact O-OG1 3.44Å; L301-T304 WeakPolarHBondContact O-CB 3.26Å; L301-T304 PolarHBondContact O-N 3.44Å; F302-T304 VanDerWaalsContact C-N 3.31Å; F302-T304 PolarHBondContact O-N 3.37Å; T304-T307 PolarHBondContact O-OG1 3.36Å; T304-T307 VanDerWaalsContact O-OG1 3.14Å; T304-F308 WeakPolarHBondContact O-CB 3.29Å; T304-F308 PolarHBondContact O-N 3.42Å; T304-F341 HydrophobicContact CG2-CD2 4.07Å; T304-F341 HydrophobicContact CG2-CE2 3.73Å; T304-F341 HydrophobicContact CG2-CZ 4.03Å; T304-C344 HydrophobicContact CG2-CB 3.83Å; T304-L345 HydrophobicContact CG2-CB 3.94Å; T304-L345 HydrophobicContact CG2-CD1 4.19Å
305	F	92.4	Very high	90.2	Very high	106 Å²	106	48.7 Å²	48.7	47%	0.465	25%	0.253	S	S	.	.	H	α-helix	trans	-63.5	-43.8	177.3	-84	-68.6	0	0	0	111.7	L301 F302 F308 I309 F341	L301-F305 HydrophobicContact CB-CD2 4.45Å; L301-F305 WeakPolarHBondContact O-CD2 3.46Å; L301-F305 PolarHBondContact O-N 3.23Å; F302-F305 PolarHBondContact O-N 2.95Å; F305-F308 PolarHBondContact O-N 3.31Å; F305-I309 VanDerWaalsContact O-CG1 3.27Å; F305-I309 WeakPolarHBondContact O-CG1 3.17Å; F305-I309 PolarHBondContact O-N 2.83Å; F305-F341 AromaticContact CD1-CE2 3.78Å; F305-F341 HydrophobicContact CD1-CE2 3.78Å; F305-F341 AromaticContact CE1-CE2 3.62Å; F305-F341 HydrophobicContact CE1-CE2 3.62Å; F305-F341 HydrophobicContact CE1-CZ 4.12Å; F305-F341 HydrophobicContact CE2-CE2 4.36Å; F305-F341 HydrophobicContact CE2-CZ 4.36Å; F305-F341 HydrophobicContact CG-CE2 4.22Å; F305-F341 AromaticContact CZ-CE2 3.93Å; F305-F341 HydrophobicContact CZ-CE2 3.93Å; F305-F341 AromaticContact CZ-CZ 3.97Å; F305-F341 HydrophobicContact CZ-CZ 3.97Å
306	F	93.3	Very high	89.9	Confident	96 Å²	96	49.8 Å²	49.8	42%	0.421	26%	0.262	S	S	.	.	H	α-helix	trans	-60.7	-48.4	178.7	178.2	-91.3	0	0	0	111.5	F302 L303 F308 I309 A310 F924 F932	F302-F306 VanDerWaalsContact O-CB 3.31Å; F302-F306 WeakPolarHBondContact O-CB 3.43Å; F302-F306 PolarHBondContact O-N 3.17Å; L303-F306 PolarHBondContact O-N 3.28Å; F306-F308 VanDerWaalsContact C-N 3.34Å; F306-F308 PolarHBondContact O-N 3.38Å; F306-I309 PolarHBondContact O-N 3.34Å; F306-A310 VanDerWaalsContact O-CB 3.3Å; F306-A310 WeakPolarHBondContact O-CB 3.1Å; F306-A310 PolarHBondContact O-N 3.28Å; F306-F924 AromaticContact CD1-CE2 3.83Å; F306-F924 HydrophobicContact CD1-CE2 3.83Å; F306-F924 HydrophobicContact CD1-CZ 4.16Å; F306-F924 HydrophobicContact CE1-CE2 4.01Å; F306-F924 AromaticContact CE1-CZ 3.96Å; F306-F924 HydrophobicContact CE1-CZ 3.96Å; F306-F932 HydrophobicContact CE1-CE1 4.22Å; F306-F932 HydrophobicContact CE1-CZ 4.42Å
307	T	90.9	Very high	89.9	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.012	29%	0.292	C	S	.	.	H	α-helix	trans	-70.6	-33.7	-178.1	57.6	0	0	0	0	112	L303 T304 A310 N311 C344 Y348 F924 F932	L303-T307 WeakPolarHBondContact O-CB 3.46Å; L303-T307 VanDerWaalsContact O-CG2 3.23Å; L303-T307 WeakPolarHBondContact O-CG2 3.23Å; L303-T307 PolarHBondContact O-N 3.42Å; L303-T307 PolarHBondContact O-OG1 3.13Å; T304-T307 PolarHBondContact O-OG1 3.36Å; T304-T307 VanDerWaalsContact O-OG1 3.14Å; T307-A310 PolarHBondContact O-N 3.45Å; T307-N311 VanDerWaalsContact O-CB 3.27Å; T307-N311 WeakPolarHBondContact O-CB 3.28Å; T307-N311 PolarHBondContact O-N 3.07Å; T307-C344 PolarHBondContact OG1-SG 3.24Å; T307-Y348 HydrophobicContact CG2-CE2 3.75Å; T307-Y348 WeakPolarHBondContact CG2-OH 3.42Å; T307-F924 HydrophobicContact CG2-CD2 3.9Å; T307-F924 HydrophobicContact CG2-CE2 3.88Å; T307-F932 HydrophobicContact CG2-CD1 3.96Å; T307-F932 HydrophobicContact CG2-CE1 4.29Å
308	F	90.9	Very high	89.7	Confident	35 Å²	35	56 Å²	56	15%	0.154	29%	0.285	C	S	.	.	H	α-helix	trans	-62.6	-49.4	172.4	174.3	-111.4	0	0	0	111.6	T304 F305 F306 A310 N311 L312 R337 D340 F341	T304-F308 WeakPolarHBondContact O-CB 3.29Å; T304-F308 PolarHBondContact O-N 3.42Å; F305-F308 PolarHBondContact O-N 3.31Å; F306-F308 VanDerWaalsContact C-N 3.34Å; F306-F308 PolarHBondContact O-N 3.38Å; F308-A310 VanDerWaalsContact C-N 3.32Å; F308-A310 PolarHBondContact O-N 2.85Å; F308-N311 PolarHBondContact O-N 3.39Å; F308-L312 HydrophobicContact CD1-CD1 4.23Å; F308-L312 HydrophobicContact CE1-CD1 3.65Å; F308-L312 HydrophobicContact CE1-CG 4.41Å; F308-L312 HydrophobicContact CE2-CD1 4.26Å; F308-L312 HydrophobicContact CE2-CD2 4.26Å; F308-L312 HydrophobicContact CE2-CG 4.2Å; F308-L312 HydrophobicContact CZ-CD1 3.67Å; F308-L312 HydrophobicContact CZ-CD2 4.25Å; F308-L312 HydrophobicContact CZ-CG 4.11Å; F308-L312 WeakPolarHBondContact O-CG 3.27Å; F308-L312 PolarHBondContact O-N 3.26Å; F308-R337 HydrophobicContact CE2-CB 4.42Å; F308-R337 WeakPolarHBondContact CE2-O 3.37Å; F308-R337 HydrophobicContact CZ-CB 4.31Å; F308-D340 HydrophobicContact CD2-CB 4.29Å; F308-D340 HydrophobicContact CE2-CB 4.24Å; F308-F341 HydrophobicContact CB-CD2 4.12Å; F308-F341 HydrophobicContact CD1-CD2 4.12Å; F308-F341 HydrophobicContact CD2-CB 3.84Å; F308-F341 HydrophobicContact CD2-CD2 4.48Å; F308-F341 HydrophobicContact CE2-CB 4.03Å; F308-F341 HydrophobicContact CG-CB 4.19Å; F308-F341 AromaticContact CG-CD2 3.97Å; F308-F341 HydrophobicContact CG-CD2 3.97Å; F308-F341 HydrophobicContact CZ-CB 4.5Å
309	I	91.9	Very high	89	Confident	97 Å²	97	56.8 Å²	56.8	50%	0.497	28%	0.278	S	S	.	.	H	α-helix	trans	-61	-43.7	176.3	-67.8	166.6	0	0	0	110.5	F305 F306 N311 L312 V313	F305-I309 VanDerWaalsContact O-CG1 3.27Å; F305-I309 WeakPolarHBondContact O-CG1 3.17Å; F305-I309 PolarHBondContact O-N 2.83Å; F306-I309 PolarHBondContact O-N 3.34Å; I309-N311 VanDerWaalsContact C-N 3.35Å; I309-N311 PolarHBondContact O-N 3.03Å; I309-L312 WeakPolarHBondContact O-CB 3.4Å; I309-L312 PolarHBondContact O-N 3.36Å; I309-V313 WeakPolarHBondContact O-CG2 3.16Å; I309-V313 PolarHBondContact O-N 2.79Å
310	A	91.7	Very high	88.3	Confident	19 Å²	19	63.2 Å²	63.2	16%	0.157	30%	0.301	C	S	.	.	H	α-helix	trans	-64.6	-38.3	179.3	0	0	0	0	0	112.3	F306 T307 F308 V313 W314 F932	F306-A310 VanDerWaalsContact O-CB 3.3Å; F306-A310 WeakPolarHBondContact O-CB 3.1Å; F306-A310 PolarHBondContact O-N 3.28Å; T307-A310 PolarHBondContact O-N 3.45Å; F308-A310 VanDerWaalsContact C-N 3.32Å; F308-A310 PolarHBondContact O-N 2.85Å; A310-V313 PolarHBondContact O-N 3.01Å; A310-W314 VanDerWaalsContact O-CB 3.28Å; A310-W314 WeakPolarHBondContact O-CB 3.5Å; A310-W314 PolarHBondContact O-N 3.22Å; A310-F932 HydrophobicContact CB-CB 4.48Å; A310-F932 HydrophobicContact CB-CD1 3.9Å; A310-F932 HydrophobicContact CB-CD2 3.48Å; A310-F932 VanDerWaalsContact CB-CD2 3.48Å; A310-F932 HydrophobicContact CB-CE1 3.91Å; A310-F932 HydrophobicContact CB-CE2 3.51Å; A310-F932 HydrophobicContact CB-CG 3.68Å; A310-F932 HydrophobicContact CB-CZ 3.71Å
311	N	88.5	Confident	87.8	Confident	12 Å²	12	71 Å²	71	6%	0.064	34%	0.335	C	S	.	.	H	α-helix	trans	-61.5	-46.6	171.9	-178.2	-6.4	0	0	0	110.9	T307 F308 I309 V313 W314 T315 F932	T307-N311 VanDerWaalsContact O-CB 3.27Å; T307-N311 WeakPolarHBondContact O-CB 3.28Å; T307-N311 PolarHBondContact O-N 3.07Å; F308-N311 PolarHBondContact O-N 3.39Å; I309-N311 VanDerWaalsContact C-N 3.35Å; I309-N311 PolarHBondContact O-N 3.03Å; N311-V313 VanDerWaalsContact C-N 3.32Å; N311-V313 PolarHBondContact O-N 3.08Å; N311-W314 PolarHBondContact O-N 2.88Å; N311-T315 WeakPolarHBondContact O-CB 3.46Å; N311-T315 PolarHBondContact O-N 2.9Å; N311-T315 PolarHBondContact O-OG1 3.46Å; N311-T315 PolarHBondContact OD1-OG1 3.25Å; N311-F932 HydrophobicContact CB-CB 3.81Å; N311-F932 PolarHBondContact ND2-O 2.73Å
312	L	87.3	Confident	87.4	Confident	62 Å²	62	70.5 Å²	70.5	33%	0.325	33%	0.331	S	S	.	.	H	α-helix	trans	-57.6	-44.9	176.9	-69.1	176.9	0	0	0	112.2	F308 I309 S316 R337	F308-L312 HydrophobicContact CD1-CD1 4.23Å; F308-L312 HydrophobicContact CE1-CD1 3.65Å; F308-L312 HydrophobicContact CE1-CG 4.41Å; F308-L312 HydrophobicContact CE2-CD1 4.26Å; F308-L312 HydrophobicContact CE2-CD2 4.26Å; F308-L312 HydrophobicContact CE2-CG 4.2Å; F308-L312 HydrophobicContact CZ-CD1 3.67Å; F308-L312 HydrophobicContact CZ-CD2 4.25Å; F308-L312 HydrophobicContact CZ-CG 4.11Å; F308-L312 WeakPolarHBondContact O-CG 3.27Å; F308-L312 PolarHBondContact O-N 3.26Å; I309-L312 WeakPolarHBondContact O-CB 3.4Å; I309-L312 PolarHBondContact O-N 3.36Å; L312-S316 WeakPolarHBondContact O-CB 3.14Å; L312-S316 PolarHBondContact O-N 2.6Å; L312-S316 PolarHBondContact O-OG 3.48Å; L312-R337 HydrophobicContact CD2-CG 4.02Å
313	V	90.4	Very high	87	Confident	59 Å²	59	75.1 Å²	75.1	36%	0.358	35%	0.345	S	S	.	.	H	α-helix	trans	-64.6	-49.4	177.7	174.3	0	0	0	0	110.6	I309 A310 N311 T315 S316 W317	I309-V313 WeakPolarHBondContact O-CG2 3.16Å; I309-V313 PolarHBondContact O-N 2.79Å; A310-V313 PolarHBondContact O-N 3.01Å; N311-V313 VanDerWaalsContact C-N 3.32Å; N311-V313 PolarHBondContact O-N 3.08Å; V313-T315 PolarHBondContact O-N 3.13Å; V313-S316 PolarHBondContact O-N 2.9Å; V313-S316 PolarHBondContact O-OG 2.91Å; V313-W317 HydrophobicContact CG1-CD2 4Å; V313-W317 HydrophobicContact CG1-CE3 4.19Å; V313-W317 HydrophobicContact CG1-CH2 3.9Å; V313-W317 HydrophobicContact CG1-CZ2 3.67Å; V313-W317 HydrophobicContact CG1-CZ3 4.15Å; V313-W317 PolarHBondContact O-N 3.42Å; V313-W317 VanDerWaalsContact O-N 3.16Å
314	W	89.5	Confident	86.7	Confident	73 Å²	73	81.3 Å²	81.3	28%	0.277	37%	0.368	S	S	.	.	H	α-helix	trans	-61.1	-46.6	-178.6	-171.2	95.4	0	0	0	112	A310 N311 S316 W317 N318 M322 L325	A310-W314 VanDerWaalsContact O-CB 3.28Å; A310-W314 WeakPolarHBondContact O-CB 3.5Å; A310-W314 PolarHBondContact O-N 3.22Å; N311-W314 PolarHBondContact O-N 2.88Å; W314-S316 PolarHBondContact O-N 2.85Å; W314-W317 PolarHBondContact O-N 3.38Å; W314-N318 HydrophobicContact CD2-CB 4.36Å; W314-N318 HydrophobicContact CE3-CB 4.38Å; W314-N318 HydrophobicContact CH2-CB 4.24Å; W314-N318 HydrophobicContact CZ2-CB 4.23Å; W314-N318 HydrophobicContact CZ3-CB 4.32Å; W314-N318 PolarHBondContact NE1-ND2 3.4Å; W314-N318 VanDerWaalsContact NE1-ND2 3.14Å; W314-N318 WeakPolarHBondContact O-CB 3.45Å; W314-N318 PolarHBondContact O-N 3.45Å; W314-M322 HydrophobicContact CH2-CE 4.27Å; W314-M322 HydrophobicContact CH2-SD 3.61Å; W314-M322 HydrophobicContact CZ2-CE 4Å; W314-M322 HydrophobicContact CZ2-SD 3.97Å; W314-L325 HydrophobicContact CH2-CD1 3.94Å; W314-L325 HydrophobicContact CZ3-CD1 4.07Å
315	T	83.4	Confident	86.1	Confident	25 Å²	25	84.8 Å²	84.8	15%	0.153	39%	0.387	C	S	.	.	H	α-helix	trans	-60.7	-45.1	176.7	-64.2	0	0	0	0	110.4	N311 V313 W317 N318 E319	N311-T315 WeakPolarHBondContact O-CB 3.46Å; N311-T315 PolarHBondContact O-N 2.9Å; N311-T315 PolarHBondContact O-OG1 3.46Å; N311-T315 PolarHBondContact OD1-OG1 3.25Å; V313-T315 PolarHBondContact O-N 3.13Å; T315-W317 PolarHBondContact O-N 3.25Å; T315-N318 PolarHBondContact O-N 3.45Å; T315-E319 HydrophobicContact CG2-CB 4Å; T315-E319 HydrophobicContact CG2-CG 4.28Å; T315-E319 WeakPolarHBondContact CG2-OE2 3.26Å; T315-E319 WeakPolarHBondContact O-CB 3.32Å; T315-E319 PolarHBondContact O-N 3.13Å
316	S	83.6	Confident	84.9	Confident	74 Å²	74	87.2 Å²	87.2	52%	0.517	40%	0.4	S	S	.	.	H	α-helix	trans	-60.3	-31.2	177.9	78.5	0	0	0	0	114.2	L312 V313 W314	L312-S316 WeakPolarHBondContact O-CB 3.14Å; L312-S316 PolarHBondContact O-N 2.6Å; L312-S316 PolarHBondContact O-OG 3.48Å; V313-S316 PolarHBondContact O-N 2.9Å; V313-S316 PolarHBondContact O-OG 2.91Å; W314-S316 PolarHBondContact O-N 2.85Å
317	W	87.3	Confident	83.2	Confident	176 Å²	176	89.5 Å²	89.5	67%	0.667	41%	0.411	S	S	*	.	H	α-helix	trans	-89	-33.2	-177.1	-68.9	-1.7	0	0	0	113.6	V313 W314 T315	V313-W317 HydrophobicContact CG1-CD2 4Å; V313-W317 HydrophobicContact CG1-CE3 4.19Å; V313-W317 HydrophobicContact CG1-CH2 3.9Å; V313-W317 HydrophobicContact CG1-CZ2 3.67Å; V313-W317 HydrophobicContact CG1-CZ3 4.15Å; V313-W317 PolarHBondContact O-N 3.42Å; V313-W317 VanDerWaalsContact O-N 3.16Å; W314-W317 PolarHBondContact O-N 3.38Å; T315-W317 PolarHBondContact O-N 3.25Å
318	N	85.5	Confident	81.6	Confident	33 Å²	33	94 Å²	94	18%	0.176	44%	0.436	C	S	.	.	H	α-helix	trans	-113	-24.9	-167.7	-67.1	-33.9	0	0	0	114.6	W314 T315 K320 K321 M322	W314-N318 HydrophobicContact CD2-CB 4.36Å; W314-N318 HydrophobicContact CE3-CB 4.38Å; W314-N318 HydrophobicContact CH2-CB 4.24Å; W314-N318 HydrophobicContact CZ2-CB 4.23Å; W314-N318 HydrophobicContact CZ3-CB 4.32Å; W314-N318 PolarHBondContact NE1-ND2 3.4Å; W314-N318 VanDerWaalsContact NE1-ND2 3.14Å; W314-N318 WeakPolarHBondContact O-CB 3.45Å; W314-N318 PolarHBondContact O-N 3.45Å; T315-N318 PolarHBondContact O-N 3.45Å; N318-K320 VanDerWaalsContact C-N 3.3Å; N318-K320 PolarHBondContact O-N 3.09Å; N318-K321 WeakPolarHBondContact O-CA 3.44Å; N318-K321 WeakPolarHBondContact O-CB 3.35Å; N318-K321 PolarHBondContact O-N 2.94Å; N318-M322 HydrophobicContact CB-CE 4Å; N318-M322 HydrophobicContact CB-SD 4.03Å; N318-M322 PolarHBondContact O-N 3.48Å; N318-M322 VanDerWaalsContact O-N 3.11Å
319	E	74.5	Confident	79.9	Confident	56 Å²	56	98.1 Å²	98.1	26%	0.262	46%	0.463	S	S	.	.	G	3₁₀ helix	trans	-56.5	-43.9	-176.1	-171.7	172.4	-142.5	0	0	111.2	T315 K321 M322 R336	T315-E319 HydrophobicContact CG2-CB 4Å; T315-E319 HydrophobicContact CG2-CG 4.28Å; T315-E319 WeakPolarHBondContact CG2-OE2 3.26Å; T315-E319 WeakPolarHBondContact O-CB 3.32Å; T315-E319 PolarHBondContact O-N 3.13Å; E319-K321 PolarHBondContact O-N 3.5Å; E319-K321 VanDerWaalsContact O-N 3.17Å; E319-M322 PolarHBondContact O-N 2.91Å; E319-R336 IonicContact OE1-CZ 3.03Å; E319-R336 IonicContact OE1-NH1 3.53Å; E319-R336 PolarHBondContact OE1-NH1 3.45Å; E319-R336 IonicContact OE1-NH2 3.37Å; E319-R336 PolarHBondContact OE1-NH2 2.99Å
320	K	75.2	Confident	78	Confident	198 Å²	198	101.1 Å²	101.1	86%	0.861	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-65.7	-18.3	176.6	-64	-174.5	-179.7	-178	0	114.6	N318	N318-K320 VanDerWaalsContact C-N 3.3Å; N318-K320 PolarHBondContact O-N 3.09Å
321	K	81.8	Confident	76.2	Confident	162 Å²	162	103.3 Å²	103.3	70%	0.704	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-98.1	-25	-176.4	-64.8	178.8	-178.2	171.1	0	112.8	N318 E319	N318-K321 WeakPolarHBondContact O-CA 3.44Å; N318-K321 WeakPolarHBondContact O-CB 3.35Å; N318-K321 PolarHBondContact O-N 2.94Å; E319-K321 PolarHBondContact O-N 3.5Å; E319-K321 VanDerWaalsContact O-N 3.17Å
322	M	83.1	Confident	74.9	Confident	44 Å²	44	113 Å²	113	22%	0.217	53%	0.527	C	S	.	.			trans	-105.2	83	-168.8	-68.3	-179.7	177	0	0	111.4	W314 N318 E319 Y324 L325	W314-M322 HydrophobicContact CH2-CE 4.27Å; W314-M322 HydrophobicContact CH2-SD 3.61Å; W314-M322 HydrophobicContact CZ2-CE 4Å; W314-M322 HydrophobicContact CZ2-SD 3.97Å; N318-M322 HydrophobicContact CB-CE 4Å; N318-M322 HydrophobicContact CB-SD 4.03Å; N318-M322 PolarHBondContact O-N 3.48Å; N318-M322 VanDerWaalsContact O-N 3.11Å; E319-M322 PolarHBondContact O-N 2.91Å; M322-Y324 HydrophobicContact CB-CD1 4.33Å; M322-Y324 HydrophobicContact CB-CE1 3.76Å; M322-Y324 HydrophobicContact CG-CE1 4Å; M322-Y324 PolarHBondContact O-N 3.33Å; M322-Y324 PolarHBondContact SD-OH 3.19Å; M322-L325 HydrophobicContact CB-CD1 3.92Å; M322-L325 HydrophobicContact CB-CG 4.24Å; M322-L325 PolarHBondContact O-N 3.02Å; M322-L325 HydrophobicContact SD-CD1 3.9Å
323	W	84.4	Confident	73.9	Confident	234 Å²	234	113.3 Å²	113.3	89%	0.886	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-22.1	-175	68.1	-92.7	0	0	0	115.7	L325	W323-L325 VanDerWaalsContact C-N 3.34Å
324	Y	84.7	Confident	73.1	Confident	144 Å²	144	115.8 Å²	115.8	57%	0.565	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-13.4	179.7	60.3	-93.1	0	0	0	113.3	M322	M322-Y324 HydrophobicContact CB-CD1 4.33Å; M322-Y324 HydrophobicContact CB-CE1 3.76Å; M322-Y324 HydrophobicContact CG-CE1 4Å; M322-Y324 PolarHBondContact O-N 3.33Å; M322-Y324 PolarHBondContact SD-OH 3.19Å
325	L	78.9	Confident	72.5	Confident	73 Å²	73	116.5 Å²	116.5	38%	0.382	56%	0.555	S	S	.	*	S	Bend	trans	-89.3	105	172	-64.3	175	0	0	0	107.8	W314 M322 W323 E327	W314-L325 HydrophobicContact CH2-CD1 3.94Å; W314-L325 HydrophobicContact CZ3-CD1 4.07Å; M322-L325 HydrophobicContact CB-CD1 3.92Å; M322-L325 HydrophobicContact CB-CG 4.24Å; M322-L325 PolarHBondContact O-N 3.02Å; M322-L325 HydrophobicContact SD-CD1 3.9Å; W323-L325 VanDerWaalsContact C-N 3.34Å; L325-E327 PolarHBondContact O-N 2.93Å
326	Q	65.8	Low	72.3	Confident	158 Å²	158	119.5 Å²	119.5	74%	0.738	56%	0.563	S	S	*	*			trans	-62.5	123.6	-173.5	-169.3	169.3	-7.8	0	0	111.5	N328	Q326-N328 PolarHBondContact O-N 2.97Å; Q326-N328 VanDerWaalsContact O-N 3.1Å
327	E	58.4	Low	72.2	Confident	143 Å²	143	121.8 Å²	121.8	67%	0.668	56%	0.561	S	S	*	*			trans	-72.4	98.4	171.3	-158.4	172.7	-155.4	0	0	107.6	L325 V329	L325-E327 PolarHBondContact O-N 2.93Å; E327-V329 VanDerWaalsContact C-N 3.34Å; E327-V329 PolarHBondContact O-N 3.25Å
328	N	56.7	Low	72	Confident	98 Å²	98	117.8 Å²	117.8	52%	0.524	55%	0.552	S	S	.	*			trans	-75	89.5	176.6	-82.8	-22.2	0	0	0	109.4	Q326 D330	Q326-N328 PolarHBondContact O-N 2.97Å; Q326-N328 VanDerWaalsContact O-N 3.1Å; N328-D330 PolarHBondContact O-N 3.39Å; N328-D330 VanDerWaalsContact O-N 3.16Å
329	V	54.5	Low	71.9	Confident	120 Å²	120	118.3 Å²	118.3	73%	0.727	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.9	-17	-176.4	178.6	0	0	0	0	113.7	E327	E327-V329 VanDerWaalsContact C-N 3.34Å; E327-V329 PolarHBondContact O-N 3.25Å
330	D	53.9	Low	72.4	Confident	161 Å²	161	117.5 Å²	117.5	86%	0.861	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.6	-1.6	-166.7	-70.3	-30.2	0	0	0	116.7	N328	N328-D330 PolarHBondContact O-N 3.39Å; N328-D330 VanDerWaalsContact O-N 3.16Å
331	T	53.8	Low	73.1	Confident	65 Å²	65	110.1 Å²	110.1	40%	0.399	52%	0.52	S	S	.	.	S	Bend	trans	-106.7	124	-178.4	-34.9	0	0	0	0	110.5	S333 L335	T331-S333 PolarHBondContact O-N 3.48Å; T331-L335 HydrophobicContact CG2-CB 4.5Å; T331-L335 HydrophobicContact CG2-CD2 4.13Å
332	R	59.6	Low	73.4	Confident	214 Å²	214	103.4 Å²	103.4	81%	0.808	49%	0.492	S	S	*	.			trans	-42.1	119.2	171.4	-85.8	-177.4	179	166.6	-0	108.7	D334 L335 R336	R332-D334 PolarHBondContact O-N 3.13Å; R332-L335 HydrophobicContact CB-CB 4.26Å; R332-L335 WeakPolarHBondContact O-CA 3.4Å; R332-L335 WeakPolarHBondContact O-CB 3.45Å; R332-L335 PolarHBondContact O-N 3.47Å; R332-R336 PolarHBondContact O-N 3.42Å
333	S	67	Low	73.7	Confident	70 Å²	70	102.2 Å²	102.2	49%	0.49	49%	0.487	S	S	.	.	H	α-helix	trans	-51.1	-34.8	-174.1	51.3	0	0	0	0	112.7	T331 R337	T331-S333 PolarHBondContact O-N 3.48Å; S333-R337 VanDerWaalsContact O-CG 3.27Å; S333-R337 WeakPolarHBondContact O-CG 3.23Å; S333-R337 PolarHBondContact O-N 3.37Å; S333-R337 VanDerWaalsContact O-N 3.14Å
334	D	74.4	Confident	73.9	Confident	111 Å²	111	91.2 Å²	91.2	59%	0.594	45%	0.446	S	S	*	.	H	α-helix	trans	-69.9	-36.5	177.2	-60.2	-31	0	0	0	113.4	R332 R337 L338	R332-D334 PolarHBondContact O-N 3.13Å; D334-R337 PolarHBondContact O-N 2.91Å; D334-R337 IonicContact OD1-NH1 3.72Å; D334-R337 PolarHBondContact OD1-NH1 3.18Å; D334-L338 PolarHBondContact O-N 3.32Å
335	L	76.7	Confident	74.1	Confident	87 Å²	87	85.4 Å²	85.4	46%	0.455	42%	0.424	S	S	.	.	H	α-helix	trans	-66.5	-45.3	175.7	-173.2	69	0	0	0	109.9	T331 R332 R337 L338 L339	T331-L335 HydrophobicContact CG2-CB 4.5Å; T331-L335 HydrophobicContact CG2-CD2 4.13Å; R332-L335 HydrophobicContact CB-CB 4.26Å; R332-L335 WeakPolarHBondContact O-CA 3.4Å; R332-L335 WeakPolarHBondContact O-CB 3.45Å; R332-L335 PolarHBondContact O-N 3.47Å; L335-R337 VanDerWaalsContact C-N 3.34Å; L335-R337 PolarHBondContact O-N 2.86Å; L335-L338 WeakPolarHBondContact O-CB 3.21Å; L335-L338 PolarHBondContact O-N 3.3Å; L335-L338 VanDerWaalsContact O-N 3.14Å; L335-L339 HydrophobicContact CG-CD1 4.23Å; L335-L339 HydrophobicContact CG-CG 4.46Å; L335-L339 VanDerWaalsContact O-CG 3.25Å; L335-L339 WeakPolarHBondContact O-CG 3.38Å; L335-L339 PolarHBondContact O-N 2.85Å
336	R	77.7	Confident	74.6	Confident	88 Å²	88	82 Å²	82	33%	0.332	41%	0.406	S	S	.	.	H	α-helix	trans	-56.6	-47.5	176.5	-178	177.7	173.8	-150.9	-0.4	111.6	E319 R332 L338 L339 D340	E319-R336 IonicContact OE1-CZ 3.03Å; E319-R336 IonicContact OE1-NH1 3.53Å; E319-R336 PolarHBondContact OE1-NH1 3.45Å; E319-R336 IonicContact OE1-NH2 3.37Å; E319-R336 PolarHBondContact OE1-NH2 2.99Å; R332-R336 PolarHBondContact O-N 3.42Å; R336-L338 VanDerWaalsContact C-N 3.32Å; R336-L338 PolarHBondContact O-N 3.14Å; R336-L339 WeakPolarHBondContact O-CB 3.44Å; R336-L339 PolarHBondContact O-N 3.29Å; R336-L339 VanDerWaalsContact O-N 3.08Å; R336-D340 VanDerWaalsContact O-CG 3.29Å; R336-D340 PolarHBondContact O-N 3.12Å
337	R	81.5	Confident	75.6	Confident	122 Å²	122	74.6 Å²	74.6	46%	0.46	37%	0.372	S	S	.	.	H	α-helix	trans	-59.1	-41.2	176.7	-69.4	169.6	-179.3	163.3	-4.2	112.4	F308 L312 S333 D334 L335 D340 F341	F308-R337 HydrophobicContact CE2-CB 4.42Å; F308-R337 WeakPolarHBondContact CE2-O 3.37Å; F308-R337 HydrophobicContact CZ-CB 4.31Å; L312-R337 HydrophobicContact CD2-CG 4.02Å; S333-R337 VanDerWaalsContact O-CG 3.27Å; S333-R337 WeakPolarHBondContact O-CG 3.23Å; S333-R337 PolarHBondContact O-N 3.37Å; S333-R337 VanDerWaalsContact O-N 3.14Å; D334-R337 PolarHBondContact O-N 2.91Å; D334-R337 IonicContact OD1-NH1 3.72Å; D334-R337 PolarHBondContact OD1-NH1 3.18Å; L335-R337 VanDerWaalsContact C-N 3.34Å; L335-R337 PolarHBondContact O-N 2.86Å; R337-D340 PolarHBondContact O-N 3.44Å; R337-F341 PolarHBondContact O-N 3.42Å; R337-F341 VanDerWaalsContact O-N 3.16Å
338	L	83.8	Confident	77.1	Confident	93 Å²	93	67.9 Å²	67.9	49%	0.487	34%	0.34	S	S	.	.	H	α-helix	trans	-64.1	-41.4	175	180	65	0	0	0	111.7	D334 L335 R336 F341 I342	D334-L338 PolarHBondContact O-N 3.32Å; L335-L338 WeakPolarHBondContact O-CB 3.21Å; L335-L338 PolarHBondContact O-N 3.3Å; L335-L338 VanDerWaalsContact O-N 3.14Å; R336-L338 VanDerWaalsContact C-N 3.32Å; R336-L338 PolarHBondContact O-N 3.14Å; L338-F341 PolarHBondContact O-N 3.34Å; L338-I342 HydrophobicContact CG-CD1 4.19Å; L338-I342 WeakPolarHBondContact O-CG1 3.37Å; L338-I342 PolarHBondContact O-N 3.04Å; L338-I342 VanDerWaalsContact O-N 3.09Å
339	L	84.5	Confident	78.5	Confident	44 Å²	44	63.4 Å²	63.4	23%	0.23	32%	0.316	C	S	.	.	H	α-helix	trans	-62.9	-43	177	-61.4	169.6	0	0	0	110.7	I85 V88 L335 R336 F341 I342 T343	I85-L339 HydrophobicContact CG2-CD2 4.26Å; V88-L339 HydrophobicContact CG2-CB 4.15Å; V88-L339 HydrophobicContact CG2-CD2 3.27Å; V88-L339 HydrophobicContact CG2-CG 4.16Å; L335-L339 HydrophobicContact CG-CD1 4.23Å; L335-L339 HydrophobicContact CG-CG 4.46Å; L335-L339 VanDerWaalsContact O-CG 3.25Å; L335-L339 WeakPolarHBondContact O-CG 3.38Å; L335-L339 PolarHBondContact O-N 2.85Å; R336-L339 WeakPolarHBondContact O-CB 3.44Å; R336-L339 PolarHBondContact O-N 3.29Å; R336-L339 VanDerWaalsContact O-N 3.08Å; L339-F341 VanDerWaalsContact C-N 3.3Å; L339-F341 PolarHBondContact O-N 3.18Å; L339-I342 PolarHBondContact O-N 3.2Å; L339-I342 VanDerWaalsContact O-N 3.1Å; L339-T343 PolarHBondContact O-N 2.86Å; L339-T343 PolarHBondContact O-OG1 3.17Å; L339-T343 VanDerWaalsContact O-OG1 3.06Å
340	D	84	Confident	79.7	Confident	38 Å²	38	58.1 Å²	58.1	20%	0.203	28%	0.284	C	S	.	.	H	α-helix	trans	-60.2	-38.8	177.1	-63.9	-28.9	0	0	0	112.2	F308 R336 R337 T343 C344	F308-D340 HydrophobicContact CD2-CB 4.29Å; F308-D340 HydrophobicContact CE2-CB 4.24Å; R336-D340 VanDerWaalsContact O-CG 3.29Å; R336-D340 PolarHBondContact O-N 3.12Å; R337-D340 PolarHBondContact O-N 3.44Å; D340-T343 PolarHBondContact O-N 3.26Å; D340-C344 PolarHBondContact O-N 3.27Å; D340-C344 PolarHBondContact O-SG 2.78Å
341	F	89.1	Confident	81.3	Confident	44 Å²	44	50.7 Å²	50.7	19%	0.193	25%	0.245	C	C	.	.	H	α-helix	trans	-63.9	-44.9	173.8	178.1	-95.4	0	0	0	111.8	T304 F305 F308 R337 L338 L339 T343 C344 L345	T304-F341 HydrophobicContact CG2-CD2 4.07Å; T304-F341 HydrophobicContact CG2-CE2 3.73Å; T304-F341 HydrophobicContact CG2-CZ 4.03Å; F305-F341 AromaticContact CD1-CE2 3.78Å; F305-F341 HydrophobicContact CD1-CE2 3.78Å; F305-F341 AromaticContact CE1-CE2 3.62Å; F305-F341 HydrophobicContact CE1-CE2 3.62Å; F305-F341 HydrophobicContact CE1-CZ 4.12Å; F305-F341 HydrophobicContact CE2-CE2 4.36Å; F305-F341 HydrophobicContact CE2-CZ 4.36Å; F305-F341 HydrophobicContact CG-CE2 4.22Å; F305-F341 AromaticContact CZ-CE2 3.93Å; F305-F341 HydrophobicContact CZ-CE2 3.93Å; F305-F341 AromaticContact CZ-CZ 3.97Å; F305-F341 HydrophobicContact CZ-CZ 3.97Å; F308-F341 HydrophobicContact CB-CD2 4.12Å; F308-F341 HydrophobicContact CD1-CD2 4.12Å; F308-F341 HydrophobicContact CD2-CB 3.84Å; F308-F341 HydrophobicContact CD2-CD2 4.48Å; F308-F341 HydrophobicContact CE2-CB 4.03Å; F308-F341 HydrophobicContact CG-CB 4.19Å; F308-F341 AromaticContact CG-CD2 3.97Å; F308-F341 HydrophobicContact CG-CD2 3.97Å; F308-F341 HydrophobicContact CZ-CB 4.5Å; R337-F341 PolarHBondContact O-N 3.42Å; R337-F341 VanDerWaalsContact O-N 3.16Å; L338-F341 PolarHBondContact O-N 3.34Å; L339-F341 VanDerWaalsContact C-N 3.3Å; L339-F341 PolarHBondContact O-N 3.18Å; F341-T343 VanDerWaalsContact C-N 3.35Å; F341-C344 PolarHBondContact O-N 3.43Å; F341-L345 PolarHBondContact O-N 2.92Å
342	I	89.6	Confident	82.7	Confident	21 Å²	21	47.8 Å²	47.8	11%	0.108	23%	0.227	C	C	.	.	H	α-helix	trans	-65.9	-38.8	177.7	-61.7	167.2	0	0	0	110.6	L82 V88 L338 L339 C344 L345 I346	L82-I342 HydrophobicContact CB-CG2 4.23Å; L82-I342 HydrophobicContact CD1-CG2 4.38Å; L82-I342 HydrophobicContact CD2-CG2 4.23Å; V88-I342 HydrophobicContact CG1-CB 3.72Å; V88-I342 HydrophobicContact CG1-CG2 3.49Å; V88-I342 VanDerWaalsContact CG1-CG2 3.49Å; L338-I342 HydrophobicContact CG-CD1 4.19Å; L338-I342 WeakPolarHBondContact O-CG1 3.37Å; L338-I342 PolarHBondContact O-N 3.04Å; L338-I342 VanDerWaalsContact O-N 3.09Å; L339-I342 PolarHBondContact O-N 3.2Å; L339-I342 VanDerWaalsContact O-N 3.1Å; I342-C344 VanDerWaalsContact C-N 3.34Å; I342-C344 PolarHBondContact O-N 3Å; I342-L345 WeakPolarHBondContact O-CB 3.45Å; I342-L345 PolarHBondContact O-N 2.87Å; I342-I346 HydrophobicContact CG2-CD1 3.86Å; I342-I346 HydrophobicContact CG2-CG1 4.28Å; I342-I346 WeakPolarHBondContact O-CG1 3.44Å; I342-I346 PolarHBondContact O-N 2.97Å
343	T	89	Confident	83.8	Confident	19 Å²	19	37.7 Å²	37.7	12%	0.117	19%	0.189	C	C	.	.	H	α-helix	trans	-58.2	-45.9	174	-62.6	0	0	0	0	111	V88 P90 L339 D340 F341 L345 I346 L347	V88-T343 WeakPolarHBondContact CG1-OG1 3.35Å; V88-T343 WeakPolarHBondContact O-CB 3.32Å; V88-T343 PolarHBondContact O-OG1 3.06Å; P90-T343 HydrophobicContact CG-CG2 4.19Å; L339-T343 PolarHBondContact O-N 2.86Å; L339-T343 PolarHBondContact O-OG1 3.17Å; L339-T343 VanDerWaalsContact O-OG1 3.06Å; D340-T343 PolarHBondContact O-N 3.26Å; F341-T343 VanDerWaalsContact C-N 3.35Å; T343-L345 VanDerWaalsContact C-N 3.34Å; T343-L345 PolarHBondContact O-N 2.97Å; T343-I346 PolarHBondContact O-N 3.09Å; T343-L347 WeakPolarHBondContact O-CB 3.48Å; T343-L347 PolarHBondContact O-N 2.92Å
344	C	88.3	Confident	84.3	Confident	3 Å²	3	34.8 Å²	34.8	2%	0.02	17%	0.168	C	C	.	.	H	α-helix	trans	-61.8	-40.6	175.2	-67	0	0	0	0	112.2	T304 T307 D340 F341 I342 L347 Y348	T304-C344 HydrophobicContact CG2-CB 3.83Å; T307-C344 PolarHBondContact OG1-SG 3.24Å; D340-C344 PolarHBondContact O-N 3.27Å; D340-C344 PolarHBondContact O-SG 2.78Å; F341-C344 PolarHBondContact O-N 3.43Å; I342-C344 VanDerWaalsContact C-N 3.34Å; I342-C344 PolarHBondContact O-N 3Å; C344-L347 WeakPolarHBondContact O-CB 3.47Å; C344-L347 PolarHBondContact O-N 2.98Å; C344-Y348 WeakPolarHBondContact O-CD2 3.49Å; C344-Y348 PolarHBondContact O-N 3.11Å
345	L	89.8	Confident	84.6	Confident	22 Å²	22	29.9 Å²	29.9	12%	0.115	14%	0.142	C	C	.	.	H	α-helix	trans	-63.6	-43.9	177.6	-172.1	81.2	0	0	0	111.6	I79 L82 L301 T304 F341 I342 T343 L347 N349	I79-L345 HydrophobicContact CD1-CD2 3.94Å; I79-L345 HydrophobicContact CD1-CG 4.22Å; L82-L345 HydrophobicContact CD1-CD2 3.89Å; L301-L345 HydrophobicContact CD2-CD1 4.1Å; T304-L345 HydrophobicContact CG2-CB 3.94Å; T304-L345 HydrophobicContact CG2-CD1 4.19Å; F341-L345 PolarHBondContact O-N 2.92Å; I342-L345 WeakPolarHBondContact O-CB 3.45Å; I342-L345 PolarHBondContact O-N 2.87Å; T343-L345 VanDerWaalsContact C-N 3.34Å; T343-L345 PolarHBondContact O-N 2.97Å; L345-L347 VanDerWaalsContact C-N 3.33Å; L345-N349 PolarHBondContact O-N 2.81Å; L345-N349 VanDerWaalsContact O-N 3.12Å
346	I	88.5	Confident	84.8	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-65.9	-38.1	177.9	-66.4	169.2	0	0	0	110.5	I79 L82 Q83 V88 P90 I342 T343 Y348 N349	I79-I346 HydrophobicContact CG2-CG1 4.43Å; L82-I346 HydrophobicContact CB-CD1 4.32Å; Q83-I346 HydrophobicContact CG-CD1 4.06Å; Q83-I346 HydrophobicContact CG-CG1 4.36Å; Q83-I346 HydrophobicContact CG-CG2 3.89Å; V88-I346 HydrophobicContact CG1-CD1 4.09Å; P90-I346 HydrophobicContact CG-CG2 4.49Å; I342-I346 HydrophobicContact CG2-CD1 3.86Å; I342-I346 HydrophobicContact CG2-CG1 4.28Å; I342-I346 WeakPolarHBondContact O-CG1 3.44Å; I342-I346 PolarHBondContact O-N 2.97Å; T343-I346 PolarHBondContact O-N 3.09Å; I346-Y348 VanDerWaalsContact C-N 3.32Å; I346-Y348 PolarHBondContact O-N 3.04Å; I346-N349 PolarHBondContact O-N 3.37Å; I346-N349 PolarHBondContact O-OD1 3.36Å
347	L	87.9	Confident	84.8	Confident	4 Å²	4	22.6 Å²	22.6	2%	0.021	11%	0.111	C	C	.	.	H	α-helix	trans	-58.9	-42.1	179.7	-170.3	71.4	0	0	0	112.3	P90 T343 C344 L345 I936	P90-L347 HydrophobicContact CG-CD1 4.16Å; T343-L347 WeakPolarHBondContact O-CB 3.48Å; T343-L347 PolarHBondContact O-N 2.92Å; C344-L347 WeakPolarHBondContact O-CB 3.47Å; C344-L347 PolarHBondContact O-N 2.98Å; L345-L347 VanDerWaalsContact C-N 3.33Å; L347-I936 HydrophobicContact CD1-CG2 3.52Å
348	Y	88	Confident	84.4	Confident	1 Å²	1	17.4 Å²	17.4	0%	0.004	9%	0.093	C	C	.	.	H	α-helix	trans	-96.6	-4.1	-175.3	-62.6	-54.5	0	0	0	114.5	L300 L303 T307 C344 I346 T350 I351 F924	L300-Y348 HydrophobicContact CD1-CG 4.5Å; L300-Y348 VanDerWaalsContact CD1-O 3.23Å; L300-Y348 WeakPolarHBondContact CD1-O 3.22Å; L303-Y348 HydrophobicContact CB-CD2 4.21Å; L303-Y348 HydrophobicContact CB-CE2 4.43Å; T307-Y348 HydrophobicContact CG2-CE2 3.75Å; T307-Y348 WeakPolarHBondContact CG2-OH 3.42Å; C344-Y348 WeakPolarHBondContact O-CD2 3.49Å; C344-Y348 PolarHBondContact O-N 3.11Å; I346-Y348 VanDerWaalsContact C-N 3.32Å; I346-Y348 PolarHBondContact O-N 3.04Å; Y348-T350 PolarHBondContact O-N 3.18Å; Y348-I351 HydrophobicContact CD1-CD1 4.33Å; Y348-I351 HydrophobicContact CG-CD1 4.48Å; Y348-I351 WeakPolarHBondContact O-CB 3.2Å; Y348-I351 VanDerWaalsContact O-CG1 3.28Å; Y348-I351 WeakPolarHBondContact O-CG1 3.46Å; Y348-I351 PolarHBondContact O-N 3.46Å; Y348-F924 HydrophobicContact CE1-CB 3.86Å
349	N	87	Confident	84.1	Confident	4 Å²	4	14 Å²	14	2%	0.021	8%	0.075	C	C	.	.	G	3₁₀ helix	trans	-50.5	-32.2	-172.3	72.4	-27	0	0	0	114.8	F75 I79 L345 I346 I351 I352	F75-N349 HydrophobicContact CE1-CB 4.48Å; F75-N349 WeakPolarHBondContact CE1-O 3.27Å; F75-N349 HydrophobicContact CZ-CB 4.12Å; I79-N349 HydrophobicContact CD1-CB 4.13Å; I79-N349 HydrophobicContact CG1-CB 4.06Å; I79-N349 HydrophobicContact CG2-CB 4.06Å; I79-N349 WeakPolarHBondContact CG2-ND2 3.19Å; L345-N349 PolarHBondContact O-N 2.81Å; L345-N349 VanDerWaalsContact O-N 3.12Å; I346-N349 PolarHBondContact O-N 3.37Å; I346-N349 PolarHBondContact O-OD1 3.36Å; N349-I351 VanDerWaalsContact C-N 3.33Å; N349-I352 PolarHBondContact O-N 3.28Å
350	T	80.7	Confident	83.9	Confident	9 Å²	9	12.4 Å²	12.4	6%	0.055	7%	0.067	C	C	.	.	G	3₁₀ helix	trans	-90	0.6	-169.9	33.5	0	0	0	0	112.6	Y348 I352 I354 N916 Y920	Y348-T350 PolarHBondContact O-N 3.18Å; T350-I352 CarbonylContact C-O 3.48Å; T350-I352 CarbonylContact O-C 3.51Å; T350-I352 PolarHBondContact O-N 3.02Å; T350-I354 HydrophobicContact CG2-CD1 3.82Å; T350-I354 HydrophobicContact CG2-CG1 4.26Å; T350-N916 PolarHBondContact O-OD1 3.4Å; T350-Y920 VanDerWaalsContact C-CD2 3.46Å; T350-Y920 VanDerWaalsContact CB-CE1 3.48Å; T350-Y920 VanDerWaalsContact CB-CE2 3.43Å; T350-Y920 WeakPolarHBondContact CB-OH 3.44Å; T350-Y920 HydrophobicContact CG2-CE1 4.31Å; T350-Y920 HydrophobicContact CG2-CE2 4.48Å; T350-Y920 WeakPolarHBondContact O-CD2 3.24Å; T350-Y920 VanDerWaalsContact O-CE2 3.24Å; T350-Y920 WeakPolarHBondContact O-CE2 3.43Å; T350-Y920 WeakPolarHBondContact OG1-CD1 3.49Å; T350-Y920 WeakPolarHBondContact OG1-CE1 3.45Å
351	I	86.5	Confident	83.5	Confident	6 Å²	6	10.8 Å²	10.8	3%	0.031	6%	0.058	C	C	.	.	G	3₁₀ helix	trans	-51.9	-36.8	159.1	-71.3	175.4	0	0	0	109.9	L296 L303 Y348 N349 V917	L296-I351 HydrophobicContact CD2-CG2 4.04Å; L303-I351 HydrophobicContact CD1-CD1 3.65Å; Y348-I351 HydrophobicContact CD1-CD1 4.33Å; Y348-I351 HydrophobicContact CG-CD1 4.48Å; Y348-I351 WeakPolarHBondContact O-CB 3.2Å; Y348-I351 VanDerWaalsContact O-CG1 3.28Å; Y348-I351 WeakPolarHBondContact O-CG1 3.46Å; Y348-I351 PolarHBondContact O-N 3.46Å; N349-I351 VanDerWaalsContact C-N 3.33Å; I351-V917 HydrophobicContact CG2-CG2 4.27Å
352	I	84	Confident	82.7	Confident	3 Å²	3	10.5 Å²	10.5	2%	0.015	6%	0.06	C	C	.	.	S	Bend	trans	-80.8	121.4	169.2	-56.1	178	0	0	0	107.7	F75 F76 I293 L296 F297 L300 N349 T350 I354	F75-I352 HydrophobicContact CD1-CD1 4.12Å; F75-I352 HydrophobicContact CE1-CB 4.23Å; F75-I352 HydrophobicContact CE1-CD1 3.85Å; F75-I352 HydrophobicContact CE1-CG1 4.44Å; F75-I352 HydrophobicContact CZ-CD1 4.12Å; F76-I352 HydrophobicContact CE2-CG2 4.32Å; F76-I352 HydrophobicContact CZ-CB 4.01Å; F76-I352 HydrophobicContact CZ-CG2 3.83Å; F76-I352 VanDerWaalsContact CZ-O 3.3Å; F76-I352 WeakPolarHBondContact CZ-O 3.22Å; I293-I352 HydrophobicContact CG2-CD1 4.43Å; I293-I352 HydrophobicContact CG2-CG2 4.05Å; L296-I352 HydrophobicContact CB-CG1 4.44Å; F297-I352 HydrophobicContact CB-CD1 3.98Å; F297-I352 HydrophobicContact CD2-CD1 4.1Å; L300-I352 HydrophobicContact CD2-CD1 4.38Å; N349-I352 PolarHBondContact O-N 3.28Å; T350-I352 CarbonylContact C-O 3.48Å; T350-I352 CarbonylContact O-C 3.51Å; T350-I352 PolarHBondContact O-N 3.02Å; I352-I354 PolarHBondContact O-N 2.91Å; I352-I354 VanDerWaalsContact O-N 3.14Å
353	P	81.5	Confident	82.3	Confident	2 Å²	2	9.6 Å²	9.6	1%	0.013	6%	0.055	C	C	.	.			trans	-69.1	111.5	-177	25.8	-34	0	0	0	111.8	S355 L356 F913	P353-S355 VanDerWaalsContact C-N 3.28Å; P353-S355 PolarHBondContact O-N 3.31Å; P353-L356 HydrophobicContact CB-CB 3.83Å; P353-L356 HydrophobicContact CG-CB 3.58Å; P353-L356 HydrophobicContact CG-CD2 3.79Å; P353-L356 HydrophobicContact CG-CG 4.28Å; P353-L356 PolarHBondContact O-N 3.46Å; P353-F913 HydrophobicContact CG-CD1 3.9Å; P353-F913 HydrophobicContact CG-CE1 3.76Å
354	I	77.9	Confident	81.9	Confident	10 Å²	10	9 Å²	9	5%	0.051	5%	0.051	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-42.5	177.9	-47.9	178.1	0	0	0	111.2	F76 T96 I103 T350 I352 L356	F76-I354 HydrophobicContact CD1-CD1 4.26Å; F76-I354 HydrophobicContact CD1-CG1 3.79Å; F76-I354 HydrophobicContact CD1-CG2 4.4Å; F76-I354 HydrophobicContact CD2-CB 4.35Å; F76-I354 HydrophobicContact CD2-CG1 4.4Å; F76-I354 HydrophobicContact CD2-CG2 3.89Å; F76-I354 HydrophobicContact CE1-CB 4.31Å; F76-I354 HydrophobicContact CE1-CD1 4.24Å; F76-I354 HydrophobicContact CE1-CG1 3.43Å; F76-I354 VanDerWaalsContact CE1-CG1 3.43Å; F76-I354 VanDerWaalsContact CE2-CA 3.46Å; F76-I354 HydrophobicContact CE2-CB 4.08Å; F76-I354 HydrophobicContact CE2-CG1 4.1Å; F76-I354 HydrophobicContact CE2-CG2 4.11Å; F76-I354 HydrophobicContact CG-CG1 4.29Å; F76-I354 HydrophobicContact CG-CG2 4.07Å; F76-I354 HydrophobicContact CZ-CB 4.05Å; F76-I354 HydrophobicContact CZ-CG1 3.6Å; F76-I354 HydrophobicContact CZ-CG2 4.46Å; T96-I354 HydrophobicContact CG2-CD1 4.34Å; I103-I354 HydrophobicContact CD1-CB 4.21Å; I103-I354 HydrophobicContact CD1-CG2 3.49Å; I103-I354 VanDerWaalsContact CD1-CG2 3.49Å; T350-I354 HydrophobicContact CG2-CD1 3.82Å; T350-I354 HydrophobicContact CG2-CG1 4.26Å; I352-I354 PolarHBondContact O-N 2.91Å; I352-I354 VanDerWaalsContact O-N 3.14Å; I354-L356 PolarHBondContact O-N 3.05Å
355	S	80.3	Confident	81.3	Confident	8 Å²	8	10.3 Å²	10.3	6%	0.056	6%	0.056	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-9.9	-174.6	56.2	0	0	0	0	114.9	P353 V358 M359 N947	P353-S355 VanDerWaalsContact C-N 3.28Å; P353-S355 PolarHBondContact O-N 3.31Å; S355-V358 PolarHBondContact O-N 3.49Å; S355-M359 WeakPolarHBondContact O-CB 3.23Å; S355-M359 WeakPolarHBondContact O-CG 3.47Å; S355-M359 PolarHBondContact O-N 3.45Å; S355-M359 WeakPolarHBondContact OG-CE 3.45Å; S355-N947 PolarHBondContact OG-O 3.16Å
356	L	80.6	Confident	80.7	Confident	2 Å²	2	10.6 Å²	10.6	1%	0.01	6%	0.058	C	C	.	.	H	α-helix	trans	-58.8	-49.8	-173.1	177.9	68.4	0	0	0	113	T289 P353 I354 V358 M359 L360 L908 I909 F913	T289-L356 HydrophobicContact CG2-CD2 3.94Å; P353-L356 HydrophobicContact CB-CB 3.83Å; P353-L356 HydrophobicContact CG-CB 3.58Å; P353-L356 HydrophobicContact CG-CD2 3.79Å; P353-L356 HydrophobicContact CG-CG 4.28Å; P353-L356 PolarHBondContact O-N 3.46Å; I354-L356 PolarHBondContact O-N 3.05Å; L356-V358 VanDerWaalsContact C-N 3.29Å; L356-V358 PolarHBondContact O-N 3.41Å; L356-M359 PolarHBondContact O-N 3.22Å; L356-L360 HydrophobicContact CD1-CD1 4.07Å; L356-L360 HydrophobicContact CD1-CD2 4.28Å; L356-L360 HydrophobicContact CD1-CG 4Å; L356-L360 HydrophobicContact CG-CD1 4Å; L356-L360 HydrophobicContact CG-CG 4.34Å; L356-L360 VanDerWaalsContact O-CG 3.27Å; L356-L360 WeakPolarHBondContact O-CG 3.25Å; L356-L360 PolarHBondContact O-N 3.06Å; L356-L908 HydrophobicContact CD1-CD2 3.91Å; L356-I909 HydrophobicContact CD1-CG1 4.31Å; L356-F913 HydrophobicContact CD2-CE1 4.15Å; L356-F913 HydrophobicContact CD2-CE2 4.01Å; L356-F913 HydrophobicContact CD2-CZ 3.65Å
357	P	77.7	Confident	80.3	Confident	19 Å²	19	10.6 Å²	10.6	12%	0.123	6%	0.058	C	C	.	.	H	α-helix	trans	-57.2	-42.4	-179.3	-25	35.5	0	0	0	112.9	A72 L360 E361	A72-P357 HydrophobicContact CB-CG 3.93Å; P357-L360 PolarHBondContact O-N 3.13Å; P357-E361 WeakPolarHBondContact O-CG 3.19Å; P357-E361 PolarHBondContact O-N 2.9Å; P357-E361 VanDerWaalsContact O-N 3.09Å
358	V	72.9	Confident	79.7	Confident	13 Å²	13	10.7 Å²	10.7	8%	0.079	6%	0.058	C	C	.	.	H	α-helix	trans	-74	-39.4	-179.4	171.5	0	0	0	0	112.2	I103 V106 S107 S355 L356 L360 E361 V362	I103-V358 HydrophobicContact CB-CG2 3.97Å; I103-V358 HydrophobicContact CG1-CG2 4.38Å; I103-V358 HydrophobicContact CG2-CB 4.11Å; I103-V358 HydrophobicContact CG2-CG2 3.17Å; V106-V358 HydrophobicContact CB-CG1 4.03Å; V106-V358 HydrophobicContact CG1-CG1 3.73Å; S107-V358 WeakPolarHBondContact OG-CG2 3.37Å; S355-V358 PolarHBondContact O-N 3.49Å; L356-V358 VanDerWaalsContact C-N 3.29Å; L356-V358 PolarHBondContact O-N 3.41Å; V358-L360 VanDerWaalsContact C-N 3.27Å; V358-L360 PolarHBondContact O-N 3.14Å; V358-E361 PolarHBondContact O-N 3.33Å; V358-V362 HydrophobicContact CG1-CG2 4.09Å; V358-V362 WeakPolarHBondContact O-CB 3.49Å; V358-V362 VanDerWaalsContact O-CG2 3.31Å; V358-V362 WeakPolarHBondContact O-CG2 3.48Å; V358-V362 PolarHBondContact O-N 3.18Å
359	M	78	Confident	79	Confident	21 Å²	21	11.9 Å²	11.9	10%	0.103	7%	0.065	C	C	.	.	H	α-helix	trans	-59.6	-41.2	173.9	-73.9	-167.7	-60.7	0	0	111.2	S355 L356 V363 S912 P955	S355-M359 WeakPolarHBondContact O-CB 3.23Å; S355-M359 WeakPolarHBondContact O-CG 3.47Å; S355-M359 PolarHBondContact O-N 3.45Å; S355-M359 WeakPolarHBondContact OG-CE 3.45Å; L356-M359 PolarHBondContact O-N 3.22Å; M359-V363 VanDerWaalsContact O-CB 3.27Å; M359-V363 WeakPolarHBondContact O-CB 3.29Å; M359-V363 VanDerWaalsContact O-CG2 3.23Å; M359-V363 WeakPolarHBondContact O-CG2 3.32Å; M359-V363 PolarHBondContact O-N 3.14Å; M359-S912 WeakPolarHBondContact CE-OG 3.43Å; M359-P955 HydrophobicContact CE-CG 4.31Å; M359-P955 HydrophobicContact SD-CB 4.22Å; M359-P955 HydrophobicContact SD-CG 3.75Å
360	L	80.6	Confident	78.4	Confident	12 Å²	12	12.7 Å²	12.7	6%	0.063	7%	0.068	C	C	.	.	H	α-helix	trans	-62.9	-45.8	175.7	-65.2	173.6	0	0	0	111.5	L356 P357 V358 R364 L905 L908 I909	L356-L360 HydrophobicContact CD1-CD1 4.07Å; L356-L360 HydrophobicContact CD1-CD2 4.28Å; L356-L360 HydrophobicContact CD1-CG 4Å; L356-L360 HydrophobicContact CG-CD1 4Å; L356-L360 HydrophobicContact CG-CG 4.34Å; L356-L360 VanDerWaalsContact O-CG 3.27Å; L356-L360 WeakPolarHBondContact O-CG 3.25Å; L356-L360 PolarHBondContact O-N 3.06Å; P357-L360 PolarHBondContact O-N 3.13Å; V358-L360 VanDerWaalsContact C-N 3.27Å; V358-L360 PolarHBondContact O-N 3.14Å; L360-R364 WeakPolarHBondContact O-CB 3.48Å; L360-R364 WeakPolarHBondContact O-CD 3.41Å; L360-R364 WeakPolarHBondContact O-CG 3.46Å; L360-R364 PolarHBondContact O-N 2.97Å; L360-L905 HydrophobicContact CD2-CD1 3.29Å; L360-L905 HydrophobicContact CD2-CD2 4.48Å; L360-L905 HydrophobicContact CD2-CG 3.82Å; L360-L908 HydrophobicContact CD2-CD2 3.72Å; L360-L908 HydrophobicContact CG-CD2 4.48Å; L360-I909 HydrophobicContact CD1-CG1 4.41Å; L360-I909 HydrophobicContact CD2-CD1 4Å; L360-I909 HydrophobicContact CD2-CG1 3.62Å
361	E	75.2	Confident	78.1	Confident	4 Å²	4	12.4 Å²	12.4	2%	0.019	7%	0.066	C	C	.	.	H	α-helix	trans	-60.9	-47.9	177	-74.5	-174.6	154.8	0	0	113.2	R70 S107 P357 V358 R364 F365	R70-E361 IonicContact CZ-OE1 3.66Å; R70-E361 VanDerWaalsContact NH1-CD 3.3Å; R70-E361 IonicContact NH1-OE1 2.62Å; R70-E361 PolarHBondContact NH1-OE1 3.26Å; R70-E361 IonicContact NH1-OE2 2.66Å; R70-E361 IonicContact NH2-OE1 3.04Å; R70-E361 PolarHBondContact NH2-OE1 2.98Å; S107-E361 WeakPolarHBondContact CB-OE2 3.49Å; S107-E361 PolarHBondContact OG-OE2 3.12Å; P357-E361 WeakPolarHBondContact O-CG 3.19Å; P357-E361 PolarHBondContact O-N 2.9Å; P357-E361 VanDerWaalsContact O-N 3.09Å; V358-E361 PolarHBondContact O-N 3.33Å; E361-R364 PolarHBondContact O-N 2.83Å; E361-F365 VanDerWaalsContact O-CB 3.29Å; E361-F365 WeakPolarHBondContact O-CB 3.49Å; E361-F365 PolarHBondContact O-N 3.19Å
362	V	73.1	Confident	77.2	Confident	38 Å²	38	12.6 Å²	12.6	23%	0.23	7%	0.067	C	C	.	.	H	α-helix	trans	-64.4	-44.2	-179.2	172.3	0	0	0	0	110.3	V106 V358 F365 I366	V106-V362 HydrophobicContact CG1-CG2 3.61Å; V358-V362 HydrophobicContact CG1-CG2 4.09Å; V358-V362 WeakPolarHBondContact O-CB 3.49Å; V358-V362 VanDerWaalsContact O-CG2 3.31Å; V358-V362 WeakPolarHBondContact O-CG2 3.48Å; V358-V362 PolarHBondContact O-N 3.18Å; V362-F365 PolarHBondContact O-N 3Å; V362-I366 HydrophobicContact CG1-CD1 3.86Å; V362-I366 WeakPolarHBondContact O-CG1 3.5Å; V362-I366 PolarHBondContact O-N 3.4Å
363	V	80.2	Confident	75.8	Confident	1 Å²	1	16.6 Å²	16.6	1%	0.006	8%	0.082	C	C	.	.	H	α-helix	trans	-65	-45.4	177.8	167.8	0	0	0	0	111.2	M359 F365 I366 Q367 L905 L908 M956 G959 L960	M359-V363 VanDerWaalsContact O-CB 3.27Å; M359-V363 WeakPolarHBondContact O-CB 3.29Å; M359-V363 VanDerWaalsContact O-CG2 3.23Å; M359-V363 WeakPolarHBondContact O-CG2 3.32Å; M359-V363 PolarHBondContact O-N 3.14Å; V363-F365 VanDerWaalsContact C-N 3.32Å; V363-F365 PolarHBondContact O-N 3.48Å; V363-I366 PolarHBondContact O-N 3.47Å; V363-Q367 HydrophobicContact CG1-CG 4.26Å; V363-Q367 WeakPolarHBondContact O-CB 3.39Å; V363-Q367 WeakPolarHBondContact O-CG 3.49Å; V363-Q367 PolarHBondContact O-N 3.46Å; V363-L905 HydrophobicContact CG1-CD1 4.5Å; V363-L908 HydrophobicContact CB-CD1 4.25Å; V363-L908 HydrophobicContact CG1-CD1 4.32Å; V363-L908 HydrophobicContact CG2-CD1 3.7Å; V363-M956 HydrophobicContact CG2-CG 4.37Å; V363-G959 WeakPolarHBondContact CG1-O 3.41Å; V363-L960 HydrophobicContact CB-CD2 4.39Å; V363-L960 HydrophobicContact CG1-CD2 4.07Å; V363-L960 HydrophobicContact CG2-CD2 4.29Å; V363-L960 HydrophobicContact CG2-CG 4.3Å
364	R	81.1	Confident	74.4	Confident	7 Å²	7	17.5 Å²	17.5	3%	0.026	9%	0.087	C	C	.	.	H	α-helix	trans	-59.3	-42.6	174.9	-79.3	165	169.9	174.7	8	111.7	S283 E286 L360 E361 Q367 A368 S436 N439 E440	S283-R364 PolarHBondContact OG-NH2 3.49Å; E286-R364 IonicContact OE2-CZ 2.71Å; E286-R364 IonicContact OE2-NH1 2.72Å; E286-R364 PolarHBondContact OE2-NH1 2.73Å; E286-R364 IonicContact OE2-NH2 2.67Å; E286-R364 PolarHBondContact OE2-NH2 2.91Å; L360-R364 WeakPolarHBondContact O-CB 3.48Å; L360-R364 WeakPolarHBondContact O-CD 3.41Å; L360-R364 WeakPolarHBondContact O-CG 3.46Å; L360-R364 PolarHBondContact O-N 2.97Å; E361-R364 PolarHBondContact O-N 2.83Å; R364-Q367 PolarHBondContact O-N 3Å; R364-A368 WeakPolarHBondContact O-CB 3.47Å; R364-A368 PolarHBondContact O-N 3.35Å; R364-S436 WeakPolarHBondContact CB-O 3.31Å; R364-N439 PolarHBondContact O-ND2 3.45Å; R364-E440 IonicContact CZ-OE1 3.6Å; R364-E440 VanDerWaalsContact CZ-OE1 3.3Å; R364-E440 IonicContact NE-OE1 2.99Å; R364-E440 PolarHBondContact NE-OE1 3.45Å; R364-E440 IonicContact NE-OE2 2.9Å; R364-E440 PolarHBondContact NE-OE2 2.85Å; R364-E440 IonicContact NH2-OE1 3.67Å; R364-E440 PolarHBondContact NH2-OE1 3.21Å
365	F	76.6	Confident	73.1	Confident	31 Å²	31	21.3 Å²	21.3	14%	0.136	11%	0.108	C	C	.	.	H	α-helix	trans	-62.6	-48	177.1	178.7	-100.6	0	0	0	111.8	K110 I113 E114 E361 V362 V363 A368 L369	K110-F365 HydrophobicContact CG-CD2 4.24Å; K110-F365 HydrophobicContact CG-CG 4.35Å; I113-F365 HydrophobicContact CG2-CZ 4.1Å; E114-F365 HydrophobicContact CG-CE2 4.25Å; E361-F365 VanDerWaalsContact O-CB 3.29Å; E361-F365 WeakPolarHBondContact O-CB 3.49Å; E361-F365 PolarHBondContact O-N 3.19Å; V362-F365 PolarHBondContact O-N 3Å; V363-F365 VanDerWaalsContact C-N 3.32Å; V363-F365 PolarHBondContact O-N 3.48Å; F365-A368 WeakPolarHBondContact O-CB 3.5Å; F365-A368 PolarHBondContact O-N 3.46Å; F365-L369 HydrophobicContact CD1-CD1 4.32Å; F365-L369 HydrophobicContact CE1-CD1 3.88Å; F365-L369 HydrophobicContact CE1-CG 4.4Å; F365-L369 HydrophobicContact CZ-CD1 4.45Å; F365-L369 HydrophobicContact CZ-CD2 4.47Å; F365-L369 WeakPolarHBondContact O-CG 3.22Å; F365-L369 PolarHBondContact O-N 2.97Å; F365-L369 VanDerWaalsContact O-N 3.11Å
366	I	75.7	Confident	71.8	Confident	28 Å²	28	27.7 Å²	27.7	14%	0.144	14%	0.137	C	C	.	.	H	α-helix	trans	-66	-39.3	177.6	-63.2	166.4	0	0	0	111	V362 V363 A368 L369 Y370 L414 L960	V362-I366 HydrophobicContact CG1-CD1 3.86Å; V362-I366 WeakPolarHBondContact O-CG1 3.5Å; V362-I366 PolarHBondContact O-N 3.4Å; V363-I366 PolarHBondContact O-N 3.47Å; I366-A368 VanDerWaalsContact C-N 3.29Å; I366-A368 PolarHBondContact O-N 3.39Å; I366-L369 WeakPolarHBondContact O-CA 3.46Å; I366-L369 WeakPolarHBondContact O-CB 3.35Å; I366-L369 PolarHBondContact O-N 2.92Å; I366-Y370 HydrophobicContact CG2-CE2 4.35Å; I366-Y370 PolarHBondContact O-N 3.12Å; I366-L414 HydrophobicContact CG2-CD1 4.46Å; I366-L414 HydrophobicContact CG2-CD2 3.98Å; I366-L960 HydrophobicContact CB-CD2 3.68Å; I366-L960 HydrophobicContact CD1-CD1 3.85Å; I366-L960 HydrophobicContact CD1-CD2 4.25Å; I366-L960 HydrophobicContact CG2-CD1 4.32Å; I366-L960 HydrophobicContact CG2-CD2 3.56Å
367	Q	80.9	Confident	70.3	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61.1	-37.5	173.8	-75.2	174	-5	0	0	112.1	V363 R364 L369 Y370 N439 G959 L960	V363-Q367 HydrophobicContact CG1-CG 4.26Å; V363-Q367 WeakPolarHBondContact O-CB 3.39Å; V363-Q367 WeakPolarHBondContact O-CG 3.49Å; V363-Q367 PolarHBondContact O-N 3.46Å; R364-Q367 PolarHBondContact O-N 3Å; Q367-L369 VanDerWaalsContact C-N 3.28Å; Q367-L369 PolarHBondContact O-N 3.14Å; Q367-Y370 WeakPolarHBondContact O-CB 3.41Å; Q367-Y370 PolarHBondContact O-N 3.37Å; Q367-Y370 VanDerWaalsContact O-N 3.15Å; Q367-N439 WeakPolarHBondContact CB-ND2 3.44Å; Q367-G959 PolarHBondContact NE2-O 2.86Å; Q367-L960 HydrophobicContact CG-CD2 4.46Å
368	A	76.2	Confident	69	Low	5 Å²	5	31.5 Å²	31.5	4%	0.041	16%	0.16	C	C	.	.	H	α-helix	trans	-65.4	-32.6	173.5	0	0	0	0	0	111.7	R364 F365 I366 Y370 I371 N372 A433 N439	R364-A368 WeakPolarHBondContact O-CB 3.47Å; R364-A368 PolarHBondContact O-N 3.35Å; F365-A368 WeakPolarHBondContact O-CB 3.5Å; F365-A368 PolarHBondContact O-N 3.46Å; I366-A368 VanDerWaalsContact C-N 3.29Å; I366-A368 PolarHBondContact O-N 3.39Å; A368-Y370 VanDerWaalsContact C-N 3.3Å; A368-Y370 PolarHBondContact O-N 2.86Å; A368-I371 PolarHBondContact O-N 3.3Å; A368-N372 PolarHBondContact O-N 3.23Å; A368-N372 PolarHBondContact O-OD1 3.25Å; A368-A433 HydrophobicContact CB-CB 3.87Å; A368-N439 PolarHBondContact N-ND2 3.2Å
369	L	72.3	Confident	67.9	Low	26 Å²	26	31.8 Å²	31.8	14%	0.136	16%	0.161	C	C	.	.	H	α-helix	trans	-66.7	-27.9	172.4	-60.8	176.9	0	0	0	113.1	F365 I366 Q367 I371 N372 V374	F365-L369 HydrophobicContact CD1-CD1 4.32Å; F365-L369 HydrophobicContact CE1-CD1 3.88Å; F365-L369 HydrophobicContact CE1-CG 4.4Å; F365-L369 HydrophobicContact CZ-CD1 4.45Å; F365-L369 HydrophobicContact CZ-CD2 4.47Å; F365-L369 WeakPolarHBondContact O-CG 3.22Å; F365-L369 PolarHBondContact O-N 2.97Å; F365-L369 VanDerWaalsContact O-N 3.11Å; I366-L369 WeakPolarHBondContact O-CA 3.46Å; I366-L369 WeakPolarHBondContact O-CB 3.35Å; I366-L369 PolarHBondContact O-N 2.92Å; Q367-L369 VanDerWaalsContact C-N 3.28Å; Q367-L369 PolarHBondContact O-N 3.14Å; L369-I371 VanDerWaalsContact C-N 3.28Å; L369-I371 PolarHBondContact O-N 2.86Å; L369-N372 PolarHBondContact O-N 2.73Å; L369-V374 HydrophobicContact CD2-CG2 4.29Å
370	Y	75.2	Confident	66.7	Low	22 Å²	22	38.1 Å²	38.1	9%	0.086	18%	0.184	C	C	.	.	H	α-helix	trans	-67.2	-30.8	172.9	-64.1	-37.6	0	0	0	113	I366 Q367 A368 L414 S417 D419 F961	I366-Y370 HydrophobicContact CG2-CE2 4.35Å; I366-Y370 PolarHBondContact O-N 3.12Å; Q367-Y370 WeakPolarHBondContact O-CB 3.41Å; Q367-Y370 PolarHBondContact O-N 3.37Å; Q367-Y370 VanDerWaalsContact O-N 3.15Å; A368-Y370 VanDerWaalsContact C-N 3.3Å; A368-Y370 PolarHBondContact O-N 2.86Å; Y370-L414 HydrophobicContact CD1-CD2 4.34Å; Y370-L414 HydrophobicContact CE1-CD2 3.23Å; Y370-L414 WeakPolarHBondContact OH-CD2 3.16Å; Y370-S417 WeakPolarHBondContact CD1-OG 3.28Å; Y370-S417 WeakPolarHBondContact CE1-OG 3.3Å; Y370-D419 PolarHBondContact O-N 3.47Å; Y370-F961 WeakPolarHBondContact OH-CE1 3.47Å
371	I	72.7	Confident	65.5	Low	3 Å²	3	44.2 Å²	44.2	2%	0.015	21%	0.207	C	C	.	.	H	α-helix	trans	-78.9	-40.1	176.6	-62.6	170.3	0	0	0	110.1	A368 L369 M422 A431 A433 Y882 L893 H897	A368-I371 PolarHBondContact O-N 3.3Å; L369-I371 VanDerWaalsContact C-N 3.28Å; L369-I371 PolarHBondContact O-N 2.86Å; I371-M422 HydrophobicContact CG2-CE 4.02Å; I371-A431 HydrophobicContact CG2-CB 4.27Å; I371-A433 HydrophobicContact CB-CB 4.29Å; I371-A433 HydrophobicContact CD1-CB 4.41Å; I371-A433 HydrophobicContact CG2-CB 4.2Å; I371-Y882 HydrophobicContact CD1-CE1 4.04Å; I371-L893 HydrophobicContact CD1-CD1 4.11Å; I371-L893 HydrophobicContact CG2-CD1 4.23Å; I371-H897 HydrophobicContact CD1-CB 4.47Å; I371-H897 HydrophobicContact CG1-CB 4.41Å
372	N	69.5	Low	64.3	Low	10 Å²	10	44.7 Å²	44.7	5%	0.053	21%	0.211	C	C	.	.	S	Bend	trans	-73.8	128.9	-176.4	-65.6	-1	0	0	0	111.3	A368 L369 V374 A431 M432 A433	A368-N372 PolarHBondContact O-N 3.23Å; A368-N372 PolarHBondContact O-OD1 3.25Å; L369-N372 PolarHBondContact O-N 2.73Å; N372-V374 HydrophobicContact CB-CG2 4.06Å; N372-V374 PolarHBondContact O-N 3.22Å; N372-A431 WeakPolarHBondContact CA-O 3.38Å; N372-M432 VanDerWaalsContact OD1-CA 3.27Å; N372-M432 WeakPolarHBondContact OD1-CA 3.4Å; N372-A433 PolarHBondContact ND2-O 3.09Å; N372-A433 WeakPolarHBondContact OD1-CA 3.43Å; N372-A433 WeakPolarHBondContact OD1-CB 3.18Å; N372-A433 PolarHBondContact OD1-N 2.91Å
373	W	54.5	Low	63.3	Low	87 Å²	87	44.6 Å²	44.6	33%	0.33	21%	0.209	S	C	.	.			trans	-74.1	117.6	156.2	-167.7	80.1	0	0	0	108.3	N375 P430 A431	W373-N375 WeakPolarHBondContact CH2-OD1 3.39Å; W373-N375 HydrophobicContact CZ3-CB 4.42Å; W373-N375 VanDerWaalsContact CZ3-CG 3.43Å; W373-N375 WeakPolarHBondContact CZ3-OD1 3.48Å; W373-P430 HydrophobicContact CB-CB 3.16Å; W373-P430 HydrophobicContact CB-CG 3.94Å; W373-P430 HydrophobicContact CD2-CB 4.3Å; W373-P430 HydrophobicContact CE3-CB 4.21Å; W373-P430 HydrophobicContact CE3-CG 4Å; W373-P430 HydrophobicContact CG-CB 3.94Å; W373-A431 PolarHBondContact N-O 3.23Å
374	V	51.9	Low	62	Low	21 Å²	21	48.4 Å²	48.4	13%	0.127	23%	0.23	C	C	.	.			trans	-103.4	111.3	178.7	-175.5	0	0	0	0	108.9	L369 N372 E376 L379	L369-V374 HydrophobicContact CD2-CG2 4.29Å; N372-V374 HydrophobicContact CB-CG2 4.06Å; N372-V374 PolarHBondContact O-N 3.22Å; V374-E376 PolarHBondContact O-N 3.45Å; V374-L379 HydrophobicContact CG1-CB 3.79Å; V374-L379 HydrophobicContact CG1-CD1 4.29Å
375	N	50.7	Low	60.7	Low	89 Å²	89	52.6 Å²	52.6	48%	0.476	25%	0.25	S	S	.	.			trans	-47.5	128	164	-97.2	-31.5	0	0	0	109.9	W373 T377 T378	W373-N375 WeakPolarHBondContact CH2-OD1 3.39Å; W373-N375 HydrophobicContact CZ3-CB 4.42Å; W373-N375 VanDerWaalsContact CZ3-CG 3.43Å; W373-N375 WeakPolarHBondContact CZ3-OD1 3.48Å; N375-T377 PolarHBondContact O-N 3.45Å; N375-T378 PolarHBondContact O-N 3.38Å
376	E	51.5	Low	59.5	Low	143 Å²	143	54.5 Å²	54.5	67%	0.668	26%	0.262	S	S	*	.	H	α-helix	trans	-47.6	-35.5	-172.4	-167.7	180	172.1	0	0	112.8	V374 R380	V374-E376 PolarHBondContact O-N 3.45Å; E376-R380 WeakPolarHBondContact O-CB 3.3Å; E376-R380 VanDerWaalsContact O-CG 3.3Å; E376-R380 WeakPolarHBondContact O-CG 3.33Å; E376-R380 PolarHBondContact O-N 3.47Å
377	T	50.6	Low	58.4	Low	64 Å²	64	55.6 Å²	55.6	39%	0.393	27%	0.267	S	S	.	.	H	α-helix	trans	-63.1	-46.1	-180	-8.7	0	0	0	0	113.2	N375 L379 R380 Y381	N375-T377 PolarHBondContact O-N 3.45Å; T377-L379 VanDerWaalsContact C-N 3.31Å; T377-L379 PolarHBondContact O-N 3.11Å; T377-R380 PolarHBondContact O-N 2.77Å; T377-Y381 HydrophobicContact CG2-CE2 3.96Å; T377-Y381 WeakPolarHBondContact O-CD2 3.43Å; T377-Y381 PolarHBondContact O-N 3.32Å; T377-Y381 VanDerWaalsContact O-N 3.12Å
378	T	49.6	Very low	57	Low	37 Å²	37	59.7 Å²	59.7	23%	0.227	29%	0.292	C	S	.	.	H	α-helix	trans	-68	-35.4	-175.3	-55.4	0	0	0	0	111.3	R120 N375 A382	R120-T378 PolarHBondContact NH1-OG1 3.05Å; N375-T378 PolarHBondContact O-N 3.38Å; T378-A382 PolarHBondContact O-N 3.35Å; T378-A382 VanDerWaalsContact O-N 3.12Å
379	L	49.4	Very low	55.7	Low	19 Å²	19	60.9 Å²	60.9	10%	0.099	30%	0.301	C	S	.	.	H	α-helix	trans	-74.2	-38.4	174.3	-154.7	74.7	0	0	0	111.6	V374 T377 Y381 A382 I383 V411 L415	V374-L379 HydrophobicContact CG1-CB 3.79Å; V374-L379 HydrophobicContact CG1-CD1 4.29Å; T377-L379 VanDerWaalsContact C-N 3.31Å; T377-L379 PolarHBondContact O-N 3.11Å; L379-Y381 PolarHBondContact O-N 3.04Å; L379-A382 CarbonylContact O-C 3.55Å; L379-A382 PolarHBondContact O-N 3.43Å; L379-A382 VanDerWaalsContact O-N 3.1Å; L379-I383 HydrophobicContact CB-CD1 4.4Å; L379-I383 HydrophobicContact CD2-CD1 3.96Å; L379-I383 HydrophobicContact CG-CD1 3.82Å; L379-I383 HydrophobicContact CG-CG1 4.13Å; L379-I383 VanDerWaalsContact O-CB 3.25Å; L379-I383 WeakPolarHBondContact O-CB 3.35Å; L379-I383 WeakPolarHBondContact O-CD1 3.46Å; L379-I383 WeakPolarHBondContact O-CG1 3.15Å; L379-I383 PolarHBondContact O-N 3.18Å; L379-V411 HydrophobicContact CD2-CG1 3.73Å; L379-V411 HydrophobicContact CG-CG1 4.42Å; L379-L415 HydrophobicContact CD2-CD1 3.9Å; L379-L415 HydrophobicContact CD2-CD2 3.31Å; L379-L415 HydrophobicContact CD2-CG 3.42Å; L379-L415 VanDerWaalsContact CD2-CG 3.42Å
380	R	52.5	Low	54.6	Low	153 Å²	153	65 Å²	65	58%	0.577	32%	0.317	S	S	*	.	H	α-helix	trans	-55.2	-39.3	173.2	-78.4	177.4	74.3	-153.7	3.1	112	E376 T377 N384	E376-R380 WeakPolarHBondContact O-CB 3.3Å; E376-R380 VanDerWaalsContact O-CG 3.3Å; E376-R380 WeakPolarHBondContact O-CG 3.33Å; E376-R380 PolarHBondContact O-N 3.47Å; T377-R380 PolarHBondContact O-N 2.77Å; R380-N384 VanDerWaalsContact O-CB 3.28Å; R380-N384 WeakPolarHBondContact O-CB 3.33Å; R380-N384 PolarHBondContact O-N 3.28Å; R380-N384 PolarHBondContact O-ND2 3.3Å; R380-N384 PolarHBondContact O-OD1 3.17Å
381	Y	55.6	Low	53.4	Low	141 Å²	141	68.4 Å²	68.4	55%	0.553	34%	0.337	S	S	*	.	H	α-helix	trans	-71.7	-41.6	174.2	-71.9	-70	0	0	0	113.3	T377 L379 I383 N384 M385	T377-Y381 HydrophobicContact CG2-CE2 3.96Å; T377-Y381 WeakPolarHBondContact O-CD2 3.43Å; T377-Y381 PolarHBondContact O-N 3.32Å; T377-Y381 VanDerWaalsContact O-N 3.12Å; L379-Y381 PolarHBondContact O-N 3.04Å; Y381-I383 VanDerWaalsContact C-N 3.31Å; Y381-I383 PolarHBondContact O-N 3.38Å; Y381-N384 PolarHBondContact O-N 3.09Å; Y381-M385 PolarHBondContact O-N 2.88Å
382	A	51.3	Low	52.3	Low	14 Å²	14	74.5 Å²	74.5	12%	0.116	37%	0.366	C	S	.	.	H	α-helix	trans	-63.7	-38.2	175.3	0	0	0	0	0	112	T378 L379 M385 L386	T378-A382 PolarHBondContact O-N 3.35Å; T378-A382 VanDerWaalsContact O-N 3.12Å; L379-A382 CarbonylContact O-C 3.55Å; L379-A382 PolarHBondContact O-N 3.43Å; L379-A382 VanDerWaalsContact O-N 3.1Å; A382-M385 PolarHBondContact O-N 2.67Å; A382-L386 WeakPolarHBondContact O-CB 3.46Å; A382-L386 PolarHBondContact O-N 3.47Å
383	I	50.4	Low	51.5	Low	36 Å²	36	80.1 Å²	80.1	19%	0.185	39%	0.388	C	S	.	.	H	α-helix	trans	-65.1	-48.2	172.5	-70.1	163.7	0	0	0	109.6	L379 Y381 M385 L386 I387 V411	L379-I383 HydrophobicContact CB-CD1 4.4Å; L379-I383 HydrophobicContact CD2-CD1 3.96Å; L379-I383 HydrophobicContact CG-CD1 3.82Å; L379-I383 HydrophobicContact CG-CG1 4.13Å; L379-I383 VanDerWaalsContact O-CB 3.25Å; L379-I383 WeakPolarHBondContact O-CB 3.35Å; L379-I383 WeakPolarHBondContact O-CD1 3.46Å; L379-I383 WeakPolarHBondContact O-CG1 3.15Å; L379-I383 PolarHBondContact O-N 3.18Å; Y381-I383 VanDerWaalsContact C-N 3.31Å; Y381-I383 PolarHBondContact O-N 3.38Å; I383-M385 VanDerWaalsContact C-N 3.26Å; I383-M385 PolarHBondContact O-N 2.9Å; I383-L386 PolarHBondContact O-N 3.18Å; I383-I387 HydrophobicContact CG2-CD1 3.42Å; I383-I387 VanDerWaalsContact CG2-CD1 3.42Å; I383-I387 HydrophobicContact CG2-CG1 4.04Å; I383-I387 VanDerWaalsContact O-CB 3.22Å; I383-I387 WeakPolarHBondContact O-CB 3.04Å; I383-I387 WeakPolarHBondContact O-CG1 3.32Å; I383-I387 PolarHBondContact O-N 3.26Å; I383-V411 HydrophobicContact CD1-CG1 3.57Å; I383-V411 HydrophobicContact CG1-CG1 3.84Å
384	N	53.2	Low	51.3	Low	81 Å²	81	80.7 Å²	80.7	43%	0.433	39%	0.394	S	S	.	.	H	α-helix	trans	-59.6	-38.7	175.1	-74.1	-17.3	0	0	0	110.9	R380 Y381 T388	R380-N384 VanDerWaalsContact O-CB 3.28Å; R380-N384 WeakPolarHBondContact O-CB 3.33Å; R380-N384 PolarHBondContact O-N 3.28Å; R380-N384 PolarHBondContact O-ND2 3.3Å; R380-N384 PolarHBondContact O-OD1 3.17Å; Y381-N384 PolarHBondContact O-N 3.09Å; N384-T388 WeakPolarHBondContact O-CA 3.49Å; N384-T388 WeakPolarHBondContact O-CB 3.08Å; N384-T388 PolarHBondContact O-N 3.22Å; N384-T388 PolarHBondContact O-OG1 3.05Å
385	M	53.9	Low	51	Low	94 Å²	94	85.2 Å²	85.2	46%	0.463	42%	0.422	S	S	.	.	H	α-helix	trans	-67.8	-41.4	174.3	-100.5	-164.5	157.4	0	0	113.3	Y381 A382 I383 T388 S389	Y381-M385 PolarHBondContact O-N 2.88Å; A382-M385 PolarHBondContact O-N 2.67Å; I383-M385 VanDerWaalsContact C-N 3.26Å; I383-M385 PolarHBondContact O-N 2.9Å; M385-T388 PolarHBondContact O-N 3.3Å; M385-S389 VanDerWaalsContact O-CB 3.24Å; M385-S389 WeakPolarHBondContact O-CB 3.41Å; M385-S389 PolarHBondContact O-N 2.88Å; M385-S389 PolarHBondContact O-OG 3.2Å
386	L	52	Low	50.7	Low	72 Å²	72	89.1 Å²	89.1	38%	0.377	44%	0.439	S	S	.	.	H	α-helix	trans	-64.7	-45.6	174.7	-98.7	159.9	0	0	0	110.7	A382 I383 S389 F390	A382-L386 WeakPolarHBondContact O-CB 3.46Å; A382-L386 PolarHBondContact O-N 3.47Å; I383-L386 PolarHBondContact O-N 3.18Å; L386-S389 PolarHBondContact O-N 3.19Å; L386-F390 HydrophobicContact CD2-CD2 4.26Å; L386-F390 HydrophobicContact CD2-CE2 4.17Å; L386-F390 WeakPolarHBondContact O-CB 3.41Å; L386-F390 WeakPolarHBondContact O-CD2 3.24Å; L386-F390 PolarHBondContact O-N 3.36Å
387	I	51.9	Low	50.5	Low	50 Å²	50	86.4 Å²	86.4	26%	0.256	43%	0.432	S	S	.	.	H	α-helix	trans	-62.2	-46.8	174.6	-70.4	175	0	0	0	109.7	I383 S389 F390 I391 V408	I383-I387 HydrophobicContact CG2-CD1 3.42Å; I383-I387 VanDerWaalsContact CG2-CD1 3.42Å; I383-I387 HydrophobicContact CG2-CG1 4.04Å; I383-I387 VanDerWaalsContact O-CB 3.22Å; I383-I387 WeakPolarHBondContact O-CB 3.04Å; I383-I387 WeakPolarHBondContact O-CG1 3.32Å; I383-I387 PolarHBondContact O-N 3.26Å; I387-S389 VanDerWaalsContact C-N 3.34Å; I387-S389 PolarHBondContact O-N 3.23Å; I387-F390 CarbonylContact O-C 3.54Å; I387-F390 PolarHBondContact O-N 3.28Å; I387-I391 HydrophobicContact CG2-CD1 3.4Å; I387-I391 HydrophobicContact CG2-CG1 4.05Å; I387-I391 VanDerWaalsContact O-CB 3.24Å; I387-I391 WeakPolarHBondContact O-CB 3.47Å; I387-I391 WeakPolarHBondContact O-CG1 3.49Å; I387-I391 PolarHBondContact O-N 3.3Å; I387-V408 HydrophobicContact CD1-CG2 4.28Å
388	T	52.3	Low	49.9	Very low	86 Å²	86	89.8 Å²	89.8	53%	0.528	46%	0.455	S	S	.	.	H	α-helix	trans	-62.9	-40.5	176.4	-63.9	0	0	0	0	111.3	N384 M385 I391 M392	N384-T388 WeakPolarHBondContact O-CA 3.49Å; N384-T388 WeakPolarHBondContact O-CB 3.08Å; N384-T388 PolarHBondContact O-N 3.22Å; N384-T388 PolarHBondContact O-OG1 3.05Å; M385-T388 PolarHBondContact O-N 3.3Å; T388-I391 PolarHBondContact O-N 3.41Å; T388-M392 VanDerWaalsContact O-CB 3.29Å; T388-M392 WeakPolarHBondContact O-CB 3.22Å; T388-M392 PolarHBondContact O-N 3.13Å
389	S	49.4	Very low	49.8	Very low	31 Å²	31	93.3 Å²	93.3	22%	0.217	47%	0.471	C	S	.	.	H	α-helix	trans	-64.4	-46.2	174.9	-60	0	0	0	0	110.7	M385 L386 I387 I391 M392 Y393	M385-S389 VanDerWaalsContact O-CB 3.24Å; M385-S389 WeakPolarHBondContact O-CB 3.41Å; M385-S389 PolarHBondContact O-N 2.88Å; M385-S389 PolarHBondContact O-OG 3.2Å; L386-S389 PolarHBondContact O-N 3.19Å; I387-S389 VanDerWaalsContact C-N 3.34Å; I387-S389 PolarHBondContact O-N 3.23Å; S389-I391 PolarHBondContact O-N 3.23Å; S389-M392 WeakPolarHBondContact O-CB 3.36Å; S389-M392 PolarHBondContact O-N 3.4Å; S389-Y393 WeakPolarHBondContact O-CD2 3.4Å; S389-Y393 PolarHBondContact O-N 2.89Å
390	F	49.2	Very low	49.7	Very low	111 Å²	111	93.9 Å²	93.9	49%	0.487	48%	0.477	S	S	.	.	H	α-helix	trans	-66.7	-33.4	175.6	-95.5	-84.6	0	0	0	113.1	L386 I387 Y393 H394	L386-F390 HydrophobicContact CD2-CD2 4.26Å; L386-F390 HydrophobicContact CD2-CE2 4.17Å; L386-F390 WeakPolarHBondContact O-CB 3.41Å; L386-F390 WeakPolarHBondContact O-CD2 3.24Å; L386-F390 PolarHBondContact O-N 3.36Å; I387-F390 CarbonylContact O-C 3.54Å; I387-F390 PolarHBondContact O-N 3.28Å; F390-Y393 CarbonylContact O-C 3.56Å; F390-Y393 PolarHBondContact O-N 3.4Å; F390-H394 PolarHBondContact O-N 3.45Å
391	I	48.9	Very low	49.2	Very low	95 Å²	95	93.4 Å²	93.4	49%	0.487	49%	0.485	S	S	.	.	H	α-helix	trans	-68	-40.5	173.1	-73.2	168.8	0	0	0	109.9	I387 T388 S389 Y393 H394	I387-I391 HydrophobicContact CG2-CD1 3.4Å; I387-I391 HydrophobicContact CG2-CG1 4.05Å; I387-I391 VanDerWaalsContact O-CB 3.24Å; I387-I391 WeakPolarHBondContact O-CB 3.47Å; I387-I391 WeakPolarHBondContact O-CG1 3.49Å; I387-I391 PolarHBondContact O-N 3.3Å; T388-I391 PolarHBondContact O-N 3.41Å; S389-I391 PolarHBondContact O-N 3.23Å; I391-Y393 VanDerWaalsContact C-N 3.26Å; I391-Y393 PolarHBondContact O-N 3.41Å; I391-H394 WeakPolarHBondContact O-CB 3.33Å; I391-H394 PolarHBondContact O-N 3.29Å; I391-H394 VanDerWaalsContact O-N 3.1Å; I391-H394 PolarHBondContact O-ND1 2.97Å
392	M	50.6	Low	48.9	Very low	130 Å²	130	94.1 Å²	94.1	64%	0.64	49%	0.494	S	S	*	.	H	α-helix	trans	-64.2	-33.3	175.9	-164.1	175.1	74.1	0	0	111.5	T388 S389	T388-M392 VanDerWaalsContact O-CB 3.29Å; T388-M392 WeakPolarHBondContact O-CB 3.22Å; T388-M392 PolarHBondContact O-N 3.13Å; S389-M392 WeakPolarHBondContact O-CB 3.36Å; S389-M392 PolarHBondContact O-N 3.4Å
393	Y	52.9	Low	48.4	Very low	128 Å²	128	96.9 Å²	96.9	50%	0.502	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-1.8	173.1	-70.4	-67.3	0	0	0	114.6	S389 F390 I391 T395 M396	S389-Y393 WeakPolarHBondContact O-CD2 3.4Å; S389-Y393 PolarHBondContact O-N 2.89Å; F390-Y393 CarbonylContact O-C 3.56Å; F390-Y393 PolarHBondContact O-N 3.4Å; I391-Y393 VanDerWaalsContact C-N 3.26Å; I391-Y393 PolarHBondContact O-N 3.41Å; Y393-T395 PolarHBondContact O-N 3.42Å; Y393-T395 VanDerWaalsContact O-N 3.09Å; Y393-M396 PolarHBondContact O-N 3.41Å; Y393-M396 VanDerWaalsContact O-N 3.16Å
394	H	50.5	Low	47.9	Very low	100 Å²	100	96.8 Å²	96.8	46%	0.463	51%	0.511	S	S	.	.	G	3₁₀ helix	trans	-66	-17.5	-174.7	101.7	-70.8	0	0	0	113.2	F390 I391 M396	F390-H394 PolarHBondContact O-N 3.45Å; I391-H394 WeakPolarHBondContact O-CB 3.33Å; I391-H394 PolarHBondContact O-N 3.29Å; I391-H394 VanDerWaalsContact O-N 3.1Å; I391-H394 PolarHBondContact O-ND1 2.97Å; H394-M396 PolarHBondContact O-N 3.29Å
395	T	44.4	Very low	47.4	Very low	116 Å²	116	97.9 Å²	97.9	71%	0.712	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-67.8	-9.3	176.3	44.1	0	0	0	0	113.8	Y393	Y393-T395 PolarHBondContact O-N 3.42Å; Y393-T395 VanDerWaalsContact O-N 3.09Å
396	M	44.2	Very low	47.1	Very low	171 Å²	171	97 Å²	97	84%	0.842	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-104.2	-13.8	178.1	-78.1	-140.3	131.9	0	0	116.1	Y393 H394	Y393-M396 PolarHBondContact O-N 3.41Å; Y393-M396 VanDerWaalsContact O-N 3.16Å; H394-M396 PolarHBondContact O-N 3.29Å
397	V	47.5	Very low	46.8	Very low	85 Å²	85	96.6 Å²	96.6	52%	0.515	51%	0.511	S	S	.	.			trans	-150.8	118.4	177.3	-173.6	0	0	0	0	111.6	I399	V397-I399 HydrophobicContact CG1-CB 4.22Å; V397-I399 HydrophobicContact CG1-CG1 4.49Å; V397-I399 PolarHBondContact O-N 3.11Å
398	P	38.4	Very low	46.1	Very low	135 Å²	135	96.4 Å²	96.4	88%	0.877	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	8.3	-176.1	-16.4	30.1	0	0	0	117.2
399	I	48.2	Very low	45.8	Very low	111 Å²	111	99.3 Å²	99.3	57%	0.569	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	1.5	-171.7	-64.4	167.8	0	0	0	112.5	V397 L401 V403	V397-I399 HydrophobicContact CG1-CB 4.22Å; V397-I399 HydrophobicContact CG1-CG1 4.49Å; V397-I399 PolarHBondContact O-N 3.11Å; I399-L401 PolarHBondContact O-N 2.88Å; I399-V403 HydrophobicContact CG2-CG2 4.35Å
400	S	47	Very low	45.5	Very low	32 Å²	32	100.1 Å²	100.1	22%	0.224	52%	0.516	C	S	.	.	H	α-helix	trans	-69.1	-23	-166.4	59.9	0	0	0	0	116.2	C404	S400-C404 VanDerWaalsContact O-CB 3.26Å; S400-C404 WeakPolarHBondContact O-CB 3.18Å; S400-C404 PolarHBondContact O-N 2.83Å; S400-C404 PolarHBondContact O-SG 2.9Å
401	L	41.3	Very low	45.3	Very low	142 Å²	142	95.9 Å²	95.9	74%	0.743	50%	0.499	S	S	*	.	H	α-helix	trans	-68.3	-40.5	-174	-160.2	83.3	0	0	0	113.1	I399 C404 L405	I399-L401 PolarHBondContact O-N 2.88Å; L401-C404 WeakPolarHBondContact O-CB 3.47Å; L401-C404 PolarHBondContact O-N 2.65Å; L401-L405 PolarHBondContact O-N 3.34Å
402	Q	49.2	Very low	44.6	Very low	157 Å²	157	96.2 Å²	96.2	73%	0.734	50%	0.498	S	S	*	.	H	α-helix	trans	-76	-36.4	-179.7	-147.5	131.9	-9.1	0	0	111.3	C404 L405 E406	Q402-C404 VanDerWaalsContact C-N 3.33Å; Q402-L405 PolarHBondContact O-N 2.85Å; Q402-E406 WeakPolarHBondContact O-CG 3.33Å; Q402-E406 PolarHBondContact O-N 3.26Å
403	V	42	Very low	44	Very low	72 Å²	72	92.1 Å²	92.1	44%	0.436	49%	0.485	S	S	.	.	H	α-helix	trans	-66.1	-36.6	172	-179.1	0	0	0	0	110.6	I399 E406 V407	I399-V403 HydrophobicContact CG2-CG2 4.35Å; V403-E406 PolarHBondContact O-N 3.22Å; V403-V407 HydrophobicContact CG1-CG2 4.12Å; V403-V407 VanDerWaalsContact O-CB 3.31Å; V403-V407 WeakPolarHBondContact O-CB 3.27Å; V403-V407 WeakPolarHBondContact O-CG2 3.37Å; V403-V407 PolarHBondContact O-N 2.81Å
404	C	38.5	Very low	43.7	Very low	34 Å²	34	87.3 Å²	87.3	23%	0.23	47%	0.468	C	S	.	.	H	α-helix	trans	-61.5	-43.8	172.7	-90.1	0	0	0	0	112	S400 L401 Q402 V407 V408	S400-C404 VanDerWaalsContact O-CB 3.26Å; S400-C404 WeakPolarHBondContact O-CB 3.18Å; S400-C404 PolarHBondContact O-N 2.83Å; S400-C404 PolarHBondContact O-SG 2.9Å; L401-C404 WeakPolarHBondContact O-CB 3.47Å; L401-C404 PolarHBondContact O-N 2.65Å; Q402-C404 VanDerWaalsContact C-N 3.33Å; C404-V407 PolarHBondContact O-N 3.4Å; C404-V408 WeakPolarHBondContact O-CB 3.24Å; C404-V408 WeakPolarHBondContact O-CG2 3.47Å; C404-V408 PolarHBondContact O-N 3.47Å
405	L	44.1	Very low	43.1	Very low	104 Å²	104	85.5 Å²	85.5	55%	0.545	46%	0.461	S	S	.	.	H	α-helix	trans	-65.4	-39.6	175.9	-86.9	163.7	0	0	0	112.6	L401 Q402 V408 R409	L401-L405 PolarHBondContact O-N 3.34Å; Q402-L405 PolarHBondContact O-N 2.85Å; L405-V408 PolarHBondContact O-N 2.89Å; L405-R409 WeakPolarHBondContact O-CG 3.05Å; L405-R409 PolarHBondContact O-N 2.89Å
406	E	47.5	Very low	42.8	Very low	75 Å²	75	87.4 Å²	87.4	35%	0.35	47%	0.466	S	S	.	.	H	α-helix	trans	-66.6	-41.5	174.6	-76.6	-81.8	136.8	0	0	112	Q402 V403 R409 L410	Q402-E406 WeakPolarHBondContact O-CG 3.33Å; Q402-E406 PolarHBondContact O-N 3.26Å; V403-E406 PolarHBondContact O-N 3.22Å; E406-R409 PolarHBondContact O-N 2.77Å; E406-L410 VanDerWaalsContact O-CB 3.27Å; E406-L410 WeakPolarHBondContact O-CB 3.1Å; E406-L410 PolarHBondContact O-N 2.81Å
407	V	44	Very low	42.9	Very low	63 Å²	63	81.6 Å²	81.6	38%	0.382	44%	0.442	S	S	.	.	H	α-helix	trans	-66.3	-39	174.2	170.8	0	0	0	0	110.4	V403 C404 L410 V411	V403-V407 HydrophobicContact CG1-CG2 4.12Å; V403-V407 VanDerWaalsContact O-CB 3.31Å; V403-V407 WeakPolarHBondContact O-CB 3.27Å; V403-V407 WeakPolarHBondContact O-CG2 3.37Å; V403-V407 PolarHBondContact O-N 2.81Å; C404-V407 PolarHBondContact O-N 3.4Å; V407-L410 WeakPolarHBondContact O-CB 3.42Å; V407-L410 PolarHBondContact O-N 3.09Å; V407-V411 HydrophobicContact CG1-CG2 4.28Å; V407-V411 WeakPolarHBondContact O-CB 3.37Å; V407-V411 WeakPolarHBondContact O-CG2 3.2Å; V407-V411 PolarHBondContact O-N 2.64Å
408	V	38.1	Very low	43.4	Very low	46 Å²	46	78.4 Å²	78.4	28%	0.279	42%	0.423	S	S	.	.	H	α-helix	trans	-62.6	-43.8	173	168	0	0	0	0	110.6	I387 C404 L405 V411 Q412	I387-V408 HydrophobicContact CD1-CG2 4.28Å; C404-V408 WeakPolarHBondContact O-CB 3.24Å; C404-V408 WeakPolarHBondContact O-CG2 3.47Å; C404-V408 PolarHBondContact O-N 3.47Å; L405-V408 PolarHBondContact O-N 2.89Å; V408-V411 CarbonylContact O-C 3.58Å; V408-V411 PolarHBondContact O-N 2.76Å; V408-Q412 WeakPolarHBondContact O-CB 3.45Å; V408-Q412 VanDerWaalsContact O-CG 3.26Å; V408-Q412 WeakPolarHBondContact O-CG 3.34Å; V408-Q412 PolarHBondContact O-N 3.02Å
409	R	45.4	Very low	44.9	Very low	147 Å²	147	72.9 Å²	72.9	56%	0.555	39%	0.387	S	S	*	.	H	α-helix	trans	-66.3	-39.4	174.7	-75.9	177.3	178.5	169.1	-0.9	112.9	L405 E406 V411 Q412 A413	L405-R409 WeakPolarHBondContact O-CG 3.05Å; L405-R409 PolarHBondContact O-N 2.89Å; E406-R409 PolarHBondContact O-N 2.77Å; R409-V411 VanDerWaalsContact C-N 3.32Å; R409-Q412 WeakPolarHBondContact O-CB 3.35Å; R409-Q412 PolarHBondContact O-N 2.97Å; R409-A413 WeakPolarHBondContact O-CB 3.34Å; R409-A413 PolarHBondContact O-N 2.88Å
410	L	42.8	Very low	46.2	Very low	49 Å²	49	73.3 Å²	73.3	26%	0.257	39%	0.389	S	S	.	.	H	α-helix	trans	-60.3	-45.6	173.4	-179.5	77.8	0	0	0	109.7	E406 V407 A413 L414 F961 L1056	E406-L410 VanDerWaalsContact O-CB 3.27Å; E406-L410 WeakPolarHBondContact O-CB 3.1Å; E406-L410 PolarHBondContact O-N 2.81Å; V407-L410 WeakPolarHBondContact O-CB 3.42Å; V407-L410 PolarHBondContact O-N 3.09Å; L410-A413 CarbonylContact O-C 3.59Å; L410-A413 WeakPolarHBondContact O-CB 3.42Å; L410-A413 PolarHBondContact O-N 3.49Å; L410-L414 VanDerWaalsContact O-CG 3.3Å; L410-L414 WeakPolarHBondContact O-CG 3.36Å; L410-L414 PolarHBondContact O-N 2.71Å; L410-F961 HydrophobicContact CD1-CZ 4.23Å; L410-L1056 HydrophobicContact CD1-CD1 3.46Å; L410-L1056 VanDerWaalsContact CD1-CD1 3.46Å; L410-L1056 HydrophobicContact CD1-CD2 3.46Å; L410-L1056 VanDerWaalsContact CD1-CD2 3.46Å; L410-L1056 HydrophobicContact CD1-CG 4.12Å
411	V	46.2	Very low	47.8	Very low	22 Å²	22	76.9 Å²	76.9	13%	0.133	41%	0.406	C	S	.	.	H	α-helix	trans	-69.8	-33.1	177.7	175.9	0	0	0	0	111.7	L379 I383 V407 V408 R409 A413 L414 L415	L379-V411 HydrophobicContact CD2-CG1 3.73Å; L379-V411 HydrophobicContact CG-CG1 4.42Å; I383-V411 HydrophobicContact CD1-CG1 3.57Å; I383-V411 HydrophobicContact CG1-CG1 3.84Å; V407-V411 HydrophobicContact CG1-CG2 4.28Å; V407-V411 WeakPolarHBondContact O-CB 3.37Å; V407-V411 WeakPolarHBondContact O-CG2 3.2Å; V407-V411 PolarHBondContact O-N 2.64Å; V408-V411 CarbonylContact O-C 3.58Å; V408-V411 PolarHBondContact O-N 2.76Å; R409-V411 VanDerWaalsContact C-N 3.32Å; V411-A413 VanDerWaalsContact C-N 3.34Å; V411-L414 HydrophobicContact CG2-CD1 4.29Å; V411-L414 CarbonylContact O-C 3.6Å; V411-L414 WeakPolarHBondContact O-CB 3.36Å; V411-L414 PolarHBondContact O-N 2.99Å; V411-L415 WeakPolarHBondContact O-CB 3.44Å; V411-L415 WeakPolarHBondContact O-CG 3.4Å; V411-L415 PolarHBondContact O-N 3.37Å
412	Q	34.3	Very low	49.8	Very low	102 Å²	102	70.2 Å²	70.2	48%	0.477	37%	0.371	S	S	.	.	H	α-helix	trans	-64	-37	167.9	-75.2	171.3	-15.5	0	0	112.3	V408 R409 L415 L416	V408-Q412 WeakPolarHBondContact O-CB 3.45Å; V408-Q412 VanDerWaalsContact O-CG 3.26Å; V408-Q412 WeakPolarHBondContact O-CG 3.34Å; V408-Q412 PolarHBondContact O-N 3.02Å; R409-Q412 WeakPolarHBondContact O-CB 3.35Å; R409-Q412 PolarHBondContact O-N 2.97Å; Q412-L415 WeakPolarHBondContact O-CB 3.4Å; Q412-L415 PolarHBondContact O-N 2.67Å; Q412-L416 PolarHBondContact O-N 3.22Å; Q412-L416 VanDerWaalsContact O-N 3.08Å
413	A	38.2	Very low	51.4	Low	43 Å²	43	66 Å²	66	36%	0.355	35%	0.349	S	S	.	.	H	α-helix	trans	-70.5	-35.3	172.2	0	0	0	0	0	111.9	R409 L410 V411 L415 L416 S417	R409-A413 WeakPolarHBondContact O-CB 3.34Å; R409-A413 PolarHBondContact O-N 2.88Å; L410-A413 CarbonylContact O-C 3.59Å; L410-A413 WeakPolarHBondContact O-CB 3.42Å; L410-A413 PolarHBondContact O-N 3.49Å; V411-A413 VanDerWaalsContact C-N 3.34Å; A413-L415 VanDerWaalsContact C-N 3.33Å; A413-L416 PolarHBondContact O-N 2.89Å; A413-S417 PolarHBondContact O-N 2.85Å
414	L	46.7	Very low	53.4	Low	28 Å²	28	63 Å²	63	15%	0.147	33%	0.33	C	S	.	.	H	α-helix	trans	-63.6	-39.1	170.4	-65.3	171.9	0	0	0	110.6	I366 Y370 L410 V411 S417	I366-L414 HydrophobicContact CG2-CD1 4.46Å; I366-L414 HydrophobicContact CG2-CD2 3.98Å; Y370-L414 HydrophobicContact CD1-CD2 4.34Å; Y370-L414 HydrophobicContact CE1-CD2 3.23Å; Y370-L414 WeakPolarHBondContact OH-CD2 3.16Å; L410-L414 VanDerWaalsContact O-CG 3.3Å; L410-L414 WeakPolarHBondContact O-CG 3.36Å; L410-L414 PolarHBondContact O-N 2.71Å; V411-L414 HydrophobicContact CG2-CD1 4.29Å; V411-L414 CarbonylContact O-C 3.6Å; V411-L414 WeakPolarHBondContact O-CB 3.36Å; V411-L414 PolarHBondContact O-N 2.99Å; L414-S417 WeakPolarHBondContact CA-OG 3.47Å; L414-S417 PolarHBondContact O-N 3.26Å; L414-S417 VanDerWaalsContact O-N 3.09Å; L414-S417 PolarHBondContact O-OG 3.07Å
415	L	37.9	Very low	55.5	Low	61 Å²	61	65.5 Å²	65.5	32%	0.319	35%	0.349	S	S	.	.	H	α-helix	trans	-60.3	-44.4	175.4	-83.3	163.5	0	0	0	112.3	L379 V411 Q412 A413 S417 C418	L379-L415 HydrophobicContact CD2-CD1 3.9Å; L379-L415 HydrophobicContact CD2-CD2 3.31Å; L379-L415 HydrophobicContact CD2-CG 3.42Å; L379-L415 VanDerWaalsContact CD2-CG 3.42Å; V411-L415 WeakPolarHBondContact O-CB 3.44Å; V411-L415 WeakPolarHBondContact O-CG 3.4Å; V411-L415 PolarHBondContact O-N 3.37Å; Q412-L415 WeakPolarHBondContact O-CB 3.4Å; Q412-L415 PolarHBondContact O-N 2.67Å; A413-L415 VanDerWaalsContact C-N 3.33Å; L415-S417 PolarHBondContact O-N 3.2Å; L415-C418 PolarHBondContact O-SG 3.38Å
416	L	37.7	Very low	57.1	Low	156 Å²	156	66.9 Å²	66.9	82%	0.817	36%	0.357	S	S	*	.	H	α-helix	trans	-66.7	-18.8	175.1	-79.5	154.1	0	0	0	113.3	Q412 A413	Q412-L416 PolarHBondContact O-N 3.22Å; Q412-L416 VanDerWaalsContact O-N 3.08Å; A413-L416 PolarHBondContact O-N 2.89Å
417	S	45.8	Very low	58.4	Low	49 Å²	49	65.7 Å²	65.7	34%	0.343	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	1.7	-174.4	71.2	0	0	0	0	115.1	Y370 A413 L414 L415 D419	Y370-S417 WeakPolarHBondContact CD1-OG 3.28Å; Y370-S417 WeakPolarHBondContact CE1-OG 3.3Å; A413-S417 PolarHBondContact O-N 2.85Å; L414-S417 WeakPolarHBondContact CA-OG 3.47Å; L414-S417 PolarHBondContact O-N 3.26Å; L414-S417 VanDerWaalsContact O-N 3.09Å; L414-S417 PolarHBondContact O-OG 3.07Å; L415-S417 PolarHBondContact O-N 3.2Å; S417-D419 PolarHBondContact O-N 2.9Å
418	C	58.6	Low	60	Low	18 Å²	18	67.7 Å²	67.7	12%	0.122	37%	0.365	C	S	.	.	S	Bend	trans	-62	135.2	172.9	-58	0	0	0	0	109.4	L415 L420	L415-C418 PolarHBondContact O-SG 3.38Å; C418-L420 PolarHBondContact O-N 3.48Å
419	D	68.9	Low	61.7	Low	20 Å²	20	66.5 Å²	66.5	11%	0.107	36%	0.358	C	S	.	.			trans	-77	93.1	-171.3	-161.5	-11.2	0	0	0	112.6	Y370 S417 D421 M422 K892 H897	Y370-D419 PolarHBondContact O-N 3.47Å; S417-D419 PolarHBondContact O-N 2.9Å; D419-D421 PolarHBondContact O-N 3.17Å; D419-D421 WeakPolarHBondContact OD1-CB 3.38Å; D419-D421 PolarHBondContact OD1-N 3.06Å; D419-D421 VanDerWaalsContact OD1-N 3.09Å; D419-M422 HydrophobicContact CB-CE 3.79Å; D419-M422 PolarHBondContact O-N 3.39Å; D419-M422 VanDerWaalsContact O-N 3.15Å; D419-K892 IonicContact OD1-NZ 2.85Å; D419-K892 PolarHBondContact OD1-NZ 2.78Å; D419-K892 VanDerWaalsContact OD2-CD 3.25Å; D419-K892 WeakPolarHBondContact OD2-CD 3.46Å; D419-K892 WeakPolarHBondContact OD2-CE 3.24Å; D419-K892 IonicContact OD2-NZ 2.62Å; D419-K892 PolarHBondContact OD2-NZ 2.95Å; D419-H897 IonicContact OD2-CD2 3.03Å; D419-H897 IonicContact OD2-CE1 2.73Å; D419-H897 IonicContact OD2-NE2 3.25Å; D419-H897 PolarHBondContact OD2-NE2 2.83Å
420	L	76	Confident	63.4	Low	119 Å²	119	61 Å²	61	62%	0.623	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-61.8	-21.8	175.4	-66.9	172.6	0	0	0	113	C418 M422 Y423	C418-L420 PolarHBondContact O-N 3.48Å; L420-M422 PolarHBondContact O-N 2.76Å; L420-Y423 PolarHBondContact O-N 3.43Å
421	D	80.9	Confident	65.3	Low	108 Å²	108	58.9 Å²	58.9	58%	0.578	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-76	-10.4	178.9	-60	-22.2	0	0	0	112.4	D419 F889 K892	D419-D421 PolarHBondContact O-N 3.17Å; D419-D421 WeakPolarHBondContact OD1-CB 3.38Å; D419-D421 PolarHBondContact OD1-N 3.06Å; D419-D421 VanDerWaalsContact OD1-N 3.09Å; D421-F889 WeakPolarHBondContact O-CD1 3.32Å; D421-F889 WeakPolarHBondContact O-CE1 3.39Å; D421-K892 HydrophobicContact CB-CD 3.96Å; D421-K892 VanDerWaalsContact CG-NZ 3.33Å; D421-K892 IonicContact OD2-NZ 3.97Å; D421-K892 PolarHBondContact OD2-NZ 3.48Å
422	M	83.5	Confident	66.9	Low	1 Å²	1	61.7 Å²	61.7	1%	0.005	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-108.3	19.8	174	-60	-167.2	-61.8	0	0	112.7	I371 D419 L420 A431 F889 K892 L893	I371-M422 HydrophobicContact CG2-CE 4.02Å; D419-M422 HydrophobicContact CB-CE 3.79Å; D419-M422 PolarHBondContact O-N 3.39Å; D419-M422 VanDerWaalsContact O-N 3.15Å; L420-M422 PolarHBondContact O-N 2.76Å; M422-A431 HydrophobicContact CB-CB 3.87Å; M422-A431 HydrophobicContact CE-CB 4.1Å; M422-A431 PolarHBondContact O-N 3.46Å; M422-F889 HydrophobicContact CB-CB 4.41Å; M422-F889 HydrophobicContact CB-CD1 4.43Å; M422-F889 HydrophobicContact CB-CG 4.25Å; M422-F889 HydrophobicContact CG-CB 4.19Å; M422-F889 HydrophobicContact CG-CD1 4.43Å; M422-F889 HydrophobicContact CG-CG 4.39Å; M422-K892 HydrophobicContact CG-CB 4.48Å; M422-K892 HydrophobicContact CG-CD 4.38Å; M422-K892 HydrophobicContact SD-CB 4.42Å; M422-L893 HydrophobicContact SD-CB 4.26Å
423	Y	83	Confident	69.2	Low	69 Å²	69	57.2 Å²	57.2	27%	0.271	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	131.7	171.3	172.6	-101.4	0	0	0	109.6	L420 D428 P430	L420-Y423 PolarHBondContact O-N 3.43Å; Y423-D428 WeakPolarHBondContact CE2-OD1 3.26Å; Y423-D428 PolarHBondContact OH-OD1 3.04Å; Y423-P430 HydrophobicContact CD2-CB 4.19Å
424	D	83.2	Confident	71	Confident	8 Å²	8	59.9 Å²	59.9	4%	0.043	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	116.6	175.5	-172.4	46.4	0	0	0	110.5	D426 S427 D428 T429 A885 Q886 F889	D424-D426 VanDerWaalsContact C-N 3.3Å; D424-D426 PolarHBondContact O-N 2.91Å; D424-S427 WeakPolarHBondContact CB-OG 3.38Å; D424-S427 PolarHBondContact OD2-N 3.3Å; D424-S427 PolarHBondContact OD2-OG 2.82Å; D424-D428 WeakPolarHBondContact O-CA 3.48Å; D424-D428 PolarHBondContact O-N 2.89Å; D424-D428 VanDerWaalsContact O-N 3.13Å; D424-T429 PolarHBondContact N-O 3.31Å; D424-T429 PolarHBondContact O-N 3.26Å; D424-A885 HydrophobicContact CB-CB 3.52Å; D424-Q886 VanDerWaalsContact CG-NE2 3.26Å; D424-Q886 PolarHBondContact OD1-NE2 3.26Å; D424-Q886 PolarHBondContact OD2-NE2 3.42Å; D424-F889 HydrophobicContact CB-CE2 4.06Å; D424-F889 HydrophobicContact CB-CZ 4.23Å
425	S	82.4	Confident	72.4	Confident	88 Å²	88	60.3 Å²	60.3	62%	0.615	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-30.4	-177.9	52.2	0	0	0	0	113.2
426	D	77.8	Confident	74.3	Confident	133 Å²	133	57.7 Å²	57.7	71%	0.711	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-35.8	-172.1	-62.5	-9.9	0	0	0	111.5	D424	D424-D426 VanDerWaalsContact C-N 3.3Å; D424-D426 PolarHBondContact O-N 2.91Å
427	S	74.7	Confident	76.4	Confident	49 Å²	49	52.3 Å²	52.3	34%	0.343	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-1	178.8	58.4	0	0	0	0	114	D424 T429	D424-S427 WeakPolarHBondContact CB-OG 3.38Å; D424-S427 PolarHBondContact OD2-N 3.3Å; D424-S427 PolarHBondContact OD2-OG 2.82Å; S427-T429 PolarHBondContact O-N 2.77Å; S427-T429 VanDerWaalsContact O-N 3.11Å; S427-T429 PolarHBondContact O-OG1 3.21Å; S427-T429 WeakPolarHBondContact OG-CB 3.48Å
428	D	77.6	Confident	78.3	Confident	105 Å²	105	50 Å²	50	56%	0.561	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.1	39	-170.3	-170.3	26.3	0	0	0	112.4	Y423 D424	Y423-D428 WeakPolarHBondContact CE2-OD1 3.26Å; Y423-D428 PolarHBondContact OH-OD1 3.04Å; D424-D428 WeakPolarHBondContact O-CA 3.48Å; D424-D428 PolarHBondContact O-N 2.89Å; D424-D428 VanDerWaalsContact O-N 3.13Å
429	T	73.8	Confident	79.6	Confident	22 Å²	22	49.1 Å²	49.1	14%	0.135	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	118	-171.8	-61.4	0	0	0	0	111.1	D424 S427 A885	D424-T429 PolarHBondContact N-O 3.31Å; D424-T429 PolarHBondContact O-N 3.26Å; S427-T429 PolarHBondContact O-N 2.77Å; S427-T429 VanDerWaalsContact O-N 3.11Å; S427-T429 PolarHBondContact O-OG1 3.21Å; S427-T429 WeakPolarHBondContact OG-CB 3.48Å; T429-A885 HydrophobicContact CG2-CB 4.1Å
430	P	80.7	Confident	80.6	Confident	32 Å²	32	48.2 Å²	48.2	21%	0.208	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	164.3	175.1	34.2	-36.5	0	0	0	113.4	W373 Y423	W373-P430 HydrophobicContact CB-CB 3.16Å; W373-P430 HydrophobicContact CB-CG 3.94Å; W373-P430 HydrophobicContact CD2-CB 4.3Å; W373-P430 HydrophobicContact CE3-CB 4.21Å; W373-P430 HydrophobicContact CE3-CG 4Å; W373-P430 HydrophobicContact CG-CB 3.94Å; Y423-P430 HydrophobicContact CD2-CB 4.19Å
431	A	83.6	Confident	81.3	Confident	3 Å²	3	42.6 Å²	42.6	3%	0.025	23%	0.231	C	C	.	.			trans	-65.3	143	162.7	0	0	0	0	0	111.8	I371 N372 W373 M422 A883 I884	I371-A431 HydrophobicContact CG2-CB 4.27Å; N372-A431 WeakPolarHBondContact CA-O 3.38Å; W373-A431 PolarHBondContact N-O 3.23Å; M422-A431 HydrophobicContact CB-CB 3.87Å; M422-A431 HydrophobicContact CE-CB 4.1Å; M422-A431 PolarHBondContact O-N 3.46Å; A431-A883 CarbonylContact C-O 3.55Å; A431-A883 VanDerWaalsContact CA-O 3.3Å; A431-A883 WeakPolarHBondContact CA-O 3.27Å; A431-I884 HydrophobicContact CB-CG2 4.24Å
432	M	79.6	Confident	81.8	Confident	81 Å²	81	37.5 Å²	37.5	40%	0.399	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	108.6	179.9	-174.8	-172.3	176.2	0	0	111.9	N372 R434 Y882 A883	N372-M432 VanDerWaalsContact OD1-CA 3.27Å; N372-M432 WeakPolarHBondContact OD1-CA 3.4Å; M432-R434 HydrophobicContact CE-CG 3.95Å; M432-R434 HydrophobicContact CG-CG 4.17Å; M432-R434 PolarHBondContact O-N 3.07Å; M432-R434 HydrophobicContact SD-CG 4.07Å; M432-Y882 CarbonylContact O-C 3.59Å; M432-Y882 WeakPolarHBondContact O-CA 3.05Å; M432-A883 HydrophobicContact CB-CB 4.33Å; M432-A883 PolarHBondContact N-O 3.25Å; M432-A883 PolarHBondContact O-N 2.97Å
433	A	82.5	Confident	82.1	Confident	8 Å²	8	37.4 Å²	37.4	7%	0.066	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	106.7	160.5	0	0	0	0	0	110.9	A368 I371 N372 Y882	A368-A433 HydrophobicContact CB-CB 3.87Å; I371-A433 HydrophobicContact CB-CB 4.29Å; I371-A433 HydrophobicContact CD1-CB 4.41Å; I371-A433 HydrophobicContact CG2-CB 4.2Å; N372-A433 PolarHBondContact ND2-O 3.09Å; N372-A433 WeakPolarHBondContact OD1-CA 3.43Å; N372-A433 WeakPolarHBondContact OD1-CB 3.18Å; N372-A433 PolarHBondContact OD1-N 2.91Å; A433-Y882 HydrophobicContact CB-CD1 3.66Å; A433-Y882 HydrophobicContact CB-CE1 3.61Å
434	R	75.6	Confident	82.5	Confident	99 Å²	99	34.8 Å²	34.8	37%	0.374	19%	0.193	S	C	.	.	S	Bend	trans	-86.3	-33.9	175.6	-62	176.3	69.5	89.7	-6.2	111.4	M432 A877 C878 S880 D881	M432-R434 HydrophobicContact CE-CG 3.95Å; M432-R434 HydrophobicContact CG-CG 4.17Å; M432-R434 PolarHBondContact O-N 3.07Å; M432-R434 HydrophobicContact SD-CG 4.07Å; R434-A877 WeakPolarHBondContact CD-O 3.29Å; R434-C878 VanDerWaalsContact CZ-O 3.3Å; R434-C878 PolarHBondContact NE-O 3.17Å; R434-C878 PolarHBondContact NH2-O 2.86Å; R434-S880 WeakPolarHBondContact CD-O 3.14Å; R434-D881 WeakPolarHBondContact CA-O 3.25Å; R434-D881 PolarHBondContact N-O 2.99Å
435	T	75.9	Confident	83	Confident	38 Å²	38	34.4 Å²	34.4	23%	0.233	19%	0.191	C	C	.	.			trans	-112.8	101.3	176.2	-54.2	0	0	0	0	110.5	N437 L438 D881	T435-N437 VanDerWaalsContact C-N 3.3Å; T435-N437 HydrophobicContact CG2-CB 4.41Å; T435-N437 PolarHBondContact O-N 3.08Å; T435-L438 HydrophobicContact CG2-CD1 3.95Å; T435-L438 HydrophobicContact CG2-CG 3.99Å; T435-D881 VanDerWaalsContact CB-OD1 3.3Å; T435-D881 WeakPolarHBondContact CB-OD1 3.42Å; T435-D881 PolarHBondContact N-O 3.38Å; T435-D881 PolarHBondContact OG1-OD1 2.9Å
436	S	79.3	Confident	83.5	Confident	6 Å²	6	34.4 Å²	34.4	4%	0.042	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-71.3	-20.3	-178.7	54.8	0	0	0	0	114.3	E114 R364 L438 N439	E114-S436 PolarHBondContact OE1-OG 3.03Å; R364-S436 WeakPolarHBondContact CB-O 3.31Å; S436-L438 PolarHBondContact O-N 2.92Å; S436-N439 PolarHBondContact O-ND2 2.77Å
437	N	80.1	Confident	84.3	Confident	42 Å²	42	28.4 Å²	28.4	23%	0.225	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-71.8	-7.1	-174.3	-69.8	-23	0	0	0	115.5	T435	T435-N437 VanDerWaalsContact C-N 3.3Å; T435-N437 HydrophobicContact CG2-CB 4.41Å; T435-N437 PolarHBondContact O-N 3.08Å
438	L	85.5	Confident	85.3	Confident	1 Å²	1	26.1 Å²	26.1	1%	0.005	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-113	9.6	-173.3	-56.5	175.1	0	0	0	113	K281 T435 S436 E440 E441 L442 D881 Y882	K281-L438 HydrophobicContact CB-CD1 4.03Å; K281-L438 HydrophobicContact CB-CD2 4.02Å; K281-L438 HydrophobicContact CD-CD1 4.06Å; T435-L438 HydrophobicContact CG2-CD1 3.95Å; T435-L438 HydrophobicContact CG2-CG 3.99Å; S436-L438 PolarHBondContact O-N 2.92Å; L438-E440 PolarHBondContact O-N 3.04Å; L438-E440 VanDerWaalsContact O-N 3.16Å; L438-E441 HydrophobicContact CB-CB 4.41Å; L438-E441 HydrophobicContact CB-CG 4.41Å; L438-E441 HydrophobicContact CD2-CG 4.16Å; L438-E441 VanDerWaalsContact O-CB 3.3Å; L438-E441 WeakPolarHBondContact O-CB 3.16Å; L438-E441 PolarHBondContact O-N 2.72Å; L438-L442 PolarHBondContact O-N 3.5Å; L438-D881 HydrophobicContact CD1-CB 4.06Å; L438-D881 VanDerWaalsContact CD1-CG 3.49Å; L438-Y882 HydrophobicContact CB-CE2 4.37Å; L438-Y882 PolarHBondContact O-OH 3.14Å
439	N	87.6	Confident	86.2	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-33.5	-174	-75.3	-13.2	0	0	0	113.3	R364 Q367 A368 S436 Y882 N901	R364-N439 PolarHBondContact O-ND2 3.45Å; Q367-N439 WeakPolarHBondContact CB-ND2 3.44Å; A368-N439 PolarHBondContact N-ND2 3.2Å; S436-N439 PolarHBondContact O-ND2 2.77Å; N439-Y882 VanDerWaalsContact CA-OH 3.23Å; N439-Y882 WeakPolarHBondContact CA-OH 3.41Å; N439-Y882 PolarHBondContact N-OH 2.85Å; N439-Y882 VanDerWaalsContact N-OH 3.08Å; N439-Y882 PolarHBondContact OD1-OH 3.44Å; N439-N901 HydrophobicContact CB-CB 4.24Å; N439-N901 WeakPolarHBondContact O-CB 3.42Å
440	E	88.2	Confident	87.3	Confident	0 Å²	0	20 Å²	20	0%	0	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-25.2	175.1	66.7	-87.2	-156.8	0	0	114	S283 V285 R364 L438 L442 G443 Y902 L905	S283-E440 WeakPolarHBondContact CB-OE1 3.24Å; S283-E440 PolarHBondContact OG-OE1 3.32Å; V285-E440 HydrophobicContact CB-CG 3.94Å; V285-E440 HydrophobicContact CG2-CB 4.43Å; V285-E440 HydrophobicContact CG2-CG 3.81Å; R364-E440 IonicContact CZ-OE1 3.6Å; R364-E440 VanDerWaalsContact CZ-OE1 3.3Å; R364-E440 IonicContact NE-OE1 2.99Å; R364-E440 PolarHBondContact NE-OE1 3.45Å; R364-E440 IonicContact NE-OE2 2.9Å; R364-E440 PolarHBondContact NE-OE2 2.85Å; R364-E440 IonicContact NH2-OE1 3.67Å; R364-E440 PolarHBondContact NH2-OE1 3.21Å; L438-E440 PolarHBondContact O-N 3.04Å; L438-E440 VanDerWaalsContact O-N 3.16Å; E440-L442 VanDerWaalsContact C-N 3.27Å; E440-L442 PolarHBondContact O-N 3.41Å; E440-G443 PolarHBondContact O-N 3.38Å; E440-Y902 HydrophobicContact CB-CD2 4.43Å; E440-L905 HydrophobicContact CB-CD2 3.78Å; E440-L905 HydrophobicContact CG-CD2 3.63Å; E440-L905 WeakPolarHBondContact OE1-CD2 3.39Å; E440-L905 WeakPolarHBondContact OE2-CD2 3.28Å
441	E	90.8	Very high	87.8	Confident	2 Å²	2	19 Å²	19	1%	0.009	9%	0.088	C	C	.	.	G	3₁₀ helix	trans	-67.1	-32.5	178.8	-68.6	-70.6	124.9	0	0	111	S283 T284 L438 G443 Q444 V445 V845 V864	S283-E441 WeakPolarHBondContact CA-OE1 3.47Å; S283-E441 VanDerWaalsContact CB-OE1 3.28Å; S283-E441 WeakPolarHBondContact CB-OE1 3.24Å; T284-E441 WeakPolarHBondContact CA-OE1 3.37Å; T284-E441 WeakPolarHBondContact CB-OE1 3.15Å; T284-E441 PolarHBondContact N-OE1 2.9Å; T284-E441 PolarHBondContact OG1-OE1 3.08Å; L438-E441 HydrophobicContact CB-CB 4.41Å; L438-E441 HydrophobicContact CB-CG 4.41Å; L438-E441 HydrophobicContact CD2-CG 4.16Å; L438-E441 VanDerWaalsContact O-CB 3.3Å; L438-E441 WeakPolarHBondContact O-CB 3.16Å; L438-E441 PolarHBondContact O-N 2.72Å; E441-G443 PolarHBondContact O-N 3.41Å; E441-Q444 PolarHBondContact O-N 3.46Å; E441-V445 PolarHBondContact O-N 3.23Å; E441-V845 HydrophobicContact CB-CG1 4.24Å; E441-V845 WeakPolarHBondContact OE2-CG1 3.49Å; E441-V845 WeakPolarHBondContact OE2-CG2 3.35Å; E441-V864 HydrophobicContact CB-CG2 3.64Å
442	L	91.9	Very high	88	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.088	C	C	.	.	G	3₁₀ helix	trans	-56.6	-20.5	171.2	-68.4	174.9	0	0	0	112.8	L438 E440 L847 V864 Y882 L893 L894 Y977	L438-L442 PolarHBondContact O-N 3.5Å; E440-L442 VanDerWaalsContact C-N 3.27Å; E440-L442 PolarHBondContact O-N 3.41Å; L442-L847 HydrophobicContact CD2-CD1 4.31Å; L442-V864 HydrophobicContact CD2-CG1 3.85Å; L442-Y882 HydrophobicContact CD1-CD1 4.3Å; L442-Y882 HydrophobicContact CD1-CD2 4.42Å; L442-Y882 HydrophobicContact CD1-CE1 3.74Å; L442-Y882 HydrophobicContact CD1-CE2 3.86Å; L442-Y882 HydrophobicContact CD2-CD2 4.14Å; L442-Y882 HydrophobicContact CD2-CE2 3.92Å; L442-Y882 HydrophobicContact CG-CE2 3.91Å; L442-L893 HydrophobicContact CD1-CD1 3.8Å; L442-L893 HydrophobicContact CD1-CG 4.04Å; L442-L893 HydrophobicContact CD2-CD2 4.38Å; L442-L893 HydrophobicContact CD2-CG 4.32Å; L442-L894 HydrophobicContact CB-CD2 4.09Å; L442-L894 HydrophobicContact CD2-CD2 3.69Å; L442-L894 VanDerWaalsContact O-CD2 3.32Å; L442-L894 WeakPolarHBondContact O-CD2 3.48Å; L442-Y977 PolarHBondContact O-OH 3.02Å
443	G	89.8	Confident	88.1	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.079	C	C	.	.	G	3₁₀ helix	trans	-86	-6.4	175.6	0	0	0	0	0	115	E440 E441 G898 T980	E440-G443 PolarHBondContact O-N 3.38Å; E441-G443 PolarHBondContact O-N 3.41Å; G443-G898 VanDerWaalsContact CA-C 3.43Å; G443-G898 WeakPolarHBondContact CA-O 3.28Å; G443-T980 VanDerWaalsContact O-CB 3.23Å; G443-T980 WeakPolarHBondContact O-CB 3.25Å; G443-T980 PolarHBondContact O-OG1 2.96Å
444	Q	91.7	Very high	88	Confident	13 Å²	13	16.7 Å²	16.7	6%	0.061	8%	0.078	C	C	.	.	S	Bend	trans	-124.5	6.4	-172.9	-66.6	178.3	-67.9	0	0	113.6	T284 E441 R446 V845 Y902 Y977 S983	T284-Q444 PolarHBondContact OG1-OE1 2.95Å; E441-Q444 PolarHBondContact O-N 3.46Å; Q444-R446 PolarHBondContact O-N 3.23Å; Q444-V845 HydrophobicContact CB-CB 4.4Å; Q444-V845 HydrophobicContact CB-CG2 3.73Å; Q444-V845 WeakPolarHBondContact O-CB 3.43Å; Q444-Y902 HydrophobicContact CG-CD2 3.78Å; Q444-Y902 HydrophobicContact CG-CE2 3.73Å; Q444-Y902 HydrophobicContact CG-CG 4.48Å; Q444-Y977 PolarHBondContact N-OH 3.14Å; Q444-S983 PolarHBondContact NE2-OG 3.45Å
445	V	94	Very high	88.7	Confident	0 Å²	0	12 Å²	12	0%	0	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	126.2	-179.6	177.5	0	0	0	0	110	E441 I448 V845 L847 L894 Y977 Q981	E441-V445 PolarHBondContact O-N 3.23Å; V445-I448 HydrophobicContact CG1-CG1 3.89Å; V445-V845 HydrophobicContact CG2-CG1 4.23Å; V445-L847 HydrophobicContact CG1-CB 3.58Å; V445-L847 HydrophobicContact CG1-CD1 4.36Å; V445-L847 HydrophobicContact CG2-CB 4.11Å; V445-L847 HydrophobicContact CG2-CD1 4Å; V445-L894 HydrophobicContact CB-CD2 4.39Å; V445-L894 HydrophobicContact CG2-CD2 3.9Å; V445-Y977 PolarHBondContact N-OH 2.73Å; V445-Y977 WeakPolarHBondContact O-CE1 3.25Å; V445-Q981 PolarHBondContact O-NE2 3.27Å
446	R	92.7	Very high	89.4	Confident	89 Å²	89	10.3 Å²	10.3	34%	0.336	5%	0.05	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	-30.9	176.7	-171.6	174.9	-178.5	-179.4	0.1	113.1	Q444 I728 S729 E786 A844 V845	Q444-R446 PolarHBondContact O-N 3.23Å; R446-I728 WeakPolarHBondContact O-CA 3.09Å; R446-S729 PolarHBondContact O-N 3.01Å; R446-E786 IonicContact NH2-OE1 3.03Å; R446-A844 HydrophobicContact CB-CB 4.19Å; R446-V845 PolarHBondContact N-O 2.82Å
447	Y	94.7	Very high	89.8	Confident	7 Å²	7	10 Å²	10	3%	0.027	5%	0.048	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	130.8	179.1	-60.5	-82.6	0	0	0	109.9	S729 W731 L815 V837 I841 A844 V845 T846 L847	Y447-S729 WeakPolarHBondContact CA-O 3.35Å; Y447-W731 AromaticContact CD1-NE1 3.75Å; Y447-L815 HydrophobicContact CE1-CD2 3.83Å; Y447-V837 HydrophobicContact CD2-CG1 4.43Å; Y447-V837 HydrophobicContact CG-CG1 4.48Å; Y447-I841 HydrophobicContact CD2-CD1 4.31Å; Y447-I841 HydrophobicContact CE2-CD1 3.41Å; Y447-I841 VanDerWaalsContact CE2-CD1 3.41Å; Y447-A844 HydrophobicContact CD2-CB 4.14Å; Y447-A844 HydrophobicContact CE2-CB 3.89Å; Y447-V845 PolarHBondContact N-O 3.33Å; Y447-T846 WeakPolarHBondContact O-CA 3.34Å; Y447-L847 PolarHBondContact O-N 2.8Å
448	I	96.4	Very high	89.7	Confident	0 Å²	0	12 Å²	12	0%	0	5%	0.052	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	125.8	173	-67.5	172	0	0	0	108.4	V445 L723 I728 S729 I730 W731 L847 I849 L890 L894	V445-I448 HydrophobicContact CG1-CG1 3.89Å; I448-L723 HydrophobicContact CD1-CD1 3.88Å; I448-L723 HydrophobicContact CD1-CD2 4.4Å; I448-I728 HydrophobicContact CB-CG2 4.3Å; I448-I728 HydrophobicContact CD1-CD1 4.44Å; I448-I728 HydrophobicContact CD1-CG2 3.55Å; I448-I728 HydrophobicContact CG1-CG2 3.6Å; I448-S729 PolarHBondContact N-O 2.73Å; I448-I730 HydrophobicContact CB-CG1 4.47Å; I448-W731 PolarHBondContact O-N 3.14Å; I448-L847 CarbonylContact C-O 3.54Å; I448-L847 VanDerWaalsContact CA-O 3.32Å; I448-L847 WeakPolarHBondContact CA-O 3.24Å; I448-L847 HydrophobicContact CG1-CB 4.23Å; I448-L847 HydrophobicContact CG1-CD2 4.17Å; I448-L847 HydrophobicContact CG2-CD2 4.06Å; I448-I849 HydrophobicContact CG2-CG2 4.14Å; I448-L890 HydrophobicContact CD1-CD2 4.01Å; I448-L894 HydrophobicContact CD1-CD1 3.99Å
449	F	96.9	Very high	89.3	Confident	0 Å²	0	13.5 Å²	13.5	0%	0	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	112.9	169.7	-59.2	-85	0	0	0	108.2	W731 L733 L833 V834 V837 T846 L847 A848 I849 M858	F449-W731 CarbonylContact C-O 3.56Å; F449-W731 WeakPolarHBondContact CA-O 2.92Å; F449-W731 HydrophobicContact CD1-CB 3.51Å; F449-W731 HydrophobicContact CD1-CD2 4.27Å; F449-W731 HydrophobicContact CD1-CE3 4.44Å; F449-W731 AromaticContact CD1-CG 3.93Å; F449-W731 HydrophobicContact CD1-CG 3.93Å; F449-W731 HydrophobicContact CE1-CB 3.83Å; F449-W731 AromaticContact CE1-CD2 3.66Å; F449-W731 HydrophobicContact CE1-CD2 3.66Å; F449-W731 AromaticContact CE1-CE3 3.84Å; F449-W731 HydrophobicContact CE1-CE3 3.84Å; F449-W731 AromaticContact CE1-CG 3.69Å; F449-W731 HydrophobicContact CE1-CG 3.69Å; F449-W731 HydrophobicContact CG-CB 4.34Å; F449-W731 HydrophobicContact CZ-CD2 4.49Å; F449-L733 HydrophobicContact CB-CD1 4.31Å; F449-L733 HydrophobicContact CD1-CD1 4.08Å; F449-L833 HydrophobicContact CD1-CD2 3.8Å; F449-L833 HydrophobicContact CE1-CD2 3.5Å; F449-V834 HydrophobicContact CB-CG2 3.87Å; F449-V834 HydrophobicContact CD1-CG2 3.87Å; F449-V834 HydrophobicContact CD2-CB 4.43Å; F449-V834 HydrophobicContact CD2-CG1 4.21Å; F449-V834 HydrophobicContact CD2-CG2 3.7Å; F449-V834 HydrophobicContact CE1-CG2 4.36Å; F449-V834 HydrophobicContact CE2-CG1 4.33Å; F449-V834 HydrophobicContact CE2-CG2 4.2Å; F449-V834 HydrophobicContact CG-CG2 3.52Å; F449-V837 HydrophobicContact CE1-CG2 4.25Å; F449-V837 HydrophobicContact CZ-CB 3.74Å; F449-V837 HydrophobicContact CZ-CG1 3.9Å; F449-V837 HydrophobicContact CZ-CG2 3.83Å; F449-T846 HydrophobicContact CE2-CG2 3.9Å; F449-L847 PolarHBondContact N-O 2.87Å; F449-A848 HydrophobicContact CB-CB 4.36Å; F449-A848 CarbonylContact O-C 3.56Å; F449-A848 VanDerWaalsContact O-CA 3.28Å; F449-A848 WeakPolarHBondContact O-CA 3.46Å; F449-I849 PolarHBondContact O-N 2.87Å; F449-M858 HydrophobicContact CB-SD 4.07Å
450	S	95.1	Very high	88.7	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	136.2	-178.4	-169.2	0	0	0	0	110.1	T455 W731 V732 L733	S450-T455 WeakPolarHBondContact OG-CG2 3.47Å; S450-W731 PolarHBondContact N-O 3.36Å; S450-V732 WeakPolarHBondContact O-CA 3Å; S450-L733 PolarHBondContact O-N 3.15Å
451	D	91.5	Very high	88.4	Confident	10 Å²	10	18.9 Å²	18.9	5%	0.053	9%	0.091	C	C	.	.			trans	-72.9	165.1	156.7	-170.1	53	0	0	0	110.9	T453 T455 L456 K830 I849 D855	D451-T453 PolarHBondContact OD2-N 2.68Å; D451-T455 WeakPolarHBondContact O-CB 3.5Å; D451-T455 WeakPolarHBondContact O-CG2 3.49Å; D451-L456 WeakPolarHBondContact O-CG 3.25Å; D451-K830 VanDerWaalsContact CG-NZ 3.3Å; D451-K830 IonicContact OD1-NZ 3.29Å; D451-K830 PolarHBondContact OD1-NZ 3.09Å; D451-I849 PolarHBondContact N-O 3.44Å; D451-I849 VanDerWaalsContact N-O 3.09Å; D451-D855 WeakPolarHBondContact CB-OD2 3.35Å
452	K	87.8	Confident	88	Confident	6 Å²	6	21 Å²	21	3%	0.026	10%	0.101	C	C	.	.	S	Bend	trans	-95.9	-54.8	179.9	-172.3	-138.9	117.9	166.5	0	112	L456 T457 D710 V732 D736 I744	K452-L456 PolarHBondContact O-N 3.47Å; K452-T457 PolarHBondContact O-N 3.02Å; K452-T457 PolarHBondContact O-OG1 2.91Å; K452-D710 WeakPolarHBondContact CE-OD2 3.27Å; K452-D710 IonicContact NZ-OD2 3.68Å; K452-D710 PolarHBondContact NZ-OD2 3.3Å; K452-V732 HydrophobicContact CB-CG1 4.41Å; K452-D736 WeakPolarHBondContact CD-OD2 3.44Å; K452-D736 VanDerWaalsContact CE-OD2 3.28Å; K452-D736 WeakPolarHBondContact CE-OD2 3.45Å; K452-D736 IonicContact NZ-OD2 3.8Å; K452-D736 PolarHBondContact NZ-OD2 3.44Å; K452-I744 HydrophobicContact CD-CD1 3.39Å; K452-I744 HydrophobicContact CG-CD1 4.1Å; K452-I744 HydrophobicContact CG-CG2 4.23Å
453	T	83	Confident	87.8	Confident	33 Å²	33	21.3 Å²	21.3	20%	0.202	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	137.7	-169.6	-49.4	0	0	0	0	109.2	D451 T455 N459 E872	D451-T453 PolarHBondContact OD2-N 2.68Å; T453-T455 PolarHBondContact O-N 3.27Å; T453-N459 HydrophobicContact CG2-CB 4.12Å; T453-E872 VanDerWaalsContact CG2-OE1 3.28Å; T453-E872 WeakPolarHBondContact CG2-OE1 3.39Å
454	G	80.6	Confident	87.6	Confident	4 Å²	4	22 Å²	22	4%	0.041	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.9	-19.3	-172.4	0	0	0	0	0	114.8	T457 Q713	G454-T457 CarbonylContact C-O 3.16Å; G454-T457 VanDerWaalsContact C-O 3.26Å; G454-T457 WeakPolarHBondContact CA-O 3.46Å; G454-T457 PolarHBondContact N-O 3.01Å; G454-Q713 PolarHBondContact O-NE2 3.5Å
455	T	89	Confident	87.5	Confident	0 Å²	0	23 Å²	23	0%	0	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-61.3	-175.7	-58.3	0	0	0	0	112.9	S450 D451 T453 Q713 I849 G850 D851 I868 F887	S450-T455 WeakPolarHBondContact OG-CG2 3.47Å; D451-T455 WeakPolarHBondContact O-CB 3.5Å; D451-T455 WeakPolarHBondContact O-CG2 3.49Å; T453-T455 PolarHBondContact O-N 3.27Å; T455-Q713 PolarHBondContact O-NE2 2.85Å; T455-Q713 PolarHBondContact O-OE1 3.12Å; T455-I849 HydrophobicContact CG2-CG1 4.17Å; T455-I849 HydrophobicContact CG2-CG2 4.25Å; T455-G850 WeakPolarHBondContact OG1-CA 3.05Å; T455-D851 PolarHBondContact OG1-N 3.22Å; T455-I868 HydrophobicContact CG2-CD1 3.77Å; T455-F887 HydrophobicContact CG2-CD2 4.09Å; T455-F887 WeakPolarHBondContact O-CB 3.38Å
456	L	90.8	Very high	87.4	Confident	3 Å²	3	23 Å²	23	2%	0.016	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-32.6	175.4	-61.3	178.6	0	0	0	111	D451 K452 Q713 V716 I720 V732 F887	D451-L456 WeakPolarHBondContact O-CG 3.25Å; K452-L456 PolarHBondContact O-N 3.47Å; L456-Q713 PolarHBondContact O-N 2.9Å; L456-V716 HydrophobicContact CB-CG1 4.45Å; L456-V716 HydrophobicContact CD2-CG1 3.86Å; L456-I720 HydrophobicContact CD2-CD1 4.13Å; L456-V732 HydrophobicContact CD1-CG1 4.35Å; L456-V732 HydrophobicContact CD1-CG2 4.16Å; L456-F887 HydrophobicContact CD2-CD1 4.19Å; L456-F887 HydrophobicContact CD2-CD2 3.75Å; L456-F887 HydrophobicContact CD2-CE1 4.07Å; L456-F887 HydrophobicContact CD2-CE2 3.6Å; L456-F887 HydrophobicContact CD2-CG 4.05Å; L456-F887 HydrophobicContact CD2-CZ 3.77Å
457	T	87.4	Confident	87.3	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	160.2	174.3	68.3	0	0	0	0	111.5	K452 G454 N459 D710 K711 L712	K452-T457 PolarHBondContact O-N 3.02Å; K452-T457 PolarHBondContact O-OG1 2.91Å; G454-T457 CarbonylContact C-O 3.16Å; G454-T457 VanDerWaalsContact C-O 3.26Å; G454-T457 WeakPolarHBondContact CA-O 3.46Å; G454-T457 PolarHBondContact N-O 3.01Å; T457-N459 VanDerWaalsContact C-N 3.28Å; T457-D710 WeakPolarHBondContact CB-OD1 3.15Å; T457-D710 WeakPolarHBondContact CG2-OD2 3.2Å; T457-D710 PolarHBondContact OG1-OD1 3.4Å; T457-D710 PolarHBondContact OG1-OD2 2.87Å; T457-K711 CarbonylContact C-O 3.57Å; T457-K711 WeakPolarHBondContact CA-O 3.43Å; T457-L712 HydrophobicContact CG2-CD2 4.02Å
458	R	79.6	Confident	87.2	Confident	83 Å²	83	18.5 Å²	18.5	31%	0.313	9%	0.092	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	-6.1	176.4	-70.2	179.9	168.8	-164.5	-6.2	112.9	V460 K711 Q713 T714	R458-V460 HydrophobicContact CB-CB 4.47Å; R458-V460 HydrophobicContact CB-CG2 4.35Å; R458-V460 PolarHBondContact O-N 2.72Å; R458-K711 PolarHBondContact N-O 2.92Å; R458-Q713 HydrophobicContact CG-CB 4.36Å; R458-Q713 HydrophobicContact CG-CG 3.89Å; R458-T714 PolarHBondContact NH2-OG1 2.62Å; R458-T714 VanDerWaalsContact NH2-OG1 3.17Å
459	N	75.6	Confident	86.7	Confident	34 Å²	34	19.3 Å²	19.3	18%	0.182	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	54.7	35.1	-170.4	-163.5	16.2	0	0	0	112.4	T187 T453 T457	T187-N459 PolarHBondContact OG1-ND2 3.1Å; T453-N459 HydrophobicContact CG2-CB 4.12Å; T457-N459 VanDerWaalsContact C-N 3.28Å
460	V	76.1	Confident	86.1	Confident	81 Å²	81	20.2 Å²	20.2	49%	0.491	11%	0.109	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	113.4	176.5	178.5	0	0	0	0	108.1	R458 K711	R458-V460 HydrophobicContact CB-CB 4.47Å; R458-V460 HydrophobicContact CB-CG2 4.35Å; R458-V460 PolarHBondContact O-N 2.72Å; V460-K711 PolarHBondContact O-N 3.38Å
461	M	80.5	Confident	85.8	Confident	31 Å²	31	24 Å²	24	15%	0.153	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	121	178.5	-63.6	-64.1	167.3	0	0	109.8	P555 A559 I708 E709 D710	M461-P555 HydrophobicContact CB-CB 4.31Å; M461-P555 HydrophobicContact CG-CB 3.82Å; M461-P555 HydrophobicContact CG-CG 3.95Å; M461-A559 HydrophobicContact CB-CB 4.06Å; M461-A559 VanDerWaalsContact O-CB 3.27Å; M461-A559 WeakPolarHBondContact O-CB 3.46Å; M461-I708 HydrophobicContact CB-CG2 3.74Å; M461-I708 HydrophobicContact CG-CG2 4.42Å; M461-I708 HydrophobicContact SD-CG2 4.2Å; M461-E709 WeakPolarHBondContact CA-O 3.41Å; M461-D710 HydrophobicContact CE-CB 4.02Å; M461-D710 HydrophobicContact SD-CB 3.98Å
462	E	83	Confident	85.7	Confident	46 Å²	46	24.9 Å²	24.9	22%	0.215	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	131.7	-179.4	-168.1	176.1	166.2	0	0	109.9	K464 N481 I708 E709 K711	E462-K464 PolarHBondContact O-N 3.21Å; E462-N481 PolarHBondContact OE1-ND2 2.76Å; E462-I708 CarbonylContact O-C 3.49Å; E462-I708 WeakPolarHBondContact O-CA 3.48Å; E462-E709 PolarHBondContact N-O 3.41Å; E462-E709 PolarHBondContact O-N 2.89Å; E462-K711 IonicContact OE2-NZ 2.76Å; E462-K711 PolarHBondContact OE2-NZ 3.15Å
463	F	87.8	Confident	85.7	Confident	7 Å²	7	24.7 Å²	24.7	3%	0.031	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	109.2	174.1	-177.6	-88.6	0	0	0	109.5	C466 A482 L483 L560 A563 T706	F463-C466 HydrophobicContact CE1-CB 4.18Å; F463-C466 HydrophobicContact CE2-CB 4.39Å; F463-C466 HydrophobicContact CZ-CB 3.55Å; F463-A482 HydrophobicContact CE1-CB 4.17Å; F463-L483 HydrophobicContact CD1-CD1 4.49Å; F463-L483 HydrophobicContact CD1-CD2 4.25Å; F463-L483 HydrophobicContact CD1-CG 4.12Å; F463-L483 HydrophobicContact CE1-CD2 4.39Å; F463-L560 HydrophobicContact CD2-CD2 3.89Å; F463-L560 HydrophobicContact CE2-CD2 4.09Å; F463-A563 HydrophobicContact CB-CB 3.71Å; F463-A563 HydrophobicContact CD1-CB 4.06Å; F463-A563 HydrophobicContact CD2-CB 4.12Å; F463-A563 HydrophobicContact CG-CB 3.72Å; F463-T706 HydrophobicContact CE2-CG2 3.73Å
464	K	85.6	Confident	85.6	Confident	14 Å²	14	23.2 Å²	23.2	6%	0.061	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	-54.3	-173.6	-88.3	-78.1	169.6	-162.9	0	112.8	E462 D479 N481 A482 L653 A707 E709	E462-K464 PolarHBondContact O-N 3.21Å; K464-D479 PolarHBondContact NZ-O 3.27Å; K464-D479 VanDerWaalsContact NZ-O 3.07Å; K464-N481 WeakPolarHBondContact CD-OD1 3.28Å; K464-N481 WeakPolarHBondContact CE-OD1 3.37Å; K464-N481 PolarHBondContact NZ-OD1 3.06Å; K464-A482 VanDerWaalsContact O-CB 3.32Å; K464-A482 WeakPolarHBondContact O-CB 2.95Å; K464-A482 PolarHBondContact O-N 3.06Å; K464-L653 HydrophobicContact CB-CD1 4.37Å; K464-L653 HydrophobicContact CB-CD2 4.15Å; K464-L653 HydrophobicContact CG-CD2 4.44Å; K464-A707 PolarHBondContact N-O 2.98Å; K464-E709 HydrophobicContact CB-CB 4.33Å; K464-E709 WeakPolarHBondContact CE-OE2 3.19Å; K464-E709 HydrophobicContact CG-CB 3.58Å; K464-E709 WeakPolarHBondContact CG-OE2 3.42Å
465	R	89.3	Confident	85.2	Confident	35 Å²	35	27.2 Å²	27.2	13%	0.132	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	159.7	-175	-61.7	-175	-178.5	153.2	3.3	111.7	G474 F648 L653 A707	R465-G474 PolarHBondContact NE-O 3.05Å; R465-F648 HydrophobicContact CB-CD1 4.14Å; R465-F648 HydrophobicContact CB-CE1 3.61Å; R465-F648 HydrophobicContact CB-CZ 4.02Å; R465-F648 HydrophobicContact CG-CE1 4.37Å; R465-L653 HydrophobicContact CB-CD1 4.2Å; R465-L653 HydrophobicContact CG-CD1 4.06Å; R465-A707 HydrophobicContact CB-CB 3.98Å; R465-A707 PolarHBondContact N-O 3.43Å; R465-A707 VanDerWaalsContact N-O 3.16Å; R465-A707 WeakPolarHBondContact O-CA 3.39Å; R465-A707 WeakPolarHBondContact O-CB 3.23Å; R465-A707 PolarHBondContact O-N 3.23Å
466	C	91.5	Very high	84.2	Confident	0 Å²	0	30 Å²	30	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	155.3	168.3	59.1	0	0	0	0	111.7	F463 Y473 F502 A705	F463-C466 HydrophobicContact CE1-CB 4.18Å; F463-C466 HydrophobicContact CE2-CB 4.39Å; F463-C466 HydrophobicContact CZ-CB 3.55Å; C466-Y473 PolarHBondContact N-O 3.46Å; C466-Y473 PolarHBondContact O-N 3.27Å; C466-F502 HydrophobicContact CB-CE1 4.32Å; C466-F502 HydrophobicContact CB-CZ 4.2Å; C466-A705 CarbonylContact C-O 3.53Å; C466-A705 VanDerWaalsContact CA-O 3.29Å; C466-A705 WeakPolarHBondContact CA-O 3.49Å; C466-A705 WeakPolarHBondContact CB-O 3.36Å
467	S	92	Very high	82.8	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	124.5	167	177.8	0	0	0	0	107.2	I471 H644 G704 A705	S467-I471 CarbonylContact C-O 3.49Å; S467-I471 VanDerWaalsContact CA-O 3.32Å; S467-I471 WeakPolarHBondContact CA-O 3.29Å; S467-H644 PolarHBondContact OG-ND1 3.39Å; S467-G704 CarbonylContact O-C 3.5Å; S467-G704 WeakPolarHBondContact O-CA 3.31Å; S467-A705 PolarHBondContact N-O 2.84Å; S467-A705 PolarHBondContact O-N 3.4Å
468	I	92	Very high	81.4	Confident	2 Å²	2	43.2 Å²	43.2	1%	0.01	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	122.9	174.9	-48.1	173.7	0	0	0	108.2	G470 I471 Y473 L488 L498 V499 F502 F503	I468-G470 VanDerWaalsContact C-N 3.26Å; I468-G470 PolarHBondContact O-N 3.4Å; I468-I471 PolarHBondContact N-O 3.41Å; I468-I471 PolarHBondContact O-N 2.92Å; I468-I471 VanDerWaalsContact O-N 3.13Å; I468-Y473 HydrophobicContact CB-CD2 4.5Å; I468-Y473 HydrophobicContact CB-CE2 3.83Å; I468-Y473 HydrophobicContact CD1-CD2 4.43Å; I468-Y473 HydrophobicContact CD1-CE2 4.26Å; I468-Y473 HydrophobicContact CG1-CD2 4.3Å; I468-Y473 HydrophobicContact CG1-CE2 4.08Å; I468-L488 HydrophobicContact CD1-CD1 3.89Å; I468-L498 HydrophobicContact CG2-CB 4.42Å; I468-V499 HydrophobicContact CD1-CG1 4.39Å; I468-V499 HydrophobicContact CG2-CG2 4.16Å; I468-F502 HydrophobicContact CD1-CB 4.34Å; I468-F502 HydrophobicContact CD1-CD1 3.54Å; I468-F502 HydrophobicContact CD1-CE1 3.87Å; I468-F502 HydrophobicContact CD1-CG 3.94Å; I468-F502 HydrophobicContact CG1-CD1 3.89Å; I468-F502 HydrophobicContact CG1-CD2 4.14Å; I468-F502 HydrophobicContact CG1-CE1 3.97Å; I468-F502 HydrophobicContact CG1-CE2 4.22Å; I468-F502 HydrophobicContact CG1-CG 3.96Å; I468-F502 HydrophobicContact CG1-CZ 4.11Å; I468-F502 HydrophobicContact CG2-CB 4.12Å; I468-F502 HydrophobicContact CG2-CD2 4.48Å; I468-F502 HydrophobicContact CG2-CG 4.3Å; I468-F503 HydrophobicContact CD1-CE2 4.29Å
469	G	86.5	Confident	80.5	Confident	16 Å²	16	45.6 Å²	45.6	17%	0.165	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	33.8	178.7	0	0	0	0	0	113.9	I471 L703	G469-I471 VanDerWaalsContact C-N 3.33Å; G469-I471 PolarHBondContact O-N 3.44Å; G469-L703 PolarHBondContact N-O 3.35Å
470	G	84.5	Confident	79.9	Confident	20 Å²	20	45.3 Å²	45.3	21%	0.206	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.9	12.4	-177.8	0	0	0	0	0	115.3	I468 S640 H644	I468-G470 VanDerWaalsContact C-N 3.26Å; I468-G470 PolarHBondContact O-N 3.4Å; G470-S640 WeakPolarHBondContact CA-OG 3.5Å; G470-H644 PolarHBondContact O-CE1 2.86Å; G470-H644 VanDerWaalsContact O-CE1 3.23Å
471	I	88.5	Confident	79.8	Confident	78 Å²	78	42.4 Å²	42.4	40%	0.4	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	132.1	174.3	-65.9	163.3	0	0	0	109.3	S467 I468 G469 Y473	S467-I471 CarbonylContact C-O 3.49Å; S467-I471 VanDerWaalsContact CA-O 3.32Å; S467-I471 WeakPolarHBondContact CA-O 3.29Å; I468-I471 PolarHBondContact N-O 3.41Å; I468-I471 PolarHBondContact O-N 2.92Å; I468-I471 VanDerWaalsContact O-N 3.13Å; G469-I471 VanDerWaalsContact C-N 3.33Å; G469-I471 PolarHBondContact O-N 3.44Å; I471-Y473 HydrophobicContact CB-CE2 4.18Å; I471-Y473 HydrophobicContact CG2-CE1 3.95Å; I471-Y473 HydrophobicContact CG2-CE2 4.01Å; I471-Y473 WeakPolarHBondContact O-CD2 3.33Å; I471-Y473 WeakPolarHBondContact O-CE2 3.18Å
472	M	88	Confident	79.6	Confident	29 Å²	29	40.9 Å²	40.9	14%	0.143	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	128.7	178.7	-169.3	180	-57.2	0	0	110.4	N475 H644 N647 F648	M472-N475 WeakPolarHBondContact CG-ND2 3.32Å; M472-N475 WeakPolarHBondContact CG-OD1 3.15Å; M472-N475 VanDerWaalsContact SD-CG 3.52Å; M472-N475 PolarHBondContact SD-ND2 2.95Å; M472-N475 PolarHBondContact SD-OD1 2.97Å; M472-H644 HydrophobicContact CE-CB 3.63Å; M472-H644 WeakPolarHBondContact CE-CD2 3.47Å; M472-N647 HydrophobicContact CE-CB 4.13Å; M472-F648 HydrophobicContact CE-CE1 4.17Å; M472-F648 HydrophobicContact CE-CZ 4.49Å; M472-F648 HydrophobicContact CG-CE1 3.66Å; M472-F648 HydrophobicContact CG-CZ 3.78Å; M472-F648 HydrophobicContact SD-CD1 4.49Å; M472-F648 HydrophobicContact SD-CE1 3.69Å; M472-F648 HydrophobicContact SD-CZ 4.3Å
473	Y	88.8	Confident	79.2	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.008	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	146.6	176.9	-55.7	-84.9	0	0	0	110.6	C466 I468 I471 N487 L488 K491	C466-Y473 PolarHBondContact N-O 3.46Å; C466-Y473 PolarHBondContact O-N 3.27Å; I468-Y473 HydrophobicContact CB-CD2 4.5Å; I468-Y473 HydrophobicContact CB-CE2 3.83Å; I468-Y473 HydrophobicContact CD1-CD2 4.43Å; I468-Y473 HydrophobicContact CD1-CE2 4.26Å; I468-Y473 HydrophobicContact CG1-CD2 4.3Å; I468-Y473 HydrophobicContact CG1-CE2 4.08Å; I471-Y473 HydrophobicContact CB-CE2 4.18Å; I471-Y473 HydrophobicContact CG2-CE1 3.95Å; I471-Y473 HydrophobicContact CG2-CE2 4.01Å; I471-Y473 WeakPolarHBondContact O-CD2 3.33Å; I471-Y473 WeakPolarHBondContact O-CE2 3.18Å; Y473-N487 HydrophobicContact CE1-CB 4.41Å; Y473-L488 HydrophobicContact CD1-CB 3.65Å; Y473-L488 HydrophobicContact CD1-CD1 4.08Å; Y473-L488 HydrophobicContact CD1-CG 4.37Å; Y473-L488 HydrophobicContact CD2-CD1 4.12Å; Y473-L488 HydrophobicContact CE1-CB 4.02Å; Y473-L488 HydrophobicContact CE1-CD1 4.01Å; Y473-L488 HydrophobicContact CE2-CD1 4.09Å; Y473-L488 HydrophobicContact CG-CB 4.17Å; Y473-L488 HydrophobicContact CG-CD1 4.12Å; Y473-K491 HydrophobicContact CE1-CD 4.36Å; Y473-K491 WeakPolarHBondContact OH-CD 3.39Å; Y473-K491 WeakPolarHBondContact OH-CE 3.32Å; Y473-K491 PolarHBondContact OH-NZ 3.33Å
474	G	81.1	Confident	78.6	Confident	2 Å²	2	46.3 Å²	46.3	2%	0.021	26%	0.261	C	S	.	.			trans	88.7	28.1	-177.6	0	0	0	0	0	115	R465 D485	R465-G474 PolarHBondContact NE-O 3.05Å; G474-D485 PolarHBondContact N-OD2 3.31Å
475	N	72.6	Confident	78.3	Confident	88 Å²	88	47.1 Å²	47.1	47%	0.471	27%	0.266	S	S	.	.			trans	-91	19.1	-178	-79.6	-4	0	0	0	115.1	M472	M472-N475 WeakPolarHBondContact CG-ND2 3.32Å; M472-N475 WeakPolarHBondContact CG-OD1 3.15Å; M472-N475 VanDerWaalsContact SD-CG 3.52Å; M472-N475 PolarHBondContact SD-ND2 2.95Å; M472-N475 PolarHBondContact SD-OD1 2.97Å
476	G	66.5	Low	77.8	Confident	58 Å²	58	51.3 Å²	51.3	60%	0.598	29%	0.287	S	S	*	.	S	Bend	trans	-72.9	-124.1	179.9	0	0	0	0	0	113.1	S480	G476-S480 WeakPolarHBondContact CA-OG 3.42Å
477	T	61.8	Low	77.3	Confident	96 Å²	96	56.4 Å²	56.4	59%	0.589	31%	0.314	S	S	*	.	S	Bend	trans	-70.2	165.6	168.6	53.9	0	0	0	0	111.5	D479 S480	T477-D479 PolarHBondContact O-N 3.13Å; T477-D479 VanDerWaalsContact O-N 3.1Å; T477-S480 PolarHBondContact N-OG 3.26Å; T477-S480 VanDerWaalsContact O-CB 3.23Å; T477-S480 WeakPolarHBondContact O-CB 3.45Å; T477-S480 PolarHBondContact O-N 2.75Å; T477-S480 PolarHBondContact O-OG 3.01Å; T477-S480 PolarHBondContact OG1-OG 3.13Å
478	E	58.5	Low	76.8	Confident	185 Å²	185	56.4 Å²	56.4	86%	0.864	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-31	175.5	-68.9	-178	166.2	0	0	112.6
479	D	60.5	Low	76.3	Confident	133 Å²	133	58.6 Å²	58.6	71%	0.711	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-7.4	177	-70.5	-36.9	0	0	0	114.7	K464 T477 N481	K464-D479 PolarHBondContact NZ-O 3.27Å; K464-D479 VanDerWaalsContact NZ-O 3.07Å; T477-D479 PolarHBondContact O-N 3.13Å; T477-D479 VanDerWaalsContact O-N 3.1Å; D479-N481 PolarHBondContact O-N 3.16Å
480	S	63.3	Low	76.1	Confident	28 Å²	28	62.1 Å²	62.1	20%	0.196	34%	0.34	C	S	.	.			trans	-64.2	126.1	-173.9	-69.3	0	0	0	0	112.5	G476 T477	G476-S480 WeakPolarHBondContact CA-OG 3.42Å; T477-S480 PolarHBondContact N-OG 3.26Å; T477-S480 VanDerWaalsContact O-CB 3.23Å; T477-S480 WeakPolarHBondContact O-CB 3.45Å; T477-S480 PolarHBondContact O-N 2.75Å; T477-S480 PolarHBondContact O-OG 3.01Å; T477-S480 PolarHBondContact OG1-OG 3.13Å
481	N	74.5	Confident	76	Confident	20 Å²	20	63.9 Å²	63.9	11%	0.107	34%	0.343	C	S	.	.			trans	-92.1	135.7	174.5	-80.6	-22.8	0	0	0	110.4	E462 K464 D479 L483 E484 D485	E462-N481 PolarHBondContact OE1-ND2 2.76Å; K464-N481 WeakPolarHBondContact CD-OD1 3.28Å; K464-N481 WeakPolarHBondContact CE-OD1 3.37Å; K464-N481 PolarHBondContact NZ-OD1 3.06Å; D479-N481 PolarHBondContact O-N 3.16Å; N481-L483 PolarHBondContact O-N 3.15Å; N481-L483 VanDerWaalsContact O-N 3.16Å; N481-E484 HydrophobicContact CB-CG 4.2Å; N481-E484 PolarHBondContact O-N 3.3Å; N481-D485 PolarHBondContact O-N 3.43Å
482	A	74.9	Confident	75.7	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-59.2	-26.2	173.8	0	0	0	0	0	112.7	F463 K464 E484 D485 L488	F463-A482 HydrophobicContact CE1-CB 4.17Å; K464-A482 VanDerWaalsContact O-CB 3.32Å; K464-A482 WeakPolarHBondContact O-CB 2.95Å; K464-A482 PolarHBondContact O-N 3.06Å; A482-E484 PolarHBondContact O-N 3.04Å; A482-D485 WeakPolarHBondContact O-CB 3.5Å; A482-D485 PolarHBondContact O-N 3.43Å; A482-L488 VanDerWaalsContact O-CD2 3.31Å; A482-L488 WeakPolarHBondContact O-CD2 3.29Å
483	L	74.4	Confident	75.3	Confident	34 Å²	34	65.4 Å²	65.4	18%	0.178	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-67.3	-23.5	175	-61.2	173.8	0	0	0	113	F463 N481 A563 T566 M567	F463-L483 HydrophobicContact CD1-CD1 4.49Å; F463-L483 HydrophobicContact CD1-CD2 4.25Å; F463-L483 HydrophobicContact CD1-CG 4.12Å; F463-L483 HydrophobicContact CE1-CD2 4.39Å; N481-L483 PolarHBondContact O-N 3.15Å; N481-L483 VanDerWaalsContact O-N 3.16Å; L483-A563 HydrophobicContact CD1-CB 4.32Å; L483-A563 HydrophobicContact CD2-CB 4.23Å; L483-T566 HydrophobicContact CD1-CG2 4.35Å; L483-M567 HydrophobicContact CD2-CG 3.52Å; L483-M567 HydrophobicContact CD2-SD 3.66Å
484	E	75.3	Confident	75	Confident	133 Å²	133	69.4 Å²	69.4	62%	0.621	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-95.9	-4.7	178	-64.5	170.7	-160.5	0	0	112.1	N481 A482 Q486	N481-E484 HydrophobicContact CB-CG 4.2Å; N481-E484 PolarHBondContact O-N 3.3Å; A482-E484 PolarHBondContact O-N 3.04Å; E484-Q486 PolarHBondContact O-N 2.85Å; E484-Q486 VanDerWaalsContact O-N 3.15Å
485	D	79.4	Confident	74.9	Confident	31 Å²	31	71 Å²	71	17%	0.166	40%	0.402	C	S	.	.			trans	-69.9	111.4	-178.3	-166	-25.2	0	0	0	110.5	G474 N481 A482 N487 L488 I489	G474-D485 PolarHBondContact N-OD2 3.31Å; N481-D485 PolarHBondContact O-N 3.43Å; A482-D485 WeakPolarHBondContact O-CB 3.5Å; A482-D485 PolarHBondContact O-N 3.43Å; D485-N487 PolarHBondContact O-N 2.82Å; D485-N487 VanDerWaalsContact O-N 3.12Å; D485-N487 WeakPolarHBondContact OD1-CB 3.44Å; D485-N487 PolarHBondContact OD1-N 2.94Å; D485-N487 PolarHBondContact OD1-ND2 3.21Å; D485-L488 HydrophobicContact CB-CB 4.34Å; D485-L488 WeakPolarHBondContact O-CB 3.42Å; D485-L488 PolarHBondContact O-N 3.15Å; D485-I489 PolarHBondContact O-N 3.35Å; D485-I489 VanDerWaalsContact O-N 3.16Å
486	Q	78.8	Confident	75.5	Confident	123 Å²	123	69.1 Å²	69.1	58%	0.575	39%	0.392	S	S	*	.	H	α-helix	trans	-55.1	-31.6	179.2	-71.6	-70.3	-17.3	0	0	112.4	E484 I489 N490	E484-Q486 PolarHBondContact O-N 2.85Å; E484-Q486 VanDerWaalsContact O-N 3.15Å; Q486-I489 PolarHBondContact O-N 2.94Å; Q486-N490 VanDerWaalsContact O-CB 3.24Å; Q486-N490 WeakPolarHBondContact O-CB 3.45Å; Q486-N490 PolarHBondContact O-N 2.92Å; Q486-N490 PolarHBondContact O-ND2 2.79Å; Q486-N490 VanDerWaalsContact O-ND2 3.1Å
487	N	80.6	Confident	76.4	Confident	106 Å²	106	71.9 Å²	71.9	57%	0.567	39%	0.392	S	S	*	.	H	α-helix	trans	-67.2	-38.3	178.8	-66.2	-42.9	0	0	0	112.2	Y473 D485 K491	Y473-N487 HydrophobicContact CE1-CB 4.41Å; D485-N487 PolarHBondContact O-N 2.82Å; D485-N487 VanDerWaalsContact O-N 3.12Å; D485-N487 WeakPolarHBondContact OD1-CB 3.44Å; D485-N487 PolarHBondContact OD1-N 2.94Å; D485-N487 PolarHBondContact OD1-ND2 3.21Å; N487-K491 WeakPolarHBondContact O-CG 3.37Å; N487-K491 PolarHBondContact O-N 3.4Å; N487-K491 VanDerWaalsContact O-N 3.07Å
488	L	83	Confident	77.7	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-69	-45.8	177.4	-175.3	62.5	0	0	0	110.6	I468 Y473 A482 D485 N490 K491 L492 V499 F503 M567	I468-L488 HydrophobicContact CD1-CD1 3.89Å; Y473-L488 HydrophobicContact CD1-CB 3.65Å; Y473-L488 HydrophobicContact CD1-CD1 4.08Å; Y473-L488 HydrophobicContact CD1-CG 4.37Å; Y473-L488 HydrophobicContact CD2-CD1 4.12Å; Y473-L488 HydrophobicContact CE1-CB 4.02Å; Y473-L488 HydrophobicContact CE1-CD1 4.01Å; Y473-L488 HydrophobicContact CE2-CD1 4.09Å; Y473-L488 HydrophobicContact CG-CB 4.17Å; Y473-L488 HydrophobicContact CG-CD1 4.12Å; A482-L488 VanDerWaalsContact O-CD2 3.31Å; A482-L488 WeakPolarHBondContact O-CD2 3.29Å; D485-L488 HydrophobicContact CB-CB 4.34Å; D485-L488 WeakPolarHBondContact O-CB 3.42Å; D485-L488 PolarHBondContact O-N 3.15Å; L488-N490 VanDerWaalsContact C-N 3.31Å; L488-N490 PolarHBondContact O-N 3.18Å; L488-K491 PolarHBondContact O-N 2.88Å; L488-L492 WeakPolarHBondContact O-CB 3.49Å; L488-L492 PolarHBondContact O-N 3.43Å; L488-V499 HydrophobicContact CD1-CG1 3.95Å; L488-V499 HydrophobicContact CD1-CG2 4.49Å; L488-F503 HydrophobicContact CD1-CE2 4.32Å; L488-F503 HydrophobicContact CD2-CE2 4.33Å; L488-F503 HydrophobicContact CD2-CZ 4.09Å; L488-M567 HydrophobicContact CD2-CE 3.69Å; L488-M567 HydrophobicContact CG-CE 3.78Å
489	I	80.9	Confident	79.2	Confident	49 Å²	49	61 Å²	61	25%	0.251	34%	0.336	S	S	.	.	H	α-helix	trans	-60.2	-43	177	-62.3	169	0	0	0	110.3	D485 Q486 K491 L492 N493	D485-I489 PolarHBondContact O-N 3.35Å; D485-I489 VanDerWaalsContact O-N 3.16Å; Q486-I489 PolarHBondContact O-N 2.94Å; I489-K491 PolarHBondContact O-N 3.04Å; I489-L492 WeakPolarHBondContact O-CB 3.28Å; I489-L492 PolarHBondContact O-N 3.08Å; I489-N493 WeakPolarHBondContact O-CB 3.48Å; I489-N493 VanDerWaalsContact O-CG 3.23Å; I489-N493 PolarHBondContact O-N 3.01Å; I489-N493 PolarHBondContact O-ND2 3.05Å
490	N	81.5	Confident	80.5	Confident	89 Å²	89	56 Å²	56	48%	0.476	31%	0.31	S	S	.	.	H	α-helix	trans	-63.3	-42.2	177.3	-73.4	-23.5	0	0	0	112.5	Q486 L488 N493 A494	Q486-N490 VanDerWaalsContact O-CB 3.24Å; Q486-N490 WeakPolarHBondContact O-CB 3.45Å; Q486-N490 PolarHBondContact O-N 2.92Å; Q486-N490 PolarHBondContact O-ND2 2.79Å; Q486-N490 VanDerWaalsContact O-ND2 3.1Å; L488-N490 VanDerWaalsContact C-N 3.31Å; L488-N490 PolarHBondContact O-N 3.18Å; N490-N493 PolarHBondContact O-N 2.66Å; N490-A494 WeakPolarHBondContact O-CB 3.34Å; N490-A494 PolarHBondContact O-N 2.81Å
491	K	83.4	Confident	81.8	Confident	58 Å²	58	57.2 Å²	57.2	25%	0.252	31%	0.312	S	S	.	.	H	α-helix	trans	-67.1	-36.8	175.1	-78.7	-175.8	169.9	-158.9	0	113.1	Y473 N487 L488 I489 A494 G495 D496 V499	Y473-K491 HydrophobicContact CE1-CD 4.36Å; Y473-K491 WeakPolarHBondContact OH-CD 3.39Å; Y473-K491 WeakPolarHBondContact OH-CE 3.32Å; Y473-K491 PolarHBondContact OH-NZ 3.33Å; N487-K491 WeakPolarHBondContact O-CG 3.37Å; N487-K491 PolarHBondContact O-N 3.4Å; N487-K491 VanDerWaalsContact O-N 3.07Å; L488-K491 PolarHBondContact O-N 2.88Å; I489-K491 PolarHBondContact O-N 3.04Å; K491-A494 PolarHBondContact O-N 2.92Å; K491-G495 PolarHBondContact O-N 3.27Å; K491-G495 VanDerWaalsContact O-N 3.14Å; K491-D496 HydrophobicContact CB-CB 4.25Å; K491-D496 IonicContact NZ-OD2 3.98Å; K491-D496 PolarHBondContact O-N 3.36Å; K491-D496 VanDerWaalsContact O-N 3.11Å; K491-V499 HydrophobicContact CB-CG2 4.32Å
492	L	81.9	Confident	82.6	Confident	20 Å²	20	56.3 Å²	56.3	11%	0.105	31%	0.307	C	S	.	.	H	α-helix	trans	-62	-49	173.5	-166	78.1	0	0	0	110.1	L488 I489 A494 G495 V499 F503 M567 Y569 R584	L488-L492 WeakPolarHBondContact O-CB 3.49Å; L488-L492 PolarHBondContact O-N 3.43Å; I489-L492 WeakPolarHBondContact O-CB 3.28Å; I489-L492 PolarHBondContact O-N 3.08Å; L492-A494 VanDerWaalsContact C-N 3.26Å; L492-A494 PolarHBondContact O-N 3.21Å; L492-G495 PolarHBondContact O-N 3.04Å; L492-V499 HydrophobicContact CD1-CG1 3.79Å; L492-F503 HydrophobicContact CD1-CD2 4.4Å; L492-M567 HydrophobicContact CD2-CE 4.2Å; L492-M567 WeakPolarHBondContact CD2-O 3.19Å; L492-Y569 HydrophobicContact CD1-CE2 3.82Å; L492-Y569 WeakPolarHBondContact CD1-OH 3.19Å; L492-R584 PolarHBondContact O-NH2 3.47Å
493	N	79.9	Confident	83.4	Confident	118 Å²	118	56.3 Å²	56.3	63%	0.631	31%	0.307	S	S	*	.	H	α-helix	trans	-62	-34.1	176.5	-69.8	-22.7	0	0	0	112.4	I489 N490 G495	I489-N493 WeakPolarHBondContact O-CB 3.48Å; I489-N493 VanDerWaalsContact O-CG 3.23Å; I489-N493 PolarHBondContact O-N 3.01Å; I489-N493 PolarHBondContact O-ND2 3.05Å; N490-N493 PolarHBondContact O-N 2.66Å; N493-G495 PolarHBondContact O-N 3.36Å
494	A	82.7	Confident	84.3	Confident	86 Å²	86	55.1 Å²	55.1	71%	0.711	30%	0.301	S	S	*	.	H	α-helix	trans	-71.3	-13.2	174.1	0	0	0	0	0	114	N490 K491 L492	N490-A494 WeakPolarHBondContact O-CB 3.34Å; N490-A494 PolarHBondContact O-N 2.81Å; K491-A494 PolarHBondContact O-N 2.92Å; L492-A494 VanDerWaalsContact C-N 3.26Å; L492-A494 PolarHBondContact O-N 3.21Å
495	G	78.2	Confident	85.1	Confident	36 Å²	36	49 Å²	49	37%	0.371	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.2	33	-179.6	0	0	0	0	0	114.2	K491 L492 N493 L497	K491-G495 PolarHBondContact O-N 3.27Å; K491-G495 VanDerWaalsContact O-N 3.14Å; L492-G495 PolarHBondContact O-N 3.04Å; N493-G495 PolarHBondContact O-N 3.36Å; G495-L497 PolarHBondContact O-N 2.82Å
496	D	85.1	Confident	85.7	Confident	49 Å²	49	47.8 Å²	47.8	26%	0.262	27%	0.266	S	S	.	.			trans	-58.6	120	176.1	-169.9	-9.5	0	0	0	110.9	K491 L498 V499 D500	K491-D496 HydrophobicContact CB-CB 4.25Å; K491-D496 IonicContact NZ-OD2 3.98Å; K491-D496 PolarHBondContact O-N 3.36Å; K491-D496 VanDerWaalsContact O-N 3.11Å; D496-L498 VanDerWaalsContact C-N 3.28Å; D496-L498 PolarHBondContact O-N 2.81Å; D496-L498 PolarHBondContact OD1-N 3.04Å; D496-V499 HydrophobicContact CB-CB 4.32Å; D496-V499 HydrophobicContact CB-CG2 4.04Å; D496-V499 PolarHBondContact O-N 2.81Å; D496-D500 PolarHBondContact O-N 3.23Å
497	L	86.4	Confident	86.3	Confident	115 Å²	115	41.9 Å²	41.9	60%	0.602	24%	0.239	S	C	*	.	H	α-helix	trans	-61.4	-36.3	-173.4	-169.4	74.5	0	0	0	111.9	G495 D500 Q501	G495-L497 PolarHBondContact O-N 2.82Å; L497-D500 PolarHBondContact O-N 3.14Å; L497-Q501 WeakPolarHBondContact O-CB 3.12Å; L497-Q501 VanDerWaalsContact O-CG 3.3Å; L497-Q501 WeakPolarHBondContact O-CG 3.45Å; L497-Q501 PolarHBondContact O-N 3.18Å
498	L	88.7	Confident	86.8	Confident	51 Å²	51	36.9 Å²	36.9	27%	0.267	21%	0.212	S	C	.	.	H	α-helix	trans	-67.8	-40	-179.6	-68.7	174.2	0	0	0	111.6	I468 D496 F502 F637 L703	I468-L498 HydrophobicContact CG2-CB 4.42Å; D496-L498 VanDerWaalsContact C-N 3.28Å; D496-L498 PolarHBondContact O-N 2.81Å; D496-L498 PolarHBondContact OD1-N 3.04Å; L498-F502 VanDerWaalsContact O-CB 3.31Å; L498-F502 WeakPolarHBondContact O-CB 3.46Å; L498-F502 PolarHBondContact O-N 2.74Å; L498-F637 HydrophobicContact CD1-CE2 4.02Å; L498-F637 HydrophobicContact CD1-CZ 4Å; L498-F637 HydrophobicContact CD2-CE2 4.45Å; L498-L703 HydrophobicContact CD2-CD2 3.85Å
499	V	88.6	Confident	87.2	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.006	21%	0.212	C	C	.	.	H	α-helix	trans	-70.3	-41.3	178.3	-177.7	0	0	0	0	110.2	I468 L488 K491 L492 D496 F502 F503	I468-V499 HydrophobicContact CD1-CG1 4.39Å; I468-V499 HydrophobicContact CG2-CG2 4.16Å; L488-V499 HydrophobicContact CD1-CG1 3.95Å; L488-V499 HydrophobicContact CD1-CG2 4.49Å; K491-V499 HydrophobicContact CB-CG2 4.32Å; L492-V499 HydrophobicContact CD1-CG1 3.79Å; D496-V499 HydrophobicContact CB-CB 4.32Å; D496-V499 HydrophobicContact CB-CG2 4.04Å; D496-V499 PolarHBondContact O-N 2.81Å; V499-F502 PolarHBondContact O-N 2.99Å; V499-F503 HydrophobicContact CG1-CD2 3.77Å; V499-F503 HydrophobicContact CG1-CE2 3.76Å; V499-F503 WeakPolarHBondContact O-CD2 3.4Å; V499-F503 PolarHBondContact O-N 2.84Å; V499-F503 VanDerWaalsContact O-N 3.11Å
500	D	89.3	Confident	87.5	Confident	30 Å²	30	34.6 Å²	34.6	16%	0.16	20%	0.2	C	C	.	.	H	α-helix	trans	-61.6	-45	175.9	-168.1	64	0	0	0	111.9	D496 L497 T504 Y569	D496-D500 PolarHBondContact O-N 3.23Å; L497-D500 PolarHBondContact O-N 3.14Å; D500-T504 WeakPolarHBondContact O-CB 3.39Å; D500-T504 PolarHBondContact O-N 3.35Å; D500-T504 PolarHBondContact O-OG1 3.06Å; D500-Y569 WeakPolarHBondContact CA-OH 3.37Å; D500-Y569 WeakPolarHBondContact OD1-CE1 3.47Å; D500-Y569 PolarHBondContact OD1-OH 3Å
501	Q	89.7	Confident	87.5	Confident	53 Å²	53	30.7 Å²	30.7	25%	0.248	18%	0.18	C	C	.	.	H	α-helix	trans	-63.7	-43.1	175.7	-75.9	-180	-8.9	0	0	112.2	L497 T504 I505 L703	L497-Q501 WeakPolarHBondContact O-CB 3.12Å; L497-Q501 VanDerWaalsContact O-CG 3.3Å; L497-Q501 WeakPolarHBondContact O-CG 3.45Å; L497-Q501 PolarHBondContact O-N 3.18Å; Q501-T504 PolarHBondContact O-N 2.78Å; Q501-I505 WeakPolarHBondContact O-CG1 3.16Å; Q501-I505 PolarHBondContact O-N 3.19Å; Q501-L703 HydrophobicContact CB-CD1 4.19Å; Q501-L703 HydrophobicContact CB-CD2 4.33Å
502	F	92.8	Very high	87.4	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-58.9	-53.1	179.6	-175.4	-95.2	0	0	0	112	C466 I468 L498 V499 T504 I505 L506 I658 L703 T706	C466-F502 HydrophobicContact CB-CE1 4.32Å; C466-F502 HydrophobicContact CB-CZ 4.2Å; I468-F502 HydrophobicContact CD1-CB 4.34Å; I468-F502 HydrophobicContact CD1-CD1 3.54Å; I468-F502 HydrophobicContact CD1-CE1 3.87Å; I468-F502 HydrophobicContact CD1-CG 3.94Å; I468-F502 HydrophobicContact CG1-CD1 3.89Å; I468-F502 HydrophobicContact CG1-CD2 4.14Å; I468-F502 HydrophobicContact CG1-CE1 3.97Å; I468-F502 HydrophobicContact CG1-CE2 4.22Å; I468-F502 HydrophobicContact CG1-CG 3.96Å; I468-F502 HydrophobicContact CG1-CZ 4.11Å; I468-F502 HydrophobicContact CG2-CB 4.12Å; I468-F502 HydrophobicContact CG2-CD2 4.48Å; I468-F502 HydrophobicContact CG2-CG 4.3Å; L498-F502 VanDerWaalsContact O-CB 3.31Å; L498-F502 WeakPolarHBondContact O-CB 3.46Å; L498-F502 PolarHBondContact O-N 2.74Å; V499-F502 PolarHBondContact O-N 2.99Å; F502-T504 VanDerWaalsContact C-N 3.35Å; F502-T504 PolarHBondContact O-N 3.14Å; F502-I505 PolarHBondContact O-N 2.88Å; F502-L506 HydrophobicContact CD1-CD1 4.08Å; F502-L506 HydrophobicContact CE1-CD1 3.71Å; F502-L506 HydrophobicContact CE1-CG 4.48Å; F502-L506 HydrophobicContact CZ-CD1 4.41Å; F502-L506 WeakPolarHBondContact O-CG 3.46Å; F502-L506 PolarHBondContact O-N 3.22Å; F502-L506 VanDerWaalsContact O-N 3.16Å; F502-I658 HydrophobicContact CD2-CB 4.19Å; F502-I658 HydrophobicContact CD2-CG1 4.37Å; F502-I658 HydrophobicContact CD2-CG2 4.33Å; F502-I658 HydrophobicContact CE2-CB 3.93Å; F502-I658 HydrophobicContact CE2-CG1 3.75Å; F502-I658 HydrophobicContact CZ-CG1 4.27Å; F502-L703 HydrophobicContact CD2-CB 4.24Å; F502-T706 HydrophobicContact CE1-CG2 4.19Å; F502-T706 HydrophobicContact CE2-CG2 4.38Å; F502-T706 HydrophobicContact CZ-CG2 3.55Å
503	F	91.7	Very high	87.1	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-70.2	-30.3	178.9	-76.3	-68.1	0	0	0	113.2	I468 L488 L492 V499 L506 A507 A564 M567 Y569	I468-F503 HydrophobicContact CD1-CE2 4.29Å; L488-F503 HydrophobicContact CD1-CE2 4.32Å; L488-F503 HydrophobicContact CD2-CE2 4.33Å; L488-F503 HydrophobicContact CD2-CZ 4.09Å; L492-F503 HydrophobicContact CD1-CD2 4.4Å; V499-F503 HydrophobicContact CG1-CD2 3.77Å; V499-F503 HydrophobicContact CG1-CE2 3.76Å; V499-F503 WeakPolarHBondContact O-CD2 3.4Å; V499-F503 PolarHBondContact O-N 2.84Å; V499-F503 VanDerWaalsContact O-N 3.11Å; F503-L506 HydrophobicContact CD1-CD1 4.16Å; F503-L506 HydrophobicContact CE1-CD1 4.43Å; F503-L506 PolarHBondContact O-N 3.19Å; F503-A507 WeakPolarHBondContact O-CB 3.21Å; F503-A507 PolarHBondContact O-N 3.1Å; F503-A564 HydrophobicContact CD1-CB 4.48Å; F503-M567 HydrophobicContact CD1-CB 4.24Å; F503-M567 HydrophobicContact CD1-CG 4.27Å; F503-M567 HydrophobicContact CE1-CB 4.12Å; F503-M567 HydrophobicContact CE1-CG 3.66Å; F503-M567 HydrophobicContact CE2-CB 4.47Å; F503-M567 HydrophobicContact CE2-CE 4.13Å; F503-M567 HydrophobicContact CE2-CG 4.23Å; F503-M567 HydrophobicContact CG-CB 4.48Å; F503-M567 HydrophobicContact CZ-CB 4.25Å; F503-M567 HydrophobicContact CZ-CE 4.1Å; F503-M567 HydrophobicContact CZ-CG 3.64Å; F503-Y569 HydrophobicContact CB-CD1 3.99Å; F503-Y569 HydrophobicContact CB-CD2 3.53Å; F503-Y569 HydrophobicContact CB-CE1 4.01Å; F503-Y569 HydrophobicContact CB-CE2 3.56Å; F503-Y569 HydrophobicContact CB-CG 3.8Å; F503-Y569 HydrophobicContact CD2-CE2 4.29Å; F503-Y569 HydrophobicContact CG-CD2 4.14Å; F503-Y569 HydrophobicContact CG-CE2 4.1Å
504	T	91.8	Very high	87.1	Confident	9 Å²	9	22.4 Å²	22.4	6%	0.055	14%	0.139	C	C	.	.	H	α-helix	trans	-61.5	-45.2	172.1	-63.3	0	0	0	0	111.3	D500 Q501 F502 L506 A507 V508 I583 Y590	D500-T504 WeakPolarHBondContact O-CB 3.39Å; D500-T504 PolarHBondContact O-N 3.35Å; D500-T504 PolarHBondContact O-OG1 3.06Å; Q501-T504 PolarHBondContact O-N 2.78Å; F502-T504 VanDerWaalsContact C-N 3.35Å; F502-T504 PolarHBondContact O-N 3.14Å; T504-L506 VanDerWaalsContact C-N 3.34Å; T504-L506 PolarHBondContact O-N 3.04Å; T504-A507 CarbonylContact O-C 3.54Å; T504-A507 PolarHBondContact O-N 2.86Å; T504-V508 HydrophobicContact CG2-CG2 4.33Å; T504-V508 WeakPolarHBondContact O-CB 3.46Å; T504-V508 WeakPolarHBondContact O-CG2 3.39Å; T504-V508 PolarHBondContact O-N 2.83Å; T504-I583 HydrophobicContact CG2-CD1 4.36Å; T504-Y590 HydrophobicContact CG2-CE1 4.28Å; T504-Y590 HydrophobicContact CG2-CE2 4.32Å; T504-Y590 WeakPolarHBondContact CG2-OH 3.37Å
505	I	92.7	Very high	86.5	Confident	6 Å²	6	20.8 Å²	20.8	3%	0.031	12%	0.117	C	C	.	.	H	α-helix	trans	-63.9	-41.1	177.6	-69.5	163.2	0	0	0	110.8	Q501 F502 A507 V508 C509 M619 I658 W660 L703	Q501-I505 WeakPolarHBondContact O-CG1 3.16Å; Q501-I505 PolarHBondContact O-N 3.19Å; F502-I505 PolarHBondContact O-N 2.88Å; I505-A507 VanDerWaalsContact C-N 3.25Å; I505-A507 PolarHBondContact O-N 3.21Å; I505-V508 PolarHBondContact O-N 3.19Å; I505-C509 HydrophobicContact CG2-CB 3.96Å; I505-C509 WeakPolarHBondContact O-CB 3.46Å; I505-C509 PolarHBondContact O-N 3.08Å; I505-M619 HydrophobicContact CG1-CB 4.21Å; I505-M619 HydrophobicContact CG1-CE 4.34Å; I505-M619 HydrophobicContact CG1-CG 3.9Å; I505-M619 HydrophobicContact CG1-SD 3.83Å; I505-M619 HydrophobicContact CG2-CB 4.1Å; I505-I658 HydrophobicContact CB-CG2 4.06Å; I505-I658 HydrophobicContact CD1-CG2 4.09Å; I505-I658 HydrophobicContact CG2-CG2 3.57Å; I505-W660 HydrophobicContact CD1-CB 3.92Å; I505-W660 HydrophobicContact CD1-CG 4.31Å; I505-L703 HydrophobicContact CD1-CD1 3.22Å
506	L	92	Very high	86	Confident	4 Å²	4	25.2 Å²	25.2	2%	0.021	12%	0.122	C	C	.	.	H	α-helix	trans	-61.2	-34.2	175.4	-65.9	-176.3	0	0	0	112.8	F502 F503 T504 H510 L560 A564 I658 T706	F502-L506 HydrophobicContact CD1-CD1 4.08Å; F502-L506 HydrophobicContact CE1-CD1 3.71Å; F502-L506 HydrophobicContact CE1-CG 4.48Å; F502-L506 HydrophobicContact CZ-CD1 4.41Å; F502-L506 WeakPolarHBondContact O-CG 3.46Å; F502-L506 PolarHBondContact O-N 3.22Å; F502-L506 VanDerWaalsContact O-N 3.16Å; F503-L506 HydrophobicContact CD1-CD1 4.16Å; F503-L506 HydrophobicContact CE1-CD1 4.43Å; F503-L506 PolarHBondContact O-N 3.19Å; T504-L506 VanDerWaalsContact C-N 3.34Å; T504-L506 PolarHBondContact O-N 3.04Å; L506-H510 PolarHBondContact O-CD2 3.49Å; L506-L560 HydrophobicContact CD1-CD2 4.4Å; L506-L560 HydrophobicContact CD2-CB 4.39Å; L506-L560 HydrophobicContact CD2-CD1 4.23Å; L506-L560 HydrophobicContact CD2-CD2 3.98Å; L506-L560 HydrophobicContact CD2-CG 4.43Å; L506-A564 HydrophobicContact CB-CB 4.3Å; L506-I658 HydrophobicContact CD2-CD1 3.71Å; L506-I658 HydrophobicContact CD2-CG1 4.13Å; L506-T706 HydrophobicContact CD1-CG2 4.25Å; L506-T706 HydrophobicContact CD2-CG2 4.08Å
507	A	91.5	Very high	84.6	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-84.9	-8.6	179.1	0	0	0	0	0	114.9	F503 T504 I505 H510 A564 V581	F503-A507 WeakPolarHBondContact O-CB 3.21Å; F503-A507 PolarHBondContact O-N 3.1Å; T504-A507 CarbonylContact O-C 3.54Å; T504-A507 PolarHBondContact O-N 2.86Å; I505-A507 VanDerWaalsContact C-N 3.25Å; I505-A507 PolarHBondContact O-N 3.21Å; A507-H510 PolarHBondContact O-NE2 3.44Å; A507-A564 HydrophobicContact CB-CB 4.13Å; A507-V581 HydrophobicContact CB-CG1 3.89Å; A507-V581 HydrophobicContact CB-CG2 4.34Å
508	V	91.6	Very high	83	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-116.9	-43	-178.5	175.8	0	0	0	0	111.8	T504 I505 H510 V581 Y590 V609 M619	T504-V508 HydrophobicContact CG2-CG2 4.33Å; T504-V508 WeakPolarHBondContact O-CB 3.46Å; T504-V508 WeakPolarHBondContact O-CG2 3.39Å; T504-V508 PolarHBondContact O-N 2.83Å; I505-V508 PolarHBondContact O-N 3.19Å; V508-H510 VanDerWaalsContact C-N 3.33Å; V508-H510 PolarHBondContact O-N 3.49Å; V508-V581 HydrophobicContact CG2-CG2 3.88Å; V508-Y590 HydrophobicContact CG1-CG 4.45Å; V508-Y590 HydrophobicContact CG2-CD1 4.48Å; V508-Y590 HydrophobicContact CG2-CD2 3.8Å; V508-Y590 HydrophobicContact CG2-CE2 4.02Å; V508-Y590 HydrophobicContact CG2-CG 4.05Å; V508-V609 HydrophobicContact CG1-CG1 3.93Å; V508-M619 HydrophobicContact CB-SD 4.14Å; V508-M619 HydrophobicContact CG1-SD 4.01Å
509	C	90.8	Very high	80.9	Confident	1 Å²	1	29.9 Å²	29.9	1%	0.007	16%	0.157	C	C	.	.	S	Bend	trans	-82.7	70.5	-175.5	-174.8	0	0	0	0	111.5	I505 V607 M619 K621	I505-C509 HydrophobicContact CG2-CB 3.96Å; I505-C509 WeakPolarHBondContact O-CB 3.46Å; I505-C509 PolarHBondContact O-N 3.08Å; C509-V607 HydrophobicContact CB-CG2 4.41Å; C509-M619 HydrophobicContact CB-CB 4.18Å; C509-K621 WeakPolarHBondContact O-CD 3.28Å; C509-K621 VanDerWaalsContact O-CE 3.28Å; C509-K621 WeakPolarHBondContact O-CE 3.33Å; C509-K621 PolarHBondContact O-NZ 2.94Å
510	H	87.8	Confident	78.7	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.005	19%	0.193	C	C	.	.	S	Bend	trans	-156.3	168.9	177.5	62.8	70.7	0	0	0	113.8	L506 A507 V508 V512 V561 F571 R574	L506-H510 PolarHBondContact O-CD2 3.49Å; A507-H510 PolarHBondContact O-NE2 3.44Å; V508-H510 VanDerWaalsContact C-N 3.33Å; V508-H510 PolarHBondContact O-N 3.49Å; H510-V512 HydrophobicContact CB-CG2 4.06Å; H510-V512 VanDerWaalsContact ND1-CB 3.34Å; H510-V512 WeakPolarHBondContact ND1-CB 3.05Å; H510-V512 PolarHBondContact ND1-N 2.74Å; H510-V512 VanDerWaalsContact ND1-N 3.13Å; H510-V561 HydrophobicContact CB-CG2 4.15Å; H510-V561 WeakPolarHBondContact CD2-CG2 3.29Å; H510-F571 AromaticContact CE1-CD1 3.6Å; H510-F571 AromaticContact CE1-CE1 3.45Å; H510-F571 VanDerWaalsContact CE1-CE1 3.45Å; H510-F571 WeakPolarHBondContact CE1-CE1 3.27Å; H510-F571 AromaticContact CE1-CG 3.95Å; H510-F571 AromaticContact CE1-CZ 3.66Å; H510-F571 AromaticContact NE2-CD1 3.95Å; H510-F571 AromaticContact NE2-CG 3.95Å; H510-R574 PolarHBondContact O-NH1 3.3Å; H510-R574 PolarHBondContact O-NH2 2.88Å; H510-R574 VanDerWaalsContact O-NH2 3.1Å
511	T	80.6	Confident	76.3	Confident	6 Å²	6	43.3 Å²	43.3	4%	0.037	22%	0.223	C	C	.	.			trans	-97.9	-3.3	174.4	66.7	0	0	0	0	113.6	E557 R574 M605 Q1216 I1220	T511-E557 PolarHBondContact N-OE2 3.41Å; T511-E557 PolarHBondContact OG1-OE2 2.94Å; T511-R574 VanDerWaalsContact C-NH1 3.34Å; T511-R574 PolarHBondContact O-NH1 3.15Å; T511-M605 HydrophobicContact CG2-CE 3.48Å; T511-M605 VanDerWaalsContact CG2-CE 3.48Å; T511-M605 HydrophobicContact CG2-SD 4.29Å; T511-Q1216 HydrophobicContact CG2-CB 4.39Å; T511-Q1216 HydrophobicContact CG2-CG 4.47Å; T511-I1220 HydrophobicContact CG2-CD1 4.31Å
512	V	81.3	Confident	73.8	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.253	C	S	.	.			trans	-52.2	139.2	-179.6	-172	0	0	0	0	113	H510 Y550 Q551 A552 E557 V561 F571 R574	H510-V512 HydrophobicContact CB-CG2 4.06Å; H510-V512 VanDerWaalsContact ND1-CB 3.34Å; H510-V512 WeakPolarHBondContact ND1-CB 3.05Å; H510-V512 PolarHBondContact ND1-N 2.74Å; H510-V512 VanDerWaalsContact ND1-N 3.13Å; V512-Y550 HydrophobicContact CG1-CD1 3.98Å; V512-Y550 HydrophobicContact CG1-CG 4.14Å; V512-Q551 CarbonylContact C-O 3.59Å; V512-Q551 WeakPolarHBondContact CA-O 3.22Å; V512-Q551 VanDerWaalsContact CG1-O 3.23Å; V512-Q551 WeakPolarHBondContact CG1-O 3.49Å; V512-A552 HydrophobicContact CB-CB 4.47Å; V512-A552 HydrophobicContact CG2-CB 3.67Å; V512-E557 HydrophobicContact CG2-CB 3.97Å; V512-V561 HydrophobicContact CB-CG2 4.25Å; V512-V561 HydrophobicContact CG2-CB 4.35Å; V512-V561 HydrophobicContact CG2-CG2 3.67Å; V512-F571 HydrophobicContact CB-CE1 4.47Å; V512-F571 HydrophobicContact CG1-CE1 4.49Å; V512-F571 VanDerWaalsContact O-CE1 3.25Å; V512-F571 WeakPolarHBondContact O-CE1 3.4Å; V512-F571 WeakPolarHBondContact O-CZ 3.26Å; V512-R574 PolarHBondContact O-NH1 2.94Å
513	V	77.1	Confident	71.1	Confident	16 Å²	16	54 Å²	54	10%	0.097	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	130.4	174.3	-179.8	0	0	0	0	109.2	Q551 Y1223	V513-Q551 PolarHBondContact N-O 3Å; V513-Q551 PolarHBondContact O-N 3.25Å; V513-Y1223 HydrophobicContact CG1-CD1 3.73Å; V513-Y1223 HydrophobicContact CG1-CE1 3.36Å; V513-Y1223 HydrophobicContact CG1-CG 4.5Å
514	P	79.4	Confident	68.4	Low	7 Å²	7	61 Å²	61	5%	0.045	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	124.4	177.4	32.7	-24.1	0	0	0	110.3	I548 Y550 F571	P514-I548 HydrophobicContact CB-CG2 3.72Å; P514-Y550 HydrophobicContact CB-CD1 4.38Å; P514-Y550 HydrophobicContact CB-CE1 4.24Å; P514-F571 HydrophobicContact CB-CD1 4.09Å; P514-F571 HydrophobicContact CB-CE1 3.85Å; P514-F571 HydrophobicContact CB-CZ 4.44Å; P514-F571 HydrophobicContact CG-CD1 4.16Å; P514-F571 HydrophobicContact CG-CE1 3.53Å; P514-F571 HydrophobicContact CG-CE2 4.27Å; P514-F571 HydrophobicContact CG-CZ 3.64Å
515	E	69.2	Low	65.7	Low	51 Å²	51	67.1 Å²	67.1	24%	0.238	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	129.1	171.7	-71.1	-168.5	143.1	0	0	110.6	I548 N549 Q551	E515-I548 CarbonylContact O-C 3.54Å; E515-I548 WeakPolarHBondContact O-CA 3.36Å; E515-N549 PolarHBondContact N-O 2.92Å; E515-N549 PolarHBondContact O-N 3.36Å; E515-Q551 HydrophobicContact CG-CG 4.25Å
516	R	67.9	Low	62.8	Low	130 Å²	130	73.3 Å²	73.3	49%	0.491	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	115.1	172.3	-60.8	-176.4	-172.2	-176.1	3.3	108.5	V518 T573	R516-V518 PolarHBondContact O-N 3.46Å; R516-T573 PolarHBondContact NH2-OG1 3.18Å; R516-T573 VanDerWaalsContact NH2-OG1 3.09Å
517	S	56.5	Low	59.9	Low	58 Å²	58	79.9 Å²	79.9	41%	0.406	43%	0.425	S	S	.	.			trans	-67.1	113.2	172.6	61.2	0	0	0	0	109.6	N519 L547	S517-N519 PolarHBondContact O-N 2.79Å; S517-L547 PolarHBondContact OG-O 3.21Å
518	V	53.2	Low	57.3	Low	118 Å²	118	87.5 Å²	87.5	72%	0.715	47%	0.465	S	S	*	.			trans	-83.7	102	170.3	-175.8	0	0	0	0	106.9	R516 E520	R516-V518 PolarHBondContact O-N 3.46Å; V518-E520 HydrophobicContact CG1-CG 4.49Å; V518-E520 PolarHBondContact O-N 2.96Å
519	N	43	Very low	54.4	Low	136 Å²	136	95 Å²	95	73%	0.727	51%	0.505	S	S	*	.			trans	-66.5	101.6	171.3	-86.1	-8.1	0	0	0	108.9	S517 N521	S517-N519 PolarHBondContact O-N 2.79Å; N519-N521 PolarHBondContact O-N 3.48Å
520	E	43.5	Very low	51.7	Low	166 Å²	166	102 Å²	102	78%	0.776	54%	0.541	S	S	*	.			trans	-74.4	9.6	173.4	-76.7	-176.5	160.2	0	0	113.7	V518 N522	V518-E520 HydrophobicContact CG1-CG 4.49Å; V518-E520 PolarHBondContact O-N 2.96Å; E520-N522 VanDerWaalsContact C-N 3.35Å; E520-N522 PolarHBondContact O-N 3.41Å
521	N	38	Very low	49	Very low	148 Å²	148	109 Å²	109	79%	0.791	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	15.9	-175.1	-74.3	-3.5	0	0	0	116.1	N519	N519-N521 PolarHBondContact O-N 3.48Å
522	N	36.9	Very low	46.7	Very low	163 Å²	163	116.6 Å²	116.6	87%	0.872	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	13.2	-179.5	-94.1	-1.3	0	0	0	115.7	E520	E520-N522 VanDerWaalsContact C-N 3.35Å; E520-N522 PolarHBondContact O-N 3.41Å
523	T	36.5	Very low	44.2	Very low	114 Å²	114	124.4 Å²	124.4	70%	0.699	66%	0.661	S	S	*	*	S	Bend	trans	-133.2	80	171.6	48.3	0	0	0	0	110.2
524	N	36.3	Very low	41.9	Very low	148 Å²	148	130.8 Å²	130.8	79%	0.791	70%	0.7	S	S	*	*	S	Bend	trans	171	104.7	141.5	-83.2	-23.1	0	0	0	110.8
525	N	34	Very low	39.4	Very low	137 Å²	137	135.1 Å²	135.1	73%	0.733	74%	0.736	S	S	*	*			trans	46.9	111	137.9	-63	-21.3	0	0	0	120.7
526	N	31.8	Very low	37.4	Very low	136 Å²	136	138.3 Å²	138.3	73%	0.727	76%	0.758	S	S	*	*				49.5	123.4	125.4	-60.8	-17.2	0	0	0	119.7
527	N	32.1	Very low	35.4	Very low	142 Å²	142	140.9 Å²	140.9	76%	0.759	77%	0.773	S	S	*	*			trans	81.3	98.6	158.8	-50.5	-20.3	0	0	0	115
528	D	35.8	Very low	34.2	Very low	160 Å²	160	144.4 Å²	144.4	86%	0.856	80%	0.797	S	S	*	*				175.8	110.3	107	-80.7	-22.1	0	0	0	110.2
529	N	30.6	Very low	33	Very low	157 Å²	157	145.8 Å²	145.8	84%	0.84	80%	0.8	S	S	*	*			trans	-62.6	138.9	165.1	-71.3	-46.2	0	0	0	108.8
530	I	34.9	Very low	32.3	Very low	148 Å²	148	145.7 Å²	145.7	76%	0.759	80%	0.8	S	S	*	*			trans	162.9	124.4	138.3	-83.6	154.2	0	0	0	110.1
531	N	31.5	Very low	31.6	Very low	148 Å²	148	144.6 Å²	144.6	79%	0.791	80%	0.799	S	S	*	*			trans	87.1	83	162.4	-58.2	-19.4	0	0	0	120.5
532	N	31	Very low	31.5	Very low	165 Å²	165	144.1 Å²	144.1	88%	0.882	80%	0.796	S	S	*	*			trans	-113.9	109.2	155.1	-86.6	-16.6	0	0	0	109.9
533	N	28.7	Very low	31.1	Very low	164 Å²	164	143.2 Å²	143.2	88%	0.877	79%	0.791	S	S	*	*			trans	-130.4	63.2	171.1	-92.5	-7	0	0	0	110
534	V	29.3	Very low	31	Very low	151 Å²	151	145.5 Å²	145.5	92%	0.915	80%	0.799	S	S	*	*			trans	-152.3	86.4	159.4	-172.5	0	0	0	0	108.9
535	A	27.3	Very low	31.4	Very low	97 Å²	97	143.1 Å²	143.1	80%	0.802	78%	0.783	S	S	*	*			trans	-162.1	94.2	167	0	0	0	0	0	110.9
536	V	27.4	Very low	32.2	Very low	118 Å²	118	142 Å²	142	72%	0.715	77%	0.774	S	S	*	*			trans	-158.1	114.5	158.7	-150.6	0	0	0	0	103.8
537	F	26.5	Very low	33.7	Very low	184 Å²	184	141.7 Å²	141.7	81%	0.807	77%	0.771	S	S	*	*	S	Bend	cis	-153.5	125.3	45	-78.9	-96.8	0	0	0	110
538	C	30.8	Very low	35.7	Very low	133 Å²	133	135.9 Å²	135.9	90%	0.899	74%	0.74	S	S	*	*			trans	-165.2	105.8	147.6	-85.2	0	0	0	0	105.2
539	N	28.4	Very low	37.5	Very low	146 Å²	146	132.1 Å²	132.1	78%	0.781	72%	0.719	S	S	*	*			trans	-65.4	132.2	178.6	-81.8	-10	0	0	0	111.4
540	D	26.8	Very low	39.8	Very low	135 Å²	135	125 Å²	125	72%	0.722	68%	0.681	S	S	*	*	S	Bend	trans	59	111.3	139.3	-55.2	-27.3	0	0	0	120.5
541	N	29.1	Very low	41.5	Very low	143 Å²	143	120 Å²	120	77%	0.765	65%	0.654	S	S	*	*			trans	95	40.6	151.9	-56.7	-35.2	0	0	0	121.2
542	L	35.6	Very low	43.4	Very low	137 Å²	137	114.1 Å²	114.1	72%	0.717	63%	0.626	S	S	*	*			trans	-119.3	80.4	152.1	-98.4	98.8	0	0	0	111.5	N544 E545	L542-N544 PolarHBondContact O-N 2.96Å; L542-E545 HydrophobicContact CD2-CG 4.16Å; L542-E545 WeakPolarHBondContact CD2-OE2 3.5Å
543	N	29.7	Very low	45	Very low	145 Å²	145	108.5 Å²	108.5	78%	0.775	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	125.5	167	-71.1	-30.3	0	0	0	109.6
544	N	34	Very low	47	Very low	161 Å²	161	101 Å²	101	86%	0.861	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	78.9	26.6	162.9	-66.2	-18.3	0	0	0	121.1	L542 Q546	L542-N544 PolarHBondContact O-N 2.96Å; N544-Q546 PolarHBondContact O-N 3.01Å
545	E	43.3	Very low	49.1	Very low	99 Å²	99	97 Å²	97	46%	0.463	54%	0.537	S	S	.	.			trans	-89.1	106.8	165.1	-72.1	-168.8	172.4	0	0	111.4	L542 L547 K582	L542-E545 HydrophobicContact CD2-CG 4.16Å; L542-E545 WeakPolarHBondContact CD2-OE2 3.5Å; E545-L547 PolarHBondContact O-N 2.96Å; E545-K582 IonicContact OE1-NZ 2.74Å; E545-K582 PolarHBondContact OE1-NZ 3.31Å
546	Q	52.7	Low	51.6	Low	114 Å²	114	92.5 Å²	92.5	53%	0.533	50%	0.5	S	S	.	.			trans	-42.9	134.5	174.6	-67.7	170.1	-13.8	0	0	111.2	N544 I548	N544-Q546 PolarHBondContact O-N 3.01Å; Q546-I548 PolarHBondContact O-N 2.97Å
547	L	63.2	Low	54.2	Low	129 Å²	129	87 Å²	87	68%	0.675	47%	0.467	S	S	*	.			trans	-63.9	97	179.1	-131	117.1	0	0	0	109.4	S517 E545 N549	S517-L547 PolarHBondContact OG-O 3.21Å; E545-L547 PolarHBondContact O-N 2.96Å; L547-N549 PolarHBondContact O-N 3.3Å
548	I	73.1	Confident	56.9	Low	19 Å²	19	79 Å²	79	10%	0.097	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	122.7	173.8	-58.4	177.3	0	0	0	107.6	P514 E515 Q546 Y550 R565 V570 T572	P514-I548 HydrophobicContact CB-CG2 3.72Å; E515-I548 CarbonylContact O-C 3.54Å; E515-I548 WeakPolarHBondContact O-CA 3.36Å; Q546-I548 PolarHBondContact O-N 2.97Å; I548-Y550 HydrophobicContact CG2-CD1 4.12Å; I548-Y550 HydrophobicContact CG2-CE1 3.72Å; I548-R565 PolarHBondContact O-NH1 3.31Å; I548-V570 HydrophobicContact CD1-CG1 4.29Å; I548-T572 HydrophobicContact CD1-CG2 4.37Å
549	N	74.6	Confident	59.5	Low	81 Å²	81	73 Å²	73	43%	0.433	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	132.2	171.2	-161.8	12.3	0	0	0	109.5	E515 L547 Q551	E515-N549 PolarHBondContact N-O 2.92Å; E515-N549 PolarHBondContact O-N 3.36Å; L547-N549 PolarHBondContact O-N 3.3Å; N549-Q551 PolarHBondContact ND2-NE2 2.9Å
550	Y	78.2	Confident	62.5	Low	8 Å²	8	66.2 Å²	66.2	3%	0.031	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	117.8	-178.9	-71.1	-47.5	0	0	0	110.1	V512 P514 I548 V561 K562 R565 F571	V512-Y550 HydrophobicContact CG1-CD1 3.98Å; V512-Y550 HydrophobicContact CG1-CG 4.14Å; P514-Y550 HydrophobicContact CB-CD1 4.38Å; P514-Y550 HydrophobicContact CB-CE1 4.24Å; I548-Y550 HydrophobicContact CG2-CD1 4.12Å; I548-Y550 HydrophobicContact CG2-CE1 3.72Å; Y550-V561 HydrophobicContact CD1-CG1 4.01Å; Y550-V561 HydrophobicContact CD2-CG1 3.83Å; Y550-V561 HydrophobicContact CE1-CG1 4.01Å; Y550-V561 HydrophobicContact CE2-CG1 3.79Å; Y550-V561 HydrophobicContact CG-CG1 3.96Å; Y550-K562 HydrophobicContact CD2-CG 4.1Å; Y550-R565 HydrophobicContact CE2-CB 3.91Å; Y550-R565 HydrophobicContact CE2-CG 4.31Å; Y550-F571 AromaticContact CD1-CD1 3.99Å; Y550-F571 HydrophobicContact CD1-CD1 3.99Å; Y550-F571 HydrophobicContact CE1-CB 4.04Å; Y550-F571 AromaticContact CE1-CD1 3.62Å; Y550-F571 HydrophobicContact CE1-CD1 3.62Å; Y550-F571 HydrophobicContact CE1-CG 4.26Å; Y550-F571 VanDerWaalsContact CE1-O 3.29Å; Y550-F571 WeakPolarHBondContact CE1-O 3.22Å; Y550-F571 PolarHBondContact OH-N 3Å; Y550-F571 PolarHBondContact OH-O 3.42Å
551	Q	69.4	Low	65.5	Low	43 Å²	43	59.8 Å²	59.8	20%	0.201	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	123.3	179.9	-61.4	-66.1	-5.7	0	0	109.3	N254 V512 V513 E515 N549	N254-Q551 WeakPolarHBondContact ND2-CB 3.33Å; N254-Q551 VanDerWaalsContact ND2-CD 3.28Å; N254-Q551 VanDerWaalsContact ND2-CG 3.33Å; N254-Q551 WeakPolarHBondContact ND2-CG 3.34Å; N254-Q551 PolarHBondContact ND2-OE1 3.47Å; N254-Q551 PolarHBondContact OD1-NE2 2.54Å; N254-Q551 VanDerWaalsContact OD1-NE2 3.12Å; V512-Q551 CarbonylContact C-O 3.59Å; V512-Q551 WeakPolarHBondContact CA-O 3.22Å; V512-Q551 VanDerWaalsContact CG1-O 3.23Å; V512-Q551 WeakPolarHBondContact CG1-O 3.49Å; V513-Q551 PolarHBondContact N-O 3Å; V513-Q551 PolarHBondContact O-N 3.25Å; E515-Q551 HydrophobicContact CG-CG 4.25Å; N549-Q551 PolarHBondContact ND2-NE2 2.9Å
552	A	72.5	Confident	68.3	Low	24 Å²	24	58.2 Å²	58.2	20%	0.198	31%	0.31	C	S	.	.			trans	-130.9	147.4	-178.6	0	0	0	0	0	110.3	V512 S554 E557 A558	V512-A552 HydrophobicContact CB-CB 4.47Å; V512-A552 HydrophobicContact CG2-CB 3.67Å; A552-S554 VanDerWaalsContact CB-O 3.26Å; A552-S554 WeakPolarHBondContact CB-O 3.49Å; A552-S554 PolarHBondContact O-N 2.98Å; A552-E557 HydrophobicContact CB-CB 4.14Å; A552-A558 HydrophobicContact CB-CB 3.81Å
553	S	64.7	Low	70.8	Confident	48 Å²	48	51.8 Å²	51.8	34%	0.336	28%	0.277	S	S	.	.	S	Bend	trans	-67.8	-24.8	171	-56.4	0	0	0	0	112
554	S	71.2	Confident	73.7	Confident	5 Å²	5	44.9 Å²	44.9	4%	0.035	24%	0.24	C	C	.	.	S	Bend	trans	-128.7	137.6	178.4	66.8	0	0	0	0	111.8	A552 D556 E557 A558 Q1208	A552-S554 VanDerWaalsContact CB-O 3.26Å; A552-S554 WeakPolarHBondContact CB-O 3.49Å; A552-S554 PolarHBondContact O-N 2.98Å; S554-D556 VanDerWaalsContact C-N 3.27Å; S554-D556 WeakPolarHBondContact CB-OD1 3.42Å; S554-D556 PolarHBondContact O-N 3.18Å; S554-D556 PolarHBondContact OG-OD1 3.01Å; S554-E557 PolarHBondContact O-N 3.44Å; S554-E557 VanDerWaalsContact OG-CG 3.3Å; S554-E557 WeakPolarHBondContact OG-CG 3.38Å; S554-A558 PolarHBondContact O-N 2.95Å; S554-Q1208 PolarHBondContact OG-NE2 2.91Å
555	P	73.6	Confident	76.2	Confident	67 Å²	67	41.2 Å²	41.2	44%	0.435	21%	0.214	S	C	.	.	H	α-helix	trans	-69.8	-23.5	-174.9	26.6	-34.5	0	0	0	113.2	M461 A558 A559	M461-P555 HydrophobicContact CB-CB 4.31Å; M461-P555 HydrophobicContact CG-CB 3.82Å; M461-P555 HydrophobicContact CG-CG 3.95Å; P555-A558 PolarHBondContact O-N 3.17Å; P555-A559 WeakPolarHBondContact O-CB 3.41Å; P555-A559 PolarHBondContact O-N 3.27Å
556	D	78.6	Confident	78.2	Confident	4 Å²	4	41.3 Å²	41.3	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-64.4	-45.2	172.5	53.1	2.8	0	0	0	111.8	S554 A558 A559 L560 R654 I708 F1206	S554-D556 VanDerWaalsContact C-N 3.27Å; S554-D556 WeakPolarHBondContact CB-OD1 3.42Å; S554-D556 PolarHBondContact O-N 3.18Å; S554-D556 PolarHBondContact OG-OD1 3.01Å; D556-A558 VanDerWaalsContact C-N 3.33Å; D556-A558 PolarHBondContact O-N 2.87Å; D556-A559 WeakPolarHBondContact O-CB 3.21Å; D556-A559 PolarHBondContact O-N 3.04Å; D556-L560 VanDerWaalsContact O-CG 3.25Å; D556-L560 WeakPolarHBondContact O-CG 3.48Å; D556-L560 PolarHBondContact O-N 3.38Å; D556-R654 IonicContact OD2-CZ 2.92Å; D556-R654 IonicContact OD2-NE 3.59Å; D556-R654 IonicContact OD2-NH2 2.67Å; D556-R654 PolarHBondContact OD2-NH2 2.91Å; D556-I708 HydrophobicContact CB-CD1 3.87Å; D556-F1206 WeakPolarHBondContact OD2-CE1 3.22Å
557	E	82.7	Confident	79.8	Confident	3 Å²	3	36.7 Å²	36.7	1%	0.014	20%	0.2	C	C	.	.	H	α-helix	trans	-60.9	-43.4	173.6	-72.3	-160.2	158.6	0	0	111.6	T511 V512 A552 S554 A559 L560 V561 K621	T511-E557 PolarHBondContact N-OE2 3.41Å; T511-E557 PolarHBondContact OG1-OE2 2.94Å; V512-E557 HydrophobicContact CG2-CB 3.97Å; A552-E557 HydrophobicContact CB-CB 4.14Å; S554-E557 PolarHBondContact O-N 3.44Å; S554-E557 VanDerWaalsContact OG-CG 3.3Å; S554-E557 WeakPolarHBondContact OG-CG 3.38Å; E557-A559 VanDerWaalsContact C-N 3.31Å; E557-A559 PolarHBondContact O-N 3.44Å; E557-L560 PolarHBondContact O-N 2.87Å; E557-V561 WeakPolarHBondContact O-CG2 3.24Å; E557-V561 PolarHBondContact O-N 3.5Å; E557-K621 VanDerWaalsContact CD-NZ 3.3Å; E557-K621 WeakPolarHBondContact OE1-CE 3.44Å; E557-K621 IonicContact OE1-NZ 3.8Å; E557-K621 PolarHBondContact OE1-NZ 3.07Å
558	A	82.3	Confident	80.7	Confident	14 Å²	14	32.2 Å²	32.2	12%	0.116	18%	0.184	C	C	.	.	H	α-helix	trans	-60.2	-43	175.6	0	0	0	0	0	111.3	A552 S554 P555 D556 K562	A552-A558 HydrophobicContact CB-CB 3.81Å; S554-A558 PolarHBondContact O-N 2.95Å; P555-A558 PolarHBondContact O-N 3.17Å; D556-A558 VanDerWaalsContact C-N 3.33Å; D556-A558 PolarHBondContact O-N 2.87Å; A558-K562 VanDerWaalsContact O-CB 3.26Å; A558-K562 WeakPolarHBondContact O-CB 3.31Å; A558-K562 WeakPolarHBondContact O-CG 3.3Å; A558-K562 PolarHBondContact O-N 3.39Å
559	A	86.3	Confident	81.5	Confident	8 Å²	8	31.3 Å²	31.3	7%	0.066	18%	0.18	C	C	.	.	H	α-helix	trans	-63.4	-42.8	177.5	0	0	0	0	0	111.9	M461 P555 D556 E557 K562 A563	M461-A559 HydrophobicContact CB-CB 4.06Å; M461-A559 VanDerWaalsContact O-CB 3.27Å; M461-A559 WeakPolarHBondContact O-CB 3.46Å; P555-A559 WeakPolarHBondContact O-CB 3.41Å; P555-A559 PolarHBondContact O-N 3.27Å; D556-A559 WeakPolarHBondContact O-CB 3.21Å; D556-A559 PolarHBondContact O-N 3.04Å; E557-A559 VanDerWaalsContact C-N 3.31Å; E557-A559 PolarHBondContact O-N 3.44Å; A559-K562 PolarHBondContact O-N 3.32Å; A559-A563 VanDerWaalsContact O-CB 3.28Å; A559-A563 WeakPolarHBondContact O-CB 3.14Å; A559-A563 PolarHBondContact O-N 2.97Å
560	L	91.1	Very high	82.2	Confident	3 Å²	3	28.5 Å²	28.5	2%	0.016	17%	0.165	C	C	.	.	H	α-helix	trans	-64.4	-45	177.9	-68.9	174.8	0	0	0	112.4	F463 L506 D556 E557 A563 A564 L656 T706 I708	F463-L560 HydrophobicContact CD2-CD2 3.89Å; F463-L560 HydrophobicContact CE2-CD2 4.09Å; L506-L560 HydrophobicContact CD1-CD2 4.4Å; L506-L560 HydrophobicContact CD2-CB 4.39Å; L506-L560 HydrophobicContact CD2-CD1 4.23Å; L506-L560 HydrophobicContact CD2-CD2 3.98Å; L506-L560 HydrophobicContact CD2-CG 4.43Å; D556-L560 VanDerWaalsContact O-CG 3.25Å; D556-L560 WeakPolarHBondContact O-CG 3.48Å; D556-L560 PolarHBondContact O-N 3.38Å; E557-L560 PolarHBondContact O-N 2.87Å; L560-A563 WeakPolarHBondContact O-CB 3.41Å; L560-A563 PolarHBondContact O-N 2.91Å; L560-A564 PolarHBondContact O-N 3.28Å; L560-L656 HydrophobicContact CD1-CD1 4.03Å; L560-T706 HydrophobicContact CD2-CG2 3.79Å; L560-I708 HydrophobicContact CD1-CD1 4.48Å; L560-I708 HydrophobicContact CD2-CD1 4Å; L560-I708 HydrophobicContact CD2-CG1 4.47Å; L560-I708 HydrophobicContact CG-CD1 4.04Å
561	V	89.8	Confident	82.8	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.006	16%	0.164	C	C	.	.	H	α-helix	trans	-70.2	-37.7	178.6	177.5	0	0	0	0	111.3	H510 V512 Y550 E557 A564 R565 F571	H510-V561 HydrophobicContact CB-CG2 4.15Å; H510-V561 WeakPolarHBondContact CD2-CG2 3.29Å; V512-V561 HydrophobicContact CB-CG2 4.25Å; V512-V561 HydrophobicContact CG2-CB 4.35Å; V512-V561 HydrophobicContact CG2-CG2 3.67Å; Y550-V561 HydrophobicContact CD1-CG1 4.01Å; Y550-V561 HydrophobicContact CD2-CG1 3.83Å; Y550-V561 HydrophobicContact CE1-CG1 4.01Å; Y550-V561 HydrophobicContact CE2-CG1 3.79Å; Y550-V561 HydrophobicContact CG-CG1 3.96Å; E557-V561 WeakPolarHBondContact O-CG2 3.24Å; E557-V561 PolarHBondContact O-N 3.5Å; V561-A564 PolarHBondContact O-N 2.66Å; V561-R565 PolarHBondContact O-N 3.3Å; V561-F571 HydrophobicContact CG1-CB 4.31Å; V561-F571 HydrophobicContact CG1-CD1 4.39Å
562	K	87.8	Confident	83.5	Confident	110 Å²	110	26.5 Å²	26.5	48%	0.478	16%	0.157	S	C	.	.	H	α-helix	trans	-61.9	-43.4	172	-76.1	174	-177.8	178.6	0	111.3	Y550 A558 A559 A564 R565 T566	Y550-K562 HydrophobicContact CD2-CG 4.1Å; A558-K562 VanDerWaalsContact O-CB 3.26Å; A558-K562 WeakPolarHBondContact O-CB 3.31Å; A558-K562 WeakPolarHBondContact O-CG 3.3Å; A558-K562 PolarHBondContact O-N 3.39Å; A559-K562 PolarHBondContact O-N 3.32Å; K562-A564 PolarHBondContact O-N 3.38Å; K562-R565 WeakPolarHBondContact O-CB 3.49Å; K562-R565 PolarHBondContact O-N 2.99Å; K562-T566 PolarHBondContact O-N 3.25Å; K562-T566 PolarHBondContact O-OG1 3.22Å; K562-T566 VanDerWaalsContact O-OG1 3.07Å
563	A	88.5	Confident	84	Confident	2 Å²	2	26.2 Å²	26.2	2%	0.017	15%	0.153	C	C	.	.	H	α-helix	trans	-60.7	-44	175.3	0	0	0	0	0	111.7	F463 L483 A559 L560 R565 T566 M567	F463-A563 HydrophobicContact CB-CB 3.71Å; F463-A563 HydrophobicContact CD1-CB 4.06Å; F463-A563 HydrophobicContact CD2-CB 4.12Å; F463-A563 HydrophobicContact CG-CB 3.72Å; L483-A563 HydrophobicContact CD1-CB 4.32Å; L483-A563 HydrophobicContact CD2-CB 4.23Å; A559-A563 VanDerWaalsContact O-CB 3.28Å; A559-A563 WeakPolarHBondContact O-CB 3.14Å; A559-A563 PolarHBondContact O-N 2.97Å; L560-A563 WeakPolarHBondContact O-CB 3.41Å; L560-A563 PolarHBondContact O-N 2.91Å; A563-R565 PolarHBondContact O-N 3.41Å; A563-T566 PolarHBondContact O-N 3.36Å; A563-M567 WeakPolarHBondContact O-CG 3.21Å; A563-M567 PolarHBondContact O-N 3.04Å
564	A	89.6	Confident	84.8	Confident	0 Å²	0	24 Å²	24	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61.2	-42.3	175.1	0	0	0	0	0	112.1	F503 L506 A507 L560 V561 K562 T566 M567 G568 Y569	F503-A564 HydrophobicContact CD1-CB 4.48Å; L506-A564 HydrophobicContact CB-CB 4.3Å; A507-A564 HydrophobicContact CB-CB 4.13Å; L560-A564 PolarHBondContact O-N 3.28Å; V561-A564 PolarHBondContact O-N 2.66Å; K562-A564 PolarHBondContact O-N 3.38Å; A564-T566 PolarHBondContact O-N 2.62Å; A564-M567 CarbonylContact O-C 3.5Å; A564-M567 PolarHBondContact O-N 3.15Å; A564-G568 PolarHBondContact O-N 3.33Å; A564-Y569 CarbonylContact C-O 3.59Å; A564-Y569 VanDerWaalsContact C-O 3.32Å; A564-Y569 WeakPolarHBondContact O-CA 3.37Å; A564-Y569 WeakPolarHBondContact O-CB 3.17Å; A564-Y569 PolarHBondContact O-N 3.21Å
565	R	87.6	Confident	85.2	Confident	84 Å²	84	24.7 Å²	24.7	32%	0.317	14%	0.141	S	C	.	.	H	α-helix	trans	-60	-45.3	174.5	171.1	177.7	175.6	-180	3	112.2	I548 Y550 V561 K562 A563 M567 G568 Y569 V570	I548-R565 PolarHBondContact O-NH1 3.31Å; Y550-R565 HydrophobicContact CE2-CB 3.91Å; Y550-R565 HydrophobicContact CE2-CG 4.31Å; V561-R565 PolarHBondContact O-N 3.3Å; K562-R565 WeakPolarHBondContact O-CB 3.49Å; K562-R565 PolarHBondContact O-N 2.99Å; A563-R565 PolarHBondContact O-N 3.41Å; R565-M567 PolarHBondContact O-N 3.11Å; R565-G568 PolarHBondContact O-N 3.13Å; R565-Y569 WeakPolarHBondContact CA-O 3.33Å; R565-Y569 PolarHBondContact N-O 3.27Å; R565-V570 HydrophobicContact CG-CG2 4.31Å
566	T	85.5	Confident	85.1	Confident	100 Å²	100	23.2 Å²	23.2	61%	0.613	13%	0.132	S	C	*	.	H	α-helix	trans	-59.3	-33.1	178.3	-56.3	0	0	0	0	111.5	L483 K562 A563 A564 G568	L483-T566 HydrophobicContact CD1-CG2 4.35Å; K562-T566 PolarHBondContact O-N 3.25Å; K562-T566 PolarHBondContact O-OG1 3.22Å; K562-T566 VanDerWaalsContact O-OG1 3.07Å; A563-T566 PolarHBondContact O-N 3.36Å; A564-T566 PolarHBondContact O-N 2.62Å; T566-G568 VanDerWaalsContact C-N 3.29Å; T566-G568 PolarHBondContact O-N 3.03Å
567	M	85.1	Confident	85.1	Confident	18 Å²	18	27.7 Å²	27.7	9%	0.089	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	8.6	176.5	-59.6	-60.1	-76.7	0	0	114	L483 L488 L492 F503 A563 A564 R565 Y569	L483-M567 HydrophobicContact CD2-CG 3.52Å; L483-M567 HydrophobicContact CD2-SD 3.66Å; L488-M567 HydrophobicContact CD2-CE 3.69Å; L488-M567 HydrophobicContact CG-CE 3.78Å; L492-M567 HydrophobicContact CD2-CE 4.2Å; L492-M567 WeakPolarHBondContact CD2-O 3.19Å; F503-M567 HydrophobicContact CD1-CB 4.24Å; F503-M567 HydrophobicContact CD1-CG 4.27Å; F503-M567 HydrophobicContact CE1-CB 4.12Å; F503-M567 HydrophobicContact CE1-CG 3.66Å; F503-M567 HydrophobicContact CE2-CB 4.47Å; F503-M567 HydrophobicContact CE2-CE 4.13Å; F503-M567 HydrophobicContact CE2-CG 4.23Å; F503-M567 HydrophobicContact CG-CB 4.48Å; F503-M567 HydrophobicContact CZ-CB 4.25Å; F503-M567 HydrophobicContact CZ-CE 4.1Å; F503-M567 HydrophobicContact CZ-CG 3.64Å; A563-M567 WeakPolarHBondContact O-CG 3.21Å; A563-M567 PolarHBondContact O-N 3.04Å; A564-M567 CarbonylContact O-C 3.5Å; A564-M567 PolarHBondContact O-N 3.15Å; R565-M567 PolarHBondContact O-N 3.11Å; M567-Y569 HydrophobicContact CB-CD2 4.24Å; M567-Y569 WeakPolarHBondContact O-CD2 3.47Å
568	G	83.3	Confident	85.2	Confident	34 Å²	34	30.4 Å²	30.4	35%	0.351	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.4	14.4	176.6	0	0	0	0	0	115.8	A564 R565 T566 R584	A564-G568 PolarHBondContact O-N 3.33Å; R565-G568 PolarHBondContact O-N 3.13Å; T566-G568 VanDerWaalsContact C-N 3.29Å; T566-G568 PolarHBondContact O-N 3.03Å; G568-R584 PolarHBondContact O-N 3.45Å
569	Y	89.5	Confident	85.5	Confident	1 Å²	1	29.7 Å²	29.7	0%	0.004	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	85.4	171.7	-62.5	-104.7	0	0	0	108.5	L492 D500 F503 A564 R565 M567 I583	L492-Y569 HydrophobicContact CD1-CE2 3.82Å; L492-Y569 WeakPolarHBondContact CD1-OH 3.19Å; D500-Y569 WeakPolarHBondContact CA-OH 3.37Å; D500-Y569 WeakPolarHBondContact OD1-CE1 3.47Å; D500-Y569 PolarHBondContact OD1-OH 3Å; F503-Y569 HydrophobicContact CB-CD1 3.99Å; F503-Y569 HydrophobicContact CB-CD2 3.53Å; F503-Y569 HydrophobicContact CB-CE1 4.01Å; F503-Y569 HydrophobicContact CB-CE2 3.56Å; F503-Y569 HydrophobicContact CB-CG 3.8Å; F503-Y569 HydrophobicContact CD2-CE2 4.29Å; F503-Y569 HydrophobicContact CG-CD2 4.14Å; F503-Y569 HydrophobicContact CG-CE2 4.1Å; A564-Y569 CarbonylContact C-O 3.59Å; A564-Y569 VanDerWaalsContact C-O 3.32Å; A564-Y569 WeakPolarHBondContact O-CA 3.37Å; A564-Y569 WeakPolarHBondContact O-CB 3.17Å; A564-Y569 PolarHBondContact O-N 3.21Å; R565-Y569 WeakPolarHBondContact CA-O 3.33Å; R565-Y569 PolarHBondContact N-O 3.27Å; M567-Y569 HydrophobicContact CB-CD2 4.24Å; M567-Y569 WeakPolarHBondContact O-CD2 3.47Å; Y569-I583 HydrophobicContact CD1-CB 4.31Å; Y569-I583 HydrophobicContact CD1-CD1 3.79Å; Y569-I583 HydrophobicContact CD1-CG1 3.74Å; Y569-I583 HydrophobicContact CD1-CG2 3.82Å; Y569-I583 HydrophobicContact CE1-CB 4.41Å; Y569-I583 HydrophobicContact CE1-CD1 3.99Å; Y569-I583 HydrophobicContact CE1-CG1 4.18Å; Y569-I583 HydrophobicContact CE1-CG2 3.46Å; Y569-I583 VanDerWaalsContact CE1-CG2 3.46Å
570	V	89.5	Confident	85.6	Confident	21 Å²	21	29.7 Å²	29.7	13%	0.127	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	111.3	-172	-172.2	0	0	0	0	109.8	I548 R565 T572 V581 K582	I548-V570 HydrophobicContact CD1-CG1 4.29Å; R565-V570 HydrophobicContact CG-CG2 4.31Å; V570-T572 HydrophobicContact CG1-CG2 4.17Å; V570-T572 PolarHBondContact O-N 3.35Å; V570-V581 CarbonylContact O-C 3.51Å; V570-V581 WeakPolarHBondContact O-CA 3.39Å; V570-K582 HydrophobicContact CB-CB 4.33Å; V570-K582 PolarHBondContact N-O 3.42Å; V570-K582 PolarHBondContact O-N 3.07Å
571	F	89.2	Confident	85.5	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	119.7	168.8	168.3	-126.9	0	0	0	109.7	H510 V512 P514 Y550 V561 T573 R574 V579	H510-F571 AromaticContact CE1-CD1 3.6Å; H510-F571 AromaticContact CE1-CE1 3.45Å; H510-F571 VanDerWaalsContact CE1-CE1 3.45Å; H510-F571 WeakPolarHBondContact CE1-CE1 3.27Å; H510-F571 AromaticContact CE1-CG 3.95Å; H510-F571 AromaticContact CE1-CZ 3.66Å; H510-F571 AromaticContact NE2-CD1 3.95Å; H510-F571 AromaticContact NE2-CG 3.95Å; V512-F571 HydrophobicContact CB-CE1 4.47Å; V512-F571 HydrophobicContact CG1-CE1 4.49Å; V512-F571 VanDerWaalsContact O-CE1 3.25Å; V512-F571 WeakPolarHBondContact O-CE1 3.4Å; V512-F571 WeakPolarHBondContact O-CZ 3.26Å; P514-F571 HydrophobicContact CB-CD1 4.09Å; P514-F571 HydrophobicContact CB-CE1 3.85Å; P514-F571 HydrophobicContact CB-CZ 4.44Å; P514-F571 HydrophobicContact CG-CD1 4.16Å; P514-F571 HydrophobicContact CG-CE1 3.53Å; P514-F571 HydrophobicContact CG-CE2 4.27Å; P514-F571 HydrophobicContact CG-CZ 3.64Å; Y550-F571 AromaticContact CD1-CD1 3.99Å; Y550-F571 HydrophobicContact CD1-CD1 3.99Å; Y550-F571 HydrophobicContact CE1-CB 4.04Å; Y550-F571 AromaticContact CE1-CD1 3.62Å; Y550-F571 HydrophobicContact CE1-CD1 3.62Å; Y550-F571 HydrophobicContact CE1-CG 4.26Å; Y550-F571 VanDerWaalsContact CE1-O 3.29Å; Y550-F571 WeakPolarHBondContact CE1-O 3.22Å; Y550-F571 PolarHBondContact OH-N 3Å; Y550-F571 PolarHBondContact OH-O 3.42Å; V561-F571 HydrophobicContact CG1-CB 4.31Å; V561-F571 HydrophobicContact CG1-CD1 4.39Å; F571-T573 WeakPolarHBondContact CE2-O 3.38Å; F571-R574 HydrophobicContact CE2-CB 4.17Å; F571-R574 HydrophobicContact CZ-CB 3.82Å; F571-R574 HydrophobicContact CZ-CG 4.31Å; F571-V579 HydrophobicContact CD2-CG1 3.79Å; F571-V579 HydrophobicContact CE2-CB 4.42Å; F571-V579 HydrophobicContact CE2-CG1 3.69Å; F571-V579 HydrophobicContact CE2-CG2 4.09Å
572	T	84.8	Confident	85.5	Confident	10 Å²	10	31.8 Å²	31.8	6%	0.061	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	-41.3	-170.3	61.7	0	0	0	0	114.4	I548 V570 V580 K582	I548-T572 HydrophobicContact CD1-CG2 4.37Å; V570-T572 HydrophobicContact CG1-CG2 4.17Å; V570-T572 PolarHBondContact O-N 3.35Å; T572-V580 PolarHBondContact N-O 3.46Å; T572-V580 PolarHBondContact OG1-O 2.88Å; T572-K582 HydrophobicContact CG2-CB 4.11Å
573	T	83.2	Confident	85.4	Confident	18 Å²	18	26.8 Å²	26.8	11%	0.11	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	137.2	-167.8	-47	0	0	0	0	109.8	R516 F571 V580 S1225 T1226	R516-T573 PolarHBondContact NH2-OG1 3.18Å; R516-T573 VanDerWaalsContact NH2-OG1 3.09Å; F571-T573 WeakPolarHBondContact CE2-O 3.38Å; T573-V580 PolarHBondContact O-N 2.98Å; T573-S1225 WeakPolarHBondContact CG2-OG 3.49Å; T573-T1226 HydrophobicContact CG2-CG2 3.85Å
574	R	81.8	Confident	84.9	Confident	2 Å²	2	33.3 Å²	33.3	1%	0.008	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	124	173.7	-164	173.1	-170.5	122.5	11.4	109.6	H510 T511 V512 F571 V579 I1220 S1225	H510-R574 PolarHBondContact O-NH1 3.3Å; H510-R574 PolarHBondContact O-NH2 2.88Å; H510-R574 VanDerWaalsContact O-NH2 3.1Å; T511-R574 VanDerWaalsContact C-NH1 3.34Å; T511-R574 PolarHBondContact O-NH1 3.15Å; V512-R574 PolarHBondContact O-NH1 2.94Å; F571-R574 HydrophobicContact CE2-CB 4.17Å; F571-R574 HydrophobicContact CZ-CB 3.82Å; F571-R574 HydrophobicContact CZ-CG 4.31Å; R574-V579 HydrophobicContact CG-CG2 4.08Å; R574-I1220 VanDerWaalsContact NH2-CG1 3.26Å; R574-S1225 PolarHBondContact N-OG 2.61Å; R574-S1225 PolarHBondContact O-N 2.52Å; R574-S1225 PolarHBondContact O-OG 2.67Å
575	T	78.5	Confident	84.4	Confident	18 Å²	18	35.8 Å²	35.8	11%	0.11	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	167.7	167.3	76.4	0	0	0	0	109.1	T577 E578 Y1223 T1226	T575-T577 PolarHBondContact O-N 2.83Å; T575-E578 PolarHBondContact N-O 3.42Å; T575-E578 PolarHBondContact O-N 3.44Å; T575-E578 WeakPolarHBondContact OG1-CA 2.97Å; T575-E578 VanDerWaalsContact OG1-CB 3.23Å; T575-E578 WeakPolarHBondContact OG1-CB 3.25Å; T575-E578 PolarHBondContact OG1-N 3.17Å; T575-E578 PolarHBondContact OG1-O 3.44Å; T575-Y1223 CarbonylContact C-O 3.55Å; T575-T1226 HydrophobicContact CG2-CG2 4.16Å
576	P	72.7	Confident	84.3	Confident	37 Å²	37	36.1 Å²	36.1	24%	0.24	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-25.7	178.2	-34.2	43.1	0	0	0	115.3	I1220 R1221 Y1223 D1224	P576-I1220 WeakPolarHBondContact CA-O 3.41Å; P576-R1221 WeakPolarHBondContact CB-O 3.35Å; P576-R1221 WeakPolarHBondContact CG-O 3.38Å; P576-Y1223 WeakPolarHBondContact CD-O 3.44Å; P576-D1224 HydrophobicContact CG-CB 4.46Å
577	T	79	Confident	84.4	Confident	97 Å²	97	36.6 Å²	36.6	60%	0.595	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-122.6	-3.9	-171.5	52.4	0	0	0	0	113	T575 G591 I592	T575-T577 PolarHBondContact O-N 2.83Å; T577-G591 CarbonylContact O-C 3.51Å; T577-G591 WeakPolarHBondContact O-CA 2.9Å; T577-I592 PolarHBondContact O-N 2.92Å
578	E	84.9	Confident	84.7	Confident	60 Å²	60	38.6 Å²	38.6	28%	0.28	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	143.4	-170.5	-167.2	179.9	-147.9	0	0	112.6	T575 H589 Y590	T575-E578 PolarHBondContact N-O 3.42Å; T575-E578 PolarHBondContact O-N 3.44Å; T575-E578 WeakPolarHBondContact OG1-CA 2.97Å; T575-E578 VanDerWaalsContact OG1-CB 3.23Å; T575-E578 WeakPolarHBondContact OG1-CB 3.25Å; T575-E578 PolarHBondContact OG1-N 3.17Å; T575-E578 PolarHBondContact OG1-O 3.44Å; E578-H589 VanDerWaalsContact CD-ND1 3.33Å; E578-H589 WeakPolarHBondContact OE1-CB 3.41Å; E578-H589 IonicContact OE1-CE1 3.61Å; E578-H589 IonicContact OE1-CG 3.56Å; E578-H589 VanDerWaalsContact OE1-CG 3.29Å; E578-H589 IonicContact OE1-ND1 2.98Å; E578-H589 PolarHBondContact OE1-ND1 2.94Å; E578-H589 IonicContact OE2-ND1 3.66Å; E578-Y590 CarbonylContact C-O 3.48Å; E578-Y590 VanDerWaalsContact CA-O 3.28Å; E578-Y590 WeakPolarHBondContact CA-O 3.38Å
579	V	87.3	Confident	85	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	128.8	169.8	159.4	0	0	0	0	109.1	F571 R574 V581 Y590 I592	F571-V579 HydrophobicContact CD2-CG1 3.79Å; F571-V579 HydrophobicContact CE2-CB 4.42Å; F571-V579 HydrophobicContact CE2-CG1 3.69Å; F571-V579 HydrophobicContact CE2-CG2 4.09Å; R574-V579 HydrophobicContact CG-CG2 4.08Å; V579-V581 HydrophobicContact CG1-CG2 3.78Å; V579-Y590 PolarHBondContact N-O 2.78Å; V579-Y590 PolarHBondContact O-N 3.1Å; V579-I592 HydrophobicContact CB-CD1 4.27Å; V579-I592 HydrophobicContact CG2-CD1 3.41Å; V579-I592 VanDerWaalsContact CG2-CD1 3.41Å; V579-I592 HydrophobicContact CG2-CG1 4.17Å
580	V	89.3	Confident	85.1	Confident	7 Å²	7	41.4 Å²	41.4	4%	0.042	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	122.4	177.6	-172.5	0	0	0	0	109.1	T572 T573 E587 K588	T572-V580 PolarHBondContact N-O 3.46Å; T572-V580 PolarHBondContact OG1-O 2.88Å; T573-V580 PolarHBondContact O-N 2.98Å; V580-E587 HydrophobicContact CG1-CB 4.17Å; V580-E587 HydrophobicContact CG1-CG 4.5Å; V580-K588 WeakPolarHBondContact CA-O 3.44Å
581	V	89.6	Confident	85.2	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	126.7	177.7	-174	0	0	0	0	108.9	A507 V508 V570 V579 I583 K588	A507-V581 HydrophobicContact CB-CG1 3.89Å; A507-V581 HydrophobicContact CB-CG2 4.34Å; V508-V581 HydrophobicContact CG2-CG2 3.88Å; V570-V581 CarbonylContact O-C 3.51Å; V570-V581 WeakPolarHBondContact O-CA 3.39Å; V579-V581 HydrophobicContact CG1-CG2 3.78Å; V581-I583 HydrophobicContact CB-CG1 4.42Å; V581-I583 HydrophobicContact CG1-CD1 4.39Å; V581-I583 HydrophobicContact CG1-CG1 3.82Å; V581-K588 PolarHBondContact N-O 3.23Å; V581-K588 PolarHBondContact O-N 2.79Å
582	K	89.6	Confident	85.1	Confident	48 Å²	48	42 Å²	42	21%	0.209	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	108.6	173.5	-171.4	173.9	-179	174.5	0	108.8	E545 V570 T572 G585 V586 E587	E545-K582 IonicContact OE1-NZ 2.74Å; E545-K582 PolarHBondContact OE1-NZ 3.31Å; V570-K582 HydrophobicContact CB-CB 4.33Å; V570-K582 PolarHBondContact N-O 3.42Å; V570-K582 PolarHBondContact O-N 3.07Å; T572-K582 HydrophobicContact CG2-CB 4.11Å; K582-G585 WeakPolarHBondContact CE-O 3.11Å; K582-V586 WeakPolarHBondContact CA-O 3.47Å; K582-E587 HydrophobicContact CB-CG 4.38Å; K582-E587 HydrophobicContact CG-CG 4.35Å
583	I	86.1	Confident	85.3	Confident	5 Å²	5	43.3 Å²	43.3	3%	0.026	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	117.3	-179.7	-55.1	-176.1	0	0	0	107.7	T504 Y569 V581 G585 V586 K588	T504-I583 HydrophobicContact CG2-CD1 4.36Å; Y569-I583 HydrophobicContact CD1-CB 4.31Å; Y569-I583 HydrophobicContact CD1-CD1 3.79Å; Y569-I583 HydrophobicContact CD1-CG1 3.74Å; Y569-I583 HydrophobicContact CD1-CG2 3.82Å; Y569-I583 HydrophobicContact CE1-CB 4.41Å; Y569-I583 HydrophobicContact CE1-CD1 3.99Å; Y569-I583 HydrophobicContact CE1-CG1 4.18Å; Y569-I583 HydrophobicContact CE1-CG2 3.46Å; Y569-I583 VanDerWaalsContact CE1-CG2 3.46Å; V581-I583 HydrophobicContact CB-CG1 4.42Å; V581-I583 HydrophobicContact CG1-CD1 4.39Å; V581-I583 HydrophobicContact CG1-CG1 3.82Å; I583-G585 PolarHBondContact O-N 3Å; I583-V586 PolarHBondContact N-O 3.18Å; I583-V586 PolarHBondContact O-N 3.46Å; I583-K588 HydrophobicContact CD1-CD 3.9Å
584	R	77.9	Confident	85.5	Confident	138 Å²	138	43.6 Å²	43.6	52%	0.521	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	38.5	-178.7	-56	177.7	-172.8	-156.3	-5.8	113.4	L492 G568 V586	L492-R584 PolarHBondContact O-NH2 3.47Å; G568-R584 PolarHBondContact O-N 3.45Å; R584-V586 VanDerWaalsContact C-N 3.3Å; R584-V586 PolarHBondContact O-N 3.35Å
585	G	77.7	Confident	85.7	Confident	52 Å²	52	44.1 Å²	44.1	54%	0.536	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.6	-14.3	-178.8	0	0	0	0	0	115.4	K582 I583	K582-G585 WeakPolarHBondContact CE-O 3.11Å; I583-G585 PolarHBondContact O-N 3Å
586	V	86.5	Confident	86.2	Confident	92 Å²	92	43.5 Å²	43.5	56%	0.558	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-96.3	123.7	-179.4	-176.6	0	0	0	0	110	K582 I583 R584 K588	K582-V586 WeakPolarHBondContact CA-O 3.47Å; I583-V586 PolarHBondContact N-O 3.18Å; I583-V586 PolarHBondContact O-N 3.46Å; R584-V586 VanDerWaalsContact C-N 3.3Å; R584-V586 PolarHBondContact O-N 3.35Å; V586-K588 PolarHBondContact O-N 2.6Å
587	E	88	Confident	86.7	Confident	109 Å²	109	43.4 Å²	43.4	51%	0.509	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	120.4	173.9	-66.5	-172.1	161.4	0	0	110.2	V580 K582	V580-E587 HydrophobicContact CG1-CB 4.17Å; V580-E587 HydrophobicContact CG1-CG 4.5Å; K582-E587 HydrophobicContact CB-CG 4.38Å; K582-E587 HydrophobicContact CG-CG 4.35Å
588	K	90.2	Very high	86.8	Confident	60 Å²	60	39.6 Å²	39.6	26%	0.261	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	137.1	173.5	-64.7	-165.4	-167.2	170	0	109.8	V580 V581 I583 V586 Y590 P612	V580-K588 WeakPolarHBondContact CA-O 3.44Å; V581-K588 PolarHBondContact N-O 3.23Å; V581-K588 PolarHBondContact O-N 2.79Å; I583-K588 HydrophobicContact CD1-CD 3.9Å; V586-K588 PolarHBondContact O-N 2.6Å; K588-Y590 HydrophobicContact CB-CD2 4.47Å; K588-Y590 HydrophobicContact CB-CE2 3.82Å; K588-P612 HydrophobicContact CB-CG 4.15Å
589	H	90.5	Very high	86.3	Confident	84 Å²	84	39 Å²	39	39%	0.389	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	113.4	-174.5	-78.1	-100.5	0	0	0	110.1	E578 P612	E578-H589 VanDerWaalsContact CD-ND1 3.33Å; E578-H589 WeakPolarHBondContact OE1-CB 3.41Å; E578-H589 IonicContact OE1-CE1 3.61Å; E578-H589 IonicContact OE1-CG 3.56Å; E578-H589 VanDerWaalsContact OE1-CG 3.29Å; E578-H589 IonicContact OE1-ND1 2.98Å; E578-H589 PolarHBondContact OE1-ND1 2.94Å; E578-H589 IonicContact OE2-ND1 3.66Å; H589-P612 WeakPolarHBondContact O-CG 3.49Å
590	Y	91.7	Very high	85.4	Confident	11 Å²	11	41.8 Å²	41.8	4%	0.043	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	116.2	178	-68.8	-89.6	0	0	0	109.9	T504 V508 E578 V579 K588 I592 E611 P612 M619	T504-Y590 HydrophobicContact CG2-CE1 4.28Å; T504-Y590 HydrophobicContact CG2-CE2 4.32Å; T504-Y590 WeakPolarHBondContact CG2-OH 3.37Å; V508-Y590 HydrophobicContact CG1-CG 4.45Å; V508-Y590 HydrophobicContact CG2-CD1 4.48Å; V508-Y590 HydrophobicContact CG2-CD2 3.8Å; V508-Y590 HydrophobicContact CG2-CE2 4.02Å; V508-Y590 HydrophobicContact CG2-CG 4.05Å; E578-Y590 CarbonylContact C-O 3.48Å; E578-Y590 VanDerWaalsContact CA-O 3.28Å; E578-Y590 WeakPolarHBondContact CA-O 3.38Å; V579-Y590 PolarHBondContact N-O 2.78Å; V579-Y590 PolarHBondContact O-N 3.1Å; K588-Y590 HydrophobicContact CB-CD2 4.47Å; K588-Y590 HydrophobicContact CB-CE2 3.82Å; Y590-I592 PolarHBondContact O-N 2.86Å; Y590-E611 HydrophobicContact CD1-CG 4.35Å; Y590-E611 HydrophobicContact CE1-CG 4.11Å; Y590-P612 HydrophobicContact CE1-CG 4.42Å; Y590-M619 HydrophobicContact CE1-CE 4.44Å
591	G	90	Very high	84.6	Confident	21 Å²	21	48.8 Å²	48.8	22%	0.216	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	115.7	176.7	0	0	0	0	0	111	T577 L593 V609 R610	T577-G591 CarbonylContact O-C 3.51Å; T577-G591 WeakPolarHBondContact O-CA 2.9Å; G591-L593 PolarHBondContact O-N 3.5Å; G591-V609 CarbonylContact O-C 3.58Å; G591-V609 VanDerWaalsContact O-CA 3.27Å; G591-V609 WeakPolarHBondContact O-CA 3.43Å; G591-R610 PolarHBondContact N-O 2.87Å; G591-R610 PolarHBondContact O-N 3.36Å
592	I	88.3	Confident	84.3	Confident	13 Å²	13	49.4 Å²	49.4	7%	0.067	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	114.6	173.7	-62.9	-179.4	0	0	0	108.7	T577 V579 Y590 V595 V607 I1220	T577-I592 PolarHBondContact O-N 2.92Å; V579-I592 HydrophobicContact CB-CD1 4.27Å; V579-I592 HydrophobicContact CG2-CD1 3.41Å; V579-I592 VanDerWaalsContact CG2-CD1 3.41Å; V579-I592 HydrophobicContact CG2-CG1 4.17Å; Y590-I592 PolarHBondContact O-N 2.86Å; I592-V595 HydrophobicContact CG2-CG2 3.67Å; I592-V607 HydrophobicContact CG1-CG1 4.47Å; I592-V607 HydrophobicContact CG2-CG1 4.14Å; I592-I1220 HydrophobicContact CD1-CG2 4.42Å
593	L	89.3	Confident	84	Confident	36 Å²	36	50.6 Å²	50.6	19%	0.188	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-55.7	177.9	-58.8	177.7	0	0	0	110.8	G591 V608 R610 I616 Y668 R1221	G591-L593 PolarHBondContact O-N 3.5Å; L593-V608 HydrophobicContact CB-CB 4.47Å; L593-V608 HydrophobicContact CB-CG1 4.45Å; L593-V608 WeakPolarHBondContact CB-O 3.27Å; L593-V608 HydrophobicContact CD1-CG1 4.33Å; L593-V608 PolarHBondContact N-O 2.96Å; L593-R610 HydrophobicContact CD1-CB 4.32Å; L593-R610 HydrophobicContact CG-CB 4.44Å; L593-I616 HydrophobicContact CD1-CD1 4.34Å; L593-I616 HydrophobicContact CD1-CG1 4.35Å; L593-I616 HydrophobicContact CD1-CG2 4.16Å; L593-Y668 HydrophobicContact CB-CE2 4.43Å; L593-Y668 WeakPolarHBondContact CB-OH 3.33Å; L593-Y668 HydrophobicContact CD1-CE1 4.12Å; L593-Y668 HydrophobicContact CD1-CE2 4.11Å; L593-R1221 PolarHBondContact O-NH2 3.21Å
594	H	87.5	Confident	84.2	Confident	25 Å²	25	50.5 Å²	50.5	12%	0.116	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	144.1	178.2	-72.2	-92.6	0	0	0	110.9	V608 Y668 W671 F675	H594-V608 HydrophobicContact CB-CB 4.29Å; H594-V608 HydrophobicContact CB-CG2 4.15Å; H594-V608 PolarHBondContact N-O 3.04Å; H594-V608 PolarHBondContact O-N 3.48Å; H594-Y668 PolarHBondContact CD2-OH 3.37Å; H594-Y668 PolarHBondContact NE2-OH 3.22Å; H594-W671 HydrophobicContact CB-CH2 4.08Å; H594-W671 HydrophobicContact CB-CZ3 4.11Å; H594-W671 AromaticContact CD2-CZ3 3.77Å; H594-W671 AromaticContact CG-CZ3 3.78Å; H594-F675 AromaticContact CE1-CD1 3.85Å; H594-F675 AromaticContact ND1-CD1 3.69Å; H594-F675 AromaticContact ND1-CE1 3.62Å
595	V	86.4	Confident	84.8	Confident	13 Å²	13	44.1 Å²	44.1	8%	0.079	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	125.5	172.5	-176.6	0	0	0	0	106.8	I592 D597 M605 V607 I1220	I592-V595 HydrophobicContact CG2-CG2 3.67Å; V595-D597 WeakPolarHBondContact CG1-OD1 3.47Å; V595-M605 HydrophobicContact CG1-CE 3.82Å; V595-V607 HydrophobicContact CG1-CG2 4.47Å; V595-V607 HydrophobicContact CG2-CG1 4.43Å; V595-I1220 HydrophobicContact CB-CD1 4.22Å; V595-I1220 HydrophobicContact CG1-CD1 3.84Å; V595-I1220 HydrophobicContact CG2-CD1 3.77Å; V595-I1220 HydrophobicContact CG2-CG2 4.43Å
596	L	88.7	Confident	85.4	Confident	4 Å²	4	41.6 Å²	41.6	2%	0.021	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	94.2	175.5	-57.1	178.1	0	0	0	106.7	G606 W671 F675 A693 I696 E697	L596-G606 WeakPolarHBondContact CA-O 3.37Å; L596-G606 WeakPolarHBondContact CB-O 2.85Å; L596-G606 PolarHBondContact N-O 3.21Å; L596-G606 PolarHBondContact O-N 3.4Å; L596-G606 VanDerWaalsContact O-N 3.08Å; L596-W671 HydrophobicContact CD2-CH2 3.99Å; L596-W671 HydrophobicContact CD2-CZ2 3.96Å; L596-F675 HydrophobicContact CD2-CE2 3.86Å; L596-F675 HydrophobicContact CD2-CZ 4.43Å; L596-A693 HydrophobicContact CD1-CB 4.18Å; L596-A693 HydrophobicContact CD2-CB 3.87Å; L596-A693 HydrophobicContact CG-CB 4.49Å; L596-I696 HydrophobicContact CD1-CG2 3.78Å; L596-E697 HydrophobicContact CD1-CG 3.82Å; L596-E697 VanDerWaalsContact CD1-OE1 3.31Å; L596-E697 WeakPolarHBondContact CD1-OE1 3.33Å
597	D	82	Confident	85.7	Confident	35 Å²	35	37.3 Å²	37.3	19%	0.187	19%	0.188	C	C	.	.			trans	-57.1	148.8	-173	-62.8	-12.3	0	0	0	111.2	V595 R602 Q1216 S1217	V595-D597 WeakPolarHBondContact CG1-OD1 3.47Å; D597-R602 WeakPolarHBondContact O-CD 3.35Å; D597-R602 PolarHBondContact O-NH1 3.03Å; D597-Q1216 HydrophobicContact CB-CB 4.45Å; D597-Q1216 PolarHBondContact OD2-N 2.96Å; D597-S1217 PolarHBondContact OD1-N 3.23Å; D597-S1217 PolarHBondContact OD2-N 3.39Å
598	F	81.1	Confident	85.9	Confident	17 Å²	17	32.1 Å²	32.1	8%	0.075	16%	0.164	C	C	.	.			trans	-70	134	172.3	175.8	-85.6	0	0	0	109.6	K603 M605 F1206 Q1208	F598-K603 VanDerWaalsContact CE2-C 3.49Å; F598-K603 VanDerWaalsContact CE2-CA 3.47Å; F598-M605 HydrophobicContact CB-CB 4.34Å; F598-F1206 HydrophobicContact CD1-CB 4.22Å; F598-F1206 HydrophobicContact CD1-CG 4.45Å; F598-F1206 HydrophobicContact CD2-CD1 4.29Å; F598-F1206 HydrophobicContact CD2-CD2 4.08Å; F598-F1206 HydrophobicContact CD2-CE1 4.49Å; F598-F1206 HydrophobicContact CD2-CE2 4.27Å; F598-F1206 HydrophobicContact CD2-CG 4.08Å; F598-F1206 HydrophobicContact CD2-CZ 4.48Å; F598-F1206 HydrophobicContact CE1-CB 3.35Å; F598-F1206 HydrophobicContact CE1-CD1 4.47Å; F598-F1206 HydrophobicContact CE1-CD2 4.45Å; F598-F1206 AromaticContact CE1-CG 3.89Å; F598-F1206 HydrophobicContact CE1-CG 3.89Å; F598-F1206 HydrophobicContact CE2-CB 3.76Å; F598-F1206 HydrophobicContact CE2-CD1 4.07Å; F598-F1206 AromaticContact CE2-CD2 3.21Å; F598-F1206 HydrophobicContact CE2-CD2 3.21Å; F598-F1206 HydrophobicContact CE2-CE1 4.49Å; F598-F1206 AromaticContact CE2-CE2 3.71Å; F598-F1206 HydrophobicContact CE2-CE2 3.71Å; F598-F1206 AromaticContact CE2-CG 3.42Å; F598-F1206 HydrophobicContact CE2-CG 3.42Å; F598-F1206 VanDerWaalsContact CE2-CG 3.42Å; F598-F1206 HydrophobicContact CE2-CZ 4.33Å; F598-F1206 HydrophobicContact CZ-CB 3.13Å; F598-F1206 HydrophobicContact CZ-CD1 4.25Å; F598-F1206 AromaticContact CZ-CD2 3.51Å; F598-F1206 HydrophobicContact CZ-CD2 3.51Å; F598-F1206 HydrophobicContact CZ-CE2 4.43Å; F598-F1206 AromaticContact CZ-CG 3.38Å; F598-F1206 HydrophobicContact CZ-CG 3.38Å; F598-Q1208 HydrophobicContact CD1-CB 4.35Å
599	T	74.6	Confident	86.1	Confident	48 Å²	48	29.3 Å²	29.3	29%	0.294	15%	0.151	S	C	.	.			trans	-133.9	153.4	162.1	85.3	0	0	0	0	109.4	F601 R602 K603	T599-F601 PolarHBondContact O-N 3.12Å; T599-R602 HydrophobicContact CG2-CG 4.1Å; T599-R602 PolarHBondContact O-N 3.24Å; T599-R602 VanDerWaalsContact O-N 3.14Å; T599-R602 WeakPolarHBondContact OG1-CG 3.15Å; T599-R602 PolarHBondContact OG1-N 3.12Å; T599-K603 PolarHBondContact O-N 2.99Å
600	S	69.3	Low	86.2	Confident	59 Å²	59	31.5 Å²	31.5	41%	0.413	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-28	179.1	71.1	0	0	0	0	112.6	K603 E1210	S600-K603 WeakPolarHBondContact O-CG 3.42Å; S600-E1210 WeakPolarHBondContact CA-OE1 3.23Å; S600-E1210 WeakPolarHBondContact CB-OE1 3.34Å; S600-E1210 PolarHBondContact N-OE1 3.18Å; S600-E1210 PolarHBondContact OG-OE1 3.42Å; S600-E1210 PolarHBondContact OG-OE2 2.96Å
601	F	71	Confident	86.1	Confident	153 Å²	153	32.9 Å²	32.9	67%	0.671	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-49.9	174.8	-167.4	-95.6	0	0	0	111.6	T599 E690	T599-F601 PolarHBondContact O-N 3.12Å; F601-E690 WeakPolarHBondContact CD1-OE1 3.16Å; F601-E690 WeakPolarHBondContact CD1-OE2 3.41Å; F601-E690 VanDerWaalsContact CE1-CD 3.43Å; F601-E690 WeakPolarHBondContact CE1-OE1 3.32Å; F601-E690 WeakPolarHBondContact CE1-OE2 3.31Å
602	R	83.7	Confident	85.9	Confident	14 Å²	14	35.6 Å²	35.6	5%	0.053	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-26.2	-179.4	9	172.8	39.9	-123.7	-18.7	113.8	D597 T599 R604 V626 E697	D597-R602 WeakPolarHBondContact O-CD 3.35Å; D597-R602 PolarHBondContact O-NH1 3.03Å; T599-R602 HydrophobicContact CG2-CG 4.1Å; T599-R602 PolarHBondContact O-N 3.24Å; T599-R602 VanDerWaalsContact O-N 3.14Å; T599-R602 WeakPolarHBondContact OG1-CG 3.15Å; T599-R602 PolarHBondContact OG1-N 3.12Å; R602-R604 HydrophobicContact CB-CG 4.47Å; R602-R604 PolarHBondContact O-N 3.4Å; R602-V626 WeakPolarHBondContact O-CG1 3.23Å; R602-E697 IonicContact NH2-OE1 2.73Å; R602-E697 IonicContact NH2-OE2 3.74Å; R602-E697 PolarHBondContact NH2-OE2 3.3Å
603	K	84.4	Confident	85.8	Confident	74 Å²	74	39.4 Å²	39.4	32%	0.322	20%	0.197	S	C	.	.			trans	50.9	27.1	-179.9	-52.5	176.9	-176.3	164.8	0	115.7	F598 T599 S600 A623 V626	F598-K603 VanDerWaalsContact CE2-C 3.49Å; F598-K603 VanDerWaalsContact CE2-CA 3.47Å; T599-K603 PolarHBondContact O-N 2.99Å; S600-K603 WeakPolarHBondContact O-CG 3.42Å; K603-A623 HydrophobicContact CB-CB 4.04Å; K603-A623 PolarHBondContact O-N 2.8Å; K603-A623 VanDerWaalsContact O-N 3.07Å; K603-V626 HydrophobicContact CB-CG2 4.03Å; K603-V626 HydrophobicContact CD-CG2 4.3Å
604	R	89.5	Confident	85.6	Confident	2 Å²	2	40 Å²	40	1%	0.008	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	155.2	178	67.7	-173.9	-178.5	-99	4.7	110.6	R602 V620 K621 V626 I627 R630 N694 E697	R602-R604 HydrophobicContact CB-CG 4.47Å; R602-R604 PolarHBondContact O-N 3.4Å; R604-V620 HydrophobicContact CB-CG1 4.29Å; R604-K621 WeakPolarHBondContact CA-O 3.27Å; R604-V626 HydrophobicContact CG-CG1 4.38Å; R604-I627 HydrophobicContact CB-CD1 4.34Å; R604-R630 VanDerWaalsContact NH1-NH2 3.16Å; R604-N694 PolarHBondContact NH2-OD1 3.1Å; R604-N694 VanDerWaalsContact NH2-OD1 3.07Å; R604-E697 IonicContact CZ-OE2 3.89Å; R604-E697 IonicContact NE-OE1 3.46Å; R604-E697 IonicContact NE-OE2 3.15Å; R604-E697 PolarHBondContact NE-OE2 3.1Å; R604-E697 IonicContact NH2-OE2 3.93Å; R604-E697 PolarHBondContact NH2-OE2 3.07Å
605	M	90	Very high	85.8	Confident	4 Å²	4	45 Å²	45	2%	0.02	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	134.8	172.1	-176.4	-168.3	-177	0	0	108.4	T511 V595 F598 V607 V620 K621	T511-M605 HydrophobicContact CG2-CE 3.48Å; T511-M605 VanDerWaalsContact CG2-CE 3.48Å; T511-M605 HydrophobicContact CG2-SD 4.29Å; V595-M605 HydrophobicContact CG1-CE 3.82Å; F598-M605 HydrophobicContact CB-CB 4.34Å; M605-V607 HydrophobicContact CE-CG2 4.09Å; M605-V620 WeakPolarHBondContact O-CA 3.45Å; M605-V620 WeakPolarHBondContact O-CG1 3.37Å; M605-K621 HydrophobicContact CB-CG 4.2Å; M605-K621 PolarHBondContact N-O 3.01Å; M605-K621 PolarHBondContact O-N 3.41Å; M605-K621 VanDerWaalsContact SD-CE 3.54Å
606	G	91.5	Very high	86.1	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	146	175.5	0	0	0	0	0	111.3	L596 M619	L596-G606 WeakPolarHBondContact CA-O 3.37Å; L596-G606 WeakPolarHBondContact CB-O 2.85Å; L596-G606 PolarHBondContact N-O 3.21Å; L596-G606 PolarHBondContact O-N 3.4Å; L596-G606 VanDerWaalsContact O-N 3.08Å; G606-M619 CarbonylContact C-O 3.59Å; G606-M619 WeakPolarHBondContact CA-O 3.32Å
607	V	91.9	Very high	86.3	Confident	2 Å²	2	44.7 Å²	44.7	1%	0.012	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	126.2	169.8	-171.9	0	0	0	0	108.6	C509 I592 V595 M605 V609 M619	C509-V607 HydrophobicContact CB-CG2 4.41Å; I592-V607 HydrophobicContact CG1-CG1 4.47Å; I592-V607 HydrophobicContact CG2-CG1 4.14Å; V595-V607 HydrophobicContact CG1-CG2 4.47Å; V595-V607 HydrophobicContact CG2-CG1 4.43Å; M605-V607 HydrophobicContact CE-CG2 4.09Å; V607-V609 HydrophobicContact CB-CG1 4.3Å; V607-V609 HydrophobicContact CG1-CG1 3.55Å; V607-M619 PolarHBondContact N-O 2.57Å; V607-M619 PolarHBondContact O-N 3.33Å
608	V	93.1	Very high	86.9	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	113.8	172.6	-167.8	0	0	0	0	107.7	L593 H594 I616 V618 Y668 I696	L593-V608 HydrophobicContact CB-CB 4.47Å; L593-V608 HydrophobicContact CB-CG1 4.45Å; L593-V608 WeakPolarHBondContact CB-O 3.27Å; L593-V608 HydrophobicContact CD1-CG1 4.33Å; L593-V608 PolarHBondContact N-O 2.96Å; H594-V608 HydrophobicContact CB-CB 4.29Å; H594-V608 HydrophobicContact CB-CG2 4.15Å; H594-V608 PolarHBondContact N-O 3.04Å; H594-V608 PolarHBondContact O-N 3.48Å; V608-I616 HydrophobicContact CG1-CG2 3.84Å; V608-V618 HydrophobicContact CG1-CG2 4.27Å; V608-V618 HydrophobicContact CG2-CG2 4.24Å; V608-Y668 HydrophobicContact CG1-CD2 4.06Å; V608-Y668 HydrophobicContact CG1-CE2 3.79Å; V608-I696 HydrophobicContact CG1-CD1 4.34Å; V608-I696 HydrophobicContact CG2-CD1 3.98Å
609	V	93.3	Very high	87.5	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	148.9	-175.2	-60.5	0	0	0	0	111.8	V508 G591 V607 I616 S617 M619	V508-V609 HydrophobicContact CG1-CG1 3.93Å; G591-V609 CarbonylContact O-C 3.58Å; G591-V609 VanDerWaalsContact O-CA 3.27Å; G591-V609 WeakPolarHBondContact O-CA 3.43Å; V607-V609 HydrophobicContact CB-CG1 4.3Å; V607-V609 HydrophobicContact CG1-CG1 3.55Å; V609-I616 WeakPolarHBondContact O-CA 3.41Å; V609-S617 WeakPolarHBondContact CG2-OG 3.34Å; V609-S617 PolarHBondContact N-O 2.75Å; V609-S617 PolarHBondContact O-N 3.44Å; V609-M619 HydrophobicContact CG2-CE 3.63Å; V609-M619 HydrophobicContact CG2-CG 4.22Å; V609-M619 HydrophobicContact CG2-SD 3.9Å
610	R	93.3	Very high	88.5	Confident	131 Å²	131	40.3 Å²	40.3	49%	0.494	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	113.8	162.5	-175.4	176.9	-65	170.9	1.1	108	G591 L593 R615	G591-R610 PolarHBondContact N-O 2.87Å; G591-R610 PolarHBondContact O-N 3.36Å; L593-R610 HydrophobicContact CD1-CB 4.32Å; L593-R610 HydrophobicContact CG-CB 4.44Å; R610-R615 WeakPolarHBondContact CA-O 3.42Å
611	E	89.9	Confident	89.6	Confident	40 Å²	40	37.9 Å²	37.9	19%	0.187	19%	0.185	C	C	.	.			trans	-69.7	160.4	177.8	-72.6	-178.1	-164.4	0	0	111.8	Y590 N613 G614 R615 S617	Y590-E611 HydrophobicContact CD1-CG 4.35Å; Y590-E611 HydrophobicContact CE1-CG 4.11Å; E611-N613 WeakPolarHBondContact CB-OD1 3.5Å; E611-N613 PolarHBondContact O-N 3.13Å; E611-N613 VanDerWaalsContact O-N 3.07Å; E611-N613 PolarHBondContact OE2-ND2 2.8Å; E611-N613 PolarHBondContact OE2-OD1 2.8Å; E611-G614 PolarHBondContact O-N 2.87Å; E611-R615 PolarHBondContact N-O 2.9Å; E611-S617 WeakPolarHBondContact CG-OG 3.38Å; E611-S617 VanDerWaalsContact OE1-CB 3.31Å; E611-S617 WeakPolarHBondContact OE1-CB 3.45Å; E611-S617 PolarHBondContact OE1-OG 3.06Å
612	P	85.8	Confident	90.5	Very high	77 Å²	77	30.6 Å²	30.6	50%	0.5	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-25.3	175.5	-23.3	29.2	0	0	0	114.4	K588 H589 Y590 G614	K588-P612 HydrophobicContact CB-CG 4.15Å; H589-P612 WeakPolarHBondContact O-CG 3.49Å; Y590-P612 HydrophobicContact CE1-CG 4.42Å; P612-G614 VanDerWaalsContact C-N 3.27Å; P612-G614 PolarHBondContact O-N 3.43Å
613	N	86.3	Confident	90.6	Very high	93 Å²	93	29.9 Å²	29.9	50%	0.497	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-2.2	177.2	61.8	19.7	0	0	0	113.4	E611 R615	E611-N613 WeakPolarHBondContact CB-OD1 3.5Å; E611-N613 PolarHBondContact O-N 3.13Å; E611-N613 VanDerWaalsContact O-N 3.07Å; E611-N613 PolarHBondContact OE2-ND2 2.8Å; E611-N613 PolarHBondContact OE2-OD1 2.8Å; N613-R615 VanDerWaalsContact OD1-CB 3.28Å; N613-R615 WeakPolarHBondContact OD1-CB 3.3Å; N613-R615 WeakPolarHBondContact OD1-CG 3.43Å; N613-R615 PolarHBondContact OD1-N 2.9Å
614	G	85	Confident	90.7	Very high	49 Å²	49	26.6 Å²	26.6	51%	0.505	14%	0.136	S	C	.	.	S	Bend	trans	88.5	-5.2	-179.1	0	0	0	0	0	115.6	E611 P612	E611-G614 PolarHBondContact O-N 2.87Å; P612-G614 VanDerWaalsContact C-N 3.27Å; P612-G614 PolarHBondContact O-N 3.43Å
615	R	91.5	Very high	90.5	Very high	130 Å²	130	28.9 Å²	28.9	49%	0.491	15%	0.151	S	C	.	.			trans	-72.8	149.7	177.1	-61.7	178	-173.6	-159.7	6.3	110.9	R610 E611 N613 E662	R610-R615 WeakPolarHBondContact CA-O 3.42Å; E611-R615 PolarHBondContact N-O 2.9Å; N613-R615 VanDerWaalsContact OD1-CB 3.28Å; N613-R615 WeakPolarHBondContact OD1-CB 3.3Å; N613-R615 WeakPolarHBondContact OD1-CG 3.43Å; N613-R615 PolarHBondContact OD1-N 2.9Å; R615-E662 WeakPolarHBondContact CD-OE1 3.33Å; R615-E662 IonicContact NE-OE1 2.67Å; R615-E662 IonicContact NH1-OE1 3.69Å; R615-E662 IonicContact NH1-OE2 3.34Å; R615-E662 PolarHBondContact NH1-OE2 3.1Å
616	I	92.6	Very high	90.5	Very high	9 Å²	9	29.4 Å²	29.4	5%	0.046	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	118.9	172.8	-58.7	178	0	0	0	107.1	L593 V608 V609 V663 P665 Y668	L593-I616 HydrophobicContact CD1-CD1 4.34Å; L593-I616 HydrophobicContact CD1-CG1 4.35Å; L593-I616 HydrophobicContact CD1-CG2 4.16Å; V608-I616 HydrophobicContact CG1-CG2 3.84Å; V609-I616 WeakPolarHBondContact O-CA 3.41Å; I616-V663 HydrophobicContact CG2-CB 4.26Å; I616-V663 PolarHBondContact O-N 2.96Å; I616-P665 HydrophobicContact CD1-CB 4.39Å; I616-P665 HydrophobicContact CD1-CG 4.4Å; I616-Y668 HydrophobicContact CD1-CD1 3.8Å; I616-Y668 HydrophobicContact CD1-CE1 4.42Å; I616-Y668 HydrophobicContact CD1-CG 3.96Å; I616-Y668 HydrophobicContact CG2-CD2 4.35Å; I616-Y668 HydrophobicContact CG2-CG 4.5Å
617	S	93.1	Very high	90.5	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.007	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	147.3	176.1	55.8	0	0	0	0	110.7	V609 E611 T661	V609-S617 WeakPolarHBondContact CG2-OG 3.34Å; V609-S617 PolarHBondContact N-O 2.75Å; V609-S617 PolarHBondContact O-N 3.44Å; E611-S617 WeakPolarHBondContact CG-OG 3.38Å; E611-S617 VanDerWaalsContact OE1-CB 3.31Å; E611-S617 WeakPolarHBondContact OE1-CB 3.45Å; E611-S617 PolarHBondContact OE1-OG 3.06Å; S617-T661 CarbonylContact C-O 3.56Å; S617-T661 VanDerWaalsContact CA-O 3.3Å; S617-T661 WeakPolarHBondContact CA-O 3.24Å
618	V	93.8	Very high	90.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	117	173.6	-179.1	0	0	0	0	106.1	V608 V620 W660 T661 V663 I696 E697	V608-V618 HydrophobicContact CG1-CG2 4.27Å; V608-V618 HydrophobicContact CG2-CG2 4.24Å; V618-V620 HydrophobicContact CG1-CG2 3.79Å; V618-W660 CarbonylContact O-C 3.26Å; V618-W660 WeakPolarHBondContact O-CA 3.48Å; V618-T661 HydrophobicContact CB-CG2 3.9Å; V618-T661 HydrophobicContact CG2-CG2 4.3Å; V618-T661 PolarHBondContact N-O 3.48Å; V618-T661 PolarHBondContact O-N 3.41Å; V618-V663 HydrophobicContact CB-CG2 4.44Å; V618-V663 HydrophobicContact CG2-CG2 3.37Å; V618-I696 HydrophobicContact CG2-CD1 4.1Å; V618-I696 HydrophobicContact CG2-CG1 3.73Å; V618-E697 HydrophobicContact CG1-CG 4.5Å
619	M	94.8	Very high	90.2	Very high	8 Å²	8	38.1 Å²	38.1	4%	0.039	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	126.8	178	-60.2	179.2	175.8	0	0	108.1	I505 V508 C509 Y590 G606 V607 V609	I505-M619 HydrophobicContact CG1-CB 4.21Å; I505-M619 HydrophobicContact CG1-CE 4.34Å; I505-M619 HydrophobicContact CG1-CG 3.9Å; I505-M619 HydrophobicContact CG1-SD 3.83Å; I505-M619 HydrophobicContact CG2-CB 4.1Å; V508-M619 HydrophobicContact CB-SD 4.14Å; V508-M619 HydrophobicContact CG1-SD 4.01Å; C509-M619 HydrophobicContact CB-CB 4.18Å; Y590-M619 HydrophobicContact CE1-CE 4.44Å; G606-M619 CarbonylContact C-O 3.59Å; G606-M619 WeakPolarHBondContact CA-O 3.32Å; V607-M619 PolarHBondContact N-O 2.57Å; V607-M619 PolarHBondContact O-N 3.33Å; V609-M619 HydrophobicContact CG2-CE 3.63Å; V609-M619 HydrophobicContact CG2-CG 4.22Å; V609-M619 HydrophobicContact CG2-SD 3.9Å
620	V	93.8	Very high	90.2	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	137.8	-173.8	-169.6	0	0	0	0	110.5	R604 M605 V618 I627 A659 E697 L700	R604-V620 HydrophobicContact CB-CG1 4.29Å; M605-V620 WeakPolarHBondContact O-CA 3.45Å; M605-V620 WeakPolarHBondContact O-CG1 3.37Å; V618-V620 HydrophobicContact CG1-CG2 3.79Å; V620-I627 HydrophobicContact CB-CD1 4.34Å; V620-I627 HydrophobicContact CG1-CD1 3.49Å; V620-I627 VanDerWaalsContact CG1-CD1 3.49Å; V620-A659 PolarHBondContact N-O 3.24Å; V620-A659 PolarHBondContact O-N 3.09Å; V620-E697 HydrophobicContact CG2-CG 4.37Å; V620-L700 HydrophobicContact CB-CD1 4.34Å; V620-L700 HydrophobicContact CG1-CD1 4.48Å; V620-L700 HydrophobicContact CG2-CD1 4.18Å; V620-L700 HydrophobicContact CG2-CD2 3.81Å
621	K	92.6	Very high	90.1	Very high	8 Å²	8	34.6 Å²	34.6	4%	0.035	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	138.9	166.6	68.4	-175	-178	-168.8	0	110.1	C509 E557 R604 M605 C657 I658	C509-K621 WeakPolarHBondContact O-CD 3.28Å; C509-K621 VanDerWaalsContact O-CE 3.28Å; C509-K621 WeakPolarHBondContact O-CE 3.33Å; C509-K621 PolarHBondContact O-NZ 2.94Å; E557-K621 VanDerWaalsContact CD-NZ 3.3Å; E557-K621 WeakPolarHBondContact OE1-CE 3.44Å; E557-K621 IonicContact OE1-NZ 3.8Å; E557-K621 PolarHBondContact OE1-NZ 3.07Å; R604-K621 WeakPolarHBondContact CA-O 3.27Å; M605-K621 HydrophobicContact CB-CG 4.2Å; M605-K621 PolarHBondContact N-O 3.01Å; M605-K621 PolarHBondContact O-N 3.41Å; M605-K621 VanDerWaalsContact SD-CE 3.54Å; K621-C657 WeakPolarHBondContact CA-O 3.35Å; K621-I658 HydrophobicContact CB-CD1 3.61Å
622	G	90.4	Very high	90	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.9	-167.9	-179.1	0	0	0	0	0	115.1	C657	G622-C657 PolarHBondContact N-O 3.03Å; G622-C657 VanDerWaalsContact N-O 3.08Å; G622-C657 PolarHBondContact O-N 2.67Å
623	A	86.6	Confident	89.8	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.198	C	C	.	.			trans	-66.4	142	178.1	0	0	0	0	0	113.2	K603 T625 V626 I627 Y1204	K603-A623 HydrophobicContact CB-CB 4.04Å; K603-A623 PolarHBondContact O-N 2.8Å; K603-A623 VanDerWaalsContact O-N 3.07Å; A623-T625 PolarHBondContact O-N 3.33Å; A623-V626 HydrophobicContact CB-CB 4.4Å; A623-V626 HydrophobicContact CB-CG2 4.23Å; A623-V626 PolarHBondContact O-N 3.11Å; A623-I627 WeakPolarHBondContact O-CB 3.38Å; A623-I627 WeakPolarHBondContact O-CG1 3.48Å; A623-I627 PolarHBondContact O-N 2.84Å; A623-Y1204 HydrophobicContact CB-CD1 3.62Å; A623-Y1204 HydrophobicContact CB-CD2 3.33Å; A623-Y1204 HydrophobicContact CB-CE1 3.96Å; A623-Y1204 HydrophobicContact CB-CE2 3.78Å; A623-Y1204 HydrophobicContact CB-CG 3.29Å
624	D	86.2	Confident	89.5	Confident	4 Å²	4	35.6 Å²	35.6	2%	0.021	20%	0.2	C	C	.	.	H	α-helix	trans	-54.9	-51.6	175.4	46.7	33.5	0	0	0	112.2	V626 I627 F628 L645 Y1204	D624-V626 PolarHBondContact O-N 2.84Å; D624-V626 VanDerWaalsContact O-N 3.08Å; D624-I627 PolarHBondContact O-N 3.11Å; D624-I627 VanDerWaalsContact O-N 3.15Å; D624-F628 HydrophobicContact CB-CD2 3.87Å; D624-F628 HydrophobicContact CB-CE2 3.89Å; D624-F628 VanDerWaalsContact O-CB 3.27Å; D624-F628 WeakPolarHBondContact O-CB 3.16Å; D624-F628 WeakPolarHBondContact O-CD2 3.2Å; D624-F628 PolarHBondContact O-N 3.5Å; D624-L645 HydrophobicContact CB-CD1 3.91Å; D624-Y1204 HydrophobicContact CB-CE2 4.34Å; D624-Y1204 WeakPolarHBondContact CB-OH 3.47Å; D624-Y1204 PolarHBondContact N-OH 2.88Å; D624-Y1204 WeakPolarHBondContact OD1-CE2 3.38Å; D624-Y1204 WeakPolarHBondContact OD2-CE2 3.21Å; D624-Y1204 PolarHBondContact OD2-OH 2.87Å
625	T	85.2	Confident	89.1	Confident	51 Å²	51	34.1 Å²	34.1	31%	0.313	18%	0.182	S	C	.	.	H	α-helix	trans	-47.9	-43.4	178.1	44.7	0	0	0	0	112.2	A623 E629 H1202	A623-T625 PolarHBondContact O-N 3.33Å; T625-E629 VanDerWaalsContact O-CG 3.28Å; T625-E629 WeakPolarHBondContact O-CG 3.37Å; T625-H1202 HydrophobicContact CG2-CB 4.41Å
626	V	89.7	Confident	88.6	Confident	15 Å²	15	35 Å²	35	9%	0.091	20%	0.196	C	C	.	.	H	α-helix	trans	-84.7	-37.8	-176	-178.4	0	0	0	0	112.6	R602 K603 R604 A623 D624 R630	R602-V626 WeakPolarHBondContact O-CG1 3.23Å; K603-V626 HydrophobicContact CB-CG2 4.03Å; K603-V626 HydrophobicContact CD-CG2 4.3Å; R604-V626 HydrophobicContact CG-CG1 4.38Å; A623-V626 HydrophobicContact CB-CB 4.4Å; A623-V626 HydrophobicContact CB-CG2 4.23Å; A623-V626 PolarHBondContact O-N 3.11Å; D624-V626 PolarHBondContact O-N 2.84Å; D624-V626 VanDerWaalsContact O-N 3.08Å; V626-R630 VanDerWaalsContact CG1-NH1 3.33Å; V626-R630 PolarHBondContact O-NH1 3.35Å
627	I	91.1	Very high	88.3	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-72.4	-42.7	-179.3	-65.9	-66.8	0	0	0	110.3	R604 V620 A623 D624 E629 R630 L631 C657 A659 L700 L702	R604-I627 HydrophobicContact CB-CD1 4.34Å; V620-I627 HydrophobicContact CB-CD1 4.34Å; V620-I627 HydrophobicContact CG1-CD1 3.49Å; V620-I627 VanDerWaalsContact CG1-CD1 3.49Å; A623-I627 WeakPolarHBondContact O-CB 3.38Å; A623-I627 WeakPolarHBondContact O-CG1 3.48Å; A623-I627 PolarHBondContact O-N 2.84Å; D624-I627 PolarHBondContact O-N 3.11Å; D624-I627 VanDerWaalsContact O-N 3.15Å; I627-E629 VanDerWaalsContact C-N 3.32Å; I627-E629 PolarHBondContact O-N 3.25Å; I627-R630 PolarHBondContact O-N 3.37Å; I627-L631 HydrophobicContact CG2-CD2 4.11Å; I627-L631 WeakPolarHBondContact O-CG 3.4Å; I627-L631 PolarHBondContact O-N 2.94Å; I627-C657 HydrophobicContact CB-CB 4.01Å; I627-C657 HydrophobicContact CG1-CB 4.08Å; I627-C657 HydrophobicContact CG2-CB 3.94Å; I627-A659 HydrophobicContact CG2-CB 3.95Å; I627-L700 HydrophobicContact CD1-CD1 4.33Å; I627-L702 HydrophobicContact CG2-CD1 4.39Å
628	F	89.6	Confident	88	Confident	44 Å²	44	38.3 Å²	38.3	19%	0.193	22%	0.215	C	C	.	.	H	α-helix	trans	-61.7	-37	-179.1	-85.2	-109.1	0	0	0	112.6	D624 R630 L631 A638 M642 L645 L702	D624-F628 HydrophobicContact CB-CD2 3.87Å; D624-F628 HydrophobicContact CB-CE2 3.89Å; D624-F628 VanDerWaalsContact O-CB 3.27Å; D624-F628 WeakPolarHBondContact O-CB 3.16Å; D624-F628 WeakPolarHBondContact O-CD2 3.2Å; D624-F628 PolarHBondContact O-N 3.5Å; F628-R630 PolarHBondContact O-N 2.87Å; F628-R630 VanDerWaalsContact O-N 3.16Å; F628-L631 HydrophobicContact CB-CD1 4.49Å; F628-L631 HydrophobicContact CD1-CD1 4.08Å; F628-L631 HydrophobicContact CE1-CD1 4.49Å; F628-L631 HydrophobicContact CG-CD1 4.13Å; F628-L631 PolarHBondContact O-N 3.45Å; F628-A638 HydrophobicContact CE1-CB 4.32Å; F628-M642 HydrophobicContact CD1-CE 3.76Å; F628-M642 HydrophobicContact CE1-CB 4.09Å; F628-M642 HydrophobicContact CE1-CE 3.7Å; F628-M642 HydrophobicContact CE1-SD 4.12Å; F628-M642 HydrophobicContact CE2-SD 4.49Å; F628-M642 HydrophobicContact CG-CE 4.23Å; F628-M642 HydrophobicContact CZ-CB 4.13Å; F628-M642 HydrophobicContact CZ-CE 4.11Å; F628-M642 HydrophobicContact CZ-SD 4Å; F628-L645 HydrophobicContact CE2-CD1 3.75Å; F628-L645 HydrophobicContact CZ-CD1 4.01Å; F628-L702 HydrophobicContact CZ-CD2 4.21Å
629	E	90.2	Very high	87.7	Confident	141 Å²	141	44.7 Å²	44.7	66%	0.659	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-21.8	173.2	-75.8	171.8	179.2	0	0	114	T625 I627	T625-E629 VanDerWaalsContact O-CG 3.28Å; T625-E629 WeakPolarHBondContact O-CG 3.37Å; I627-E629 VanDerWaalsContact C-N 3.32Å; I627-E629 PolarHBondContact O-N 3.25Å
630	R	91.8	Very high	87.4	Confident	28 Å²	28	46 Å²	46	11%	0.106	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	2.6	-172.3	-72	165.8	-177.2	75.3	3.3	113.5	R604 V626 I627 F628 N694 E697 N699 L700	R604-R630 VanDerWaalsContact NH1-NH2 3.16Å; V626-R630 VanDerWaalsContact CG1-NH1 3.33Å; V626-R630 PolarHBondContact O-NH1 3.35Å; I627-R630 PolarHBondContact O-N 3.37Å; F628-R630 PolarHBondContact O-N 2.87Å; F628-R630 VanDerWaalsContact O-N 3.16Å; R630-N694 PolarHBondContact NE-OD1 2.91Å; R630-N694 PolarHBondContact NH2-OD1 3.48Å; R630-E697 WeakPolarHBondContact CB-O 2.99Å; R630-N699 PolarHBondContact O-N 2.96Å; R630-N699 VanDerWaalsContact O-N 3.13Å; R630-L700 HydrophobicContact CB-CD1 3.98Å; R630-L700 HydrophobicContact CB-CG 4.48Å; R630-L700 PolarHBondContact O-N 3.43Å
631	L	91.4	Very high	87.3	Confident	29 Å²	29	46 Å²	46	15%	0.152	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-67.7	142	177.2	-66.5	178.4	0	0	0	110.7	I627 F628 A638 A659 L700 L702	I627-L631 HydrophobicContact CG2-CD2 4.11Å; I627-L631 WeakPolarHBondContact O-CG 3.4Å; I627-L631 PolarHBondContact O-N 2.94Å; F628-L631 HydrophobicContact CB-CD1 4.49Å; F628-L631 HydrophobicContact CD1-CD1 4.08Å; F628-L631 HydrophobicContact CE1-CD1 4.49Å; F628-L631 HydrophobicContact CG-CD1 4.13Å; F628-L631 PolarHBondContact O-N 3.45Å; L631-A638 HydrophobicContact CD1-CB 4.3Å; L631-A659 HydrophobicContact CD2-CB 4.41Å; L631-L700 CarbonylContact C-O 3.51Å; L631-L700 VanDerWaalsContact CA-O 3.24Å; L631-L700 WeakPolarHBondContact CA-O 3.4Å; L631-L700 HydrophobicContact CD2-CB 4.15Å; L631-L700 WeakPolarHBondContact CD2-O 3.47Å; L631-L702 HydrophobicContact CD1-CB 4.05Å; L631-L702 HydrophobicContact CD1-CD2 4.2Å; L631-L702 HydrophobicContact CD2-CB 3.72Å; L631-L702 HydrophobicContact CD2-CD1 4.38Å
632	A	88.5	Confident	87.1	Confident	11 Å²	11	48.1 Å²	48.1	9%	0.091	27%	0.266	C	S	.	.			trans	-63.2	145.8	167.2	0	0	0	0	0	109.8	T634 S635 N699 L700	A632-T634 PolarHBondContact O-N 3.26Å; A632-S635 WeakPolarHBondContact O-CB 3.45Å; A632-S635 PolarHBondContact O-N 2.83Å; A632-N699 HydrophobicContact CB-CB 4.18Å; A632-L700 PolarHBondContact N-O 3.4Å
633	S	81.5	Confident	87	Confident	130 Å²	130	52.1 Å²	52.1	91%	0.909	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-17.5	174.5	54.2	0	0	0	0	113.8	S635	S633-S635 VanDerWaalsContact C-N 3.35Å
634	T	79.1	Confident	87.2	Confident	90 Å²	90	53.6 Å²	53.6	55%	0.552	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-0.8	178.3	64.4	0	0	0	0	114.2	A632 L636 Q701	A632-T634 PolarHBondContact O-N 3.26Å; T634-L636 PolarHBondContact O-N 3.4Å; T634-L636 VanDerWaalsContact O-N 3.16Å; T634-Q701 PolarHBondContact OG1-NE2 2.84Å
635	S	77.7	Confident	87.3	Confident	18 Å²	18	53.6 Å²	53.6	13%	0.126	29%	0.294	C	S	.	.			trans	-70	111.2	-174	-169.1	0	0	0	0	111.8	A632 S633 F637 L702	A632-S635 WeakPolarHBondContact O-CB 3.45Å; A632-S635 PolarHBondContact O-N 2.83Å; S633-S635 VanDerWaalsContact C-N 3.35Å; S635-F637 PolarHBondContact O-N 3.18Å; S635-L702 WeakPolarHBondContact OG-CB 3.48Å; S635-L702 PolarHBondContact OG-N 2.79Å
636	L	81	Confident	87.2	Confident	148 Å²	148	54.8 Å²	54.8	78%	0.775	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-28.2	-171.7	-65.3	170.9	0	0	0	114.5	T634	T634-L636 PolarHBondContact O-N 3.4Å; T634-L636 VanDerWaalsContact O-N 3.16Å
637	F	86.1	Confident	86.9	Confident	52 Å²	52	57.1 Å²	57.1	23%	0.228	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	11.7	-166.1	-49.8	-60.4	0	0	0	114.1	L498 S635 S640 T641	L498-F637 HydrophobicContact CD1-CE2 4.02Å; L498-F637 HydrophobicContact CD1-CZ 4Å; L498-F637 HydrophobicContact CD2-CE2 4.45Å; S635-F637 PolarHBondContact O-N 3.18Å; F637-S640 PolarHBondContact O-OG 3.1Å; F637-T641 VanDerWaalsContact O-CB 3.23Å; F637-T641 WeakPolarHBondContact O-CB 3.35Å; F637-T641 PolarHBondContact O-N 3.13Å; F637-T641 PolarHBondContact O-OG1 2.92Å
638	A	86.7	Confident	86.6	Confident	28 Å²	28	57.1 Å²	57.1	23%	0.231	31%	0.308	C	S	.	.	H	α-helix	trans	-60.3	-51	-174.3	0	0	0	0	0	112.4	F628 L631 T641 M642	F628-A638 HydrophobicContact CE1-CB 4.32Å; L631-A638 HydrophobicContact CD1-CB 4.3Å; A638-T641 PolarHBondContact O-N 3.32Å; A638-M642 WeakPolarHBondContact O-CB 3.43Å; A638-M642 PolarHBondContact O-N 3.44Å
639	Q	87.1	Confident	85.8	Confident	134 Å²	134	56.3 Å²	56.3	63%	0.626	31%	0.309	S	S	*	.	H	α-helix	trans	-66.7	-48.3	-177.3	-171.7	62.4	38.8	0	0	112.4	T641 M642 D643	Q639-T641 VanDerWaalsContact C-N 3.29Å; Q639-T641 PolarHBondContact O-N 2.91Å; Q639-M642 WeakPolarHBondContact O-CB 3.41Å; Q639-M642 PolarHBondContact O-N 2.7Å; Q639-M642 VanDerWaalsContact O-N 3.14Å; Q639-D643 PolarHBondContact NE2-OD1 2.95Å; Q639-D643 PolarHBondContact O-N 3.45Å
640	S	89.9	Confident	84.7	Confident	36 Å²	36	56.8 Å²	56.8	25%	0.252	31%	0.309	S	S	.	.	H	α-helix	trans	-62.8	-37.8	179.9	53.6	0	0	0	0	112	G470 F637 H644	G470-S640 WeakPolarHBondContact CA-OG 3.5Å; F637-S640 PolarHBondContact O-OG 3.1Å; S640-H644 PolarHBondContact O-CD2 3.3Å; S640-H644 PolarHBondContact O-N 2.86Å; S640-H644 VanDerWaalsContact O-N 3.1Å
641	T	90.3	Very high	83.7	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-70.2	-34.3	176.1	-53.4	0	0	0	0	111.8	F637 A638 Q639 H644 L645 L702 A705	F637-T641 VanDerWaalsContact O-CB 3.23Å; F637-T641 WeakPolarHBondContact O-CB 3.35Å; F637-T641 PolarHBondContact O-N 3.13Å; F637-T641 PolarHBondContact O-OG1 2.92Å; A638-T641 PolarHBondContact O-N 3.32Å; Q639-T641 VanDerWaalsContact C-N 3.29Å; Q639-T641 PolarHBondContact O-N 2.91Å; T641-H644 WeakPolarHBondContact O-CB 3.11Å; T641-H644 PolarHBondContact O-N 3.16Å; T641-L645 HydrophobicContact CG2-CD1 4.21Å; T641-L645 HydrophobicContact CG2-CG 4.4Å; T641-L645 WeakPolarHBondContact O-CB 3.4Å; T641-L645 VanDerWaalsContact O-CG 3.24Å; T641-L645 WeakPolarHBondContact O-CG 3.39Å; T641-L645 PolarHBondContact O-N 3.28Å; T641-L702 HydrophobicContact CG2-CD2 3.97Å; T641-A705 HydrophobicContact CG2-CB 3.83Å
642	M	88.8	Confident	82.6	Confident	52 Å²	52	57.9 Å²	57.9	26%	0.256	33%	0.325	S	S	.	.	H	α-helix	trans	-62.2	-47.9	173.6	-168.9	67.7	102.4	0	0	111.5	F628 A638 Q639 H644 L645 E646	F628-M642 HydrophobicContact CD1-CE 3.76Å; F628-M642 HydrophobicContact CE1-CB 4.09Å; F628-M642 HydrophobicContact CE1-CE 3.7Å; F628-M642 HydrophobicContact CE1-SD 4.12Å; F628-M642 HydrophobicContact CE2-SD 4.49Å; F628-M642 HydrophobicContact CG-CE 4.23Å; F628-M642 HydrophobicContact CZ-CB 4.13Å; F628-M642 HydrophobicContact CZ-CE 4.11Å; F628-M642 HydrophobicContact CZ-SD 4Å; A638-M642 WeakPolarHBondContact O-CB 3.43Å; A638-M642 PolarHBondContact O-N 3.44Å; Q639-M642 WeakPolarHBondContact O-CB 3.41Å; Q639-M642 PolarHBondContact O-N 2.7Å; Q639-M642 VanDerWaalsContact O-N 3.14Å; M642-H644 PolarHBondContact O-N 3.1Å; M642-L645 WeakPolarHBondContact O-CB 3.47Å; M642-L645 PolarHBondContact O-N 3.39Å; M642-L645 VanDerWaalsContact O-N 3.12Å; M642-E646 PolarHBondContact O-N 3.18Å
643	D	89.3	Confident	82.2	Confident	83 Å²	83	58.1 Å²	58.1	44%	0.444	33%	0.325	S	S	.	.	H	α-helix	trans	-59.9	-36.1	176.8	-60.5	-14.9	0	0	0	111.1	Q639 N647	Q639-D643 PolarHBondContact NE2-OD1 2.95Å; Q639-D643 PolarHBondContact O-N 3.45Å; D643-N647 PolarHBondContact O-N 2.83Å
644	H	90.2	Very high	82.1	Confident	32 Å²	32	55.5 Å²	55.5	15%	0.148	30%	0.295	C	S	.	.	H	α-helix	trans	-69.7	-42.1	175.4	-66.1	-179.5	0	0	0	112.8	S467 G470 M472 S640 T641 M642 E646 N647 F648	S467-H644 PolarHBondContact OG-ND1 3.39Å; G470-H644 PolarHBondContact O-CE1 2.86Å; G470-H644 VanDerWaalsContact O-CE1 3.23Å; M472-H644 HydrophobicContact CE-CB 3.63Å; M472-H644 WeakPolarHBondContact CE-CD2 3.47Å; S640-H644 PolarHBondContact O-CD2 3.3Å; S640-H644 PolarHBondContact O-N 2.86Å; S640-H644 VanDerWaalsContact O-N 3.1Å; T641-H644 WeakPolarHBondContact O-CB 3.11Å; T641-H644 PolarHBondContact O-N 3.16Å; M642-H644 PolarHBondContact O-N 3.1Å; H644-E646 VanDerWaalsContact C-N 3.33Å; H644-N647 WeakPolarHBondContact O-CB 3.33Å; H644-N647 PolarHBondContact O-N 3.08Å; H644-N647 VanDerWaalsContact O-N 3.16Å; H644-F648 HydrophobicContact CB-CE2 4.31Å; H644-F648 HydrophobicContact CB-CZ 4.45Å; H644-F648 WeakPolarHBondContact O-CD2 3.39Å; H644-F648 WeakPolarHBondContact O-CG 3.48Å; H644-F648 PolarHBondContact O-N 3.42Å
645	L	87.2	Confident	82.4	Confident	3 Å²	3	51.9 Å²	51.9	2%	0.016	27%	0.273	C	S	.	.	H	α-helix	trans	-60.6	-42.4	175.4	-76.8	164.3	0	0	0	111.1	D624 F628 T641 M642 N647 F648 A649 T655 A705	D624-L645 HydrophobicContact CB-CD1 3.91Å; F628-L645 HydrophobicContact CE2-CD1 3.75Å; F628-L645 HydrophobicContact CZ-CD1 4.01Å; T641-L645 HydrophobicContact CG2-CD1 4.21Å; T641-L645 HydrophobicContact CG2-CG 4.4Å; T641-L645 WeakPolarHBondContact O-CB 3.4Å; T641-L645 VanDerWaalsContact O-CG 3.24Å; T641-L645 WeakPolarHBondContact O-CG 3.39Å; T641-L645 PolarHBondContact O-N 3.28Å; M642-L645 WeakPolarHBondContact O-CB 3.47Å; M642-L645 PolarHBondContact O-N 3.39Å; M642-L645 VanDerWaalsContact O-N 3.12Å; L645-N647 VanDerWaalsContact C-N 3.31Å; L645-N647 PolarHBondContact O-N 2.84Å; L645-F648 PolarHBondContact O-N 2.91Å; L645-A649 VanDerWaalsContact O-CB 3.31Å; L645-A649 WeakPolarHBondContact O-CB 3.35Å; L645-A649 PolarHBondContact O-N 2.78Å; L645-T655 VanDerWaalsContact CD2-CB 3.42Å; L645-T655 HydrophobicContact CD2-CG2 3.62Å; L645-A705 HydrophobicContact CD1-CB 4.49Å; L645-A705 HydrophobicContact CD2-CB 3.52Å; L645-A705 HydrophobicContact CG-CB 3.98Å
646	E	83.2	Confident	83	Confident	76 Å²	76	51 Å²	51	36%	0.355	27%	0.267	S	S	.	.	H	α-helix	trans	-60.4	-41.1	173.1	-76.3	-168.9	-167.3	0	0	112.1	M642 H644 A649 K650	M642-E646 PolarHBondContact O-N 3.18Å; H644-E646 VanDerWaalsContact C-N 3.33Å; E646-A649 PolarHBondContact O-N 3.29Å; E646-K650 WeakPolarHBondContact O-CB 3.32Å; E646-K650 VanDerWaalsContact O-CG 3.25Å; E646-K650 WeakPolarHBondContact O-CG 3.41Å; E646-K650 PolarHBondContact O-N 2.9Å; E646-K650 IonicContact OE2-NZ 2.76Å; E646-K650 PolarHBondContact OE2-NZ 3.42Å
647	N	84.2	Confident	83.6	Confident	64 Å²	64	44 Å²	44	34%	0.342	23%	0.23	S	C	.	.	H	α-helix	trans	-65.5	-44.8	176.7	-167.8	12.9	0	0	0	111.4	M472 D643 H644 L645 A649 K650 T651	M472-N647 HydrophobicContact CE-CB 4.13Å; D643-N647 PolarHBondContact O-N 2.83Å; H644-N647 WeakPolarHBondContact O-CB 3.33Å; H644-N647 PolarHBondContact O-N 3.08Å; H644-N647 VanDerWaalsContact O-N 3.16Å; L645-N647 VanDerWaalsContact C-N 3.31Å; L645-N647 PolarHBondContact O-N 2.84Å; N647-A649 VanDerWaalsContact C-N 3.32Å; N647-A649 PolarHBondContact O-N 3.22Å; N647-K650 PolarHBondContact O-N 2.98Å; N647-T651 PolarHBondContact O-N 3.05Å; N647-T651 PolarHBondContact O-OG1 2.86Å
648	F	84.8	Confident	84	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-59.7	-43.2	175.4	-62.2	-25.6	0	0	0	111.8	R465 M472 H644 L645 T651 G652 L653 T655 A707	R465-F648 HydrophobicContact CB-CD1 4.14Å; R465-F648 HydrophobicContact CB-CE1 3.61Å; R465-F648 HydrophobicContact CB-CZ 4.02Å; R465-F648 HydrophobicContact CG-CE1 4.37Å; M472-F648 HydrophobicContact CE-CE1 4.17Å; M472-F648 HydrophobicContact CE-CZ 4.49Å; M472-F648 HydrophobicContact CG-CE1 3.66Å; M472-F648 HydrophobicContact CG-CZ 3.78Å; M472-F648 HydrophobicContact SD-CD1 4.49Å; M472-F648 HydrophobicContact SD-CE1 3.69Å; M472-F648 HydrophobicContact SD-CZ 4.3Å; H644-F648 HydrophobicContact CB-CE2 4.31Å; H644-F648 HydrophobicContact CB-CZ 4.45Å; H644-F648 WeakPolarHBondContact O-CD2 3.39Å; H644-F648 WeakPolarHBondContact O-CG 3.48Å; H644-F648 PolarHBondContact O-N 3.42Å; L645-F648 PolarHBondContact O-N 2.91Å; F648-T651 WeakPolarHBondContact CA-OG1 3.34Å; F648-T651 CarbonylContact O-C 3.22Å; F648-T651 PolarHBondContact O-N 3.05Å; F648-T651 PolarHBondContact O-OG1 3.46Å; F648-G652 PolarHBondContact O-N 3.4Å; F648-L653 HydrophobicContact CB-CB 4.41Å; F648-L653 HydrophobicContact CD1-CD1 4.47Å; F648-L653 PolarHBondContact O-N 3.2Å; F648-T655 HydrophobicContact CB-CG2 3.54Å; F648-T655 HydrophobicContact CD2-CG2 4.07Å; F648-T655 HydrophobicContact CG-CG2 4.32Å; F648-A707 HydrophobicContact CB-CB 4.05Å; F648-A707 HydrophobicContact CD1-CB 4.17Å; F648-A707 HydrophobicContact CD2-CB 3.74Å; F648-A707 HydrophobicContact CE2-CB 4.18Å; F648-A707 HydrophobicContact CG-CB 3.73Å
649	A	72.1	Confident	84.3	Confident	28 Å²	28	40.2 Å²	40.2	23%	0.231	21%	0.208	C	C	.	.	H	α-helix	trans	-63.6	-41.7	175.7	0	0	0	0	0	112.1	L645 E646 N647 T651 G652 N743	L645-A649 VanDerWaalsContact O-CB 3.31Å; L645-A649 WeakPolarHBondContact O-CB 3.35Å; L645-A649 PolarHBondContact O-N 2.78Å; E646-A649 PolarHBondContact O-N 3.29Å; N647-A649 VanDerWaalsContact C-N 3.32Å; N647-A649 PolarHBondContact O-N 3.22Å; A649-T651 PolarHBondContact O-N 3.4Å; A649-G652 PolarHBondContact O-N 3.07Å; A649-N743 PolarHBondContact O-ND2 3.28Å
650	K	68.7	Low	84.7	Confident	151 Å²	151	36.3 Å²	36.3	66%	0.657	19%	0.188	S	C	*	.	H	α-helix	trans	-61.2	-32.5	174	-76.5	166.1	-173.7	156.7	0	112.5	E646 N647 G652	E646-K650 WeakPolarHBondContact O-CB 3.32Å; E646-K650 VanDerWaalsContact O-CG 3.25Å; E646-K650 WeakPolarHBondContact O-CG 3.41Å; E646-K650 PolarHBondContact O-N 2.9Å; E646-K650 IonicContact OE2-NZ 2.76Å; E646-K650 PolarHBondContact OE2-NZ 3.42Å; N647-K650 PolarHBondContact O-N 2.98Å; K650-G652 VanDerWaalsContact C-N 3.29Å
651	T	70.8	Confident	84.8	Confident	55 Å²	55	35.6 Å²	35.6	34%	0.337	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-2.8	173.4	55.4	0	0	0	0	114.5	N647 F648 A649	N647-T651 PolarHBondContact O-N 3.05Å; N647-T651 PolarHBondContact O-OG1 2.86Å; F648-T651 WeakPolarHBondContact CA-OG1 3.34Å; F648-T651 CarbonylContact O-C 3.22Å; F648-T651 PolarHBondContact O-N 3.05Å; F648-T651 PolarHBondContact O-OG1 3.46Å; A649-T651 PolarHBondContact O-N 3.4Å
652	G	68.5	Low	84.9	Confident	24 Å²	24	40.1 Å²	40.1	25%	0.247	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.6	15	178.2	0	0	0	0	0	115.8	F648 A649 K650	F648-G652 PolarHBondContact O-N 3.4Å; A649-G652 PolarHBondContact O-N 3.07Å; K650-G652 VanDerWaalsContact C-N 3.29Å
653	L	78.8	Confident	85	Confident	17 Å²	17	38.2 Å²	38.2	9%	0.089	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-83.6	140.9	178.6	-57.1	175.5	0	0	0	110.5	K464 R465 F648 T655 A707 E709	K464-L653 HydrophobicContact CB-CD1 4.37Å; K464-L653 HydrophobicContact CB-CD2 4.15Å; K464-L653 HydrophobicContact CG-CD2 4.44Å; R465-L653 HydrophobicContact CB-CD1 4.2Å; R465-L653 HydrophobicContact CG-CD1 4.06Å; F648-L653 HydrophobicContact CB-CB 4.41Å; F648-L653 HydrophobicContact CD1-CD1 4.47Å; F648-L653 PolarHBondContact O-N 3.2Å; L653-T655 PolarHBondContact O-N 3.14Å; L653-A707 HydrophobicContact CB-CB 3.84Å; L653-A707 HydrophobicContact CD1-CB 3.72Å; L653-A707 HydrophobicContact CG-CB 4.41Å; L653-E709 HydrophobicContact CD2-CB 3.55Å; L653-E709 HydrophobicContact CD2-CG 3.99Å
654	R	79	Confident	85.1	Confident	75 Å²	75	39.2 Å²	39.2	28%	0.283	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	118.2	172.4	-178.5	175.1	172.8	147.8	-7.7	109.1	D556 A707 I708 A1205	D556-R654 IonicContact OD2-CZ 2.92Å; D556-R654 IonicContact OD2-NE 3.59Å; D556-R654 IonicContact OD2-NH2 2.67Å; D556-R654 PolarHBondContact OD2-NH2 2.91Å; R654-A707 CarbonylContact O-C 3.58Å; R654-A707 WeakPolarHBondContact O-CA 3.48Å; R654-I708 HydrophobicContact CB-CB 4.46Å; R654-I708 WeakPolarHBondContact CB-O 3.46Å; R654-I708 PolarHBondContact N-O 3.26Å; R654-I708 PolarHBondContact O-N 2.74Å; R654-A1205 PolarHBondContact NH1-O 3.03Å; R654-A1205 PolarHBondContact NH2-O 3.21Å
655	T	85.8	Confident	85	Confident	13 Å²	13	41 Å²	41	8%	0.08	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	154.5	-176.5	49.5	0	0	0	0	111.7	L645 F648 L653 T706 Y1204	L645-T655 VanDerWaalsContact CD2-CB 3.42Å; L645-T655 HydrophobicContact CD2-CG2 3.62Å; F648-T655 HydrophobicContact CB-CG2 3.54Å; F648-T655 HydrophobicContact CD2-CG2 4.07Å; F648-T655 HydrophobicContact CG-CG2 4.32Å; L653-T655 PolarHBondContact O-N 3.14Å; T655-T706 CarbonylContact C-O 3.58Å; T655-T706 WeakPolarHBondContact CA-O 3.26Å; T655-Y1204 WeakPolarHBondContact O-CE1 3.47Å; T655-Y1204 PolarHBondContact OG1-OH 3.12Å; T655-Y1204 VanDerWaalsContact OG1-OH 3.07Å
656	L	90.4	Very high	85.2	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	134.4	163.4	-71.1	168.8	0	0	0	109.7	L560 A705 T706 I708 Y1204 F1206	L560-L656 HydrophobicContact CD1-CD1 4.03Å; L656-A705 CarbonylContact O-C 3.54Å; L656-A705 VanDerWaalsContact O-CA 3.22Å; L656-A705 WeakPolarHBondContact O-CA 3.42Å; L656-T706 WeakPolarHBondContact CB-OG1 3.39Å; L656-T706 PolarHBondContact N-O 2.81Å; L656-T706 PolarHBondContact O-N 2.88Å; L656-T706 PolarHBondContact O-OG1 2.91Å; L656-I708 HydrophobicContact CD1-CD1 4.47Å; L656-Y1204 HydrophobicContact CD2-CD1 4.15Å; L656-Y1204 HydrophobicContact CD2-CE1 4.06Å; L656-F1206 HydrophobicContact CD1-CZ 4.17Å; L656-F1206 HydrophobicContact CD2-CE2 3.57Å; L656-F1206 HydrophobicContact CD2-CZ 3.54Å; L656-F1206 HydrophobicContact CG-CZ 4.5Å
657	C	93.2	Very high	85.6	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	138.8	174.5	-68.1	0	0	0	0	110.6	K621 G622 I627 L702	K621-C657 WeakPolarHBondContact CA-O 3.35Å; G622-C657 PolarHBondContact N-O 3.03Å; G622-C657 VanDerWaalsContact N-O 3.08Å; G622-C657 PolarHBondContact O-N 2.67Å; I627-C657 HydrophobicContact CB-CB 4.01Å; I627-C657 HydrophobicContact CG1-CB 4.08Å; I627-C657 HydrophobicContact CG2-CB 3.94Å; C657-L702 HydrophobicContact CB-CD1 4.28Å
658	I	94.3	Very high	85.9	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	122.5	177	-53.1	-59.4	0	0	0	108.6	F502 I505 L506 K621 L703 G704 T706	F502-I658 HydrophobicContact CD2-CB 4.19Å; F502-I658 HydrophobicContact CD2-CG1 4.37Å; F502-I658 HydrophobicContact CD2-CG2 4.33Å; F502-I658 HydrophobicContact CE2-CB 3.93Å; F502-I658 HydrophobicContact CE2-CG1 3.75Å; F502-I658 HydrophobicContact CZ-CG1 4.27Å; I505-I658 HydrophobicContact CB-CG2 4.06Å; I505-I658 HydrophobicContact CD1-CG2 4.09Å; I505-I658 HydrophobicContact CG2-CG2 3.57Å; L506-I658 HydrophobicContact CD2-CD1 3.71Å; L506-I658 HydrophobicContact CD2-CG1 4.13Å; K621-I658 HydrophobicContact CB-CD1 3.61Å; I658-L703 HydrophobicContact CG2-CD1 4.48Å; I658-L703 PolarHBondContact O-N 3.34Å; I658-G704 PolarHBondContact N-O 3.4Å; I658-G704 PolarHBondContact O-N 2.76Å; I658-T706 HydrophobicContact CD1-CG2 4.39Å; I658-T706 HydrophobicContact CG1-CG2 4.05Å
659	A	93.9	Very high	86.2	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	159.4	-179.1	0	0	0	0	0	111.1	V620 I627 L631 L700 Q701	V620-A659 PolarHBondContact N-O 3.24Å; V620-A659 PolarHBondContact O-N 3.09Å; I627-A659 HydrophobicContact CG2-CB 3.95Å; L631-A659 HydrophobicContact CD2-CB 4.41Å; A659-L700 HydrophobicContact CB-CB 3.97Å; A659-L700 HydrophobicContact CB-CD1 4.38Å; A659-Q701 VanDerWaalsContact CA-O 3.25Å; A659-Q701 WeakPolarHBondContact CA-O 3.29Å; A659-Q701 WeakPolarHBondContact CB-O 3.43Å
660	W	94.2	Very high	87.1	Confident	53 Å²	53	53.2 Å²	53.2	20%	0.201	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	162.1	177.7	74.1	-73	0	0	0	111.6	I505 V618 E662 Q701 L703	I505-W660 HydrophobicContact CD1-CB 3.92Å; I505-W660 HydrophobicContact CD1-CG 4.31Å; V618-W660 CarbonylContact O-C 3.26Å; V618-W660 WeakPolarHBondContact O-CA 3.48Å; W660-E662 HydrophobicContact CZ3-CB 4.13Å; W660-Q701 PolarHBondContact N-O 3.08Å; W660-Q701 PolarHBondContact O-N 2.73Å; W660-L703 VanDerWaalsContact CD1-CD1 3.44Å; W660-L703 HydrophobicContact CG-CD1 4.33Å
661	T	93	Very high	88.3	Confident	20 Å²	20	46.2 Å²	46.2	12%	0.123	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	150.8	167.7	-173.1	0	0	0	0	110.9	S617 V618 V663 L700	S617-T661 CarbonylContact C-O 3.56Å; S617-T661 VanDerWaalsContact CA-O 3.3Å; S617-T661 WeakPolarHBondContact CA-O 3.24Å; V618-T661 HydrophobicContact CB-CG2 3.9Å; V618-T661 HydrophobicContact CG2-CG2 4.3Å; V618-T661 PolarHBondContact N-O 3.48Å; V618-T661 PolarHBondContact O-N 3.41Å; T661-V663 HydrophobicContact CG2-CG2 4.24Å; T661-L700 HydrophobicContact CG2-CD2 3.83Å
662	E	91.7	Very high	89.2	Confident	96 Å²	96	45.6 Å²	45.6	45%	0.449	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	138.3	167.4	-167.8	167.8	168.8	0	0	109	R615 W660	R615-E662 WeakPolarHBondContact CD-OE1 3.33Å; R615-E662 IonicContact NE-OE1 2.67Å; R615-E662 IonicContact NH1-OE1 3.69Å; R615-E662 IonicContact NH1-OE2 3.34Å; R615-E662 PolarHBondContact NH1-OE2 3.1Å; W660-E662 HydrophobicContact CZ3-CB 4.13Å
663	V	91	Very high	90.2	Very high	12 Å²	12	46.8 Å²	46.8	7%	0.073	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	129.5	-178.8	178.2	0	0	0	0	110	I616 V618 T661 F667 I696	I616-V663 HydrophobicContact CG2-CB 4.26Å; I616-V663 PolarHBondContact O-N 2.96Å; V618-V663 HydrophobicContact CB-CG2 4.44Å; V618-V663 HydrophobicContact CG2-CG2 3.37Å; T661-V663 HydrophobicContact CG2-CG2 4.24Å; V663-F667 HydrophobicContact CG1-CD1 3.68Å; V663-F667 HydrophobicContact CG1-CE1 4.45Å; V663-I696 HydrophobicContact CG2-CG1 4.23Å
664	D	91.3	Very high	90.7	Very high	103 Å²	103	48.3 Å²	48.3	55%	0.551	26%	0.256	S	S	*	.			trans	-63.9	129.6	174.4	178	50.4	0	0	0	111	A666 F667 Y668	D664-A666 PolarHBondContact O-N 2.98Å; D664-A666 VanDerWaalsContact O-N 3.13Å; D664-A666 WeakPolarHBondContact OD2-CB 3.34Å; D664-A666 PolarHBondContact OD2-N 2.83Å; D664-F667 HydrophobicContact CB-CB 4.37Å; D664-F667 WeakPolarHBondContact O-CB 3.4Å; D664-F667 PolarHBondContact O-N 3.1Å; D664-F667 VanDerWaalsContact O-N 3.07Å; D664-Y668 PolarHBondContact O-N 2.96Å
665	P	88.8	Confident	91.1	Very high	71 Å²	71	46.4 Å²	46.4	46%	0.461	25%	0.25	S	C	.	.	H	α-helix	trans	-55	-31.5	-179.5	-30	36.4	0	0	0	114.8	I616 Y668 N669	I616-P665 HydrophobicContact CD1-CB 4.39Å; I616-P665 HydrophobicContact CD1-CG 4.4Å; P665-Y668 PolarHBondContact O-N 2.8Å; P665-N669 VanDerWaalsContact O-CG 3.27Å; P665-N669 PolarHBondContact O-N 2.87Å; P665-N669 PolarHBondContact O-ND2 3.31Å; P665-N669 VanDerWaalsContact O-ND2 3.14Å
666	A	90.7	Very high	91.1	Very high	67 Å²	67	53.4 Å²	53.4	55%	0.554	28%	0.276	S	S	*	.	H	α-helix	trans	-70.8	-40.8	178	0	0	0	0	0	111.8	D664 K670	D664-A666 PolarHBondContact O-N 2.98Å; D664-A666 VanDerWaalsContact O-N 3.13Å; D664-A666 WeakPolarHBondContact OD2-CB 3.34Å; D664-A666 PolarHBondContact OD2-N 2.83Å; A666-K670 PolarHBondContact O-N 3.03Å
667	F	92	Very high	90.9	Very high	86 Å²	86	60 Å²	60	38%	0.377	31%	0.305	S	S	.	.	H	α-helix	trans	-61.7	-45.7	172	178	-93.3	0	0	0	111.3	V663 D664 N669 K670 W671 I696	V663-F667 HydrophobicContact CG1-CD1 3.68Å; V663-F667 HydrophobicContact CG1-CE1 4.45Å; D664-F667 HydrophobicContact CB-CB 4.37Å; D664-F667 WeakPolarHBondContact O-CB 3.4Å; D664-F667 PolarHBondContact O-N 3.1Å; D664-F667 VanDerWaalsContact O-N 3.07Å; F667-N669 PolarHBondContact O-N 2.87Å; F667-K670 WeakPolarHBondContact O-CB 3.32Å; F667-K670 PolarHBondContact O-N 2.75Å; F667-W671 HydrophobicContact CE1-CB 4.4Å; F667-W671 WeakPolarHBondContact O-CB 3.41Å; F667-W671 PolarHBondContact O-N 3.27Å; F667-I696 HydrophobicContact CE1-CB 4.42Å; F667-I696 HydrophobicContact CE1-CG1 4.33Å
668	Y	91.2	Very high	90.4	Very high	18 Å²	18	60.2 Å²	60.2	7%	0.071	31%	0.307	C	S	.	.	H	α-helix	trans	-57.7	-46.1	178.6	173.4	-99.8	0	0	0	112.2	L593 H594 V608 I616 D664 P665 K670 W671 V672 I696	L593-Y668 HydrophobicContact CB-CE2 4.43Å; L593-Y668 WeakPolarHBondContact CB-OH 3.33Å; L593-Y668 HydrophobicContact CD1-CE1 4.12Å; L593-Y668 HydrophobicContact CD1-CE2 4.11Å; H594-Y668 PolarHBondContact CD2-OH 3.37Å; H594-Y668 PolarHBondContact NE2-OH 3.22Å; V608-Y668 HydrophobicContact CG1-CD2 4.06Å; V608-Y668 HydrophobicContact CG1-CE2 3.79Å; I616-Y668 HydrophobicContact CD1-CD1 3.8Å; I616-Y668 HydrophobicContact CD1-CE1 4.42Å; I616-Y668 HydrophobicContact CD1-CG 3.96Å; I616-Y668 HydrophobicContact CG2-CD2 4.35Å; I616-Y668 HydrophobicContact CG2-CG 4.5Å; D664-Y668 PolarHBondContact O-N 2.96Å; P665-Y668 PolarHBondContact O-N 2.8Å; Y668-K670 VanDerWaalsContact C-N 3.29Å; Y668-K670 PolarHBondContact O-N 2.77Å; Y668-W671 HydrophobicContact CD2-CE3 4.31Å; Y668-W671 HydrophobicContact CE2-CE3 4.17Å; Y668-W671 HydrophobicContact CE2-CZ3 4.32Å; Y668-W671 WeakPolarHBondContact O-CB 3.21Å; Y668-W671 PolarHBondContact O-N 2.98Å; Y668-W671 VanDerWaalsContact O-N 3.11Å; Y668-V672 HydrophobicContact CD1-CG2 4.09Å; Y668-V672 HydrophobicContact CD2-CG2 4.23Å; Y668-V672 HydrophobicContact CE1-CG2 3.53Å; Y668-V672 HydrophobicContact CE2-CG2 3.69Å; Y668-V672 HydrophobicContact CG-CG2 4.4Å; Y668-V672 WeakPolarHBondContact O-CG2 3.24Å; Y668-V672 PolarHBondContact O-N 3Å; Y668-V672 WeakPolarHBondContact OH-CG2 3.3Å; Y668-I696 HydrophobicContact CD2-CD1 4.26Å
669	N	90.6	Very high	89.5	Confident	109 Å²	109	61.7 Å²	61.7	58%	0.583	32%	0.317	S	S	*	.	H	α-helix	trans	-61	-37.2	178.7	-71.4	-31	0	0	0	112.7	P665 F667	P665-N669 VanDerWaalsContact O-CG 3.27Å; P665-N669 PolarHBondContact O-N 2.87Å; P665-N669 PolarHBondContact O-ND2 3.31Å; P665-N669 VanDerWaalsContact O-ND2 3.14Å; F667-N669 PolarHBondContact O-N 2.87Å
670	K	91.1	Very high	88.8	Confident	147 Å²	147	65.5 Å²	65.5	64%	0.639	34%	0.34	S	S	*	.	H	α-helix	trans	-67.6	-43.2	173.9	-174.4	-178.9	178.2	-175.1	0	111.3	A666 F667 Y668 A673 N674	A666-K670 PolarHBondContact O-N 3.03Å; F667-K670 WeakPolarHBondContact O-CB 3.32Å; F667-K670 PolarHBondContact O-N 2.75Å; Y668-K670 VanDerWaalsContact C-N 3.29Å; Y668-K670 PolarHBondContact O-N 2.77Å; K670-A673 PolarHBondContact O-N 3.03Å; K670-N674 PolarHBondContact O-N 3.28Å
671	W	93.3	Very high	88.2	Confident	3 Å²	3	63.9 Å²	63.9	1%	0.011	34%	0.338	C	S	.	.	H	α-helix	trans	-61.7	-42.4	178.1	-179.9	86	0	0	0	112.2	H594 L596 F667 Y668 A673 N674 F675 V692 I696	H594-W671 HydrophobicContact CB-CH2 4.08Å; H594-W671 HydrophobicContact CB-CZ3 4.11Å; H594-W671 AromaticContact CD2-CZ3 3.77Å; H594-W671 AromaticContact CG-CZ3 3.78Å; L596-W671 HydrophobicContact CD2-CH2 3.99Å; L596-W671 HydrophobicContact CD2-CZ2 3.96Å; F667-W671 HydrophobicContact CE1-CB 4.4Å; F667-W671 WeakPolarHBondContact O-CB 3.41Å; F667-W671 PolarHBondContact O-N 3.27Å; Y668-W671 HydrophobicContact CD2-CE3 4.31Å; Y668-W671 HydrophobicContact CE2-CE3 4.17Å; Y668-W671 HydrophobicContact CE2-CZ3 4.32Å; Y668-W671 WeakPolarHBondContact O-CB 3.21Å; Y668-W671 PolarHBondContact O-N 2.98Å; Y668-W671 VanDerWaalsContact O-N 3.11Å; W671-A673 VanDerWaalsContact C-N 3.29Å; W671-A673 PolarHBondContact O-N 2.95Å; W671-N674 CarbonylContact O-C 3.45Å; W671-N674 WeakPolarHBondContact O-CB 3.42Å; W671-N674 PolarHBondContact O-N 3.44Å; W671-F675 HydrophobicContact CD2-CB 4.41Å; W671-F675 HydrophobicContact CE3-CB 4.3Å; W671-F675 HydrophobicContact CH2-CB 4.05Å; W671-F675 HydrophobicContact CH2-CD1 4.38Å; W671-F675 AromaticContact CH2-CD2 3.51Å; W671-F675 HydrophobicContact CH2-CD2 3.51Å; W671-F675 HydrophobicContact CH2-CE2 4.02Å; W671-F675 AromaticContact CH2-CG 3.71Å; W671-F675 HydrophobicContact CH2-CG 3.71Å; W671-F675 HydrophobicContact CZ2-CB 4.16Å; W671-F675 AromaticContact CZ2-CD2 3.46Å; W671-F675 HydrophobicContact CZ2-CD2 3.46Å; W671-F675 VanDerWaalsContact CZ2-CD2 3.46Å; W671-F675 HydrophobicContact CZ2-CE2 4.1Å; W671-F675 AromaticContact CZ2-CG 3.99Å; W671-F675 HydrophobicContact CZ2-CG 3.99Å; W671-F675 HydrophobicContact CZ3-CB 4.12Å; W671-F675 HydrophobicContact CZ3-CD2 4.38Å; W671-F675 HydrophobicContact CZ3-CG 4.15Å; W671-F675 WeakPolarHBondContact O-CB 3.11Å; W671-F675 PolarHBondContact O-N 3.18Å; W671-V692 HydrophobicContact CD2-CG1 4.44Å; W671-V692 HydrophobicContact CG-CG1 4.46Å; W671-V692 HydrophobicContact CZ2-CG1 4.17Å; W671-V692 PolarHBondContact NE1-O 3.12Å; W671-I696 HydrophobicContact CD2-CB 4.22Å; W671-I696 HydrophobicContact CD2-CD1 3.66Å; W671-I696 HydrophobicContact CD2-CG2 4.4Å; W671-I696 HydrophobicContact CE3-CD1 3.84Å; W671-I696 HydrophobicContact CG-CB 4.24Å; W671-I696 HydrophobicContact CG-CD1 4.05Å; W671-I696 HydrophobicContact CZ2-CB 4.34Å; W671-I696 HydrophobicContact CZ2-CD1 4.35Å; W671-I696 HydrophobicContact CZ2-CG2 3.62Å; W671-I696 HydrophobicContact CZ3-CD1 4.27Å
672	V	90.1	Very high	87.4	Confident	43 Å²	43	71.1 Å²	71.1	26%	0.261	38%	0.375	S	S	.	.	H	α-helix	trans	-56.6	-42	176.8	169.8	0	0	0	0	111.8	Y668 F675 Y676	Y668-V672 HydrophobicContact CD1-CG2 4.09Å; Y668-V672 HydrophobicContact CD2-CG2 4.23Å; Y668-V672 HydrophobicContact CE1-CG2 3.53Å; Y668-V672 HydrophobicContact CE2-CG2 3.69Å; Y668-V672 HydrophobicContact CG-CG2 4.4Å; Y668-V672 WeakPolarHBondContact O-CG2 3.24Å; Y668-V672 PolarHBondContact O-N 3Å; Y668-V672 WeakPolarHBondContact OH-CG2 3.3Å; V672-F675 PolarHBondContact O-N 3.32Å; V672-Y676 WeakPolarHBondContact O-CB 3.28Å; V672-Y676 PolarHBondContact O-N 2.79Å
673	A	89.2	Confident	86.9	Confident	48 Å²	48	72.1 Å²	72.1	40%	0.397	38%	0.384	S	S	.	.	H	α-helix	trans	-65	-39.5	177.5	0	0	0	0	0	112.1	K670 W671 K677	K670-A673 PolarHBondContact O-N 3.03Å; W671-A673 VanDerWaalsContact C-N 3.29Å; W671-A673 PolarHBondContact O-N 2.95Å; A673-K677 VanDerWaalsContact O-CG 3.31Å; A673-K677 WeakPolarHBondContact O-CG 3.45Å; A673-K677 PolarHBondContact O-N 3.5Å
674	N	90.5	Very high	86.3	Confident	49 Å²	49	77.4 Å²	77.4	26%	0.262	41%	0.412	S	S	.	.	H	α-helix	trans	-68.7	-41.6	175.2	-72.2	-9.2	0	0	0	111.8	K670 W671 Y676 K677 A678 V692	K670-N674 PolarHBondContact O-N 3.28Å; W671-N674 CarbonylContact O-C 3.45Å; W671-N674 WeakPolarHBondContact O-CB 3.42Å; W671-N674 PolarHBondContact O-N 3.44Å; N674-Y676 VanDerWaalsContact C-N 3.35Å; N674-Y676 PolarHBondContact O-N 3.13Å; N674-K677 WeakPolarHBondContact O-CB 3.09Å; N674-K677 PolarHBondContact O-N 3.09Å; N674-A678 PolarHBondContact O-N 2.66Å; N674-V692 HydrophobicContact CB-CG1 4.23Å; N674-V692 HydrophobicContact CB-CG2 4.21Å
675	F	87.2	Confident	85.6	Confident	35 Å²	35	78.6 Å²	78.6	15%	0.154	41%	0.408	C	S	.	.	H	α-helix	trans	-64.1	-41.4	178.3	-171.4	-94.1	0	0	0	111.2	H594 L596 W671 V672 K677 A678 S679 L689 V692	H594-F675 AromaticContact CE1-CD1 3.85Å; H594-F675 AromaticContact ND1-CD1 3.69Å; H594-F675 AromaticContact ND1-CE1 3.62Å; L596-F675 HydrophobicContact CD2-CE2 3.86Å; L596-F675 HydrophobicContact CD2-CZ 4.43Å; W671-F675 HydrophobicContact CD2-CB 4.41Å; W671-F675 HydrophobicContact CE3-CB 4.3Å; W671-F675 HydrophobicContact CH2-CB 4.05Å; W671-F675 HydrophobicContact CH2-CD1 4.38Å; W671-F675 AromaticContact CH2-CD2 3.51Å; W671-F675 HydrophobicContact CH2-CD2 3.51Å; W671-F675 HydrophobicContact CH2-CE2 4.02Å; W671-F675 AromaticContact CH2-CG 3.71Å; W671-F675 HydrophobicContact CH2-CG 3.71Å; W671-F675 HydrophobicContact CZ2-CB 4.16Å; W671-F675 AromaticContact CZ2-CD2 3.46Å; W671-F675 HydrophobicContact CZ2-CD2 3.46Å; W671-F675 VanDerWaalsContact CZ2-CD2 3.46Å; W671-F675 HydrophobicContact CZ2-CE2 4.1Å; W671-F675 AromaticContact CZ2-CG 3.99Å; W671-F675 HydrophobicContact CZ2-CG 3.99Å; W671-F675 HydrophobicContact CZ3-CB 4.12Å; W671-F675 HydrophobicContact CZ3-CD2 4.38Å; W671-F675 HydrophobicContact CZ3-CG 4.15Å; W671-F675 WeakPolarHBondContact O-CB 3.11Å; W671-F675 PolarHBondContact O-N 3.18Å; V672-F675 PolarHBondContact O-N 3.32Å; F675-K677 PolarHBondContact O-N 2.98Å; F675-A678 PolarHBondContact O-N 2.98Å; F675-S679 WeakPolarHBondContact O-CB 3.38Å; F675-S679 PolarHBondContact O-N 2.76Å; F675-S679 PolarHBondContact O-OG 2.9Å; F675-L689 HydrophobicContact CD2-CD2 4.13Å; F675-L689 HydrophobicContact CE1-CD2 4.47Å; F675-L689 HydrophobicContact CE2-CD2 3.74Å; F675-L689 HydrophobicContact CZ-CD2 3.93Å; F675-V692 HydrophobicContact CB-CG1 3.86Å; F675-V692 HydrophobicContact CD2-CG1 4Å; F675-V692 HydrophobicContact CG-CG1 4.46Å
676	Y	85.8	Confident	84.9	Confident	160 Å²	160	82.2 Å²	82.2	63%	0.627	42%	0.419	S	S	*	.	H	α-helix	trans	-61.2	-44.9	174.3	-176.8	-102	0	0	0	112	V672 N674 A678 S679 T680	V672-Y676 WeakPolarHBondContact O-CB 3.28Å; V672-Y676 PolarHBondContact O-N 2.79Å; N674-Y676 VanDerWaalsContact C-N 3.35Å; N674-Y676 PolarHBondContact O-N 3.13Å; Y676-A678 VanDerWaalsContact C-N 3.35Å; Y676-A678 PolarHBondContact O-N 2.93Å; Y676-S679 WeakPolarHBondContact CA-OG 3.38Å; Y676-S679 PolarHBondContact O-N 3.36Å; Y676-S679 PolarHBondContact O-OG 3.39Å; Y676-T680 HydrophobicContact CE1-CG2 4.17Å; Y676-T680 HydrophobicContact CE2-CG2 4.12Å; Y676-T680 WeakPolarHBondContact O-CG2 3.49Å; Y676-T680 PolarHBondContact O-N 3.01Å; Y676-T680 PolarHBondContact O-OG1 2.9Å
677	K	85.3	Confident	84.6	Confident	140 Å²	140	81.4 Å²	81.4	61%	0.609	41%	0.413	S	S	*	.	H	α-helix	trans	-60.8	-41.2	174.5	-72	171.5	-175.7	176.3	0	112.5	A673 N674 F675 T680 A681	A673-K677 VanDerWaalsContact O-CG 3.31Å; A673-K677 WeakPolarHBondContact O-CG 3.45Å; A673-K677 PolarHBondContact O-N 3.5Å; N674-K677 WeakPolarHBondContact O-CB 3.09Å; N674-K677 PolarHBondContact O-N 3.09Å; F675-K677 PolarHBondContact O-N 2.98Å; K677-T680 PolarHBondContact O-OG1 2.66Å; K677-A681 PolarHBondContact O-N 2.81Å
678	A	83.5	Confident	84.2	Confident	5 Å²	5	81.4 Å²	81.4	4%	0.041	41%	0.412	C	S	.	.	H	α-helix	trans	-66.9	-41.9	176.1	0	0	0	0	0	111.4	N674 F675 Y676 T680 A681 K688 L689 V692	N674-A678 PolarHBondContact O-N 2.66Å; F675-A678 PolarHBondContact O-N 2.98Å; Y676-A678 VanDerWaalsContact C-N 3.35Å; Y676-A678 PolarHBondContact O-N 2.93Å; A678-T680 VanDerWaalsContact C-N 3.27Å; A678-T680 PolarHBondContact O-N 3.14Å; A678-A681 WeakPolarHBondContact O-CB 3.38Å; A678-A681 PolarHBondContact O-N 3.06Å; A678-K688 HydrophobicContact CB-CB 3.96Å; A678-L689 HydrophobicContact CB-CD2 3.85Å; A678-L689 HydrophobicContact CB-CG 4.17Å; A678-V692 HydrophobicContact CB-CG2 4.02Å
679	S	75.2	Confident	83.9	Confident	30 Å²	30	82.3 Å²	82.3	21%	0.21	42%	0.418	C	S	.	.	H	α-helix	trans	-67.4	-24.2	179.9	74.9	0	0	0	0	114.3	F675 Y676 R685	F675-S679 WeakPolarHBondContact O-CB 3.38Å; F675-S679 PolarHBondContact O-N 2.76Å; F675-S679 PolarHBondContact O-OG 2.9Å; Y676-S679 WeakPolarHBondContact CA-OG 3.38Å; Y676-S679 PolarHBondContact O-N 3.36Å; Y676-S679 PolarHBondContact O-OG 3.39Å; S679-R685 PolarHBondContact O-NE 3.28Å; S679-R685 VanDerWaalsContact O-NE 3.09Å; S679-R685 PolarHBondContact O-NH2 2.92Å
680	T	79.4	Confident	83.7	Confident	80 Å²	80	79.3 Å²	79.3	49%	0.491	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-0.8	178	51.1	0	0	0	0	112.8	Y676 K677 A678	Y676-T680 HydrophobicContact CE1-CG2 4.17Å; Y676-T680 HydrophobicContact CE2-CG2 4.12Å; Y676-T680 WeakPolarHBondContact O-CG2 3.49Å; Y676-T680 PolarHBondContact O-N 3.01Å; Y676-T680 PolarHBondContact O-OG1 2.9Å; K677-T680 PolarHBondContact O-OG1 2.66Å; A678-T680 VanDerWaalsContact C-N 3.27Å; A678-T680 PolarHBondContact O-N 3.14Å
681	A	80.6	Confident	83.6	Confident	20 Å²	20	78 Å²	78	17%	0.165	40%	0.4	C	S	.	.			trans	-68.5	133.1	176.9	0	0	0	0	0	111	K677 A678 R685 K688	K677-A681 PolarHBondContact O-N 2.81Å; A678-A681 WeakPolarHBondContact O-CB 3.38Å; A678-A681 PolarHBondContact O-N 3.06Å; A681-R685 WeakPolarHBondContact O-CB 3.19Å; A681-K688 HydrophobicContact CB-CD 3.76Å
682	L	76.8	Confident	83.4	Confident	171 Å²	171	78.5 Å²	78.5	90%	0.895	40%	0.403	S	S	*	.	S	Bend	trans	-79.9	-35.5	174.7	-67.3	168.6	0	0	0	112.2
683	N	81.4	Confident	83.4	Confident	118 Å²	118	76.6 Å²	76.6	63%	0.631	39%	0.392	S	S	*	.	S	Bend	trans	-107.5	137.3	-177.8	-59.9	-7.6	0	0	0	110.7	R685 K688	N683-R685 PolarHBondContact O-N 3.48Å; N683-K688 WeakPolarHBondContact O-CE 3.28Å; N683-K688 PolarHBondContact O-NZ 2.85Å
684	D	78.7	Confident	83.4	Confident	122 Å²	122	76.5 Å²	76.5	65%	0.652	39%	0.385	S	S	*	.	S	Bend	trans	49.5	38.5	179.1	-55.1	-35.9	0	0	0	113.2	E686 A687 K688	D684-E686 VanDerWaalsContact C-N 3.3Å; D684-E686 PolarHBondContact O-N 3.4Å; D684-A687 HydrophobicContact CB-CB 4.43Å; D684-A687 PolarHBondContact O-N 3.33Å; D684-K688 WeakPolarHBondContact O-CB 3.38Å; D684-K688 WeakPolarHBondContact O-CG 3.49Å; D684-K688 PolarHBondContact O-N 2.86Å
685	R	75.6	Confident	83.4	Confident	129 Å²	129	78.5 Å²	78.5	49%	0.487	39%	0.393	S	S	.	.	H	α-helix	trans	-55.4	-46.8	-176.5	-178.1	177.8	167.8	178.5	-1.4	111.5	S679 A681 N683 K688 L689	S679-R685 PolarHBondContact O-NE 3.28Å; S679-R685 VanDerWaalsContact O-NE 3.09Å; S679-R685 PolarHBondContact O-NH2 2.92Å; A681-R685 WeakPolarHBondContact O-CB 3.19Å; N683-R685 PolarHBondContact O-N 3.48Å; R685-K688 PolarHBondContact O-N 3.16Å; R685-L689 HydrophobicContact CG-CD1 3.85Å; R685-L689 HydrophobicContact CG-CG 4.36Å; R685-L689 WeakPolarHBondContact O-CB 3.13Å; R685-L689 VanDerWaalsContact O-CG 3.26Å; R685-L689 WeakPolarHBondContact O-CG 3.32Å; R685-L689 PolarHBondContact O-N 3.17Å
686	E	74.7	Confident	83.6	Confident	147 Å²	147	77 Å²	77	69%	0.687	39%	0.386	S	S	*	.	H	α-helix	trans	-63.5	-49.2	-178	-66.6	178.8	178.8	0	0	111.7	D684 K688 L689 E690	D684-E686 VanDerWaalsContact C-N 3.3Å; D684-E686 PolarHBondContact O-N 3.4Å; E686-K688 VanDerWaalsContact C-N 3.34Å; E686-K688 PolarHBondContact O-N 3.12Å; E686-L689 PolarHBondContact O-N 2.92Å; E686-E690 WeakPolarHBondContact O-CB 3.35Å; E686-E690 PolarHBondContact O-N 3.03Å
687	A	83.8	Confident	83.9	Confident	50 Å²	50	69.4 Å²	69.4	41%	0.413	36%	0.357	S	S	.	.	H	α-helix	trans	-61.7	-40.5	176.8	0	0	0	0	0	112.1	D684 E690 L691	D684-A687 HydrophobicContact CB-CB 4.43Å; D684-A687 PolarHBondContact O-N 3.33Å; A687-E690 PolarHBondContact O-N 3.43Å; A687-L691 WeakPolarHBondContact O-CG 3.5Å; A687-L691 PolarHBondContact O-N 2.79Å
688	K	85	Confident	84	Confident	85 Å²	85	66.1 Å²	66.1	37%	0.37	34%	0.343	S	S	.	.	H	α-helix	trans	-65.6	-43.4	175.6	-74	170.8	-177.9	162.4	0	112.2	A678 A681 N683 D684 R685 E686 E690 L691 V692	A678-K688 HydrophobicContact CB-CB 3.96Å; A681-K688 HydrophobicContact CB-CD 3.76Å; N683-K688 WeakPolarHBondContact O-CE 3.28Å; N683-K688 PolarHBondContact O-NZ 2.85Å; D684-K688 WeakPolarHBondContact O-CB 3.38Å; D684-K688 WeakPolarHBondContact O-CG 3.49Å; D684-K688 PolarHBondContact O-N 2.86Å; R685-K688 PolarHBondContact O-N 3.16Å; E686-K688 VanDerWaalsContact C-N 3.34Å; E686-K688 PolarHBondContact O-N 3.12Å; K688-E690 VanDerWaalsContact C-N 3.27Å; K688-E690 PolarHBondContact O-N 3.47Å; K688-L691 PolarHBondContact O-N 3.01Å; K688-V692 WeakPolarHBondContact O-CG2 2.99Å; K688-V692 PolarHBondContact O-N 2.96Å; K688-V692 VanDerWaalsContact O-N 3.1Å
689	L	84.1	Confident	84.4	Confident	38 Å²	38	70.9 Å²	70.9	20%	0.199	37%	0.368	C	S	.	.	H	α-helix	trans	-61.7	-40.3	175.5	-79.1	172.3	0	0	0	110.8	F675 A678 R685 E686 V692 A693	F675-L689 HydrophobicContact CD2-CD2 4.13Å; F675-L689 HydrophobicContact CE1-CD2 4.47Å; F675-L689 HydrophobicContact CE2-CD2 3.74Å; F675-L689 HydrophobicContact CZ-CD2 3.93Å; A678-L689 HydrophobicContact CB-CD2 3.85Å; A678-L689 HydrophobicContact CB-CG 4.17Å; R685-L689 HydrophobicContact CG-CD1 3.85Å; R685-L689 HydrophobicContact CG-CG 4.36Å; R685-L689 WeakPolarHBondContact O-CB 3.13Å; R685-L689 VanDerWaalsContact O-CG 3.26Å; R685-L689 WeakPolarHBondContact O-CG 3.32Å; R685-L689 PolarHBondContact O-N 3.17Å; E686-L689 PolarHBondContact O-N 2.92Å; L689-V692 PolarHBondContact O-N 2.82Å; L689-A693 WeakPolarHBondContact O-CB 3.32Å; L689-A693 PolarHBondContact O-N 3.49Å
690	E	85.4	Confident	85.2	Confident	46 Å²	46	69.5 Å²	69.5	22%	0.215	36%	0.358	C	S	.	.	H	α-helix	trans	-64.7	-46.2	177	-170.7	-171.5	176.2	0	0	112.2	F601 E686 A687 K688 V692 A693 N694	F601-E690 WeakPolarHBondContact CD1-OE1 3.16Å; F601-E690 WeakPolarHBondContact CD1-OE2 3.41Å; F601-E690 VanDerWaalsContact CE1-CD 3.43Å; F601-E690 WeakPolarHBondContact CE1-OE1 3.32Å; F601-E690 WeakPolarHBondContact CE1-OE2 3.31Å; E686-E690 WeakPolarHBondContact O-CB 3.35Å; E686-E690 PolarHBondContact O-N 3.03Å; A687-E690 PolarHBondContact O-N 3.43Å; K688-E690 VanDerWaalsContact C-N 3.27Å; K688-E690 PolarHBondContact O-N 3.47Å; E690-V692 VanDerWaalsContact C-N 3.32Å; E690-V692 PolarHBondContact O-N 3.31Å; E690-A693 PolarHBondContact O-N 3.33Å; E690-N694 VanDerWaalsContact O-CB 3.32Å; E690-N694 WeakPolarHBondContact O-CB 3.3Å; E690-N694 PolarHBondContact O-N 3.16Å
691	L	88.9	Confident	85.8	Confident	120 Å²	120	68.6 Å²	68.6	63%	0.628	35%	0.348	S	S	*	.	H	α-helix	trans	-55.9	-49.3	176.5	-74.8	172.2	0	0	0	110.8	A687 K688 N694 E695	A687-L691 WeakPolarHBondContact O-CG 3.5Å; A687-L691 PolarHBondContact O-N 2.79Å; K688-L691 PolarHBondContact O-N 3.01Å; L691-N694 WeakPolarHBondContact O-CB 3.3Å; L691-N694 PolarHBondContact O-N 3.06Å; L691-E695 PolarHBondContact O-N 3.02Å; L691-E695 VanDerWaalsContact O-N 3.16Å
692	V	90.5	Very high	86.4	Confident	13 Å²	13	67.9 Å²	67.9	8%	0.079	34%	0.342	C	S	.	.	H	α-helix	trans	-64.7	-42.5	178.2	177.1	0	0	0	0	111	W671 N674 F675 A678 K688 L689 E690 N694 E695	W671-V692 HydrophobicContact CD2-CG1 4.44Å; W671-V692 HydrophobicContact CG-CG1 4.46Å; W671-V692 HydrophobicContact CZ2-CG1 4.17Å; W671-V692 PolarHBondContact NE1-O 3.12Å; N674-V692 HydrophobicContact CB-CG1 4.23Å; N674-V692 HydrophobicContact CB-CG2 4.21Å; F675-V692 HydrophobicContact CB-CG1 3.86Å; F675-V692 HydrophobicContact CD2-CG1 4Å; F675-V692 HydrophobicContact CG-CG1 4.46Å; A678-V692 HydrophobicContact CB-CG2 4.02Å; K688-V692 WeakPolarHBondContact O-CG2 2.99Å; K688-V692 PolarHBondContact O-N 2.96Å; K688-V692 VanDerWaalsContact O-N 3.1Å; L689-V692 PolarHBondContact O-N 2.82Å; E690-V692 VanDerWaalsContact C-N 3.32Å; E690-V692 PolarHBondContact O-N 3.31Å; V692-N694 VanDerWaalsContact C-N 3.27Å; V692-N694 PolarHBondContact O-N 3.19Å; V692-E695 WeakPolarHBondContact O-CB 3.46Å; V692-E695 PolarHBondContact O-N 3.1Å; V692-E695 VanDerWaalsContact O-N 3.12Å
693	A	88.9	Confident	87.1	Confident	3 Å²	3	59.9 Å²	59.9	3%	0.025	30%	0.3	C	S	.	.	H	α-helix	trans	-63.7	-34.6	177	0	0	0	0	0	112.1	L596 L689 E690 E695 I696 E697	L596-A693 HydrophobicContact CD1-CB 4.18Å; L596-A693 HydrophobicContact CD2-CB 3.87Å; L596-A693 HydrophobicContact CG-CB 4.49Å; L689-A693 WeakPolarHBondContact O-CB 3.32Å; L689-A693 PolarHBondContact O-N 3.49Å; E690-A693 PolarHBondContact O-N 3.33Å; A693-E695 VanDerWaalsContact C-N 3.29Å; A693-E695 PolarHBondContact O-N 3.39Å; A693-I696 VanDerWaalsContact O-CG2 3.3Å; A693-I696 WeakPolarHBondContact O-CG2 3.27Å; A693-I696 PolarHBondContact O-N 2.77Å; A693-E697 VanDerWaalsContact O-CG 3.3Å; A693-E697 WeakPolarHBondContact O-CG 3.35Å; A693-E697 PolarHBondContact O-N 3.4Å
694	N	90	Very high	87.7	Confident	46 Å²	46	54.3 Å²	54.3	25%	0.246	27%	0.27	C	S	.	.	H	α-helix	trans	-67.4	-27.5	174.6	-164.6	49.8	0	0	0	112.7	R604 R630 E690 L691 V692 Q698	R604-N694 PolarHBondContact NH2-OD1 3.1Å; R604-N694 VanDerWaalsContact NH2-OD1 3.07Å; R630-N694 PolarHBondContact NE-OD1 2.91Å; R630-N694 PolarHBondContact NH2-OD1 3.48Å; E690-N694 VanDerWaalsContact O-CB 3.32Å; E690-N694 WeakPolarHBondContact O-CB 3.3Å; E690-N694 PolarHBondContact O-N 3.16Å; L691-N694 WeakPolarHBondContact O-CB 3.3Å; L691-N694 PolarHBondContact O-N 3.06Å; V692-N694 VanDerWaalsContact C-N 3.27Å; V692-N694 PolarHBondContact O-N 3.19Å; N694-Q698 VanDerWaalsContact O-CG 3.31Å; N694-Q698 WeakPolarHBondContact O-CG 3.48Å; N694-Q698 PolarHBondContact O-NE2 3.5Å; N694-Q698 PolarHBondContact OD1-NE2 2.88Å
695	E	90.6	Very high	88.3	Confident	91 Å²	91	48.5 Å²	48.5	43%	0.425	24%	0.239	S	C	.	.	H	α-helix	trans	-65.8	-39.5	176.3	-68.7	178.4	172.7	0	0	112.6	L691 V692 A693	L691-E695 PolarHBondContact O-N 3.02Å; L691-E695 VanDerWaalsContact O-N 3.16Å; V692-E695 WeakPolarHBondContact O-CB 3.46Å; V692-E695 PolarHBondContact O-N 3.1Å; V692-E695 VanDerWaalsContact O-N 3.12Å; A693-E695 VanDerWaalsContact C-N 3.29Å; A693-E695 PolarHBondContact O-N 3.39Å
696	I	91.9	Very high	89.1	Confident	4 Å²	4	42.3 Å²	42.3	2%	0.021	22%	0.216	C	C	.	.	H	α-helix	trans	-85.3	-20.8	-178.1	-166.7	161.1	0	0	0	113	L596 V608 V618 V663 F667 Y668 W671 A693 Q698	L596-I696 HydrophobicContact CD1-CG2 3.78Å; V608-I696 HydrophobicContact CG1-CD1 4.34Å; V608-I696 HydrophobicContact CG2-CD1 3.98Å; V618-I696 HydrophobicContact CG2-CD1 4.1Å; V618-I696 HydrophobicContact CG2-CG1 3.73Å; V663-I696 HydrophobicContact CG2-CG1 4.23Å; F667-I696 HydrophobicContact CE1-CB 4.42Å; F667-I696 HydrophobicContact CE1-CG1 4.33Å; Y668-I696 HydrophobicContact CD2-CD1 4.26Å; W671-I696 HydrophobicContact CD2-CB 4.22Å; W671-I696 HydrophobicContact CD2-CD1 3.66Å; W671-I696 HydrophobicContact CD2-CG2 4.4Å; W671-I696 HydrophobicContact CE3-CD1 3.84Å; W671-I696 HydrophobicContact CG-CB 4.24Å; W671-I696 HydrophobicContact CG-CD1 4.05Å; W671-I696 HydrophobicContact CZ2-CB 4.34Å; W671-I696 HydrophobicContact CZ2-CD1 4.35Å; W671-I696 HydrophobicContact CZ2-CG2 3.62Å; W671-I696 HydrophobicContact CZ3-CD1 4.27Å; A693-I696 VanDerWaalsContact O-CG2 3.3Å; A693-I696 WeakPolarHBondContact O-CG2 3.27Å; A693-I696 PolarHBondContact O-N 2.77Å; I696-Q698 VanDerWaalsContact C-N 3.32Å; I696-Q698 PolarHBondContact O-N 3.25Å
697	E	90.5	Very high	89.8	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	21.7	178.9	-65.6	170.6	149.6	0	0	113	L596 R602 R604 V618 V620 R630 A693 L700	L596-E697 HydrophobicContact CD1-CG 3.82Å; L596-E697 VanDerWaalsContact CD1-OE1 3.31Å; L596-E697 WeakPolarHBondContact CD1-OE1 3.33Å; R602-E697 IonicContact NH2-OE1 2.73Å; R602-E697 IonicContact NH2-OE2 3.74Å; R602-E697 PolarHBondContact NH2-OE2 3.3Å; R604-E697 IonicContact CZ-OE2 3.89Å; R604-E697 IonicContact NE-OE1 3.46Å; R604-E697 IonicContact NE-OE2 3.15Å; R604-E697 PolarHBondContact NE-OE2 3.1Å; R604-E697 IonicContact NH2-OE2 3.93Å; R604-E697 PolarHBondContact NH2-OE2 3.07Å; V618-E697 HydrophobicContact CG1-CG 4.5Å; V620-E697 HydrophobicContact CG2-CG 4.37Å; R630-E697 WeakPolarHBondContact CB-O 2.99Å; A693-E697 VanDerWaalsContact O-CG 3.3Å; A693-E697 WeakPolarHBondContact O-CG 3.35Å; A693-E697 PolarHBondContact O-N 3.4Å; E697-L700 WeakPolarHBondContact O-CD1 3.48Å; E697-L700 WeakPolarHBondContact O-CG 3.46Å
698	Q	89.3	Confident	89.9	Confident	71 Å²	71	33 Å²	33	33%	0.332	16%	0.163	S	C	.	.			trans	-89.1	158.3	172.6	-64.4	-56.9	-43	0	0	112.1	N694 I696 L700	N694-Q698 VanDerWaalsContact O-CG 3.31Å; N694-Q698 WeakPolarHBondContact O-CG 3.48Å; N694-Q698 PolarHBondContact O-NE2 3.5Å; N694-Q698 PolarHBondContact OD1-NE2 2.88Å; I696-Q698 VanDerWaalsContact C-N 3.32Å; I696-Q698 PolarHBondContact O-N 3.25Å; Q698-L700 PolarHBondContact O-N 3.39Å
699	N	91.2	Very high	89.7	Confident	105 Å²	105	31.6 Å²	31.6	56%	0.561	16%	0.158	S	C	*	.	S	Bend	trans	60.2	38.5	176	-56.7	-50.4	0	0	0	114.2	R630 A632	R630-N699 PolarHBondContact O-N 2.96Å; R630-N699 VanDerWaalsContact O-N 3.13Å; A632-N699 HydrophobicContact CB-CB 4.18Å
700	L	92.2	Very high	89.5	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.156	C	C	.	.	B	Isolated β-bridge	trans	-67.8	142	179.3	-61.4	173	0	0	0	111.7	V620 I627 R630 L631 A632 A659 T661 E697 Q698	V620-L700 HydrophobicContact CB-CD1 4.34Å; V620-L700 HydrophobicContact CG1-CD1 4.48Å; V620-L700 HydrophobicContact CG2-CD1 4.18Å; V620-L700 HydrophobicContact CG2-CD2 3.81Å; I627-L700 HydrophobicContact CD1-CD1 4.33Å; R630-L700 HydrophobicContact CB-CD1 3.98Å; R630-L700 HydrophobicContact CB-CG 4.48Å; R630-L700 PolarHBondContact O-N 3.43Å; L631-L700 CarbonylContact C-O 3.51Å; L631-L700 VanDerWaalsContact CA-O 3.24Å; L631-L700 WeakPolarHBondContact CA-O 3.4Å; L631-L700 HydrophobicContact CD2-CB 4.15Å; L631-L700 WeakPolarHBondContact CD2-O 3.47Å; A632-L700 PolarHBondContact N-O 3.4Å; A659-L700 HydrophobicContact CB-CB 3.97Å; A659-L700 HydrophobicContact CB-CD1 4.38Å; T661-L700 HydrophobicContact CG2-CD2 3.83Å; E697-L700 WeakPolarHBondContact O-CD1 3.48Å; E697-L700 WeakPolarHBondContact O-CG 3.46Å; Q698-L700 PolarHBondContact O-N 3.39Å
701	Q	92.2	Very high	89.2	Confident	61 Å²	61	32.1 Å²	32.1	29%	0.285	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	120.9	168.8	-60.5	-63.8	-29.6	0	0	109.3	T634 A659 W660 L703	T634-Q701 PolarHBondContact OG1-NE2 2.84Å; A659-Q701 VanDerWaalsContact CA-O 3.25Å; A659-Q701 WeakPolarHBondContact CA-O 3.29Å; A659-Q701 WeakPolarHBondContact CB-O 3.43Å; W660-Q701 PolarHBondContact N-O 3.08Å; W660-Q701 PolarHBondContact O-N 2.73Å; Q701-L703 PolarHBondContact O-N 3.04Å
702	L	93.1	Very high	89.1	Confident	6 Å²	6	28 Å²	28	3%	0.031	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	125.7	175.5	-170	67.5	0	0	0	110.6	I627 F628 L631 S635 T641 C657	I627-L702 HydrophobicContact CG2-CD1 4.39Å; F628-L702 HydrophobicContact CZ-CD2 4.21Å; L631-L702 HydrophobicContact CD1-CB 4.05Å; L631-L702 HydrophobicContact CD1-CD2 4.2Å; L631-L702 HydrophobicContact CD2-CB 3.72Å; L631-L702 HydrophobicContact CD2-CD1 4.38Å; S635-L702 WeakPolarHBondContact OG-CB 3.48Å; S635-L702 PolarHBondContact OG-N 2.79Å; T641-L702 HydrophobicContact CG2-CD2 3.97Å; C657-L702 HydrophobicContact CB-CD1 4.28Å
703	L	91.9	Very high	89	Confident	3 Å²	3	28.1 Å²	28.1	2%	0.016	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	-37.1	170.8	-73.5	166.9	0	0	0	111.8	G469 L498 Q501 F502 I505 I658 W660 Q701	G469-L703 PolarHBondContact N-O 3.35Å; L498-L703 HydrophobicContact CD2-CD2 3.85Å; Q501-L703 HydrophobicContact CB-CD1 4.19Å; Q501-L703 HydrophobicContact CB-CD2 4.33Å; F502-L703 HydrophobicContact CD2-CB 4.24Å; I505-L703 HydrophobicContact CD1-CD1 3.22Å; I658-L703 HydrophobicContact CG2-CD1 4.48Å; I658-L703 PolarHBondContact O-N 3.34Å; W660-L703 VanDerWaalsContact CD1-CD1 3.44Å; W660-L703 HydrophobicContact CG-CD1 4.33Å; Q701-L703 PolarHBondContact O-N 3.04Å
704	G	92.3	Very high	88.9	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	163.4	-163.1	-174.1	0	0	0	0	0	113.5	S467 I658	S467-G704 CarbonylContact O-C 3.5Å; S467-G704 WeakPolarHBondContact O-CA 3.31Å; I658-G704 PolarHBondContact N-O 3.4Å; I658-G704 PolarHBondContact O-N 2.76Å
705	A	92.8	Very high	88.8	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	147.1	-179.5	0	0	0	0	0	111.5	C466 S467 T641 L645 L656	C466-A705 CarbonylContact C-O 3.53Å; C466-A705 VanDerWaalsContact CA-O 3.29Å; C466-A705 WeakPolarHBondContact CA-O 3.49Å; C466-A705 WeakPolarHBondContact CB-O 3.36Å; S467-A705 PolarHBondContact N-O 2.84Å; S467-A705 PolarHBondContact O-N 3.4Å; T641-A705 HydrophobicContact CG2-CB 3.83Å; L645-A705 HydrophobicContact CD1-CB 4.49Å; L645-A705 HydrophobicContact CD2-CB 3.52Å; L645-A705 HydrophobicContact CG-CB 3.98Å; L656-A705 CarbonylContact O-C 3.54Å; L656-A705 VanDerWaalsContact O-CA 3.22Å; L656-A705 WeakPolarHBondContact O-CA 3.42Å
706	T	91.9	Very high	88.9	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	155	170.7	66.5	0	0	0	0	109.6	F463 F502 L506 L560 T655 L656 I658	F463-T706 HydrophobicContact CE2-CG2 3.73Å; F502-T706 HydrophobicContact CE1-CG2 4.19Å; F502-T706 HydrophobicContact CE2-CG2 4.38Å; F502-T706 HydrophobicContact CZ-CG2 3.55Å; L506-T706 HydrophobicContact CD1-CG2 4.25Å; L506-T706 HydrophobicContact CD2-CG2 4.08Å; L560-T706 HydrophobicContact CD2-CG2 3.79Å; T655-T706 CarbonylContact C-O 3.58Å; T655-T706 WeakPolarHBondContact CA-O 3.26Å; L656-T706 WeakPolarHBondContact CB-OG1 3.39Å; L656-T706 PolarHBondContact N-O 2.81Å; L656-T706 PolarHBondContact O-N 2.88Å; L656-T706 PolarHBondContact O-OG1 2.91Å; I658-T706 HydrophobicContact CD1-CG2 4.39Å; I658-T706 HydrophobicContact CG1-CG2 4.05Å
707	A	88.6	Confident	88.8	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	116.9	175	0	0	0	0	0	109.4	K464 R465 F648 L653 R654	K464-A707 PolarHBondContact N-O 2.98Å; R465-A707 HydrophobicContact CB-CB 3.98Å; R465-A707 PolarHBondContact N-O 3.43Å; R465-A707 VanDerWaalsContact N-O 3.16Å; R465-A707 WeakPolarHBondContact O-CA 3.39Å; R465-A707 WeakPolarHBondContact O-CB 3.23Å; R465-A707 PolarHBondContact O-N 3.23Å; F648-A707 HydrophobicContact CB-CB 4.05Å; F648-A707 HydrophobicContact CD1-CB 4.17Å; F648-A707 HydrophobicContact CD2-CB 3.74Å; F648-A707 HydrophobicContact CE2-CB 4.18Å; F648-A707 HydrophobicContact CG-CB 3.73Å; L653-A707 HydrophobicContact CB-CB 3.84Å; L653-A707 HydrophobicContact CD1-CB 3.72Å; L653-A707 HydrophobicContact CG-CB 4.41Å; R654-A707 CarbonylContact O-C 3.58Å; R654-A707 WeakPolarHBondContact O-CA 3.48Å
708	I	86.6	Confident	88.9	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	129.7	-173	-56.6	174.3	0	0	0	108.1	M461 E462 D556 L560 R654 L656	M461-I708 HydrophobicContact CB-CG2 3.74Å; M461-I708 HydrophobicContact CG-CG2 4.42Å; M461-I708 HydrophobicContact SD-CG2 4.2Å; E462-I708 CarbonylContact O-C 3.49Å; E462-I708 WeakPolarHBondContact O-CA 3.48Å; D556-I708 HydrophobicContact CB-CD1 3.87Å; L560-I708 HydrophobicContact CD1-CD1 4.48Å; L560-I708 HydrophobicContact CD2-CD1 4Å; L560-I708 HydrophobicContact CD2-CG1 4.47Å; L560-I708 HydrophobicContact CG-CD1 4.04Å; R654-I708 HydrophobicContact CB-CB 4.46Å; R654-I708 WeakPolarHBondContact CB-O 3.46Å; R654-I708 PolarHBondContact N-O 3.26Å; R654-I708 PolarHBondContact O-N 2.74Å; L656-I708 HydrophobicContact CD1-CD1 4.47Å
709	E	81.7	Confident	89.1	Confident	56 Å²	56	29.6 Å²	29.6	26%	0.262	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	137.6	175.2	-172.3	179.9	-158.7	0	0	110.9	M461 E462 K464 L653	M461-E709 WeakPolarHBondContact CA-O 3.41Å; E462-E709 PolarHBondContact N-O 3.41Å; E462-E709 PolarHBondContact O-N 2.89Å; K464-E709 HydrophobicContact CB-CB 4.33Å; K464-E709 WeakPolarHBondContact CE-OE2 3.19Å; K464-E709 HydrophobicContact CG-CB 3.58Å; K464-E709 WeakPolarHBondContact CG-OE2 3.42Å; L653-E709 HydrophobicContact CD2-CB 3.55Å; L653-E709 HydrophobicContact CD2-CG 3.99Å
710	D	78.9	Confident	89.3	Confident	27 Å²	27	24.7 Å²	24.7	14%	0.144	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	98.7	161.2	-176.6	11.2	0	0	0	108.1	K452 T457 M461 L712	K452-D710 WeakPolarHBondContact CE-OD2 3.27Å; K452-D710 IonicContact NZ-OD2 3.68Å; K452-D710 PolarHBondContact NZ-OD2 3.3Å; T457-D710 WeakPolarHBondContact CB-OD1 3.15Å; T457-D710 WeakPolarHBondContact CG2-OD2 3.2Å; T457-D710 PolarHBondContact OG1-OD1 3.4Å; T457-D710 PolarHBondContact OG1-OD2 2.87Å; M461-D710 HydrophobicContact CE-CB 4.02Å; M461-D710 HydrophobicContact SD-CB 3.98Å; D710-L712 PolarHBondContact O-N 3.48Å
711	K	80.1	Confident	89.2	Confident	69 Å²	69	26.3 Å²	26.3	30%	0.3	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	127.9	-167.3	-167.7	173.1	-162.8	148.9	0	111.7	T457 R458 V460 E462	T457-K711 CarbonylContact C-O 3.57Å; T457-K711 WeakPolarHBondContact CA-O 3.43Å; R458-K711 PolarHBondContact N-O 2.92Å; V460-K711 PolarHBondContact O-N 3.38Å; E462-K711 IonicContact OE2-NZ 2.76Å; E462-K711 PolarHBondContact OE2-NZ 3.15Å
712	L	86.4	Confident	89.2	Confident	32 Å²	32	23.8 Å²	23.8	17%	0.168	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	150.7	171.2	-67.3	178.2	0	0	0	111.6	T457 D710 P717 I744 C748	T457-L712 HydrophobicContact CG2-CD2 4.02Å; D710-L712 PolarHBondContact O-N 3.48Å; L712-P717 HydrophobicContact CD1-CG 4.11Å; L712-I744 HydrophobicContact CD2-CG2 4.4Å; L712-C748 VanDerWaalsContact CD2-SG 3.52Å
713	Q	87.5	Confident	89.3	Confident	17 Å²	17	23.5 Å²	23.5	8%	0.079	13%	0.131	C	C	.	.	P	Polyproline II helix	trans	-66	155.9	168.1	-61.4	-168.3	3.1	0	0	111.2	G454 T455 L456 R458 G715 V716	G454-Q713 PolarHBondContact O-NE2 3.5Å; T455-Q713 PolarHBondContact O-NE2 2.85Å; T455-Q713 PolarHBondContact O-OE1 3.12Å; L456-Q713 PolarHBondContact O-N 2.9Å; R458-Q713 HydrophobicContact CG-CB 4.36Å; R458-Q713 HydrophobicContact CG-CG 3.89Å; Q713-G715 PolarHBondContact O-N 3.2Å; Q713-V716 HydrophobicContact CB-CG2 3.64Å; Q713-V716 WeakPolarHBondContact O-CG2 3.34Å; Q713-V716 PolarHBondContact O-N 2.87Å
714	T	86.7	Confident	89.2	Confident	55 Å²	55	24.5 Å²	24.5	34%	0.337	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	123.5	179.4	24.4	0	0	0	0	111.8	R458 V716 R888	R458-T714 PolarHBondContact NH2-OG1 2.62Å; R458-T714 VanDerWaalsContact NH2-OG1 3.17Å; T714-V716 VanDerWaalsContact C-N 3.33Å; T714-V716 PolarHBondContact O-N 3.18Å; T714-R888 WeakPolarHBondContact O-CB 3.39Å; T714-R888 WeakPolarHBondContact O-CD 3.46Å
715	G	88.7	Confident	89	Confident	36 Å²	36	30 Å²	30	37%	0.371	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	78	8.8	174.6	0	0	0	0	0	115.6	Q713 T719	Q713-G715 PolarHBondContact O-N 3.2Å; G715-T719 WeakPolarHBondContact O-CB 3.34Å; G715-T719 PolarHBondContact O-N 2.61Å; G715-T719 PolarHBondContact O-OG1 3.38Å
716	V	92.2	Very high	88.9	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-58.7	-50.4	177.3	168.1	0	0	0	0	112.6	L456 Q713 T714 H718 T719 I720 F887	L456-V716 HydrophobicContact CB-CG1 4.45Å; L456-V716 HydrophobicContact CD2-CG1 3.86Å; Q713-V716 HydrophobicContact CB-CG2 3.64Å; Q713-V716 WeakPolarHBondContact O-CG2 3.34Å; Q713-V716 PolarHBondContact O-N 2.87Å; T714-V716 VanDerWaalsContact C-N 3.33Å; T714-V716 PolarHBondContact O-N 3.18Å; V716-H718 VanDerWaalsContact C-N 3.34Å; V716-H718 PolarHBondContact O-N 3.04Å; V716-T719 PolarHBondContact O-N 2.78Å; V716-T719 VanDerWaalsContact O-N 3.14Å; V716-I720 HydrophobicContact CG1-CD1 3.67Å; V716-I720 HydrophobicContact CG1-CG1 4.35Å; V716-I720 WeakPolarHBondContact O-CG1 3.32Å; V716-I720 PolarHBondContact O-N 3.5Å; V716-F887 HydrophobicContact CB-CD1 4.42Å; V716-F887 HydrophobicContact CG1-CD1 4.32Å; V716-F887 HydrophobicContact CG2-CB 3.99Å; V716-F887 HydrophobicContact CG2-CD1 3.9Å; V716-F887 HydrophobicContact CG2-CG 4.22Å
717	P	91.2	Very high	88.7	Confident	33 Å²	33	30.2 Å²	30.2	21%	0.214	16%	0.159	C	C	.	.	H	α-helix	trans	-61.7	-42.2	-177.8	-22.7	33.5	0	0	0	112.6	L712 T719 I720 S721 S747 C748 Q749	L712-P717 HydrophobicContact CD1-CG 4.11Å; P717-T719 VanDerWaalsContact C-N 3.35Å; P717-T719 PolarHBondContact O-N 3.1Å; P717-I720 PolarHBondContact O-N 3.46Å; P717-S721 WeakPolarHBondContact O-CB 3.41Å; P717-S721 PolarHBondContact O-N 2.65Å; P717-S747 WeakPolarHBondContact CG-O 3.48Å; P717-C748 WeakPolarHBondContact CA-O 3.4Å; P717-Q749 HydrophobicContact CB-CG 4.16Å
718	H	92.4	Very high	88.9	Confident	118 Å²	118	30.3 Å²	30.3	55%	0.546	16%	0.159	S	C	.	.	H	α-helix	trans	-63.7	-40.4	176.9	-175.2	59	0	0	0	112.2	V716 S721 N722	V716-H718 VanDerWaalsContact C-N 3.34Å; V716-H718 PolarHBondContact O-N 3.04Å; H718-S721 PolarHBondContact O-N 3.09Å; H718-N722 PolarHBondContact CD2-ND2 3.28Å; H718-N722 PolarHBondContact CE1-ND2 3.45Å; H718-N722 PolarHBondContact NE2-ND2 3.08Å; H718-N722 VanDerWaalsContact O-CG 3.31Å; H718-N722 PolarHBondContact O-N 3.29Å; H718-N722 PolarHBondContact O-ND2 3.14Å
719	T	93.7	Very high	89.1	Confident	4 Å²	4	30.7 Å²	30.7	3%	0.025	16%	0.162	C	C	.	.	H	α-helix	trans	-65.8	-48.3	178.3	-58.8	0	0	0	0	111.2	G715 V716 P717 S721 N722 L723 F887 R888 N891	G715-T719 WeakPolarHBondContact O-CB 3.34Å; G715-T719 PolarHBondContact O-N 2.61Å; G715-T719 PolarHBondContact O-OG1 3.38Å; V716-T719 PolarHBondContact O-N 2.78Å; V716-T719 VanDerWaalsContact O-N 3.14Å; P717-T719 VanDerWaalsContact C-N 3.35Å; P717-T719 PolarHBondContact O-N 3.1Å; T719-S721 VanDerWaalsContact C-N 3.31Å; T719-S721 PolarHBondContact O-N 3.28Å; T719-N722 PolarHBondContact O-N 3.45Å; T719-L723 HydrophobicContact CG2-CD1 3.83Å; T719-L723 HydrophobicContact CG2-CG 4.28Å; T719-L723 VanDerWaalsContact O-CG 3.24Å; T719-L723 WeakPolarHBondContact O-CG 3.32Å; T719-L723 PolarHBondContact O-N 3.27Å; T719-F887 HydrophobicContact CG2-CD1 4.01Å; T719-F887 HydrophobicContact CG2-CE1 3.74Å; T719-R888 WeakPolarHBondContact OG1-CA 3.31Å; T719-N891 HydrophobicContact CG2-CB 3.9Å
720	I	93.4	Very high	89.7	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-58.4	-44.6	176.6	-72.9	175.6	0	0	0	110.7	L456 V716 P717 N722 L723 M724 I730 C748 L750 F887	L456-I720 HydrophobicContact CD2-CD1 4.13Å; V716-I720 HydrophobicContact CG1-CD1 3.67Å; V716-I720 HydrophobicContact CG1-CG1 4.35Å; V716-I720 WeakPolarHBondContact O-CG1 3.32Å; V716-I720 PolarHBondContact O-N 3.5Å; P717-I720 PolarHBondContact O-N 3.46Å; I720-N722 PolarHBondContact O-N 3.33Å; I720-L723 PolarHBondContact O-N 3.47Å; I720-M724 HydrophobicContact CG2-CE 3.71Å; I720-M724 HydrophobicContact CG2-SD 4.45Å; I720-M724 WeakPolarHBondContact O-CG 3.19Å; I720-M724 PolarHBondContact O-N 3.49Å; I720-I730 HydrophobicContact CB-CD1 4.27Å; I720-I730 HydrophobicContact CG1-CD1 4.22Å; I720-I730 HydrophobicContact CG2-CD1 3.84Å; I720-C748 HydrophobicContact CD1-CB 3.69Å; I720-L750 HydrophobicContact CG2-CB 4.28Å; I720-L750 HydrophobicContact CG2-CD1 4.13Å; I720-F887 HydrophobicContact CD1-CE1 4.38Å; I720-F887 HydrophobicContact CG1-CE1 3.78Å; I720-F887 HydrophobicContact CG1-CZ 4.1Å
721	S	91.5	Very high	90.5	Very high	35 Å²	35	26.9 Å²	26.9	25%	0.245	14%	0.144	C	C	.	.	H	α-helix	trans	-58.3	-46.1	175.6	-171.5	0	0	0	0	112.6	P717 H718 T719 M724 R725	P717-S721 WeakPolarHBondContact O-CB 3.41Å; P717-S721 PolarHBondContact O-N 2.65Å; H718-S721 PolarHBondContact O-N 3.09Å; T719-S721 VanDerWaalsContact C-N 3.31Å; T719-S721 PolarHBondContact O-N 3.28Å; S721-M724 PolarHBondContact O-N 3.4Å; S721-R725 WeakPolarHBondContact O-CG 3.44Å; S721-R725 PolarHBondContact O-N 3.22Å
722	N	92.4	Very high	91.2	Very high	8 Å²	8	24 Å²	24	4%	0.043	13%	0.132	C	C	.	.	H	α-helix	trans	-64.8	-42.4	177.3	-72.3	-21.6	0	0	0	112.4	H718 T719 I720 R725 A726 N891 P974	H718-N722 PolarHBondContact CD2-ND2 3.28Å; H718-N722 PolarHBondContact CE1-ND2 3.45Å; H718-N722 PolarHBondContact NE2-ND2 3.08Å; H718-N722 VanDerWaalsContact O-CG 3.31Å; H718-N722 PolarHBondContact O-N 3.29Å; H718-N722 PolarHBondContact O-ND2 3.14Å; T719-N722 PolarHBondContact O-N 3.45Å; I720-N722 PolarHBondContact O-N 3.33Å; N722-R725 PolarHBondContact O-N 2.65Å; N722-A726 WeakPolarHBondContact O-CB 3.4Å; N722-A726 PolarHBondContact O-N 2.87Å; N722-N891 PolarHBondContact ND2-ND2 3.13Å; N722-N891 VanDerWaalsContact ND2-ND2 3.18Å; N722-P974 HydrophobicContact CB-CB 4.39Å; N722-P974 HydrophobicContact CB-CG 3.73Å; N722-P974 WeakPolarHBondContact O-CB 3.08Å
723	L	93.6	Very high	91.6	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-65	-42.1	178.4	-66.4	172	0	0	0	111.6	I448 T719 I720 R725 A726 G727 I728 I730 F887 L890 L894	I448-L723 HydrophobicContact CD1-CD1 3.88Å; I448-L723 HydrophobicContact CD1-CD2 4.4Å; T719-L723 HydrophobicContact CG2-CD1 3.83Å; T719-L723 HydrophobicContact CG2-CG 4.28Å; T719-L723 VanDerWaalsContact O-CG 3.24Å; T719-L723 WeakPolarHBondContact O-CG 3.32Å; T719-L723 PolarHBondContact O-N 3.27Å; I720-L723 PolarHBondContact O-N 3.47Å; L723-R725 VanDerWaalsContact C-N 3.34Å; L723-R725 PolarHBondContact O-N 2.8Å; L723-A726 WeakPolarHBondContact O-CB 3.17Å; L723-A726 PolarHBondContact O-N 2.83Å; L723-G727 PolarHBondContact O-N 3.29Å; L723-I728 HydrophobicContact CB-CB 4.47Å; L723-I728 HydrophobicContact CB-CD1 4.41Å; L723-I728 HydrophobicContact CD2-CD1 3.76Å; L723-I728 WeakPolarHBondContact O-CB 3.44Å; L723-I728 PolarHBondContact O-N 2.92Å; L723-I730 HydrophobicContact CB-CD1 4.17Å; L723-F887 HydrophobicContact CD1-CZ 4.49Å; L723-L890 HydrophobicContact CD1-CD2 4.12Å; L723-L894 HydrophobicContact CD2-CD1 3.85Å
724	M	90.6	Very high	91.8	Very high	23 Å²	23	21.8 Å²	21.8	11%	0.113	12%	0.121	C	C	.	.	H	α-helix	trans	-63.8	-38.8	174	-73.1	-168.8	-67.4	0	0	112.1	I720 S721 A726 G727 I730 Q749 L750	I720-M724 HydrophobicContact CG2-CE 3.71Å; I720-M724 HydrophobicContact CG2-SD 4.45Å; I720-M724 WeakPolarHBondContact O-CG 3.19Å; I720-M724 PolarHBondContact O-N 3.49Å; S721-M724 PolarHBondContact O-N 3.4Å; M724-A726 VanDerWaalsContact C-N 3.3Å; M724-A726 PolarHBondContact O-N 3.09Å; M724-G727 PolarHBondContact O-N 2.84Å; M724-G727 VanDerWaalsContact O-N 3.07Å; M724-I730 HydrophobicContact CG-CD1 4.06Å; M724-Q749 WeakPolarHBondContact CE-O 3.43Å; M724-L750 HydrophobicContact SD-CD1 4.27Å
725	R	89.1	Confident	91.5	Very high	116 Å²	116	21.5 Å²	21.5	44%	0.438	13%	0.129	S	C	.	.	H	α-helix	trans	-65.4	-33.3	173.6	-73.8	177.5	65.9	172.5	-4.7	112.6	S721 N722 L723 G727 P974 E975 K978	S721-R725 WeakPolarHBondContact O-CG 3.44Å; S721-R725 PolarHBondContact O-N 3.22Å; N722-R725 PolarHBondContact O-N 2.65Å; L723-R725 VanDerWaalsContact C-N 3.34Å; L723-R725 PolarHBondContact O-N 2.8Å; R725-G727 PolarHBondContact O-N 2.85Å; R725-P974 HydrophobicContact CB-CB 4.32Å; R725-E975 IonicContact CZ-OE1 2.83Å; R725-E975 VanDerWaalsContact CZ-OE1 3.25Å; R725-E975 IonicContact NE-OE1 2.75Å; R725-E975 PolarHBondContact NE-OE1 3.31Å; R725-E975 IonicContact NH2-OE1 2.66Å; R725-E975 PolarHBondContact NH2-OE1 2.83Å; R725-E975 IonicContact NH2-OE2 3.92Å; R725-K978 WeakPolarHBondContact O-CE 3.33Å
726	A	89.9	Confident	91	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-5	171.9	0	0	0	0	0	113.8	N722 L723 M724 I728 L895 P974 Y977 K978 Q981	N722-A726 WeakPolarHBondContact O-CB 3.4Å; N722-A726 PolarHBondContact O-N 2.87Å; L723-A726 WeakPolarHBondContact O-CB 3.17Å; L723-A726 PolarHBondContact O-N 2.83Å; M724-A726 VanDerWaalsContact C-N 3.3Å; M724-A726 PolarHBondContact O-N 3.09Å; A726-I728 HydrophobicContact CB-CD1 4.36Å; A726-I728 HydrophobicContact CB-CG1 4.44Å; A726-L895 HydrophobicContact CB-CD2 3.76Å; A726-P974 WeakPolarHBondContact CA-O 3.27Å; A726-P974 HydrophobicContact CB-CB 3.9Å; A726-P974 WeakPolarHBondContact CB-O 3.14Å; A726-Y977 HydrophobicContact CB-CD1 4.17Å; A726-Y977 HydrophobicContact CB-CG 4.38Å; A726-K978 WeakPolarHBondContact O-CG 3.38Å; A726-Q981 PolarHBondContact O-OE1 2.86Å
727	G	88.1	Confident	89.9	Confident	5 Å²	5	23.4 Å²	23.4	5%	0.052	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.5	22.9	-178.7	0	0	0	0	0	113.8	L723 M724 R725	L723-G727 PolarHBondContact O-N 3.29Å; M724-G727 PolarHBondContact O-N 2.84Å; M724-G727 VanDerWaalsContact O-N 3.07Å; R725-G727 PolarHBondContact O-N 2.85Å
728	I	92.2	Very high	89.4	Confident	1 Å²	1	23.7 Å²	23.7	1%	0.005	13%	0.127	C	C	.	.			trans	-95.1	127.6	176.1	-58.8	170.1	0	0	0	108.8	R446 I448 L723 A726 L894 Y977	R446-I728 WeakPolarHBondContact O-CA 3.09Å; I448-I728 HydrophobicContact CB-CG2 4.3Å; I448-I728 HydrophobicContact CD1-CD1 4.44Å; I448-I728 HydrophobicContact CD1-CG2 3.55Å; I448-I728 HydrophobicContact CG1-CG2 3.6Å; L723-I728 HydrophobicContact CB-CB 4.47Å; L723-I728 HydrophobicContact CB-CD1 4.41Å; L723-I728 HydrophobicContact CD2-CD1 3.76Å; L723-I728 WeakPolarHBondContact O-CB 3.44Å; L723-I728 PolarHBondContact O-N 2.92Å; A726-I728 HydrophobicContact CB-CD1 4.36Å; A726-I728 HydrophobicContact CB-CG1 4.44Å; I728-L894 HydrophobicContact CD1-CD1 4.16Å; I728-Y977 HydrophobicContact CD1-CD1 4.25Å; I728-Y977 HydrophobicContact CD1-CE1 3.87Å; I728-Y977 HydrophobicContact CG1-CD1 4.47Å; I728-Y977 HydrophobicContact CG1-CE1 4.19Å
729	S	91.5	Very high	88.6	Confident	9 Å²	9	21.6 Å²	21.6	6%	0.063	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	131.2	174.2	-55	0	0	0	0	109.7	R446 Y447 I448 K818	R446-S729 PolarHBondContact O-N 3.01Å; Y447-S729 WeakPolarHBondContact CA-O 3.35Å; I448-S729 PolarHBondContact N-O 2.73Å; S729-K818 WeakPolarHBondContact CA-O 3.33Å; S729-K818 WeakPolarHBondContact CB-O 3.36Å
730	I	94.3	Very high	87.7	Confident	2 Å²	2	23.9 Å²	23.9	1%	0.01	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	127.2	-173.3	-62.1	168.6	0	0	0	109.5	I448 I720 L723 M724 V732 L750 K818 S819 V820	I448-I730 HydrophobicContact CB-CG1 4.47Å; I720-I730 HydrophobicContact CB-CD1 4.27Å; I720-I730 HydrophobicContact CG1-CD1 4.22Å; I720-I730 HydrophobicContact CG2-CD1 3.84Å; L723-I730 HydrophobicContact CB-CD1 4.17Å; M724-I730 HydrophobicContact CG-CD1 4.06Å; I730-V732 HydrophobicContact CG2-CG2 4.33Å; I730-L750 HydrophobicContact CB-CD1 3.76Å; I730-L750 HydrophobicContact CD1-CD1 4.39Å; I730-L750 HydrophobicContact CG2-CD1 3.91Å; I730-K818 PolarHBondContact N-O 3.39Å; I730-S819 VanDerWaalsContact O-CA 3.32Å; I730-S819 WeakPolarHBondContact O-CA 3.46Å; I730-V820 PolarHBondContact O-N 2.96Å; I730-V820 VanDerWaalsContact O-N 3.11Å
731	W	95.7	Very high	87.2	Confident	1 Å²	1	24 Å²	24	0%	0.004	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	119.6	177.8	-70.1	56.8	0	0	0	108.2	Y447 I448 F449 S450 A814 L815 V820 L833 V837	Y447-W731 AromaticContact CD1-NE1 3.75Å; I448-W731 PolarHBondContact O-N 3.14Å; F449-W731 CarbonylContact C-O 3.56Å; F449-W731 WeakPolarHBondContact CA-O 2.92Å; F449-W731 HydrophobicContact CD1-CB 3.51Å; F449-W731 HydrophobicContact CD1-CD2 4.27Å; F449-W731 HydrophobicContact CD1-CE3 4.44Å; F449-W731 AromaticContact CD1-CG 3.93Å; F449-W731 HydrophobicContact CD1-CG 3.93Å; F449-W731 HydrophobicContact CE1-CB 3.83Å; F449-W731 AromaticContact CE1-CD2 3.66Å; F449-W731 HydrophobicContact CE1-CD2 3.66Å; F449-W731 AromaticContact CE1-CE3 3.84Å; F449-W731 HydrophobicContact CE1-CE3 3.84Å; F449-W731 AromaticContact CE1-CG 3.69Å; F449-W731 HydrophobicContact CE1-CG 3.69Å; F449-W731 HydrophobicContact CG-CB 4.34Å; F449-W731 HydrophobicContact CZ-CD2 4.49Å; S450-W731 PolarHBondContact N-O 3.36Å; W731-A814 HydrophobicContact CH2-CB 3.34Å; W731-A814 HydrophobicContact CZ2-CB 3.83Å; W731-A814 HydrophobicContact CZ3-CB 4.2Å; W731-L815 HydrophobicContact CZ2-CD2 4.18Å; W731-V820 CarbonylContact C-O 3.58Å; W731-V820 VanDerWaalsContact CA-O 3.22Å; W731-V820 WeakPolarHBondContact CA-O 3.47Å; W731-V820 HydrophobicContact CD2-CB 3.59Å; W731-V820 HydrophobicContact CD2-CG1 4.09Å; W731-V820 HydrophobicContact CD2-CG2 3.83Å; W731-V820 HydrophobicContact CE3-CB 3.69Å; W731-V820 HydrophobicContact CE3-CG1 3.61Å; W731-V820 HydrophobicContact CE3-CG2 4.14Å; W731-V820 HydrophobicContact CG-CB 3.99Å; W731-V820 HydrophobicContact CG-CG2 4.39Å; W731-V820 HydrophobicContact CH2-CG1 4.39Å; W731-V820 HydrophobicContact CH2-CG2 4.19Å; W731-V820 HydrophobicContact CZ2-CB 4.4Å; W731-V820 HydrophobicContact CZ2-CG2 3.78Å; W731-V820 HydrophobicContact CZ3-CB 4.19Å; W731-V820 HydrophobicContact CZ3-CG1 3.8Å; W731-V820 HydrophobicContact CZ3-CG2 4.32Å; W731-L833 HydrophobicContact CE3-CD2 3.71Å; W731-L833 HydrophobicContact CZ3-CD1 4.14Å; W731-L833 HydrophobicContact CZ3-CD2 3.87Å; W731-L833 HydrophobicContact CZ3-CG 4.26Å; W731-V837 HydrophobicContact CH2-CG2 4.1Å; W731-V837 HydrophobicContact CZ2-CG2 4.38Å
732	V	95.2	Very high	86.9	Confident	9 Å²	9	23.8 Å²	23.8	6%	0.055	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	117.4	176.1	179.9	0	0	0	0	108.4	S450 K452 L456 I730 L750 V820 I821 C822	S450-V732 WeakPolarHBondContact O-CA 3Å; K452-V732 HydrophobicContact CB-CG1 4.41Å; L456-V732 HydrophobicContact CD1-CG1 4.35Å; L456-V732 HydrophobicContact CD1-CG2 4.16Å; I730-V732 HydrophobicContact CG2-CG2 4.33Å; V732-L750 HydrophobicContact CG2-CD2 3.53Å; V732-V820 PolarHBondContact N-O 3.4Å; V732-I821 HydrophobicContact CB-CG1 4.44Å; V732-I821 WeakPolarHBondContact O-CA 3.3Å; V732-C822 PolarHBondContact O-N 3.34Å
733	L	94.1	Very high	86.4	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	95.6	-178.3	-51.4	-176	0	0	0	109	F449 S450 C822 K830 L833 V834 M858	F449-L733 HydrophobicContact CB-CD1 4.31Å; F449-L733 HydrophobicContact CD1-CD1 4.08Å; S450-L733 PolarHBondContact O-N 3.15Å; L733-C822 HydrophobicContact CD2-CB 3.75Å; L733-K830 HydrophobicContact CB-CD 4.26Å; L733-K830 HydrophobicContact CB-CG 4.08Å; L733-K830 HydrophobicContact CD1-CB 4.1Å; L733-K830 HydrophobicContact CD1-CG 4.29Å; L733-K830 WeakPolarHBondContact O-CE 3.5Å; L733-K830 PolarHBondContact O-NZ 3.02Å; L733-L833 HydrophobicContact CD1-CD2 3.87Å; L733-L833 HydrophobicContact CD2-CD2 3.73Å; L733-L833 HydrophobicContact CG-CD2 4.44Å; L733-V834 HydrophobicContact CD1-CG2 4.47Å; L733-M858 HydrophobicContact CD1-SD 3.84Å
734	T	90.4	Very high	85.9	Confident	1 Å²	1	25.9 Å²	25.9	1%	0.006	14%	0.14	C	C	.	.			trans	-115.1	150.1	-172.7	-174.3	0	0	0	0	112.4	D736 A741 C822 C823 R824 V825	T734-D736 HydrophobicContact CG2-CB 4.11Å; T734-D736 WeakPolarHBondContact OG1-CB 3.49Å; T734-D736 PolarHBondContact OG1-N 3.18Å; T734-D736 VanDerWaalsContact OG1-N 3.09Å; T734-A741 HydrophobicContact CG2-CB 3.85Å; T734-C822 PolarHBondContact N-O 3.41Å; T734-C823 CarbonylContact O-C 3.48Å; T734-R824 PolarHBondContact O-N 2.9Å; T734-V825 PolarHBondContact O-N 3.46Å
735	G	82.3	Confident	85.7	Confident	50 Å²	50	24.9 Å²	24.9	52%	0.515	14%	0.136	S	C	.	.	S	Bend	trans	-76.8	-10.2	166.5	0	0	0	0	0	113.4
736	D	77.6	Confident	85.5	Confident	40 Å²	40	23.9 Å²	23.9	21%	0.214	13%	0.133	C	C	.	.	S	Bend	trans	-71.7	164.2	-177.1	-78.1	-17.3	0	0	0	113.1	K452 T734 C823 R824	K452-D736 WeakPolarHBondContact CD-OD2 3.44Å; K452-D736 VanDerWaalsContact CE-OD2 3.28Å; K452-D736 WeakPolarHBondContact CE-OD2 3.45Å; K452-D736 IonicContact NZ-OD2 3.8Å; K452-D736 PolarHBondContact NZ-OD2 3.44Å; T734-D736 HydrophobicContact CG2-CB 4.11Å; T734-D736 WeakPolarHBondContact OG1-CB 3.49Å; T734-D736 PolarHBondContact OG1-N 3.18Å; T734-D736 VanDerWaalsContact OG1-N 3.09Å; D736-C823 WeakPolarHBondContact O-CB 3.49Å; D736-R824 PolarHBondContact O-N 3.48Å
737	K	69.6	Low	85.2	Confident	35 Å²	35	26.5 Å²	26.5	15%	0.152	15%	0.151	C	C	.	.			trans	-67.9	157.2	170.5	-66.5	-173.7	179.7	-172.4	0	111.5	E739 T740 A741 G1203 Y1204 A1205	K737-E739 PolarHBondContact O-N 2.84Å; K737-T740 PolarHBondContact O-N 3.34Å; K737-A741 WeakPolarHBondContact O-CB 3.13Å; K737-A741 PolarHBondContact O-N 2.88Å; K737-G1203 VanDerWaalsContact CD-O 3.24Å; K737-G1203 WeakPolarHBondContact CD-O 3.15Å; K737-G1203 PolarHBondContact NZ-O 3.02Å; K737-Y1204 WeakPolarHBondContact CE-O 3.44Å; K737-Y1204 PolarHBondContact NZ-O 3.32Å; K737-A1205 HydrophobicContact CD-CB 3.96Å; K737-A1205 HydrophobicContact CG-CB 4.14Å
738	Q	81.1	Confident	85.1	Confident	39 Å²	39	26.3 Å²	26.3	18%	0.182	15%	0.149	C	C	.	.	H	α-helix	trans	-55.9	-47.2	-179	-172	-172.3	-13.1	0	0	114.1	T740 A741 I742 N761 I792 C823	Q738-T740 PolarHBondContact O-N 3.03Å; Q738-A741 PolarHBondContact O-N 2.99Å; Q738-A741 VanDerWaalsContact O-N 3.16Å; Q738-I742 HydrophobicContact CG-CD1 3.78Å; Q738-I742 HydrophobicContact CG-CG1 4.29Å; Q738-I742 VanDerWaalsContact O-CG1 3.3Å; Q738-I742 WeakPolarHBondContact O-CG1 3.43Å; Q738-I742 PolarHBondContact O-N 3.43Å; Q738-N761 PolarHBondContact OE1-ND2 3.43Å; Q738-N761 PolarHBondContact OE1-OD1 3.34Å; Q738-I792 HydrophobicContact CG-CG2 3.65Å; Q738-C823 VanDerWaalsContact CA-SG 3.6Å
739	E	74.6	Confident	84.8	Confident	75 Å²	75	30.9 Å²	30.9	35%	0.35	17%	0.17	S	C	.	.	H	α-helix	trans	-56.9	-50.3	-179.6	-68.4	155.9	-121.6	0	0	111.6	K737 A741 I742 N743 D1201 G1203	K737-E739 PolarHBondContact O-N 2.84Å; E739-A741 VanDerWaalsContact C-N 3.32Å; E739-A741 PolarHBondContact O-N 2.71Å; E739-I742 PolarHBondContact O-N 3.28Å; E739-N743 WeakPolarHBondContact O-CB 3.41Å; E739-N743 VanDerWaalsContact O-CG 3.23Å; E739-N743 PolarHBondContact O-N 3.23Å; E739-N743 PolarHBondContact O-ND2 3.47Å; E739-D1201 VanDerWaalsContact OE1-O 3.14Å; E739-G1203 PolarHBondContact OE1-N 3.28Å; E739-G1203 PolarHBondContact OE2-N 2.97Å
740	T	73.8	Confident	84.5	Confident	51 Å²	51	30.5 Å²	30.5	31%	0.313	17%	0.167	S	C	.	.	H	α-helix	trans	-60.6	-42.3	176.6	-49.1	0	0	0	0	111.3	K737 Q738 N743 I744	K737-T740 PolarHBondContact O-N 3.34Å; Q738-T740 PolarHBondContact O-N 3.03Å; T740-N743 PolarHBondContact O-N 2.89Å; T740-I744 HydrophobicContact CG2-CD1 3.89Å; T740-I744 WeakPolarHBondContact O-CB 3.42Å; T740-I744 VanDerWaalsContact O-CG1 3.29Å; T740-I744 WeakPolarHBondContact O-CG1 3.45Å; T740-I744 PolarHBondContact O-N 3.03Å
741	A	84	Confident	84.2	Confident	5 Å²	5	30.5 Å²	30.5	4%	0.041	17%	0.167	C	C	.	.	H	α-helix	trans	-66.7	-40.3	-179.8	0	0	0	0	0	112.6	T734 K737 Q738 E739 G745 I821	T734-A741 HydrophobicContact CG2-CB 3.85Å; K737-A741 WeakPolarHBondContact O-CB 3.13Å; K737-A741 PolarHBondContact O-N 2.88Å; Q738-A741 PolarHBondContact O-N 2.99Å; Q738-A741 VanDerWaalsContact O-N 3.16Å; E739-A741 VanDerWaalsContact C-N 3.32Å; E739-A741 PolarHBondContact O-N 2.71Å; A741-G745 PolarHBondContact O-N 2.74Å; A741-I821 HydrophobicContact CB-CG2 3.72Å
742	I	85.8	Confident	83.5	Confident	30 Å²	30	32.9 Å²	32.9	15%	0.154	18%	0.182	C	C	.	.	H	α-helix	trans	-64	-46.3	175.2	-69.9	171.1	0	0	0	110.4	Q738 E739 I744 G745 Y746 L751 I792	Q738-I742 HydrophobicContact CG-CD1 3.78Å; Q738-I742 HydrophobicContact CG-CG1 4.29Å; Q738-I742 VanDerWaalsContact O-CG1 3.3Å; Q738-I742 WeakPolarHBondContact O-CG1 3.43Å; Q738-I742 PolarHBondContact O-N 3.43Å; E739-I742 PolarHBondContact O-N 3.28Å; I742-I744 VanDerWaalsContact C-N 3.34Å; I742-I744 PolarHBondContact O-N 2.79Å; I742-G745 CarbonylContact O-C 3.43Å; I742-G745 VanDerWaalsContact O-CA 3.31Å; I742-G745 WeakPolarHBondContact O-CA 3.29Å; I742-G745 PolarHBondContact O-N 3.08Å; I742-Y746 HydrophobicContact CG2-CD2 3.85Å; I742-Y746 HydrophobicContact CG2-CE2 3.58Å; I742-Y746 WeakPolarHBondContact O-CD2 3.39Å; I742-Y746 PolarHBondContact O-N 2.75Å; I742-L751 HydrophobicContact CG2-CD1 4.17Å; I742-I792 HydrophobicContact CD1-CD1 3.78Å; I742-I792 HydrophobicContact CD1-CG2 4.41Å; I742-I792 HydrophobicContact CG1-CD1 3.67Å; I742-I792 HydrophobicContact CG1-CG1 4.32Å; I742-I792 HydrophobicContact CG1-CG2 4.36Å
743	N	80.4	Confident	82.7	Confident	35 Å²	35	41.7 Å²	41.7	19%	0.187	22%	0.223	C	C	.	.	H	α-helix	trans	-60.5	-45.1	179.5	-74.9	-17.1	0	0	0	111.7	A649 E739 T740 G745 Y746 S747	A649-N743 PolarHBondContact O-ND2 3.28Å; E739-N743 WeakPolarHBondContact O-CB 3.41Å; E739-N743 VanDerWaalsContact O-CG 3.23Å; E739-N743 PolarHBondContact O-N 3.23Å; E739-N743 PolarHBondContact O-ND2 3.47Å; T740-N743 PolarHBondContact O-N 2.89Å; N743-G745 VanDerWaalsContact C-N 3.27Å; N743-G745 PolarHBondContact O-N 2.66Å; N743-Y746 PolarHBondContact O-N 2.81Å; N743-Y746 VanDerWaalsContact O-N 3.13Å; N743-S747 PolarHBondContact O-N 3.3Å; N743-S747 PolarHBondContact O-OG 3.23Å
744	I	83.6	Confident	81.9	Confident	17 Å²	17	46.5 Å²	46.5	9%	0.087	26%	0.256	C	S	.	.	H	α-helix	trans	-65	-35.5	173.9	-69.7	168.5	0	0	0	110.9	K452 L712 T740 I742 Y746 S747 C748	K452-I744 HydrophobicContact CD-CD1 3.39Å; K452-I744 HydrophobicContact CG-CD1 4.1Å; K452-I744 HydrophobicContact CG-CG2 4.23Å; L712-I744 HydrophobicContact CD2-CG2 4.4Å; T740-I744 HydrophobicContact CG2-CD1 3.89Å; T740-I744 WeakPolarHBondContact O-CB 3.42Å; T740-I744 VanDerWaalsContact O-CG1 3.29Å; T740-I744 WeakPolarHBondContact O-CG1 3.45Å; T740-I744 PolarHBondContact O-N 3.03Å; I742-I744 VanDerWaalsContact C-N 3.34Å; I742-I744 PolarHBondContact O-N 2.79Å; I744-Y746 VanDerWaalsContact C-N 3.3Å; I744-Y746 PolarHBondContact O-N 2.59Å; I744-S747 PolarHBondContact O-N 3.18Å; I744-C748 WeakPolarHBondContact O-CB 3.49Å; I744-C748 PolarHBondContact O-N 2.73Å; I744-C748 PolarHBondContact O-SG 3.39Å
745	G	87.1	Confident	81.5	Confident	2 Å²	2	47 Å²	47	2%	0.021	26%	0.259	C	S	.	.	H	α-helix	trans	-55.2	-43.2	170.9	0	0	0	0	0	112.7	A741 I742 N743 Q749 L750 L751	A741-G745 PolarHBondContact O-N 2.74Å; I742-G745 CarbonylContact O-C 3.43Å; I742-G745 VanDerWaalsContact O-CA 3.31Å; I742-G745 WeakPolarHBondContact O-CA 3.29Å; I742-G745 PolarHBondContact O-N 3.08Å; N743-G745 VanDerWaalsContact C-N 3.27Å; N743-G745 PolarHBondContact O-N 2.66Å; G745-Q749 PolarHBondContact O-N 3.03Å; G745-L750 WeakPolarHBondContact O-CB 3.46Å; G745-L750 PolarHBondContact O-N 2.99Å; G745-L751 PolarHBondContact O-N 3.45Å
746	Y	85.1	Confident	81.6	Confident	95 Å²	95	47.9 Å²	47.9	37%	0.373	26%	0.257	S	S	.	.	H	α-helix	trans	-69.5	-46.2	174.5	-76.6	-66.5	0	0	0	112.6	I742 N743 I744 C748 Q749 L751 L757	I742-Y746 HydrophobicContact CG2-CD2 3.85Å; I742-Y746 HydrophobicContact CG2-CE2 3.58Å; I742-Y746 WeakPolarHBondContact O-CD2 3.39Å; I742-Y746 PolarHBondContact O-N 2.75Å; N743-Y746 PolarHBondContact O-N 2.81Å; N743-Y746 VanDerWaalsContact O-N 3.13Å; I744-Y746 VanDerWaalsContact C-N 3.3Å; I744-Y746 PolarHBondContact O-N 2.59Å; Y746-C748 VanDerWaalsContact C-N 3.29Å; Y746-C748 PolarHBondContact O-N 2.63Å; Y746-Q749 PolarHBondContact O-N 3.35Å; Y746-L751 HydrophobicContact CD1-CB 3.83Å; Y746-L751 WeakPolarHBondContact CD1-O 3.4Å; Y746-L751 HydrophobicContact CD2-CD1 4.48Å; Y746-L751 HydrophobicContact CE1-CB 3.89Å; Y746-L751 HydrophobicContact CE2-CD1 4.4Å; Y746-L751 HydrophobicContact CG-CB 4.21Å; Y746-L757 WeakPolarHBondContact OH-CD1 3.47Å
747	S	83.4	Confident	82.1	Confident	54 Å²	54	48.8 Å²	48.8	38%	0.378	26%	0.261	S	S	.	.	H	α-helix	trans	-62.8	-35.7	179.2	-55.6	0	0	0	0	112.6	P717 N743 I744 Q749	P717-S747 WeakPolarHBondContact CG-O 3.48Å; N743-S747 PolarHBondContact O-N 3.3Å; N743-S747 PolarHBondContact O-OG 3.23Å; I744-S747 PolarHBondContact O-N 3.18Å; S747-Q749 PolarHBondContact O-N 2.84Å
748	C	86.1	Confident	83.1	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.014	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-3.8	174.5	-75.4	0	0	0	0	114	L712 P717 I720 I744 Y746 L750	L712-C748 VanDerWaalsContact CD2-SG 3.52Å; P717-C748 WeakPolarHBondContact CA-O 3.4Å; I720-C748 HydrophobicContact CD1-CB 3.69Å; I744-C748 WeakPolarHBondContact O-CB 3.49Å; I744-C748 PolarHBondContact O-N 2.73Å; I744-C748 PolarHBondContact O-SG 3.39Å; Y746-C748 VanDerWaalsContact C-N 3.29Å; Y746-C748 PolarHBondContact O-N 2.63Å; C748-L750 HydrophobicContact CB-CB 4.37Å; C748-L750 PolarHBondContact O-N 3.25Å; C748-L750 VanDerWaalsContact O-N 3.13Å
749	Q	84.4	Confident	83.5	Confident	96 Å²	96	49.2 Å²	49.2	45%	0.449	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.2	19.5	-169.5	-59.8	-178.7	-15.3	0	0	114.1	P717 M724 G745 Y746 S747 L751	P717-Q749 HydrophobicContact CB-CG 4.16Å; M724-Q749 WeakPolarHBondContact CE-O 3.43Å; G745-Q749 PolarHBondContact O-N 3.03Å; Y746-Q749 PolarHBondContact O-N 3.35Å; S747-Q749 PolarHBondContact O-N 2.84Å; Q749-L751 VanDerWaalsContact C-N 3.32Å
750	L	86.9	Confident	84.1	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.01	25%	0.252	C	S	.	.	S	Bend	trans	-69.9	-36.9	171.8	-176.6	69.9	0	0	0	110.4	I720 M724 I730 V732 G745 C748 S819 I821	I720-L750 HydrophobicContact CG2-CB 4.28Å; I720-L750 HydrophobicContact CG2-CD1 4.13Å; M724-L750 HydrophobicContact SD-CD1 4.27Å; I730-L750 HydrophobicContact CB-CD1 3.76Å; I730-L750 HydrophobicContact CD1-CD1 4.39Å; I730-L750 HydrophobicContact CG2-CD1 3.91Å; V732-L750 HydrophobicContact CG2-CD2 3.53Å; G745-L750 WeakPolarHBondContact O-CB 3.46Å; G745-L750 PolarHBondContact O-N 2.99Å; C748-L750 HydrophobicContact CB-CB 4.37Å; C748-L750 PolarHBondContact O-N 3.25Å; C748-L750 VanDerWaalsContact O-N 3.13Å; L750-S819 PolarHBondContact O-OG 3.33Å; L750-I821 HydrophobicContact CD2-CD1 4.03Å; L750-I821 HydrophobicContact CD2-CG1 3.98Å
751	L	87.1	Confident	84.8	Confident	2 Å²	2	47 Å²	47	1%	0.01	26%	0.257	C	S	.	.	S	Bend	trans	-106	131.4	170.8	-54	-178.5	0	0	0	108.2	I742 G745 Y746 Q749 L757 A790 I821	I742-L751 HydrophobicContact CG2-CD1 4.17Å; G745-L751 PolarHBondContact O-N 3.45Å; Y746-L751 HydrophobicContact CD1-CB 3.83Å; Y746-L751 WeakPolarHBondContact CD1-O 3.4Å; Y746-L751 HydrophobicContact CD2-CD1 4.48Å; Y746-L751 HydrophobicContact CE1-CB 3.89Å; Y746-L751 HydrophobicContact CE2-CD1 4.4Å; Y746-L751 HydrophobicContact CG-CB 4.21Å; Q749-L751 VanDerWaalsContact C-N 3.32Å; L751-L757 HydrophobicContact CB-CD2 4.5Å; L751-L757 HydrophobicContact CD1-CD2 3.99Å; L751-L757 HydrophobicContact CD2-CD2 3.74Å; L751-L757 HydrophobicContact CG-CD2 4.29Å; L751-A790 HydrophobicContact CD2-CB 3.32Å; L751-I821 HydrophobicContact CD1-CD1 3.88Å; L751-I821 HydrophobicContact CD2-CD1 4.22Å; L751-I821 HydrophobicContact CG-CD1 4.13Å
752	T	81.7	Confident	84.9	Confident	51 Å²	51	47.2 Å²	47.2	31%	0.313	26%	0.258	S	S	.	.			trans	-124.5	155.8	172.9	53.3	0	0	0	0	108.2	S754 I755	T752-S754 PolarHBondContact O-N 3.43Å; T752-S754 PolarHBondContact OG1-OG 2.98Å; T752-I755 PolarHBondContact O-N 3.05Å; T752-I755 WeakPolarHBondContact OG1-CD1 3.15Å; T752-I755 WeakPolarHBondContact OG1-CG1 3.31Å
753	Q	77.6	Confident	84.9	Confident	194 Å²	194	54.1 Å²	54.1	91%	0.907	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-18	179.8	-66.7	178.3	-9.6	0	0	113.4
754	S	77.2	Confident	85.2	Confident	100 Å²	100	54.3 Å²	54.3	70%	0.699	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-18.9	174.4	47.6	0	0	0	0	114.6	T752	T752-S754 PolarHBondContact O-N 3.43Å; T752-S754 PolarHBondContact OG1-OG 2.98Å
755	I	81.4	Confident	85.5	Confident	13 Å²	13	55.6 Å²	55.6	7%	0.067	30%	0.298	C	S	.	.	S	Bend	trans	-89.5	127.9	-178.6	-66.2	169.7	0	0	0	108.5	T752 D788 A790	T752-I755 PolarHBondContact O-N 3.05Å; T752-I755 WeakPolarHBondContact OG1-CD1 3.15Å; T752-I755 WeakPolarHBondContact OG1-CG1 3.31Å; I755-D788 WeakPolarHBondContact CA-O 3.41Å; I755-D788 HydrophobicContact CG1-CB 4.44Å; I755-D788 WeakPolarHBondContact CG2-O 3.4Å; I755-A790 HydrophobicContact CG2-CB 3.69Å
756	S	85.4	Confident	85.6	Confident	67 Å²	67	61.2 Å²	61.2	47%	0.469	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	128.3	176.2	-65.7	0	0	0	0	110.3	D788 F789 A790	S756-D788 PolarHBondContact N-O 3.39Å; S756-F789 VanDerWaalsContact CB-CD1 3.49Å; S756-F789 WeakPolarHBondContact O-CA 3.36Å; S756-A790 PolarHBondContact O-N 2.87Å
757	L	88.2	Confident	85.8	Confident	59 Å²	59	61.5 Å²	61.5	31%	0.309	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	126.1	-179	-58.3	-175.3	0	0	0	110.8	Y746 L751 A790 I792	Y746-L757 WeakPolarHBondContact OH-CD1 3.47Å; L751-L757 HydrophobicContact CB-CD2 4.5Å; L751-L757 HydrophobicContact CD1-CD2 3.99Å; L751-L757 HydrophobicContact CD2-CD2 3.74Å; L751-L757 HydrophobicContact CG-CD2 4.29Å; L757-A790 HydrophobicContact CD2-CB 3.84Å; L757-I792 HydrophobicContact CB-CD1 4.3Å; L757-I792 HydrophobicContact CD1-CD1 4.23Å; L757-I792 HydrophobicContact CD2-CD1 4.31Å
758	L	89.5	Confident	85.9	Confident	29 Å²	29	58.9 Å²	58.9	15%	0.152	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	114.2	172.9	-59.6	175.3	0	0	0	108.4	L775 F779 F789 A790 L791 I792	L758-L775 HydrophobicContact CD1-CD2 4.27Å; L758-L775 HydrophobicContact CD2-CD2 3.87Å; L758-F779 HydrophobicContact CD1-CE2 3.79Å; L758-F779 HydrophobicContact CD1-CZ 3.49Å; L758-F779 VanDerWaalsContact CD1-CZ 3.49Å; L758-F789 HydrophobicContact CD1-CB 4.04Å; L758-F789 HydrophobicContact CD1-CD1 4.07Å; L758-F789 HydrophobicContact CD1-CG 4.2Å; L758-F789 HydrophobicContact CD2-CD1 4.32Å; L758-F789 HydrophobicContact CG-CB 4.48Å; L758-F789 HydrophobicContact CG-CD1 4.12Å; L758-A790 PolarHBondContact N-O 2.82Å; L758-L791 HydrophobicContact CB-CD1 4.08Å; L758-L791 CarbonylContact O-C 3.41Å; L758-L791 WeakPolarHBondContact O-CA 3.41Å; L758-I792 PolarHBondContact O-N 2.89Å
759	T	89.8	Confident	86.1	Confident	55 Å²	55	64.1 Å²	64.1	34%	0.337	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	129.2	-177.2	-62.5	0	0	0	0	111	Q771 I792	T759-Q771 PolarHBondContact O-NE2 3.4Å; T759-I792 WeakPolarHBondContact CA-O 3.35Å
760	M	88.5	Confident	86.3	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	103.7	178.1	-69.3	-171.1	71.4	0	0	111.2	T768 L772 L775 L791 I792 D794 T797	M760-T768 HydrophobicContact CE-CG2 3.99Å; M760-L772 HydrophobicContact CE-CD1 4.37Å; M760-L772 HydrophobicContact CE-CD2 3.55Å; M760-L772 HydrophobicContact CE-CG 3.6Å; M760-L772 HydrophobicContact SD-CD2 3.8Å; M760-L775 HydrophobicContact CG-CD1 4.33Å; M760-L775 HydrophobicContact SD-CD1 4.21Å; M760-L791 HydrophobicContact CG-CD1 4.1Å; M760-L791 HydrophobicContact SD-CD1 4.01Å; M760-I792 PolarHBondContact N-O 3.5Å; M760-D794 PolarHBondContact O-N 3Å; M760-T797 HydrophobicContact CB-CG2 3.94Å; M760-T797 HydrophobicContact CE-CG2 4.22Å; M760-T797 PolarHBondContact O-OG1 2.93Å
761	N	87	Confident	86.4	Confident	80 Å²	80	68.1 Å²	68.1	43%	0.428	35%	0.352	S	S	.	.			trans	-128.9	60	-178.1	-69.2	-9.4	0	0	0	110.6	Q738	Q738-N761 PolarHBondContact OE1-ND2 3.43Å; Q738-N761 PolarHBondContact OE1-OD1 3.34Å
762	T	87.1	Confident	86.5	Confident	9 Å²	9	68 Å²	68	6%	0.055	35%	0.352	C	S	.	.			trans	-91.7	146.7	-179.6	57.8	0	0	0	0	111.5	Q767 T768 Q771 T797	T762-Q767 HydrophobicContact CG2-CB 3.96Å; T762-T768 PolarHBondContact OG1-OG1 2.91Å; T762-Q771 HydrophobicContact CG2-CB 4.48Å; T762-T797 PolarHBondContact N-OG1 3.35Å; T762-T797 PolarHBondContact O-OG1 3.33Å; T762-T797 WeakPolarHBondContact OG1-CG2 3.37Å; T762-T797 PolarHBondContact OG1-OG1 3.37Å
763	K	85.2	Confident	86.8	Confident	174 Å²	174	67.7 Å²	67.7	76%	0.757	35%	0.349	S	S	*	.	S	Bend	trans	-100.7	-7.7	-179.4	-65.1	-176.9	179.5	178.8	0	113.7	F800	K763-F800 WeakPolarHBondContact O-CE2 3.45Å
764	S	88.1	Confident	87.3	Confident	39 Å²	39	62 Å²	62	27%	0.273	33%	0.325	S	S	.	.	S	Bend	trans	-142.7	152.2	-175.7	64.3	0	0	0	0	111.3	D766 Q767 T768	S764-D766 PolarHBondContact O-N 3.25Å; S764-Q767 PolarHBondContact O-N 3.2Å; S764-Q767 WeakPolarHBondContact OG-CB 3.49Å; S764-Q767 WeakPolarHBondContact OG-CG 3.36Å; S764-Q767 PolarHBondContact OG-OE1 3.39Å; S764-T768 PolarHBondContact O-N 2.62Å; S764-T768 VanDerWaalsContact O-N 3.09Å; S764-T768 PolarHBondContact O-OG1 2.9Å
765	L	88.2	Confident	87.7	Confident	44 Å²	44	58 Å²	58	23%	0.23	30%	0.296	C	S	.	.	H	α-helix	trans	-55.1	-46.6	178.3	-172.7	158.7	0	0	0	112.9	Q767 T768 R769 F800 L803	L765-Q767 PolarHBondContact O-N 3.08Å; L765-T768 WeakPolarHBondContact O-CB 3.46Å; L765-T768 PolarHBondContact O-N 3.25Å; L765-T768 VanDerWaalsContact O-N 3.13Å; L765-R769 PolarHBondContact O-N 2.79Å; L765-F800 HydrophobicContact CB-CD1 4.13Å; L765-F800 HydrophobicContact CB-CG 4.48Å; L765-L803 HydrophobicContact CD1-CD1 3.58Å
766	D	88.8	Confident	87.8	Confident	121 Å²	121	59.2 Å²	59.2	65%	0.647	30%	0.302	S	S	*	.	H	α-helix	trans	-62.5	-43.1	-177.5	-64.2	-34.7	0	0	0	112.1	S764 T768 R769 E770	S764-D766 PolarHBondContact O-N 3.25Å; D766-T768 VanDerWaalsContact C-N 3.35Å; D766-T768 PolarHBondContact O-N 3.36Å; D766-R769 WeakPolarHBondContact O-CB 3.34Å; D766-R769 PolarHBondContact O-N 3.43Å; D766-E770 WeakPolarHBondContact O-CB 3.32Å; D766-E770 PolarHBondContact O-N 2.8Å
767	Q	89.3	Confident	87.8	Confident	100 Å²	100	62.6 Å²	62.6	47%	0.467	31%	0.31	S	S	.	.	H	α-helix	trans	-61.6	-41.9	173.7	-71.3	173.2	1.6	0	0	111.9	T762 S764 L765 R769 E770 Q771	T762-Q767 HydrophobicContact CG2-CB 3.96Å; S764-Q767 PolarHBondContact O-N 3.2Å; S764-Q767 WeakPolarHBondContact OG-CB 3.49Å; S764-Q767 WeakPolarHBondContact OG-CG 3.36Å; S764-Q767 PolarHBondContact OG-OE1 3.39Å; L765-Q767 PolarHBondContact O-N 3.08Å; Q767-R769 VanDerWaalsContact C-N 3.3Å; Q767-R769 PolarHBondContact O-N 3.39Å; Q767-E770 PolarHBondContact O-N 3.41Å; Q767-Q771 WeakPolarHBondContact O-CB 3.26Å; Q767-Q771 PolarHBondContact O-N 3.01Å
768	T	87.3	Confident	87.5	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-59.8	-44.3	176.3	-49.4	0	0	0	0	110.6	M760 T762 S764 L765 D766 L772 T797 F800 A801	M760-T768 HydrophobicContact CE-CG2 3.99Å; T762-T768 PolarHBondContact OG1-OG1 2.91Å; S764-T768 PolarHBondContact O-N 2.62Å; S764-T768 VanDerWaalsContact O-N 3.09Å; S764-T768 PolarHBondContact O-OG1 2.9Å; L765-T768 WeakPolarHBondContact O-CB 3.46Å; L765-T768 PolarHBondContact O-N 3.25Å; L765-T768 VanDerWaalsContact O-N 3.13Å; D766-T768 VanDerWaalsContact C-N 3.35Å; D766-T768 PolarHBondContact O-N 3.36Å; T768-L772 HydrophobicContact CG2-CD1 4.17Å; T768-L772 WeakPolarHBondContact O-CB 3.48Å; T768-L772 VanDerWaalsContact O-CG 3.24Å; T768-L772 WeakPolarHBondContact O-CG 3.4Å; T768-L772 PolarHBondContact O-N 3.48Å; T768-T797 HydrophobicContact CG2-CG2 4.01Å; T768-F800 HydrophobicContact CG2-CB 4.39Å; T768-A801 HydrophobicContact CG2-CB 4.25Å
769	R	89	Confident	87	Confident	112 Å²	112	65.3 Å²	65.3	42%	0.423	33%	0.325	S	S	.	.	H	α-helix	trans	-64.6	-48.8	179	-173.6	179.5	-179.9	158	0.8	112	L765 D766 Q767 Q771 L772 V773 E805	L765-R769 PolarHBondContact O-N 2.79Å; D766-R769 WeakPolarHBondContact O-CB 3.34Å; D766-R769 PolarHBondContact O-N 3.43Å; Q767-R769 VanDerWaalsContact C-N 3.3Å; Q767-R769 PolarHBondContact O-N 3.39Å; R769-Q771 VanDerWaalsContact C-N 3.34Å; R769-Q771 PolarHBondContact O-N 3.46Å; R769-L772 PolarHBondContact O-N 3.24Å; R769-V773 WeakPolarHBondContact O-CG2 3.48Å; R769-V773 PolarHBondContact O-N 3.23Å; R769-E805 IonicContact NH1-OE2 2.72Å
770	E	89.9	Confident	86.4	Confident	126 Å²	126	64.4 Å²	64.4	59%	0.589	33%	0.326	S	S	*	.	H	α-helix	trans	-59.9	-45.6	178.6	-172.6	179.5	-176.6	0	0	111	D766 Q767 L772 V773 N774	D766-E770 WeakPolarHBondContact O-CB 3.32Å; D766-E770 PolarHBondContact O-N 2.8Å; Q767-E770 PolarHBondContact O-N 3.41Å; E770-L772 PolarHBondContact O-N 2.98Å; E770-V773 PolarHBondContact O-N 3.17Å; E770-N774 WeakPolarHBondContact O-CB 3.44Å; E770-N774 PolarHBondContact O-N 2.87Å; E770-N774 PolarHBondContact O-ND2 2.85Å; E770-N774 PolarHBondContact O-OD1 3.37Å
771	Q	88.3	Confident	85.5	Confident	56 Å²	56	72.3 Å²	72.3	26%	0.262	37%	0.369	S	S	.	.	H	α-helix	trans	-63.6	-39.7	177.3	-168.5	175.9	-1.1	0	0	112	T759 T762 Q767 R769 N774 L775	T759-Q771 PolarHBondContact O-NE2 3.4Å; T762-Q771 HydrophobicContact CG2-CB 4.48Å; Q767-Q771 WeakPolarHBondContact O-CB 3.26Å; Q767-Q771 PolarHBondContact O-N 3.01Å; R769-Q771 VanDerWaalsContact C-N 3.34Å; R769-Q771 PolarHBondContact O-N 3.46Å; Q771-N774 PolarHBondContact O-N 3.27Å; Q771-L775 HydrophobicContact CG-CD1 4.41Å; Q771-L775 WeakPolarHBondContact O-CB 3.31Å; Q771-L775 VanDerWaalsContact O-CG 3.26Å; Q771-L775 WeakPolarHBondContact O-CG 3.41Å; Q771-L775 PolarHBondContact O-N 2.99Å
772	L	88.9	Confident	84.7	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-64.5	-43.3	175.2	-75.9	171.9	0	0	0	112.3	M760 T768 R769 E770 L775 I776 C806 Q809 F810 V813	M760-L772 HydrophobicContact CE-CD1 4.37Å; M760-L772 HydrophobicContact CE-CD2 3.55Å; M760-L772 HydrophobicContact CE-CG 3.6Å; M760-L772 HydrophobicContact SD-CD2 3.8Å; T768-L772 HydrophobicContact CG2-CD1 4.17Å; T768-L772 WeakPolarHBondContact O-CB 3.48Å; T768-L772 VanDerWaalsContact O-CG 3.24Å; T768-L772 WeakPolarHBondContact O-CG 3.4Å; T768-L772 PolarHBondContact O-N 3.48Å; R769-L772 PolarHBondContact O-N 3.24Å; E770-L772 PolarHBondContact O-N 2.98Å; L772-L775 PolarHBondContact O-N 2.98Å; L772-I776 WeakPolarHBondContact O-CB 3.3Å; L772-I776 WeakPolarHBondContact O-CD1 3.5Å; L772-I776 WeakPolarHBondContact O-CG1 3.36Å; L772-I776 PolarHBondContact O-N 2.95Å; L772-C806 HydrophobicContact CD1-CB 4Å; L772-Q809 HydrophobicContact CB-CB 4.24Å; L772-Q809 HydrophobicContact CD1-CB 4.29Å; L772-F810 HydrophobicContact CD1-CB 3.99Å; L772-F810 HydrophobicContact CD2-CB 4.3Å; L772-F810 HydrophobicContact CD2-CD2 4.38Å; L772-V813 HydrophobicContact CD2-CB 4.37Å; L772-V813 HydrophobicContact CD2-CG2 4.11Å
773	V	88.2	Confident	83.7	Confident	43 Å²	43	77.7 Å²	77.7	26%	0.261	39%	0.385	S	S	.	.	H	α-helix	trans	-62.5	-45.7	176.9	172.1	0	0	0	0	110.5	R769 E770 L775 I776 E777	R769-V773 WeakPolarHBondContact O-CG2 3.48Å; R769-V773 PolarHBondContact O-N 3.23Å; E770-V773 PolarHBondContact O-N 3.17Å; V773-L775 VanDerWaalsContact C-N 3.34Å; V773-L775 PolarHBondContact O-N 3.39Å; V773-I776 WeakPolarHBondContact O-CB 3.11Å; V773-I776 PolarHBondContact O-N 2.72Å; V773-E777 WeakPolarHBondContact O-CG 3.39Å; V773-E777 PolarHBondContact O-N 2.67Å
774	N	88	Confident	82.7	Confident	75 Å²	75	77.6 Å²	77.6	40%	0.401	38%	0.38	S	S	.	.	H	α-helix	trans	-60.4	-43.3	176.9	-66.6	-14.8	0	0	0	111.6	E770 Q771 I776 E777 D778	E770-N774 WeakPolarHBondContact O-CB 3.44Å; E770-N774 PolarHBondContact O-N 2.87Å; E770-N774 PolarHBondContact O-ND2 2.85Å; E770-N774 PolarHBondContact O-OD1 3.37Å; Q771-N774 PolarHBondContact O-N 3.27Å; N774-I776 PolarHBondContact O-N 2.98Å; N774-E777 PolarHBondContact O-N 3.43Å; N774-D778 VanDerWaalsContact O-CG 3.29Å; N774-D778 PolarHBondContact O-N 2.86Å
775	L	85.1	Confident	81.6	Confident	16 Å²	16	81.2 Å²	81.2	8%	0.084	39%	0.394	C	S	.	.	H	α-helix	trans	-63.3	-41.8	176.3	-73.8	173.4	0	0	0	111.9	L758 M760 Q771 L772 V773 E777 D778 F779 V813	L758-L775 HydrophobicContact CD1-CD2 4.27Å; L758-L775 HydrophobicContact CD2-CD2 3.87Å; M760-L775 HydrophobicContact CG-CD1 4.33Å; M760-L775 HydrophobicContact SD-CD1 4.21Å; Q771-L775 HydrophobicContact CG-CD1 4.41Å; Q771-L775 WeakPolarHBondContact O-CB 3.31Å; Q771-L775 VanDerWaalsContact O-CG 3.26Å; Q771-L775 WeakPolarHBondContact O-CG 3.41Å; Q771-L775 PolarHBondContact O-N 2.99Å; L772-L775 PolarHBondContact O-N 2.98Å; V773-L775 VanDerWaalsContact C-N 3.34Å; V773-L775 PolarHBondContact O-N 3.39Å; L775-E777 VanDerWaalsContact C-N 3.32Å; L775-E777 PolarHBondContact O-N 3.4Å; L775-D778 PolarHBondContact O-N 2.91Å; L775-F779 WeakPolarHBondContact O-CD2 3.34Å; L775-F779 PolarHBondContact O-N 3.21Å; L775-V813 HydrophobicContact CB-CG2 4.16Å; L775-V813 HydrophobicContact CD1-CG1 4.22Å
776	I	84.6	Confident	80.6	Confident	38 Å²	38	84.9 Å²	84.9	20%	0.195	41%	0.41	C	S	.	.	H	α-helix	trans	-60.2	-44.9	175.5	-73	169.1	0	0	0	110.2	L772 V773 N774 D778 F779 G780 I783 Q809 V813	L772-I776 WeakPolarHBondContact O-CB 3.3Å; L772-I776 WeakPolarHBondContact O-CD1 3.5Å; L772-I776 WeakPolarHBondContact O-CG1 3.36Å; L772-I776 PolarHBondContact O-N 2.95Å; V773-I776 WeakPolarHBondContact O-CB 3.11Å; V773-I776 PolarHBondContact O-N 2.72Å; N774-I776 PolarHBondContact O-N 2.98Å; I776-D778 PolarHBondContact O-N 3.4Å; I776-F779 PolarHBondContact O-N 2.84Å; I776-G780 PolarHBondContact O-N 2.67Å; I776-I783 HydrophobicContact CB-CD1 4.41Å; I776-I783 HydrophobicContact CG2-CD1 3.57Å; I776-I783 WeakPolarHBondContact O-CD1 3.46Å; I776-Q809 HydrophobicContact CD1-CB 3.64Å; I776-Q809 HydrophobicContact CD1-CG 3.86Å; I776-V813 HydrophobicContact CD1-CG2 4.31Å; I776-V813 HydrophobicContact CG1-CG2 3.63Å
777	E	84.7	Confident	79.8	Confident	138 Å²	138	80.1 Å²	80.1	65%	0.645	38%	0.384	S	S	*	.	H	α-helix	trans	-62	-41	175.2	-70.7	-177.7	-178.4	0	0	112.1	V773 N774 L775 G780	V773-E777 WeakPolarHBondContact O-CG 3.39Å; V773-E777 PolarHBondContact O-N 2.67Å; N774-E777 PolarHBondContact O-N 3.43Å; L775-E777 VanDerWaalsContact C-N 3.32Å; L775-E777 PolarHBondContact O-N 3.4Å; E777-G780 PolarHBondContact O-N 3.01Å
778	D	82.1	Confident	79.4	Confident	134 Å²	134	80 Å²	80	72%	0.717	39%	0.387	S	S	*	.	H	α-helix	trans	-64.9	-37.6	176.4	-73.6	-21.1	0	0	0	112.8	N774 L775 I776	N774-D778 VanDerWaalsContact O-CG 3.29Å; N774-D778 PolarHBondContact O-N 2.86Å; L775-D778 PolarHBondContact O-N 2.91Å; I776-D778 PolarHBondContact O-N 3.4Å
779	F	80	Confident	79.4	Confident	11 Å²	11	82.2 Å²	82.2	5%	0.048	40%	0.397	C	S	.	.	H	α-helix	trans	-68.6	-35.4	173.9	-80.5	-70.7	0	0	0	111.7	L758 L775 I776 D781 R782 I783 N787 F789 V813	L758-F779 HydrophobicContact CD1-CE2 3.79Å; L758-F779 HydrophobicContact CD1-CZ 3.49Å; L758-F779 VanDerWaalsContact CD1-CZ 3.49Å; L775-F779 WeakPolarHBondContact O-CD2 3.34Å; L775-F779 PolarHBondContact O-N 3.21Å; I776-F779 PolarHBondContact O-N 2.84Å; F779-D781 PolarHBondContact O-N 3.15Å; F779-R782 WeakPolarHBondContact O-CA 3.45Å; F779-R782 WeakPolarHBondContact O-CB 3.02Å; F779-R782 WeakPolarHBondContact O-CG 3.46Å; F779-R782 PolarHBondContact O-N 3.46Å; F779-I783 HydrophobicContact CB-CG1 3.59Å; F779-N787 HydrophobicContact CE1-CB 4.47Å; F779-F789 HydrophobicContact CD1-CD2 4.4Å; F779-F789 HydrophobicContact CD1-CE2 4.25Å; F779-F789 AromaticContact CE1-CD2 3.41Å; F779-F789 HydrophobicContact CE1-CD2 3.41Å; F779-F789 VanDerWaalsContact CE1-CD2 3.41Å; F779-F789 AromaticContact CE1-CE2 3.65Å; F779-F789 HydrophobicContact CE1-CE2 3.65Å; F779-F789 HydrophobicContact CE1-CG 4.02Å; F779-F789 HydrophobicContact CE1-CZ 4.44Å; F779-F789 HydrophobicContact CZ-CB 4.39Å; F779-F789 HydrophobicContact CZ-CD2 4.03Å; F779-F789 HydrophobicContact CZ-CG 4.17Å; F779-V813 HydrophobicContact CE2-CG1 4.06Å
780	G	76.3	Confident	79.5	Confident	36 Å²	36	76.9 Å²	76.9	37%	0.371	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	52.8	-125.6	-179.1	0	0	0	0	0	112.2	I776 E777 R782 I783	I776-G780 PolarHBondContact O-N 2.67Å; E777-G780 PolarHBondContact O-N 3.01Å; G780-R782 PolarHBondContact O-N 3.42Å; G780-R782 VanDerWaalsContact O-N 3.13Å; G780-I783 VanDerWaalsContact O-CD1 3.22Å; G780-I783 WeakPolarHBondContact O-CD1 3.36Å; G780-I783 VanDerWaalsContact O-CG1 3.23Å; G780-I783 WeakPolarHBondContact O-CG1 3.47Å; G780-I783 PolarHBondContact O-N 3.23Å
781	D	70.3	Confident	79.7	Confident	167 Å²	167	70.9 Å²	70.9	89%	0.893	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-67.4	-10.1	177.7	-66.3	-28.2	0	0	0	114.1	F779 I783	F779-D781 PolarHBondContact O-N 3.15Å; D781-I783 VanDerWaalsContact C-N 3.27Å; D781-I783 PolarHBondContact O-N 3.45Å
782	R	69.3	Low	79.9	Confident	152 Å²	152	68.2 Å²	68.2	57%	0.574	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-82.9	-1.6	179.9	-53.8	-178.2	-178.2	170.2	2.7	113.2	F779 G780 R784 M785 N787	F779-R782 WeakPolarHBondContact O-CA 3.45Å; F779-R782 WeakPolarHBondContact O-CB 3.02Å; F779-R782 WeakPolarHBondContact O-CG 3.46Å; F779-R782 PolarHBondContact O-N 3.46Å; G780-R782 PolarHBondContact O-N 3.42Å; G780-R782 VanDerWaalsContact O-N 3.13Å; R782-R784 PolarHBondContact O-N 2.84Å; R782-M785 WeakPolarHBondContact O-CB 3.3Å; R782-M785 PolarHBondContact O-N 2.99Å; R782-M785 VanDerWaalsContact O-N 3.12Å; R782-N787 PolarHBondContact O-ND2 3.08Å
783	I	65.4	Low	80.1	Confident	50 Å²	50	68.2 Å²	68.2	26%	0.256	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	134.3	175.6	-64	161.3	0	0	0	109.5	I776 F779 G780 D781 M785 D812	I776-I783 HydrophobicContact CB-CD1 4.41Å; I776-I783 HydrophobicContact CG2-CD1 3.57Å; I776-I783 WeakPolarHBondContact O-CD1 3.46Å; F779-I783 HydrophobicContact CB-CG1 3.59Å; G780-I783 VanDerWaalsContact O-CD1 3.22Å; G780-I783 WeakPolarHBondContact O-CD1 3.36Å; G780-I783 VanDerWaalsContact O-CG1 3.23Å; G780-I783 WeakPolarHBondContact O-CG1 3.47Å; G780-I783 PolarHBondContact O-N 3.23Å; D781-I783 VanDerWaalsContact C-N 3.27Å; D781-I783 PolarHBondContact O-N 3.45Å; I783-M785 PolarHBondContact O-N 3.11Å; I783-D812 HydrophobicContact CG2-CB 4.16Å
784	R	64.4	Low	80.1	Confident	171 Å²	171	67.1 Å²	67.1	65%	0.645	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	13.2	-175.8	-62.4	170	179.7	-179.2	5.2	115	R782 D812 S816	R782-R784 PolarHBondContact O-N 2.84Å; R784-D812 IonicContact CZ-OD1 3.93Å; R784-D812 IonicContact CZ-OD2 3.34Å; R784-D812 IonicContact NE-OD1 2.86Å; R784-D812 PolarHBondContact NE-OD1 3.41Å; R784-D812 IonicContact NE-OD2 2.84Å; R784-D812 IonicContact NH2-OD1 3.05Å; R784-D812 PolarHBondContact NH2-OD1 3.38Å; R784-D812 IonicContact NH2-OD2 2.72Å; R784-D812 PolarHBondContact NH2-OD2 3.31Å; R784-S816 PolarHBondContact N-OG 3.37Å
785	M	66.5	Low	79.9	Confident	115 Å²	115	63.9 Å²	63.9	57%	0.567	31%	0.313	S	S	*	.	S	Bend	trans	-93.3	152.3	164.9	-60.1	-167.3	69	0	0	110.1	R782 I783 N787	R782-M785 WeakPolarHBondContact O-CB 3.3Å; R782-M785 PolarHBondContact O-N 2.99Å; R782-M785 VanDerWaalsContact O-N 3.12Å; I783-M785 PolarHBondContact O-N 3.11Å; M785-N787 PolarHBondContact O-N 3.24Å; M785-N787 PolarHBondContact O-ND2 3.42Å
786	E	66.1	Low	80	Confident	122 Å²	122	68.3 Å²	68.3	57%	0.57	33%	0.334	S	S	*	.			trans	-68.9	100	172.9	-70.7	178.9	-172.6	0	0	108.9	R446	R446-E786 IonicContact NH2-OE1 3.03Å
787	N	71.4	Confident	80.3	Confident	20 Å²	20	66.6 Å²	66.6	11%	0.107	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	149.1	176.2	-57.9	-55.9	0	0	0	110.5	F779 R782 M785 F789 S816	F779-N787 HydrophobicContact CE1-CB 4.47Å; R782-N787 PolarHBondContact O-ND2 3.08Å; M785-N787 PolarHBondContact O-N 3.24Å; M785-N787 PolarHBondContact O-ND2 3.42Å; N787-F789 HydrophobicContact CB-CD2 3.44Å; N787-F789 VanDerWaalsContact CB-CD2 3.44Å; N787-F789 HydrophobicContact CB-CE2 3.82Å; N787-F789 PolarHBondContact O-N 3.39Å; N787-S816 PolarHBondContact N-O 3.13Å
788	D	81	Confident	80.6	Confident	98 Å²	98	60 Å²	60	52%	0.524	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	55.6	175.4	-69.9	-44	0	0	0	111.3	I755 S756 K818	I755-D788 WeakPolarHBondContact CA-O 3.41Å; I755-D788 HydrophobicContact CG1-CB 4.44Å; I755-D788 WeakPolarHBondContact CG2-O 3.4Å; S756-D788 PolarHBondContact N-O 3.39Å; D788-K818 IonicContact OD1-NZ 3.71Å; D788-K818 PolarHBondContact OD1-NZ 3.39Å
789	F	88	Confident	80.9	Confident	46 Å²	46	59.2 Å²	59.2	20%	0.202	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	150.6	168.3	-63.9	-88	0	0	0	110.6	S756 L758 F779 N787 C817 K818	S756-F789 VanDerWaalsContact CB-CD1 3.49Å; S756-F789 WeakPolarHBondContact O-CA 3.36Å; L758-F789 HydrophobicContact CD1-CB 4.04Å; L758-F789 HydrophobicContact CD1-CD1 4.07Å; L758-F789 HydrophobicContact CD1-CG 4.2Å; L758-F789 HydrophobicContact CD2-CD1 4.32Å; L758-F789 HydrophobicContact CG-CB 4.48Å; L758-F789 HydrophobicContact CG-CD1 4.12Å; F779-F789 HydrophobicContact CD1-CD2 4.4Å; F779-F789 HydrophobicContact CD1-CE2 4.25Å; F779-F789 AromaticContact CE1-CD2 3.41Å; F779-F789 HydrophobicContact CE1-CD2 3.41Å; F779-F789 VanDerWaalsContact CE1-CD2 3.41Å; F779-F789 AromaticContact CE1-CE2 3.65Å; F779-F789 HydrophobicContact CE1-CE2 3.65Å; F779-F789 HydrophobicContact CE1-CG 4.02Å; F779-F789 HydrophobicContact CE1-CZ 4.44Å; F779-F789 HydrophobicContact CZ-CB 4.39Å; F779-F789 HydrophobicContact CZ-CD2 4.03Å; F779-F789 HydrophobicContact CZ-CG 4.17Å; N787-F789 HydrophobicContact CB-CD2 3.44Å; N787-F789 VanDerWaalsContact CB-CD2 3.44Å; N787-F789 HydrophobicContact CB-CE2 3.82Å; N787-F789 PolarHBondContact O-N 3.39Å; F789-C817 WeakPolarHBondContact O-CA 3.42Å; F789-C817 WeakPolarHBondContact O-CB 3.49Å; F789-K818 PolarHBondContact O-N 2.8Å
790	A	91.3	Very high	81.4	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	132.6	169.6	0	0	0	0	0	110.2	L751 I755 S756 L757 L758 S819	L751-A790 HydrophobicContact CD2-CB 3.32Å; I755-A790 HydrophobicContact CG2-CB 3.69Å; S756-A790 PolarHBondContact O-N 2.87Å; L757-A790 HydrophobicContact CD2-CB 3.84Å; L758-A790 PolarHBondContact N-O 2.82Å; A790-S819 CarbonylContact C-O 3.53Å; A790-S819 VanDerWaalsContact CA-O 3.26Å; A790-S819 WeakPolarHBondContact CA-O 3.38Å; A790-S819 WeakPolarHBondContact CB-OG 3.22Å
791	L	93.1	Very high	82	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	129.5	178.8	-178.6	67.8	0	0	0	110.4	L758 M760 V793 F810 V813 A814 C817 S819 V820 I821	L758-L791 HydrophobicContact CB-CD1 4.08Å; L758-L791 CarbonylContact O-C 3.41Å; L758-L791 WeakPolarHBondContact O-CA 3.41Å; M760-L791 HydrophobicContact CG-CD1 4.1Å; M760-L791 HydrophobicContact SD-CD1 4.01Å; L791-V793 HydrophobicContact CD1-CG2 4.32Å; L791-V793 HydrophobicContact CD2-CG2 3.88Å; L791-V793 HydrophobicContact CG-CG2 3.72Å; L791-F810 HydrophobicContact CD2-CE2 4.05Å; L791-V813 HydrophobicContact CD1-CG1 4.3Å; L791-V813 HydrophobicContact CD2-CG1 4.3Å; L791-A814 HydrophobicContact CD2-CB 3.72Å; L791-C817 HydrophobicContact CB-CB 4.21Å; L791-S819 PolarHBondContact N-O 2.94Å; L791-V820 HydrophobicContact CB-CG1 4.24Å; L791-V820 HydrophobicContact CB-CG2 4.23Å; L791-V820 HydrophobicContact CD2-CG1 4.21Å; L791-V820 HydrophobicContact CG-CG1 4.44Å; L791-V820 CarbonylContact O-C 3.55Å; L791-V820 VanDerWaalsContact O-CA 3.29Å; L791-V820 WeakPolarHBondContact O-CA 3.44Å; L791-I821 PolarHBondContact O-N 2.95Å
792	I	93.6	Very high	82.8	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	124	175.9	-60.3	153.4	0	0	0	108.2	Q738 I742 L757 L758 T759 M760 I821	Q738-I792 HydrophobicContact CG-CG2 3.65Å; I742-I792 HydrophobicContact CD1-CD1 3.78Å; I742-I792 HydrophobicContact CD1-CG2 4.41Å; I742-I792 HydrophobicContact CG1-CD1 3.67Å; I742-I792 HydrophobicContact CG1-CG1 4.32Å; I742-I792 HydrophobicContact CG1-CG2 4.36Å; L757-I792 HydrophobicContact CB-CD1 4.3Å; L757-I792 HydrophobicContact CD1-CD1 4.23Å; L757-I792 HydrophobicContact CD2-CD1 4.31Å; L758-I792 PolarHBondContact O-N 2.89Å; T759-I792 WeakPolarHBondContact CA-O 3.35Å; M760-I792 PolarHBondContact N-O 3.5Å; I792-I821 WeakPolarHBondContact CA-O 3.34Å; I792-I821 HydrophobicContact CG1-CB 4.41Å
793	V	92.4	Very high	83.7	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	127.5	-174.1	-167.3	0	0	0	0	109.8	L791 T797 L798 F810 I821 C822 C823	L791-V793 HydrophobicContact CD1-CG2 4.32Å; L791-V793 HydrophobicContact CD2-CG2 3.88Å; L791-V793 HydrophobicContact CG-CG2 3.72Å; V793-T797 HydrophobicContact CG1-CG2 4.16Å; V793-L798 HydrophobicContact CG1-CB 3.98Å; V793-L798 HydrophobicContact CG1-CD1 4.38Å; V793-F810 HydrophobicContact CG2-CE2 3.97Å; V793-F810 HydrophobicContact CG2-CZ 4.48Å; V793-I821 PolarHBondContact N-O 2.85Å; V793-C822 WeakPolarHBondContact O-CA 3.46Å; V793-C823 PolarHBondContact O-N 2.86Å
794	D	89.6	Confident	84.2	Confident	21 Å²	21	52 Å²	52	11%	0.112	26%	0.256	C	S	.	.			trans	-78.2	155.3	172	-171.8	35.9	0	0	0	112	M760 Q796 T797 L798	M760-D794 PolarHBondContact O-N 3Å; D794-Q796 VanDerWaalsContact C-N 3.32Å; D794-Q796 PolarHBondContact O-N 3.06Å; D794-T797 PolarHBondContact O-N 3Å; D794-L798 WeakPolarHBondContact O-CB 3.43Å; D794-L798 PolarHBondContact O-N 3.4Å
795	G	83.9	Confident	85.1	Confident	7 Å²	7	50 Å²	50	7%	0.072	25%	0.254	C	S	.	.	H	α-helix	trans	-61.3	-36.4	-173.3	0	0	0	0	0	113.9	L798 E799 C823	G795-L798 PolarHBondContact O-N 3.01Å; G795-E799 PolarHBondContact O-N 3.36Å; G795-E799 VanDerWaalsContact O-N 3.14Å; G795-C823 VanDerWaalsContact CA-O 3.25Å; G795-C823 WeakPolarHBondContact CA-O 3.43Å; G795-C823 PolarHBondContact N-O 2.83Å
796	Q	86.3	Confident	86	Confident	109 Å²	109	44.5 Å²	44.5	51%	0.509	23%	0.227	S	C	.	.	H	α-helix	trans	-68.4	-44.6	176	-66.4	-177.2	-2.5	0	0	111.4	D794 L798 E799 F800	D794-Q796 VanDerWaalsContact C-N 3.32Å; D794-Q796 PolarHBondContact O-N 3.06Å; Q796-L798 VanDerWaalsContact C-N 3.28Å; Q796-L798 PolarHBondContact O-N 3.16Å; Q796-E799 WeakPolarHBondContact O-CB 3.49Å; Q796-E799 PolarHBondContact O-N 3.29Å; Q796-F800 WeakPolarHBondContact O-CD2 3.21Å; Q796-F800 PolarHBondContact O-N 3.45Å
797	T	90.9	Very high	87.1	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.006	21%	0.214	C	C	.	.	H	α-helix	trans	-62.9	-38	176	-55.7	0	0	0	0	111.5	M760 T762 T768 V793 D794 E799 F800 A801	M760-T797 HydrophobicContact CB-CG2 3.94Å; M760-T797 HydrophobicContact CE-CG2 4.22Å; M760-T797 PolarHBondContact O-OG1 2.93Å; T762-T797 PolarHBondContact N-OG1 3.35Å; T762-T797 PolarHBondContact O-OG1 3.33Å; T762-T797 WeakPolarHBondContact OG1-CG2 3.37Å; T762-T797 PolarHBondContact OG1-OG1 3.37Å; T768-T797 HydrophobicContact CG2-CG2 4.01Å; V793-T797 HydrophobicContact CG1-CG2 4.16Å; D794-T797 PolarHBondContact O-N 3Å; T797-E799 VanDerWaalsContact C-N 3.34Å; T797-E799 PolarHBondContact O-N 3.3Å; T797-F800 PolarHBondContact O-N 3.25Å; T797-A801 WeakPolarHBondContact O-CB 3.19Å; T797-A801 PolarHBondContact O-N 3.23Å
798	L	90.7	Very high	87.8	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.8	-39.4	176.7	-176	64.1	0	0	0	112	V793 D794 G795 Q796 F800 A801 L802 F810 C822 V825 L833	V793-L798 HydrophobicContact CG1-CB 3.98Å; V793-L798 HydrophobicContact CG1-CD1 4.38Å; D794-L798 WeakPolarHBondContact O-CB 3.43Å; D794-L798 PolarHBondContact O-N 3.4Å; G795-L798 PolarHBondContact O-N 3.01Å; Q796-L798 VanDerWaalsContact C-N 3.28Å; Q796-L798 PolarHBondContact O-N 3.16Å; L798-F800 VanDerWaalsContact C-N 3.33Å; L798-F800 PolarHBondContact O-N 2.87Å; L798-A801 PolarHBondContact O-N 2.92Å; L798-L802 HydrophobicContact CD1-CD1 4.23Å; L798-L802 HydrophobicContact CD1-CG 4.09Å; L798-L802 HydrophobicContact CD2-CD1 4.44Å; L798-L802 HydrophobicContact CG-CD1 3.88Å; L798-L802 HydrophobicContact CG-CG 4.2Å; L798-L802 WeakPolarHBondContact O-CB 3.34Å; L798-L802 WeakPolarHBondContact O-CG 3.36Å; L798-L802 PolarHBondContact O-N 3.02Å; L798-F810 HydrophobicContact CD1-CE1 4.16Å; L798-F810 HydrophobicContact CD1-CZ 3.84Å; L798-C822 HydrophobicContact CD2-CB 4.25Å; L798-V825 HydrophobicContact CD2-CG1 4.24Å; L798-V825 HydrophobicContact CD2-CG2 3.91Å; L798-L833 HydrophobicContact CD1-CD1 3.86Å; L798-L833 HydrophobicContact CD2-CD1 4.35Å
799	E	88.1	Confident	88.1	Confident	118 Å²	118	46.4 Å²	46.4	55%	0.551	23%	0.229	S	C	*	.	H	α-helix	trans	-58	-46.6	175.7	-171.7	176.3	-179	0	0	111.3	G795 Q796 T797 L802	G795-E799 PolarHBondContact O-N 3.36Å; G795-E799 VanDerWaalsContact O-N 3.14Å; Q796-E799 WeakPolarHBondContact O-CB 3.49Å; Q796-E799 PolarHBondContact O-N 3.29Å; T797-E799 VanDerWaalsContact C-N 3.34Å; T797-E799 PolarHBondContact O-N 3.3Å; E799-L802 PolarHBondContact O-N 3.19Å
800	F	90.1	Very high	88.3	Confident	54 Å²	54	44.2 Å²	44.2	24%	0.237	22%	0.219	C	C	.	.	H	α-helix	trans	-66	-39.5	174.9	-59.4	-53.9	0	0	0	112.6	K763 L765 T768 Q796 T797 L798 L802 L803	K763-F800 WeakPolarHBondContact O-CE2 3.45Å; L765-F800 HydrophobicContact CB-CD1 4.13Å; L765-F800 HydrophobicContact CB-CG 4.48Å; T768-F800 HydrophobicContact CG2-CB 4.39Å; Q796-F800 WeakPolarHBondContact O-CD2 3.21Å; Q796-F800 PolarHBondContact O-N 3.45Å; T797-F800 PolarHBondContact O-N 3.25Å; L798-F800 VanDerWaalsContact C-N 3.33Å; L798-F800 PolarHBondContact O-N 2.87Å; F800-L802 VanDerWaalsContact C-N 3.28Å; F800-L802 PolarHBondContact O-N 3.13Å; F800-L803 HydrophobicContact CD1-CD1 4.32Å; F800-L803 WeakPolarHBondContact O-CB 3.41Å; F800-L803 PolarHBondContact O-N 3.41Å
801	A	89.5	Confident	88.2	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-67.5	-26.9	179.5	0	0	0	0	0	113.2	T768 T797 L798 R807 F810	T768-A801 HydrophobicContact CG2-CB 4.25Å; T797-A801 WeakPolarHBondContact O-CB 3.19Å; T797-A801 PolarHBondContact O-N 3.23Å; L798-A801 PolarHBondContact O-N 2.92Å; A801-R807 WeakPolarHBondContact O-CA 3.48Å; A801-R807 PolarHBondContact O-N 3.39Å; A801-F810 HydrophobicContact CB-CB 4.12Å; A801-F810 HydrophobicContact CB-CD1 4.38Å; A801-F810 HydrophobicContact CB-CD2 3.81Å; A801-F810 HydrophobicContact CB-CE2 4.34Å; A801-F810 HydrophobicContact CB-CG 3.83Å
802	L	88	Confident	87.9	Confident	14 Å²	14	46.5 Å²	46.5	7%	0.073	23%	0.231	C	C	.	.	H	α-helix	trans	-81.5	-12.5	177.6	-71.9	173.3	0	0	0	113.6	L798 E799 F800 L836	L798-L802 HydrophobicContact CD1-CD1 4.23Å; L798-L802 HydrophobicContact CD1-CG 4.09Å; L798-L802 HydrophobicContact CD2-CD1 4.44Å; L798-L802 HydrophobicContact CG-CD1 3.88Å; L798-L802 HydrophobicContact CG-CG 4.2Å; L798-L802 WeakPolarHBondContact O-CB 3.34Å; L798-L802 WeakPolarHBondContact O-CG 3.36Å; L798-L802 PolarHBondContact O-N 3.02Å; E799-L802 PolarHBondContact O-N 3.19Å; F800-L802 VanDerWaalsContact C-N 3.28Å; F800-L802 PolarHBondContact O-N 3.13Å; L802-L836 HydrophobicContact CD2-CD1 3.63Å
803	L	87.6	Confident	87.6	Confident	81 Å²	81	46.6 Å²	46.6	42%	0.424	23%	0.232	S	C	.	.	S	Bend	trans	-64.6	150.1	173.1	-65.4	172.1	0	0	0	110.9	L765 F800 E805 C806 R807	L765-L803 HydrophobicContact CD1-CD1 3.58Å; F800-L803 HydrophobicContact CD1-CD1 4.32Å; F800-L803 WeakPolarHBondContact O-CB 3.41Å; F800-L803 PolarHBondContact O-N 3.41Å; L803-E805 PolarHBondContact O-N 3.2Å; L803-C806 PolarHBondContact O-N 3.04Å; L803-R807 WeakPolarHBondContact O-CB 3.48Å; L803-R807 PolarHBondContact O-N 2.8Å; L803-R807 VanDerWaalsContact O-N 3.1Å
804	C	76.1	Confident	87.5	Confident	116 Å²	116	46.6 Å²	46.6	78%	0.784	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-28.4	-169.8	-70.6	0	0	0	0	114.3
805	E	82	Confident	87.4	Confident	127 Å²	127	46.8 Å²	46.8	59%	0.593	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-39	-177.4	-59.8	-173	-179.7	0	0	113.9	R769 L803	R769-E805 IonicContact NH1-OE2 2.72Å; L803-E805 PolarHBondContact O-N 3.2Å
806	C	87.1	Confident	87.5	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-12.4	-176.4	-65.2	0	0	0	0	112.8	L772 L803 E808 Q809 F810	L772-C806 HydrophobicContact CD1-CB 4Å; L803-C806 PolarHBondContact O-N 3.04Å; C806-E808 PolarHBondContact O-N 2.88Å; C806-Q809 PolarHBondContact O-N 2.81Å; C806-F810 WeakPolarHBondContact O-CB 3.36Å; C806-F810 PolarHBondContact O-N 3.33Å
807	R	88.1	Confident	87.5	Confident	79 Å²	79	41.4 Å²	41.4	30%	0.298	21%	0.206	S	C	.	.	H	α-helix	trans	-54.1	-45.3	-172	166	167.5	177.3	-176.7	3	114.6	A801 L803 L811 L836	A801-R807 WeakPolarHBondContact O-CA 3.48Å; A801-R807 PolarHBondContact O-N 3.39Å; L803-R807 WeakPolarHBondContact O-CB 3.48Å; L803-R807 PolarHBondContact O-N 2.8Å; L803-R807 VanDerWaalsContact O-N 3.1Å; R807-L811 WeakPolarHBondContact O-CB 3.14Å; R807-L811 PolarHBondContact O-N 3.34Å; R807-L811 VanDerWaalsContact O-N 3.11Å; R807-L836 HydrophobicContact CG-CD1 3.74Å; R807-L836 HydrophobicContact CG-CG 4.36Å; R807-L836 VanDerWaalsContact NE-CD1 3.26Å
808	E	86.8	Confident	87.3	Confident	151 Å²	151	44.5 Å²	44.5	71%	0.706	22%	0.219	S	C	*	.	H	α-helix	trans	-70.6	-41.8	-178.6	-66.1	-165.8	156.9	0	0	111.7	C806 L811 D812	C806-E808 PolarHBondContact O-N 2.88Å; E808-L811 PolarHBondContact O-N 3.18Å; E808-D812 PolarHBondContact O-N 2.99Å
809	Q	87.9	Confident	87.3	Confident	50 Å²	50	44.5 Å²	44.5	23%	0.234	22%	0.219	C	C	.	.	H	α-helix	trans	-64.1	-46	178	-66.3	179.6	-31	0	0	111.6	L772 I776 C806 L811 D812 V813	L772-Q809 HydrophobicContact CB-CB 4.24Å; L772-Q809 HydrophobicContact CD1-CB 4.29Å; I776-Q809 HydrophobicContact CD1-CB 3.64Å; I776-Q809 HydrophobicContact CD1-CG 3.86Å; C806-Q809 PolarHBondContact O-N 2.81Å; Q809-L811 VanDerWaalsContact C-N 3.29Å; Q809-L811 PolarHBondContact O-N 3.25Å; Q809-D812 PolarHBondContact O-N 2.94Å; Q809-V813 WeakPolarHBondContact O-CG2 3.34Å; Q809-V813 PolarHBondContact O-N 3.05Å; Q809-V813 VanDerWaalsContact O-N 3.13Å
810	F	90.9	Very high	87.6	Confident	1 Å²	1	38.9 Å²	38.9	0%	0.004	19%	0.193	C	C	.	.	H	α-helix	trans	-57	-45.4	174.4	171.9	-108.5	0	0	0	111.5	L772 L791 V793 L798 A801 C806 V813 A814 L833	L772-F810 HydrophobicContact CD1-CB 3.99Å; L772-F810 HydrophobicContact CD2-CB 4.3Å; L772-F810 HydrophobicContact CD2-CD2 4.38Å; L791-F810 HydrophobicContact CD2-CE2 4.05Å; V793-F810 HydrophobicContact CG2-CE2 3.97Å; V793-F810 HydrophobicContact CG2-CZ 4.48Å; L798-F810 HydrophobicContact CD1-CE1 4.16Å; L798-F810 HydrophobicContact CD1-CZ 3.84Å; A801-F810 HydrophobicContact CB-CB 4.12Å; A801-F810 HydrophobicContact CB-CD1 4.38Å; A801-F810 HydrophobicContact CB-CD2 3.81Å; A801-F810 HydrophobicContact CB-CE2 4.34Å; A801-F810 HydrophobicContact CB-CG 3.83Å; C806-F810 WeakPolarHBondContact O-CB 3.36Å; C806-F810 PolarHBondContact O-N 3.33Å; F810-V813 PolarHBondContact O-N 3.19Å; F810-A814 HydrophobicContact CE2-CB 4.47Å; F810-A814 HydrophobicContact CZ-CB 4.33Å; F810-A814 VanDerWaalsContact O-CB 3.24Å; F810-A814 WeakPolarHBondContact O-CB 3.37Å; F810-A814 PolarHBondContact O-N 2.8Å; F810-L833 HydrophobicContact CE1-CD1 4.4Å
811	L	88.9	Confident	87.8	Confident	16 Å²	16	36.3 Å²	36.3	8%	0.084	18%	0.182	C	C	.	.	H	α-helix	trans	-63.6	-44.2	179.5	-177.2	70.3	0	0	0	111.6	R807 E808 Q809 V813 A814 L815 L836 V837 S840	R807-L811 WeakPolarHBondContact O-CB 3.14Å; R807-L811 PolarHBondContact O-N 3.34Å; R807-L811 VanDerWaalsContact O-N 3.11Å; E808-L811 PolarHBondContact O-N 3.18Å; Q809-L811 VanDerWaalsContact C-N 3.29Å; Q809-L811 PolarHBondContact O-N 3.25Å; L811-V813 VanDerWaalsContact C-N 3.32Å; L811-V813 PolarHBondContact O-N 3.18Å; L811-A814 PolarHBondContact O-N 3.27Å; L811-L815 HydrophobicContact CD1-CD1 3.71Å; L811-L815 HydrophobicContact CD1-CD2 4.05Å; L811-L815 HydrophobicContact CD1-CG 3.69Å; L811-L815 HydrophobicContact CD2-CD1 4.11Å; L811-L815 HydrophobicContact CG-CD1 3.6Å; L811-L815 HydrophobicContact CG-CG 3.94Å; L811-L815 WeakPolarHBondContact O-CB 3.47Å; L811-L815 WeakPolarHBondContact O-CG 3.2Å; L811-L815 PolarHBondContact O-N 3.45Å; L811-L836 HydrophobicContact CB-CD2 4.45Å; L811-L836 HydrophobicContact CD1-CD2 3.7Å; L811-L836 HydrophobicContact CG-CD2 4.43Å; L811-V837 HydrophobicContact CD1-CG2 4.02Å; L811-S840 WeakPolarHBondContact CD2-OG 3.2Å
812	D	86.5	Confident	88	Confident	32 Å²	32	36.3 Å²	36.3	17%	0.171	18%	0.182	C	C	.	.	H	α-helix	trans	-61.4	-40.5	179.4	-78.4	-22	0	0	0	112.3	I783 R784 E808 Q809 S816	I783-D812 HydrophobicContact CG2-CB 4.16Å; R784-D812 IonicContact CZ-OD1 3.93Å; R784-D812 IonicContact CZ-OD2 3.34Å; R784-D812 IonicContact NE-OD1 2.86Å; R784-D812 PolarHBondContact NE-OD1 3.41Å; R784-D812 IonicContact NE-OD2 2.84Å; R784-D812 IonicContact NH2-OD1 3.05Å; R784-D812 PolarHBondContact NH2-OD1 3.38Å; R784-D812 IonicContact NH2-OD2 2.72Å; R784-D812 PolarHBondContact NH2-OD2 3.31Å; E808-D812 PolarHBondContact O-N 2.99Å; Q809-D812 PolarHBondContact O-N 2.94Å; D812-S816 WeakPolarHBondContact O-CB 3.3Å; D812-S816 PolarHBondContact O-N 2.88Å; D812-S816 PolarHBondContact O-OG 3.03Å
813	V	88.4	Confident	88.2	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.006	18%	0.178	C	C	.	.	H	α-helix	trans	-65.1	-50.3	173.3	172.3	0	0	0	0	110.9	L772 L775 I776 F779 L791 Q809 F810 L811 L815 S816 C817	L772-V813 HydrophobicContact CD2-CB 4.37Å; L772-V813 HydrophobicContact CD2-CG2 4.11Å; L775-V813 HydrophobicContact CB-CG2 4.16Å; L775-V813 HydrophobicContact CD1-CG1 4.22Å; I776-V813 HydrophobicContact CD1-CG2 4.31Å; I776-V813 HydrophobicContact CG1-CG2 3.63Å; F779-V813 HydrophobicContact CE2-CG1 4.06Å; L791-V813 HydrophobicContact CD1-CG1 4.3Å; L791-V813 HydrophobicContact CD2-CG1 4.3Å; Q809-V813 WeakPolarHBondContact O-CG2 3.34Å; Q809-V813 PolarHBondContact O-N 3.05Å; Q809-V813 VanDerWaalsContact O-N 3.13Å; F810-V813 PolarHBondContact O-N 3.19Å; L811-V813 VanDerWaalsContact C-N 3.32Å; L811-V813 PolarHBondContact O-N 3.18Å; V813-L815 PolarHBondContact O-N 2.83Å; V813-S816 WeakPolarHBondContact O-CB 3.45Å; V813-S816 PolarHBondContact O-N 3.33Å; V813-C817 PolarHBondContact O-N 2.71Å; V813-C817 PolarHBondContact O-SG 2.75Å
814	A	89.5	Confident	88.1	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-68.3	-34.5	-173.9	0	0	0	0	0	113.1	W731 L791 F810 L811 S816 C817 V820	W731-A814 HydrophobicContact CH2-CB 3.34Å; W731-A814 HydrophobicContact CZ2-CB 3.83Å; W731-A814 HydrophobicContact CZ3-CB 4.2Å; L791-A814 HydrophobicContact CD2-CB 3.72Å; F810-A814 HydrophobicContact CE2-CB 4.47Å; F810-A814 HydrophobicContact CZ-CB 4.33Å; F810-A814 VanDerWaalsContact O-CB 3.24Å; F810-A814 WeakPolarHBondContact O-CB 3.37Å; F810-A814 PolarHBondContact O-N 2.8Å; L811-A814 PolarHBondContact O-N 3.27Å; A814-S816 VanDerWaalsContact C-N 3.3Å; A814-C817 PolarHBondContact O-N 3.1Å; A814-V820 HydrophobicContact CB-CG2 4.4Å
815	L	87.5	Confident	88.7	Confident	26 Å²	26	32.5 Å²	32.5	14%	0.136	15%	0.145	C	C	.	.	H	α-helix	trans	-74.5	-19.4	175.1	-65.2	-179.2	0	0	0	113.8	Y447 W731 L811 V813 C817 V837 I841	Y447-L815 HydrophobicContact CE1-CD2 3.83Å; W731-L815 HydrophobicContact CZ2-CD2 4.18Å; L811-L815 HydrophobicContact CD1-CD1 3.71Å; L811-L815 HydrophobicContact CD1-CD2 4.05Å; L811-L815 HydrophobicContact CD1-CG 3.69Å; L811-L815 HydrophobicContact CD2-CD1 4.11Å; L811-L815 HydrophobicContact CG-CD1 3.6Å; L811-L815 HydrophobicContact CG-CG 3.94Å; L811-L815 WeakPolarHBondContact O-CB 3.47Å; L811-L815 WeakPolarHBondContact O-CG 3.2Å; L811-L815 PolarHBondContact O-N 3.45Å; V813-L815 PolarHBondContact O-N 2.83Å; L815-C817 VanDerWaalsContact C-N 3.29Å; L815-V837 HydrophobicContact CD2-CG1 4.19Å; L815-I841 HydrophobicContact CD1-CD1 3.47Å; L815-I841 VanDerWaalsContact CD1-CD1 3.47Å; L815-I841 HydrophobicContact CD1-CG1 3.82Å; L815-I841 HydrophobicContact CD2-CD1 3.52Å; L815-I841 HydrophobicContact CG-CD1 4.1Å
816	S	85.7	Confident	88.7	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-79.7	-16.4	173.9	-55.7	0	0	0	0	112.3	R784 N787 D812 V813 A814	R784-S816 PolarHBondContact N-OG 3.37Å; N787-S816 PolarHBondContact N-O 3.13Å; D812-S816 WeakPolarHBondContact O-CB 3.3Å; D812-S816 PolarHBondContact O-N 2.88Å; D812-S816 PolarHBondContact O-OG 3.03Å; V813-S816 WeakPolarHBondContact O-CB 3.45Å; V813-S816 PolarHBondContact O-N 3.33Å; A814-S816 VanDerWaalsContact C-N 3.3Å
817	C	87.4	Confident	88.5	Confident	2 Å²	2	31.3 Å²	31.3	1%	0.014	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	144.3	178.7	-61.7	0	0	0	0	111	F789 L791 V813 A814 L815 V820	F789-C817 WeakPolarHBondContact O-CA 3.42Å; F789-C817 WeakPolarHBondContact O-CB 3.49Å; L791-C817 HydrophobicContact CB-CB 4.21Å; V813-C817 PolarHBondContact O-N 2.71Å; V813-C817 PolarHBondContact O-SG 2.75Å; A814-C817 PolarHBondContact O-N 3.1Å; L815-C817 VanDerWaalsContact C-N 3.29Å; C817-V820 HydrophobicContact CB-CG2 4.22Å
818	K	85.8	Confident	88.4	Confident	66 Å²	66	36 Å²	36	29%	0.287	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	-34	179.5	-172.1	177	-171.9	172.9	0	112.5	S729 I730 D788 F789	S729-K818 WeakPolarHBondContact CA-O 3.33Å; S729-K818 WeakPolarHBondContact CB-O 3.36Å; I730-K818 PolarHBondContact N-O 3.39Å; D788-K818 IonicContact OD1-NZ 3.71Å; D788-K818 PolarHBondContact OD1-NZ 3.39Å; F789-K818 PolarHBondContact O-N 2.8Å
819	S	91.6	Very high	88.4	Confident	0 Å²	0	30 Å²	30	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	143.2	174.7	53.8	0	0	0	0	111	I730 L750 A790 L791	I730-S819 VanDerWaalsContact O-CA 3.32Å; I730-S819 WeakPolarHBondContact O-CA 3.46Å; L750-S819 PolarHBondContact O-OG 3.33Å; A790-S819 CarbonylContact C-O 3.53Å; A790-S819 VanDerWaalsContact CA-O 3.26Å; A790-S819 WeakPolarHBondContact CA-O 3.38Å; A790-S819 WeakPolarHBondContact CB-OG 3.22Å; L791-S819 PolarHBondContact N-O 2.94Å
820	V	93.9	Very high	88.5	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	129.7	177.7	-176.5	0	0	0	0	108.7	I730 W731 V732 L791 A814 C817	I730-V820 PolarHBondContact O-N 2.96Å; I730-V820 VanDerWaalsContact O-N 3.11Å; W731-V820 CarbonylContact C-O 3.58Å; W731-V820 VanDerWaalsContact CA-O 3.22Å; W731-V820 WeakPolarHBondContact CA-O 3.47Å; W731-V820 HydrophobicContact CD2-CB 3.59Å; W731-V820 HydrophobicContact CD2-CG1 4.09Å; W731-V820 HydrophobicContact CD2-CG2 3.83Å; W731-V820 HydrophobicContact CE3-CB 3.69Å; W731-V820 HydrophobicContact CE3-CG1 3.61Å; W731-V820 HydrophobicContact CE3-CG2 4.14Å; W731-V820 HydrophobicContact CG-CB 3.99Å; W731-V820 HydrophobicContact CG-CG2 4.39Å; W731-V820 HydrophobicContact CH2-CG1 4.39Å; W731-V820 HydrophobicContact CH2-CG2 4.19Å; W731-V820 HydrophobicContact CZ2-CB 4.4Å; W731-V820 HydrophobicContact CZ2-CG2 3.78Å; W731-V820 HydrophobicContact CZ3-CB 4.19Å; W731-V820 HydrophobicContact CZ3-CG1 3.8Å; W731-V820 HydrophobicContact CZ3-CG2 4.32Å; V732-V820 PolarHBondContact N-O 3.4Å; L791-V820 HydrophobicContact CB-CG1 4.24Å; L791-V820 HydrophobicContact CB-CG2 4.23Å; L791-V820 HydrophobicContact CD2-CG1 4.21Å; L791-V820 HydrophobicContact CG-CG1 4.44Å; L791-V820 CarbonylContact O-C 3.55Å; L791-V820 VanDerWaalsContact O-CA 3.29Å; L791-V820 WeakPolarHBondContact O-CA 3.44Å; A814-V820 HydrophobicContact CB-CG2 4.4Å; C817-V820 HydrophobicContact CB-CG2 4.22Å
821	I	94.5	Very high	88.5	Confident	1 Å²	1	29 Å²	29	1%	0.005	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	110.5	178.3	-56.1	180	0	0	0	107.8	V732 A741 L750 L751 L791 I792 V793	V732-I821 HydrophobicContact CB-CG1 4.44Å; V732-I821 WeakPolarHBondContact O-CA 3.3Å; A741-I821 HydrophobicContact CB-CG2 3.72Å; L750-I821 HydrophobicContact CD2-CD1 4.03Å; L750-I821 HydrophobicContact CD2-CG1 3.98Å; L751-I821 HydrophobicContact CD1-CD1 3.88Å; L751-I821 HydrophobicContact CD2-CD1 4.22Å; L751-I821 HydrophobicContact CG-CD1 4.13Å; L791-I821 PolarHBondContact O-N 2.95Å; I792-I821 WeakPolarHBondContact CA-O 3.34Å; I792-I821 HydrophobicContact CG1-CB 4.41Å; V793-I821 PolarHBondContact N-O 2.85Å
822	C	94.2	Very high	88.6	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	123	174	-59.8	0	0	0	0	108.7	V732 L733 T734 V793 L798 V825	V732-C822 PolarHBondContact O-N 3.34Å; L733-C822 HydrophobicContact CD2-CB 3.75Å; T734-C822 PolarHBondContact N-O 3.41Å; V793-C822 WeakPolarHBondContact O-CA 3.46Å; L798-C822 HydrophobicContact CD2-CB 4.25Å; C822-V825 HydrophobicContact CB-CG2 3.45Å; C822-V825 VanDerWaalsContact CB-CG2 3.45Å; C822-V825 WeakPolarHBondContact O-CG2 3.27Å
823	C	91.4	Very high	88.9	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.139	C	C	.	.			trans	-100.8	156.2	-176.4	-51.6	0	0	0	0	110.5	T734 D736 Q738 V793 G795 V825	T734-C823 CarbonylContact O-C 3.48Å; D736-C823 WeakPolarHBondContact O-CB 3.49Å; Q738-C823 VanDerWaalsContact CA-SG 3.6Å; V793-C823 PolarHBondContact O-N 2.86Å; G795-C823 VanDerWaalsContact CA-O 3.25Å; G795-C823 WeakPolarHBondContact CA-O 3.43Å; G795-C823 PolarHBondContact N-O 2.83Å; C823-V825 VanDerWaalsContact C-N 3.25Å; C823-V825 PolarHBondContact O-N 3.27Å
824	R	86.7	Confident	89.1	Confident	123 Å²	123	29.5 Å²	29.5	46%	0.464	14%	0.139	S	C	.	.	S	Bend	trans	48.4	41.4	-179.8	-63.7	-178.6	168.3	158.4	-8.8	114.6	T734 D736	T734-R824 PolarHBondContact O-N 2.9Å; D736-R824 PolarHBondContact O-N 3.48Å
825	V	87	Confident	89.2	Confident	7 Å²	7	35 Å²	35	4%	0.042	16%	0.163	C	C	.	.			trans	-87.2	123.4	-177.5	-171	0	0	0	0	110.8	T734 L798 C822 C823 Q829 K830	T734-V825 PolarHBondContact O-N 3.46Å; L798-V825 HydrophobicContact CD2-CG1 4.24Å; L798-V825 HydrophobicContact CD2-CG2 3.91Å; C822-V825 HydrophobicContact CB-CG2 3.45Å; C822-V825 VanDerWaalsContact CB-CG2 3.45Å; C822-V825 WeakPolarHBondContact O-CG2 3.27Å; C823-V825 VanDerWaalsContact C-N 3.25Å; C823-V825 PolarHBondContact O-N 3.27Å; V825-Q829 HydrophobicContact CG1-CB 3.59Å; V825-K830 HydrophobicContact CB-CG 4.25Å; V825-K830 HydrophobicContact CG1-CB 4.4Å; V825-K830 HydrophobicContact CG1-CG 3.63Å
826	S	82.8	Confident	89.4	Confident	46 Å²	46	34 Å²	34	32%	0.322	16%	0.157	S	C	.	.			trans	-69.8	154.3	172.4	65.4	0	0	0	0	112.3	W828 Q829 K830	S826-W828 PolarHBondContact O-N 3.16Å; S826-W828 VanDerWaalsContact O-N 3.13Å; S826-Q829 PolarHBondContact O-N 3.39Å; S826-Q829 WeakPolarHBondContact OG-CB 3.42Å; S826-Q829 VanDerWaalsContact OG-CD 3.24Å; S826-Q829 VanDerWaalsContact OG-CG 3.24Å; S826-Q829 WeakPolarHBondContact OG-CG 3.48Å; S826-Q829 PolarHBondContact OG-N 2.73Å; S826-Q829 PolarHBondContact OG-OE1 3.1Å; S826-K830 PolarHBondContact O-N 3.01Å
827	P	83.3	Confident	89.7	Confident	57 Å²	57	34 Å²	34	37%	0.37	16%	0.157	S	C	.	.	H	α-helix	trans	-51	-39.8	178.6	-30.6	37.1	0	0	0	114.1	K830 A831 N854	P827-K830 WeakPolarHBondContact O-CB 3.05Å; P827-K830 PolarHBondContact O-N 3.01Å; P827-A831 PolarHBondContact O-N 3.18Å; P827-N854 HydrophobicContact CB-CB 4.37Å; P827-N854 WeakPolarHBondContact CB-O 3.17Å; P827-N854 HydrophobicContact CG-CB 3.89Å
828	W	85	Confident	89.9	Confident	177 Å²	177	38.5 Å²	38.5	67%	0.67	17%	0.174	S	C	*	.	H	α-helix	trans	-68.8	-42	177.9	179.3	85.4	0	0	0	112.5	S826 K830 A831 Q832	S826-W828 PolarHBondContact O-N 3.16Å; S826-W828 VanDerWaalsContact O-N 3.13Å; W828-K830 VanDerWaalsContact C-N 3.31Å; W828-K830 PolarHBondContact O-N 3.35Å; W828-A831 PolarHBondContact O-N 3.09Å; W828-Q832 PolarHBondContact O-N 2.69Å
829	Q	87.3	Confident	90.1	Very high	24 Å²	24	40.3 Å²	40.3	11%	0.112	18%	0.183	C	C	.	.	H	α-helix	trans	-63.2	-36.7	174.7	-73.9	166.6	-39.6	0	0	111.5	V825 S826 A831 Q832 L833	V825-Q829 HydrophobicContact CG1-CB 3.59Å; S826-Q829 PolarHBondContact O-N 3.39Å; S826-Q829 WeakPolarHBondContact OG-CB 3.42Å; S826-Q829 VanDerWaalsContact OG-CD 3.24Å; S826-Q829 VanDerWaalsContact OG-CG 3.24Å; S826-Q829 WeakPolarHBondContact OG-CG 3.48Å; S826-Q829 PolarHBondContact OG-N 2.73Å; S826-Q829 PolarHBondContact OG-OE1 3.1Å; Q829-A831 PolarHBondContact O-N 3.44Å; Q829-Q832 PolarHBondContact O-N 3.38Å; Q829-L833 WeakPolarHBondContact O-CB 3.15Å; Q829-L833 PolarHBondContact O-N 3.49Å
830	K	90.8	Very high	89.8	Confident	11 Å²	11	42.9 Å²	42.9	5%	0.048	20%	0.201	C	C	.	.	H	α-helix	trans	-55.9	-51.4	173.5	-62.8	-170.4	-172.7	-177.3	0	110.6	D451 L733 V825 S826 P827 W828 Q832 L833 V834 D855 M858	D451-K830 VanDerWaalsContact CG-NZ 3.3Å; D451-K830 IonicContact OD1-NZ 3.29Å; D451-K830 PolarHBondContact OD1-NZ 3.09Å; L733-K830 HydrophobicContact CB-CD 4.26Å; L733-K830 HydrophobicContact CB-CG 4.08Å; L733-K830 HydrophobicContact CD1-CB 4.1Å; L733-K830 HydrophobicContact CD1-CG 4.29Å; L733-K830 WeakPolarHBondContact O-CE 3.5Å; L733-K830 PolarHBondContact O-NZ 3.02Å; V825-K830 HydrophobicContact CB-CG 4.25Å; V825-K830 HydrophobicContact CG1-CB 4.4Å; V825-K830 HydrophobicContact CG1-CG 3.63Å; S826-K830 PolarHBondContact O-N 3.01Å; P827-K830 WeakPolarHBondContact O-CB 3.05Å; P827-K830 PolarHBondContact O-N 3.01Å; W828-K830 VanDerWaalsContact C-N 3.31Å; W828-K830 PolarHBondContact O-N 3.35Å; K830-Q832 PolarHBondContact O-N 3.05Å; K830-L833 PolarHBondContact O-N 2.95Å; K830-V834 WeakPolarHBondContact O-CG2 3.46Å; K830-V834 PolarHBondContact O-N 2.96Å; K830-V834 VanDerWaalsContact O-N 3.15Å; K830-D855 IonicContact NZ-OD1 2.63Å; K830-D855 PolarHBondContact NZ-OD1 2.85Å; K830-M858 HydrophobicContact CB-CB 4.14Å; K830-M858 HydrophobicContact CB-CG 4.28Å; K830-M858 HydrophobicContact CB-SD 4.3Å; K830-M858 HydrophobicContact CD-SD 4.3Å
831	A	90.1	Very high	89.3	Confident	19 Å²	19	44.4 Å²	44.4	16%	0.157	21%	0.209	C	C	.	.	H	α-helix	trans	-63.3	-39.7	178.8	0	0	0	0	0	112.8	P827 W828 Q829 K835 G857 A861	P827-A831 PolarHBondContact O-N 3.18Å; W828-A831 PolarHBondContact O-N 3.09Å; Q829-A831 PolarHBondContact O-N 3.44Å; A831-K835 VanDerWaalsContact O-CB 3.31Å; A831-K835 WeakPolarHBondContact O-CB 3.47Å; A831-K835 PolarHBondContact O-N 3.13Å; A831-G857 WeakPolarHBondContact CB-O 3.46Å; A831-A861 HydrophobicContact CB-CB 4.43Å
832	Q	90.9	Very high	88.4	Confident	59 Å²	59	52.9 Å²	52.9	28%	0.276	25%	0.246	S	C	.	.	H	α-helix	trans	-63.6	-44	178.2	-171.5	-177.1	13.5	0	0	111.8	W828 Q829 K830 K835 L836	W828-Q832 PolarHBondContact O-N 2.69Å; Q829-Q832 PolarHBondContact O-N 3.38Å; K830-Q832 PolarHBondContact O-N 3.05Å; Q832-K835 PolarHBondContact O-N 3.04Å; Q832-L836 VanDerWaalsContact O-CB 3.28Å; Q832-L836 WeakPolarHBondContact O-CB 3.23Å; Q832-L836 PolarHBondContact O-N 3.28Å
833	L	92.5	Very high	87.6	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-65.6	-44.2	180	-176	133.9	0	0	0	111.7	F449 W731 L733 L798 F810 Q829 K830 K835 L836 V837	F449-L833 HydrophobicContact CD1-CD2 3.8Å; F449-L833 HydrophobicContact CE1-CD2 3.5Å; W731-L833 HydrophobicContact CE3-CD2 3.71Å; W731-L833 HydrophobicContact CZ3-CD1 4.14Å; W731-L833 HydrophobicContact CZ3-CD2 3.87Å; W731-L833 HydrophobicContact CZ3-CG 4.26Å; L733-L833 HydrophobicContact CD1-CD2 3.87Å; L733-L833 HydrophobicContact CD2-CD2 3.73Å; L733-L833 HydrophobicContact CG-CD2 4.44Å; L798-L833 HydrophobicContact CD1-CD1 3.86Å; L798-L833 HydrophobicContact CD2-CD1 4.35Å; F810-L833 HydrophobicContact CE1-CD1 4.4Å; Q829-L833 WeakPolarHBondContact O-CB 3.15Å; Q829-L833 PolarHBondContact O-N 3.49Å; K830-L833 PolarHBondContact O-N 2.95Å; L833-K835 VanDerWaalsContact C-N 3.33Å; L833-K835 PolarHBondContact O-N 3.36Å; L833-L836 WeakPolarHBondContact O-CB 3.36Å; L833-L836 PolarHBondContact O-N 2.74Å; L833-V837 PolarHBondContact O-N 3.29Å
834	V	93.5	Very high	87.3	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-59.6	-45.2	173.4	174.2	0	0	0	0	111.3	F449 L733 K830 L836 V837 R838 M858 A861 A862	F449-V834 HydrophobicContact CB-CG2 3.87Å; F449-V834 HydrophobicContact CD1-CG2 3.87Å; F449-V834 HydrophobicContact CD2-CB 4.43Å; F449-V834 HydrophobicContact CD2-CG1 4.21Å; F449-V834 HydrophobicContact CD2-CG2 3.7Å; F449-V834 HydrophobicContact CE1-CG2 4.36Å; F449-V834 HydrophobicContact CE2-CG1 4.33Å; F449-V834 HydrophobicContact CE2-CG2 4.2Å; F449-V834 HydrophobicContact CG-CG2 3.52Å; L733-V834 HydrophobicContact CD1-CG2 4.47Å; K830-V834 WeakPolarHBondContact O-CG2 3.46Å; K830-V834 PolarHBondContact O-N 2.96Å; K830-V834 VanDerWaalsContact O-N 3.15Å; V834-L836 VanDerWaalsContact C-N 3.3Å; V834-L836 PolarHBondContact O-N 2.6Å; V834-V837 PolarHBondContact O-N 2.99Å; V834-R838 VanDerWaalsContact O-CB 3.27Å; V834-R838 WeakPolarHBondContact O-CB 3.33Å; V834-R838 PolarHBondContact O-N 3.35Å; V834-M858 HydrophobicContact CG2-CG 3.55Å; V834-M858 HydrophobicContact CG2-SD 4.48Å; V834-A861 HydrophobicContact CB-CB 4.29Å; V834-A861 HydrophobicContact CG1-CB 4.08Å; V834-A862 HydrophobicContact CG1-CB 3.81Å
835	K	91.6	Very high	87.6	Confident	116 Å²	116	55 Å²	55	50%	0.504	27%	0.268	S	S	.	.	H	α-helix	trans	-62.1	-38.6	178.2	-173	177.6	-179.7	-178.6	0	111.6	A831 Q832 L833 Q839	A831-K835 VanDerWaalsContact O-CB 3.31Å; A831-K835 WeakPolarHBondContact O-CB 3.47Å; A831-K835 PolarHBondContact O-N 3.13Å; Q832-K835 PolarHBondContact O-N 3.04Å; L833-K835 VanDerWaalsContact C-N 3.33Å; L833-K835 PolarHBondContact O-N 3.36Å; K835-Q839 HydrophobicContact CG-CG 4.44Å; K835-Q839 WeakPolarHBondContact O-CB 3.31Å; K835-Q839 VanDerWaalsContact O-CG 3.23Å; K835-Q839 WeakPolarHBondContact O-CG 3.46Å; K835-Q839 PolarHBondContact O-N 2.99Å
836	L	91.9	Very high	88	Confident	4 Å²	4	54.8 Å²	54.8	2%	0.021	27%	0.266	C	S	.	.	H	α-helix	trans	-65.3	-46.8	179.3	-179.4	154.3	0	0	0	112.1	L802 R807 L811 Q832 L833 V834 Q839 S840	L802-L836 HydrophobicContact CD2-CD1 3.63Å; R807-L836 HydrophobicContact CG-CD1 3.74Å; R807-L836 HydrophobicContact CG-CG 4.36Å; R807-L836 VanDerWaalsContact NE-CD1 3.26Å; L811-L836 HydrophobicContact CB-CD2 4.45Å; L811-L836 HydrophobicContact CD1-CD2 3.7Å; L811-L836 HydrophobicContact CG-CD2 4.43Å; Q832-L836 VanDerWaalsContact O-CB 3.28Å; Q832-L836 WeakPolarHBondContact O-CB 3.23Å; Q832-L836 PolarHBondContact O-N 3.28Å; L833-L836 WeakPolarHBondContact O-CB 3.36Å; L833-L836 PolarHBondContact O-N 2.74Å; V834-L836 VanDerWaalsContact C-N 3.3Å; V834-L836 PolarHBondContact O-N 2.6Å; L836-Q839 PolarHBondContact O-N 3.46Å; L836-S840 WeakPolarHBondContact O-CB 3.47Å; L836-S840 PolarHBondContact O-N 3.44Å; L836-S840 VanDerWaalsContact O-N 3.17Å; L836-S840 PolarHBondContact O-OG 3.48Å
837	V	92.4	Very high	88.6	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.006	25%	0.251	C	S	.	.	H	α-helix	trans	-66.7	-41.9	176.6	176.7	0	0	0	0	111.1	Y447 F449 W731 L811 L815 L833 V834 Q839 S840 I841 T846	Y447-V837 HydrophobicContact CD2-CG1 4.43Å; Y447-V837 HydrophobicContact CG-CG1 4.48Å; F449-V837 HydrophobicContact CE1-CG2 4.25Å; F449-V837 HydrophobicContact CZ-CB 3.74Å; F449-V837 HydrophobicContact CZ-CG1 3.9Å; F449-V837 HydrophobicContact CZ-CG2 3.83Å; W731-V837 HydrophobicContact CH2-CG2 4.1Å; W731-V837 HydrophobicContact CZ2-CG2 4.38Å; L811-V837 HydrophobicContact CD1-CG2 4.02Å; L815-V837 HydrophobicContact CD2-CG1 4.19Å; L833-V837 PolarHBondContact O-N 3.29Å; V834-V837 PolarHBondContact O-N 2.99Å; V837-Q839 PolarHBondContact O-N 3.49Å; V837-S840 WeakPolarHBondContact CA-OG 3.38Å; V837-S840 PolarHBondContact O-N 2.93Å; V837-S840 PolarHBondContact O-OG 3.06Å; V837-I841 HydrophobicContact CG1-CD1 4.15Å; V837-I841 PolarHBondContact O-N 3.2Å; V837-I841 VanDerWaalsContact O-N 3.15Å; V837-T846 HydrophobicContact CG1-CG2 4.18Å
838	R	91.2	Very high	89.3	Confident	96 Å²	96	49.9 Å²	49.9	36%	0.362	23%	0.233	S	C	.	.	H	α-helix	trans	-61	-40.3	176	158.4	169.9	164.7	-159.2	-6.7	113	V834 T846 A861 H863	V834-R838 VanDerWaalsContact O-CB 3.27Å; V834-R838 WeakPolarHBondContact O-CB 3.33Å; V834-R838 PolarHBondContact O-N 3.35Å; R838-T846 HydrophobicContact CB-CG2 4.36Å; R838-A861 WeakPolarHBondContact CD-O 3.39Å; R838-A861 PolarHBondContact NH1-O 3.48Å; R838-H863 WeakPolarHBondContact CG-CE1 3.32Å
839	Q	89.4	Confident	89.8	Confident	104 Å²	104	41.4 Å²	41.4	49%	0.486	20%	0.201	S	C	.	.	H	α-helix	trans	-74.8	-32.4	-177.8	-78.1	178.3	-18.2	0	0	113	K835 L836 V837	K835-Q839 HydrophobicContact CG-CG 4.44Å; K835-Q839 WeakPolarHBondContact O-CB 3.31Å; K835-Q839 VanDerWaalsContact O-CG 3.23Å; K835-Q839 WeakPolarHBondContact O-CG 3.46Å; K835-Q839 PolarHBondContact O-N 2.99Å; L836-Q839 PolarHBondContact O-N 3.46Å; V837-Q839 PolarHBondContact O-N 3.49Å
840	S	85.8	Confident	90	Very high	54 Å²	54	40.3 Å²	40.3	38%	0.378	20%	0.196	S	C	.	.	H	α-helix	trans	-78.2	-39.6	-177.9	49.2	0	0	0	0	112.7	L811 L836 V837	L811-S840 WeakPolarHBondContact CD2-OG 3.2Å; L836-S840 WeakPolarHBondContact O-CB 3.47Å; L836-S840 PolarHBondContact O-N 3.44Å; L836-S840 VanDerWaalsContact O-N 3.17Å; L836-S840 PolarHBondContact O-OG 3.48Å; V837-S840 WeakPolarHBondContact CA-OG 3.38Å; V837-S840 PolarHBondContact O-N 2.93Å; V837-S840 PolarHBondContact O-OG 3.06Å
841	I	83.7	Confident	89.8	Confident	32 Å²	32	39.8 Å²	39.8	16%	0.164	19%	0.194	C	C	.	.			trans	-105.3	89.1	-179.1	-44.2	173.1	0	0	0	110.5	Y447 L815 V837 D843 A844	Y447-I841 HydrophobicContact CD2-CD1 4.31Å; Y447-I841 HydrophobicContact CE2-CD1 3.41Å; Y447-I841 VanDerWaalsContact CE2-CD1 3.41Å; L815-I841 HydrophobicContact CD1-CD1 3.47Å; L815-I841 VanDerWaalsContact CD1-CD1 3.47Å; L815-I841 HydrophobicContact CD1-CG1 3.82Å; L815-I841 HydrophobicContact CD2-CD1 3.52Å; L815-I841 HydrophobicContact CG-CD1 4.1Å; V837-I841 HydrophobicContact CG1-CD1 4.15Å; V837-I841 PolarHBondContact O-N 3.2Å; V837-I841 VanDerWaalsContact O-N 3.15Å; I841-D843 PolarHBondContact O-N 2.91Å; I841-A844 HydrophobicContact CB-CB 4.11Å; I841-A844 HydrophobicContact CG2-CB 3.41Å; I841-A844 VanDerWaalsContact CG2-CB 3.41Å; I841-A844 PolarHBondContact O-N 2.75Å
842	K	75.5	Confident	89.4	Confident	179 Å²	179	39 Å²	39	78%	0.778	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-26.3	-176.9	-68	-179.7	-178.7	172	0	114.4
843	D	77	Confident	88.8	Confident	160 Å²	160	37.1 Å²	37.1	86%	0.856	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-3.2	-173.5	-60.2	-30.3	0	0	0	113.4	I841	I841-D843 PolarHBondContact O-N 2.91Å
844	A	85.7	Confident	88.3	Confident	7 Å²	7	40 Å²	40	6%	0.058	20%	0.198	C	C	.	.			trans	-110.8	137.1	-177.7	0	0	0	0	0	112.1	R446 Y447 I841	R446-A844 HydrophobicContact CB-CB 4.19Å; Y447-A844 HydrophobicContact CD2-CB 4.14Å; Y447-A844 HydrophobicContact CE2-CB 3.89Å; I841-A844 HydrophobicContact CB-CB 4.11Å; I841-A844 HydrophobicContact CG2-CB 3.41Å; I841-A844 VanDerWaalsContact CG2-CB 3.41Å; I841-A844 PolarHBondContact O-N 2.75Å
845	V	92.7	Very high	88	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.012	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	132	175.8	-176.5	0	0	0	0	109.3	T284 E441 Q444 V445 R446 Y447 H863 V864	T284-V845 HydrophobicContact CG2-CG2 4.15Å; E441-V845 HydrophobicContact CB-CG1 4.24Å; E441-V845 WeakPolarHBondContact OE2-CG1 3.49Å; E441-V845 WeakPolarHBondContact OE2-CG2 3.35Å; Q444-V845 HydrophobicContact CB-CB 4.4Å; Q444-V845 HydrophobicContact CB-CG2 3.73Å; Q444-V845 WeakPolarHBondContact O-CB 3.43Å; V445-V845 HydrophobicContact CG2-CG1 4.23Å; R446-V845 PolarHBondContact N-O 2.82Å; Y447-V845 PolarHBondContact N-O 3.33Å; V845-H863 HydrophobicContact CG1-CB 3.84Å; V845-V864 HydrophobicContact CG1-CG2 4.23Å
846	T	95	Very high	87.8	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.006	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	130.8	178.5	56.9	0	0	0	0	109.8	Y447 F449 V837 R838 H863 V864	Y447-T846 WeakPolarHBondContact O-CA 3.34Å; F449-T846 HydrophobicContact CE2-CG2 3.9Å; V837-T846 HydrophobicContact CG1-CG2 4.18Å; R838-T846 HydrophobicContact CB-CG2 4.36Å; T846-H863 PolarHBondContact N-ND1 2.96Å; T846-H863 WeakPolarHBondContact O-CB 3.33Å; T846-H863 PolarHBondContact O-N 2.99Å; T846-H863 PolarHBondContact OG1-N 3.49Å; T846-H863 PolarHBondContact OG1-ND1 2.95Å; T846-V864 PolarHBondContact O-N 3.26Å; T846-V864 VanDerWaalsContact O-N 3.1Å
847	L	96.4	Very high	87.5	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	136.4	174.8	-176.6	149.9	0	0	0	109.1	L442 V445 Y447 I448 F449 I849 V864 V866 L890 L894	L442-L847 HydrophobicContact CD2-CD1 4.31Å; V445-L847 HydrophobicContact CG1-CB 3.58Å; V445-L847 HydrophobicContact CG1-CD1 4.36Å; V445-L847 HydrophobicContact CG2-CB 4.11Å; V445-L847 HydrophobicContact CG2-CD1 4Å; Y447-L847 PolarHBondContact O-N 2.8Å; I448-L847 CarbonylContact C-O 3.54Å; I448-L847 VanDerWaalsContact CA-O 3.32Å; I448-L847 WeakPolarHBondContact CA-O 3.24Å; I448-L847 HydrophobicContact CG1-CB 4.23Å; I448-L847 HydrophobicContact CG1-CD2 4.17Å; I448-L847 HydrophobicContact CG2-CD2 4.06Å; F449-L847 PolarHBondContact N-O 2.87Å; L847-I849 HydrophobicContact CD2-CB 4.19Å; L847-V864 VanDerWaalsContact CA-O 3.3Å; L847-V864 WeakPolarHBondContact CA-O 3.22Å; L847-V864 HydrophobicContact CD1-CG1 4.25Å; L847-V864 HydrophobicContact CG-CB 4.48Å; L847-V866 HydrophobicContact CD1-CG2 3.83Å; L847-V866 HydrophobicContact CD2-CB 4.49Å; L847-V866 HydrophobicContact CD2-CG2 3.98Å; L847-V866 HydrophobicContact CG-CG2 3.98Å; L847-L890 HydrophobicContact CD1-CD1 4.14Å; L847-L890 HydrophobicContact CD2-CD1 4.37Å; L847-L894 HydrophobicContact CD1-CD1 4.44Å; L847-L894 HydrophobicContact CD1-CD2 3.91Å
848	A	96.7	Very high	87.5	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	137.5	170.7	0	0	0	0	0	110.2	F449 M858 A862 V864 V866	F449-A848 HydrophobicContact CB-CB 4.36Å; F449-A848 CarbonylContact O-C 3.56Å; F449-A848 VanDerWaalsContact O-CA 3.28Å; F449-A848 WeakPolarHBondContact O-CA 3.46Å; A848-M858 HydrophobicContact CB-CE 4.23Å; A848-M858 HydrophobicContact CB-CG 3.83Å; A848-M858 WeakPolarHBondContact CB-O 3.33Å; A848-M858 HydrophobicContact CB-SD 4.43Å; A848-A862 HydrophobicContact CB-CB 3.49Å; A848-A862 VanDerWaalsContact CB-CB 3.49Å; A848-V864 PolarHBondContact N-O 3.34Å; A848-V866 PolarHBondContact O-N 2.85Å
849	I	95.6	Very high	87.5	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	133.7	179.9	-171.7	167.4	0	0	0	111.4	I448 F449 D451 T455 L847 M858 V866 I868 I884 F887 L890	I448-I849 HydrophobicContact CG2-CG2 4.14Å; F449-I849 PolarHBondContact O-N 2.87Å; D451-I849 PolarHBondContact N-O 3.44Å; D451-I849 VanDerWaalsContact N-O 3.09Å; T455-I849 HydrophobicContact CG2-CG1 4.17Å; T455-I849 HydrophobicContact CG2-CG2 4.25Å; L847-I849 HydrophobicContact CD2-CB 4.19Å; I849-M858 WeakPolarHBondContact O-CE 3.38Å; I849-V866 VanDerWaalsContact CA-O 3.29Å; I849-V866 WeakPolarHBondContact CA-O 3.27Å; I849-V866 HydrophobicContact CB-CB 4.16Å; I849-V866 HydrophobicContact CD1-CB 4.24Å; I849-V866 HydrophobicContact CD1-CG1 3.8Å; I849-V866 HydrophobicContact CG1-CB 4.03Å; I849-V866 HydrophobicContact CG1-CG1 3.98Å; I849-I868 HydrophobicContact CD1-CD1 3.87Å; I849-I868 HydrophobicContact CD1-CG1 3.95Å; I849-I868 HydrophobicContact CG1-CD1 4.09Å; I849-I868 HydrophobicContact CG1-CG1 3.91Å; I849-I884 HydrophobicContact CD1-CD1 4.04Å; I849-F887 HydrophobicContact CD1-CD2 3.9Å; I849-F887 HydrophobicContact CD1-CE2 4.3Å; I849-F887 HydrophobicContact CG2-CE2 4.12Å; I849-L890 HydrophobicContact CD1-CD2 4.17Å
850	G	91.7	Very high	87.5	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	166.9	-179.9	0	0	0	0	0	112.3	T455 D855 V866 G867 I868 A876	T455-G850 WeakPolarHBondContact OG1-CA 3.05Å; G850-D855 WeakPolarHBondContact CA-OD2 3.2Å; G850-V866 PolarHBondContact N-O 3.45Å; G850-G867 CarbonylContact O-C 3.32Å; G850-G867 WeakPolarHBondContact O-CA 3.24Å; G850-I868 PolarHBondContact O-N 2.99Å; G850-A876 WeakPolarHBondContact O-CB 3.26Å
851	D	87.7	Confident	87.8	Confident	1 Å²	1	27 Å²	27	1%	0.005	15%	0.15	C	C	.	.	S	Bend	trans	-111.1	-45.4	-177.4	-173.4	25.3	0	0	0	111.6	T455 D855 I868 G870 M871 E872 A876	T455-D851 PolarHBondContact OG1-N 3.22Å; D851-D855 PolarHBondContact N-OD2 3.43Å; D851-I868 HydrophobicContact CB-CB 4.17Å; D851-G870 WeakPolarHBondContact OD1-CA 3.48Å; D851-G870 PolarHBondContact OD1-N 3.2Å; D851-G870 VanDerWaalsContact OD2-CA 3.28Å; D851-G870 WeakPolarHBondContact OD2-CA 3.27Å; D851-M871 PolarHBondContact OD2-N 2.9Å; D851-E872 PolarHBondContact OD2-N 3.04Å; D851-A876 VanDerWaalsContact C-CB 3.48Å; D851-A876 WeakPolarHBondContact O-CB 3.5Å
852	G	79.8	Confident	88.2	Confident	1 Å²	1	25.5 Å²	25.5	1%	0.01	14%	0.142	C	C	.	.	S	Bend	trans	-85.2	172.3	-173.9	0	0	0	0	0	116	N854 D855 E872	G852-N854 PolarHBondContact O-N 3.36Å; G852-D855 PolarHBondContact O-N 3.26Å; G852-E872 WeakPolarHBondContact CA-OE2 3.3Å; G852-E872 PolarHBondContact N-OE2 2.76Å
853	A	79.8	Confident	89.1	Confident	21 Å²	21	18.8 Å²	18.8	17%	0.174	11%	0.113	C	C	.	.	G	3₁₀ helix	trans	-63.6	-30.3	176.1	0	0	0	0	0	112.9	L183 D855 V856 Q875	L183-A853 VanDerWaalsContact O-CB 3.28Å; L183-A853 WeakPolarHBondContact O-CB 3.34Å; A853-D855 PolarHBondContact O-N 3.39Å; A853-D855 VanDerWaalsContact O-N 3.15Å; A853-V856 WeakPolarHBondContact O-CB 3.02Å; A853-V856 WeakPolarHBondContact O-CG2 3.5Å; A853-V856 PolarHBondContact O-N 3.29Å; A853-V856 VanDerWaalsContact O-N 3.13Å; A853-Q875 HydrophobicContact CB-CB 4.17Å; A853-Q875 HydrophobicContact CB-CG 4.29Å
854	N	81.5	Confident	89.9	Confident	62 Å²	62	11.1 Å²	11.1	33%	0.332	7%	0.072	S	C	.	.	G	3₁₀ helix	trans	-58.7	-23.7	175.6	-71.5	-31.2	0	0	0	113.7	D184 P827 G852	D184-N854 PolarHBondContact O-ND2 3.26Å; D184-N854 PolarHBondContact O-OD1 2.92Å; P827-N854 HydrophobicContact CB-CB 4.37Å; P827-N854 WeakPolarHBondContact CB-O 3.17Å; P827-N854 HydrophobicContact CG-CB 3.89Å; G852-N854 PolarHBondContact O-N 3.36Å
855	D	87.8	Confident	90.3	Very high	1 Å²	1	10.8 Å²	10.8	1%	0.005	7%	0.07	C	C	.	.	G	3₁₀ helix	trans	-94.2	-9.5	-177.9	-60.9	-36.5	0	0	0	113	D451 K830 G850 D851 G852 A853 G857 M858 I859	D451-D855 WeakPolarHBondContact CB-OD2 3.35Å; K830-D855 IonicContact NZ-OD1 2.63Å; K830-D855 PolarHBondContact NZ-OD1 2.85Å; G850-D855 WeakPolarHBondContact CA-OD2 3.2Å; D851-D855 PolarHBondContact N-OD2 3.43Å; G852-D855 PolarHBondContact O-N 3.26Å; A853-D855 PolarHBondContact O-N 3.39Å; A853-D855 VanDerWaalsContact O-N 3.15Å; D855-G857 VanDerWaalsContact C-N 3.27Å; D855-G857 PolarHBondContact O-N 3.01Å; D855-M858 HydrophobicContact CB-CE 4.04Å; D855-M858 WeakPolarHBondContact O-CA 3.43Å; D855-M858 VanDerWaalsContact O-CB 3.29Å; D855-M858 WeakPolarHBondContact O-CB 3.17Å; D855-M858 PolarHBondContact O-N 3Å; D855-I859 HydrophobicContact CB-CD1 4.26Å; D855-I859 WeakPolarHBondContact O-CG1 3.33Å; D855-I859 PolarHBondContact O-N 2.78Å
856	V	85.7	Confident	90.3	Very high	23 Å²	23	10.7 Å²	10.7	14%	0.139	7%	0.069	C	C	.	.	H	α-helix	trans	-56.8	-42.2	-178.1	172.2	0	0	0	0	111.2	A853 M858 I859 Q860 Q875 A879	A853-V856 WeakPolarHBondContact O-CB 3.02Å; A853-V856 WeakPolarHBondContact O-CG2 3.5Å; A853-V856 PolarHBondContact O-N 3.29Å; A853-V856 VanDerWaalsContact O-N 3.13Å; V856-M858 VanDerWaalsContact C-N 3.32Å; V856-M858 PolarHBondContact O-N 3.09Å; V856-I859 PolarHBondContact O-N 3.32Å; V856-Q860 HydrophobicContact CG1-CG 4.36Å; V856-Q860 WeakPolarHBondContact O-CB 3.4Å; V856-Q860 WeakPolarHBondContact O-CG 3.49Å; V856-Q860 PolarHBondContact O-N 3.44Å; V856-Q875 HydrophobicContact CG2-CB 4.24Å; V856-A879 HydrophobicContact CB-CB 4.48Å; V856-A879 HydrophobicContact CG1-CB 3.67Å; V856-A879 HydrophobicContact CG2-CB 4.15Å
857	G	86.3	Confident	90.1	Very high	32 Å²	32	10.7 Å²	10.7	33%	0.33	7%	0.069	S	C	.	.	H	α-helix	trans	-61.8	-38.9	175.9	0	0	0	0	0	112.9	A831 D855 A861	A831-G857 WeakPolarHBondContact CB-O 3.46Å; D855-G857 VanDerWaalsContact C-N 3.27Å; D855-G857 PolarHBondContact O-N 3.01Å; G857-A861 VanDerWaalsContact O-CB 3.27Å; G857-A861 WeakPolarHBondContact O-CB 3.44Å; G857-A861 PolarHBondContact O-N 2.78Å; G857-A861 VanDerWaalsContact O-N 3.12Å
858	M	91.9	Very high	89.9	Confident	0 Å²	0	10.7 Å²	10.7	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-67.1	-46.8	176.4	-173.2	-172.4	60.9	0	0	111.4	F449 L733 K830 V834 A848 I849 D855 V856 Q860 A861 A862	F449-M858 HydrophobicContact CB-SD 4.07Å; L733-M858 HydrophobicContact CD1-SD 3.84Å; K830-M858 HydrophobicContact CB-CB 4.14Å; K830-M858 HydrophobicContact CB-CG 4.28Å; K830-M858 HydrophobicContact CB-SD 4.3Å; K830-M858 HydrophobicContact CD-SD 4.3Å; V834-M858 HydrophobicContact CG2-CG 3.55Å; V834-M858 HydrophobicContact CG2-SD 4.48Å; A848-M858 HydrophobicContact CB-CE 4.23Å; A848-M858 HydrophobicContact CB-CG 3.83Å; A848-M858 WeakPolarHBondContact CB-O 3.33Å; A848-M858 HydrophobicContact CB-SD 4.43Å; I849-M858 WeakPolarHBondContact O-CE 3.38Å; D855-M858 HydrophobicContact CB-CE 4.04Å; D855-M858 WeakPolarHBondContact O-CA 3.43Å; D855-M858 VanDerWaalsContact O-CB 3.29Å; D855-M858 WeakPolarHBondContact O-CB 3.17Å; D855-M858 PolarHBondContact O-N 3Å; V856-M858 VanDerWaalsContact C-N 3.32Å; V856-M858 PolarHBondContact O-N 3.09Å; M858-Q860 PolarHBondContact O-N 3.03Å; M858-A861 PolarHBondContact O-N 2.92Å; M858-A862 PolarHBondContact O-N 3.17Å
859	I	91.9	Very high	89.1	Confident	0 Å²	0	11.7 Å²	11.7	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-61.1	-42.7	179.3	-70.8	171.8	0	0	0	111.6	K281 D855 V856 A876	K281-I859 PolarHBondContact NZ-O 3.32Å; D855-I859 HydrophobicContact CB-CD1 4.26Å; D855-I859 WeakPolarHBondContact O-CG1 3.33Å; D855-I859 PolarHBondContact O-N 2.78Å; V856-I859 PolarHBondContact O-N 3.32Å; I859-A876 HydrophobicContact CD1-CB 3.67Å
860	Q	89.9	Confident	87.9	Confident	28 Å²	28	13 Å²	13	13%	0.131	9%	0.09	C	C	.	.	H	α-helix	trans	-73.9	-31	178.4	-69.6	-176.5	-2.9	0	0	113	T276 P279 V856 M858	T276-Q860 PolarHBondContact O-NE2 2.76Å; T276-Q860 PolarHBondContact OG1-NE2 3.21Å; T276-Q860 PolarHBondContact OG1-OE1 3.45Å; P279-Q860 HydrophobicContact CG-CB 4.46Å; V856-Q860 HydrophobicContact CG1-CG 4.36Å; V856-Q860 WeakPolarHBondContact O-CB 3.4Å; V856-Q860 WeakPolarHBondContact O-CG 3.49Å; V856-Q860 PolarHBondContact O-N 3.44Å; M858-Q860 PolarHBondContact O-N 3.03Å
861	A	90.6	Very high	86.7	Confident	18 Å²	18	20.2 Å²	20.2	15%	0.149	13%	0.125	C	C	.	.	H	α-helix	trans	-71.4	-31.1	177.9	0	0	0	0	0	113.1	A831 V834 R838 G857 M858	A831-A861 HydrophobicContact CB-CB 4.43Å; V834-A861 HydrophobicContact CB-CB 4.29Å; V834-A861 HydrophobicContact CG1-CB 4.08Å; R838-A861 WeakPolarHBondContact CD-O 3.39Å; R838-A861 PolarHBondContact NH1-O 3.48Å; G857-A861 VanDerWaalsContact O-CB 3.27Å; G857-A861 WeakPolarHBondContact O-CB 3.44Å; G857-A861 PolarHBondContact O-N 2.78Å; G857-A861 VanDerWaalsContact O-N 3.12Å; M858-A861 PolarHBondContact O-N 2.92Å
862	A	93.7	Very high	85.7	Confident	0 Å²	0	21 Å²	21	0%	0	13%	0.129	C	C	.	.	S	Bend	trans	-69.5	160.6	179	0	0	0	0	0	113.5	K281 V834 A848 M858 V864	K281-A862 VanDerWaalsContact CE-O 3.32Å; K281-A862 WeakPolarHBondContact CE-O 3.23Å; K281-A862 PolarHBondContact NZ-O 3.45Å; V834-A862 HydrophobicContact CG1-CB 3.81Å; A848-A862 HydrophobicContact CB-CB 3.49Å; A848-A862 VanDerWaalsContact CB-CB 3.49Å; M858-A862 PolarHBondContact O-N 3.17Å; A862-V864 VanDerWaalsContact C-N 3.32Å; A862-V864 WeakPolarHBondContact CB-O 3.29Å
863	H	93.6	Very high	85.1	Confident	37 Å²	37	21.3 Å²	21.3	17%	0.171	13%	0.133	C	C	.	.	S	Bend	trans	-65.4	-38	172.3	-68.2	105.8	0	0	0	111.8	K281 R838 V845 T846	K281-H863 WeakPolarHBondContact CD-O 3.27Å; R838-H863 WeakPolarHBondContact CG-CE1 3.32Å; V845-H863 HydrophobicContact CG1-CB 3.84Å; T846-H863 PolarHBondContact N-ND1 2.96Å; T846-H863 WeakPolarHBondContact O-CB 3.33Å; T846-H863 PolarHBondContact O-N 2.99Å; T846-H863 PolarHBondContact OG1-N 3.49Å; T846-H863 PolarHBondContact OG1-ND1 2.95Å
864	V	93.5	Very high	84.8	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	126.7	173	-179.1	0	0	0	0	108.9	E441 L442 V845 T846 L847 A848 A862 Y882	E441-V864 HydrophobicContact CB-CG2 3.64Å; L442-V864 HydrophobicContact CD2-CG1 3.85Å; V845-V864 HydrophobicContact CG1-CG2 4.23Å; T846-V864 PolarHBondContact O-N 3.26Å; T846-V864 VanDerWaalsContact O-N 3.1Å; L847-V864 VanDerWaalsContact CA-O 3.3Å; L847-V864 WeakPolarHBondContact CA-O 3.22Å; L847-V864 HydrophobicContact CD1-CG1 4.25Å; L847-V864 HydrophobicContact CG-CB 4.48Å; A848-V864 PolarHBondContact N-O 3.34Å; A862-V864 VanDerWaalsContact C-N 3.32Å; A862-V864 WeakPolarHBondContact CB-O 3.29Å; V864-Y882 HydrophobicContact CG1-CD2 3.7Å; V864-Y882 HydrophobicContact CG1-CE2 3.7Å
865	G	93.7	Very high	84.6	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	127.1	175.5	0	0	0	0	0	111.4	D881 Y882	G865-D881 PolarHBondContact N-OD2 2.95Å; G865-D881 WeakPolarHBondContact O-CA 3.39Å; G865-D881 WeakPolarHBondContact O-CB 3.28Å; G865-D881 PolarHBondContact O-N 3.44Å; G865-Y882 PolarHBondContact O-N 3.35Å; G865-Y882 VanDerWaalsContact O-N 3.11Å
866	V	94	Very high	84.3	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	126.1	174	-177.5	0	0	0	0	109	L847 A848 I849 G850 Y882 I884 L890	L847-V866 HydrophobicContact CD1-CG2 3.83Å; L847-V866 HydrophobicContact CD2-CB 4.49Å; L847-V866 HydrophobicContact CD2-CG2 3.98Å; L847-V866 HydrophobicContact CG-CG2 3.98Å; A848-V866 PolarHBondContact O-N 2.85Å; I849-V866 VanDerWaalsContact CA-O 3.29Å; I849-V866 WeakPolarHBondContact CA-O 3.27Å; I849-V866 HydrophobicContact CB-CB 4.16Å; I849-V866 HydrophobicContact CD1-CB 4.24Å; I849-V866 HydrophobicContact CD1-CG1 3.8Å; I849-V866 HydrophobicContact CG1-CB 4.03Å; I849-V866 HydrophobicContact CG1-CG1 3.98Å; G850-V866 PolarHBondContact N-O 3.45Å; V866-Y882 CarbonylContact C-O 3.52Å; V866-Y882 WeakPolarHBondContact CA-O 3.47Å; V866-I884 HydrophobicContact CG1-CD1 3.69Å; V866-I884 HydrophobicContact CG1-CG1 3.79Å; V866-L890 HydrophobicContact CG2-CD1 4.41Å
867	G	91.4	Very high	84.1	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	131.9	174.6	0	0	0	0	0	109.6	G850 S880 Y882 A883 I884	G850-G867 CarbonylContact O-C 3.32Å; G850-G867 WeakPolarHBondContact O-CA 3.24Å; G867-S880 PolarHBondContact N-OG 3.4Å; G867-Y882 PolarHBondContact N-O 3.42Å; G867-A883 CarbonylContact O-C 3.44Å; G867-A883 VanDerWaalsContact O-CA 3.26Å; G867-A883 WeakPolarHBondContact O-CA 3.49Å; G867-I884 PolarHBondContact O-N 2.73Å
868	I	90.4	Very high	83.6	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	138.4	166.6	-61.8	-166.9	0	0	0	108	T455 I849 G850 D851 G870 I884 A885 F887	T455-I868 HydrophobicContact CG2-CD1 3.77Å; I849-I868 HydrophobicContact CD1-CD1 3.87Å; I849-I868 HydrophobicContact CD1-CG1 3.95Å; I849-I868 HydrophobicContact CG1-CD1 4.09Å; I849-I868 HydrophobicContact CG1-CG1 3.91Å; G850-I868 PolarHBondContact O-N 2.99Å; D851-I868 HydrophobicContact CB-CB 4.17Å; I868-G870 VanDerWaalsContact C-N 3.34Å; I868-G870 PolarHBondContact O-N 3.48Å; I868-I884 CarbonylContact C-O 3.44Å; I868-I884 WeakPolarHBondContact CA-O 3.32Å; I868-I884 HydrophobicContact CG1-CG1 4.21Å; I868-A885 WeakPolarHBondContact CG2-O 3.41Å; I868-F887 HydrophobicContact CD1-CB 4.17Å
869	S	81.5	Confident	83.1	Confident	21 Å²	21	30.3 Å²	30.3	15%	0.147	16%	0.163	C	C	.	.			trans	-93.8	70.9	170.9	-63.9	0	0	0	0	108.3	I884	S869-I884 PolarHBondContact N-O 3.1Å
870	G	69.6	Low	82.8	Confident	29 Å²	29	30.5 Å²	30.5	30%	0.299	16%	0.164	S	C	.	.			trans	-99.4	-155.7	-176.8	0	0	0	0	0	112.9	D851 I868	D851-G870 WeakPolarHBondContact OD1-CA 3.48Å; D851-G870 PolarHBondContact OD1-N 3.2Å; D851-G870 VanDerWaalsContact OD2-CA 3.28Å; D851-G870 WeakPolarHBondContact OD2-CA 3.27Å; I868-G870 VanDerWaalsContact C-N 3.34Å; I868-G870 PolarHBondContact O-N 3.48Å
871	M	67.5	Low	82.7	Confident	150 Å²	150	29.5 Å²	29.5	74%	0.739	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-16.2	-174.1	-61.4	-67.6	-72.5	0	0	112.1	D851 G873	D851-M871 PolarHBondContact OD2-N 2.9Å; M871-G873 PolarHBondContact O-N 2.96Å
872	E	65.4	Low	82.7	Confident	17 Å²	17	28.7 Å²	28.7	8%	0.079	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	1.1	-179.2	-64.6	-171.5	174.8	0	0	113.8	S181 T187 T453 D851 G852	S181-E872 CarbonylContact C-O 3.55Å; S181-E872 WeakPolarHBondContact CA-O 3.3Å; S181-E872 VanDerWaalsContact CB-O 3.26Å; S181-E872 WeakPolarHBondContact CB-O 3.33Å; T187-E872 HydrophobicContact CG2-CB 4.27Å; T187-E872 HydrophobicContact CG2-CG 3.88Å; T453-E872 VanDerWaalsContact CG2-OE1 3.28Å; T453-E872 WeakPolarHBondContact CG2-OE1 3.39Å; D851-E872 PolarHBondContact OD2-N 3.04Å; G852-E872 WeakPolarHBondContact CA-OE2 3.3Å; G852-E872 PolarHBondContact N-OE2 2.76Å
873	G	68.1	Low	82.4	Confident	9 Å²	9	29 Å²	29	9%	0.093	16%	0.155	C	C	.	.			trans	118.1	-174.8	178.3	0	0	0	0	0	112.5	N182 M871	N182-G873 WeakPolarHBondContact OD1-CA 3.49Å; M871-G873 PolarHBondContact O-N 2.96Å
874	R	72.6	Confident	82.3	Confident	172 Å²	172	27.3 Å²	27.3	65%	0.649	15%	0.147	S	C	*	.	S	Bend	trans	-108.5	7.6	-175.9	-68.2	-178.5	176	170.9	-1.8	114.2	N182 A877 C878	N182-R874 PolarHBondContact OD1-N 2.87Å; R874-A877 PolarHBondContact O-N 3.07Å; R874-C878 WeakPolarHBondContact O-CB 3.27Å; R874-C878 PolarHBondContact O-N 2.64Å; R874-C878 PolarHBondContact O-SG 3.01Å
875	Q	77.1	Confident	82	Confident	64 Å²	64	27.6 Å²	27.6	30%	0.299	15%	0.15	S	C	.	.	H	α-helix	trans	-67.9	-44.4	-172.8	-64.5	-56.9	-17.4	0	0	113.1	N182 A853 V856 A877 C878 A879	N182-Q875 VanDerWaalsContact O-CD 3.25Å; N182-Q875 WeakPolarHBondContact O-CG 3.43Å; N182-Q875 PolarHBondContact O-NE2 3.47Å; A853-Q875 HydrophobicContact CB-CB 4.17Å; A853-Q875 HydrophobicContact CB-CG 4.29Å; V856-Q875 HydrophobicContact CG2-CB 4.24Å; Q875-A877 PolarHBondContact O-N 3.38Å; Q875-C878 PolarHBondContact O-N 2.96Å; Q875-A879 WeakPolarHBondContact O-CB 3.29Å; Q875-A879 PolarHBondContact O-N 3.14Å
876	A	82.3	Confident	81.9	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.1	-48.2	175.8	0	0	0	0	0	110.7	G850 D851 I859 C878 A879 S880	G850-A876 WeakPolarHBondContact O-CB 3.26Å; D851-A876 VanDerWaalsContact C-CB 3.48Å; D851-A876 WeakPolarHBondContact O-CB 3.5Å; I859-A876 HydrophobicContact CD1-CB 3.67Å; A876-C878 VanDerWaalsContact C-N 3.33Å; A876-C878 PolarHBondContact O-N 3.34Å; A876-A879 PolarHBondContact O-N 3.17Å; A876-S880 WeakPolarHBondContact O-CB 3.15Å; A876-S880 PolarHBondContact O-N 3.46Å; A876-S880 PolarHBondContact O-OG 3Å
877	A	81.1	Confident	81.8	Confident	7 Å²	7	28.3 Å²	28.3	6%	0.058	15%	0.153	C	C	.	.	H	α-helix	trans	-56.5	-43.8	175.4	0	0	0	0	0	112.4	R434 R874 Q875 S880 A883	R434-A877 WeakPolarHBondContact CD-O 3.29Å; R874-A877 PolarHBondContact O-N 3.07Å; Q875-A877 PolarHBondContact O-N 3.38Å; A877-S880 PolarHBondContact O-OG 3.29Å; A877-A883 HydrophobicContact CB-CB 3.95Å
878	C	76.5	Confident	81.9	Confident	64 Å²	64	33 Å²	33	43%	0.432	17%	0.171	S	C	.	.	H	α-helix	trans	-67	-36.7	178.6	-77.8	0	0	0	0	113.8	R434 R874 Q875 A876	R434-C878 VanDerWaalsContact CZ-O 3.3Å; R434-C878 PolarHBondContact NE-O 3.17Å; R434-C878 PolarHBondContact NH2-O 2.86Å; R874-C878 WeakPolarHBondContact O-CB 3.27Å; R874-C878 PolarHBondContact O-N 2.64Å; R874-C878 PolarHBondContact O-SG 3.01Å; Q875-C878 PolarHBondContact O-N 2.96Å; A876-C878 VanDerWaalsContact C-N 3.33Å; A876-C878 PolarHBondContact O-N 3.34Å
879	A	79.9	Confident	82	Confident	21 Å²	21	33.4 Å²	33.4	17%	0.174	17%	0.173	C	C	.	.	H	α-helix	trans	-87.8	-14	-178.9	0	0	0	0	0	114.2	V856 Q875 A876	V856-A879 HydrophobicContact CB-CB 4.48Å; V856-A879 HydrophobicContact CG1-CB 3.67Å; V856-A879 HydrophobicContact CG2-CB 4.15Å; Q875-A879 WeakPolarHBondContact O-CB 3.29Å; Q875-A879 PolarHBondContact O-N 3.14Å; A876-A879 PolarHBondContact O-N 3.17Å
880	S	87.4	Confident	82.6	Confident	4 Å²	4	32.4 Å²	32.4	3%	0.028	17%	0.166	C	C	.	.	S	Bend	trans	-77.1	162.2	-178.2	69.7	0	0	0	0	114.3	R434 G867 A876 A877 Y882	R434-S880 WeakPolarHBondContact CD-O 3.14Å; G867-S880 PolarHBondContact N-OG 3.4Å; A876-S880 WeakPolarHBondContact O-CB 3.15Å; A876-S880 PolarHBondContact O-N 3.46Å; A876-S880 PolarHBondContact O-OG 3Å; A877-S880 PolarHBondContact O-OG 3.29Å; S880-Y882 PolarHBondContact OG-O 2.88Å; S880-Y882 VanDerWaalsContact OG-O 3.11Å
881	D	86.7	Confident	83.7	Confident	6 Å²	6	31.8 Å²	31.8	3%	0.032	16%	0.156	C	C	.	.	S	Bend	trans	-79	-34.6	170.2	-62.2	-60.8	0	0	0	111.2	K281 R434 T435 L438 G865	K281-D881 WeakPolarHBondContact CE-OD2 3.39Å; K281-D881 IonicContact NZ-OD2 2.9Å; K281-D881 PolarHBondContact NZ-OD2 2.96Å; R434-D881 WeakPolarHBondContact CA-O 3.25Å; R434-D881 PolarHBondContact N-O 2.99Å; T435-D881 VanDerWaalsContact CB-OD1 3.3Å; T435-D881 WeakPolarHBondContact CB-OD1 3.42Å; T435-D881 PolarHBondContact N-O 3.38Å; T435-D881 PolarHBondContact OG1-OD1 2.9Å; L438-D881 HydrophobicContact CD1-CB 4.06Å; L438-D881 VanDerWaalsContact CD1-CG 3.49Å; G865-D881 PolarHBondContact N-OD2 2.95Å; G865-D881 WeakPolarHBondContact O-CA 3.39Å; G865-D881 WeakPolarHBondContact O-CB 3.28Å; G865-D881 PolarHBondContact O-N 3.44Å
882	Y	90.4	Very high	84.8	Confident	1 Å²	1	25.9 Å²	25.9	0%	0.004	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	124.6	177	-58.9	-85.6	0	0	0	110.1	I371 M432 A433 L438 N439 L442 V864 G865 V866 G867 S880	I371-Y882 HydrophobicContact CD1-CE1 4.04Å; M432-Y882 CarbonylContact O-C 3.59Å; M432-Y882 WeakPolarHBondContact O-CA 3.05Å; A433-Y882 HydrophobicContact CB-CD1 3.66Å; A433-Y882 HydrophobicContact CB-CE1 3.61Å; L438-Y882 HydrophobicContact CB-CE2 4.37Å; L438-Y882 PolarHBondContact O-OH 3.14Å; N439-Y882 VanDerWaalsContact CA-OH 3.23Å; N439-Y882 WeakPolarHBondContact CA-OH 3.41Å; N439-Y882 PolarHBondContact N-OH 2.85Å; N439-Y882 VanDerWaalsContact N-OH 3.08Å; N439-Y882 PolarHBondContact OD1-OH 3.44Å; L442-Y882 HydrophobicContact CD1-CD1 4.3Å; L442-Y882 HydrophobicContact CD1-CD2 4.42Å; L442-Y882 HydrophobicContact CD1-CE1 3.74Å; L442-Y882 HydrophobicContact CD1-CE2 3.86Å; L442-Y882 HydrophobicContact CD2-CD2 4.14Å; L442-Y882 HydrophobicContact CD2-CE2 3.92Å; L442-Y882 HydrophobicContact CG-CE2 3.91Å; V864-Y882 HydrophobicContact CG1-CD2 3.7Å; V864-Y882 HydrophobicContact CG1-CE2 3.7Å; G865-Y882 PolarHBondContact O-N 3.35Å; G865-Y882 VanDerWaalsContact O-N 3.11Å; V866-Y882 CarbonylContact C-O 3.52Å; V866-Y882 WeakPolarHBondContact CA-O 3.47Å; G867-Y882 PolarHBondContact N-O 3.42Å; S880-Y882 PolarHBondContact OG-O 2.88Å; S880-Y882 VanDerWaalsContact OG-O 3.11Å
883	A	88.2	Confident	86.1	Confident	7 Å²	7	25 Å²	25	6%	0.058	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	134.5	170.7	0	0	0	0	0	110.2	A431 M432 G867 A877	A431-A883 CarbonylContact C-O 3.55Å; A431-A883 VanDerWaalsContact CA-O 3.3Å; A431-A883 WeakPolarHBondContact CA-O 3.27Å; M432-A883 HydrophobicContact CB-CB 4.33Å; M432-A883 PolarHBondContact N-O 3.25Å; M432-A883 PolarHBondContact O-N 2.97Å; G867-A883 CarbonylContact O-C 3.44Å; G867-A883 VanDerWaalsContact O-CA 3.26Å; G867-A883 WeakPolarHBondContact O-CA 3.49Å; A877-A883 HydrophobicContact CB-CB 3.95Å
884	I	90.6	Very high	87.3	Confident	1 Å²	1	24.6 Å²	24.6	1%	0.005	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	155.1	174.5	61.4	178.9	0	0	0	109.1	A431 I849 V866 G867 I868 S869 Q886 F889 L890 L893	A431-I884 HydrophobicContact CB-CG2 4.24Å; I849-I884 HydrophobicContact CD1-CD1 4.04Å; V866-I884 HydrophobicContact CG1-CD1 3.69Å; V866-I884 HydrophobicContact CG1-CG1 3.79Å; G867-I884 PolarHBondContact O-N 2.73Å; I868-I884 CarbonylContact C-O 3.44Å; I868-I884 WeakPolarHBondContact CA-O 3.32Å; I868-I884 HydrophobicContact CG1-CG1 4.21Å; S869-I884 PolarHBondContact N-O 3.1Å; I884-Q886 WeakPolarHBondContact CD1-O 3.26Å; I884-F889 HydrophobicContact CB-CB 4.42Å; I884-F889 HydrophobicContact CB-CD2 4.48Å; I884-F889 HydrophobicContact CD1-CB 4.43Å; I884-L890 HydrophobicContact CD1-CB 4.45Å; I884-L893 HydrophobicContact CG2-CD2 4.31Å
885	A	88.4	Confident	88.2	Confident	6 Å²	6	16.7 Å²	16.7	5%	0.05	9%	0.088	C	C	.	.	S	Bend	trans	-83.9	-27.7	-179.6	0	0	0	0	0	113.9	D424 T429 I868 F889	D424-A885 HydrophobicContact CB-CB 3.52Å; T429-A885 HydrophobicContact CG2-CB 4.1Å; I868-A885 WeakPolarHBondContact CG2-O 3.41Å; A885-F889 HydrophobicContact CB-CE2 4.16Å
886	Q	90.4	Very high	88.8	Confident	15 Å²	15	13.7 Å²	13.7	7%	0.07	7%	0.074	C	C	.	.	S	Bend	trans	-142.3	151.3	-175.4	-66.2	179.3	-11	0	0	111.8	D424 I884 R888 F889	D424-Q886 VanDerWaalsContact CG-NE2 3.26Å; D424-Q886 PolarHBondContact OD1-NE2 3.26Å; D424-Q886 PolarHBondContact OD2-NE2 3.42Å; I884-Q886 WeakPolarHBondContact CD1-O 3.26Å; Q886-R888 VanDerWaalsContact C-N 3.27Å; Q886-R888 HydrophobicContact CB-CG 4.14Å; Q886-R888 PolarHBondContact O-N 2.91Å; Q886-F889 HydrophobicContact CB-CD2 4.12Å; Q886-F889 HydrophobicContact CB-CE2 4.04Å; Q886-F889 HydrophobicContact CG-CE2 4.4Å; Q886-F889 PolarHBondContact O-N 3.31Å
887	F	93.1	Very high	89.2	Confident	1 Å²	1	14.4 Å²	14.4	0%	0.004	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-33.4	-179.2	-175.1	-90.6	0	0	0	113.3	T455 L456 V716 T719 I720 L723 I849 I868 F889 L890	T455-F887 HydrophobicContact CG2-CD2 4.09Å; T455-F887 WeakPolarHBondContact O-CB 3.38Å; L456-F887 HydrophobicContact CD2-CD1 4.19Å; L456-F887 HydrophobicContact CD2-CD2 3.75Å; L456-F887 HydrophobicContact CD2-CE1 4.07Å; L456-F887 HydrophobicContact CD2-CE2 3.6Å; L456-F887 HydrophobicContact CD2-CG 4.05Å; L456-F887 HydrophobicContact CD2-CZ 3.77Å; V716-F887 HydrophobicContact CB-CD1 4.42Å; V716-F887 HydrophobicContact CG1-CD1 4.32Å; V716-F887 HydrophobicContact CG2-CB 3.99Å; V716-F887 HydrophobicContact CG2-CD1 3.9Å; V716-F887 HydrophobicContact CG2-CG 4.22Å; T719-F887 HydrophobicContact CG2-CD1 4.01Å; T719-F887 HydrophobicContact CG2-CE1 3.74Å; I720-F887 HydrophobicContact CD1-CE1 4.38Å; I720-F887 HydrophobicContact CG1-CE1 3.78Å; I720-F887 HydrophobicContact CG1-CZ 4.1Å; L723-F887 HydrophobicContact CD1-CZ 4.49Å; I849-F887 HydrophobicContact CD1-CD2 3.9Å; I849-F887 HydrophobicContact CD1-CE2 4.3Å; I849-F887 HydrophobicContact CG2-CE2 4.12Å; I868-F887 HydrophobicContact CD1-CB 4.17Å; F887-F889 PolarHBondContact O-N 3.12Å; F887-F889 VanDerWaalsContact O-N 3.14Å; F887-L890 HydrophobicContact CE2-CD2 4.11Å; F887-L890 HydrophobicContact CZ-CD2 4.23Å; F887-L890 WeakPolarHBondContact O-CB 3.44Å; F887-L890 PolarHBondContact O-N 3.12Å
888	R	92.8	Very high	89.6	Confident	98 Å²	98	14.1 Å²	14.1	37%	0.37	8%	0.075	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-26.8	-179.7	64.1	170.8	175.9	173.6	-3	114.2	T714 T719 Q886 L890 N891	T714-R888 WeakPolarHBondContact O-CB 3.39Å; T714-R888 WeakPolarHBondContact O-CD 3.46Å; T719-R888 WeakPolarHBondContact OG1-CA 3.31Å; Q886-R888 VanDerWaalsContact C-N 3.27Å; Q886-R888 HydrophobicContact CB-CG 4.14Å; Q886-R888 PolarHBondContact O-N 2.91Å; R888-L890 PolarHBondContact O-N 2.81Å; R888-N891 VanDerWaalsContact O-CB 3.25Å; R888-N891 WeakPolarHBondContact O-CB 3.26Å; R888-N891 PolarHBondContact O-N 3.29Å
889	F	92.5	Very high	90.2	Very high	9 Å²	9	11.1 Å²	11.1	4%	0.039	6%	0.055	C	C	.	.	H	α-helix	trans	-69.8	-18.8	179.6	-58.8	-35.1	0	0	0	112.4	D421 M422 D424 I884 A885 Q886 F887 N891 K892 L893	D421-F889 WeakPolarHBondContact O-CD1 3.32Å; D421-F889 WeakPolarHBondContact O-CE1 3.39Å; M422-F889 HydrophobicContact CB-CB 4.41Å; M422-F889 HydrophobicContact CB-CD1 4.43Å; M422-F889 HydrophobicContact CB-CG 4.25Å; M422-F889 HydrophobicContact CG-CB 4.19Å; M422-F889 HydrophobicContact CG-CD1 4.43Å; M422-F889 HydrophobicContact CG-CG 4.39Å; D424-F889 HydrophobicContact CB-CE2 4.06Å; D424-F889 HydrophobicContact CB-CZ 4.23Å; I884-F889 HydrophobicContact CB-CB 4.42Å; I884-F889 HydrophobicContact CB-CD2 4.48Å; I884-F889 HydrophobicContact CD1-CB 4.43Å; A885-F889 HydrophobicContact CB-CE2 4.16Å; Q886-F889 HydrophobicContact CB-CD2 4.12Å; Q886-F889 HydrophobicContact CB-CE2 4.04Å; Q886-F889 HydrophobicContact CG-CE2 4.4Å; Q886-F889 PolarHBondContact O-N 3.31Å; F887-F889 PolarHBondContact O-N 3.12Å; F887-F889 VanDerWaalsContact O-N 3.14Å; F889-N891 PolarHBondContact O-N 3.3Å; F889-K892 PolarHBondContact O-N 2.89Å; F889-L893 WeakPolarHBondContact O-CB 3.49Å; F889-L893 PolarHBondContact O-N 3.26Å
890	L	93.1	Very high	90.6	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-58.1	-31.9	172.2	-166.9	61.8	0	0	0	112	I448 L723 L847 I849 V866 I884 F887 R888 K892 L893 L894	I448-L890 HydrophobicContact CD1-CD2 4.01Å; L723-L890 HydrophobicContact CD1-CD2 4.12Å; L847-L890 HydrophobicContact CD1-CD1 4.14Å; L847-L890 HydrophobicContact CD2-CD1 4.37Å; I849-L890 HydrophobicContact CD1-CD2 4.17Å; V866-L890 HydrophobicContact CG2-CD1 4.41Å; I884-L890 HydrophobicContact CD1-CB 4.45Å; F887-L890 HydrophobicContact CE2-CD2 4.11Å; F887-L890 HydrophobicContact CZ-CD2 4.23Å; F887-L890 WeakPolarHBondContact O-CB 3.44Å; F887-L890 PolarHBondContact O-N 3.12Å; R888-L890 PolarHBondContact O-N 2.81Å; L890-K892 PolarHBondContact O-N 3.33Å; L890-L893 HydrophobicContact CD1-CD2 4.31Å; L890-L893 PolarHBondContact O-N 3.36Å; L890-L894 HydrophobicContact CD1-CD1 3.9Å; L890-L894 HydrophobicContact CD1-CG 3.97Å; L890-L894 HydrophobicContact CD2-CD1 4.5Å; L890-L894 HydrophobicContact CG-CD1 3.86Å; L890-L894 HydrophobicContact CG-CG 4.27Å; L890-L894 WeakPolarHBondContact O-CG 3.26Å; L890-L894 PolarHBondContact O-N 2.75Å
891	N	92.6	Very high	90.7	Very high	16 Å²	16	11.3 Å²	11.3	9%	0.086	5%	0.05	C	C	.	.	H	α-helix	trans	-57.7	-50.3	176.3	-163.5	20.9	0	0	0	111.4	T719 N722 R888 F889 L895	T719-N891 HydrophobicContact CG2-CB 3.9Å; N722-N891 PolarHBondContact ND2-ND2 3.13Å; N722-N891 VanDerWaalsContact ND2-ND2 3.18Å; R888-N891 VanDerWaalsContact O-CB 3.25Å; R888-N891 WeakPolarHBondContact O-CB 3.26Å; R888-N891 PolarHBondContact O-N 3.29Å; F889-N891 PolarHBondContact O-N 3.3Å; N891-L895 VanDerWaalsContact O-CB 3.27Å; N891-L895 WeakPolarHBondContact O-CB 3.48Å; N891-L895 VanDerWaalsContact O-CG 3.3Å; N891-L895 WeakPolarHBondContact O-CG 3.49Å; N891-L895 PolarHBondContact O-N 3.46Å; N891-L895 VanDerWaalsContact O-N 3.08Å; N891-L895 WeakPolarHBondContact OD1-CD1 3.42Å
892	K	91	Very high	90.9	Very high	25 Å²	25	11 Å²	11	11%	0.109	5%	0.049	C	C	.	.	H	α-helix	trans	-76.2	-38.5	-179.3	-165.4	171.9	-175.7	-173.3	0	112	D419 D421 M422 F889 L890 L894 V896 H897 L971	D419-K892 IonicContact OD1-NZ 2.85Å; D419-K892 PolarHBondContact OD1-NZ 2.78Å; D419-K892 VanDerWaalsContact OD2-CD 3.25Å; D419-K892 WeakPolarHBondContact OD2-CD 3.46Å; D419-K892 WeakPolarHBondContact OD2-CE 3.24Å; D419-K892 IonicContact OD2-NZ 2.62Å; D419-K892 PolarHBondContact OD2-NZ 2.95Å; D421-K892 HydrophobicContact CB-CD 3.96Å; D421-K892 VanDerWaalsContact CG-NZ 3.33Å; D421-K892 IonicContact OD2-NZ 3.97Å; D421-K892 PolarHBondContact OD2-NZ 3.48Å; M422-K892 HydrophobicContact CG-CB 4.48Å; M422-K892 HydrophobicContact CG-CD 4.38Å; M422-K892 HydrophobicContact SD-CB 4.42Å; F889-K892 PolarHBondContact O-N 2.89Å; L890-K892 PolarHBondContact O-N 3.33Å; K892-L894 VanDerWaalsContact C-N 3.33Å; K892-L894 PolarHBondContact O-N 3.34Å; K892-V896 HydrophobicContact CG-CB 4.16Å; K892-V896 HydrophobicContact CG-CG2 4.05Å; K892-V896 WeakPolarHBondContact O-CB 3.49Å; K892-V896 PolarHBondContact O-N 2.89Å; K892-V896 VanDerWaalsContact O-N 3.14Å; K892-H897 PolarHBondContact O-N 3.14Å; K892-L971 HydrophobicContact CB-CD2 4.48Å
893	L	92.1	Very high	90.8	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	5%	0.051	C	C	.	.	I	π-helix	trans	-57.2	-43.7	177.7	-176	62.9	0	0	0	112	I371 M422 L442 I884 F889 L890 H897 G898	I371-L893 HydrophobicContact CD1-CD1 4.11Å; I371-L893 HydrophobicContact CG2-CD1 4.23Å; M422-L893 HydrophobicContact SD-CB 4.26Å; L442-L893 HydrophobicContact CD1-CD1 3.8Å; L442-L893 HydrophobicContact CD1-CG 4.04Å; L442-L893 HydrophobicContact CD2-CD2 4.38Å; L442-L893 HydrophobicContact CD2-CG 4.32Å; I884-L893 HydrophobicContact CG2-CD2 4.31Å; F889-L893 WeakPolarHBondContact O-CB 3.49Å; F889-L893 PolarHBondContact O-N 3.26Å; L890-L893 HydrophobicContact CD1-CD2 4.31Å; L890-L893 PolarHBondContact O-N 3.36Å; L893-H897 WeakPolarHBondContact O-CB 3.43Å; L893-G898 PolarHBondContact O-N 2.86Å
894	L	93.6	Very high	90.8	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	5%	0.05	C	C	.	.	I	π-helix	trans	-84.2	-58	-179.8	-61.8	178.5	0	0	0	112.4	L442 V445 I448 L723 I728 L847 L890 K892 V896 G898 A899 Y977	L442-L894 HydrophobicContact CB-CD2 4.09Å; L442-L894 HydrophobicContact CD2-CD2 3.69Å; L442-L894 VanDerWaalsContact O-CD2 3.32Å; L442-L894 WeakPolarHBondContact O-CD2 3.48Å; V445-L894 HydrophobicContact CB-CD2 4.39Å; V445-L894 HydrophobicContact CG2-CD2 3.9Å; I448-L894 HydrophobicContact CD1-CD1 3.99Å; L723-L894 HydrophobicContact CD2-CD1 3.85Å; I728-L894 HydrophobicContact CD1-CD1 4.16Å; L847-L894 HydrophobicContact CD1-CD1 4.44Å; L847-L894 HydrophobicContact CD1-CD2 3.91Å; L890-L894 HydrophobicContact CD1-CD1 3.9Å; L890-L894 HydrophobicContact CD1-CG 3.97Å; L890-L894 HydrophobicContact CD2-CD1 4.5Å; L890-L894 HydrophobicContact CG-CD1 3.86Å; L890-L894 HydrophobicContact CG-CG 4.27Å; L890-L894 WeakPolarHBondContact O-CG 3.26Å; L890-L894 PolarHBondContact O-N 2.75Å; K892-L894 VanDerWaalsContact C-N 3.33Å; K892-L894 PolarHBondContact O-N 3.34Å; L894-V896 VanDerWaalsContact C-N 3.28Å; L894-V896 PolarHBondContact O-N 3.01Å; L894-G898 WeakPolarHBondContact O-CA 3.36Å; L894-G898 PolarHBondContact O-N 3.22Å; L894-A899 PolarHBondContact O-N 2.93Å; L894-A899 VanDerWaalsContact O-N 3.1Å; L894-Y977 HydrophobicContact CB-CE2 4.32Å; L894-Y977 WeakPolarHBondContact O-CE2 3.4Å
895	L	92.5	Very high	90.6	Very high	5 Å²	5	11.6 Å²	11.6	3%	0.026	5%	0.05	C	C	.	.	I	π-helix	trans	-69.7	-24.9	-169.2	-57.9	-174.4	0	0	0	113.5	A726 N891 A899 P974 Y977	A726-L895 HydrophobicContact CB-CD2 3.76Å; N891-L895 VanDerWaalsContact O-CB 3.27Å; N891-L895 WeakPolarHBondContact O-CB 3.48Å; N891-L895 VanDerWaalsContact O-CG 3.3Å; N891-L895 WeakPolarHBondContact O-CG 3.49Å; N891-L895 PolarHBondContact O-N 3.46Å; N891-L895 VanDerWaalsContact O-N 3.08Å; N891-L895 WeakPolarHBondContact OD1-CD1 3.42Å; L895-A899 WeakPolarHBondContact O-CB 3.48Å; L895-P974 HydrophobicContact CD1-CB 3.78Å; L895-P974 HydrophobicContact CD1-CG 4.04Å; L895-P974 HydrophobicContact CD2-CB 4.35Å; L895-Y977 HydrophobicContact CD2-CD2 3.93Å; L895-Y977 HydrophobicContact CD2-CG 3.84Å
896	V	89.8	Confident	90.7	Very high	2 Å²	2	11.5 Å²	11.5	1%	0.012	5%	0.049	C	C	.	.	I	π-helix	trans	-108.3	-69.6	-179.1	-174	0	0	0	0	110.1	K892 L894 W900 V967 C970 L971	K892-V896 HydrophobicContact CG-CB 4.16Å; K892-V896 HydrophobicContact CG-CG2 4.05Å; K892-V896 WeakPolarHBondContact O-CB 3.49Å; K892-V896 PolarHBondContact O-N 2.89Å; K892-V896 VanDerWaalsContact O-N 3.14Å; L894-V896 VanDerWaalsContact C-N 3.28Å; L894-V896 PolarHBondContact O-N 3.01Å; V896-W900 HydrophobicContact CG1-CD2 4.05Å; V896-W900 HydrophobicContact CG1-CE3 4.11Å; V896-W900 HydrophobicContact CG1-CH2 4.1Å; V896-W900 HydrophobicContact CG1-CZ2 3.99Å; V896-W900 HydrophobicContact CG1-CZ3 4.14Å; V896-W900 VanDerWaalsContact O-CB 3.24Å; V896-W900 WeakPolarHBondContact O-CB 3.5Å; V896-W900 PolarHBondContact O-N 3.39Å; V896-V967 HydrophobicContact CG1-CG1 4.25Å; V896-V967 HydrophobicContact CG1-CG2 4.1Å; V896-V967 HydrophobicContact CG2-CG1 4.04Å; V896-C970 HydrophobicContact CG2-CB 4Å; V896-L971 HydrophobicContact CG2-CD2 3.95Å; V896-L971 HydrophobicContact CG2-CG 3.97Å
897	H	89.7	Confident	90.6	Very high	15 Å²	15	12.6 Å²	12.6	7%	0.069	5%	0.053	C	C	.	.	I	π-helix	trans	-63.4	-50.8	-174.2	-72.4	-75.1	0	0	0	111.7	I371 D419 K892 L893 W900 N901	I371-H897 HydrophobicContact CD1-CB 4.47Å; I371-H897 HydrophobicContact CG1-CB 4.41Å; D419-H897 IonicContact OD2-CD2 3.03Å; D419-H897 IonicContact OD2-CE1 2.73Å; D419-H897 IonicContact OD2-NE2 3.25Å; D419-H897 PolarHBondContact OD2-NE2 2.83Å; K892-H897 PolarHBondContact O-N 3.14Å; L893-H897 WeakPolarHBondContact O-CB 3.43Å; H897-W900 PolarHBondContact O-N 3.4Å; H897-N901 WeakPolarHBondContact O-CB 3.14Å; H897-N901 PolarHBondContact O-N 2.62Å; H897-N901 PolarHBondContact O-ND2 3.44Å; H897-N901 VanDerWaalsContact O-ND2 3.12Å; H897-N901 PolarHBondContact O-OD1 3.02Å
898	G	89.5	Confident	90.4	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	5%	0.053	C	C	.	.	I	π-helix	trans	-59	-51.6	177.8	0	0	0	0	0	112.9	G443 L893 L894 W900 N901 Y902	G443-G898 VanDerWaalsContact CA-C 3.43Å; G443-G898 WeakPolarHBondContact CA-O 3.28Å; L893-G898 PolarHBondContact O-N 2.86Å; L894-G898 WeakPolarHBondContact O-CA 3.36Å; L894-G898 PolarHBondContact O-N 3.22Å; G898-W900 PolarHBondContact O-N 3.03Å; G898-N901 PolarHBondContact O-N 3.38Å; G898-Y902 WeakPolarHBondContact O-CB 3.39Å; G898-Y902 PolarHBondContact O-N 2.95Å
899	A	89.5	Confident	90.2	Very high	2 Å²	2	7.9 Å²	7.9	2%	0.017	4%	0.036	C	C	.	.	H	α-helix	trans	-60.2	-42.7	179.1	0	0	0	0	0	112.6	L894 L895 N903 Y977 T980	L894-A899 PolarHBondContact O-N 2.93Å; L894-A899 VanDerWaalsContact O-N 3.1Å; L895-A899 WeakPolarHBondContact O-CB 3.48Å; A899-N903 PolarHBondContact O-N 3.46Å; A899-N903 PolarHBondContact O-ND2 3.44Å; A899-Y977 HydrophobicContact CB-CD2 4.18Å; A899-T980 HydrophobicContact CB-CG2 4.45Å
900	W	89.1	Confident	90.1	Very high	27 Å²	27	7.8 Å²	7.8	10%	0.102	4%	0.036	C	C	.	.	H	α-helix	trans	-68.3	-47.1	177.7	-72.8	6	0	0	0	111.9	V896 H897 G898 Y902 N903 R904 R963 C965 V967	V896-W900 HydrophobicContact CG1-CD2 4.05Å; V896-W900 HydrophobicContact CG1-CE3 4.11Å; V896-W900 HydrophobicContact CG1-CH2 4.1Å; V896-W900 HydrophobicContact CG1-CZ2 3.99Å; V896-W900 HydrophobicContact CG1-CZ3 4.14Å; V896-W900 VanDerWaalsContact O-CB 3.24Å; V896-W900 WeakPolarHBondContact O-CB 3.5Å; V896-W900 PolarHBondContact O-N 3.39Å; H897-W900 PolarHBondContact O-N 3.4Å; G898-W900 PolarHBondContact O-N 3.03Å; W900-Y902 VanDerWaalsContact C-N 3.34Å; W900-Y902 PolarHBondContact O-N 3.37Å; W900-N903 PolarHBondContact O-N 2.81Å; W900-R904 VanDerWaalsContact O-CB 3.32Å; W900-R904 WeakPolarHBondContact O-CB 3.14Å; W900-R904 WeakPolarHBondContact O-CD 3.49Å; W900-R904 WeakPolarHBondContact O-CG 3.12Å; W900-R904 PolarHBondContact O-N 3.06Å; W900-R963 HydrophobicContact CH2-CG 4.25Å; W900-R963 HydrophobicContact CZ2-CG 4.43Å; W900-R963 HydrophobicContact CZ3-CG 4.33Å; W900-C965 VanDerWaalsContact CZ2-O 3.28Å; W900-C965 WeakPolarHBondContact CZ2-O 3.38Å; W900-C965 PolarHBondContact NE1-O 2.87Å; W900-V967 HydrophobicContact CH2-CG2 3.39Å; W900-V967 HydrophobicContact CZ2-CG2 3.78Å; W900-V967 HydrophobicContact CZ3-CG2 4.34Å
901	N	89.4	Confident	90	Very high	1 Å²	1	7.9 Å²	7.9	1%	0.005	4%	0.036	C	C	.	.	H	α-helix	trans	-61.2	-42.6	-179	-68.4	-17.8	0	0	0	111.3	N439 H897 G898 N903 R904 L905	N439-N901 HydrophobicContact CB-CB 4.24Å; N439-N901 WeakPolarHBondContact O-CB 3.42Å; H897-N901 WeakPolarHBondContact O-CB 3.14Å; H897-N901 PolarHBondContact O-N 2.62Å; H897-N901 PolarHBondContact O-ND2 3.44Å; H897-N901 VanDerWaalsContact O-ND2 3.12Å; H897-N901 PolarHBondContact O-OD1 3.02Å; G898-N901 PolarHBondContact O-N 3.38Å; N901-N903 PolarHBondContact O-N 3.39Å; N901-R904 PolarHBondContact O-N 2.65Å; N901-L905 VanDerWaalsContact O-CB 3.31Å; N901-L905 WeakPolarHBondContact O-CB 3.48Å; N901-L905 PolarHBondContact O-N 3.17Å
902	Y	89.8	Confident	89.8	Confident	0 Å²	0	7.1 Å²	7.1	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-58	-49.6	174.3	176.8	-98.4	0	0	0	112.6	V285 E440 Q444 G898 W900 T906 T980 S983	V285-Y902 HydrophobicContact CG2-CD2 4.14Å; V285-Y902 HydrophobicContact CG2-CE2 3.84Å; E440-Y902 HydrophobicContact CB-CD2 4.43Å; Q444-Y902 HydrophobicContact CG-CD2 3.78Å; Q444-Y902 HydrophobicContact CG-CE2 3.73Å; Q444-Y902 HydrophobicContact CG-CG 4.48Å; G898-Y902 WeakPolarHBondContact O-CB 3.39Å; G898-Y902 PolarHBondContact O-N 2.95Å; W900-Y902 VanDerWaalsContact C-N 3.34Å; W900-Y902 PolarHBondContact O-N 3.37Å; Y902-T906 VanDerWaalsContact O-CB 3.26Å; Y902-T906 WeakPolarHBondContact O-CB 3.39Å; Y902-T906 PolarHBondContact O-N 2.94Å; Y902-T906 PolarHBondContact O-OG1 3.38Å; Y902-T980 HydrophobicContact CD1-CG2 3.89Å; Y902-T980 HydrophobicContact CE1-CG2 4.46Å; Y902-S983 WeakPolarHBondContact OH-CA 3.15Å
903	N	88.2	Confident	89.7	Confident	8 Å²	8	6 Å²	6	4%	0.043	3%	0.027	C	C	.	.	H	α-helix	trans	-65.2	-43.5	-179.9	-63.4	-39.2	0	0	0	112.2	A899 W900 N901 T906 K907 S964 R1131	A899-N903 PolarHBondContact O-N 3.46Å; A899-N903 PolarHBondContact O-ND2 3.44Å; W900-N903 PolarHBondContact O-N 2.81Å; N901-N903 PolarHBondContact O-N 3.39Å; N903-T906 PolarHBondContact O-N 3.17Å; N903-K907 WeakPolarHBondContact O-CB 3.44Å; N903-K907 WeakPolarHBondContact O-CG 3.35Å; N903-K907 PolarHBondContact O-N 2.93Å; N903-S964 PolarHBondContact ND2-OG 3.27Å; N903-R1131 PolarHBondContact ND2-NH1 3.08Å; N903-R1131 PolarHBondContact ND2-NH2 3.08Å; N903-R1131 VanDerWaalsContact ND2-NH2 3.16Å; N903-R1131 PolarHBondContact OD1-NH1 2.86Å
904	R	88.5	Confident	89.8	Confident	14 Å²	14	6 Å²	6	5%	0.053	3%	0.027	C	C	.	.	H	α-helix	trans	-59.2	-50	178.9	-77	166.6	180	176.9	-6.3	111	W900 N901 K907 L908 G959 L960 D962	W900-R904 VanDerWaalsContact O-CB 3.32Å; W900-R904 WeakPolarHBondContact O-CB 3.14Å; W900-R904 WeakPolarHBondContact O-CD 3.49Å; W900-R904 WeakPolarHBondContact O-CG 3.12Å; W900-R904 PolarHBondContact O-N 3.06Å; N901-R904 PolarHBondContact O-N 2.65Å; R904-K907 PolarHBondContact O-N 3.03Å; R904-L908 WeakPolarHBondContact O-CB 3.48Å; R904-L908 PolarHBondContact O-N 2.8Å; R904-G959 WeakPolarHBondContact CB-O 3.35Å; R904-G959 WeakPolarHBondContact CD-O 3.31Å; R904-L960 VanDerWaalsContact CZ-O 3.24Å; R904-L960 PolarHBondContact NE-O 2.94Å; R904-L960 PolarHBondContact NH2-O 3.47Å; R904-D962 HydrophobicContact CG-CB 4.44Å; R904-D962 PolarHBondContact NE-O 3.28Å; R904-D962 PolarHBondContact NH2-O 3.32Å; R904-D962 VanDerWaalsContact NH2-O 3.1Å
905	L	87.9	Confident	89.6	Confident	0 Å²	0	6 Å²	6	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-65.8	-44.2	-178.8	-160	71.4	0	0	0	111.4	V285 L360 V363 E440 N901 K907 L908 I909	V285-L905 HydrophobicContact CG1-CD2 4.21Å; L360-L905 HydrophobicContact CD2-CD1 3.29Å; L360-L905 HydrophobicContact CD2-CD2 4.48Å; L360-L905 HydrophobicContact CD2-CG 3.82Å; V363-L905 HydrophobicContact CG1-CD1 4.5Å; E440-L905 HydrophobicContact CB-CD2 3.78Å; E440-L905 HydrophobicContact CG-CD2 3.63Å; E440-L905 WeakPolarHBondContact OE1-CD2 3.39Å; E440-L905 WeakPolarHBondContact OE2-CD2 3.28Å; N901-L905 VanDerWaalsContact O-CB 3.31Å; N901-L905 WeakPolarHBondContact O-CB 3.48Å; N901-L905 PolarHBondContact O-N 3.17Å; L905-K907 PolarHBondContact O-N 3.49Å; L905-L908 WeakPolarHBondContact O-CB 3.3Å; L905-L908 PolarHBondContact O-N 3.44Å; L905-I909 HydrophobicContact CG-CD1 4.08Å; L905-I909 WeakPolarHBondContact O-CD1 3.34Å; L905-I909 VanDerWaalsContact O-CG1 3.26Å; L905-I909 WeakPolarHBondContact O-CG1 3.32Å; L905-I909 PolarHBondContact O-N 3.38Å
906	T	89.4	Confident	89.5	Confident	3 Å²	3	5.8 Å²	5.8	2%	0.018	3%	0.026	C	C	.	.	H	α-helix	trans	-57.3	-48.4	176.3	-65.7	0	0	0	0	111.8	Y902 N903 I909 L910 F986	Y902-T906 VanDerWaalsContact O-CB 3.26Å; Y902-T906 WeakPolarHBondContact O-CB 3.39Å; Y902-T906 PolarHBondContact O-N 2.94Å; Y902-T906 PolarHBondContact O-OG1 3.38Å; N903-T906 PolarHBondContact O-N 3.17Å; T906-I909 PolarHBondContact O-N 3.37Å; T906-L910 HydrophobicContact CG2-CD1 3.88Å; T906-L910 WeakPolarHBondContact O-CG 3.28Å; T906-L910 PolarHBondContact O-N 3.43Å; T906-F986 HydrophobicContact CG2-CB 3.61Å; T906-F986 HydrophobicContact CG2-CD2 3.76Å; T906-F986 HydrophobicContact CG2-CG 4.01Å
907	K	88.6	Confident	89.6	Confident	39 Å²	39	6.3 Å²	6.3	17%	0.17	3%	0.029	C	C	.	.	H	α-helix	trans	-63.1	-42.6	177.7	-76.6	-175.3	178.9	-172.4	0	111.9	N903 R904 L905 I909 L910 Y911 D962 E1049 T1051	N903-K907 WeakPolarHBondContact O-CB 3.44Å; N903-K907 WeakPolarHBondContact O-CG 3.35Å; N903-K907 PolarHBondContact O-N 2.93Å; R904-K907 PolarHBondContact O-N 3.03Å; L905-K907 PolarHBondContact O-N 3.49Å; K907-I909 PolarHBondContact O-N 2.69Å; K907-L910 PolarHBondContact O-N 3.29Å; K907-Y911 VanDerWaalsContact O-CB 3.24Å; K907-Y911 WeakPolarHBondContact O-CB 3.29Å; K907-Y911 PolarHBondContact O-N 3.23Å; K907-D962 WeakPolarHBondContact CD-OD2 3.37Å; K907-D962 WeakPolarHBondContact CE-OD2 3.29Å; K907-D962 IonicContact NZ-OD2 2.76Å; K907-D962 PolarHBondContact NZ-OD2 3.32Å; K907-E1049 PolarHBondContact NZ-O 3Å; K907-T1051 PolarHBondContact NZ-OG1 3.31Å
908	L	89.1	Confident	89.8	Confident	0 Å²	0	5.6 Å²	5.6	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-58.1	-47.9	176.6	178.9	164.5	0	0	0	111.3	L356 L360 V363 R904 L905 S912 P955	L356-L908 HydrophobicContact CD1-CD2 3.91Å; L360-L908 HydrophobicContact CD2-CD2 3.72Å; L360-L908 HydrophobicContact CG-CD2 4.48Å; V363-L908 HydrophobicContact CB-CD1 4.25Å; V363-L908 HydrophobicContact CG1-CD1 4.32Å; V363-L908 HydrophobicContact CG2-CD1 3.7Å; R904-L908 WeakPolarHBondContact O-CB 3.48Å; R904-L908 PolarHBondContact O-N 2.8Å; L905-L908 WeakPolarHBondContact O-CB 3.3Å; L905-L908 PolarHBondContact O-N 3.44Å; L908-S912 VanDerWaalsContact O-CB 3.27Å; L908-S912 WeakPolarHBondContact O-CB 3.08Å; L908-S912 PolarHBondContact O-N 3.46Å; L908-S912 PolarHBondContact O-OG 2.98Å; L908-P955 WeakPolarHBondContact CD1-O 3.35Å; L908-P955 HydrophobicContact CG-CB 4.15Å
909	I	89.1	Confident	89.8	Confident	0 Å²	0	5.6 Å²	5.6	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-62.2	-51.7	-179.4	-66.9	162	0	0	0	110.4	V285 T289 L356 L360 L905 T906 K907 Y911 S912 F913 F986	V285-I909 HydrophobicContact CG1-CD1 3.57Å; T289-I909 HydrophobicContact CG2-CG2 4.28Å; L356-I909 HydrophobicContact CD1-CG1 4.31Å; L360-I909 HydrophobicContact CD1-CG1 4.41Å; L360-I909 HydrophobicContact CD2-CD1 4Å; L360-I909 HydrophobicContact CD2-CG1 3.62Å; L905-I909 HydrophobicContact CG-CD1 4.08Å; L905-I909 WeakPolarHBondContact O-CD1 3.34Å; L905-I909 VanDerWaalsContact O-CG1 3.26Å; L905-I909 WeakPolarHBondContact O-CG1 3.32Å; L905-I909 PolarHBondContact O-N 3.38Å; T906-I909 PolarHBondContact O-N 3.37Å; K907-I909 PolarHBondContact O-N 2.69Å; I909-Y911 PolarHBondContact O-N 3.37Å; I909-S912 PolarHBondContact O-N 3.29Å; I909-F913 HydrophobicContact CG2-CD2 3.73Å; I909-F913 HydrophobicContact CG2-CE2 3.45Å; I909-F913 VanDerWaalsContact CG2-CE2 3.45Å; I909-F913 VanDerWaalsContact O-CD2 3.24Å; I909-F913 WeakPolarHBondContact O-CD2 3.22Å; I909-F913 PolarHBondContact O-N 2.89Å; I909-F986 HydrophobicContact CB-CE2 4.38Å; I909-F986 HydrophobicContact CD1-CZ 4.39Å; I909-F986 HydrophobicContact CG2-CE2 3.91Å; I909-F986 HydrophobicContact CG2-CZ 3.97Å
910	L	90.6	Very high	89.8	Confident	7 Å²	7	5.6 Å²	5.6	4%	0.037	3%	0.025	C	C	.	.	H	α-helix	trans	-60.1	-45.2	-179.3	-69.7	171.1	0	0	0	111.9	T906 K907 S912 F913 Y914 F986 V990 F991 W994	T906-L910 HydrophobicContact CG2-CD1 3.88Å; T906-L910 WeakPolarHBondContact O-CG 3.28Å; T906-L910 PolarHBondContact O-N 3.43Å; K907-L910 PolarHBondContact O-N 3.29Å; L910-S912 VanDerWaalsContact C-N 3.35Å; L910-S912 PolarHBondContact O-N 3.32Å; L910-F913 PolarHBondContact O-N 3.09Å; L910-Y914 WeakPolarHBondContact O-CB 3.42Å; L910-Y914 PolarHBondContact O-N 2.66Å; L910-F986 HydrophobicContact CD1-CD2 4.47Å; L910-F986 HydrophobicContact CD2-CD2 4.23Å; L910-F986 HydrophobicContact CD2-CE2 4.18Å; L910-F986 HydrophobicContact CG-CD2 4.22Å; L910-F986 HydrophobicContact CG-CE2 4.31Å; L910-V990 HydrophobicContact CD1-CG1 3.91Å; L910-V990 HydrophobicContact CD2-CG1 4.48Å; L910-F991 HydrophobicContact CD2-CB 4.39Å; L910-F991 HydrophobicContact CD2-CD2 4.23Å; L910-W994 HydrophobicContact CB-CD2 4.13Å; L910-W994 HydrophobicContact CB-CG 4.32Å; L910-W994 HydrophobicContact CB-CZ2 4.41Å; L910-W994 HydrophobicContact CD2-CG 4.36Å
911	Y	90.9	Very high	89.9	Confident	1 Å²	1	5.1 Å²	5.1	0%	0.004	3%	0.025	C	C	.	.	H	α-helix	trans	-64.3	-39.1	177	178.2	-93.9	0	0	0	112.1	K907 I909 Y914 K915 P954 P955 L958 V1042 A1046	K907-Y911 VanDerWaalsContact O-CB 3.24Å; K907-Y911 WeakPolarHBondContact O-CB 3.29Å; K907-Y911 PolarHBondContact O-N 3.23Å; I909-Y911 PolarHBondContact O-N 3.37Å; Y911-Y914 HydrophobicContact CD2-CD1 4.23Å; Y911-Y914 HydrophobicContact CE2-CD1 4.38Å; Y911-Y914 HydrophobicContact CE2-CE1 4.46Å; Y911-Y914 PolarHBondContact O-N 3.4Å; Y911-K915 HydrophobicContact CD1-CD 4.06Å; Y911-K915 HydrophobicContact CE1-CD 3.59Å; Y911-K915 PolarHBondContact O-N 2.71Å; Y911-P954 HydrophobicContact CE1-CB 4.34Å; Y911-P955 HydrophobicContact CD1-CB 3.92Å; Y911-P955 HydrophobicContact CD1-CG 4.37Å; Y911-P955 HydrophobicContact CE1-CB 4.27Å; Y911-P955 HydrophobicContact CE1-CG 4.27Å; Y911-L958 HydrophobicContact CD1-CD1 4.41Å; Y911-L958 HydrophobicContact CD2-CD1 4.4Å; Y911-L958 HydrophobicContact CG-CD1 4.1Å; Y911-V1042 WeakPolarHBondContact CE2-O 3.45Å; Y911-V1042 PolarHBondContact OH-O 2.83Å; Y911-A1046 HydrophobicContact CD2-CB 4.34Å; Y911-A1046 HydrophobicContact CE1-CB 4.48Å; Y911-A1046 HydrophobicContact CE2-CB 3.58Å
912	S	88.1	Confident	90.1	Very high	0 Å²	0	5.1 Å²	5.1	0%	0	2%	0.024	C	C	.	.	H	α-helix	trans	-65.3	-39.7	179.3	-64	0	0	0	0	112.6	M359 L908 I909 L910 K915 N916	M359-S912 WeakPolarHBondContact CE-OG 3.43Å; L908-S912 VanDerWaalsContact O-CB 3.27Å; L908-S912 WeakPolarHBondContact O-CB 3.08Å; L908-S912 PolarHBondContact O-N 3.46Å; L908-S912 PolarHBondContact O-OG 2.98Å; I909-S912 PolarHBondContact O-N 3.29Å; L910-S912 VanDerWaalsContact C-N 3.35Å; L910-S912 PolarHBondContact O-N 3.32Å; S912-K915 WeakPolarHBondContact O-CG 3.17Å; S912-N916 PolarHBondContact O-N 2.9Å; S912-N916 PolarHBondContact O-ND2 3.29Å
913	F	89.3	Confident	90.1	Very high	2 Å²	2	5.1 Å²	5.1	1%	0.009	3%	0.025	C	C	.	.	H	α-helix	trans	-68.2	-45.8	172	-73.4	-59.7	0	0	0	111.8	T289 I293 L296 P353 L356 I909 L910 K915 N916 V917 F991 I995	T289-F913 HydrophobicContact CG2-CE2 4.31Å; T289-F913 HydrophobicContact CG2-CZ 4.26Å; I293-F913 HydrophobicContact CG1-CE1 4.19Å; I293-F913 HydrophobicContact CG1-CZ 3.87Å; L296-F913 HydrophobicContact CD1-CD1 3.18Å; L296-F913 HydrophobicContact CD1-CE1 3.32Å; L296-F913 HydrophobicContact CD1-CG 4.1Å; L296-F913 HydrophobicContact CD1-CZ 4.3Å; P353-F913 HydrophobicContact CG-CD1 3.9Å; P353-F913 HydrophobicContact CG-CE1 3.76Å; L356-F913 HydrophobicContact CD2-CE1 4.15Å; L356-F913 HydrophobicContact CD2-CE2 4.01Å; L356-F913 HydrophobicContact CD2-CZ 3.65Å; I909-F913 HydrophobicContact CG2-CD2 3.73Å; I909-F913 HydrophobicContact CG2-CE2 3.45Å; I909-F913 VanDerWaalsContact CG2-CE2 3.45Å; I909-F913 VanDerWaalsContact O-CD2 3.24Å; I909-F913 WeakPolarHBondContact O-CD2 3.22Å; I909-F913 PolarHBondContact O-N 2.89Å; L910-F913 PolarHBondContact O-N 3.09Å; F913-K915 PolarHBondContact O-N 2.88Å; F913-N916 PolarHBondContact O-N 2.98Å; F913-V917 WeakPolarHBondContact O-CG2 3.17Å; F913-V917 PolarHBondContact O-N 3.24Å; F913-F991 HydrophobicContact CB-CE2 4.23Å; F913-F991 HydrophobicContact CD2-CD2 4.38Å; F913-F991 AromaticContact CD2-CE2 3.64Å; F913-F991 HydrophobicContact CD2-CE2 3.64Å; F913-F991 HydrophobicContact CE2-CE2 4.06Å; F913-F991 AromaticContact CG-CE2 3.94Å; F913-F991 HydrophobicContact CG-CE2 3.94Å; F913-I995 HydrophobicContact CB-CD1 4.44Å
914	Y	92.5	Very high	90.2	Very high	1 Å²	1	5.9 Å²	5.9	0%	0.004	3%	0.028	C	C	.	.	H	α-helix	trans	-56	-47.8	179.8	156.6	-90	0	0	0	112.6	L910 Y911 N916 C918 W994 S998 H1001 V1042 K1045	L910-Y914 WeakPolarHBondContact O-CB 3.42Å; L910-Y914 PolarHBondContact O-N 2.66Å; Y911-Y914 HydrophobicContact CD2-CD1 4.23Å; Y911-Y914 HydrophobicContact CE2-CD1 4.38Å; Y911-Y914 HydrophobicContact CE2-CE1 4.46Å; Y911-Y914 PolarHBondContact O-N 3.4Å; Y914-N916 PolarHBondContact O-N 3.12Å; Y914-C918 VanDerWaalsContact O-CB 3.26Å; Y914-C918 WeakPolarHBondContact O-CB 3.2Å; Y914-C918 PolarHBondContact O-N 3.45Å; Y914-W994 HydrophobicContact CD2-CE3 4.24Å; Y914-W994 AromaticContact CG-CE3 3.96Å; Y914-W994 HydrophobicContact CG-CE3 3.96Å; Y914-W994 HydrophobicContact CG-CZ3 4.25Å; Y914-S998 PolarHBondContact O-OG 3.07Å; Y914-H1001 AromaticContact CE2-ND1 3.55Å; Y914-H1001 AromaticContact CZ-ND1 3.54Å; Y914-H1001 PolarHBondContact OH-ND1 2.82Å; Y914-V1042 HydrophobicContact CE1-CB 4.5Å; Y914-V1042 HydrophobicContact CE1-CG1 4.13Å; Y914-K1045 HydrophobicContact CD1-CG 4.43Å; Y914-K1045 HydrophobicContact CE1-CB 4.26Å; Y914-K1045 HydrophobicContact CE1-CG 3.64Å
915	K	91.3	Very high	90.5	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-67.7	-37.4	-177.1	78.6	-171.3	-177.5	76	0	112.2	Y911 S912 F913 C918 L919 Y946 N947 T951 V1042	Y911-K915 HydrophobicContact CD1-CD 4.06Å; Y911-K915 HydrophobicContact CE1-CD 3.59Å; Y911-K915 PolarHBondContact O-N 2.71Å; S912-K915 WeakPolarHBondContact O-CG 3.17Å; F913-K915 PolarHBondContact O-N 2.88Å; K915-C918 WeakPolarHBondContact O-CB 3.31Å; K915-C918 PolarHBondContact O-N 3.5Å; K915-L919 PolarHBondContact O-N 2.94Å; K915-Y946 HydrophobicContact CG-CE1 4.29Å; K915-Y946 PolarHBondContact O-OH 3.11Å; K915-Y946 VanDerWaalsContact O-OH 3.14Å; K915-N947 PolarHBondContact NZ-OD1 2.99Å; K915-T951 PolarHBondContact NZ-OG1 3.26Å; K915-V1042 HydrophobicContact CB-CB 4.41Å; K915-V1042 HydrophobicContact CB-CG1 4.27Å
916	N	90.1	Very high	90.7	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-68.1	-52.3	179	-84.2	-86.5	0	0	0	111	T350 S912 F913 Y914 C918 L919 Y920 N947	T350-N916 PolarHBondContact O-OD1 3.4Å; S912-N916 PolarHBondContact O-N 2.9Å; S912-N916 PolarHBondContact O-ND2 3.29Å; F913-N916 PolarHBondContact O-N 2.98Å; Y914-N916 PolarHBondContact O-N 3.12Å; N916-C918 PolarHBondContact O-N 3.33Å; N916-C918 VanDerWaalsContact O-N 3.14Å; N916-L919 PolarHBondContact O-N 2.87Å; N916-Y920 HydrophobicContact CB-CD2 4.36Å; N916-Y920 WeakPolarHBondContact O-CD2 3.28Å; N916-Y920 PolarHBondContact O-N 3.4Å; N916-N947 PolarHBondContact ND2-OD1 3.08Å; N916-N947 VanDerWaalsContact OD1-CG 3.24Å; N916-N947 PolarHBondContact OD1-ND2 3.33Å; N916-N947 PolarHBondContact OD1-OD1 2.99Å
917	V	91.1	Very high	90.8	Very high	12 Å²	12	8.6 Å²	8.6	7%	0.073	4%	0.039	C	C	.	.	H	α-helix	trans	-56.6	-34.4	176	175.1	0	0	0	0	110.8	L296 I351 F913 L921 I995 S998	L296-V917 HydrophobicContact CD2-CG2 4.3Å; I351-V917 HydrophobicContact CG2-CG2 4.27Å; F913-V917 WeakPolarHBondContact O-CG2 3.17Å; F913-V917 PolarHBondContact O-N 3.24Å; V917-L921 WeakPolarHBondContact O-CB 3.2Å; V917-L921 PolarHBondContact O-N 3.46Å; V917-I995 HydrophobicContact CG2-CD1 3.9Å; V917-S998 VanDerWaalsContact C-OG 3.28Å; V917-S998 WeakPolarHBondContact CB-OG 3.34Å; V917-S998 WeakPolarHBondContact CG1-OG 3.08Å
918	C	93.2	Very high	90.9	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-66.7	-44.8	-177.6	-173.2	0	0	0	0	111.8	Y914 K915 N916 I922 S998 S1002	Y914-C918 VanDerWaalsContact O-CB 3.26Å; Y914-C918 WeakPolarHBondContact O-CB 3.2Å; Y914-C918 PolarHBondContact O-N 3.45Å; K915-C918 WeakPolarHBondContact O-CB 3.31Å; K915-C918 PolarHBondContact O-N 3.5Å; N916-C918 PolarHBondContact O-N 3.33Å; N916-C918 VanDerWaalsContact O-N 3.14Å; C918-I922 WeakPolarHBondContact O-CD1 3.35Å; C918-I922 WeakPolarHBondContact O-CG1 3.15Å; C918-S998 VanDerWaalsContact CA-OG 3.23Å; C918-S998 WeakPolarHBondContact CA-OG 2.98Å; C918-S998 WeakPolarHBondContact CB-OG 3.25Å; C918-S998 PolarHBondContact N-OG 2.81Å; C918-S1002 WeakPolarHBondContact O-CB 3.44Å
919	L	91.1	Very high	91	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-73.6	-45.9	179.1	-178	73.1	0	0	0	111.6	K915 N916 I922 F938 Y946 Y1035 V1038	K915-L919 PolarHBondContact O-N 2.94Å; N916-L919 PolarHBondContact O-N 2.87Å; L919-I922 WeakPolarHBondContact O-CB 3.37Å; L919-I922 PolarHBondContact O-N 3.3Å; L919-F938 HydrophobicContact CD1-CD2 4.18Å; L919-F938 HydrophobicContact CD1-CE2 3.53Å; L919-F938 HydrophobicContact CD1-CZ 3.76Å; L919-F938 HydrophobicContact CG-CE2 4.15Å; L919-Y946 HydrophobicContact CB-CD1 4.49Å; L919-Y946 HydrophobicContact CB-CE1 4.05Å; L919-Y946 HydrophobicContact CD2-CD1 3.51Å; L919-Y946 HydrophobicContact CD2-CD2 3.78Å; L919-Y946 HydrophobicContact CD2-CE1 3.91Å; L919-Y946 HydrophobicContact CD2-CE2 4.14Å; L919-Y946 HydrophobicContact CD2-CG 3.43Å; L919-Y946 VanDerWaalsContact CD2-CG 3.43Å; L919-Y1035 HydrophobicContact CD1-CD2 3.91Å; L919-Y1035 HydrophobicContact CD1-CE2 3.99Å; L919-Y1035 HydrophobicContact CD2-CE2 4.22Å; L919-V1038 HydrophobicContact CB-CG1 4.37Å; L919-V1038 HydrophobicContact CD1-CB 4.45Å; L919-V1038 HydrophobicContact CD1-CG1 3.95Å; L919-V1038 HydrophobicContact CD1-CG2 4.47Å
920	Y	87.7	Confident	91	Very high	2 Å²	2	15.6 Å²	15.6	1%	0.008	8%	0.079	C	C	.	.	H	α-helix	trans	-78.8	-25.4	-170	-66.9	-67.8	0	0	0	113.3	T350 N916 I922 Q923 I943	T350-Y920 VanDerWaalsContact C-CD2 3.46Å; T350-Y920 VanDerWaalsContact CB-CE1 3.48Å; T350-Y920 VanDerWaalsContact CB-CE2 3.43Å; T350-Y920 WeakPolarHBondContact CB-OH 3.44Å; T350-Y920 HydrophobicContact CG2-CE1 4.31Å; T350-Y920 HydrophobicContact CG2-CE2 4.48Å; T350-Y920 WeakPolarHBondContact O-CD2 3.24Å; T350-Y920 VanDerWaalsContact O-CE2 3.24Å; T350-Y920 WeakPolarHBondContact O-CE2 3.43Å; T350-Y920 WeakPolarHBondContact OG1-CD1 3.49Å; T350-Y920 WeakPolarHBondContact OG1-CE1 3.45Å; N916-Y920 HydrophobicContact CB-CD2 4.36Å; N916-Y920 WeakPolarHBondContact O-CD2 3.28Å; N916-Y920 PolarHBondContact O-N 3.4Å; Y920-I922 PolarHBondContact O-N 2.98Å; Y920-Q923 WeakPolarHBondContact O-CB 3.48Å; Y920-Q923 PolarHBondContact O-N 3.28Å; Y920-I943 HydrophobicContact CE1-CG2 3.57Å; Y920-I943 PolarHBondContact OH-O 3.41Å
921	L	91.3	Very high	90.9	Very high	18 Å²	18	15.4 Å²	15.4	9%	0.094	8%	0.079	C	C	.	.	H	α-helix	trans	-69.6	-20.8	171.2	-161	69.4	0	0	0	112.6	L303 V917 Q923 F924 W925 I999 S1002	L303-L921 HydrophobicContact CD1-CD1 4.47Å; V917-L921 WeakPolarHBondContact O-CB 3.2Å; V917-L921 PolarHBondContact O-N 3.46Å; L921-Q923 PolarHBondContact O-N 3.04Å; L921-F924 HydrophobicContact CD1-CB 4.01Å; L921-F924 HydrophobicContact CD1-CD1 4.14Å; L921-F924 HydrophobicContact CD1-CG 4.26Å; L921-F924 WeakPolarHBondContact O-CB 3.49Å; L921-F924 PolarHBondContact O-N 2.99Å; L921-F924 VanDerWaalsContact O-N 3.1Å; L921-W925 HydrophobicContact CD2-CZ2 3.85Å; L921-W925 HydrophobicContact CG-CZ2 4.21Å; L921-W925 VanDerWaalsContact O-CD1 3.24Å; L921-W925 PolarHBondContact O-N 3.34Å; L921-I999 HydrophobicContact CD2-CB 3.99Å; L921-I999 HydrophobicContact CD2-CG1 3.66Å; L921-I999 HydrophobicContact CD2-CG2 3.88Å; L921-S1002 WeakPolarHBondContact CD2-OG 3.34Å
922	I	93.4	Very high	90.7	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-62.5	-34.8	171.9	-65.9	170.6	0	0	0	111.3	C918 L919 Y920 F924 W925 F926 F938 L1005 F1006 V1034 V1038	C918-I922 WeakPolarHBondContact O-CD1 3.35Å; C918-I922 WeakPolarHBondContact O-CG1 3.15Å; L919-I922 WeakPolarHBondContact O-CB 3.37Å; L919-I922 PolarHBondContact O-N 3.3Å; Y920-I922 PolarHBondContact O-N 2.98Å; I922-F924 VanDerWaalsContact C-N 3.29Å; I922-F924 PolarHBondContact O-N 3.29Å; I922-W925 PolarHBondContact O-N 2.87Å; I922-F926 PolarHBondContact O-N 2.88Å; I922-F938 HydrophobicContact CB-CE2 4.45Å; I922-F938 HydrophobicContact CB-CZ 4.32Å; I922-F938 HydrophobicContact CD1-CZ 4.43Å; I922-F938 HydrophobicContact CG2-CE2 4.24Å; I922-F938 HydrophobicContact CG2-CZ 3.83Å; I922-L1005 HydrophobicContact CD1-CB 4.28Å; I922-F1006 HydrophobicContact CG1-CB 4.32Å; I922-F1006 HydrophobicContact CG2-CB 4.08Å; I922-F1006 HydrophobicContact CG2-CD2 3.54Å; I922-F1006 HydrophobicContact CG2-CE2 4.31Å; I922-F1006 HydrophobicContact CG2-CG 4.09Å; I922-V1034 HydrophobicContact CD1-CG1 4.01Å; I922-V1034 HydrophobicContact CG2-CG1 4.07Å; I922-V1038 HydrophobicContact CD1-CG2 3.32Å
923	Q	90.4	Very high	90.5	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-66.9	-34.1	175.4	-57	-173.5	25.5	0	0	111.5	Y920 L921 F926 A927 F938	Y920-Q923 WeakPolarHBondContact O-CB 3.48Å; Y920-Q923 PolarHBondContact O-N 3.28Å; L921-Q923 PolarHBondContact O-N 3.04Å; Q923-F926 PolarHBondContact O-N 2.85Å; Q923-A927 WeakPolarHBondContact O-CB 3.34Å; Q923-A927 PolarHBondContact O-N 3.32Å; Q923-F938 HydrophobicContact CG-CE2 4.43Å
924	F	91.7	Very high	90.3	Very high	24 Å²	24	20 Å²	20	11%	0.105	11%	0.109	C	C	.	.	H	α-helix	trans	-64.7	-43.9	172.3	176.5	-99.3	0	0	0	111.7	L303 F306 T307 Y348 L921 I922 F926 A927 I928	L303-F924 HydrophobicContact CD2-CD2 3.93Å; L303-F924 HydrophobicContact CD2-CE2 3.89Å; L303-F924 HydrophobicContact CD2-CG 4.43Å; L303-F924 HydrophobicContact CD2-CZ 4.35Å; F306-F924 AromaticContact CD1-CE2 3.83Å; F306-F924 HydrophobicContact CD1-CE2 3.83Å; F306-F924 HydrophobicContact CD1-CZ 4.16Å; F306-F924 HydrophobicContact CE1-CE2 4.01Å; F306-F924 AromaticContact CE1-CZ 3.96Å; F306-F924 HydrophobicContact CE1-CZ 3.96Å; T307-F924 HydrophobicContact CG2-CD2 3.9Å; T307-F924 HydrophobicContact CG2-CE2 3.88Å; Y348-F924 HydrophobicContact CE1-CB 3.86Å; L921-F924 HydrophobicContact CD1-CB 4.01Å; L921-F924 HydrophobicContact CD1-CD1 4.14Å; L921-F924 HydrophobicContact CD1-CG 4.26Å; L921-F924 WeakPolarHBondContact O-CB 3.49Å; L921-F924 PolarHBondContact O-N 2.99Å; L921-F924 VanDerWaalsContact O-N 3.1Å; I922-F924 VanDerWaalsContact C-N 3.29Å; I922-F924 PolarHBondContact O-N 3.29Å; F924-F926 VanDerWaalsContact C-N 3.3Å; F924-F926 PolarHBondContact O-N 3.46Å; F924-A927 WeakPolarHBondContact O-CB 3.02Å; F924-A927 PolarHBondContact O-N 3.01Å; F924-I928 HydrophobicContact CE1-CD1 4.15Å; F924-I928 PolarHBondContact O-N 2.89Å
925	W	93.4	Very high	90	Very high	47 Å²	47	24.8 Å²	24.8	18%	0.178	13%	0.132	C	C	.	.	H	α-helix	trans	-61.4	-39.8	175.3	-57.3	133.6	0	0	0	112.3	L921 I922 I928 I999 S1002 F1006	L921-W925 HydrophobicContact CD2-CZ2 3.85Å; L921-W925 HydrophobicContact CG-CZ2 4.21Å; L921-W925 VanDerWaalsContact O-CD1 3.24Å; L921-W925 PolarHBondContact O-N 3.34Å; I922-W925 PolarHBondContact O-N 2.87Å; W925-I928 HydrophobicContact CE3-CD1 3.93Å; W925-I928 HydrophobicContact CZ3-CD1 4.29Å; W925-I928 PolarHBondContact O-N 3.24Å; W925-I999 HydrophobicContact CZ2-CG2 4.36Å; W925-S1002 PolarHBondContact NE1-OG 3.36Å; W925-F1006 HydrophobicContact CB-CB 4.48Å; W925-F1006 HydrophobicContact CB-CD1 3.32Å; W925-F1006 HydrophobicContact CB-CE1 3.55Å; W925-F1006 HydrophobicContact CB-CG 3.92Å; W925-F1006 HydrophobicContact CB-CZ 4.32Å; W925-F1006 HydrophobicContact CG-CD1 4.15Å
926	F	92.8	Very high	90	Very high	22 Å²	22	25.6 Å²	25.6	10%	0.096	14%	0.136	C	C	.	.	H	α-helix	trans	-69.2	-34.9	174.3	-179.3	-112.3	0	0	0	113.4	I922 Q923 F924 I928 L929 S930 Q935 V937 F1006 L1027	I922-F926 PolarHBondContact O-N 2.88Å; Q923-F926 PolarHBondContact O-N 2.85Å; F924-F926 VanDerWaalsContact C-N 3.3Å; F924-F926 PolarHBondContact O-N 3.46Å; F926-I928 PolarHBondContact O-N 2.9Å; F926-L929 WeakPolarHBondContact O-CA 3.46Å; F926-L929 PolarHBondContact O-N 3.22Å; F926-S930 PolarHBondContact O-N 3.18Å; F926-S930 PolarHBondContact O-OG 3.35Å; F926-Q935 WeakPolarHBondContact CD1-O 3.41Å; F926-Q935 HydrophobicContact CE1-CB 4.09Å; F926-Q935 HydrophobicContact CE1-CG 3.94Å; F926-Q935 WeakPolarHBondContact CE1-O 3.33Å; F926-Q935 HydrophobicContact CZ-CG 4.45Å; F926-V937 HydrophobicContact CB-CG2 3.19Å; F926-V937 HydrophobicContact CD1-CB 4.46Å; F926-V937 HydrophobicContact CD1-CG2 3.25Å; F926-V937 HydrophobicContact CD2-CG2 3.59Å; F926-V937 HydrophobicContact CE1-CG2 3.9Å; F926-V937 HydrophobicContact CE2-CG2 4.21Å; F926-V937 HydrophobicContact CG-CB 4.47Å; F926-V937 HydrophobicContact CG-CG2 3.04Å; F926-V937 HydrophobicContact CZ-CG2 4.34Å; F926-F1006 HydrophobicContact CB-CE2 3.95Å; F926-F1006 HydrophobicContact CB-CZ 3.86Å; F926-F1006 HydrophobicContact CD2-CE2 4.34Å; F926-F1006 HydrophobicContact CD2-CZ 4.2Å; F926-L1027 HydrophobicContact CE2-CD1 3.59Å; F926-L1027 HydrophobicContact CZ-CD1 3.65Å; F926-L1027 HydrophobicContact CZ-CD2 3.81Å; F926-L1027 HydrophobicContact CZ-CG 4.4Å
927	A	91.1	Very high	90.1	Very high	4 Å²	4	25.6 Å²	25.6	3%	0.033	14%	0.136	C	C	.	.	H	α-helix	trans	-57.5	-33.9	176.3	0	0	0	0	0	111.8	Q923 F924 L929 S930 G931 F932	Q923-A927 WeakPolarHBondContact O-CB 3.34Å; Q923-A927 PolarHBondContact O-N 3.32Å; F924-A927 WeakPolarHBondContact O-CB 3.02Å; F924-A927 PolarHBondContact O-N 3.01Å; A927-L929 VanDerWaalsContact C-N 3.3Å; A927-L929 PolarHBondContact O-N 3.43Å; A927-S930 WeakPolarHBondContact CA-OG 3.38Å; A927-S930 PolarHBondContact O-N 3.18Å; A927-G931 PolarHBondContact O-N 2.8Å; A927-F932 HydrophobicContact CB-CD1 4.01Å; A927-F932 HydrophobicContact CB-CE1 4.49Å; A927-F932 WeakPolarHBondContact O-CA 3.36Å; A927-F932 PolarHBondContact O-N 3.27Å
928	I	91.8	Very high	90.1	Very high	74 Å²	74	25.1 Å²	25.1	38%	0.379	13%	0.133	S	C	.	.	H	α-helix	trans	-62.2	-38.6	174.6	-60.7	171.4	0	0	0	111.2	F924 W925 F926 F932	F924-I928 HydrophobicContact CE1-CD1 4.15Å; F924-I928 PolarHBondContact O-N 2.89Å; W925-I928 HydrophobicContact CE3-CD1 3.93Å; W925-I928 HydrophobicContact CZ3-CD1 4.29Å; W925-I928 PolarHBondContact O-N 3.24Å; F926-I928 PolarHBondContact O-N 2.9Å; I928-F932 HydrophobicContact CB-CZ 4.44Å; I928-F932 HydrophobicContact CG1-CE1 4.09Å; I928-F932 HydrophobicContact CG1-CZ 3.99Å
929	L	90.8	Very high	89.9	Confident	85 Å²	85	25.5 Å²	25.5	45%	0.445	13%	0.134	S	C	.	.	H	α-helix	trans	-80.1	-34.3	-179.4	-58.2	179.1	0	0	0	112.8	F926 A927 G931 F1006 W1007 L1010	F926-L929 WeakPolarHBondContact O-CA 3.46Å; F926-L929 PolarHBondContact O-N 3.22Å; A927-L929 VanDerWaalsContact C-N 3.3Å; A927-L929 PolarHBondContact O-N 3.43Å; L929-G931 VanDerWaalsContact C-N 3.27Å; L929-G931 PolarHBondContact O-N 3.4Å; L929-F1006 HydrophobicContact CD1-CE1 3.89Å; L929-F1006 HydrophobicContact CD1-CZ 3.69Å; L929-W1007 HydrophobicContact CD2-CH2 4.21Å; L929-L1010 HydrophobicContact CD1-CD1 4.02Å; L929-L1010 HydrophobicContact CD1-CD2 3.43Å; L929-L1010 VanDerWaalsContact CD1-CD2 3.43Å; L929-L1010 HydrophobicContact CD1-CG 4.38Å
930	S	89	Confident	89.8	Confident	27 Å²	27	29.6 Å²	29.6	19%	0.189	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	11.2	-177.3	68.4	0	0	0	0	114	F926 A927 S933	F926-S930 PolarHBondContact O-N 3.18Å; F926-S930 PolarHBondContact O-OG 3.35Å; A927-S930 WeakPolarHBondContact CA-OG 3.38Å; A927-S930 PolarHBondContact O-N 3.18Å; S930-S933 WeakPolarHBondContact O-CB 3.36Å; S930-S933 PolarHBondContact O-OG 3.43Å; S930-S933 PolarHBondContact OG-OG 3.37Å
931	G	86.8	Confident	89.7	Confident	4 Å²	4	32.1 Å²	32.1	4%	0.041	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.4	28	179.3	0	0	0	0	0	114.2	A927 L929 S933	A927-G931 PolarHBondContact O-N 2.8Å; L929-G931 VanDerWaalsContact C-N 3.27Å; L929-G931 PolarHBondContact O-N 3.4Å; G931-S933 PolarHBondContact O-N 2.82Å
932	F	88.6	Confident	89.6	Confident	28 Å²	28	31.3 Å²	31.3	12%	0.123	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	28.3	-177.6	-54.6	-84.6	0	0	0	114.1	F306 T307 A310 N311 A927 I928 G934	F306-F932 HydrophobicContact CE1-CE1 4.22Å; F306-F932 HydrophobicContact CE1-CZ 4.42Å; T307-F932 HydrophobicContact CG2-CD1 3.96Å; T307-F932 HydrophobicContact CG2-CE1 4.29Å; A310-F932 HydrophobicContact CB-CB 4.48Å; A310-F932 HydrophobicContact CB-CD1 3.9Å; A310-F932 HydrophobicContact CB-CD2 3.48Å; A310-F932 VanDerWaalsContact CB-CD2 3.48Å; A310-F932 HydrophobicContact CB-CE1 3.91Å; A310-F932 HydrophobicContact CB-CE2 3.51Å; A310-F932 HydrophobicContact CB-CG 3.68Å; A310-F932 HydrophobicContact CB-CZ 3.71Å; N311-F932 HydrophobicContact CB-CB 3.81Å; N311-F932 PolarHBondContact ND2-O 2.73Å; A927-F932 HydrophobicContact CB-CD1 4.01Å; A927-F932 HydrophobicContact CB-CE1 4.49Å; A927-F932 WeakPolarHBondContact O-CA 3.36Å; A927-F932 PolarHBondContact O-N 3.27Å; I928-F932 HydrophobicContact CB-CZ 4.44Å; I928-F932 HydrophobicContact CG1-CE1 4.09Å; I928-F932 HydrophobicContact CG1-CZ 3.99Å; F932-G934 PolarHBondContact O-N 3.19Å
933	S	84	Confident	89.2	Confident	67 Å²	67	31.6 Å²	31.6	47%	0.469	16%	0.157	S	C	.	.			trans	-65.3	-14.1	-178.9	52.4	0	0	0	0	115.3	S930 G931 Q935	S930-S933 WeakPolarHBondContact O-CB 3.36Å; S930-S933 PolarHBondContact O-OG 3.43Å; S930-S933 PolarHBondContact OG-OG 3.37Å; G931-S933 PolarHBondContact O-N 2.82Å; S933-Q935 VanDerWaalsContact C-N 3.32Å
934	G	83.2	Confident	88.7	Confident	5 Å²	5	32 Å²	32	5%	0.052	16%	0.162	C	C	.	.			trans	81.9	7.1	-173.1	0	0	0	0	0	114.4	P90 F932	P90-G934 WeakPolarHBondContact CB-O 3.39Å; F932-G934 PolarHBondContact O-N 3.19Å
935	Q	88.1	Confident	88.4	Confident	101 Å²	101	32.2 Å²	32.2	47%	0.472	16%	0.163	S	C	.	.			trans	-65.7	133.7	176.5	-177.9	60.4	33.7	0	0	111.8	F926 S933	F926-Q935 WeakPolarHBondContact CD1-O 3.41Å; F926-Q935 HydrophobicContact CE1-CB 4.09Å; F926-Q935 HydrophobicContact CE1-CG 3.94Å; F926-Q935 WeakPolarHBondContact CE1-O 3.33Å; F926-Q935 HydrophobicContact CZ-CG 4.45Å; S933-Q935 VanDerWaalsContact C-N 3.32Å
936	I	90.8	Very high	88	Confident	17 Å²	17	30 Å²	30	9%	0.087	16%	0.155	C	C	.	.			trans	-83.2	142.4	174.7	56	178.9	0	0	0	111.8	P90 T91 L347 F938 I943	P90-I936 HydrophobicContact CB-CG2 4.23Å; P90-I936 WeakPolarHBondContact O-CD1 3Å; T91-I936 HydrophobicContact CG2-CG2 4.21Å; L347-I936 HydrophobicContact CD1-CG2 3.52Å; I936-F938 WeakPolarHBondContact CD1-O 3.5Å; I936-F938 VanDerWaalsContact CG1-O 3.32Å; I936-F938 WeakPolarHBondContact CG1-O 3.38Å; I936-I943 HydrophobicContact CB-CD1 4.14Å; I936-I943 HydrophobicContact CD1-CD1 4.23Å; I936-I943 HydrophobicContact CG2-CD1 4.04Å
937	V	91.7	Very high	87.4	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.152	C	C	.	.	S	Bend	trans	-76.3	-38.7	172.2	177.1	0	0	0	0	111.7	F926	F926-V937 HydrophobicContact CB-CG2 3.19Å; F926-V937 HydrophobicContact CD1-CB 4.46Å; F926-V937 HydrophobicContact CD1-CG2 3.25Å; F926-V937 HydrophobicContact CD2-CG2 3.59Å; F926-V937 HydrophobicContact CE1-CG2 3.9Å; F926-V937 HydrophobicContact CE2-CG2 4.21Å; F926-V937 HydrophobicContact CG-CB 4.47Å; F926-V937 HydrophobicContact CG-CG2 3.04Å; F926-V937 HydrophobicContact CZ-CG2 4.34Å
938	F	91.2	Very high	86.7	Confident	2 Å²	2	30.8 Å²	30.8	1%	0.009	16%	0.161	C	C	.	.	S	Bend	trans	-99.6	160.2	-173.9	-48.9	-62	0	0	0	110.1	L919 I922 Q923 I936 I943 G1031 V1034 Y1035	L919-F938 HydrophobicContact CD1-CD2 4.18Å; L919-F938 HydrophobicContact CD1-CE2 3.53Å; L919-F938 HydrophobicContact CD1-CZ 3.76Å; L919-F938 HydrophobicContact CG-CE2 4.15Å; I922-F938 HydrophobicContact CB-CE2 4.45Å; I922-F938 HydrophobicContact CB-CZ 4.32Å; I922-F938 HydrophobicContact CD1-CZ 4.43Å; I922-F938 HydrophobicContact CG2-CE2 4.24Å; I922-F938 HydrophobicContact CG2-CZ 3.83Å; Q923-F938 HydrophobicContact CG-CE2 4.43Å; I936-F938 WeakPolarHBondContact CD1-O 3.5Å; I936-F938 VanDerWaalsContact CG1-O 3.32Å; I936-F938 WeakPolarHBondContact CG1-O 3.38Å; F938-I943 HydrophobicContact CB-CD1 3.98Å; F938-I943 HydrophobicContact CB-CG1 3.69Å; F938-I943 HydrophobicContact CD2-CD1 4.42Å; F938-I943 HydrophobicContact CD2-CG1 4.15Å; F938-I943 HydrophobicContact CG-CG1 4.39Å; F938-G1031 WeakPolarHBondContact CD1-O 3.28Å; F938-G1031 WeakPolarHBondContact CE1-O 3.38Å; F938-V1034 HydrophobicContact CE1-CB 4.17Å; F938-V1034 HydrophobicContact CE1-CG1 3.94Å; F938-V1034 HydrophobicContact CZ-CG1 4.01Å; F938-Y1035 HydrophobicContact CB-CD2 4.35Å; F938-Y1035 AromaticContact CD1-CD2 3.68Å; F938-Y1035 HydrophobicContact CD1-CD2 3.68Å; F938-Y1035 HydrophobicContact CD1-CG 4.22Å; F938-Y1035 HydrophobicContact CD2-CD2 4.37Å; F938-Y1035 AromaticContact CE1-CD2 3.98Å; F938-Y1035 HydrophobicContact CE1-CD2 3.98Å; F938-Y1035 HydrophobicContact CE1-CG 4.38Å; F938-Y1035 AromaticContact CG-CD2 3.88Å; F938-Y1035 HydrophobicContact CG-CD2 3.88Å; F938-Y1035 HydrophobicContact CZ-CD2 4.44Å
939	E	90	Very high	86.2	Confident	8 Å²	8	30.9 Å²	30.9	4%	0.037	16%	0.162	C	C	.	.			trans	-71.2	147.3	173.5	-167.5	-80.2	154.8	0	0	111.4	W941 S942 I943 Y1075 M1088	E939-W941 PolarHBondContact O-N 2.85Å; E939-W941 PolarHBondContact OE1-N 3.49Å; E939-W941 WeakPolarHBondContact OE2-CA 3.42Å; E939-W941 WeakPolarHBondContact OE2-CB 3.48Å; E939-W941 PolarHBondContact OE2-N 3.3Å; E939-S942 WeakPolarHBondContact O-CB 3.44Å; E939-S942 PolarHBondContact O-N 3.47Å; E939-S942 VanDerWaalsContact O-N 3.11Å; E939-S942 PolarHBondContact OE2-N 2.81Å; E939-I943 PolarHBondContact O-N 3.43Å; E939-Y1075 PolarHBondContact OE1-OH 2.96Å; E939-M1088 HydrophobicContact CB-CE 3.65Å; E939-M1088 HydrophobicContact CB-CG 4.37Å; E939-M1088 HydrophobicContact CB-SD 3.99Å; E939-M1088 HydrophobicContact CG-CE 3.88Å; E939-M1088 HydrophobicContact CG-CG 3.78Å; E939-M1088 HydrophobicContact CG-SD 4.08Å
940	R	88.1	Confident	86.1	Confident	85 Å²	85	26.9 Å²	26.9	32%	0.321	14%	0.141	S	C	.	.	H	α-helix	trans	-53.7	-44.1	-172.8	51.1	176.1	174	-170.9	-5	114.4	T91 T95 G944	T91-R940 WeakPolarHBondContact O-CB 3.47Å; T95-R940 HydrophobicContact CG2-CB 4.23Å; T95-R940 WeakPolarHBondContact CG2-O 3.46Å; R940-G944 PolarHBondContact O-N 3.32Å; R940-G944 VanDerWaalsContact O-N 3.16Å
941	W	86.1	Confident	85.9	Confident	55 Å²	55	25.6 Å²	25.6	21%	0.208	13%	0.132	C	C	.	.	H	α-helix	trans	-76.7	-34	177.9	-72.5	100.6	0	0	0	111.9	V98 E939 I943 G944 L945 L1084	V98-W941 HydrophobicContact CG2-CH2 4.37Å; E939-W941 PolarHBondContact O-N 2.85Å; E939-W941 PolarHBondContact OE1-N 3.49Å; E939-W941 WeakPolarHBondContact OE2-CA 3.42Å; E939-W941 WeakPolarHBondContact OE2-CB 3.48Å; E939-W941 PolarHBondContact OE2-N 3.3Å; W941-I943 PolarHBondContact O-N 2.79Å; W941-G944 PolarHBondContact O-N 3.17Å; W941-L945 HydrophobicContact CB-CD1 4.44Å; W941-L945 HydrophobicContact CE3-CG 4.42Å; W941-L945 VanDerWaalsContact O-CB 3.28Å; W941-L945 WeakPolarHBondContact O-CB 3.15Å; W941-L945 VanDerWaalsContact O-CG 3.24Å; W941-L945 WeakPolarHBondContact O-CG 3.4Å; W941-L945 PolarHBondContact O-N 2.8Å; W941-L1084 HydrophobicContact CZ2-CD2 4.46Å
942	S	87.8	Confident	85.7	Confident	1 Å²	1	26.6 Å²	26.6	1%	0.007	14%	0.139	C	C	.	.	H	α-helix	trans	-57.5	-40.2	172.3	-58.5	0	0	0	0	111.3	E939 Y946 Y1035	E939-S942 WeakPolarHBondContact O-CB 3.44Å; E939-S942 PolarHBondContact O-N 3.47Å; E939-S942 VanDerWaalsContact O-N 3.11Å; E939-S942 PolarHBondContact OE2-N 2.81Å; S942-Y946 PolarHBondContact O-N 3.24Å; S942-Y1035 WeakPolarHBondContact O-CE2 3.42Å; S942-Y1035 PolarHBondContact O-OH 3.42Å
943	I	85.4	Confident	85.5	Confident	6 Å²	6	26.7 Å²	26.7	3%	0.031	15%	0.145	C	C	.	.	H	α-helix	trans	-66.9	-50.3	173.6	-65.7	169.8	0	0	0	111.7	T91 Y920 I936 F938 E939 W941 L945 Y946	T91-I943 HydrophobicContact CG2-CD1 4.36Å; Y920-I943 HydrophobicContact CE1-CG2 3.57Å; Y920-I943 PolarHBondContact OH-O 3.41Å; I936-I943 HydrophobicContact CB-CD1 4.14Å; I936-I943 HydrophobicContact CD1-CD1 4.23Å; I936-I943 HydrophobicContact CG2-CD1 4.04Å; F938-I943 HydrophobicContact CB-CD1 3.98Å; F938-I943 HydrophobicContact CB-CG1 3.69Å; F938-I943 HydrophobicContact CD2-CD1 4.42Å; F938-I943 HydrophobicContact CD2-CG1 4.15Å; F938-I943 HydrophobicContact CG-CG1 4.39Å; E939-I943 PolarHBondContact O-N 3.43Å; W941-I943 PolarHBondContact O-N 2.79Å; I943-L945 VanDerWaalsContact C-N 3.33Å; I943-L945 PolarHBondContact O-N 3.03Å; I943-Y946 WeakPolarHBondContact O-CB 3.39Å; I943-Y946 PolarHBondContact O-N 3.05Å
944	G	79.9	Confident	85.6	Confident	11 Å²	11	23.5 Å²	23.5	11%	0.113	12%	0.123	C	C	.	.	H	α-helix	trans	-63.6	-36	-176.2	0	0	0	0	0	113.6	R940 W941	R940-G944 PolarHBondContact O-N 3.32Å; R940-G944 VanDerWaalsContact O-N 3.16Å; W941-G944 PolarHBondContact O-N 3.17Å
945	L	85.1	Confident	85.6	Confident	27 Å²	27	23.2 Å²	23.2	14%	0.141	12%	0.12	C	C	.	.	H	α-helix	trans	-86.5	-10.8	-176.9	-61.6	177.9	0	0	0	113.7	W941 I943 N947 V948 I949 F950 F1071	W941-L945 HydrophobicContact CB-CD1 4.44Å; W941-L945 HydrophobicContact CE3-CG 4.42Å; W941-L945 VanDerWaalsContact O-CB 3.28Å; W941-L945 WeakPolarHBondContact O-CB 3.15Å; W941-L945 VanDerWaalsContact O-CG 3.24Å; W941-L945 WeakPolarHBondContact O-CG 3.4Å; W941-L945 PolarHBondContact O-N 2.8Å; I943-L945 VanDerWaalsContact C-N 3.33Å; I943-L945 PolarHBondContact O-N 3.03Å; L945-N947 VanDerWaalsContact C-N 3.31Å; L945-N947 PolarHBondContact O-N 3.39Å; L945-V948 PolarHBondContact O-N 3.3Å; L945-I949 HydrophobicContact CB-CD1 4.41Å; L945-I949 HydrophobicContact CD1-CD1 4.21Å; L945-I949 HydrophobicContact CD2-CD1 3.8Å; L945-I949 HydrophobicContact CD2-CG1 4.29Å; L945-I949 HydrophobicContact CG-CD1 4.35Å; L945-I949 PolarHBondContact O-N 2.83Å; L945-F950 HydrophobicContact CB-CD2 4.25Å; L945-F950 HydrophobicContact CB-CE2 3.69Å; L945-F950 HydrophobicContact CB-CZ 4.18Å; L945-F950 HydrophobicContact CD1-CZ 4.49Å; L945-F950 PolarHBondContact O-N 2.8Å; L945-F1071 HydrophobicContact CD1-CE2 3.99Å; L945-F1071 HydrophobicContact CD1-CZ 4.24Å
946	Y	85.6	Confident	85.3	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.117	C	C	.	.	I	π-helix	trans	-50.3	-49.8	179.2	178.1	-110.9	0	0	0	112.8	K915 L919 S942 I943 T951 Y1035 V1038 V1039	K915-Y946 HydrophobicContact CG-CE1 4.29Å; K915-Y946 PolarHBondContact O-OH 3.11Å; K915-Y946 VanDerWaalsContact O-OH 3.14Å; L919-Y946 HydrophobicContact CB-CD1 4.49Å; L919-Y946 HydrophobicContact CB-CE1 4.05Å; L919-Y946 HydrophobicContact CD2-CD1 3.51Å; L919-Y946 HydrophobicContact CD2-CD2 3.78Å; L919-Y946 HydrophobicContact CD2-CE1 3.91Å; L919-Y946 HydrophobicContact CD2-CE2 4.14Å; L919-Y946 HydrophobicContact CD2-CG 3.43Å; L919-Y946 VanDerWaalsContact CD2-CG 3.43Å; S942-Y946 PolarHBondContact O-N 3.24Å; I943-Y946 WeakPolarHBondContact O-CB 3.39Å; I943-Y946 PolarHBondContact O-N 3.05Å; Y946-T951 HydrophobicContact CD2-CG2 3.86Å; Y946-T951 HydrophobicContact CE2-CG2 3.39Å; Y946-T951 PolarHBondContact O-N 2.98Å; Y946-T951 PolarHBondContact O-OG1 2.98Å; Y946-Y1035 WeakPolarHBondContact CA-OH 3.23Å; Y946-Y1035 VanDerWaalsContact CB-OH 3.29Å; Y946-Y1035 WeakPolarHBondContact CB-OH 3.49Å; Y946-Y1035 HydrophobicContact CD2-CE2 4.33Å; Y946-Y1035 AromaticContact CD2-CZ 3.88Å; Y946-Y1035 WeakPolarHBondContact CD2-OH 3.49Å; Y946-V1038 HydrophobicContact CE2-CG1 4.31Å; Y946-V1039 HydrophobicContact CE2-CG2 4.47Å
947	N	80.4	Confident	84.9	Confident	5 Å²	5	21.6 Å²	21.6	3%	0.027	11%	0.114	C	C	.	.	I	π-helix	trans	-82.2	-20.9	-175.1	-80.2	-46.1	0	0	0	114.5	S355 K915 N916 L945	S355-N947 PolarHBondContact OG-O 3.16Å; K915-N947 PolarHBondContact NZ-OD1 2.99Å; N916-N947 PolarHBondContact ND2-OD1 3.08Å; N916-N947 VanDerWaalsContact OD1-CG 3.24Å; N916-N947 PolarHBondContact OD1-ND2 3.33Å; N916-N947 PolarHBondContact OD1-OD1 2.99Å; L945-N947 VanDerWaalsContact C-N 3.31Å; L945-N947 PolarHBondContact O-N 3.39Å
948	V	76.4	Confident	84.6	Confident	38 Å²	38	21.6 Å²	21.6	23%	0.23	11%	0.114	C	C	.	.	I	π-helix	trans	-100.1	-38.1	-171.3	-178.9	0	0	0	0	111.6	P99 I102 L945 A952	P99-V948 HydrophobicContact CB-CG2 3.91Å; P99-V948 HydrophobicContact CG-CG2 4.28Å; I102-V948 HydrophobicContact CD1-CG1 4.43Å; L945-V948 PolarHBondContact O-N 3.3Å; V948-A952 WeakPolarHBondContact O-CB 3.34Å
949	I	82.2	Confident	84.1	Confident	77 Å²	77	21.5 Å²	21.5	40%	0.395	11%	0.114	S	C	.	.	I	π-helix	trans	-114	-67.3	-175.2	-58.7	-175.2	0	0	0	109.9	L945 T951 C1067	L945-I949 HydrophobicContact CB-CD1 4.41Å; L945-I949 HydrophobicContact CD1-CD1 4.21Å; L945-I949 HydrophobicContact CD2-CD1 3.8Å; L945-I949 HydrophobicContact CD2-CG1 4.29Å; L945-I949 HydrophobicContact CG-CD1 4.35Å; L945-I949 PolarHBondContact O-N 2.83Å; I949-T951 VanDerWaalsContact C-N 3.33Å; I949-T951 PolarHBondContact O-N 3.19Å; I949-C1067 VanDerWaalsContact CG2-SG 3.58Å
950	F	87.1	Confident	83.6	Confident	1 Å²	1	21.5 Å²	21.5	0%	0.004	11%	0.114	C	C	.	.	I	π-helix	trans	-68.6	-28.7	-164.1	-51.8	-51.1	0	0	0	113.9	L945 Y1035 S1064 W1068 F1071	L945-F950 HydrophobicContact CB-CD2 4.25Å; L945-F950 HydrophobicContact CB-CE2 3.69Å; L945-F950 HydrophobicContact CB-CZ 4.18Å; L945-F950 HydrophobicContact CD1-CZ 4.49Å; L945-F950 PolarHBondContact O-N 2.8Å; F950-Y1035 HydrophobicContact CD2-CE1 4.2Å; F950-Y1035 VanDerWaalsContact CD2-OH 3.23Å; F950-Y1035 WeakPolarHBondContact CD2-OH 3.44Å; F950-S1064 WeakPolarHBondContact O-CB 3.08Å; F950-S1064 PolarHBondContact O-OG 3.27Å; F950-W1068 HydrophobicContact CD1-CB 4.29Å; F950-W1068 HydrophobicContact CD1-CE3 4.31Å; F950-W1068 HydrophobicContact CD2-CE3 4.08Å; F950-W1068 HydrophobicContact CE1-CE3 4.11Å; F950-W1068 AromaticContact CE2-CE3 3.85Å; F950-W1068 HydrophobicContact CE2-CE3 3.85Å; F950-W1068 AromaticContact CE2-CZ3 3.99Å; F950-W1068 HydrophobicContact CE2-CZ3 3.99Å; F950-W1068 HydrophobicContact CG-CE3 4.3Å; F950-W1068 AromaticContact CZ-CE3 3.88Å; F950-W1068 HydrophobicContact CZ-CE3 3.88Å; F950-W1068 HydrophobicContact CZ-CZ3 4.18Å; F950-F1071 HydrophobicContact CE1-CB 3.68Å; F950-F1071 HydrophobicContact CE1-CD1 4.24Å; F950-F1071 HydrophobicContact CE1-CD2 4.25Å; F950-F1071 AromaticContact CE1-CG 3.81Å; F950-F1071 HydrophobicContact CE1-CG 3.81Å; F950-F1071 HydrophobicContact CE2-CD1 4.39Å; F950-F1071 HydrophobicContact CZ-CB 3.89Å; F950-F1071 AromaticContact CZ-CD1 3.56Å; F950-F1071 HydrophobicContact CZ-CD1 3.56Å; F950-F1071 AromaticContact CZ-CD2 3.84Å; F950-F1071 HydrophobicContact CZ-CD2 3.84Å; F950-F1071 AromaticContact CZ-CE1 3.99Å; F950-F1071 HydrophobicContact CZ-CE1 3.99Å; F950-F1071 HydrophobicContact CZ-CE2 4.24Å; F950-F1071 AromaticContact CZ-CG 3.47Å; F950-F1071 HydrophobicContact CZ-CG 3.47Å; F950-F1071 VanDerWaalsContact CZ-CG 3.47Å; F950-F1071 HydrophobicContact CZ-CZ 4.3Å
951	T	86.2	Confident	83.3	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.6	19.6	-178.8	68.2	0	0	0	0	114.4	K915 Y946 I949 P955 V1042	K915-T951 PolarHBondContact NZ-OG1 3.26Å; Y946-T951 HydrophobicContact CD2-CG2 3.86Å; Y946-T951 HydrophobicContact CE2-CG2 3.39Å; Y946-T951 PolarHBondContact O-N 2.98Å; Y946-T951 PolarHBondContact O-OG1 2.98Å; I949-T951 VanDerWaalsContact C-N 3.33Å; I949-T951 PolarHBondContact O-N 3.19Å; T951-P955 WeakPolarHBondContact O-CD 3.35Å; T951-P955 WeakPolarHBondContact O-CG 3.3Å; T951-V1042 HydrophobicContact CG2-CG2 3.89Å
952	A	81.7	Confident	83.2	Confident	24 Å²	24	16.7 Å²	16.7	20%	0.198	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-34.9	178.6	0	0	0	0	0	113.2	V948 P955	V948-A952 WeakPolarHBondContact O-CB 3.34Å; A952-P955 VanDerWaalsContact O-CD 3.32Å; A952-P955 WeakPolarHBondContact O-CD 3.38Å; A952-P955 WeakPolarHBondContact O-CG 3.47Å
953	A	85.2	Confident	82.7	Confident	30 Å²	30	22.8 Å²	22.8	25%	0.248	12%	0.12	C	C	.	.	H	α-helix	trans	-69.2	-43.6	-176.9	0	0	0	0	0	114.3	M956 A957 A1060	A953-M956 PolarHBondContact O-N 3.29Å; A953-A957 PolarHBondContact O-N 3.12Å; A953-A1060 HydrophobicContact CB-CB 3.9Å
954	P	85.7	Confident	82.2	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-58.9	-47.8	-179.7	-23.9	33.7	0	0	0	115.5	Y911 M956 A957 L958 A1046 S1064	Y911-P954 HydrophobicContact CE1-CB 4.34Å; P954-M956 VanDerWaalsContact C-N 3.28Å; P954-M956 PolarHBondContact O-N 3.14Å; P954-A957 PolarHBondContact O-N 3.33Å; P954-L958 PolarHBondContact O-N 2.85Å; P954-A1046 HydrophobicContact CB-CB 3.74Å; P954-S1064 WeakPolarHBondContact CD-OG 3.47Å
955	P	83.6	Confident	82.3	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-63.5	-35.7	176.3	19.8	-25.9	0	0	0	112.2	M359 L908 Y911 T951 A952 L958 G959	M359-P955 HydrophobicContact CE-CG 4.31Å; M359-P955 HydrophobicContact SD-CB 4.22Å; M359-P955 HydrophobicContact SD-CG 3.75Å; L908-P955 WeakPolarHBondContact CD1-O 3.35Å; L908-P955 HydrophobicContact CG-CB 4.15Å; Y911-P955 HydrophobicContact CD1-CB 3.92Å; Y911-P955 HydrophobicContact CD1-CG 4.37Å; Y911-P955 HydrophobicContact CE1-CB 4.27Å; Y911-P955 HydrophobicContact CE1-CG 4.27Å; T951-P955 WeakPolarHBondContact O-CD 3.35Å; T951-P955 WeakPolarHBondContact O-CG 3.3Å; A952-P955 VanDerWaalsContact O-CD 3.32Å; A952-P955 WeakPolarHBondContact O-CD 3.38Å; A952-P955 WeakPolarHBondContact O-CG 3.47Å; P955-L958 PolarHBondContact O-N 3.38Å; P955-G959 PolarHBondContact O-N 2.97Å
956	M	80.9	Confident	82.3	Confident	80 Å²	80	23.2 Å²	23.2	39%	0.394	12%	0.124	S	C	.	.	H	α-helix	trans	-65.7	-43	176.1	-173.2	170.7	65.4	0	0	111.4	V363 A953 P954 G959 L960	V363-M956 HydrophobicContact CG2-CG 4.37Å; A953-M956 PolarHBondContact O-N 3.29Å; P954-M956 VanDerWaalsContact C-N 3.28Å; P954-M956 PolarHBondContact O-N 3.14Å; M956-G959 PolarHBondContact O-N 3.45Å; M956-G959 VanDerWaalsContact O-N 3.17Å; M956-L960 HydrophobicContact CG-CD1 3.79Å; M956-L960 HydrophobicContact CG-CG 4.46Å; M956-L960 WeakPolarHBondContact O-CB 3.42Å; M956-L960 WeakPolarHBondContact O-CG 3.36Å; M956-L960 PolarHBondContact O-N 3.29Å
957	A	83.1	Confident	82.3	Confident	4 Å²	4	25.1 Å²	25.1	3%	0.033	14%	0.136	C	C	.	.	H	α-helix	trans	-63.6	-40.9	175.7	0	0	0	0	0	112.5	A953 P954 G959 L960 F961 A1060	A953-A957 PolarHBondContact O-N 3.12Å; P954-A957 PolarHBondContact O-N 3.33Å; A957-G959 VanDerWaalsContact C-N 3.31Å; A957-G959 PolarHBondContact O-N 3.16Å; A957-L960 PolarHBondContact O-N 3.26Å; A957-F961 HydrophobicContact CB-CD2 4.26Å; A957-F961 PolarHBondContact O-N 3.45Å; A957-A1060 HydrophobicContact CB-CB 3.64Å
958	L	84.2	Confident	82.6	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-60.5	-40.6	171.6	-77	169.7	0	0	0	111.9	Y911 P954 P955 D962 A1046 E1049 H1050	Y911-L958 HydrophobicContact CD1-CD1 4.41Å; Y911-L958 HydrophobicContact CD2-CD1 4.4Å; Y911-L958 HydrophobicContact CG-CD1 4.1Å; P954-L958 PolarHBondContact O-N 2.85Å; P955-L958 PolarHBondContact O-N 3.38Å; L958-D962 VanDerWaalsContact O-CB 3.3Å; L958-D962 WeakPolarHBondContact O-CB 3.43Å; L958-A1046 HydrophobicContact CD1-CB 4.34Å; L958-E1049 HydrophobicContact CD2-CB 4.38Å; L958-H1050 HydrophobicContact CD2-CB 4.41Å; L958-H1050 WeakPolarHBondContact CD2-CD2 3.15Å; L958-H1050 WeakPolarHBondContact CD2-NE2 3.26Å
959	G	82.4	Confident	83.1	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-71.6	-23.4	180	0	0	0	0	0	115	V363 Q367 R904 P955 M956 A957	V363-G959 WeakPolarHBondContact CG1-O 3.41Å; Q367-G959 PolarHBondContact NE2-O 2.86Å; R904-G959 WeakPolarHBondContact CB-O 3.35Å; R904-G959 WeakPolarHBondContact CD-O 3.31Å; P955-G959 PolarHBondContact O-N 2.97Å; M956-G959 PolarHBondContact O-N 3.45Å; M956-G959 VanDerWaalsContact O-N 3.17Å; A957-G959 VanDerWaalsContact C-N 3.31Å; A957-G959 PolarHBondContact O-N 3.16Å
960	L	78.3	Confident	83.3	Confident	8 Å²	8	26.5 Å²	26.5	4%	0.042	14%	0.143	C	C	.	.	H	α-helix	trans	-108.5	-45.9	-174.1	-65.5	176.3	0	0	0	113.4	V363 I366 Q367 R904 M956 A957	V363-L960 HydrophobicContact CB-CD2 4.39Å; V363-L960 HydrophobicContact CG1-CD2 4.07Å; V363-L960 HydrophobicContact CG2-CD2 4.29Å; V363-L960 HydrophobicContact CG2-CG 4.3Å; I366-L960 HydrophobicContact CB-CD2 3.68Å; I366-L960 HydrophobicContact CD1-CD1 3.85Å; I366-L960 HydrophobicContact CD1-CD2 4.25Å; I366-L960 HydrophobicContact CG2-CD1 4.32Å; I366-L960 HydrophobicContact CG2-CD2 3.56Å; Q367-L960 HydrophobicContact CG-CD2 4.46Å; R904-L960 VanDerWaalsContact CZ-O 3.24Å; R904-L960 PolarHBondContact NE-O 2.94Å; R904-L960 PolarHBondContact NH2-O 3.47Å; M956-L960 HydrophobicContact CG-CD1 3.79Å; M956-L960 HydrophobicContact CG-CG 4.46Å; M956-L960 WeakPolarHBondContact O-CB 3.42Å; M956-L960 WeakPolarHBondContact O-CG 3.36Å; M956-L960 PolarHBondContact O-N 3.29Å; A957-L960 PolarHBondContact O-N 3.26Å
961	F	82.1	Confident	83.4	Confident	37 Å²	37	28.7 Å²	28.7	16%	0.162	15%	0.154	C	C	.	.	H	α-helix	trans	-109	-9	-164.2	-53.4	-59.5	0	0	0	114.3	Y370 L410 A957 T1054 L1056	Y370-F961 WeakPolarHBondContact OH-CE1 3.47Å; L410-F961 HydrophobicContact CD1-CZ 4.23Å; A957-F961 HydrophobicContact CB-CD2 4.26Å; A957-F961 PolarHBondContact O-N 3.45Å; F961-T1054 HydrophobicContact CB-CG2 4.19Å; F961-L1056 HydrophobicContact CD1-CD1 4.07Å; F961-L1056 HydrophobicContact CD2-CB 3.88Å; F961-L1056 HydrophobicContact CD2-CD1 4.14Å; F961-L1056 HydrophobicContact CE1-CD1 3.57Å; F961-L1056 HydrophobicContact CE2-CB 3.86Å; F961-L1056 HydrophobicContact CE2-CD1 3.66Å; F961-L1056 HydrophobicContact CE2-CG 4.31Å; F961-L1056 HydrophobicContact CG-CB 4.49Å; F961-L1056 HydrophobicContact CG-CD1 4.34Å; F961-L1056 HydrophobicContact CZ-CB 4.46Å; F961-L1056 HydrophobicContact CZ-CD1 3.37Å; F961-L1056 HydrophobicContact CZ-CG 4.45Å
962	D	83.2	Confident	83.4	Confident	2 Å²	2	33.8 Å²	33.8	1%	0.011	18%	0.176	C	C	.	.			trans	-68.3	142.2	179.8	-164.1	31.7	0	0	0	111.1	R904 K907 L958 T1051 A1052	R904-D962 HydrophobicContact CG-CB 4.44Å; R904-D962 PolarHBondContact NE-O 3.28Å; R904-D962 PolarHBondContact NH2-O 3.32Å; R904-D962 VanDerWaalsContact NH2-O 3.1Å; K907-D962 WeakPolarHBondContact CD-OD2 3.37Å; K907-D962 WeakPolarHBondContact CE-OD2 3.29Å; K907-D962 IonicContact NZ-OD2 2.76Å; K907-D962 PolarHBondContact NZ-OD2 3.32Å; L958-D962 VanDerWaalsContact O-CB 3.3Å; L958-D962 WeakPolarHBondContact O-CB 3.43Å; D962-T1051 PolarHBondContact OD1-N 3.19Å; D962-T1051 PolarHBondContact OD1-OG1 3.37Å; D962-T1051 PolarHBondContact OD2-OG1 2.88Å; D962-A1052 PolarHBondContact OD1-N 3.27Å
963	R	77.5	Confident	83.8	Confident	128 Å²	128	33.4 Å²	33.4	48%	0.483	17%	0.17	S	C	.	.			trans	-138.4	124.7	179.5	-64.5	-176.6	-63.5	177.9	2.8	108.5	W900 T1051 A1052	W900-R963 HydrophobicContact CH2-CG 4.25Å; W900-R963 HydrophobicContact CZ2-CG 4.43Å; W900-R963 HydrophobicContact CZ3-CG 4.33Å; R963-T1051 PolarHBondContact O-OG1 3.04Å; R963-T1051 VanDerWaalsContact O-OG1 3.04Å; R963-A1052 HydrophobicContact CB-CB 4.14Å
964	S	76	Confident	84	Confident	16 Å²	16	32 Å²	32	11%	0.112	16%	0.158	C	C	.	.	S	Bend	trans	-79.1	-59.2	176.5	-52.3	0	0	0	0	111.1	N903 M1135	N903-S964 PolarHBondContact ND2-OG 3.27Å; S964-M1135 WeakPolarHBondContact O-CE 3.41Å; S964-M1135 WeakPolarHBondContact O-CG 3.13Å
965	C	81.4	Confident	84.1	Confident	4 Å²	4	32.8 Å²	32.8	3%	0.027	16%	0.162	C	C	.	.	S	Bend	trans	-122.7	159.4	177.6	-59.9	0	0	0	0	110.3	W900	W900-C965 VanDerWaalsContact CZ2-O 3.28Å; W900-C965 WeakPolarHBondContact CZ2-O 3.38Å; W900-C965 PolarHBondContact NE1-O 2.87Å
966	S	85	Confident	84.3	Confident	33 Å²	33	33 Å²	33	23%	0.231	16%	0.163	C	C	.	.			trans	-64.4	157.2	170.5	53.3	0	0	0	0	113.1	N968 N969 C970 E1138	S966-N968 VanDerWaalsContact C-N 3.29Å; S966-N968 PolarHBondContact O-N 3.43Å; S966-N969 PolarHBondContact O-N 3.48Å; S966-N969 PolarHBondContact OG-ND2 2.88Å; S966-C970 PolarHBondContact O-N 2.83Å; S966-E1138 WeakPolarHBondContact CB-OE1 3.27Å; S966-E1138 PolarHBondContact N-OE1 2.81Å; S966-E1138 PolarHBondContact N-OE2 3.41Å; S966-E1138 VanDerWaalsContact OG-CD 3.32Å; S966-E1138 PolarHBondContact OG-OE1 3.4Å; S966-E1138 PolarHBondContact OG-OE2 3.44Å
967	V	85.3	Confident	84.8	Confident	41 Å²	41	29.3 Å²	29.3	25%	0.248	15%	0.145	C	C	.	.	H	α-helix	trans	-53.6	-46.6	175.8	-177.5	0	0	0	0	110.9	V896 W900 N969 C970 L971	V896-V967 HydrophobicContact CG1-CG1 4.25Å; V896-V967 HydrophobicContact CG1-CG2 4.1Å; V896-V967 HydrophobicContact CG2-CG1 4.04Å; W900-V967 HydrophobicContact CH2-CG2 3.39Å; W900-V967 HydrophobicContact CZ2-CG2 3.78Å; W900-V967 HydrophobicContact CZ3-CG2 4.34Å; V967-N969 VanDerWaalsContact C-N 3.35Å; V967-N969 PolarHBondContact O-N 3.43Å; V967-C970 PolarHBondContact O-N 2.91Å; V967-L971 HydrophobicContact CG1-CD1 3.99Å; V967-L971 WeakPolarHBondContact O-CG 3.29Å; V967-L971 PolarHBondContact O-N 3.14Å
968	N	86.9	Confident	84.9	Confident	122 Å²	122	32.9 Å²	32.9	65%	0.652	16%	0.16	S	C	*	.	H	α-helix	trans	-61.8	-41.7	-178.8	-66.5	-15.1	0	0	0	112.1	S966 L971 K972	S966-N968 VanDerWaalsContact C-N 3.29Å; S966-N968 PolarHBondContact O-N 3.43Å; N968-L971 PolarHBondContact O-N 3.26Å; N968-K972 WeakPolarHBondContact O-CB 3.32Å; N968-K972 PolarHBondContact O-N 3.39Å
969	N	86.7	Confident	84.9	Confident	21 Å²	21	35 Å²	35	11%	0.112	17%	0.171	C	C	.	.	H	α-helix	trans	-70.1	-39.5	177.7	-76	-17.3	0	0	0	111.9	S966 V967 L971 Y973 E1138	S966-N969 PolarHBondContact O-N 3.48Å; S966-N969 PolarHBondContact OG-ND2 2.88Å; V967-N969 VanDerWaalsContact C-N 3.35Å; V967-N969 PolarHBondContact O-N 3.43Å; N969-L971 VanDerWaalsContact C-N 3.33Å; N969-L971 PolarHBondContact O-N 3.11Å; N969-Y973 WeakPolarHBondContact O-CB 3.18Å; N969-Y973 WeakPolarHBondContact O-CD2 3.35Å; N969-Y973 PolarHBondContact O-N 3.06Å; N969-E1138 PolarHBondContact ND2-OE2 3.4Å
970	C	86.6	Confident	85.1	Confident	6 Å²	6	35 Å²	35	4%	0.041	17%	0.171	C	C	.	.	H	α-helix	trans	-60.1	-40.9	174.1	-76.3	0	0	0	0	112.4	V896 S966 V967 Y973	V896-C970 HydrophobicContact CG2-CB 4Å; S966-C970 PolarHBondContact O-N 2.83Å; V967-C970 PolarHBondContact O-N 2.91Å; C970-Y973 CarbonylContact O-C 3.54Å
971	L	88.6	Confident	85.3	Confident	46 Å²	46	36.4 Å²	36.4	24%	0.241	18%	0.177	C	C	.	.	H	α-helix	trans	-77.4	-39.8	179.5	-68.1	174.8	0	0	0	112.8	K892 V896 V967 N968 N969 Y973	K892-L971 HydrophobicContact CB-CD2 4.48Å; V896-L971 HydrophobicContact CG2-CD2 3.95Å; V896-L971 HydrophobicContact CG2-CG 3.97Å; V967-L971 HydrophobicContact CG1-CD1 3.99Å; V967-L971 WeakPolarHBondContact O-CG 3.29Å; V967-L971 PolarHBondContact O-N 3.14Å; N968-L971 PolarHBondContact O-N 3.26Å; N969-L971 VanDerWaalsContact C-N 3.33Å; N969-L971 PolarHBondContact O-N 3.11Å; L971-Y973 VanDerWaalsContact C-N 3.32Å
972	K	87.6	Confident	85.2	Confident	108 Å²	108	38.2 Å²	38.2	47%	0.47	20%	0.199	S	C	.	.	H	α-helix	trans	-69.8	-30.2	178.9	-173.8	177.8	176.8	-169.5	0	112.3	N968 P974 D1143	N968-K972 WeakPolarHBondContact O-CB 3.32Å; N968-K972 PolarHBondContact O-N 3.39Å; K972-P974 WeakPolarHBondContact O-CD 3.27Å; K972-D1143 VanDerWaalsContact NZ-CG 3.26Å; K972-D1143 IonicContact NZ-OD1 3.35Å; K972-D1143 PolarHBondContact NZ-OD1 3.49Å; K972-D1143 IonicContact NZ-OD2 2.63Å; K972-D1143 PolarHBondContact NZ-OD2 3.43Å
973	Y	89.1	Confident	84.9	Confident	16 Å²	16	39.3 Å²	39.3	6%	0.063	21%	0.207	C	C	.	.			trans	-126	76.8	-177.7	-56.4	-66.9	0	0	0	111.8	N969 C970 L971 E975 L976 D1143 P1144 G1145 I1148	N969-Y973 WeakPolarHBondContact O-CB 3.18Å; N969-Y973 WeakPolarHBondContact O-CD2 3.35Å; N969-Y973 PolarHBondContact O-N 3.06Å; C970-Y973 CarbonylContact O-C 3.54Å; L971-Y973 VanDerWaalsContact C-N 3.32Å; Y973-E975 WeakPolarHBondContact CA-OE2 3.4Å; Y973-E975 PolarHBondContact O-N 2.89Å; Y973-L976 WeakPolarHBondContact O-CB 3.33Å; Y973-L976 WeakPolarHBondContact O-CG 3.37Å; Y973-L976 PolarHBondContact O-N 3.22Å; Y973-D1143 PolarHBondContact OH-OD1 3.09Å; Y973-P1144 HydrophobicContact CD2-CG 4.06Å; Y973-P1144 HydrophobicContact CE2-CG 3.44Å; Y973-P1144 VanDerWaalsContact CE2-CG 3.44Å; Y973-G1145 WeakPolarHBondContact OH-CA 3.09Å; Y973-G1145 PolarHBondContact OH-N 2.78Å; Y973-I1148 HydrophobicContact CD1-CB 4.35Å; Y973-I1148 HydrophobicContact CD1-CD1 3.24Å; Y973-I1148 HydrophobicContact CD1-CG1 4.38Å; Y973-I1148 HydrophobicContact CD1-CG2 4.23Å; Y973-I1148 HydrophobicContact CD2-CD1 3.74Å; Y973-I1148 HydrophobicContact CE1-CD1 3.75Å; Y973-I1148 HydrophobicContact CE2-CD1 4.22Å; Y973-I1148 HydrophobicContact CG-CD1 3.22Å
974	P	89.5	Confident	84.6	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.006	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-58.9	-21.2	-179.3	-23.1	33.9	0	0	0	113.9	N722 R725 A726 L895 K972 L976 Y977	N722-P974 HydrophobicContact CB-CB 4.39Å; N722-P974 HydrophobicContact CB-CG 3.73Å; N722-P974 WeakPolarHBondContact O-CB 3.08Å; R725-P974 HydrophobicContact CB-CB 4.32Å; A726-P974 WeakPolarHBondContact CA-O 3.27Å; A726-P974 HydrophobicContact CB-CB 3.9Å; A726-P974 WeakPolarHBondContact CB-O 3.14Å; L895-P974 HydrophobicContact CD1-CB 3.78Å; L895-P974 HydrophobicContact CD1-CG 4.04Å; L895-P974 HydrophobicContact CD2-CB 4.35Å; K972-P974 WeakPolarHBondContact O-CD 3.27Å; P974-L976 PolarHBondContact O-N 3.37Å; P974-L976 VanDerWaalsContact O-N 3.08Å; P974-Y977 VanDerWaalsContact O-CB 3.24Å; P974-Y977 WeakPolarHBondContact O-CB 3.24Å; P974-Y977 PolarHBondContact O-N 2.89Å
975	E	87.7	Confident	84.5	Confident	15 Å²	15	37.2 Å²	37.2	7%	0.07	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-59.6	-22.1	179.2	-58.9	82.8	-179.5	0	0	113	R725 Y973 Y977 K978 I1148 I1152	R725-E975 IonicContact CZ-OE1 2.83Å; R725-E975 VanDerWaalsContact CZ-OE1 3.25Å; R725-E975 IonicContact NE-OE1 2.75Å; R725-E975 PolarHBondContact NE-OE1 3.31Å; R725-E975 IonicContact NH2-OE1 2.66Å; R725-E975 PolarHBondContact NH2-OE1 2.83Å; R725-E975 IonicContact NH2-OE2 3.92Å; Y973-E975 WeakPolarHBondContact CA-OE2 3.4Å; Y973-E975 PolarHBondContact O-N 2.89Å; E975-Y977 PolarHBondContact O-N 3.23Å; E975-K978 WeakPolarHBondContact O-CB 3.08Å; E975-K978 PolarHBondContact O-N 2.97Å; E975-K978 VanDerWaalsContact O-N 3.14Å; E975-I1148 HydrophobicContact CG-CG2 4.39Å; E975-I1152 HydrophobicContact CG-CD1 4.1Å; E975-I1152 HydrophobicContact CG-CG1 4.42Å
976	L	88.3	Confident	84.6	Confident	4 Å²	4	37.1 Å²	37.1	2%	0.021	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-63.2	-17.6	175.1	-67.7	175.8	0	0	0	113.8	Y973 P974 L1130 R1131 V1134	Y973-L976 WeakPolarHBondContact O-CB 3.33Å; Y973-L976 WeakPolarHBondContact O-CG 3.37Å; Y973-L976 PolarHBondContact O-N 3.22Å; P974-L976 PolarHBondContact O-N 3.37Å; P974-L976 VanDerWaalsContact O-N 3.08Å; L976-L1130 HydrophobicContact CD2-CD2 4.35Å; L976-L1130 HydrophobicContact CD2-CG 4.14Å; L976-R1131 HydrophobicContact CD2-CB 4.38Å; L976-V1134 HydrophobicContact CD1-CG1 4.2Å; L976-V1134 HydrophobicContact CD2-CB 4.35Å; L976-V1134 HydrophobicContact CD2-CG2 3.98Å
977	Y	90.7	Very high	84.6	Confident	3 Å²	3	38 Å²	38	1%	0.012	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-74.9	-25.3	176.1	-170.5	-97.4	0	0	0	112.6	L442 Q444 V445 A726 I728 L894 L895 A899 P974 E975 D979 T980 Q981	L442-Y977 PolarHBondContact O-OH 3.02Å; Q444-Y977 PolarHBondContact N-OH 3.14Å; V445-Y977 PolarHBondContact N-OH 2.73Å; V445-Y977 WeakPolarHBondContact O-CE1 3.25Å; A726-Y977 HydrophobicContact CB-CD1 4.17Å; A726-Y977 HydrophobicContact CB-CG 4.38Å; I728-Y977 HydrophobicContact CD1-CD1 4.25Å; I728-Y977 HydrophobicContact CD1-CE1 3.87Å; I728-Y977 HydrophobicContact CG1-CD1 4.47Å; I728-Y977 HydrophobicContact CG1-CE1 4.19Å; L894-Y977 HydrophobicContact CB-CE2 4.32Å; L894-Y977 WeakPolarHBondContact O-CE2 3.4Å; L895-Y977 HydrophobicContact CD2-CD2 3.93Å; L895-Y977 HydrophobicContact CD2-CG 3.84Å; A899-Y977 HydrophobicContact CB-CD2 4.18Å; P974-Y977 VanDerWaalsContact O-CB 3.24Å; P974-Y977 WeakPolarHBondContact O-CB 3.24Å; P974-Y977 PolarHBondContact O-N 2.89Å; E975-Y977 PolarHBondContact O-N 3.23Å; Y977-D979 PolarHBondContact O-N 3.38Å; Y977-T980 PolarHBondContact O-N 3.22Å; Y977-T980 PolarHBondContact O-OG1 3.14Å; Y977-Q981 HydrophobicContact CD1-CG 3.68Å; Y977-Q981 HydrophobicContact CE1-CG 3.51Å; Y977-Q981 PolarHBondContact O-N 3.38Å
978	K	86.4	Confident	84.7	Confident	80 Å²	80	39.5 Å²	39.5	35%	0.348	23%	0.227	S	C	.	.	H	α-helix	trans	-59.8	-34.1	178.4	-66.8	-168.7	-179.7	-154.5	0	112.8	R725 A726 E975 T980 Q981 A982	R725-K978 WeakPolarHBondContact O-CE 3.33Å; A726-K978 WeakPolarHBondContact O-CG 3.38Å; E975-K978 WeakPolarHBondContact O-CB 3.08Å; E975-K978 PolarHBondContact O-N 2.97Å; E975-K978 VanDerWaalsContact O-N 3.14Å; K978-T980 VanDerWaalsContact C-N 3.27Å; K978-T980 PolarHBondContact O-N 3Å; K978-Q981 PolarHBondContact O-N 3.47Å; K978-A982 PolarHBondContact O-N 3.49Å
979	D	84.3	Confident	84.9	Confident	44 Å²	44	42 Å²	42	24%	0.235	23%	0.232	C	C	.	.	H	α-helix	trans	-62.3	-33.4	177.4	-78.9	-2.1	0	0	0	112.1	Y977	Y977-D979 PolarHBondContact O-N 3.38Å
980	T	85.8	Confident	85.1	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-80.8	-37.3	178	56.4	0	0	0	0	111.8	G443 A899 Y902 Y977 K978 A982 S983	G443-T980 VanDerWaalsContact O-CB 3.23Å; G443-T980 WeakPolarHBondContact O-CB 3.25Å; G443-T980 PolarHBondContact O-OG1 2.96Å; A899-T980 HydrophobicContact CB-CG2 4.45Å; Y902-T980 HydrophobicContact CD1-CG2 3.89Å; Y902-T980 HydrophobicContact CE1-CG2 4.46Å; Y977-T980 PolarHBondContact O-N 3.22Å; Y977-T980 PolarHBondContact O-OG1 3.14Å; K978-T980 VanDerWaalsContact C-N 3.27Å; K978-T980 PolarHBondContact O-N 3Å; T980-A982 VanDerWaalsContact C-N 3.34Å; T980-A982 PolarHBondContact O-N 3.46Å; T980-S983 PolarHBondContact O-N 3.36Å; T980-S983 VanDerWaalsContact O-N 3.1Å
981	Q	83.3	Confident	85.2	Confident	37 Å²	37	42.8 Å²	42.8	17%	0.173	24%	0.237	C	C	.	.	H	α-helix	trans	-58.9	-42.9	172.8	-67.2	176.3	-35.5	0	0	112.3	V445 A726 Y977 K978 S983	V445-Q981 PolarHBondContact O-NE2 3.27Å; A726-Q981 PolarHBondContact O-OE1 2.86Å; Y977-Q981 HydrophobicContact CD1-CG 3.68Å; Y977-Q981 HydrophobicContact CE1-CG 3.51Å; Y977-Q981 PolarHBondContact O-N 3.38Å; K978-Q981 PolarHBondContact O-N 3.47Å; Q981-S983 PolarHBondContact O-N 3.08Å
982	A	78.8	Confident	85.4	Confident	75 Å²	75	45 Å²	45	62%	0.62	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-0.8	178.8	0	0	0	0	0	114	K978 T980 A984	K978-A982 PolarHBondContact O-N 3.49Å; T980-A982 VanDerWaalsContact C-N 3.34Å; T980-A982 PolarHBondContact O-N 3.46Å; A982-A984 PolarHBondContact O-N 3.22Å
983	S	77.5	Confident	85.6	Confident	26 Å²	26	42.9 Å²	42.9	18%	0.182	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.6	31.6	-177.4	-57.9	0	0	0	0	113.3	Q444 Y902 T980 Q981 S985 F986	Q444-S983 PolarHBondContact NE2-OG 3.45Å; Y902-S983 WeakPolarHBondContact OH-CA 3.15Å; T980-S983 PolarHBondContact O-N 3.36Å; T980-S983 VanDerWaalsContact O-N 3.1Å; Q981-S983 PolarHBondContact O-N 3.08Å; S983-S985 PolarHBondContact O-N 3.11Å; S983-F986 CarbonylContact O-C 3.35Å; S983-F986 PolarHBondContact O-N 3.17Å; S983-F986 VanDerWaalsContact O-N 3.12Å
984	A	70.8	Confident	85.8	Confident	56 Å²	56	43.7 Å²	43.7	46%	0.463	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-28.4	-172.8	0	0	0	0	0	112.5	A982 N987	A982-A984 PolarHBondContact O-N 3.22Å; A984-N987 PolarHBondContact O-ND2 2.87Å
985	S	74.8	Confident	86	Confident	44 Å²	44	44.6 Å²	44.6	31%	0.308	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-26.9	178.8	-59.1	0	0	0	0	113.6	S983	S983-S985 PolarHBondContact O-N 3.11Å
986	F	82.6	Confident	86.3	Confident	1 Å²	1	50.3 Å²	50.3	0%	0.004	28%	0.276	C	S	.	.	S	Bend	trans	-130	74.3	-173.7	-160.1	-122.7	0	0	0	111.1	V285 Q288 Y292 T906 I909 L910 S983	V285-F986 HydrophobicContact CG1-CD1 4.3Å; V285-F986 HydrophobicContact CG1-CE1 3.98Å; Q288-F986 HydrophobicContact CB-CD1 4.44Å; Q288-F986 HydrophobicContact CB-CE1 3.8Å; Y292-F986 HydrophobicContact CD2-CE1 4.34Å; Y292-F986 HydrophobicContact CD2-CE2 4.26Å; Y292-F986 AromaticContact CD2-CZ 3.72Å; Y292-F986 HydrophobicContact CD2-CZ 3.72Å; Y292-F986 HydrophobicContact CE2-CD1 4.44Å; Y292-F986 AromaticContact CE2-CE1 3.73Å; Y292-F986 HydrophobicContact CE2-CE1 3.73Å; Y292-F986 AromaticContact CE2-CE2 3.84Å; Y292-F986 HydrophobicContact CE2-CE2 3.84Å; Y292-F986 AromaticContact CE2-CZ 3.4Å; Y292-F986 HydrophobicContact CE2-CZ 3.4Å; Y292-F986 VanDerWaalsContact CE2-CZ 3.4Å; T906-F986 HydrophobicContact CG2-CB 3.61Å; T906-F986 HydrophobicContact CG2-CD2 3.76Å; T906-F986 HydrophobicContact CG2-CG 4.01Å; I909-F986 HydrophobicContact CB-CE2 4.38Å; I909-F986 HydrophobicContact CD1-CZ 4.39Å; I909-F986 HydrophobicContact CG2-CE2 3.91Å; I909-F986 HydrophobicContact CG2-CZ 3.97Å; L910-F986 HydrophobicContact CD1-CD2 4.47Å; L910-F986 HydrophobicContact CD2-CD2 4.23Å; L910-F986 HydrophobicContact CD2-CE2 4.18Å; L910-F986 HydrophobicContact CG-CD2 4.22Å; L910-F986 HydrophobicContact CG-CE2 4.31Å; S983-F986 CarbonylContact O-C 3.35Å; S983-F986 PolarHBondContact O-N 3.17Å; S983-F986 VanDerWaalsContact O-N 3.12Å
987	N	85.1	Confident	86.6	Confident	51 Å²	51	51 Å²	51	27%	0.273	28%	0.279	S	S	.	.	S	Bend	trans	-120.1	161	172.9	61.4	38.3	0	0	0	110.2	A984 K989 V990 F991	A984-N987 PolarHBondContact O-ND2 2.87Å; N987-K989 PolarHBondContact O-N 2.66Å; N987-K989 VanDerWaalsContact O-N 3.15Å; N987-K989 PolarHBondContact OD1-N 2.68Å; N987-V990 PolarHBondContact O-N 3.42Å; N987-V990 VanDerWaalsContact O-N 3.14Å; N987-V990 VanDerWaalsContact OD1-CB 3.29Å; N987-V990 WeakPolarHBondContact OD1-CB 3.48Å; N987-V990 WeakPolarHBondContact OD1-CG2 3.26Å; N987-V990 PolarHBondContact OD1-N 2.96Å; N987-F991 PolarHBondContact O-N 3.25Å
988	P	87.9	Confident	86.7	Confident	74 Å²	74	50.9 Å²	50.9	48%	0.481	28%	0.279	S	S	.	.	H	α-helix	trans	-56.6	-33.7	-179.8	-27.5	34.8	0	0	0	112.9	Y292 F991 F992	Y292-P988 HydrophobicContact CE1-CB 4.35Å; Y292-P988 HydrophobicContact CE1-CG 4.32Å; Y292-P988 WeakPolarHBondContact OH-CA 3.49Å; Y292-P988 WeakPolarHBondContact OH-CD 3.1Å; P988-F991 WeakPolarHBondContact O-CB 3.31Å; P988-F991 PolarHBondContact O-N 2.85Å; P988-F992 WeakPolarHBondContact O-CD2 3.41Å; P988-F992 PolarHBondContact O-N 2.93Å
989	K	90.3	Very high	87.1	Confident	174 Å²	174	49.9 Å²	49.9	76%	0.757	28%	0.277	S	S	*	.	H	α-helix	trans	-63.3	-46.1	178.2	-177.4	179.4	179.5	177.9	0	112.3	N987 C993	N987-K989 PolarHBondContact O-N 2.66Å; N987-K989 VanDerWaalsContact O-N 3.15Å; N987-K989 PolarHBondContact OD1-N 2.68Å; K989-C993 WeakPolarHBondContact O-CB 3.24Å; K989-C993 PolarHBondContact O-N 3.33Å
990	V	90.2	Very high	87.6	Confident	40 Å²	40	51.8 Å²	51.8	24%	0.242	28%	0.281	C	S	.	.	H	α-helix	trans	-64.1	-46.2	175.8	170.7	0	0	0	0	108.6	L910 N987 F992 C993 W994	L910-V990 HydrophobicContact CD1-CG1 3.91Å; L910-V990 HydrophobicContact CD2-CG1 4.48Å; N987-V990 PolarHBondContact O-N 3.42Å; N987-V990 VanDerWaalsContact O-N 3.14Å; N987-V990 VanDerWaalsContact OD1-CB 3.29Å; N987-V990 WeakPolarHBondContact OD1-CB 3.48Å; N987-V990 WeakPolarHBondContact OD1-CG2 3.26Å; N987-V990 PolarHBondContact OD1-N 2.96Å; V990-F992 PolarHBondContact O-N 2.68Å; V990-C993 VanDerWaalsContact O-CB 3.31Å; V990-C993 WeakPolarHBondContact O-CB 3.44Å; V990-C993 PolarHBondContact O-N 3.37Å; V990-C993 VanDerWaalsContact O-N 3.09Å; V990-W994 VanDerWaalsContact O-CD1 3.24Å; V990-W994 PolarHBondContact O-N 3.35Å
991	F	90.2	Very high	88.1	Confident	3 Å²	3	51.8 Å²	51.8	1%	0.013	28%	0.281	C	S	.	.	H	α-helix	trans	-52.6	-53.9	176.5	176.6	-99.4	0	0	0	112.3	Y292 L296 L910 F913 N987 P988 C993 W994 I995	Y292-F991 HydrophobicContact CD1-CD1 4.03Å; Y292-F991 HydrophobicContact CD1-CE1 4.25Å; Y292-F991 HydrophobicContact CD1-CG 4.2Å; Y292-F991 AromaticContact CD2-CD2 3.95Å; Y292-F991 HydrophobicContact CD2-CD2 3.95Å; Y292-F991 HydrophobicContact CD2-CE2 4.28Å; Y292-F991 HydrophobicContact CD2-CG 4.23Å; Y292-F991 HydrophobicContact CE1-CB 4.41Å; Y292-F991 HydrophobicContact CE1-CD1 4.34Å; Y292-F991 HydrophobicContact CE1-CG 4.32Å; Y292-F991 HydrophobicContact CE2-CB 4.33Å; Y292-F991 HydrophobicContact CE2-CD2 4.36Å; Y292-F991 HydrophobicContact CE2-CG 4.35Å; Y292-F991 HydrophobicContact CG-CD1 4.3Å; Y292-F991 HydrophobicContact CG-CD2 4.07Å; Y292-F991 HydrophobicContact CG-CE1 4.32Å; Y292-F991 HydrophobicContact CG-CE2 4.11Å; Y292-F991 HydrophobicContact CG-CG 4.17Å; Y292-F991 HydrophobicContact CG-CZ 4.23Å; L296-F991 HydrophobicContact CD1-CZ 4.18Å; L296-F991 HydrophobicContact CG-CZ 4.26Å; L910-F991 HydrophobicContact CD2-CB 4.39Å; L910-F991 HydrophobicContact CD2-CD2 4.23Å; F913-F991 HydrophobicContact CB-CE2 4.23Å; F913-F991 HydrophobicContact CD2-CD2 4.38Å; F913-F991 AromaticContact CD2-CE2 3.64Å; F913-F991 HydrophobicContact CD2-CE2 3.64Å; F913-F991 HydrophobicContact CE2-CE2 4.06Å; F913-F991 AromaticContact CG-CE2 3.94Å; F913-F991 HydrophobicContact CG-CE2 3.94Å; N987-F991 PolarHBondContact O-N 3.25Å; P988-F991 WeakPolarHBondContact O-CB 3.31Å; P988-F991 PolarHBondContact O-N 2.85Å; F991-C993 VanDerWaalsContact C-N 3.31Å; F991-C993 PolarHBondContact O-N 3Å; F991-W994 WeakPolarHBondContact O-CB 3.06Å; F991-W994 PolarHBondContact O-N 2.9Å; F991-W994 VanDerWaalsContact O-N 3.1Å; F991-I995 HydrophobicContact CD1-CG1 4.29Å; F991-I995 HydrophobicContact CE1-CD1 4.39Å; F991-I995 HydrophobicContact CE1-CG1 3.88Å; F991-I995 HydrophobicContact CE2-CD1 4.29Å; F991-I995 HydrophobicContact CE2-CG1 4.36Å; F991-I995 HydrophobicContact CZ-CD1 3.94Å; F991-I995 HydrophobicContact CZ-CG1 3.92Å; F991-I995 WeakPolarHBondContact O-CG1 3.46Å; F991-I995 PolarHBondContact O-N 2.99Å
992	F	91.7	Very high	88.7	Confident	92 Å²	92	50 Å²	50	40%	0.404	27%	0.273	S	S	.	.	H	α-helix	trans	-63.1	-35	177.6	-76.3	-66.8	0	0	0	113.1	P988 V990 W994 I995 F996	P988-F992 WeakPolarHBondContact O-CD2 3.41Å; P988-F992 PolarHBondContact O-N 2.93Å; V990-F992 PolarHBondContact O-N 2.68Å; F992-W994 VanDerWaalsContact C-N 3.29Å; F992-W994 PolarHBondContact O-N 3.23Å; F992-I995 PolarHBondContact O-N 3.23Å; F992-F996 HydrophobicContact CB-CD2 4.37Å; F992-F996 HydrophobicContact CB-CE2 4.15Å; F992-F996 WeakPolarHBondContact O-CD2 3.45Å; F992-F996 PolarHBondContact O-N 2.89Å
993	C	92.7	Very high	89.5	Confident	65 Å²	65	48.3 Å²	48.3	44%	0.439	26%	0.256	S	S	.	.	H	α-helix	trans	-59.6	-39.2	173.8	-172.6	0	0	0	0	112.2	K989 V990 F991 N997	K989-C993 WeakPolarHBondContact O-CB 3.24Å; K989-C993 PolarHBondContact O-N 3.33Å; V990-C993 VanDerWaalsContact O-CB 3.31Å; V990-C993 WeakPolarHBondContact O-CB 3.44Å; V990-C993 PolarHBondContact O-N 3.37Å; V990-C993 VanDerWaalsContact O-N 3.09Å; F991-C993 VanDerWaalsContact C-N 3.31Å; F991-C993 PolarHBondContact O-N 3Å; C993-N997 WeakPolarHBondContact O-CB 3.39Å; C993-N997 PolarHBondContact O-N 3.1Å
994	W	93.6	Very high	90.3	Very high	33 Å²	33	48.7 Å²	48.7	13%	0.125	26%	0.257	C	S	.	.	H	α-helix	trans	-69.8	-37.1	174.8	-81.7	86.4	0	0	0	112.5	L910 Y914 V990 F991 F992 N997 S998 E1049	L910-W994 HydrophobicContact CB-CD2 4.13Å; L910-W994 HydrophobicContact CB-CG 4.32Å; L910-W994 HydrophobicContact CB-CZ2 4.41Å; L910-W994 HydrophobicContact CD2-CG 4.36Å; Y914-W994 HydrophobicContact CD2-CE3 4.24Å; Y914-W994 AromaticContact CG-CE3 3.96Å; Y914-W994 HydrophobicContact CG-CE3 3.96Å; Y914-W994 HydrophobicContact CG-CZ3 4.25Å; V990-W994 VanDerWaalsContact O-CD1 3.24Å; V990-W994 PolarHBondContact O-N 3.35Å; F991-W994 WeakPolarHBondContact O-CB 3.06Å; F991-W994 PolarHBondContact O-N 2.9Å; F991-W994 VanDerWaalsContact O-N 3.1Å; F992-W994 VanDerWaalsContact C-N 3.29Å; F992-W994 PolarHBondContact O-N 3.23Å; W994-N997 WeakPolarHBondContact O-CB 3.37Å; W994-N997 PolarHBondContact O-N 3.38Å; W994-S998 PolarHBondContact O-N 3.46Å; W994-E1049 HydrophobicContact CH2-CG 3.63Å; W994-E1049 HydrophobicContact CZ2-CG 4.47Å; W994-E1049 HydrophobicContact CZ3-CG 4.41Å
995	I	92.5	Very high	91.5	Very high	20 Å²	20	46 Å²	46	10%	0.103	23%	0.234	C	C	.	.	H	α-helix	trans	-64.8	-46.9	174.4	-62.3	-65.1	0	0	0	110.9	L296 F913 V917 F991 F992 N997 S998 I999	L296-I995 HydrophobicContact CD2-CD1 4.32Å; F913-I995 HydrophobicContact CB-CD1 4.44Å; V917-I995 HydrophobicContact CG2-CD1 3.9Å; F991-I995 HydrophobicContact CD1-CG1 4.29Å; F991-I995 HydrophobicContact CE1-CD1 4.39Å; F991-I995 HydrophobicContact CE1-CG1 3.88Å; F991-I995 HydrophobicContact CE2-CD1 4.29Å; F991-I995 HydrophobicContact CE2-CG1 4.36Å; F991-I995 HydrophobicContact CZ-CD1 3.94Å; F991-I995 HydrophobicContact CZ-CG1 3.92Å; F991-I995 WeakPolarHBondContact O-CG1 3.46Å; F991-I995 PolarHBondContact O-N 2.99Å; F992-I995 PolarHBondContact O-N 3.23Å; I995-N997 VanDerWaalsContact C-N 3.3Å; I995-N997 PolarHBondContact O-N 3.41Å; I995-S998 WeakPolarHBondContact O-CA 3.23Å; I995-S998 VanDerWaalsContact O-CB 3.26Å; I995-S998 WeakPolarHBondContact O-CB 3.37Å; I995-S998 PolarHBondContact O-N 2.74Å; I995-I999 HydrophobicContact CG2-CD1 4.16Å; I995-I999 WeakPolarHBondContact O-CG1 3.45Å; I995-I999 PolarHBondContact O-N 2.79Å
996	F	94.3	Very high	92.5	Very high	135 Å²	135	44 Å²	44	59%	0.592	22%	0.22	S	C	*	.	H	α-helix	trans	-62.9	-36.5	175.4	-71.9	-58.1	0	0	0	112.5	F992 S998 I999 Y1000	F992-F996 HydrophobicContact CB-CD2 4.37Å; F992-F996 HydrophobicContact CB-CE2 4.15Å; F992-F996 WeakPolarHBondContact O-CD2 3.45Å; F992-F996 PolarHBondContact O-N 2.89Å; F996-S998 VanDerWaalsContact C-N 3.33Å; F996-I999 HydrophobicContact CD1-CD1 4.09Å; F996-I999 PolarHBondContact O-N 2.73Å; F996-Y1000 PolarHBondContact O-N 3.03Å
997	N	94.4	Very high	93	Very high	18 Å²	18	48.3 Å²	48.3	10%	0.096	24%	0.236	C	C	.	.	H	α-helix	trans	-58.8	-46.6	170.7	-177.3	-5.1	0	0	0	110.9	C993 W994 I995 I999 Y1000 H1001 R1115 D1116	C993-N997 WeakPolarHBondContact O-CB 3.39Å; C993-N997 PolarHBondContact O-N 3.1Å; W994-N997 WeakPolarHBondContact O-CB 3.37Å; W994-N997 PolarHBondContact O-N 3.38Å; I995-N997 VanDerWaalsContact C-N 3.3Å; I995-N997 PolarHBondContact O-N 3.41Å; N997-I999 PolarHBondContact O-N 3.34Å; N997-Y1000 WeakPolarHBondContact O-CB 3.33Å; N997-Y1000 PolarHBondContact O-N 3.45Å; N997-Y1000 VanDerWaalsContact O-N 3.17Å; N997-H1001 PolarHBondContact O-N 2.71Å; N997-H1001 PolarHBondContact OD1-CE1 3.35Å; N997-H1001 PolarHBondContact OD1-ND1 3.43Å; N997-H1001 PolarHBondContact OD1-NE2 3.21Å; N997-R1115 PolarHBondContact OD1-NH2 3.23Å; N997-D1116 PolarHBondContact ND2-OD1 3.33Å; N997-D1116 PolarHBondContact ND2-OD2 3.35Å
998	S	94.3	Very high	93.5	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-60.1	-41.9	177.3	-171.2	0	0	0	0	113.3	Y914 V917 C918 W994 I995 F996 Y1000 H1001 S1002	Y914-S998 PolarHBondContact O-OG 3.07Å; V917-S998 VanDerWaalsContact C-OG 3.28Å; V917-S998 WeakPolarHBondContact CB-OG 3.34Å; V917-S998 WeakPolarHBondContact CG1-OG 3.08Å; C918-S998 VanDerWaalsContact CA-OG 3.23Å; C918-S998 WeakPolarHBondContact CA-OG 2.98Å; C918-S998 WeakPolarHBondContact CB-OG 3.25Å; C918-S998 PolarHBondContact N-OG 2.81Å; W994-S998 PolarHBondContact O-N 3.46Å; I995-S998 WeakPolarHBondContact O-CA 3.23Å; I995-S998 VanDerWaalsContact O-CB 3.26Å; I995-S998 WeakPolarHBondContact O-CB 3.37Å; I995-S998 PolarHBondContact O-N 2.74Å; F996-S998 VanDerWaalsContact C-N 3.33Å; S998-Y1000 VanDerWaalsContact C-N 3.34Å; S998-Y1000 PolarHBondContact O-N 3.47Å; S998-H1001 PolarHBondContact O-N 2.79Å; S998-S1002 WeakPolarHBondContact O-CB 3.28Å; S998-S1002 PolarHBondContact O-N 2.8Å; S998-S1002 PolarHBondContact O-OG 3.44Å
999	I	94.3	Very high	93.7	Very high	59 Å²	59	44.6 Å²	44.6	30%	0.303	21%	0.212	S	C	.	.	H	α-helix	trans	-61.2	-43.6	174.6	-64.5	167.1	0	0	0	110.6	L921 W925 I995 F996 N997 S1002 S1003	L921-I999 HydrophobicContact CD2-CB 3.99Å; L921-I999 HydrophobicContact CD2-CG1 3.66Å; L921-I999 HydrophobicContact CD2-CG2 3.88Å; W925-I999 HydrophobicContact CZ2-CG2 4.36Å; I995-I999 HydrophobicContact CG2-CD1 4.16Å; I995-I999 WeakPolarHBondContact O-CG1 3.45Å; I995-I999 PolarHBondContact O-N 2.79Å; F996-I999 HydrophobicContact CD1-CD1 4.09Å; F996-I999 PolarHBondContact O-N 2.73Å; N997-I999 PolarHBondContact O-N 3.34Å; I999-S1002 PolarHBondContact O-OG 2.78Å; I999-S1003 WeakPolarHBondContact O-CB 3.36Å; I999-S1003 PolarHBondContact O-N 3.42Å
1000	Y	95.3	Very high	93.8	Very high	84 Å²	84	38.3 Å²	38.3	33%	0.329	19%	0.186	S	C	.	.	H	α-helix	trans	-62.8	-47.9	177.1	169.9	-95.4	0	0	0	112.1	F996 N997 S998 S1003 L1004 R1115	F996-Y1000 PolarHBondContact O-N 3.03Å; N997-Y1000 WeakPolarHBondContact O-CB 3.33Å; N997-Y1000 PolarHBondContact O-N 3.45Å; N997-Y1000 VanDerWaalsContact O-N 3.17Å; S998-Y1000 VanDerWaalsContact C-N 3.34Å; S998-Y1000 PolarHBondContact O-N 3.47Å; Y1000-S1003 PolarHBondContact O-N 2.89Å; Y1000-L1004 HydrophobicContact CD1-CD1 4.16Å; Y1000-L1004 HydrophobicContact CE1-CD1 3.47Å; Y1000-L1004 VanDerWaalsContact CE1-CD1 3.47Å; Y1000-L1004 HydrophobicContact CE1-CG 4.44Å; Y1000-L1004 HydrophobicContact CE2-CD1 4Å; Y1000-L1004 HydrophobicContact CE2-CG 4.4Å; Y1000-L1004 PolarHBondContact O-N 2.88Å; Y1000-L1004 VanDerWaalsContact O-N 3.14Å; Y1000-L1004 WeakPolarHBondContact OH-CD1 3.2Å; Y1000-R1115 VanDerWaalsContact CD1-NH2 3.34Å; Y1000-R1115 HydrophobicContact CE1-CB 4.37Å
1001	H	96.5	Very high	93.8	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-64.6	-42.9	178	-73.4	170.4	0	0	0	112.2	Y914 N997 S998 S1003 L1004 L1005 A1112 R1115 D1116	Y914-H1001 AromaticContact CE2-ND1 3.55Å; Y914-H1001 AromaticContact CZ-ND1 3.54Å; Y914-H1001 PolarHBondContact OH-ND1 2.82Å; N997-H1001 PolarHBondContact O-N 2.71Å; N997-H1001 PolarHBondContact OD1-CE1 3.35Å; N997-H1001 PolarHBondContact OD1-ND1 3.43Å; N997-H1001 PolarHBondContact OD1-NE2 3.21Å; S998-H1001 PolarHBondContact O-N 2.79Å; H1001-S1003 VanDerWaalsContact C-N 3.29Å; H1001-S1003 PolarHBondContact O-N 3.37Å; H1001-L1004 PolarHBondContact O-N 3.4Å; H1001-L1005 HydrophobicContact CB-CD1 4.28Å; H1001-L1005 VanDerWaalsContact O-CB 3.26Å; H1001-L1005 WeakPolarHBondContact O-CB 3.3Å; H1001-L1005 WeakPolarHBondContact O-CD1 3.16Å; H1001-L1005 WeakPolarHBondContact O-CG 3.32Å; H1001-L1005 PolarHBondContact O-N 2.86Å; H1001-A1112 PolarHBondContact NE2-O 2.84Å; H1001-R1115 PolarHBondContact NE2-NH2 2.98Å; H1001-D1116 IonicContact CE1-OD2 3.57Å; H1001-D1116 PolarHBondContact CE1-OD2 3.33Å; H1001-D1116 IonicContact NE2-OD1 2.65Å; H1001-D1116 IonicContact NE2-OD2 2.78Å
1002	S	95.3	Very high	93.8	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.3	-38.4	178	66.5	0	0	0	0	112.4	C918 L921 W925 S998 I999 F1006	C918-S1002 WeakPolarHBondContact O-CB 3.44Å; L921-S1002 WeakPolarHBondContact CD2-OG 3.34Å; W925-S1002 PolarHBondContact NE1-OG 3.36Å; S998-S1002 WeakPolarHBondContact O-CB 3.28Å; S998-S1002 PolarHBondContact O-N 2.8Å; S998-S1002 PolarHBondContact O-OG 3.44Å; I999-S1002 PolarHBondContact O-OG 2.78Å; S1002-F1006 WeakPolarHBondContact O-CB 3.43Å; S1002-F1006 PolarHBondContact O-N 3.43Å; S1002-F1006 VanDerWaalsContact O-N 3.13Å
1003	S	94.5	Very high	93.6	Very high	39 Å²	39	40.2 Å²	40.2	27%	0.273	20%	0.203	S	C	.	.	H	α-helix	trans	-61.8	-50.2	174.8	-177.5	0	0	0	0	111.5	I999 Y1000 H1001 F1006 W1007	I999-S1003 WeakPolarHBondContact O-CB 3.36Å; I999-S1003 PolarHBondContact O-N 3.42Å; Y1000-S1003 PolarHBondContact O-N 2.89Å; H1001-S1003 VanDerWaalsContact C-N 3.29Å; H1001-S1003 PolarHBondContact O-N 3.37Å; S1003-F1006 PolarHBondContact O-N 3.43Å; S1003-W1007 WeakPolarHBondContact O-CB 3.33Å; S1003-W1007 PolarHBondContact O-N 3.48Å
1004	L	95.4	Very high	93.3	Very high	35 Å²	35	41.3 Å²	41.3	18%	0.183	21%	0.212	C	C	.	.	H	α-helix	trans	-63.8	-44	179.1	-67.1	-178.7	0	0	0	112.4	Y1000 H1001 F1006 I1008 I1111 A1112	Y1000-L1004 HydrophobicContact CD1-CD1 4.16Å; Y1000-L1004 HydrophobicContact CE1-CD1 3.47Å; Y1000-L1004 VanDerWaalsContact CE1-CD1 3.47Å; Y1000-L1004 HydrophobicContact CE1-CG 4.44Å; Y1000-L1004 HydrophobicContact CE2-CD1 4Å; Y1000-L1004 HydrophobicContact CE2-CG 4.4Å; Y1000-L1004 PolarHBondContact O-N 2.88Å; Y1000-L1004 VanDerWaalsContact O-N 3.14Å; Y1000-L1004 WeakPolarHBondContact OH-CD1 3.2Å; H1001-L1004 PolarHBondContact O-N 3.4Å; L1004-F1006 PolarHBondContact O-N 3.27Å; L1004-I1008 HydrophobicContact CB-CD1 4.16Å; L1004-I1008 HydrophobicContact CD2-CD1 4.08Å; L1004-I1008 WeakPolarHBondContact O-CB 3.24Å; L1004-I1008 WeakPolarHBondContact O-CG1 2.8Å; L1004-I1008 PolarHBondContact O-N 3.5Å; L1004-I1111 HydrophobicContact CD1-CG2 4.45Å; L1004-A1112 HydrophobicContact CD1-CB 4.5Å
1005	L	95.8	Very high	92.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-67	-18.9	-178.1	-70.3	166.9	0	0	0	113.1	I922 H1001 P1009 V1038 T1041 I1108	I922-L1005 HydrophobicContact CD1-CB 4.28Å; H1001-L1005 HydrophobicContact CB-CD1 4.28Å; H1001-L1005 VanDerWaalsContact O-CB 3.26Å; H1001-L1005 WeakPolarHBondContact O-CB 3.3Å; H1001-L1005 WeakPolarHBondContact O-CD1 3.16Å; H1001-L1005 WeakPolarHBondContact O-CG 3.32Å; H1001-L1005 PolarHBondContact O-N 2.86Å; L1005-P1009 VanDerWaalsContact O-CD 3.29Å; L1005-P1009 WeakPolarHBondContact O-CD 3.34Å; L1005-P1009 WeakPolarHBondContact O-CG 3.2Å; L1005-V1038 HydrophobicContact CB-CG2 4.25Å; L1005-V1038 HydrophobicContact CD1-CG2 3.99Å; L1005-T1041 HydrophobicContact CD1-CG2 4.2Å; L1005-T1041 HydrophobicContact CD2-CG2 4.45Å; L1005-T1041 WeakPolarHBondContact CD2-OG1 3.46Å; L1005-I1108 HydrophobicContact CD2-CG2 3.77Å
1006	F	94.9	Very high	91.4	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-98	-52.8	175.4	-179.7	-108.6	0	0	0	112.8	I922 W925 F926 L929 S1002 S1003 L1004 P1009 L1010	I922-F1006 HydrophobicContact CG1-CB 4.32Å; I922-F1006 HydrophobicContact CG2-CB 4.08Å; I922-F1006 HydrophobicContact CG2-CD2 3.54Å; I922-F1006 HydrophobicContact CG2-CE2 4.31Å; I922-F1006 HydrophobicContact CG2-CG 4.09Å; W925-F1006 HydrophobicContact CB-CB 4.48Å; W925-F1006 HydrophobicContact CB-CD1 3.32Å; W925-F1006 HydrophobicContact CB-CE1 3.55Å; W925-F1006 HydrophobicContact CB-CG 3.92Å; W925-F1006 HydrophobicContact CB-CZ 4.32Å; W925-F1006 HydrophobicContact CG-CD1 4.15Å; F926-F1006 HydrophobicContact CB-CE2 3.95Å; F926-F1006 HydrophobicContact CB-CZ 3.86Å; F926-F1006 HydrophobicContact CD2-CE2 4.34Å; F926-F1006 HydrophobicContact CD2-CZ 4.2Å; L929-F1006 HydrophobicContact CD1-CE1 3.89Å; L929-F1006 HydrophobicContact CD1-CZ 3.69Å; S1002-F1006 WeakPolarHBondContact O-CB 3.43Å; S1002-F1006 PolarHBondContact O-N 3.43Å; S1002-F1006 VanDerWaalsContact O-N 3.13Å; S1003-F1006 PolarHBondContact O-N 3.43Å; L1004-F1006 PolarHBondContact O-N 3.27Å; F1006-P1009 WeakPolarHBondContact O-CD 3.15Å; F1006-L1010 HydrophobicContact CE1-CD2 4.21Å; F1006-L1010 HydrophobicContact CZ-CD2 4.49Å; F1006-L1010 WeakPolarHBondContact O-CB 3.41Å; F1006-L1010 PolarHBondContact O-N 3.23Å
1007	W	94.6	Very high	90.8	Very high	92 Å²	92	42.9 Å²	42.9	35%	0.348	25%	0.246	S	C	.	.	H	α-helix	trans	-70.7	-34.7	-172.2	-72.8	105.8	0	0	0	113.1	L929 S1003 L1010 L1011	L929-W1007 HydrophobicContact CD2-CH2 4.21Å; S1003-W1007 WeakPolarHBondContact O-CB 3.33Å; S1003-W1007 PolarHBondContact O-N 3.48Å; W1007-L1010 HydrophobicContact CE3-CD2 3.7Å; W1007-L1010 HydrophobicContact CZ3-CD2 3.69Å; W1007-L1010 PolarHBondContact O-N 2.96Å; W1007-L1011 WeakPolarHBondContact O-CB 3.13Å; W1007-L1011 VanDerWaalsContact O-CG 3.28Å; W1007-L1011 WeakPolarHBondContact O-CG 3.24Å; W1007-L1011 PolarHBondContact O-N 3.35Å
1008	I	94.4	Very high	90.1	Very high	47 Å²	47	42.5 Å²	42.5	24%	0.241	25%	0.245	C	C	.	.	H	α-helix	trans	-67.5	-50.6	178.8	-60.9	172.1	0	0	0	111.1	L1004 L1010 L1011 A1012 I1108 I1111	L1004-I1008 HydrophobicContact CB-CD1 4.16Å; L1004-I1008 HydrophobicContact CD2-CD1 4.08Å; L1004-I1008 WeakPolarHBondContact O-CB 3.24Å; L1004-I1008 WeakPolarHBondContact O-CG1 2.8Å; L1004-I1008 PolarHBondContact O-N 3.5Å; I1008-L1010 VanDerWaalsContact C-N 3.33Å; I1008-L1010 PolarHBondContact O-N 3.43Å; I1008-L1011 PolarHBondContact O-N 3.24Å; I1008-A1012 WeakPolarHBondContact O-CB 3.39Å; I1008-A1012 PolarHBondContact O-N 2.74Å; I1008-I1108 HydrophobicContact CB-CD1 4.46Å; I1008-I1108 HydrophobicContact CG2-CD1 3.92Å; I1008-I1108 HydrophobicContact CG2-CG1 3.87Å; I1008-I1111 HydrophobicContact CD1-CG2 4.25Å
1009	P	92.5	Very high	89.7	Confident	1 Å²	1	44 Å²	44	1%	0.006	25%	0.251	C	S	.	.	H	α-helix	trans	-57.5	-43.8	171.4	-28.9	38	0	0	0	112.8	L1005 F1006 L1011 A1012 F1013 L1030 V1034 Y1037 I1108	L1005-P1009 VanDerWaalsContact O-CD 3.29Å; L1005-P1009 WeakPolarHBondContact O-CD 3.34Å; L1005-P1009 WeakPolarHBondContact O-CG 3.2Å; F1006-P1009 WeakPolarHBondContact O-CD 3.15Å; P1009-L1011 VanDerWaalsContact C-N 3.29Å; P1009-L1011 PolarHBondContact O-N 2.94Å; P1009-A1012 WeakPolarHBondContact O-CB 3.29Å; P1009-A1012 PolarHBondContact O-N 3.43Å; P1009-F1013 VanDerWaalsContact O-CD2 3.24Å; P1009-F1013 WeakPolarHBondContact O-CD2 3.46Å; P1009-F1013 PolarHBondContact O-N 2.71Å; P1009-L1030 HydrophobicContact CB-CD1 4.05Å; P1009-V1034 HydrophobicContact CB-CG2 3.67Å; P1009-V1034 HydrophobicContact CG-CG2 3.93Å; P1009-Y1037 HydrophobicContact CB-CD2 4.46Å; P1009-Y1037 HydrophobicContact CB-CE2 4.21Å; P1009-Y1037 HydrophobicContact CG-CD2 3.61Å; P1009-Y1037 HydrophobicContact CG-CE2 3.75Å; P1009-I1108 HydrophobicContact CG-CD1 3.64Å
1010	L	92.1	Very high	89.1	Confident	41 Å²	41	47 Å²	47	22%	0.215	28%	0.284	C	S	.	.	H	α-helix	trans	-57.1	-44.1	179.9	-176.5	73.2	0	0	0	112.2	L929 F1006 W1007 I1008 F1013 S1014 L1030	L929-L1010 HydrophobicContact CD1-CD1 4.02Å; L929-L1010 HydrophobicContact CD1-CD2 3.43Å; L929-L1010 VanDerWaalsContact CD1-CD2 3.43Å; L929-L1010 HydrophobicContact CD1-CG 4.38Å; F1006-L1010 HydrophobicContact CE1-CD2 4.21Å; F1006-L1010 HydrophobicContact CZ-CD2 4.49Å; F1006-L1010 WeakPolarHBondContact O-CB 3.41Å; F1006-L1010 PolarHBondContact O-N 3.23Å; W1007-L1010 HydrophobicContact CE3-CD2 3.7Å; W1007-L1010 HydrophobicContact CZ3-CD2 3.69Å; W1007-L1010 PolarHBondContact O-N 2.96Å; I1008-L1010 VanDerWaalsContact C-N 3.33Å; I1008-L1010 PolarHBondContact O-N 3.43Å; L1010-F1013 PolarHBondContact O-N 3.5Å; L1010-S1014 PolarHBondContact O-N 2.98Å; L1010-L1030 HydrophobicContact CD1-CD2 3.96Å
1011	L	91.9	Very high	88.6	Confident	120 Å²	120	47.9 Å²	47.9	63%	0.628	29%	0.294	S	S	*	.	H	α-helix	trans	-66.9	-37.1	175.3	-70.8	170.8	0	0	0	112.2	W1007 I1008 P1009 F1013 S1014	W1007-L1011 WeakPolarHBondContact O-CB 3.13Å; W1007-L1011 VanDerWaalsContact O-CG 3.28Å; W1007-L1011 WeakPolarHBondContact O-CG 3.24Å; W1007-L1011 PolarHBondContact O-N 3.35Å; I1008-L1011 PolarHBondContact O-N 3.24Å; P1009-L1011 VanDerWaalsContact C-N 3.29Å; P1009-L1011 PolarHBondContact O-N 2.94Å; L1011-F1013 VanDerWaalsContact C-N 3.32Å; L1011-F1013 PolarHBondContact O-N 3.21Å; L1011-S1014 PolarHBondContact O-N 2.96Å; L1011-S1014 PolarHBondContact O-OG 3.1Å
1012	A	89.4	Confident	88	Confident	38 Å²	38	50 Å²	50	31%	0.314	32%	0.315	S	S	.	.	H	α-helix	trans	-66.7	-34.8	176.9	0	0	0	0	0	112.3	I1008 P1009 I1100	I1008-A1012 WeakPolarHBondContact O-CB 3.39Å; I1008-A1012 PolarHBondContact O-N 2.74Å; P1009-A1012 WeakPolarHBondContact O-CB 3.29Å; P1009-A1012 PolarHBondContact O-N 3.43Å; A1012-I1100 HydrophobicContact CB-CG2 3.77Å
1013	F	88.3	Confident	87.6	Confident	17 Å²	17	55.6 Å²	55.6	8%	0.075	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	1.4	178.4	-78.6	-98.2	0	0	0	113.5	P1009 L1010 L1011 V1015 V1018 V1029 L1030 S1033 I1100	P1009-F1013 VanDerWaalsContact O-CD2 3.24Å; P1009-F1013 WeakPolarHBondContact O-CD2 3.46Å; P1009-F1013 PolarHBondContact O-N 2.71Å; L1010-F1013 PolarHBondContact O-N 3.5Å; L1011-F1013 VanDerWaalsContact C-N 3.32Å; L1011-F1013 PolarHBondContact O-N 3.21Å; F1013-V1015 PolarHBondContact O-N 3.42Å; F1013-V1018 HydrophobicContact CD1-CG1 4.02Å; F1013-V1018 HydrophobicContact CD1-CG2 3.89Å; F1013-V1018 HydrophobicContact CE1-CG1 3.78Å; F1013-V1018 HydrophobicContact CE1-CG2 4.49Å; F1013-V1029 HydrophobicContact CE1-CG1 3.93Å; F1013-V1029 HydrophobicContact CZ-CG1 4.5Å; F1013-L1030 HydrophobicContact CB-CD1 4.17Å; F1013-L1030 HydrophobicContact CD2-CD1 3.9Å; F1013-L1030 HydrophobicContact CE2-CD1 4.47Å; F1013-L1030 HydrophobicContact CG-CD1 4.04Å; F1013-S1033 WeakPolarHBondContact CZ-OG 3.35Å; F1013-I1100 HydrophobicContact CD2-CG2 4.32Å; F1013-I1100 HydrophobicContact CE2-CG2 4.1Å
1014	S	85	Confident	87.2	Confident	88 Å²	88	58.8 Å²	58.8	62%	0.615	36%	0.36	S	S	*	.			trans	-70	-18.9	-179	73.5	0	0	0	0	113	L1010 L1011 G1016	L1010-S1014 PolarHBondContact O-N 2.98Å; L1011-S1014 PolarHBondContact O-N 2.96Å; L1011-S1014 PolarHBondContact O-OG 3.1Å; S1014-G1016 PolarHBondContact O-N 3.37Å
1015	V	76.8	Confident	86.7	Confident	86 Å²	86	58.9 Å²	58.9	52%	0.521	36%	0.363	S	S	.	.	S	Bend	trans	-77.9	111.2	172.6	-174.1	0	0	0	0	107.7	F1013 T1017 V1018	F1013-V1015 PolarHBondContact O-N 3.42Å; V1015-T1017 PolarHBondContact O-N 3.1Å; V1015-V1018 WeakPolarHBondContact O-CG2 3.48Å
1016	G	70.6	Confident	86.2	Confident	46 Å²	46	61.4 Å²	61.4	47%	0.474	38%	0.381	S	S	.	.	S	Bend	trans	-54.2	-29.3	-170.3	0	0	0	0	0	115.1	S1014 T1024	S1014-G1016 PolarHBondContact O-N 3.37Å; G1016-T1024 WeakPolarHBondContact O-CA 3.28Å; G1016-T1024 WeakPolarHBondContact O-CG2 3.43Å
1017	T	80.1	Confident	86	Confident	89 Å²	89	64.3 Å²	64.3	55%	0.546	40%	0.396	S	S	.	.	B	Isolated β-bridge	trans	-95	95.9	176.5	54.8	0	0	0	0	110.9	V1015	V1015-T1017 PolarHBondContact O-N 3.1Å
1018	V	81.2	Confident	85.8	Confident	11 Å²	11	61.9 Å²	61.9	7%	0.067	39%	0.39	C	S	.	.			trans	-92.5	-27.6	-175.5	173	0	0	0	0	112.2	F1013 V1015 Q1023 C1098 I1100	F1013-V1018 HydrophobicContact CD1-CG1 4.02Å; F1013-V1018 HydrophobicContact CD1-CG2 3.89Å; F1013-V1018 HydrophobicContact CE1-CG1 3.78Å; F1013-V1018 HydrophobicContact CE1-CG2 4.49Å; V1015-V1018 WeakPolarHBondContact O-CG2 3.48Å; V1018-Q1023 PolarHBondContact N-O 3.06Å; V1018-C1098 HydrophobicContact CG1-CB 4.45Å; V1018-C1098 WeakPolarHBondContact CG1-SG 3.34Å; V1018-I1100 HydrophobicContact CB-CD1 4.48Å; V1018-I1100 HydrophobicContact CG1-CD1 4.03Å; V1018-I1100 HydrophobicContact CG1-CG1 4.41Å; V1018-I1100 HydrophobicContact CG2-CD1 4.46Å
1019	Y	85.1	Confident	85.7	Confident	32 Å²	32	59.8 Å²	59.8	13%	0.125	38%	0.379	C	S	.	.	S	Bend	trans	-98	148.8	-177.5	-62	-75	0	0	0	111.7	N1021 G1022 Q1023 A1094 C1098	Y1019-N1021 WeakPolarHBondContact CB-OD1 3.29Å; Y1019-N1021 PolarHBondContact O-N 3.2Å; Y1019-N1021 VanDerWaalsContact O-N 3.12Å; Y1019-G1022 PolarHBondContact O-N 3.03Å; Y1019-Q1023 HydrophobicContact CD2-CB 3.83Å; Y1019-Q1023 WeakPolarHBondContact CD2-O 3.21Å; Y1019-Q1023 HydrophobicContact CG-CB 4.43Å; Y1019-A1094 WeakPolarHBondContact CE1-O 3.46Å; Y1019-A1094 PolarHBondContact OH-O 3.03Å; Y1019-C1098 HydrophobicContact CD1-CB 4.46Å; Y1019-C1098 HydrophobicContact CE1-CB 3.9Å
1020	A	82.3	Confident	85.7	Confident	120 Å²	120	60.5 Å²	60.5	99%	0.992	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-19.8	177.2	0	0	0	0	0	113.5	G1022	A1020-G1022 VanDerWaalsContact C-N 3.31Å
1021	N	83.9	Confident	85.7	Confident	104 Å²	104	58.6 Å²	58.6	56%	0.556	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	3.2	175.5	66.6	2.6	0	0	0	113.7	Y1019 Q1023	Y1019-N1021 WeakPolarHBondContact CB-OD1 3.29Å; Y1019-N1021 PolarHBondContact O-N 3.2Å; Y1019-N1021 VanDerWaalsContact O-N 3.12Å; N1021-Q1023 VanDerWaalsContact C-N 3.34Å; N1021-Q1023 PolarHBondContact ND2-OE1 3.37Å; N1021-Q1023 PolarHBondContact O-N 3.18Å; N1021-Q1023 VanDerWaalsContact OD1-CB 3.3Å; N1021-Q1023 WeakPolarHBondContact OD1-CB 3.33Å; N1021-Q1023 WeakPolarHBondContact OD1-CG 3.48Å; N1021-Q1023 PolarHBondContact OD1-N 2.94Å
1022	G	83.9	Confident	85.8	Confident	43 Å²	43	53 Å²	53	44%	0.443	34%	0.343	S	S	.	.	S	Bend	trans	81.2	4.4	-179.9	0	0	0	0	0	115.3	Y1019 A1020	Y1019-G1022 PolarHBondContact O-N 3.03Å; A1020-G1022 VanDerWaalsContact C-N 3.31Å
1023	Q	86.7	Confident	86	Confident	118 Å²	118	51.1 Å²	51.1	55%	0.551	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-71.4	154.5	176.3	-68.9	177.1	-24	0	0	112	V1018 Y1019 N1021	V1018-Q1023 PolarHBondContact N-O 3.06Å; Y1019-Q1023 HydrophobicContact CD2-CB 3.83Å; Y1019-Q1023 WeakPolarHBondContact CD2-O 3.21Å; Y1019-Q1023 HydrophobicContact CG-CB 4.43Å; N1021-Q1023 VanDerWaalsContact C-N 3.34Å; N1021-Q1023 PolarHBondContact ND2-OE1 3.37Å; N1021-Q1023 PolarHBondContact O-N 3.18Å; N1021-Q1023 VanDerWaalsContact OD1-CB 3.3Å; N1021-Q1023 WeakPolarHBondContact OD1-CB 3.33Å; N1021-Q1023 WeakPolarHBondContact OD1-CG 3.48Å; N1021-Q1023 PolarHBondContact OD1-N 2.94Å
1024	T	86.7	Confident	86.3	Confident	107 Å²	107	50.3 Å²	50.3	66%	0.656	33%	0.325	S	S	*	.	B	Isolated β-bridge	trans	-91.7	154.2	175.1	58.2	0	0	0	0	111	G1016	G1016-T1024 WeakPolarHBondContact O-CA 3.28Å; G1016-T1024 WeakPolarHBondContact O-CG2 3.43Å
1025	S	83.8	Confident	86.8	Confident	36 Å²	36	46.1 Å²	46.1	25%	0.252	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-92.1	148.6	177.9	60.9	0	0	0	0	112.5
1026	S	86.8	Confident	87.6	Confident	53 Å²	53	42 Å²	42	37%	0.371	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-85.6	166.5	170.8	74.3	0	0	0	0	112.2	L1028 V1029 L1030	S1026-L1028 PolarHBondContact O-N 3.14Å; S1026-L1028 PolarHBondContact OG-N 3.13Å; S1026-V1029 PolarHBondContact O-N 2.93Å; S1026-V1029 VanDerWaalsContact O-N 3.16Å; S1026-V1029 PolarHBondContact OG-N 3.26Å; S1026-L1030 PolarHBondContact O-N 3.31Å
1027	L	89.4	Confident	88.8	Confident	62 Å²	62	39.9 Å²	39.9	33%	0.325	25%	0.248	S	C	.	.	H	α-helix	trans	-55.5	-37	172.5	175.8	63.3	0	0	0	112	F926 V1029 L1030 G1031	F926-L1027 HydrophobicContact CE2-CD1 3.59Å; F926-L1027 HydrophobicContact CZ-CD1 3.65Å; F926-L1027 HydrophobicContact CZ-CD2 3.81Å; F926-L1027 HydrophobicContact CZ-CG 4.4Å; L1027-V1029 VanDerWaalsContact C-N 3.34Å; L1027-V1029 PolarHBondContact O-N 2.83Å; L1027-L1030 WeakPolarHBondContact O-CB 3.28Å; L1027-L1030 PolarHBondContact O-N 2.95Å; L1027-G1031 PolarHBondContact O-N 3.37Å
1028	L	91	Very high	89.6	Confident	40 Å²	40	35.7 Å²	35.7	21%	0.209	22%	0.222	C	C	.	.	H	α-helix	trans	-70.8	-29.9	-178.4	-64.8	172.3	0	0	0	112.2	S1026 G1031 N1032 D1087 M1088 M1091	S1026-L1028 PolarHBondContact O-N 3.14Å; S1026-L1028 PolarHBondContact OG-N 3.13Å; L1028-G1031 PolarHBondContact O-N 3.48Å; L1028-N1032 VanDerWaalsContact O-CB 3.27Å; L1028-N1032 WeakPolarHBondContact O-CB 3.4Å; L1028-N1032 VanDerWaalsContact O-CG 3.24Å; L1028-N1032 PolarHBondContact O-N 2.93Å; L1028-N1032 PolarHBondContact O-ND2 2.85Å; L1028-D1087 HydrophobicContact CD1-CB 4.02Å; L1028-D1087 WeakPolarHBondContact CD1-O 3.49Å; L1028-M1088 HydrophobicContact CB-CE 3.9Å; L1028-M1088 HydrophobicContact CD1-CE 3.71Å; L1028-M1088 HydrophobicContact CD2-CE 3.66Å; L1028-M1088 HydrophobicContact CG-CE 3.94Å; L1028-M1091 HydrophobicContact CB-SD 3.89Å
1029	V	91.9	Very high	90.2	Very high	3 Å²	3	35.1 Å²	35.1	2%	0.018	22%	0.219	C	C	.	.	H	α-helix	trans	-65.3	-45.4	171.9	176.6	0	0	0	0	110.2	F1013 S1026 L1027 S1033 M1091 A1094 V1095	F1013-V1029 HydrophobicContact CE1-CG1 3.93Å; F1013-V1029 HydrophobicContact CZ-CG1 4.5Å; S1026-V1029 PolarHBondContact O-N 2.93Å; S1026-V1029 VanDerWaalsContact O-N 3.16Å; S1026-V1029 PolarHBondContact OG-N 3.26Å; L1027-V1029 VanDerWaalsContact C-N 3.34Å; L1027-V1029 PolarHBondContact O-N 2.83Å; V1029-S1033 VanDerWaalsContact O-CB 3.3Å; V1029-S1033 WeakPolarHBondContact O-CB 3.29Å; V1029-S1033 PolarHBondContact O-N 3.45Å; V1029-S1033 PolarHBondContact O-OG 3.36Å; V1029-M1091 HydrophobicContact CG2-SD 4.1Å; V1029-A1094 HydrophobicContact CG2-CB 3.95Å; V1029-V1095 HydrophobicContact CG1-CG2 4.37Å
1030	L	91.9	Very high	90.7	Very high	17 Å²	17	34 Å²	34	9%	0.089	22%	0.216	C	C	.	.	H	α-helix	trans	-61.1	-47.1	173.4	175.1	64.7	0	0	0	110.7	P1009 L1010 F1013 S1026 L1027 S1033 V1034	P1009-L1030 HydrophobicContact CB-CD1 4.05Å; L1010-L1030 HydrophobicContact CD1-CD2 3.96Å; F1013-L1030 HydrophobicContact CB-CD1 4.17Å; F1013-L1030 HydrophobicContact CD2-CD1 3.9Å; F1013-L1030 HydrophobicContact CE2-CD1 4.47Å; F1013-L1030 HydrophobicContact CG-CD1 4.04Å; S1026-L1030 PolarHBondContact O-N 3.31Å; L1027-L1030 WeakPolarHBondContact O-CB 3.28Å; L1027-L1030 PolarHBondContact O-N 2.95Å; L1030-S1033 WeakPolarHBondContact O-CB 3.4Å; L1030-S1033 PolarHBondContact O-N 3.03Å; L1030-V1034 HydrophobicContact CD1-CG2 4Å; L1030-V1034 HydrophobicContact CG-CG2 4.36Å; L1030-V1034 WeakPolarHBondContact O-CB 3.49Å; L1030-V1034 VanDerWaalsContact O-CG2 3.29Å; L1030-V1034 WeakPolarHBondContact O-CG2 3.19Å; L1030-V1034 PolarHBondContact O-N 3.38Å
1031	G	92.9	Very high	91.4	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61.1	-47.5	-179.2	0	0	0	0	0	113.1	F938 L1027 L1028 S1033 V1034 Y1035	F938-G1031 WeakPolarHBondContact CD1-O 3.28Å; F938-G1031 WeakPolarHBondContact CE1-O 3.38Å; L1027-G1031 PolarHBondContact O-N 3.37Å; L1028-G1031 PolarHBondContact O-N 3.48Å; G1031-S1033 VanDerWaalsContact C-N 3.32Å; G1031-S1033 PolarHBondContact O-N 3.34Å; G1031-V1034 PolarHBondContact O-N 3Å; G1031-Y1035 VanDerWaalsContact O-CB 3.25Å; G1031-Y1035 WeakPolarHBondContact O-CB 3.49Å; G1031-Y1035 PolarHBondContact O-N 3.44Å
1032	N	93.7	Very high	91.9	Very high	2 Å²	2	23.4 Å²	23.4	1%	0.011	14%	0.142	C	C	.	.	H	α-helix	trans	-66.6	-33.5	176.8	-71.6	-23.4	0	0	0	112.1	L1028 T1036 L1072 V1095	L1028-N1032 VanDerWaalsContact O-CB 3.27Å; L1028-N1032 WeakPolarHBondContact O-CB 3.4Å; L1028-N1032 VanDerWaalsContact O-CG 3.24Å; L1028-N1032 PolarHBondContact O-N 2.93Å; L1028-N1032 PolarHBondContact O-ND2 2.85Å; N1032-T1036 WeakPolarHBondContact O-CB 3.42Å; N1032-T1036 PolarHBondContact O-N 3.27Å; N1032-T1036 PolarHBondContact O-OG1 3.31Å; N1032-L1072 HydrophobicContact CB-CD1 4.38Å; N1032-V1095 HydrophobicContact CB-CG2 3.8Å
1033	S	93.6	Very high	92.4	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-65.4	-52.3	173.8	-59.6	0	0	0	0	111.3	F1013 V1029 L1030 G1031 Y1035 T1036 Y1037	F1013-S1033 WeakPolarHBondContact CZ-OG 3.35Å; V1029-S1033 VanDerWaalsContact O-CB 3.3Å; V1029-S1033 WeakPolarHBondContact O-CB 3.29Å; V1029-S1033 PolarHBondContact O-N 3.45Å; V1029-S1033 PolarHBondContact O-OG 3.36Å; L1030-S1033 WeakPolarHBondContact O-CB 3.4Å; L1030-S1033 PolarHBondContact O-N 3.03Å; G1031-S1033 VanDerWaalsContact C-N 3.32Å; G1031-S1033 PolarHBondContact O-N 3.34Å; S1033-Y1035 VanDerWaalsContact C-N 3.32Å; S1033-Y1035 PolarHBondContact O-N 3.04Å; S1033-T1036 WeakPolarHBondContact O-CB 3.36Å; S1033-T1036 PolarHBondContact O-N 3Å; S1033-Y1037 WeakPolarHBondContact O-CD2 3.04Å; S1033-Y1037 PolarHBondContact O-N 3.23Å
1034	V	95.1	Very high	92.8	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-58.1	-45	176.1	171.8	0	0	0	0	110.7	I922 F938 P1009 L1030 G1031 T1036 Y1037 V1038	I922-V1034 HydrophobicContact CD1-CG1 4.01Å; I922-V1034 HydrophobicContact CG2-CG1 4.07Å; F938-V1034 HydrophobicContact CE1-CB 4.17Å; F938-V1034 HydrophobicContact CE1-CG1 3.94Å; F938-V1034 HydrophobicContact CZ-CG1 4.01Å; P1009-V1034 HydrophobicContact CB-CG2 3.67Å; P1009-V1034 HydrophobicContact CG-CG2 3.93Å; L1030-V1034 HydrophobicContact CD1-CG2 4Å; L1030-V1034 HydrophobicContact CG-CG2 4.36Å; L1030-V1034 WeakPolarHBondContact O-CB 3.49Å; L1030-V1034 VanDerWaalsContact O-CG2 3.29Å; L1030-V1034 WeakPolarHBondContact O-CG2 3.19Å; L1030-V1034 PolarHBondContact O-N 3.38Å; G1031-V1034 PolarHBondContact O-N 3Å; V1034-T1036 VanDerWaalsContact C-N 3.33Å; V1034-T1036 PolarHBondContact O-N 3.4Å; V1034-Y1037 PolarHBondContact O-N 3.48Å; V1034-V1038 HydrophobicContact CG1-CG2 4.34Å; V1034-V1038 VanDerWaalsContact O-CG2 3.28Å; V1034-V1038 WeakPolarHBondContact O-CG2 3.29Å; V1034-V1038 PolarHBondContact O-N 3.05Å
1035	Y	94.6	Very high	93.2	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-61	-42.9	179	-165.4	-81.6	0	0	0	111.7	L919 F938 S942 Y946 F950 G1031 S1033 Y1037 V1038 V1039 W1068	L919-Y1035 HydrophobicContact CD1-CD2 3.91Å; L919-Y1035 HydrophobicContact CD1-CE2 3.99Å; L919-Y1035 HydrophobicContact CD2-CE2 4.22Å; F938-Y1035 HydrophobicContact CB-CD2 4.35Å; F938-Y1035 AromaticContact CD1-CD2 3.68Å; F938-Y1035 HydrophobicContact CD1-CD2 3.68Å; F938-Y1035 HydrophobicContact CD1-CG 4.22Å; F938-Y1035 HydrophobicContact CD2-CD2 4.37Å; F938-Y1035 AromaticContact CE1-CD2 3.98Å; F938-Y1035 HydrophobicContact CE1-CD2 3.98Å; F938-Y1035 HydrophobicContact CE1-CG 4.38Å; F938-Y1035 AromaticContact CG-CD2 3.88Å; F938-Y1035 HydrophobicContact CG-CD2 3.88Å; F938-Y1035 HydrophobicContact CZ-CD2 4.44Å; S942-Y1035 WeakPolarHBondContact O-CE2 3.42Å; S942-Y1035 PolarHBondContact O-OH 3.42Å; Y946-Y1035 WeakPolarHBondContact CA-OH 3.23Å; Y946-Y1035 VanDerWaalsContact CB-OH 3.29Å; Y946-Y1035 WeakPolarHBondContact CB-OH 3.49Å; Y946-Y1035 HydrophobicContact CD2-CE2 4.33Å; Y946-Y1035 AromaticContact CD2-CZ 3.88Å; Y946-Y1035 WeakPolarHBondContact CD2-OH 3.49Å; F950-Y1035 HydrophobicContact CD2-CE1 4.2Å; F950-Y1035 VanDerWaalsContact CD2-OH 3.23Å; F950-Y1035 WeakPolarHBondContact CD2-OH 3.44Å; G1031-Y1035 VanDerWaalsContact O-CB 3.25Å; G1031-Y1035 WeakPolarHBondContact O-CB 3.49Å; G1031-Y1035 PolarHBondContact O-N 3.44Å; S1033-Y1035 VanDerWaalsContact C-N 3.32Å; S1033-Y1035 PolarHBondContact O-N 3.04Å; Y1035-Y1037 VanDerWaalsContact C-N 3.33Å; Y1035-Y1037 PolarHBondContact O-N 3.26Å; Y1035-V1038 WeakPolarHBondContact O-CB 3.36Å; Y1035-V1038 PolarHBondContact O-N 2.7Å; Y1035-V1039 HydrophobicContact CD1-CG2 3.68Å; Y1035-V1039 HydrophobicContact CE1-CG2 3.4Å; Y1035-V1039 VanDerWaalsContact CE1-CG2 3.4Å; Y1035-V1039 WeakPolarHBondContact O-CG2 3.25Å; Y1035-V1039 PolarHBondContact O-N 2.97Å; Y1035-W1068 AromaticContact CD1-CD2 3.83Å; Y1035-W1068 HydrophobicContact CD1-CD2 3.83Å; Y1035-W1068 AromaticContact CD1-CE2 3.58Å; Y1035-W1068 AromaticContact CD1-CE3 3.85Å; Y1035-W1068 HydrophobicContact CD1-CE3 3.85Å; Y1035-W1068 AromaticContact CD1-CH2 3.4Å; Y1035-W1068 HydrophobicContact CD1-CH2 3.4Å; Y1035-W1068 AromaticContact CD1-CZ2 3.38Å; Y1035-W1068 HydrophobicContact CD1-CZ2 3.38Å; Y1035-W1068 AromaticContact CD1-CZ3 3.63Å; Y1035-W1068 HydrophobicContact CD1-CZ3 3.63Å; Y1035-W1068 AromaticContact CE1-CD2 3.85Å; Y1035-W1068 HydrophobicContact CE1-CD2 3.85Å; Y1035-W1068 AromaticContact CE1-CE3 3.5Å; Y1035-W1068 HydrophobicContact CE1-CE3 3.5Å; Y1035-W1068 VanDerWaalsContact CE1-CE3 3.5Å; Y1035-W1068 AromaticContact CE1-CH2 3.73Å; Y1035-W1068 HydrophobicContact CE1-CH2 3.73Å; Y1035-W1068 HydrophobicContact CE1-CZ2 4.06Å; Y1035-W1068 AromaticContact CE1-CZ3 3.43Å; Y1035-W1068 HydrophobicContact CE1-CZ3 3.43Å; Y1035-W1068 VanDerWaalsContact CE1-CZ3 3.43Å; Y1035-W1068 HydrophobicContact CG-CH2 4.05Å; Y1035-W1068 HydrophobicContact CG-CZ2 4.09Å
1036	T	95.3	Very high	93.6	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-58.5	-46.3	175	-56.8	0	0	0	0	110.9	N1032 S1033 V1034 V1038 V1039 V1040 W1068 F1069 F1101 F1105	N1032-T1036 WeakPolarHBondContact O-CB 3.42Å; N1032-T1036 PolarHBondContact O-N 3.27Å; N1032-T1036 PolarHBondContact O-OG1 3.31Å; S1033-T1036 WeakPolarHBondContact O-CB 3.36Å; S1033-T1036 PolarHBondContact O-N 3Å; V1034-T1036 VanDerWaalsContact C-N 3.33Å; V1034-T1036 PolarHBondContact O-N 3.4Å; T1036-V1038 VanDerWaalsContact C-N 3.32Å; T1036-V1038 PolarHBondContact O-N 2.92Å; T1036-V1039 PolarHBondContact O-N 3.42Å; T1036-V1040 HydrophobicContact CG2-CG2 4.44Å; T1036-V1040 VanDerWaalsContact O-CG2 3.25Å; T1036-V1040 WeakPolarHBondContact O-CG2 3.23Å; T1036-V1040 PolarHBondContact O-N 3.2Å; T1036-W1068 PolarHBondContact OG1-NE1 3.33Å; T1036-F1069 HydrophobicContact CG2-CE1 4.39Å; T1036-F1069 HydrophobicContact CG2-CE2 4.38Å; T1036-F1069 HydrophobicContact CG2-CZ 3.85Å; T1036-F1101 HydrophobicContact CG2-CE2 3.95Å; T1036-F1101 HydrophobicContact CG2-CZ 3.93Å; T1036-F1105 HydrophobicContact CG2-CD2 4.24Å
1037	Y	95.8	Very high	93.9	Very high	1 Å²	1	9.3 Å²	9.3	0%	0.004	5%	0.05	C	C	.	.	H	α-helix	trans	-64.7	-36.7	178.2	-52.6	-31.3	0	0	0	112.3	P1009 S1033 V1034 Y1035 T1041 F1101 G1104 F1105 I1108	P1009-Y1037 HydrophobicContact CB-CD2 4.46Å; P1009-Y1037 HydrophobicContact CB-CE2 4.21Å; P1009-Y1037 HydrophobicContact CG-CD2 3.61Å; P1009-Y1037 HydrophobicContact CG-CE2 3.75Å; S1033-Y1037 WeakPolarHBondContact O-CD2 3.04Å; S1033-Y1037 PolarHBondContact O-N 3.23Å; V1034-Y1037 PolarHBondContact O-N 3.48Å; Y1035-Y1037 VanDerWaalsContact C-N 3.33Å; Y1035-Y1037 PolarHBondContact O-N 3.26Å; Y1037-T1041 WeakPolarHBondContact O-CB 3.34Å; Y1037-T1041 PolarHBondContact O-N 3.06Å; Y1037-T1041 PolarHBondContact O-OG1 3.21Å; Y1037-F1101 HydrophobicContact CE1-CD2 4.27Å; Y1037-F1101 HydrophobicContact CE1-CE2 4.32Å; Y1037-F1101 VanDerWaalsContact OH-CA 3.29Å; Y1037-F1101 WeakPolarHBondContact OH-CA 3.46Å; Y1037-F1101 PolarHBondContact OH-O 3.24Å; Y1037-G1104 VanDerWaalsContact CE1-C 3.43Å; Y1037-G1104 WeakPolarHBondContact OH-CA 3.27Å; Y1037-F1105 HydrophobicContact CE1-CB 3.91Å; Y1037-I1108 HydrophobicContact CD2-CD1 3.7Å; Y1037-I1108 HydrophobicContact CE2-CD1 3.56Å; Y1037-I1108 HydrophobicContact CG-CD1 4.4Å
1038	V	95.5	Very high	94	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-62.4	-53.3	174	173.4	0	0	0	0	110.4	L919 I922 Y946 L1005 V1034 Y1035 T1036 V1040 T1041 V1042	L919-V1038 HydrophobicContact CB-CG1 4.37Å; L919-V1038 HydrophobicContact CD1-CB 4.45Å; L919-V1038 HydrophobicContact CD1-CG1 3.95Å; L919-V1038 HydrophobicContact CD1-CG2 4.47Å; I922-V1038 HydrophobicContact CD1-CG2 3.32Å; Y946-V1038 HydrophobicContact CE2-CG1 4.31Å; L1005-V1038 HydrophobicContact CB-CG2 4.25Å; L1005-V1038 HydrophobicContact CD1-CG2 3.99Å; V1034-V1038 HydrophobicContact CG1-CG2 4.34Å; V1034-V1038 VanDerWaalsContact O-CG2 3.28Å; V1034-V1038 WeakPolarHBondContact O-CG2 3.29Å; V1034-V1038 PolarHBondContact O-N 3.05Å; Y1035-V1038 WeakPolarHBondContact O-CB 3.36Å; Y1035-V1038 PolarHBondContact O-N 2.7Å; T1036-V1038 VanDerWaalsContact C-N 3.32Å; T1036-V1038 PolarHBondContact O-N 2.92Å; V1038-V1040 VanDerWaalsContact C-N 3.32Å; V1038-V1040 PolarHBondContact O-N 2.9Å; V1038-T1041 PolarHBondContact O-N 3.43Å; V1038-V1042 HydrophobicContact CG1-CG1 4.26Å; V1038-V1042 WeakPolarHBondContact O-CG1 3.47Å; V1038-V1042 WeakPolarHBondContact O-CG2 3.48Å; V1038-V1042 PolarHBondContact O-N 2.98Å
1039	V	94.6	Very high	94	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-56.4	-47.2	-179.4	172.4	0	0	0	0	110.9	Y946 Y1035 T1036 V1042 C1043 W1068	Y946-V1039 HydrophobicContact CE2-CG2 4.47Å; Y1035-V1039 HydrophobicContact CD1-CG2 3.68Å; Y1035-V1039 HydrophobicContact CE1-CG2 3.4Å; Y1035-V1039 VanDerWaalsContact CE1-CG2 3.4Å; Y1035-V1039 WeakPolarHBondContact O-CG2 3.25Å; Y1035-V1039 PolarHBondContact O-N 2.97Å; T1036-V1039 PolarHBondContact O-N 3.42Å; V1039-V1042 WeakPolarHBondContact O-CG2 3.29Å; V1039-C1043 VanDerWaalsContact O-CB 3.29Å; V1039-C1043 WeakPolarHBondContact O-CB 3.47Å; V1039-C1043 PolarHBondContact O-N 3.37Å; V1039-C1043 PolarHBondContact O-SG 2.88Å; V1039-W1068 HydrophobicContact CG1-CB 4.1Å; V1039-W1068 HydrophobicContact CG1-CG 4.43Å; V1039-W1068 HydrophobicContact CG2-CG 4.37Å
1040	V	95.7	Very high	93.9	Very high	9 Å²	9	7.6 Å²	7.6	6%	0.055	4%	0.04	C	C	.	.	H	α-helix	trans	-63.6	-48.4	178.5	174.7	0	0	0	0	110.9	T1036 V1038 V1042 C1043 L1044 I1065 F1105 P1109	T1036-V1040 HydrophobicContact CG2-CG2 4.44Å; T1036-V1040 VanDerWaalsContact O-CG2 3.25Å; T1036-V1040 WeakPolarHBondContact O-CG2 3.23Å; T1036-V1040 PolarHBondContact O-N 3.2Å; V1038-V1040 VanDerWaalsContact C-N 3.32Å; V1038-V1040 PolarHBondContact O-N 2.9Å; V1040-V1042 PolarHBondContact O-N 3.4Å; V1040-C1043 PolarHBondContact O-N 3.44Å; V1040-L1044 HydrophobicContact CG1-CD1 3.74Å; V1040-L1044 HydrophobicContact CG1-CG 4.24Å; V1040-L1044 WeakPolarHBondContact O-CB 3.49Å; V1040-L1044 VanDerWaalsContact O-CG 3.29Å; V1040-L1044 WeakPolarHBondContact O-CG 3.32Å; V1040-L1044 PolarHBondContact O-N 3.18Å; V1040-I1065 HydrophobicContact CG2-CG2 4.18Å; V1040-F1105 HydrophobicContact CG2-CD2 4.26Å; V1040-F1105 HydrophobicContact CG2-CE2 3.7Å; V1040-P1109 HydrophobicContact CB-CG 4.32Å; V1040-P1109 HydrophobicContact CG1-CB 4.1Å; V1040-P1109 HydrophobicContact CG1-CG 3.82Å
1041	T	96.4	Very high	93.6	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-63.9	-42.4	-177.5	-58.1	0	0	0	0	111.8	L1005 Y1037 V1038 K1045 A1112 L1113	L1005-T1041 HydrophobicContact CD1-CG2 4.2Å; L1005-T1041 HydrophobicContact CD2-CG2 4.45Å; L1005-T1041 WeakPolarHBondContact CD2-OG1 3.46Å; Y1037-T1041 WeakPolarHBondContact O-CB 3.34Å; Y1037-T1041 PolarHBondContact O-N 3.06Å; Y1037-T1041 PolarHBondContact O-OG1 3.21Å; V1038-T1041 PolarHBondContact O-N 3.43Å; T1041-K1045 WeakPolarHBondContact O-CB 3.16Å; T1041-K1045 PolarHBondContact O-N 2.85Å; T1041-A1112 HydrophobicContact CG2-CB 3.86Å; T1041-L1113 HydrophobicContact CG2-CD2 4.23Å; T1041-L1113 HydrophobicContact CG2-CG 4.29Å
1042	V	94.9	Very high	93.1	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-69.5	-38.9	177.6	-58	0	0	0	0	111.8	Y911 Y914 K915 T951 V1038 V1039 V1040 K1045 A1046	Y911-V1042 WeakPolarHBondContact CE2-O 3.45Å; Y911-V1042 PolarHBondContact OH-O 2.83Å; Y914-V1042 HydrophobicContact CE1-CB 4.5Å; Y914-V1042 HydrophobicContact CE1-CG1 4.13Å; K915-V1042 HydrophobicContact CB-CB 4.41Å; K915-V1042 HydrophobicContact CB-CG1 4.27Å; T951-V1042 HydrophobicContact CG2-CG2 3.89Å; V1038-V1042 HydrophobicContact CG1-CG1 4.26Å; V1038-V1042 WeakPolarHBondContact O-CG1 3.47Å; V1038-V1042 WeakPolarHBondContact O-CG2 3.48Å; V1038-V1042 PolarHBondContact O-N 2.98Å; V1039-V1042 WeakPolarHBondContact O-CG2 3.29Å; V1040-V1042 PolarHBondContact O-N 3.4Å; V1042-K1045 WeakPolarHBondContact O-CB 3.3Å; V1042-K1045 PolarHBondContact O-N 3.43Å; V1042-A1046 PolarHBondContact O-N 2.78Å
1043	C	94.5	Very high	92.8	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-66.5	-43.4	177.3	-69.1	0	0	0	0	111.9	V1039 V1040 K1045 A1046 G1047 I1061 I1065	V1039-C1043 VanDerWaalsContact O-CB 3.29Å; V1039-C1043 WeakPolarHBondContact O-CB 3.47Å; V1039-C1043 PolarHBondContact O-N 3.37Å; V1039-C1043 PolarHBondContact O-SG 2.88Å; V1040-C1043 PolarHBondContact O-N 3.44Å; C1043-K1045 VanDerWaalsContact C-N 3.33Å; C1043-A1046 VanDerWaalsContact O-CB 3.3Å; C1043-A1046 WeakPolarHBondContact O-CB 3.23Å; C1043-A1046 PolarHBondContact O-N 2.87Å; C1043-G1047 PolarHBondContact O-N 3.33Å; C1043-I1061 HydrophobicContact CB-CG2 4.15Å; C1043-I1065 HydrophobicContact CB-CD1 3.86Å; C1043-I1065 HydrophobicContact CB-CG1 3.8Å
1044	L	95.1	Very high	92.3	Very high	53 Å²	53	16.3 Å²	16.3	28%	0.277	8%	0.083	S	C	.	.	H	α-helix	trans	-66	-36.7	173.6	-69.6	178.5	0	0	0	111.8	V1040 A1046 G1047 L1048 W1062 P1109 L1113	V1040-L1044 HydrophobicContact CG1-CD1 3.74Å; V1040-L1044 HydrophobicContact CG1-CG 4.24Å; V1040-L1044 WeakPolarHBondContact O-CB 3.49Å; V1040-L1044 VanDerWaalsContact O-CG 3.29Å; V1040-L1044 WeakPolarHBondContact O-CG 3.32Å; V1040-L1044 PolarHBondContact O-N 3.18Å; L1044-A1046 VanDerWaalsContact C-N 3.31Å; L1044-A1046 PolarHBondContact O-N 2.88Å; L1044-G1047 WeakPolarHBondContact O-CA 3.36Å; L1044-G1047 PolarHBondContact O-N 3.38Å; L1044-G1047 VanDerWaalsContact O-N 3.14Å; L1044-L1048 PolarHBondContact O-N 3.42Å; L1044-W1062 HydrophobicContact CD2-CH2 4.07Å; L1044-W1062 HydrophobicContact CD2-CZ3 4.41Å; L1044-P1109 HydrophobicContact CD1-CB 4.24Å; L1044-L1113 HydrophobicContact CB-CD1 3.5Å; L1044-L1113 HydrophobicContact CD1-CD1 4.04Å; L1044-L1113 HydrophobicContact CG-CD1 4.45Å
1045	K	95.1	Very high	91.8	Very high	5 Å²	5	23 Å²	23	2%	0.022	11%	0.108	C	C	.	.	H	α-helix	trans	-59.8	-41.4	170.6	176.1	59.1	174.5	167.8	0	111.3	Y914 T1041 V1042 C1043 G1047 L1048 E1049 L1113 D1116	Y914-K1045 HydrophobicContact CD1-CG 4.43Å; Y914-K1045 HydrophobicContact CE1-CB 4.26Å; Y914-K1045 HydrophobicContact CE1-CG 3.64Å; T1041-K1045 WeakPolarHBondContact O-CB 3.16Å; T1041-K1045 PolarHBondContact O-N 2.85Å; V1042-K1045 WeakPolarHBondContact O-CB 3.3Å; V1042-K1045 PolarHBondContact O-N 3.43Å; C1043-K1045 VanDerWaalsContact C-N 3.33Å; K1045-G1047 VanDerWaalsContact C-N 3.31Å; K1045-G1047 PolarHBondContact O-N 3.37Å; K1045-L1048 HydrophobicContact CD-CD2 4.19Å; K1045-L1048 PolarHBondContact O-N 3.48Å; K1045-E1049 HydrophobicContact CD-CG 4.45Å; K1045-E1049 WeakPolarHBondContact CE-OE1 3.36Å; K1045-E1049 IonicContact NZ-OE1 3.87Å; K1045-E1049 PolarHBondContact NZ-OE1 2.96Å; K1045-E1049 WeakPolarHBondContact O-CG 3.21Å; K1045-E1049 PolarHBondContact O-N 3.47Å; K1045-L1113 HydrophobicContact CB-CD2 3.95Å; K1045-L1113 HydrophobicContact CD-CD2 4.34Å; K1045-D1116 WeakPolarHBondContact CD-OD2 3.37Å; K1045-D1116 WeakPolarHBondContact CE-OD2 3.18Å; K1045-D1116 IonicContact NZ-OD2 3.24Å; K1045-D1116 PolarHBondContact NZ-OD2 3.35Å
1046	A	91.9	Very high	91.1	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-59.1	-44.4	173.1	0	0	0	0	0	111.2	Y911 P954 L958 V1042 C1043 L1044 L1048 E1049 H1050	Y911-A1046 HydrophobicContact CD2-CB 4.34Å; Y911-A1046 HydrophobicContact CE1-CB 4.48Å; Y911-A1046 HydrophobicContact CE2-CB 3.58Å; P954-A1046 HydrophobicContact CB-CB 3.74Å; L958-A1046 HydrophobicContact CD1-CB 4.34Å; V1042-A1046 PolarHBondContact O-N 2.78Å; C1043-A1046 VanDerWaalsContact O-CB 3.3Å; C1043-A1046 WeakPolarHBondContact O-CB 3.23Å; C1043-A1046 PolarHBondContact O-N 2.87Å; L1044-A1046 VanDerWaalsContact C-N 3.31Å; L1044-A1046 PolarHBondContact O-N 2.88Å; A1046-L1048 VanDerWaalsContact C-N 3.28Å; A1046-L1048 PolarHBondContact O-N 2.9Å; A1046-E1049 PolarHBondContact O-N 3.5Å; A1046-H1050 PolarHBondContact O-CD2 3.19Å; A1046-H1050 PolarHBondContact O-N 3.39Å
1047	G	92.4	Very high	90.5	Very high	4 Å²	4	24 Å²	24	4%	0.041	11%	0.114	C	C	.	.	H	α-helix	trans	-58.1	-37	174.2	0	0	0	0	0	113.9	C1043 L1044 K1045 E1049 H1050 W1053	C1043-G1047 PolarHBondContact O-N 3.33Å; L1044-G1047 WeakPolarHBondContact O-CA 3.36Å; L1044-G1047 PolarHBondContact O-N 3.38Å; L1044-G1047 VanDerWaalsContact O-N 3.14Å; K1045-G1047 VanDerWaalsContact C-N 3.31Å; K1045-G1047 PolarHBondContact O-N 3.37Å; G1047-E1049 VanDerWaalsContact C-N 3.25Å; G1047-E1049 PolarHBondContact O-N 2.69Å; G1047-H1050 PolarHBondContact O-N 3.27Å; G1047-W1053 VanDerWaalsContact C-CZ2 3.49Å; G1047-W1053 WeakPolarHBondContact O-CZ2 3.5Å; G1047-W1053 PolarHBondContact O-NE1 3.18Å
1048	L	92.9	Very high	90.2	Very high	40 Å²	40	27.9 Å²	27.9	21%	0.209	13%	0.132	C	C	.	.	H	α-helix	trans	-72.2	-17	175.8	-179.3	145.8	0	0	0	113.4	L1044 K1045 A1046 D1116 I1117 K1120	L1044-L1048 PolarHBondContact O-N 3.42Å; K1045-L1048 HydrophobicContact CD-CD2 4.19Å; K1045-L1048 PolarHBondContact O-N 3.48Å; A1046-L1048 VanDerWaalsContact C-N 3.28Å; A1046-L1048 PolarHBondContact O-N 2.9Å; L1048-D1116 HydrophobicContact CD1-CB 4.37Å; L1048-D1116 HydrophobicContact CD2-CB 4.38Å; L1048-I1117 HydrophobicContact CD1-CB 4.47Å; L1048-I1117 HydrophobicContact CD1-CD1 4.36Å; L1048-I1117 HydrophobicContact CD1-CG1 3.39Å; L1048-K1120 HydrophobicContact CD2-CD 3.54Å; L1048-K1120 HydrophobicContact CD2-CG 4.43Å; L1048-K1120 HydrophobicContact CG-CD 4.25Å; L1048-K1120 PolarHBondContact O-NZ 2.96Å
1049	E	91	Very high	89.8	Confident	17 Å²	17	32.2 Å²	32.2	8%	0.079	15%	0.154	C	C	.	.	H	α-helix	trans	-94.9	-23.8	175.9	-62.5	-62.8	147.5	0	0	113.4	K907 L958 W994 K1045 A1046 G1047 T1051 K1120	K907-E1049 PolarHBondContact NZ-O 3Å; L958-E1049 HydrophobicContact CD2-CB 4.38Å; W994-E1049 HydrophobicContact CH2-CG 3.63Å; W994-E1049 HydrophobicContact CZ2-CG 4.47Å; W994-E1049 HydrophobicContact CZ3-CG 4.41Å; K1045-E1049 HydrophobicContact CD-CG 4.45Å; K1045-E1049 WeakPolarHBondContact CE-OE1 3.36Å; K1045-E1049 IonicContact NZ-OE1 3.87Å; K1045-E1049 PolarHBondContact NZ-OE1 2.96Å; K1045-E1049 WeakPolarHBondContact O-CG 3.21Å; K1045-E1049 PolarHBondContact O-N 3.47Å; A1046-E1049 PolarHBondContact O-N 3.5Å; G1047-E1049 VanDerWaalsContact C-N 3.25Å; G1047-E1049 PolarHBondContact O-N 2.69Å; E1049-T1051 PolarHBondContact O-N 3.39Å; E1049-K1120 WeakPolarHBondContact OE1-CE 3.45Å; E1049-K1120 IonicContact OE1-NZ 2.64Å; E1049-K1120 PolarHBondContact OE1-NZ 3.46Å; E1049-K1120 IonicContact OE2-NZ 3.61Å; E1049-K1120 PolarHBondContact OE2-NZ 3.45Å
1050	H	88.7	Confident	89.4	Confident	11 Å²	11	32.6 Å²	32.6	5%	0.051	16%	0.158	C	C	.	.			trans	-59.2	123.4	169.8	-93.7	-84.7	0	0	0	110.3	L958 A1046 G1047 A1052 S1057	L958-H1050 HydrophobicContact CD2-CB 4.41Å; L958-H1050 WeakPolarHBondContact CD2-CD2 3.15Å; L958-H1050 WeakPolarHBondContact CD2-NE2 3.26Å; A1046-H1050 PolarHBondContact O-CD2 3.19Å; A1046-H1050 PolarHBondContact O-N 3.39Å; G1047-H1050 PolarHBondContact O-N 3.27Å; H1050-A1052 PolarHBondContact ND1-O 3.05Å; H1050-S1057 PolarHBondContact CE1-OG 2.82Å; H1050-S1057 PolarHBondContact ND1-OG 3.27Å
1051	T	85.5	Confident	89.1	Confident	37 Å²	37	32.2 Å²	32.2	23%	0.227	16%	0.155	C	C	.	.	S	Bend	trans	-90.3	-34.1	172.1	38.5	0	0	0	0	111.5	K907 D962 R963 E1049 M1135	K907-T1051 PolarHBondContact NZ-OG1 3.31Å; D962-T1051 PolarHBondContact OD1-N 3.19Å; D962-T1051 PolarHBondContact OD1-OG1 3.37Å; D962-T1051 PolarHBondContact OD2-OG1 2.88Å; R963-T1051 PolarHBondContact O-OG1 3.04Å; R963-T1051 VanDerWaalsContact O-OG1 3.04Å; E1049-T1051 PolarHBondContact O-N 3.39Å; T1051-M1135 HydrophobicContact CG2-CE 3.68Å
1052	A	83	Confident	89	Confident	17 Å²	17	38.7 Å²	38.7	14%	0.14	18%	0.18	C	C	.	.	S	Bend	trans	-115.3	121	169.9	0	0	0	0	0	110.1	D962 R963 H1050	D962-A1052 PolarHBondContact OD1-N 3.27Å; R963-A1052 HydrophobicContact CB-CB 4.14Å; H1050-A1052 PolarHBondContact ND1-O 3.05Å
1053	W	87.5	Confident	88.8	Confident	117 Å²	117	40.2 Å²	40.2	44%	0.443	20%	0.195	S	C	.	.			trans	-89.4	108.2	173.2	-78.3	73.5	0	0	0	109.5	G1047 H1058 I1061	G1047-W1053 VanDerWaalsContact C-CZ2 3.49Å; G1047-W1053 WeakPolarHBondContact O-CZ2 3.5Å; G1047-W1053 PolarHBondContact O-NE1 3.18Å; W1053-H1058 AromaticContact CE3-CE1 3.32Å; W1053-H1058 AromaticContact CE3-ND1 3.61Å; W1053-H1058 AromaticContact CE3-NE2 3.65Å; W1053-H1058 AromaticContact CZ3-CE1 3.7Å; W1053-H1058 AromaticContact CZ3-ND1 3.66Å; W1053-I1061 HydrophobicContact CE3-CD1 4.4Å; W1053-I1061 HydrophobicContact CH2-CD1 3.61Å; W1053-I1061 HydrophobicContact CZ2-CD1 4.33Å; W1053-I1061 HydrophobicContact CZ3-CD1 3.64Å
1054	T	82.5	Confident	88.6	Confident	32 Å²	32	40.4 Å²	40.4	20%	0.196	20%	0.197	C	C	.	.			trans	-97.8	162.3	171.6	62.3	0	0	0	0	110.2	F961 L1056 S1057 H1058	F961-T1054 HydrophobicContact CB-CG2 4.19Å; T1054-L1056 PolarHBondContact O-N 2.93Å; T1054-S1057 PolarHBondContact N-OG 3.14Å; T1054-S1057 WeakPolarHBondContact O-CA 3.35Å; T1054-S1057 VanDerWaalsContact O-CB 3.29Å; T1054-S1057 WeakPolarHBondContact O-CB 3.19Å; T1054-S1057 PolarHBondContact O-N 3.44Å; T1054-S1057 PolarHBondContact OG1-N 2.89Å; T1054-S1057 PolarHBondContact OG1-OG 2.92Å; T1054-H1058 PolarHBondContact O-CD2 3.49Å; T1054-H1058 VanDerWaalsContact O-CD2 3.31Å; T1054-H1058 PolarHBondContact O-N 3.37Å
1055	W	84.9	Confident	88.5	Confident	140 Å²	140	38.6 Å²	38.6	53%	0.53	19%	0.187	S	C	.	.	H	α-helix	trans	-56.5	-32.6	173.5	76	-94.3	0	0	0	112	H1058 L1059	W1055-H1058 WeakPolarHBondContact O-CB 3.43Å; W1055-H1058 PolarHBondContact O-N 3.46Å; W1055-L1059 HydrophobicContact CZ3-CD2 4.03Å; W1055-L1059 PolarHBondContact O-N 3.34Å
1056	L	80	Confident	88.4	Confident	22 Å²	22	40.1 Å²	40.1	12%	0.115	20%	0.204	C	C	.	.	H	α-helix	trans	-68.1	-33.7	173.3	-68.4	168.2	0	0	0	112.9	L410 F961 T1054 L1059 A1060	L410-L1056 HydrophobicContact CD1-CD1 3.46Å; L410-L1056 VanDerWaalsContact CD1-CD1 3.46Å; L410-L1056 HydrophobicContact CD1-CD2 3.46Å; L410-L1056 VanDerWaalsContact CD1-CD2 3.46Å; L410-L1056 HydrophobicContact CD1-CG 4.12Å; F961-L1056 HydrophobicContact CD1-CD1 4.07Å; F961-L1056 HydrophobicContact CD2-CB 3.88Å; F961-L1056 HydrophobicContact CD2-CD1 4.14Å; F961-L1056 HydrophobicContact CE1-CD1 3.57Å; F961-L1056 HydrophobicContact CE2-CB 3.86Å; F961-L1056 HydrophobicContact CE2-CD1 3.66Å; F961-L1056 HydrophobicContact CE2-CG 4.31Å; F961-L1056 HydrophobicContact CG-CB 4.49Å; F961-L1056 HydrophobicContact CG-CD1 4.34Å; F961-L1056 HydrophobicContact CZ-CB 4.46Å; F961-L1056 HydrophobicContact CZ-CD1 3.37Å; F961-L1056 HydrophobicContact CZ-CG 4.45Å; T1054-L1056 PolarHBondContact O-N 2.93Å; L1056-L1059 PolarHBondContact O-N 3.4Å; L1056-A1060 VanDerWaalsContact O-CB 3.27Å; L1056-A1060 WeakPolarHBondContact O-CB 3.4Å; L1056-A1060 PolarHBondContact O-N 2.95Å
1057	S	82.5	Confident	88.4	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-67.2	-40.3	173.4	-50.9	0	0	0	0	110.5	H1050 T1054 A1060 I1061	H1050-S1057 PolarHBondContact CE1-OG 2.82Å; H1050-S1057 PolarHBondContact ND1-OG 3.27Å; T1054-S1057 PolarHBondContact N-OG 3.14Å; T1054-S1057 WeakPolarHBondContact O-CA 3.35Å; T1054-S1057 VanDerWaalsContact O-CB 3.29Å; T1054-S1057 WeakPolarHBondContact O-CB 3.19Å; T1054-S1057 PolarHBondContact O-N 3.44Å; T1054-S1057 PolarHBondContact OG1-N 2.89Å; T1054-S1057 PolarHBondContact OG1-OG 2.92Å; S1057-A1060 PolarHBondContact O-N 3.02Å; S1057-I1061 WeakPolarHBondContact O-CB 3.46Å; S1057-I1061 VanDerWaalsContact O-CG1 3.3Å; S1057-I1061 WeakPolarHBondContact O-CG1 3.39Å; S1057-I1061 PolarHBondContact O-N 2.96Å
1058	H	88.8	Confident	88.5	Confident	81 Å²	81	42 Å²	42	38%	0.375	22%	0.217	S	C	.	.	H	α-helix	trans	-61.4	-48	172	-74.1	-73.1	0	0	0	111.8	W1053 T1054 W1055 A1060 I1061 W1062	W1053-H1058 AromaticContact CE3-CE1 3.32Å; W1053-H1058 AromaticContact CE3-ND1 3.61Å; W1053-H1058 AromaticContact CE3-NE2 3.65Å; W1053-H1058 AromaticContact CZ3-CE1 3.7Å; W1053-H1058 AromaticContact CZ3-ND1 3.66Å; T1054-H1058 PolarHBondContact O-CD2 3.49Å; T1054-H1058 VanDerWaalsContact O-CD2 3.31Å; T1054-H1058 PolarHBondContact O-N 3.37Å; W1055-H1058 WeakPolarHBondContact O-CB 3.43Å; W1055-H1058 PolarHBondContact O-N 3.46Å; H1058-A1060 VanDerWaalsContact C-N 3.31Å; H1058-A1060 PolarHBondContact O-N 3.35Å; H1058-I1061 PolarHBondContact O-N 3.12Å; H1058-W1062 AromaticContact ND1-CD1 3.94Å; H1058-W1062 AromaticContact ND1-NE1 3.57Å; H1058-W1062 WeakPolarHBondContact O-CB 3.38Å; H1058-W1062 PolarHBondContact O-N 3.44Å
1059	L	87.2	Confident	88.5	Confident	91 Å²	91	42.1 Å²	42.1	48%	0.476	22%	0.215	S	C	.	.	H	α-helix	trans	-59.8	-42.2	176.6	-179.4	63.9	0	0	0	111.4	W1055 L1056 G1063	W1055-L1059 HydrophobicContact CZ3-CD2 4.03Å; W1055-L1059 PolarHBondContact O-N 3.34Å; L1056-L1059 PolarHBondContact O-N 3.4Å; L1059-G1063 WeakPolarHBondContact O-CA 3.4Å; L1059-G1063 PolarHBondContact O-N 2.92Å
1060	A	86.7	Confident	88.6	Confident	9 Å²	9	45.8 Å²	45.8	7%	0.074	24%	0.235	C	C	.	.	H	α-helix	trans	-64.8	-45.7	179.3	0	0	0	0	0	112.5	A953 A957 L1056 S1057 H1058 S1064	A953-A1060 HydrophobicContact CB-CB 3.9Å; A957-A1060 HydrophobicContact CB-CB 3.64Å; L1056-A1060 VanDerWaalsContact O-CB 3.27Å; L1056-A1060 WeakPolarHBondContact O-CB 3.4Å; L1056-A1060 PolarHBondContact O-N 2.95Å; S1057-A1060 PolarHBondContact O-N 3.02Å; H1058-A1060 VanDerWaalsContact C-N 3.31Å; H1058-A1060 PolarHBondContact O-N 3.35Å; A1060-S1064 WeakPolarHBondContact O-CB 3.34Å; A1060-S1064 PolarHBondContact O-N 2.9Å; A1060-S1064 PolarHBondContact O-OG 3.35Å
1061	I	90.6	Very high	88.7	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-73	-55.5	-177.4	-66.5	166.1	0	0	0	110.7	C1043 W1053 S1057 H1058 S1064 I1065	C1043-I1061 HydrophobicContact CB-CG2 4.15Å; W1053-I1061 HydrophobicContact CE3-CD1 4.4Å; W1053-I1061 HydrophobicContact CH2-CD1 3.61Å; W1053-I1061 HydrophobicContact CZ2-CD1 4.33Å; W1053-I1061 HydrophobicContact CZ3-CD1 3.64Å; S1057-I1061 WeakPolarHBondContact O-CB 3.46Å; S1057-I1061 VanDerWaalsContact O-CG1 3.3Å; S1057-I1061 WeakPolarHBondContact O-CG1 3.39Å; S1057-I1061 PolarHBondContact O-N 2.96Å; H1058-I1061 PolarHBondContact O-N 3.12Å; I1061-S1064 PolarHBondContact O-N 3.45Å; I1061-I1065 HydrophobicContact CG2-CD1 4.49Å; I1061-I1065 WeakPolarHBondContact O-CG1 3.31Å; I1061-I1065 PolarHBondContact O-N 2.99Å
1062	W	94.3	Very high	89	Confident	136 Å²	136	45.5 Å²	45.5	52%	0.515	23%	0.231	S	C	.	.	H	α-helix	trans	-74.4	-34.4	-176.1	-59.7	123.1	0	0	0	112.1	L1044 H1058 S1064 I1065 G1066	L1044-W1062 HydrophobicContact CD2-CH2 4.07Å; L1044-W1062 HydrophobicContact CD2-CZ3 4.41Å; H1058-W1062 AromaticContact ND1-CD1 3.94Å; H1058-W1062 AromaticContact ND1-NE1 3.57Å; H1058-W1062 WeakPolarHBondContact O-CB 3.38Å; H1058-W1062 PolarHBondContact O-N 3.44Å; W1062-S1064 VanDerWaalsContact C-N 3.35Å; W1062-I1065 HydrophobicContact CE3-CD1 3.9Å; W1062-I1065 HydrophobicContact CZ3-CD1 4.01Å; W1062-I1065 PolarHBondContact O-N 2.97Å; W1062-G1066 PolarHBondContact O-N 3.44Å
1063	G	89.7	Confident	89.5	Confident	32 Å²	32	47.5 Å²	47.5	33%	0.33	24%	0.241	S	C	.	.	H	α-helix	trans	-64.8	-37.6	173.2	0	0	0	0	0	112.1	L1059 C1067	L1059-G1063 WeakPolarHBondContact O-CA 3.4Å; L1059-G1063 PolarHBondContact O-N 2.92Å; G1063-C1067 WeakPolarHBondContact O-CB 3.21Å; G1063-C1067 PolarHBondContact O-N 3.29Å
1064	S	90.2	Very high	89.6	Confident	4 Å²	4	46.6 Å²	46.6	3%	0.028	24%	0.244	C	C	.	.	H	α-helix	trans	-61.6	-46.5	172	-93.1	0	0	0	0	112.8	F950 P954 A1060 I1061 W1062 C1067 W1068	F950-S1064 WeakPolarHBondContact O-CB 3.08Å; F950-S1064 PolarHBondContact O-OG 3.27Å; P954-S1064 WeakPolarHBondContact CD-OG 3.47Å; A1060-S1064 WeakPolarHBondContact O-CB 3.34Å; A1060-S1064 PolarHBondContact O-N 2.9Å; A1060-S1064 PolarHBondContact O-OG 3.35Å; I1061-S1064 PolarHBondContact O-N 3.45Å; W1062-S1064 VanDerWaalsContact C-N 3.35Å; S1064-C1067 PolarHBondContact O-N 3.5Å; S1064-W1068 PolarHBondContact O-N 3.23Å
1065	I	93.5	Very high	90	Very high	15 Å²	15	46.1 Å²	46.1	8%	0.077	24%	0.239	C	C	.	.	H	α-helix	trans	-64.1	-49.6	177.6	-65	169	0	0	0	110	V1040 C1043 I1061 W1062 C1067 W1068 F1069	V1040-I1065 HydrophobicContact CG2-CG2 4.18Å; C1043-I1065 HydrophobicContact CB-CD1 3.86Å; C1043-I1065 HydrophobicContact CB-CG1 3.8Å; I1061-I1065 HydrophobicContact CG2-CD1 4.49Å; I1061-I1065 WeakPolarHBondContact O-CG1 3.31Å; I1061-I1065 PolarHBondContact O-N 2.99Å; W1062-I1065 HydrophobicContact CE3-CD1 3.9Å; W1062-I1065 HydrophobicContact CZ3-CD1 4.01Å; W1062-I1065 PolarHBondContact O-N 2.97Å; I1065-C1067 VanDerWaalsContact C-N 3.3Å; I1065-C1067 PolarHBondContact O-N 3.24Å; I1065-W1068 WeakPolarHBondContact O-CB 3.22Å; I1065-W1068 PolarHBondContact O-N 3.44Å; I1065-F1069 HydrophobicContact CG2-CD2 3.92Å; I1065-F1069 HydrophobicContact CG2-CE2 3.77Å; I1065-F1069 WeakPolarHBondContact O-CD2 3.27Å; I1065-F1069 PolarHBondContact O-N 3.46Å
1066	G	93.5	Very high	90.3	Very high	37 Å²	37	39.5 Å²	39.5	38%	0.381	21%	0.214	S	C	.	.	H	α-helix	trans	-61.3	-36.6	178.6	0	0	0	0	0	113.1	W1062 W1068 F1069 L1070	W1062-G1066 PolarHBondContact O-N 3.44Å; G1066-W1068 VanDerWaalsContact C-N 3.34Å; G1066-W1068 PolarHBondContact O-N 3.18Å; G1066-F1069 PolarHBondContact O-N 3.4Å; G1066-L1070 WeakPolarHBondContact O-CB 3.49Å; G1066-L1070 PolarHBondContact O-N 2.87Å
1067	C	91.5	Very high	90.8	Very high	45 Å²	45	43.5 Å²	43.5	30%	0.304	23%	0.232	S	C	.	.	H	α-helix	trans	-63.4	-38.9	176	-177.4	0	0	0	0	112	I949 G1063 S1064 I1065 L1070 F1071	I949-C1067 VanDerWaalsContact CG2-SG 3.58Å; G1063-C1067 WeakPolarHBondContact O-CB 3.21Å; G1063-C1067 PolarHBondContact O-N 3.29Å; S1064-C1067 PolarHBondContact O-N 3.5Å; I1065-C1067 VanDerWaalsContact C-N 3.3Å; I1065-C1067 PolarHBondContact O-N 3.24Å; C1067-L1070 PolarHBondContact O-N 3.34Å; C1067-F1071 WeakPolarHBondContact O-CB 3.16Å; C1067-F1071 PolarHBondContact O-N 3.22Å
1068	W	93.6	Very high	91.1	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-64.4	-47	173.7	169.3	-110.9	0	0	0	112.2	F950 Y1035 T1036 V1039 S1064 I1065 G1066 L1070 F1071 L1072	F950-W1068 HydrophobicContact CD1-CB 4.29Å; F950-W1068 HydrophobicContact CD1-CE3 4.31Å; F950-W1068 HydrophobicContact CD2-CE3 4.08Å; F950-W1068 HydrophobicContact CE1-CE3 4.11Å; F950-W1068 AromaticContact CE2-CE3 3.85Å; F950-W1068 HydrophobicContact CE2-CE3 3.85Å; F950-W1068 AromaticContact CE2-CZ3 3.99Å; F950-W1068 HydrophobicContact CE2-CZ3 3.99Å; F950-W1068 HydrophobicContact CG-CE3 4.3Å; F950-W1068 AromaticContact CZ-CE3 3.88Å; F950-W1068 HydrophobicContact CZ-CE3 3.88Å; F950-W1068 HydrophobicContact CZ-CZ3 4.18Å; Y1035-W1068 AromaticContact CD1-CD2 3.83Å; Y1035-W1068 HydrophobicContact CD1-CD2 3.83Å; Y1035-W1068 AromaticContact CD1-CE2 3.58Å; Y1035-W1068 AromaticContact CD1-CE3 3.85Å; Y1035-W1068 HydrophobicContact CD1-CE3 3.85Å; Y1035-W1068 AromaticContact CD1-CH2 3.4Å; Y1035-W1068 HydrophobicContact CD1-CH2 3.4Å; Y1035-W1068 AromaticContact CD1-CZ2 3.38Å; Y1035-W1068 HydrophobicContact CD1-CZ2 3.38Å; Y1035-W1068 AromaticContact CD1-CZ3 3.63Å; Y1035-W1068 HydrophobicContact CD1-CZ3 3.63Å; Y1035-W1068 AromaticContact CE1-CD2 3.85Å; Y1035-W1068 HydrophobicContact CE1-CD2 3.85Å; Y1035-W1068 AromaticContact CE1-CE3 3.5Å; Y1035-W1068 HydrophobicContact CE1-CE3 3.5Å; Y1035-W1068 VanDerWaalsContact CE1-CE3 3.5Å; Y1035-W1068 AromaticContact CE1-CH2 3.73Å; Y1035-W1068 HydrophobicContact CE1-CH2 3.73Å; Y1035-W1068 HydrophobicContact CE1-CZ2 4.06Å; Y1035-W1068 AromaticContact CE1-CZ3 3.43Å; Y1035-W1068 HydrophobicContact CE1-CZ3 3.43Å; Y1035-W1068 VanDerWaalsContact CE1-CZ3 3.43Å; Y1035-W1068 HydrophobicContact CG-CH2 4.05Å; Y1035-W1068 HydrophobicContact CG-CZ2 4.09Å; T1036-W1068 PolarHBondContact OG1-NE1 3.33Å; V1039-W1068 HydrophobicContact CG1-CB 4.1Å; V1039-W1068 HydrophobicContact CG1-CG 4.43Å; V1039-W1068 HydrophobicContact CG2-CG 4.37Å; S1064-W1068 PolarHBondContact O-N 3.23Å; I1065-W1068 WeakPolarHBondContact O-CB 3.22Å; I1065-W1068 PolarHBondContact O-N 3.44Å; G1066-W1068 VanDerWaalsContact C-N 3.34Å; G1066-W1068 PolarHBondContact O-N 3.18Å; W1068-L1070 VanDerWaalsContact C-N 3.32Å; W1068-L1070 PolarHBondContact O-N 2.83Å; W1068-F1071 HydrophobicContact CE3-CD1 4.01Å; W1068-F1071 AromaticContact CZ3-CD1 3.66Å; W1068-F1071 HydrophobicContact CZ3-CD1 3.66Å; W1068-F1071 HydrophobicContact CZ3-CE1 4.07Å; W1068-F1071 WeakPolarHBondContact O-CB 3.28Å; W1068-F1071 PolarHBondContact O-N 3.26Å; W1068-L1072 HydrophobicContact CZ2-CD1 4.42Å; W1068-L1072 HydrophobicContact CZ2-CD2 4.45Å; W1068-L1072 PolarHBondContact O-N 3.41Å
1069	F	93.5	Very high	91	Very high	41 Å²	41	46 Å²	46	18%	0.18	24%	0.242	C	C	.	.	H	α-helix	trans	-60.9	-41.7	176.4	-81.3	-79.3	0	0	0	111.9	T1036 I1065 G1066 F1071 L1072 T1073 Y1096 F1101 F1105	T1036-F1069 HydrophobicContact CG2-CE1 4.39Å; T1036-F1069 HydrophobicContact CG2-CE2 4.38Å; T1036-F1069 HydrophobicContact CG2-CZ 3.85Å; I1065-F1069 HydrophobicContact CG2-CD2 3.92Å; I1065-F1069 HydrophobicContact CG2-CE2 3.77Å; I1065-F1069 WeakPolarHBondContact O-CD2 3.27Å; I1065-F1069 PolarHBondContact O-N 3.46Å; G1066-F1069 PolarHBondContact O-N 3.4Å; F1069-F1071 VanDerWaalsContact C-N 3.34Å; F1069-F1071 PolarHBondContact O-N 3.39Å; F1069-L1072 PolarHBondContact O-N 2.97Å; F1069-T1073 PolarHBondContact O-N 3.39Å; F1069-T1073 PolarHBondContact O-OG1 3.3Å; F1069-Y1096 AromaticContact CD1-CE1 3.76Å; F1069-Y1096 HydrophobicContact CD1-CE1 3.76Å; F1069-Y1096 AromaticContact CD1-CZ 3.99Å; F1069-Y1096 WeakPolarHBondContact CD1-OH 3.49Å; F1069-Y1096 AromaticContact CE1-CE1 3.92Å; F1069-Y1096 HydrophobicContact CE1-CE1 3.92Å; F1069-Y1096 PolarHBondContact O-OH 3.38Å; F1069-Y1096 VanDerWaalsContact O-OH 3.06Å; F1069-F1101 HydrophobicContact CE1-CZ 4.29Å; F1069-F1105 AromaticContact CE2-CE2 3.9Å; F1069-F1105 HydrophobicContact CE2-CE2 3.9Å; F1069-F1105 HydrophobicContact CE2-CZ 4.44Å; F1069-F1105 HydrophobicContact CZ-CD2 4.09Å; F1069-F1105 AromaticContact CZ-CE2 3.57Å; F1069-F1105 HydrophobicContact CZ-CE2 3.57Å; F1069-F1105 HydrophobicContact CZ-CZ 4.22Å
1070	L	92.7	Very high	90.9	Very high	94 Å²	94	46.6 Å²	46.6	49%	0.492	25%	0.251	S	S	.	.	H	α-helix	trans	-62.3	-42.9	175.6	-173.4	68.7	0	0	0	111.5	G1066 C1067 W1068 T1073 I1074	G1066-L1070 WeakPolarHBondContact O-CB 3.49Å; G1066-L1070 PolarHBondContact O-N 2.87Å; C1067-L1070 PolarHBondContact O-N 3.34Å; W1068-L1070 VanDerWaalsContact C-N 3.32Å; W1068-L1070 PolarHBondContact O-N 2.83Å; L1070-T1073 PolarHBondContact O-N 3.02Å; L1070-I1074 HydrophobicContact CD1-CD1 3.77Å; L1070-I1074 HydrophobicContact CD1-CG1 4.39Å; L1070-I1074 HydrophobicContact CD2-CD1 4.4Å; L1070-I1074 HydrophobicContact CG-CD1 3.75Å; L1070-I1074 WeakPolarHBondContact O-CG1 3.49Å; L1070-I1074 PolarHBondContact O-N 3.46Å
1071	F	91.6	Very high	91	Very high	38 Å²	38	51.8 Å²	51.8	17%	0.167	28%	0.282	C	S	.	.	H	α-helix	trans	-62.6	-46.1	176	179	-96	0	0	0	111.6	L945 F950 C1067 W1068 F1069 T1073 I1074 Y1075	L945-F1071 HydrophobicContact CD1-CE2 3.99Å; L945-F1071 HydrophobicContact CD1-CZ 4.24Å; F950-F1071 HydrophobicContact CE1-CB 3.68Å; F950-F1071 HydrophobicContact CE1-CD1 4.24Å; F950-F1071 HydrophobicContact CE1-CD2 4.25Å; F950-F1071 AromaticContact CE1-CG 3.81Å; F950-F1071 HydrophobicContact CE1-CG 3.81Å; F950-F1071 HydrophobicContact CE2-CD1 4.39Å; F950-F1071 HydrophobicContact CZ-CB 3.89Å; F950-F1071 AromaticContact CZ-CD1 3.56Å; F950-F1071 HydrophobicContact CZ-CD1 3.56Å; F950-F1071 AromaticContact CZ-CD2 3.84Å; F950-F1071 HydrophobicContact CZ-CD2 3.84Å; F950-F1071 AromaticContact CZ-CE1 3.99Å; F950-F1071 HydrophobicContact CZ-CE1 3.99Å; F950-F1071 HydrophobicContact CZ-CE2 4.24Å; F950-F1071 AromaticContact CZ-CG 3.47Å; F950-F1071 HydrophobicContact CZ-CG 3.47Å; F950-F1071 VanDerWaalsContact CZ-CG 3.47Å; F950-F1071 HydrophobicContact CZ-CZ 4.3Å; C1067-F1071 WeakPolarHBondContact O-CB 3.16Å; C1067-F1071 PolarHBondContact O-N 3.22Å; W1068-F1071 HydrophobicContact CE3-CD1 4.01Å; W1068-F1071 AromaticContact CZ3-CD1 3.66Å; W1068-F1071 HydrophobicContact CZ3-CD1 3.66Å; W1068-F1071 HydrophobicContact CZ3-CE1 4.07Å; W1068-F1071 WeakPolarHBondContact O-CB 3.28Å; W1068-F1071 PolarHBondContact O-N 3.26Å; F1069-F1071 VanDerWaalsContact C-N 3.34Å; F1069-F1071 PolarHBondContact O-N 3.39Å; F1071-T1073 PolarHBondContact O-N 2.75Å; F1071-I1074 PolarHBondContact O-N 3.07Å; F1071-Y1075 HydrophobicContact CD2-CG 4.5Å; F1071-Y1075 AromaticContact CE1-CD1 3.8Å; F1071-Y1075 HydrophobicContact CE1-CD1 3.8Å; F1071-Y1075 HydrophobicContact CE1-CD2 4.44Å; F1071-Y1075 HydrophobicContact CE1-CE1 4.4Å; F1071-Y1075 AromaticContact CE1-CG 3.83Å; F1071-Y1075 HydrophobicContact CE1-CG 3.83Å; F1071-Y1075 HydrophobicContact CE2-CD1 4.42Å; F1071-Y1075 AromaticContact CE2-CD2 3.61Å; F1071-Y1075 HydrophobicContact CE2-CD2 3.61Å; F1071-Y1075 HydrophobicContact CE2-CE2 4.17Å; F1071-Y1075 AromaticContact CE2-CG 3.76Å; F1071-Y1075 HydrophobicContact CE2-CG 3.76Å; F1071-Y1075 AromaticContact CZ-CD1 3.59Å; F1071-Y1075 HydrophobicContact CZ-CD1 3.59Å; F1071-Y1075 AromaticContact CZ-CD2 3.55Å; F1071-Y1075 HydrophobicContact CZ-CD2 3.55Å; F1071-Y1075 AromaticContact CZ-CE1 3.97Å; F1071-Y1075 HydrophobicContact CZ-CE1 3.97Å; F1071-Y1075 AromaticContact CZ-CE2 3.93Å; F1071-Y1075 HydrophobicContact CZ-CE2 3.93Å; F1071-Y1075 AromaticContact CZ-CG 3.38Å; F1071-Y1075 HydrophobicContact CZ-CG 3.38Å; F1071-Y1075 WeakPolarHBondContact O-CB 3.29Å; F1071-Y1075 PolarHBondContact O-N 2.85Å
1072	L	91.5	Very high	90.6	Very high	4 Å²	4	56.2 Å²	56.2	2%	0.021	31%	0.306	C	S	.	.	H	α-helix	trans	-64.1	-29.1	178.6	-173.3	63.4	0	0	0	112.3	N1032 W1068 F1069 P1076 V1095 Y1096	N1032-L1072 HydrophobicContact CB-CD1 4.38Å; W1068-L1072 HydrophobicContact CZ2-CD1 4.42Å; W1068-L1072 HydrophobicContact CZ2-CD2 4.45Å; W1068-L1072 PolarHBondContact O-N 3.41Å; F1069-L1072 PolarHBondContact O-N 2.97Å; L1072-P1076 WeakPolarHBondContact O-CD 3.28Å; L1072-P1076 WeakPolarHBondContact O-CG 3.32Å; L1072-V1095 HydrophobicContact CD2-CB 4.43Å; L1072-V1095 HydrophobicContact CD2-CG1 4.16Å; L1072-Y1096 HydrophobicContact CD2-CE1 3.92Å
1073	T	92.3	Very high	90.1	Very high	59 Å²	59	55.5 Å²	55.5	36%	0.362	32%	0.318	S	S	.	.	H	α-helix	trans	-78.2	-37.6	174.5	-55.3	0	0	0	0	112.7	F1069 L1070 F1071 H1077 Y1096	F1069-T1073 PolarHBondContact O-N 3.39Å; F1069-T1073 PolarHBondContact O-OG1 3.3Å; L1070-T1073 PolarHBondContact O-N 3.02Å; F1071-T1073 PolarHBondContact O-N 2.75Å; T1073-H1077 PolarHBondContact O-CD2 3.3Å; T1073-H1077 VanDerWaalsContact O-CD2 3.24Å; T1073-Y1096 WeakPolarHBondContact OG1-CE2 3.29Å; T1073-Y1096 PolarHBondContact OG1-OH 3.38Å
1074	I	91.3	Very high	89.7	Confident	99 Å²	99	57 Å²	57	51%	0.508	32%	0.319	S	S	.	.	H	α-helix	trans	-86.7	-42.9	-174.9	-65.3	174	0	0	0	112	L1070 F1071 H1077	L1070-I1074 HydrophobicContact CD1-CD1 3.77Å; L1070-I1074 HydrophobicContact CD1-CG1 4.39Å; L1070-I1074 HydrophobicContact CD2-CD1 4.4Å; L1070-I1074 HydrophobicContact CG-CD1 3.75Å; L1070-I1074 WeakPolarHBondContact O-CG1 3.49Å; L1070-I1074 PolarHBondContact O-N 3.46Å; F1071-I1074 PolarHBondContact O-N 3.07Å; I1074-H1077 PolarHBondContact O-N 2.88Å; I1074-H1077 VanDerWaalsContact O-N 3.12Å
1075	Y	90.6	Very high	89.3	Confident	22 Å²	22	56.9 Å²	56.9	9%	0.086	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-60.7	-39.6	-169.2	-168.8	-116.4	0	0	0	114.4	E939 F1071 H1077 V1078 A1085 M1088	E939-Y1075 PolarHBondContact OE1-OH 2.96Å; F1071-Y1075 HydrophobicContact CD2-CG 4.5Å; F1071-Y1075 AromaticContact CE1-CD1 3.8Å; F1071-Y1075 HydrophobicContact CE1-CD1 3.8Å; F1071-Y1075 HydrophobicContact CE1-CD2 4.44Å; F1071-Y1075 HydrophobicContact CE1-CE1 4.4Å; F1071-Y1075 AromaticContact CE1-CG 3.83Å; F1071-Y1075 HydrophobicContact CE1-CG 3.83Å; F1071-Y1075 HydrophobicContact CE2-CD1 4.42Å; F1071-Y1075 AromaticContact CE2-CD2 3.61Å; F1071-Y1075 HydrophobicContact CE2-CD2 3.61Å; F1071-Y1075 HydrophobicContact CE2-CE2 4.17Å; F1071-Y1075 AromaticContact CE2-CG 3.76Å; F1071-Y1075 HydrophobicContact CE2-CG 3.76Å; F1071-Y1075 AromaticContact CZ-CD1 3.59Å; F1071-Y1075 HydrophobicContact CZ-CD1 3.59Å; F1071-Y1075 AromaticContact CZ-CD2 3.55Å; F1071-Y1075 HydrophobicContact CZ-CD2 3.55Å; F1071-Y1075 AromaticContact CZ-CE1 3.97Å; F1071-Y1075 HydrophobicContact CZ-CE1 3.97Å; F1071-Y1075 AromaticContact CZ-CE2 3.93Å; F1071-Y1075 HydrophobicContact CZ-CE2 3.93Å; F1071-Y1075 AromaticContact CZ-CG 3.38Å; F1071-Y1075 HydrophobicContact CZ-CG 3.38Å; F1071-Y1075 WeakPolarHBondContact O-CB 3.29Å; F1071-Y1075 PolarHBondContact O-N 2.85Å; Y1075-H1077 VanDerWaalsContact C-N 3.26Å; Y1075-H1077 PolarHBondContact O-N 3.43Å; Y1075-V1078 HydrophobicContact CD2-CG2 4.46Å; Y1075-V1078 WeakPolarHBondContact O-CB 3.33Å; Y1075-V1078 WeakPolarHBondContact O-CG2 3.5Å; Y1075-V1078 PolarHBondContact O-N 3.28Å; Y1075-A1085 HydrophobicContact CD1-CB 3.86Å; Y1075-A1085 HydrophobicContact CD2-CB 4.23Å; Y1075-A1085 HydrophobicContact CE1-CB 3.43Å; Y1075-A1085 VanDerWaalsContact CE1-CB 3.43Å; Y1075-A1085 HydrophobicContact CE2-CB 3.84Å; Y1075-A1085 HydrophobicContact CG-CB 4.22Å; Y1075-M1088 HydrophobicContact CD1-CB 4.22Å; Y1075-M1088 HydrophobicContact CD1-CG 3.9Å; Y1075-M1088 HydrophobicContact CE1-CB 4.44Å; Y1075-M1088 HydrophobicContact CE1-CG 3.85Å
1076	P	91	Very high	89	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.006	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-56.9	-31.1	172.8	-33.8	43	0	0	0	115.8	L1072 M1088 M1091 D1092	L1072-P1076 WeakPolarHBondContact O-CD 3.28Å; L1072-P1076 WeakPolarHBondContact O-CG 3.32Å; P1076-M1088 WeakPolarHBondContact CA-O 3.43Å; P1076-M1088 WeakPolarHBondContact CB-O 3.27Å; P1076-M1088 WeakPolarHBondContact CG-O 3.24Å; P1076-M1091 HydrophobicContact CG-CB 4.3Å; P1076-D1092 HydrophobicContact CG-CB 4.17Å
1077	H	89.6	Confident	88.7	Confident	105 Å²	105	61.6 Å²	61.6	49%	0.486	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-89.5	-1.4	-176.5	-65.5	-64.9	0	0	0	113.5	T1073 I1074 Y1075 Y1079 D1092 F1093	T1073-H1077 PolarHBondContact O-CD2 3.3Å; T1073-H1077 VanDerWaalsContact O-CD2 3.24Å; I1074-H1077 PolarHBondContact O-N 2.88Å; I1074-H1077 VanDerWaalsContact O-N 3.12Å; Y1075-H1077 VanDerWaalsContact C-N 3.26Å; Y1075-H1077 PolarHBondContact O-N 3.43Å; H1077-Y1079 VanDerWaalsContact C-N 3.3Å; H1077-D1092 IonicContact CD2-OD2 3.58Å; H1077-D1092 IonicContact CE1-OD2 3.32Å; H1077-D1092 IonicContact NE2-OD1 2.8Å; H1077-D1092 IonicContact NE2-OD2 3.79Å; H1077-D1092 PolarHBondContact NE2-OD2 2.87Å; H1077-F1093 AromaticContact CE1-CE2 3.97Å
1078	V	89	Confident	88.6	Confident	29 Å²	29	59.5 Å²	59.5	18%	0.176	32%	0.324	C	S	.	.	S	Bend	trans	-66.8	-36.5	176.4	175.2	0	0	0	0	110.5	Y1075 T1081 L1082 L1084	Y1075-V1078 HydrophobicContact CD2-CG2 4.46Å; Y1075-V1078 WeakPolarHBondContact O-CB 3.33Å; Y1075-V1078 WeakPolarHBondContact O-CG2 3.5Å; Y1075-V1078 PolarHBondContact O-N 3.28Å; V1078-T1081 WeakPolarHBondContact O-CA 3.24Å; V1078-T1081 PolarHBondContact O-N 3.34Å; V1078-T1081 PolarHBondContact O-OG1 3.42Å; V1078-L1082 HydrophobicContact CG1-CB 3.76Å; V1078-L1082 HydrophobicContact CG1-CD1 4.11Å; V1078-L1082 HydrophobicContact CG1-CG 4.41Å; V1078-L1082 PolarHBondContact O-N 3.06Å; V1078-L1084 HydrophobicContact CG1-CB 4.03Å
1079	Y	87.1	Confident	88.5	Confident	105 Å²	105	63 Å²	63	41%	0.412	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	135.9	171.3	-170.7	-92.3	0	0	0	109.9	H1077 L1084 V1089	H1077-Y1079 VanDerWaalsContact C-N 3.3Å; Y1079-L1084 WeakPolarHBondContact CB-O 3.49Å; Y1079-V1089 HydrophobicContact CD1-CG2 3.5Å; Y1079-V1089 VanDerWaalsContact CD1-CG2 3.5Å; Y1079-V1089 HydrophobicContact CE1-CG2 4.43Å; Y1079-V1089 HydrophobicContact CG-CG2 3.96Å
1080	P	85.6	Confident	88.3	Confident	104 Å²	104	62.4 Å²	62.4	68%	0.675	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	cis	-92.6	3.1	9	35.7	-35.9	0	0	0	115.3	L1082	P1080-L1082 VanDerWaalsContact C-N 3.33Å; P1080-L1082 PolarHBondContact O-N 3.44Å
1081	T	87.9	Confident	88.2	Confident	117 Å²	117	59.1 Å²	59.1	72%	0.718	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-38.3	-173.9	66	0	0	0	0	113.6	V1078	V1078-T1081 WeakPolarHBondContact O-CA 3.24Å; V1078-T1081 PolarHBondContact O-N 3.34Å; V1078-T1081 PolarHBondContact O-OG1 3.42Å
1082	L	83.4	Confident	88.2	Confident	94 Å²	94	57.7 Å²	57.7	49%	0.492	33%	0.328	S	S	.	.	S	Bend	trans	-121.1	143.2	166.7	-65.8	168.7	0	0	0	108	V1078 P1080 L1084	V1078-L1082 HydrophobicContact CG1-CB 3.76Å; V1078-L1082 HydrophobicContact CG1-CD1 4.11Å; V1078-L1082 HydrophobicContact CG1-CG 4.41Å; V1078-L1082 PolarHBondContact O-N 3.06Å; P1080-L1082 VanDerWaalsContact C-N 3.33Å; P1080-L1082 PolarHBondContact O-N 3.44Å; L1082-L1084 HydrophobicContact CB-CD1 4.2Å; L1082-L1084 HydrophobicContact CD1-CD1 4.44Å; L1082-L1084 PolarHBondContact O-N 3.21Å
1083	P	83	Confident	88.1	Confident	120 Å²	120	64.7 Å²	64.7	78%	0.779	36%	0.358	S	S	*	.	S	Bend	trans	-74.8	49.6	177.6	33.2	-36.8	0	0	0	111.7
1084	L	81.1	Confident	88	Confident	65 Å²	65	63 Å²	63	34%	0.34	35%	0.35	S	S	.	.	S	Bend	trans	-121	151.2	177	-79	155	0	0	0	107.6	W941 V1078 Y1079 L1082 S1086	W941-L1084 HydrophobicContact CZ2-CD2 4.46Å; V1078-L1084 HydrophobicContact CG1-CB 4.03Å; Y1079-L1084 WeakPolarHBondContact CB-O 3.49Å; L1082-L1084 HydrophobicContact CB-CD1 4.2Å; L1082-L1084 HydrophobicContact CD1-CD1 4.44Å; L1082-L1084 PolarHBondContact O-N 3.21Å; L1084-S1086 VanDerWaalsContact C-N 3.33Å; L1084-S1086 PolarHBondContact O-N 3.16Å
1085	A	82.2	Confident	88.1	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.008	33%	0.326	C	S	.	.			trans	60.8	28.8	172.7	0	0	0	0	0	116.6	Y1075 D1087 M1088	Y1075-A1085 HydrophobicContact CD1-CB 3.86Å; Y1075-A1085 HydrophobicContact CD2-CB 4.23Å; Y1075-A1085 HydrophobicContact CE1-CB 3.43Å; Y1075-A1085 VanDerWaalsContact CE1-CB 3.43Å; Y1075-A1085 HydrophobicContact CE2-CB 3.84Å; Y1075-A1085 HydrophobicContact CG-CB 4.22Å; A1085-D1087 PolarHBondContact O-N 3.4Å; A1085-M1088 HydrophobicContact CB-CB 4.16Å; A1085-M1088 PolarHBondContact O-N 3.33Å
1086	S	86.8	Confident	88.1	Confident	54 Å²	54	59.8 Å²	59.8	38%	0.378	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-49.5	-34.3	177.5	52.6	0	0	0	0	113.8	L1084 V1089	L1084-S1086 VanDerWaalsContact C-N 3.33Å; L1084-S1086 PolarHBondContact O-N 3.16Å; S1086-V1089 WeakPolarHBondContact O-CG2 3.3Å
1087	D	88	Confident	88	Confident	96 Å²	96	62.3 Å²	62.3	51%	0.513	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-86.4	-11.4	-174.4	-46.1	-17.4	0	0	0	112	L1028 A1085	L1028-D1087 HydrophobicContact CD1-CB 4.02Å; L1028-D1087 WeakPolarHBondContact CD1-O 3.49Å; A1085-D1087 PolarHBondContact O-N 3.4Å
1088	M	89.5	Confident	88	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.01	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-96.9	-0.3	-177.9	-70.3	-79.3	108.2	0	0	113.6	E939 L1028 Y1075 P1076 A1085 G1090 M1091	E939-M1088 HydrophobicContact CB-CE 3.65Å; E939-M1088 HydrophobicContact CB-CG 4.37Å; E939-M1088 HydrophobicContact CB-SD 3.99Å; E939-M1088 HydrophobicContact CG-CE 3.88Å; E939-M1088 HydrophobicContact CG-CG 3.78Å; E939-M1088 HydrophobicContact CG-SD 4.08Å; L1028-M1088 HydrophobicContact CB-CE 3.9Å; L1028-M1088 HydrophobicContact CD1-CE 3.71Å; L1028-M1088 HydrophobicContact CD2-CE 3.66Å; L1028-M1088 HydrophobicContact CG-CE 3.94Å; Y1075-M1088 HydrophobicContact CD1-CB 4.22Å; Y1075-M1088 HydrophobicContact CD1-CG 3.9Å; Y1075-M1088 HydrophobicContact CE1-CB 4.44Å; Y1075-M1088 HydrophobicContact CE1-CG 3.85Å; P1076-M1088 WeakPolarHBondContact CA-O 3.43Å; P1076-M1088 WeakPolarHBondContact CB-O 3.27Å; P1076-M1088 WeakPolarHBondContact CG-O 3.24Å; A1085-M1088 HydrophobicContact CB-CB 4.16Å; A1085-M1088 PolarHBondContact O-N 3.33Å; M1088-G1090 PolarHBondContact O-N 3.04Å; M1088-M1091 HydrophobicContact CB-CG 4.39Å; M1088-M1091 HydrophobicContact CE-CG 4.15Å; M1088-M1091 VanDerWaalsContact O-CB 3.27Å; M1088-M1091 WeakPolarHBondContact O-CB 3.25Å; M1088-M1091 VanDerWaalsContact O-CG 3.22Å; M1088-M1091 WeakPolarHBondContact O-CG 3.22Å; M1088-M1091 PolarHBondContact O-N 2.63Å; M1088-M1091 HydrophobicContact SD-CB 4.48Å; M1088-M1091 HydrophobicContact SD-CG 4.18Å
1089	V	91	Very high	87.9	Confident	73 Å²	73	58.5 Å²	58.5	44%	0.442	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	124	-176.8	178.1	0	0	0	0	110.7	Y1079 S1086 M1091	Y1079-V1089 HydrophobicContact CD1-CG2 3.5Å; Y1079-V1089 VanDerWaalsContact CD1-CG2 3.5Å; Y1079-V1089 HydrophobicContact CE1-CG2 4.43Å; Y1079-V1089 HydrophobicContact CG-CG2 3.96Å; S1086-V1089 WeakPolarHBondContact O-CG2 3.3Å; V1089-M1091 VanDerWaalsContact C-N 3.25Å; V1089-M1091 PolarHBondContact O-N 2.85Å
1090	G	88.8	Confident	88.1	Confident	29 Å²	29	55.8 Å²	55.8	30%	0.299	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	9.3	180	0	0	0	0	0	115.7	M1088 D1092 F1093 A1094	M1088-G1090 PolarHBondContact O-N 3.04Å; G1090-D1092 VanDerWaalsContact C-N 3.28Å; G1090-D1092 PolarHBondContact O-N 3.48Å; G1090-F1093 PolarHBondContact O-N 2.87Å; G1090-A1094 WeakPolarHBondContact O-CB 3.38Å; G1090-A1094 PolarHBondContact O-N 3.25Å; G1090-A1094 VanDerWaalsContact O-N 3.09Å
1091	M	90.9	Very high	88.4	Confident	25 Å²	25	50.8 Å²	50.8	12%	0.123	31%	0.313	C	S	.	.	H	α-helix	trans	-68	-26.3	-179.9	-71.8	-63	130.8	0	0	113.5	L1028 V1029 P1076 M1088 V1089 A1094 V1095	L1028-M1091 HydrophobicContact CB-SD 3.89Å; V1029-M1091 HydrophobicContact CG2-SD 4.1Å; P1076-M1091 HydrophobicContact CG-CB 4.3Å; M1088-M1091 HydrophobicContact CB-CG 4.39Å; M1088-M1091 HydrophobicContact CE-CG 4.15Å; M1088-M1091 VanDerWaalsContact O-CB 3.27Å; M1088-M1091 WeakPolarHBondContact O-CB 3.25Å; M1088-M1091 VanDerWaalsContact O-CG 3.22Å; M1088-M1091 WeakPolarHBondContact O-CG 3.22Å; M1088-M1091 PolarHBondContact O-N 2.63Å; M1088-M1091 HydrophobicContact SD-CB 4.48Å; M1088-M1091 HydrophobicContact SD-CG 4.18Å; V1089-M1091 VanDerWaalsContact C-N 3.25Å; V1089-M1091 PolarHBondContact O-N 2.85Å; M1091-A1094 PolarHBondContact O-N 3.04Å; M1091-V1095 WeakPolarHBondContact O-CB 3.49Å; M1091-V1095 VanDerWaalsContact O-CG2 3.23Å; M1091-V1095 WeakPolarHBondContact O-CG2 3.47Å; M1091-V1095 PolarHBondContact O-N 3.37Å
1092	D	91.2	Very high	88.6	Confident	8 Å²	8	51.2 Å²	51.2	4%	0.043	30%	0.301	C	S	.	.	H	α-helix	trans	-59.4	-52.8	173.4	58.3	-32.5	0	0	0	111	P1076 H1077 G1090 A1094 V1095 Y1096	P1076-D1092 HydrophobicContact CG-CB 4.17Å; H1077-D1092 IonicContact CD2-OD2 3.58Å; H1077-D1092 IonicContact CE1-OD2 3.32Å; H1077-D1092 IonicContact NE2-OD1 2.8Å; H1077-D1092 IonicContact NE2-OD2 3.79Å; H1077-D1092 PolarHBondContact NE2-OD2 2.87Å; G1090-D1092 VanDerWaalsContact C-N 3.28Å; G1090-D1092 PolarHBondContact O-N 3.48Å; D1092-A1094 PolarHBondContact O-N 3.42Å; D1092-V1095 PolarHBondContact O-N 3.45Å; D1092-Y1096 HydrophobicContact CB-CD2 4.38Å; D1092-Y1096 HydrophobicContact CB-CE2 4.26Å; D1092-Y1096 VanDerWaalsContact O-CB 3.29Å; D1092-Y1096 WeakPolarHBondContact O-CB 3.35Å; D1092-Y1096 WeakPolarHBondContact O-CD2 3.17Å; D1092-Y1096 VanDerWaalsContact O-CG 3.28Å; D1092-Y1096 PolarHBondContact O-N 2.82Å
1093	F	90.4	Very high	89	Confident	151 Å²	151	53.3 Å²	53.3	66%	0.662	31%	0.307	S	S	*	.	H	α-helix	trans	-65.3	-39.4	176.5	-69.9	-76.3	0	0	0	111.9	H1077 G1090 G1097	H1077-F1093 AromaticContact CE1-CE2 3.97Å; G1090-F1093 PolarHBondContact O-N 2.87Å; F1093-G1097 WeakPolarHBondContact O-CA 3.45Å; F1093-G1097 PolarHBondContact O-N 3.24Å
1094	A	90.3	Very high	89.4	Confident	23 Å²	23	48 Å²	48	19%	0.19	27%	0.273	C	S	.	.	H	α-helix	trans	-67.4	-38.5	-179.8	0	0	0	0	0	112.7	Y1019 V1029 G1090 M1091 D1092	Y1019-A1094 WeakPolarHBondContact CE1-O 3.46Å; Y1019-A1094 PolarHBondContact OH-O 3.03Å; V1029-A1094 HydrophobicContact CG2-CB 3.95Å; G1090-A1094 WeakPolarHBondContact O-CB 3.38Å; G1090-A1094 PolarHBondContact O-N 3.25Å; G1090-A1094 VanDerWaalsContact O-N 3.09Å; M1091-A1094 PolarHBondContact O-N 3.04Å; D1092-A1094 PolarHBondContact O-N 3.42Å
1095	V	92.1	Very high	90	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-79.5	-48.9	179.4	174.9	0	0	0	0	110.4	V1029 N1032 L1072 M1091 D1092 G1097 C1098 F1101	V1029-V1095 HydrophobicContact CG1-CG2 4.37Å; N1032-V1095 HydrophobicContact CB-CG2 3.8Å; L1072-V1095 HydrophobicContact CD2-CB 4.43Å; L1072-V1095 HydrophobicContact CD2-CG1 4.16Å; M1091-V1095 WeakPolarHBondContact O-CB 3.49Å; M1091-V1095 VanDerWaalsContact O-CG2 3.23Å; M1091-V1095 WeakPolarHBondContact O-CG2 3.47Å; M1091-V1095 PolarHBondContact O-N 3.37Å; D1092-V1095 PolarHBondContact O-N 3.45Å; V1095-G1097 VanDerWaalsContact C-N 3.32Å; V1095-G1097 PolarHBondContact O-N 2.99Å; V1095-C1098 WeakPolarHBondContact O-CB 3.06Å; V1095-C1098 PolarHBondContact O-N 2.72Å; V1095-F1101 HydrophobicContact CG1-CD1 4.08Å; V1095-F1101 HydrophobicContact CG1-CD2 3.55Å; V1095-F1101 HydrophobicContact CG1-CE1 4.05Å; V1095-F1101 HydrophobicContact CG1-CE2 3.5Å; V1095-F1101 VanDerWaalsContact CG1-CE2 3.5Å; V1095-F1101 HydrophobicContact CG1-CG 3.83Å; V1095-F1101 HydrophobicContact CG1-CZ 3.75Å; V1095-F1101 WeakPolarHBondContact O-CD1 3.4Å
1096	Y	91.6	Very high	90.4	Very high	53 Å²	53	53.2 Å²	53.2	21%	0.208	30%	0.298	C	S	.	.	H	α-helix	trans	-71.3	-25.3	-178.1	-59.8	-34.3	0	0	0	113.5	F1069 L1072 T1073 D1092 C1098 F1101 W1102	F1069-Y1096 AromaticContact CD1-CE1 3.76Å; F1069-Y1096 HydrophobicContact CD1-CE1 3.76Å; F1069-Y1096 AromaticContact CD1-CZ 3.99Å; F1069-Y1096 WeakPolarHBondContact CD1-OH 3.49Å; F1069-Y1096 AromaticContact CE1-CE1 3.92Å; F1069-Y1096 HydrophobicContact CE1-CE1 3.92Å; F1069-Y1096 PolarHBondContact O-OH 3.38Å; F1069-Y1096 VanDerWaalsContact O-OH 3.06Å; L1072-Y1096 HydrophobicContact CD2-CE1 3.92Å; T1073-Y1096 WeakPolarHBondContact OG1-CE2 3.29Å; T1073-Y1096 PolarHBondContact OG1-OH 3.38Å; D1092-Y1096 HydrophobicContact CB-CD2 4.38Å; D1092-Y1096 HydrophobicContact CB-CE2 4.26Å; D1092-Y1096 VanDerWaalsContact O-CB 3.29Å; D1092-Y1096 WeakPolarHBondContact O-CB 3.35Å; D1092-Y1096 WeakPolarHBondContact O-CD2 3.17Å; D1092-Y1096 VanDerWaalsContact O-CG 3.28Å; D1092-Y1096 PolarHBondContact O-N 2.82Å; Y1096-C1098 VanDerWaalsContact C-N 3.25Å; Y1096-C1098 PolarHBondContact O-N 3.03Å; Y1096-F1101 AromaticContact CD1-CE1 3.94Å; Y1096-F1101 HydrophobicContact CD1-CE1 3.94Å; Y1096-F1101 HydrophobicContact CD1-CZ 4.45Å; Y1096-F1101 HydrophobicContact CE1-CE1 4.37Å; Y1096-F1101 HydrophobicContact CE1-CZ 4.49Å; Y1096-W1102 HydrophobicContact CD1-CZ2 4.17Å; Y1096-W1102 PolarHBondContact O-NE1 3.19Å
1097	G	89	Confident	90.8	Very high	55 Å²	55	53.8 Å²	53.8	57%	0.567	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-8.8	173.6	0	0	0	0	0	114.3	F1093 V1095	F1093-G1097 WeakPolarHBondContact O-CA 3.45Å; F1093-G1097 PolarHBondContact O-N 3.24Å; V1095-G1097 VanDerWaalsContact C-N 3.32Å; V1095-G1097 PolarHBondContact O-N 2.99Å
1098	C	88.6	Confident	91.1	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.273	C	S	.	.			trans	-84.6	118.4	-179.4	177.7	0	0	0	0	111.3	V1018 Y1019 V1095 Y1096 I1100 F1101	V1018-C1098 HydrophobicContact CG1-CB 4.45Å; V1018-C1098 WeakPolarHBondContact CG1-SG 3.34Å; Y1019-C1098 HydrophobicContact CD1-CB 4.46Å; Y1019-C1098 HydrophobicContact CE1-CB 3.9Å; V1095-C1098 WeakPolarHBondContact O-CB 3.06Å; V1095-C1098 PolarHBondContact O-N 2.72Å; Y1096-C1098 VanDerWaalsContact C-N 3.25Å; Y1096-C1098 PolarHBondContact O-N 3.03Å; C1098-I1100 VanDerWaalsContact C-N 3.32Å; C1098-I1100 PolarHBondContact O-N 3.2Å; C1098-F1101 HydrophobicContact CB-CB 3.83Å; C1098-F1101 WeakPolarHBondContact O-CB 3.34Å; C1098-F1101 PolarHBondContact O-N 2.87Å; C1098-F1101 PolarHBondContact SG-N 3.36Å; C1098-F1101 VanDerWaalsContact SG-N 3.38Å
1099	G	88.2	Confident	91.3	Very high	53 Å²	53	49.6 Å²	49.6	55%	0.546	27%	0.274	S	S	.	.	H	α-helix	trans	-65	-35.5	176	0	0	0	0	0	113.1	F1101 W1102 F1103	G1099-F1101 VanDerWaalsContact C-N 3.25Å; G1099-F1101 PolarHBondContact O-N 2.82Å; G1099-W1102 PolarHBondContact O-N 3.3Å; G1099-F1103 PolarHBondContact O-N 3.16Å
1100	I	89.9	Confident	91.4	Very high	48 Å²	48	51.6 Å²	51.6	25%	0.246	28%	0.28	C	S	.	.	H	α-helix	trans	-62.7	-36.1	176.6	-55.1	-174.3	0	0	0	110.5	A1012 F1013 V1018 C1098 F1103 G1104	A1012-I1100 HydrophobicContact CB-CG2 3.77Å; F1013-I1100 HydrophobicContact CD2-CG2 4.32Å; F1013-I1100 HydrophobicContact CE2-CG2 4.1Å; V1018-I1100 HydrophobicContact CB-CD1 4.48Å; V1018-I1100 HydrophobicContact CG1-CD1 4.03Å; V1018-I1100 HydrophobicContact CG1-CG1 4.41Å; V1018-I1100 HydrophobicContact CG2-CD1 4.46Å; C1098-I1100 VanDerWaalsContact C-N 3.32Å; C1098-I1100 PolarHBondContact O-N 3.2Å; I1100-F1103 PolarHBondContact O-N 3.42Å; I1100-G1104 PolarHBondContact O-N 3.41Å
1101	F	91.8	Very high	91.7	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-59.6	-49.5	178.2	167.3	-100	0	0	0	112	T1036 Y1037 F1069 V1095 Y1096 C1098 G1099 G1104 F1105	T1036-F1101 HydrophobicContact CG2-CE2 3.95Å; T1036-F1101 HydrophobicContact CG2-CZ 3.93Å; Y1037-F1101 HydrophobicContact CE1-CD2 4.27Å; Y1037-F1101 HydrophobicContact CE1-CE2 4.32Å; Y1037-F1101 VanDerWaalsContact OH-CA 3.29Å; Y1037-F1101 WeakPolarHBondContact OH-CA 3.46Å; Y1037-F1101 PolarHBondContact OH-O 3.24Å; F1069-F1101 HydrophobicContact CE1-CZ 4.29Å; V1095-F1101 HydrophobicContact CG1-CD1 4.08Å; V1095-F1101 HydrophobicContact CG1-CD2 3.55Å; V1095-F1101 HydrophobicContact CG1-CE1 4.05Å; V1095-F1101 HydrophobicContact CG1-CE2 3.5Å; V1095-F1101 VanDerWaalsContact CG1-CE2 3.5Å; V1095-F1101 HydrophobicContact CG1-CG 3.83Å; V1095-F1101 HydrophobicContact CG1-CZ 3.75Å; V1095-F1101 WeakPolarHBondContact O-CD1 3.4Å; Y1096-F1101 AromaticContact CD1-CE1 3.94Å; Y1096-F1101 HydrophobicContact CD1-CE1 3.94Å; Y1096-F1101 HydrophobicContact CD1-CZ 4.45Å; Y1096-F1101 HydrophobicContact CE1-CE1 4.37Å; Y1096-F1101 HydrophobicContact CE1-CZ 4.49Å; C1098-F1101 HydrophobicContact CB-CB 3.83Å; C1098-F1101 WeakPolarHBondContact O-CB 3.34Å; C1098-F1101 PolarHBondContact O-N 2.87Å; C1098-F1101 PolarHBondContact SG-N 3.36Å; C1098-F1101 VanDerWaalsContact SG-N 3.38Å; G1099-F1101 VanDerWaalsContact C-N 3.25Å; G1099-F1101 PolarHBondContact O-N 2.82Å; F1101-G1104 PolarHBondContact O-N 3.45Å; F1101-F1105 WeakPolarHBondContact O-CB 3.28Å; F1101-F1105 PolarHBondContact O-N 2.82Å
1102	W	92.8	Very high	91.9	Very high	125 Å²	125	52.1 Å²	52.1	47%	0.473	28%	0.276	S	S	.	.	H	α-helix	trans	-67.2	-36.7	179.8	-70.1	108.3	0	0	0	113.2	Y1096 G1099 F1105 L1106	Y1096-W1102 HydrophobicContact CD1-CZ2 4.17Å; Y1096-W1102 PolarHBondContact O-NE1 3.19Å; G1099-W1102 PolarHBondContact O-N 3.3Å; W1102-F1105 HydrophobicContact CE3-CD1 4.45Å; W1102-F1105 WeakPolarHBondContact O-CB 3.27Å; W1102-F1105 PolarHBondContact O-N 3.45Å; W1102-L1106 PolarHBondContact O-N 3.19Å
1103	F	92.2	Very high	92.1	Very high	139 Å²	139	52.5 Å²	52.5	61%	0.61	28%	0.278	S	S	*	.	H	α-helix	trans	-66.5	-45.3	174.3	-172.9	-103.6	0	0	0	111.4	G1099 I1100 F1105 L1106 L1107	G1099-F1103 PolarHBondContact O-N 3.16Å; I1100-F1103 PolarHBondContact O-N 3.42Å; F1103-F1105 VanDerWaalsContact C-N 3.29Å; F1103-F1105 PolarHBondContact O-N 3.1Å; F1103-L1106 PolarHBondContact O-N 3.09Å; F1103-L1107 HydrophobicContact CD1-CD2 4.34Å; F1103-L1107 HydrophobicContact CE1-CB 4.5Å; F1103-L1107 HydrophobicContact CE1-CD2 3.55Å; F1103-L1107 HydrophobicContact CZ-CD2 4Å; F1103-L1107 WeakPolarHBondContact O-CB 3.36Å; F1103-L1107 PolarHBondContact O-N 2.94Å
1104	G	92.1	Very high	92.2	Very high	7 Å²	7	49.4 Å²	49.4	7%	0.072	27%	0.271	C	S	.	.	H	α-helix	trans	-62.8	-34.9	175	0	0	0	0	0	112.9	Y1037 I1100 F1101 L1106 L1107 I1108	Y1037-G1104 VanDerWaalsContact CE1-C 3.43Å; Y1037-G1104 WeakPolarHBondContact OH-CA 3.27Å; I1100-G1104 PolarHBondContact O-N 3.41Å; F1101-G1104 PolarHBondContact O-N 3.45Å; G1104-L1106 VanDerWaalsContact C-N 3.29Å; G1104-L1106 PolarHBondContact O-N 3.41Å; G1104-L1107 PolarHBondContact O-N 3.28Å; G1104-I1108 VanDerWaalsContact O-CB 3.27Å; G1104-I1108 WeakPolarHBondContact O-CB 3.41Å; G1104-I1108 VanDerWaalsContact O-CG1 3.32Å; G1104-I1108 WeakPolarHBondContact O-CG1 3.44Å; G1104-I1108 PolarHBondContact O-N 3.06Å
1105	F	92.5	Very high	92.4	Very high	60 Å²	60	52.2 Å²	52.2	26%	0.263	28%	0.277	S	S	.	.	H	α-helix	trans	-59.1	-39	177.8	171.5	-98.3	0	0	0	112.5	T1036 Y1037 V1040 F1069 F1101 W1102 F1103 P1109	T1036-F1105 HydrophobicContact CG2-CD2 4.24Å; Y1037-F1105 HydrophobicContact CE1-CB 3.91Å; V1040-F1105 HydrophobicContact CG2-CD2 4.26Å; V1040-F1105 HydrophobicContact CG2-CE2 3.7Å; F1069-F1105 AromaticContact CE2-CE2 3.9Å; F1069-F1105 HydrophobicContact CE2-CE2 3.9Å; F1069-F1105 HydrophobicContact CE2-CZ 4.44Å; F1069-F1105 HydrophobicContact CZ-CD2 4.09Å; F1069-F1105 AromaticContact CZ-CE2 3.57Å; F1069-F1105 HydrophobicContact CZ-CE2 3.57Å; F1069-F1105 HydrophobicContact CZ-CZ 4.22Å; F1101-F1105 WeakPolarHBondContact O-CB 3.28Å; F1101-F1105 PolarHBondContact O-N 2.82Å; W1102-F1105 HydrophobicContact CE3-CD1 4.45Å; W1102-F1105 WeakPolarHBondContact O-CB 3.27Å; W1102-F1105 PolarHBondContact O-N 3.45Å; F1103-F1105 VanDerWaalsContact C-N 3.29Å; F1103-F1105 PolarHBondContact O-N 3.1Å; F1105-P1109 VanDerWaalsContact O-CD 3.25Å; F1105-P1109 WeakPolarHBondContact O-CD 3.39Å; F1105-P1109 WeakPolarHBondContact O-CG 3.33Å
1106	L	91.7	Very high	92.5	Very high	117 Å²	117	52.5 Å²	52.5	61%	0.613	28%	0.278	S	S	*	.	H	α-helix	trans	-80.2	-47.3	176	-176	65.8	0	0	0	111.9	W1102 F1103 G1104 M1110	W1102-L1106 PolarHBondContact O-N 3.19Å; F1103-L1106 PolarHBondContact O-N 3.09Å; G1104-L1106 VanDerWaalsContact C-N 3.29Å; G1104-L1106 PolarHBondContact O-N 3.41Å; L1106-M1110 WeakPolarHBondContact O-CG 3.5Å
1107	L	94.1	Very high	92.6	Very high	66 Å²	66	53.4 Å²	53.4	35%	0.346	29%	0.286	S	S	.	.	H	α-helix	trans	-76.7	-44.1	-167.5	-175.7	65.5	0	0	0	113.1	F1103 G1104 M1110 I1111	F1103-L1107 HydrophobicContact CD1-CD2 4.34Å; F1103-L1107 HydrophobicContact CE1-CB 4.5Å; F1103-L1107 HydrophobicContact CE1-CD2 3.55Å; F1103-L1107 HydrophobicContact CZ-CD2 4Å; F1103-L1107 WeakPolarHBondContact O-CB 3.36Å; F1103-L1107 PolarHBondContact O-N 2.94Å; G1104-L1107 PolarHBondContact O-N 3.28Å; L1107-M1110 PolarHBondContact O-N 2.98Å; L1107-I1111 HydrophobicContact CD1-CD1 3.89Å; L1107-I1111 HydrophobicContact CD1-CG1 4.18Å; L1107-I1111 HydrophobicContact CD2-CD1 4.11Å; L1107-I1111 HydrophobicContact CG-CD1 3.64Å; L1107-I1111 HydrophobicContact CG-CG1 4.27Å; L1107-I1111 WeakPolarHBondContact O-CG1 3.48Å; L1107-I1111 PolarHBondContact O-N 2.97Å
1108	I	94.5	Very high	92.8	Very high	5 Å²	5	53.4 Å²	53.4	3%	0.026	28%	0.281	C	S	.	.	H	α-helix	trans	-70.2	-47.5	-167.1	-60.8	174.8	0	0	0	111.9	L1005 I1008 P1009 Y1037 G1104 M1110 I1111 A1112	L1005-I1108 HydrophobicContact CD2-CG2 3.77Å; I1008-I1108 HydrophobicContact CB-CD1 4.46Å; I1008-I1108 HydrophobicContact CG2-CD1 3.92Å; I1008-I1108 HydrophobicContact CG2-CG1 3.87Å; P1009-I1108 HydrophobicContact CG-CD1 3.64Å; Y1037-I1108 HydrophobicContact CD2-CD1 3.7Å; Y1037-I1108 HydrophobicContact CE2-CD1 3.56Å; Y1037-I1108 HydrophobicContact CG-CD1 4.4Å; G1104-I1108 VanDerWaalsContact O-CB 3.27Å; G1104-I1108 WeakPolarHBondContact O-CB 3.41Å; G1104-I1108 VanDerWaalsContact O-CG1 3.32Å; G1104-I1108 WeakPolarHBondContact O-CG1 3.44Å; G1104-I1108 PolarHBondContact O-N 3.06Å; I1108-M1110 VanDerWaalsContact C-N 3.26Å; I1108-M1110 PolarHBondContact O-N 3.02Å; I1108-I1111 PolarHBondContact O-N 2.92Å; I1108-A1112 PolarHBondContact O-N 3.28Å
1109	P	93.8	Very high	92.9	Very high	4 Å²	4	61 Å²	61	3%	0.026	31%	0.31	C	S	.	.	H	α-helix	trans	-59.8	-36.3	173.9	-24.6	36	0	0	0	112.8	V1040 L1044 F1105 L1113	V1040-P1109 HydrophobicContact CB-CG 4.32Å; V1040-P1109 HydrophobicContact CG1-CB 4.1Å; V1040-P1109 HydrophobicContact CG1-CG 3.82Å; L1044-P1109 HydrophobicContact CD1-CB 4.24Å; F1105-P1109 VanDerWaalsContact O-CD 3.25Å; F1105-P1109 WeakPolarHBondContact O-CD 3.39Å; F1105-P1109 WeakPolarHBondContact O-CG 3.33Å; P1109-L1113 WeakPolarHBondContact O-CB 3.43Å; P1109-L1113 VanDerWaalsContact O-CG 3.28Å; P1109-L1113 WeakPolarHBondContact O-CG 3.28Å; P1109-L1113 PolarHBondContact O-N 2.88Å
1110	M	93.9	Very high	92.9	Very high	115 Å²	115	60.7 Å²	60.7	57%	0.567	29%	0.293	S	S	*	.	H	α-helix	trans	-64.3	-47.4	176.2	-75.8	-136.4	-68.3	0	0	111.9	L1106 L1107 I1108 A1112 L1113 T1114	L1106-M1110 WeakPolarHBondContact O-CG 3.5Å; L1107-M1110 PolarHBondContact O-N 2.98Å; I1108-M1110 VanDerWaalsContact C-N 3.26Å; I1108-M1110 PolarHBondContact O-N 3.02Å; M1110-A1112 VanDerWaalsContact C-N 3.35Å; M1110-A1112 PolarHBondContact O-N 3.32Å; M1110-L1113 PolarHBondContact O-N 3.49Å; M1110-T1114 WeakPolarHBondContact O-CB 3.36Å; M1110-T1114 PolarHBondContact O-N 3.41Å; M1110-T1114 PolarHBondContact O-OG1 3.45Å
1111	I	94.9	Very high	92.9	Very high	66 Å²	66	64.3 Å²	64.3	34%	0.338	31%	0.31	S	S	.	.	H	α-helix	trans	-60.2	-46.5	177.5	-68.6	173.2	0	0	0	110.6	L1004 I1008 L1107 I1108 L1113	L1004-I1111 HydrophobicContact CD1-CG2 4.45Å; I1008-I1111 HydrophobicContact CD1-CG2 4.25Å; L1107-I1111 HydrophobicContact CD1-CD1 3.89Å; L1107-I1111 HydrophobicContact CD1-CG1 4.18Å; L1107-I1111 HydrophobicContact CD2-CD1 4.11Å; L1107-I1111 HydrophobicContact CG-CD1 3.64Å; L1107-I1111 HydrophobicContact CG-CG1 4.27Å; L1107-I1111 WeakPolarHBondContact O-CG1 3.48Å; L1107-I1111 PolarHBondContact O-N 2.97Å; I1108-I1111 PolarHBondContact O-N 2.92Å; I1111-L1113 PolarHBondContact O-N 3.47Å
1112	A	94.2	Very high	92.8	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-58.6	-48.7	-179.8	0	0	0	0	0	111.6	H1001 L1004 T1041 I1108 M1110	H1001-A1112 PolarHBondContact NE2-O 2.84Å; L1004-A1112 HydrophobicContact CD1-CB 4.5Å; T1041-A1112 HydrophobicContact CG2-CB 3.86Å; I1108-A1112 PolarHBondContact O-N 3.28Å; M1110-A1112 VanDerWaalsContact C-N 3.35Å; M1110-A1112 PolarHBondContact O-N 3.32Å
1113	L	94.8	Very high	92.4	Very high	15 Å²	15	65.1 Å²	65.1	8%	0.079	33%	0.326	C	S	.	.	H	α-helix	trans	-80.7	-16.9	-173.8	-63.6	171.4	0	0	0	114.6	T1041 L1044 K1045 P1109 M1110 I1111 R1115 D1116 I1117	T1041-L1113 HydrophobicContact CG2-CD2 4.23Å; T1041-L1113 HydrophobicContact CG2-CG 4.29Å; L1044-L1113 HydrophobicContact CB-CD1 3.5Å; L1044-L1113 HydrophobicContact CD1-CD1 4.04Å; L1044-L1113 HydrophobicContact CG-CD1 4.45Å; K1045-L1113 HydrophobicContact CB-CD2 3.95Å; K1045-L1113 HydrophobicContact CD-CD2 4.34Å; P1109-L1113 WeakPolarHBondContact O-CB 3.43Å; P1109-L1113 VanDerWaalsContact O-CG 3.28Å; P1109-L1113 WeakPolarHBondContact O-CG 3.28Å; P1109-L1113 PolarHBondContact O-N 2.88Å; M1110-L1113 PolarHBondContact O-N 3.49Å; I1111-L1113 PolarHBondContact O-N 3.47Å; L1113-R1115 VanDerWaalsContact C-N 3.32Å; L1113-R1115 PolarHBondContact O-N 3Å; L1113-D1116 WeakPolarHBondContact O-CB 3.49Å; L1113-D1116 PolarHBondContact O-N 3.16Å; L1113-I1117 WeakPolarHBondContact O-CG1 3.46Å; L1113-I1117 PolarHBondContact O-N 3.09Å
1114	T	93.9	Very high	91.9	Very high	86 Å²	86	63.2 Å²	63.2	53%	0.528	32%	0.315	S	S	.	.	H	α-helix	trans	-56.9	-44.5	-177.6	-66.4	0	0	0	0	112	M1110 D1116 I1117 A1118	M1110-T1114 WeakPolarHBondContact O-CB 3.36Å; M1110-T1114 PolarHBondContact O-N 3.41Å; M1110-T1114 PolarHBondContact O-OG1 3.45Å; T1114-D1116 VanDerWaalsContact C-N 3.32Å; T1114-D1116 PolarHBondContact O-N 3.43Å; T1114-I1117 PolarHBondContact O-N 3.1Å; T1114-A1118 WeakPolarHBondContact O-CB 2.95Å; T1114-A1118 PolarHBondContact O-N 3.01Å
1115	R	94.2	Very high	91.4	Very high	82 Å²	82	68.3 Å²	68.3	31%	0.309	35%	0.345	S	S	.	.	H	α-helix	trans	-62.4	-40.3	176.4	-175.4	-143.6	59.3	-160.8	-23.2	111.5	N997 Y1000 H1001 L1113 A1118 W1119	N997-R1115 PolarHBondContact OD1-NH2 3.23Å; Y1000-R1115 VanDerWaalsContact CD1-NH2 3.34Å; Y1000-R1115 HydrophobicContact CE1-CB 4.37Å; H1001-R1115 PolarHBondContact NE2-NH2 2.98Å; L1113-R1115 VanDerWaalsContact C-N 3.32Å; L1113-R1115 PolarHBondContact O-N 3Å; R1115-A1118 PolarHBondContact O-N 3.3Å; R1115-W1119 WeakPolarHBondContact O-CB 3.49Å; R1115-W1119 PolarHBondContact O-N 3.18Å
1116	D	93.9	Very high	90.9	Very high	6 Å²	6	71 Å²	71	3%	0.032	37%	0.366	C	S	.	.	H	α-helix	trans	-64.7	-42.1	179.5	-85.5	17.2	0	0	0	112.2	N997 H1001 K1045 L1048 L1113 T1114 K1120	N997-D1116 PolarHBondContact ND2-OD1 3.33Å; N997-D1116 PolarHBondContact ND2-OD2 3.35Å; H1001-D1116 IonicContact CE1-OD2 3.57Å; H1001-D1116 PolarHBondContact CE1-OD2 3.33Å; H1001-D1116 IonicContact NE2-OD1 2.65Å; H1001-D1116 IonicContact NE2-OD2 2.78Å; K1045-D1116 WeakPolarHBondContact CD-OD2 3.37Å; K1045-D1116 WeakPolarHBondContact CE-OD2 3.18Å; K1045-D1116 IonicContact NZ-OD2 3.24Å; K1045-D1116 PolarHBondContact NZ-OD2 3.35Å; L1048-D1116 HydrophobicContact CD1-CB 4.37Å; L1048-D1116 HydrophobicContact CD2-CB 4.38Å; L1113-D1116 WeakPolarHBondContact O-CB 3.49Å; L1113-D1116 PolarHBondContact O-N 3.16Å; T1114-D1116 VanDerWaalsContact C-N 3.32Å; T1114-D1116 PolarHBondContact O-N 3.43Å; D1116-K1120 WeakPolarHBondContact O-CB 3.44Å; D1116-K1120 WeakPolarHBondContact O-CG 3.39Å; D1116-K1120 PolarHBondContact O-N 3.04Å
1117	I	93.6	Very high	90.1	Very high	72 Å²	72	68.6 Å²	68.6	37%	0.369	36%	0.363	S	S	.	.	H	α-helix	trans	-61.5	-50.1	174.7	-64.7	167.6	0	0	0	109.7	L1048 L1113 T1114 W1119 K1120 M1121	L1048-I1117 HydrophobicContact CD1-CB 4.47Å; L1048-I1117 HydrophobicContact CD1-CD1 4.36Å; L1048-I1117 HydrophobicContact CD1-CG1 3.39Å; L1113-I1117 WeakPolarHBondContact O-CG1 3.46Å; L1113-I1117 PolarHBondContact O-N 3.09Å; T1114-I1117 PolarHBondContact O-N 3.1Å; I1117-W1119 PolarHBondContact O-N 3.23Å; I1117-K1120 PolarHBondContact O-N 3.46Å; I1117-M1121 HydrophobicContact CG2-CE 3.64Å; I1117-M1121 HydrophobicContact CG2-CG 4.47Å; I1117-M1121 HydrophobicContact CG2-SD 3.98Å; I1117-M1121 WeakPolarHBondContact O-CB 3.44Å; I1117-M1121 WeakPolarHBondContact O-CG 3.32Å; I1117-M1121 PolarHBondContact O-N 3.18Å
1118	A	93.4	Very high	88.9	Confident	55 Å²	55	66 Å²	66	46%	0.455	35%	0.353	S	S	.	.	H	α-helix	trans	-59.8	-45	179.6	0	0	0	0	0	112.1	T1114 R1115 M1121 A1122	T1114-A1118 WeakPolarHBondContact O-CB 2.95Å; T1114-A1118 PolarHBondContact O-N 3.01Å; R1115-A1118 PolarHBondContact O-N 3.3Å; A1118-M1121 PolarHBondContact O-N 2.77Å; A1118-A1122 VanDerWaalsContact O-CB 3.31Å; A1118-A1122 WeakPolarHBondContact O-CB 3.46Å; A1118-A1122 PolarHBondContact O-N 3.26Å
1119	W	91	Very high	88.1	Confident	161 Å²	161	67.9 Å²	67.9	61%	0.61	37%	0.366	S	S	*	.	H	α-helix	trans	-61	-46.3	176.5	172.3	-103.9	0	0	0	112.1	R1115 I1117 A1122 K1123	R1115-W1119 WeakPolarHBondContact O-CB 3.49Å; R1115-W1119 PolarHBondContact O-N 3.18Å; I1117-W1119 PolarHBondContact O-N 3.23Å; W1119-A1122 PolarHBondContact O-N 2.82Å; W1119-K1123 WeakPolarHBondContact O-CB 3.5Å; W1119-K1123 PolarHBondContact O-N 3.19Å
1120	K	88.8	Confident	87.3	Confident	46 Å²	46	69.3 Å²	69.3	20%	0.2	37%	0.373	C	S	.	.	H	α-helix	trans	-64.9	-41.3	178.7	-77.1	-159.3	175.3	-157.1	0	112.6	L1048 E1049 D1116 I1117 R1124	L1048-K1120 HydrophobicContact CD2-CD 3.54Å; L1048-K1120 HydrophobicContact CD2-CG 4.43Å; L1048-K1120 HydrophobicContact CG-CD 4.25Å; L1048-K1120 PolarHBondContact O-NZ 2.96Å; E1049-K1120 WeakPolarHBondContact OE1-CE 3.45Å; E1049-K1120 IonicContact OE1-NZ 2.64Å; E1049-K1120 PolarHBondContact OE1-NZ 3.46Å; E1049-K1120 IonicContact OE2-NZ 3.61Å; E1049-K1120 PolarHBondContact OE2-NZ 3.45Å; D1116-K1120 WeakPolarHBondContact O-CB 3.44Å; D1116-K1120 WeakPolarHBondContact O-CG 3.39Å; D1116-K1120 PolarHBondContact O-N 3.04Å; I1117-K1120 PolarHBondContact O-N 3.46Å; K1120-R1124 WeakPolarHBondContact O-CB 3.35Å; K1120-R1124 WeakPolarHBondContact O-CG 3.42Å; K1120-R1124 PolarHBondContact O-N 3.42Å
1121	M	88.5	Confident	86.7	Confident	123 Å²	123	64.7 Å²	64.7	61%	0.606	35%	0.35	S	S	*	.	H	α-helix	trans	-62.1	-48.9	174.6	-72.8	179.9	175.7	0	0	110.8	I1117 A1118 K1123 R1124 V1125	I1117-M1121 HydrophobicContact CG2-CE 3.64Å; I1117-M1121 HydrophobicContact CG2-CG 4.47Å; I1117-M1121 HydrophobicContact CG2-SD 3.98Å; I1117-M1121 WeakPolarHBondContact O-CB 3.44Å; I1117-M1121 WeakPolarHBondContact O-CG 3.32Å; I1117-M1121 PolarHBondContact O-N 3.18Å; A1118-M1121 PolarHBondContact O-N 2.77Å; M1121-K1123 VanDerWaalsContact C-N 3.35Å; M1121-K1123 PolarHBondContact O-N 3.07Å; M1121-R1124 PolarHBondContact O-N 3.33Å; M1121-V1125 WeakPolarHBondContact O-CG2 3.4Å; M1121-V1125 PolarHBondContact O-N 3.24Å
1122	A	89.2	Confident	86	Confident	49 Å²	49	63.5 Å²	63.5	41%	0.405	34%	0.342	S	S	.	.	H	α-helix	trans	-59.2	-44.4	178.3	0	0	0	0	0	112.1	A1118 W1119 V1125 T1126	A1118-A1122 VanDerWaalsContact O-CB 3.31Å; A1118-A1122 WeakPolarHBondContact O-CB 3.46Å; A1118-A1122 PolarHBondContact O-N 3.26Å; W1119-A1122 PolarHBondContact O-N 2.82Å; A1122-V1125 PolarHBondContact O-N 3.38Å; A1122-T1126 WeakPolarHBondContact O-CB 3.37Å; A1122-T1126 WeakPolarHBondContact O-CG2 3.47Å; A1122-T1126 PolarHBondContact O-N 3.48Å; A1122-T1126 PolarHBondContact O-OG1 3.42Å
1123	K	85.7	Confident	85.4	Confident	93 Å²	93	65.7 Å²	65.7	40%	0.404	35%	0.353	S	S	.	.	H	α-helix	trans	-62	-48.4	177	-173	-171.8	175.3	-156.4	0	111.6	W1119 M1121 V1125 T1126 A1127 G1128 E1132	W1119-K1123 WeakPolarHBondContact O-CB 3.5Å; W1119-K1123 PolarHBondContact O-N 3.19Å; M1121-K1123 VanDerWaalsContact C-N 3.35Å; M1121-K1123 PolarHBondContact O-N 3.07Å; K1123-V1125 VanDerWaalsContact C-N 3.25Å; K1123-V1125 PolarHBondContact O-N 3.38Å; K1123-T1126 PolarHBondContact O-N 2.92Å; K1123-A1127 CarbonylContact O-C 3.58Å; K1123-A1127 WeakPolarHBondContact O-CA 3.33Å; K1123-A1127 PolarHBondContact O-N 2.93Å; K1123-G1128 PolarHBondContact O-N 3.36Å; K1123-G1128 VanDerWaalsContact O-N 3.13Å; K1123-E1132 IonicContact NZ-OE1 3.72Å
1124	R	81.2	Confident	84.8	Confident	99 Å²	99	65 Å²	65	37%	0.374	35%	0.349	S	S	.	.	H	α-helix	trans	-60.3	-34.4	-180	-78.7	-177.5	-178.5	-166.4	4.2	112.8	K1120 M1121	K1120-R1124 WeakPolarHBondContact O-CB 3.35Å; K1120-R1124 WeakPolarHBondContact O-CG 3.42Å; K1120-R1124 PolarHBondContact O-N 3.42Å; M1121-R1124 PolarHBondContact O-N 3.33Å
1125	V	82.7	Confident	84.2	Confident	115 Å²	115	61.9 Å²	61.9	70%	0.697	33%	0.329	S	S	*	.	H	α-helix	trans	-81	-43.7	-179.6	174	0	0	0	0	112.2	M1121 A1122 K1123	M1121-V1125 WeakPolarHBondContact O-CG2 3.4Å; M1121-V1125 PolarHBondContact O-N 3.24Å; A1122-V1125 PolarHBondContact O-N 3.38Å; K1123-V1125 VanDerWaalsContact C-N 3.25Å; K1123-V1125 PolarHBondContact O-N 3.38Å
1126	T	81.3	Confident	83.5	Confident	116 Å²	116	61 Å²	61	71%	0.712	33%	0.328	S	S	*	.	H	α-helix	trans	-91	-32.6	-170.5	58.6	0	0	0	0	114	A1122 K1123	A1122-T1126 WeakPolarHBondContact O-CB 3.37Å; A1122-T1126 WeakPolarHBondContact O-CG2 3.47Å; A1122-T1126 PolarHBondContact O-N 3.48Å; A1122-T1126 PolarHBondContact O-OG1 3.42Å; K1123-T1126 PolarHBondContact O-N 2.92Å
1127	A	74.6	Confident	82.9	Confident	66 Å²	66	62 Å²	62	55%	0.545	33%	0.333	S	S	.	.	S	Bend	trans	-147.2	40.2	-171	0	0	0	0	0	111.2	K1123 S1129	K1123-A1127 CarbonylContact O-C 3.58Å; K1123-A1127 WeakPolarHBondContact O-CA 3.33Å; K1123-A1127 PolarHBondContact O-N 2.93Å; A1127-S1129 PolarHBondContact O-N 2.7Å
1128	G	69.2	Low	82.3	Confident	12 Å²	12	61.5 Å²	61.5	12%	0.124	33%	0.329	C	S	.	.			trans	-59.5	127.2	176.6	0	0	0	0	0	110.3	K1123 E1132 Q1133	K1123-G1128 PolarHBondContact O-N 3.36Å; K1123-G1128 VanDerWaalsContact O-N 3.13Å; G1128-E1132 WeakPolarHBondContact CA-OE2 3.23Å; G1128-Q1133 PolarHBondContact O-NE2 3.32Å
1129	S	76.6	Confident	81.6	Confident	44 Å²	44	65.3 Å²	65.3	31%	0.308	34%	0.338	S	S	.	.			trans	-63.9	161.5	175.8	66.7	0	0	0	0	111	A1127 R1131 E1132 Q1133	A1127-S1129 PolarHBondContact O-N 2.7Å; S1129-R1131 PolarHBondContact O-N 3.03Å; S1129-E1132 PolarHBondContact O-N 3.3Å; S1129-E1132 WeakPolarHBondContact OG-CG 3.33Å; S1129-E1132 PolarHBondContact OG-N 3.44Å; S1129-Q1133 WeakPolarHBondContact O-CG 3.16Å; S1129-Q1133 PolarHBondContact O-N 2.82Å
1130	L	78.8	Confident	81.2	Confident	34 Å²	34	63.5 Å²	63.5	18%	0.178	34%	0.338	C	S	.	.	H	α-helix	trans	-53.5	-44.9	177.4	-178.9	64.6	0	0	0	110.6	L976 Q1133 V1134 L1147 I1148	L976-L1130 HydrophobicContact CD2-CD2 4.35Å; L976-L1130 HydrophobicContact CD2-CG 4.14Å; L1130-Q1133 PolarHBondContact O-N 3.5Å; L1130-V1134 WeakPolarHBondContact O-CG2 3.45Å; L1130-V1134 PolarHBondContact O-N 2.74Å; L1130-L1147 HydrophobicContact CD1-CD2 3.44Å; L1130-L1147 VanDerWaalsContact CD1-CD2 3.44Å; L1130-I1148 HydrophobicContact CD1-CG1 4.24Å
1131	R	79.8	Confident	80.7	Confident	19 Å²	19	70.1 Å²	70.1	7%	0.072	37%	0.369	C	S	.	.	H	α-helix	trans	-57.1	-49.2	172.6	177.3	178.3	-89.6	161.1	-3.1	113.1	N903 L976 S1129 Q1133 V1134 M1135	N903-R1131 PolarHBondContact ND2-NH1 3.08Å; N903-R1131 PolarHBondContact ND2-NH2 3.08Å; N903-R1131 VanDerWaalsContact ND2-NH2 3.16Å; N903-R1131 PolarHBondContact OD1-NH1 2.86Å; L976-R1131 HydrophobicContact CD2-CB 4.38Å; S1129-R1131 PolarHBondContact O-N 3.03Å; R1131-Q1133 VanDerWaalsContact C-N 3.27Å; R1131-Q1133 PolarHBondContact O-N 3.29Å; R1131-V1134 PolarHBondContact O-N 3.48Å; R1131-M1135 HydrophobicContact CG-CG 4.46Å; R1131-M1135 HydrophobicContact CG-SD 4.08Å; R1131-M1135 VanDerWaalsContact O-CG 3.22Å; R1131-M1135 WeakPolarHBondContact O-CG 3.27Å; R1131-M1135 PolarHBondContact O-N 2.86Å
1132	E	81.3	Confident	80.2	Confident	40 Å²	40	68.2 Å²	68.2	19%	0.187	36%	0.364	C	S	.	.	H	α-helix	trans	-62.2	-35.8	179.7	-74.6	174.2	-176.1	0	0	111.9	K1123 G1128 S1129 M1135 Q1136	K1123-E1132 IonicContact NZ-OE1 3.72Å; G1128-E1132 WeakPolarHBondContact CA-OE2 3.23Å; S1129-E1132 PolarHBondContact O-N 3.3Å; S1129-E1132 WeakPolarHBondContact OG-CG 3.33Å; S1129-E1132 PolarHBondContact OG-N 3.44Å; E1132-M1135 PolarHBondContact O-N 2.82Å; E1132-Q1136 VanDerWaalsContact O-CG 3.32Å; E1132-Q1136 WeakPolarHBondContact O-CG 3.45Å; E1132-Q1136 PolarHBondContact O-N 3.48Å
1133	Q	80.4	Confident	79.5	Confident	47 Å²	47	70.1 Å²	70.1	22%	0.22	37%	0.368	C	S	.	.	H	α-helix	trans	-67.2	-42.7	175.1	-65.8	173.6	18.2	0	0	111.6	G1128 S1129 L1130 R1131 M1135 Q1136 M1137 L1147	G1128-Q1133 PolarHBondContact O-NE2 3.32Å; S1129-Q1133 WeakPolarHBondContact O-CG 3.16Å; S1129-Q1133 PolarHBondContact O-N 2.82Å; L1130-Q1133 PolarHBondContact O-N 3.5Å; R1131-Q1133 VanDerWaalsContact C-N 3.27Å; R1131-Q1133 PolarHBondContact O-N 3.29Å; Q1133-M1135 VanDerWaalsContact C-N 3.35Å; Q1133-Q1136 PolarHBondContact O-N 3.29Å; Q1133-M1137 HydrophobicContact CB-CE 4.39Å; Q1133-M1137 VanDerWaalsContact O-CE 3.31Å; Q1133-M1137 WeakPolarHBondContact O-CE 3.48Å; Q1133-M1137 PolarHBondContact O-N 3.27Å; Q1133-L1147 HydrophobicContact CB-CD1 4.28Å; Q1133-L1147 HydrophobicContact CB-CD2 4.15Å; Q1133-L1147 VanDerWaalsContact OE1-CD1 3.32Å; Q1133-L1147 VanDerWaalsContact OE1-CD2 3.29Å
1134	V	81.8	Confident	79	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-62	-42.6	174.2	171.9	0	0	0	0	111.5	L976 L1130 R1131 Q1136 M1137 E1138 P1144 I1148	L976-V1134 HydrophobicContact CD1-CG1 4.2Å; L976-V1134 HydrophobicContact CD2-CB 4.35Å; L976-V1134 HydrophobicContact CD2-CG2 3.98Å; L1130-V1134 WeakPolarHBondContact O-CG2 3.45Å; L1130-V1134 PolarHBondContact O-N 2.74Å; R1131-V1134 PolarHBondContact O-N 3.48Å; V1134-Q1136 VanDerWaalsContact C-N 3.34Å; V1134-Q1136 PolarHBondContact O-N 3.35Å; V1134-M1137 HydrophobicContact CG2-CE 4.36Å; V1134-M1137 PolarHBondContact O-N 3.31Å; V1134-E1138 WeakPolarHBondContact O-CB 2.99Å; V1134-E1138 PolarHBondContact O-N 3.11Å; V1134-P1144 HydrophobicContact CB-CB 4.46Å; V1134-P1144 HydrophobicContact CG1-CB 4.2Å; V1134-P1144 HydrophobicContact CG1-CG 4.06Å; V1134-P1144 HydrophobicContact CG2-CB 3.99Å; V1134-I1148 HydrophobicContact CG2-CD1 3.93Å; V1134-I1148 HydrophobicContact CG2-CG1 4.26Å
1135	M	81.8	Confident	78.6	Confident	21 Å²	21	61.3 Å²	61.3	10%	0.103	33%	0.334	C	S	.	.	H	α-helix	trans	-60.4	-42.5	175.9	-69.6	175	62.8	0	0	112.6	S964 T1051 R1131 E1132 Q1133 E1138 Q1139	S964-M1135 WeakPolarHBondContact O-CE 3.41Å; S964-M1135 WeakPolarHBondContact O-CG 3.13Å; T1051-M1135 HydrophobicContact CG2-CE 3.68Å; R1131-M1135 HydrophobicContact CG-CG 4.46Å; R1131-M1135 HydrophobicContact CG-SD 4.08Å; R1131-M1135 VanDerWaalsContact O-CG 3.22Å; R1131-M1135 WeakPolarHBondContact O-CG 3.27Å; R1131-M1135 PolarHBondContact O-N 2.86Å; E1132-M1135 PolarHBondContact O-N 2.82Å; Q1133-M1135 VanDerWaalsContact C-N 3.35Å; M1135-E1138 PolarHBondContact O-N 3.38Å; M1135-Q1139 WeakPolarHBondContact O-CG 3.39Å; M1135-Q1139 PolarHBondContact O-N 3.01Å
1136	Q	80.6	Confident	78.1	Confident	63 Å²	63	66.2 Å²	66.2	29%	0.294	34%	0.339	S	S	.	.	H	α-helix	trans	-64.5	-42.4	177.2	-73.2	173.3	17.4	0	0	111.5	E1132 Q1133 V1134 E1138 Q1139 M1140	E1132-Q1136 VanDerWaalsContact O-CG 3.32Å; E1132-Q1136 WeakPolarHBondContact O-CG 3.45Å; E1132-Q1136 PolarHBondContact O-N 3.48Å; Q1133-Q1136 PolarHBondContact O-N 3.29Å; V1134-Q1136 VanDerWaalsContact C-N 3.34Å; V1134-Q1136 PolarHBondContact O-N 3.35Å; Q1136-E1138 VanDerWaalsContact C-N 3.34Å; Q1136-Q1139 PolarHBondContact O-N 2.71Å; Q1136-M1140 HydrophobicContact CB-CE 4.21Å; Q1136-M1140 WeakPolarHBondContact O-CE 3.4Å; Q1136-M1140 WeakPolarHBondContact O-CG 3.48Å; Q1136-M1140 PolarHBondContact O-N 3.16Å
1137	M	80.3	Confident	77.6	Confident	27 Å²	27	62.4 Å²	62.4	13%	0.133	32%	0.315	C	S	.	.	H	α-helix	trans	-65.3	-38.5	176.1	-73.3	-176.5	-77.4	0	0	112.1	Q1133 V1134 M1140 Q1141 V1142 P1144 L1147	Q1133-M1137 HydrophobicContact CB-CE 4.39Å; Q1133-M1137 VanDerWaalsContact O-CE 3.31Å; Q1133-M1137 WeakPolarHBondContact O-CE 3.48Å; Q1133-M1137 PolarHBondContact O-N 3.27Å; V1134-M1137 HydrophobicContact CG2-CE 4.36Å; V1134-M1137 PolarHBondContact O-N 3.31Å; M1137-M1140 CarbonylContact O-C 3.53Å; M1137-M1140 PolarHBondContact O-N 3.37Å; M1137-Q1141 PolarHBondContact O-N 2.85Å; M1137-V1142 PolarHBondContact O-N 2.88Å; M1137-P1144 HydrophobicContact CB-CB 4.25Å; M1137-P1144 HydrophobicContact CE-CB 3.54Å; M1137-P1144 HydrophobicContact SD-CB 4Å; M1137-L1147 HydrophobicContact CE-CB 3.68Å; M1137-L1147 HydrophobicContact CE-CD1 3.69Å; M1137-L1147 HydrophobicContact CE-CD2 3.87Å; M1137-L1147 HydrophobicContact CE-CG 3.93Å; M1137-L1147 HydrophobicContact SD-CB 4.18Å; M1137-L1147 HydrophobicContact SD-CD1 4.3Å
1138	E	81.7	Confident	77.3	Confident	62 Å²	62	59.5 Å²	59.5	29%	0.29	29%	0.29	S	S	.	.	H	α-helix	trans	-62.5	-42.8	174.5	-175.8	172	-177.3	0	0	111.8	S966 N969 V1134 M1135 Q1136 M1140 Q1141	S966-E1138 WeakPolarHBondContact CB-OE1 3.27Å; S966-E1138 PolarHBondContact N-OE1 2.81Å; S966-E1138 PolarHBondContact N-OE2 3.41Å; S966-E1138 VanDerWaalsContact OG-CD 3.32Å; S966-E1138 PolarHBondContact OG-OE1 3.4Å; S966-E1138 PolarHBondContact OG-OE2 3.44Å; N969-E1138 PolarHBondContact ND2-OE2 3.4Å; V1134-E1138 WeakPolarHBondContact O-CB 2.99Å; V1134-E1138 PolarHBondContact O-N 3.11Å; M1135-E1138 PolarHBondContact O-N 3.38Å; Q1136-E1138 VanDerWaalsContact C-N 3.34Å; E1138-M1140 VanDerWaalsContact C-N 3.28Å; E1138-M1140 PolarHBondContact O-N 2.69Å; E1138-Q1141 PolarHBondContact O-N 3.43Å
1139	Q	79.1	Confident	77.2	Confident	135 Å²	135	67.3 Å²	67.3	63%	0.631	32%	0.315	S	S	*	.	H	α-helix	trans	-64.3	-32.8	173.8	-72.8	177.1	-10.5	0	0	112.7	M1135 Q1136 Q1141	M1135-Q1139 WeakPolarHBondContact O-CG 3.39Å; M1135-Q1139 PolarHBondContact O-N 3.01Å; Q1136-Q1139 PolarHBondContact O-N 2.71Å; Q1139-Q1141 VanDerWaalsContact C-N 3.28Å
1140	M	81.7	Confident	76.4	Confident	123 Å²	123	68 Å²	68	61%	0.606	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-0.1	174	-68.7	-173.9	-79.1	0	0	113.5	Q1136 M1137 E1138 V1142	Q1136-M1140 HydrophobicContact CB-CE 4.21Å; Q1136-M1140 WeakPolarHBondContact O-CE 3.4Å; Q1136-M1140 WeakPolarHBondContact O-CG 3.48Å; Q1136-M1140 PolarHBondContact O-N 3.16Å; M1137-M1140 CarbonylContact O-C 3.53Å; M1137-M1140 PolarHBondContact O-N 3.37Å; E1138-M1140 VanDerWaalsContact C-N 3.28Å; E1138-M1140 PolarHBondContact O-N 2.69Å; M1140-V1142 HydrophobicContact CB-CG2 4.13Å; M1140-V1142 PolarHBondContact O-N 3.49Å
1141	Q	77.9	Confident	75.7	Confident	184 Å²	184	69.6 Å²	69.6	86%	0.86	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	30.9	-174.7	-58.3	-174.8	-30.1	0	0	114.5	M1137 E1138 Q1139	M1137-Q1141 PolarHBondContact O-N 2.85Å; E1138-Q1141 PolarHBondContact O-N 3.43Å; Q1139-Q1141 VanDerWaalsContact C-N 3.28Å
1142	V	78.7	Confident	74.7	Confident	83 Å²	83	73.1 Å²	73.1	50%	0.503	36%	0.357	S	S	.	.			trans	-102.1	134.7	176.9	-180	0	0	0	0	110	M1137 M1140 P1144	M1137-V1142 PolarHBondContact O-N 2.88Å; M1140-V1142 HydrophobicContact CB-CG2 4.13Å; M1140-V1142 PolarHBondContact O-N 3.49Å; V1142-P1144 VanDerWaalsContact O-CD 3.29Å; V1142-P1144 WeakPolarHBondContact O-CD 3.22Å
1143	D	74.2	Confident	72.9	Confident	90 Å²	90	81 Å²	81	48%	0.481	39%	0.385	S	S	.	.			trans	-67.2	118.5	179.3	-167.8	9.8	0	0	0	110.9	K972 Y973 G1145	K972-D1143 VanDerWaalsContact NZ-CG 3.26Å; K972-D1143 IonicContact NZ-OD1 3.35Å; K972-D1143 PolarHBondContact NZ-OD1 3.49Å; K972-D1143 IonicContact NZ-OD2 2.63Å; K972-D1143 PolarHBondContact NZ-OD2 3.43Å; Y973-D1143 PolarHBondContact OH-OD1 3.09Å; D1143-G1145 PolarHBondContact O-N 3.41Å; D1143-G1145 VanDerWaalsContact O-N 3.09Å
1144	P	74.9	Confident	71	Confident	3 Å²	3	84.4 Å²	84.4	2%	0.019	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-1.2	-173.4	29.2	-37.8	0	0	0	114.6	Y973 V1134 M1137 V1142 R1146 L1147 I1148	Y973-P1144 HydrophobicContact CD2-CG 4.06Å; Y973-P1144 HydrophobicContact CE2-CG 3.44Å; Y973-P1144 VanDerWaalsContact CE2-CG 3.44Å; V1134-P1144 HydrophobicContact CB-CB 4.46Å; V1134-P1144 HydrophobicContact CG1-CB 4.2Å; V1134-P1144 HydrophobicContact CG1-CG 4.06Å; V1134-P1144 HydrophobicContact CG2-CB 3.99Å; M1137-P1144 HydrophobicContact CB-CB 4.25Å; M1137-P1144 HydrophobicContact CE-CB 3.54Å; M1137-P1144 HydrophobicContact SD-CB 4Å; V1142-P1144 VanDerWaalsContact O-CD 3.29Å; V1142-P1144 WeakPolarHBondContact O-CD 3.22Å; P1144-R1146 VanDerWaalsContact C-N 3.26Å; P1144-R1146 PolarHBondContact O-N 3.24Å; P1144-R1146 VanDerWaalsContact O-N 3.11Å; P1144-L1147 PolarHBondContact O-N 3.12Å; P1144-I1148 HydrophobicContact CB-CD1 4.32Å; P1144-I1148 PolarHBondContact O-N 3.48Å
1145	G	74.1	Confident	68.8	Low	4 Å²	4	94.9 Å²	94.9	4%	0.041	46%	0.457	C	S	.	.	H	α-helix	trans	-64.2	-19.9	-169.7	0	0	0	0	0	116.2	Y973 D1143 R1149	Y973-G1145 WeakPolarHBondContact OH-CA 3.09Å; Y973-G1145 PolarHBondContact OH-N 2.78Å; D1143-G1145 PolarHBondContact O-N 3.41Å; D1143-G1145 VanDerWaalsContact O-N 3.09Å; G1145-R1149 PolarHBondContact O-N 2.97Å; G1145-R1149 PolarHBondContact O-NE 3.21Å; G1145-R1149 VanDerWaalsContact O-NE 3.13Å
1146	R	72	Confident	66.6	Low	217 Å²	217	98.5 Å²	98.5	82%	0.819	48%	0.484	S	S	*	.	H	α-helix	trans	-72.7	-39.4	172.8	-72.7	-174.1	-178.4	-178.6	1.6	111.9	P1144 A1150	P1144-R1146 VanDerWaalsContact C-N 3.26Å; P1144-R1146 PolarHBondContact O-N 3.24Å; P1144-R1146 VanDerWaalsContact O-N 3.11Å; R1146-A1150 PolarHBondContact O-N 3.48Å; R1146-A1150 VanDerWaalsContact O-N 3.14Å
1147	L	70.6	Confident	64.3	Low	37 Å²	37	102.1 Å²	102.1	19%	0.194	51%	0.511	C	S	.	.	H	α-helix	trans	-70.4	-41.7	-177.1	-173.9	132.3	0	0	0	111.2	L1130 Q1133 M1137 P1144 A1150 S1151	L1130-L1147 HydrophobicContact CD1-CD2 3.44Å; L1130-L1147 VanDerWaalsContact CD1-CD2 3.44Å; Q1133-L1147 HydrophobicContact CB-CD1 4.28Å; Q1133-L1147 HydrophobicContact CB-CD2 4.15Å; Q1133-L1147 VanDerWaalsContact OE1-CD1 3.32Å; Q1133-L1147 VanDerWaalsContact OE1-CD2 3.29Å; M1137-L1147 HydrophobicContact CE-CB 3.68Å; M1137-L1147 HydrophobicContact CE-CD1 3.69Å; M1137-L1147 HydrophobicContact CE-CD2 3.87Å; M1137-L1147 HydrophobicContact CE-CG 3.93Å; M1137-L1147 HydrophobicContact SD-CB 4.18Å; M1137-L1147 HydrophobicContact SD-CD1 4.3Å; P1144-L1147 PolarHBondContact O-N 3.12Å; L1147-A1150 WeakPolarHBondContact O-CB 3.5Å; L1147-A1150 PolarHBondContact O-N 3.16Å; L1147-A1150 VanDerWaalsContact O-N 3.12Å; L1147-S1151 PolarHBondContact O-N 3.47Å
1148	I	68.1	Low	62.2	Low	4 Å²	4	105.3 Å²	105.3	2%	0.021	53%	0.529	C	S	.	.	H	α-helix	trans	-68	-39.9	179.7	-63.6	165.1	0	0	0	110.8	Y973 E975 L1130 V1134 P1144 A1150 S1151 I1152	Y973-I1148 HydrophobicContact CD1-CB 4.35Å; Y973-I1148 HydrophobicContact CD1-CD1 3.24Å; Y973-I1148 HydrophobicContact CD1-CG1 4.38Å; Y973-I1148 HydrophobicContact CD1-CG2 4.23Å; Y973-I1148 HydrophobicContact CD2-CD1 3.74Å; Y973-I1148 HydrophobicContact CE1-CD1 3.75Å; Y973-I1148 HydrophobicContact CE2-CD1 4.22Å; Y973-I1148 HydrophobicContact CG-CD1 3.22Å; E975-I1148 HydrophobicContact CG-CG2 4.39Å; L1130-I1148 HydrophobicContact CD1-CG1 4.24Å; V1134-I1148 HydrophobicContact CG2-CD1 3.93Å; V1134-I1148 HydrophobicContact CG2-CG1 4.26Å; P1144-I1148 HydrophobicContact CB-CD1 4.32Å; P1144-I1148 PolarHBondContact O-N 3.48Å; I1148-A1150 PolarHBondContact O-N 3.26Å; I1148-S1151 WeakPolarHBondContact CA-OG 3.41Å; I1148-S1151 PolarHBondContact O-N 2.99Å; I1148-S1151 VanDerWaalsContact O-N 3.14Å; I1148-S1151 PolarHBondContact O-OG 2.71Å; I1148-I1152 HydrophobicContact CG2-CD1 4Å; I1148-I1152 WeakPolarHBondContact O-CD1 3.49Å; I1148-I1152 VanDerWaalsContact O-CG1 3.3Å; I1148-I1152 WeakPolarHBondContact O-CG1 3.45Å; I1148-I1152 PolarHBondContact O-N 2.89Å; I1148-I1152 VanDerWaalsContact O-N 3.13Å
1149	R	67.2	Low	60.1	Low	176 Å²	176	114.1 Å²	114.1	66%	0.664	56%	0.559	S	S	*	*	H	α-helix	trans	-61.3	-33.7	171.4	-85.8	-176.7	-87.5	-176.7	-13.3	112.8	G1145	G1145-R1149 PolarHBondContact O-N 2.97Å; G1145-R1149 PolarHBondContact O-NE 3.21Å; G1145-R1149 VanDerWaalsContact O-NE 3.13Å
1150	A	60.2	Low	58.4	Low	60 Å²	60	110.5 Å²	110.5	50%	0.496	55%	0.548	S	S	.	.	H	α-helix	trans	-71.6	-34.7	174.8	0	0	0	0	0	112.3	R1146 L1147 I1148	R1146-A1150 PolarHBondContact O-N 3.48Å; R1146-A1150 VanDerWaalsContact O-N 3.14Å; L1147-A1150 WeakPolarHBondContact O-CB 3.5Å; L1147-A1150 PolarHBondContact O-N 3.16Å; L1147-A1150 VanDerWaalsContact O-N 3.12Å; I1148-A1150 PolarHBondContact O-N 3.26Å
1151	S	63.1	Low	56.6	Low	66 Å²	66	106.4 Å²	106.4	46%	0.462	53%	0.534	S	S	.	.	H	α-helix	trans	-73.1	-24.7	178	61.2	0	0	0	0	114.1	L1147 I1148	L1147-S1151 PolarHBondContact O-N 3.47Å; I1148-S1151 WeakPolarHBondContact CA-OG 3.41Å; I1148-S1151 PolarHBondContact O-N 2.99Å; I1148-S1151 VanDerWaalsContact O-N 3.14Å; I1148-S1151 PolarHBondContact O-OG 2.71Å
1152	I	58.9	Low	55	Low	94 Å²	94	102.6 Å²	102.6	48%	0.482	52%	0.515	S	S	.	.	H	α-helix	trans	-77.1	-24.3	179.8	-66.4	163.3	0	0	0	112.2	E975 I1148	E975-I1152 HydrophobicContact CG-CD1 4.1Å; E975-I1152 HydrophobicContact CG-CG1 4.42Å; I1148-I1152 HydrophobicContact CG2-CD1 4Å; I1148-I1152 WeakPolarHBondContact O-CD1 3.49Å; I1148-I1152 VanDerWaalsContact O-CG1 3.3Å; I1148-I1152 WeakPolarHBondContact O-CG1 3.45Å; I1148-I1152 PolarHBondContact O-N 2.89Å; I1148-I1152 VanDerWaalsContact O-N 3.13Å
1153	R	43.2	Very low	53.6	Low	205 Å²	205	102.8 Å²	102.8	77%	0.774	52%	0.516	S	S	*	.	S	Bend	trans	-66.1	129.1	-178.9	-74.6	-172.4	178.1	-171.5	-1.7	110.7	K1155	R1153-K1155 PolarHBondContact O-N 2.82Å
1154	P	40.9	Very low	52.3	Low	118 Å²	118	105.9 Å²	105.9	77%	0.766	52%	0.521	S	S	*	.			trans	-58.7	134.3	180	21.5	-30.4	0	0	0	110.1	S1156	P1154-S1156 VanDerWaalsContact C-N 3.28Å; P1154-S1156 PolarHBondContact O-N 3.26Å
1155	K	35.4	Very low	51.3	Low	221 Å²	221	111.7 Å²	111.7	96%	0.961	55%	0.551	S	S	*	*			trans	-61	82.4	-179.4	-70.9	172.3	179.4	166.4	0	110.8	R1153	R1153-K1155 PolarHBondContact O-N 2.82Å
1156	S	35.3	Very low	50	Low	96 Å²	96	116.4 Å²	116.4	67%	0.671	57%	0.573	S	S	*	*			trans	-110.3	112	156.3	58.7	0	0	0	0	108.5	P1154 D1158	P1154-S1156 VanDerWaalsContact C-N 3.28Å; P1154-S1156 PolarHBondContact O-N 3.26Å; S1156-D1158 PolarHBondContact O-N 3.35Å
1157	T	32.8	Very low	48.9	Very low	139 Å²	139	116.2 Å²	116.2	85%	0.853	57%	0.572	S	S	*	*	S	Bend	trans	60.5	48.3	145.4	-20.2	0	0	0	0	119.1
1158	D	35.2	Very low	47.9	Very low	95 Å²	95	125 Å²	125	51%	0.508	60%	0.603	S	S	.	*			trans	-168.3	86.7	144.3	-124.9	-16.2	0	0	0	114.2	S1156 S1160 A1161	S1156-D1158 PolarHBondContact O-N 3.35Å; D1158-S1160 PolarHBondContact O-N 2.9Å; D1158-S1160 VanDerWaalsContact OD1-CB 3.27Å; D1158-S1160 WeakPolarHBondContact OD1-CB 3.5Å; D1158-S1160 PolarHBondContact OD1-OG 3.42Å; D1158-A1161 HydrophobicContact CB-CB 4.07Å; D1158-A1161 PolarHBondContact O-N 2.99Å
1159	R	38.9	Very low	47	Very low	247 Å²	247	129.7 Å²	129.7	93%	0.932	64%	0.636	S	S	*	*	H	α-helix	trans	-61.1	-17.5	164.2	-100.4	178.7	163.2	166.3	-5.1	111.9
1160	S	43.5	Very low	45.9	Very low	58 Å²	58	129.5 Å²	129.5	41%	0.406	65%	0.645	S	S	.	*	H	α-helix	trans	-71.7	-33.4	179.3	-21.9	0	0	0	0	114.1	D1158 R1164	D1158-S1160 PolarHBondContact O-N 2.9Å; D1158-S1160 VanDerWaalsContact OD1-CB 3.27Å; D1158-S1160 WeakPolarHBondContact OD1-CB 3.5Å; D1158-S1160 PolarHBondContact OD1-OG 3.42Å; S1160-R1164 WeakPolarHBondContact O-CB 3.33Å; S1160-R1164 PolarHBondContact O-N 3.08Å
1161	A	43.9	Very low	44.6	Very low	37 Å²	37	129.3 Å²	129.3	31%	0.306	65%	0.649	S	S	.	*	H	α-helix	trans	-71	-38.3	-169.3	0	0	0	0	0	112.3	D1158 R1164 I1165	D1158-A1161 HydrophobicContact CB-CB 4.07Å; D1158-A1161 PolarHBondContact O-N 2.99Å; A1161-R1164 PolarHBondContact O-N 3.14Å; A1161-I1165 WeakPolarHBondContact O-CG1 3.44Å; A1161-I1165 PolarHBondContact O-N 2.92Å
1162	F	43.8	Very low	43.3	Very low	105 Å²	105	131.8 Å²	131.8	46%	0.461	67%	0.666	S	S	.	*	H	α-helix	trans	-63.6	-43.6	179.2	-174	-100.8	0	0	0	112.2	R1164 I1165 M1166	F1162-R1164 VanDerWaalsContact C-N 3.32Å; F1162-R1164 PolarHBondContact O-N 3.37Å; F1162-I1165 PolarHBondContact O-N 3.24Å; F1162-M1166 PolarHBondContact O-N 3.06Å
1163	V	49.7	Very low	42.2	Very low	87 Å²	87	136.4 Å²	136.4	53%	0.527	69%	0.686	S	S	.	*	H	α-helix	trans	-66.4	-34.6	176	179.4	0	0	0	0	111.4	R1167	V1163-R1167 PolarHBondContact O-N 2.73Å; V1163-R1167 VanDerWaalsContact O-N 3.08Å
1164	R	47	Very low	41.7	Very low	155 Å²	155	131.6 Å²	131.6	59%	0.585	69%	0.69	S	S	*	*	H	α-helix	trans	-71.3	-33.5	-179.9	-152.5	-178.8	-64.8	152.7	1.1	112.8	S1160 A1161 F1162 R1168	S1160-R1164 WeakPolarHBondContact O-CB 3.33Å; S1160-R1164 PolarHBondContact O-N 3.08Å; A1161-R1164 PolarHBondContact O-N 3.14Å; F1162-R1164 VanDerWaalsContact C-N 3.32Å; F1162-R1164 PolarHBondContact O-N 3.37Å; R1164-R1168 PolarHBondContact O-N 3.14Å
1165	I	52.9	Low	41.3	Very low	124 Å²	124	134.4 Å²	134.4	64%	0.636	70%	0.697	S	S	*	*	H	α-helix	trans	-71.5	-42.4	175.7	-67.2	167.8	0	0	0	110.7	A1161 F1162 R1167 R1168 S1169	A1161-I1165 WeakPolarHBondContact O-CG1 3.44Å; A1161-I1165 PolarHBondContact O-N 2.92Å; F1162-I1165 PolarHBondContact O-N 3.24Å; I1165-R1167 PolarHBondContact O-N 3.17Å; I1165-R1168 PolarHBondContact O-N 3.18Å; I1165-S1169 PolarHBondContact O-N 3.49Å
1166	M	47.5	Very low	41.3	Very low	104 Å²	104	131.6 Å²	131.6	51%	0.512	69%	0.692	S	S	.	*	H	α-helix	trans	-63.5	-40.3	175.7	-90.8	-108.7	-100.7	0	0	112.9	F1162 R1168 S1169	F1162-M1166 PolarHBondContact O-N 3.06Å; M1166-R1168 PolarHBondContact O-N 2.96Å; M1166-S1169 PolarHBondContact O-N 3.43Å
1167	R	49.2	Very low	41.3	Very low	213 Å²	213	134 Å²	134	80%	0.804	70%	0.698	S	S	*	*	H	α-helix	trans	-64.8	-25.2	177	-111.2	-178.4	-175.2	165	2.2	113.9	V1163 I1165	V1163-R1167 PolarHBondContact O-N 2.73Å; V1163-R1167 VanDerWaalsContact O-N 3.08Å; I1165-R1167 PolarHBondContact O-N 3.17Å
1168	R	49	Very low	41.3	Very low	220 Å²	220	135.4 Å²	135.4	83%	0.83	70%	0.699	S	S	*	*	H	α-helix	trans	-84	-17.7	176.4	-85.9	-177.5	166.2	175.8	-4.3	113.7	R1164 I1165 M1166	R1164-R1168 PolarHBondContact O-N 3.14Å; I1165-R1168 PolarHBondContact O-N 3.18Å; M1166-R1168 PolarHBondContact O-N 2.96Å
1169	S	48.7	Very low	41.3	Very low	103 Å²	103	137.2 Å²	137.2	72%	0.72	72%	0.718	S	S	*	*	H	α-helix	trans	-90	-10.4	-177.7	-173	0	0	0	0	114.4	I1165 M1166	I1165-S1169 PolarHBondContact O-N 3.49Å; M1166-S1169 PolarHBondContact O-N 3.43Å
1170	M	44.3	Very low	41.3	Very low	172 Å²	172	133.2 Å²	133.2	85%	0.847	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	8.9	177.7	-78.7	-170.4	175.8	0	0	113.9
1171	G	33.3	Very low	40.7	Very low	57 Å²	57	134.2 Å²	134.2	59%	0.588	73%	0.734	S	S	*	*			trans	-88.6	109.9	169.8	0	0	0	0	0	110.8
1172	S	34.9	Very low	40.1	Very low	118 Å²	118	136.9 Å²	136.9	83%	0.825	76%	0.756	S	S	*	*	S	Bend	trans	-52.1	142	165.6	-169.4	0	0	0	0	110.5
1173	Q	35.9	Very low	39.5	Very low	191 Å²	191	137.5 Å²	137.5	89%	0.893	77%	0.773	S	S	*	*			trans	89.1	69	179.8	-51.5	-174.4	-6.5	0	0	117.8
1174	A	32.9	Very low	38.7	Very low	103 Å²	103	139.1 Å²	139.1	85%	0.851	78%	0.783	S	S	*	*			trans	-164.8	62.4	153.4	0	0	0	0	0	112.8
1175	L	32.5	Very low	37.8	Very low	178 Å²	178	142.7 Å²	142.7	93%	0.932	80%	0.796	S	S	*	*	S	Bend	trans	-103.1	26.8	176.4	-143.4	144.9	0	0	0	112.9
1176	L	36.6	Very low	36.8	Very low	161 Å²	161	142.7 Å²	142.7	84%	0.843	80%	0.802	S	S	*	*	S	Bend	trans	-131.6	-5.1	-173.6	-139	90.6	0	0	0	118
1177	N	34.7	Very low	36	Very low	148 Å²	148	145 Å²	145	79%	0.791	82%	0.816	S	S	*	*	S	Bend	trans	-124.9	18.3	-161.9	-93.8	-0.8	0	0	0	119.4
1178	L	33.1	Very low	34.9	Very low	167 Å²	167	141.8 Å²	141.8	87%	0.874	82%	0.821	S	S	*	*			trans	-138.7	58.1	176.8	-109.7	112.6	0	0	0	115.1
1179	C	35.4	Very low	34.1	Very low	134 Å²	134	135.9 Å²	135.9	91%	0.905	82%	0.819	S	S	*	*			trans	-101.2	24.1	158.9	-87.8	0	0	0	0	113
1180	L	38.2	Very low	33.1	Very low	162 Å²	162	136.5 Å²	136.5	85%	0.848	82%	0.823	S	S	*	*	S	Bend	trans	-132.7	132.8	178.3	-73.7	166.5	0	0	0	111
1181	G	30.6	Very low	32.6	Very low	80 Å²	80	134 Å²	134	83%	0.825	82%	0.82	S	S	*	*			trans	-73.2	172.3	-161.1	0	0	0	0	0	116.7
1182	A	32.5	Very low	32.4	Very low	93 Å²	93	137.1 Å²	137.1	77%	0.769	83%	0.828	S	S	*	*			trans	-153.6	109.4	152.2	0	0	0	0	0	108.5
1183	S	29.8	Very low	32.2	Very low	117 Å²	117	137.1 Å²	137.1	82%	0.818	83%	0.825	S	S	*	*			trans	-56.9	132	159.8	170	0	0	0	0	109.6
1184	V	33.5	Very low	31.9	Very low	122 Å²	122	135.4 Å²	135.4	74%	0.739	82%	0.82	S	S	*	*			trans	-129.2	106.1	164.2	177.7	0	0	0	0	108.2	T1186	V1184-T1186 HydrophobicContact CG1-CG2 4.19Å
1185	R	28.2	Very low	31.7	Very low	229 Å²	229	136.7 Å²	136.7	86%	0.864	82%	0.818	S	S	*	*			trans	-62.8	133.3	157.5	-83.9	172.5	161.4	169.4	-6.2	109.1
1186	T	32.6	Very low	31.6	Very low	124 Å²	124	134 Å²	134	76%	0.761	80%	0.804	S	S	*	*			trans	-136.6	105.3	154.5	48.6	0	0	0	0	110	V1184	V1184-T1186 HydrophobicContact CG1-CG2 4.19Å
1187	N	29.9	Very low	31.1	Very low	152 Å²	152	131.9 Å²	131.9	81%	0.813	80%	0.803	S	S	*	*			trans	27.3	109.2	146.6	-65.3	-6.3	0	0	0	119.1	A1189	N1187-A1189 PolarHBondContact O-N 2.94Å
1188	T	27	Very low	30.9	Very low	147 Å²	147	134.6 Å²	134.6	90%	0.902	80%	0.802	S	S	*	*			trans	-44	118.9	143.6	45	0	0	0	0	112.1
1189	A	31.7	Very low	30.6	Very low	95 Å²	95	136 Å²	136	79%	0.785	80%	0.804	S	S	*	*			trans	-131.9	108.1	155.2	0	0	0	0	0	106.8	N1187 P1191	N1187-A1189 PolarHBondContact O-N 2.94Å; A1189-P1191 WeakPolarHBondContact O-CD 3.34Å
1190	S	27.7	Very low	30.4	Very low	117 Å²	117	134.6 Å²	134.6	82%	0.818	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-67.6	128.9	175	45.2	0	0	0	0	111.1
1191	P	32.9	Very low	30	Very low	120 Å²	120	133.9 Å²	133.9	78%	0.779	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-95.2	121.5	151.7	14.7	4.6	0	0	0	108.4	A1189	A1189-P1191 WeakPolarHBondContact O-CD 3.34Å
1192	T	29.1	Very low	30.2	Very low	121 Å²	121	132.5 Å²	132.5	74%	0.742	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-46.1	132.8	168.6	39.6	0	0	0	0	112.2	I1194	T1192-I1194 PolarHBondContact O-N 3.03Å
1193	P	31.9	Very low	30.2	Very low	118 Å²	118	129 Å²	129	77%	0.766	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-73.4	119.7	168.5	29.5	-28.4	0	0	0	108.5	T1195	P1193-T1195 PolarHBondContact O-N 2.75Å
1194	I	29.7	Very low	30.5	Very low	156 Å²	156	124.5 Å²	124.5	80%	0.8	70%	0.699	S	S	*	*			trans	-70.2	109.1	163.8	-65.9	171.1	0	0	0	105.9	T1192 D1196	T1192-I1194 PolarHBondContact O-N 3.03Å; I1194-D1196 PolarHBondContact O-N 3.28Å
1195	T	27.8	Very low	30.5	Very low	130 Å²	130	120.3 Å²	120.3	80%	0.798	68%	0.677	S	S	*	*			trans	-66.8	104.6	167.2	27.2	0	0	0	0	108.6	P1193	P1193-T1195 PolarHBondContact O-N 2.75Å
1196	D	29.9	Very low	30.8	Very low	121 Å²	121	110.9 Å²	110.9	65%	0.647	64%	0.642	S	S	*	*			trans	-112.7	94.4	161.4	-141.7	5.9	0	0	0	107.8	I1194 R1198	I1194-D1196 PolarHBondContact O-N 3.28Å; D1196-R1198 PolarHBondContact O-N 3.33Å; D1196-R1198 VanDerWaalsContact O-N 3.16Å
1197	S	26.6	Very low	31	Very low	116 Å²	116	109.9 Å²	109.9	81%	0.811	64%	0.64	S	S	*	*			trans	-73.2	95.6	173.8	51.7	0	0	0	0	108.8
1198	R	30.6	Very low	31.7	Very low	205 Å²	205	103.9 Å²	103.9	77%	0.774	61%	0.607	S	S	*	*			trans	-109.6	116.1	163.4	-77.3	-175.4	177.2	168.9	0.8	109.1	D1196 T1200	D1196-R1198 PolarHBondContact O-N 3.33Å; D1196-R1198 VanDerWaalsContact O-N 3.16Å; R1198-T1200 PolarHBondContact O-N 3.02Å; R1198-T1200 VanDerWaalsContact O-N 3.12Å
1199	Q	26.7	Very low	32.7	Very low	197 Å²	197	101.9 Å²	101.9	92%	0.921	59%	0.588	S	S	*	*			trans	-46.1	111.3	172.8	-72.9	165.7	-42.2	0	0	109.9
1200	T	30.9	Very low	33.2	Very low	105 Å²	105	102 Å²	102	64%	0.644	57%	0.572	S	S	*	*			trans	-92.7	107.3	168.7	49.7	0	0	0	0	107.8	R1198 H1202	R1198-T1200 PolarHBondContact O-N 3.02Å; R1198-T1200 VanDerWaalsContact O-N 3.12Å; T1200-H1202 PolarHBondContact O-N 3.22Å
1201	D	31.4	Very low	34.2	Very low	146 Å²	146	103.9 Å²	103.9	78%	0.781	57%	0.567	S	S	*	*			trans	-56.6	120.4	170.2	-79.7	-29.6	0	0	0	109.8	E739 G1203	E739-D1201 VanDerWaalsContact OE1-O 3.14Å; D1201-G1203 PolarHBondContact O-N 3.26Å
1202	H	33.3	Very low	35.1	Very low	51 Å²	51	100 Å²	100	24%	0.236	55%	0.549	C	S	.	.			trans	-73.1	115.8	179.5	-61.5	-63.3	0	0	0	111.5	T625 T1200	T625-H1202 HydrophobicContact CG2-CB 4.41Å; T1200-H1202 PolarHBondContact O-N 3.22Å
1203	G	32.4	Very low	36.3	Very low	19 Å²	19	96.4 Å²	96.4	20%	0.196	53%	0.532	C	S	.	.			trans	-113	99.5	-168.4	0	0	0	0	0	116.1	K737 E739 D1201	K737-G1203 VanDerWaalsContact CD-O 3.24Å; K737-G1203 WeakPolarHBondContact CD-O 3.15Å; K737-G1203 PolarHBondContact NZ-O 3.02Å; E739-G1203 PolarHBondContact OE1-N 3.28Å; E739-G1203 PolarHBondContact OE2-N 2.97Å; D1201-G1203 PolarHBondContact O-N 3.26Å
1204	Y	37.2	Very low	37.5	Very low	24 Å²	24	91.4 Å²	91.4	9%	0.094	50%	0.499	C	S	.	.			trans	-75.6	130.3	178.6	-73	-111.2	0	0	0	115	A623 D624 T655 L656 K737	A623-Y1204 HydrophobicContact CB-CD1 3.62Å; A623-Y1204 HydrophobicContact CB-CD2 3.33Å; A623-Y1204 HydrophobicContact CB-CE1 3.96Å; A623-Y1204 HydrophobicContact CB-CE2 3.78Å; A623-Y1204 HydrophobicContact CB-CG 3.29Å; D624-Y1204 HydrophobicContact CB-CE2 4.34Å; D624-Y1204 WeakPolarHBondContact CB-OH 3.47Å; D624-Y1204 PolarHBondContact N-OH 2.88Å; D624-Y1204 WeakPolarHBondContact OD1-CE2 3.38Å; D624-Y1204 WeakPolarHBondContact OD2-CE2 3.21Å; D624-Y1204 PolarHBondContact OD2-OH 2.87Å; T655-Y1204 WeakPolarHBondContact O-CE1 3.47Å; T655-Y1204 PolarHBondContact OG1-OH 3.12Å; T655-Y1204 VanDerWaalsContact OG1-OH 3.07Å; L656-Y1204 HydrophobicContact CD2-CD1 4.15Å; L656-Y1204 HydrophobicContact CD2-CE1 4.06Å; K737-Y1204 WeakPolarHBondContact CE-O 3.44Å; K737-Y1204 PolarHBondContact NZ-O 3.32Å
1205	A	32.4	Very low	39	Very low	34 Å²	34	86 Å²	86	28%	0.281	48%	0.475	S	S	.	.			trans	-116	94.1	176.2	0	0	0	0	0	111.8	R654 K737	R654-A1205 PolarHBondContact NH1-O 3.03Å; R654-A1205 PolarHBondContact NH2-O 3.21Å; K737-A1205 HydrophobicContact CD-CB 3.96Å; K737-A1205 HydrophobicContact CG-CB 4.14Å
1206	F	35.7	Very low	40.7	Very low	31 Å²	31	81.4 Å²	81.4	14%	0.136	44%	0.444	C	S	.	.			trans	-88.3	126.9	164.2	-87.1	-89.9	0	0	0	109	D556 F598 L656	D556-F1206 WeakPolarHBondContact OD2-CE1 3.22Å; F598-F1206 HydrophobicContact CD1-CB 4.22Å; F598-F1206 HydrophobicContact CD1-CG 4.45Å; F598-F1206 HydrophobicContact CD2-CD1 4.29Å; F598-F1206 HydrophobicContact CD2-CD2 4.08Å; F598-F1206 HydrophobicContact CD2-CE1 4.49Å; F598-F1206 HydrophobicContact CD2-CE2 4.27Å; F598-F1206 HydrophobicContact CD2-CG 4.08Å; F598-F1206 HydrophobicContact CD2-CZ 4.48Å; F598-F1206 HydrophobicContact CE1-CB 3.35Å; F598-F1206 HydrophobicContact CE1-CD1 4.47Å; F598-F1206 HydrophobicContact CE1-CD2 4.45Å; F598-F1206 AromaticContact CE1-CG 3.89Å; F598-F1206 HydrophobicContact CE1-CG 3.89Å; F598-F1206 HydrophobicContact CE2-CB 3.76Å; F598-F1206 HydrophobicContact CE2-CD1 4.07Å; F598-F1206 AromaticContact CE2-CD2 3.21Å; F598-F1206 HydrophobicContact CE2-CD2 3.21Å; F598-F1206 HydrophobicContact CE2-CE1 4.49Å; F598-F1206 AromaticContact CE2-CE2 3.71Å; F598-F1206 HydrophobicContact CE2-CE2 3.71Å; F598-F1206 AromaticContact CE2-CG 3.42Å; F598-F1206 HydrophobicContact CE2-CG 3.42Å; F598-F1206 VanDerWaalsContact CE2-CG 3.42Å; F598-F1206 HydrophobicContact CE2-CZ 4.33Å; F598-F1206 HydrophobicContact CZ-CB 3.13Å; F598-F1206 HydrophobicContact CZ-CD1 4.25Å; F598-F1206 AromaticContact CZ-CD2 3.51Å; F598-F1206 HydrophobicContact CZ-CD2 3.51Å; F598-F1206 HydrophobicContact CZ-CE2 4.43Å; F598-F1206 AromaticContact CZ-CG 3.38Å; F598-F1206 HydrophobicContact CZ-CG 3.38Å; L656-F1206 HydrophobicContact CD1-CZ 4.17Å; L656-F1206 HydrophobicContact CD2-CE2 3.57Å; L656-F1206 HydrophobicContact CD2-CZ 3.54Å; L656-F1206 HydrophobicContact CG-CZ 4.5Å
1207	S	36.2	Very low	42.3	Very low	102 Å²	102	77.2 Å²	77.2	71%	0.713	43%	0.425	S	S	*	.			trans	-100.2	91.6	168.9	164.8	0	0	0	0	107.2
1208	Q	45.2	Very low	44.2	Very low	27 Å²	27	76.4 Å²	76.4	13%	0.126	41%	0.408	C	S	.	.			trans	-128.6	135.1	168.1	-70.4	-174.4	-5.2	0	0	106.9	S554 F598 E1210	S554-Q1208 PolarHBondContact OG-NE2 2.91Å; F598-Q1208 HydrophobicContact CD1-CB 4.35Å; Q1208-E1210 PolarHBondContact O-N 3.5Å
1209	E	46.6	Very low	45.8	Very low	105 Å²	105	67.5 Å²	67.5	49%	0.491	38%	0.376	S	S	.	.			trans	-62.5	109.7	174.7	-75.9	-177.3	168.9	0	0	109	K190 H1211	K190-E1209 VanDerWaalsContact CE-OE1 3.27Å; K190-E1209 WeakPolarHBondContact CE-OE1 3.14Å; K190-E1209 IonicContact NZ-OE1 2.67Å; E1209-H1211 PolarHBondContact O-N 2.67Å; E1209-H1211 VanDerWaalsContact O-N 3.17Å
1210	E	43.9	Very low	47.7	Very low	97 Å²	97	58.4 Å²	58.4	45%	0.453	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-7.9	-176.5	-56.5	-164.6	105.5	0	0	113.6	S600 Q1208	S600-E1210 WeakPolarHBondContact CA-OE1 3.23Å; S600-E1210 WeakPolarHBondContact CB-OE1 3.34Å; S600-E1210 PolarHBondContact N-OE1 3.18Å; S600-E1210 PolarHBondContact OG-OE1 3.42Å; S600-E1210 PolarHBondContact OG-OE2 2.96Å; Q1208-E1210 PolarHBondContact O-N 3.5Å
1211	H	48.3	Very low	49.5	Very low	157 Å²	157	60.1 Å²	60.1	73%	0.727	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.2	31.5	-170	-58.7	-43.6	0	0	0	113.9	E1209	E1209-H1211 PolarHBondContact O-N 2.67Å; E1209-H1211 VanDerWaalsContact O-N 3.17Å
1212	G	51.3	Low	51.1	Low	39 Å²	39	54.2 Å²	54.2	40%	0.402	30%	0.299	S	S	.	.			trans	-55.7	143.8	174	0	0	0	0	0	112.5	V1214	G1212-V1214 PolarHBondContact O-N 2.95Å
1213	A	53.6	Low	52.7	Low	45 Å²	45	52.4 Å²	52.4	37%	0.372	29%	0.291	S	S	.	.	S	Bend	trans	-55.7	-25.6	-179.8	0	0	0	0	0	113.6	T243	T243-A1213 HydrophobicContact CG2-CB 3.67Å
1214	V	56.7	Low	54.4	Low	13 Å²	13	53.3 Å²	53.3	8%	0.079	29%	0.291	C	S	.	.	S	Bend	trans	-124.9	125	177.1	-174	0	0	0	0	107.4	M175 L191 G1212 Q1218	M175-V1214 HydrophobicContact SD-CG2 4.25Å; L191-V1214 HydrophobicContact CD2-CB 3.52Å; L191-V1214 HydrophobicContact CD2-CG1 4.4Å; L191-V1214 HydrophobicContact CD2-CG2 3.68Å; G1212-V1214 PolarHBondContact O-N 2.95Å; V1214-Q1218 HydrophobicContact CG1-CB 3.41Å; V1214-Q1218 VanDerWaalsContact CG1-CB 3.41Å
1215	S	62.6	Low	55.9	Low	41 Å²	41	54.1 Å²	54.1	29%	0.287	30%	0.3	S	S	.	.			trans	-62.2	152.2	174.3	57.6	0	0	0	0	111.2	S1217 Q1218 L1219	S1215-S1217 PolarHBondContact O-N 3.06Å; S1215-S1217 PolarHBondContact OG-OG 2.94Å; S1215-S1217 VanDerWaalsContact OG-OG 3.11Å; S1215-Q1218 WeakPolarHBondContact O-CB 3.48Å; S1215-Q1218 PolarHBondContact O-N 3.32Å; S1215-Q1218 WeakPolarHBondContact OG-CB 3.39Å; S1215-Q1218 VanDerWaalsContact OG-CD 3.27Å; S1215-Q1218 VanDerWaalsContact OG-CG 3.23Å; S1215-Q1218 WeakPolarHBondContact OG-CG 3.44Å; S1215-Q1218 PolarHBondContact OG-N 3.03Å; S1215-Q1218 PolarHBondContact OG-OE1 3.14Å; S1215-L1219 PolarHBondContact O-N 3.18Å
1216	Q	63.7	Low	57.5	Low	34 Å²	34	57 Å²	57	16%	0.159	31%	0.314	C	S	.	.	H	α-helix	trans	-56.5	-39.8	178.3	-65.4	175.5	-5	0	0	110.5	T511 D597 Q1218 L1219 I1220	T511-Q1216 HydrophobicContact CG2-CB 4.39Å; T511-Q1216 HydrophobicContact CG2-CG 4.47Å; D597-Q1216 HydrophobicContact CB-CB 4.45Å; D597-Q1216 PolarHBondContact OD2-N 2.96Å; Q1216-Q1218 VanDerWaalsContact C-N 3.34Å; Q1216-Q1218 PolarHBondContact O-N 2.84Å; Q1216-L1219 WeakPolarHBondContact O-CB 3.49Å; Q1216-L1219 PolarHBondContact O-N 2.8Å; Q1216-I1220 WeakPolarHBondContact O-CB 3.3Å; Q1216-I1220 WeakPolarHBondContact O-CD1 3.41Å; Q1216-I1220 WeakPolarHBondContact O-CG1 2.99Å; Q1216-I1220 PolarHBondContact O-N 3.4Å
1217	S	63.1	Low	59	Low	34 Å²	34	64.5 Å²	64.5	24%	0.238	34%	0.342	C	S	.	.	H	α-helix	trans	-58.1	-39.2	173.6	68.4	0	0	0	0	114.2	D597 S1215 R1221	D597-S1217 PolarHBondContact OD1-N 3.23Å; D597-S1217 PolarHBondContact OD2-N 3.39Å; S1215-S1217 PolarHBondContact O-N 3.06Å; S1215-S1217 PolarHBondContact OG-OG 2.94Å; S1215-S1217 VanDerWaalsContact OG-OG 3.11Å; S1217-R1221 WeakPolarHBondContact O-CB 3.48Å; S1217-R1221 VanDerWaalsContact O-CG 3.24Å; S1217-R1221 WeakPolarHBondContact O-CG 3.15Å; S1217-R1221 PolarHBondContact O-N 3.5Å; S1217-R1221 VanDerWaalsContact O-N 3.15Å
1218	Q	66.4	Low	60.5	Low	99 Å²	99	71.5 Å²	71.5	46%	0.463	35%	0.352	S	S	.	.	H	α-helix	trans	-71.8	-39.8	175.5	-77.3	167.4	-33.5	0	0	111.9	V1214 S1215 Q1216 I1220 R1221 A1222	V1214-Q1218 HydrophobicContact CG1-CB 3.41Å; V1214-Q1218 VanDerWaalsContact CG1-CB 3.41Å; S1215-Q1218 WeakPolarHBondContact O-CB 3.48Å; S1215-Q1218 PolarHBondContact O-N 3.32Å; S1215-Q1218 WeakPolarHBondContact OG-CB 3.39Å; S1215-Q1218 VanDerWaalsContact OG-CD 3.27Å; S1215-Q1218 VanDerWaalsContact OG-CG 3.23Å; S1215-Q1218 WeakPolarHBondContact OG-CG 3.44Å; S1215-Q1218 PolarHBondContact OG-N 3.03Å; S1215-Q1218 PolarHBondContact OG-OE1 3.14Å; Q1216-Q1218 VanDerWaalsContact C-N 3.34Å; Q1216-Q1218 PolarHBondContact O-N 2.84Å; Q1218-I1220 VanDerWaalsContact C-N 3.32Å; Q1218-I1220 PolarHBondContact O-N 3.11Å; Q1218-R1221 CarbonylContact O-C 3.6Å; Q1218-R1221 PolarHBondContact O-N 2.89Å; Q1218-R1221 VanDerWaalsContact O-N 3.17Å; Q1218-A1222 WeakPolarHBondContact O-CB 3.37Å; Q1218-A1222 PolarHBondContact O-N 3.41Å
1219	L	64.5	Low	61.8	Low	18 Å²	18	72.6 Å²	72.6	9%	0.094	36%	0.356	C	S	.	.	H	α-helix	trans	-57.3	-48.6	176.2	-166	71.6	0	0	0	110.9	M175 Y177 L191 S1215 Q1216 R1221 A1222 Y1223	M175-L1219 HydrophobicContact SD-CD1 4.02Å; Y177-L1219 VanDerWaalsContact OH-CD1 3.3Å; Y177-L1219 WeakPolarHBondContact OH-CD1 3.33Å; L191-L1219 HydrophobicContact CD1-CD1 4.1Å; L191-L1219 HydrophobicContact CD2-CD1 3.78Å; S1215-L1219 PolarHBondContact O-N 3.18Å; Q1216-L1219 WeakPolarHBondContact O-CB 3.49Å; Q1216-L1219 PolarHBondContact O-N 2.8Å; L1219-R1221 VanDerWaalsContact C-N 3.29Å; L1219-R1221 PolarHBondContact O-N 3.42Å; L1219-A1222 PolarHBondContact O-N 3.36Å; L1219-Y1223 PolarHBondContact O-N 2.92Å
1220	I	65.3	Low	63.1	Low	6 Å²	6	70.1 Å²	70.1	3%	0.031	35%	0.349	C	S	.	.	H	α-helix	trans	-60.6	-41.3	178.2	-67	165.9	0	0	0	110.5	T511 R574 P576 I592 V595 Q1216 Q1218	T511-I1220 HydrophobicContact CG2-CD1 4.31Å; R574-I1220 VanDerWaalsContact NH2-CG1 3.26Å; P576-I1220 WeakPolarHBondContact CA-O 3.41Å; I592-I1220 HydrophobicContact CD1-CG2 4.42Å; V595-I1220 HydrophobicContact CB-CD1 4.22Å; V595-I1220 HydrophobicContact CG1-CD1 3.84Å; V595-I1220 HydrophobicContact CG2-CD1 3.77Å; V595-I1220 HydrophobicContact CG2-CG2 4.43Å; Q1216-I1220 WeakPolarHBondContact O-CB 3.3Å; Q1216-I1220 WeakPolarHBondContact O-CD1 3.41Å; Q1216-I1220 WeakPolarHBondContact O-CG1 2.99Å; Q1216-I1220 PolarHBondContact O-N 3.4Å; Q1218-I1220 VanDerWaalsContact C-N 3.32Å; Q1218-I1220 PolarHBondContact O-N 3.11Å
1221	R	69.5	Low	64.4	Low	141 Å²	141	69.8 Å²	69.8	53%	0.532	35%	0.351	S	S	.	.	H	α-helix	trans	-77.6	-18	-178.9	-73.6	177.7	177.2	-162.7	-1.3	114.5	P576 L593 S1217 Q1218 L1219	P576-R1221 WeakPolarHBondContact CB-O 3.35Å; P576-R1221 WeakPolarHBondContact CG-O 3.38Å; L593-R1221 PolarHBondContact O-NH2 3.21Å; S1217-R1221 WeakPolarHBondContact O-CB 3.48Å; S1217-R1221 VanDerWaalsContact O-CG 3.24Å; S1217-R1221 WeakPolarHBondContact O-CG 3.15Å; S1217-R1221 PolarHBondContact O-N 3.5Å; S1217-R1221 VanDerWaalsContact O-N 3.15Å; Q1218-R1221 CarbonylContact O-C 3.6Å; Q1218-R1221 PolarHBondContact O-N 2.89Å; Q1218-R1221 VanDerWaalsContact O-N 3.17Å; L1219-R1221 VanDerWaalsContact C-N 3.29Å; L1219-R1221 PolarHBondContact O-N 3.42Å
1222	A	64.7	Low	65.2	Low	21 Å²	21	62.5 Å²	62.5	17%	0.174	32%	0.318	C	S	.	.	H	α-helix	trans	-87.6	-22.7	176.2	0	0	0	0	0	112.1	P172 M175 Q1218 L1219	P172-A1222 WeakPolarHBondContact CG-O 3.02Å; M175-A1222 HydrophobicContact CE-CB 3.75Å; Q1218-A1222 WeakPolarHBondContact O-CB 3.37Å; Q1218-A1222 PolarHBondContact O-N 3.41Å; L1219-A1222 PolarHBondContact O-N 3.36Å
1223	Y	67	Low	65.7	Low	14 Å²	14	70.4 Å²	70.4	6%	0.055	34%	0.336	C	S	.	.			trans	-88.5	122.2	-173	-136.4	-93.4	0	0	0	112.9	E171 V513 T575 P576 L1219 K1229	E171-Y1223 WeakPolarHBondContact OE2-CE2 3.25Å; E171-Y1223 PolarHBondContact OE2-OH 3.02Å; V513-Y1223 HydrophobicContact CG1-CD1 3.73Å; V513-Y1223 HydrophobicContact CG1-CE1 3.36Å; V513-Y1223 HydrophobicContact CG1-CG 4.5Å; T575-Y1223 CarbonylContact C-O 3.55Å; P576-Y1223 WeakPolarHBondContact CD-O 3.44Å; L1219-Y1223 PolarHBondContact O-N 2.92Å; Y1223-K1229 VanDerWaalsContact OH-CE 3.32Å; Y1223-K1229 WeakPolarHBondContact OH-CE 3.49Å; Y1223-K1229 PolarHBondContact OH-NZ 3.19Å
1224	D	69.2	Low	66.3	Low	38 Å²	38	71.7 Å²	71.7	20%	0.203	33%	0.334	C	S	.	.			trans	-126.9	99	172.5	-176.8	-3.1	0	0	0	109.1	P576 T1226 R1227	P576-D1224 HydrophobicContact CG-CB 4.46Å; D1224-T1226 VanDerWaalsContact CG-OG1 3.3Å; D1224-T1226 PolarHBondContact O-N 3.27Å; D1224-T1226 WeakPolarHBondContact OD1-CB 3.49Å; D1224-T1226 PolarHBondContact OD1-N 3.16Å; D1224-T1226 VanDerWaalsContact OD1-N 3.08Å; D1224-T1226 PolarHBondContact OD1-OG1 3.45Å; D1224-T1226 PolarHBondContact OD2-OG1 3.17Å; D1224-R1227 HydrophobicContact CB-CG 4.28Å; D1224-R1227 PolarHBondContact O-N 3.37Å; D1224-R1227 WeakPolarHBondContact OD2-CG 3.39Å; D1224-R1227 IonicContact OD2-CZ 3.83Å; D1224-R1227 IonicContact OD2-NE 3.4Å; D1224-R1227 PolarHBondContact OD2-NE 3.29Å
1225	S	68.7	Low	66.8	Low	41 Å²	41	74.7 Å²	74.7	29%	0.287	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-3.6	-177.7	66.5	0	0	0	0	113.5	T573 R574	T573-S1225 WeakPolarHBondContact CG2-OG 3.49Å; R574-S1225 PolarHBondContact N-OG 2.61Å; R574-S1225 PolarHBondContact O-N 2.52Å; R574-S1225 PolarHBondContact O-OG 2.67Å
1226	T	65.5	Low	67	Low	93 Å²	93	76.6 Å²	76.6	57%	0.571	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-20.3	175.6	71.6	0	0	0	0	113.1	T573 T575 D1224	T573-T1226 HydrophobicContact CG2-CG2 3.85Å; T575-T1226 HydrophobicContact CG2-CG2 4.16Å; D1224-T1226 VanDerWaalsContact CG-OG1 3.3Å; D1224-T1226 PolarHBondContact O-N 3.27Å; D1224-T1226 WeakPolarHBondContact OD1-CB 3.49Å; D1224-T1226 PolarHBondContact OD1-N 3.16Å; D1224-T1226 VanDerWaalsContact OD1-N 3.08Å; D1224-T1226 PolarHBondContact OD1-OG1 3.45Å; D1224-T1226 PolarHBondContact OD2-OG1 3.17Å
1227	R	67.7	Low	67.2	Low	190 Å²	190	79.1 Å²	79.1	72%	0.717	36%	0.362	S	S	*	.	S	Bend	trans	-84.8	139.5	-177.8	-67.1	-178.8	-172.9	-156.9	-5	111.9	D1224 K1229	D1224-R1227 HydrophobicContact CB-CG 4.28Å; D1224-R1227 PolarHBondContact O-N 3.37Å; D1224-R1227 WeakPolarHBondContact OD2-CG 3.39Å; D1224-R1227 IonicContact OD2-CZ 3.83Å; D1224-R1227 IonicContact OD2-NE 3.4Å; D1224-R1227 PolarHBondContact OD2-NE 3.29Å; R1227-K1229 PolarHBondContact O-N 2.97Å
1228	R	67.7	Low	67.5	Low	248 Å²	248	81.9 Å²	81.9	94%	0.936	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-72.2	126.8	169.8	-73.5	-171.7	177.8	-171.7	-0.2	109.9
1229	K	72.1	Confident	67.5	Low	50 Å²	50	80.8 Å²	80.8	22%	0.217	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-68.2	141.1	174.4	-58.3	-178.7	178.1	-170.8	0	110.4	E171 K256 Y1223 R1227	E171-K1229 WeakPolarHBondContact OE1-CD 3.32Å; E171-K1229 VanDerWaalsContact OE1-CE 3.24Å; E171-K1229 WeakPolarHBondContact OE1-CE 3.44Å; E171-K1229 IonicContact OE1-NZ 2.71Å; E171-K1229 PolarHBondContact OE1-NZ 2.85Å; E171-K1229 WeakPolarHBondContact OE2-CE 3.48Å; E171-K1229 IonicContact OE2-NZ 3.3Å; E171-K1229 PolarHBondContact OE2-NZ 3.26Å; K256-K1229 HydrophobicContact CD-CB 4.07Å; K256-K1229 HydrophobicContact CD-CD 4.28Å; K256-K1229 HydrophobicContact CG-CD 4.23Å; Y1223-K1229 VanDerWaalsContact OH-CE 3.32Å; Y1223-K1229 WeakPolarHBondContact OH-CE 3.49Å; Y1223-K1229 PolarHBondContact OH-NZ 3.19Å; R1227-K1229 PolarHBondContact O-N 2.97Å
1230	P	72.7	Confident	67.8	Low	53 Å²	53	85.3 Å²	85.3	34%	0.344	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-61.8	148	177.7	26.1	-34.7	0	0	0	112	S170 W257	S170-P1230 WeakPolarHBondContact O-CD 3.31Å; W257-P1230 HydrophobicContact CZ2-CB 4.18Å; W257-P1230 HydrophobicContact CZ2-CG 3.97Å; W257-P1230 PolarHBondContact NE1-O 2.98Å
1231	D	72.9	Confident	67.9	Low	91 Å²	91	91.4 Å²	91.4	49%	0.487	41%	0.41	S	S	.	.			trans	-81.9	-17.4	-177.3	-66.7	-18.2	0	0	0	113.5	W257 R1233	W257-D1231 PolarHBondContact NE1-O 2.85Å; D1231-R1233 HydrophobicContact CB-CG 4.11Å; D1231-R1233 IonicContact OD2-CZ 3.39Å; D1231-R1233 IonicContact OD2-NE 3.72Å; D1231-R1233 IonicContact OD2-NH2 3.1Å; D1231-R1233 PolarHBondContact OD2-NH2 3.1Å
1232	G	64.7	Low	67.8	Low	4 Å²	4	87.3 Å²	87.3	4%	0.041	40%	0.4	C	S	.	.			trans	63.1	57.6	-179.5	0	0	0	0	0	113.1	K153 L202 W257	K153-G1232 PolarHBondContact NZ-O 2.82Å; L202-G1232 WeakPolarHBondContact O-CA 3.28Å; W257-G1232 VanDerWaalsContact CE2-CA 3.41Å
1233	R	60.8	Low	68.1	Low	204 Å²	204	93.3 Å²	93.3	77%	0.77	42%	0.421	S	S	*	.			trans	-76.9	0	-171.9	-67.1	-173.4	-173.9	-177.1	2.5	113.1	W138 T203 A204 D1231	W138-R1233 PolarHBondContact NE1-OXT 2.96Å; T203-R1233 CarbonylContact C-O 3.59Å; T203-R1233 WeakPolarHBondContact CA-O 3.23Å; A204-R1233 PolarHBondContact N-O 2.92Å; D1231-R1233 HydrophobicContact CB-CG 4.11Å; D1231-R1233 IonicContact OD2-CZ 3.39Å; D1231-R1233 IonicContact OD2-NE 3.72Å; D1231-R1233 IonicContact OD2-NH2 3.1Å; D1231-R1233 PolarHBondContact OD2-NH2 3.1Å

Retrieved 1,233 of 1,233 residues in 2656.1 ms (Link to these results)

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