A0A096MRV4_PAPAN Loading...

Integrator complex subunit 7

AlphaFold DB (A0A0D9RS77), UniProt , Accession A0A096MRV4, Species PAPAN (Papio anubis, Olive baboon), Gene INTS7, Length 962 aa.

						>A0A096MRV4_PAPAN|A0A096MRV4|INTS7
MASNSTKSFLADAGYGEQELDANSALMELDKGLRSGKLGEQCEAVVRFPRLFQKYPFPILINSAFLKLADVFRVGNNFLRLCVLKVTQQSEKHLEKILNVDEFVKRIFSVIHSNDPVARAITLRMLGSLASIIPERKNAHHSIRQSLDSHDNVEVEAAVFAAANFSAQSKDFAVGICNKISEMIQGLATPVDLKLKLIPILQHMHHDAILASSARQLLQQLVTSYPSTKMVIVSLHTFTLLAASSLVDTPKQIQLLLQYLKNDPRKAVKRLAIQDLKLLASKTPHTWSRENIQALCECALQTPYDSLKLGMLSVLSTLSGTIAIKHYFSTVPGNVSSPPRSSDLVKLAQECCYHNNRGIAAHGVRVLTNITVSCQEKDLLALEQDAVFGLESLLVLCSQDDSPGAQATLKIALNCMVKLAKGRPHLSQSVVETLLTQLHSAQDAARILMCHCLAAIAMQLPVLGDGMLGDLMELYKVIGRSATDKQQELLVSLATVIFVASQKALSVESKAVIKQQLESVSNGWTVYRIARQASRMGNHDMAKELYQSLLTQVASEHFYFWLNSLKEFSHAEQCLTGLQEENYSSALSCIAESLKFYHKGIASLTAASTPLNPLSFQCEFVKLRIDLLQAFSQLICTCNSLKTSPPPAIATTIAMTLGNDLQRCGRISNQMKQSMEEFRSLASRYGDLYQASFDADSATLRNVELQQQSCLLISHAIEALILDPESASFQEYGSTGTAHADSEYERRMMSVYNHVLEEVESLNRKYTPVSYMHTACLCNAIIALLKVPLSFQRYFFQKLQSTSIKLALSPSPRNPAEPIAVQNNQQLALKVEGVVQHGSKPGLFRKIQSVCLNVSSTLQSKSGQDYKIPIDNMTNEMEQRVEPHNDYFSTQFLLNFAILGTHNITVESSVKDANGIVWKTGPRTTIFVKSLEDPYSQQIRLQQQQAQQPLQQQQQRNAYTRF
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	24.2	Very low	25.3	Very low	251 Å²	251	135.6 Å²	135.6	100%	1.236	78%	0.778	S	S	*	*				0	54.9	0	-62.7	-171	-160.8	0	0	111.1
2	A	23.6	Very low	25.7	Very low	90 Å²	90	136.8 Å²	136.8	74%	0.744	78%	0.78	S	S	*	*			trans	-146	52.9	-178	0	0	0	0	0	110
3	S	21.3	Very low	26	Very low	102 Å²	102	128.6 Å²	128.6	71%	0.713	74%	0.739	S	S	*	*	S	Bend	trans	-139.6	10.8	-179.9	57.5	0	0	0	0	114.5
4	N	21.7	Very low	26.2	Very low	156 Å²	156	124.9 Å²	124.9	83%	0.834	74%	0.743	S	S	*	*	S	Bend	trans	-125.2	14.9	177.9	-95	0.2	0	0	0	114.8
5	S	25.3	Very low	26.2	Very low	110 Å²	110	131.1 Å²	131.1	77%	0.769	75%	0.75	S	S	*	*			trans	-95.2	7.6	-177.9	59.9	0	0	0	0	115.2
6	T	24.8	Very low	26.3	Very low	133 Å²	133	127.9 Å²	127.9	82%	0.816	76%	0.755	S	S	*	*	S	Bend	trans	-94.9	5.4	-178.3	41.5	0	0	0	0	114.7
7	K	26.1	Very low	26.4	Very low	192 Å²	192	129.3 Å²	129.3	84%	0.835	75%	0.752	S	S	*	*	S	Bend	trans	-113.8	93.9	169.3	-75.3	-173.9	176.8	-178.1	0	110.1
8	S	27.3	Very low	26.7	Very low	65 Å²	65	132.1 Å²	132.1	46%	0.455	76%	0.757	S	S	.	*	S	Bend	trans	169.6	50.8	155.9	177.2	0	0	0	0	112.4
9	F	30.9	Very low	27.4	Very low	170 Å²	170	134.1 Å²	134.1	75%	0.746	76%	0.759	S	S	*	*	S	Bend	trans	-114.8	-30.2	159.4	-158.6	-96.1	0	0	0	111.4
10	L	28.1	Very low	28.7	Very low	144 Å²	144	131.7 Å²	131.7	75%	0.754	74%	0.744	S	S	*	*	S	Bend	trans	-99.2	-7	175.7	-70.3	168.3	0	0	0	114.1	A13	L10-A13 PolarHBondContact O-N 3.47Å
11	A	25.6	Very low	31.1	Very low	79 Å²	79	130.2 Å²	130.2	65%	0.653	73%	0.734	S	S	*	*	S	Bend	trans	-82.2	-18.1	-176.2	0	0	0	0	0	114
12	D	29.2	Very low	33.8	Very low	150 Å²	150	118.8 Å²	118.8	80%	0.802	68%	0.679	S	S	*	*	S	Bend	trans	-92.5	-3.9	171.5	-91.8	-14.7	0	0	0	112.7	G14	D12-G14 VanDerWaalsContact C-N 3.28Å; D12-G14 PolarHBondContact O-N 3.16Å
13	A	29.9	Very low	36.7	Very low	30 Å²	30	119.2 Å²	119.2	25%	0.248	67%	0.669	C	S	.	*	S	Bend	trans	-78.3	87.1	165.6	0	0	0	0	0	107.5	L10 Y15	L10-A13 PolarHBondContact O-N 3.47Å; A13-Y15 VanDerWaalsContact C-N 3.34Å; A13-Y15 PolarHBondContact O-N 3.47Å
14	G	28.9	Very low	39.8	Very low	77 Å²	77	116.3 Å²	116.3	79%	0.794	65%	0.649	S	S	*	*			trans	-55.2	93.9	174.1	0	0	0	0	0	111	D12 G16	D12-G14 VanDerWaalsContact C-N 3.28Å; D12-G14 PolarHBondContact O-N 3.16Å; G14-G16 PolarHBondContact O-N 2.92Å
15	Y	25.8	Very low	43.1	Very low	217 Å²	217	109.8 Å²	109.8	85%	0.851	62%	0.617	S	S	*	*			trans	-69.9	108.7	161.7	-89.8	-90	0	0	0	108.1	A13 E17	A13-Y15 VanDerWaalsContact C-N 3.34Å; A13-Y15 PolarHBondContact O-N 3.47Å; Y15-E17 PolarHBondContact O-N 3.43Å
16	G	28.1	Very low	46.3	Very low	80 Å²	80	105.3 Å²	105.3	83%	0.825	58%	0.584	S	S	*	*	S	Bend	trans	79.7	11.6	145.1	0	0	0	0	0	119.7	G14	G14-G16 PolarHBondContact O-N 2.92Å
17	E	29.1	Very low	49.4	Very low	152 Å²	152	105.5 Å²	105.5	71%	0.71	58%	0.577	S	S	*	*			trans	-81.4	115.4	158	-78.9	-171.8	175.4	0	0	107.7	Y15 E19	Y15-E17 PolarHBondContact O-N 3.43Å; E17-E19 PolarHBondContact O-N 2.83Å
18	Q	31.6	Very low	52.6	Low	180 Å²	180	101.4 Å²	101.4	84%	0.841	56%	0.561	S	S	*	*			trans	-45.7	118.6	164.7	-79.6	174.9	-16.8	0	0	107.6	L20	Q18-L20 PolarHBondContact O-N 3.41Å
19	E	40	Very low	55.8	Low	170 Å²	170	99 Å²	99	79%	0.794	54%	0.543	S	S	*	.			trans	-63.1	89.6	-180	-75.7	-170.6	147.1	0	0	109.2	E17 D21	E17-E19 PolarHBondContact O-N 2.83Å; E19-D21 PolarHBondContact O-N 2.97Å
20	L	53	Low	58.8	Low	86 Å²	86	92.1 Å²	92.1	45%	0.45	51%	0.514	S	S	.	.			trans	-60.7	121.6	168.2	-75.7	164.7	0	0	0	107.6	Q18 Y55	Q18-L20 PolarHBondContact O-N 3.41Å; L20-Y55 PolarHBondContact O-OH 3.46Å
21	D	77.9	Confident	61.9	Low	100 Å²	100	93.2 Å²	93.2	54%	0.535	51%	0.513	S	S	.	.			trans	-48.8	146.2	170.6	177.9	37.2	0	0	0	110.7	E19 N23 S24 A25	E19-D21 PolarHBondContact O-N 2.97Å; D21-N23 PolarHBondContact O-N 2.9Å; D21-N23 VanDerWaalsContact O-N 3.07Å; D21-N23 WeakPolarHBondContact OD2-CB 3.33Å; D21-N23 PolarHBondContact OD2-ND2 3.39Å; D21-S24 PolarHBondContact N-OG 3.31Å; D21-S24 PolarHBondContact O-N 2.99Å; D21-S24 PolarHBondContact O-OG 3.44Å; D21-A25 PolarHBondContact O-N 3.45Å; D21-A25 VanDerWaalsContact O-N 3.08Å
22	A	82.3	Confident	65.1	Low	11 Å²	11	90.3 Å²	90.3	9%	0.091	49%	0.49	C	S	.	.	H	α-helix	trans	-55.7	-33.7	-175.6	0	0	0	0	0	112.3	L26 Y55 L60	A22-L26 PolarHBondContact O-N 3.49Å; A22-L26 VanDerWaalsContact O-N 3.09Å; A22-Y55 HydrophobicContact CB-CD1 3.87Å; A22-Y55 HydrophobicContact CB-CD2 3.76Å; A22-Y55 HydrophobicContact CB-CE1 4.17Å; A22-Y55 HydrophobicContact CB-CE2 4.03Å; A22-Y55 HydrophobicContact CB-CG 3.66Å; A22-L60 HydrophobicContact CB-CD1 4.35Å; A22-L60 HydrophobicContact CB-CD2 4.05Å
23	N	84.2	Confident	68.2	Low	99 Å²	99	83.7 Å²	83.7	53%	0.529	46%	0.455	S	S	.	.	H	α-helix	trans	-69.3	-42.3	176.8	-68.5	-46.6	0	0	0	112.7	D21 A25 L26 M27	D21-N23 PolarHBondContact O-N 2.9Å; D21-N23 VanDerWaalsContact O-N 3.07Å; D21-N23 WeakPolarHBondContact OD2-CB 3.33Å; D21-N23 PolarHBondContact OD2-ND2 3.39Å; N23-A25 VanDerWaalsContact C-N 3.35Å; N23-L26 PolarHBondContact O-N 3.09Å; N23-M27 VanDerWaalsContact O-CG 3.31Å; N23-M27 WeakPolarHBondContact O-CG 3.35Å; N23-M27 PolarHBondContact O-N 3.41Å
24	S	87.3	Confident	71.1	Confident	42 Å²	42	91.1 Å²	91.1	29%	0.294	48%	0.477	S	S	.	.	H	α-helix	trans	-67	-40.2	179.4	63.6	0	0	0	0	110.9	D21 L26 M27 E28	D21-S24 PolarHBondContact N-OG 3.31Å; D21-S24 PolarHBondContact O-N 2.99Å; D21-S24 PolarHBondContact O-OG 3.44Å; S24-L26 PolarHBondContact O-N 3.37Å; S24-M27 PolarHBondContact O-N 3.26Å; S24-E28 PolarHBondContact O-N 2.99Å
25	A	89.5	Confident	74.1	Confident	19 Å²	19	88.5 Å²	88.5	16%	0.157	45%	0.446	C	S	.	.	H	α-helix	trans	-60.1	-42.9	173.6	0	0	0	0	0	112.2	D21 N23 E28 L29 L51	D21-A25 PolarHBondContact O-N 3.45Å; D21-A25 VanDerWaalsContact O-N 3.08Å; N23-A25 VanDerWaalsContact C-N 3.35Å; A25-E28 PolarHBondContact O-N 3.08Å; A25-L29 WeakPolarHBondContact O-CG 3.49Å; A25-L29 PolarHBondContact O-N 2.93Å; A25-L29 VanDerWaalsContact O-N 3.16Å; A25-L51 HydrophobicContact CB-CD1 4.16Å
26	L	92.4	Very high	76.9	Confident	15 Å²	15	82.2 Å²	82.2	8%	0.079	45%	0.447	C	S	.	.	H	α-helix	trans	-67.2	-38.4	176	-177.9	62	0	0	0	112.3	A22 N23 S24 E28 L29 D30 F48 L51 L60 A64 K67	A22-L26 PolarHBondContact O-N 3.49Å; A22-L26 VanDerWaalsContact O-N 3.09Å; N23-L26 PolarHBondContact O-N 3.09Å; S24-L26 PolarHBondContact O-N 3.37Å; L26-E28 VanDerWaalsContact C-N 3.35Å; L26-L29 PolarHBondContact O-N 3.38Å; L26-D30 WeakPolarHBondContact O-CB 3.39Å; L26-D30 PolarHBondContact O-N 2.94Å; L26-F48 HydrophobicContact CD1-CE1 3.89Å; L26-L51 HydrophobicContact CB-CD1 4.38Å; L26-L60 HydrophobicContact CB-CD1 3.92Å; L26-L60 HydrophobicContact CD2-CD1 3.69Å; L26-L60 HydrophobicContact CG-CD1 4.32Å; L26-A64 HydrophobicContact CD1-CB 4.04Å; L26-K67 HydrophobicContact CD1-CD 4.23Å
27	M	91.4	Very high	80	Confident	138 Å²	138	84.7 Å²	84.7	68%	0.68	44%	0.435	S	S	*	.	H	α-helix	trans	-64.2	-39	176.6	-75.2	-177.6	177.2	0	0	112.1	N23 S24 D30 K31	N23-M27 VanDerWaalsContact O-CG 3.31Å; N23-M27 WeakPolarHBondContact O-CG 3.35Å; N23-M27 PolarHBondContact O-N 3.41Å; S24-M27 PolarHBondContact O-N 3.26Å; M27-D30 PolarHBondContact O-N 2.82Å; M27-K31 PolarHBondContact O-N 3.37Å
28	E	92.5	Very high	83.1	Confident	105 Å²	105	80.9 Å²	80.9	49%	0.491	42%	0.419	S	S	.	.	H	α-helix	trans	-63.3	-47.7	175.4	-171.8	-170.6	158.2	0	0	111.5	S24 A25 L26 D30 K31 G32	S24-E28 PolarHBondContact O-N 2.99Å; A25-E28 PolarHBondContact O-N 3.08Å; L26-E28 VanDerWaalsContact C-N 3.35Å; E28-D30 VanDerWaalsContact C-N 3.31Å; E28-D30 PolarHBondContact O-N 2.72Å; E28-K31 WeakPolarHBondContact O-CB 3.45Å; E28-K31 PolarHBondContact O-N 2.76Å; E28-G32 PolarHBondContact O-N 2.62Å
29	L	94.3	Very high	86	Confident	15 Å²	15	74.8 Å²	74.8	8%	0.079	41%	0.405	C	S	.	.	H	α-helix	trans	-62.5	-39.8	176	-65.4	-176	0	0	0	111.5	A25 L26 K31 G32 L33 A44 R47 F48 L51	A25-L29 WeakPolarHBondContact O-CG 3.49Å; A25-L29 PolarHBondContact O-N 2.93Å; A25-L29 VanDerWaalsContact O-N 3.16Å; L26-L29 PolarHBondContact O-N 3.38Å; L29-K31 VanDerWaalsContact C-N 3.3Å; L29-K31 PolarHBondContact O-N 2.68Å; L29-G32 PolarHBondContact O-N 3.39Å; L29-G32 VanDerWaalsContact O-N 3.14Å; L29-L33 WeakPolarHBondContact O-CG 3.48Å; L29-L33 PolarHBondContact O-N 3.12Å; L29-A44 HydrophobicContact CD2-CB 4.35Å; L29-R47 HydrophobicContact CD1-CB 4.48Å; L29-R47 HydrophobicContact CD2-CB 3.75Å; L29-F48 HydrophobicContact CB-CE2 4.15Å; L29-F48 HydrophobicContact CB-CZ 3.91Å; L29-F48 HydrophobicContact CD1-CD1 4.08Å; L29-F48 HydrophobicContact CD1-CD2 4.15Å; L29-F48 HydrophobicContact CD1-CE1 4.04Å; L29-F48 HydrophobicContact CD1-CE2 4.12Å; L29-F48 HydrophobicContact CD1-CG 4.15Å; L29-F48 HydrophobicContact CD1-CZ 4.07Å; L29-L51 HydrophobicContact CD1-CB 4.36Å; L29-L51 HydrophobicContact CD1-CD1 3.72Å
30	D	93.5	Very high	88.6	Confident	25 Å²	25	70.1 Å²	70.1	13%	0.134	38%	0.383	C	S	.	.	H	α-helix	trans	-60.3	-39.6	175.3	-169.6	47.9	0	0	0	112.1	L26 M27 E28 G32 L33 R34 K67	L26-D30 WeakPolarHBondContact O-CB 3.39Å; L26-D30 PolarHBondContact O-N 2.94Å; M27-D30 PolarHBondContact O-N 2.82Å; E28-D30 VanDerWaalsContact C-N 3.31Å; E28-D30 PolarHBondContact O-N 2.72Å; D30-G32 VanDerWaalsContact C-N 3.35Å; D30-L33 PolarHBondContact O-N 3.36Å; D30-R34 VanDerWaalsContact O-CG 3.31Å; D30-R34 WeakPolarHBondContact O-CG 3.4Å; D30-R34 PolarHBondContact O-N 2.9Å; D30-R34 IonicContact OD1-NE 3.09Å; D30-R34 IonicContact OD1-NH2 2.81Å; D30-R34 IonicContact OD2-CZ 3.6Å; D30-R34 VanDerWaalsContact OD2-CZ 3.31Å; D30-R34 IonicContact OD2-NE 3.24Å; D30-R34 PolarHBondContact OD2-NE 3.17Å; D30-R34 IonicContact OD2-NH2 2.99Å; D30-R34 PolarHBondContact OD2-NH2 2.96Å; D30-K67 HydrophobicContact CB-CD 4.2Å; D30-K67 IonicContact OD1-NZ 2.64Å; D30-K67 PolarHBondContact OD1-NZ 3.45Å; D30-K67 IonicContact OD2-NZ 3.46Å; D30-K67 PolarHBondContact OD2-NZ 3.08Å
31	K	93.6	Very high	90.7	Very high	168 Å²	168	68 Å²	68	73%	0.73	37%	0.371	S	S	*	.	H	α-helix	trans	-62.9	-42.7	173.8	-172.9	-178.5	177.7	-176.1	0	111.3	M27 E28 L29 R34 S35	M27-K31 PolarHBondContact O-N 3.37Å; E28-K31 WeakPolarHBondContact O-CB 3.45Å; E28-K31 PolarHBondContact O-N 2.76Å; L29-K31 VanDerWaalsContact C-N 3.3Å; L29-K31 PolarHBondContact O-N 2.68Å; K31-R34 PolarHBondContact O-N 3.05Å; K31-S35 PolarHBondContact O-N 3.44Å
32	G	92.7	Very high	91.5	Very high	18 Å²	18	64.1 Å²	64.1	19%	0.186	35%	0.351	C	S	.	.	H	α-helix	trans	-61.8	-41.9	174.6	0	0	0	0	0	113	E28 L29 D30 R34 S35	E28-G32 PolarHBondContact O-N 2.62Å; L29-G32 PolarHBondContact O-N 3.39Å; L29-G32 VanDerWaalsContact O-N 3.14Å; D30-G32 VanDerWaalsContact C-N 3.35Å; G32-R34 VanDerWaalsContact C-N 3.3Å; G32-R34 PolarHBondContact O-N 3.49Å; G32-S35 WeakPolarHBondContact O-CB 3.41Å; G32-S35 PolarHBondContact O-N 3.13Å; G32-S35 VanDerWaalsContact O-N 3.15Å
33	L	93.7	Very high	92.1	Very high	10 Å²	10	68 Å²	68	5%	0.052	37%	0.368	C	S	.	.	H	α-helix	trans	-63.3	-33.9	175.7	-68.8	-178.2	0	0	0	112.9	L29 D30 S35 Q41 A44 V45 F48 K67 V71	L29-L33 WeakPolarHBondContact O-CG 3.48Å; L29-L33 PolarHBondContact O-N 3.12Å; D30-L33 PolarHBondContact O-N 3.36Å; L33-S35 VanDerWaalsContact C-N 3.28Å; L33-Q41 PolarHBondContact O-NE2 2.89Å; L33-A44 HydrophobicContact CD2-CB 3.87Å; L33-A44 HydrophobicContact CG-CB 4.17Å; L33-V45 HydrophobicContact CD2-CG2 3.63Å; L33-F48 HydrophobicContact CD1-CE2 3.8Å; L33-F48 HydrophobicContact CD1-CZ 3.74Å; L33-F48 HydrophobicContact CD2-CE2 4.23Å; L33-F48 HydrophobicContact CG-CE2 4.2Å; L33-F48 HydrophobicContact CG-CZ 4.49Å; L33-K67 HydrophobicContact CD1-CB 4.14Å; L33-V71 HydrophobicContact CB-CG2 4.16Å; L33-V71 HydrophobicContact CD1-CG2 3.94Å; L33-V71 HydrophobicContact CD2-CG2 3.94Å; L33-V71 HydrophobicContact CG-CG2 4.23Å
34	R	91.4	Very high	92.6	Very high	187 Å²	187	63.6 Å²	63.6	71%	0.706	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-3.8	177.2	-66.7	177.1	-165.8	-155.8	9.6	113.8	D30 K31 G32	D30-R34 VanDerWaalsContact O-CG 3.31Å; D30-R34 WeakPolarHBondContact O-CG 3.4Å; D30-R34 PolarHBondContact O-N 2.9Å; D30-R34 IonicContact OD1-NE 3.09Å; D30-R34 IonicContact OD1-NH2 2.81Å; D30-R34 IonicContact OD2-CZ 3.6Å; D30-R34 VanDerWaalsContact OD2-CZ 3.31Å; D30-R34 IonicContact OD2-NE 3.24Å; D30-R34 PolarHBondContact OD2-NE 3.17Å; D30-R34 IonicContact OD2-NH2 2.99Å; D30-R34 PolarHBondContact OD2-NH2 2.96Å; K31-R34 PolarHBondContact O-N 3.05Å; G32-R34 VanDerWaalsContact C-N 3.3Å; G32-R34 PolarHBondContact O-N 3.49Å
35	S	91.9	Very high	93.1	Very high	21 Å²	21	61.6 Å²	61.6	15%	0.147	33%	0.331	C	S	.	.			trans	-61.1	144.6	175.8	-177.9	0	0	0	0	111.1	K31 G32 L33 K37 E40 Q41	K31-S35 PolarHBondContact O-N 3.44Å; G32-S35 WeakPolarHBondContact O-CB 3.41Å; G32-S35 PolarHBondContact O-N 3.13Å; G32-S35 VanDerWaalsContact O-N 3.15Å; L33-S35 VanDerWaalsContact C-N 3.28Å; S35-K37 PolarHBondContact O-N 3.28Å; S35-K37 PolarHBondContact OG-N 2.99Å; S35-K37 VanDerWaalsContact OG-N 3.11Å; S35-E40 WeakPolarHBondContact CB-OE2 3.43Å; S35-E40 PolarHBondContact OG-OE2 3.35Å; S35-Q41 VanDerWaalsContact O-CD 3.31Å; S35-Q41 WeakPolarHBondContact O-CG 3.43Å; S35-Q41 PolarHBondContact O-NE2 3.01Å
36	G	85.3	Confident	93.4	Very high	85 Å²	85	64.8 Å²	64.8	88%	0.876	35%	0.348	S	S	*	.	S	Bend	trans	-72.8	-8.8	169.8	0	0	0	0	0	113.5
37	K	92.9	Very high	93.5	Very high	132 Å²	132	69.6 Å²	69.6	57%	0.574	37%	0.365	S	S	*	.			trans	-95.5	121	-178.5	-58.3	-168.5	-154.3	145.5	0	111.3	S35 G39 E40 Q41	S35-K37 PolarHBondContact O-N 3.28Å; S35-K37 PolarHBondContact OG-N 2.99Å; S35-K37 VanDerWaalsContact OG-N 3.11Å; K37-G39 PolarHBondContact O-N 3.4Å; K37-E40 HydrophobicContact CB-CB 4.37Å; K37-E40 HydrophobicContact CB-CG 4.18Å; K37-E40 WeakPolarHBondContact CD-OE1 3.37Å; K37-E40 WeakPolarHBondContact CE-OE1 3.16Å; K37-E40 IonicContact NZ-OE1 3.72Å; K37-E40 PolarHBondContact NZ-OE1 3.03Å; K37-E40 PolarHBondContact O-N 3.37Å; K37-E40 VanDerWaalsContact O-N 3.14Å; K37-Q41 PolarHBondContact O-N 2.72Å; K37-Q41 VanDerWaalsContact O-N 3.17Å
38	L	92.9	Very high	93.7	Very high	72 Å²	72	63 Å²	63	38%	0.377	33%	0.333	S	S	.	.	H	α-helix	trans	-54.6	-38.4	178.1	-178.6	61.5	0	0	0	113.1	Q41 C42 N76 L79	L38-Q41 PolarHBondContact O-N 2.94Å; L38-C42 WeakPolarHBondContact O-CB 3.36Å; L38-C42 PolarHBondContact O-N 3.46Å; L38-C42 PolarHBondContact O-SG 2.87Å; L38-N76 VanDerWaalsContact CD1-ND2 3.34Å; L38-N76 WeakPolarHBondContact CD1-ND2 2.92Å; L38-L79 HydrophobicContact CD1-CD1 3.82Å; L38-L79 HydrophobicContact CD1-CD2 4.07Å; L38-L79 HydrophobicContact CD1-CG 3.69Å
39	G	93.9	Very high	93.8	Very high	53 Å²	53	58.7 Å²	58.7	55%	0.546	31%	0.314	S	S	.	.	H	α-helix	trans	-60.9	-45.6	178.6	0	0	0	0	0	113.2	K37 C42 E43	K37-G39 PolarHBondContact O-N 3.4Å; G39-C42 PolarHBondContact O-N 2.93Å; G39-E43 WeakPolarHBondContact O-CB 3.45Å; G39-E43 PolarHBondContact O-N 3.47Å
40	E	94.6	Very high	93.6	Very high	72 Å²	72	67 Å²	67	34%	0.336	34%	0.344	S	S	.	.	H	α-helix	trans	-67.6	-37.5	179.1	-66.3	175.4	-164.7	0	0	111.2	S35 K37 E43 A44	S35-E40 WeakPolarHBondContact CB-OE2 3.43Å; S35-E40 PolarHBondContact OG-OE2 3.35Å; K37-E40 HydrophobicContact CB-CB 4.37Å; K37-E40 HydrophobicContact CB-CG 4.18Å; K37-E40 WeakPolarHBondContact CD-OE1 3.37Å; K37-E40 WeakPolarHBondContact CE-OE1 3.16Å; K37-E40 IonicContact NZ-OE1 3.72Å; K37-E40 PolarHBondContact NZ-OE1 3.03Å; K37-E40 PolarHBondContact O-N 3.37Å; K37-E40 VanDerWaalsContact O-N 3.14Å; E40-E43 PolarHBondContact O-N 2.92Å; E40-A44 WeakPolarHBondContact O-CB 3.45Å; E40-A44 PolarHBondContact O-N 3.45Å
41	Q	95.6	Very high	93.6	Very high	42 Å²	42	66.4 Å²	66.4	20%	0.196	34%	0.341	C	S	.	.	H	α-helix	trans	-63.9	-46.3	174.7	-66.1	-178.5	-43.9	0	0	111.8	L33 S35 K37 L38 A44 V45 L79	L33-Q41 PolarHBondContact O-NE2 2.89Å; S35-Q41 VanDerWaalsContact O-CD 3.31Å; S35-Q41 WeakPolarHBondContact O-CG 3.43Å; S35-Q41 PolarHBondContact O-NE2 3.01Å; K37-Q41 PolarHBondContact O-N 2.72Å; K37-Q41 VanDerWaalsContact O-N 3.17Å; L38-Q41 PolarHBondContact O-N 2.94Å; Q41-A44 PolarHBondContact O-N 3.32Å; Q41-V45 WeakPolarHBondContact O-CG2 3.39Å; Q41-V45 PolarHBondContact O-N 3.38Å; Q41-L79 HydrophobicContact CB-CD1 4.42Å; Q41-L79 HydrophobicContact CB-CD2 3.8Å
42	C	94.8	Very high	93.4	Very high	17 Å²	17	58.4 Å²	58.4	12%	0.115	31%	0.306	C	S	.	.	H	α-helix	trans	-63.1	-44.3	177.7	-68.4	0	0	0	0	111.7	L38 G39 A44 V45 V46 F78 L79	L38-C42 WeakPolarHBondContact O-CB 3.36Å; L38-C42 PolarHBondContact O-N 3.46Å; L38-C42 PolarHBondContact O-SG 2.87Å; G39-C42 PolarHBondContact O-N 2.93Å; C42-A44 VanDerWaalsContact C-N 3.34Å; C42-A44 PolarHBondContact O-N 3.05Å; C42-V45 PolarHBondContact O-N 3.44Å; C42-V46 WeakPolarHBondContact O-CG2 3.41Å; C42-V46 PolarHBondContact O-N 2.94Å; C42-F78 HydrophobicContact CB-CE1 4.34Å; C42-F78 WeakPolarHBondContact SG-CD1 3.43Å; C42-F78 WeakPolarHBondContact SG-CE1 3.32Å; C42-L79 VanDerWaalsContact SG-CD2 3.51Å
43	E	95.2	Very high	93.1	Very high	94 Å²	94	64.3 Å²	64.3	44%	0.439	33%	0.329	S	S	.	.	H	α-helix	trans	-58.6	-45.7	175.3	179.7	172.4	-161.7	0	0	111.5	G39 E40 V45 V46 R47	G39-E43 WeakPolarHBondContact O-CB 3.45Å; G39-E43 PolarHBondContact O-N 3.47Å; E40-E43 PolarHBondContact O-N 2.92Å; E43-V45 PolarHBondContact O-N 3.04Å; E43-V46 WeakPolarHBondContact O-CG2 3.37Å; E43-V46 PolarHBondContact O-N 2.8Å; E43-R47 VanDerWaalsContact O-CG 3.31Å; E43-R47 WeakPolarHBondContact O-CG 3.33Å; E43-R47 PolarHBondContact O-N 3.43Å; E43-R47 IonicContact OE1-CZ 2.74Å; E43-R47 VanDerWaalsContact OE1-CZ 3.31Å; E43-R47 IonicContact OE1-NE 3.88Å; E43-R47 PolarHBondContact OE1-NE 2.96Å; E43-R47 IonicContact OE1-NH2 3.31Å; E43-R47 PolarHBondContact OE1-NH2 3.44Å
44	A	95.8	Very high	92.7	Very high	5 Å²	5	68.3 Å²	68.3	4%	0.041	35%	0.346	C	S	.	.	H	α-helix	trans	-61	-45	175.9	0	0	0	0	0	111.7	L29 L33 E40 Q41 C42 V46 R47 F48	L29-A44 HydrophobicContact CD2-CB 4.35Å; L33-A44 HydrophobicContact CD2-CB 3.87Å; L33-A44 HydrophobicContact CG-CB 4.17Å; E40-A44 WeakPolarHBondContact O-CB 3.45Å; E40-A44 PolarHBondContact O-N 3.45Å; Q41-A44 PolarHBondContact O-N 3.32Å; C42-A44 VanDerWaalsContact C-N 3.34Å; C42-A44 PolarHBondContact O-N 3.05Å; A44-V46 PolarHBondContact O-N 3.01Å; A44-R47 PolarHBondContact O-N 2.74Å; A44-F48 WeakPolarHBondContact O-CD2 3.46Å; A44-F48 WeakPolarHBondContact O-CE2 3.25Å
45	V	96.7	Very high	92.4	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-57	-49.9	177.2	171.9	0	0	0	0	111.4	L33 Q41 C42 E43 R47 F48 L68 V71 L79 C82 V83 V86	L33-V45 HydrophobicContact CD2-CG2 3.63Å; Q41-V45 WeakPolarHBondContact O-CG2 3.39Å; Q41-V45 PolarHBondContact O-N 3.38Å; C42-V45 PolarHBondContact O-N 3.44Å; E43-V45 PolarHBondContact O-N 3.04Å; V45-R47 PolarHBondContact O-N 3.12Å; V45-F48 WeakPolarHBondContact O-CD2 3.37Å; V45-F48 PolarHBondContact O-N 2.82Å; V45-L68 HydrophobicContact CG1-CD2 4.2Å; V45-L68 HydrophobicContact CG2-CD2 4.26Å; V45-V71 HydrophobicContact CG2-CG1 4.47Å; V45-L79 HydrophobicContact CG2-CD2 4.45Å; V45-C82 HydrophobicContact CB-CB 4.37Å; V45-C82 HydrophobicContact CG1-CB 3.68Å; V45-V83 HydrophobicContact CG1-CG2 3.95Å; V45-V83 HydrophobicContact CG2-CG2 4.19Å; V45-V86 HydrophobicContact CG1-CG2 3.77Å; V45-V86 VanDerWaalsContact O-CG2 3.31Å; V45-V86 WeakPolarHBondContact O-CG2 3.22Å
46	V	95.4	Very high	92	Very high	87 Å²	87	60.2 Å²	60.2	53%	0.527	31%	0.313	S	S	.	.	H	α-helix	trans	-72.9	-10.5	-175.9	-58.9	0	0	0	0	114.1	C42 E43 A44 P49	C42-V46 WeakPolarHBondContact O-CG2 3.41Å; C42-V46 PolarHBondContact O-N 2.94Å; E43-V46 WeakPolarHBondContact O-CG2 3.37Å; E43-V46 PolarHBondContact O-N 2.8Å; A44-V46 PolarHBondContact O-N 3.01Å; V46-P49 WeakPolarHBondContact O-CD 3.41Å
47	R	95.8	Very high	91.9	Very high	116 Å²	116	58.7 Å²	58.7	44%	0.438	28%	0.283	S	S	.	.	H	α-helix	trans	-84.7	-17.7	173.8	-74.1	176	179.7	-155.2	1.7	113.5	L29 E43 A44 V45 R50 L51	L29-R47 HydrophobicContact CD1-CB 4.48Å; L29-R47 HydrophobicContact CD2-CB 3.75Å; E43-R47 VanDerWaalsContact O-CG 3.31Å; E43-R47 WeakPolarHBondContact O-CG 3.33Å; E43-R47 PolarHBondContact O-N 3.43Å; E43-R47 IonicContact OE1-CZ 2.74Å; E43-R47 VanDerWaalsContact OE1-CZ 3.31Å; E43-R47 IonicContact OE1-NE 3.88Å; E43-R47 PolarHBondContact OE1-NE 2.96Å; E43-R47 IonicContact OE1-NH2 3.31Å; E43-R47 PolarHBondContact OE1-NH2 3.44Å; A44-R47 PolarHBondContact O-N 2.74Å; V45-R47 PolarHBondContact O-N 3.12Å; R47-R50 PolarHBondContact O-N 2.94Å; R47-L51 PolarHBondContact O-N 3.37Å
48	F	95.4	Very high	91.4	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-57.3	-40.7	178.4	-82	-85.4	0	0	0	115	L26 L29 L33 A44 V45 R50 L51 F52 A64 L68 V86	L26-F48 HydrophobicContact CD1-CE1 3.89Å; L29-F48 HydrophobicContact CB-CE2 4.15Å; L29-F48 HydrophobicContact CB-CZ 3.91Å; L29-F48 HydrophobicContact CD1-CD1 4.08Å; L29-F48 HydrophobicContact CD1-CD2 4.15Å; L29-F48 HydrophobicContact CD1-CE1 4.04Å; L29-F48 HydrophobicContact CD1-CE2 4.12Å; L29-F48 HydrophobicContact CD1-CG 4.15Å; L29-F48 HydrophobicContact CD1-CZ 4.07Å; L33-F48 HydrophobicContact CD1-CE2 3.8Å; L33-F48 HydrophobicContact CD1-CZ 3.74Å; L33-F48 HydrophobicContact CD2-CE2 4.23Å; L33-F48 HydrophobicContact CG-CE2 4.2Å; L33-F48 HydrophobicContact CG-CZ 4.49Å; A44-F48 WeakPolarHBondContact O-CD2 3.46Å; A44-F48 WeakPolarHBondContact O-CE2 3.25Å; V45-F48 WeakPolarHBondContact O-CD2 3.37Å; V45-F48 PolarHBondContact O-N 2.82Å; F48-R50 VanDerWaalsContact C-N 3.26Å; F48-R50 PolarHBondContact O-N 2.89Å; F48-L51 WeakPolarHBondContact O-CA 3.4Å; F48-L51 WeakPolarHBondContact O-CB 3.22Å; F48-L51 PolarHBondContact O-N 2.95Å; F48-F52 HydrophobicContact CB-CE2 4.04Å; F48-F52 HydrophobicContact CB-CZ 4.1Å; F48-F52 HydrophobicContact CD1-CE1 4.25Å; F48-F52 HydrophobicContact CD1-CZ 4.06Å; F48-F52 HydrophobicContact CG-CZ 4.5Å; F48-F52 WeakPolarHBondContact O-CD2 3.35Å; F48-F52 WeakPolarHBondContact O-CG 3.24Å; F48-F52 PolarHBondContact O-N 3.47Å; F48-A64 HydrophobicContact CD1-CB 3.74Å; F48-A64 HydrophobicContact CE1-CB 3.59Å; F48-L68 HydrophobicContact CB-CD1 4.45Å; F48-L68 HydrophobicContact CD1-CD1 4.44Å; F48-L68 HydrophobicContact CD2-CD2 3.84Å; F48-L68 HydrophobicContact CD2-CG 4.41Å; F48-L68 HydrophobicContact CE2-CD2 4.02Å; F48-L68 HydrophobicContact CG-CD1 4.25Å; F48-L68 HydrophobicContact CG-CD2 4.3Å; F48-L68 HydrophobicContact CG-CG 4.47Å; F48-V86 HydrophobicContact CB-CG1 4.14Å
49	P	94.4	Very high	91	Very high	13 Å²	13	54.5 Å²	54.5	8%	0.084	27%	0.266	C	S	.	.	H	α-helix	trans	-55.1	-39.8	175.9	-27.6	34.6	0	0	0	113.5	V46 F52 Q53 V86 Q89	V46-P49 WeakPolarHBondContact O-CD 3.41Å; P49-F52 PolarHBondContact O-N 3.36Å; P49-Q53 PolarHBondContact O-N 3.33Å; P49-V86 HydrophobicContact CG-CB 4.35Å; P49-V86 HydrophobicContact CG-CG1 4Å; P49-V86 HydrophobicContact CG-CG2 3.99Å; P49-Q89 HydrophobicContact CB-CG 4.48Å
50	R	90.9	Very high	90.8	Very high	191 Å²	191	52.5 Å²	52.5	72%	0.721	24%	0.242	S	C	*	.	H	α-helix	trans	-67.2	-39.4	176.7	-174.3	178.8	-73.6	178.2	-1.8	111.1	R47 F48 Q53 K54	R47-R50 PolarHBondContact O-N 2.94Å; F48-R50 VanDerWaalsContact C-N 3.26Å; F48-R50 PolarHBondContact O-N 2.89Å; R50-Q53 PolarHBondContact O-N 3.12Å; R50-K54 WeakPolarHBondContact O-CB 3.45Å; R50-K54 PolarHBondContact O-N 3.46Å
51	L	92.2	Very high	90.6	Very high	12 Å²	12	49.1 Å²	49.1	6%	0.063	23%	0.226	C	C	.	.	H	α-helix	trans	-62.4	-43.5	174.4	-178.5	149.2	0	0	0	111.5	A25 L26 L29 R47 F48 K54 Y55 L60	A25-L51 HydrophobicContact CB-CD1 4.16Å; L26-L51 HydrophobicContact CB-CD1 4.38Å; L29-L51 HydrophobicContact CD1-CB 4.36Å; L29-L51 HydrophobicContact CD1-CD1 3.72Å; R47-L51 PolarHBondContact O-N 3.37Å; F48-L51 WeakPolarHBondContact O-CA 3.4Å; F48-L51 WeakPolarHBondContact O-CB 3.22Å; F48-L51 PolarHBondContact O-N 2.95Å; L51-K54 PolarHBondContact O-N 3.32Å; L51-Y55 HydrophobicContact CG-CD2 4.49Å; L51-Y55 PolarHBondContact O-N 2.85Å; L51-L60 HydrophobicContact CD2-CD2 3.58Å; L51-L60 HydrophobicContact CD2-CG 3.97Å; L51-L60 HydrophobicContact CG-CD2 4.31Å
52	F	90.7	Very high	90.5	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.7	-40	177.3	-60.1	-32.7	0	0	0	113.1	F48 P49 Y55 P56 I61 A64 F65 L68 V86	F48-F52 HydrophobicContact CB-CE2 4.04Å; F48-F52 HydrophobicContact CB-CZ 4.1Å; F48-F52 HydrophobicContact CD1-CE1 4.25Å; F48-F52 HydrophobicContact CD1-CZ 4.06Å; F48-F52 HydrophobicContact CG-CZ 4.5Å; F48-F52 WeakPolarHBondContact O-CD2 3.35Å; F48-F52 WeakPolarHBondContact O-CG 3.24Å; F48-F52 PolarHBondContact O-N 3.47Å; P49-F52 PolarHBondContact O-N 3.36Å; F52-Y55 CarbonylContact O-C 3.54Å; F52-P56 WeakPolarHBondContact O-CA 3.03Å; F52-I61 HydrophobicContact CD1-CG1 3.91Å; F52-I61 HydrophobicContact CE1-CG1 4.38Å; F52-A64 HydrophobicContact CE1-CB 3.47Å; F52-A64 VanDerWaalsContact CE1-CB 3.47Å; F52-A64 HydrophobicContact CZ-CB 3.89Å; F52-F65 HydrophobicContact CE1-CE2 4.44Å; F52-F65 HydrophobicContact CE2-CE1 4.45Å; F52-F65 AromaticContact CE2-CE2 3.94Å; F52-F65 HydrophobicContact CE2-CE2 3.94Å; F52-F65 AromaticContact CE2-CZ 3.84Å; F52-F65 HydrophobicContact CE2-CZ 3.84Å; F52-F65 HydrophobicContact CZ-CD2 4.09Å; F52-F65 AromaticContact CZ-CE2 3.84Å; F52-F65 HydrophobicContact CZ-CE2 3.84Å; F52-F65 HydrophobicContact CZ-CZ 4.1Å; F52-L68 HydrophobicContact CE2-CD1 4.48Å; F52-L68 HydrophobicContact CZ-CD1 4.17Å; F52-V86 HydrophobicContact CE2-CG1 4.25Å
53	Q	85.1	Confident	90.5	Very high	142 Å²	142	48.9 Å²	48.9	66%	0.664	23%	0.229	S	C	*	.	H	α-helix	trans	-66.1	-40.7	177	-173.9	176.2	1.5	0	0	111.6	P49 R50	P49-Q53 PolarHBondContact O-N 3.33Å; R50-Q53 PolarHBondContact O-N 3.12Å
54	K	84.9	Confident	90.5	Very high	94 Å²	94	44.4 Å²	44.4	41%	0.409	21%	0.208	S	C	.	.	H	α-helix	trans	-73.5	-40.3	-180	-168.4	170.8	-175.6	174.6	0	112.3	R50 L51 P56	R50-K54 WeakPolarHBondContact O-CB 3.45Å; R50-K54 PolarHBondContact O-N 3.46Å; L51-K54 PolarHBondContact O-N 3.32Å; K54-P56 WeakPolarHBondContact O-CD 3.32Å
55	Y	85.3	Confident	90.6	Very high	30 Å²	30	44.2 Å²	44.2	12%	0.118	21%	0.206	C	C	.	.			trans	-127.9	78.3	-173.9	-57.2	-59.9	0	0	0	111.3	L20 A22 L51 F52 F57 L60	L20-Y55 PolarHBondContact O-OH 3.46Å; A22-Y55 HydrophobicContact CB-CD1 3.87Å; A22-Y55 HydrophobicContact CB-CD2 3.76Å; A22-Y55 HydrophobicContact CB-CE1 4.17Å; A22-Y55 HydrophobicContact CB-CE2 4.03Å; A22-Y55 HydrophobicContact CB-CG 3.66Å; L51-Y55 HydrophobicContact CG-CD2 4.49Å; L51-Y55 PolarHBondContact O-N 2.85Å; F52-Y55 CarbonylContact O-C 3.54Å; Y55-F57 HydrophobicContact CD1-CE2 4.45Å; Y55-F57 PolarHBondContact O-N 2.94Å; Y55-L60 HydrophobicContact CD2-CD2 4.33Å; Y55-L60 HydrophobicContact CG-CD2 4.16Å
56	P	84.3	Confident	90.6	Very high	8 Å²	8	45.4 Å²	45.4	5%	0.052	21%	0.212	C	C	.	.			trans	-79.2	33.5	-172.2	33.3	-38.1	0	0	0	114.1	F52 K54 K96 V834	F52-P56 WeakPolarHBondContact O-CA 3.03Å; K54-P56 WeakPolarHBondContact O-CD 3.32Å; P56-K96 PolarHBondContact O-NZ 2.91Å; P56-V834 HydrophobicContact CB-CG1 4.01Å; P56-V834 HydrophobicContact CB-CG2 4.41Å; P56-V834 HydrophobicContact CG-CB 4.27Å; P56-V834 HydrophobicContact CG-CG1 3.72Å; P56-V834 HydrophobicContact CG-CG2 4.24Å; P56-V834 WeakPolarHBondContact O-CG2 3.07Å
57	F	82.5	Confident	90.7	Very high	53 Å²	53	43.6 Å²	43.6	23%	0.232	20%	0.198	C	C	.	.			trans	-85.3	133.7	-175.5	-61.6	-62.8	0	0	0	112.1	Y55 I59 L60 I61 K805 A807	Y55-F57 HydrophobicContact CD1-CE2 4.45Å; Y55-F57 PolarHBondContact O-N 2.94Å; F57-I59 VanDerWaalsContact C-N 3.35Å; F57-I59 PolarHBondContact O-N 3.05Å; F57-L60 HydrophobicContact CB-CB 4.35Å; F57-L60 PolarHBondContact O-N 3.4Å; F57-I61 WeakPolarHBondContact O-CB 3.42Å; F57-I61 WeakPolarHBondContact O-CG1 3.36Å; F57-I61 PolarHBondContact O-N 3.2Å; F57-K805 HydrophobicContact CE1-CD 4.22Å; F57-K805 HydrophobicContact CZ-CD 3.89Å; F57-A807 HydrophobicContact CE1-CB 4.46Å
58	P	83.1	Confident	90.7	Very high	3 Å²	3	38.1 Å²	38.1	2%	0.019	18%	0.177	C	C	.	.	H	α-helix	trans	-56.2	-42.6	-176.8	-24.6	31.1	0	0	0	114.3	L60 I61 N62 K96 L98 Y887	P58-L60 PolarHBondContact O-N 3Å; P58-I61 PolarHBondContact O-N 3.41Å; P58-N62 WeakPolarHBondContact O-CB 3.35Å; P58-N62 PolarHBondContact O-N 3.15Å; P58-K96 HydrophobicContact CB-CB 4.46Å; P58-L98 HydrophobicContact CB-CD2 4.3Å; P58-L98 HydrophobicContact CB-CG 4.49Å; P58-Y887 HydrophobicContact CG-CD2 3.94Å; P58-Y887 HydrophobicContact CG-CE1 4.26Å; P58-Y887 HydrophobicContact CG-CE2 3.17Å; P58-Y887 WeakPolarHBondContact CG-OH 3.45Å
59	I	84.9	Confident	90.9	Very high	112 Å²	112	38.1 Å²	38.1	57%	0.574	18%	0.177	S	C	*	.	H	α-helix	trans	-62.8	-44.3	-178	-58.8	169.8	0	0	0	110.9	F57 S63	F57-I59 VanDerWaalsContact C-N 3.35Å; F57-I59 PolarHBondContact O-N 3.05Å; I59-S63 WeakPolarHBondContact O-CB 3.19Å; I59-S63 PolarHBondContact O-N 2.9Å; I59-S63 PolarHBondContact O-OG 3.48Å
60	L	89.6	Confident	90.9	Very high	12 Å²	12	40.1 Å²	40.1	6%	0.063	19%	0.187	C	C	.	.	H	α-helix	trans	-66.8	-48.1	177.9	-174.5	77.2	0	0	0	111.1	A22 L26 L51 Y55 F57 P58 S63 A64	A22-L60 HydrophobicContact CB-CD1 4.35Å; A22-L60 HydrophobicContact CB-CD2 4.05Å; L26-L60 HydrophobicContact CB-CD1 3.92Å; L26-L60 HydrophobicContact CD2-CD1 3.69Å; L26-L60 HydrophobicContact CG-CD1 4.32Å; L51-L60 HydrophobicContact CD2-CD2 3.58Å; L51-L60 HydrophobicContact CD2-CG 3.97Å; L51-L60 HydrophobicContact CG-CD2 4.31Å; Y55-L60 HydrophobicContact CD2-CD2 4.33Å; Y55-L60 HydrophobicContact CG-CD2 4.16Å; F57-L60 HydrophobicContact CB-CB 4.35Å; F57-L60 PolarHBondContact O-N 3.4Å; P58-L60 PolarHBondContact O-N 3Å; L60-S63 PolarHBondContact O-N 3.3Å; L60-A64 WeakPolarHBondContact O-CB 3.36Å; L60-A64 PolarHBondContact O-N 2.59Å
61	I	91.1	Very high	91.2	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-59.8	-48.8	179.3	-72	173.2	0	0	0	110.3	F52 F57 P58 S63 A64 F65 H93 K96	F52-I61 HydrophobicContact CD1-CG1 3.91Å; F52-I61 HydrophobicContact CE1-CG1 4.38Å; F57-I61 WeakPolarHBondContact O-CB 3.42Å; F57-I61 WeakPolarHBondContact O-CG1 3.36Å; F57-I61 PolarHBondContact O-N 3.2Å; P58-I61 PolarHBondContact O-N 3.41Å; I61-S63 PolarHBondContact O-N 3Å; I61-A64 PolarHBondContact O-N 3.16Å; I61-F65 HydrophobicContact CG2-CD2 3.5Å; I61-F65 VanDerWaalsContact CG2-CD2 3.5Å; I61-F65 HydrophobicContact CG2-CE2 3.6Å; I61-F65 WeakPolarHBondContact O-CD2 3.19Å; I61-F65 PolarHBondContact O-N 2.74Å; I61-H93 HydrophobicContact CD1-CB 4.13Å; I61-H93 HydrophobicContact CG2-CB 4.44Å; I61-K96 HydrophobicContact CB-CB 4.46Å; I61-K96 HydrophobicContact CD1-CB 4.13Å; I61-K96 HydrophobicContact CD1-CD 3.49Å; I61-K96 VanDerWaalsContact CD1-CD 3.49Å; I61-K96 HydrophobicContact CD1-CG 4.43Å; I61-K96 HydrophobicContact CG2-CB 4.11Å
62	N	92.6	Very high	91.4	Very high	12 Å²	12	31.2 Å²	31.2	6%	0.064	15%	0.154	C	C	.	.	H	α-helix	trans	-55.1	-49.9	175.2	-179.1	63.3	0	0	0	111.4	P58 A64 F65 L66 L98 N99	P58-N62 WeakPolarHBondContact O-CB 3.35Å; P58-N62 PolarHBondContact O-N 3.15Å; N62-A64 VanDerWaalsContact C-N 3.35Å; N62-A64 PolarHBondContact O-N 3.03Å; N62-F65 PolarHBondContact O-N 2.78Å; N62-L66 VanDerWaalsContact O-CG 3.28Å; N62-L66 WeakPolarHBondContact O-CG 3.31Å; N62-L66 PolarHBondContact O-N 2.98Å; N62-L98 HydrophobicContact CB-CB 4.32Å; N62-L98 HydrophobicContact CB-CD1 4.47Å; N62-L98 HydrophobicContact CB-CG 4.2Å; N62-L98 PolarHBondContact OD1-N 3.03Å; N62-N99 PolarHBondContact OD1-N 3.45Å
63	S	94.4	Very high	91.7	Very high	43 Å²	43	36.6 Å²	36.6	30%	0.301	18%	0.175	S	C	.	.	H	α-helix	trans	-61.5	-42.6	-179.9	-59.1	0	0	0	0	112.3	I59 L60 I61 L66 K67	I59-S63 WeakPolarHBondContact O-CB 3.19Å; I59-S63 PolarHBondContact O-N 2.9Å; I59-S63 PolarHBondContact O-OG 3.48Å; L60-S63 PolarHBondContact O-N 3.3Å; I61-S63 PolarHBondContact O-N 3Å; S63-L66 PolarHBondContact O-N 3.28Å; S63-K67 WeakPolarHBondContact O-CG 3.48Å; S63-K67 PolarHBondContact O-N 2.97Å; S63-K67 VanDerWaalsContact O-N 3.14Å
64	A	96	Very high	92.2	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-66.5	-44.4	177.1	0	0	0	0	0	112.7	L26 F48 F52 L60 I61 N62 L66 K67 L68	L26-A64 HydrophobicContact CD1-CB 4.04Å; F48-A64 HydrophobicContact CD1-CB 3.74Å; F48-A64 HydrophobicContact CE1-CB 3.59Å; F52-A64 HydrophobicContact CE1-CB 3.47Å; F52-A64 VanDerWaalsContact CE1-CB 3.47Å; F52-A64 HydrophobicContact CZ-CB 3.89Å; L60-A64 WeakPolarHBondContact O-CB 3.36Å; L60-A64 PolarHBondContact O-N 2.59Å; I61-A64 PolarHBondContact O-N 3.16Å; N62-A64 VanDerWaalsContact C-N 3.35Å; N62-A64 PolarHBondContact O-N 3.03Å; A64-L66 VanDerWaalsContact C-N 3.34Å; A64-L66 PolarHBondContact O-N 3.08Å; A64-K67 WeakPolarHBondContact O-CB 3.27Å; A64-K67 PolarHBondContact O-N 3.17Å; A64-L68 WeakPolarHBondContact O-CG 3.4Å; A64-L68 PolarHBondContact O-N 2.97Å
65	F	97.1	Very high	92.5	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-64.7	-37.1	175.7	-86.6	-69.5	0	0	0	112.2	F52 I61 N62 K67 L68 A69 L94 I97 F103	F52-F65 HydrophobicContact CE1-CE2 4.44Å; F52-F65 HydrophobicContact CE2-CE1 4.45Å; F52-F65 AromaticContact CE2-CE2 3.94Å; F52-F65 HydrophobicContact CE2-CE2 3.94Å; F52-F65 AromaticContact CE2-CZ 3.84Å; F52-F65 HydrophobicContact CE2-CZ 3.84Å; F52-F65 HydrophobicContact CZ-CD2 4.09Å; F52-F65 AromaticContact CZ-CE2 3.84Å; F52-F65 HydrophobicContact CZ-CE2 3.84Å; F52-F65 HydrophobicContact CZ-CZ 4.1Å; I61-F65 HydrophobicContact CG2-CD2 3.5Å; I61-F65 VanDerWaalsContact CG2-CD2 3.5Å; I61-F65 HydrophobicContact CG2-CE2 3.6Å; I61-F65 WeakPolarHBondContact O-CD2 3.19Å; I61-F65 PolarHBondContact O-N 2.74Å; N62-F65 PolarHBondContact O-N 2.78Å; F65-K67 VanDerWaalsContact C-N 3.32Å; F65-K67 PolarHBondContact O-N 2.88Å; F65-L68 HydrophobicContact CD1-CD1 4.11Å; F65-L68 HydrophobicContact CE1-CD1 4.36Å; F65-L68 PolarHBondContact O-N 3.37Å; F65-A69 WeakPolarHBondContact O-CB 3.28Å; F65-A69 PolarHBondContact O-N 2.91Å; F65-L94 HydrophobicContact CE1-CD2 3.71Å; F65-L94 HydrophobicContact CE2-CD2 4.23Å; F65-L94 HydrophobicContact CZ-CD2 3.52Å; F65-I97 HydrophobicContact CB-CD1 3.91Å; F65-I97 HydrophobicContact CB-CG1 4.07Å; F65-I97 HydrophobicContact CD1-CD1 4.07Å; F65-I97 HydrophobicContact CD2-CD1 3.68Å; F65-I97 HydrophobicContact CD2-CG1 3.62Å; F65-I97 HydrophobicContact CE2-CD1 4.19Å; F65-I97 HydrophobicContact CE2-CG1 4.28Å; F65-I97 HydrophobicContact CG-CD1 3.62Å; F65-I97 HydrophobicContact CG-CG1 3.95Å; F65-F103 HydrophobicContact CB-CD2 4.04Å; F65-F103 HydrophobicContact CB-CE2 3.86Å; F65-F103 AromaticContact CD1-CE2 3.93Å; F65-F103 HydrophobicContact CD1-CE2 3.93Å; F65-F103 HydrophobicContact CD1-CZ 4Å; F65-F103 HydrophobicContact CG-CE2 4.34Å; F65-F103 VanDerWaalsContact O-CD2 3.31Å; F65-F103 WeakPolarHBondContact O-CD2 3.45Å; F65-F103 VanDerWaalsContact O-CE2 3.23Å; F65-F103 WeakPolarHBondContact O-CE2 3.24Å
66	L	97.2	Very high	92.9	Very high	25 Å²	25	33.6 Å²	33.6	13%	0.131	18%	0.177	C	C	.	.	H	α-helix	trans	-61.3	-40.7	173.4	-71.9	172.7	0	0	0	112.1	N62 S63 A64 A69 D70 N99 E102 F103 R106	N62-L66 VanDerWaalsContact O-CG 3.28Å; N62-L66 WeakPolarHBondContact O-CG 3.31Å; N62-L66 PolarHBondContact O-N 2.98Å; S63-L66 PolarHBondContact O-N 3.28Å; A64-L66 VanDerWaalsContact C-N 3.34Å; A64-L66 PolarHBondContact O-N 3.08Å; L66-A69 PolarHBondContact O-N 3.48Å; L66-D70 PolarHBondContact O-N 3.43Å; L66-N99 HydrophobicContact CD1-CB 4.22Å; L66-N99 HydrophobicContact CD2-CB 4.27Å; L66-E102 HydrophobicContact CD2-CB 4.42Å; L66-E102 HydrophobicContact CD2-CG 4.26Å; L66-F103 HydrophobicContact CD2-CB 4.16Å; L66-R106 PolarHBondContact O-NH1 3.26Å; L66-R106 VanDerWaalsContact O-NH1 3.07Å
67	K	96.4	Very high	93.5	Very high	50 Å²	50	35.2 Å²	35.2	22%	0.217	19%	0.185	C	C	.	.	H	α-helix	trans	-65.6	-42.9	173.4	-70.3	175.4	-178.8	-61	0	112.2	L26 D30 L33 S63 A64 F65 A69 D70 V71	L26-K67 HydrophobicContact CD1-CD 4.23Å; D30-K67 HydrophobicContact CB-CD 4.2Å; D30-K67 IonicContact OD1-NZ 2.64Å; D30-K67 PolarHBondContact OD1-NZ 3.45Å; D30-K67 IonicContact OD2-NZ 3.46Å; D30-K67 PolarHBondContact OD2-NZ 3.08Å; L33-K67 HydrophobicContact CD1-CB 4.14Å; S63-K67 WeakPolarHBondContact O-CG 3.48Å; S63-K67 PolarHBondContact O-N 2.97Å; S63-K67 VanDerWaalsContact O-N 3.14Å; A64-K67 WeakPolarHBondContact O-CB 3.27Å; A64-K67 PolarHBondContact O-N 3.17Å; F65-K67 VanDerWaalsContact C-N 3.32Å; F65-K67 PolarHBondContact O-N 2.88Å; K67-A69 VanDerWaalsContact C-N 3.28Å; K67-A69 PolarHBondContact O-N 3.36Å; K67-D70 WeakPolarHBondContact O-CB 3.4Å; K67-D70 PolarHBondContact O-N 3.06Å; K67-V71 WeakPolarHBondContact O-CG2 3.24Å; K67-V71 PolarHBondContact O-N 3.39Å
68	L	97.4	Very high	94.2	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-61	-37.7	174.9	-73.2	170.4	0	0	0	111.6	V45 F48 F52 A64 F65 V71 F72 V83 V86	V45-L68 HydrophobicContact CG1-CD2 4.2Å; V45-L68 HydrophobicContact CG2-CD2 4.26Å; F48-L68 HydrophobicContact CB-CD1 4.45Å; F48-L68 HydrophobicContact CD1-CD1 4.44Å; F48-L68 HydrophobicContact CD2-CD2 3.84Å; F48-L68 HydrophobicContact CD2-CG 4.41Å; F48-L68 HydrophobicContact CE2-CD2 4.02Å; F48-L68 HydrophobicContact CG-CD1 4.25Å; F48-L68 HydrophobicContact CG-CD2 4.3Å; F48-L68 HydrophobicContact CG-CG 4.47Å; F52-L68 HydrophobicContact CE2-CD1 4.48Å; F52-L68 HydrophobicContact CZ-CD1 4.17Å; A64-L68 WeakPolarHBondContact O-CG 3.4Å; A64-L68 PolarHBondContact O-N 2.97Å; F65-L68 HydrophobicContact CD1-CD1 4.11Å; F65-L68 HydrophobicContact CE1-CD1 4.36Å; F65-L68 PolarHBondContact O-N 3.37Å; L68-V71 PolarHBondContact O-N 2.92Å; L68-F72 WeakPolarHBondContact O-CB 3.39Å; L68-F72 PolarHBondContact O-N 3.43Å; L68-V83 HydrophobicContact CB-CG1 3.97Å; L68-V83 HydrophobicContact CD2-CG1 4.38Å; L68-V83 HydrophobicContact CD2-CG2 4.01Å; L68-V86 HydrophobicContact CD1-CG1 4.03Å
69	A	97.8	Very high	94.8	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-68.5	-34.9	174.9	0	0	0	0	0	113	F65 L66 K67 F72 R73 F103 R106 I107	F65-A69 WeakPolarHBondContact O-CB 3.28Å; F65-A69 PolarHBondContact O-N 2.91Å; L66-A69 PolarHBondContact O-N 3.48Å; K67-A69 VanDerWaalsContact C-N 3.28Å; K67-A69 PolarHBondContact O-N 3.36Å; A69-F72 PolarHBondContact O-N 3.23Å; A69-R73 WeakPolarHBondContact O-CB 3.4Å; A69-R73 PolarHBondContact O-N 3.45Å; A69-F103 HydrophobicContact CB-CD2 3.5Å; A69-F103 HydrophobicContact CB-CE2 3.71Å; A69-F103 HydrophobicContact CB-CG 4.45Å; A69-R106 HydrophobicContact CB-CB 3.86Å; A69-I107 HydrophobicContact CB-CD1 4.08Å; A69-I107 HydrophobicContact CB-CG1 4.35Å
70	D	96.1	Very high	95.4	Very high	54 Å²	54	34.7 Å²	34.7	29%	0.289	18%	0.177	S	C	.	.	H	α-helix	trans	-63	-45.9	172.4	-77	-38.7	0	0	0	111.2	L66 K67 F72 R73 V74 R106	L66-D70 PolarHBondContact O-N 3.43Å; K67-D70 WeakPolarHBondContact O-CB 3.4Å; K67-D70 PolarHBondContact O-N 3.06Å; D70-F72 VanDerWaalsContact C-N 3.34Å; D70-F72 PolarHBondContact O-N 2.9Å; D70-R73 PolarHBondContact O-N 3.42Å; D70-R73 IonicContact OD1-CZ 3.69Å; D70-R73 IonicContact OD1-NH2 2.65Å; D70-R73 PolarHBondContact OD1-NH2 3.23Å; D70-R73 VanDerWaalsContact OD1-NH2 3.08Å; D70-V74 PolarHBondContact O-N 2.94Å; D70-R106 IonicContact OD1-CZ 3.81Å; D70-R106 IonicContact OD1-NE 3.33Å; D70-R106 IonicContact OD1-NH1 3.08Å; D70-R106 PolarHBondContact OD1-NH1 3.45Å; D70-R106 VanDerWaalsContact OD1-NH1 3.16Å; D70-R106 IonicContact OD2-CZ 3.1Å; D70-R106 IonicContact OD2-NH1 3.95Å; D70-R106 PolarHBondContact OD2-NH1 2.92Å
71	V	96.2	Very high	95.8	Very high	17 Å²	17	37.5 Å²	37.5	10%	0.103	19%	0.192	C	C	.	.	H	α-helix	trans	-62.9	-40.3	175.4	176.1	0	0	0	0	111.4	L33 V45 K67 L68 R73 G75 L79 V83	L33-V71 HydrophobicContact CB-CG2 4.16Å; L33-V71 HydrophobicContact CD1-CG2 3.94Å; L33-V71 HydrophobicContact CD2-CG2 3.94Å; L33-V71 HydrophobicContact CG-CG2 4.23Å; V45-V71 HydrophobicContact CG2-CG1 4.47Å; K67-V71 WeakPolarHBondContact O-CG2 3.24Å; K67-V71 PolarHBondContact O-N 3.39Å; L68-V71 PolarHBondContact O-N 2.92Å; V71-R73 VanDerWaalsContact C-N 3.34Å; V71-R73 PolarHBondContact O-N 3.16Å; V71-G75 VanDerWaalsContact O-CA 3.23Å; V71-G75 WeakPolarHBondContact O-CA 3.45Å; V71-G75 PolarHBondContact O-N 3.25Å; V71-L79 HydrophobicContact CG1-CB 4.3Å; V71-L79 HydrophobicContact CG1-CD1 4.33Å; V71-V83 HydrophobicContact CG1-CG2 4.44Å
72	F	97.6	Very high	96.1	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-62.5	-41.4	177.3	-171.6	-86	0	0	0	112.3	L68 A69 D70 R80 V83 I107 V110 I121 T122 M125	L68-F72 WeakPolarHBondContact O-CB 3.39Å; L68-F72 PolarHBondContact O-N 3.43Å; A69-F72 PolarHBondContact O-N 3.23Å; D70-F72 VanDerWaalsContact C-N 3.34Å; D70-F72 PolarHBondContact O-N 2.9Å; F72-R80 HydrophobicContact CD2-CB 3.87Å; F72-R80 HydrophobicContact CD2-CG 3.95Å; F72-R80 HydrophobicContact CE2-CB 3.67Å; F72-R80 HydrophobicContact CE2-CG 4.04Å; F72-R80 HydrophobicContact CG-CG 4.21Å; F72-R80 HydrophobicContact CZ-CB 4.27Å; F72-R80 HydrophobicContact CZ-CG 4.36Å; F72-R80 WeakPolarHBondContact O-CG 3.11Å; F72-R80 PolarHBondContact O-NE 3.28Å; F72-R80 VanDerWaalsContact O-NE 3.08Å; F72-V83 HydrophobicContact CB-CG1 4.39Å; F72-V83 HydrophobicContact CD2-CB 4.13Å; F72-V83 HydrophobicContact CD2-CG1 4.12Å; F72-I107 HydrophobicContact CB-CD1 3.73Å; F72-I107 HydrophobicContact CD1-CD1 3.49Å; F72-I107 VanDerWaalsContact CD1-CD1 3.49Å; F72-I107 HydrophobicContact CD1-CG2 4.48Å; F72-I107 HydrophobicContact CD2-CD1 4.15Å; F72-I107 HydrophobicContact CE1-CD1 4.13Å; F72-I107 HydrophobicContact CE1-CG2 4.13Å; F72-I107 HydrophobicContact CG-CD1 3.51Å; F72-V110 HydrophobicContact CD1-CG2 3.95Å; F72-V110 HydrophobicContact CE1-CB 4.14Å; F72-V110 HydrophobicContact CE1-CG1 4.48Å; F72-V110 HydrophobicContact CE1-CG2 3.96Å; F72-I121 HydrophobicContact CE2-CG2 3.85Å; F72-I121 HydrophobicContact CZ-CG2 4.07Å; F72-T122 HydrophobicContact CE1-CG2 4.35Å; F72-M125 HydrophobicContact CD2-CE 3.94Å; F72-M125 HydrophobicContact CE2-CB 4.35Å; F72-M125 HydrophobicContact CE2-CE 3.84Å; F72-M125 HydrophobicContact CE2-CG 4.49Å; F72-M125 HydrophobicContact CZ-CB 4.2Å; F72-M125 HydrophobicContact CZ-CG 4.48Å
73	R	97.1	Very high	96.4	Very high	113 Å²	113	37.9 Å²	37.9	43%	0.426	20%	0.195	S	C	.	.	H	α-helix	trans	-61.8	-50.3	-177.5	179.7	168.7	59.1	137.7	-5.7	112.2	A69 D70 V71	A69-R73 WeakPolarHBondContact O-CB 3.4Å; A69-R73 PolarHBondContact O-N 3.45Å; D70-R73 PolarHBondContact O-N 3.42Å; D70-R73 IonicContact OD1-CZ 3.69Å; D70-R73 IonicContact OD1-NH2 2.65Å; D70-R73 PolarHBondContact OD1-NH2 3.23Å; D70-R73 VanDerWaalsContact OD1-NH2 3.08Å; V71-R73 VanDerWaalsContact C-N 3.34Å; V71-R73 PolarHBondContact O-N 3.16Å
74	V	93.6	Very high	96.6	Very high	121 Å²	121	36 Å²	36	73%	0.733	18%	0.182	S	C	*	.	H	α-helix	trans	-101.5	-14.1	-174.1	-59	0	0	0	0	114.6	D70	D70-V74 PolarHBondContact O-N 2.94Å
75	G	91.7	Very high	96.7	Very high	12 Å²	12	41.8 Å²	41.8	12%	0.124	21%	0.207	C	C	.	.	S	Bend	trans	-71.8	166.9	-175.3	0	0	0	0	0	114.1	V71 R80	V71-G75 VanDerWaalsContact O-CA 3.23Å; V71-G75 WeakPolarHBondContact O-CA 3.45Å; V71-G75 PolarHBondContact O-N 3.25Å; G75-R80 PolarHBondContact O-NE 3.37Å; G75-R80 PolarHBondContact O-NH2 3.22Å
76	N	94.4	Very high	96.7	Very high	70 Å²	70	41.9 Å²	41.9	37%	0.374	21%	0.208	S	C	.	.			trans	-72.4	169.2	172.1	67.8	18.8	0	0	0	111.7	L38 F78 L79 R80	L38-N76 VanDerWaalsContact CD1-ND2 3.34Å; L38-N76 WeakPolarHBondContact CD1-ND2 2.92Å; N76-F78 PolarHBondContact O-N 2.68Å; N76-F78 VanDerWaalsContact O-N 3.15Å; N76-F78 PolarHBondContact OD1-N 3.35Å; N76-L79 PolarHBondContact O-N 2.72Å; N76-L79 WeakPolarHBondContact OD1-CG 3.38Å; N76-L79 PolarHBondContact OD1-N 3.03Å; N76-R80 WeakPolarHBondContact O-CG 3.29Å; N76-R80 PolarHBondContact O-N 3.27Å; N76-R80 VanDerWaalsContact O-N 3.08Å
77	N	96.5	Very high	96.7	Very high	41 Å²	41	40.8 Å²	40.8	22%	0.219	20%	0.202	C	C	.	.	H	α-helix	trans	-59.8	-28.5	-178.8	-73.3	-19	0	0	0	113.9	R80 L81 D115 V117 A118 I121	N77-R80 PolarHBondContact OD1-NH1 3.02Å; N77-L81 WeakPolarHBondContact O-CB 3.35Å; N77-L81 PolarHBondContact O-N 3.28Å; N77-D115 PolarHBondContact ND2-OD2 2.7Å; N77-V117 HydrophobicContact CB-CG1 4.37Å; N77-A118 WeakPolarHBondContact OD1-CB 3.49Å; N77-I121 HydrophobicContact CB-CD1 4.07Å; N77-I121 WeakPolarHBondContact O-CD1 3.25Å
78	F	96.7	Very high	96.6	Very high	118 Å²	118	41.3 Å²	41.3	52%	0.518	21%	0.205	S	C	.	.	H	α-helix	trans	-67.8	-47.4	177.2	-171.1	-103.9	0	0	0	111.6	C42 N76 R80 L81 C82	C42-F78 HydrophobicContact CB-CE1 4.34Å; C42-F78 WeakPolarHBondContact SG-CD1 3.43Å; C42-F78 WeakPolarHBondContact SG-CE1 3.32Å; N76-F78 PolarHBondContact O-N 2.68Å; N76-F78 VanDerWaalsContact O-N 3.15Å; N76-F78 PolarHBondContact OD1-N 3.35Å; F78-R80 VanDerWaalsContact C-N 3.34Å; F78-R80 PolarHBondContact O-N 3.04Å; F78-L81 WeakPolarHBondContact O-CB 3.3Å; F78-L81 PolarHBondContact O-N 2.82Å; F78-C82 PolarHBondContact O-N 3.45Å; F78-C82 PolarHBondContact O-SG 2.65Å; F78-C82 VanDerWaalsContact O-SG 3.37Å
79	L	96.3	Very high	96.5	Very high	4 Å²	4	48 Å²	48	2%	0.021	24%	0.236	C	C	.	.	H	α-helix	trans	-61.4	-42.5	174.6	-73.5	169.4	0	0	0	111.8	L38 Q41 C42 V45 V71 N76 L81 C82 V83	L38-L79 HydrophobicContact CD1-CD1 3.82Å; L38-L79 HydrophobicContact CD1-CD2 4.07Å; L38-L79 HydrophobicContact CD1-CG 3.69Å; Q41-L79 HydrophobicContact CB-CD1 4.42Å; Q41-L79 HydrophobicContact CB-CD2 3.8Å; C42-L79 VanDerWaalsContact SG-CD2 3.51Å; V45-L79 HydrophobicContact CG2-CD2 4.45Å; V71-L79 HydrophobicContact CG1-CB 4.3Å; V71-L79 HydrophobicContact CG1-CD1 4.33Å; N76-L79 PolarHBondContact O-N 2.72Å; N76-L79 WeakPolarHBondContact OD1-CG 3.38Å; N76-L79 PolarHBondContact OD1-N 3.03Å; L79-L81 VanDerWaalsContact C-N 3.27Å; L79-L81 PolarHBondContact O-N 3.18Å; L79-C82 WeakPolarHBondContact O-CB 3.42Å; L79-C82 PolarHBondContact O-N 3.18Å; L79-C82 VanDerWaalsContact O-N 3.12Å; L79-V83 WeakPolarHBondContact O-CG2 3.38Å; L79-V83 PolarHBondContact O-N 3.08Å
80	R	98	Very high	96.4	Very high	36 Å²	36	48.2 Å²	48.2	14%	0.136	24%	0.238	C	C	.	.	H	α-helix	trans	-57.6	-42.1	175.4	-67.7	174	-177.4	141.8	-0.7	111.6	F72 G75 N76 N77 F78 V83 L84 I121	F72-R80 HydrophobicContact CD2-CB 3.87Å; F72-R80 HydrophobicContact CD2-CG 3.95Å; F72-R80 HydrophobicContact CE2-CB 3.67Å; F72-R80 HydrophobicContact CE2-CG 4.04Å; F72-R80 HydrophobicContact CG-CG 4.21Å; F72-R80 HydrophobicContact CZ-CB 4.27Å; F72-R80 HydrophobicContact CZ-CG 4.36Å; F72-R80 WeakPolarHBondContact O-CG 3.11Å; F72-R80 PolarHBondContact O-NE 3.28Å; F72-R80 VanDerWaalsContact O-NE 3.08Å; G75-R80 PolarHBondContact O-NE 3.37Å; G75-R80 PolarHBondContact O-NH2 3.22Å; N76-R80 WeakPolarHBondContact O-CG 3.29Å; N76-R80 PolarHBondContact O-N 3.27Å; N76-R80 VanDerWaalsContact O-N 3.08Å; N77-R80 PolarHBondContact OD1-NH1 3.02Å; F78-R80 VanDerWaalsContact C-N 3.34Å; F78-R80 PolarHBondContact O-N 3.04Å; R80-V83 PolarHBondContact O-N 3.38Å; R80-L84 WeakPolarHBondContact O-CB 3.4Å; R80-L84 PolarHBondContact O-N 2.95Å; R80-I121 HydrophobicContact CB-CD1 4.33Å; R80-I121 HydrophobicContact CB-CG2 3.81Å
81	L	97.9	Very high	96.1	Very high	71 Å²	71	51.6 Å²	51.6	37%	0.372	25%	0.252	S	S	.	.	H	α-helix	trans	-65.2	-42.5	175.2	-177.8	62.9	0	0	0	111.8	N77 F78 L79 V83 L84 K85 I121	N77-L81 WeakPolarHBondContact O-CB 3.35Å; N77-L81 PolarHBondContact O-N 3.28Å; F78-L81 WeakPolarHBondContact O-CB 3.3Å; F78-L81 PolarHBondContact O-N 2.82Å; L79-L81 VanDerWaalsContact C-N 3.27Å; L79-L81 PolarHBondContact O-N 3.18Å; L81-V83 PolarHBondContact O-N 3.05Å; L81-L84 HydrophobicContact CD1-CD2 4.21Å; L81-L84 WeakPolarHBondContact O-CB 3.34Å; L81-L84 PolarHBondContact O-N 3.15Å; L81-K85 WeakPolarHBondContact O-CG 3.49Å; L81-K85 PolarHBondContact O-N 3Å; L81-I121 HydrophobicContact CB-CD1 4.3Å
82	C	97.7	Very high	95.7	Very high	18 Å²	18	55.6 Å²	55.6	12%	0.122	27%	0.268	C	S	.	.	H	α-helix	trans	-59.4	-46.2	174.5	-67.1	0	0	0	0	111.6	V45 F78 L79 L84 K85 V86	V45-C82 HydrophobicContact CB-CB 4.37Å; V45-C82 HydrophobicContact CG1-CB 3.68Å; F78-C82 PolarHBondContact O-N 3.45Å; F78-C82 PolarHBondContact O-SG 2.65Å; F78-C82 VanDerWaalsContact O-SG 3.37Å; L79-C82 WeakPolarHBondContact O-CB 3.42Å; L79-C82 PolarHBondContact O-N 3.18Å; L79-C82 VanDerWaalsContact O-N 3.12Å; C82-L84 VanDerWaalsContact C-N 3.34Å; C82-L84 PolarHBondContact O-N 3.12Å; C82-K85 PolarHBondContact O-N 3.19Å; C82-V86 WeakPolarHBondContact O-CG2 3.18Å; C82-V86 PolarHBondContact O-N 3.05Å
83	V	98.1	Very high	95.3	Very high	1 Å²	1	56 Å²	56	1%	0.006	27%	0.27	C	S	.	.	H	α-helix	trans	-63.7	-40	177.6	176.8	0	0	0	0	111.2	V45 L68 V71 F72 L79 R80 L81 K85 V86 T87 M125	V45-V83 HydrophobicContact CG1-CG2 3.95Å; V45-V83 HydrophobicContact CG2-CG2 4.19Å; L68-V83 HydrophobicContact CB-CG1 3.97Å; L68-V83 HydrophobicContact CD2-CG1 4.38Å; L68-V83 HydrophobicContact CD2-CG2 4.01Å; V71-V83 HydrophobicContact CG1-CG2 4.44Å; F72-V83 HydrophobicContact CB-CG1 4.39Å; F72-V83 HydrophobicContact CD2-CB 4.13Å; F72-V83 HydrophobicContact CD2-CG1 4.12Å; L79-V83 WeakPolarHBondContact O-CG2 3.38Å; L79-V83 PolarHBondContact O-N 3.08Å; R80-V83 PolarHBondContact O-N 3.38Å; L81-V83 PolarHBondContact O-N 3.05Å; V83-K85 PolarHBondContact O-N 3.19Å; V83-V86 PolarHBondContact O-N 3Å; V83-T87 WeakPolarHBondContact O-CB 3.4Å; V83-T87 PolarHBondContact O-N 2.98Å; V83-T87 PolarHBondContact O-OG1 3.43Å; V83-M125 HydrophobicContact CB-CE 4.48Å; V83-M125 HydrophobicContact CG1-CE 3.8Å
84	L	98.3	Very high	95	Very high	3 Å²	3	50.7 Å²	50.7	2%	0.016	25%	0.25	C	C	.	.	H	α-helix	trans	-57.6	-47.3	171.8	172	63.5	0	0	0	111.6	R80 L81 C82 V86 T87 Q88 I121 R124 M125	R80-L84 WeakPolarHBondContact O-CB 3.4Å; R80-L84 PolarHBondContact O-N 2.95Å; L81-L84 HydrophobicContact CD1-CD2 4.21Å; L81-L84 WeakPolarHBondContact O-CB 3.34Å; L81-L84 PolarHBondContact O-N 3.15Å; C82-L84 VanDerWaalsContact C-N 3.34Å; C82-L84 PolarHBondContact O-N 3.12Å; L84-V86 PolarHBondContact O-N 3.08Å; L84-T87 WeakPolarHBondContact O-CB 3.45Å; L84-T87 PolarHBondContact O-N 3.26Å; L84-Q88 HydrophobicContact CD1-CG 4.16Å; L84-Q88 WeakPolarHBondContact O-CG 3.24Å; L84-Q88 PolarHBondContact O-N 3.5Å; L84-I121 HydrophobicContact CB-CG2 4.34Å; L84-I121 HydrophobicContact CD2-CG2 4.18Å; L84-R124 HydrophobicContact CD1-CB 4.03Å; L84-R124 HydrophobicContact CD2-CB 3.59Å; L84-R124 HydrophobicContact CD2-CG 4.49Å; L84-R124 HydrophobicContact CG-CB 4.48Å; L84-M125 HydrophobicContact CB-CE 4.14Å; L84-M125 HydrophobicContact CD1-CB 4.19Å; L84-M125 HydrophobicContact CD1-CE 4.45Å
85	K	98.1	Very high	94.5	Very high	122 Å²	122	48 Å²	48	53%	0.53	23%	0.229	S	C	.	.	H	α-helix	trans	-63.3	-41.2	178.7	-68.5	-64.7	179.6	-171.4	0	112.2	L81 C82 V83 T87 Q88 Q89	L81-K85 WeakPolarHBondContact O-CG 3.49Å; L81-K85 PolarHBondContact O-N 3Å; C82-K85 PolarHBondContact O-N 3.19Å; V83-K85 PolarHBondContact O-N 3.19Å; K85-T87 VanDerWaalsContact C-N 3.33Å; K85-T87 PolarHBondContact O-N 2.71Å; K85-Q88 PolarHBondContact O-N 2.95Å; K85-Q89 WeakPolarHBondContact O-CB 3.43Å; K85-Q89 PolarHBondContact O-N 3.5Å
86	V	97.4	Very high	94.2	Very high	3 Å²	3	47.7 Å²	47.7	2%	0.018	22%	0.224	C	C	.	.	H	α-helix	trans	-61.1	-42.7	174.2	166.7	0	0	0	0	111.3	V45 F48 P49 F52 L68 C82 V83 L84 Q89 S90	V45-V86 HydrophobicContact CG1-CG2 3.77Å; V45-V86 VanDerWaalsContact O-CG2 3.31Å; V45-V86 WeakPolarHBondContact O-CG2 3.22Å; F48-V86 HydrophobicContact CB-CG1 4.14Å; P49-V86 HydrophobicContact CG-CB 4.35Å; P49-V86 HydrophobicContact CG-CG1 4Å; P49-V86 HydrophobicContact CG-CG2 3.99Å; F52-V86 HydrophobicContact CE2-CG1 4.25Å; L68-V86 HydrophobicContact CD1-CG1 4.03Å; C82-V86 WeakPolarHBondContact O-CG2 3.18Å; C82-V86 PolarHBondContact O-N 3.05Å; V83-V86 PolarHBondContact O-N 3Å; L84-V86 PolarHBondContact O-N 3.08Å; V86-Q89 PolarHBondContact O-N 3.46Å; V86-S90 WeakPolarHBondContact O-CB 3.23Å; V86-S90 PolarHBondContact O-N 2.93Å; V86-S90 PolarHBondContact O-OG 3.16Å
87	T	96.9	Very high	94	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.006	21%	0.209	C	C	.	.	H	α-helix	trans	-63.7	-46.8	178	-54.9	0	0	0	0	110.8	V83 L84 K85 Q89 S90 E91 L94 M125 L129	V83-T87 WeakPolarHBondContact O-CB 3.4Å; V83-T87 PolarHBondContact O-N 2.98Å; V83-T87 PolarHBondContact O-OG1 3.43Å; L84-T87 WeakPolarHBondContact O-CB 3.45Å; L84-T87 PolarHBondContact O-N 3.26Å; K85-T87 VanDerWaalsContact C-N 3.33Å; K85-T87 PolarHBondContact O-N 2.71Å; T87-Q89 PolarHBondContact O-N 3.13Å; T87-S90 CarbonylContact O-C 3.57Å; T87-S90 PolarHBondContact O-N 2.83Å; T87-E91 PolarHBondContact O-N 2.91Å; T87-L94 HydrophobicContact CG2-CD1 4.26Å; T87-L94 HydrophobicContact CG2-CD2 3.74Å; T87-M125 HydrophobicContact CG2-SD 3.73Å; T87-M125 WeakPolarHBondContact OG1-CE 3.35Å; T87-L129 HydrophobicContact CG2-CD2 3.86Å
88	Q	95.6	Very high	93.5	Very high	62 Å²	62	47 Å²	47	29%	0.29	22%	0.22	S	C	.	.	H	α-helix	trans	-62.6	-38.9	176.5	-73.6	176.7	-13.9	0	0	112.8	L84 K85 S90 S128	L84-Q88 HydrophobicContact CD1-CG 4.16Å; L84-Q88 WeakPolarHBondContact O-CG 3.24Å; L84-Q88 PolarHBondContact O-N 3.5Å; K85-Q88 PolarHBondContact O-N 2.95Å; Q88-S90 VanDerWaalsContact C-N 3.3Å; Q88-S128 WeakPolarHBondContact CG-OG 3.19Å; Q88-S128 PolarHBondContact NE2-OG 2.81Å
89	Q	95.4	Very high	93.4	Very high	141 Å²	141	45.6 Å²	45.6	66%	0.659	22%	0.218	S	C	*	.	H	α-helix	trans	-70.8	-28	177.4	-176	178.4	2.7	0	0	112.4	P49 K85 V86 T87	P49-Q89 HydrophobicContact CB-CG 4.48Å; K85-Q89 WeakPolarHBondContact O-CB 3.43Å; K85-Q89 PolarHBondContact O-N 3.5Å; V86-Q89 PolarHBondContact O-N 3.46Å; T87-Q89 PolarHBondContact O-N 3.13Å
90	S	94.1	Very high	93.3	Very high	4 Å²	4	47 Å²	47	3%	0.028	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	27.1	-171.6	-47.1	0	0	0	0	112.7	V86 T87 Q88 K92 H93	V86-S90 WeakPolarHBondContact O-CB 3.23Å; V86-S90 PolarHBondContact O-N 2.93Å; V86-S90 PolarHBondContact O-OG 3.16Å; T87-S90 CarbonylContact O-C 3.57Å; T87-S90 PolarHBondContact O-N 2.83Å; Q88-S90 VanDerWaalsContact C-N 3.3Å; S90-K92 VanDerWaalsContact C-N 3.29Å; S90-K92 PolarHBondContact O-N 3Å; S90-H93 WeakPolarHBondContact O-CB 3.49Å; S90-H93 PolarHBondContact O-N 3.32Å
91	E	91	Very high	93.1	Very high	125 Å²	125	50.6 Å²	50.6	58%	0.584	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-49.8	-45.6	-175.1	-174.8	-174.2	-174.9	0	0	112.9	T87 H93 L94	T87-E91 PolarHBondContact O-N 2.91Å; E91-H93 PolarHBondContact O-N 2.98Å; E91-L94 HydrophobicContact CG-CD1 4.37Å; E91-L94 WeakPolarHBondContact O-CB 3.23Å; E91-L94 WeakPolarHBondContact O-CG 3.35Å; E91-L94 PolarHBondContact O-N 3.25Å
92	K	87.3	Confident	93	Very high	101 Å²	101	50.6 Å²	50.6	44%	0.439	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-60.1	-8.5	178.3	66.2	174.3	-178.4	173.4	0	115.4	S90	S90-K92 VanDerWaalsContact C-N 3.29Å; S90-K92 PolarHBondContact O-N 3Å
93	H	89.3	Confident	93	Very high	10 Å²	10	49.9 Å²	49.9	5%	0.046	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-106.8	-8.4	179.3	-62.7	-45.8	0	0	0	113.1	I61 S90 E91 E95 K96	I61-H93 HydrophobicContact CD1-CB 4.13Å; I61-H93 HydrophobicContact CG2-CB 4.44Å; S90-H93 WeakPolarHBondContact O-CB 3.49Å; S90-H93 PolarHBondContact O-N 3.32Å; E91-H93 PolarHBondContact O-N 2.98Å; H93-E95 PolarHBondContact O-N 3.36Å; H93-K96 WeakPolarHBondContact O-CB 3.4Å; H93-K96 PolarHBondContact O-N 3.47Å; H93-K96 VanDerWaalsContact O-N 3.13Å
94	L	89.9	Confident	92.9	Very high	1 Å²	1	50 Å²	50	1%	0.005	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-65.5	-36.1	-173.7	-66.3	176.1	0	0	0	113.2	F65 T87 E91 K96 I97 S128 L129 I132	F65-L94 HydrophobicContact CE1-CD2 3.71Å; F65-L94 HydrophobicContact CE2-CD2 4.23Å; F65-L94 HydrophobicContact CZ-CD2 3.52Å; T87-L94 HydrophobicContact CG2-CD1 4.26Å; T87-L94 HydrophobicContact CG2-CD2 3.74Å; E91-L94 HydrophobicContact CG-CD1 4.37Å; E91-L94 WeakPolarHBondContact O-CB 3.23Å; E91-L94 WeakPolarHBondContact O-CG 3.35Å; E91-L94 PolarHBondContact O-N 3.25Å; L94-K96 PolarHBondContact O-N 3.46Å; L94-K96 VanDerWaalsContact O-N 3.15Å; L94-I97 HydrophobicContact CD2-CD1 4.19Å; L94-I97 WeakPolarHBondContact O-CB 3.41Å; L94-I97 WeakPolarHBondContact O-CD1 3.34Å; L94-I97 VanDerWaalsContact O-CG1 3.22Å; L94-I97 WeakPolarHBondContact O-CG1 3.32Å; L94-I97 PolarHBondContact O-N 2.89Å; L94-I97 VanDerWaalsContact O-N 3.17Å; L94-S128 WeakPolarHBondContact CD1-O 3.24Å; L94-L129 HydrophobicContact CD1-CD2 4.2Å; L94-L129 HydrophobicContact CD2-CD2 3.98Å; L94-I132 HydrophobicContact CB-CG2 4.13Å
95	E	83.5	Confident	92.9	Very high	63 Å²	63	56.7 Å²	56.7	29%	0.294	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-68.6	-12	178.3	-64	151.4	-173	0	0	113.1	H93 I97 I132 H884 N885	H93-E95 PolarHBondContact O-N 3.36Å; E95-I97 VanDerWaalsContact C-N 3.26Å; E95-I132 HydrophobicContact CB-CG2 4.43Å; E95-I132 HydrophobicContact CG-CG2 3.87Å; E95-H884 IonicContact OE1-CE1 2.95Å; E95-H884 PolarHBondContact OE1-CE1 3.4Å; E95-H884 IonicContact OE1-ND1 4Å; E95-H884 PolarHBondContact OE1-ND1 3.44Å; E95-H884 IonicContact OE2-CE1 2.64Å; E95-H884 PolarHBondContact OE2-CE1 2.8Å; E95-H884 VanDerWaalsContact OE2-CE1 3.24Å; E95-H884 IonicContact OE2-CG 2.91Å; E95-H884 IonicContact OE2-ND1 3.69Å; E95-H884 PolarHBondContact OE2-ND1 2.96Å; E95-N885 PolarHBondContact OE1-ND2 3.25Å; E95-N885 PolarHBondContact OE2-ND2 2.91Å
96	K	86	Confident	92.9	Very high	7 Å²	7	52.8 Å²	52.8	3%	0.03	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-86.3	2.3	177.5	-51.8	179.5	-179.5	-162.3	0	112.3	P56 P58 I61 H93 L94 Y887	P56-K96 PolarHBondContact O-NZ 2.91Å; P58-K96 HydrophobicContact CB-CB 4.46Å; I61-K96 HydrophobicContact CB-CB 4.46Å; I61-K96 HydrophobicContact CD1-CB 4.13Å; I61-K96 HydrophobicContact CD1-CD 3.49Å; I61-K96 VanDerWaalsContact CD1-CD 3.49Å; I61-K96 HydrophobicContact CD1-CG 4.43Å; I61-K96 HydrophobicContact CG2-CB 4.11Å; H93-K96 WeakPolarHBondContact O-CB 3.4Å; H93-K96 PolarHBondContact O-N 3.47Å; H93-K96 VanDerWaalsContact O-N 3.13Å; L94-K96 PolarHBondContact O-N 3.46Å; L94-K96 VanDerWaalsContact O-N 3.15Å; K96-Y887 HydrophobicContact CG-CG 4.45Å
97	I	89.3	Confident	92.9	Very high	9 Å²	9	52.6 Å²	52.6	5%	0.046	25%	0.252	C	S	.	.			trans	-76.6	121.7	174.6	-61.7	170.7	0	0	0	108.5	F65 L94 E95 V100 F103 I132	F65-I97 HydrophobicContact CB-CD1 3.91Å; F65-I97 HydrophobicContact CB-CG1 4.07Å; F65-I97 HydrophobicContact CD1-CD1 4.07Å; F65-I97 HydrophobicContact CD2-CD1 3.68Å; F65-I97 HydrophobicContact CD2-CG1 3.62Å; F65-I97 HydrophobicContact CE2-CD1 4.19Å; F65-I97 HydrophobicContact CE2-CG1 4.28Å; F65-I97 HydrophobicContact CG-CD1 3.62Å; F65-I97 HydrophobicContact CG-CG1 3.95Å; L94-I97 HydrophobicContact CD2-CD1 4.19Å; L94-I97 WeakPolarHBondContact O-CB 3.41Å; L94-I97 WeakPolarHBondContact O-CD1 3.34Å; L94-I97 VanDerWaalsContact O-CG1 3.22Å; L94-I97 WeakPolarHBondContact O-CG1 3.32Å; L94-I97 PolarHBondContact O-N 2.89Å; L94-I97 VanDerWaalsContact O-N 3.17Å; E95-I97 VanDerWaalsContact C-N 3.26Å; I97-V100 HydrophobicContact CB-CG2 4.37Å; I97-V100 HydrophobicContact CG2-CG2 4.12Å; I97-V100 WeakPolarHBondContact O-CG2 3.47Å; I97-F103 HydrophobicContact CD1-CD1 4.35Å; I97-F103 HydrophobicContact CD1-CE1 4.26Å; I97-F103 HydrophobicContact CG2-CB 4.47Å; I97-I132 HydrophobicContact CD1-CD1 4.22Å
98	L	87.3	Confident	92.9	Very high	88 Å²	88	54.1 Å²	54.1	46%	0.461	26%	0.259	S	S	.	.	S	Bend	trans	-84.8	-45.4	-178.6	-56	175.9	0	0	0	111.2	P58 N62 V100	P58-L98 HydrophobicContact CB-CD2 4.3Å; P58-L98 HydrophobicContact CB-CG 4.49Å; N62-L98 HydrophobicContact CB-CB 4.32Å; N62-L98 HydrophobicContact CB-CD1 4.47Å; N62-L98 HydrophobicContact CB-CG 4.2Å; N62-L98 PolarHBondContact OD1-N 3.03Å; L98-V100 VanDerWaalsContact C-N 3.33Å; L98-V100 PolarHBondContact O-N 3.38Å
99	N	93.3	Very high	93	Very high	87 Å²	87	53.8 Å²	53.8	47%	0.465	26%	0.263	S	S	.	.			trans	-93.5	59.6	-177	-69.1	-25.4	0	0	0	111.3	N62 L66 D101 E102 F103	N62-N99 PolarHBondContact OD1-N 3.45Å; L66-N99 HydrophobicContact CD1-CB 4.22Å; L66-N99 HydrophobicContact CD2-CB 4.27Å; N99-D101 VanDerWaalsContact C-N 3.32Å; N99-D101 PolarHBondContact O-N 3.26Å; N99-E102 PolarHBondContact O-N 3.18Å; N99-F103 WeakPolarHBondContact O-CB 3.41Å; N99-F103 PolarHBondContact O-N 2.62Å; N99-F103 VanDerWaalsContact O-N 3.13Å
100	V	94.7	Very high	93.1	Very high	34 Å²	34	47.5 Å²	47.5	21%	0.206	23%	0.234	C	C	.	.	H	α-helix	trans	-58.4	-42	-176	-179.2	0	0	0	0	111.8	I97 L98 E102 F103 V104 I132 I133	I97-V100 HydrophobicContact CB-CG2 4.37Å; I97-V100 HydrophobicContact CG2-CG2 4.12Å; I97-V100 WeakPolarHBondContact O-CG2 3.47Å; L98-V100 VanDerWaalsContact C-N 3.33Å; L98-V100 PolarHBondContact O-N 3.38Å; V100-E102 PolarHBondContact O-N 3.01Å; V100-F103 PolarHBondContact O-N 2.93Å; V100-V104 HydrophobicContact CG1-CG2 3.95Å; V100-V104 WeakPolarHBondContact O-CB 3.32Å; V100-V104 WeakPolarHBondContact O-CG2 3.25Å; V100-V104 PolarHBondContact O-N 3.07Å; V100-I132 HydrophobicContact CG1-CD1 4.33Å; V100-I133 HydrophobicContact CG1-CG2 3.6Å
101	D	94.6	Very high	93.2	Very high	111 Å²	111	47.8 Å²	47.8	59%	0.594	24%	0.236	S	C	*	.	H	α-helix	trans	-61.5	-46.2	-177.3	-78.1	-29.1	0	0	0	113.5	N99 V104 K105 R136	N99-D101 VanDerWaalsContact C-N 3.32Å; N99-D101 PolarHBondContact O-N 3.26Å; D101-V104 PolarHBondContact O-N 2.86Å; D101-K105 VanDerWaalsContact O-CB 3.27Å; D101-K105 WeakPolarHBondContact O-CB 3.46Å; D101-K105 PolarHBondContact O-N 2.72Å; D101-R136 IonicContact OD1-CZ 3.73Å; D101-R136 IonicContact OD1-NH1 3.8Å; D101-R136 PolarHBondContact OD1-NH1 3.49Å; D101-R136 IonicContact OD1-NH2 2.62Å
102	E	96	Very high	93.4	Very high	72 Å²	72	48.9 Å²	48.9	34%	0.336	24%	0.24	S	C	.	.	H	α-helix	trans	-70.4	-40.4	-179.6	-179	57.5	-160.5	0	0	111.1	L66 N99 V100 K105 R106	L66-E102 HydrophobicContact CD2-CB 4.42Å; L66-E102 HydrophobicContact CD2-CG 4.26Å; N99-E102 PolarHBondContact O-N 3.18Å; V100-E102 PolarHBondContact O-N 3.01Å; E102-K105 PolarHBondContact O-N 2.87Å; E102-R106 WeakPolarHBondContact O-CG 3.48Å; E102-R106 PolarHBondContact O-N 3.44Å; E102-R106 VanDerWaalsContact O-N 3.14Å; E102-R106 IonicContact OE1-CZ 2.98Å; E102-R106 IonicContact OE1-NE 3.73Å; E102-R106 PolarHBondContact OE1-NE 3.45Å; E102-R106 IonicContact OE1-NH2 3.39Å; E102-R106 PolarHBondContact OE1-NH2 3.31Å
103	F	97.1	Very high	93.8	Very high	2 Å²	2	45.8 Å²	45.8	1%	0.009	23%	0.232	C	C	.	.	H	α-helix	trans	-56.8	-51.8	173	176.5	-103.5	0	0	0	111.2	F65 L66 A69 I97 N99 V100 K105 R106 I107 L129	F65-F103 HydrophobicContact CB-CD2 4.04Å; F65-F103 HydrophobicContact CB-CE2 3.86Å; F65-F103 AromaticContact CD1-CE2 3.93Å; F65-F103 HydrophobicContact CD1-CE2 3.93Å; F65-F103 HydrophobicContact CD1-CZ 4Å; F65-F103 HydrophobicContact CG-CE2 4.34Å; F65-F103 VanDerWaalsContact O-CD2 3.31Å; F65-F103 WeakPolarHBondContact O-CD2 3.45Å; F65-F103 VanDerWaalsContact O-CE2 3.23Å; F65-F103 WeakPolarHBondContact O-CE2 3.24Å; L66-F103 HydrophobicContact CD2-CB 4.16Å; A69-F103 HydrophobicContact CB-CD2 3.5Å; A69-F103 HydrophobicContact CB-CE2 3.71Å; A69-F103 HydrophobicContact CB-CG 4.45Å; I97-F103 HydrophobicContact CD1-CD1 4.35Å; I97-F103 HydrophobicContact CD1-CE1 4.26Å; I97-F103 HydrophobicContact CG2-CB 4.47Å; N99-F103 WeakPolarHBondContact O-CB 3.41Å; N99-F103 PolarHBondContact O-N 2.62Å; N99-F103 VanDerWaalsContact O-N 3.13Å; V100-F103 PolarHBondContact O-N 2.93Å; F103-K105 PolarHBondContact O-N 3Å; F103-R106 PolarHBondContact O-N 2.94Å; F103-I107 HydrophobicContact CE1-CG1 4.26Å; F103-I107 HydrophobicContact CE2-CG1 4.4Å; F103-I107 HydrophobicContact CZ-CD1 4.45Å; F103-I107 HydrophobicContact CZ-CG1 4.14Å; F103-I107 WeakPolarHBondContact O-CG1 3.42Å; F103-I107 PolarHBondContact O-N 2.94Å; F103-I107 VanDerWaalsContact O-N 3.13Å; F103-L129 HydrophobicContact CD1-CD1 4.41Å; F103-L129 HydrophobicContact CE1-CD1 3.59Å; F103-L129 HydrophobicContact CE1-CD2 3.73Å; F103-L129 HydrophobicContact CE1-CG 4.31Å; F103-L129 HydrophobicContact CZ-CD1 4.39Å; F103-L129 HydrophobicContact CZ-CD2 4.32Å
104	V	96.9	Very high	94	Very high	4 Å²	4	52.8 Å²	52.8	2%	0.024	27%	0.269	C	S	.	.	H	α-helix	trans	-65.9	-39.9	-178.4	174.3	0	0	0	0	111.4	V100 D101 R106 I107 F108 I133	V100-V104 HydrophobicContact CG1-CG2 3.95Å; V100-V104 WeakPolarHBondContact O-CB 3.32Å; V100-V104 WeakPolarHBondContact O-CG2 3.25Å; V100-V104 PolarHBondContact O-N 3.07Å; D101-V104 PolarHBondContact O-N 2.86Å; V104-R106 VanDerWaalsContact C-N 3.31Å; V104-R106 PolarHBondContact O-N 3.12Å; V104-I107 PolarHBondContact O-N 3.17Å; V104-F108 WeakPolarHBondContact O-CB 3.4Å; V104-F108 PolarHBondContact O-N 2.89Å; V104-I133 HydrophobicContact CG1-CD1 4.27Å; V104-I133 HydrophobicContact CG2-CD1 4.19Å; V104-I133 HydrophobicContact CG2-CG2 3.71Å
105	K	97.1	Very high	94.4	Very high	143 Å²	143	55.1 Å²	55.1	62%	0.622	28%	0.282	S	S	*	.	H	α-helix	trans	-57.4	-43.8	176.2	-179.1	-178	176.3	-174.1	0	111.7	D101 E102 F103 S109	D101-K105 VanDerWaalsContact O-CB 3.27Å; D101-K105 WeakPolarHBondContact O-CB 3.46Å; D101-K105 PolarHBondContact O-N 2.72Å; E102-K105 PolarHBondContact O-N 2.87Å; F103-K105 PolarHBondContact O-N 3Å; K105-S109 PolarHBondContact O-N 3.31Å; K105-S109 VanDerWaalsContact O-N 3.09Å
106	R	97.8	Very high	95	Very high	40 Å²	40	53.6 Å²	53.6	15%	0.151	28%	0.277	C	S	.	.	H	α-helix	trans	-65.1	-46.5	177.9	-69.1	168.5	-169	-162.5	-4.8	112	L66 A69 D70 E102 F103 V104 S109	L66-R106 PolarHBondContact O-NH1 3.26Å; L66-R106 VanDerWaalsContact O-NH1 3.07Å; A69-R106 HydrophobicContact CB-CB 3.86Å; D70-R106 IonicContact OD1-CZ 3.81Å; D70-R106 IonicContact OD1-NE 3.33Å; D70-R106 IonicContact OD1-NH1 3.08Å; D70-R106 PolarHBondContact OD1-NH1 3.45Å; D70-R106 VanDerWaalsContact OD1-NH1 3.16Å; D70-R106 IonicContact OD2-CZ 3.1Å; D70-R106 IonicContact OD2-NH1 3.95Å; D70-R106 PolarHBondContact OD2-NH1 2.92Å; E102-R106 WeakPolarHBondContact O-CG 3.48Å; E102-R106 PolarHBondContact O-N 3.44Å; E102-R106 VanDerWaalsContact O-N 3.14Å; E102-R106 IonicContact OE1-CZ 2.98Å; E102-R106 IonicContact OE1-NE 3.73Å; E102-R106 PolarHBondContact OE1-NE 3.45Å; E102-R106 IonicContact OE1-NH2 3.39Å; E102-R106 PolarHBondContact OE1-NH2 3.31Å; F103-R106 PolarHBondContact O-N 2.94Å; V104-R106 VanDerWaalsContact C-N 3.31Å; V104-R106 PolarHBondContact O-N 3.12Å; R106-S109 PolarHBondContact O-OG 2.87Å
107	I	97.8	Very high	95.6	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-60.6	-50.2	175.7	-64.7	-57.1	0	0	0	111.1	A69 F72 F103 V104 S109 V110 T122 M125 L126	A69-I107 HydrophobicContact CB-CD1 4.08Å; A69-I107 HydrophobicContact CB-CG1 4.35Å; F72-I107 HydrophobicContact CB-CD1 3.73Å; F72-I107 HydrophobicContact CD1-CD1 3.49Å; F72-I107 VanDerWaalsContact CD1-CD1 3.49Å; F72-I107 HydrophobicContact CD1-CG2 4.48Å; F72-I107 HydrophobicContact CD2-CD1 4.15Å; F72-I107 HydrophobicContact CE1-CD1 4.13Å; F72-I107 HydrophobicContact CE1-CG2 4.13Å; F72-I107 HydrophobicContact CG-CD1 3.51Å; F103-I107 HydrophobicContact CE1-CG1 4.26Å; F103-I107 HydrophobicContact CE2-CG1 4.4Å; F103-I107 HydrophobicContact CZ-CD1 4.45Å; F103-I107 HydrophobicContact CZ-CG1 4.14Å; F103-I107 WeakPolarHBondContact O-CG1 3.42Å; F103-I107 PolarHBondContact O-N 2.94Å; F103-I107 VanDerWaalsContact O-N 3.13Å; V104-I107 PolarHBondContact O-N 3.17Å; I107-S109 VanDerWaalsContact C-N 3.27Å; I107-S109 PolarHBondContact O-N 3.32Å; I107-V110 PolarHBondContact O-N 3.42Å; I107-T122 HydrophobicContact CG2-CG2 4.27Å; I107-T122 WeakPolarHBondContact O-CG2 3.32Å; I107-M125 HydrophobicContact CD1-CG 4.23Å; I107-M125 HydrophobicContact CG1-CG 4.36Å; I107-M125 HydrophobicContact CG2-CB 4.21Å; I107-M125 HydrophobicContact CG2-CG 3.49Å; I107-M125 VanDerWaalsContact CG2-CG 3.49Å; I107-L126 HydrophobicContact CG2-CD2 4.26Å
108	F	97.4	Very high	95.9	Very high	32 Å²	32	55.8 Å²	55.8	14%	0.14	29%	0.292	C	S	.	.	H	α-helix	trans	-65.4	-29.9	-174.1	-166.6	-94.2	0	0	0	112.3	V104 V110 I111 H112 L126 N138	V104-F108 WeakPolarHBondContact O-CB 3.4Å; V104-F108 PolarHBondContact O-N 2.89Å; F108-V110 PolarHBondContact O-N 2.9Å; F108-I111 HydrophobicContact CD1-CG2 4.06Å; F108-I111 HydrophobicContact CD2-CG2 4.26Å; F108-I111 HydrophobicContact CE1-CG2 3.82Å; F108-I111 HydrophobicContact CE2-CG2 4.02Å; F108-I111 HydrophobicContact CG-CG2 4.28Å; F108-I111 HydrophobicContact CZ-CG2 3.8Å; F108-I111 WeakPolarHBondContact O-CB 3.27Å; F108-I111 WeakPolarHBondContact O-CG2 3.31Å; F108-I111 PolarHBondContact O-N 3.43Å; F108-H112 AromaticContact CE1-CE1 3.95Å; F108-H112 AromaticContact CE1-NE2 3.51Å; F108-L126 HydrophobicContact CD2-CD1 3.94Å; F108-L126 HydrophobicContact CD2-CD2 4.3Å; F108-L126 HydrophobicContact CE2-CD1 4.19Å; F108-N138 HydrophobicContact CE1-CB 4.28Å; F108-N138 HydrophobicContact CE2-CB 4.26Å; F108-N138 HydrophobicContact CZ-CB 3.87Å
109	S	97.1	Very high	96.5	Very high	56 Å²	56	54 Å²	54	39%	0.392	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-55.5	-24.9	179.8	70.2	0	0	0	0	114.6	K105 R106 I107	K105-S109 PolarHBondContact O-N 3.31Å; K105-S109 VanDerWaalsContact O-N 3.09Å; R106-S109 PolarHBondContact O-OG 2.87Å; I107-S109 VanDerWaalsContact C-N 3.27Å; I107-S109 PolarHBondContact O-N 3.32Å
110	V	97.2	Very high	96.7	Very high	8 Å²	8	50 Å²	50	5%	0.048	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-77.1	-20	179.4	-174.6	0	0	0	0	112.8	F72 I107 F108 H112 S113 A118	F72-V110 HydrophobicContact CD1-CG2 3.95Å; F72-V110 HydrophobicContact CE1-CB 4.14Å; F72-V110 HydrophobicContact CE1-CG1 4.48Å; F72-V110 HydrophobicContact CE1-CG2 3.96Å; I107-V110 PolarHBondContact O-N 3.42Å; F108-V110 PolarHBondContact O-N 2.9Å; V110-H112 PolarHBondContact O-N 2.97Å; V110-S113 WeakPolarHBondContact O-CB 3.5Å; V110-S113 PolarHBondContact O-N 3.43Å; V110-S113 VanDerWaalsContact O-N 3.14Å; V110-S113 PolarHBondContact O-OG 3.03Å; V110-A118 HydrophobicContact CG1-CB 4.13Å
111	I	97.1	Very high	96.9	Very high	11 Å²	11	49 Å²	49	6%	0.056	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-69.3	-19.6	-175.4	-152.7	149.9	0	0	0	113.5	F108 S113 R119 T122 L123 L126	F108-I111 HydrophobicContact CD1-CG2 4.06Å; F108-I111 HydrophobicContact CD2-CG2 4.26Å; F108-I111 HydrophobicContact CE1-CG2 3.82Å; F108-I111 HydrophobicContact CE2-CG2 4.02Å; F108-I111 HydrophobicContact CG-CG2 4.28Å; F108-I111 HydrophobicContact CZ-CG2 3.8Å; F108-I111 WeakPolarHBondContact O-CB 3.27Å; F108-I111 WeakPolarHBondContact O-CG2 3.31Å; F108-I111 PolarHBondContact O-N 3.43Å; I111-S113 VanDerWaalsContact C-N 3.26Å; I111-S113 PolarHBondContact O-N 3.28Å; I111-R119 WeakPolarHBondContact O-CD 3.3Å; I111-R119 WeakPolarHBondContact O-CG 3.4Å; I111-T122 HydrophobicContact CB-CG2 3.97Å; I111-T122 HydrophobicContact CD1-CG2 4.15Å; I111-T122 HydrophobicContact CG1-CG2 4.34Å; I111-L123 HydrophobicContact CD1-CD2 3.86Å; I111-L123 HydrophobicContact CD1-CG 4.06Å; I111-L126 HydrophobicContact CD1-CD1 3.81Å
112	H	94.9	Very high	97.1	Very high	147 Å²	147	43.8 Å²	43.8	68%	0.681	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-86.1	5.7	177.1	-58.2	-56.1	0	0	0	113.2	F108 V110	F108-H112 AromaticContact CE1-CE1 3.95Å; F108-H112 AromaticContact CE1-NE2 3.51Å; V110-H112 PolarHBondContact O-N 2.97Å
113	S	94.9	Very high	97.2	Very high	37 Å²	37	40.3 Å²	40.3	26%	0.259	21%	0.207	S	C	.	.	S	Bend	trans	-69.5	154.1	173.8	63.5	0	0	0	0	111.9	V110 I111 D115 R119	V110-S113 WeakPolarHBondContact O-CB 3.5Å; V110-S113 PolarHBondContact O-N 3.43Å; V110-S113 VanDerWaalsContact O-N 3.14Å; V110-S113 PolarHBondContact O-OG 3.03Å; I111-S113 VanDerWaalsContact C-N 3.26Å; I111-S113 PolarHBondContact O-N 3.28Å; S113-D115 VanDerWaalsContact C-N 3.26Å; S113-R119 VanDerWaalsContact O-CD 3.24Å; S113-R119 WeakPolarHBondContact O-CD 3.45Å; S113-R119 PolarHBondContact O-NE 3.48Å
114	N	94.5	Very high	97.3	Very high	156 Å²	156	43.9 Å²	43.9	83%	0.834	22%	0.221	S	C	*	.	S	Bend	trans	-78.8	-7.8	172.8	60.9	-30.8	0	0	0	113.4	P116	N114-P116 WeakPolarHBondContact O-CD 3.43Å
115	D	96.8	Very high	97.4	Very high	51 Å²	51	43.7 Å²	43.7	27%	0.273	22%	0.22	S	C	.	.			trans	-83.8	113	179.5	175.1	4.7	0	0	0	110.8	N77 S113 V117 A118 R119	N77-D115 PolarHBondContact ND2-OD2 2.7Å; S113-D115 VanDerWaalsContact C-N 3.26Å; D115-V117 PolarHBondContact O-N 2.83Å; D115-V117 WeakPolarHBondContact OD1-CB 3.31Å; D115-V117 PolarHBondContact OD1-N 2.69Å; D115-A118 HydrophobicContact CB-CB 3.9Å; D115-A118 PolarHBondContact O-N 3.3Å; D115-R119 PolarHBondContact O-N 3.33Å
116	P	96.8	Very high	97.4	Very high	30 Å²	30	36.9 Å²	36.9	20%	0.195	19%	0.19	C	C	.	.	H	α-helix	trans	-63.8	-27.7	-179.2	26.3	-33.9	0	0	0	113.3	N114 A120 D151 V153	N114-P116 WeakPolarHBondContact O-CD 3.43Å; P116-A120 WeakPolarHBondContact O-CB 3.44Å; P116-A120 PolarHBondContact O-N 3.2Å; P116-D151 HydrophobicContact CB-CB 3.73Å; P116-D151 VanDerWaalsContact CB-CG 3.44Å; P116-D151 WeakPolarHBondContact CB-OD2 3.4Å; P116-V153 HydrophobicContact CB-CG1 4.44Å
117	V	97.9	Very high	97.4	Very high	62 Å²	62	35.1 Å²	35.1	38%	0.376	18%	0.184	S	C	.	.	H	α-helix	trans	-71.8	-42.6	177.4	-179.6	0	0	0	0	110.2	N77 D115 A120 I121	N77-V117 HydrophobicContact CB-CG1 4.37Å; D115-V117 PolarHBondContact O-N 2.83Å; D115-V117 WeakPolarHBondContact OD1-CB 3.31Å; D115-V117 PolarHBondContact OD1-N 2.69Å; V117-A120 PolarHBondContact O-N 3.4Å; V117-I121 HydrophobicContact CG1-CD1 3.99Å; V117-I121 VanDerWaalsContact O-CG1 3.3Å; V117-I121 WeakPolarHBondContact O-CG1 3.16Å; V117-I121 PolarHBondContact O-N 3.27Å
118	A	97.6	Very high	97.4	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.008	19%	0.191	C	C	.	.	H	α-helix	trans	-62	-44	174.8	0	0	0	0	0	111.5	N77 V110 D115 I121 T122	N77-A118 WeakPolarHBondContact OD1-CB 3.49Å; V110-A118 HydrophobicContact CG1-CB 4.13Å; D115-A118 HydrophobicContact CB-CB 3.9Å; D115-A118 PolarHBondContact O-N 3.3Å; A118-I121 PolarHBondContact O-N 3.37Å; A118-T122 WeakPolarHBondContact O-CB 3.1Å; A118-T122 PolarHBondContact O-N 2.95Å; A118-T122 PolarHBondContact O-OG1 2.94Å
119	R	98.1	Very high	97.4	Very high	50 Å²	50	34.6 Å²	34.6	19%	0.189	18%	0.184	C	C	.	.	H	α-helix	trans	-60.9	-45.6	173.8	-69.3	-171.5	-73	147.6	0.8	112	I111 S113 D115 I121 T122 L123 D151 E154	I111-R119 WeakPolarHBondContact O-CD 3.3Å; I111-R119 WeakPolarHBondContact O-CG 3.4Å; S113-R119 VanDerWaalsContact O-CD 3.24Å; S113-R119 WeakPolarHBondContact O-CD 3.45Å; S113-R119 PolarHBondContact O-NE 3.48Å; D115-R119 PolarHBondContact O-N 3.33Å; R119-I121 PolarHBondContact O-N 3.3Å; R119-T122 WeakPolarHBondContact O-CB 2.91Å; R119-T122 PolarHBondContact O-N 3.48Å; R119-T122 VanDerWaalsContact O-N 3.16Å; R119-L123 WeakPolarHBondContact O-CG 3.37Å; R119-L123 PolarHBondContact O-N 2.88Å; R119-D151 IonicContact NH2-OD2 3.07Å; R119-D151 PolarHBondContact NH2-OD2 2.96Å; R119-E154 HydrophobicContact CB-CG 4.31Å; R119-E154 VanDerWaalsContact CZ-CD 3.44Å; R119-E154 IonicContact CZ-OE1 2.78Å; R119-E154 IonicContact CZ-OE2 3.8Å; R119-E154 IonicContact NE-OE1 2.76Å; R119-E154 IonicContact NE-OE2 3.15Å; R119-E154 IonicContact NH1-OE1 2.62Å; R119-E154 PolarHBondContact NH1-OE1 3.42Å; R119-E154 IonicContact NH1-OE2 2.68Å; R119-E154 PolarHBondContact NH1-OE2 3.47Å; R119-E154 IonicContact NH2-OE2 3.39Å; R119-E154 PolarHBondContact NH2-OE2 3.21Å; R119-E154 VanDerWaalsContact NH2-OE2 3.1Å
120	A	98.5	Very high	97.4	Very high	4 Å²	4	32 Å²	32	3%	0.033	17%	0.167	C	C	.	.	H	α-helix	trans	-60.8	-45.1	177.3	0	0	0	0	0	112.8	P116 V117 T122 L123 R124 V153 A157	P116-A120 WeakPolarHBondContact O-CB 3.44Å; P116-A120 PolarHBondContact O-N 3.2Å; V117-A120 PolarHBondContact O-N 3.4Å; A120-T122 VanDerWaalsContact C-N 3.28Å; A120-T122 PolarHBondContact O-N 3.37Å; A120-L123 PolarHBondContact O-N 2.76Å; A120-R124 WeakPolarHBondContact O-CG 3.4Å; A120-R124 PolarHBondContact O-N 2.96Å; A120-V153 HydrophobicContact CB-CG1 4.38Å; A120-V153 HydrophobicContact CB-CG2 4.04Å; A120-V153 WeakPolarHBondContact CB-O 3.16Å; A120-A157 HydrophobicContact CB-CB 3.74Å; A120-A157 WeakPolarHBondContact O-CB 3.27Å
121	I	98.6	Very high	97.2	Very high	13 Å²	13	33.5 Å²	33.5	7%	0.067	18%	0.178	C	C	.	.	H	α-helix	trans	-62.9	-39.8	175.7	-65.2	166.1	0	0	0	110.2	F72 N77 R80 L81 L84 V117 A118 R119 R124 M125	F72-I121 HydrophobicContact CE2-CG2 3.85Å; F72-I121 HydrophobicContact CZ-CG2 4.07Å; N77-I121 HydrophobicContact CB-CD1 4.07Å; N77-I121 WeakPolarHBondContact O-CD1 3.25Å; R80-I121 HydrophobicContact CB-CD1 4.33Å; R80-I121 HydrophobicContact CB-CG2 3.81Å; L81-I121 HydrophobicContact CB-CD1 4.3Å; L84-I121 HydrophobicContact CB-CG2 4.34Å; L84-I121 HydrophobicContact CD2-CG2 4.18Å; V117-I121 HydrophobicContact CG1-CD1 3.99Å; V117-I121 VanDerWaalsContact O-CG1 3.3Å; V117-I121 WeakPolarHBondContact O-CG1 3.16Å; V117-I121 PolarHBondContact O-N 3.27Å; A118-I121 PolarHBondContact O-N 3.37Å; R119-I121 PolarHBondContact O-N 3.3Å; I121-R124 PolarHBondContact O-N 3.48Å; I121-M125 WeakPolarHBondContact O-CB 3.47Å; I121-M125 PolarHBondContact O-N 3.23Å
122	T	98.6	Very high	97	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-65.2	-43.2	177.9	-52.1	0	0	0	0	111.9	F72 I107 I111 A118 R119 A120 R124 M125 L126	F72-T122 HydrophobicContact CE1-CG2 4.35Å; I107-T122 HydrophobicContact CG2-CG2 4.27Å; I107-T122 WeakPolarHBondContact O-CG2 3.32Å; I111-T122 HydrophobicContact CB-CG2 3.97Å; I111-T122 HydrophobicContact CD1-CG2 4.15Å; I111-T122 HydrophobicContact CG1-CG2 4.34Å; A118-T122 WeakPolarHBondContact O-CB 3.1Å; A118-T122 PolarHBondContact O-N 2.95Å; A118-T122 PolarHBondContact O-OG1 2.94Å; R119-T122 WeakPolarHBondContact O-CB 2.91Å; R119-T122 PolarHBondContact O-N 3.48Å; R119-T122 VanDerWaalsContact O-N 3.16Å; A120-T122 VanDerWaalsContact C-N 3.28Å; A120-T122 PolarHBondContact O-N 3.37Å; T122-R124 PolarHBondContact O-N 2.72Å; T122-M125 WeakPolarHBondContact O-CB 3.45Å; T122-M125 PolarHBondContact O-N 3.46Å; T122-M125 VanDerWaalsContact O-N 3.15Å; T122-L126 WeakPolarHBondContact O-CG 3.39Å; T122-L126 PolarHBondContact O-N 3.38Å
123	L	98.6	Very high	97	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61.2	-42.9	174	-73.8	163.4	0	0	0	111.8	I111 R119 A120 M125 L126 G127 I143 E154 A157 A158 A161	I111-L123 HydrophobicContact CD1-CD2 3.86Å; I111-L123 HydrophobicContact CD1-CG 4.06Å; R119-L123 WeakPolarHBondContact O-CG 3.37Å; R119-L123 PolarHBondContact O-N 2.88Å; A120-L123 PolarHBondContact O-N 2.76Å; L123-M125 VanDerWaalsContact C-N 3.31Å; L123-M125 PolarHBondContact O-N 2.65Å; L123-L126 PolarHBondContact O-N 3.46Å; L123-G127 PolarHBondContact O-N 3Å; L123-I143 HydrophobicContact CD2-CG1 3.87Å; L123-E154 HydrophobicContact CD1-CG 3.75Å; L123-A157 HydrophobicContact CB-CB 3.91Å; L123-A157 HydrophobicContact CD1-CB 4.28Å; L123-A158 HydrophobicContact CD1-CB 4.07Å; L123-A161 HydrophobicContact CB-CB 4.47Å; L123-A161 WeakPolarHBondContact O-CB 3.44Å
124	R	98.6	Very high	97.1	Very high	77 Å²	77	28.1 Å²	28.1	29%	0.291	15%	0.153	S	C	.	.	H	α-helix	trans	-62.9	-38.8	173.8	-71	-179.6	179.2	-79.4	0.2	112	L84 A120 I121 T122 G127 S128 A157 F160	L84-R124 HydrophobicContact CD1-CB 4.03Å; L84-R124 HydrophobicContact CD2-CB 3.59Å; L84-R124 HydrophobicContact CD2-CG 4.49Å; L84-R124 HydrophobicContact CG-CB 4.48Å; A120-R124 WeakPolarHBondContact O-CG 3.4Å; A120-R124 PolarHBondContact O-N 2.96Å; I121-R124 PolarHBondContact O-N 3.48Å; T122-R124 PolarHBondContact O-N 2.72Å; R124-G127 PolarHBondContact O-N 3.04Å; R124-S128 PolarHBondContact O-N 3.08Å; R124-S128 PolarHBondContact O-OG 3.14Å; R124-A157 HydrophobicContact CG-CB 3.84Å; R124-F160 HydrophobicContact CB-CD1 4.19Å; R124-F160 HydrophobicContact CB-CE1 4.27Å; R124-F160 HydrophobicContact CG-CD1 3.97Å; R124-F160 HydrophobicContact CG-CE1 4.46Å; R124-F160 WeakPolarHBondContact O-CE1 3.27Å
125	M	98.4	Very high	97.2	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61	-52.7	173.8	178.5	61.9	77.9	0	0	110.6	F72 V83 L84 T87 I107 I121 T122 L123 G127 S128 L129	F72-M125 HydrophobicContact CD2-CE 3.94Å; F72-M125 HydrophobicContact CE2-CB 4.35Å; F72-M125 HydrophobicContact CE2-CE 3.84Å; F72-M125 HydrophobicContact CE2-CG 4.49Å; F72-M125 HydrophobicContact CZ-CB 4.2Å; F72-M125 HydrophobicContact CZ-CG 4.48Å; V83-M125 HydrophobicContact CB-CE 4.48Å; V83-M125 HydrophobicContact CG1-CE 3.8Å; L84-M125 HydrophobicContact CB-CE 4.14Å; L84-M125 HydrophobicContact CD1-CB 4.19Å; L84-M125 HydrophobicContact CD1-CE 4.45Å; T87-M125 HydrophobicContact CG2-SD 3.73Å; T87-M125 WeakPolarHBondContact OG1-CE 3.35Å; I107-M125 HydrophobicContact CD1-CG 4.23Å; I107-M125 HydrophobicContact CG1-CG 4.36Å; I107-M125 HydrophobicContact CG2-CB 4.21Å; I107-M125 HydrophobicContact CG2-CG 3.49Å; I107-M125 VanDerWaalsContact CG2-CG 3.49Å; I121-M125 WeakPolarHBondContact O-CB 3.47Å; I121-M125 PolarHBondContact O-N 3.23Å; T122-M125 WeakPolarHBondContact O-CB 3.45Å; T122-M125 PolarHBondContact O-N 3.46Å; T122-M125 VanDerWaalsContact O-N 3.15Å; L123-M125 VanDerWaalsContact C-N 3.31Å; L123-M125 PolarHBondContact O-N 2.65Å; M125-G127 VanDerWaalsContact C-N 3.29Å; M125-G127 PolarHBondContact O-N 3.1Å; M125-S128 CarbonylContact O-C 3.58Å; M125-S128 WeakPolarHBondContact O-CA 3.08Å; M125-S128 WeakPolarHBondContact O-CB 3.16Å; M125-S128 PolarHBondContact O-N 2.72Å; M125-L129 HydrophobicContact CG-CD1 4.02Å; M125-L129 VanDerWaalsContact O-CG 3.3Å; M125-L129 WeakPolarHBondContact O-CG 3.45Å; M125-L129 PolarHBondContact O-N 3.33Å; M125-L129 VanDerWaalsContact O-N 3.1Å; M125-L129 HydrophobicContact SD-CD1 4.2Å; M125-L129 HydrophobicContact SD-CG 4.32Å
126	L	98.3	Very high	97.1	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-56.5	-44.3	177.7	-66.8	174.9	0	0	0	111.7	I107 F108 I111 T122 L123 S128 L129 A130 I133 A139 F165	I107-L126 HydrophobicContact CG2-CD2 4.26Å; F108-L126 HydrophobicContact CD2-CD1 3.94Å; F108-L126 HydrophobicContact CD2-CD2 4.3Å; F108-L126 HydrophobicContact CE2-CD1 4.19Å; I111-L126 HydrophobicContact CD1-CD1 3.81Å; T122-L126 WeakPolarHBondContact O-CG 3.39Å; T122-L126 PolarHBondContact O-N 3.38Å; L123-L126 PolarHBondContact O-N 3.46Å; L126-S128 VanDerWaalsContact C-N 3.31Å; L126-S128 PolarHBondContact O-N 3.36Å; L126-L129 CarbonylContact O-C 3.43Å; L126-L129 WeakPolarHBondContact O-CA 3.22Å; L126-L129 PolarHBondContact O-N 3.43Å; L126-A130 PolarHBondContact O-N 3.18Å; L126-I133 HydrophobicContact CD2-CD1 4.3Å; L126-A139 HydrophobicContact CD1-CB 4.34Å; L126-F165 HydrophobicContact CB-CE2 4.23Å; L126-F165 VanDerWaalsContact O-CE2 3.27Å; L126-F165 WeakPolarHBondContact O-CE2 3.15Å
127	G	97.8	Very high	97.1	Very high	3 Å²	3	29.3 Å²	29.3	3%	0.031	15%	0.145	C	C	.	.	H	α-helix	trans	-58.3	-41	175	0	0	0	0	0	113	L123 R124 M125 L129 A130 N164	L123-G127 PolarHBondContact O-N 3Å; R124-G127 PolarHBondContact O-N 3.04Å; M125-G127 VanDerWaalsContact C-N 3.29Å; M125-G127 PolarHBondContact O-N 3.1Å; G127-L129 PolarHBondContact O-N 3.04Å; G127-A130 VanDerWaalsContact O-CB 3.29Å; G127-A130 WeakPolarHBondContact O-CB 3.4Å; G127-A130 PolarHBondContact O-N 3.1Å; G127-N164 WeakPolarHBondContact O-CB 3.39Å
128	S	97.9	Very high	96.9	Very high	20 Å²	20	31.5 Å²	31.5	14%	0.14	15%	0.154	C	C	.	.	H	α-helix	trans	-70	-13.5	174.8	-66.3	0	0	0	0	114.1	Q88 L94 R124 M125 L126	Q88-S128 WeakPolarHBondContact CG-OG 3.19Å; Q88-S128 PolarHBondContact NE2-OG 2.81Å; L94-S128 WeakPolarHBondContact CD1-O 3.24Å; R124-S128 PolarHBondContact O-N 3.08Å; R124-S128 PolarHBondContact O-OG 3.14Å; M125-S128 CarbonylContact O-C 3.58Å; M125-S128 WeakPolarHBondContact O-CA 3.08Å; M125-S128 WeakPolarHBondContact O-CB 3.16Å; M125-S128 PolarHBondContact O-N 2.72Å; L126-S128 VanDerWaalsContact C-N 3.31Å; L126-S128 PolarHBondContact O-N 3.36Å
129	L	96.9	Very high	96.9	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	2.5	175.9	-59.3	171.9	0	0	0	112.6	T87 L94 F103 M125 L126 G127 S131 I132 I133	T87-L129 HydrophobicContact CG2-CD2 3.86Å; L94-L129 HydrophobicContact CD1-CD2 4.2Å; L94-L129 HydrophobicContact CD2-CD2 3.98Å; F103-L129 HydrophobicContact CD1-CD1 4.41Å; F103-L129 HydrophobicContact CE1-CD1 3.59Å; F103-L129 HydrophobicContact CE1-CD2 3.73Å; F103-L129 HydrophobicContact CE1-CG 4.31Å; F103-L129 HydrophobicContact CZ-CD1 4.39Å; F103-L129 HydrophobicContact CZ-CD2 4.32Å; M125-L129 HydrophobicContact CG-CD1 4.02Å; M125-L129 VanDerWaalsContact O-CG 3.3Å; M125-L129 WeakPolarHBondContact O-CG 3.45Å; M125-L129 PolarHBondContact O-N 3.33Å; M125-L129 VanDerWaalsContact O-N 3.1Å; M125-L129 HydrophobicContact SD-CD1 4.2Å; M125-L129 HydrophobicContact SD-CG 4.32Å; L126-L129 CarbonylContact O-C 3.43Å; L126-L129 WeakPolarHBondContact O-CA 3.22Å; L126-L129 PolarHBondContact O-N 3.43Å; G127-L129 PolarHBondContact O-N 3.04Å; L129-S131 PolarHBondContact O-N 3.4Å; L129-I132 HydrophobicContact CB-CG1 4.24Å; L129-I132 HydrophobicContact CD2-CD1 4.12Å; L129-I132 VanDerWaalsContact O-CG1 3.25Å; L129-I132 WeakPolarHBondContact O-CG1 3.38Å; L129-I132 PolarHBondContact O-N 2.91Å; L129-I133 HydrophobicContact CB-CD1 4.01Å; L129-I133 HydrophobicContact CB-CG1 3.97Å; L129-I133 WeakPolarHBondContact O-CG1 3.43Å; L129-I133 PolarHBondContact O-N 3.23Å
130	A	96.5	Very high	96.9	Very high	3 Å²	3	30.1 Å²	30.1	3%	0.025	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-27.1	-173.7	0	0	0	0	0	113.9	L126 G127 N164 F165 Q168	L126-A130 PolarHBondContact O-N 3.18Å; G127-A130 VanDerWaalsContact O-CB 3.29Å; G127-A130 WeakPolarHBondContact O-CB 3.4Å; G127-A130 PolarHBondContact O-N 3.1Å; A130-N164 HydrophobicContact CB-CB 3.96Å; A130-F165 HydrophobicContact CB-CD1 4.41Å; A130-F165 HydrophobicContact CB-CD2 3.95Å; A130-F165 HydrophobicContact CB-CE2 4.1Å; A130-F165 HydrophobicContact CB-CG 4.13Å; A130-F165 HydrophobicContact CB-CZ 4.39Å; A130-Q168 HydrophobicContact CB-CG 4.37Å
131	S	93.1	Very high	96.8	Very high	39 Å²	39	35.8 Å²	35.8	27%	0.273	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-28.7	176.2	52.4	0	0	0	0	114.1	L129	L129-S131 PolarHBondContact O-N 3.4Å
132	I	93.4	Very high	96.7	Very high	33 Å²	33	35.5 Å²	35.5	17%	0.169	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-14.6	-177.9	63	165.9	0	0	0	113.6	L94 E95 I97 V100 L129 P134	L94-I132 HydrophobicContact CB-CG2 4.13Å; E95-I132 HydrophobicContact CB-CG2 4.43Å; E95-I132 HydrophobicContact CG-CG2 3.87Å; I97-I132 HydrophobicContact CD1-CD1 4.22Å; V100-I132 HydrophobicContact CG1-CD1 4.33Å; L129-I132 HydrophobicContact CB-CG1 4.24Å; L129-I132 HydrophobicContact CD2-CD1 4.12Å; L129-I132 VanDerWaalsContact O-CG1 3.25Å; L129-I132 WeakPolarHBondContact O-CG1 3.38Å; L129-I132 PolarHBondContact O-N 2.91Å; I132-P134 VanDerWaalsContact C-CD 3.43Å
133	I	95.9	Very high	96.7	Very high	7 Å²	7	35.5 Å²	35.5	4%	0.036	18%	0.175	C	C	.	.			trans	-131.5	46.8	178.8	52.3	159.4	0	0	0	114.1	V100 V104 L126 L129 E135 R136 F165	V100-I133 HydrophobicContact CG1-CG2 3.6Å; V104-I133 HydrophobicContact CG1-CD1 4.27Å; V104-I133 HydrophobicContact CG2-CD1 4.19Å; V104-I133 HydrophobicContact CG2-CG2 3.71Å; L126-I133 HydrophobicContact CD2-CD1 4.3Å; L129-I133 HydrophobicContact CB-CD1 4.01Å; L129-I133 HydrophobicContact CB-CG1 3.97Å; L129-I133 WeakPolarHBondContact O-CG1 3.43Å; L129-I133 PolarHBondContact O-N 3.23Å; I133-E135 PolarHBondContact O-N 2.78Å; I133-E135 VanDerWaalsContact O-N 3.1Å; I133-R136 HydrophobicContact CB-CB 4.4Å; I133-R136 HydrophobicContact CB-CG 3.69Å; I133-R136 HydrophobicContact CG2-CG 3.94Å; I133-R136 PolarHBondContact O-N 3.3Å; I133-F165 HydrophobicContact CD1-CZ 4.18Å; I133-F165 HydrophobicContact CG1-CZ 4.36Å; I133-F165 WeakPolarHBondContact O-CE1 3.46Å
134	P	96.2	Very high	96.7	Very high	41 Å²	41	40.9 Å²	40.9	27%	0.266	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-29.8	-173.5	25	-34.6	0	0	0	113.1	I132 H140 Q168 S169	I132-P134 VanDerWaalsContact C-CD 3.43Å; P134-H140 PolarHBondContact O-CE1 3.3Å; P134-H140 VanDerWaalsContact O-CE1 3.27Å; P134-H140 PolarHBondContact O-NE2 2.91Å; P134-Q168 HydrophobicContact CB-CB 4.12Å; P134-S169 VanDerWaalsContact O-CB 3.26Å; P134-S169 WeakPolarHBondContact O-CB 3.48Å; P134-S169 PolarHBondContact O-OG 3.4Å
135	E	95.9	Very high	96.6	Very high	89 Å²	89	43.4 Å²	43.4	42%	0.416	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	12.2	-171.8	-66	-51	131	0	0	115.8	I133 K137 S169	I133-E135 PolarHBondContact O-N 2.78Å; I133-E135 VanDerWaalsContact O-N 3.1Å; E135-K137 PolarHBondContact O-N 3.33Å; E135-K137 IonicContact OE2-NZ 2.89Å; E135-K137 PolarHBondContact OE2-NZ 2.85Å; E135-S169 WeakPolarHBondContact OE1-CB 3.26Å; E135-S169 PolarHBondContact OE1-OG 3.37Å
136	R	95.8	Very high	96.5	Very high	69 Å²	69	43.8 Å²	43.8	26%	0.26	21%	0.213	S	C	.	.			trans	-74.2	97.6	-179.6	-71.1	-69.4	-89.9	-102.2	8.3	111.7	D101 I133 N138 A139 H140	D101-R136 IonicContact OD1-CZ 3.73Å; D101-R136 IonicContact OD1-NH1 3.8Å; D101-R136 PolarHBondContact OD1-NH1 3.49Å; D101-R136 IonicContact OD1-NH2 2.62Å; I133-R136 HydrophobicContact CB-CB 4.4Å; I133-R136 HydrophobicContact CB-CG 3.69Å; I133-R136 HydrophobicContact CG2-CG 3.94Å; I133-R136 PolarHBondContact O-N 3.3Å; R136-N138 VanDerWaalsContact C-N 3.25Å; R136-N138 PolarHBondContact O-N 3.19Å; R136-N138 VanDerWaalsContact O-N 3.17Å; R136-A139 HydrophobicContact CB-CB 4.21Å; R136-A139 WeakPolarHBondContact O-CB 3.37Å; R136-A139 PolarHBondContact O-N 2.85Å; R136-H140 PolarHBondContact O-CD2 2.92Å; R136-H140 PolarHBondContact O-N 3.36Å; R136-H140 VanDerWaalsContact O-N 3.08Å
137	K	95.9	Very high	96.4	Very high	105 Å²	105	44 Å²	44	46%	0.457	21%	0.214	S	C	.	.	H	α-helix	trans	-57.9	-31.5	-178.2	-54.4	-49.8	-172.3	-166	0	113.9	E135 A139 H140 H141 D171	E135-K137 PolarHBondContact O-N 3.33Å; E135-K137 IonicContact OE2-NZ 2.89Å; E135-K137 PolarHBondContact OE2-NZ 2.85Å; K137-A139 PolarHBondContact O-N 3.22Å; K137-H140 WeakPolarHBondContact O-CB 3.47Å; K137-H140 PolarHBondContact O-N 3.34Å; K137-H141 WeakPolarHBondContact O-CB 3.18Å; K137-H141 PolarHBondContact O-N 3.14Å; K137-D171 IonicContact NZ-OD2 3.31Å; K137-D171 PolarHBondContact NZ-OD2 3.44Å
138	N	95.3	Very high	96.2	Very high	107 Å²	107	48 Å²	48	57%	0.572	24%	0.235	S	C	*	.	H	α-helix	trans	-63.2	-41.4	174.4	-61.6	5	0	0	0	111.9	F108 R136 H141 S142	F108-N138 HydrophobicContact CE1-CB 4.28Å; F108-N138 HydrophobicContact CE2-CB 4.26Å; F108-N138 HydrophobicContact CZ-CB 3.87Å; R136-N138 VanDerWaalsContact C-N 3.25Å; R136-N138 PolarHBondContact O-N 3.19Å; R136-N138 VanDerWaalsContact O-N 3.17Å; N138-H141 PolarHBondContact O-N 3.41Å; N138-S142 PolarHBondContact O-N 3.05Å; N138-S142 PolarHBondContact O-OG 2.64Å
139	A	96.8	Very high	96	Very high	3 Å²	3	48.4 Å²	48.4	3%	0.025	24%	0.237	C	C	.	.	H	α-helix	trans	-67.6	-41.3	175.3	0	0	0	0	0	110.8	L126 R136 K137 H141 S142 I143 F165	L126-A139 HydrophobicContact CD1-CB 4.34Å; R136-A139 HydrophobicContact CB-CB 4.21Å; R136-A139 WeakPolarHBondContact O-CB 3.37Å; R136-A139 PolarHBondContact O-N 2.85Å; K137-A139 PolarHBondContact O-N 3.22Å; A139-H141 VanDerWaalsContact C-N 3.34Å; A139-H141 PolarHBondContact O-N 3.22Å; A139-S142 WeakPolarHBondContact CA-OG 3.27Å; A139-S142 PolarHBondContact O-N 3.42Å; A139-S142 PolarHBondContact O-OG 3.44Å; A139-I143 WeakPolarHBondContact O-CB 3.36Å; A139-I143 WeakPolarHBondContact O-CD1 3.5Å; A139-I143 WeakPolarHBondContact O-CG1 3.37Å; A139-I143 PolarHBondContact O-N 3.35Å; A139-F165 HydrophobicContact CB-CE1 4.3Å; A139-F165 HydrophobicContact CB-CZ 3.92Å
140	H	97.6	Very high	95.9	Very high	19 Å²	19	57.2 Å²	57.2	9%	0.088	28%	0.278	C	S	.	.	H	α-helix	trans	-57	-48	174.8	-61.7	-179.9	0	0	0	111.6	P134 R136 K137 I143 R144 F165 F172	P134-H140 PolarHBondContact O-CE1 3.3Å; P134-H140 VanDerWaalsContact O-CE1 3.27Å; P134-H140 PolarHBondContact O-NE2 2.91Å; R136-H140 PolarHBondContact O-CD2 2.92Å; R136-H140 PolarHBondContact O-N 3.36Å; R136-H140 VanDerWaalsContact O-N 3.08Å; K137-H140 WeakPolarHBondContact O-CB 3.47Å; K137-H140 PolarHBondContact O-N 3.34Å; H140-I143 PolarHBondContact O-N 3.18Å; H140-R144 PolarHBondContact O-N 3.03Å; H140-F165 AromaticContact CD2-CD1 3.71Å; H140-F165 AromaticContact CD2-CE1 3.95Å; H140-F165 AromaticContact NE2-CD1 3.71Å; H140-F172 HydrophobicContact CB-CD2 3.65Å; H140-F172 HydrophobicContact CB-CE2 4Å; H140-F172 AromaticContact CD2-CD2 3.6Å; H140-F172 AromaticContact CG-CD2 3.52Å
141	H	97	Very high	95.8	Very high	123 Å²	123	60 Å²	60	57%	0.569	29%	0.293	S	S	*	.	H	α-helix	trans	-63.6	-47.1	179.1	-177.6	69.7	0	0	0	111.9	K137 N138 A139 I143 R144 Q145	K137-H141 WeakPolarHBondContact O-CB 3.18Å; K137-H141 PolarHBondContact O-N 3.14Å; N138-H141 PolarHBondContact O-N 3.41Å; A139-H141 VanDerWaalsContact C-N 3.34Å; A139-H141 PolarHBondContact O-N 3.22Å; H141-I143 VanDerWaalsContact C-N 3.32Å; H141-I143 PolarHBondContact O-N 3.12Å; H141-R144 PolarHBondContact O-N 3.36Å; H141-Q145 WeakPolarHBondContact O-CB 3.39Å; H141-Q145 PolarHBondContact O-N 2.99Å
142	S	97.3	Very high	95.8	Very high	7 Å²	7	64.3 Å²	64.3	5%	0.049	31%	0.312	C	S	.	.	H	α-helix	trans	-62.2	-39.2	178.9	61.7	0	0	0	0	112.4	N138 A139 Q145 S146	N138-S142 PolarHBondContact O-N 3.05Å; N138-S142 PolarHBondContact O-OG 2.64Å; A139-S142 WeakPolarHBondContact CA-OG 3.27Å; A139-S142 PolarHBondContact O-N 3.42Å; A139-S142 PolarHBondContact O-OG 3.44Å; S142-Q145 PolarHBondContact O-N 2.7Å; S142-S146 WeakPolarHBondContact O-CB 3.39Å; S142-S146 PolarHBondContact O-N 3.36Å; S142-S146 PolarHBondContact O-OG 3.27Å
143	I	98.2	Very high	95.8	Very high	0 Å²	0	66 Å²	66	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-64.3	-45.8	176.9	-66.3	163	0	0	0	110.1	L123 A139 H140 H141 Q145 S146 L147 A161 A162 F165 F172	L123-I143 HydrophobicContact CD2-CG1 3.87Å; A139-I143 WeakPolarHBondContact O-CB 3.36Å; A139-I143 WeakPolarHBondContact O-CD1 3.5Å; A139-I143 WeakPolarHBondContact O-CG1 3.37Å; A139-I143 PolarHBondContact O-N 3.35Å; H140-I143 PolarHBondContact O-N 3.18Å; H141-I143 VanDerWaalsContact C-N 3.32Å; H141-I143 PolarHBondContact O-N 3.12Å; I143-Q145 VanDerWaalsContact C-N 3.33Å; I143-Q145 PolarHBondContact O-N 3.01Å; I143-S146 PolarHBondContact O-N 2.77Å; I143-L147 WeakPolarHBondContact O-CG 3.41Å; I143-L147 PolarHBondContact O-N 3.09Å; I143-L147 VanDerWaalsContact O-N 3.16Å; I143-A161 HydrophobicContact CD1-CB 3.77Å; I143-A161 HydrophobicContact CG1-CB 3.8Å; I143-A161 HydrophobicContact CG2-CB 4.33Å; I143-A162 HydrophobicContact CG2-CB 3.84Å; I143-F165 HydrophobicContact CD1-CD2 3.38Å; I143-F165 HydrophobicContact CD1-CE2 3.62Å; I143-F165 HydrophobicContact CD1-CG 3.97Å; I143-F165 HydrophobicContact CD1-CZ 4.39Å; I143-F172 HydrophobicContact CB-CE2 4.37Å; I143-F172 HydrophobicContact CB-CZ 4.24Å; I143-F172 HydrophobicContact CD1-CZ 4.43Å; I143-F172 HydrophobicContact CG2-CE2 4.38Å; I143-F172 HydrophobicContact CG2-CZ 3.77Å
144	R	97.1	Very high	95.9	Very high	114 Å²	114	65.6 Å²	65.6	43%	0.43	32%	0.322	S	S	.	.	H	α-helix	trans	-61.4	-41.8	178.2	-175.1	173.2	-176.6	139.1	3.7	112	H140 H141 G175 I176	H140-R144 PolarHBondContact O-N 3.03Å; H141-R144 PolarHBondContact O-N 3.36Å; R144-G175 PolarHBondContact NH1-O 3.36Å; R144-I176 HydrophobicContact CB-CD1 4.3Å; R144-I176 HydrophobicContact CG-CD1 4.34Å
145	Q	96.7	Very high	96	Very high	129 Å²	129	64.1 Å²	64.1	60%	0.603	31%	0.312	S	S	*	.	H	α-helix	trans	-67.2	-46.8	178.1	-174.2	-179.1	17.1	0	0	111.9	H141 S142 I143 L147 D148	H141-Q145 WeakPolarHBondContact O-CB 3.39Å; H141-Q145 PolarHBondContact O-N 2.99Å; S142-Q145 PolarHBondContact O-N 2.7Å; I143-Q145 VanDerWaalsContact C-N 3.33Å; I143-Q145 PolarHBondContact O-N 3.01Å; Q145-L147 PolarHBondContact O-N 2.98Å; Q145-D148 PolarHBondContact O-N 3.14Å; Q145-D148 VanDerWaalsContact O-N 3.12Å
146	S	97.3	Very high	96	Very high	9 Å²	9	63.5 Å²	63.5	6%	0.063	31%	0.309	C	S	.	.	H	α-helix	trans	-69.5	-16.9	-178	-71.8	0	0	0	0	114.1	S142 I143 D148 S149 E154	S142-S146 WeakPolarHBondContact O-CB 3.39Å; S142-S146 PolarHBondContact O-N 3.36Å; S142-S146 PolarHBondContact O-OG 3.27Å; I143-S146 PolarHBondContact O-N 2.77Å; S146-D148 PolarHBondContact O-N 3.32Å; S146-S149 VanDerWaalsContact O-CB 3.23Å; S146-S149 WeakPolarHBondContact O-CB 3.08Å; S146-S149 PolarHBondContact O-N 2.97Å; S146-E154 WeakPolarHBondContact CB-OE1 3.4Å; S146-E154 PolarHBondContact OG-OE1 2.9Å
147	L	96	Very high	96.1	Very high	3 Å²	3	60.2 Å²	60.2	2%	0.016	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-24.4	170.5	-80.2	170	0	0	0	113	I143 Q145 A158 V159 I176 I180 M183	I143-L147 WeakPolarHBondContact O-CG 3.41Å; I143-L147 PolarHBondContact O-N 3.09Å; I143-L147 VanDerWaalsContact O-N 3.16Å; Q145-L147 PolarHBondContact O-N 2.98Å; L147-A158 HydrophobicContact CD2-CB 3.85Å; L147-A158 HydrophobicContact CG-CB 3.91Å; L147-V159 HydrophobicContact CD2-CG2 3.93Å; L147-I176 HydrophobicContact CD1-CD1 3.74Å; L147-I176 HydrophobicContact CD1-CG1 4.27Å; L147-I180 HydrophobicContact CD1-CD1 4.18Å; L147-M183 HydrophobicContact CB-CE 4.44Å; L147-M183 HydrophobicContact CB-SD 4.2Å; L147-M183 WeakPolarHBondContact O-CE 3.42Å
148	D	92.8	Very high	96.2	Very high	89 Å²	89	55.2 Å²	55.2	48%	0.476	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	8.9	176.5	-69.7	-41.3	0	0	0	113.1	Q145 S146 K179	Q145-D148 PolarHBondContact O-N 3.14Å; Q145-D148 VanDerWaalsContact O-N 3.12Å; S146-D148 PolarHBondContact O-N 3.32Å; D148-K179 WeakPolarHBondContact OD1-CE 3.43Å; D148-K179 IonicContact OD1-NZ 2.77Å; D148-K179 PolarHBondContact OD1-NZ 2.84Å; D148-K179 WeakPolarHBondContact OD2-CE 3.4Å; D148-K179 IonicContact OD2-NZ 2.85Å; D148-K179 PolarHBondContact OD2-NZ 3.49Å
149	S	94.9	Very high	96.4	Very high	27 Å²	27	50.6 Å²	50.6	19%	0.189	25%	0.251	C	S	.	.			trans	-64.9	151	179.1	-175.7	0	0	0	0	112.3	S146 D151 E154 V155	S146-S149 VanDerWaalsContact O-CB 3.23Å; S146-S149 WeakPolarHBondContact O-CB 3.08Å; S146-S149 PolarHBondContact O-N 2.97Å; S149-D151 VanDerWaalsContact C-N 3.3Å; S149-D151 PolarHBondContact OG-N 3.31Å; S149-D151 VanDerWaalsContact OG-N 3.16Å; S149-E154 WeakPolarHBondContact CB-OE2 3.19Å; S149-E154 PolarHBondContact OG-OE2 2.94Å; S149-V155 WeakPolarHBondContact O-CG2 3.42Å
150	H	93.4	Very high	96.4	Very high	186 Å²	186	53.3 Å²	53.3	86%	0.861	26%	0.262	S	S	*	.	S	Bend	trans	-81.6	-11	171.8	-60	-54.4	0	0	0	112.7
151	D	95.1	Very high	96.5	Very high	62 Å²	62	52.4 Å²	52.4	33%	0.332	26%	0.258	S	S	.	.			trans	-90.7	113.1	-179.2	-70.5	-65.8	0	0	0	111.6	P116 R119 S149 V153 E154 V155	P116-D151 HydrophobicContact CB-CB 3.73Å; P116-D151 VanDerWaalsContact CB-CG 3.44Å; P116-D151 WeakPolarHBondContact CB-OD2 3.4Å; R119-D151 IonicContact NH2-OD2 3.07Å; R119-D151 PolarHBondContact NH2-OD2 2.96Å; S149-D151 VanDerWaalsContact C-N 3.3Å; S149-D151 PolarHBondContact OG-N 3.31Å; S149-D151 VanDerWaalsContact OG-N 3.16Å; D151-V153 VanDerWaalsContact C-N 3.28Å; D151-V153 PolarHBondContact O-N 3.2Å; D151-E154 HydrophobicContact CB-CB 4.04Å; D151-E154 PolarHBondContact O-N 2.99Å; D151-V155 PolarHBondContact O-N 3.38Å
152	N	92.4	Very high	96.6	Very high	128 Å²	128	46.6 Å²	46.6	68%	0.684	23%	0.231	S	C	*	.	H	α-helix	trans	-54.7	-40.5	-177.5	-69.5	-36.3	0	0	0	113.6	E154 V155 E156	N152-E154 VanDerWaalsContact C-N 3.3Å; N152-E154 PolarHBondContact O-N 3.11Å; N152-V155 PolarHBondContact O-N 3.09Å; N152-E156 WeakPolarHBondContact O-CG 3.5Å; N152-E156 PolarHBondContact O-N 3.12Å
153	V	95.1	Very high	96.6	Very high	68 Å²	68	47.3 Å²	47.3	41%	0.412	24%	0.237	S	C	.	.	H	α-helix	trans	-65.9	-34.5	-179.4	67.6	0	0	0	0	112.3	P116 A120 D151 A157	P116-V153 HydrophobicContact CB-CG1 4.44Å; A120-V153 HydrophobicContact CB-CG1 4.38Å; A120-V153 HydrophobicContact CB-CG2 4.04Å; A120-V153 WeakPolarHBondContact CB-O 3.16Å; D151-V153 VanDerWaalsContact C-N 3.28Å; D151-V153 PolarHBondContact O-N 3.2Å; V153-A157 PolarHBondContact O-N 2.88Å
154	E	97.7	Very high	96.6	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-74.4	-45	178.3	-171	-173.4	-176.3	0	0	110.7	R119 L123 S146 S149 D151 N152 E156 A157 A158	R119-E154 HydrophobicContact CB-CG 4.31Å; R119-E154 VanDerWaalsContact CZ-CD 3.44Å; R119-E154 IonicContact CZ-OE1 2.78Å; R119-E154 IonicContact CZ-OE2 3.8Å; R119-E154 IonicContact NE-OE1 2.76Å; R119-E154 IonicContact NE-OE2 3.15Å; R119-E154 IonicContact NH1-OE1 2.62Å; R119-E154 PolarHBondContact NH1-OE1 3.42Å; R119-E154 IonicContact NH1-OE2 2.68Å; R119-E154 PolarHBondContact NH1-OE2 3.47Å; R119-E154 IonicContact NH2-OE2 3.39Å; R119-E154 PolarHBondContact NH2-OE2 3.21Å; R119-E154 VanDerWaalsContact NH2-OE2 3.1Å; L123-E154 HydrophobicContact CD1-CG 3.75Å; S146-E154 WeakPolarHBondContact CB-OE1 3.4Å; S146-E154 PolarHBondContact OG-OE1 2.9Å; S149-E154 WeakPolarHBondContact CB-OE2 3.19Å; S149-E154 PolarHBondContact OG-OE2 2.94Å; D151-E154 HydrophobicContact CB-CB 4.04Å; D151-E154 PolarHBondContact O-N 2.99Å; N152-E154 VanDerWaalsContact C-N 3.3Å; N152-E154 PolarHBondContact O-N 3.11Å; E154-E156 VanDerWaalsContact C-N 3.29Å; E154-E156 PolarHBondContact O-N 3.08Å; E154-A157 CarbonylContact O-C 3.49Å; E154-A157 WeakPolarHBondContact O-CB 3.33Å; E154-A157 PolarHBondContact O-N 2.7Å; E154-A157 VanDerWaalsContact O-N 3.08Å; E154-A158 WeakPolarHBondContact O-CB 3.43Å; E154-A158 PolarHBondContact O-N 3.36Å
155	V	97.1	Very high	96.6	Very high	9 Å²	9	44.2 Å²	44.2	6%	0.055	23%	0.23	C	C	.	.	H	α-helix	trans	-57.9	-43.8	176.3	176.5	0	0	0	0	110.7	S149 D151 N152 A157 A158 V159 L193	S149-V155 WeakPolarHBondContact O-CG2 3.42Å; D151-V155 PolarHBondContact O-N 3.38Å; N152-V155 PolarHBondContact O-N 3.09Å; V155-A157 VanDerWaalsContact C-N 3.32Å; V155-A157 PolarHBondContact O-N 3.38Å; V155-A158 WeakPolarHBondContact O-CB 3.15Å; V155-A158 PolarHBondContact O-N 3.3Å; V155-V159 HydrophobicContact CG1-CG2 4.43Å; V155-V159 WeakPolarHBondContact O-CG2 3.22Å; V155-V159 PolarHBondContact O-N 3.17Å; V155-L193 HydrophobicContact CG1-CD1 3.95Å; V155-L193 HydrophobicContact CG1-CD2 3.88Å
156	E	96.6	Very high	96.7	Very high	76 Å²	76	38.1 Å²	38.1	36%	0.355	20%	0.201	S	C	.	.	H	α-helix	trans	-63.7	-36.4	176.5	-73.7	-170.3	-165	0	0	113.4	N152 E154 F160 K196	N152-E156 WeakPolarHBondContact O-CG 3.5Å; N152-E156 PolarHBondContact O-N 3.12Å; E154-E156 VanDerWaalsContact C-N 3.29Å; E154-E156 PolarHBondContact O-N 3.08Å; E156-F160 PolarHBondContact O-N 3.22Å; E156-F160 VanDerWaalsContact O-N 3.14Å; E156-K196 HydrophobicContact CG-CD 4.34Å; E156-K196 IonicContact OE1-NZ 3.9Å; E156-K196 PolarHBondContact OE1-NZ 3.1Å; E156-K196 IonicContact OE2-NZ 2.74Å; E156-K196 PolarHBondContact OE2-NZ 3Å
157	A	98.1	Very high	96.7	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-69.6	-37.5	173.8	0	0	0	0	0	112.1	A120 L123 R124 V153 E154 V155 F160 A161	A120-A157 HydrophobicContact CB-CB 3.74Å; A120-A157 WeakPolarHBondContact O-CB 3.27Å; L123-A157 HydrophobicContact CB-CB 3.91Å; L123-A157 HydrophobicContact CD1-CB 4.28Å; R124-A157 HydrophobicContact CG-CB 3.84Å; V153-A157 PolarHBondContact O-N 2.88Å; E154-A157 CarbonylContact O-C 3.49Å; E154-A157 WeakPolarHBondContact O-CB 3.33Å; E154-A157 PolarHBondContact O-N 2.7Å; E154-A157 VanDerWaalsContact O-N 3.08Å; V155-A157 VanDerWaalsContact C-N 3.32Å; V155-A157 PolarHBondContact O-N 3.38Å; A157-F160 PolarHBondContact O-N 2.86Å; A157-A161 WeakPolarHBondContact O-CB 3.36Å; A157-A161 PolarHBondContact O-N 3.47Å
158	A	98.3	Very high	96.6	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65	-40.6	174.6	0	0	0	0	0	111.3	L123 L147 E154 V155 F160 A161 A162	L123-A158 HydrophobicContact CD1-CB 4.07Å; L147-A158 HydrophobicContact CD2-CB 3.85Å; L147-A158 HydrophobicContact CG-CB 3.91Å; E154-A158 WeakPolarHBondContact O-CB 3.43Å; E154-A158 PolarHBondContact O-N 3.36Å; V155-A158 WeakPolarHBondContact O-CB 3.15Å; V155-A158 PolarHBondContact O-N 3.3Å; A158-F160 PolarHBondContact O-N 3.34Å; A158-A161 PolarHBondContact O-N 2.65Å; A158-A162 VanDerWaalsContact O-CB 3.24Å; A158-A162 WeakPolarHBondContact O-CB 3.39Å; A158-A162 PolarHBondContact O-N 3.21Å
159	V	98.3	Very high	96.8	Very high	11 Å²	11	39.8 Å²	39.8	7%	0.067	21%	0.209	C	C	.	.	H	α-helix	trans	-58.3	-47.3	172.2	172.1	0	0	0	0	110.9	L147 V155 A162 A163 L193 K196 L197 I200	L147-V159 HydrophobicContact CD2-CG2 3.93Å; V155-V159 HydrophobicContact CG1-CG2 4.43Å; V155-V159 WeakPolarHBondContact O-CG2 3.22Å; V155-V159 PolarHBondContact O-N 3.17Å; V159-A162 PolarHBondContact O-N 3.09Å; V159-A163 PolarHBondContact O-N 2.9Å; V159-L193 HydrophobicContact CG2-CD1 4.02Å; V159-K196 HydrophobicContact CG1-CB 4.15Å; V159-K196 WeakPolarHBondContact CG1-O 3.36Å; V159-L197 HydrophobicContact CG2-CD2 3.69Å; V159-L197 HydrophobicContact CG2-CG 4.41Å; V159-I200 HydrophobicContact CG1-CD1 4.05Å
160	F	98.4	Very high	96.9	Very high	60 Å²	60	42.9 Å²	42.9	26%	0.263	22%	0.219	S	C	.	.	H	α-helix	trans	-60.3	-46.8	176.3	171.3	-93.4	0	0	0	111.9	R124 E156 A157 A158 A163 N164	R124-F160 HydrophobicContact CB-CD1 4.19Å; R124-F160 HydrophobicContact CB-CE1 4.27Å; R124-F160 HydrophobicContact CG-CD1 3.97Å; R124-F160 HydrophobicContact CG-CE1 4.46Å; R124-F160 WeakPolarHBondContact O-CE1 3.27Å; E156-F160 PolarHBondContact O-N 3.22Å; E156-F160 VanDerWaalsContact O-N 3.14Å; A157-F160 PolarHBondContact O-N 2.86Å; A158-F160 PolarHBondContact O-N 3.34Å; F160-A163 PolarHBondContact O-N 2.93Å; F160-N164 WeakPolarHBondContact CD1-ND2 3.49Å; F160-N164 WeakPolarHBondContact CE1-ND2 3.5Å; F160-N164 WeakPolarHBondContact CE2-ND2 3.3Å; F160-N164 WeakPolarHBondContact CZ-ND2 3.22Å; F160-N164 PolarHBondContact O-N 3.37Å; F160-N164 PolarHBondContact O-ND2 3.07Å
161	A	98.3	Very high	97	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-63.4	-43.8	177.9	0	0	0	0	0	111.5	L123 I143 A157 A158 A163 N164 F165	L123-A161 HydrophobicContact CB-CB 4.47Å; L123-A161 WeakPolarHBondContact O-CB 3.44Å; I143-A161 HydrophobicContact CD1-CB 3.77Å; I143-A161 HydrophobicContact CG1-CB 3.8Å; I143-A161 HydrophobicContact CG2-CB 4.33Å; A157-A161 WeakPolarHBondContact O-CB 3.36Å; A157-A161 PolarHBondContact O-N 3.47Å; A158-A161 PolarHBondContact O-N 2.65Å; A161-A163 VanDerWaalsContact C-N 3.33Å; A161-A163 PolarHBondContact O-N 3.36Å; A161-N164 PolarHBondContact O-N 3.28Å; A161-F165 WeakPolarHBondContact O-CD2 3.48Å; A161-F165 PolarHBondContact O-N 2.93Å
162	A	98.4	Very high	97.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.3	-41.8	178.4	0	0	0	0	0	111.9	I143 A158 V159 S166 F172 I200	I143-A162 HydrophobicContact CG2-CB 3.84Å; A158-A162 VanDerWaalsContact O-CB 3.24Å; A158-A162 WeakPolarHBondContact O-CB 3.39Å; A158-A162 PolarHBondContact O-N 3.21Å; V159-A162 PolarHBondContact O-N 3.09Å; A162-S166 VanDerWaalsContact O-CB 3.23Å; A162-S166 WeakPolarHBondContact O-CB 3.32Å; A162-S166 PolarHBondContact O-N 2.98Å; A162-S166 PolarHBondContact O-OG 3.27Å; A162-F172 HydrophobicContact CB-CE1 4.16Å; A162-F172 HydrophobicContact CB-CZ 4.23Å; A162-F172 WeakPolarHBondContact O-CE1 3.39Å; A162-I200 HydrophobicContact CB-CD1 4.18Å
163	A	98.1	Very high	97.3	Very high	22 Å²	22	29.8 Å²	29.8	18%	0.182	16%	0.155	C	C	.	.	H	α-helix	trans	-59.2	-50.8	174.6	0	0	0	0	0	111.7	V159 F160 A161 S166 A167 I200 H203	V159-A163 PolarHBondContact O-N 2.9Å; F160-A163 PolarHBondContact O-N 2.93Å; A161-A163 VanDerWaalsContact C-N 3.33Å; A161-A163 PolarHBondContact O-N 3.36Å; A163-S166 PolarHBondContact O-N 3.38Å; A163-A167 PolarHBondContact O-N 3.2Å; A163-I200 HydrophobicContact CB-CG1 4.1Å; A163-H203 PolarHBondContact O-CD2 3.15Å
164	N	98	Very high	97.3	Very high	50 Å²	50	29.8 Å²	29.8	27%	0.267	16%	0.155	S	C	.	.	H	α-helix	trans	-65.6	-41.7	-177.7	-67.8	-45.8	0	0	0	112.8	G127 A130 F160 A161 A167	G127-N164 WeakPolarHBondContact O-CB 3.39Å; A130-N164 HydrophobicContact CB-CB 3.96Å; F160-N164 WeakPolarHBondContact CD1-ND2 3.49Å; F160-N164 WeakPolarHBondContact CE1-ND2 3.5Å; F160-N164 WeakPolarHBondContact CE2-ND2 3.3Å; F160-N164 WeakPolarHBondContact CZ-ND2 3.22Å; F160-N164 PolarHBondContact O-N 3.37Å; F160-N164 PolarHBondContact O-ND2 3.07Å; A161-N164 PolarHBondContact O-N 3.28Å; N164-A167 WeakPolarHBondContact O-CB 3.3Å; N164-A167 PolarHBondContact O-N 3.48Å
165	F	98.3	Very high	97.1	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-68.8	-36.5	175.5	-86.7	-91.6	0	0	0	112.2	L126 A130 I133 A139 H140 I143 A161 A167 Q168 S169 F172	L126-F165 HydrophobicContact CB-CE2 4.23Å; L126-F165 VanDerWaalsContact O-CE2 3.27Å; L126-F165 WeakPolarHBondContact O-CE2 3.15Å; A130-F165 HydrophobicContact CB-CD1 4.41Å; A130-F165 HydrophobicContact CB-CD2 3.95Å; A130-F165 HydrophobicContact CB-CE2 4.1Å; A130-F165 HydrophobicContact CB-CG 4.13Å; A130-F165 HydrophobicContact CB-CZ 4.39Å; I133-F165 HydrophobicContact CD1-CZ 4.18Å; I133-F165 HydrophobicContact CG1-CZ 4.36Å; I133-F165 WeakPolarHBondContact O-CE1 3.46Å; A139-F165 HydrophobicContact CB-CE1 4.3Å; A139-F165 HydrophobicContact CB-CZ 3.92Å; H140-F165 AromaticContact CD2-CD1 3.71Å; H140-F165 AromaticContact CD2-CE1 3.95Å; H140-F165 AromaticContact NE2-CD1 3.71Å; I143-F165 HydrophobicContact CD1-CD2 3.38Å; I143-F165 HydrophobicContact CD1-CE2 3.62Å; I143-F165 HydrophobicContact CD1-CG 3.97Å; I143-F165 HydrophobicContact CD1-CZ 4.39Å; A161-F165 WeakPolarHBondContact O-CD2 3.48Å; A161-F165 PolarHBondContact O-N 2.93Å; F165-A167 PolarHBondContact O-N 3.06Å; F165-Q168 PolarHBondContact O-N 3.49Å; F165-S169 PolarHBondContact O-N 3.2Å; F165-F172 HydrophobicContact CB-CD1 3.52Å; F165-F172 HydrophobicContact CB-CD2 4.5Å; F165-F172 HydrophobicContact CB-CE1 3.71Å; F165-F172 HydrophobicContact CB-CG 3.94Å; F165-F172 HydrophobicContact CB-CZ 4.28Å
166	S	98	Very high	97	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64.8	-30.3	175.3	-57.5	0	0	0	0	112	A162 A163 Q168 H206	A162-S166 VanDerWaalsContact O-CB 3.23Å; A162-S166 WeakPolarHBondContact O-CB 3.32Å; A162-S166 PolarHBondContact O-N 2.98Å; A162-S166 PolarHBondContact O-OG 3.27Å; A163-S166 PolarHBondContact O-N 3.38Å; S166-Q168 VanDerWaalsContact C-N 3.28Å; S166-Q168 PolarHBondContact O-N 3.45Å; S166-H206 PolarHBondContact O-NE2 3.18Å
167	A	96.7	Very high	96.9	Very high	25 Å²	25	27.5 Å²	27.5	21%	0.207	15%	0.153	C	C	.	.	H	α-helix	trans	-64.9	-31.8	176.7	0	0	0	0	0	112.9	A163 N164 F165 H203	A163-A167 PolarHBondContact O-N 3.2Å; N164-A167 WeakPolarHBondContact O-CB 3.3Å; N164-A167 PolarHBondContact O-N 3.48Å; F165-A167 PolarHBondContact O-N 3.06Å; A167-H203 WeakPolarHBondContact CB-ND1 3.46Å
168	Q	95.1	Very high	96.7	Very high	112 Å²	112	32.6 Å²	32.6	52%	0.523	18%	0.18	S	C	.	.	H	α-helix	trans	-107.1	-41.8	-171.6	-55	-60.7	-19.2	0	0	113.3	A130 P134 F165 S166	A130-Q168 HydrophobicContact CB-CG 4.37Å; P134-Q168 HydrophobicContact CB-CB 4.12Å; F165-Q168 PolarHBondContact O-N 3.49Å; S166-Q168 VanDerWaalsContact C-N 3.28Å; S166-Q168 PolarHBondContact O-N 3.45Å
169	S	97.2	Very high	96.5	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.186	C	C	.	.			trans	-104.9	116.2	-173.7	179.2	0	0	0	0	111.6	P134 E135 F165 F172 A173	P134-S169 VanDerWaalsContact O-CB 3.26Å; P134-S169 WeakPolarHBondContact O-CB 3.48Å; P134-S169 PolarHBondContact O-OG 3.4Å; E135-S169 WeakPolarHBondContact OE1-CB 3.26Å; E135-S169 PolarHBondContact OE1-OG 3.37Å; F165-S169 PolarHBondContact O-N 3.2Å; S169-F172 PolarHBondContact O-N 2.96Å; S169-F172 PolarHBondContact OG-N 3.34Å; S169-A173 WeakPolarHBondContact O-CB 3.45Å; S169-A173 PolarHBondContact O-N 3.39Å
170	K	96	Very high	96.4	Very high	91 Å²	91	33.4 Å²	33.4	40%	0.396	18%	0.183	S	C	.	.	H	α-helix	trans	-60	-47.6	173.3	175.8	176.5	178.7	168.6	0	111.6	F172 A173 V174 H206 D207	K170-F172 VanDerWaalsContact C-N 3.28Å; K170-F172 PolarHBondContact O-N 2.91Å; K170-A173 WeakPolarHBondContact O-CB 3.43Å; K170-A173 PolarHBondContact O-N 2.91Å; K170-A173 VanDerWaalsContact O-N 3.13Å; K170-V174 HydrophobicContact CG-CG2 4.43Å; K170-V174 WeakPolarHBondContact O-CG2 3.42Å; K170-V174 PolarHBondContact O-N 3.34Å; K170-H206 HydrophobicContact CB-CB 4.06Å; K170-H206 HydrophobicContact CD-CB 4.1Å; K170-H206 HydrophobicContact CG-CB 3.78Å; K170-D207 WeakPolarHBondContact CE-OD2 3.42Å; K170-D207 IonicContact NZ-OD2 3.47Å; K170-D207 PolarHBondContact NZ-OD2 3.25Å
171	D	95.1	Very high	96.2	Very high	94 Å²	94	31.6 Å²	31.6	50%	0.503	18%	0.178	S	C	.	.	H	α-helix	trans	-56.3	-45.1	-179.9	-78.2	6.4	0	0	0	111.4	K137 G175	K137-D171 IonicContact NZ-OD2 3.31Å; K137-D171 PolarHBondContact NZ-OD2 3.44Å; D171-G175 PolarHBondContact O-N 2.75Å
172	F	97.4	Very high	96	Very high	8 Å²	8	37.3 Å²	37.3	4%	0.035	20%	0.204	C	C	.	.	H	α-helix	trans	-64.9	-44.4	176.9	-175	-96.9	0	0	0	111.8	H140 I143 A162 F165 S169 K170 V174 G175 I176	H140-F172 HydrophobicContact CB-CD2 3.65Å; H140-F172 HydrophobicContact CB-CE2 4Å; H140-F172 AromaticContact CD2-CD2 3.6Å; H140-F172 AromaticContact CG-CD2 3.52Å; I143-F172 HydrophobicContact CB-CE2 4.37Å; I143-F172 HydrophobicContact CB-CZ 4.24Å; I143-F172 HydrophobicContact CD1-CZ 4.43Å; I143-F172 HydrophobicContact CG2-CE2 4.38Å; I143-F172 HydrophobicContact CG2-CZ 3.77Å; A162-F172 HydrophobicContact CB-CE1 4.16Å; A162-F172 HydrophobicContact CB-CZ 4.23Å; A162-F172 WeakPolarHBondContact O-CE1 3.39Å; F165-F172 HydrophobicContact CB-CD1 3.52Å; F165-F172 HydrophobicContact CB-CD2 4.5Å; F165-F172 HydrophobicContact CB-CE1 3.71Å; F165-F172 HydrophobicContact CB-CG 3.94Å; F165-F172 HydrophobicContact CB-CZ 4.28Å; S169-F172 PolarHBondContact O-N 2.96Å; S169-F172 PolarHBondContact OG-N 3.34Å; K170-F172 VanDerWaalsContact C-N 3.28Å; K170-F172 PolarHBondContact O-N 2.91Å; F172-V174 PolarHBondContact O-N 3.26Å; F172-G175 PolarHBondContact O-N 3.47Å; F172-I176 HydrophobicContact CD1-CB 4.41Å; F172-I176 HydrophobicContact CD1-CG2 4.19Å; F172-I176 HydrophobicContact CE1-CB 3.98Å; F172-I176 HydrophobicContact CE1-CG1 4.07Å; F172-I176 HydrophobicContact CE1-CG2 3.91Å; F172-I176 HydrophobicContact CE2-CD1 4.47Å; F172-I176 HydrophobicContact CZ-CB 4.12Å; F172-I176 HydrophobicContact CZ-CD1 4.05Å; F172-I176 HydrophobicContact CZ-CG1 3.91Å; F172-I176 WeakPolarHBondContact O-CB 3.32Å; F172-I176 WeakPolarHBondContact O-CG2 3.5Å; F172-I176 PolarHBondContact O-N 3.42Å
173	A	96.8	Very high	95.9	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-58.1	-46.2	178.5	0	0	0	0	0	111.9	S169 K170 G175 I176 C177 M204	S169-A173 WeakPolarHBondContact O-CB 3.45Å; S169-A173 PolarHBondContact O-N 3.39Å; K170-A173 WeakPolarHBondContact O-CB 3.43Å; K170-A173 PolarHBondContact O-N 2.91Å; K170-A173 VanDerWaalsContact O-N 3.13Å; A173-G175 PolarHBondContact O-N 3.25Å; A173-I176 PolarHBondContact O-N 2.82Å; A173-C177 VanDerWaalsContact O-CB 3.25Å; A173-C177 WeakPolarHBondContact O-CB 3.38Å; A173-C177 PolarHBondContact O-N 3.22Å; A173-M204 HydrophobicContact CB-CE 4.41Å; A173-M204 HydrophobicContact CB-SD 3.95Å
174	V	94.9	Very high	95.7	Very high	67 Å²	67	37.2 Å²	37.2	41%	0.406	20%	0.2	S	C	.	.	H	α-helix	trans	-58.3	-49.7	173.9	177.6	0	0	0	0	110.6	K170 F172 I176 L210	K170-V174 HydrophobicContact CG-CG2 4.43Å; K170-V174 WeakPolarHBondContact O-CG2 3.42Å; K170-V174 PolarHBondContact O-N 3.34Å; F172-V174 PolarHBondContact O-N 3.26Å; V174-I176 VanDerWaalsContact C-N 3.33Å; V174-I176 PolarHBondContact O-N 3.33Å; V174-L210 HydrophobicContact CB-CD2 4.36Å; V174-L210 HydrophobicContact CG2-CD1 3.59Å; V174-L210 HydrophobicContact CG2-CD2 3.99Å; V174-L210 HydrophobicContact CG2-CG 4.17Å
175	G	93.3	Very high	95.5	Very high	32 Å²	32	38.8 Å²	38.8	33%	0.33	21%	0.206	S	C	.	.	H	α-helix	trans	-66.4	-32.3	-175.5	0	0	0	0	0	114	R144 D171 F172 A173	R144-G175 PolarHBondContact NH1-O 3.36Å; D171-G175 PolarHBondContact O-N 2.75Å; F172-G175 PolarHBondContact O-N 3.47Å; A173-G175 PolarHBondContact O-N 3.25Å
176	I	95.8	Very high	95.2	Very high	2 Å²	2	40 Å²	40	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-91.4	-26.1	-176.3	-149.6	61.9	0	0	0	112.8	R144 L147 F172 A173 V174 N178 K179 I180 M204	R144-I176 HydrophobicContact CB-CD1 4.3Å; R144-I176 HydrophobicContact CG-CD1 4.34Å; L147-I176 HydrophobicContact CD1-CD1 3.74Å; L147-I176 HydrophobicContact CD1-CG1 4.27Å; F172-I176 HydrophobicContact CD1-CB 4.41Å; F172-I176 HydrophobicContact CD1-CG2 4.19Å; F172-I176 HydrophobicContact CE1-CB 3.98Å; F172-I176 HydrophobicContact CE1-CG1 4.07Å; F172-I176 HydrophobicContact CE1-CG2 3.91Å; F172-I176 HydrophobicContact CE2-CD1 4.47Å; F172-I176 HydrophobicContact CZ-CB 4.12Å; F172-I176 HydrophobicContact CZ-CD1 4.05Å; F172-I176 HydrophobicContact CZ-CG1 3.91Å; F172-I176 WeakPolarHBondContact O-CB 3.32Å; F172-I176 WeakPolarHBondContact O-CG2 3.5Å; F172-I176 PolarHBondContact O-N 3.42Å; A173-I176 PolarHBondContact O-N 2.82Å; V174-I176 VanDerWaalsContact C-N 3.33Å; V174-I176 PolarHBondContact O-N 3.33Å; I176-N178 VanDerWaalsContact C-N 3.35Å; I176-N178 PolarHBondContact O-N 3.28Å; I176-K179 HydrophobicContact CD1-CB 4.36Å; I176-K179 WeakPolarHBondContact O-CB 2.9Å; I176-K179 PolarHBondContact O-N 3.36Å; I176-I180 HydrophobicContact CG1-CD1 4.26Å; I176-I180 HydrophobicContact CG1-CG1 4.09Å; I176-I180 HydrophobicContact CG2-CG1 4.45Å; I176-I180 WeakPolarHBondContact O-CG1 3.39Å; I176-I180 PolarHBondContact O-N 3.3Å; I176-M204 HydrophobicContact CG2-CE 4.15Å
177	C	95.1	Very high	94.6	Very high	3 Å²	3	48.2 Å²	48.2	2%	0.02	26%	0.261	C	S	.	.	H	α-helix	trans	-54.4	-46.9	-174.2	-175.8	0	0	0	0	112.8	A173 K179 I180 S181 M204	A173-C177 VanDerWaalsContact O-CB 3.25Å; A173-C177 WeakPolarHBondContact O-CB 3.38Å; A173-C177 PolarHBondContact O-N 3.22Å; C177-K179 PolarHBondContact O-N 2.72Å; C177-I180 PolarHBondContact O-N 2.83Å; C177-S181 WeakPolarHBondContact O-CB 3.4Å; C177-S181 PolarHBondContact O-N 2.7Å; C177-S181 PolarHBondContact O-OG 3.43Å; C177-M204 HydrophobicContact CB-CE 4.16Å; C177-M204 HydrophobicContact CB-SD 3.91Å
178	N	93	Very high	94.3	Very high	107 Å²	107	51.9 Å²	51.9	57%	0.572	29%	0.292	S	S	*	.	H	α-helix	trans	-62.1	-43.2	177.2	-69.6	-12.6	0	0	0	111.8	I176 I180 S181 E182	I176-N178 VanDerWaalsContact C-N 3.35Å; I176-N178 PolarHBondContact O-N 3.28Å; N178-I180 PolarHBondContact O-N 3.39Å; N178-S181 WeakPolarHBondContact O-CB 3.25Å; N178-S181 PolarHBondContact O-N 3.14Å; N178-S181 VanDerWaalsContact O-N 3.16Å; N178-E182 WeakPolarHBondContact O-CG 3.14Å; N178-E182 PolarHBondContact O-N 3.09Å
179	K	94.9	Very high	94.1	Very high	29 Å²	29	47.6 Å²	47.6	13%	0.126	27%	0.273	C	S	.	.	H	α-helix	trans	-62.2	-44.8	178.5	-178.5	65.9	-176.6	-170.1	0	111.8	D148 I176 C177 S181 E182 M183	D148-K179 WeakPolarHBondContact OD1-CE 3.43Å; D148-K179 IonicContact OD1-NZ 2.77Å; D148-K179 PolarHBondContact OD1-NZ 2.84Å; D148-K179 WeakPolarHBondContact OD2-CE 3.4Å; D148-K179 IonicContact OD2-NZ 2.85Å; D148-K179 PolarHBondContact OD2-NZ 3.49Å; I176-K179 HydrophobicContact CD1-CB 4.36Å; I176-K179 WeakPolarHBondContact O-CB 2.9Å; I176-K179 PolarHBondContact O-N 3.36Å; C177-K179 PolarHBondContact O-N 2.72Å; K179-S181 VanDerWaalsContact C-N 3.3Å; K179-S181 PolarHBondContact O-N 3.05Å; K179-E182 PolarHBondContact O-N 3.28Å; K179-M183 HydrophobicContact CG-SD 4.35Å; K179-M183 WeakPolarHBondContact O-CG 3.48Å; K179-M183 PolarHBondContact O-N 3.45Å
180	I	96	Very high	93.8	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-62.7	-40.5	175.7	-61	-54.5	0	0	0	110.5	L147 I176 C177 N178 M183 I184 L197 I200 L201	L147-I180 HydrophobicContact CD1-CD1 4.18Å; I176-I180 HydrophobicContact CG1-CD1 4.26Å; I176-I180 HydrophobicContact CG1-CG1 4.09Å; I176-I180 HydrophobicContact CG2-CG1 4.45Å; I176-I180 WeakPolarHBondContact O-CG1 3.39Å; I176-I180 PolarHBondContact O-N 3.3Å; C177-I180 PolarHBondContact O-N 2.83Å; N178-I180 PolarHBondContact O-N 3.39Å; I180-M183 PolarHBondContact O-N 3.44Å; I180-I184 HydrophobicContact CG2-CD1 3.58Å; I180-I184 HydrophobicContact CG2-CG1 4.24Å; I180-I184 VanDerWaalsContact O-CG1 3.22Å; I180-I184 WeakPolarHBondContact O-CG1 3.27Å; I180-I184 PolarHBondContact O-N 2.9Å; I180-L197 HydrophobicContact CD1-CD2 3.78Å; I180-L197 HydrophobicContact CG2-CB 4.36Å; I180-I200 HydrophobicContact CD1-CD1 3.66Å; I180-I200 HydrophobicContact CG1-CD1 4.22Å; I180-I200 HydrophobicContact CG1-CG2 4.38Å; I180-L201 HydrophobicContact CG2-CD2 4.31Å
181	S	94.1	Very high	93.7	Very high	22 Å²	22	50.8 Å²	50.8	15%	0.154	30%	0.301	C	S	.	.	H	α-helix	trans	-60.2	-48.6	177.3	-54.5	0	0	0	0	111.6	C177 N178 K179 I184 Q185 L217	C177-S181 WeakPolarHBondContact O-CB 3.4Å; C177-S181 PolarHBondContact O-N 2.7Å; C177-S181 PolarHBondContact O-OG 3.43Å; N178-S181 WeakPolarHBondContact O-CB 3.25Å; N178-S181 PolarHBondContact O-N 3.14Å; N178-S181 VanDerWaalsContact O-N 3.16Å; K179-S181 VanDerWaalsContact C-N 3.3Å; K179-S181 PolarHBondContact O-N 3.05Å; S181-I184 PolarHBondContact O-N 3.36Å; S181-Q185 WeakPolarHBondContact O-CB 3.11Å; S181-Q185 WeakPolarHBondContact O-CG 3.38Å; S181-Q185 PolarHBondContact O-N 3.24Å; S181-L217 WeakPolarHBondContact OG-CD2 3.29Å
182	E	94.2	Very high	93.6	Very high	119 Å²	119	51.3 Å²	51.3	56%	0.556	31%	0.305	S	S	*	.	H	α-helix	trans	-59.1	-46.9	176.4	-71.2	164.4	-163.6	0	0	111.8	N178 K179 I184 Q185 G186	N178-E182 WeakPolarHBondContact O-CG 3.14Å; N178-E182 PolarHBondContact O-N 3.09Å; K179-E182 PolarHBondContact O-N 3.28Å; E182-I184 PolarHBondContact O-N 2.9Å; E182-Q185 PolarHBondContact O-N 3.49Å; E182-G186 WeakPolarHBondContact O-CA 3.34Å; E182-G186 PolarHBondContact O-N 2.9Å
183	M	95.4	Very high	93.4	Very high	21 Å²	21	52.3 Å²	52.3	10%	0.103	31%	0.31	C	S	.	.	H	α-helix	trans	-64.5	-38.8	178.7	-69.5	178.4	78.9	0	0	112.3	L147 K179 I180 T189 L197	L147-M183 HydrophobicContact CB-CE 4.44Å; L147-M183 HydrophobicContact CB-SD 4.2Å; L147-M183 WeakPolarHBondContact O-CE 3.42Å; K179-M183 HydrophobicContact CG-SD 4.35Å; K179-M183 WeakPolarHBondContact O-CG 3.48Å; K179-M183 PolarHBondContact O-N 3.45Å; I180-M183 PolarHBondContact O-N 3.44Å; M183-T189 VanDerWaalsContact O-CB 3.24Å; M183-T189 WeakPolarHBondContact O-CB 3.47Å; M183-T189 PolarHBondContact O-OG1 3.13Å; M183-L197 HydrophobicContact CB-CD1 3.84Å; M183-L197 HydrophobicContact CE-CD1 4.28Å
184	I	95.1	Very high	93.4	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-70.9	-41.3	178.9	-64.3	166.7	0	0	0	110.9	I180 S181 E182 G186 K194 L197 I198 L201 L221	I180-I184 HydrophobicContact CG2-CD1 3.58Å; I180-I184 HydrophobicContact CG2-CG1 4.24Å; I180-I184 VanDerWaalsContact O-CG1 3.22Å; I180-I184 WeakPolarHBondContact O-CG1 3.27Å; I180-I184 PolarHBondContact O-N 2.9Å; S181-I184 PolarHBondContact O-N 3.36Å; E182-I184 PolarHBondContact O-N 2.9Å; I184-G186 VanDerWaalsContact C-N 3.33Å; I184-K194 WeakPolarHBondContact O-CD 3.13Å; I184-K194 WeakPolarHBondContact O-CE 3.35Å; I184-K194 PolarHBondContact O-NZ 2.87Å; I184-L197 HydrophobicContact CD1-CB 4.03Å; I184-L197 HydrophobicContact CG1-CB 3.74Å; I184-L197 HydrophobicContact CG1-CD1 4.21Å; I184-I198 HydrophobicContact CD1-CG1 3.91Å; I184-I198 HydrophobicContact CG1-CG1 4.47Å; I184-I198 HydrophobicContact CG2-CG1 4.32Å; I184-L201 HydrophobicContact CD1-CD1 4.26Å; I184-L221 HydrophobicContact CG2-CD1 3.71Å; I184-L221 HydrophobicContact CG2-CD2 3.48Å; I184-L221 VanDerWaalsContact CG2-CD2 3.48Å; I184-L221 HydrophobicContact CG2-CG 4.24Å
185	Q	93	Very high	93.4	Very high	83 Å²	83	50.8 Å²	50.8	39%	0.388	30%	0.299	S	S	.	.	H	α-helix	trans	-75.2	-25.3	179.6	-69.1	177.7	-13.6	0	0	112.4	S181 E182 L217	S181-Q185 WeakPolarHBondContact O-CB 3.11Å; S181-Q185 WeakPolarHBondContact O-CG 3.38Å; S181-Q185 PolarHBondContact O-N 3.24Å; E182-Q185 PolarHBondContact O-N 3.49Å; Q185-L217 HydrophobicContact CG-CD1 4.11Å
186	G	92.8	Very high	93.6	Very high	25 Å²	25	53.4 Å²	53.4	26%	0.258	30%	0.301	S	S	.	.			trans	-55.8	135.4	177.3	0	0	0	0	0	113.2	E182 I184 A188 K194	E182-G186 WeakPolarHBondContact O-CA 3.34Å; E182-G186 PolarHBondContact O-N 2.9Å; I184-G186 VanDerWaalsContact C-N 3.33Å; G186-A188 VanDerWaalsContact C-N 3.3Å; G186-K194 WeakPolarHBondContact O-CE 3.47Å; G186-K194 PolarHBondContact O-NZ 3.4Å
187	L	85.4	Confident	93.6	Very high	172 Å²	172	53.3 Å²	53.3	90%	0.901	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-26.2	178.6	-60.9	160.9	0	0	0	111.9	T189	L187-T189 VanDerWaalsContact C-N 3.29Å; L187-T189 PolarHBondContact O-N 3.32Å
188	A	88.8	Confident	93.8	Very high	102 Å²	102	53.1 Å²	53.1	84%	0.843	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-17.7	-177.9	0	0	0	0	0	113.8	G186	G186-A188 VanDerWaalsContact C-N 3.3Å
189	T	91.2	Very high	94	Very high	23 Å²	23	50 Å²	50	14%	0.141	29%	0.285	C	S	.	.	S	Bend	trans	-84.9	122.3	-176.4	-57.2	0	0	0	0	110.4	M183 L187 L193 K194 L197	M183-T189 VanDerWaalsContact O-CB 3.24Å; M183-T189 WeakPolarHBondContact O-CB 3.47Å; M183-T189 PolarHBondContact O-OG1 3.13Å; L187-T189 VanDerWaalsContact C-N 3.29Å; L187-T189 PolarHBondContact O-N 3.32Å; T189-L193 HydrophobicContact CG2-CB 3.92Å; T189-L193 HydrophobicContact CG2-CD2 3.85Å; T189-L193 HydrophobicContact CG2-CG 3.83Å; T189-K194 HydrophobicContact CG2-CG 3.82Å; T189-K194 WeakPolarHBondContact O-CE 3.43Å; T189-L197 HydrophobicContact CG2-CD1 4.19Å
190	P	92.2	Very high	94.2	Very high	76 Å²	76	48.7 Å²	48.7	49%	0.494	28%	0.28	S	S	.	.			trans	-65.9	152.6	-179.7	27.1	-34.1	0	0	0	111.4	D192 L193 K194	P190-D192 VanDerWaalsContact C-N 3.27Å; P190-D192 PolarHBondContact O-N 3.47Å; P190-L193 HydrophobicContact CG-CB 3.93Å; P190-L193 PolarHBondContact O-N 2.72Å; P190-K194 PolarHBondContact O-N 3.48Å; P190-K194 VanDerWaalsContact O-N 3.08Å
191	V	92.6	Very high	94.2	Very high	81 Å²	81	48.7 Å²	48.7	49%	0.491	28%	0.28	S	S	.	.	H	α-helix	trans	-55.5	-40.9	-175.9	177.8	0	0	0	0	112.2	L193 K194 L195 M230	V191-L193 VanDerWaalsContact C-N 3.29Å; V191-L193 PolarHBondContact O-N 3.16Å; V191-K194 WeakPolarHBondContact O-CB 3.3Å; V191-K194 PolarHBondContact O-N 3.44Å; V191-L195 HydrophobicContact CG1-CD1 4.35Å; V191-L195 HydrophobicContact CG1-CG 4.49Å; V191-L195 WeakPolarHBondContact O-CG 3.43Å; V191-L195 PolarHBondContact O-N 2.92Å; V191-M230 HydrophobicContact CG1-CG 4.37Å; V191-M230 HydrophobicContact CG1-SD 4.17Å
192	D	92.9	Very high	94.3	Very high	106 Å²	106	50.1 Å²	50.1	57%	0.567	28%	0.284	S	S	*	.	H	α-helix	trans	-62.8	-35.4	179.3	-66.1	-49.4	0	0	0	112.7	P190 K196	P190-D192 VanDerWaalsContact C-N 3.27Å; P190-D192 PolarHBondContact O-N 3.47Å; D192-K196 WeakPolarHBondContact O-CG 3.47Å; D192-K196 PolarHBondContact O-N 2.79Å
193	L	94.3	Very high	94.5	Very high	28 Å²	28	45.9 Å²	45.9	15%	0.147	26%	0.264	C	S	.	.	H	α-helix	trans	-73.1	-38.7	175.4	-177.5	54.5	0	0	0	111	V155 V159 T189 P190 V191 L195 K196 L197	V155-L193 HydrophobicContact CG1-CD1 3.95Å; V155-L193 HydrophobicContact CG1-CD2 3.88Å; V159-L193 HydrophobicContact CG2-CD1 4.02Å; T189-L193 HydrophobicContact CG2-CB 3.92Å; T189-L193 HydrophobicContact CG2-CD2 3.85Å; T189-L193 HydrophobicContact CG2-CG 3.83Å; P190-L193 HydrophobicContact CG-CB 3.93Å; P190-L193 PolarHBondContact O-N 2.72Å; V191-L193 VanDerWaalsContact C-N 3.29Å; V191-L193 PolarHBondContact O-N 3.16Å; L193-L195 VanDerWaalsContact C-N 3.3Å; L193-L195 PolarHBondContact O-N 2.98Å; L193-K196 PolarHBondContact O-N 3.44Å; L193-L197 HydrophobicContact CD1-CD1 4.42Å; L193-L197 HydrophobicContact CD1-CG 4.27Å; L193-L197 HydrophobicContact CG-CD1 4.01Å; L193-L197 HydrophobicContact CG-CG 4.38Å; L193-L197 WeakPolarHBondContact O-CG 3.49Å; L193-L197 PolarHBondContact O-N 2.84Å
194	K	95.4	Very high	94.5	Very high	10 Å²	10	44.9 Å²	44.9	4%	0.043	26%	0.259	C	S	.	.	H	α-helix	trans	-57.5	-43.8	172.7	-60.7	-170	-176	-153.2	0	111.6	I184 G186 T189 P190 V191 K196 L197 I198 Y225 M230	I184-K194 WeakPolarHBondContact O-CD 3.13Å; I184-K194 WeakPolarHBondContact O-CE 3.35Å; I184-K194 PolarHBondContact O-NZ 2.87Å; G186-K194 WeakPolarHBondContact O-CE 3.47Å; G186-K194 PolarHBondContact O-NZ 3.4Å; T189-K194 HydrophobicContact CG2-CG 3.82Å; T189-K194 WeakPolarHBondContact O-CE 3.43Å; P190-K194 PolarHBondContact O-N 3.48Å; P190-K194 VanDerWaalsContact O-N 3.08Å; V191-K194 WeakPolarHBondContact O-CB 3.3Å; V191-K194 PolarHBondContact O-N 3.44Å; K194-K196 PolarHBondContact O-N 3.33Å; K194-L197 PolarHBondContact O-N 2.84Å; K194-L197 VanDerWaalsContact O-N 3.16Å; K194-I198 WeakPolarHBondContact O-CD1 3.21Å; K194-I198 VanDerWaalsContact O-CG1 3.25Å; K194-I198 WeakPolarHBondContact O-CG1 3.39Å; K194-I198 PolarHBondContact O-N 3.03Å; K194-Y225 PolarHBondContact NZ-OH 3.08Å; K194-M230 HydrophobicContact CB-CE 4.2Å; K194-M230 HydrophobicContact CB-SD 4.33Å; K194-M230 HydrophobicContact CD-CE 4.46Å
195	L	96	Very high	94.5	Very high	26 Å²	26	48 Å²	48	14%	0.136	27%	0.273	C	S	.	.	H	α-helix	trans	-60.7	-29.1	176.3	-69.4	172.3	0	0	0	113.1	V191 L193 P199 K229 M230 V233	V191-L195 HydrophobicContact CG1-CD1 4.35Å; V191-L195 HydrophobicContact CG1-CG 4.49Å; V191-L195 WeakPolarHBondContact O-CG 3.43Å; V191-L195 PolarHBondContact O-N 2.92Å; L193-L195 VanDerWaalsContact C-N 3.3Å; L193-L195 PolarHBondContact O-N 2.98Å; L195-P199 WeakPolarHBondContact O-CD 3.17Å; L195-K229 HydrophobicContact CD1-CB 4.06Å; L195-K229 HydrophobicContact CD1-CD 4.19Å; L195-K229 HydrophobicContact CD2-CB 4.09Å; L195-M230 HydrophobicContact CD2-CG 4.18Å; L195-M230 HydrophobicContact CD2-SD 3.51Å; L195-M230 VanDerWaalsContact CD2-SD 3.51Å; L195-M230 HydrophobicContact CG-SD 3.91Å; L195-V233 HydrophobicContact CD2-CB 4.04Å; L195-V233 HydrophobicContact CD2-CG2 3.82Å
196	K	96.4	Very high	94.5	Very high	86 Å²	86	46.6 Å²	46.6	37%	0.374	27%	0.267	S	S	.	.	H	α-helix	trans	-83.6	-29.4	176.1	-65.1	175.8	-172.3	-175.4	0	112.9	E156 V159 D192 L193 K194	E156-K196 HydrophobicContact CG-CD 4.34Å; E156-K196 IonicContact OE1-NZ 3.9Å; E156-K196 PolarHBondContact OE1-NZ 3.1Å; E156-K196 IonicContact OE2-NZ 2.74Å; E156-K196 PolarHBondContact OE2-NZ 3Å; V159-K196 HydrophobicContact CG1-CB 4.15Å; V159-K196 WeakPolarHBondContact CG1-O 3.36Å; D192-K196 WeakPolarHBondContact O-CG 3.47Å; D192-K196 PolarHBondContact O-N 2.79Å; L193-K196 PolarHBondContact O-N 3.44Å; K194-K196 PolarHBondContact O-N 3.33Å
197	L	97.4	Very high	94.5	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-77.6	-39.5	179.2	-71.2	167.7	0	0	0	112.8	V159 I180 M183 I184 T189 L193 K194 I200	V159-L197 HydrophobicContact CG2-CD2 3.69Å; V159-L197 HydrophobicContact CG2-CG 4.41Å; I180-L197 HydrophobicContact CD1-CD2 3.78Å; I180-L197 HydrophobicContact CG2-CB 4.36Å; M183-L197 HydrophobicContact CB-CD1 3.84Å; M183-L197 HydrophobicContact CE-CD1 4.28Å; I184-L197 HydrophobicContact CD1-CB 4.03Å; I184-L197 HydrophobicContact CG1-CB 3.74Å; I184-L197 HydrophobicContact CG1-CD1 4.21Å; T189-L197 HydrophobicContact CG2-CD1 4.19Å; L193-L197 HydrophobicContact CD1-CD1 4.42Å; L193-L197 HydrophobicContact CD1-CG 4.27Å; L193-L197 HydrophobicContact CG-CD1 4.01Å; L193-L197 HydrophobicContact CG-CG 4.38Å; L193-L197 WeakPolarHBondContact O-CG 3.49Å; L193-L197 PolarHBondContact O-N 2.84Å; K194-L197 PolarHBondContact O-N 2.84Å; K194-L197 VanDerWaalsContact O-N 3.16Å; L197-I200 HydrophobicContact CD2-CD1 4.11Å; L197-I200 VanDerWaalsContact O-CB 3.32Å; L197-I200 WeakPolarHBondContact O-CB 3.5Å; L197-I200 WeakPolarHBondContact O-CG1 3.29Å; L197-I200 PolarHBondContact O-N 3.33Å; L197-I200 VanDerWaalsContact O-N 3.08Å
198	I	97.7	Very high	94.7	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-52.2	-48	-177.3	-71	160.8	0	0	0	112.4	I184 K194 I200 L201 L218 L221 M230 V233 T237	I184-I198 HydrophobicContact CD1-CG1 3.91Å; I184-I198 HydrophobicContact CG1-CG1 4.47Å; I184-I198 HydrophobicContact CG2-CG1 4.32Å; K194-I198 WeakPolarHBondContact O-CD1 3.21Å; K194-I198 VanDerWaalsContact O-CG1 3.25Å; K194-I198 WeakPolarHBondContact O-CG1 3.39Å; K194-I198 PolarHBondContact O-N 3.03Å; I198-I200 PolarHBondContact O-N 3.32Å; I198-L201 VanDerWaalsContact O-CB 3.32Å; I198-L201 WeakPolarHBondContact O-CB 3.3Å; I198-L201 WeakPolarHBondContact O-CG 3.25Å; I198-L201 PolarHBondContact O-N 2.87Å; I198-L218 HydrophobicContact CG2-CD2 3.88Å; I198-L221 HydrophobicContact CD1-CD1 4.33Å; I198-L221 HydrophobicContact CG1-CD1 4.03Å; I198-M230 HydrophobicContact CD1-CE 3.7Å; I198-M230 HydrophobicContact CD1-SD 4.11Å; I198-V233 HydrophobicContact CB-CG1 4.01Å; I198-V233 HydrophobicContact CG2-CG1 3.88Å; I198-T237 HydrophobicContact CG2-CG2 4.3Å; I198-T237 WeakPolarHBondContact O-CG2 3.35Å
199	P	98.2	Very high	94.8	Very high	41 Å²	41	44.4 Å²	44.4	27%	0.266	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-57	-22.4	179.9	-28.7	36.8	0	0	0	115.6	L195 L201 Q202 V233	L195-P199 WeakPolarHBondContact O-CD 3.17Å; P199-L201 PolarHBondContact O-N 3.46Å; P199-Q202 WeakPolarHBondContact O-CB 3.47Å; P199-Q202 VanDerWaalsContact O-CD 3.31Å; P199-Q202 WeakPolarHBondContact O-CG 3.46Å; P199-Q202 PolarHBondContact O-N 3.1Å; P199-Q202 VanDerWaalsContact O-N 3.12Å; P199-V233 HydrophobicContact CG-CG1 3.85Å
200	I	98	Very high	94.8	Very high	2 Å²	2	44 Å²	44	1%	0.01	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-58	-33.1	175.8	-59.8	172.1	0	0	0	110.5	V159 A162 A163 I180 L197 I198 Q202 H203 M204	V159-I200 HydrophobicContact CG1-CD1 4.05Å; A162-I200 HydrophobicContact CB-CD1 4.18Å; A163-I200 HydrophobicContact CB-CG1 4.1Å; I180-I200 HydrophobicContact CD1-CD1 3.66Å; I180-I200 HydrophobicContact CG1-CD1 4.22Å; I180-I200 HydrophobicContact CG1-CG2 4.38Å; L197-I200 HydrophobicContact CD2-CD1 4.11Å; L197-I200 VanDerWaalsContact O-CB 3.32Å; L197-I200 WeakPolarHBondContact O-CB 3.5Å; L197-I200 WeakPolarHBondContact O-CG1 3.29Å; L197-I200 PolarHBondContact O-N 3.33Å; L197-I200 VanDerWaalsContact O-N 3.08Å; I198-I200 PolarHBondContact O-N 3.32Å; I200-Q202 PolarHBondContact O-N 3.15Å; I200-Q202 VanDerWaalsContact O-N 3.12Å; I200-H203 PolarHBondContact O-N 3.46Å; I200-H203 VanDerWaalsContact O-N 3.15Å; I200-M204 HydrophobicContact CG2-CE 4.11Å
201	L	97.4	Very high	94.9	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-64	-16.7	-178.5	-58.9	172.5	0	0	0	113.4	I180 I184 I198 P199 H203 M204 A214 L217 L218 T237	I180-L201 HydrophobicContact CG2-CD2 4.31Å; I184-L201 HydrophobicContact CD1-CD1 4.26Å; I198-L201 VanDerWaalsContact O-CB 3.32Å; I198-L201 WeakPolarHBondContact O-CB 3.3Å; I198-L201 WeakPolarHBondContact O-CG 3.25Å; I198-L201 PolarHBondContact O-N 2.87Å; P199-L201 PolarHBondContact O-N 3.46Å; L201-H203 PolarHBondContact O-N 3.35Å; L201-M204 HydrophobicContact CD2-CG 4.33Å; L201-M204 WeakPolarHBondContact O-CB 3.49Å; L201-M204 WeakPolarHBondContact O-CG 3.21Å; L201-M204 PolarHBondContact O-N 2.88Å; L201-A214 HydrophobicContact CB-CB 4.45Å; L201-A214 HydrophobicContact CD2-CB 4.46Å; L201-L217 HydrophobicContact CD1-CD2 3.72Å; L201-L217 HydrophobicContact CD1-CG 4.34Å; L201-L217 HydrophobicContact CD2-CD2 4.21Å; L201-L218 HydrophobicContact CB-CD1 4.45Å; L201-L218 HydrophobicContact CD1-CD2 3.91Å; L201-L218 HydrophobicContact CD1-CG 4.02Å; L201-T237 HydrophobicContact CB-CG2 3.98Å
202	Q	96.3	Very high	94.8	Very high	51 Å²	51	39.7 Å²	39.7	24%	0.238	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-61.8	-23.9	175	79.3	-167.2	-5.9	0	0	112.6	P199 I200 M204 H205 T237 L240	P199-Q202 WeakPolarHBondContact O-CB 3.47Å; P199-Q202 VanDerWaalsContact O-CD 3.31Å; P199-Q202 WeakPolarHBondContact O-CG 3.46Å; P199-Q202 PolarHBondContact O-N 3.1Å; P199-Q202 VanDerWaalsContact O-N 3.12Å; I200-Q202 PolarHBondContact O-N 3.15Å; I200-Q202 VanDerWaalsContact O-N 3.12Å; Q202-M204 VanDerWaalsContact C-N 3.33Å; Q202-H205 PolarHBondContact O-ND1 3.39Å; Q202-H205 VanDerWaalsContact O-ND1 3.09Å; Q202-T237 HydrophobicContact CB-CG2 4.07Å; Q202-L240 HydrophobicContact CB-CB 4.08Å
203	H	97.4	Very high	94.8	Very high	31 Å²	31	36.7 Å²	36.7	14%	0.144	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-89.3	4.5	-178.2	-59.9	-61	0	0	0	113.6	A163 A167 I200 L201 H205 H206	A163-H203 PolarHBondContact O-CD2 3.15Å; A167-H203 WeakPolarHBondContact CB-ND1 3.46Å; I200-H203 PolarHBondContact O-N 3.46Å; I200-H203 VanDerWaalsContact O-N 3.15Å; L201-H203 PolarHBondContact O-N 3.35Å; H203-H205 PolarHBondContact O-N 3.02Å; H203-H206 PolarHBondContact O-CD2 3.22Å; H203-H206 PolarHBondContact O-NE2 2.97Å
204	M	96.4	Very high	94.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.197	C	C	.	.			trans	-83.1	33	179.4	-56.1	-59.9	158.1	0	0	112.7	A173 I176 C177 I200 L201 Q202 L210 A211 A214 L241	A173-M204 HydrophobicContact CB-CE 4.41Å; A173-M204 HydrophobicContact CB-SD 3.95Å; I176-M204 HydrophobicContact CG2-CE 4.15Å; C177-M204 HydrophobicContact CB-CE 4.16Å; C177-M204 HydrophobicContact CB-SD 3.91Å; I200-M204 HydrophobicContact CG2-CE 4.11Å; L201-M204 HydrophobicContact CD2-CG 4.33Å; L201-M204 WeakPolarHBondContact O-CB 3.49Å; L201-M204 WeakPolarHBondContact O-CG 3.21Å; L201-M204 PolarHBondContact O-N 2.88Å; Q202-M204 VanDerWaalsContact C-N 3.33Å; M204-L210 HydrophobicContact CB-CB 4.34Å; M204-L210 CarbonylContact O-C 3.6Å; M204-A211 VanDerWaalsContact O-CA 3.27Å; M204-A211 WeakPolarHBondContact O-CA 3.47Å; M204-A211 PolarHBondContact O-N 2.95Å; M204-A211 VanDerWaalsContact O-N 3.12Å; M204-A214 HydrophobicContact CB-CB 3.73Å; M204-A214 HydrophobicContact CG-CB 4Å; M204-L241 HydrophobicContact CB-CD1 4.17Å
205	H	94.6	Very high	94.7	Very high	65 Å²	65	36.4 Å²	36.4	30%	0.301	20%	0.201	S	C	.	.			trans	-95.5	5.3	-177.3	55.8	-94.6	0	0	0	113.8	Q202 H203 D207 L241	Q202-H205 PolarHBondContact O-ND1 3.39Å; Q202-H205 VanDerWaalsContact O-ND1 3.09Å; H203-H205 PolarHBondContact O-N 3.02Å; H205-D207 VanDerWaalsContact C-N 3.34Å; H205-D207 PolarHBondContact O-N 3.04Å; H205-L241 HydrophobicContact CB-CD1 4.02Å
206	H	93.8	Very high	94.5	Very high	54 Å²	54	41.1 Å²	41.1	25%	0.25	22%	0.223	C	C	.	.	S	Bend	trans	-68.7	-26.3	-175.7	-63.4	-69	0	0	0	114.6	S166 K170 H203 L210	S166-H206 PolarHBondContact O-NE2 3.18Å; K170-H206 HydrophobicContact CB-CB 4.06Å; K170-H206 HydrophobicContact CD-CB 4.1Å; K170-H206 HydrophobicContact CG-CB 3.78Å; H203-H206 PolarHBondContact O-CD2 3.22Å; H203-H206 PolarHBondContact O-NE2 2.97Å; H206-L210 HydrophobicContact CB-CD1 4.31Å
207	D	91.4	Very high	94.4	Very high	43 Å²	43	37.5 Å²	37.5	23%	0.23	21%	0.207	C	C	.	.	S	Bend	trans	-154.3	168.5	170.3	63.6	49.1	0	0	0	111.9	K170 H205 I209 L210 A211	K170-D207 WeakPolarHBondContact CE-OD2 3.42Å; K170-D207 IonicContact NZ-OD2 3.47Å; K170-D207 PolarHBondContact NZ-OD2 3.25Å; H205-D207 VanDerWaalsContact C-N 3.34Å; H205-D207 PolarHBondContact O-N 3.04Å; D207-I209 VanDerWaalsContact C-N 3.3Å; D207-I209 PolarHBondContact O-N 3.32Å; D207-I209 PolarHBondContact OD1-N 3Å; D207-I209 VanDerWaalsContact OD1-N 3.09Å; D207-L210 WeakPolarHBondContact OD1-CB 3.5Å; D207-L210 VanDerWaalsContact OD1-CG 3.32Å; D207-L210 WeakPolarHBondContact OD1-CG 3.42Å; D207-L210 PolarHBondContact OD1-N 3.19Å; D207-A211 WeakPolarHBondContact O-CB 3.43Å; D207-A211 PolarHBondContact O-N 2.99Å
208	A	89.8	Confident	94.4	Very high	71 Å²	71	37.5 Å²	37.5	59%	0.587	21%	0.207	S	C	*	.	H	α-helix	trans	-65.8	-30.7	-176.1	0	0	0	0	0	113.3	S212	A208-S212 WeakPolarHBondContact O-CB 3.09Å; A208-S212 PolarHBondContact O-N 3.23Å
209	I	90.6	Very high	94.2	Very high	139 Å²	139	42.4 Å²	42.4	71%	0.713	23%	0.23	S	C	*	.	H	α-helix	trans	-72.7	-47.4	-176.8	-57.4	172.5	0	0	0	109.3	D207 S212 S213	D207-I209 VanDerWaalsContact C-N 3.3Å; D207-I209 PolarHBondContact O-N 3.32Å; D207-I209 PolarHBondContact OD1-N 3Å; D207-I209 VanDerWaalsContact OD1-N 3.09Å; I209-S212 WeakPolarHBondContact O-CB 3.13Å; I209-S212 PolarHBondContact O-N 3.4Å; I209-S213 PolarHBondContact O-N 3Å; I209-S213 PolarHBondContact O-OG 3.45Å
210	L	92.4	Very high	94	Very high	14 Å²	14	45 Å²	45	7%	0.073	24%	0.239	C	C	.	.	H	α-helix	trans	-62.7	-42.8	174.6	-68.3	175.9	0	0	0	112.1	V174 M204 H206 D207 S212 S213 A214	V174-L210 HydrophobicContact CB-CD2 4.36Å; V174-L210 HydrophobicContact CG2-CD1 3.59Å; V174-L210 HydrophobicContact CG2-CD2 3.99Å; V174-L210 HydrophobicContact CG2-CG 4.17Å; M204-L210 HydrophobicContact CB-CB 4.34Å; M204-L210 CarbonylContact O-C 3.6Å; H206-L210 HydrophobicContact CB-CD1 4.31Å; D207-L210 WeakPolarHBondContact OD1-CB 3.5Å; D207-L210 VanDerWaalsContact OD1-CG 3.32Å; D207-L210 WeakPolarHBondContact OD1-CG 3.42Å; D207-L210 PolarHBondContact OD1-N 3.19Å; L210-S212 VanDerWaalsContact C-N 3.29Å; L210-S212 PolarHBondContact O-N 2.91Å; L210-S213 PolarHBondContact O-N 3.47Å; L210-S213 PolarHBondContact O-OG 3.17Å; L210-A214 VanDerWaalsContact O-CB 3.31Å; L210-A214 WeakPolarHBondContact O-CB 3.45Å; L210-A214 PolarHBondContact O-N 3.21Å
211	A	93.3	Very high	93.7	Very high	12 Å²	12	45 Å²	45	10%	0.099	24%	0.239	C	C	.	.	H	α-helix	trans	-62.9	-41	177.4	0	0	0	0	0	110.9	M204 D207 R215	M204-A211 VanDerWaalsContact O-CA 3.27Å; M204-A211 WeakPolarHBondContact O-CA 3.47Å; M204-A211 PolarHBondContact O-N 2.95Å; M204-A211 VanDerWaalsContact O-N 3.12Å; D207-A211 WeakPolarHBondContact O-CB 3.43Å; D207-A211 PolarHBondContact O-N 2.99Å; A211-R215 WeakPolarHBondContact O-CB 3.33Å; A211-R215 PolarHBondContact O-N 2.92Å
212	S	91.1	Very high	93.5	Very high	54 Å²	54	45.6 Å²	45.6	38%	0.378	24%	0.242	S	C	.	.	H	α-helix	trans	-63.9	-46.6	175.5	172.4	0	0	0	0	112.4	A208 I209 L210 R215 Q216	A208-S212 WeakPolarHBondContact O-CB 3.09Å; A208-S212 PolarHBondContact O-N 3.23Å; I209-S212 WeakPolarHBondContact O-CB 3.13Å; I209-S212 PolarHBondContact O-N 3.4Å; L210-S212 VanDerWaalsContact C-N 3.29Å; L210-S212 PolarHBondContact O-N 2.91Å; S212-R215 WeakPolarHBondContact O-CB 3.39Å; S212-R215 PolarHBondContact O-N 3.4Å; S212-Q216 WeakPolarHBondContact O-CG 3.41Å; S212-Q216 PolarHBondContact O-N 2.92Å
213	S	92.1	Very high	93.2	Very high	43 Å²	43	48 Å²	48	30%	0.301	26%	0.26	S	S	.	.	H	α-helix	trans	-65.8	-45.1	-179.5	66.1	0	0	0	0	111.7	I209 L210 R215 Q216 L217	I209-S213 PolarHBondContact O-N 3Å; I209-S213 PolarHBondContact O-OG 3.45Å; L210-S213 PolarHBondContact O-N 3.47Å; L210-S213 PolarHBondContact O-OG 3.17Å; S213-R215 VanDerWaalsContact C-N 3.3Å; S213-R215 PolarHBondContact O-N 3.43Å; S213-Q216 PolarHBondContact O-N 2.91Å; S213-L217 PolarHBondContact O-N 2.93Å
214	A	94.8	Very high	92.9	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-61.3	-39.7	174.9	0	0	0	0	0	111.6	L201 M204 L210 L217 L218 L241	L201-A214 HydrophobicContact CB-CB 4.45Å; L201-A214 HydrophobicContact CD2-CB 4.46Å; M204-A214 HydrophobicContact CB-CB 3.73Å; M204-A214 HydrophobicContact CG-CB 4Å; L210-A214 VanDerWaalsContact O-CB 3.31Å; L210-A214 WeakPolarHBondContact O-CB 3.45Å; L210-A214 PolarHBondContact O-N 3.21Å; A214-L217 PolarHBondContact O-N 3.08Å; A214-L218 WeakPolarHBondContact O-CB 3.37Å; A214-L218 WeakPolarHBondContact O-CD1 3.49Å; A214-L218 VanDerWaalsContact O-CG 3.24Å; A214-L218 WeakPolarHBondContact O-CG 3.45Å; A214-L218 PolarHBondContact O-N 3.4Å; A214-L241 HydrophobicContact CB-CD2 3.84Å
215	R	93.3	Very high	92.6	Very high	32 Å²	32	52.4 Å²	52.4	12%	0.121	29%	0.285	C	S	.	.	H	α-helix	trans	-60.1	-48.9	173.9	164.8	160.9	-163.1	108.2	11.3	112.3	A211 S212 S213 L217 L218 Q219 F238 D248 K251	A211-R215 WeakPolarHBondContact O-CB 3.33Å; A211-R215 PolarHBondContact O-N 2.92Å; S212-R215 WeakPolarHBondContact O-CB 3.39Å; S212-R215 PolarHBondContact O-N 3.4Å; S213-R215 VanDerWaalsContact C-N 3.3Å; S213-R215 PolarHBondContact O-N 3.43Å; R215-L217 VanDerWaalsContact C-N 3.33Å; R215-L217 PolarHBondContact O-N 3.24Å; R215-L218 PolarHBondContact O-N 3.04Å; R215-Q219 WeakPolarHBondContact O-CB 3.42Å; R215-Q219 PolarHBondContact O-N 3.23Å; R215-F238 HydrophobicContact CB-CE2 3.81Å; R215-F238 HydrophobicContact CB-CZ 4.28Å; R215-F238 HydrophobicContact CG-CE2 3.52Å; R215-F238 HydrophobicContact CG-CZ 3.56Å; R215-D248 WeakPolarHBondContact CD-OD2 3.35Å; R215-D248 IonicContact NE-OD2 2.64Å; R215-K251 VanDerWaalsContact NH2-CB 3.32Å
216	Q	92.9	Very high	92.4	Very high	126 Å²	126	53.8 Å²	53.8	59%	0.589	30%	0.3	S	S	*	.	H	α-helix	trans	-60.9	-44	178.4	-73.1	174.4	0.8	0	0	111.3	S212 S213 Q219 Q220	S212-Q216 WeakPolarHBondContact O-CG 3.41Å; S212-Q216 PolarHBondContact O-N 2.92Å; S213-Q216 PolarHBondContact O-N 2.91Å; Q216-Q219 PolarHBondContact O-N 2.85Å; Q216-Q220 PolarHBondContact O-N 3.46Å
217	L	94.7	Very high	92.4	Very high	10 Å²	10	54.1 Å²	54.1	5%	0.052	31%	0.309	C	S	.	.	H	α-helix	trans	-60.9	-50.7	175.6	177.1	62.2	0	0	0	111.6	S181 Q185 L201 S213 A214 R215 Q219 Q220 L221	S181-L217 WeakPolarHBondContact OG-CD2 3.29Å; Q185-L217 HydrophobicContact CG-CD1 4.11Å; L201-L217 HydrophobicContact CD1-CD2 3.72Å; L201-L217 HydrophobicContact CD1-CG 4.34Å; L201-L217 HydrophobicContact CD2-CD2 4.21Å; S213-L217 PolarHBondContact O-N 2.93Å; A214-L217 PolarHBondContact O-N 3.08Å; R215-L217 VanDerWaalsContact C-N 3.33Å; R215-L217 PolarHBondContact O-N 3.24Å; L217-Q219 VanDerWaalsContact C-N 3.27Å; L217-Q219 PolarHBondContact O-N 3.05Å; L217-Q220 WeakPolarHBondContact O-CB 3.46Å; L217-Q220 PolarHBondContact O-N 3.44Å; L217-Q220 VanDerWaalsContact O-N 3.12Å; L217-L221 HydrophobicContact CD1-CD1 4.32Å; L217-L221 HydrophobicContact CD1-CD2 4.38Å; L217-L221 HydrophobicContact CD1-CG 4.14Å; L217-L221 HydrophobicContact CG-CD1 4.1Å; L217-L221 HydrophobicContact CG-CG 4.33Å; L217-L221 VanDerWaalsContact O-CG 3.28Å; L217-L221 WeakPolarHBondContact O-CG 3.33Å; L217-L221 PolarHBondContact O-N 2.75Å
218	L	95.5	Very high	92.6	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-59.3	-39.5	179.2	-73.3	165.1	0	0	0	111.8	I198 L201 A214 R215 L221 V222 T237 F238 L241	I198-L218 HydrophobicContact CG2-CD2 3.88Å; L201-L218 HydrophobicContact CB-CD1 4.45Å; L201-L218 HydrophobicContact CD1-CD2 3.91Å; L201-L218 HydrophobicContact CD1-CG 4.02Å; A214-L218 WeakPolarHBondContact O-CB 3.37Å; A214-L218 WeakPolarHBondContact O-CD1 3.49Å; A214-L218 VanDerWaalsContact O-CG 3.24Å; A214-L218 WeakPolarHBondContact O-CG 3.45Å; A214-L218 PolarHBondContact O-N 3.4Å; R215-L218 PolarHBondContact O-N 3.04Å; L218-L221 PolarHBondContact O-N 2.92Å; L218-V222 VanDerWaalsContact O-CG2 3.29Å; L218-V222 WeakPolarHBondContact O-CG2 3.45Å; L218-V222 PolarHBondContact O-N 2.83Å; L218-T237 HydrophobicContact CD1-CG2 4.25Å; L218-T237 HydrophobicContact CD2-CG2 4.16Å; L218-F238 HydrophobicContact CB-CB 4.45Å; L218-F238 HydrophobicContact CB-CD1 4.32Å; L218-F238 HydrophobicContact CB-CG 4.25Å; L218-F238 HydrophobicContact CD1-CB 3.93Å; L218-F238 HydrophobicContact CD1-CD2 4.12Å; L218-F238 HydrophobicContact CD1-CG 4.15Å; L218-L241 HydrophobicContact CD1-CD2 4.4Å
219	Q	93.6	Very high	92.9	Very high	103 Å²	103	58 Å²	58	48%	0.481	32%	0.315	S	S	.	.	H	α-helix	trans	-63	-45.8	174.7	-173	170.2	8.4	0	0	111.6	R215 Q216 L217 L221 V222 T223	R215-Q219 WeakPolarHBondContact O-CB 3.42Å; R215-Q219 PolarHBondContact O-N 3.23Å; Q216-Q219 PolarHBondContact O-N 2.85Å; L217-Q219 VanDerWaalsContact C-N 3.27Å; L217-Q219 PolarHBondContact O-N 3.05Å; Q219-L221 PolarHBondContact O-N 3.48Å; Q219-V222 PolarHBondContact O-N 3.35Å; Q219-T223 PolarHBondContact O-N 3.01Å; Q219-T223 PolarHBondContact O-OG1 3.17Å
220	Q	93.9	Very high	93.1	Very high	96 Å²	96	51.6 Å²	51.6	45%	0.449	28%	0.282	S	S	.	.	H	α-helix	trans	-58.2	-47.5	174.5	-174	-174.1	-0.1	0	0	111	Q216 L217 V222 T223 S224	Q216-Q220 PolarHBondContact O-N 3.46Å; L217-Q220 WeakPolarHBondContact O-CB 3.46Å; L217-Q220 PolarHBondContact O-N 3.44Å; L217-Q220 VanDerWaalsContact O-N 3.12Å; Q220-V222 VanDerWaalsContact C-N 3.34Å; Q220-V222 PolarHBondContact O-N 3.44Å; Q220-T223 PolarHBondContact O-N 2.83Å; Q220-T223 VanDerWaalsContact O-N 3.08Å; Q220-T223 PolarHBondContact O-OG1 2.99Å; Q220-S224 WeakPolarHBondContact O-CB 3.44Å; Q220-S224 PolarHBondContact O-N 3.35Å; Q220-S224 PolarHBondContact O-OG 2.96Å; Q220-S224 VanDerWaalsContact O-OG 3.08Å
221	L	92.8	Very high	93.4	Very high	2 Å²	2	51 Å²	51	1%	0.01	28%	0.279	C	S	.	.	H	α-helix	trans	-61.3	-40.2	-178.4	-67.1	176	0	0	0	112.9	I184 I198 L217 L218 Q219 T223 S224 Y225	I184-L221 HydrophobicContact CG2-CD1 3.71Å; I184-L221 HydrophobicContact CG2-CD2 3.48Å; I184-L221 VanDerWaalsContact CG2-CD2 3.48Å; I184-L221 HydrophobicContact CG2-CG 4.24Å; I198-L221 HydrophobicContact CD1-CD1 4.33Å; I198-L221 HydrophobicContact CG1-CD1 4.03Å; L217-L221 HydrophobicContact CD1-CD1 4.32Å; L217-L221 HydrophobicContact CD1-CD2 4.38Å; L217-L221 HydrophobicContact CD1-CG 4.14Å; L217-L221 HydrophobicContact CG-CD1 4.1Å; L217-L221 HydrophobicContact CG-CG 4.33Å; L217-L221 VanDerWaalsContact O-CG 3.28Å; L217-L221 WeakPolarHBondContact O-CG 3.33Å; L217-L221 PolarHBondContact O-N 2.75Å; L218-L221 PolarHBondContact O-N 2.92Å; Q219-L221 PolarHBondContact O-N 3.48Å; L221-T223 VanDerWaalsContact C-N 3.29Å; L221-T223 PolarHBondContact O-N 3.04Å; L221-S224 PolarHBondContact O-N 3.26Å; L221-Y225 HydrophobicContact CD2-CD2 3.79Å; L221-Y225 HydrophobicContact CD2-CE2 3.74Å; L221-Y225 WeakPolarHBondContact O-CB 3.4Å; L221-Y225 PolarHBondContact O-N 2.74Å
222	V	93.1	Very high	93.6	Very high	11 Å²	11	52.7 Å²	52.7	7%	0.067	29%	0.286	C	S	.	.	H	α-helix	trans	-65.5	-36.2	177.1	175.8	0	0	0	0	110.9	L218 Q219 Q220 V231 L235 Y259	L218-V222 VanDerWaalsContact O-CG2 3.29Å; L218-V222 WeakPolarHBondContact O-CG2 3.45Å; L218-V222 PolarHBondContact O-N 2.83Å; Q219-V222 PolarHBondContact O-N 3.35Å; Q220-V222 VanDerWaalsContact C-N 3.34Å; Q220-V222 PolarHBondContact O-N 3.44Å; V222-V231 HydrophobicContact CG1-CG1 4.44Å; V222-L235 HydrophobicContact CG2-CD2 4.34Å; V222-L235 HydrophobicContact CG2-CG 4.44Å; V222-Y259 HydrophobicContact CG1-CE1 4.2Å; V222-Y259 HydrophobicContact CG1-CE2 4.12Å; V222-Y259 VanDerWaalsContact CG1-CZ 3.49Å; V222-Y259 WeakPolarHBondContact CG1-OH 3.41Å
223	T	90.8	Very high	93.9	Very high	102 Å²	102	51.8 Å²	51.8	63%	0.626	28%	0.278	S	S	*	.	H	α-helix	trans	-76.1	-36.6	176.5	58.6	0	0	0	0	113.5	Q219 Q220 L221	Q219-T223 PolarHBondContact O-N 3.01Å; Q219-T223 PolarHBondContact O-OG1 3.17Å; Q220-T223 PolarHBondContact O-N 2.83Å; Q220-T223 VanDerWaalsContact O-N 3.08Å; Q220-T223 PolarHBondContact O-OG1 2.99Å; L221-T223 VanDerWaalsContact C-N 3.29Å; L221-T223 PolarHBondContact O-N 3.04Å
224	S	90.6	Very high	94.2	Very high	60 Å²	60	49.8 Å²	49.8	42%	0.42	26%	0.264	S	S	.	.	H	α-helix	trans	-89.6	-22.6	-173.5	68.5	0	0	0	0	113.9	Q220 L221 P226	Q220-S224 WeakPolarHBondContact O-CB 3.44Å; Q220-S224 PolarHBondContact O-N 3.35Å; Q220-S224 PolarHBondContact O-OG 2.96Å; Q220-S224 VanDerWaalsContact O-OG 3.08Å; L221-S224 PolarHBondContact O-N 3.26Å; S224-P226 WeakPolarHBondContact O-CD 3.34Å
225	Y	89.9	Confident	94.3	Very high	63 Å²	63	49.8 Å²	49.8	25%	0.247	26%	0.264	C	S	.	.			trans	-121.5	80.5	-179	-65.9	-78.6	0	0	0	111.6	K194 L221 S227 M230	K194-Y225 PolarHBondContact NZ-OH 3.08Å; L221-Y225 HydrophobicContact CD2-CD2 3.79Å; L221-Y225 HydrophobicContact CD2-CE2 3.74Å; L221-Y225 WeakPolarHBondContact O-CB 3.4Å; L221-Y225 PolarHBondContact O-N 2.74Å; Y225-S227 PolarHBondContact O-N 3.34Å; Y225-M230 HydrophobicContact CD1-CE 4.37Å; Y225-M230 HydrophobicContact CD2-CE 4.11Å; Y225-M230 HydrophobicContact CG-CE 3.88Å
226	P	89.9	Confident	94.5	Very high	94 Å²	94	51.8 Å²	51.8	61%	0.61	28%	0.275	S	S	*	.			trans	-73.4	13.4	-173	31.2	-37	0	0	0	114.8	S224 R265	S224-P226 WeakPolarHBondContact O-CD 3.34Å; P226-R265 PolarHBondContact O-NH1 3.3Å
227	S	94.4	Very high	94.7	Very high	62 Å²	62	46 Å²	46	43%	0.434	25%	0.248	S	C	.	.			trans	-68.3	139.8	176.5	171.2	0	0	0	0	111.8	Y225 K229 M230 V231	Y225-S227 PolarHBondContact O-N 3.34Å; S227-K229 VanDerWaalsContact C-N 3.32Å; S227-K229 PolarHBondContact O-N 2.95Å; S227-M230 PolarHBondContact O-N 3.45Å; S227-M230 VanDerWaalsContact O-N 3.13Å; S227-V231 WeakPolarHBondContact O-CG2 3.39Å; S227-V231 PolarHBondContact O-N 3.09Å
228	T	95.8	Very high	94.8	Very high	58 Å²	58	45.6 Å²	45.6	36%	0.356	25%	0.246	S	C	.	.	H	α-helix	trans	-53.2	-45.2	-179.5	-55.9	0	0	0	0	112.8	I232 A267	T228-I232 HydrophobicContact CG2-CD1 3.91Å; T228-I232 WeakPolarHBondContact O-CB 3.32Å; T228-I232 WeakPolarHBondContact O-CD1 3.17Å; T228-I232 WeakPolarHBondContact O-CG1 3.29Å; T228-I232 PolarHBondContact O-N 3.11Å; T228-I232 VanDerWaalsContact O-N 3.08Å; T228-A267 HydrophobicContact CG2-CB 3.92Å
229	K	96	Very high	94.8	Very high	138 Å²	138	45.6 Å²	45.6	60%	0.6	25%	0.246	S	C	*	.	H	α-helix	trans	-67.9	-41.8	179.6	-67.9	-176.6	-179.2	178.3	0	111.8	L195 S227 I232 V233	L195-K229 HydrophobicContact CD1-CB 4.06Å; L195-K229 HydrophobicContact CD1-CD 4.19Å; L195-K229 HydrophobicContact CD2-CB 4.09Å; S227-K229 VanDerWaalsContact C-N 3.32Å; S227-K229 PolarHBondContact O-N 2.95Å; K229-I232 PolarHBondContact O-N 3.11Å; K229-V233 WeakPolarHBondContact O-CG2 3.32Å; K229-V233 PolarHBondContact O-N 3.21Å
230	M	95.3	Very high	95	Very high	4 Å²	4	42.6 Å²	42.6	2%	0.02	23%	0.233	C	C	.	.	H	α-helix	trans	-64.4	-47.1	-179.8	-71.8	-67.5	-70.1	0	0	111.5	V191 K194 L195 I198 Y225 S227 I232 V233 S234	V191-M230 HydrophobicContact CG1-CG 4.37Å; V191-M230 HydrophobicContact CG1-SD 4.17Å; K194-M230 HydrophobicContact CB-CE 4.2Å; K194-M230 HydrophobicContact CB-SD 4.33Å; K194-M230 HydrophobicContact CD-CE 4.46Å; L195-M230 HydrophobicContact CD2-CG 4.18Å; L195-M230 HydrophobicContact CD2-SD 3.51Å; L195-M230 VanDerWaalsContact CD2-SD 3.51Å; L195-M230 HydrophobicContact CG-SD 3.91Å; I198-M230 HydrophobicContact CD1-CE 3.7Å; I198-M230 HydrophobicContact CD1-SD 4.11Å; Y225-M230 HydrophobicContact CD1-CE 4.37Å; Y225-M230 HydrophobicContact CD2-CE 4.11Å; Y225-M230 HydrophobicContact CG-CE 3.88Å; S227-M230 PolarHBondContact O-N 3.45Å; S227-M230 VanDerWaalsContact O-N 3.13Å; M230-I232 VanDerWaalsContact C-N 3.33Å; M230-I232 PolarHBondContact O-N 2.68Å; M230-V233 PolarHBondContact O-N 3.41Å; M230-S234 VanDerWaalsContact O-CB 3.24Å; M230-S234 WeakPolarHBondContact O-CB 3.37Å; M230-S234 PolarHBondContact O-N 2.91Å; M230-S234 PolarHBondContact O-OG 2.95Å
231	V	97	Very high	95.1	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.006	21%	0.213	C	C	.	.	H	α-helix	trans	-61	-43.6	176.3	173.4	0	0	0	0	110.5	V222 S227 S234 L235 V268	V222-V231 HydrophobicContact CG1-CG1 4.44Å; S227-V231 WeakPolarHBondContact O-CG2 3.39Å; S227-V231 PolarHBondContact O-N 3.09Å; V231-S234 PolarHBondContact O-N 3.11Å; V231-L235 HydrophobicContact CG1-CD1 3.71Å; V231-L235 HydrophobicContact CG1-CG 4.18Å; V231-L235 VanDerWaalsContact O-CB 3.31Å; V231-L235 WeakPolarHBondContact O-CB 3.32Å; V231-L235 VanDerWaalsContact O-CG 3.3Å; V231-L235 WeakPolarHBondContact O-CG 3.37Å; V231-L235 PolarHBondContact O-N 2.93Å; V231-V268 HydrophobicContact CG1-CG1 4.06Å; V231-V268 HydrophobicContact CG1-CG2 4.09Å
232	I	97.8	Very high	95.1	Very high	47 Å²	47	38.3 Å²	38.3	24%	0.241	21%	0.213	C	C	.	.	H	α-helix	trans	-61.2	-53.1	179.4	-77.9	171.9	0	0	0	111.7	T228 K229 M230 S234 L235 H236 A267 V268 L271	T228-I232 HydrophobicContact CG2-CD1 3.91Å; T228-I232 WeakPolarHBondContact O-CB 3.32Å; T228-I232 WeakPolarHBondContact O-CD1 3.17Å; T228-I232 WeakPolarHBondContact O-CG1 3.29Å; T228-I232 PolarHBondContact O-N 3.11Å; T228-I232 VanDerWaalsContact O-N 3.08Å; K229-I232 PolarHBondContact O-N 3.11Å; M230-I232 VanDerWaalsContact C-N 3.33Å; M230-I232 PolarHBondContact O-N 2.68Å; I232-S234 VanDerWaalsContact C-N 3.32Å; I232-S234 PolarHBondContact O-N 3.32Å; I232-L235 PolarHBondContact O-N 2.92Å; I232-H236 WeakPolarHBondContact O-CB 3.39Å; I232-H236 PolarHBondContact O-N 3.18Å; I232-A267 HydrophobicContact CD1-CB 3.93Å; I232-V268 HydrophobicContact CG1-CG2 4.44Å; I232-L271 VanDerWaalsContact CA-CD2 3.47Å; I232-L271 HydrophobicContact CB-CD2 3.97Å; I232-L271 HydrophobicContact CG1-CB 4.44Å; I232-L271 HydrophobicContact CG1-CD2 4Å; I232-L271 HydrophobicContact CG2-CD2 3.96Å; I232-L271 WeakPolarHBondContact O-CD2 3.22Å
233	V	98	Very high	95.1	Very high	36 Å²	36	37.9 Å²	37.9	22%	0.218	21%	0.211	C	C	.	.	H	α-helix	trans	-65.3	-38.8	-177.4	173.7	0	0	0	0	111	L195 I198 P199 K229 M230 T237	L195-V233 HydrophobicContact CD2-CB 4.04Å; L195-V233 HydrophobicContact CD2-CG2 3.82Å; I198-V233 HydrophobicContact CB-CG1 4.01Å; I198-V233 HydrophobicContact CG2-CG1 3.88Å; P199-V233 HydrophobicContact CG-CG1 3.85Å; K229-V233 WeakPolarHBondContact O-CG2 3.32Å; K229-V233 PolarHBondContact O-N 3.21Å; M230-V233 PolarHBondContact O-N 3.41Å; V233-T237 WeakPolarHBondContact O-CB 3.43Å; V233-T237 PolarHBondContact O-N 3.4Å; V233-T237 PolarHBondContact O-OG1 3.35Å
234	S	97.2	Very high	95.3	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.007	20%	0.198	C	C	.	.	H	α-helix	trans	-66.9	-48.6	178.4	-54.4	0	0	0	0	111.9	M230 V231 I232 H236 T237 F238	M230-S234 VanDerWaalsContact O-CB 3.24Å; M230-S234 WeakPolarHBondContact O-CB 3.37Å; M230-S234 PolarHBondContact O-N 2.91Å; M230-S234 PolarHBondContact O-OG 2.95Å; V231-S234 PolarHBondContact O-N 3.11Å; I232-S234 VanDerWaalsContact C-N 3.32Å; I232-S234 PolarHBondContact O-N 3.32Å; S234-H236 PolarHBondContact O-N 3.5Å; S234-T237 PolarHBondContact O-N 2.79Å; S234-F238 VanDerWaalsContact O-CB 3.27Å; S234-F238 WeakPolarHBondContact O-CB 3.23Å; S234-F238 PolarHBondContact O-N 2.99Å
235	L	97.1	Very high	95.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.7	-42.9	178	-75.1	178.1	0	0	0	111.8	V222 V231 I232 F238 T239 L255 Y259 V268 L271	V222-L235 HydrophobicContact CG2-CD2 4.34Å; V222-L235 HydrophobicContact CG2-CG 4.44Å; V231-L235 HydrophobicContact CG1-CD1 3.71Å; V231-L235 HydrophobicContact CG1-CG 4.18Å; V231-L235 VanDerWaalsContact O-CB 3.31Å; V231-L235 WeakPolarHBondContact O-CB 3.32Å; V231-L235 VanDerWaalsContact O-CG 3.3Å; V231-L235 WeakPolarHBondContact O-CG 3.37Å; V231-L235 PolarHBondContact O-N 2.93Å; I232-L235 PolarHBondContact O-N 2.92Å; L235-F238 WeakPolarHBondContact O-CB 3.31Å; L235-F238 PolarHBondContact O-N 2.81Å; L235-T239 PolarHBondContact O-N 3.47Å; L235-T239 PolarHBondContact O-OG1 3.45Å; L235-T239 VanDerWaalsContact O-OG1 3.11Å; L235-L255 HydrophobicContact CD2-CD2 4.08Å; L235-Y259 HydrophobicContact CD1-CD1 4.38Å; L235-Y259 HydrophobicContact CD1-CD2 4.08Å; L235-Y259 HydrophobicContact CD1-CE2 4.48Å; L235-Y259 HydrophobicContact CD1-CG 4.08Å; L235-Y259 HydrophobicContact CD2-CD2 4Å; L235-Y259 HydrophobicContact CD2-CE2 3.97Å; L235-V268 HydrophobicContact CD1-CG1 4.1Å; L235-L271 HydrophobicContact CB-CD2 3.85Å
236	H	98.3	Very high	95	Very high	74 Å²	74	35.8 Å²	35.8	34%	0.343	20%	0.202	S	C	.	.	H	α-helix	trans	-63.7	-46	178.8	-171.1	56.1	0	0	0	111.9	I232 S234 F238 T239 L240 L271 D275	I232-H236 WeakPolarHBondContact O-CB 3.39Å; I232-H236 PolarHBondContact O-N 3.18Å; S234-H236 PolarHBondContact O-N 3.5Å; H236-F238 VanDerWaalsContact C-N 3.26Å; H236-F238 PolarHBondContact O-N 3.44Å; H236-T239 WeakPolarHBondContact O-CB 3.47Å; H236-T239 PolarHBondContact O-N 3.3Å; H236-L240 WeakPolarHBondContact O-CG 3.41Å; H236-L240 PolarHBondContact O-N 3.4Å; H236-L271 HydrophobicContact CB-CD1 4.1Å; H236-L271 HydrophobicContact CB-CD2 4.43Å; H236-D275 WeakPolarHBondContact CA-OD2 3.37Å; H236-D275 IonicContact CE1-OD1 2.86Å; H236-D275 IonicContact ND1-OD1 3.5Å; H236-D275 PolarHBondContact ND1-OD1 3.08Å; H236-D275 IonicContact ND1-OD2 2.72Å
237	T	97.8	Very high	94.5	Very high	3 Å²	3	36 Å²	36	2%	0.018	20%	0.201	C	C	.	.	H	α-helix	trans	-58.7	-41.6	175.2	-57.1	0	0	0	0	111	I198 L201 Q202 L218 V233 S234 L240 L241	I198-T237 HydrophobicContact CG2-CG2 4.3Å; I198-T237 WeakPolarHBondContact O-CG2 3.35Å; L201-T237 HydrophobicContact CB-CG2 3.98Å; Q202-T237 HydrophobicContact CB-CG2 4.07Å; L218-T237 HydrophobicContact CD1-CG2 4.25Å; L218-T237 HydrophobicContact CD2-CG2 4.16Å; V233-T237 WeakPolarHBondContact O-CB 3.43Å; V233-T237 PolarHBondContact O-N 3.4Å; V233-T237 PolarHBondContact O-OG1 3.35Å; S234-T237 PolarHBondContact O-N 2.79Å; T237-L240 PolarHBondContact O-N 3.04Å; T237-L241 PolarHBondContact O-N 2.83Å
238	F	95.1	Very high	94.2	Very high	3 Å²	3	34.9 Å²	34.9	1%	0.013	19%	0.19	C	C	.	.	H	α-helix	trans	-64.2	-41.9	178.1	-161.1	-178.2	0	0	0	112.1	R215 L218 S234 L235 H236 L241 A242 L255	R215-F238 HydrophobicContact CB-CE2 3.81Å; R215-F238 HydrophobicContact CB-CZ 4.28Å; R215-F238 HydrophobicContact CG-CE2 3.52Å; R215-F238 HydrophobicContact CG-CZ 3.56Å; L218-F238 HydrophobicContact CB-CB 4.45Å; L218-F238 HydrophobicContact CB-CD1 4.32Å; L218-F238 HydrophobicContact CB-CG 4.25Å; L218-F238 HydrophobicContact CD1-CB 3.93Å; L218-F238 HydrophobicContact CD1-CD2 4.12Å; L218-F238 HydrophobicContact CD1-CG 4.15Å; S234-F238 VanDerWaalsContact O-CB 3.27Å; S234-F238 WeakPolarHBondContact O-CB 3.23Å; S234-F238 PolarHBondContact O-N 2.99Å; L235-F238 WeakPolarHBondContact O-CB 3.31Å; L235-F238 PolarHBondContact O-N 2.81Å; H236-F238 VanDerWaalsContact C-N 3.26Å; H236-F238 PolarHBondContact O-N 3.44Å; F238-L241 PolarHBondContact O-N 2.98Å; F238-A242 WeakPolarHBondContact O-CB 3.47Å; F238-A242 PolarHBondContact O-N 2.89Å; F238-L255 HydrophobicContact CD1-CD2 3.69Å; F238-L255 HydrophobicContact CE1-CD2 3.41Å; F238-L255 VanDerWaalsContact CE1-CD2 3.41Å; F238-L255 HydrophobicContact CZ-CD2 4.44Å
239	T	96.9	Very high	94	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-62.5	-44.5	173.6	-62.1	0	0	0	0	111.6	L235 H236 L241 A242 A243 Q252 D275 L278 L279	L235-T239 PolarHBondContact O-N 3.47Å; L235-T239 PolarHBondContact O-OG1 3.45Å; L235-T239 VanDerWaalsContact O-OG1 3.11Å; H236-T239 WeakPolarHBondContact O-CB 3.47Å; H236-T239 PolarHBondContact O-N 3.3Å; T239-L241 PolarHBondContact O-N 3.21Å; T239-A242 PolarHBondContact O-N 3.13Å; T239-A243 VanDerWaalsContact O-CB 3.22Å; T239-A243 WeakPolarHBondContact O-CB 3.33Å; T239-A243 PolarHBondContact O-N 3.4Å; T239-Q252 PolarHBondContact OG1-NE2 3.18Å; T239-D275 VanDerWaalsContact CB-OD2 3.3Å; T239-D275 WeakPolarHBondContact CB-OD2 3.35Å; T239-D275 HydrophobicContact CG2-CB 3.76Å; T239-D275 VanDerWaalsContact OG1-CG 3.26Å; T239-D275 PolarHBondContact OG1-OD2 3.08Å; T239-L278 HydrophobicContact CG2-CD2 3.89Å; T239-L279 HydrophobicContact CG2-CD1 4.28Å; T239-L279 HydrophobicContact CG2-CD2 4.11Å; T239-L279 HydrophobicContact CG2-CG 4.02Å
240	L	97.1	Very high	93.8	Very high	40 Å²	40	28.2 Å²	28.2	21%	0.209	16%	0.162	C	C	.	.	H	α-helix	trans	-64.9	-38.8	179.1	-69.1	178.4	0	0	0	112.5	Q202 H236 T237 S244 L278	Q202-L240 HydrophobicContact CB-CB 4.08Å; H236-L240 WeakPolarHBondContact O-CG 3.41Å; H236-L240 PolarHBondContact O-N 3.4Å; T237-L240 PolarHBondContact O-N 3.04Å; L240-S244 WeakPolarHBondContact O-CB 3.39Å; L240-S244 PolarHBondContact O-N 3.24Å; L240-S244 VanDerWaalsContact O-N 3.14Å; L240-S244 PolarHBondContact O-OG 3.09Å; L240-L278 HydrophobicContact CD2-CD2 4.45Å
241	L	95.8	Very high	93.8	Very high	4 Å²	4	33.1 Å²	33.1	2%	0.021	18%	0.183	C	C	.	.	H	α-helix	trans	-63	-47.6	173	-179.3	68.1	0	0	0	111.4	M204 H205 A214 L218 T237 F238 T239 S244 S245	M204-L241 HydrophobicContact CB-CD1 4.17Å; H205-L241 HydrophobicContact CB-CD1 4.02Å; A214-L241 HydrophobicContact CB-CD2 3.84Å; L218-L241 HydrophobicContact CD1-CD2 4.4Å; T237-L241 PolarHBondContact O-N 2.83Å; F238-L241 PolarHBondContact O-N 2.98Å; T239-L241 PolarHBondContact O-N 3.21Å; L241-S244 PolarHBondContact O-N 3.19Å; L241-S245 WeakPolarHBondContact O-CB 3.48Å; L241-S245 PolarHBondContact O-N 2.64Å; L241-S245 PolarHBondContact O-OG 2.67Å
242	A	93.8	Very high	93.7	Very high	3 Å²	3	33.1 Å²	33.1	3%	0.025	18%	0.183	C	C	.	.	H	α-helix	trans	-63.2	-42.7	178.6	0	0	0	0	0	111.8	F238 T239 S244 L246 Q252	F238-A242 WeakPolarHBondContact O-CB 3.47Å; F238-A242 PolarHBondContact O-N 2.89Å; T239-A242 PolarHBondContact O-N 3.13Å; A242-S244 PolarHBondContact O-N 3.24Å; A242-L246 WeakPolarHBondContact O-CA 3.43Å; A242-L246 PolarHBondContact O-N 2.91Å; A242-Q252 HydrophobicContact CB-CB 3.91Å; A242-Q252 HydrophobicContact CB-CG 4.01Å
243	A	93.6	Very high	93.7	Very high	2 Å²	2	30.9 Å²	30.9	2%	0.017	17%	0.172	C	C	.	.	H	α-helix	trans	-68.6	-17.9	178.7	0	0	0	0	0	113.8	T239 L278 L279 K282	T239-A243 VanDerWaalsContact O-CB 3.22Å; T239-A243 WeakPolarHBondContact O-CB 3.33Å; T239-A243 PolarHBondContact O-N 3.4Å; A243-L278 HydrophobicContact CB-CD2 4.22Å; A243-L279 HydrophobicContact CB-CD2 3.87Å; A243-K282 HydrophobicContact CB-CD 4.29Å; A243-K282 WeakPolarHBondContact O-CE 3.45Å; A243-K282 PolarHBondContact O-NZ 3.15Å
244	S	93.4	Very high	93.7	Very high	52 Å²	52	33.8 Å²	33.8	36%	0.364	18%	0.183	S	C	.	.	H	α-helix	trans	-97.8	-38.9	178.4	-54.1	0	0	0	0	112.1	L240 L241 A242	L240-S244 WeakPolarHBondContact O-CB 3.39Å; L240-S244 PolarHBondContact O-N 3.24Å; L240-S244 VanDerWaalsContact O-N 3.14Å; L240-S244 PolarHBondContact O-OG 3.09Å; L241-S244 PolarHBondContact O-N 3.19Å; A242-S244 PolarHBondContact O-N 3.24Å
245	S	90.6	Very high	93.7	Very high	31 Å²	31	35.1 Å²	35.1	22%	0.217	19%	0.19	C	C	.	.	H	α-helix	trans	-81.4	-25.3	178.6	58.5	0	0	0	0	114.1	L241 V247	L241-S245 WeakPolarHBondContact O-CB 3.48Å; L241-S245 PolarHBondContact O-N 2.64Å; L241-S245 PolarHBondContact O-OG 2.67Å; S245-V247 WeakPolarHBondContact O-CG2 3.41Å; S245-V247 PolarHBondContact O-N 3.43Å
246	L	83.3	Confident	93.7	Very high	99 Å²	99	35.1 Å²	35.1	52%	0.518	19%	0.19	S	C	.	.			trans	60.2	3.6	-179.4	-54.7	175.1	0	0	0	116.2	A242 T283	A242-L246 WeakPolarHBondContact O-CA 3.43Å; A242-L246 PolarHBondContact O-N 2.91Å; L246-T283 HydrophobicContact CD2-CG2 3.36Å
247	V	80.9	Confident	93.7	Very high	98 Å²	98	32 Å²	32	59%	0.594	18%	0.176	S	C	*	.	S	Bend	trans	-80.4	-49.8	-176.2	-178.5	0	0	0	0	112.5	S245	S245-V247 WeakPolarHBondContact O-CG2 3.41Å; S245-V247 PolarHBondContact O-N 3.43Å
248	D	86.7	Confident	93.7	Very high	38 Å²	38	37 Å²	37	20%	0.203	20%	0.199	C	C	.	.	S	Bend	trans	-111.5	25.6	-170.7	-83	-38.2	0	0	0	113.3	R215 K251 Q252	R215-D248 WeakPolarHBondContact CD-OD2 3.35Å; R215-D248 IonicContact NE-OD2 2.64Å; D248-K251 HydrophobicContact CB-CD 4.42Å; D248-K251 PolarHBondContact O-N 3.41Å; D248-K251 WeakPolarHBondContact OD1-CD 3.36Å; D248-K251 WeakPolarHBondContact OD1-CE 3.34Å; D248-K251 IonicContact OD1-NZ 2.76Å; D248-K251 PolarHBondContact OD1-NZ 3.41Å; D248-K251 IonicContact OD2-NZ 3.85Å; D248-Q252 PolarHBondContact O-N 3.44Å
249	T	91.6	Very high	93.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-55	-43.4	179.3	-47	0	0	0	0	113.1	K251 Q252 I253 L279 T286	T249-K251 PolarHBondContact O-N 3.26Å; T249-Q252 WeakPolarHBondContact O-CB 3.44Å; T249-Q252 PolarHBondContact O-N 2.71Å; T249-Q252 VanDerWaalsContact O-N 3.12Å; T249-I253 HydrophobicContact CG2-CD1 4.23Å; T249-I253 WeakPolarHBondContact O-CG1 3.37Å; T249-I253 PolarHBondContact O-N 3.28Å; T249-L279 HydrophobicContact CG2-CD1 4.5Å; T249-L279 HydrophobicContact CG2-CD2 4.1Å; T249-T286 WeakPolarHBondContact CG2-OG1 3.42Å
250	P	93.6	Very high	93.7	Very high	57 Å²	57	39.2 Å²	39.2	37%	0.37	21%	0.207	S	C	.	.	H	α-helix	trans	-60.9	-41	177.1	-25.1	36	0	0	0	113.3	Q252 I253 Q254	P250-Q252 VanDerWaalsContact C-N 3.29Å; P250-Q252 PolarHBondContact O-N 3.4Å; P250-I253 PolarHBondContact O-N 3.38Å; P250-Q254 WeakPolarHBondContact O-CG 3.22Å; P250-Q254 PolarHBondContact O-N 2.95Å
251	K	93.6	Very high	93.7	Very high	107 Å²	107	41.1 Å²	41.1	47%	0.465	21%	0.214	S	C	.	.	H	α-helix	trans	-65.6	-35	175.7	-62.4	-178.8	-172.3	148.3	0	111.4	R215 D248 T249 L255	R215-K251 VanDerWaalsContact NH2-CB 3.32Å; D248-K251 HydrophobicContact CB-CD 4.42Å; D248-K251 PolarHBondContact O-N 3.41Å; D248-K251 WeakPolarHBondContact OD1-CD 3.36Å; D248-K251 WeakPolarHBondContact OD1-CE 3.34Å; D248-K251 IonicContact OD1-NZ 2.76Å; D248-K251 PolarHBondContact OD1-NZ 3.41Å; D248-K251 IonicContact OD2-NZ 3.85Å; T249-K251 PolarHBondContact O-N 3.26Å; K251-L255 WeakPolarHBondContact O-CB 3.28Å; K251-L255 PolarHBondContact O-N 3.45Å
252	Q	96.2	Very high	93.7	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-66.4	-43.9	175.1	-175.5	60.8	12.9	0	0	111.6	T239 A242 D248 T249 P250 Q254 L255 L256 L279	T239-Q252 PolarHBondContact OG1-NE2 3.18Å; A242-Q252 HydrophobicContact CB-CB 3.91Å; A242-Q252 HydrophobicContact CB-CG 4.01Å; D248-Q252 PolarHBondContact O-N 3.44Å; T249-Q252 WeakPolarHBondContact O-CB 3.44Å; T249-Q252 PolarHBondContact O-N 2.71Å; T249-Q252 VanDerWaalsContact O-N 3.12Å; P250-Q252 VanDerWaalsContact C-N 3.29Å; P250-Q252 PolarHBondContact O-N 3.4Å; Q252-Q254 VanDerWaalsContact C-N 3.33Å; Q252-Q254 PolarHBondContact O-N 2.87Å; Q252-L255 PolarHBondContact O-N 3.32Å; Q252-L256 HydrophobicContact CG-CD1 4.15Å; Q252-L256 HydrophobicContact CG-CG 4.46Å; Q252-L256 VanDerWaalsContact O-CG 3.3Å; Q252-L256 WeakPolarHBondContact O-CG 3.47Å; Q252-L256 PolarHBondContact O-N 2.98Å; Q252-L279 HydrophobicContact CG-CD1 4.18Å
253	I	97.6	Very high	93.8	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59.1	-46.6	175.5	-65.7	165.6	0	0	0	110.1	T249 P250 L255 L256 L257 L276 L279 W287 N291	T249-I253 HydrophobicContact CG2-CD1 4.23Å; T249-I253 WeakPolarHBondContact O-CG1 3.37Å; T249-I253 PolarHBondContact O-N 3.28Å; P250-I253 PolarHBondContact O-N 3.38Å; I253-L255 PolarHBondContact O-N 3.44Å; I253-L256 PolarHBondContact O-N 3.28Å; I253-L257 HydrophobicContact CG2-CD1 3.84Å; I253-L257 HydrophobicContact CG2-CG 4.33Å; I253-L257 WeakPolarHBondContact O-CB 3.33Å; I253-L257 VanDerWaalsContact O-CG 3.27Å; I253-L257 WeakPolarHBondContact O-CG 3.47Å; I253-L257 PolarHBondContact O-N 2.79Å; I253-L276 HydrophobicContact CG2-CD2 4.1Å; I253-L279 HydrophobicContact CG1-CD1 3.85Å; I253-W287 HydrophobicContact CD1-CD2 3.92Å; I253-W287 HydrophobicContact CD1-CG 4.07Å; I253-W287 HydrophobicContact CD1-CZ2 4.33Å; I253-W287 HydrophobicContact CG1-CZ2 4.38Å; I253-W287 HydrophobicContact CG2-CE3 4.16Å; I253-W287 HydrophobicContact CG2-CH2 4.22Å; I253-W287 HydrophobicContact CG2-CZ3 3.99Å; I253-N291 HydrophobicContact CG2-CB 3.86Å
254	Q	97.1	Very high	93.9	Very high	98 Å²	98	53.1 Å²	53.1	46%	0.458	28%	0.284	S	S	.	.	H	α-helix	trans	-58.7	-45.6	176.7	-71.8	173.5	-1.3	0	0	112.2	P250 Q252 L257 Q258	P250-Q254 WeakPolarHBondContact O-CG 3.22Å; P250-Q254 PolarHBondContact O-N 2.95Å; Q252-Q254 VanDerWaalsContact C-N 3.33Å; Q252-Q254 PolarHBondContact O-N 2.87Å; Q254-L257 PolarHBondContact O-N 3.47Å; Q254-Q258 VanDerWaalsContact O-CG 3.3Å; Q254-Q258 WeakPolarHBondContact O-CG 3.19Å; Q254-Q258 PolarHBondContact O-N 2.92Å
255	L	96.9	Very high	94	Very high	28 Å²	28	53.7 Å²	53.7	15%	0.147	28%	0.278	C	S	.	.	H	α-helix	trans	-60.4	-47.4	177.2	-174.6	68.7	0	0	0	111.6	L235 F238 K251 Q252 I253 L257 Q258 Y259	L235-L255 HydrophobicContact CD2-CD2 4.08Å; F238-L255 HydrophobicContact CD1-CD2 3.69Å; F238-L255 HydrophobicContact CE1-CD2 3.41Å; F238-L255 VanDerWaalsContact CE1-CD2 3.41Å; F238-L255 HydrophobicContact CZ-CD2 4.44Å; K251-L255 WeakPolarHBondContact O-CB 3.28Å; K251-L255 PolarHBondContact O-N 3.45Å; Q252-L255 PolarHBondContact O-N 3.32Å; I253-L255 PolarHBondContact O-N 3.44Å; L255-L257 VanDerWaalsContact C-N 3.32Å; L255-L257 PolarHBondContact O-N 3.22Å; L255-Q258 WeakPolarHBondContact O-CB 3.48Å; L255-Q258 PolarHBondContact O-N 3.47Å; L255-Y259 HydrophobicContact CD1-CD2 4.16Å; L255-Y259 HydrophobicContact CD1-CE2 3.69Å; L255-Y259 HydrophobicContact CG-CD2 4.04Å; L255-Y259 HydrophobicContact CG-CE2 3.93Å; L255-Y259 VanDerWaalsContact O-CD2 3.31Å; L255-Y259 WeakPolarHBondContact O-CD2 3.47Å; L255-Y259 PolarHBondContact O-N 2.87Å
256	L	98	Very high	94.3	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-62.3	-40	178.4	-68.6	172.6	0	0	0	111.6	Q252 I253 Y259 L260 A272 D275 L276 L279	Q252-L256 HydrophobicContact CG-CD1 4.15Å; Q252-L256 HydrophobicContact CG-CG 4.46Å; Q252-L256 VanDerWaalsContact O-CG 3.3Å; Q252-L256 WeakPolarHBondContact O-CG 3.47Å; Q252-L256 PolarHBondContact O-N 2.98Å; I253-L256 PolarHBondContact O-N 3.28Å; L256-Y259 PolarHBondContact O-N 3.32Å; L256-L260 VanDerWaalsContact O-CB 3.25Å; L256-L260 WeakPolarHBondContact O-CB 3.47Å; L256-L260 PolarHBondContact O-N 2.79Å; L256-A272 HydrophobicContact CD2-CB 4.27Å; L256-D275 HydrophobicContact CD1-CB 3.81Å; L256-D275 HydrophobicContact CD2-CB 4.15Å; L256-L276 HydrophobicContact CB-CD1 4.48Å; L256-L276 HydrophobicContact CB-CD2 3.82Å; L256-L276 HydrophobicContact CB-CG 4.03Å; L256-L276 HydrophobicContact CD1-CD2 3.87Å; L256-L276 HydrophobicContact CD1-CG 4.1Å; L256-L279 HydrophobicContact CD1-CD1 3.95Å
257	L	98.1	Very high	95	Very high	9 Å²	9	53.8 Å²	53.8	5%	0.047	28%	0.276	C	S	.	.	H	α-helix	trans	-65.9	-37	174.5	-69.4	171.3	0	0	0	112.2	I253 Q254 L255 L260 K261 L276 N291 A294 L295	I253-L257 HydrophobicContact CG2-CD1 3.84Å; I253-L257 HydrophobicContact CG2-CG 4.33Å; I253-L257 WeakPolarHBondContact O-CB 3.33Å; I253-L257 VanDerWaalsContact O-CG 3.27Å; I253-L257 WeakPolarHBondContact O-CG 3.47Å; I253-L257 PolarHBondContact O-N 2.79Å; Q254-L257 PolarHBondContact O-N 3.47Å; L255-L257 VanDerWaalsContact C-N 3.32Å; L255-L257 PolarHBondContact O-N 3.22Å; L257-L260 HydrophobicContact CD2-CD2 4.49Å; L257-L260 PolarHBondContact O-N 2.98Å; L257-K261 WeakPolarHBondContact O-CG 3.4Å; L257-K261 PolarHBondContact O-N 3.15Å; L257-L276 HydrophobicContact CD2-CD1 4.01Å; L257-N291 HydrophobicContact CD1-CB 3.94Å; L257-A294 HydrophobicContact CD1-CB 4.18Å; L257-L295 HydrophobicContact CD2-CB 3.88Å; L257-L295 HydrophobicContact CD2-CD1 3.96Å; L257-L295 HydrophobicContact CD2-CG 4.45Å
258	Q	97.1	Very high	95.8	Very high	108 Å²	108	49.1 Å²	49.1	51%	0.505	25%	0.248	S	C	.	.	H	α-helix	trans	-63.6	-46.3	173.6	-73.6	171.8	2.9	0	0	111.6	Q254 L255 L260 K261 N262	Q254-Q258 VanDerWaalsContact O-CG 3.3Å; Q254-Q258 WeakPolarHBondContact O-CG 3.19Å; Q254-Q258 PolarHBondContact O-N 2.92Å; L255-Q258 WeakPolarHBondContact O-CB 3.48Å; L255-Q258 PolarHBondContact O-N 3.47Å; Q258-L260 VanDerWaalsContact C-N 3.27Å; Q258-L260 PolarHBondContact O-N 3.28Å; Q258-K261 PolarHBondContact O-N 2.91Å; Q258-N262 WeakPolarHBondContact O-CB 3.49Å; Q258-N262 PolarHBondContact O-N 3.38Å
259	Y	96.8	Very high	96.3	Very high	49 Å²	49	48.8 Å²	48.8	19%	0.192	24%	0.244	C	C	.	.	H	α-helix	trans	-62.5	-37.7	173.1	-83.8	-75.4	0	0	0	111.7	V222 L235 L255 L256 K261 D263 V268	V222-Y259 HydrophobicContact CG1-CE1 4.2Å; V222-Y259 HydrophobicContact CG1-CE2 4.12Å; V222-Y259 VanDerWaalsContact CG1-CZ 3.49Å; V222-Y259 WeakPolarHBondContact CG1-OH 3.41Å; L235-Y259 HydrophobicContact CD1-CD1 4.38Å; L235-Y259 HydrophobicContact CD1-CD2 4.08Å; L235-Y259 HydrophobicContact CD1-CE2 4.48Å; L235-Y259 HydrophobicContact CD1-CG 4.08Å; L235-Y259 HydrophobicContact CD2-CD2 4Å; L235-Y259 HydrophobicContact CD2-CE2 3.97Å; L255-Y259 HydrophobicContact CD1-CD2 4.16Å; L255-Y259 HydrophobicContact CD1-CE2 3.69Å; L255-Y259 HydrophobicContact CG-CD2 4.04Å; L255-Y259 HydrophobicContact CG-CE2 3.93Å; L255-Y259 VanDerWaalsContact O-CD2 3.31Å; L255-Y259 WeakPolarHBondContact O-CD2 3.47Å; L255-Y259 PolarHBondContact O-N 2.87Å; L256-Y259 PolarHBondContact O-N 3.32Å; Y259-K261 VanDerWaalsContact C-N 3.35Å; Y259-K261 PolarHBondContact O-N 2.79Å; Y259-D263 HydrophobicContact CD1-CB 4.03Å; Y259-D263 WeakPolarHBondContact O-CB 3.37Å; Y259-D263 PolarHBondContact O-N 3.31Å; Y259-V268 HydrophobicContact CD1-CG1 4.07Å; Y259-V268 HydrophobicContact CG-CG1 4.49Å
260	L	96.8	Very high	96.6	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-66.8	-35.4	178.4	-167.1	64.5	0	0	0	112.5	L256 L257 Q258 K269 A272 I273 L276 L295 M311	L256-L260 VanDerWaalsContact O-CB 3.25Å; L256-L260 WeakPolarHBondContact O-CB 3.47Å; L256-L260 PolarHBondContact O-N 2.79Å; L257-L260 HydrophobicContact CD2-CD2 4.49Å; L257-L260 PolarHBondContact O-N 2.98Å; Q258-L260 VanDerWaalsContact C-N 3.27Å; Q258-L260 PolarHBondContact O-N 3.28Å; L260-K269 HydrophobicContact CD1-CB 3.88Å; L260-K269 HydrophobicContact CD1-CG 4.22Å; L260-K269 PolarHBondContact O-NZ 3.03Å; L260-A272 HydrophobicContact CB-CB 4.47Å; L260-A272 HydrophobicContact CD1-CB 4.37Å; L260-I273 HydrophobicContact CD1-CD1 4.16Å; L260-I273 HydrophobicContact CD1-CG1 3.84Å; L260-I273 HydrophobicContact CD2-CG1 4.46Å; L260-L276 HydrophobicContact CD2-CD1 4.13Å; L260-L295 HydrophobicContact CD2-CD1 3.59Å; L260-M311 HydrophobicContact CD1-CE 3.67Å; L260-M311 HydrophobicContact CD2-CE 3.81Å; L260-M311 HydrophobicContact CD2-CG 4.17Å; L260-M311 HydrophobicContact CD2-SD 4.28Å; L260-M311 HydrophobicContact CG-CE 3.73Å
261	K	95.9	Very high	96.8	Very high	80 Å²	80	52.6 Å²	52.6	35%	0.348	25%	0.252	S	S	.	.	H	α-helix	trans	-77.4	-53.4	175.1	-73.2	-176.4	171.5	-167.7	0	111.7	L257 Q258 Y259 K269 A294 E297 C298	L257-K261 WeakPolarHBondContact O-CG 3.4Å; L257-K261 PolarHBondContact O-N 3.15Å; Q258-K261 PolarHBondContact O-N 2.91Å; Y259-K261 VanDerWaalsContact C-N 3.35Å; Y259-K261 PolarHBondContact O-N 2.79Å; K261-K269 PolarHBondContact O-NZ 3.21Å; K261-A294 WeakPolarHBondContact CE-O 3.48Å; K261-E297 IonicContact NZ-OE2 3.19Å; K261-E297 PolarHBondContact NZ-OE2 2.94Å; K261-C298 HydrophobicContact CG-CB 4.12Å
262	N	95.7	Very high	97	Very high	127 Å²	127	47.5 Å²	47.5	68%	0.679	23%	0.23	S	C	*	.	H	α-helix	trans	-92	-31.1	-163.5	-58.5	-21.3	0	0	0	114.2	Q258	Q258-N262 WeakPolarHBondContact O-CB 3.49Å; Q258-N262 PolarHBondContact O-N 3.38Å
263	D	96.1	Very high	97.1	Very high	17 Å²	17	48 Å²	48	9%	0.091	23%	0.233	C	C	.	.			trans	-79.6	124.3	-173.3	-165.9	-87.1	0	0	0	111.8	Y259 R265 V268 K269	Y259-D263 HydrophobicContact CD1-CB 4.03Å; Y259-D263 WeakPolarHBondContact O-CB 3.37Å; Y259-D263 PolarHBondContact O-N 3.31Å; D263-R265 VanDerWaalsContact C-N 3.27Å; D263-R265 PolarHBondContact O-N 3.41Å; D263-R265 WeakPolarHBondContact OD1-CA 3.32Å; D263-R265 WeakPolarHBondContact OD1-CB 3.33Å; D263-R265 WeakPolarHBondContact OD1-CG 3.46Å; D263-R265 IonicContact OD1-CZ 3.69Å; D263-R265 PolarHBondContact OD1-N 3.2Å; D263-R265 IonicContact OD1-NE 3.21Å; D263-R265 PolarHBondContact OD1-NE 2.71Å; D263-R265 IonicContact OD1-NH2 2.78Å; D263-R265 IonicContact OD2-CZ 3.05Å; D263-R265 IonicContact OD2-NE 2.94Å; D263-R265 PolarHBondContact OD2-NE 3.12Å; D263-R265 VanDerWaalsContact OD2-NE 3.07Å; D263-R265 IonicContact OD2-NH2 2.74Å; D263-R265 PolarHBondContact OD2-NH2 3.07Å; D263-V268 HydrophobicContact CB-CG1 4.39Å; D263-K269 WeakPolarHBondContact O-CE 3.48Å; D263-K269 PolarHBondContact O-NZ 2.9Å
264	P	95.4	Very high	97.2	Very high	117 Å²	117	54.1 Å²	54.1	76%	0.76	26%	0.261	S	S	*	.			trans	-75.6	-14.3	-175.8	29.8	-35.1	0	0	0	113.4	K266	P264-K266 PolarHBondContact O-N 3.28Å
265	R	96.8	Very high	97.2	Very high	64 Å²	64	49.5 Å²	49.5	24%	0.242	24%	0.24	C	C	.	.			trans	-80.8	118.3	-168.6	-57.2	165	-73.3	-173.6	-6.3	110.4	P226 D263 A267 V268 K269	P226-R265 PolarHBondContact O-NH1 3.3Å; D263-R265 VanDerWaalsContact C-N 3.27Å; D263-R265 PolarHBondContact O-N 3.41Å; D263-R265 WeakPolarHBondContact OD1-CA 3.32Å; D263-R265 WeakPolarHBondContact OD1-CB 3.33Å; D263-R265 WeakPolarHBondContact OD1-CG 3.46Å; D263-R265 IonicContact OD1-CZ 3.69Å; D263-R265 PolarHBondContact OD1-N 3.2Å; D263-R265 IonicContact OD1-NE 3.21Å; D263-R265 PolarHBondContact OD1-NE 2.71Å; D263-R265 IonicContact OD1-NH2 2.78Å; D263-R265 IonicContact OD2-CZ 3.05Å; D263-R265 IonicContact OD2-NE 2.94Å; D263-R265 PolarHBondContact OD2-NE 3.12Å; D263-R265 VanDerWaalsContact OD2-NE 3.07Å; D263-R265 IonicContact OD2-NH2 2.74Å; D263-R265 PolarHBondContact OD2-NH2 3.07Å; R265-A267 PolarHBondContact O-N 2.83Å; R265-A267 VanDerWaalsContact O-N 3.12Å; R265-V268 HydrophobicContact CB-CB 4.37Å; R265-V268 HydrophobicContact CB-CG2 4.05Å; R265-V268 PolarHBondContact O-N 2.96Å; R265-V268 VanDerWaalsContact O-N 3.09Å; R265-K269 PolarHBondContact O-N 2.87Å; R265-K269 VanDerWaalsContact O-N 3.1Å
266	K	96.1	Very high	97.3	Very high	104 Å²	104	48.2 Å²	48.2	45%	0.452	23%	0.233	S	C	.	.	H	α-helix	trans	-54.7	-34.7	179.2	-170.4	174	-176.5	175.4	0	113.8	P264 R270	P264-K266 PolarHBondContact O-N 3.28Å; K266-R270 WeakPolarHBondContact O-CB 3.36Å; K266-R270 WeakPolarHBondContact O-CG 3.16Å; K266-R270 PolarHBondContact O-N 3.45Å
267	A	97.3	Very high	97.3	Very high	29 Å²	29	52.2 Å²	52.2	24%	0.24	25%	0.25	C	S	.	.	H	α-helix	trans	-68	-41.5	178.9	0	0	0	0	0	112.5	T228 I232 R265 R270 L271	T228-A267 HydrophobicContact CG2-CB 3.92Å; I232-A267 HydrophobicContact CD1-CB 3.93Å; R265-A267 PolarHBondContact O-N 2.83Å; R265-A267 VanDerWaalsContact O-N 3.12Å; A267-R270 PolarHBondContact O-N 2.91Å; A267-L271 PolarHBondContact O-N 3.5Å
268	V	97.7	Very high	97.3	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-67.6	-44.5	177.2	179.7	0	0	0	0	110.3	V231 I232 L235 Y259 D263 R265 R270 L271 A272	V231-V268 HydrophobicContact CG1-CG1 4.06Å; V231-V268 HydrophobicContact CG1-CG2 4.09Å; I232-V268 HydrophobicContact CG1-CG2 4.44Å; L235-V268 HydrophobicContact CD1-CG1 4.1Å; Y259-V268 HydrophobicContact CD1-CG1 4.07Å; Y259-V268 HydrophobicContact CG-CG1 4.49Å; D263-V268 HydrophobicContact CB-CG1 4.39Å; R265-V268 HydrophobicContact CB-CB 4.37Å; R265-V268 HydrophobicContact CB-CG2 4.05Å; R265-V268 PolarHBondContact O-N 2.96Å; R265-V268 VanDerWaalsContact O-N 3.09Å; V268-R270 VanDerWaalsContact C-N 3.33Å; V268-R270 PolarHBondContact O-N 3.5Å; V268-L271 PolarHBondContact O-N 3.1Å; V268-A272 PolarHBondContact O-N 2.91Å
269	K	98	Very high	97.3	Very high	30 Å²	30	49.6 Å²	49.6	13%	0.13	24%	0.239	C	C	.	.	H	α-helix	trans	-58.2	-42.5	174.4	-66.8	-168.3	-173.2	-61.6	0	112.5	L260 K261 D263 R265 A272 I273 L307	L260-K269 HydrophobicContact CD1-CB 3.88Å; L260-K269 HydrophobicContact CD1-CG 4.22Å; L260-K269 PolarHBondContact O-NZ 3.03Å; K261-K269 PolarHBondContact O-NZ 3.21Å; D263-K269 WeakPolarHBondContact O-CE 3.48Å; D263-K269 PolarHBondContact O-NZ 2.9Å; R265-K269 PolarHBondContact O-N 2.87Å; R265-K269 VanDerWaalsContact O-N 3.1Å; K269-A272 PolarHBondContact O-N 2.95Å; K269-I273 WeakPolarHBondContact O-CG1 3.25Å; K269-I273 PolarHBondContact O-N 3.17Å; K269-L307 HydrophobicContact CB-CD1 4.24Å; K269-L307 HydrophobicContact CB-CD2 3.94Å; K269-L307 HydrophobicContact CD-CD1 3.73Å
270	R	97.8	Very high	97.3	Very high	126 Å²	126	47.3 Å²	47.3	48%	0.475	23%	0.231	S	C	.	.	H	α-helix	trans	-63.8	-41.8	176.1	-77.2	-173.2	-60.9	167.9	3.3	112.6	K266 A267 V268 I273 Q274 L307	K266-R270 WeakPolarHBondContact O-CB 3.36Å; K266-R270 WeakPolarHBondContact O-CG 3.16Å; K266-R270 PolarHBondContact O-N 3.45Å; A267-R270 PolarHBondContact O-N 2.91Å; V268-R270 VanDerWaalsContact C-N 3.33Å; V268-R270 PolarHBondContact O-N 3.5Å; R270-I273 PolarHBondContact O-N 3.21Å; R270-Q274 WeakPolarHBondContact O-CG 3.3Å; R270-Q274 PolarHBondContact O-N 3.4Å; R270-Q274 VanDerWaalsContact O-N 3.08Å; R270-L307 HydrophobicContact CG-CD2 3.75Å
271	L	98.2	Very high	97.3	Very high	12 Å²	12	51.1 Å²	51.1	6%	0.063	26%	0.257	C	S	.	.	H	α-helix	trans	-61.1	-49.2	173.6	173.5	71	0	0	0	110.6	I232 L235 H236 A267 V268 I273 Q274 D275	I232-L271 VanDerWaalsContact CA-CD2 3.47Å; I232-L271 HydrophobicContact CB-CD2 3.97Å; I232-L271 HydrophobicContact CG1-CB 4.44Å; I232-L271 HydrophobicContact CG1-CD2 4Å; I232-L271 HydrophobicContact CG2-CD2 3.96Å; I232-L271 WeakPolarHBondContact O-CD2 3.22Å; L235-L271 HydrophobicContact CB-CD2 3.85Å; H236-L271 HydrophobicContact CB-CD1 4.1Å; H236-L271 HydrophobicContact CB-CD2 4.43Å; A267-L271 PolarHBondContact O-N 3.5Å; V268-L271 PolarHBondContact O-N 3.1Å; L271-I273 PolarHBondContact O-N 3.49Å; L271-Q274 WeakPolarHBondContact O-CA 3.36Å; L271-Q274 WeakPolarHBondContact O-CB 3.23Å; L271-Q274 PolarHBondContact O-N 3.24Å; L271-D275 PolarHBondContact O-N 2.97Å
272	A	98.4	Very high	97.2	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-56.8	-40.7	-179	0	0	0	0	0	111.4	L256 L260 V268 K269 D275 L276	L256-A272 HydrophobicContact CD2-CB 4.27Å; L260-A272 HydrophobicContact CB-CB 4.47Å; L260-A272 HydrophobicContact CD1-CB 4.37Å; V268-A272 PolarHBondContact O-N 2.91Å; K269-A272 PolarHBondContact O-N 2.95Å; A272-D275 PolarHBondContact O-N 3.04Å; A272-L276 WeakPolarHBondContact O-CB 3.33Å; A272-L276 WeakPolarHBondContact O-CG 3.42Å; A272-L276 PolarHBondContact O-N 3.45Å
273	I	98.6	Very high	97.1	Very high	11 Å²	11	47.3 Å²	47.3	6%	0.056	24%	0.235	C	C	.	.	H	α-helix	trans	-60.5	-45.1	172.5	-71	166.5	0	0	0	112.1	L260 K269 R270 L271 L276 K277 L307 G310 M311 V314	L260-I273 HydrophobicContact CD1-CD1 4.16Å; L260-I273 HydrophobicContact CD1-CG1 3.84Å; L260-I273 HydrophobicContact CD2-CG1 4.46Å; K269-I273 WeakPolarHBondContact O-CG1 3.25Å; K269-I273 PolarHBondContact O-N 3.17Å; R270-I273 PolarHBondContact O-N 3.21Å; L271-I273 PolarHBondContact O-N 3.49Å; I273-L276 PolarHBondContact O-N 2.91Å; I273-K277 WeakPolarHBondContact O-CB 3.36Å; I273-K277 PolarHBondContact O-N 3.12Å; I273-L307 HydrophobicContact CD1-CB 4.35Å; I273-L307 HydrophobicContact CD1-CD2 3.83Å; I273-G310 WeakPolarHBondContact CG2-O 3.42Å; I273-M311 HydrophobicContact CD1-CE 4.35Å; I273-M311 HydrophobicContact CD1-CG 3.9Å; I273-M311 HydrophobicContact CG1-CG 3.99Å; I273-V314 HydrophobicContact CG2-CG2 4.19Å; I273-V314 WeakPolarHBondContact O-CG2 3.4Å
274	Q	98.3	Very high	97.1	Very high	127 Å²	127	47.6 Å²	47.6	59%	0.593	24%	0.238	S	C	*	.	H	α-helix	trans	-63.8	-43.8	179.2	-72.1	172.7	-6.7	0	0	111.7	R270 L271 K277 L278	R270-Q274 WeakPolarHBondContact O-CG 3.3Å; R270-Q274 PolarHBondContact O-N 3.4Å; R270-Q274 VanDerWaalsContact O-N 3.08Å; L271-Q274 WeakPolarHBondContact O-CA 3.36Å; L271-Q274 WeakPolarHBondContact O-CB 3.23Å; L271-Q274 PolarHBondContact O-N 3.24Å; Q274-K277 WeakPolarHBondContact O-CB 3.49Å; Q274-K277 PolarHBondContact O-N 3.2Å; Q274-L278 PolarHBondContact O-N 3.3Å
275	D	98.4	Very high	97	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.011	23%	0.228	C	C	.	.	H	α-helix	trans	-66.5	-41.7	177.3	-84.4	0.6	0	0	0	111.7	H236 T239 L256 L271 A272 K277 L278 L279	H236-D275 WeakPolarHBondContact CA-OD2 3.37Å; H236-D275 IonicContact CE1-OD1 2.86Å; H236-D275 IonicContact ND1-OD1 3.5Å; H236-D275 PolarHBondContact ND1-OD1 3.08Å; H236-D275 IonicContact ND1-OD2 2.72Å; T239-D275 VanDerWaalsContact CB-OD2 3.3Å; T239-D275 WeakPolarHBondContact CB-OD2 3.35Å; T239-D275 HydrophobicContact CG2-CB 3.76Å; T239-D275 VanDerWaalsContact OG1-CG 3.26Å; T239-D275 PolarHBondContact OG1-OD2 3.08Å; L256-D275 HydrophobicContact CD1-CB 3.81Å; L256-D275 HydrophobicContact CD2-CB 4.15Å; L271-D275 PolarHBondContact O-N 2.97Å; A272-D275 PolarHBondContact O-N 3.04Å; D275-K277 VanDerWaalsContact C-N 3.29Å; D275-K277 PolarHBondContact O-N 2.89Å; D275-L278 WeakPolarHBondContact O-CB 3.44Å; D275-L278 PolarHBondContact O-N 2.75Å; D275-L279 WeakPolarHBondContact O-CG 3.5Å; D275-L279 PolarHBondContact O-N 3.05Å
276	L	98.5	Very high	96.8	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-61.9	-37.5	172.3	-71.3	171.2	0	0	0	111.4	I253 L256 L257 L260 A272 I273 L279 A280 W287 L295 V314	I253-L276 HydrophobicContact CG2-CD2 4.1Å; L256-L276 HydrophobicContact CB-CD1 4.48Å; L256-L276 HydrophobicContact CB-CD2 3.82Å; L256-L276 HydrophobicContact CB-CG 4.03Å; L256-L276 HydrophobicContact CD1-CD2 3.87Å; L256-L276 HydrophobicContact CD1-CG 4.1Å; L257-L276 HydrophobicContact CD2-CD1 4.01Å; L260-L276 HydrophobicContact CD2-CD1 4.13Å; A272-L276 WeakPolarHBondContact O-CB 3.33Å; A272-L276 WeakPolarHBondContact O-CG 3.42Å; A272-L276 PolarHBondContact O-N 3.45Å; I273-L276 PolarHBondContact O-N 2.91Å; L276-L279 PolarHBondContact O-N 2.98Å; L276-A280 VanDerWaalsContact O-CB 3.29Å; L276-A280 WeakPolarHBondContact O-CB 3.34Å; L276-A280 PolarHBondContact O-N 2.77Å; L276-W287 HydrophobicContact CB-CH2 4.11Å; L276-W287 HydrophobicContact CB-CZ2 4.42Å; L276-W287 HydrophobicContact CD2-CH2 3.61Å; L276-W287 HydrophobicContact CD2-CZ2 4.08Å; L276-W287 HydrophobicContact CD2-CZ3 4.48Å; L276-W287 HydrophobicContact CG-CH2 4.34Å; L276-L295 HydrophobicContact CD1-CD1 4.35Å; L276-V314 HydrophobicContact CB-CG1 4.08Å; L276-V314 HydrophobicContact CB-CG2 4.15Å
277	K	98.3	Very high	96.8	Very high	85 Å²	85	41.7 Å²	41.7	37%	0.37	21%	0.206	S	C	.	.	H	α-helix	trans	-65.9	-40.2	174.8	-168.6	172.3	-175.6	166.6	0	112.1	I273 Q274 D275 A280 S281 S313 V314	I273-K277 WeakPolarHBondContact O-CB 3.36Å; I273-K277 PolarHBondContact O-N 3.12Å; Q274-K277 WeakPolarHBondContact O-CB 3.49Å; Q274-K277 PolarHBondContact O-N 3.2Å; D275-K277 VanDerWaalsContact C-N 3.29Å; D275-K277 PolarHBondContact O-N 2.89Å; K277-A280 PolarHBondContact O-N 3.16Å; K277-S281 WeakPolarHBondContact O-CB 3.23Å; K277-S281 PolarHBondContact O-N 3.07Å; K277-S281 PolarHBondContact O-OG 3.32Å; K277-S313 PolarHBondContact NZ-OG 3.47Å; K277-V314 HydrophobicContact CB-CG2 3.95Å
278	L	97.6	Very high	96.6	Very high	62 Å²	62	41.8 Å²	41.8	33%	0.325	21%	0.205	S	C	.	.	H	α-helix	trans	-61.2	-47.9	174.4	179.4	123.5	0	0	0	110.6	T239 L240 A243 Q274 D275 S281 K282	T239-L278 HydrophobicContact CG2-CD2 3.89Å; L240-L278 HydrophobicContact CD2-CD2 4.45Å; A243-L278 HydrophobicContact CB-CD2 4.22Å; Q274-L278 PolarHBondContact O-N 3.3Å; D275-L278 WeakPolarHBondContact O-CB 3.44Å; D275-L278 PolarHBondContact O-N 2.75Å; L278-S281 PolarHBondContact O-N 3.02Å; L278-S281 VanDerWaalsContact O-N 3.17Å; L278-K282 WeakPolarHBondContact O-CB 3.28Å; L278-K282 PolarHBondContact O-N 3.04Å
279	L	97.4	Very high	96.3	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.3	-40	176.3	-66.6	179.3	0	0	0	112.6	T239 A243 T249 Q252 I253 L256 D275 L276 S281 K282 T283 W287	T239-L279 HydrophobicContact CG2-CD1 4.28Å; T239-L279 HydrophobicContact CG2-CD2 4.11Å; T239-L279 HydrophobicContact CG2-CG 4.02Å; A243-L279 HydrophobicContact CB-CD2 3.87Å; T249-L279 HydrophobicContact CG2-CD1 4.5Å; T249-L279 HydrophobicContact CG2-CD2 4.1Å; Q252-L279 HydrophobicContact CG-CD1 4.18Å; I253-L279 HydrophobicContact CG1-CD1 3.85Å; L256-L279 HydrophobicContact CD1-CD1 3.95Å; D275-L279 WeakPolarHBondContact O-CG 3.5Å; D275-L279 PolarHBondContact O-N 3.05Å; L276-L279 PolarHBondContact O-N 2.98Å; L279-S281 PolarHBondContact O-N 3.17Å; L279-K282 PolarHBondContact O-N 3.4Å; L279-T283 CarbonylContact O-C 3.53Å; L279-T283 VanDerWaalsContact O-C 3.24Å; L279-T283 WeakPolarHBondContact O-CA 3.33Å; L279-T283 PolarHBondContact O-N 3.03Å; L279-T283 PolarHBondContact O-OG1 3.44Å; L279-W287 HydrophobicContact CB-CZ2 4.48Å
280	A	96.9	Very high	96.1	Very high	1 Å²	1	50 Å²	50	1%	0.008	24%	0.24	C	C	.	.	H	α-helix	trans	-62.4	-31.9	174	0	0	0	0	0	112.6	L276 K277 P284 W287 V314 T317 L318	L276-A280 VanDerWaalsContact O-CB 3.29Å; L276-A280 WeakPolarHBondContact O-CB 3.34Å; L276-A280 PolarHBondContact O-N 2.77Å; K277-A280 PolarHBondContact O-N 3.16Å; A280-P284 WeakPolarHBondContact O-CB 3.09Å; A280-W287 HydrophobicContact CB-CZ2 4.23Å; A280-V314 HydrophobicContact CB-CG1 4.22Å; A280-T317 HydrophobicContact CB-CG2 4.05Å; A280-L318 HydrophobicContact CB-CD2 3.55Å; A280-L318 HydrophobicContact CB-CG 3.72Å
281	S	95.9	Very high	96	Very high	80 Å²	80	44.4 Å²	44.4	56%	0.559	22%	0.22	S	C	*	.	H	α-helix	trans	-81.3	-38.4	179.6	-53.3	0	0	0	0	112.3	K277 L278 L279	K277-S281 WeakPolarHBondContact O-CB 3.23Å; K277-S281 PolarHBondContact O-N 3.07Å; K277-S281 PolarHBondContact O-OG 3.32Å; L278-S281 PolarHBondContact O-N 3.02Å; L278-S281 VanDerWaalsContact O-N 3.17Å; L279-S281 PolarHBondContact O-N 3.17Å
282	K	94.2	Very high	95.8	Very high	123 Å²	123	44.1 Å²	44.1	54%	0.535	22%	0.218	S	C	.	.	H	α-helix	trans	-91.1	-38.5	-174.6	-170.4	169.4	173.1	171.8	0	113.4	A243 L278 L279	A243-K282 HydrophobicContact CB-CD 4.29Å; A243-K282 WeakPolarHBondContact O-CE 3.45Å; A243-K282 PolarHBondContact O-NZ 3.15Å; L278-K282 WeakPolarHBondContact O-CB 3.28Å; L278-K282 PolarHBondContact O-N 3.04Å; L279-K282 PolarHBondContact O-N 3.4Å
283	T	94.4	Very high	95.6	Very high	3 Å²	3	47.2 Å²	47.2	2%	0.018	23%	0.233	C	C	.	.			trans	-136.3	58.1	-175	59.3	0	0	0	0	111.9	L246 L279 H285 T286	L246-T283 HydrophobicContact CD2-CG2 3.36Å; L279-T283 CarbonylContact O-C 3.53Å; L279-T283 VanDerWaalsContact O-C 3.24Å; L279-T283 WeakPolarHBondContact O-CA 3.33Å; L279-T283 PolarHBondContact O-N 3.03Å; L279-T283 PolarHBondContact O-OG1 3.44Å; T283-H285 PolarHBondContact O-N 3.23Å; T283-T286 PolarHBondContact O-N 3.14Å; T283-T286 PolarHBondContact O-OG1 3.47Å
284	P	95.2	Very high	95.4	Very high	24 Å²	24	47.4 Å²	47.4	16%	0.156	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-62.5	-27.4	-178.3	22.2	-32	0	0	0	113.6	A280 T286 W287 T321	A280-P284 WeakPolarHBondContact O-CB 3.09Å; P284-T286 PolarHBondContact O-N 3.36Å; P284-W287 PolarHBondContact O-N 2.86Å; P284-T321 HydrophobicContact CB-CG2 3.79Å; P284-T321 WeakPolarHBondContact CB-OG1 3.47Å; P284-T321 HydrophobicContact CG-CG2 4Å
285	H	92.9	Very high	95.4	Very high	122 Å²	122	41.4 Å²	41.4	57%	0.565	21%	0.208	S	C	*	.	G	3₁₀ helix	trans	-71.3	-14.5	-175.7	63.2	-91.2	0	0	0	114.1	T283 W287 I322	T283-H285 PolarHBondContact O-N 3.23Å; H285-W287 VanDerWaalsContact C-N 3.33Å; H285-I322 HydrophobicContact CB-CD1 3.82Å; H285-I322 HydrophobicContact CB-CG1 4.47Å
286	T	93.6	Very high	95.3	Very high	33 Å²	33	41.3 Å²	41.3	20%	0.202	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-88.2	1.8	-179.5	63.6	0	0	0	0	113.5	T249 T283 P284	T249-T286 WeakPolarHBondContact CG2-OG1 3.42Å; T283-T286 PolarHBondContact O-N 3.14Å; T283-T286 PolarHBondContact O-OG1 3.47Å; P284-T286 PolarHBondContact O-N 3.36Å
287	W	95.1	Very high	95	Very high	6 Å²	6	44.8 Å²	44.8	2%	0.023	22%	0.224	C	C	.	.			trans	-84.9	131.1	-176.8	-74.5	71.9	0	0	0	111.6	I253 L276 L279 A280 P284 H285 N291 I292 L295 V314 L318	I253-W287 HydrophobicContact CD1-CD2 3.92Å; I253-W287 HydrophobicContact CD1-CG 4.07Å; I253-W287 HydrophobicContact CD1-CZ2 4.33Å; I253-W287 HydrophobicContact CG1-CZ2 4.38Å; I253-W287 HydrophobicContact CG2-CE3 4.16Å; I253-W287 HydrophobicContact CG2-CH2 4.22Å; I253-W287 HydrophobicContact CG2-CZ3 3.99Å; L276-W287 HydrophobicContact CB-CH2 4.11Å; L276-W287 HydrophobicContact CB-CZ2 4.42Å; L276-W287 HydrophobicContact CD2-CH2 3.61Å; L276-W287 HydrophobicContact CD2-CZ2 4.08Å; L276-W287 HydrophobicContact CD2-CZ3 4.48Å; L276-W287 HydrophobicContact CG-CH2 4.34Å; L279-W287 HydrophobicContact CB-CZ2 4.48Å; A280-W287 HydrophobicContact CB-CZ2 4.23Å; P284-W287 PolarHBondContact O-N 2.86Å; H285-W287 VanDerWaalsContact C-N 3.33Å; W287-N291 HydrophobicContact CE3-CB 3.93Å; W287-N291 HydrophobicContact CZ3-CB 4.37Å; W287-I292 HydrophobicContact CE3-CG1 4.36Å; W287-L295 HydrophobicContact CZ3-CD2 4.45Å; W287-V314 HydrophobicContact CH2-CG1 3.96Å; W287-V314 HydrophobicContact CZ2-CG1 4.41Å; W287-L318 HydrophobicContact CB-CD2 4.39Å; W287-L318 HydrophobicContact CD2-CD1 3.75Å; W287-L318 HydrophobicContact CD2-CD2 3.69Å; W287-L318 HydrophobicContact CD2-CG 4.38Å; W287-L318 HydrophobicContact CE3-CD1 3.54Å; W287-L318 HydrophobicContact CE3-CD2 4.36Å; W287-L318 HydrophobicContact CG-CD1 4.45Å; W287-L318 HydrophobicContact CG-CD2 3.69Å; W287-L318 HydrophobicContact CH2-CD1 3.85Å; W287-L318 HydrophobicContact CZ2-CD1 4.1Å; W287-L318 HydrophobicContact CZ2-CD2 4.31Å; W287-L318 HydrophobicContact CZ3-CD1 3.6Å
288	S	93.6	Very high	94.9	Very high	31 Å²	31	41 Å²	41	22%	0.217	21%	0.208	C	C	.	.			trans	-94.2	167.9	176.4	67.1	0	0	0	0	112.5	E290 N291 I292	S288-E290 VanDerWaalsContact C-N 3.3Å; S288-E290 WeakPolarHBondContact CB-OE2 3.41Å; S288-E290 PolarHBondContact O-N 2.89Å; S288-E290 PolarHBondContact OG-OE2 3.41Å; S288-N291 PolarHBondContact N-OD1 3.49Å; S288-N291 PolarHBondContact O-N 3.01Å; S288-N291 PolarHBondContact OG-N 3.08Å; S288-N291 PolarHBondContact OG-OD1 3.47Å; S288-I292 PolarHBondContact O-N 2.83Å
289	R	91.6	Very high	94.8	Very high	84 Å²	84	38.1 Å²	38.1	32%	0.317	19%	0.193	S	C	.	.	H	α-helix	trans	-60.9	-42.4	175.1	177.6	179.7	-75.2	-171.8	2	111	N291 I292 Q293 Y327 S329	R289-N291 VanDerWaalsContact C-N 3.3Å; R289-N291 PolarHBondContact O-N 3.19Å; R289-I292 PolarHBondContact O-N 3.15Å; R289-Q293 HydrophobicContact CG-CG 4.43Å; R289-Q293 WeakPolarHBondContact O-CG 3.44Å; R289-Q293 PolarHBondContact O-N 2.91Å; R289-Y327 HydrophobicContact CB-CD2 4.32Å; R289-Y327 HydrophobicContact CG-CD2 3.93Å; R289-Y327 HydrophobicContact CG-CE2 3.87Å; R289-Y327 PolarHBondContact NE-O 3.25Å; R289-Y327 PolarHBondContact NH2-O 3.11Å; R289-S329 PolarHBondContact NH2-O 3.41Å
290	E	92.9	Very high	94.6	Very high	119 Å²	119	41.7 Å²	41.7	56%	0.556	21%	0.211	S	C	*	.	H	α-helix	trans	-63.5	-37.3	-178.3	-62.3	69.3	-151.7	0	0	111.1	S288 A294	S288-E290 VanDerWaalsContact C-N 3.3Å; S288-E290 WeakPolarHBondContact CB-OE2 3.41Å; S288-E290 PolarHBondContact O-N 2.89Å; S288-E290 PolarHBondContact OG-OE2 3.41Å; E290-A294 VanDerWaalsContact O-CB 3.27Å; E290-A294 WeakPolarHBondContact O-CB 3.42Å; E290-A294 PolarHBondContact O-N 2.85Å
291	N	95.4	Very high	94.3	Very high	8 Å²	8	49 Å²	49	4%	0.043	25%	0.246	C	C	.	.	H	α-helix	trans	-65.5	-42.4	176.5	-60.4	141.5	0	0	0	112	I253 L257 W287 S288 R289 L295	I253-N291 HydrophobicContact CG2-CB 3.86Å; L257-N291 HydrophobicContact CD1-CB 3.94Å; W287-N291 HydrophobicContact CE3-CB 3.93Å; W287-N291 HydrophobicContact CZ3-CB 4.37Å; S288-N291 PolarHBondContact N-OD1 3.49Å; S288-N291 PolarHBondContact O-N 3.01Å; S288-N291 PolarHBondContact OG-N 3.08Å; S288-N291 PolarHBondContact OG-OD1 3.47Å; R289-N291 VanDerWaalsContact C-N 3.3Å; R289-N291 PolarHBondContact O-N 3.19Å; N291-L295 PolarHBondContact O-N 2.95Å; N291-L295 VanDerWaalsContact O-N 3.09Å
292	I	95.5	Very high	94.3	Very high	5 Å²	5	46 Å²	46	3%	0.026	22%	0.224	C	C	.	.	H	α-helix	trans	-67.9	-44.8	179.6	-64.5	172.2	0	0	0	109.9	W287 S288 R289 A294 L295 C296 L315 L318 Y327 L344	W287-I292 HydrophobicContact CE3-CG1 4.36Å; S288-I292 PolarHBondContact O-N 2.83Å; R289-I292 PolarHBondContact O-N 3.15Å; I292-A294 PolarHBondContact O-N 3.25Å; I292-L295 PolarHBondContact O-N 3.36Å; I292-C296 PolarHBondContact O-N 2.86Å; I292-C296 PolarHBondContact O-SG 3.42Å; I292-L315 HydrophobicContact CG2-CD2 4.08Å; I292-L318 HydrophobicContact CG1-CD1 4.46Å; I292-Y327 HydrophobicContact CB-CD2 3.81Å; I292-Y327 HydrophobicContact CB-CE2 3.82Å; I292-Y327 HydrophobicContact CD1-CD2 3.83Å; I292-Y327 HydrophobicContact CD1-CG 4.32Å; I292-Y327 HydrophobicContact CG1-CD2 4.4Å; I292-Y327 HydrophobicContact CG2-CD2 3.77Å; I292-Y327 HydrophobicContact CG2-CE2 3.6Å; I292-L344 HydrophobicContact CG2-CD2 4.22Å
293	Q	93.4	Very high	94.2	Very high	65 Å²	65	45.2 Å²	45.2	30%	0.304	23%	0.231	S	C	.	.	H	α-helix	trans	-57.7	-49.2	175.1	-74.4	173.8	-21.7	0	0	111.6	R289 L295 C296 E297 Y327	R289-Q293 HydrophobicContact CG-CG 4.43Å; R289-Q293 WeakPolarHBondContact O-CG 3.44Å; R289-Q293 PolarHBondContact O-N 2.91Å; Q293-L295 VanDerWaalsContact C-N 3.26Å; Q293-L295 PolarHBondContact O-N 3.35Å; Q293-C296 WeakPolarHBondContact O-CB 3.21Å; Q293-C296 PolarHBondContact O-N 2.92Å; Q293-C296 VanDerWaalsContact O-N 3.07Å; Q293-E297 WeakPolarHBondContact O-CG 3.45Å; Q293-E297 PolarHBondContact O-N 3.12Å; Q293-Y327 HydrophobicContact CG-CE2 4.06Å
294	A	94.9	Very high	94.3	Very high	16 Å²	16	51.6 Å²	51.6	13%	0.132	26%	0.256	C	S	.	.	H	α-helix	trans	-60.9	-34.5	178.8	0	0	0	0	0	113.1	L257 K261 E290 I292 C298	L257-A294 HydrophobicContact CD1-CB 4.18Å; K261-A294 WeakPolarHBondContact CE-O 3.48Å; E290-A294 VanDerWaalsContact O-CB 3.27Å; E290-A294 WeakPolarHBondContact O-CB 3.42Å; E290-A294 PolarHBondContact O-N 2.85Å; I292-A294 PolarHBondContact O-N 3.25Å; A294-C298 WeakPolarHBondContact O-CB 3.29Å; A294-C298 PolarHBondContact O-N 2.89Å
295	L	97.1	Very high	94.3	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-70.5	-40.7	174.2	-174.8	59.1	0	0	0	111.7	L257 L260 L276 W287 N291 I292 Q293 C298 A299 M311 V314 L315	L257-L295 HydrophobicContact CD2-CB 3.88Å; L257-L295 HydrophobicContact CD2-CD1 3.96Å; L257-L295 HydrophobicContact CD2-CG 4.45Å; L260-L295 HydrophobicContact CD2-CD1 3.59Å; L276-L295 HydrophobicContact CD1-CD1 4.35Å; W287-L295 HydrophobicContact CZ3-CD2 4.45Å; N291-L295 PolarHBondContact O-N 2.95Å; N291-L295 VanDerWaalsContact O-N 3.09Å; I292-L295 PolarHBondContact O-N 3.36Å; Q293-L295 VanDerWaalsContact C-N 3.26Å; Q293-L295 PolarHBondContact O-N 3.35Å; L295-C298 PolarHBondContact O-N 3.18Å; L295-A299 WeakPolarHBondContact O-CB 3.34Å; L295-A299 PolarHBondContact O-N 2.99Å; L295-M311 HydrophobicContact CD1-CB 4.09Å; L295-M311 HydrophobicContact CD1-CG 3.95Å; L295-M311 HydrophobicContact CD1-SD 4.44Å; L295-V314 HydrophobicContact CD2-CB 4.18Å; L295-V314 HydrophobicContact CD2-CG1 3.89Å; L295-L315 HydrophobicContact CD2-CD2 3.75Å; L295-L315 HydrophobicContact CD2-CG 3.89Å; L295-L315 HydrophobicContact CG-CD2 4.26Å; L295-L315 HydrophobicContact CG-CG 4.33Å
296	C	95.9	Very high	94.4	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-62.5	-48.1	176.1	-70.2	0	0	0	0	112	I292 Q293 C298 A299 L300 D343 L347	I292-C296 PolarHBondContact O-N 2.86Å; I292-C296 PolarHBondContact O-SG 3.42Å; Q293-C296 WeakPolarHBondContact O-CB 3.21Å; Q293-C296 PolarHBondContact O-N 2.92Å; Q293-C296 VanDerWaalsContact O-N 3.07Å; C296-C298 VanDerWaalsContact C-N 3.29Å; C296-C298 PolarHBondContact O-N 3.44Å; C296-A299 PolarHBondContact O-N 3.45Å; C296-A299 VanDerWaalsContact O-N 3.15Å; C296-L300 WeakPolarHBondContact O-CG 3.22Å; C296-L300 PolarHBondContact O-N 2.88Å; C296-D343 HydrophobicContact CB-CB 4.11Å; C296-L347 HydrophobicContact CB-CD2 4.11Å
297	E	93.8	Very high	94.6	Very high	74 Å²	74	49.7 Å²	49.7	35%	0.346	25%	0.253	S	S	.	.	H	α-helix	trans	-55.9	-45.1	174.8	-70	168.8	175.5	0	0	111.7	K261 Q293 A299 L300 Q301	K261-E297 IonicContact NZ-OE2 3.19Å; K261-E297 PolarHBondContact NZ-OE2 2.94Å; Q293-E297 WeakPolarHBondContact O-CG 3.45Å; Q293-E297 PolarHBondContact O-N 3.12Å; E297-A299 VanDerWaalsContact C-N 3.32Å; E297-A299 PolarHBondContact O-N 2.72Å; E297-L300 PolarHBondContact O-N 3.37Å; E297-Q301 WeakPolarHBondContact O-CG 3.33Å; E297-Q301 PolarHBondContact O-N 3.17Å
298	C	94.9	Very high	94.7	Very high	6 Å²	6	50.2 Å²	50.2	4%	0.041	26%	0.255	C	S	.	.	H	α-helix	trans	-63.5	-39.6	178.6	-171.7	0	0	0	0	111.8	K261 A294 L295 C296 Q301 T302 M311	K261-C298 HydrophobicContact CG-CB 4.12Å; A294-C298 WeakPolarHBondContact O-CB 3.29Å; A294-C298 PolarHBondContact O-N 2.89Å; L295-C298 PolarHBondContact O-N 3.18Å; C296-C298 VanDerWaalsContact C-N 3.29Å; C296-C298 PolarHBondContact O-N 3.44Å; C298-Q301 PolarHBondContact O-N 2.78Å; C298-T302 WeakPolarHBondContact O-CB 3.45Å; C298-T302 PolarHBondContact O-N 2.78Å; C298-T302 PolarHBondContact O-OG1 2.92Å; C298-M311 HydrophobicContact CB-SD 4.44Å; C298-M311 VanDerWaalsContact SG-CE 3.57Å
299	A	95.8	Very high	94.9	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-67	-40.5	176.8	0	0	0	0	0	112.5	L295 C296 E297 Q301 T302 K308 M311 L347	L295-A299 WeakPolarHBondContact O-CB 3.34Å; L295-A299 PolarHBondContact O-N 2.99Å; C296-A299 PolarHBondContact O-N 3.45Å; C296-A299 VanDerWaalsContact O-N 3.15Å; E297-A299 VanDerWaalsContact C-N 3.32Å; E297-A299 PolarHBondContact O-N 2.72Å; A299-Q301 VanDerWaalsContact C-N 3.33Å; A299-Q301 PolarHBondContact O-N 2.77Å; A299-T302 PolarHBondContact O-N 2.73Å; A299-K308 WeakPolarHBondContact O-CE 3.49Å; A299-M311 VanDerWaalsContact CA-SD 3.52Å; A299-M311 HydrophobicContact CB-CB 4.2Å; A299-M311 HydrophobicContact CB-SD 3.74Å; A299-L347 HydrophobicContact CB-CD1 4.13Å; A299-L347 HydrophobicContact CB-CD2 3.75Å
300	L	92.8	Very high	95.2	Very high	75 Å²	75	47.8 Å²	47.8	39%	0.393	25%	0.248	S	C	.	.	H	α-helix	trans	-63.8	-37.4	176.5	-73.9	169.7	0	0	0	112.3	C296 E297 T302 L347	C296-L300 WeakPolarHBondContact O-CG 3.22Å; C296-L300 PolarHBondContact O-N 2.88Å; E297-L300 PolarHBondContact O-N 3.37Å; L300-T302 VanDerWaalsContact C-N 3.33Å; L300-L347 HydrophobicContact CD2-CB 4.19Å; L300-L347 HydrophobicContact CD2-CD1 3.65Å; L300-L347 HydrophobicContact CG-CB 4.4Å; L300-L347 HydrophobicContact CG-CD1 3.93Å
301	Q	92	Very high	95.5	Very high	155 Å²	155	42.1 Å²	42.1	72%	0.724	22%	0.222	S	C	*	.	H	α-helix	trans	-81.9	-10	-180	-67.7	172.4	2.2	0	0	113.7	E297 C298 A299 P303	E297-Q301 WeakPolarHBondContact O-CG 3.33Å; E297-Q301 PolarHBondContact O-N 3.17Å; C298-Q301 PolarHBondContact O-N 2.78Å; A299-Q301 VanDerWaalsContact C-N 3.33Å; A299-Q301 PolarHBondContact O-N 2.77Å; Q301-P303 WeakPolarHBondContact O-CD 3.39Å
302	T	94.3	Very high	95.6	Very high	17 Å²	17	41.8 Å²	41.8	10%	0.104	22%	0.22	C	C	.	.			trans	-83.6	121.4	-173.2	-71.7	0	0	0	0	111.5	C298 A299 L300 Y304 L307	C298-T302 WeakPolarHBondContact O-CB 3.45Å; C298-T302 PolarHBondContact O-N 2.78Å; C298-T302 PolarHBondContact O-OG1 2.92Å; A299-T302 PolarHBondContact O-N 2.73Å; L300-T302 VanDerWaalsContact C-N 3.33Å; T302-Y304 VanDerWaalsContact C-N 3.29Å; T302-Y304 PolarHBondContact O-N 3.49Å; T302-L307 HydrophobicContact CG2-CB 3.7Å; T302-L307 HydrophobicContact CG2-CD1 4.34Å
303	P	93.2	Very high	95.7	Very high	107 Å²	107	42 Å²	42	70%	0.695	22%	0.223	S	C	*	.			trans	-82.7	-2.7	178.6	34.2	-36.7	0	0	0	113.7	Q301	Q301-P303 WeakPolarHBondContact O-CD 3.39Å
304	Y	95.3	Very high	95.9	Very high	136 Å²	136	39 Å²	39	53%	0.533	21%	0.208	S	C	.	.			trans	-106.3	116.4	-173.8	-58.9	-72.8	0	0	0	112.6	T302 S306 L307 K308	T302-Y304 VanDerWaalsContact C-N 3.29Å; T302-Y304 PolarHBondContact O-N 3.49Å; Y304-S306 VanDerWaalsContact C-N 3.31Å; Y304-S306 PolarHBondContact O-N 3.24Å; Y304-L307 HydrophobicContact CD2-CD1 4.01Å; Y304-L307 HydrophobicContact CG-CD1 4.48Å; Y304-L307 PolarHBondContact O-N 3.49Å; Y304-K308 PolarHBondContact O-N 2.94Å
305	D	95.9	Very high	96.1	Very high	70 Å²	70	38.4 Å²	38.4	37%	0.374	20%	0.203	S	C	.	.	H	α-helix	trans	-49.8	-46.4	177.2	-71.8	18.9	0	0	0	113.8	L307 K308 L309 H354 I359	D305-L307 VanDerWaalsContact C-N 3.26Å; D305-L307 PolarHBondContact O-N 2.93Å; D305-K308 PolarHBondContact O-N 3.47Å; D305-L309 WeakPolarHBondContact O-CB 3.43Å; D305-L309 PolarHBondContact O-N 3.3Å; D305-H354 IonicContact OD1-CE1 3.13Å; D305-H354 IonicContact OD2-CE1 3.66Å; D305-I359 HydrophobicContact CB-CD1 4.03Å
306	S	96.3	Very high	96.1	Very high	66 Å²	66	38.7 Å²	38.7	46%	0.462	21%	0.205	S	C	.	.	H	α-helix	trans	-62.8	-32.8	-177.6	170.9	0	0	0	0	112.9	Y304 G310	Y304-S306 VanDerWaalsContact C-N 3.31Å; Y304-S306 PolarHBondContact O-N 3.24Å; S306-G310 PolarHBondContact O-N 3.36Å
307	L	97.1	Very high	96.2	Very high	3 Å²	3	40.5 Å²	40.5	2%	0.016	22%	0.216	C	C	.	.	H	α-helix	trans	-80.6	-43.4	177.6	-67.7	-179.5	0	0	0	110.5	K269 R270 I273 T302 Y304 D305 L309 G310 M311	K269-L307 HydrophobicContact CB-CD1 4.24Å; K269-L307 HydrophobicContact CB-CD2 3.94Å; K269-L307 HydrophobicContact CD-CD1 3.73Å; R270-L307 HydrophobicContact CG-CD2 3.75Å; I273-L307 HydrophobicContact CD1-CB 4.35Å; I273-L307 HydrophobicContact CD1-CD2 3.83Å; T302-L307 HydrophobicContact CG2-CB 3.7Å; T302-L307 HydrophobicContact CG2-CD1 4.34Å; Y304-L307 HydrophobicContact CD2-CD1 4.01Å; Y304-L307 HydrophobicContact CG-CD1 4.48Å; Y304-L307 PolarHBondContact O-N 3.49Å; D305-L307 VanDerWaalsContact C-N 3.26Å; D305-L307 PolarHBondContact O-N 2.93Å; L307-L309 PolarHBondContact O-N 3.49Å; L307-G310 PolarHBondContact O-N 3.17Å; L307-G310 VanDerWaalsContact O-N 3.11Å; L307-M311 HydrophobicContact CB-CE 4.41Å; L307-M311 WeakPolarHBondContact O-CG 3.37Å; L307-M311 PolarHBondContact O-N 2.84Å
308	K	97.5	Very high	96.4	Very high	17 Å²	17	37.1 Å²	37.1	7%	0.074	20%	0.201	C	C	.	.	H	α-helix	trans	-57	-47.5	174.4	-173.6	179.5	-80.7	-160	0	111.1	A299 Y304 D305 G310 M311 L312 E350 I359	A299-K308 WeakPolarHBondContact O-CE 3.49Å; Y304-K308 PolarHBondContact O-N 2.94Å; D305-K308 PolarHBondContact O-N 3.47Å; K308-G310 VanDerWaalsContact C-N 3.32Å; K308-G310 PolarHBondContact O-N 3.5Å; K308-M311 PolarHBondContact O-N 3.12Å; K308-L312 HydrophobicContact CG-CD1 4.19Å; K308-L312 WeakPolarHBondContact O-CB 3.35Å; K308-L312 WeakPolarHBondContact O-CG 3.01Å; K308-L312 PolarHBondContact O-N 3.13Å; K308-E350 IonicContact NZ-OE1 2.87Å; K308-E350 PolarHBondContact NZ-OE1 3.35Å; K308-E350 IonicContact NZ-OE2 2.75Å; K308-E350 PolarHBondContact NZ-OE2 3.07Å; K308-I359 HydrophobicContact CB-CD1 4.26Å; K308-I359 HydrophobicContact CD-CD1 4.28Å; K308-I359 HydrophobicContact CD-CG2 4.44Å; K308-I359 HydrophobicContact CG-CD1 4.34Å
309	L	97.6	Very high	96.4	Very high	52 Å²	52	37 Å²	37	27%	0.272	20%	0.2	S	C	.	.	H	α-helix	trans	-55.5	-45.8	173.2	177.5	62.4	0	0	0	112.2	D305 L307 L312 S313 G358 I359	D305-L309 WeakPolarHBondContact O-CB 3.43Å; D305-L309 PolarHBondContact O-N 3.3Å; L307-L309 PolarHBondContact O-N 3.49Å; L309-L312 PolarHBondContact O-N 3Å; L309-S313 WeakPolarHBondContact O-CB 3.33Å; L309-S313 PolarHBondContact O-N 2.92Å; L309-G358 WeakPolarHBondContact CD1-O 3.43Å; L309-I359 HydrophobicContact CB-CD1 4.39Å; L309-I359 HydrophobicContact CB-CG1 3.83Å; L309-I359 HydrophobicContact CD1-CG1 4.08Å
310	G	97.6	Very high	96.3	Very high	12 Å²	12	39.1 Å²	39.1	12%	0.124	22%	0.222	C	C	.	.	H	α-helix	trans	-60	-49.8	178.6	0	0	0	0	0	112.5	I273 S306 L307 K308 S313 V314	I273-G310 WeakPolarHBondContact CG2-O 3.42Å; S306-G310 PolarHBondContact O-N 3.36Å; L307-G310 PolarHBondContact O-N 3.17Å; L307-G310 VanDerWaalsContact O-N 3.11Å; K308-G310 VanDerWaalsContact C-N 3.32Å; K308-G310 PolarHBondContact O-N 3.5Å; G310-S313 WeakPolarHBondContact O-CB 3.39Å; G310-S313 PolarHBondContact O-N 2.93Å; G310-S313 VanDerWaalsContact O-N 3.15Å; G310-S313 PolarHBondContact O-OG 3.33Å; G310-V314 PolarHBondContact O-N 3.2Å
311	M	98.4	Very high	96.5	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.9	-43.5	177.7	-63.9	172.5	-166.9	0	0	112	L260 I273 L295 C298 A299 L307 K308 S313 V314 L315	L260-M311 HydrophobicContact CD1-CE 3.67Å; L260-M311 HydrophobicContact CD2-CE 3.81Å; L260-M311 HydrophobicContact CD2-CG 4.17Å; L260-M311 HydrophobicContact CD2-SD 4.28Å; L260-M311 HydrophobicContact CG-CE 3.73Å; I273-M311 HydrophobicContact CD1-CE 4.35Å; I273-M311 HydrophobicContact CD1-CG 3.9Å; I273-M311 HydrophobicContact CG1-CG 3.99Å; L295-M311 HydrophobicContact CD1-CB 4.09Å; L295-M311 HydrophobicContact CD1-CG 3.95Å; L295-M311 HydrophobicContact CD1-SD 4.44Å; C298-M311 HydrophobicContact CB-SD 4.44Å; C298-M311 VanDerWaalsContact SG-CE 3.57Å; A299-M311 VanDerWaalsContact CA-SD 3.52Å; A299-M311 HydrophobicContact CB-CB 4.2Å; A299-M311 HydrophobicContact CB-SD 3.74Å; L307-M311 HydrophobicContact CB-CE 4.41Å; L307-M311 WeakPolarHBondContact O-CG 3.37Å; L307-M311 PolarHBondContact O-N 2.84Å; K308-M311 PolarHBondContact O-N 3.12Å; M311-S313 PolarHBondContact O-N 2.84Å; M311-V314 WeakPolarHBondContact O-CB 3.35Å; M311-V314 PolarHBondContact O-N 2.84Å; M311-V314 VanDerWaalsContact O-N 3.08Å; M311-L315 PolarHBondContact O-N 2.99Å
312	L	97.9	Very high	96.5	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-62.6	-32.5	174.1	-73	170.8	0	0	0	112.2	K308 L309 V314 L315 S316 L347 C351 I359 H362	K308-L312 HydrophobicContact CG-CD1 4.19Å; K308-L312 WeakPolarHBondContact O-CB 3.35Å; K308-L312 WeakPolarHBondContact O-CG 3.01Å; K308-L312 PolarHBondContact O-N 3.13Å; L309-L312 PolarHBondContact O-N 3Å; L312-V314 VanDerWaalsContact C-N 3.31Å; L312-V314 PolarHBondContact O-N 3.2Å; L312-L315 HydrophobicContact CD2-CD1 4.29Å; L312-L315 PolarHBondContact O-N 3.46Å; L312-S316 VanDerWaalsContact O-CB 3.28Å; L312-S316 WeakPolarHBondContact O-CB 3.32Å; L312-S316 PolarHBondContact O-N 3.39Å; L312-S316 PolarHBondContact O-OG 2.91Å; L312-L347 HydrophobicContact CD2-CD2 4.14Å; L312-L347 HydrophobicContact CD2-CG 4.18Å; L312-C351 HydrophobicContact CD1-CB 3.84Å; L312-C351 HydrophobicContact CD2-CB 4.38Å; L312-I359 HydrophobicContact CD1-CB 4.26Å; L312-I359 HydrophobicContact CD1-CG1 4.48Å; L312-I359 HydrophobicContact CD1-CG2 3.57Å; L312-H362 HydrophobicContact CB-CB 3.76Å
313	S	97.9	Very high	96.4	Very high	11 Å²	11	34.7 Å²	34.7	8%	0.077	20%	0.204	C	C	.	.	H	α-helix	trans	-64.7	-36.7	173.9	89.3	0	0	0	0	112.1	K277 L309 G310 M311 S316 T317	K277-S313 PolarHBondContact NZ-OG 3.47Å; L309-S313 WeakPolarHBondContact O-CB 3.33Å; L309-S313 PolarHBondContact O-N 2.92Å; G310-S313 WeakPolarHBondContact O-CB 3.39Å; G310-S313 PolarHBondContact O-N 2.93Å; G310-S313 VanDerWaalsContact O-N 3.15Å; G310-S313 PolarHBondContact O-OG 3.33Å; M311-S313 PolarHBondContact O-N 2.84Å; S313-S316 PolarHBondContact O-OG 2.78Å; S313-T317 PolarHBondContact O-N 2.99Å; S313-T317 PolarHBondContact O-OG1 2.92Å
314	V	98.5	Very high	96.3	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-64.6	-51.7	171.9	-178.9	0	0	0	0	110	I273 L276 K277 A280 W287 L295 G310 M311 L312 S316 T317 L318	I273-V314 HydrophobicContact CG2-CG2 4.19Å; I273-V314 WeakPolarHBondContact O-CG2 3.4Å; L276-V314 HydrophobicContact CB-CG1 4.08Å; L276-V314 HydrophobicContact CB-CG2 4.15Å; K277-V314 HydrophobicContact CB-CG2 3.95Å; A280-V314 HydrophobicContact CB-CG1 4.22Å; W287-V314 HydrophobicContact CH2-CG1 3.96Å; W287-V314 HydrophobicContact CZ2-CG1 4.41Å; L295-V314 HydrophobicContact CD2-CB 4.18Å; L295-V314 HydrophobicContact CD2-CG1 3.89Å; G310-V314 PolarHBondContact O-N 3.2Å; M311-V314 WeakPolarHBondContact O-CB 3.35Å; M311-V314 PolarHBondContact O-N 2.84Å; M311-V314 VanDerWaalsContact O-N 3.08Å; L312-V314 VanDerWaalsContact C-N 3.31Å; L312-V314 PolarHBondContact O-N 3.2Å; V314-S316 VanDerWaalsContact C-N 3.3Å; V314-S316 PolarHBondContact O-N 2.9Å; V314-T317 WeakPolarHBondContact O-CA 3.44Å; V314-T317 WeakPolarHBondContact O-CB 3.25Å; V314-T317 PolarHBondContact O-N 2.89Å; V314-L318 HydrophobicContact CG1-CD1 4.08Å; V314-L318 PolarHBondContact O-N 2.79Å
315	L	98.1	Very high	96	Very high	4 Å²	4	29.4 Å²	29.4	2%	0.021	17%	0.173	C	C	.	.	H	α-helix	trans	-59.1	-39.6	179.6	-70.2	172.3	0	0	0	112.3	I292 L295 M311 L312 T317 L318 S319 L344 L347 V366	I292-L315 HydrophobicContact CG2-CD2 4.08Å; L295-L315 HydrophobicContact CD2-CD2 3.75Å; L295-L315 HydrophobicContact CD2-CG 3.89Å; L295-L315 HydrophobicContact CG-CD2 4.26Å; L295-L315 HydrophobicContact CG-CG 4.33Å; M311-L315 PolarHBondContact O-N 2.99Å; L312-L315 HydrophobicContact CD2-CD1 4.29Å; L312-L315 PolarHBondContact O-N 3.46Å; L315-T317 VanDerWaalsContact C-N 3.27Å; L315-T317 PolarHBondContact O-N 3.09Å; L315-L318 PolarHBondContact O-N 2.91Å; L315-S319 VanDerWaalsContact O-CB 3.32Å; L315-S319 WeakPolarHBondContact O-CB 3.36Å; L315-S319 PolarHBondContact O-N 3.04Å; L315-S319 PolarHBondContact O-OG 3.18Å; L315-L344 HydrophobicContact CB-CD1 4.46Å; L315-L344 HydrophobicContact CD1-CD1 4.09Å; L315-L344 HydrophobicContact CD2-CD1 4.03Å; L315-L344 HydrophobicContact CG-CD1 4.43Å; L315-L347 HydrophobicContact CD1-CD2 3.69Å; L315-V366 HydrophobicContact CB-CG2 4.32Å
316	S	97.2	Very high	95.6	Very high	7 Å²	7	31 Å²	31	5%	0.049	18%	0.178	C	C	.	.	H	α-helix	trans	-67.8	-27.2	176	76.6	0	0	0	0	113.5	L312 S313 V314 S319 H362	L312-S316 VanDerWaalsContact O-CB 3.28Å; L312-S316 WeakPolarHBondContact O-CB 3.32Å; L312-S316 PolarHBondContact O-N 3.39Å; L312-S316 PolarHBondContact O-OG 2.91Å; S313-S316 PolarHBondContact O-OG 2.78Å; V314-S316 VanDerWaalsContact C-N 3.3Å; V314-S316 PolarHBondContact O-N 2.9Å; S316-S319 WeakPolarHBondContact CA-OG 3.21Å; S316-S319 PolarHBondContact O-OG 3.38Å; S316-H362 WeakPolarHBondContact CB-ND1 3.34Å; S316-H362 PolarHBondContact OG-CE1 2.89Å; S316-H362 PolarHBondContact OG-ND1 2.54Å
317	T	97.9	Very high	95.3	Very high	37 Å²	37	28.1 Å²	28.1	23%	0.227	16%	0.157	C	C	.	.	H	α-helix	trans	-74.5	-48.8	174.6	-54.5	0	0	0	0	109.2	A280 S313 V314 L315 S319 G320	A280-T317 HydrophobicContact CB-CG2 4.05Å; S313-T317 PolarHBondContact O-N 2.99Å; S313-T317 PolarHBondContact O-OG1 2.92Å; V314-T317 WeakPolarHBondContact O-CA 3.44Å; V314-T317 WeakPolarHBondContact O-CB 3.25Å; V314-T317 PolarHBondContact O-N 2.89Å; L315-T317 VanDerWaalsContact C-N 3.27Å; L315-T317 PolarHBondContact O-N 3.09Å; T317-S319 PolarHBondContact O-N 3.06Å; T317-G320 PolarHBondContact O-N 2.82Å
318	L	97.4	Very high	94.6	Very high	4 Å²	4	29.5 Å²	29.5	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-60.8	-42.8	177	-69.9	170.7	0	0	0	112.3	A280 W287 I292 V314 L315 G320 T321 A323	A280-L318 HydrophobicContact CB-CD2 3.55Å; A280-L318 HydrophobicContact CB-CG 3.72Å; W287-L318 HydrophobicContact CB-CD2 4.39Å; W287-L318 HydrophobicContact CD2-CD1 3.75Å; W287-L318 HydrophobicContact CD2-CD2 3.69Å; W287-L318 HydrophobicContact CD2-CG 4.38Å; W287-L318 HydrophobicContact CE3-CD1 3.54Å; W287-L318 HydrophobicContact CE3-CD2 4.36Å; W287-L318 HydrophobicContact CG-CD1 4.45Å; W287-L318 HydrophobicContact CG-CD2 3.69Å; W287-L318 HydrophobicContact CH2-CD1 3.85Å; W287-L318 HydrophobicContact CZ2-CD1 4.1Å; W287-L318 HydrophobicContact CZ2-CD2 4.31Å; W287-L318 HydrophobicContact CZ3-CD1 3.6Å; I292-L318 HydrophobicContact CG1-CD1 4.46Å; V314-L318 HydrophobicContact CG1-CD1 4.08Å; V314-L318 PolarHBondContact O-N 2.79Å; L315-L318 PolarHBondContact O-N 2.91Å; L318-G320 PolarHBondContact O-N 3.37Å; L318-T321 PolarHBondContact O-N 3.14Å; L318-T321 PolarHBondContact O-OG1 3.06Å; L318-A323 HydrophobicContact CB-CB 4.43Å; L318-A323 HydrophobicContact CD2-CB 4.31Å
319	S	95.3	Very high	93.6	Very high	3 Å²	3	31.2 Å²	31.2	2%	0.021	18%	0.177	C	C	.	.	H	α-helix	trans	-65.5	-20.7	-177.9	68.5	0	0	0	0	113.4	L315 S316 T317 T321 I324 N369	L315-S319 VanDerWaalsContact O-CB 3.32Å; L315-S319 WeakPolarHBondContact O-CB 3.36Å; L315-S319 PolarHBondContact O-N 3.04Å; L315-S319 PolarHBondContact O-OG 3.18Å; S316-S319 WeakPolarHBondContact CA-OG 3.21Å; S316-S319 PolarHBondContact O-OG 3.38Å; T317-S319 PolarHBondContact O-N 3.06Å; S319-T321 PolarHBondContact O-N 3.29Å; S319-I324 WeakPolarHBondContact O-CG2 3.5Å; S319-N369 WeakPolarHBondContact O-CB 3.4Å; S319-N369 PolarHBondContact OG-ND2 2.86Å
320	G	94.7	Very high	91.8	Very high	45 Å²	45	34.5 Å²	34.5	46%	0.464	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	0	173.2	0	0	0	0	0	114.8	T317 L318 N369	T317-G320 PolarHBondContact O-N 2.82Å; L318-G320 PolarHBondContact O-N 3.37Å; G320-N369 PolarHBondContact N-ND2 3.26Å
321	T	95.5	Very high	89.8	Confident	40 Å²	40	38.8 Å²	38.8	25%	0.245	22%	0.223	C	C	.	.	S	Bend	trans	-123.3	-177.4	-173.3	73.7	0	0	0	0	111.8	P284 L318 S319 A323 I324	P284-T321 HydrophobicContact CB-CG2 3.79Å; P284-T321 WeakPolarHBondContact CB-OG1 3.47Å; P284-T321 HydrophobicContact CG-CG2 4Å; L318-T321 PolarHBondContact O-N 3.14Å; L318-T321 PolarHBondContact O-OG1 3.06Å; S319-T321 PolarHBondContact O-N 3.29Å; T321-A323 PolarHBondContact O-N 2.97Å; T321-A323 VanDerWaalsContact O-N 3.11Å; T321-A323 WeakPolarHBondContact OG1-CB 3.39Å; T321-A323 PolarHBondContact OG1-N 2.95Å; T321-I324 WeakPolarHBondContact O-CG2 3.2Å; T321-I324 PolarHBondContact O-N 3.08Å
322	I	92.2	Very high	87.2	Confident	109 Å²	109	44.9 Å²	44.9	56%	0.559	26%	0.263	S	S	*	.	H	α-helix	trans	-60.7	-17.6	174.8	60.4	167.2	0	0	0	114	H285 I324 K325 H326	H285-I322 HydrophobicContact CB-CD1 3.82Å; H285-I322 HydrophobicContact CB-CG1 4.47Å; I322-I324 PolarHBondContact O-N 2.76Å; I322-K325 PolarHBondContact O-N 3.37Å; I322-K325 VanDerWaalsContact O-N 3.11Å; I322-H326 PolarHBondContact O-N 2.98Å; I322-H326 VanDerWaalsContact O-N 3.09Å
323	A	93.1	Very high	84.8	Confident	5 Å²	5	48.6 Å²	48.6	4%	0.041	30%	0.301	C	S	.	.	H	α-helix	trans	-56.9	-34.6	178.9	0	0	0	0	0	112.4	L318 T321 Y327	L318-A323 HydrophobicContact CB-CB 4.43Å; L318-A323 HydrophobicContact CD2-CB 4.31Å; T321-A323 PolarHBondContact O-N 2.97Å; T321-A323 VanDerWaalsContact O-N 3.11Å; T321-A323 WeakPolarHBondContact OG1-CB 3.39Å; T321-A323 PolarHBondContact OG1-N 2.95Å; A323-Y327 WeakPolarHBondContact O-CB 3.36Å; A323-Y327 PolarHBondContact O-N 3.24Å
324	I	91.6	Very high	82.3	Confident	4 Å²	4	54.1 Å²	54.1	2%	0.021	33%	0.329	C	S	.	.	H	α-helix	trans	-69.5	-38.9	178.5	-157.9	57.7	0	0	0	112.4	S319 T321 I322 Y327 F328 L344 I370	S319-I324 WeakPolarHBondContact O-CG2 3.5Å; T321-I324 WeakPolarHBondContact O-CG2 3.2Å; T321-I324 PolarHBondContact O-N 3.08Å; I322-I324 PolarHBondContact O-N 2.76Å; I324-Y327 WeakPolarHBondContact O-CB 3.43Å; I324-Y327 PolarHBondContact O-N 3.02Å; I324-F328 HydrophobicContact CD1-CD2 4.28Å; I324-F328 HydrophobicContact CD1-CE2 3.79Å; I324-F328 HydrophobicContact CG1-CD2 4.24Å; I324-F328 HydrophobicContact CG1-CE2 4.06Å; I324-F328 VanDerWaalsContact O-CD2 3.32Å; I324-F328 WeakPolarHBondContact O-CD2 3.41Å; I324-F328 PolarHBondContact O-N 3.42Å; I324-L344 HydrophobicContact CD1-CD2 3.51Å; I324-I370 HydrophobicContact CD1-CD1 4.44Å; I324-I370 HydrophobicContact CD1-CG1 3.87Å; I324-I370 HydrophobicContact CG1-CG1 3.95Å
325	K	88.5	Confident	79.6	Confident	127 Å²	127	61.1 Å²	61.1	55%	0.552	37%	0.372	S	S	*	.	H	α-helix	trans	-66	-43.4	178.2	-64.4	-175.5	175.9	-175	0	110.3	I322 Y327 F328 S329	I322-K325 PolarHBondContact O-N 3.37Å; I322-K325 VanDerWaalsContact O-N 3.11Å; K325-Y327 VanDerWaalsContact C-N 3.31Å; K325-Y327 PolarHBondContact O-N 3.39Å; K325-F328 PolarHBondContact O-N 3.07Å; K325-S329 PolarHBondContact O-N 3.27Å
326	H	88	Confident	76.9	Confident	104 Å²	104	64.5 Å²	64.5	48%	0.481	40%	0.396	S	S	.	.	H	α-helix	trans	-64.2	-35.9	174.8	-175.8	-101.3	0	0	0	112.4	I322 F328 S329	I322-H326 PolarHBondContact O-N 2.98Å; I322-H326 VanDerWaalsContact O-N 3.09Å; H326-F328 VanDerWaalsContact C-N 3.31Å; H326-F328 PolarHBondContact O-N 3.36Å; H326-S329 WeakPolarHBondContact CA-OG 3.49Å; H326-S329 PolarHBondContact O-N 2.85Å; H326-S329 PolarHBondContact O-OG 3.21Å
327	Y	88.3	Confident	74.2	Confident	6 Å²	6	68.4 Å²	68.4	2%	0.024	42%	0.423	C	S	.	.	H	α-helix	trans	-59.6	-40.8	176.5	-178.3	-98.5	0	0	0	112.2	R289 I292 Q293 A323 I324 K325 L344	R289-Y327 HydrophobicContact CB-CD2 4.32Å; R289-Y327 HydrophobicContact CG-CD2 3.93Å; R289-Y327 HydrophobicContact CG-CE2 3.87Å; R289-Y327 PolarHBondContact NE-O 3.25Å; R289-Y327 PolarHBondContact NH2-O 3.11Å; I292-Y327 HydrophobicContact CB-CD2 3.81Å; I292-Y327 HydrophobicContact CB-CE2 3.82Å; I292-Y327 HydrophobicContact CD1-CD2 3.83Å; I292-Y327 HydrophobicContact CD1-CG 4.32Å; I292-Y327 HydrophobicContact CG1-CD2 4.4Å; I292-Y327 HydrophobicContact CG2-CD2 3.77Å; I292-Y327 HydrophobicContact CG2-CE2 3.6Å; Q293-Y327 HydrophobicContact CG-CE2 4.06Å; A323-Y327 WeakPolarHBondContact O-CB 3.36Å; A323-Y327 PolarHBondContact O-N 3.24Å; I324-Y327 WeakPolarHBondContact O-CB 3.43Å; I324-Y327 PolarHBondContact O-N 3.02Å; K325-Y327 VanDerWaalsContact C-N 3.31Å; K325-Y327 PolarHBondContact O-N 3.39Å; Y327-L344 HydrophobicContact CD1-CD2 4.27Å; Y327-L344 HydrophobicContact CE1-CB 4.1Å; Y327-L344 HydrophobicContact CE1-CD2 4.17Å
328	F	82.4	Confident	71.6	Confident	31 Å²	31	71.8 Å²	71.8	14%	0.136	45%	0.446	C	S	.	.	H	α-helix	trans	-89.4	-19.4	179.8	-72.8	-77.4	0	0	0	114.6	I324 K325 H326 T330 V345 I370 C374 E376	I324-F328 HydrophobicContact CD1-CD2 4.28Å; I324-F328 HydrophobicContact CD1-CE2 3.79Å; I324-F328 HydrophobicContact CG1-CD2 4.24Å; I324-F328 HydrophobicContact CG1-CE2 4.06Å; I324-F328 VanDerWaalsContact O-CD2 3.32Å; I324-F328 WeakPolarHBondContact O-CD2 3.41Å; I324-F328 PolarHBondContact O-N 3.42Å; K325-F328 PolarHBondContact O-N 3.07Å; H326-F328 VanDerWaalsContact C-N 3.31Å; H326-F328 PolarHBondContact O-N 3.36Å; F328-T330 PolarHBondContact O-N 3.12Å; F328-V345 HydrophobicContact CE1-CG2 4.48Å; F328-V345 HydrophobicContact CZ-CG2 3.96Å; F328-I370 HydrophobicContact CE2-CD1 4.49Å; F328-I370 HydrophobicContact CE2-CG1 4.27Å; F328-I370 HydrophobicContact CE2-CG2 3.97Å; F328-I370 HydrophobicContact CZ-CG2 4.13Å; F328-C374 VanDerWaalsContact CD2-SG 3.5Å; F328-E376 HydrophobicContact CD1-CG 4.5Å
329	S	77.2	Confident	69.2	Low	53 Å²	53	76.7 Å²	76.7	37%	0.371	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-60.6	131	179.3	59.9	0	0	0	0	112.4	R289 K325 H326	R289-S329 PolarHBondContact NH2-O 3.41Å; K325-S329 PolarHBondContact O-N 3.27Å; H326-S329 WeakPolarHBondContact CA-OG 3.49Å; H326-S329 PolarHBondContact O-N 2.85Å; H326-S329 PolarHBondContact O-OG 3.21Å
330	T	60.8	Low	66.9	Low	121 Å²	121	86.7 Å²	86.7	74%	0.742	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-83.5	119.5	171.3	39.6	0	0	0	0	109.6	F328	F328-T330 PolarHBondContact O-N 3.12Å
331	V	55.2	Low	64.9	Low	103 Å²	103	88 Å²	88	62%	0.624	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-72.1	125	171.4	-179.4	0	0	0	0	108	G333	V331-G333 PolarHBondContact O-N 2.87Å; V331-G333 VanDerWaalsContact O-N 3.15Å
332	P	42.3	Very low	63.7	Low	128 Å²	128	86.9 Å²	86.9	83%	0.831	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	117.7	173.8	-14.7	27.2	0	0	0	109.3
333	G	47.8	Very low	63.2	Low	78 Å²	78	84 Å²	84	80%	0.804	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	119.6	-7.9	173	0	0	0	0	0	116.7	V331	V331-G333 PolarHBondContact O-N 2.87Å; V331-G333 VanDerWaalsContact O-N 3.15Å
334	N	46.3	Very low	63	Low	127 Å²	127	84 Å²	84	68%	0.679	50%	0.496	S	S	*	.			trans	-103.2	102	174.3	-143.9	-0	0	0	0	110.4	S336	N334-S336 PolarHBondContact O-N 3.09Å
335	V	41.6	Very low	63	Low	147 Å²	147	84.9 Å²	84.9	89%	0.891	50%	0.501	S	S	*	.			trans	-75.5	17.8	-176.6	-163.4	0	0	0	0	112.3	S337	V335-S337 PolarHBondContact O-N 3.44Å
336	S	42	Very low	63	Low	75 Å²	75	82.9 Å²	82.9	52%	0.524	49%	0.493	S	S	.	.			trans	-76.6	96.5	177.6	57.4	0	0	0	0	110.7	N334	N334-S336 PolarHBondContact O-N 3.09Å
337	S	40.5	Very low	63.3	Low	90 Å²	90	78 Å²	78	63%	0.629	47%	0.47	S	S	*	.			trans	44.2	137.2	159.1	57.4	0	0	0	0	119.3	V335	V335-S337 PolarHBondContact O-N 3.44Å
338	P	42.7	Very low	63.5	Low	108 Å²	108	77.8 Å²	77.8	70%	0.701	47%	0.47	S	S	*	.	S	Bend	trans	-55.6	154.2	174.3	26.6	-34.5	0	0	0	111.2	R340	P338-R340 PolarHBondContact O-N 3.48Å
339	P	46.2	Very low	64	Low	106 Å²	106	79.3 Å²	79.3	69%	0.688	48%	0.477	S	S	*	.			trans	-59.6	97.5	-177.2	25.2	-33.4	0	0	0	109.6	S341	P339-S341 PolarHBondContact O-N 3.44Å
340	R	47.4	Very low	64.8	Low	214 Å²	214	81 Å²	81	81%	0.808	48%	0.479	S	S	*	.			trans	-54.5	126.9	158.2	-73.7	-179.3	174.9	174.5	-0.7	104.9	P338 S342	P338-R340 PolarHBondContact O-N 3.48Å; R340-S342 VanDerWaalsContact O-CA 3.25Å; R340-S342 WeakPolarHBondContact O-CA 3.44Å; R340-S342 PolarHBondContact O-N 3.05Å
341	S	54.3	Low	66.4	Low	71 Å²	71	75.2 Å²	75.2	50%	0.497	44%	0.444	S	S	.	.	S	Bend	trans	-29.3	103.6	176.3	35.9	0	0	0	0	110.1	P339 D343 K346	P339-S341 PolarHBondContact O-N 3.44Å; S341-D343 PolarHBondContact O-N 3.12Å; S341-K346 WeakPolarHBondContact O-CE 3.32Å; S341-K346 PolarHBondContact O-NZ 2.96Å; S341-K346 WeakPolarHBondContact OG-CE 3.22Å; S341-K346 PolarHBondContact OG-NZ 3.13Å
342	S	68.4	Low	68.3	Low	18 Å²	18	70.3 Å²	70.3	13%	0.126	41%	0.414	C	S	.	.			trans	-58.4	138.9	-158.7	73.3	0	0	0	0	109.6	R340 L344 V345 K346	R340-S342 VanDerWaalsContact O-CA 3.25Å; R340-S342 WeakPolarHBondContact O-CA 3.44Å; R340-S342 PolarHBondContact O-N 3.05Å; S342-L344 CarbonylContact O-C 3.34Å; S342-L344 PolarHBondContact O-N 3.01Å; S342-V345 PolarHBondContact O-N 2.82Å; S342-V345 VanDerWaalsContact OG-CG2 3.32Å; S342-V345 WeakPolarHBondContact OG-CG2 3.35Å; S342-V345 PolarHBondContact OG-N 3.01Å; S342-K346 PolarHBondContact O-N 3.01Å
343	D	81.8	Confident	70.8	Confident	49 Å²	49	69.4 Å²	69.4	26%	0.262	40%	0.395	S	S	.	.	H	α-helix	trans	-54	-27	-175	-67.5	-39.3	0	0	0	112.7	C296 S341 L347	C296-D343 HydrophobicContact CB-CB 4.11Å; S341-D343 PolarHBondContact O-N 3.12Å; D343-L347 WeakPolarHBondContact O-CB 3.29Å; D343-L347 PolarHBondContact O-N 3.03Å
344	L	90.6	Very high	73	Confident	5 Å²	5	67.5 Å²	67.5	3%	0.026	37%	0.365	C	S	.	.	H	α-helix	trans	-62.3	-46.7	170.8	-178.9	60.4	0	0	0	113.7	I292 L315 I324 Y327 S342 A348 V366 I370	I292-L344 HydrophobicContact CG2-CD2 4.22Å; L315-L344 HydrophobicContact CB-CD1 4.46Å; L315-L344 HydrophobicContact CD1-CD1 4.09Å; L315-L344 HydrophobicContact CD2-CD1 4.03Å; L315-L344 HydrophobicContact CG-CD1 4.43Å; I324-L344 HydrophobicContact CD1-CD2 3.51Å; Y327-L344 HydrophobicContact CD1-CD2 4.27Å; Y327-L344 HydrophobicContact CE1-CB 4.1Å; Y327-L344 HydrophobicContact CE1-CD2 4.17Å; S342-L344 CarbonylContact O-C 3.34Å; S342-L344 PolarHBondContact O-N 3.01Å; L344-A348 VanDerWaalsContact O-CB 3.29Å; L344-A348 WeakPolarHBondContact O-CB 3.22Å; L344-A348 PolarHBondContact O-N 3.27Å; L344-V366 HydrophobicContact CD1-CG1 3.95Å; L344-V366 HydrophobicContact CG-CG1 4.27Å; L344-I370 HydrophobicContact CD2-CD1 4.24Å; L344-I370 HydrophobicContact CG-CD1 4.25Å
345	V	90	Very high	75.2	Confident	21 Å²	21	69.1 Å²	69.1	13%	0.127	37%	0.373	C	S	.	.	H	α-helix	trans	-65.5	-46.5	178.4	171.9	0	0	0	0	109.9	F328 S342 L347 A348 Q349 I370 L382	F328-V345 HydrophobicContact CE1-CG2 4.48Å; F328-V345 HydrophobicContact CZ-CG2 3.96Å; S342-V345 PolarHBondContact O-N 2.82Å; S342-V345 VanDerWaalsContact OG-CG2 3.32Å; S342-V345 WeakPolarHBondContact OG-CG2 3.35Å; S342-V345 PolarHBondContact OG-N 3.01Å; V345-L347 PolarHBondContact O-N 3.17Å; V345-A348 PolarHBondContact O-N 3.11Å; V345-Q349 HydrophobicContact CG1-CG 4.39Å; V345-Q349 WeakPolarHBondContact O-CG 3.38Å; V345-Q349 PolarHBondContact O-N 3.2Å; V345-I370 HydrophobicContact CG2-CD1 4.07Å; V345-L382 HydrophobicContact CG1-CD1 3.78Å
346	K	88.8	Confident	77.8	Confident	86 Å²	86	64.9 Å²	64.9	37%	0.374	35%	0.346	S	S	.	.	H	α-helix	trans	-59.1	-47.2	176.8	-69.5	178.8	-177.4	158.3	0	112.4	S341 S342 A348 Q349 E350	S341-K346 WeakPolarHBondContact O-CE 3.32Å; S341-K346 PolarHBondContact O-NZ 2.96Å; S341-K346 WeakPolarHBondContact OG-CE 3.22Å; S341-K346 PolarHBondContact OG-NZ 3.13Å; S342-K346 PolarHBondContact O-N 3.01Å; K346-A348 VanDerWaalsContact C-N 3.3Å; K346-A348 PolarHBondContact O-N 2.95Å; K346-Q349 PolarHBondContact O-N 3.26Å; K346-E350 PolarHBondContact O-N 3.44Å
347	L	93.9	Very high	80.3	Confident	1 Å²	1	65 Å²	65	1%	0.005	34%	0.335	C	S	.	.	H	α-helix	trans	-60.6	-42.6	176.9	174.3	65.9	0	0	0	110.9	C296 A299 L300 L312 L315 D343 V345 E350 C351	C296-L347 HydrophobicContact CB-CD2 4.11Å; A299-L347 HydrophobicContact CB-CD1 4.13Å; A299-L347 HydrophobicContact CB-CD2 3.75Å; L300-L347 HydrophobicContact CD2-CB 4.19Å; L300-L347 HydrophobicContact CD2-CD1 3.65Å; L300-L347 HydrophobicContact CG-CB 4.4Å; L300-L347 HydrophobicContact CG-CD1 3.93Å; L312-L347 HydrophobicContact CD2-CD2 4.14Å; L312-L347 HydrophobicContact CD2-CG 4.18Å; L315-L347 HydrophobicContact CD1-CD2 3.69Å; D343-L347 WeakPolarHBondContact O-CB 3.29Å; D343-L347 PolarHBondContact O-N 3.03Å; V345-L347 PolarHBondContact O-N 3.17Å; L347-E350 PolarHBondContact O-N 3.25Å; L347-C351 VanDerWaalsContact CD1-SG 3.58Å; L347-C351 WeakPolarHBondContact O-CB 3.49Å; L347-C351 PolarHBondContact O-N 3.4Å; L347-C351 PolarHBondContact O-SG 2.94Å
348	A	94.2	Very high	82.9	Confident	2 Å²	2	61.5 Å²	61.5	2%	0.017	31%	0.313	C	S	.	.	H	α-helix	trans	-66.2	-38.7	179.2	0	0	0	0	0	112.3	L344 V345 K346 C351 C352 V366 L367	L344-A348 VanDerWaalsContact O-CB 3.29Å; L344-A348 WeakPolarHBondContact O-CB 3.22Å; L344-A348 PolarHBondContact O-N 3.27Å; V345-A348 PolarHBondContact O-N 3.11Å; K346-A348 VanDerWaalsContact C-N 3.3Å; K346-A348 PolarHBondContact O-N 2.95Å; A348-C351 PolarHBondContact O-N 3.43Å; A348-C352 WeakPolarHBondContact O-CB 3.44Å; A348-C352 PolarHBondContact O-N 3.4Å; A348-V366 HydrophobicContact CB-CB 4.21Å; A348-V366 HydrophobicContact CB-CG1 3.88Å; A348-L367 HydrophobicContact CB-CD2 3.57Å; A348-L367 HydrophobicContact CB-CG 3.84Å
349	Q	92.6	Very high	85.5	Confident	63 Å²	63	56.4 Å²	56.4	29%	0.294	28%	0.279	S	S	.	.	H	α-helix	trans	-66.5	-39.6	173.5	-72.4	173.1	-42.9	0	0	112.7	V345 K346 C352 L367 D385	V345-Q349 HydrophobicContact CG1-CG 4.39Å; V345-Q349 WeakPolarHBondContact O-CG 3.38Å; V345-Q349 PolarHBondContact O-N 3.2Å; K346-Q349 PolarHBondContact O-N 3.26Å; Q349-C352 PolarHBondContact O-SG 2.93Å; Q349-L367 HydrophobicContact CG-CD2 4.14Å; Q349-D385 PolarHBondContact NE2-OD2 2.79Å
350	E	92.5	Very high	87.9	Confident	87 Å²	87	51.4 Å²	51.4	41%	0.407	25%	0.247	S	C	.	.	H	α-helix	trans	-66	-44.5	173.9	-177.6	-107.6	156.6	0	0	111.1	K308 K346 L347	K308-E350 IonicContact NZ-OE1 2.87Å; K308-E350 PolarHBondContact NZ-OE1 3.35Å; K308-E350 IonicContact NZ-OE2 2.75Å; K308-E350 PolarHBondContact NZ-OE2 3.07Å; K346-E350 PolarHBondContact O-N 3.44Å; L347-E350 PolarHBondContact O-N 3.25Å
351	C	95.1	Very high	90.3	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-77.2	-25.4	-173.8	-71.5	0	0	0	0	113.7	L312 L347 A348 Y353 H354 I359 A360	L312-C351 HydrophobicContact CD1-CB 3.84Å; L312-C351 HydrophobicContact CD2-CB 4.38Å; L347-C351 VanDerWaalsContact CD1-SG 3.58Å; L347-C351 WeakPolarHBondContact O-CB 3.49Å; L347-C351 PolarHBondContact O-N 3.4Å; L347-C351 PolarHBondContact O-SG 2.94Å; A348-C351 PolarHBondContact O-N 3.43Å; C351-Y353 PolarHBondContact O-N 2.91Å; C351-H354 VanDerWaalsContact O-CB 3.26Å; C351-H354 WeakPolarHBondContact O-CB 3.32Å; C351-H354 PolarHBondContact O-N 3.24Å; C351-H354 VanDerWaalsContact O-N 3.17Å; C351-I359 HydrophobicContact CB-CG2 3.84Å; C351-A360 VanDerWaalsContact O-CA 3.22Å; C351-A360 WeakPolarHBondContact O-CA 3.42Å; C351-A360 PolarHBondContact O-N 3.36Å
352	C	94.7	Very high	92.4	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-20.4	-176.4	66.8	0	0	0	0	113.7	A348 Q349 A360 V364 L367	A348-C352 WeakPolarHBondContact O-CB 3.44Å; A348-C352 PolarHBondContact O-N 3.4Å; Q349-C352 PolarHBondContact O-SG 2.93Å; C352-A360 WeakPolarHBondContact O-CB 3.35Å; C352-V364 HydrophobicContact CB-CB 4.44Å; C352-L367 HydrophobicContact CB-CD1 3.85Å
353	Y	94.6	Very high	93.7	Very high	110 Å²	110	38.2 Å²	38.2	43%	0.431	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	18.2	175.6	-57.1	-69	0	0	0	113.5	C351 F388	C351-Y353 PolarHBondContact O-N 2.91Å; Y353-F388 WeakPolarHBondContact OH-CB 3.26Å
354	H	95.5	Very high	94.4	Very high	37 Å²	37	35.9 Å²	35.9	17%	0.171	17%	0.172	C	C	.	.			trans	-70.7	144.5	-178.1	-167.1	-91.4	0	0	0	112.7	D305 C351 N356 I359	D305-H354 IonicContact OD1-CE1 3.13Å; D305-H354 IonicContact OD2-CE1 3.66Å; C351-H354 VanDerWaalsContact O-CB 3.26Å; C351-H354 WeakPolarHBondContact O-CB 3.32Å; C351-H354 PolarHBondContact O-N 3.24Å; C351-H354 VanDerWaalsContact O-N 3.17Å; H354-N356 WeakPolarHBondContact ND1-CB 3.33Å; H354-N356 PolarHBondContact ND1-N 3.03Å; H354-N356 PolarHBondContact O-N 3.43Å; H354-N356 VanDerWaalsContact O-N 3.12Å; H354-I359 HydrophobicContact CB-CB 4.14Å; H354-I359 HydrophobicContact CB-CG2 3.56Å
355	N	92.7	Very high	94.8	Very high	161 Å²	161	38.6 Å²	38.6	86%	0.861	18%	0.182	S	C	*	.	S	Bend	trans	-55.5	-33.6	178.9	-65	-26.8	0	0	0	113.4	R357	N355-R357 PolarHBondContact O-N 2.83Å
356	N	94.6	Very high	95.1	Very high	58 Å²	58	37.7 Å²	37.7	31%	0.31	18%	0.177	S	C	.	.	S	Bend	trans	-79.8	110.3	173.9	-166.6	-45	0	0	0	111.1	H354 G358 I359 A360	H354-N356 WeakPolarHBondContact ND1-CB 3.33Å; H354-N356 PolarHBondContact ND1-N 3.03Å; H354-N356 PolarHBondContact O-N 3.43Å; H354-N356 VanDerWaalsContact O-N 3.12Å; N356-G358 PolarHBondContact O-N 3.42Å; N356-G358 VanDerWaalsContact O-N 3.13Å; N356-G358 PolarHBondContact OD1-N 2.81Å; N356-G358 VanDerWaalsContact OD1-N 3.08Å; N356-I359 HydrophobicContact CB-CB 4.26Å; N356-I359 HydrophobicContact CB-CD1 4.01Å; N356-I359 HydrophobicContact CB-CG1 4.14Å; N356-I359 WeakPolarHBondContact O-CB 3.21Å; N356-I359 PolarHBondContact O-N 3.48Å; N356-A360 PolarHBondContact O-N 2.99Å; N356-A360 VanDerWaalsContact O-N 3.09Å
357	R	94.8	Very high	95.3	Very high	79 Å²	79	33.6 Å²	33.6	30%	0.298	16%	0.159	S	C	.	.	H	α-helix	trans	-51.1	-37.4	179.9	-64.4	171.4	-68.4	177.6	-3.7	114.5	N355 A360 A361 D400 T408	N355-R357 PolarHBondContact O-N 2.83Å; R357-A360 PolarHBondContact O-N 2.92Å; R357-A361 WeakPolarHBondContact O-CB 3.38Å; R357-A361 PolarHBondContact O-N 3.32Å; R357-D400 IonicContact CZ-OD2 3.98Å; R357-D400 IonicContact NH1-OD2 3.58Å; R357-D400 PolarHBondContact NH1-OD2 3.38Å; R357-D400 IonicContact NH2-OD2 3.31Å; R357-T408 HydrophobicContact CB-CG2 4.02Å; R357-T408 WeakPolarHBondContact O-CG2 3.23Å
358	G	95.4	Very high	95.4	Very high	16 Å²	16	33.5 Å²	33.5	17%	0.165	16%	0.159	C	C	.	.	H	α-helix	trans	-66.5	-38.6	178.4	0	0	0	0	0	112.5	L309 N356 H362	L309-G358 WeakPolarHBondContact CD1-O 3.43Å; N356-G358 PolarHBondContact O-N 3.42Å; N356-G358 VanDerWaalsContact O-N 3.13Å; N356-G358 PolarHBondContact OD1-N 2.81Å; N356-G358 VanDerWaalsContact OD1-N 3.08Å; G358-H362 PolarHBondContact O-CD2 3.49Å; G358-H362 VanDerWaalsContact O-CD2 3.24Å; G358-H362 PolarHBondContact O-N 3.24Å; G358-H362 VanDerWaalsContact O-N 3.12Å
359	I	97.1	Very high	95.4	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-66.6	-47.7	176.7	-68.8	179.7	0	0	0	109.1	D305 K308 L309 L312 C351 H354 N356 A361 H362 G363	D305-I359 HydrophobicContact CB-CD1 4.03Å; K308-I359 HydrophobicContact CB-CD1 4.26Å; K308-I359 HydrophobicContact CD-CD1 4.28Å; K308-I359 HydrophobicContact CD-CG2 4.44Å; K308-I359 HydrophobicContact CG-CD1 4.34Å; L309-I359 HydrophobicContact CB-CD1 4.39Å; L309-I359 HydrophobicContact CB-CG1 3.83Å; L309-I359 HydrophobicContact CD1-CG1 4.08Å; L312-I359 HydrophobicContact CD1-CB 4.26Å; L312-I359 HydrophobicContact CD1-CG1 4.48Å; L312-I359 HydrophobicContact CD1-CG2 3.57Å; C351-I359 HydrophobicContact CB-CG2 3.84Å; H354-I359 HydrophobicContact CB-CB 4.14Å; H354-I359 HydrophobicContact CB-CG2 3.56Å; N356-I359 HydrophobicContact CB-CB 4.26Å; N356-I359 HydrophobicContact CB-CD1 4.01Å; N356-I359 HydrophobicContact CB-CG1 4.14Å; N356-I359 WeakPolarHBondContact O-CB 3.21Å; N356-I359 PolarHBondContact O-N 3.48Å; I359-A361 PolarHBondContact O-N 3.49Å; I359-H362 PolarHBondContact O-N 2.93Å; I359-G363 PolarHBondContact O-N 2.89Å
360	A	97.2	Very high	95.4	Very high	2 Å²	2	31.1 Å²	31.1	2%	0.017	15%	0.147	C	C	.	.	H	α-helix	trans	-57.6	-45.3	175.3	0	0	0	0	0	112.9	C351 C352 N356 R357 H362 G363 V364 L393	C351-A360 VanDerWaalsContact O-CA 3.22Å; C351-A360 WeakPolarHBondContact O-CA 3.42Å; C351-A360 PolarHBondContact O-N 3.36Å; C352-A360 WeakPolarHBondContact O-CB 3.35Å; N356-A360 PolarHBondContact O-N 2.99Å; N356-A360 VanDerWaalsContact O-N 3.09Å; R357-A360 PolarHBondContact O-N 2.92Å; A360-H362 PolarHBondContact O-N 3.45Å; A360-G363 PolarHBondContact O-N 3.17Å; A360-V364 PolarHBondContact O-N 3.38Å; A360-L393 HydrophobicContact CB-CD2 3.63Å; A360-L393 HydrophobicContact CB-CG 4.34Å
361	A	97.2	Very high	95.4	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-60.3	-40.6	175.3	0	0	0	0	0	114	R357 I359 V364 R365 L393 T408 I411	R357-A361 WeakPolarHBondContact O-CB 3.38Å; R357-A361 PolarHBondContact O-N 3.32Å; I359-A361 PolarHBondContact O-N 3.49Å; A361-V364 WeakPolarHBondContact O-CG1 3.37Å; A361-R365 WeakPolarHBondContact O-CB 3.35Å; A361-R365 PolarHBondContact O-N 2.74Å; A361-L393 VanDerWaalsContact CA-CD1 3.5Å; A361-L393 HydrophobicContact CB-CD1 4.05Å; A361-T408 HydrophobicContact CB-CG2 3.6Å; A361-I411 HydrophobicContact CB-CB 4.25Å; A361-I411 HydrophobicContact CB-CD1 4.2Å; A361-I411 HydrophobicContact CB-CG2 3.89Å
362	H	97.8	Very high	95.2	Very high	25 Å²	25	28.6 Å²	28.6	12%	0.116	14%	0.138	C	C	.	.	H	α-helix	trans	-74.1	-36.6	176.5	-79.1	-72.3	0	0	0	112.3	L312 S316 G358 I359 A360 R365 V366	L312-H362 HydrophobicContact CB-CB 3.76Å; S316-H362 WeakPolarHBondContact CB-ND1 3.34Å; S316-H362 PolarHBondContact OG-CE1 2.89Å; S316-H362 PolarHBondContact OG-ND1 2.54Å; G358-H362 PolarHBondContact O-CD2 3.49Å; G358-H362 VanDerWaalsContact O-CD2 3.24Å; G358-H362 PolarHBondContact O-N 3.24Å; G358-H362 VanDerWaalsContact O-N 3.12Å; I359-H362 PolarHBondContact O-N 2.93Å; A360-H362 PolarHBondContact O-N 3.45Å; H362-R365 PolarHBondContact O-N 3.23Å; H362-V366 WeakPolarHBondContact O-CG2 3.48Å; H362-V366 PolarHBondContact O-N 3.07Å
363	G	96.9	Very high	94.9	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-58.3	-54.4	173.4	0	0	0	0	0	111.4	I359 A360 R365 V366 L367	I359-G363 PolarHBondContact O-N 2.89Å; A360-G363 PolarHBondContact O-N 3.17Å; G363-R365 VanDerWaalsContact C-N 3.32Å; G363-R365 PolarHBondContact O-N 3Å; G363-V366 WeakPolarHBondContact O-CB 3.43Å; G363-V366 PolarHBondContact O-N 3.1Å; G363-V366 VanDerWaalsContact O-N 3.11Å; G363-L367 PolarHBondContact O-N 2.84Å
364	V	96.9	Very high	94.3	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-64	-36.4	178.8	81.7	0	0	0	0	112.5	C352 A360 A361 V366 L367 T368 L390 L393	C352-V364 HydrophobicContact CB-CB 4.44Å; A360-V364 PolarHBondContact O-N 3.38Å; A361-V364 WeakPolarHBondContact O-CG1 3.37Å; V364-V366 VanDerWaalsContact C-N 3.3Å; V364-V366 PolarHBondContact O-N 3.48Å; V364-L367 WeakPolarHBondContact O-CB 3.31Å; V364-L367 PolarHBondContact O-N 2.76Å; V364-T368 PolarHBondContact O-N 2.89Å; V364-T368 PolarHBondContact O-OG1 3.33Å; V364-L390 HydrophobicContact CB-CD2 4.5Å; V364-L390 HydrophobicContact CG1-CD2 3.91Å; V364-L390 HydrophobicContact CG2-CB 4.45Å; V364-L390 HydrophobicContact CG2-CD2 3.71Å; V364-L390 HydrophobicContact CG2-CG 3.59Å; V364-L393 HydrophobicContact CB-CD1 4.36Å; V364-L393 HydrophobicContact CG1-CD1 3.49Å; V364-L393 VanDerWaalsContact CG1-CD1 3.49Å
365	R	97.9	Very high	93	Very high	63 Å²	63	30.8 Å²	30.8	24%	0.238	16%	0.157	C	C	.	.	H	α-helix	trans	-60.9	-40.4	174.6	172.6	174	-75.4	-179.3	-6.1	111.7	A361 H362 G363 N369 I411	A361-R365 WeakPolarHBondContact O-CB 3.35Å; A361-R365 PolarHBondContact O-N 2.74Å; H362-R365 PolarHBondContact O-N 3.23Å; G363-R365 VanDerWaalsContact C-N 3.32Å; G363-R365 PolarHBondContact O-N 3Å; R365-N369 WeakPolarHBondContact O-CB 3.39Å; R365-N369 PolarHBondContact O-N 3.03Å; R365-N369 PolarHBondContact O-ND2 3.25Å; R365-I411 HydrophobicContact CB-CG2 4.35Å
366	V	96.3	Very high	91.7	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.006	14%	0.135	C	C	.	.	H	α-helix	trans	-64.1	-47.2	174.8	171.1	0	0	0	0	110	L315 L344 A348 H362 G363 V364 T368 N369 I370	L315-V366 HydrophobicContact CB-CG2 4.32Å; L344-V366 HydrophobicContact CD1-CG1 3.95Å; L344-V366 HydrophobicContact CG-CG1 4.27Å; A348-V366 HydrophobicContact CB-CB 4.21Å; A348-V366 HydrophobicContact CB-CG1 3.88Å; H362-V366 WeakPolarHBondContact O-CG2 3.48Å; H362-V366 PolarHBondContact O-N 3.07Å; G363-V366 WeakPolarHBondContact O-CB 3.43Å; G363-V366 PolarHBondContact O-N 3.1Å; G363-V366 VanDerWaalsContact O-N 3.11Å; V364-V366 VanDerWaalsContact C-N 3.3Å; V364-V366 PolarHBondContact O-N 3.48Å; V366-T368 PolarHBondContact O-N 2.78Å; V366-N369 PolarHBondContact O-N 3.08Å; V366-I370 HydrophobicContact CG1-CD1 3.77Å; V366-I370 HydrophobicContact CG1-CG1 4.41Å; V366-I370 VanDerWaalsContact O-CG1 3.3Å; V366-I370 WeakPolarHBondContact O-CG1 3.38Å; V366-I370 PolarHBondContact O-N 3.43Å
367	L	94.4	Very high	90	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-55.6	-53.5	175.8	-65.6	175.6	0	0	0	111.3	A348 Q349 C352 G363 V364 N369 I370 T371 L382 A386	A348-L367 HydrophobicContact CB-CD2 3.57Å; A348-L367 HydrophobicContact CB-CG 3.84Å; Q349-L367 HydrophobicContact CG-CD2 4.14Å; C352-L367 HydrophobicContact CB-CD1 3.85Å; G363-L367 PolarHBondContact O-N 2.84Å; V364-L367 WeakPolarHBondContact O-CB 3.31Å; V364-L367 PolarHBondContact O-N 2.76Å; L367-N369 VanDerWaalsContact C-N 3.29Å; L367-N369 PolarHBondContact O-N 3.29Å; L367-I370 PolarHBondContact O-N 3.34Å; L367-I370 VanDerWaalsContact O-N 3.1Å; L367-T371 PolarHBondContact O-N 2.9Å; L367-T371 PolarHBondContact O-OG1 3.03Å; L367-L382 HydrophobicContact CD2-CD1 3.61Å; L367-A386 HydrophobicContact CB-CB 4.18Å
368	T	95.4	Very high	88.5	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-55.2	-43.9	177.1	-57.1	0	0	0	0	112.2	V364 V366 I370 T371 V372 C415 L419	V364-T368 PolarHBondContact O-N 2.89Å; V364-T368 PolarHBondContact O-OG1 3.33Å; V366-T368 PolarHBondContact O-N 2.78Å; T368-I370 PolarHBondContact O-N 2.95Å; T368-T371 PolarHBondContact O-N 3.41Å; T368-V372 HydrophobicContact CG2-CG2 4.35Å; T368-V372 WeakPolarHBondContact O-CB 3.48Å; T368-V372 VanDerWaalsContact O-CG2 3.29Å; T368-V372 WeakPolarHBondContact O-CG2 3.36Å; T368-V372 PolarHBondContact O-N 2.79Å; T368-C415 HydrophobicContact CG2-CB 3.96Å; T368-C415 WeakPolarHBondContact CG2-O 3.36Å; T368-L419 HydrophobicContact CG2-CB 4.05Å
369	N	94.6	Very high	87.2	Confident	9 Å²	9	37.9 Å²	37.9	5%	0.048	18%	0.184	C	C	.	.	H	α-helix	trans	-64.6	-39.4	179.2	-77.7	-18.1	0	0	0	112.4	S319 G320 R365 V366 L367 S373 K418	S319-N369 WeakPolarHBondContact O-CB 3.4Å; S319-N369 PolarHBondContact OG-ND2 2.86Å; G320-N369 PolarHBondContact N-ND2 3.26Å; R365-N369 WeakPolarHBondContact O-CB 3.39Å; R365-N369 PolarHBondContact O-N 3.03Å; R365-N369 PolarHBondContact O-ND2 3.25Å; V366-N369 PolarHBondContact O-N 3.08Å; L367-N369 VanDerWaalsContact C-N 3.29Å; L367-N369 PolarHBondContact O-N 3.29Å; N369-S373 WeakPolarHBondContact O-CB 3.45Å; N369-S373 PolarHBondContact O-N 2.9Å; N369-S373 PolarHBondContact O-OG 3.21Å; N369-K418 PolarHBondContact OD1-NZ 2.9Å
370	I	92.1	Very high	86.2	Confident	5 Å²	5	44.1 Å²	44.1	3%	0.026	22%	0.217	C	C	.	.	H	α-helix	trans	-64.7	-52.1	175.6	-65.8	167.8	0	0	0	109.6	I324 F328 L344 V345 V366 L367 T368 V372 S373 C374 L382	I324-I370 HydrophobicContact CD1-CD1 4.44Å; I324-I370 HydrophobicContact CD1-CG1 3.87Å; I324-I370 HydrophobicContact CG1-CG1 3.95Å; F328-I370 HydrophobicContact CE2-CD1 4.49Å; F328-I370 HydrophobicContact CE2-CG1 4.27Å; F328-I370 HydrophobicContact CE2-CG2 3.97Å; F328-I370 HydrophobicContact CZ-CG2 4.13Å; L344-I370 HydrophobicContact CD2-CD1 4.24Å; L344-I370 HydrophobicContact CG-CD1 4.25Å; V345-I370 HydrophobicContact CG2-CD1 4.07Å; V366-I370 HydrophobicContact CG1-CD1 3.77Å; V366-I370 HydrophobicContact CG1-CG1 4.41Å; V366-I370 VanDerWaalsContact O-CG1 3.3Å; V366-I370 WeakPolarHBondContact O-CG1 3.38Å; V366-I370 PolarHBondContact O-N 3.43Å; L367-I370 PolarHBondContact O-N 3.34Å; L367-I370 VanDerWaalsContact O-N 3.1Å; T368-I370 PolarHBondContact O-N 2.95Å; I370-V372 VanDerWaalsContact C-N 3.3Å; I370-V372 PolarHBondContact O-N 3.29Å; I370-S373 PolarHBondContact O-N 2.82Å; I370-S373 VanDerWaalsContact O-N 3.12Å; I370-C374 HydrophobicContact CG2-CB 4.4Å; I370-C374 WeakPolarHBondContact O-CB 3.48Å; I370-C374 PolarHBondContact O-N 2.9Å; I370-L382 HydrophobicContact CB-CD2 4.15Å; I370-L382 HydrophobicContact CG2-CD2 3.53Å
371	T	91.4	Very high	85.6	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-55.9	-41	-179.1	-58.7	0	0	0	0	113.1	L367 T368 E383 L419 R423	L367-T371 PolarHBondContact O-N 2.9Å; L367-T371 PolarHBondContact O-OG1 3.03Å; T368-T371 PolarHBondContact O-N 3.41Å; T371-E383 HydrophobicContact CG2-CB 4.42Å; T371-E383 HydrophobicContact CG2-CG 3.41Å; T371-E383 VanDerWaalsContact CG2-CG 3.41Å; T371-L419 HydrophobicContact CG2-CD1 3.74Å; T371-R423 HydrophobicContact CG2-CG 4.41Å; T371-R423 PolarHBondContact O-NE 3.03Å; T371-R423 VanDerWaalsContact O-NE 3.11Å; T371-R423 PolarHBondContact O-NH2 2.69Å
372	V	91.1	Very high	85	Confident	35 Å²	35	47.8 Å²	47.8	21%	0.212	24%	0.244	C	C	.	.	H	α-helix	trans	-77.2	-32.6	179.4	172.7	0	0	0	0	112.2	T368 I370 K418 L419	T368-V372 HydrophobicContact CG2-CG2 4.35Å; T368-V372 WeakPolarHBondContact O-CB 3.48Å; T368-V372 VanDerWaalsContact O-CG2 3.29Å; T368-V372 WeakPolarHBondContact O-CG2 3.36Å; T368-V372 PolarHBondContact O-N 2.79Å; I370-V372 VanDerWaalsContact C-N 3.3Å; I370-V372 PolarHBondContact O-N 3.29Å; V372-K418 HydrophobicContact CG1-CG 4.46Å; V372-K418 HydrophobicContact CG2-CG 4.39Å; V372-L419 HydrophobicContact CG2-CD1 4.09Å
373	S	88.4	Confident	84.7	Confident	33 Å²	33	47 Å²	47	23%	0.231	24%	0.24	C	C	.	.	H	α-helix	trans	-97.2	-21.9	-170.1	-50.1	0	0	0	0	114.6	N369 I370	N369-S373 WeakPolarHBondContact O-CB 3.45Å; N369-S373 PolarHBondContact O-N 2.9Å; N369-S373 PolarHBondContact O-OG 3.21Å; I370-S373 PolarHBondContact O-N 2.82Å; I370-S373 VanDerWaalsContact O-N 3.12Å
374	C	82.2	Confident	84.4	Confident	8 Å²	8	52.1 Å²	52.1	5%	0.054	26%	0.264	C	S	.	.			trans	-114.5	149.3	-173.6	-51	0	0	0	0	110.8	F328 I370 R423	F328-C374 VanDerWaalsContact CD2-SG 3.5Å; I370-C374 HydrophobicContact CG2-CB 4.4Å; I370-C374 WeakPolarHBondContact O-CB 3.48Å; I370-C374 PolarHBondContact O-N 2.9Å; C374-R423 PolarHBondContact O-NH2 3.43Å
375	Q	69.3	Low	84.1	Confident	152 Å²	152	54 Å²	54	71%	0.71	28%	0.275	S	S	*	.			trans	-122.6	49.6	-176.9	-138.2	97	-17	0	0	110
376	E	65.1	Low	83.9	Confident	85 Å²	85	51 Å²	51	40%	0.397	26%	0.263	S	S	.	.			trans	-69.4	159.3	176.8	-67.4	-63.3	154.2	0	0	113.2	F328 D378 L379	F328-E376 HydrophobicContact CD1-CG 4.5Å; E376-D378 PolarHBondContact O-N 3.23Å; E376-L379 HydrophobicContact CB-CD1 3.83Å; E376-L379 VanDerWaalsContact O-CD1 3.25Å; E376-L379 WeakPolarHBondContact O-CD1 3.46Å
377	K	57.4	Low	83.8	Confident	209 Å²	209	51.5 Å²	51.5	91%	0.909	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-23.6	-178.4	-67.2	-169.2	177.1	-175.7	0	114.4
378	D	64.5	Low	83.8	Confident	143 Å²	143	55.8 Å²	55.8	77%	0.765	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	29.4	179.9	-62.5	-30.8	0	0	0	113.1	E376 L380	E376-D378 PolarHBondContact O-N 3.23Å; D378-L380 VanDerWaalsContact C-N 3.33Å; D378-L380 PolarHBondContact O-N 3.29Å
379	L	68.2	Low	83.7	Confident	25 Å²	25	55.8 Å²	55.8	13%	0.131	29%	0.285	C	S	.	.	H	α-helix	trans	-61.9	-34.1	-170.3	-129	74.4	0	0	0	114.4	E376 A381 L382 E383	E376-L379 HydrophobicContact CB-CD1 3.83Å; E376-L379 VanDerWaalsContact O-CD1 3.25Å; E376-L379 WeakPolarHBondContact O-CD1 3.46Å; L379-A381 PolarHBondContact O-N 3.38Å; L379-L382 PolarHBondContact O-N 2.93Å; L379-E383 WeakPolarHBondContact O-CG 3.37Å; L379-E383 PolarHBondContact O-N 3.22Å
380	L	76.6	Confident	83.7	Confident	132 Å²	132	55.5 Å²	55.5	69%	0.691	28%	0.283	S	S	*	.	H	α-helix	trans	-64.3	-40	-172.2	-68.3	176	0	0	0	113.1	D378 L382 E383 Q384	D378-L380 VanDerWaalsContact C-N 3.33Å; D378-L380 PolarHBondContact O-N 3.29Å; L380-L382 VanDerWaalsContact C-N 3.34Å; L380-E383 PolarHBondContact O-N 3.44Å; L380-Q384 PolarHBondContact O-N 2.87Å; L380-Q384 VanDerWaalsContact O-N 3.07Å
381	A	83.1	Confident	83.8	Confident	59 Å²	59	57.7 Å²	57.7	49%	0.488	29%	0.293	S	S	.	.	H	α-helix	trans	-67.1	-38.6	178	0	0	0	0	0	111.4	L379 Q384 D385	L379-A381 PolarHBondContact O-N 3.38Å; A381-Q384 PolarHBondContact O-N 3.22Å; A381-D385 PolarHBondContact O-N 3.39Å
382	L	86.3	Confident	83.9	Confident	19 Å²	19	59.7 Å²	59.7	10%	0.099	31%	0.307	C	S	.	.	H	α-helix	trans	-71.1	-35.1	178	-165.7	72.5	0	0	0	112.3	V345 L367 I370 L379 L380 A386	V345-L382 HydrophobicContact CG1-CD1 3.78Å; L367-L382 HydrophobicContact CD2-CD1 3.61Å; I370-L382 HydrophobicContact CB-CD2 4.15Å; I370-L382 HydrophobicContact CG2-CD2 3.53Å; L379-L382 PolarHBondContact O-N 2.93Å; L380-L382 VanDerWaalsContact C-N 3.34Å; L382-A386 WeakPolarHBondContact O-CB 3.4Å; L382-A386 PolarHBondContact O-N 3.23Å
383	E	90.6	Very high	84.1	Confident	9 Å²	9	58 Å²	58	4%	0.042	30%	0.297	C	S	.	.	H	α-helix	trans	-60	-47.4	171.7	-77.2	178.2	172.3	0	0	111	T371 L379 L380 A386 V387 R423 H425 L426	T371-E383 HydrophobicContact CG2-CB 4.42Å; T371-E383 HydrophobicContact CG2-CG 3.41Å; T371-E383 VanDerWaalsContact CG2-CG 3.41Å; L379-E383 WeakPolarHBondContact O-CG 3.37Å; L379-E383 PolarHBondContact O-N 3.22Å; L380-E383 PolarHBondContact O-N 3.44Å; E383-A386 PolarHBondContact O-N 3.22Å; E383-V387 WeakPolarHBondContact O-CG2 3.14Å; E383-V387 PolarHBondContact O-N 2.85Å; E383-R423 IonicContact OE1-NE 3.43Å; E383-H425 IonicContact OE1-CE1 2.66Å; E383-H425 PolarHBondContact OE1-CE1 3Å; E383-H425 IonicContact OE1-NE2 3.11Å; E383-H425 IonicContact OE2-CD2 3.49Å; E383-H425 IonicContact OE2-CE1 3.36Å; E383-H425 PolarHBondContact OE2-CE1 2.79Å; E383-H425 IonicContact OE2-NE2 3.57Å; E383-H425 PolarHBondContact OE2-NE2 2.91Å; E383-L426 HydrophobicContact CB-CD1 4Å; E383-L426 HydrophobicContact CB-CD2 4.49Å; E383-L426 HydrophobicContact CG-CD1 3.92Å
384	Q	90.7	Very high	84.4	Confident	108 Å²	108	56.5 Å²	56.5	51%	0.505	29%	0.286	S	S	.	.	H	α-helix	trans	-61.1	-47.4	177.9	-173.5	178.5	16	0	0	111.9	L380 A381 A386 V387 F388	L380-Q384 PolarHBondContact O-N 2.87Å; L380-Q384 VanDerWaalsContact O-N 3.07Å; A381-Q384 PolarHBondContact O-N 3.22Å; Q384-A386 VanDerWaalsContact C-N 3.31Å; Q384-A386 PolarHBondContact O-N 2.97Å; Q384-V387 PolarHBondContact O-N 2.99Å; Q384-F388 HydrophobicContact CG-CD2 3.67Å; Q384-F388 HydrophobicContact CG-CE2 3.24Å; Q384-F388 HydrophobicContact CG-CZ 3.85Å; Q384-F388 WeakPolarHBondContact O-CD2 3.33Å; Q384-F388 WeakPolarHBondContact O-CG 3.38Å; Q384-F388 PolarHBondContact O-N 2.82Å
385	D	91.1	Very high	84.8	Confident	40 Å²	40	60.2 Å²	60.2	21%	0.214	31%	0.308	C	S	.	.	H	α-helix	trans	-61.3	-38.4	175.7	-85	-18.2	0	0	0	112.7	Q349 A381 G389	Q349-D385 PolarHBondContact NE2-OD2 2.79Å; A381-D385 PolarHBondContact O-N 3.39Å; D385-G389 PolarHBondContact O-N 3.11Å
386	A	92.8	Very high	85.9	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-65.3	-43.9	177	0	0	0	0	0	111.1	L367 L382 E383 Q384 L390	L367-A386 HydrophobicContact CB-CB 4.18Å; L382-A386 WeakPolarHBondContact O-CB 3.4Å; L382-A386 PolarHBondContact O-N 3.23Å; E383-A386 PolarHBondContact O-N 3.22Å; Q384-A386 VanDerWaalsContact C-N 3.31Å; Q384-A386 PolarHBondContact O-N 2.97Å; A386-L390 WeakPolarHBondContact O-CB 3.33Å; A386-L390 WeakPolarHBondContact O-CD1 3.48Å; A386-L390 WeakPolarHBondContact O-CG 3.48Å; A386-L390 PolarHBondContact O-N 2.78Å; A386-L390 VanDerWaalsContact O-N 3.14Å
387	V	94.1	Very high	87.3	Confident	10 Å²	10	53.4 Å²	53.4	6%	0.061	28%	0.279	C	S	.	.	H	α-helix	trans	-62.4	-56.5	176.4	173.9	0	0	0	0	109.8	E383 Q384 G389 L390 E391 L419 L426	E383-V387 WeakPolarHBondContact O-CG2 3.14Å; E383-V387 PolarHBondContact O-N 2.85Å; Q384-V387 PolarHBondContact O-N 2.99Å; V387-G389 VanDerWaalsContact C-N 3.32Å; V387-G389 PolarHBondContact O-N 2.86Å; V387-L390 WeakPolarHBondContact O-CA 3.47Å; V387-L390 VanDerWaalsContact O-CB 3.27Å; V387-L390 WeakPolarHBondContact O-CB 3.44Å; V387-L390 PolarHBondContact O-N 2.76Å; V387-E391 HydrophobicContact CG1-CG 4.28Å; V387-E391 VanDerWaalsContact O-CG 3.26Å; V387-E391 WeakPolarHBondContact O-CG 3.47Å; V387-E391 PolarHBondContact O-N 2.94Å; V387-L419 HydrophobicContact CG2-CD2 4.04Å; V387-L426 HydrophobicContact CG2-CD1 4.47Å
388	F	94.1	Very high	88.9	Confident	90 Å²	90	43.4 Å²	43.4	40%	0.395	24%	0.236	S	C	.	.	H	α-helix	trans	-59.5	-38.2	-178.6	-67.5	-34.3	0	0	0	114	Y353 Q384 L390 E391 S392	Y353-F388 WeakPolarHBondContact OH-CB 3.26Å; Q384-F388 HydrophobicContact CG-CD2 3.67Å; Q384-F388 HydrophobicContact CG-CE2 3.24Å; Q384-F388 HydrophobicContact CG-CZ 3.85Å; Q384-F388 WeakPolarHBondContact O-CD2 3.33Å; Q384-F388 WeakPolarHBondContact O-CG 3.38Å; Q384-F388 PolarHBondContact O-N 2.82Å; F388-L390 VanDerWaalsContact C-N 3.28Å; F388-L390 PolarHBondContact O-N 2.9Å; F388-E391 PolarHBondContact O-N 2.9Å; F388-S392 PolarHBondContact O-N 2.84Å
389	G	94.3	Very high	90.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.3	-35.9	173.1	0	0	0	0	0	112.7	D385 V387 L393	D385-G389 PolarHBondContact O-N 3.11Å; V387-G389 VanDerWaalsContact C-N 3.32Å; V387-G389 PolarHBondContact O-N 2.86Å; G389-L393 PolarHBondContact O-N 2.78Å
390	L	95.2	Very high	91.2	Very high	3 Å²	3	44.5 Å²	44.5	2%	0.016	24%	0.237	C	C	.	.	H	α-helix	trans	-69	-41.7	175	-72.7	168.7	0	0	0	111.2	V364 A386 V387 F388 L393 L394 A412 C415 M416 L419	V364-L390 HydrophobicContact CB-CD2 4.5Å; V364-L390 HydrophobicContact CG1-CD2 3.91Å; V364-L390 HydrophobicContact CG2-CB 4.45Å; V364-L390 HydrophobicContact CG2-CD2 3.71Å; V364-L390 HydrophobicContact CG2-CG 3.59Å; A386-L390 WeakPolarHBondContact O-CB 3.33Å; A386-L390 WeakPolarHBondContact O-CD1 3.48Å; A386-L390 WeakPolarHBondContact O-CG 3.48Å; A386-L390 PolarHBondContact O-N 2.78Å; A386-L390 VanDerWaalsContact O-N 3.14Å; V387-L390 WeakPolarHBondContact O-CA 3.47Å; V387-L390 VanDerWaalsContact O-CB 3.27Å; V387-L390 WeakPolarHBondContact O-CB 3.44Å; V387-L390 PolarHBondContact O-N 2.76Å; F388-L390 VanDerWaalsContact C-N 3.28Å; F388-L390 PolarHBondContact O-N 2.9Å; L390-L393 PolarHBondContact O-N 3.03Å; L390-L394 WeakPolarHBondContact O-CG 3.42Å; L390-L394 PolarHBondContact O-N 2.96Å; L390-A412 HydrophobicContact CD2-CB 4.07Å; L390-A412 WeakPolarHBondContact CD2-O 3.38Å; L390-C415 HydrophobicContact CD2-CB 3.82Å; L390-M416 HydrophobicContact CB-CE 3.62Å; L390-M416 HydrophobicContact CB-CG 4.24Å; L390-M416 HydrophobicContact CD1-CG 3.74Å; L390-M416 HydrophobicContact CD2-CE 4.12Å; L390-M416 HydrophobicContact CD2-CG 4.22Å; L390-M416 HydrophobicContact CG-CE 4.33Å; L390-M416 HydrophobicContact CG-CG 4.27Å; L390-L419 HydrophobicContact CD1-CD2 4.06Å
391	E	93.9	Very high	91.8	Very high	52 Å²	52	42.2 Å²	42.2	24%	0.243	23%	0.226	C	C	.	.	H	α-helix	trans	-61.8	-44.6	175.6	-46.4	-165.9	139.3	0	0	111.5	V387 F388 L393 L394 V395 T433	V387-E391 HydrophobicContact CG1-CG 4.28Å; V387-E391 VanDerWaalsContact O-CG 3.26Å; V387-E391 WeakPolarHBondContact O-CG 3.47Å; V387-E391 PolarHBondContact O-N 2.94Å; F388-E391 PolarHBondContact O-N 2.9Å; E391-L393 VanDerWaalsContact C-N 3.33Å; E391-L393 PolarHBondContact O-N 3.36Å; E391-L394 WeakPolarHBondContact O-CB 3.36Å; E391-L394 PolarHBondContact O-N 2.89Å; E391-L394 VanDerWaalsContact O-N 3.13Å; E391-V395 WeakPolarHBondContact O-CG2 3.32Å; E391-V395 PolarHBondContact O-N 3.47Å; E391-T433 HydrophobicContact CB-CG2 3.86Å; E391-T433 HydrophobicContact CG-CG2 3.57Å; E391-T433 WeakPolarHBondContact OE1-CG2 3.43Å; E391-T433 PolarHBondContact OE1-OG1 2.99Å
392	S	93.8	Very high	92.3	Very high	41 Å²	41	41.2 Å²	41.2	29%	0.287	22%	0.215	S	C	.	.	H	α-helix	trans	-56.3	-47	177.1	-174.4	0	0	0	0	111.6	F388 L394 V395 L396	F388-S392 PolarHBondContact O-N 2.84Å; S392-L394 PolarHBondContact O-N 3.5Å; S392-V395 PolarHBondContact O-N 3.18Å; S392-L396 WeakPolarHBondContact O-CB 3.33Å; S392-L396 VanDerWaalsContact O-CG 3.24Å; S392-L396 WeakPolarHBondContact O-CG 3.31Å; S392-L396 PolarHBondContact O-N 3.42Å
393	L	94.8	Very high	92.6	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-66.7	-35.4	177.1	-76	179.9	0	0	0	113.7	A360 A361 V364 G389 L390 E391 C397 T408 A412	A360-L393 HydrophobicContact CB-CD2 3.63Å; A360-L393 HydrophobicContact CB-CG 4.34Å; A361-L393 VanDerWaalsContact CA-CD1 3.5Å; A361-L393 HydrophobicContact CB-CD1 4.05Å; V364-L393 HydrophobicContact CB-CD1 4.36Å; V364-L393 HydrophobicContact CG1-CD1 3.49Å; V364-L393 VanDerWaalsContact CG1-CD1 3.49Å; G389-L393 PolarHBondContact O-N 2.78Å; L390-L393 PolarHBondContact O-N 3.03Å; E391-L393 VanDerWaalsContact C-N 3.33Å; E391-L393 PolarHBondContact O-N 3.36Å; L393-C397 VanDerWaalsContact O-CB 3.31Å; L393-C397 WeakPolarHBondContact O-CB 3.4Å; L393-C397 PolarHBondContact O-N 3.07Å; L393-C397 PolarHBondContact O-SG 3.01Å; L393-T408 HydrophobicContact CD1-CG2 4.48Å; L393-T408 HydrophobicContact CD2-CG2 3.79Å; L393-A412 HydrophobicContact CB-CB 4.11Å; L393-A412 HydrophobicContact CD1-CB 4.13Å
394	L	94.5	Very high	92.7	Very high	1 Å²	1	47 Å²	47	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-57.9	-54.9	173.3	-76.2	175	0	0	0	109.8	L390 E391 S392 L396 C397 S398 L409 L413 M416 T433 L434 Q437 M449	L390-L394 WeakPolarHBondContact O-CG 3.42Å; L390-L394 PolarHBondContact O-N 2.96Å; E391-L394 WeakPolarHBondContact O-CB 3.36Å; E391-L394 PolarHBondContact O-N 2.89Å; E391-L394 VanDerWaalsContact O-N 3.13Å; S392-L394 PolarHBondContact O-N 3.5Å; L394-L396 VanDerWaalsContact C-N 3.33Å; L394-L396 PolarHBondContact O-N 3.22Å; L394-C397 PolarHBondContact O-N 3.11Å; L394-S398 VanDerWaalsContact O-CB 3.31Å; L394-S398 WeakPolarHBondContact O-CB 3.37Å; L394-S398 PolarHBondContact O-N 3.07Å; L394-S398 PolarHBondContact O-OG 3.2Å; L394-L409 HydrophobicContact CD2-CD1 3.64Å; L394-L413 HydrophobicContact CD2-CD2 3.7Å; L394-L413 HydrophobicContact CD2-CG 4.44Å; L394-M416 HydrophobicContact CD1-CE 3.3Å; L394-M416 HydrophobicContact CD1-SD 3.9Å; L394-M416 HydrophobicContact CD2-CE 3.58Å; L394-M416 HydrophobicContact CD2-SD 4.32Å; L394-M416 HydrophobicContact CG-CE 3.26Å; L394-M416 HydrophobicContact CG-SD 4.34Å; L394-T433 HydrophobicContact CD1-CG2 3.9Å; L394-L434 HydrophobicContact CD1-CD2 3.97Å; L394-L434 HydrophobicContact CD2-CD2 4.07Å; L394-Q437 HydrophobicContact CB-CG 4.41Å; L394-M449 HydrophobicContact CD2-CE 4.11Å
395	V	91.6	Very high	92.9	Very high	85 Å²	85	41.9 Å²	41.9	52%	0.515	24%	0.239	S	C	.	.	H	α-helix	trans	-58.4	-47.2	-177.4	177.6	0	0	0	0	110.8	E391 S392 C397	E391-V395 WeakPolarHBondContact O-CG2 3.32Å; E391-V395 PolarHBondContact O-N 3.47Å; S392-V395 PolarHBondContact O-N 3.18Å; V395-C397 VanDerWaalsContact C-N 3.32Å; V395-C397 PolarHBondContact O-N 3.37Å
396	L	91.6	Very high	93	Very high	93 Å²	93	42.4 Å²	42.4	49%	0.487	24%	0.24	S	C	.	.	H	α-helix	trans	-64.8	-30.2	-178.8	-69.5	173.1	0	0	0	114.3	S392 L394	S392-L396 WeakPolarHBondContact O-CB 3.33Å; S392-L396 VanDerWaalsContact O-CG 3.24Å; S392-L396 WeakPolarHBondContact O-CG 3.31Å; S392-L396 PolarHBondContact O-N 3.42Å; L394-L396 VanDerWaalsContact C-N 3.33Å; L394-L396 PolarHBondContact O-N 3.22Å
397	C	94.4	Very high	93.1	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.007	26%	0.26	C	S	.	.	H	α-helix	trans	-102.6	-11.3	-174.2	-57.3	0	0	0	0	113.8	L393 L394 V395 Q399 A405 L409	L393-C397 VanDerWaalsContact O-CB 3.31Å; L393-C397 WeakPolarHBondContact O-CB 3.4Å; L393-C397 PolarHBondContact O-N 3.07Å; L393-C397 PolarHBondContact O-SG 3.01Å; L394-C397 PolarHBondContact O-N 3.11Å; V395-C397 VanDerWaalsContact C-N 3.32Å; V395-C397 PolarHBondContact O-N 3.37Å; C397-Q399 VanDerWaalsContact C-N 3.31Å; C397-Q399 PolarHBondContact O-N 2.98Å; C397-A405 HydrophobicContact CB-CB 4.48Å; C397-L409 HydrophobicContact CB-CB 3.88Å; C397-L409 HydrophobicContact CB-CD1 4.4Å
398	S	90.9	Very high	93.2	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-24	-172.4	-69.7	0	0	0	0	114.8	L394 Q437 Q442 A445 M449	L394-S398 VanDerWaalsContact O-CB 3.31Å; L394-S398 WeakPolarHBondContact O-CB 3.37Å; L394-S398 PolarHBondContact O-N 3.07Å; L394-S398 PolarHBondContact O-OG 3.2Å; S398-Q437 VanDerWaalsContact OG-CG 3.25Å; S398-Q437 WeakPolarHBondContact OG-CG 3.39Å; S398-Q437 PolarHBondContact OG-NE2 3.17Å; S398-Q442 WeakPolarHBondContact O-CG 3.46Å; S398-Q442 PolarHBondContact O-N 3.42Å; S398-A445 WeakPolarHBondContact O-CB 3.38Å; S398-M449 WeakPolarHBondContact OG-CE 3.31Å
399	Q	89.8	Confident	93.3	Very high	138 Å²	138	40.7 Å²	40.7	65%	0.645	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-111	1.2	-176.5	-63	-175.2	-11.3	0	0	113.2	C397 S440	C397-Q399 VanDerWaalsContact C-N 3.31Å; C397-Q399 PolarHBondContact O-N 2.98Å; Q399-S440 PolarHBondContact NE2-O 3.26Å; Q399-S440 VanDerWaalsContact NE2-O 3.15Å
400	D	91.6	Very high	93.4	Very high	52 Å²	52	45 Å²	45	28%	0.278	26%	0.26	S	S	.	.			trans	-109.1	114.8	-179.2	-177.5	-15.6	0	0	0	110.6	R357 S402 A405 Q442	R357-D400 IonicContact CZ-OD2 3.98Å; R357-D400 IonicContact NH1-OD2 3.58Å; R357-D400 PolarHBondContact NH1-OD2 3.38Å; R357-D400 IonicContact NH2-OD2 3.31Å; D400-S402 VanDerWaalsContact C-N 3.26Å; D400-S402 VanDerWaalsContact CG-OG 3.24Å; D400-S402 PolarHBondContact O-N 2.87Å; D400-S402 WeakPolarHBondContact OD1-CA 3.5Å; D400-S402 WeakPolarHBondContact OD1-CB 3.26Å; D400-S402 PolarHBondContact OD1-N 3.38Å; D400-S402 PolarHBondContact OD1-OG 3.39Å; D400-S402 PolarHBondContact OD2-OG 3.01Å; D400-A405 HydrophobicContact CB-CB 3.7Å; D400-A405 WeakPolarHBondContact O-CB 3.44Å; D400-Q442 PolarHBondContact O-NE2 3.47Å; D400-Q442 VanDerWaalsContact O-NE2 3.08Å
401	D	88.3	Confident	93.5	Very high	85 Å²	85	46.3 Å²	46.3	46%	0.455	27%	0.267	S	S	.	.			trans	-82.3	1.4	-178.5	-160.3	34	0	0	0	114.1	Q406 A444	D401-Q406 PolarHBondContact O-NE2 3.37Å; D401-Q406 PolarHBondContact OD1-NE2 2.77Å; D401-A444 WeakPolarHBondContact OD1-CB 3.42Å
402	S	93.9	Very high	93.6	Very high	37 Å²	37	43.8 Å²	43.8	26%	0.259	26%	0.255	S	S	.	.	S	Bend	trans	-62.7	144.1	179.8	66.9	0	0	0	0	111.7	D400 G404 A405 Q406	D400-S402 VanDerWaalsContact C-N 3.26Å; D400-S402 VanDerWaalsContact CG-OG 3.24Å; D400-S402 PolarHBondContact O-N 2.87Å; D400-S402 WeakPolarHBondContact OD1-CA 3.5Å; D400-S402 WeakPolarHBondContact OD1-CB 3.26Å; D400-S402 PolarHBondContact OD1-N 3.38Å; D400-S402 PolarHBondContact OD1-OG 3.39Å; D400-S402 PolarHBondContact OD2-OG 3.01Å; S402-G404 PolarHBondContact O-N 3.03Å; S402-A405 WeakPolarHBondContact O-CB 3.38Å; S402-A405 PolarHBondContact O-N 3.35Å; S402-A405 WeakPolarHBondContact OG-CB 3.22Å; S402-A405 PolarHBondContact OG-N 3.16Å; S402-Q406 PolarHBondContact O-N 2.99Å
403	P	92.9	Very high	93.8	Very high	109 Å²	109	42.1 Å²	42.1	71%	0.708	24%	0.243	S	C	*	.	H	α-helix	trans	-56.4	-29.6	177.7	-27.1	34.5	0	0	0	113.8	A407	P403-A407 WeakPolarHBondContact O-CB 3.48Å; P403-A407 PolarHBondContact O-N 2.74Å
404	G	93.2	Very high	93.9	Very high	42 Å²	42	47 Å²	47	43%	0.433	27%	0.27	S	S	.	.	H	α-helix	trans	-69.3	-42.2	176	0	0	0	0	0	113.1	S402 A407 T408	S402-G404 PolarHBondContact O-N 3.03Å; G404-A407 PolarHBondContact O-N 3.49Å; G404-T408 PolarHBondContact O-N 2.81Å; G404-T408 VanDerWaalsContact O-N 3.13Å; G404-T408 PolarHBondContact O-OG1 2.92Å
405	A	94.1	Very high	94	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-63.6	-48.2	173.4	0	0	0	0	0	110.9	C397 D400 S402 A407 T408 L409	C397-A405 HydrophobicContact CB-CB 4.48Å; D400-A405 HydrophobicContact CB-CB 3.7Å; D400-A405 WeakPolarHBondContact O-CB 3.44Å; S402-A405 WeakPolarHBondContact O-CB 3.38Å; S402-A405 PolarHBondContact O-N 3.35Å; S402-A405 WeakPolarHBondContact OG-CB 3.22Å; S402-A405 PolarHBondContact OG-N 3.16Å; A405-A407 VanDerWaalsContact C-N 3.29Å; A405-A407 PolarHBondContact O-N 3.24Å; A405-T408 WeakPolarHBondContact O-CB 3.27Å; A405-T408 PolarHBondContact O-N 3.49Å; A405-T408 VanDerWaalsContact O-N 3.16Å; A405-L409 WeakPolarHBondContact O-CB 3.36Å; A405-L409 PolarHBondContact O-N 3.14Å
406	Q	93.8	Very high	94.2	Very high	51 Å²	51	43.4 Å²	43.4	24%	0.238	25%	0.247	C	C	.	.	H	α-helix	trans	-61.7	-35.8	178.6	-65.8	-174.1	6.5	0	0	112.7	D401 S402 K410	D401-Q406 PolarHBondContact O-NE2 3.37Å; D401-Q406 PolarHBondContact OD1-NE2 2.77Å; S402-Q406 PolarHBondContact O-N 2.99Å; Q406-K410 VanDerWaalsContact O-CG 3.29Å; Q406-K410 WeakPolarHBondContact O-CG 3.43Å; Q406-K410 PolarHBondContact O-N 3.42Å
407	A	94.4	Very high	94.4	Very high	51 Å²	51	40.4 Å²	40.4	42%	0.421	23%	0.233	S	C	.	.	H	α-helix	trans	-65.3	-45.5	175	0	0	0	0	0	111.5	P403 G404 A405 K410 I411	P403-A407 WeakPolarHBondContact O-CB 3.48Å; P403-A407 PolarHBondContact O-N 2.74Å; G404-A407 PolarHBondContact O-N 3.49Å; A405-A407 VanDerWaalsContact C-N 3.29Å; A405-A407 PolarHBondContact O-N 3.24Å; A407-K410 PolarHBondContact O-N 3.24Å; A407-I411 WeakPolarHBondContact O-CG1 3.38Å; A407-I411 PolarHBondContact O-N 2.96Å; A407-I411 VanDerWaalsContact O-N 3.1Å
408	T	96.1	Very high	94.4	Very high	10 Å²	10	43.9 Å²	43.9	6%	0.061	25%	0.248	C	C	.	.	H	α-helix	trans	-60.4	-46.3	174.8	-55.4	0	0	0	0	111.2	R357 A361 L393 G404 A405 K410 I411 A412	R357-T408 HydrophobicContact CB-CG2 4.02Å; R357-T408 WeakPolarHBondContact O-CG2 3.23Å; A361-T408 HydrophobicContact CB-CG2 3.6Å; L393-T408 HydrophobicContact CD1-CG2 4.48Å; L393-T408 HydrophobicContact CD2-CG2 3.79Å; G404-T408 PolarHBondContact O-N 2.81Å; G404-T408 VanDerWaalsContact O-N 3.13Å; G404-T408 PolarHBondContact O-OG1 2.92Å; A405-T408 WeakPolarHBondContact O-CB 3.27Å; A405-T408 PolarHBondContact O-N 3.49Å; A405-T408 VanDerWaalsContact O-N 3.16Å; T408-K410 PolarHBondContact O-N 3.09Å; T408-I411 WeakPolarHBondContact O-CA 3.41Å; T408-I411 WeakPolarHBondContact O-CB 3.42Å; T408-I411 PolarHBondContact O-N 2.93Å; T408-I411 VanDerWaalsContact O-N 3.07Å; T408-A412 PolarHBondContact O-N 3.26Å
409	L	96.6	Very high	94.5	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-59.5	-44.5	177.6	-178.8	57.6	0	0	0	111.6	L394 C397 A405 I411 A412 L413 A445 L448	L394-L409 HydrophobicContact CD2-CD1 3.64Å; C397-L409 HydrophobicContact CB-CB 3.88Å; C397-L409 HydrophobicContact CB-CD1 4.4Å; A405-L409 WeakPolarHBondContact O-CB 3.36Å; A405-L409 PolarHBondContact O-N 3.14Å; L409-I411 VanDerWaalsContact C-N 3.28Å; L409-I411 PolarHBondContact O-N 2.98Å; L409-A412 PolarHBondContact O-N 2.93Å; L409-L413 HydrophobicContact CD1-CD1 3.96Å; L409-L413 HydrophobicContact CD1-CD2 4.42Å; L409-L413 HydrophobicContact CD1-CG 3.97Å; L409-L413 HydrophobicContact CG-CD1 3.83Å; L409-L413 HydrophobicContact CG-CG 4.28Å; L409-L413 WeakPolarHBondContact O-CB 3.32Å; L409-L413 VanDerWaalsContact O-CG 3.28Å; L409-L413 WeakPolarHBondContact O-CG 3.47Å; L409-L413 PolarHBondContact O-N 3.34Å; L409-A445 HydrophobicContact CD2-CB 3.67Å; L409-L448 HydrophobicContact CD2-CD1 3.93Å; L409-L448 HydrophobicContact CG-CD1 4.31Å
410	K	96.8	Very high	94.6	Very high	91 Å²	91	37.4 Å²	37.4	40%	0.396	22%	0.218	S	C	.	.	H	α-helix	trans	-60.6	-37.3	174.5	-74.7	171.8	-177.1	175.2	0	112.5	Q406 A407 T408 N414 L448	Q406-K410 VanDerWaalsContact O-CG 3.29Å; Q406-K410 WeakPolarHBondContact O-CG 3.43Å; Q406-K410 PolarHBondContact O-N 3.42Å; A407-K410 PolarHBondContact O-N 3.24Å; T408-K410 PolarHBondContact O-N 3.09Å; K410-N414 WeakPolarHBondContact O-CB 3.3Å; K410-N414 PolarHBondContact O-N 3.11Å; K410-N414 VanDerWaalsContact O-N 3.09Å; K410-N414 PolarHBondContact O-ND2 3.49Å; K410-L448 HydrophobicContact CD-CD2 4.5Å; K410-L448 HydrophobicContact CG-CD1 4.03Å; K410-L448 HydrophobicContact CG-CD2 4.12Å
411	I	96.4	Very high	94.5	Very high	30 Å²	30	39.8 Å²	39.8	15%	0.154	23%	0.226	C	C	.	.	H	α-helix	trans	-62.2	-50.3	174.7	-67.7	168.7	0	0	0	109.9	A361 R365 A407 T408 L409 N414 C415	A361-I411 HydrophobicContact CB-CB 4.25Å; A361-I411 HydrophobicContact CB-CD1 4.2Å; A361-I411 HydrophobicContact CB-CG2 3.89Å; R365-I411 HydrophobicContact CB-CG2 4.35Å; A407-I411 WeakPolarHBondContact O-CG1 3.38Å; A407-I411 PolarHBondContact O-N 2.96Å; A407-I411 VanDerWaalsContact O-N 3.1Å; T408-I411 WeakPolarHBondContact O-CA 3.41Å; T408-I411 WeakPolarHBondContact O-CB 3.42Å; T408-I411 PolarHBondContact O-N 2.93Å; T408-I411 VanDerWaalsContact O-N 3.07Å; L409-I411 VanDerWaalsContact C-N 3.28Å; L409-I411 PolarHBondContact O-N 2.98Å; I411-N414 PolarHBondContact O-N 3.27Å; I411-C415 PolarHBondContact O-N 3.35Å; I411-C415 VanDerWaalsContact O-N 3.07Å; I411-C415 PolarHBondContact O-SG 2.84Å
412	A	97.2	Very high	94.5	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61.7	-49.7	-179.2	0	0	0	0	0	112	L390 L393 T408 L409 N414 C415 M416	L390-A412 HydrophobicContact CD2-CB 4.07Å; L390-A412 WeakPolarHBondContact CD2-O 3.38Å; L393-A412 HydrophobicContact CB-CB 4.11Å; L393-A412 HydrophobicContact CD1-CB 4.13Å; T408-A412 PolarHBondContact O-N 3.26Å; L409-A412 PolarHBondContact O-N 2.93Å; A412-N414 PolarHBondContact O-N 3.21Å; A412-C415 CarbonylContact O-C 3.52Å; A412-C415 WeakPolarHBondContact O-CA 3.47Å; A412-C415 WeakPolarHBondContact O-CB 3.44Å; A412-C415 PolarHBondContact O-N 3.36Å; A412-M416 HydrophobicContact CB-CE 4.24Å; A412-M416 PolarHBondContact O-N 3.28Å
413	L	97.2	Very high	94.2	Very high	6 Å²	6	36.9 Å²	36.9	3%	0.031	21%	0.213	C	C	.	.	H	α-helix	trans	-61.2	-41.4	179.3	-66.2	172.3	0	0	0	112.3	L394 L409 C415 M416 V417 L434 L448 M449 C452	L394-L413 HydrophobicContact CD2-CD2 3.7Å; L394-L413 HydrophobicContact CD2-CG 4.44Å; L409-L413 HydrophobicContact CD1-CD1 3.96Å; L409-L413 HydrophobicContact CD1-CD2 4.42Å; L409-L413 HydrophobicContact CD1-CG 3.97Å; L409-L413 HydrophobicContact CG-CD1 3.83Å; L409-L413 HydrophobicContact CG-CG 4.28Å; L409-L413 WeakPolarHBondContact O-CB 3.32Å; L409-L413 VanDerWaalsContact O-CG 3.28Å; L409-L413 WeakPolarHBondContact O-CG 3.47Å; L409-L413 PolarHBondContact O-N 3.34Å; L413-C415 VanDerWaalsContact C-N 3.26Å; L413-C415 PolarHBondContact O-N 3.19Å; L413-M416 HydrophobicContact CD2-CE 4.47Å; L413-M416 HydrophobicContact CD2-SD 4.01Å; L413-M416 WeakPolarHBondContact O-CB 3.47Å; L413-M416 PolarHBondContact O-N 3.47Å; L413-V417 WeakPolarHBondContact O-CG2 3.34Å; L413-V417 PolarHBondContact O-N 3.29Å; L413-L434 HydrophobicContact CD2-CD2 3.57Å; L413-L448 HydrophobicContact CD1-CB 3.54Å; L413-M449 HydrophobicContact CD2-CG 4.42Å; L413-C452 HydrophobicContact CB-CB 4.15Å; L413-C452 HydrophobicContact CD1-CB 4.49Å; L413-C452 HydrophobicContact CD2-CB 3.77Å; L413-C452 HydrophobicContact CG-CB 4.35Å
414	N	96.3	Very high	94	Very high	104 Å²	104	35.1 Å²	35.1	56%	0.556	20%	0.201	S	C	*	.	H	α-helix	trans	-64.8	-32.8	174.7	-71.2	-13	0	0	0	112.2	K410 I411 A412 K418	K410-N414 WeakPolarHBondContact O-CB 3.3Å; K410-N414 PolarHBondContact O-N 3.11Å; K410-N414 VanDerWaalsContact O-N 3.09Å; K410-N414 PolarHBondContact O-ND2 3.49Å; I411-N414 PolarHBondContact O-N 3.27Å; A412-N414 PolarHBondContact O-N 3.21Å; N414-K418 WeakPolarHBondContact O-CB 3.49Å; N414-K418 PolarHBondContact O-N 3.31Å; N414-K418 VanDerWaalsContact O-N 3.07Å
415	C	96.9	Very high	93.9	Very high	5 Å²	5	38.7 Å²	38.7	3%	0.034	21%	0.206	C	C	.	.	H	α-helix	trans	-69.2	-40.5	173.8	-64.9	0	0	0	0	111	T368 L390 I411 A412 L413 V417 K418 L419	T368-C415 HydrophobicContact CG2-CB 3.96Å; T368-C415 WeakPolarHBondContact CG2-O 3.36Å; L390-C415 HydrophobicContact CD2-CB 3.82Å; I411-C415 PolarHBondContact O-N 3.35Å; I411-C415 VanDerWaalsContact O-N 3.07Å; I411-C415 PolarHBondContact O-SG 2.84Å; A412-C415 CarbonylContact O-C 3.52Å; A412-C415 WeakPolarHBondContact O-CA 3.47Å; A412-C415 WeakPolarHBondContact O-CB 3.44Å; A412-C415 PolarHBondContact O-N 3.36Å; L413-C415 VanDerWaalsContact C-N 3.26Å; L413-C415 PolarHBondContact O-N 3.19Å; C415-V417 PolarHBondContact O-N 3.48Å; C415-K418 PolarHBondContact O-N 2.8Å; C415-L419 WeakPolarHBondContact O-CB 3.42Å; C415-L419 PolarHBondContact O-N 2.94Å
416	M	96.6	Very high	93.7	Very high	4 Å²	4	39.8 Å²	39.8	2%	0.02	21%	0.212	C	C	.	.	H	α-helix	trans	-58.1	-47.3	172.4	-73.7	170.1	-148.6	0	0	112.4	L390 L394 A412 L413 K418 L419 A420 V430 L434	L390-M416 HydrophobicContact CB-CE 3.62Å; L390-M416 HydrophobicContact CB-CG 4.24Å; L390-M416 HydrophobicContact CD1-CG 3.74Å; L390-M416 HydrophobicContact CD2-CE 4.12Å; L390-M416 HydrophobicContact CD2-CG 4.22Å; L390-M416 HydrophobicContact CG-CE 4.33Å; L390-M416 HydrophobicContact CG-CG 4.27Å; L394-M416 HydrophobicContact CD1-CE 3.3Å; L394-M416 HydrophobicContact CD1-SD 3.9Å; L394-M416 HydrophobicContact CD2-CE 3.58Å; L394-M416 HydrophobicContact CD2-SD 4.32Å; L394-M416 HydrophobicContact CG-CE 3.26Å; L394-M416 HydrophobicContact CG-SD 4.34Å; A412-M416 HydrophobicContact CB-CE 4.24Å; A412-M416 PolarHBondContact O-N 3.28Å; L413-M416 HydrophobicContact CD2-CE 4.47Å; L413-M416 HydrophobicContact CD2-SD 4.01Å; L413-M416 WeakPolarHBondContact O-CB 3.47Å; L413-M416 PolarHBondContact O-N 3.47Å; M416-K418 VanDerWaalsContact C-N 3.32Å; M416-K418 PolarHBondContact O-N 3.38Å; M416-L419 PolarHBondContact O-N 2.88Å; M416-A420 WeakPolarHBondContact O-CB 3.46Å; M416-A420 PolarHBondContact O-N 3.39Å; M416-V430 HydrophobicContact CB-CG1 3.74Å; M416-V430 HydrophobicContact CG-CG1 3.83Å; M416-V430 HydrophobicContact SD-CG1 4.12Å; M416-L434 HydrophobicContact SD-CD1 4.42Å; M416-L434 HydrophobicContact SD-CD2 3.98Å; M416-L434 HydrophobicContact SD-CG 4.28Å
417	V	95.1	Very high	93.6	Very high	30 Å²	30	37.8 Å²	37.8	18%	0.182	20%	0.203	C	C	.	.	H	α-helix	trans	-58.6	-45.6	175.9	175.5	0	0	0	0	110.7	L413 C415 L419 K421 A455 I456	L413-V417 WeakPolarHBondContact O-CG2 3.34Å; L413-V417 PolarHBondContact O-N 3.29Å; C415-V417 PolarHBondContact O-N 3.48Å; V417-L419 PolarHBondContact O-N 3.25Å; V417-K421 WeakPolarHBondContact O-CB 3.35Å; V417-K421 PolarHBondContact O-N 3.06Å; V417-A455 HydrophobicContact CG1-CB 4.13Å; V417-A455 HydrophobicContact CG2-CB 3.86Å; V417-I456 HydrophobicContact CG2-CG1 4.15Å
418	K	94.1	Very high	93.5	Very high	75 Å²	75	41 Å²	41	33%	0.326	21%	0.21	S	C	.	.	H	α-helix	trans	-63.8	-41	178.6	-171.6	178.4	177.5	179	0	112	N369 V372 N414 C415 M416 G422	N369-K418 PolarHBondContact OD1-NZ 2.9Å; V372-K418 HydrophobicContact CG1-CG 4.46Å; V372-K418 HydrophobicContact CG2-CG 4.39Å; N414-K418 WeakPolarHBondContact O-CB 3.49Å; N414-K418 PolarHBondContact O-N 3.31Å; N414-K418 VanDerWaalsContact O-N 3.07Å; C415-K418 PolarHBondContact O-N 2.8Å; M416-K418 VanDerWaalsContact C-N 3.32Å; M416-K418 PolarHBondContact O-N 3.38Å; K418-G422 PolarHBondContact O-N 3.11Å
419	L	93.4	Very high	93.2	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-65.8	-50.3	178.6	-172.4	61.3	0	0	0	110.8	T368 T371 V372 V387 L390 C415 M416 V417 K421 G422 R423 L426	T368-L419 HydrophobicContact CG2-CB 4.05Å; T371-L419 HydrophobicContact CG2-CD1 3.74Å; V372-L419 HydrophobicContact CG2-CD1 4.09Å; V387-L419 HydrophobicContact CG2-CD2 4.04Å; L390-L419 HydrophobicContact CD1-CD2 4.06Å; C415-L419 WeakPolarHBondContact O-CB 3.42Å; C415-L419 PolarHBondContact O-N 2.94Å; M416-L419 PolarHBondContact O-N 2.88Å; V417-L419 PolarHBondContact O-N 3.25Å; L419-K421 VanDerWaalsContact C-N 3.31Å; L419-K421 PolarHBondContact O-N 3.15Å; L419-G422 PolarHBondContact O-N 3.38Å; L419-G422 VanDerWaalsContact O-N 3.16Å; L419-R423 HydrophobicContact CD1-CB 4.47Å; L419-R423 HydrophobicContact CD1-CG 4.31Å; L419-R423 PolarHBondContact O-N 3.29Å; L419-L426 HydrophobicContact CD1-CD1 3.98Å; L419-L426 HydrophobicContact CD2-CD1 4.14Å; L419-L426 HydrophobicContact CG-CD1 4.03Å
420	A	92	Very high	93	Very high	1 Å²	1	43 Å²	43	1%	0.008	22%	0.224	C	C	.	.	H	α-helix	trans	-60.8	-38.7	178.2	0	0	0	0	0	112.3	M416 I456	M416-A420 WeakPolarHBondContact O-CB 3.46Å; M416-A420 PolarHBondContact O-N 3.39Å; A420-I456 HydrophobicContact CB-CD1 4.29Å; A420-I456 HydrophobicContact CB-CG1 4.13Å; A420-I456 HydrophobicContact CB-CG2 4.12Å
421	K	88.8	Confident	92.8	Very high	102 Å²	102	39 Å²	39	44%	0.443	21%	0.207	S	C	.	.	H	α-helix	trans	-67.8	-39.7	174.9	-175.7	170.5	-175	161.9	0	112.5	V417 L419 D741	V417-K421 WeakPolarHBondContact O-CB 3.35Å; V417-K421 PolarHBondContact O-N 3.06Å; L419-K421 VanDerWaalsContact C-N 3.31Å; L419-K421 PolarHBondContact O-N 3.15Å; K421-D741 IonicContact NZ-OD1 2.73Å; K421-D741 PolarHBondContact NZ-OD1 3.32Å
422	G	88.2	Confident	92.7	Very high	32 Å²	32	42.3 Å²	42.3	33%	0.33	22%	0.222	S	C	.	.	H	α-helix	trans	-83.3	-27	-177.1	0	0	0	0	0	114.8	K418 L419	K418-G422 PolarHBondContact O-N 3.11Å; L419-G422 PolarHBondContact O-N 3.38Å; L419-G422 VanDerWaalsContact O-N 3.16Å
423	R	89.1	Confident	92.5	Very high	30 Å²	30	43.4 Å²	43.4	11%	0.113	23%	0.229	C	C	.	.			trans	-136	79.2	-176.7	-62.3	-63.4	179.8	-154.7	-3	109.5	T371 C374 E383 L419 H425 L426	T371-R423 HydrophobicContact CG2-CG 4.41Å; T371-R423 PolarHBondContact O-NE 3.03Å; T371-R423 VanDerWaalsContact O-NE 3.11Å; T371-R423 PolarHBondContact O-NH2 2.69Å; C374-R423 PolarHBondContact O-NH2 3.43Å; E383-R423 IonicContact OE1-NE 3.43Å; L419-R423 HydrophobicContact CD1-CB 4.47Å; L419-R423 HydrophobicContact CD1-CG 4.31Å; L419-R423 PolarHBondContact O-N 3.29Å; R423-H425 PolarHBondContact O-N 2.53Å; R423-H425 VanDerWaalsContact O-N 3.11Å; R423-L426 HydrophobicContact CB-CD1 3.93Å; R423-L426 HydrophobicContact CB-CG 4.26Å; R423-L426 HydrophobicContact CG-CD1 4.49Å; R423-L426 PolarHBondContact O-N 2.61Å; R423-L426 VanDerWaalsContact O-N 3.09Å
424	P	88.8	Confident	92.4	Very high	71 Å²	71	43.1 Å²	43.1	46%	0.461	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-58.5	-25.1	-175.1	-27.3	36.1	0	0	0	114.9	L426 S427 L460	P424-L426 PolarHBondContact O-N 3.44Å; P424-S427 WeakPolarHBondContact O-CB 3.43Å; P424-S427 PolarHBondContact O-N 3.23Å; P424-S427 PolarHBondContact O-OG 2.92Å; P424-L460 HydrophobicContact CB-CD1 4.4Å; P424-L460 HydrophobicContact CB-CD2 4.23Å
425	H	89.4	Confident	92.3	Very high	118 Å²	118	38.8 Å²	38.8	55%	0.546	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-65.5	-19.5	177.7	69.1	-75.3	0	0	0	113.7	E383 R423	E383-H425 IonicContact OE1-CE1 2.66Å; E383-H425 PolarHBondContact OE1-CE1 3Å; E383-H425 IonicContact OE1-NE2 3.11Å; E383-H425 IonicContact OE2-CD2 3.49Å; E383-H425 IonicContact OE2-CE1 3.36Å; E383-H425 PolarHBondContact OE2-CE1 2.79Å; E383-H425 IonicContact OE2-NE2 3.57Å; E383-H425 PolarHBondContact OE2-NE2 2.91Å; R423-H425 PolarHBondContact O-N 2.53Å; R423-H425 VanDerWaalsContact O-N 3.11Å
426	L	91.1	Very high	92.1	Very high	22 Å²	22	43 Å²	43	12%	0.115	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-91.4	-6.9	177.9	-58.8	176.5	0	0	0	113.2	E383 V387 L419 R423 P424 Q428 S429 V430	E383-L426 HydrophobicContact CB-CD1 4Å; E383-L426 HydrophobicContact CB-CD2 4.49Å; E383-L426 HydrophobicContact CG-CD1 3.92Å; V387-L426 HydrophobicContact CG2-CD1 4.47Å; L419-L426 HydrophobicContact CD1-CD1 3.98Å; L419-L426 HydrophobicContact CD2-CD1 4.14Å; L419-L426 HydrophobicContact CG-CD1 4.03Å; R423-L426 HydrophobicContact CB-CD1 3.93Å; R423-L426 HydrophobicContact CB-CG 4.26Å; R423-L426 HydrophobicContact CG-CD1 4.49Å; R423-L426 PolarHBondContact O-N 2.61Å; R423-L426 VanDerWaalsContact O-N 3.09Å; P424-L426 PolarHBondContact O-N 3.44Å; L426-Q428 VanDerWaalsContact C-N 3.32Å; L426-Q428 PolarHBondContact O-N 3.18Å; L426-S429 PolarHBondContact O-N 2.98Å; L426-V430 PolarHBondContact O-N 3.41Å
427	S	90.9	Very high	92.1	Very high	9 Å²	9	43.9 Å²	43.9	6%	0.063	23%	0.234	C	C	.	.	H	α-helix	trans	-65.3	-35.2	-169	67.6	0	0	0	0	113.3	P424 V431 L460 L463	P424-S427 WeakPolarHBondContact O-CB 3.43Å; P424-S427 PolarHBondContact O-N 3.23Å; P424-S427 PolarHBondContact O-OG 2.92Å; S427-V431 WeakPolarHBondContact O-CG2 3.37Å; S427-V431 PolarHBondContact O-N 3.35Å; S427-L460 VanDerWaalsContact CB-CD1 3.44Å; S427-L463 WeakPolarHBondContact OG-CD1 3.44Å
428	Q	91.8	Very high	91.9	Very high	120 Å²	120	42.6 Å²	42.6	56%	0.561	23%	0.226	S	C	*	.	H	α-helix	trans	-64.5	-49.5	179.2	179.4	173.3	-8.8	0	0	111.3	L426 V430 V431 E432 L463	L426-Q428 VanDerWaalsContact C-N 3.32Å; L426-Q428 PolarHBondContact O-N 3.18Å; Q428-V430 VanDerWaalsContact C-N 3.32Å; Q428-V430 PolarHBondContact O-N 3.44Å; Q428-V431 PolarHBondContact O-N 2.87Å; Q428-V431 VanDerWaalsContact O-N 3.12Å; Q428-E432 HydrophobicContact CG-CG 4.42Å; Q428-E432 VanDerWaalsContact CG-OE1 3.22Å; Q428-E432 WeakPolarHBondContact CG-OE1 3.41Å; Q428-E432 PolarHBondContact NE2-OE1 2.91Å; Q428-E432 WeakPolarHBondContact O-CG 3.42Å; Q428-E432 PolarHBondContact O-N 2.93Å; Q428-L463 HydrophobicContact CB-CD2 4.27Å
429	S	91.1	Very high	91.7	Very high	47 Å²	47	43.1 Å²	43.1	33%	0.329	23%	0.229	S	C	.	.	H	α-helix	trans	-56.1	-46.6	177.2	167.9	0	0	0	0	111.5	L426 V431 E432 T433	L426-S429 PolarHBondContact O-N 2.98Å; S429-V431 VanDerWaalsContact C-N 3.33Å; S429-V431 PolarHBondContact O-N 3.14Å; S429-E432 PolarHBondContact O-N 3.5Å; S429-T433 PolarHBondContact O-N 3.42Å; S429-T433 VanDerWaalsContact O-N 3.08Å; S429-T433 PolarHBondContact O-OG1 3.37Å
430	V	91.6	Very high	91.5	Very high	5 Å²	5	45.6 Å²	45.6	3%	0.03	25%	0.247	C	C	.	.	H	α-helix	trans	-61.8	-39.7	178.1	173	0	0	0	0	112.3	M416 L426 Q428 L434 I456	M416-V430 HydrophobicContact CB-CG1 3.74Å; M416-V430 HydrophobicContact CG-CG1 3.83Å; M416-V430 HydrophobicContact SD-CG1 4.12Å; L426-V430 PolarHBondContact O-N 3.41Å; Q428-V430 VanDerWaalsContact C-N 3.32Å; Q428-V430 PolarHBondContact O-N 3.44Å; V430-L434 HydrophobicContact CG1-CD1 4.23Å; V430-L434 WeakPolarHBondContact O-CG 3.27Å; V430-L434 PolarHBondContact O-N 3.16Å; V430-L434 VanDerWaalsContact O-N 3.1Å; V430-I456 HydrophobicContact CG1-CD1 3.97Å
431	V	93.9	Very high	91.5	Very high	8 Å²	8	45.7 Å²	45.7	5%	0.048	25%	0.248	C	C	.	.	H	α-helix	trans	-67.5	-44.1	178.2	167	0	0	0	0	111.1	S427 Q428 S429 T433 L434 L435 L453 I456 L463 M467	S427-V431 WeakPolarHBondContact O-CG2 3.37Å; S427-V431 PolarHBondContact O-N 3.35Å; Q428-V431 PolarHBondContact O-N 2.87Å; Q428-V431 VanDerWaalsContact O-N 3.12Å; S429-V431 VanDerWaalsContact C-N 3.33Å; S429-V431 PolarHBondContact O-N 3.14Å; V431-T433 VanDerWaalsContact C-N 3.33Å; V431-T433 PolarHBondContact O-N 3.03Å; V431-L434 WeakPolarHBondContact O-CB 3.16Å; V431-L434 PolarHBondContact O-N 3.17Å; V431-L434 VanDerWaalsContact O-N 3.12Å; V431-L435 HydrophobicContact CG1-CD1 3.83Å; V431-L435 HydrophobicContact CG1-CG 4.21Å; V431-L435 WeakPolarHBondContact O-CG 3.4Å; V431-L435 PolarHBondContact O-N 3.39Å; V431-L453 HydrophobicContact CB-CD2 4.48Å; V431-L453 HydrophobicContact CG1-CD2 4.1Å; V431-L453 HydrophobicContact CG2-CD2 4.23Å; V431-I456 HydrophobicContact CG2-CG2 4.09Å; V431-L463 HydrophobicContact CG2-CD1 4.06Å; V431-M467 HydrophobicContact CG1-CE 3.98Å; V431-M467 HydrophobicContact CG2-CE 4.37Å
432	E	92.8	Very high	91.6	Very high	100 Å²	100	43.4 Å²	43.4	47%	0.467	24%	0.239	S	C	.	.	H	α-helix	trans	-59.2	-43.2	177.3	-71.6	170.3	-175.2	0	0	111.5	Q428 S429 L434 L435 T436	Q428-E432 HydrophobicContact CG-CG 4.42Å; Q428-E432 VanDerWaalsContact CG-OE1 3.22Å; Q428-E432 WeakPolarHBondContact CG-OE1 3.41Å; Q428-E432 PolarHBondContact NE2-OE1 2.91Å; Q428-E432 WeakPolarHBondContact O-CG 3.42Å; Q428-E432 PolarHBondContact O-N 2.93Å; S429-E432 PolarHBondContact O-N 3.5Å; E432-L434 VanDerWaalsContact C-N 3.34Å; E432-L434 PolarHBondContact O-N 3.39Å; E432-L435 PolarHBondContact O-N 3.14Å; E432-T436 WeakPolarHBondContact O-CG2 3.35Å; E432-T436 PolarHBondContact O-N 2.86Å; E432-T436 PolarHBondContact O-OG1 3.21Å
433	T	93.6	Very high	91.8	Very high	22 Å²	22	42.6 Å²	42.6	14%	0.135	23%	0.227	C	C	.	.	H	α-helix	trans	-63.1	-39.5	174.7	-45.2	0	0	0	0	111.8	E391 L394 S429 V431 T436 Q437	E391-T433 HydrophobicContact CB-CG2 3.86Å; E391-T433 HydrophobicContact CG-CG2 3.57Å; E391-T433 WeakPolarHBondContact OE1-CG2 3.43Å; E391-T433 PolarHBondContact OE1-OG1 2.99Å; L394-T433 HydrophobicContact CD1-CG2 3.9Å; S429-T433 PolarHBondContact O-N 3.42Å; S429-T433 VanDerWaalsContact O-N 3.08Å; S429-T433 PolarHBondContact O-OG1 3.37Å; V431-T433 VanDerWaalsContact C-N 3.33Å; V431-T433 PolarHBondContact O-N 3.03Å; T433-T436 WeakPolarHBondContact CA-OG1 3.42Å; T433-T436 PolarHBondContact O-OG1 3.14Å; T433-Q437 VanDerWaalsContact O-CB 3.27Å; T433-Q437 WeakPolarHBondContact O-CB 3.48Å; T433-Q437 PolarHBondContact O-N 2.94Å; T433-Q437 VanDerWaalsContact O-N 3.1Å
434	L	95.6	Very high	91.9	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-66.4	-44.1	177.3	-74.8	170.5	0	0	0	111.7	L394 L413 M416 V430 V431 E432 Q437 L438 M449 C452 L453 I456	L394-L434 HydrophobicContact CD1-CD2 3.97Å; L394-L434 HydrophobicContact CD2-CD2 4.07Å; L413-L434 HydrophobicContact CD2-CD2 3.57Å; M416-L434 HydrophobicContact SD-CD1 4.42Å; M416-L434 HydrophobicContact SD-CD2 3.98Å; M416-L434 HydrophobicContact SD-CG 4.28Å; V430-L434 HydrophobicContact CG1-CD1 4.23Å; V430-L434 WeakPolarHBondContact O-CG 3.27Å; V430-L434 PolarHBondContact O-N 3.16Å; V430-L434 VanDerWaalsContact O-N 3.1Å; V431-L434 WeakPolarHBondContact O-CB 3.16Å; V431-L434 PolarHBondContact O-N 3.17Å; V431-L434 VanDerWaalsContact O-N 3.12Å; E432-L434 VanDerWaalsContact C-N 3.34Å; E432-L434 PolarHBondContact O-N 3.39Å; L434-Q437 PolarHBondContact O-N 3.18Å; L434-L438 WeakPolarHBondContact O-CB 3.41Å; L434-L438 PolarHBondContact O-N 3.01Å; L434-M449 HydrophobicContact CD2-CB 4.47Å; L434-M449 HydrophobicContact CD2-CG 4.19Å; L434-C452 HydrophobicContact CD1-CB 4.3Å; L434-L453 HydrophobicContact CB-CD2 3.81Å; L434-L453 HydrophobicContact CB-CG 4.23Å; L434-L453 HydrophobicContact CD1-CD2 3.78Å; L434-L453 HydrophobicContact CD1-CG 4.14Å; L434-L453 HydrophobicContact CG-CD2 4.47Å; L434-I456 HydrophobicContact CD1-CD1 4.13Å
435	L	93.9	Very high	92.2	Very high	13 Å²	13	38.6 Å²	38.6	7%	0.068	21%	0.206	C	C	.	.	H	α-helix	trans	-65.7	-44.4	-179.6	-67.6	172.9	0	0	0	112.1	V431 E432 Q437 L438 H439 L453 M467 D470 L471	V431-L435 HydrophobicContact CG1-CD1 3.83Å; V431-L435 HydrophobicContact CG1-CG 4.21Å; V431-L435 WeakPolarHBondContact O-CG 3.4Å; V431-L435 PolarHBondContact O-N 3.39Å; E432-L435 PolarHBondContact O-N 3.14Å; L435-Q437 VanDerWaalsContact C-N 3.34Å; L435-Q437 PolarHBondContact O-N 2.97Å; L435-L438 WeakPolarHBondContact O-CB 3.26Å; L435-L438 PolarHBondContact O-N 2.83Å; L435-H439 PolarHBondContact O-ND1 3.47Å; L435-L453 HydrophobicContact CD2-CD1 3.98Å; L435-M467 HydrophobicContact CD1-CB 3.73Å; L435-M467 HydrophobicContact CD2-CB 4.06Å; L435-M467 HydrophobicContact CG-CB 4.46Å; L435-D470 HydrophobicContact CD2-CB 4.34Å; L435-L471 HydrophobicContact CD2-CD2 4.43Å
436	T	92.9	Very high	92.4	Very high	95 Å²	95	35 Å²	35	58%	0.583	19%	0.188	S	C	*	.	H	α-helix	trans	-60.4	-45.2	175.9	51.2	0	0	0	0	111	E432 T433 L438	E432-T436 WeakPolarHBondContact O-CG2 3.35Å; E432-T436 PolarHBondContact O-N 2.86Å; E432-T436 PolarHBondContact O-OG1 3.21Å; T433-T436 WeakPolarHBondContact CA-OG1 3.42Å; T433-T436 PolarHBondContact O-OG1 3.14Å; T436-L438 VanDerWaalsContact C-N 3.33Å; T436-L438 PolarHBondContact O-N 3.46Å
437	Q	95.1	Very high	92.6	Very high	22 Å²	22	34.8 Å²	34.8	10%	0.103	19%	0.186	C	C	.	.	H	α-helix	trans	-72.4	-24.2	-179.8	-165.7	61.5	17.3	0	0	113.7	L394 S398 T433 L434 L435 H439 S440 A441 M449	L394-Q437 HydrophobicContact CB-CG 4.41Å; S398-Q437 VanDerWaalsContact OG-CG 3.25Å; S398-Q437 WeakPolarHBondContact OG-CG 3.39Å; S398-Q437 PolarHBondContact OG-NE2 3.17Å; T433-Q437 VanDerWaalsContact O-CB 3.27Å; T433-Q437 WeakPolarHBondContact O-CB 3.48Å; T433-Q437 PolarHBondContact O-N 2.94Å; T433-Q437 VanDerWaalsContact O-N 3.1Å; L434-Q437 PolarHBondContact O-N 3.18Å; L435-Q437 VanDerWaalsContact C-N 3.34Å; L435-Q437 PolarHBondContact O-N 2.97Å; Q437-H439 PolarHBondContact O-N 2.79Å; Q437-S440 PolarHBondContact NE2-OG 2.83Å; Q437-S440 PolarHBondContact O-N 3.49Å; Q437-S440 PolarHBondContact O-OG 3.26Å; Q437-S440 VanDerWaalsContact O-OG 3.13Å; Q437-S440 PolarHBondContact OE1-OG 3.46Å; Q437-A441 WeakPolarHBondContact O-CB 3.43Å; Q437-A441 PolarHBondContact O-N 3.49Å; Q437-M449 HydrophobicContact CB-CE 4.36Å; Q437-M449 HydrophobicContact CG-CE 3.74Å; Q437-M449 HydrophobicContact CG-SD 4.47Å
438	L	92.8	Very high	92.9	Very high	3 Å²	3	35.7 Å²	35.7	2%	0.016	19%	0.191	C	C	.	.	H	α-helix	trans	-60.5	-34.9	-179.2	-145.3	150.3	0	0	0	112.2	L434 L435 T436 R446 M449 L453 L474	L434-L438 WeakPolarHBondContact O-CB 3.41Å; L434-L438 PolarHBondContact O-N 3.01Å; L435-L438 WeakPolarHBondContact O-CB 3.26Å; L435-L438 PolarHBondContact O-N 2.83Å; T436-L438 VanDerWaalsContact C-N 3.33Å; T436-L438 PolarHBondContact O-N 3.46Å; L438-R446 HydrophobicContact CD2-CG 4.23Å; L438-R446 PolarHBondContact O-NE 3.04Å; L438-M449 HydrophobicContact CD1-CB 4.31Å; L438-L453 HydrophobicContact CD1-CD1 3.63Å; L438-L474 HydrophobicContact CD2-CD1 3.9Å; L438-L474 HydrophobicContact CD2-CD2 3.08Å; L438-L474 HydrophobicContact CD2-CG 4.03Å
439	H	89.9	Confident	93.1	Very high	85 Å²	85	30 Å²	30	39%	0.394	16%	0.164	S	C	.	.	H	α-helix	trans	-68.3	-35.6	178.8	-66.5	86.8	0	0	0	112.5	L435 Q437 R446	L435-H439 PolarHBondContact O-ND1 3.47Å; Q437-H439 PolarHBondContact O-N 2.79Å; H439-R446 PolarHBondContact O-NH2 3.19Å; H439-R446 VanDerWaalsContact O-NH2 3.11Å
440	S	88.9	Confident	93.4	Very high	52 Å²	52	27.8 Å²	27.8	36%	0.364	15%	0.148	S	C	.	.	H	α-helix	trans	-96.9	-6.5	-174.9	65.2	0	0	0	0	114.5	Q399 Q437	Q399-S440 PolarHBondContact NE2-O 3.26Å; Q399-S440 VanDerWaalsContact NE2-O 3.15Å; Q437-S440 PolarHBondContact NE2-OG 2.83Å; Q437-S440 PolarHBondContact O-N 3.49Å; Q437-S440 PolarHBondContact O-OG 3.26Å; Q437-S440 VanDerWaalsContact O-OG 3.13Å; Q437-S440 PolarHBondContact OE1-OG 3.46Å
441	A	92.3	Very high	93.6	Very high	4 Å²	4	32 Å²	32	3%	0.033	17%	0.167	C	C	.	.	S	Bend	trans	-82.5	153.8	-179.8	0	0	0	0	0	113.1	Q437 A445 R446 M449	Q437-A441 WeakPolarHBondContact O-CB 3.43Å; Q437-A441 PolarHBondContact O-N 3.49Å; A441-A445 HydrophobicContact CB-CB 4.12Å; A441-R446 HydrophobicContact CB-CG 3.96Å; A441-R446 PolarHBondContact O-NE 3.3Å; A441-R446 PolarHBondContact O-NH2 3.25Å; A441-M449 HydrophobicContact CB-CE 4.08Å; A441-M449 HydrophobicContact CB-SD 4.11Å
442	Q	90.8	Very high	93.7	Very high	54 Å²	54	31.9 Å²	31.9	25%	0.252	17%	0.167	S	C	.	.			trans	-76.4	161.9	167.8	73.6	-169.6	-19	0	0	111.6	S398 D400 A444 A445 R446	S398-Q442 WeakPolarHBondContact O-CG 3.46Å; S398-Q442 PolarHBondContact O-N 3.42Å; D400-Q442 PolarHBondContact O-NE2 3.47Å; D400-Q442 VanDerWaalsContact O-NE2 3.08Å; Q442-A444 VanDerWaalsContact C-N 3.3Å; Q442-A444 HydrophobicContact CG-CB 4.44Å; Q442-A444 PolarHBondContact O-N 2.73Å; Q442-A444 VanDerWaalsContact O-N 3.16Å; Q442-A445 HydrophobicContact CG-CB 4.28Å; Q442-A445 PolarHBondContact O-N 2.86Å; Q442-R446 WeakPolarHBondContact O-CG 3.43Å; Q442-R446 PolarHBondContact O-N 2.89Å
443	D	91.1	Very high	93.8	Very high	15 Å²	15	27.1 Å²	27.1	8%	0.08	14%	0.144	C	C	.	.	H	α-helix	trans	-58.7	-35.6	-171.7	-68	-12.4	0	0	0	114.2	A445 R446 I447 T483 K485 L489	D443-A445 VanDerWaalsContact C-N 3.34Å; D443-A445 PolarHBondContact O-N 3.36Å; D443-R446 PolarHBondContact O-N 3.02Å; D443-R446 IonicContact OD1-CZ 2.69Å; D443-R446 IonicContact OD1-NH1 3.36Å; D443-R446 PolarHBondContact OD1-NH1 3.26Å; D443-I447 WeakPolarHBondContact O-CG1 3.43Å; D443-I447 PolarHBondContact O-N 3.42Å; D443-I447 VanDerWaalsContact O-N 3.08Å; D443-T483 WeakPolarHBondContact OD2-CB 3.35Å; D443-T483 WeakPolarHBondContact OD2-CG2 3.39Å; D443-T483 PolarHBondContact OD2-OG1 3.23Å; D443-K485 HydrophobicContact CB-CB 4.02Å; D443-L489 HydrophobicContact CB-CD2 3.79Å; D443-L489 WeakPolarHBondContact OD1-CD2 3.35Å
444	A	91.5	Very high	93.8	Very high	15 Å²	15	26.7 Å²	26.7	12%	0.124	14%	0.143	C	C	.	.	H	α-helix	trans	-62.4	-39	175.9	0	0	0	0	0	112.9	D401 Q442	D401-A444 WeakPolarHBondContact OD1-CB 3.42Å; Q442-A444 VanDerWaalsContact C-N 3.3Å; Q442-A444 HydrophobicContact CG-CB 4.44Å; Q442-A444 PolarHBondContact O-N 2.73Å; Q442-A444 VanDerWaalsContact O-N 3.16Å
445	A	94.2	Very high	93.7	Very high	2 Å²	2	28.1 Å²	28.1	2%	0.017	16%	0.155	C	C	.	.	H	α-helix	trans	-76.5	-39.4	176.7	0	0	0	0	0	111.4	S398 L409 A441 Q442 D443 I447 L448 M449	S398-A445 WeakPolarHBondContact O-CB 3.38Å; L409-A445 HydrophobicContact CD2-CB 3.67Å; A441-A445 HydrophobicContact CB-CB 4.12Å; Q442-A445 HydrophobicContact CG-CB 4.28Å; Q442-A445 PolarHBondContact O-N 2.86Å; D443-A445 VanDerWaalsContact C-N 3.34Å; D443-A445 PolarHBondContact O-N 3.36Å; A445-I447 VanDerWaalsContact C-N 3.28Å; A445-I447 PolarHBondContact O-N 3.01Å; A445-L448 PolarHBondContact O-N 3.24Å; A445-M449 HydrophobicContact CB-CE 4.42Å; A445-M449 WeakPolarHBondContact O-CG 3.46Å; A445-M449 PolarHBondContact O-N 2.81Å
446	R	94.5	Very high	93.6	Very high	42 Å²	42	27.5 Å²	27.5	16%	0.158	15%	0.152	C	C	.	.	H	α-helix	trans	-55	-42.1	174.7	-69.6	178.8	176.9	154.7	-4.1	112.3	L438 H439 A441 Q442 D443 L448 M449 C450 L489	L438-R446 HydrophobicContact CD2-CG 4.23Å; L438-R446 PolarHBondContact O-NE 3.04Å; H439-R446 PolarHBondContact O-NH2 3.19Å; H439-R446 VanDerWaalsContact O-NH2 3.11Å; A441-R446 HydrophobicContact CB-CG 3.96Å; A441-R446 PolarHBondContact O-NE 3.3Å; A441-R446 PolarHBondContact O-NH2 3.25Å; Q442-R446 WeakPolarHBondContact O-CG 3.43Å; Q442-R446 PolarHBondContact O-N 2.89Å; D443-R446 PolarHBondContact O-N 3.02Å; D443-R446 IonicContact OD1-CZ 2.69Å; D443-R446 IonicContact OD1-NH1 3.36Å; D443-R446 PolarHBondContact OD1-NH1 3.26Å; R446-L448 VanDerWaalsContact C-N 3.34Å; R446-L448 PolarHBondContact O-N 3.03Å; R446-M449 PolarHBondContact O-N 2.9Å; R446-C450 WeakPolarHBondContact O-CB 3.46Å; R446-C450 PolarHBondContact O-N 2.84Å; R446-C450 PolarHBondContact O-SG 3.37Å; R446-L489 HydrophobicContact CB-CD1 3.63Å; R446-L489 HydrophobicContact CB-CD2 4.29Å
447	I	95.2	Very high	93.4	Very high	17 Å²	17	23 Å²	23	9%	0.087	13%	0.125	C	C	.	.	H	α-helix	trans	-56.8	-48.2	175	-71.1	161.3	0	0	0	111	D443 A445 C450 H451 K485 E488 L489	D443-I447 WeakPolarHBondContact O-CG1 3.43Å; D443-I447 PolarHBondContact O-N 3.42Å; D443-I447 VanDerWaalsContact O-N 3.08Å; A445-I447 VanDerWaalsContact C-N 3.28Å; A445-I447 PolarHBondContact O-N 3.01Å; I447-C450 PolarHBondContact O-N 3.44Å; I447-H451 PolarHBondContact O-N 3.01Å; I447-H451 PolarHBondContact O-ND1 2.81Å; I447-K485 HydrophobicContact CD1-CB 4.03Å; I447-E488 HydrophobicContact CD1-CB 3.82Å; I447-E488 HydrophobicContact CD1-CG 3.8Å; I447-E488 HydrophobicContact CG1-CG 4.28Å; I447-E488 HydrophobicContact CG2-CG 4.15Å; I447-L489 HydrophobicContact CD1-CB 4.29Å; I447-L489 HydrophobicContact CG1-CB 3.93Å; I447-L489 HydrophobicContact CG1-CD1 4.04Å
448	L	96.4	Very high	93	Very high	29 Å²	29	24 Å²	24	15%	0.152	13%	0.13	C	C	.	.	H	α-helix	trans	-66.9	-38.1	-179.6	-62.6	173.3	0	0	0	111.8	L409 K410 L413 A445 R446 H451 C452	L409-L448 HydrophobicContact CD2-CD1 3.93Å; L409-L448 HydrophobicContact CG-CD1 4.31Å; K410-L448 HydrophobicContact CD-CD2 4.5Å; K410-L448 HydrophobicContact CG-CD1 4.03Å; K410-L448 HydrophobicContact CG-CD2 4.12Å; L413-L448 HydrophobicContact CD1-CB 3.54Å; A445-L448 PolarHBondContact O-N 3.24Å; R446-L448 VanDerWaalsContact C-N 3.34Å; R446-L448 PolarHBondContact O-N 3.03Å; L448-H451 PolarHBondContact O-N 3.43Å; L448-C452 PolarHBondContact O-N 2.93Å
449	M	96.8	Very high	92.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64.8	-42.2	175	-67.2	175.8	-177.4	0	0	111.9	L394 S398 L413 L434 Q437 L438 A441 A445 R446 H451 C452 L453	L394-M449 HydrophobicContact CD2-CE 4.11Å; S398-M449 WeakPolarHBondContact OG-CE 3.31Å; L413-M449 HydrophobicContact CD2-CG 4.42Å; L434-M449 HydrophobicContact CD2-CB 4.47Å; L434-M449 HydrophobicContact CD2-CG 4.19Å; Q437-M449 HydrophobicContact CB-CE 4.36Å; Q437-M449 HydrophobicContact CG-CE 3.74Å; Q437-M449 HydrophobicContact CG-SD 4.47Å; L438-M449 HydrophobicContact CD1-CB 4.31Å; A441-M449 HydrophobicContact CB-CE 4.08Å; A441-M449 HydrophobicContact CB-SD 4.11Å; A445-M449 HydrophobicContact CB-CE 4.42Å; A445-M449 WeakPolarHBondContact O-CG 3.46Å; A445-M449 PolarHBondContact O-N 2.81Å; R446-M449 PolarHBondContact O-N 2.9Å; M449-H451 VanDerWaalsContact C-N 3.31Å; M449-H451 PolarHBondContact O-N 2.85Å; M449-C452 WeakPolarHBondContact O-CA 3.47Å; M449-C452 WeakPolarHBondContact O-CB 3.18Å; M449-C452 PolarHBondContact O-N 3.15Å; M449-C452 VanDerWaalsContact O-N 3.08Å; M449-L453 WeakPolarHBondContact O-CG 3.41Å; M449-L453 PolarHBondContact O-N 2.96Å
450	C	96.6	Very high	92.1	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-60.2	-41.2	174.1	-67.9	0	0	0	0	111.6	R446 I447 C452 L453 A454 L493 V496	R446-C450 WeakPolarHBondContact O-CB 3.46Å; R446-C450 PolarHBondContact O-N 2.84Å; R446-C450 PolarHBondContact O-SG 3.37Å; I447-C450 PolarHBondContact O-N 3.44Å; C450-C452 VanDerWaalsContact C-N 3.32Å; C450-C452 PolarHBondContact O-N 3.16Å; C450-L453 PolarHBondContact O-N 2.78Å; C450-A454 VanDerWaalsContact O-CB 3.27Å; C450-A454 WeakPolarHBondContact O-CB 3.4Å; C450-A454 PolarHBondContact O-N 2.98Å; C450-L493 WeakPolarHBondContact SG-CD2 3.02Å; C450-V496 HydrophobicContact CB-CG1 4.28Å
451	H	96	Very high	91.6	Very high	94 Å²	94	22.4 Å²	22.4	44%	0.435	12%	0.12	S	C	.	.	H	α-helix	trans	-63.2	-38	173.5	-65.9	155.8	0	0	0	112.5	I447 L448 M449 A455	I447-H451 PolarHBondContact O-N 3.01Å; I447-H451 PolarHBondContact O-ND1 2.81Å; L448-H451 PolarHBondContact O-N 3.43Å; M449-H451 VanDerWaalsContact C-N 3.31Å; M449-H451 PolarHBondContact O-N 2.85Å; H451-A455 WeakPolarHBondContact O-CB 3.39Å; H451-A455 PolarHBondContact O-N 2.92Å
452	C	96.4	Very high	91.1	Very high	5 Å²	5	28.1 Å²	28.1	3%	0.034	15%	0.154	C	C	.	.	H	α-helix	trans	-65.3	-49.8	175.9	-168.9	0	0	0	0	111.6	L413 L434 L448 M449 C450 A454 A455 I456	L413-C452 HydrophobicContact CB-CB 4.15Å; L413-C452 HydrophobicContact CD1-CB 4.49Å; L413-C452 HydrophobicContact CD2-CB 3.77Å; L413-C452 HydrophobicContact CG-CB 4.35Å; L434-C452 HydrophobicContact CD1-CB 4.3Å; L448-C452 PolarHBondContact O-N 2.93Å; M449-C452 WeakPolarHBondContact O-CA 3.47Å; M449-C452 WeakPolarHBondContact O-CB 3.18Å; M449-C452 PolarHBondContact O-N 3.15Å; M449-C452 VanDerWaalsContact O-N 3.08Å; C450-C452 VanDerWaalsContact C-N 3.32Å; C450-C452 PolarHBondContact O-N 3.16Å; C452-A454 PolarHBondContact O-N 3.09Å; C452-A455 WeakPolarHBondContact O-CB 3.45Å; C452-A455 PolarHBondContact O-N 2.89Å; C452-A455 VanDerWaalsContact O-N 3.15Å; C452-I456 WeakPolarHBondContact O-CG1 3.2Å; C452-I456 PolarHBondContact O-N 3.15Å
453	L	95.9	Very high	90.8	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-58.7	-46.6	176.5	-72.8	172.1	0	0	0	111.4	V431 L434 L435 L438 M449 C450 A455 I456 A457 M467 L471 V496	V431-L453 HydrophobicContact CB-CD2 4.48Å; V431-L453 HydrophobicContact CG1-CD2 4.1Å; V431-L453 HydrophobicContact CG2-CD2 4.23Å; L434-L453 HydrophobicContact CB-CD2 3.81Å; L434-L453 HydrophobicContact CB-CG 4.23Å; L434-L453 HydrophobicContact CD1-CD2 3.78Å; L434-L453 HydrophobicContact CD1-CG 4.14Å; L434-L453 HydrophobicContact CG-CD2 4.47Å; L435-L453 HydrophobicContact CD2-CD1 3.98Å; L438-L453 HydrophobicContact CD1-CD1 3.63Å; M449-L453 WeakPolarHBondContact O-CG 3.41Å; M449-L453 PolarHBondContact O-N 2.96Å; C450-L453 PolarHBondContact O-N 2.78Å; L453-A455 VanDerWaalsContact C-N 3.31Å; L453-A455 PolarHBondContact O-N 2.73Å; L453-I456 PolarHBondContact O-N 2.81Å; L453-A457 VanDerWaalsContact O-CB 3.26Å; L453-A457 WeakPolarHBondContact O-CB 3.37Å; L453-A457 PolarHBondContact O-N 2.69Å; L453-M467 HydrophobicContact CD2-SD 4.43Å; L453-L471 HydrophobicContact CD1-CD2 4.27Å; L453-V496 HydrophobicContact CB-CG2 3.72Å
454	A	93.4	Very high	90.4	Very high	13 Å²	13	25.8 Å²	25.8	11%	0.107	14%	0.143	C	C	.	.	H	α-helix	trans	-61.1	-40.5	176	0	0	0	0	0	111.8	C450 C452 M458 V496 V499	C450-A454 VanDerWaalsContact O-CB 3.27Å; C450-A454 WeakPolarHBondContact O-CB 3.4Å; C450-A454 PolarHBondContact O-N 2.98Å; C452-A454 PolarHBondContact O-N 3.09Å; A454-M458 WeakPolarHBondContact O-CG 3.37Å; A454-M458 PolarHBondContact O-N 3.37Å; A454-V496 HydrophobicContact CB-CB 4.2Å; A454-V496 HydrophobicContact CB-CG2 4.32Å; A454-V499 HydrophobicContact CB-CG2 4.48Å
455	A	92.1	Very high	89.9	Confident	30 Å²	30	29.5 Å²	29.5	25%	0.248	16%	0.161	C	C	.	.	H	α-helix	trans	-60.7	-52.6	175.5	0	0	0	0	0	110.7	V417 H451 C452 L453 M458 Q459	V417-A455 HydrophobicContact CG1-CB 4.13Å; V417-A455 HydrophobicContact CG2-CB 3.86Å; H451-A455 WeakPolarHBondContact O-CB 3.39Å; H451-A455 PolarHBondContact O-N 2.92Å; C452-A455 WeakPolarHBondContact O-CB 3.45Å; C452-A455 PolarHBondContact O-N 2.89Å; C452-A455 VanDerWaalsContact O-N 3.15Å; L453-A455 VanDerWaalsContact C-N 3.31Å; L453-A455 PolarHBondContact O-N 2.73Å; A455-M458 WeakPolarHBondContact O-CB 3.38Å; A455-M458 PolarHBondContact O-N 3.34Å; A455-Q459 PolarHBondContact O-NE2 3.2Å; A455-Q459 PolarHBondContact O-OE1 2.62Å
456	I	91.9	Very high	89.5	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-60.8	-48.4	-179	-65.5	170.1	0	0	0	111.7	V417 A420 V430 V431 L434 C452 L453 M458 Q459 L460 L463	V417-I456 HydrophobicContact CG2-CG1 4.15Å; A420-I456 HydrophobicContact CB-CD1 4.29Å; A420-I456 HydrophobicContact CB-CG1 4.13Å; A420-I456 HydrophobicContact CB-CG2 4.12Å; V430-I456 HydrophobicContact CG1-CD1 3.97Å; V431-I456 HydrophobicContact CG2-CG2 4.09Å; L434-I456 HydrophobicContact CD1-CD1 4.13Å; C452-I456 WeakPolarHBondContact O-CG1 3.2Å; C452-I456 PolarHBondContact O-N 3.15Å; L453-I456 PolarHBondContact O-N 2.81Å; I456-M458 VanDerWaalsContact C-N 3.25Å; I456-M458 PolarHBondContact O-N 3.5Å; I456-Q459 PolarHBondContact O-N 2.96Å; I456-L460 PolarHBondContact O-N 2.81Å; I456-L463 HydrophobicContact CG2-CD1 3.75Å
457	A	90.2	Very high	89.3	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.008	19%	0.185	C	C	.	.	H	α-helix	trans	-63.7	-29.3	-177.5	0	0	0	0	0	112.9	L453 Q459 L460 M467 V499	L453-A457 VanDerWaalsContact O-CB 3.26Å; L453-A457 WeakPolarHBondContact O-CB 3.37Å; L453-A457 PolarHBondContact O-N 2.69Å; A457-Q459 VanDerWaalsContact C-N 3.25Å; A457-Q459 PolarHBondContact O-N 2.67Å; A457-L460 CarbonylContact O-C 3.56Å; A457-L460 PolarHBondContact O-N 3Å; A457-M467 HydrophobicContact CB-CE 4.01Å; A457-V499 HydrophobicContact CB-CG1 3.7Å
458	M	86	Confident	89.1	Confident	43 Å²	43	31.6 Å²	31.6	21%	0.212	19%	0.19	C	C	.	.	H	α-helix	trans	-62.9	-30.6	173.1	-75.3	-68.5	-65.6	0	0	112.8	A454 A455 I456 V499 M536 R746	A454-M458 WeakPolarHBondContact O-CG 3.37Å; A454-M458 PolarHBondContact O-N 3.37Å; A455-M458 WeakPolarHBondContact O-CB 3.38Å; A455-M458 PolarHBondContact O-N 3.34Å; I456-M458 VanDerWaalsContact C-N 3.25Å; I456-M458 PolarHBondContact O-N 3.5Å; M458-V499 HydrophobicContact CG-CG1 3.85Å; M458-V499 HydrophobicContact CG-CG2 4.44Å; M458-V499 HydrophobicContact SD-CG1 3.89Å; M458-V499 HydrophobicContact SD-CG2 4.08Å; M458-M536 HydrophobicContact CE-CE 4.49Å; M458-M536 HydrophobicContact SD-CE 3.63Å; M458-M536 HydrophobicContact SD-SD 4.2Å; M458-R746 PolarHBondContact O-NH1 3.46Å; M458-R746 PolarHBondContact O-NH2 2.7Å
459	Q	81.9	Confident	88.7	Confident	46 Å²	46	32.5 Å²	32.5	22%	0.215	21%	0.207	C	C	.	.	H	α-helix	trans	-86.5	-35.2	175.1	-66.2	88.5	53.2	0	0	112.6	A455 I456 A457 P461 R746	A455-Q459 PolarHBondContact O-NE2 3.2Å; A455-Q459 PolarHBondContact O-OE1 2.62Å; I456-Q459 PolarHBondContact O-N 2.96Å; A457-Q459 VanDerWaalsContact C-N 3.25Å; A457-Q459 PolarHBondContact O-N 2.67Å; Q459-P461 WeakPolarHBondContact O-CD 3.49Å; Q459-R746 PolarHBondContact O-NH1 3.41Å
460	L	82.7	Confident	88.4	Confident	36 Å²	36	35.5 Å²	35.5	19%	0.188	22%	0.223	C	C	.	.			trans	-126.8	80.8	-173.2	-64.5	165.1	0	0	0	110.9	P424 S427 I456 A457 V462 L463	P424-L460 HydrophobicContact CB-CD1 4.4Å; P424-L460 HydrophobicContact CB-CD2 4.23Å; S427-L460 VanDerWaalsContact CB-CD1 3.44Å; I456-L460 PolarHBondContact O-N 2.81Å; A457-L460 CarbonylContact O-C 3.56Å; A457-L460 PolarHBondContact O-N 3Å; L460-V462 PolarHBondContact O-N 3.07Å; L460-V462 VanDerWaalsContact O-N 3.13Å; L460-L463 HydrophobicContact CB-CD1 3.61Å; L460-L463 HydrophobicContact CB-CG 4.09Å; L460-L463 HydrophobicContact CD1-CD1 4Å; L460-L463 HydrophobicContact CG-CD1 4.47Å; L460-L463 WeakPolarHBondContact O-CB 3.48Å; L460-L463 PolarHBondContact O-N 3.36Å; L460-L463 VanDerWaalsContact O-N 3.13Å
461	P	78.7	Confident	88.3	Confident	24 Å²	24	35.6 Å²	35.6	16%	0.156	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-29.1	-176	-28.2	36.8	0	0	0	114.5	Q459 L463 G464 Q502 E743 R746	Q459-P461 WeakPolarHBondContact O-CD 3.49Å; P461-L463 PolarHBondContact O-N 2.75Å; P461-L463 VanDerWaalsContact O-N 3.08Å; P461-G464 PolarHBondContact O-N 3.1Å; P461-Q502 HydrophobicContact CB-CG 4.3Å; P461-E743 HydrophobicContact CB-CG 4.32Å; P461-E743 HydrophobicContact CG-CB 4.3Å; P461-E743 HydrophobicContact CG-CG 3.84Å; P461-R746 VanDerWaalsContact CD-NH2 3.33Å
462	V	80.1	Confident	88	Confident	123 Å²	123	31.7 Å²	31.7	75%	0.745	21%	0.206	S	C	*	.	H	α-helix	trans	-57.4	-23.6	179.1	-61.2	0	0	0	0	113	L460	L460-V462 PolarHBondContact O-N 3.07Å; L460-V462 VanDerWaalsContact O-N 3.13Å
463	L	85.7	Confident	87.7	Confident	21 Å²	21	37 Å²	37	11%	0.11	23%	0.23	C	C	.	.	H	α-helix	trans	-79.7	-21.9	177.2	-56.7	169.8	0	0	0	112.3	S427 Q428 V431 I456 L460 P461 M467	S427-L463 WeakPolarHBondContact OG-CD1 3.44Å; Q428-L463 HydrophobicContact CB-CD2 4.27Å; V431-L463 HydrophobicContact CG2-CD1 4.06Å; I456-L463 HydrophobicContact CG2-CD1 3.75Å; L460-L463 HydrophobicContact CB-CD1 3.61Å; L460-L463 HydrophobicContact CB-CG 4.09Å; L460-L463 HydrophobicContact CD1-CD1 4Å; L460-L463 HydrophobicContact CG-CD1 4.47Å; L460-L463 WeakPolarHBondContact O-CB 3.48Å; L460-L463 PolarHBondContact O-N 3.36Å; L460-L463 VanDerWaalsContact O-N 3.13Å; P461-L463 PolarHBondContact O-N 2.75Å; P461-L463 VanDerWaalsContact O-N 3.08Å; L463-M467 HydrophobicContact CB-CE 3.81Å; L463-M467 WeakPolarHBondContact O-CE 3.31Å; L463-M467 PolarHBondContact O-N 3.29Å
464	G	83.2	Confident	87.4	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-63.6	-47.5	-175.3	0	0	0	0	0	113.1	P461 G466 M467 L468 A500	P461-G464 PolarHBondContact O-N 3.1Å; G464-G466 VanDerWaalsContact C-N 3.27Å; G464-G466 PolarHBondContact O-N 3.36Å; G464-M467 VanDerWaalsContact O-CG 3.25Å; G464-M467 WeakPolarHBondContact O-CG 3.32Å; G464-M467 PolarHBondContact O-N 3.07Å; G464-L468 PolarHBondContact O-N 3.38Å; G464-A500 CarbonylContact C-O 3.53Å
465	D	80.3	Confident	87.3	Confident	93 Å²	93	37 Å²	37	50%	0.497	23%	0.228	S	C	.	.	H	α-helix	trans	-61.8	-36.9	-178.3	-78.2	-17.2	0	0	0	111.8
466	G	84.9	Confident	87.1	Confident	66 Å²	66	40.9 Å²	40.9	68%	0.68	24%	0.239	S	C	*	.	H	α-helix	trans	-70.2	-29	179	0	0	0	0	0	114.4	G464	G464-G466 VanDerWaalsContact C-N 3.27Å; G464-G466 PolarHBondContact O-N 3.36Å
467	M	91.4	Very high	86.8	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-93.6	-12	-177.7	68.5	176.3	86.9	0	0	114.3	V431 L435 L453 A457 L463 G464 G469 D470 L471 V496 A500	V431-M467 HydrophobicContact CG1-CE 3.98Å; V431-M467 HydrophobicContact CG2-CE 4.37Å; L435-M467 HydrophobicContact CD1-CB 3.73Å; L435-M467 HydrophobicContact CD2-CB 4.06Å; L435-M467 HydrophobicContact CG-CB 4.46Å; L453-M467 HydrophobicContact CD2-SD 4.43Å; A457-M467 HydrophobicContact CB-CE 4.01Å; L463-M467 HydrophobicContact CB-CE 3.81Å; L463-M467 WeakPolarHBondContact O-CE 3.31Å; L463-M467 PolarHBondContact O-N 3.29Å; G464-M467 VanDerWaalsContact O-CG 3.25Å; G464-M467 WeakPolarHBondContact O-CG 3.32Å; G464-M467 PolarHBondContact O-N 3.07Å; M467-G469 VanDerWaalsContact C-N 3.32Å; M467-G469 PolarHBondContact O-N 3.09Å; M467-D470 PolarHBondContact O-N 3.42Å; M467-L471 HydrophobicContact CB-CD1 4.33Å; M467-L471 HydrophobicContact CG-CD1 3.8Å; M467-L471 VanDerWaalsContact O-CG 3.26Å; M467-L471 WeakPolarHBondContact O-CG 3.47Å; M467-L471 PolarHBondContact O-N 3.02Å; M467-L471 VanDerWaalsContact O-N 3.15Å; M467-L471 HydrophobicContact SD-CD1 3.97Å; M467-V496 HydrophobicContact SD-CG2 4.33Å; M467-A500 HydrophobicContact CG-CB 4Å; M467-A500 HydrophobicContact SD-CB 4.32Å
468	L	89.6	Confident	86.3	Confident	37 Å²	37	45.3 Å²	45.3	19%	0.194	27%	0.266	C	S	.	.	H	α-helix	trans	-62.6	-37	-170.5	-175.6	62.5	0	0	0	113.1	G464 M472 I497 A500	G464-L468 PolarHBondContact O-N 3.38Å; L468-M472 WeakPolarHBondContact O-CB 3.1Å; L468-M472 PolarHBondContact O-N 3.13Å; L468-I497 HydrophobicContact CD1-CG2 3.95Å; L468-A500 HydrophobicContact CD1-CB 4.35Å
469	G	89.5	Confident	85.5	Confident	49 Å²	49	43.8 Å²	43.8	51%	0.505	26%	0.261	S	S	.	.	H	α-helix	trans	-60.4	-56.1	178.2	0	0	0	0	0	112.3	M467 L471 M472 E473	M467-G469 VanDerWaalsContact C-N 3.32Å; M467-G469 PolarHBondContact O-N 3.09Å; G469-L471 VanDerWaalsContact C-N 3.32Å; G469-L471 PolarHBondContact O-N 2.82Å; G469-M472 PolarHBondContact O-N 3.32Å; G469-M472 VanDerWaalsContact O-N 3.12Å; G469-E473 PolarHBondContact O-N 3.03Å
470	D	91	Very high	84.9	Confident	63 Å²	63	52.4 Å²	52.4	34%	0.337	29%	0.291	S	S	.	.	H	α-helix	trans	-59.3	-42.3	179.9	-64.8	-9	0	0	0	112	L435 M467 M472 E473 L474	L435-D470 HydrophobicContact CD2-CB 4.34Å; M467-D470 PolarHBondContact O-N 3.42Å; D470-M472 VanDerWaalsContact C-N 3.32Å; D470-M472 PolarHBondContact O-N 3.47Å; D470-E473 PolarHBondContact O-N 2.71Å; D470-L474 PolarHBondContact O-N 3.15Å
471	L	92.7	Very high	84.2	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-62.6	-40	177.3	-69.4	173	0	0	0	111.9	L435 L453 M467 G469 Y475 L493 V496 I497 A500	L435-L471 HydrophobicContact CD2-CD2 4.43Å; L453-L471 HydrophobicContact CD1-CD2 4.27Å; M467-L471 HydrophobicContact CB-CD1 4.33Å; M467-L471 HydrophobicContact CG-CD1 3.8Å; M467-L471 VanDerWaalsContact O-CG 3.26Å; M467-L471 WeakPolarHBondContact O-CG 3.47Å; M467-L471 PolarHBondContact O-N 3.02Å; M467-L471 VanDerWaalsContact O-N 3.15Å; M467-L471 HydrophobicContact SD-CD1 3.97Å; G469-L471 VanDerWaalsContact C-N 3.32Å; G469-L471 PolarHBondContact O-N 2.82Å; L471-Y475 WeakPolarHBondContact O-CB 3.32Å; L471-Y475 PolarHBondContact O-N 3.16Å; L471-L493 HydrophobicContact CD2-CD2 4.43Å; L471-V496 HydrophobicContact CD1-CB 4.42Å; L471-V496 HydrophobicContact CD1-CG1 3.95Å; L471-V496 HydrophobicContact CD1-CG2 3.8Å; L471-V496 HydrophobicContact CD2-CG1 3.72Å; L471-V496 HydrophobicContact CD2-CG2 4.49Å; L471-V496 HydrophobicContact CG-CG1 4.43Å; L471-I497 HydrophobicContact CB-CD1 4.46Å; L471-I497 HydrophobicContact CB-CG1 3.81Å; L471-I497 HydrophobicContact CD1-CG1 4.46Å; L471-A500 HydrophobicContact CD1-CB 4.23Å
472	M	91.6	Very high	83.7	Confident	13 Å²	13	56 Å²	56	6%	0.064	33%	0.327	C	S	.	.	H	α-helix	trans	-71	-37.9	178.3	-169.6	58.2	58.9	0	0	111.9	L468 G469 D470 Y475 K476 I497 V512 I513	L468-M472 WeakPolarHBondContact O-CB 3.1Å; L468-M472 PolarHBondContact O-N 3.13Å; G469-M472 PolarHBondContact O-N 3.32Å; G469-M472 VanDerWaalsContact O-N 3.12Å; D470-M472 VanDerWaalsContact C-N 3.32Å; D470-M472 PolarHBondContact O-N 3.47Å; M472-Y475 PolarHBondContact O-N 3.02Å; M472-K476 WeakPolarHBondContact O-CG 3.46Å; M472-K476 PolarHBondContact O-N 3.36Å; M472-K476 VanDerWaalsContact O-N 3.11Å; M472-I497 HydrophobicContact CE-CD1 4.05Å; M472-I497 HydrophobicContact CE-CG2 3.95Å; M472-V512 HydrophobicContact SD-CB 4.08Å; M472-V512 HydrophobicContact SD-CG1 3.73Å; M472-I513 HydrophobicContact CE-CD1 4.35Å; M472-I513 HydrophobicContact CE-CG1 4.49Å
473	E	90	Very high	83.8	Confident	117 Å²	117	52.8 Å²	52.8	55%	0.547	31%	0.307	S	S	.	.	H	α-helix	trans	-60.6	-48.8	173.8	-176.2	169	-175.9	0	0	110.9	G469 D470 Y475 K476 V477	G469-E473 PolarHBondContact O-N 3.03Å; D470-E473 PolarHBondContact O-N 2.71Å; E473-Y475 VanDerWaalsContact C-N 3.3Å; E473-Y475 PolarHBondContact O-N 3.03Å; E473-K476 WeakPolarHBondContact O-CB 3.41Å; E473-K476 PolarHBondContact O-N 3.16Å; E473-K476 VanDerWaalsContact O-N 3.13Å; E473-V477 WeakPolarHBondContact O-CG2 3.48Å; E473-V477 PolarHBondContact O-N 2.61Å
474	L	89.8	Confident	83.7	Confident	11 Å²	11	58.1 Å²	58.1	6%	0.058	34%	0.336	C	S	.	.	H	α-helix	trans	-63.5	-37.1	177.6	-163.5	99.7	0	0	0	112.5	L438 D470 K476 V477 I478 L493	L438-L474 HydrophobicContact CD2-CD1 3.9Å; L438-L474 HydrophobicContact CD2-CD2 3.08Å; L438-L474 HydrophobicContact CD2-CG 4.03Å; D470-L474 PolarHBondContact O-N 3.15Å; L474-K476 VanDerWaalsContact C-N 3.28Å; L474-K476 PolarHBondContact O-N 2.94Å; L474-V477 PolarHBondContact O-N 2.77Å; L474-V477 VanDerWaalsContact O-N 3.14Å; L474-I478 PolarHBondContact O-N 3.05Å; L474-L493 HydrophobicContact CD2-CD1 3.82Å; L474-L493 HydrophobicContact CD2-CD2 3.47Å; L474-L493 VanDerWaalsContact CD2-CD2 3.47Å; L474-L493 HydrophobicContact CD2-CG 4.26Å
475	Y	90.8	Very high	84	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-60.9	-36.4	175.6	-162.8	-84.4	0	0	0	112.2	L471 M472 E473 I478 L490 L493 A494 I497 V512 I513 Q516	L471-Y475 WeakPolarHBondContact O-CB 3.32Å; L471-Y475 PolarHBondContact O-N 3.16Å; M472-Y475 PolarHBondContact O-N 3.02Å; E473-Y475 VanDerWaalsContact C-N 3.3Å; E473-Y475 PolarHBondContact O-N 3.03Å; Y475-I478 WeakPolarHBondContact O-CG2 3.44Å; Y475-L490 HydrophobicContact CE1-CD2 4.42Å; Y475-L490 HydrophobicContact CE2-CD2 3.93Å; Y475-L493 HydrophobicContact CD2-CB 3.69Å; Y475-L493 HydrophobicContact CD2-CD1 4.38Å; Y475-L493 HydrophobicContact CE2-CB 4.22Å; Y475-A494 HydrophobicContact CE2-CB 4.07Å; Y475-I497 HydrophobicContact CD2-CD1 3.84Å; Y475-I497 HydrophobicContact CG-CD1 4.09Å; Y475-V512 HydrophobicContact CD1-CG1 4.25Å; Y475-I513 HydrophobicContact CD1-CG1 4.38Å; Y475-I513 HydrophobicContact CE1-CB 4.29Å; Y475-I513 HydrophobicContact CE1-CG1 4.04Å; Y475-I513 HydrophobicContact CE1-CG2 4.47Å; Y475-Q516 HydrophobicContact CD1-CB 4.33Å; Y475-Q516 HydrophobicContact CD1-CG 4.35Å; Y475-Q516 HydrophobicContact CE1-CB 3.64Å; Y475-Q516 HydrophobicContact CE1-CG 3.76Å
476	K	88.3	Confident	84.4	Confident	113 Å²	113	58 Å²	58	49%	0.491	33%	0.331	S	S	.	.	H	α-helix	trans	-65.8	-37.8	174	-69.4	170.4	-179.8	174.4	0	112.4	M472 E473 L474 G479 V512	M472-K476 WeakPolarHBondContact O-CG 3.46Å; M472-K476 PolarHBondContact O-N 3.36Å; M472-K476 VanDerWaalsContact O-N 3.11Å; E473-K476 WeakPolarHBondContact O-CB 3.41Å; E473-K476 PolarHBondContact O-N 3.16Å; E473-K476 VanDerWaalsContact O-N 3.13Å; L474-K476 VanDerWaalsContact C-N 3.28Å; L474-K476 PolarHBondContact O-N 2.94Å; K476-G479 WeakPolarHBondContact O-CA 3.46Å; K476-V512 HydrophobicContact CD-CG1 4.39Å; K476-V512 HydrophobicContact CD-CG2 4.48Å; K476-V512 VanDerWaalsContact CE-CG2 3.45Å; K476-V512 HydrophobicContact CG-CG1 3.47Å; K476-V512 VanDerWaalsContact CG-CG1 3.47Å; K476-V512 HydrophobicContact CG-CG2 4.33Å
477	V	84.8	Confident	84.8	Confident	90 Å²	90	57 Å²	57	55%	0.545	31%	0.308	S	S	.	.	H	α-helix	trans	-78.1	-37.6	-175.8	-178.9	0	0	0	0	111.5	E473 L474 G479 R480	E473-V477 WeakPolarHBondContact O-CG2 3.48Å; E473-V477 PolarHBondContact O-N 2.61Å; L474-V477 PolarHBondContact O-N 2.77Å; L474-V477 VanDerWaalsContact O-N 3.14Å; V477-G479 VanDerWaalsContact C-N 3.28Å; V477-G479 WeakPolarHBondContact O-CA 3.4Å; V477-G479 PolarHBondContact O-N 2.85Å; V477-R480 PolarHBondContact O-N 3.22Å; V477-R480 VanDerWaalsContact O-N 3.09Å
478	I	80.7	Confident	84.9	Confident	5 Å²	5	59.9 Å²	59.9	3%	0.026	32%	0.322	C	S	.	.	H	α-helix	trans	-68.7	-29	-176.8	-153.4	58.4	0	0	0	113.4	L474 Y475 R480 S481 Q486 L489 L490 L493	L474-I478 PolarHBondContact O-N 3.05Å; Y475-I478 WeakPolarHBondContact O-CG2 3.44Å; I478-R480 PolarHBondContact O-N 2.85Å; I478-S481 PolarHBondContact O-N 3.3Å; I478-Q486 PolarHBondContact O-NE2 2.87Å; I478-L489 HydrophobicContact CD1-CD2 3.54Å; I478-L489 HydrophobicContact CG1-CD2 3.55Å; I478-L489 HydrophobicContact CG1-CG 4.09Å; I478-L490 HydrophobicContact CG2-CD2 3.7Å; I478-L493 HydrophobicContact CB-CD1 4.41Å; I478-L493 HydrophobicContact CG2-CD1 3.87Å
479	G	67.9	Low	85.1	Confident	10 Å²	10	58.1 Å²	58.1	10%	0.103	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn		34.7	-83.1	119.4	0	0	0	0	0	116.7	K476 V477 Q516	K476-G479 WeakPolarHBondContact O-CA 3.46Å; V477-G479 VanDerWaalsContact C-N 3.28Å; V477-G479 WeakPolarHBondContact O-CA 3.4Å; V477-G479 PolarHBondContact O-N 2.85Å; G479-Q516 VanDerWaalsContact C-NE2 3.32Å; G479-Q516 VanDerWaalsContact CA-OE1 3.23Å; G479-Q516 VanDerWaalsContact N-NE2 3.16Å; G479-Q516 PolarHBondContact O-NE2 2.81Å
480	R	69.6	Low	85.3	Confident	227 Å²	227	55.8 Å²	55.8	86%	0.857	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.6	-1.2	-156.7	-55.1	171.4	-176.2	177.7	-0.8	111.8	V477 I478	V477-R480 PolarHBondContact O-N 3.22Å; V477-R480 VanDerWaalsContact O-N 3.09Å; I478-R480 PolarHBondContact O-N 2.85Å
481	S	68.1	Low	85.5	Confident	35 Å²	35	52.9 Å²	52.9	25%	0.245	27%	0.273	C	S	.	.			trans	-87.2	126.5	-177.2	-172.9	0	0	0	0	111.1	I478 Q486	I478-S481 PolarHBondContact O-N 3.3Å; S481-Q486 WeakPolarHBondContact O-CG 2.89Å; S481-Q486 PolarHBondContact O-NE2 2.88Å; S481-Q486 PolarHBondContact O-OE1 3.19Å
482	A	68.8	Low	85.6	Confident	102 Å²	102	52.9 Å²	52.9	84%	0.843	27%	0.273	S	S	*	.			trans	-104	56.2	179.5	0	0	0	0	0	112
483	T	82.3	Confident	85.8	Confident	54 Å²	54	52.2 Å²	52.2	33%	0.331	27%	0.27	S	S	.	.			trans	-92.9	155.1	177.6	60.1	0	0	0	0	112.1	D443 K485 Q486	D443-T483 WeakPolarHBondContact OD2-CB 3.35Å; D443-T483 WeakPolarHBondContact OD2-CG2 3.39Å; D443-T483 PolarHBondContact OD2-OG1 3.23Å; T483-K485 PolarHBondContact O-N 3.05Å; T483-K485 VanDerWaalsContact O-N 3.13Å; T483-Q486 VanDerWaalsContact O-CB 3.3Å; T483-Q486 WeakPolarHBondContact O-CB 3.11Å; T483-Q486 PolarHBondContact O-N 2.98Å; T483-Q486 VanDerWaalsContact O-N 3.1Å; T483-Q486 PolarHBondContact OG1-N 3.2Å
484	D	83.8	Confident	86	Confident	134 Å²	134	46.7 Å²	46.7	72%	0.717	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-18.1	173.7	73.4	-43.7	0	0	0	112.7
485	K	87.6	Confident	86.3	Confident	78 Å²	78	46.8 Å²	46.8	34%	0.339	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-7.3	177.3	-57.7	-49.1	-177.4	-132.9	0	114.6	D443 I447 T483 Q487 E488 L489	D443-K485 HydrophobicContact CB-CB 4.02Å; I447-K485 HydrophobicContact CD1-CB 4.03Å; T483-K485 PolarHBondContact O-N 3.05Å; T483-K485 VanDerWaalsContact O-N 3.13Å; K485-Q487 VanDerWaalsContact C-N 3.25Å; K485-Q487 PolarHBondContact O-N 2.69Å; K485-Q487 VanDerWaalsContact O-N 3.15Å; K485-E488 PolarHBondContact O-N 3.22Å; K485-E488 VanDerWaalsContact O-N 3.09Å; K485-L489 PolarHBondContact O-N 3.39Å
486	Q	90.5	Very high	86.4	Confident	12 Å²	12	46.8 Å²	46.8	6%	0.056	25%	0.245	C	C	.	.	H	α-helix	trans	-52.5	-43.6	-173.2	-171.7	-166.8	27.1	0	0	112.5	I478 S481 T483 E488 L489 L490	I478-Q486 PolarHBondContact O-NE2 2.87Å; S481-Q486 WeakPolarHBondContact O-CG 2.89Å; S481-Q486 PolarHBondContact O-NE2 2.88Å; S481-Q486 PolarHBondContact O-OE1 3.19Å; T483-Q486 VanDerWaalsContact O-CB 3.3Å; T483-Q486 WeakPolarHBondContact O-CB 3.11Å; T483-Q486 PolarHBondContact O-N 2.98Å; T483-Q486 VanDerWaalsContact O-N 3.1Å; T483-Q486 PolarHBondContact OG1-N 3.2Å; Q486-E488 PolarHBondContact O-N 3.07Å; Q486-L489 PolarHBondContact O-N 3.48Å; Q486-L490 HydrophobicContact CG-CD1 4.29Å; Q486-L490 WeakPolarHBondContact O-CG 3.43Å; Q486-L490 PolarHBondContact O-N 3.13Å
487	Q	92	Very high	86.7	Confident	44 Å²	44	41.4 Å²	41.4	21%	0.206	22%	0.222	C	C	.	.	H	α-helix	trans	-62.4	-45.6	-179	-60.6	-59.7	-49.5	0	0	112.1	K485 L489 V491 V520 T525	K485-Q487 VanDerWaalsContact C-N 3.25Å; K485-Q487 PolarHBondContact O-N 2.69Å; K485-Q487 VanDerWaalsContact O-N 3.15Å; Q487-L489 VanDerWaalsContact C-N 3.35Å; Q487-V491 WeakPolarHBondContact O-CG2 3.49Å; Q487-V491 PolarHBondContact O-N 3.33Å; Q487-V520 PolarHBondContact NE2-O 3.26Å; Q487-T525 WeakPolarHBondContact CB-OG1 3.31Å; Q487-T525 VanDerWaalsContact OE1-CB 3.3Å; Q487-T525 PolarHBondContact OE1-OG1 2.89Å
488	E	93.9	Very high	87.1	Confident	62 Å²	62	37.1 Å²	37.1	29%	0.29	20%	0.196	S	C	.	.	H	α-helix	trans	-68.7	-36.1	178	-170.9	64.5	-149.8	0	0	111.7	I447 K485 Q486 V491 S492 R528	I447-E488 HydrophobicContact CD1-CB 3.82Å; I447-E488 HydrophobicContact CD1-CG 3.8Å; I447-E488 HydrophobicContact CG1-CG 4.28Å; I447-E488 HydrophobicContact CG2-CG 4.15Å; K485-E488 PolarHBondContact O-N 3.22Å; K485-E488 VanDerWaalsContact O-N 3.09Å; Q486-E488 PolarHBondContact O-N 3.07Å; E488-V491 PolarHBondContact O-N 3.35Å; E488-S492 WeakPolarHBondContact O-CB 3.24Å; E488-S492 PolarHBondContact O-N 3.36Å; E488-S492 PolarHBondContact O-OG 3.04Å; E488-R528 VanDerWaalsContact CD-NH2 3.28Å; E488-R528 IonicContact OE1-CZ 3.03Å; E488-R528 IonicContact OE1-NH1 3.95Å; E488-R528 IonicContact OE1-NH2 2.69Å; E488-R528 PolarHBondContact OE1-NH2 2.75Å; E488-R528 IonicContact OE2-CZ 2.61Å; E488-R528 VanDerWaalsContact OE2-CZ 3.31Å; E488-R528 IonicContact OE2-NH1 3.44Å; E488-R528 PolarHBondContact OE2-NH1 2.87Å; E488-R528 IonicContact OE2-NH2 3.55Å; E488-R528 PolarHBondContact OE2-NH2 3.33Å; E488-R528 VanDerWaalsContact OE2-NH2 3.07Å
489	L	93.3	Very high	87.6	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-67.1	-42.3	177.1	-179.3	54.6	0	0	0	111.9	D443 R446 I447 I478 K485 Q486 Q487 V491 S492 L493	D443-L489 HydrophobicContact CB-CD2 3.79Å; D443-L489 WeakPolarHBondContact OD1-CD2 3.35Å; R446-L489 HydrophobicContact CB-CD1 3.63Å; R446-L489 HydrophobicContact CB-CD2 4.29Å; I447-L489 HydrophobicContact CD1-CB 4.29Å; I447-L489 HydrophobicContact CG1-CB 3.93Å; I447-L489 HydrophobicContact CG1-CD1 4.04Å; I478-L489 HydrophobicContact CD1-CD2 3.54Å; I478-L489 HydrophobicContact CG1-CD2 3.55Å; I478-L489 HydrophobicContact CG1-CG 4.09Å; K485-L489 PolarHBondContact O-N 3.39Å; Q486-L489 PolarHBondContact O-N 3.48Å; Q487-L489 VanDerWaalsContact C-N 3.35Å; L489-V491 VanDerWaalsContact C-N 3.33Å; L489-V491 PolarHBondContact O-N 2.98Å; L489-S492 PolarHBondContact O-N 3.37Å; L489-S492 VanDerWaalsContact O-N 3.14Å; L489-L493 HydrophobicContact CD1-CD1 3.88Å; L489-L493 HydrophobicContact CD1-CG 3.94Å; L489-L493 HydrophobicContact CG-CD1 3.88Å; L489-L493 HydrophobicContact CG-CG 4.42Å; L489-L493 WeakPolarHBondContact O-CB 3.39Å; L489-L493 WeakPolarHBondContact O-CG 3.48Å; L489-L493 PolarHBondContact O-N 2.85Å
490	L	94.1	Very high	88.6	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-57.7	-45.1	172.6	-75.4	171.2	0	0	0	111.5	Y475 I478 Q486 S492 A494 Q516 V520 T525	Y475-L490 HydrophobicContact CE1-CD2 4.42Å; Y475-L490 HydrophobicContact CE2-CD2 3.93Å; I478-L490 HydrophobicContact CG2-CD2 3.7Å; Q486-L490 HydrophobicContact CG-CD1 4.29Å; Q486-L490 WeakPolarHBondContact O-CG 3.43Å; Q486-L490 PolarHBondContact O-N 3.13Å; L490-S492 VanDerWaalsContact C-N 3.34Å; L490-S492 PolarHBondContact O-N 3Å; L490-A494 VanDerWaalsContact O-CB 3.29Å; L490-A494 WeakPolarHBondContact O-CB 3.43Å; L490-A494 PolarHBondContact O-N 3Å; L490-Q516 HydrophobicContact CD2-CG 3.8Å; L490-V520 HydrophobicContact CD1-CG1 3.79Å; L490-T525 HydrophobicContact CB-CG2 4.3Å
491	V	95.3	Very high	89.4	Confident	2 Å²	2	26.4 Å²	26.4	1%	0.012	15%	0.154	C	C	.	.	H	α-helix	trans	-60.6	-45.7	174.8	178.4	0	0	0	0	110.9	Q487 E488 L489 T495 T525 R528 I529	Q487-V491 WeakPolarHBondContact O-CG2 3.49Å; Q487-V491 PolarHBondContact O-N 3.33Å; E488-V491 PolarHBondContact O-N 3.35Å; L489-V491 VanDerWaalsContact C-N 3.33Å; L489-V491 PolarHBondContact O-N 2.98Å; V491-T495 WeakPolarHBondContact O-CB 3.28Å; V491-T495 PolarHBondContact O-N 3.49Å; V491-T495 PolarHBondContact O-OG1 2.5Å; V491-T525 HydrophobicContact CG2-CG2 3.87Å; V491-R528 HydrophobicContact CG1-CB 4.15Å; V491-R528 HydrophobicContact CG2-CB 3.96Å; V491-I529 HydrophobicContact CB-CG1 4.48Å; V491-I529 HydrophobicContact CG2-CG1 4.16Å
492	S	95.7	Very high	89.5	Confident	1 Å²	1	26 Å²	26	1%	0.007	15%	0.149	C	C	.	.	H	α-helix	trans	-65.3	-44.1	-175.8	-56.7	0	0	0	0	111.7	E488 L489 L490 T495 V496	E488-S492 WeakPolarHBondContact O-CB 3.24Å; E488-S492 PolarHBondContact O-N 3.36Å; E488-S492 PolarHBondContact O-OG 3.04Å; L489-S492 PolarHBondContact O-N 3.37Å; L489-S492 VanDerWaalsContact O-N 3.14Å; L490-S492 VanDerWaalsContact C-N 3.34Å; L490-S492 PolarHBondContact O-N 3Å; S492-T495 WeakPolarHBondContact O-CB 3.22Å; S492-T495 PolarHBondContact O-N 3.38Å; S492-V496 PolarHBondContact O-N 3.23Å
493	L	94.7	Very high	89.5	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-65.9	-47.8	176.5	-72.5	164.1	0	0	0	111.9	C450 L471 L474 Y475 I478 L489 T495 V496 I497	C450-L493 WeakPolarHBondContact SG-CD2 3.02Å; L471-L493 HydrophobicContact CD2-CD2 4.43Å; L474-L493 HydrophobicContact CD2-CD1 3.82Å; L474-L493 HydrophobicContact CD2-CD2 3.47Å; L474-L493 VanDerWaalsContact CD2-CD2 3.47Å; L474-L493 HydrophobicContact CD2-CG 4.26Å; Y475-L493 HydrophobicContact CD2-CB 3.69Å; Y475-L493 HydrophobicContact CD2-CD1 4.38Å; Y475-L493 HydrophobicContact CE2-CB 4.22Å; I478-L493 HydrophobicContact CB-CD1 4.41Å; I478-L493 HydrophobicContact CG2-CD1 3.87Å; L489-L493 HydrophobicContact CD1-CD1 3.88Å; L489-L493 HydrophobicContact CD1-CG 3.94Å; L489-L493 HydrophobicContact CG-CD1 3.88Å; L489-L493 HydrophobicContact CG-CG 4.42Å; L489-L493 WeakPolarHBondContact O-CB 3.39Å; L489-L493 WeakPolarHBondContact O-CG 3.48Å; L489-L493 PolarHBondContact O-N 2.85Å; L493-T495 PolarHBondContact O-N 3.38Å; L493-V496 WeakPolarHBondContact O-CG1 3.22Å; L493-V496 PolarHBondContact O-N 2.92Å; L493-I497 WeakPolarHBondContact O-CB 3.08Å; L493-I497 VanDerWaalsContact O-CG1 3.25Å; L493-I497 WeakPolarHBondContact O-CG1 3.26Å; L493-I497 PolarHBondContact O-N 3.18Å
494	A	94.7	Very high	89.1	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.2	-38.8	176.2	0	0	0	0	0	111.4	Y475 L490 I497 F498 I529	Y475-A494 HydrophobicContact CE2-CB 4.07Å; L490-A494 VanDerWaalsContact O-CB 3.29Å; L490-A494 WeakPolarHBondContact O-CB 3.43Å; L490-A494 PolarHBondContact O-N 3Å; A494-I497 PolarHBondContact O-N 3.33Å; A494-F498 HydrophobicContact CB-CE2 4.05Å; A494-F498 HydrophobicContact CB-CZ 4.35Å; A494-F498 WeakPolarHBondContact O-CD2 3.29Å; A494-F498 WeakPolarHBondContact O-CG 3.43Å; A494-F498 PolarHBondContact O-N 3.4Å; A494-I529 HydrophobicContact CB-CB 4.47Å; A494-I529 HydrophobicContact CB-CD1 4.01Å; A494-I529 HydrophobicContact CB-CG1 3.89Å; A494-I529 HydrophobicContact CB-CG2 3.83Å
495	T	94.8	Very high	89.1	Confident	13 Å²	13	24.1 Å²	24.1	8%	0.08	13%	0.126	C	C	.	.	H	α-helix	trans	-60.6	-48.5	176.7	-56.6	0	0	0	0	111.4	V491 S492 L493 F498 V499 Q532	V491-T495 WeakPolarHBondContact O-CB 3.28Å; V491-T495 PolarHBondContact O-N 3.49Å; V491-T495 PolarHBondContact O-OG1 2.5Å; S492-T495 WeakPolarHBondContact O-CB 3.22Å; S492-T495 PolarHBondContact O-N 3.38Å; L493-T495 PolarHBondContact O-N 3.38Å; T495-F498 PolarHBondContact O-N 3.25Å; T495-V499 VanDerWaalsContact O-CG2 3.27Å; T495-V499 WeakPolarHBondContact O-CG2 3.47Å; T495-V499 PolarHBondContact O-N 3.45Å; T495-Q532 HydrophobicContact CG2-CG 4.3Å; T495-Q532 WeakPolarHBondContact OG1-CG 3.39Å
496	V	94.6	Very high	89.1	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-69.1	-35	179	63.8	0	0	0	0	111.9	C450 L453 A454 M467 L471 S492 L493 F498 V499 A500	C450-V496 HydrophobicContact CB-CG1 4.28Å; L453-V496 HydrophobicContact CB-CG2 3.72Å; A454-V496 HydrophobicContact CB-CB 4.2Å; A454-V496 HydrophobicContact CB-CG2 4.32Å; M467-V496 HydrophobicContact SD-CG2 4.33Å; L471-V496 HydrophobicContact CD1-CB 4.42Å; L471-V496 HydrophobicContact CD1-CG1 3.95Å; L471-V496 HydrophobicContact CD1-CG2 3.8Å; L471-V496 HydrophobicContact CD2-CG1 3.72Å; L471-V496 HydrophobicContact CD2-CG2 4.49Å; L471-V496 HydrophobicContact CG-CG1 4.43Å; S492-V496 PolarHBondContact O-N 3.23Å; L493-V496 WeakPolarHBondContact O-CG1 3.22Å; L493-V496 PolarHBondContact O-N 2.92Å; V496-F498 PolarHBondContact O-N 3.36Å; V496-V499 PolarHBondContact O-N 3.4Å; V496-A500 VanDerWaalsContact O-CB 3.26Å; V496-A500 WeakPolarHBondContact O-CB 3.41Å; V496-A500 PolarHBondContact O-N 3.45Å
497	I	94.5	Very high	88.8	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.2	-46.2	172.7	-72.1	164.9	0	0	0	110.8	L468 L471 M472 Y475 L493 A494 V499 A500 S501 L505 I513	L468-I497 HydrophobicContact CD1-CG2 3.95Å; L471-I497 HydrophobicContact CB-CD1 4.46Å; L471-I497 HydrophobicContact CB-CG1 3.81Å; L471-I497 HydrophobicContact CD1-CG1 4.46Å; M472-I497 HydrophobicContact CE-CD1 4.05Å; M472-I497 HydrophobicContact CE-CG2 3.95Å; Y475-I497 HydrophobicContact CD2-CD1 3.84Å; Y475-I497 HydrophobicContact CG-CD1 4.09Å; L493-I497 WeakPolarHBondContact O-CB 3.08Å; L493-I497 VanDerWaalsContact O-CG1 3.25Å; L493-I497 WeakPolarHBondContact O-CG1 3.26Å; L493-I497 PolarHBondContact O-N 3.18Å; A494-I497 PolarHBondContact O-N 3.33Å; I497-V499 VanDerWaalsContact C-N 3.29Å; I497-V499 PolarHBondContact O-N 2.77Å; I497-A500 PolarHBondContact O-N 2.95Å; I497-S501 VanDerWaalsContact O-CB 3.3Å; I497-S501 WeakPolarHBondContact O-CB 3.33Å; I497-S501 PolarHBondContact O-N 3.31Å; I497-L505 HydrophobicContact CG2-CD2 4.04Å; I497-I513 HydrophobicContact CG2-CD1 4.32Å
498	F	92.7	Very high	88.5	Confident	1 Å²	1	34 Å²	34	0%	0.004	19%	0.188	C	C	.	.	H	α-helix	trans	-67.6	-28.7	177.6	-60.9	-36.7	0	0	0	113.3	A494 T495 V496 L505 I513 I529 Q532 A533 M536 N538 M541	A494-F498 HydrophobicContact CB-CE2 4.05Å; A494-F498 HydrophobicContact CB-CZ 4.35Å; A494-F498 WeakPolarHBondContact O-CD2 3.29Å; A494-F498 WeakPolarHBondContact O-CG 3.43Å; A494-F498 PolarHBondContact O-N 3.4Å; T495-F498 PolarHBondContact O-N 3.25Å; V496-F498 PolarHBondContact O-N 3.36Å; F498-L505 HydrophobicContact CD1-CD1 3.81Å; F498-L505 HydrophobicContact CE1-CD1 3.64Å; F498-I513 HydrophobicContact CE1-CD1 4.13Å; F498-I529 HydrophobicContact CE2-CG2 3.7Å; F498-I529 WeakPolarHBondContact CE2-O 3.37Å; F498-I529 HydrophobicContact CZ-CG2 3.83Å; F498-Q532 HydrophobicContact CD2-CB 4.12Å; F498-Q532 HydrophobicContact CE2-CB 4.5Å; F498-A533 HydrophobicContact CD2-CB 4.01Å; F498-A533 HydrophobicContact CE1-CB 4.26Å; F498-A533 HydrophobicContact CE2-CB 3.65Å; F498-A533 HydrophobicContact CG-CB 4.46Å; F498-A533 HydrophobicContact CZ-CB 3.8Å; F498-M536 HydrophobicContact CB-CB 3.96Å; F498-M536 HydrophobicContact CB-CG 3.9Å; F498-N538 HydrophobicContact CD1-CB 4.43Å; F498-N538 PolarHBondContact O-ND2 2.63Å; F498-M541 HydrophobicContact CE1-CG 4.49Å
499	V	90.9	Very high	88.2	Confident	5 Å²	5	31.7 Å²	31.7	3%	0.03	18%	0.179	C	C	.	.	H	α-helix	trans	-75.9	-38.4	174.2	171.7	0	0	0	0	111.5	A454 A457 M458 T495 V496 I497 Q502 M536	A454-V499 HydrophobicContact CB-CG2 4.48Å; A457-V499 HydrophobicContact CB-CG1 3.7Å; M458-V499 HydrophobicContact CG-CG1 3.85Å; M458-V499 HydrophobicContact CG-CG2 4.44Å; M458-V499 HydrophobicContact SD-CG1 3.89Å; M458-V499 HydrophobicContact SD-CG2 4.08Å; T495-V499 VanDerWaalsContact O-CG2 3.27Å; T495-V499 WeakPolarHBondContact O-CG2 3.47Å; T495-V499 PolarHBondContact O-N 3.45Å; V496-V499 PolarHBondContact O-N 3.4Å; I497-V499 VanDerWaalsContact C-N 3.29Å; I497-V499 PolarHBondContact O-N 2.77Å; V499-Q502 PolarHBondContact O-NE2 2.9Å; V499-M536 HydrophobicContact CB-CE 4.37Å; V499-M536 HydrophobicContact CG2-CE 3.79Å; V499-M536 HydrophobicContact CG2-CG 4.08Å; V499-M536 HydrophobicContact CG2-SD 3.73Å
500	A	88.8	Confident	88	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-69.7	-38.5	179	0	0	0	0	0	111.8	G464 M467 L468 L471 V496 I497 Q502	G464-A500 CarbonylContact C-O 3.53Å; M467-A500 HydrophobicContact CG-CB 4Å; M467-A500 HydrophobicContact SD-CB 4.32Å; L468-A500 HydrophobicContact CD1-CB 4.35Å; L471-A500 HydrophobicContact CD1-CB 4.23Å; V496-A500 VanDerWaalsContact O-CB 3.26Å; V496-A500 WeakPolarHBondContact O-CB 3.41Å; V496-A500 PolarHBondContact O-N 3.45Å; I497-A500 PolarHBondContact O-N 2.95Å; A500-Q502 PolarHBondContact O-N 3.46Å; A500-Q502 VanDerWaalsContact O-N 3.08Å; A500-Q502 PolarHBondContact O-NE2 3.39Å
501	S	85.7	Confident	87.8	Confident	12 Å²	12	36.4 Å²	36.4	8%	0.084	21%	0.21	C	C	.	.			trans	-74.3	94.4	179.6	-168.8	0	0	0	0	111.3	I497 K503 L505	I497-S501 VanDerWaalsContact O-CB 3.3Å; I497-S501 WeakPolarHBondContact O-CB 3.33Å; I497-S501 PolarHBondContact O-N 3.31Å; S501-K503 VanDerWaalsContact C-N 3.28Å; S501-K503 PolarHBondContact OG-O 3.37Å; S501-L505 WeakPolarHBondContact OG-CD2 3.2Å
502	Q	70.1	Confident	87.5	Confident	27 Å²	27	37.5 Å²	37.5	13%	0.126	22%	0.217	C	C	.	.			trans	-72.9	-24.2	174.1	-49	-51.7	-41	0	0	112.1	P461 V499 A500 E743 R747	P461-Q502 HydrophobicContact CB-CG 4.3Å; V499-Q502 PolarHBondContact O-NE2 2.9Å; A500-Q502 PolarHBondContact O-N 3.46Å; A500-Q502 VanDerWaalsContact O-N 3.08Å; A500-Q502 PolarHBondContact O-NE2 3.39Å; Q502-E743 PolarHBondContact OE1-OE1 3.17Å; Q502-E743 PolarHBondContact OE1-OE2 3.46Å; Q502-R747 PolarHBondContact O-NH2 3.2Å
503	K	69.5	Low	87.2	Confident	159 Å²	159	37.5 Å²	37.5	69%	0.691	22%	0.217	S	C	*	.	S	Bend	trans	-102.8	168.3	178	-62.1	177	-174.3	172	0	110.1	S501 L505	S501-K503 VanDerWaalsContact C-N 3.28Å; S501-K503 PolarHBondContact OG-O 3.37Å; K503-L505 PolarHBondContact O-N 3.07Å
504	A	74.8	Confident	86.9	Confident	84 Å²	84	41 Å²	41	69%	0.694	23%	0.232	S	C	*	.	P	Polyproline II helix	trans	-55.8	130.4	168.4	0	0	0	0	0	109.8
505	L	83.1	Confident	86.5	Confident	7 Å²	7	47.8 Å²	47.8	4%	0.037	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-53.6	143.4	177.8	-74.1	169	0	0	0	111.4	I497 F498 S501 K503 K510 I513 M541	I497-L505 HydrophobicContact CG2-CD2 4.04Å; F498-L505 HydrophobicContact CD1-CD1 3.81Å; F498-L505 HydrophobicContact CE1-CD1 3.64Å; S501-L505 WeakPolarHBondContact OG-CD2 3.2Å; K503-L505 PolarHBondContact O-N 3.07Å; L505-K510 HydrophobicContact CB-CG 3.9Å; L505-K510 WeakPolarHBondContact O-CE 3.37Å; L505-K510 PolarHBondContact O-NZ 2.72Å; L505-K510 VanDerWaalsContact O-NZ 3.12Å; L505-I513 HydrophobicContact CD1-CD1 4.21Å; L505-M541 HydrophobicContact CD1-CG 3.89Å
506	S	86.5	Confident	86.1	Confident	60 Å²	60	48.2 Å²	48.2	42%	0.42	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-64	152.9	173.8	68.4	0	0	0	0	111.1	E508 S509 K510	S506-E508 PolarHBondContact O-N 3.09Å; S506-S509 WeakPolarHBondContact O-CB 3.43Å; S506-S509 PolarHBondContact O-N 3.08Å; S506-S509 VanDerWaalsContact O-N 3.1Å; S506-S509 WeakPolarHBondContact OG-CB 3.43Å; S506-S509 PolarHBondContact OG-N 3.47Å; S506-S509 PolarHBondContact OG-OG 3.27Å; S506-K510 WeakPolarHBondContact O-CG 3.33Å; S506-K510 PolarHBondContact O-N 3Å
507	V	86.3	Confident	85.8	Confident	120 Å²	120	48.6 Å²	48.6	73%	0.727	27%	0.267	S	S	*	.	H	α-helix	trans	-55.8	-39.9	179	179.8	0	0	0	0	111.3	K510 A511	V507-K510 PolarHBondContact O-N 2.82Å; V507-A511 WeakPolarHBondContact O-CB 3.12Å; V507-A511 PolarHBondContact O-N 2.85Å
508	E	85.3	Confident	85.4	Confident	160 Å²	160	54.8 Å²	54.8	75%	0.748	30%	0.296	S	S	*	.	H	α-helix	trans	-62.6	-44.9	176.7	-62	174.3	-172	0	0	112.4	S506 K510 A511 V512	S506-E508 PolarHBondContact O-N 3.09Å; E508-K510 VanDerWaalsContact C-N 3.32Å; E508-K510 PolarHBondContact O-N 2.74Å; E508-A511 PolarHBondContact O-N 2.81Å; E508-V512 VanDerWaalsContact O-CG2 3.31Å; E508-V512 WeakPolarHBondContact O-CG2 3.07Å; E508-V512 PolarHBondContact O-N 2.9Å
509	S	87.8	Confident	84.9	Confident	15 Å²	15	59.1 Å²	59.1	11%	0.105	33%	0.326	C	S	.	.	H	α-helix	trans	-62.2	-41.4	177.6	-61.9	0	0	0	0	111.6	S506 V512 I513	S506-S509 WeakPolarHBondContact O-CB 3.43Å; S506-S509 PolarHBondContact O-N 3.08Å; S506-S509 VanDerWaalsContact O-N 3.1Å; S506-S509 WeakPolarHBondContact OG-CB 3.43Å; S506-S509 PolarHBondContact OG-N 3.47Å; S506-S509 PolarHBondContact OG-OG 3.27Å; S509-V512 PolarHBondContact O-N 2.64Å; S509-I513 WeakPolarHBondContact O-CG1 3.29Å; S509-I513 PolarHBondContact O-N 2.88Å
510	K	89.1	Confident	84.6	Confident	43 Å²	43	61.1 Å²	61.1	19%	0.187	34%	0.338	C	S	.	.	H	α-helix	trans	-63.3	-44.9	176.7	-63.8	176.3	-179.5	159.1	0	111.4	L505 S506 V507 E508 V512 I513 K514 D540 M541	L505-K510 HydrophobicContact CB-CG 3.9Å; L505-K510 WeakPolarHBondContact O-CE 3.37Å; L505-K510 PolarHBondContact O-NZ 2.72Å; L505-K510 VanDerWaalsContact O-NZ 3.12Å; S506-K510 WeakPolarHBondContact O-CG 3.33Å; S506-K510 PolarHBondContact O-N 3Å; V507-K510 PolarHBondContact O-N 2.82Å; E508-K510 VanDerWaalsContact C-N 3.32Å; E508-K510 PolarHBondContact O-N 2.74Å; K510-V512 VanDerWaalsContact C-N 3.35Å; K510-V512 PolarHBondContact O-N 2.93Å; K510-I513 PolarHBondContact O-N 3.39Å; K510-K514 WeakPolarHBondContact O-CB 3.44Å; K510-K514 PolarHBondContact O-N 2.95Å; K510-D540 WeakPolarHBondContact CE-OD2 3.42Å; K510-D540 IonicContact NZ-OD2 2.62Å; K510-D540 PolarHBondContact NZ-OD2 2.83Å; K510-M541 HydrophobicContact CB-SD 3.58Å; K510-M541 VanDerWaalsContact CB-SD 3.58Å; K510-M541 HydrophobicContact CD-SD 4.14Å; K510-M541 HydrophobicContact CG-CG 4.01Å; K510-M541 HydrophobicContact CG-SD 3.49Å; K510-M541 WeakPolarHBondContact CG-SD 3.44Å
511	A	88.4	Confident	84.3	Confident	56 Å²	56	62.3 Å²	62.3	46%	0.463	35%	0.346	S	S	.	.	H	α-helix	trans	-60.7	-43.6	178.5	0	0	0	0	0	111.8	V507 E508 K514 Q515	V507-A511 WeakPolarHBondContact O-CB 3.12Å; V507-A511 PolarHBondContact O-N 2.85Å; E508-A511 PolarHBondContact O-N 2.81Å; A511-K514 PolarHBondContact O-N 3.26Å; A511-Q515 WeakPolarHBondContact O-CB 3.32Å; A511-Q515 PolarHBondContact O-N 2.86Å
512	V	89	Confident	84.5	Confident	25 Å²	25	65.5 Å²	65.5	15%	0.152	36%	0.363	C	S	.	.	H	α-helix	trans	-61	-47.8	176.1	169.3	0	0	0	0	111.5	M472 Y475 K476 E508 S509 K510 K514 Q516	M472-V512 HydrophobicContact SD-CB 4.08Å; M472-V512 HydrophobicContact SD-CG1 3.73Å; Y475-V512 HydrophobicContact CD1-CG1 4.25Å; K476-V512 HydrophobicContact CD-CG1 4.39Å; K476-V512 HydrophobicContact CD-CG2 4.48Å; K476-V512 VanDerWaalsContact CE-CG2 3.45Å; K476-V512 HydrophobicContact CG-CG1 3.47Å; K476-V512 VanDerWaalsContact CG-CG1 3.47Å; K476-V512 HydrophobicContact CG-CG2 4.33Å; E508-V512 VanDerWaalsContact O-CG2 3.31Å; E508-V512 WeakPolarHBondContact O-CG2 3.07Å; E508-V512 PolarHBondContact O-N 2.9Å; S509-V512 PolarHBondContact O-N 2.64Å; K510-V512 VanDerWaalsContact C-N 3.35Å; K510-V512 PolarHBondContact O-N 2.93Å; V512-K514 VanDerWaalsContact C-N 3.32Å; V512-K514 PolarHBondContact O-N 2.75Å; V512-Q516 WeakPolarHBondContact O-CB 3.48Å; V512-Q516 PolarHBondContact O-N 2.88Å; V512-Q516 VanDerWaalsContact O-N 3.14Å
513	I	89.6	Confident	85.6	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-59.8	-46.7	178.7	-68	170.9	0	0	0	110.3	M472 Y475 I497 F498 L505 S509 K510 Q516 L517 M541	M472-I513 HydrophobicContact CE-CD1 4.35Å; M472-I513 HydrophobicContact CE-CG1 4.49Å; Y475-I513 HydrophobicContact CD1-CG1 4.38Å; Y475-I513 HydrophobicContact CE1-CB 4.29Å; Y475-I513 HydrophobicContact CE1-CG1 4.04Å; Y475-I513 HydrophobicContact CE1-CG2 4.47Å; I497-I513 HydrophobicContact CG2-CD1 4.32Å; F498-I513 HydrophobicContact CE1-CD1 4.13Å; L505-I513 HydrophobicContact CD1-CD1 4.21Å; S509-I513 WeakPolarHBondContact O-CG1 3.29Å; S509-I513 PolarHBondContact O-N 2.88Å; K510-I513 PolarHBondContact O-N 3.39Å; I513-Q516 PolarHBondContact O-N 3.15Å; I513-L517 HydrophobicContact CG2-CD1 3.9Å; I513-L517 HydrophobicContact CG2-CG 4.46Å; I513-L517 VanDerWaalsContact O-CG 3.27Å; I513-L517 WeakPolarHBondContact O-CG 3.35Å; I513-L517 PolarHBondContact O-N 3.18Å; I513-L517 VanDerWaalsContact O-N 3.14Å; I513-M541 HydrophobicContact CB-CE 3.91Å; I513-M541 HydrophobicContact CD1-CE 4.47Å; I513-M541 HydrophobicContact CG2-CE 3.58Å
514	K	88.2	Confident	86.7	Confident	75 Å²	75	64.9 Å²	64.9	33%	0.326	36%	0.363	S	S	.	.	H	α-helix	trans	-61.9	-52.1	-179.6	-179.7	174	175.1	169.9	0	112.2	K510 A511 V512 Q516 L517 E518 E544	K510-K514 WeakPolarHBondContact O-CB 3.44Å; K510-K514 PolarHBondContact O-N 2.95Å; A511-K514 PolarHBondContact O-N 3.26Å; V512-K514 VanDerWaalsContact C-N 3.32Å; V512-K514 PolarHBondContact O-N 2.75Å; K514-Q516 PolarHBondContact O-N 3.03Å; K514-L517 PolarHBondContact O-N 2.97Å; K514-E518 WeakPolarHBondContact CE-OE1 3.24Å; K514-E518 HydrophobicContact CG-CG 4.45Å; K514-E518 WeakPolarHBondContact CG-OE1 3.42Å; K514-E518 IonicContact NZ-OE1 3.98Å; K514-E518 WeakPolarHBondContact O-CG 3.13Å; K514-E518 PolarHBondContact O-N 3.37Å; K514-E544 IonicContact NZ-OE1 2.72Å; K514-E544 PolarHBondContact NZ-OE1 3.15Å
515	Q	87.1	Confident	87.7	Confident	142 Å²	142	61 Å²	61	66%	0.664	33%	0.33	S	S	*	.	H	α-helix	trans	-55	-41.3	-179.7	-175.8	-178.5	13.1	0	0	111.4	A511 S519	A511-Q515 WeakPolarHBondContact O-CB 3.32Å; A511-Q515 PolarHBondContact O-N 2.86Å; Q515-S519 PolarHBondContact O-N 2.78Å
516	Q	86.1	Confident	88.3	Confident	21 Å²	21	61.1 Å²	61.1	10%	0.098	33%	0.331	C	S	.	.	H	α-helix	trans	-68.8	-37.8	179.6	-174.5	52.5	24.9	0	0	113.2	Y475 G479 L490 V512 I513 K514 S519 V520	Y475-Q516 HydrophobicContact CD1-CB 4.33Å; Y475-Q516 HydrophobicContact CD1-CG 4.35Å; Y475-Q516 HydrophobicContact CE1-CB 3.64Å; Y475-Q516 HydrophobicContact CE1-CG 3.76Å; G479-Q516 VanDerWaalsContact C-NE2 3.32Å; G479-Q516 VanDerWaalsContact CA-OE1 3.23Å; G479-Q516 VanDerWaalsContact N-NE2 3.16Å; G479-Q516 PolarHBondContact O-NE2 2.81Å; L490-Q516 HydrophobicContact CD2-CG 3.8Å; V512-Q516 WeakPolarHBondContact O-CB 3.48Å; V512-Q516 PolarHBondContact O-N 2.88Å; V512-Q516 VanDerWaalsContact O-N 3.14Å; I513-Q516 PolarHBondContact O-N 3.15Å; K514-Q516 PolarHBondContact O-N 3.03Å; Q516-S519 PolarHBondContact O-N 3.25Å; Q516-V520 VanDerWaalsContact NE2-CG1 3.34Å; Q516-V520 PolarHBondContact O-N 3.42Å
517	L	88.8	Confident	88.8	Confident	8 Å²	8	59.7 Å²	59.7	4%	0.042	32%	0.317	C	S	.	.	H	α-helix	trans	-69	-41.3	179.4	-67.9	175.4	0	0	0	111.9	I513 K514 S519 S521 V526 I529 L545	I513-L517 HydrophobicContact CG2-CD1 3.9Å; I513-L517 HydrophobicContact CG2-CG 4.46Å; I513-L517 VanDerWaalsContact O-CG 3.27Å; I513-L517 WeakPolarHBondContact O-CG 3.35Å; I513-L517 PolarHBondContact O-N 3.18Å; I513-L517 VanDerWaalsContact O-N 3.14Å; K514-L517 PolarHBondContact O-N 2.97Å; L517-S519 PolarHBondContact O-N 3.41Å; L517-S521 WeakPolarHBondContact CD2-OG 3.45Å; L517-S521 WeakPolarHBondContact O-CB 3.2Å; L517-S521 PolarHBondContact O-N 3.06Å; L517-V526 HydrophobicContact CB-CG2 4.22Å; L517-V526 HydrophobicContact CD2-CG2 4.32Å; L517-I529 HydrophobicContact CD1-CD1 4.35Å; L517-I529 HydrophobicContact CD1-CG2 4.37Å; L517-I529 HydrophobicContact CD2-CD1 3.49Å; L517-I529 VanDerWaalsContact CD2-CD1 3.49Å; L517-L545 HydrophobicContact CD1-CD1 4.19Å; L517-L545 HydrophobicContact CD1-CD2 3.61Å
518	E	86.4	Confident	89.3	Confident	131 Å²	131	56 Å²	56	61%	0.612	29%	0.29	S	S	*	.	H	α-helix	trans	-62.7	-31.9	176.3	-69.8	175.6	175.3	0	0	112.5	K514	K514-E518 WeakPolarHBondContact CE-OE1 3.24Å; K514-E518 HydrophobicContact CG-CG 4.45Å; K514-E518 WeakPolarHBondContact CG-OE1 3.42Å; K514-E518 IonicContact NZ-OE1 3.98Å; K514-E518 WeakPolarHBondContact O-CG 3.13Å; K514-E518 PolarHBondContact O-N 3.37Å
519	S	82.2	Confident	89.8	Confident	91 Å²	91	48.3 Å²	48.3	64%	0.636	25%	0.254	S	S	*	.	H	α-helix	trans	-76.3	-37.1	-177	-178.4	0	0	0	0	114.5	Q515 Q516 L517	Q515-S519 PolarHBondContact O-N 2.78Å; Q516-S519 PolarHBondContact O-N 3.25Å; L517-S519 PolarHBondContact O-N 3.41Å
520	V	83.6	Confident	90.3	Very high	48 Å²	48	47.6 Å²	47.6	29%	0.291	25%	0.249	S	C	.	.	H	α-helix	trans	-143.8	-8.9	-162.4	83.1	0	0	0	0	115.1	Q487 L490 Q516	Q487-V520 PolarHBondContact NE2-O 3.26Å; L490-V520 HydrophobicContact CD1-CG1 3.79Å; Q516-V520 VanDerWaalsContact NE2-CG1 3.34Å; Q516-V520 PolarHBondContact O-N 3.42Å
521	S	83.1	Confident	90.6	Very high	24 Å²	24	46.7 Å²	46.7	17%	0.168	24%	0.244	C	C	.	.			trans	-91.4	139	-170.4	-158.2	0	0	0	0	112.1	L517 T525	L517-S521 WeakPolarHBondContact CD2-OG 3.45Å; L517-S521 WeakPolarHBondContact O-CB 3.2Å; L517-S521 PolarHBondContact O-N 3.06Å; S521-T525 WeakPolarHBondContact OG-CB 3.41Å; S521-T525 WeakPolarHBondContact OG-CG2 3.28Å
522	N	89.8	Confident	91	Very high	80 Å²	80	45.3 Å²	45.3	43%	0.428	23%	0.228	S	C	.	.			trans	-82.6	161.9	168.3	70.4	35.6	0	0	0	111.2	W524 T525 V526	N522-W524 PolarHBondContact O-N 2.89Å; N522-W524 VanDerWaalsContact O-N 3.11Å; N522-W524 WeakPolarHBondContact OD1-CB 3.42Å; N522-W524 PolarHBondContact OD1-N 3.05Å; N522-W524 VanDerWaalsContact OD1-N 3.13Å; N522-T525 WeakPolarHBondContact O-CB 3.48Å; N522-T525 PolarHBondContact O-N 2.94Å; N522-T525 VanDerWaalsContact O-N 3.07Å; N522-T525 PolarHBondContact OD1-N 2.94Å; N522-T525 PolarHBondContact OD1-OG1 2.93Å; N522-T525 VanDerWaalsContact OD1-OG1 3.12Å; N522-V526 PolarHBondContact O-N 3.32Å; N522-V526 VanDerWaalsContact O-N 3.11Å
523	G	92.3	Very high	91.3	Very high	25 Å²	25	44.1 Å²	44.1	26%	0.258	22%	0.221	S	C	.	.	H	α-helix	trans	-57.3	-29.5	-178.3	0	0	0	0	0	114.4	Y527 L549	G523-Y527 VanDerWaalsContact O-CB 3.29Å; G523-Y527 WeakPolarHBondContact O-CB 3.37Å; G523-Y527 PolarHBondContact O-N 3.44Å; G523-L549 WeakPolarHBondContact O-CD2 3.5Å
524	W	94.2	Very high	91.5	Very high	148 Å²	148	44.2 Å²	44.2	56%	0.561	22%	0.222	S	C	*	.	H	α-helix	trans	-70.2	-40.8	176.7	-178.6	-119.7	0	0	0	112.7	N522 Y527 R528	N522-W524 PolarHBondContact O-N 2.89Å; N522-W524 VanDerWaalsContact O-N 3.11Å; N522-W524 WeakPolarHBondContact OD1-CB 3.42Å; N522-W524 PolarHBondContact OD1-N 3.05Å; N522-W524 VanDerWaalsContact OD1-N 3.13Å; W524-Y527 AromaticContact CE3-CD1 3.76Å; W524-Y527 HydrophobicContact CE3-CD1 3.76Å; W524-Y527 HydrophobicContact CE3-CE1 4.49Å; W524-Y527 HydrophobicContact CH2-CD1 4.15Å; W524-Y527 HydrophobicContact CH2-CE1 4.22Å; W524-Y527 AromaticContact CZ3-CD1 3.42Å; W524-Y527 HydrophobicContact CZ3-CD1 3.42Å; W524-Y527 VanDerWaalsContact CZ3-CD1 3.42Å; W524-Y527 AromaticContact CZ3-CE1 3.71Å; W524-Y527 HydrophobicContact CZ3-CE1 3.71Å; W524-Y527 HydrophobicContact CZ3-CG 4.49Å; W524-Y527 PolarHBondContact O-N 3.2Å; W524-R528 HydrophobicContact CD2-CG 4.33Å; W524-R528 HydrophobicContact CZ2-CG 4.18Å; W524-R528 VanDerWaalsContact O-CG 3.32Å; W524-R528 WeakPolarHBondContact O-CG 3.42Å; W524-R528 PolarHBondContact O-N 3.42Å
525	T	94.9	Very high	91.8	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.018	22%	0.217	C	C	.	.	H	α-helix	trans	-63.3	-47.8	174.8	-62.8	0	0	0	0	110.6	Q487 L490 V491 S521 N522 Y527 R528 I529	Q487-T525 WeakPolarHBondContact CB-OG1 3.31Å; Q487-T525 VanDerWaalsContact OE1-CB 3.3Å; Q487-T525 PolarHBondContact OE1-OG1 2.89Å; L490-T525 HydrophobicContact CB-CG2 4.3Å; V491-T525 HydrophobicContact CG2-CG2 3.87Å; S521-T525 WeakPolarHBondContact OG-CB 3.41Å; S521-T525 WeakPolarHBondContact OG-CG2 3.28Å; N522-T525 WeakPolarHBondContact O-CB 3.48Å; N522-T525 PolarHBondContact O-N 2.94Å; N522-T525 VanDerWaalsContact O-N 3.07Å; N522-T525 PolarHBondContact OD1-N 2.94Å; N522-T525 PolarHBondContact OD1-OG1 2.93Å; N522-T525 VanDerWaalsContact OD1-OG1 3.12Å; T525-Y527 VanDerWaalsContact C-N 3.33Å; T525-Y527 PolarHBondContact O-N 3.35Å; T525-R528 PolarHBondContact O-N 3.42Å; T525-I529 HydrophobicContact CG2-CD1 4.04Å; T525-I529 WeakPolarHBondContact O-CG1 3.44Å; T525-I529 PolarHBondContact O-N 3.35Å
526	V	95.8	Very high	92	Very high	9 Å²	9	38.8 Å²	38.8	6%	0.055	20%	0.195	C	C	.	.	H	α-helix	trans	-58.6	-44.9	175.8	180	0	0	0	0	110.9	L517 N522 R528 I529 A530 L545 L549	L517-V526 HydrophobicContact CB-CG2 4.22Å; L517-V526 HydrophobicContact CD2-CG2 4.32Å; N522-V526 PolarHBondContact O-N 3.32Å; N522-V526 VanDerWaalsContact O-N 3.11Å; V526-R528 PolarHBondContact O-N 3.06Å; V526-I529 PolarHBondContact O-N 2.86Å; V526-A530 WeakPolarHBondContact O-CB 3.43Å; V526-A530 PolarHBondContact O-N 2.92Å; V526-L545 HydrophobicContact CG1-CB 4.14Å; V526-L545 HydrophobicContact CG1-CD2 4.08Å; V526-L549 HydrophobicContact CB-CD2 4.09Å; V526-L549 HydrophobicContact CB-CG 4.45Å; V526-L549 HydrophobicContact CG1-CD1 4.07Å; V526-L549 HydrophobicContact CG1-CD2 4.1Å; V526-L549 HydrophobicContact CG1-CG 3.95Å
527	Y	96.7	Very high	92.3	Very high	29 Å²	29	38.4 Å²	38.4	11%	0.114	20%	0.197	C	C	.	.	H	α-helix	trans	-61.1	-44.3	176.7	175.7	-106.3	0	0	0	112.5	G523 W524 T525 I529 A530 R531 Y546 L549 W561 L562 L565	G523-Y527 VanDerWaalsContact O-CB 3.29Å; G523-Y527 WeakPolarHBondContact O-CB 3.37Å; G523-Y527 PolarHBondContact O-N 3.44Å; W524-Y527 AromaticContact CE3-CD1 3.76Å; W524-Y527 HydrophobicContact CE3-CD1 3.76Å; W524-Y527 HydrophobicContact CE3-CE1 4.49Å; W524-Y527 HydrophobicContact CH2-CD1 4.15Å; W524-Y527 HydrophobicContact CH2-CE1 4.22Å; W524-Y527 AromaticContact CZ3-CD1 3.42Å; W524-Y527 HydrophobicContact CZ3-CD1 3.42Å; W524-Y527 VanDerWaalsContact CZ3-CD1 3.42Å; W524-Y527 AromaticContact CZ3-CE1 3.71Å; W524-Y527 HydrophobicContact CZ3-CE1 3.71Å; W524-Y527 HydrophobicContact CZ3-CG 4.49Å; W524-Y527 PolarHBondContact O-N 3.2Å; T525-Y527 VanDerWaalsContact C-N 3.33Å; T525-Y527 PolarHBondContact O-N 3.35Å; Y527-I529 VanDerWaalsContact C-N 3.3Å; Y527-I529 PolarHBondContact O-N 3.04Å; Y527-A530 PolarHBondContact O-N 3.4Å; Y527-R531 WeakPolarHBondContact O-CB 3.48Å; Y527-R531 PolarHBondContact O-N 3.27Å; Y527-Y546 HydrophobicContact CD2-CE1 4.21Å; Y527-Y546 HydrophobicContact CE2-CE1 4.23Å; Y527-L549 HydrophobicContact CD2-CD1 4.23Å; Y527-W561 AromaticContact CE2-NE1 3.91Å; Y527-W561 AromaticContact CZ-NE1 3.85Å; Y527-W561 PolarHBondContact OH-NE1 2.96Å; Y527-L562 HydrophobicContact CD2-CD2 3.67Å; Y527-L562 HydrophobicContact CE2-CD2 3.8Å; Y527-L565 HydrophobicContact CE2-CD1 4.02Å
528	R	97	Very high	92.4	Very high	42 Å²	42	38.8 Å²	38.8	16%	0.158	20%	0.199	C	C	.	.	H	α-helix	trans	-61.5	-41	176.9	-75.6	176.1	64.5	-172.6	2.9	111.2	E488 V491 W524 T525 V526 R531 Q532	E488-R528 VanDerWaalsContact CD-NH2 3.28Å; E488-R528 IonicContact OE1-CZ 3.03Å; E488-R528 IonicContact OE1-NH1 3.95Å; E488-R528 IonicContact OE1-NH2 2.69Å; E488-R528 PolarHBondContact OE1-NH2 2.75Å; E488-R528 IonicContact OE2-CZ 2.61Å; E488-R528 VanDerWaalsContact OE2-CZ 3.31Å; E488-R528 IonicContact OE2-NH1 3.44Å; E488-R528 PolarHBondContact OE2-NH1 2.87Å; E488-R528 IonicContact OE2-NH2 3.55Å; E488-R528 PolarHBondContact OE2-NH2 3.33Å; E488-R528 VanDerWaalsContact OE2-NH2 3.07Å; V491-R528 HydrophobicContact CG1-CB 4.15Å; V491-R528 HydrophobicContact CG2-CB 3.96Å; W524-R528 HydrophobicContact CD2-CG 4.33Å; W524-R528 HydrophobicContact CZ2-CG 4.18Å; W524-R528 VanDerWaalsContact O-CG 3.32Å; W524-R528 WeakPolarHBondContact O-CG 3.42Å; W524-R528 PolarHBondContact O-N 3.42Å; T525-R528 PolarHBondContact O-N 3.42Å; V526-R528 PolarHBondContact O-N 3.06Å; R528-R531 PolarHBondContact O-N 3.19Å; R528-Q532 VanDerWaalsContact O-CG 3.24Å; R528-Q532 WeakPolarHBondContact O-CG 3.41Å; R528-Q532 PolarHBondContact O-N 2.95Å
529	I	96.7	Very high	92.8	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-66.1	-46.7	177.4	-69.3	172.2	0	0	0	110.6	V491 A494 F498 L517 T525 V526 Y527 R531 Q532 A533 L545	V491-I529 HydrophobicContact CB-CG1 4.48Å; V491-I529 HydrophobicContact CG2-CG1 4.16Å; A494-I529 HydrophobicContact CB-CB 4.47Å; A494-I529 HydrophobicContact CB-CD1 4.01Å; A494-I529 HydrophobicContact CB-CG1 3.89Å; A494-I529 HydrophobicContact CB-CG2 3.83Å; F498-I529 HydrophobicContact CE2-CG2 3.7Å; F498-I529 WeakPolarHBondContact CE2-O 3.37Å; F498-I529 HydrophobicContact CZ-CG2 3.83Å; L517-I529 HydrophobicContact CD1-CD1 4.35Å; L517-I529 HydrophobicContact CD1-CG2 4.37Å; L517-I529 HydrophobicContact CD2-CD1 3.49Å; L517-I529 VanDerWaalsContact CD2-CD1 3.49Å; T525-I529 HydrophobicContact CG2-CD1 4.04Å; T525-I529 WeakPolarHBondContact O-CG1 3.44Å; T525-I529 PolarHBondContact O-N 3.35Å; V526-I529 PolarHBondContact O-N 2.86Å; Y527-I529 VanDerWaalsContact C-N 3.3Å; Y527-I529 PolarHBondContact O-N 3.04Å; I529-R531 VanDerWaalsContact C-N 3.29Å; I529-R531 PolarHBondContact O-N 2.99Å; I529-Q532 PolarHBondContact O-N 3.1Å; I529-A533 PolarHBondContact O-N 2.98Å; I529-L545 HydrophobicContact CB-CD1 4.34Å; I529-L545 HydrophobicContact CG2-CD1 3.68Å
530	A	96.8	Very high	93.2	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-57.1	-42.7	175.5	0	0	0	0	0	112.1	V526 Y527 Q532 A533 S534 L545 Y546	V526-A530 WeakPolarHBondContact O-CB 3.43Å; V526-A530 PolarHBondContact O-N 2.92Å; Y527-A530 PolarHBondContact O-N 3.4Å; A530-Q532 PolarHBondContact O-N 3.2Å; A530-A533 WeakPolarHBondContact O-CB 3.24Å; A530-A533 PolarHBondContact O-N 3.49Å; A530-S534 WeakPolarHBondContact O-CB 3.44Å; A530-S534 PolarHBondContact O-N 2.9Å; A530-L545 HydrophobicContact CB-CB 3.62Å; A530-L545 HydrophobicContact CB-CD1 4.02Å; A530-L545 HydrophobicContact CB-CG 4.49Å; A530-Y546 HydrophobicContact CB-CD1 3.77Å; A530-Y546 HydrophobicContact CB-CE1 3.42Å; A530-Y546 VanDerWaalsContact CB-CE1 3.42Å; A530-Y546 HydrophobicContact CB-CE2 4.47Å; A530-Y546 HydrophobicContact CB-CG 4.43Å; A530-Y546 PolarHBondContact O-OH 3.3Å
531	R	97.2	Very high	93.7	Very high	24 Å²	24	29.2 Å²	29.2	9%	0.091	14%	0.143	C	C	.	.	H	α-helix	trans	-60.8	-43.2	173.9	-179.2	179.3	67.2	175.3	3.4	112.3	Y527 R528 I529 S534 R535 F796	Y527-R531 WeakPolarHBondContact O-CB 3.48Å; Y527-R531 PolarHBondContact O-N 3.27Å; R528-R531 PolarHBondContact O-N 3.19Å; I529-R531 VanDerWaalsContact C-N 3.29Å; I529-R531 PolarHBondContact O-N 2.99Å; R531-S534 PolarHBondContact O-N 3.39Å; R531-R535 WeakPolarHBondContact O-CB 3.02Å; R531-R535 PolarHBondContact O-N 3.46Å; R531-F796 VanDerWaalsContact CD-CG 3.48Å; R531-F796 HydrophobicContact CG-CB 4.23Å; R531-F796 HydrophobicContact CG-CD1 3.75Å; R531-F796 HydrophobicContact CG-CD2 3.65Å; R531-F796 HydrophobicContact CG-CE1 3.95Å; R531-F796 HydrophobicContact CG-CE2 3.84Å; R531-F796 HydrophobicContact CG-CG 3.61Å; R531-F796 HydrophobicContact CG-CZ 3.99Å
532	Q	95.4	Very high	94.3	Very high	27 Å²	27	28 Å²	28	13%	0.126	14%	0.135	C	C	.	.	H	α-helix	trans	-68.5	-38.5	177.5	-62.4	-64.8	6.5	0	0	111.9	T495 F498 R528 I529 A530 R535 M536	T495-Q532 HydrophobicContact CG2-CG 4.3Å; T495-Q532 WeakPolarHBondContact OG1-CG 3.39Å; F498-Q532 HydrophobicContact CD2-CB 4.12Å; F498-Q532 HydrophobicContact CE2-CB 4.5Å; R528-Q532 VanDerWaalsContact O-CG 3.24Å; R528-Q532 WeakPolarHBondContact O-CG 3.41Å; R528-Q532 PolarHBondContact O-N 2.95Å; I529-Q532 PolarHBondContact O-N 3.1Å; A530-Q532 PolarHBondContact O-N 3.2Å; Q532-R535 PolarHBondContact O-N 2.77Å; Q532-M536 WeakPolarHBondContact O-CG 3.39Å; Q532-M536 PolarHBondContact O-N 2.74Å
533	A	94.8	Very high	94.5	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-58.1	-49.4	173.2	0	0	0	0	0	110.8	F498 I529 A530 R535 M536 G537 N538 M541 A542	F498-A533 HydrophobicContact CD2-CB 4.01Å; F498-A533 HydrophobicContact CE1-CB 4.26Å; F498-A533 HydrophobicContact CE2-CB 3.65Å; F498-A533 HydrophobicContact CG-CB 4.46Å; F498-A533 HydrophobicContact CZ-CB 3.8Å; I529-A533 PolarHBondContact O-N 2.98Å; A530-A533 WeakPolarHBondContact O-CB 3.24Å; A530-A533 PolarHBondContact O-N 3.49Å; A533-R535 PolarHBondContact O-N 3.38Å; A533-M536 CarbonylContact O-C 3.57Å; A533-M536 PolarHBondContact O-N 3.36Å; A533-M536 VanDerWaalsContact O-N 3.15Å; A533-G537 PolarHBondContact O-N 3.01Å; A533-G537 VanDerWaalsContact O-N 3.13Å; A533-N538 HydrophobicContact CB-CB 4.12Å; A533-N538 PolarHBondContact O-N 3.15Å; A533-M541 HydrophobicContact CB-CB 4.28Å; A533-A542 HydrophobicContact CB-CB 4.15Å
534	S	95.6	Very high	94.6	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.007	13%	0.131	C	C	.	.	H	α-helix	trans	-62.3	-38.8	177.7	-168.1	0	0	0	0	112.9	A530 R531 M536 G537 F791	A530-S534 WeakPolarHBondContact O-CB 3.44Å; A530-S534 PolarHBondContact O-N 2.9Å; R531-S534 PolarHBondContact O-N 3.39Å; S534-M536 VanDerWaalsContact C-N 3.35Å; S534-M536 PolarHBondContact O-N 2.83Å; S534-G537 PolarHBondContact O-N 2.56Å; S534-F791 WeakPolarHBondContact OG-CD2 3.25Å
535	R	94.3	Very high	94.7	Very high	63 Å²	63	22.6 Å²	22.6	24%	0.238	11%	0.105	C	C	.	.	H	α-helix	trans	-63.6	-39.3	173.4	-168.4	-162.6	75.4	-166.3	2.6	112	R531 Q532 A533 G537 S790 F791	R531-R535 WeakPolarHBondContact O-CB 3.02Å; R531-R535 PolarHBondContact O-N 3.46Å; Q532-R535 PolarHBondContact O-N 2.77Å; A533-R535 PolarHBondContact O-N 3.38Å; R535-G537 VanDerWaalsContact C-N 3.28Å; R535-G537 PolarHBondContact O-N 2.76Å; R535-S790 PolarHBondContact O-OG 3.49Å; R535-F791 WeakPolarHBondContact CA-O 3.39Å; R535-F791 WeakPolarHBondContact CG-O 3.33Å
536	M	91.4	Very high	94.8	Very high	40 Å²	40	22.4 Å²	22.4	20%	0.197	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	6.8	-179.9	-60.9	-46.9	-51.9	0	0	113.8	M458 F498 V499 Q532 A533 S534 N538	M458-M536 HydrophobicContact CE-CE 4.49Å; M458-M536 HydrophobicContact SD-CE 3.63Å; M458-M536 HydrophobicContact SD-SD 4.2Å; F498-M536 HydrophobicContact CB-CB 3.96Å; F498-M536 HydrophobicContact CB-CG 3.9Å; V499-M536 HydrophobicContact CB-CE 4.37Å; V499-M536 HydrophobicContact CG2-CE 3.79Å; V499-M536 HydrophobicContact CG2-CG 4.08Å; V499-M536 HydrophobicContact CG2-SD 3.73Å; Q532-M536 WeakPolarHBondContact O-CG 3.39Å; Q532-M536 PolarHBondContact O-N 2.74Å; A533-M536 CarbonylContact O-C 3.57Å; A533-M536 PolarHBondContact O-N 3.36Å; A533-M536 VanDerWaalsContact O-N 3.15Å; S534-M536 VanDerWaalsContact C-N 3.35Å; S534-M536 PolarHBondContact O-N 2.83Å; M536-N538 VanDerWaalsContact C-N 3.3Å; M536-N538 PolarHBondContact O-N 2.85Å
537	G	91.2	Very high	94.8	Very high	13 Å²	13	26.2 Å²	26.2	13%	0.134	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.5	8.6	-179.8	0	0	0	0	0	115	A533 S534 R535 H539	A533-G537 PolarHBondContact O-N 3.01Å; A533-G537 VanDerWaalsContact O-N 3.13Å; S534-G537 PolarHBondContact O-N 2.56Å; R535-G537 VanDerWaalsContact C-N 3.28Å; R535-G537 PolarHBondContact O-N 2.76Å; G537-H539 VanDerWaalsContact C-N 3.27Å; G537-H539 PolarHBondContact O-CD2 3.23Å; G537-H539 PolarHBondContact O-N 3.47Å
538	N	92.1	Very high	94.7	Very high	16 Å²	16	27.3 Å²	27.3	9%	0.086	13%	0.133	C	C	.	.			trans	-83.6	64.7	176.6	-73.8	-65.7	0	0	0	111.2	F498 A533 M536 D540 M541 A542	F498-N538 HydrophobicContact CD1-CB 4.43Å; F498-N538 PolarHBondContact O-ND2 2.63Å; A533-N538 HydrophobicContact CB-CB 4.12Å; A533-N538 PolarHBondContact O-N 3.15Å; M536-N538 VanDerWaalsContact C-N 3.3Å; M536-N538 PolarHBondContact O-N 2.85Å; N538-D540 VanDerWaalsContact C-N 3.34Å; N538-D540 PolarHBondContact O-N 3.48Å; N538-M541 PolarHBondContact O-N 3.32Å; N538-A542 PolarHBondContact O-N 3.06Å; N538-A542 VanDerWaalsContact O-N 3.14Å
539	H	93.1	Very high	94.6	Very high	5 Å²	5	25.7 Å²	25.7	2%	0.023	13%	0.128	C	C	.	.	H	α-helix	trans	-68.4	-26.7	-170.2	-64.5	-57.7	0	0	0	115.1	G537 A542 K543 E572 L789 F791	G537-H539 VanDerWaalsContact C-N 3.27Å; G537-H539 PolarHBondContact O-CD2 3.23Å; G537-H539 PolarHBondContact O-N 3.47Å; H539-A542 PolarHBondContact O-N 2.91Å; H539-K543 WeakPolarHBondContact O-CB 3.44Å; H539-K543 PolarHBondContact O-N 3.08Å; H539-E572 HydrophobicContact CB-CB 4.21Å; H539-E572 WeakPolarHBondContact CD2-CB 3.38Å; H539-L789 PolarHBondContact CE1-O 2.94Å; H539-L789 PolarHBondContact NE2-O 3.34Å; H539-F791 AromaticContact CE1-CD2 3.84Å; H539-F791 AromaticContact CE1-CE2 3.79Å
540	D	92.3	Very high	94.5	Very high	56 Å²	56	26.8 Å²	26.8	30%	0.299	13%	0.134	S	C	.	.	H	α-helix	trans	-62.7	-51	175.3	-176.3	36	0	0	0	111.6	K510 N538 A542 K543 E544 Q573	K510-D540 WeakPolarHBondContact CE-OD2 3.42Å; K510-D540 IonicContact NZ-OD2 2.62Å; K510-D540 PolarHBondContact NZ-OD2 2.83Å; N538-D540 VanDerWaalsContact C-N 3.34Å; N538-D540 PolarHBondContact O-N 3.48Å; D540-A542 VanDerWaalsContact C-N 3.34Å; D540-A542 PolarHBondContact O-N 3.29Å; D540-K543 PolarHBondContact O-N 3.29Å; D540-E544 PolarHBondContact O-N 3.46Å; D540-Q573 PolarHBondContact OD1-NE2 2.99Å
541	M	93.1	Very high	94.2	Very high	8 Å²	8	32.5 Å²	32.5	4%	0.039	17%	0.169	C	C	.	.	H	α-helix	trans	-63.9	-39.2	174	-78.7	-58.8	-65.9	0	0	111.9	F498 L505 K510 I513 A533 N538 K543 E544 L545	F498-M541 HydrophobicContact CE1-CG 4.49Å; L505-M541 HydrophobicContact CD1-CG 3.89Å; K510-M541 HydrophobicContact CB-SD 3.58Å; K510-M541 VanDerWaalsContact CB-SD 3.58Å; K510-M541 HydrophobicContact CD-SD 4.14Å; K510-M541 HydrophobicContact CG-CG 4.01Å; K510-M541 HydrophobicContact CG-SD 3.49Å; K510-M541 WeakPolarHBondContact CG-SD 3.44Å; I513-M541 HydrophobicContact CB-CE 3.91Å; I513-M541 HydrophobicContact CD1-CE 4.47Å; I513-M541 HydrophobicContact CG2-CE 3.58Å; A533-M541 HydrophobicContact CB-CB 4.28Å; N538-M541 PolarHBondContact O-N 3.32Å; M541-K543 PolarHBondContact O-N 2.82Å; M541-E544 PolarHBondContact O-N 3.16Å; M541-L545 HydrophobicContact CE-CD1 4.49Å; M541-L545 VanDerWaalsContact O-CG 3.25Å; M541-L545 WeakPolarHBondContact O-CG 3.32Å; M541-L545 PolarHBondContact O-N 3.48Å; M541-L545 VanDerWaalsContact O-N 3.11Å
542	A	95.2	Very high	93.8	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.2	-47.2	178.1	0	0	0	0	0	111.7	A533 N538 H539 D540 E544 L545 Y546	A533-A542 HydrophobicContact CB-CB 4.15Å; N538-A542 PolarHBondContact O-N 3.06Å; N538-A542 VanDerWaalsContact O-N 3.14Å; H539-A542 PolarHBondContact O-N 2.91Å; D540-A542 VanDerWaalsContact C-N 3.34Å; D540-A542 PolarHBondContact O-N 3.29Å; A542-E544 PolarHBondContact O-N 2.77Å; A542-L545 PolarHBondContact O-N 3.42Å; A542-Y546 HydrophobicContact CB-CD2 4.29Å; A542-Y546 HydrophobicContact CB-CE2 3.85Å; A542-Y546 WeakPolarHBondContact O-CB 3.31Å; A542-Y546 WeakPolarHBondContact O-CD2 3.47Å; A542-Y546 VanDerWaalsContact O-CG 3.25Å; A542-Y546 PolarHBondContact O-N 3.38Å
543	K	95.6	Very high	93.7	Very high	55 Å²	55	37.2 Å²	37.2	24%	0.239	20%	0.195	C	C	.	.	H	α-helix	trans	-57.2	-49.8	177.6	175.9	-171.3	166.3	-173.1	0	111.9	H539 D540 M541 L545 Y546 Q547 K566 H570 Q573	H539-K543 WeakPolarHBondContact O-CB 3.44Å; H539-K543 PolarHBondContact O-N 3.08Å; D540-K543 PolarHBondContact O-N 3.29Å; M541-K543 PolarHBondContact O-N 2.82Å; K543-L545 VanDerWaalsContact C-N 3.34Å; K543-L545 PolarHBondContact O-N 3.13Å; K543-Y546 PolarHBondContact O-N 3.39Å; K543-Q547 WeakPolarHBondContact O-CB 3.31Å; K543-Q547 PolarHBondContact O-N 2.8Å; K543-K566 HydrophobicContact CG-CG 4.36Å; K543-H570 HydrophobicContact CD-CB 4.03Å; K543-H570 PolarHBondContact NZ-CD2 3.09Å; K543-H570 PolarHBondContact NZ-NE2 3.01Å; K543-Q573 VanDerWaalsContact NZ-OE1 3.07Å
544	E	94.1	Very high	93.5	Very high	78 Å²	78	42.6 Å²	42.6	36%	0.364	24%	0.239	S	C	.	.	H	α-helix	trans	-59.5	-45.4	-179.5	-176.1	65.9	-166.5	0	0	111.4	K514 D540 M541 A542 Q547 S548	K514-E544 IonicContact NZ-OE1 2.72Å; K514-E544 PolarHBondContact NZ-OE1 3.15Å; D540-E544 PolarHBondContact O-N 3.46Å; M541-E544 PolarHBondContact O-N 3.16Å; A542-E544 PolarHBondContact O-N 2.77Å; E544-Q547 PolarHBondContact O-N 2.91Å; E544-S548 PolarHBondContact O-N 3.4Å
545	L	95.4	Very high	93.4	Very high	5 Å²	5	44.5 Å²	44.5	3%	0.026	25%	0.253	C	S	.	.	H	α-helix	trans	-70.1	-38.7	-179.6	-62.6	-179.8	0	0	0	112.4	L517 V526 I529 A530 M541 A542 K543 Q547 S548 L549	L517-L545 HydrophobicContact CD1-CD1 4.19Å; L517-L545 HydrophobicContact CD1-CD2 3.61Å; V526-L545 HydrophobicContact CG1-CB 4.14Å; V526-L545 HydrophobicContact CG1-CD2 4.08Å; I529-L545 HydrophobicContact CB-CD1 4.34Å; I529-L545 HydrophobicContact CG2-CD1 3.68Å; A530-L545 HydrophobicContact CB-CB 3.62Å; A530-L545 HydrophobicContact CB-CD1 4.02Å; A530-L545 HydrophobicContact CB-CG 4.49Å; M541-L545 HydrophobicContact CE-CD1 4.49Å; M541-L545 VanDerWaalsContact O-CG 3.25Å; M541-L545 WeakPolarHBondContact O-CG 3.32Å; M541-L545 PolarHBondContact O-N 3.48Å; M541-L545 VanDerWaalsContact O-N 3.11Å; A542-L545 PolarHBondContact O-N 3.42Å; K543-L545 VanDerWaalsContact C-N 3.34Å; K543-L545 PolarHBondContact O-N 3.13Å; L545-Q547 VanDerWaalsContact C-N 3.33Å; L545-S548 PolarHBondContact O-N 3.19Å; L545-L549 WeakPolarHBondContact O-CG 3.36Å; L545-L549 PolarHBondContact O-N 2.87Å
546	Y	97.3	Very high	93.4	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-65.4	-37.7	173.7	-65.2	-44.6	0	0	0	112	Y527 A530 A542 K543 L549 L550 L562 L565 S569	Y527-Y546 HydrophobicContact CD2-CE1 4.21Å; Y527-Y546 HydrophobicContact CE2-CE1 4.23Å; A530-Y546 HydrophobicContact CB-CD1 3.77Å; A530-Y546 HydrophobicContact CB-CE1 3.42Å; A530-Y546 VanDerWaalsContact CB-CE1 3.42Å; A530-Y546 HydrophobicContact CB-CE2 4.47Å; A530-Y546 HydrophobicContact CB-CG 4.43Å; A530-Y546 PolarHBondContact O-OH 3.3Å; A542-Y546 HydrophobicContact CB-CD2 4.29Å; A542-Y546 HydrophobicContact CB-CE2 3.85Å; A542-Y546 WeakPolarHBondContact O-CB 3.31Å; A542-Y546 WeakPolarHBondContact O-CD2 3.47Å; A542-Y546 VanDerWaalsContact O-CG 3.25Å; A542-Y546 PolarHBondContact O-N 3.38Å; K543-Y546 PolarHBondContact O-N 3.39Å; Y546-L549 PolarHBondContact O-N 3.26Å; Y546-L550 PolarHBondContact O-N 3.15Å; Y546-L550 VanDerWaalsContact O-N 3.12Å; Y546-L562 HydrophobicContact CD1-CD2 3.88Å; Y546-L562 HydrophobicContact CE1-CD2 4.41Å; Y546-L565 HydrophobicContact CD1-CB 4.23Å; Y546-L565 HydrophobicContact CD1-CD1 4.32Å; Y546-L565 HydrophobicContact CD2-CB 3.77Å; Y546-L565 HydrophobicContact CE1-CB 4.13Å; Y546-L565 HydrophobicContact CE1-CD1 3.69Å; Y546-L565 HydrophobicContact CE2-CB 3.66Å; Y546-L565 HydrophobicContact CE2-CD1 4.45Å; Y546-L565 HydrophobicContact CG-CB 4.08Å; Y546-S569 WeakPolarHBondContact CE2-OG 3.03Å
547	Q	95.6	Very high	93.5	Very high	89 Å²	89	49 Å²	49	42%	0.416	28%	0.276	S	S	.	.	H	α-helix	trans	-62.6	-42.5	174.4	-179.1	62.6	39.3	0	0	111.5	K543 E544 L545 L549 L550 K566	K543-Q547 WeakPolarHBondContact O-CB 3.31Å; K543-Q547 PolarHBondContact O-N 2.8Å; E544-Q547 PolarHBondContact O-N 2.91Å; L545-Q547 VanDerWaalsContact C-N 3.33Å; Q547-L549 VanDerWaalsContact C-N 3.31Å; Q547-L549 PolarHBondContact O-N 3.35Å; Q547-L550 WeakPolarHBondContact O-CB 3.39Å; Q547-L550 PolarHBondContact O-N 2.96Å; Q547-K566 HydrophobicContact CB-CD 4.48Å; Q547-K566 HydrophobicContact CB-CG 4.47Å
548	S	94.1	Very high	93.7	Very high	51 Å²	51	54.9 Å²	54.9	36%	0.357	30%	0.298	S	S	.	.	H	α-helix	trans	-63.5	-34.1	174.9	178.2	0	0	0	0	112.9	E544 L545 T551 Q552	E544-S548 PolarHBondContact O-N 3.4Å; L545-S548 PolarHBondContact O-N 3.19Å; S548-T551 PolarHBondContact O-OG1 3.27Å; S548-Q552 PolarHBondContact O-NE2 3.42Å
549	L	95.1	Very high	93.9	Very high	9 Å²	9	58.4 Å²	58.4	5%	0.047	31%	0.311	C	S	.	.	H	α-helix	trans	-75.7	-24.5	178	-73.2	168.8	0	0	0	114	G523 V526 Y527 L545 Y546 Q547 T551 Q552 V553 L562	G523-L549 WeakPolarHBondContact O-CD2 3.5Å; V526-L549 HydrophobicContact CB-CD2 4.09Å; V526-L549 HydrophobicContact CB-CG 4.45Å; V526-L549 HydrophobicContact CG1-CD1 4.07Å; V526-L549 HydrophobicContact CG1-CD2 4.1Å; V526-L549 HydrophobicContact CG1-CG 3.95Å; Y527-L549 HydrophobicContact CD2-CD1 4.23Å; L545-L549 WeakPolarHBondContact O-CG 3.36Å; L545-L549 PolarHBondContact O-N 2.87Å; Y546-L549 PolarHBondContact O-N 3.26Å; Q547-L549 VanDerWaalsContact C-N 3.31Å; Q547-L549 PolarHBondContact O-N 3.35Å; L549-T551 PolarHBondContact O-N 2.95Å; L549-Q552 HydrophobicContact CD2-CG 4.31Å; L549-Q552 WeakPolarHBondContact O-CG 3.46Å; L549-Q552 PolarHBondContact O-N 3.31Å; L549-Q552 VanDerWaalsContact O-N 3.12Å; L549-V553 WeakPolarHBondContact O-CG2 3.45Å; L549-L562 HydrophobicContact CB-CD1 3.91Å; L549-L562 HydrophobicContact CB-CD2 4.4Å; L549-L562 HydrophobicContact CD1-CD2 4.21Å
550	L	95.1	Very high	94.2	Very high	22 Å²	22	61.5 Å²	61.5	12%	0.115	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-25	-171.5	-167	146.7	0	0	0	113.1	Y546 Q547 Y559 N563 K566	Y546-L550 PolarHBondContact O-N 3.15Å; Y546-L550 VanDerWaalsContact O-N 3.12Å; Q547-L550 WeakPolarHBondContact O-CB 3.39Å; Q547-L550 PolarHBondContact O-N 2.96Å; L550-Y559 HydrophobicContact CD1-CE2 4.47Å; L550-Y559 HydrophobicContact CD2-CD2 4.14Å; L550-Y559 HydrophobicContact CD2-CE2 3.29Å; L550-Y559 HydrophobicContact CG-CD2 4.08Å; L550-Y559 HydrophobicContact CG-CE2 3.66Å; L550-N563 HydrophobicContact CD1-CB 3.81Å; L550-K566 HydrophobicContact CD1-CD 4.45Å
551	T	89.3	Confident	94.4	Very high	120 Å²	120	60 Å²	60	74%	0.736	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-7.2	178.8	57.9	0	0	0	0	114.2	S548 L549	S548-T551 PolarHBondContact O-OG1 3.27Å; L549-T551 PolarHBondContact O-N 2.95Å
552	Q	90.4	Very high	94.7	Very high	105 Å²	105	60.2 Å²	60.2	49%	0.491	32%	0.316	S	S	.	.	S	Bend	trans	-123.1	32.7	-171.8	54.4	178.8	-47.2	0	0	112.6	S548 L549	S548-Q552 PolarHBondContact O-NE2 3.42Å; L549-Q552 HydrophobicContact CD2-CG 4.31Å; L549-Q552 WeakPolarHBondContact O-CG 3.46Å; L549-Q552 PolarHBondContact O-N 3.31Å; L549-Q552 VanDerWaalsContact O-N 3.12Å
553	V	92.4	Very high	94.8	Very high	45 Å²	45	61.6 Å²	61.6	27%	0.273	32%	0.323	S	S	.	.			trans	-101.7	127.3	-174.6	-163.6	0	0	0	0	111.8	L549 S555 F558 L562	L549-V553 WeakPolarHBondContact O-CG2 3.45Å; V553-S555 WeakPolarHBondContact CG1-O 3.36Å; V553-F558 HydrophobicContact CG1-CB 3.61Å; V553-L562 HydrophobicContact CG2-CD1 3.58Å
554	A	91.2	Very high	94.9	Very high	113 Å²	113	59 Å²	59	93%	0.934	31%	0.312	S	S	*	.	S	Bend	trans	-89.5	-0.4	-177.4	0	0	0	0	0	114.9
555	S	93.1	Very high	95.2	Very high	42 Å²	42	55.4 Å²	55.4	29%	0.294	30%	0.295	S	S	.	.	S	Bend	trans	-143.7	139	-178.7	173.6	0	0	0	0	110.7	V553 H557 F558 Y559	V553-S555 WeakPolarHBondContact CG1-O 3.36Å; S555-H557 VanDerWaalsContact C-N 3.34Å; S555-H557 PolarHBondContact O-N 2.84Å; S555-H557 PolarHBondContact OG-N 2.99Å; S555-F558 PolarHBondContact O-N 3.33Å; S555-Y559 PolarHBondContact O-N 3.18Å
556	E	93.6	Very high	95.3	Very high	126 Å²	126	56.4 Å²	56.4	59%	0.589	30%	0.299	S	S	*	.	H	α-helix	trans	-59	-41.2	177.4	62.6	-174.4	172.6	0	0	112.9	F558 Y559 F560	E556-F558 VanDerWaalsContact C-N 3.34Å; E556-F558 PolarHBondContact O-N 3.37Å; E556-Y559 WeakPolarHBondContact O-CB 3.5Å; E556-Y559 PolarHBondContact O-N 3.46Å; E556-Y559 VanDerWaalsContact O-N 3.1Å; E556-F560 HydrophobicContact CB-CE2 4.39Å; E556-F560 WeakPolarHBondContact O-CD2 3.26Å; E556-F560 PolarHBondContact O-N 3.49Å
557	H	94.5	Very high	95.3	Very high	71 Å²	71	57.2 Å²	57.2	33%	0.329	30%	0.303	S	S	.	.	H	α-helix	trans	-64.4	-41.2	-179.5	-55.3	-53.1	0	0	0	111.3	S555 Y559 F560 W561 A607	S555-H557 VanDerWaalsContact C-N 3.34Å; S555-H557 PolarHBondContact O-N 2.84Å; S555-H557 PolarHBondContact OG-N 2.99Å; H557-Y559 VanDerWaalsContact C-N 3.31Å; H557-F560 PolarHBondContact O-N 3.48Å; H557-W561 WeakPolarHBondContact O-CB 3.36Å; H557-W561 PolarHBondContact O-N 3.08Å; H557-A607 WeakPolarHBondContact O-CB 3.37Å
558	F	95	Very high	95.5	Very high	136 Å²	136	53 Å²	53	60%	0.596	28%	0.283	S	S	*	.	H	α-helix	trans	-70.8	-28.8	175.5	-64.1	-45.5	0	0	0	112.3	V553 S555 E556 L562	V553-F558 HydrophobicContact CG1-CB 3.61Å; S555-F558 PolarHBondContact O-N 3.33Å; E556-F558 VanDerWaalsContact C-N 3.34Å; E556-F558 PolarHBondContact O-N 3.37Å; F558-L562 WeakPolarHBondContact O-CB 3.19Å; F558-L562 WeakPolarHBondContact O-CG 3.33Å; F558-L562 PolarHBondContact O-N 3.49Å
559	Y	97.1	Very high	95.6	Very high	91 Å²	91	50.7 Å²	50.7	36%	0.357	27%	0.267	S	S	.	.	H	α-helix	trans	-65.3	-50.3	173.4	170.4	-86.6	0	0	0	110.1	L550 S555 E556 H557 W561 L562 N563	L550-Y559 HydrophobicContact CD1-CE2 4.47Å; L550-Y559 HydrophobicContact CD2-CD2 4.14Å; L550-Y559 HydrophobicContact CD2-CE2 3.29Å; L550-Y559 HydrophobicContact CG-CD2 4.08Å; L550-Y559 HydrophobicContact CG-CE2 3.66Å; S555-Y559 PolarHBondContact O-N 3.18Å; E556-Y559 WeakPolarHBondContact O-CB 3.5Å; E556-Y559 PolarHBondContact O-N 3.46Å; E556-Y559 VanDerWaalsContact O-N 3.1Å; H557-Y559 VanDerWaalsContact C-N 3.31Å; Y559-W561 VanDerWaalsContact C-N 3.31Å; Y559-W561 PolarHBondContact O-N 3.49Å; Y559-L562 PolarHBondContact O-N 3.42Å; Y559-N563 VanDerWaalsContact O-CB 3.29Å; Y559-N563 WeakPolarHBondContact O-CB 3.33Å; Y559-N563 PolarHBondContact O-N 2.96Å
560	F	97.9	Very high	95.7	Very high	70 Å²	70	52.1 Å²	52.1	31%	0.307	27%	0.273	S	S	.	.	H	α-helix	trans	-64	-35.8	177.9	-74.9	-60.7	0	0	0	112.6	E556 H557 S564 S603 A606 A607	E556-F560 HydrophobicContact CB-CE2 4.39Å; E556-F560 WeakPolarHBondContact O-CD2 3.26Å; E556-F560 PolarHBondContact O-N 3.49Å; H557-F560 PolarHBondContact O-N 3.48Å; F560-S564 WeakPolarHBondContact O-CB 3.49Å; F560-S564 PolarHBondContact O-N 2.96Å; F560-S564 PolarHBondContact O-OG 3.24Å; F560-S603 WeakPolarHBondContact CB-O 3.48Å; F560-S603 PolarHBondContact O-OG 3.39Å; F560-A606 HydrophobicContact CD1-CB 4.17Å; F560-A606 HydrophobicContact CD2-CB 4.32Å; F560-A606 HydrophobicContact CE1-CB 4.42Å; F560-A606 HydrophobicContact CG-CB 4.13Å; F560-A607 HydrophobicContact CB-CB 3.77Å
561	W	97.8	Very high	95.8	Very high	23 Å²	23	51.1 Å²	51.1	9%	0.087	27%	0.268	C	S	.	.	H	α-helix	trans	-60.8	-54.5	171.1	172.6	-104.9	0	0	0	111.7	Y527 H557 Y559 N563 S564 L565 L604 A607 L614 Q617 F795 F796	Y527-W561 AromaticContact CE2-NE1 3.91Å; Y527-W561 AromaticContact CZ-NE1 3.85Å; Y527-W561 PolarHBondContact OH-NE1 2.96Å; H557-W561 WeakPolarHBondContact O-CB 3.36Å; H557-W561 PolarHBondContact O-N 3.08Å; Y559-W561 VanDerWaalsContact C-N 3.31Å; Y559-W561 PolarHBondContact O-N 3.49Å; W561-N563 VanDerWaalsContact C-N 3.33Å; W561-N563 PolarHBondContact O-N 2.94Å; W561-S564 PolarHBondContact O-N 3.5Å; W561-S564 VanDerWaalsContact O-N 3.14Å; W561-S564 PolarHBondContact O-OG 3.07Å; W561-L565 HydrophobicContact CD2-CD1 4.43Å; W561-L565 HydrophobicContact CH2-CD2 4.41Å; W561-L565 HydrophobicContact CZ2-CD1 3.96Å; W561-L565 HydrophobicContact CZ2-CD2 4.12Å; W561-L565 HydrophobicContact CZ2-CG 4.29Å; W561-L565 WeakPolarHBondContact O-CG 2.92Å; W561-L565 PolarHBondContact O-N 3.38Å; W561-L604 HydrophobicContact CE3-CD1 3.53Å; W561-L604 HydrophobicContact CZ3-CD1 3.52Å; W561-A607 HydrophobicContact CB-CB 4.37Å; W561-L614 HydrophobicContact CE3-CD1 3.91Å; W561-L614 HydrophobicContact CZ3-CD1 4.15Å; W561-Q617 HydrophobicContact CH2-CG 4.13Å; W561-Q617 HydrophobicContact CZ3-CG 4.09Å; W561-F795 HydrophobicContact CH2-CD1 4.08Å; W561-F795 AromaticContact CH2-CE1 3.85Å; W561-F795 HydrophobicContact CH2-CE1 3.85Å; W561-F795 WeakPolarHBondContact CH2-O 3.48Å; W561-F795 HydrophobicContact CZ3-CE1 4.47Å; W561-F796 AromaticContact CZ2-CD1 3.98Å; W561-F796 HydrophobicContact CZ2-CD1 3.98Å
562	L	98.1	Very high	96	Very high	14 Å²	14	45.4 Å²	45.4	7%	0.073	23%	0.233	C	C	.	.	H	α-helix	trans	-63.4	-39.2	179.7	-75.2	171.5	0	0	0	112.5	Y527 Y546 L549 V553 F558 Y559 S564 L565 K566	Y527-L562 HydrophobicContact CD2-CD2 3.67Å; Y527-L562 HydrophobicContact CE2-CD2 3.8Å; Y546-L562 HydrophobicContact CD1-CD2 3.88Å; Y546-L562 HydrophobicContact CE1-CD2 4.41Å; L549-L562 HydrophobicContact CB-CD1 3.91Å; L549-L562 HydrophobicContact CB-CD2 4.4Å; L549-L562 HydrophobicContact CD1-CD2 4.21Å; V553-L562 HydrophobicContact CG2-CD1 3.58Å; F558-L562 WeakPolarHBondContact O-CB 3.19Å; F558-L562 WeakPolarHBondContact O-CG 3.33Å; F558-L562 PolarHBondContact O-N 3.49Å; Y559-L562 PolarHBondContact O-N 3.42Å; L562-S564 VanDerWaalsContact C-N 3.32Å; L562-S564 PolarHBondContact O-N 3.14Å; L562-L565 PolarHBondContact O-N 3.02Å; L562-K566 WeakPolarHBondContact O-CB 3.22Å; L562-K566 PolarHBondContact O-N 3.25Å
563	N	98.4	Very high	96.1	Very high	29 Å²	29	42.8 Å²	42.8	16%	0.155	22%	0.221	C	C	.	.	H	α-helix	trans	-61.7	-41.9	174.5	-175	56.5	0	0	0	111.2	L550 Y559 W561 K566 E567 S603	L550-N563 HydrophobicContact CD1-CB 3.81Å; Y559-N563 VanDerWaalsContact O-CB 3.29Å; Y559-N563 WeakPolarHBondContact O-CB 3.33Å; Y559-N563 PolarHBondContact O-N 2.96Å; W561-N563 VanDerWaalsContact C-N 3.33Å; W561-N563 PolarHBondContact O-N 2.94Å; N563-K566 PolarHBondContact O-N 3.3Å; N563-K566 PolarHBondContact OD1-NZ 3.28Å; N563-E567 WeakPolarHBondContact O-CG 3.29Å; N563-E567 PolarHBondContact O-N 3.42Å; N563-S603 PolarHBondContact ND2-OG 3.24Å
564	S	98.5	Very high	96	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.6	-45.6	175.1	73.8	0	0	0	0	112.4	F560 W561 L562 K566 E567 F568 G600	F560-S564 WeakPolarHBondContact O-CB 3.49Å; F560-S564 PolarHBondContact O-N 2.96Å; F560-S564 PolarHBondContact O-OG 3.24Å; W561-S564 PolarHBondContact O-N 3.5Å; W561-S564 VanDerWaalsContact O-N 3.14Å; W561-S564 PolarHBondContact O-OG 3.07Å; L562-S564 VanDerWaalsContact C-N 3.32Å; L562-S564 PolarHBondContact O-N 3.14Å; S564-K566 VanDerWaalsContact C-N 3.32Å; S564-K566 PolarHBondContact O-N 2.78Å; S564-E567 PolarHBondContact O-N 3.35Å; S564-F568 WeakPolarHBondContact O-CD2 3.23Å; S564-F568 WeakPolarHBondContact O-CG 3.43Å; S564-F568 PolarHBondContact O-N 3.39Å; S564-G600 VanDerWaalsContact CB-O 3.26Å; S564-G600 WeakPolarHBondContact CB-O 3.5Å
565	L	98.4	Very high	95.9	Very high	3 Å²	3	36.3 Å²	36.3	2%	0.016	17%	0.17	C	C	.	.	H	α-helix	trans	-61.5	-39.3	177.5	-68.6	-179.1	0	0	0	112.6	Y527 Y546 W561 L562 S569 F795 F796	Y527-L565 HydrophobicContact CE2-CD1 4.02Å; Y546-L565 HydrophobicContact CD1-CB 4.23Å; Y546-L565 HydrophobicContact CD1-CD1 4.32Å; Y546-L565 HydrophobicContact CD2-CB 3.77Å; Y546-L565 HydrophobicContact CE1-CB 4.13Å; Y546-L565 HydrophobicContact CE1-CD1 3.69Å; Y546-L565 HydrophobicContact CE2-CB 3.66Å; Y546-L565 HydrophobicContact CE2-CD1 4.45Å; Y546-L565 HydrophobicContact CG-CB 4.08Å; W561-L565 HydrophobicContact CD2-CD1 4.43Å; W561-L565 HydrophobicContact CH2-CD2 4.41Å; W561-L565 HydrophobicContact CZ2-CD1 3.96Å; W561-L565 HydrophobicContact CZ2-CD2 4.12Å; W561-L565 HydrophobicContact CZ2-CG 4.29Å; W561-L565 WeakPolarHBondContact O-CG 2.92Å; W561-L565 PolarHBondContact O-N 3.38Å; L562-L565 PolarHBondContact O-N 3.02Å; L565-S569 WeakPolarHBondContact O-CB 3.42Å; L565-S569 PolarHBondContact O-N 3.04Å; L565-S569 PolarHBondContact O-OG 3.02Å; L565-F795 HydrophobicContact CD2-CD1 4.43Å; L565-F795 HydrophobicContact CD2-CE1 3.72Å; L565-F796 HydrophobicContact CD1-CD1 4.49Å; L565-F796 HydrophobicContact CD1-CE1 4.11Å; L565-F796 HydrophobicContact CD2-CE1 3.8Å
566	K	98.4	Very high	95.4	Very high	25 Å²	25	38 Å²	38	11%	0.109	18%	0.179	C	C	.	.	H	α-helix	trans	-62.2	-48.6	173.9	-179.4	-141.9	65.1	-170.1	0	111.2	K543 Q547 L550 L562 N563 S564 S569 H570	K543-K566 HydrophobicContact CG-CG 4.36Å; Q547-K566 HydrophobicContact CB-CD 4.48Å; Q547-K566 HydrophobicContact CB-CG 4.47Å; L550-K566 HydrophobicContact CD1-CD 4.45Å; L562-K566 WeakPolarHBondContact O-CB 3.22Å; L562-K566 PolarHBondContact O-N 3.25Å; N563-K566 PolarHBondContact O-N 3.3Å; N563-K566 PolarHBondContact OD1-NZ 3.28Å; S564-K566 VanDerWaalsContact C-N 3.32Å; S564-K566 PolarHBondContact O-N 2.78Å; K566-S569 PolarHBondContact O-N 3.1Å; K566-H570 WeakPolarHBondContact O-CB 2.92Å; K566-H570 PolarHBondContact O-N 3.35Å
567	E	98.4	Very high	94.6	Very high	18 Å²	18	34.6 Å²	34.6	8%	0.084	18%	0.178	C	C	.	.	H	α-helix	trans	-63.7	-40.2	178.2	-65	-61.3	158.5	0	0	112	N563 S564 H570 A571 F596 K599	N563-E567 WeakPolarHBondContact O-CG 3.29Å; N563-E567 PolarHBondContact O-N 3.42Å; S564-E567 PolarHBondContact O-N 3.35Å; E567-H570 WeakPolarHBondContact O-CB 3.29Å; E567-H570 PolarHBondContact O-N 2.86Å; E567-A571 PolarHBondContact O-N 3.05Å; E567-F596 WeakPolarHBondContact OE2-CD1 3.49Å; E567-K599 HydrophobicContact CG-CB 4.27Å
568	F	98.3	Very high	94.1	Very high	1 Å²	1	31.7 Å²	31.7	0%	0.004	16%	0.164	C	C	.	.	H	α-helix	trans	-64.4	-43.3	175	-59.2	-33.9	0	0	0	112.5	S564 H570 A571 E572 Y597 G600 L604 V621 F791 F795	S564-F568 WeakPolarHBondContact O-CD2 3.23Å; S564-F568 WeakPolarHBondContact O-CG 3.43Å; S564-F568 PolarHBondContact O-N 3.39Å; F568-H570 VanDerWaalsContact C-N 3.26Å; F568-H570 PolarHBondContact O-N 3.34Å; F568-A571 PolarHBondContact O-N 2.56Å; F568-E572 PolarHBondContact O-N 3.32Å; F568-Y597 HydrophobicContact CB-CE1 4.37Å; F568-Y597 AromaticContact CD1-CD1 3.55Å; F568-Y597 HydrophobicContact CD1-CD1 3.55Å; F568-Y597 AromaticContact CD1-CE1 3.79Å; F568-Y597 HydrophobicContact CD1-CE1 3.79Å; F568-Y597 HydrophobicContact CE1-CD1 4.02Å; F568-Y597 HydrophobicContact CG-CE1 4.36Å; F568-G600 VanDerWaalsContact CE1-C 3.41Å; F568-G600 VanDerWaalsContact CE1-CA 3.47Å; F568-G600 VanDerWaalsContact CZ-C 3.45Å; F568-L604 HydrophobicContact CE2-CD2 4.19Å; F568-L604 HydrophobicContact CZ-CB 4.25Å; F568-L604 HydrophobicContact CZ-CD2 4.11Å; F568-V621 HydrophobicContact CD1-CG1 4.32Å; F568-V621 HydrophobicContact CD2-CG2 4.45Å; F568-V621 HydrophobicContact CE1-CB 4.46Å; F568-V621 HydrophobicContact CE1-CG1 3.51Å; F568-V621 HydrophobicContact CE1-CG2 4.11Å; F568-V621 HydrophobicContact CE2-CG2 3.92Å; F568-V621 HydrophobicContact CZ-CB 4.3Å; F568-V621 HydrophobicContact CZ-CG1 3.74Å; F568-V621 HydrophobicContact CZ-CG2 3.73Å; F568-F791 HydrophobicContact CB-CZ 4.05Å; F568-F795 HydrophobicContact CD2-CZ 4.46Å; F568-F795 HydrophobicContact CE2-CZ 4.34Å
569	S	97	Very high	93.4	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.007	16%	0.164	C	C	.	.	H	α-helix	trans	-63.7	-35.5	175.9	-54	0	0	0	0	111.1	Y546 L565 K566 Q573	Y546-S569 WeakPolarHBondContact CE2-OG 3.03Å; L565-S569 WeakPolarHBondContact O-CB 3.42Å; L565-S569 PolarHBondContact O-N 3.04Å; L565-S569 PolarHBondContact O-OG 3.02Å; K566-S569 PolarHBondContact O-N 3.1Å; S569-Q573 WeakPolarHBondContact O-CB 3.26Å; S569-Q573 PolarHBondContact O-N 3.49Å
570	H	96.7	Very high	92.5	Very high	40 Å²	40	33 Å²	33	19%	0.185	18%	0.176	C	C	.	.	H	α-helix	trans	-66.9	-44.5	174.6	-163.5	179.6	0	0	0	112.1	K543 K566 E567 F568 E572 Q573 C574 F596	K543-H570 HydrophobicContact CD-CB 4.03Å; K543-H570 PolarHBondContact NZ-CD2 3.09Å; K543-H570 PolarHBondContact NZ-NE2 3.01Å; K566-H570 WeakPolarHBondContact O-CB 2.92Å; K566-H570 PolarHBondContact O-N 3.35Å; E567-H570 WeakPolarHBondContact O-CB 3.29Å; E567-H570 PolarHBondContact O-N 2.86Å; F568-H570 VanDerWaalsContact C-N 3.26Å; F568-H570 PolarHBondContact O-N 3.34Å; H570-E572 VanDerWaalsContact C-N 3.34Å; H570-E572 PolarHBondContact O-N 3.44Å; H570-Q573 WeakPolarHBondContact O-CB 3.39Å; H570-Q573 PolarHBondContact O-N 3.41Å; H570-C574 PolarHBondContact O-N 3.23Å; H570-C574 PolarHBondContact O-SG 3.41Å; H570-F596 AromaticContact CE1-CE1 3.68Å; H570-F596 AromaticContact CE1-CE2 3.61Å; H570-F596 AromaticContact CE1-CZ 3.21Å; H570-F596 WeakPolarHBondContact CE1-CZ 3.44Å; H570-F596 AromaticContact ND1-CD1 3.85Å; H570-F596 AromaticContact ND1-CE1 3.47Å; H570-F596 WeakPolarHBondContact ND1-CE1 3.34Å; H570-F596 AromaticContact ND1-CE2 3.75Å; H570-F596 AromaticContact ND1-CZ 3.43Å; H570-F596 WeakPolarHBondContact ND1-CZ 3.29Å; H570-F596 AromaticContact NE2-CE2 3.86Å; H570-F596 AromaticContact NE2-CZ 3.89Å
571	A	96.4	Very high	91.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-59.1	-45.5	176.8	0	0	0	0	0	111.9	E567 F568 C574 L575 S593 F596 Y597	E567-A571 PolarHBondContact O-N 3.05Å; F568-A571 PolarHBondContact O-N 2.56Å; A571-C574 WeakPolarHBondContact O-CB 3.43Å; A571-C574 PolarHBondContact O-N 3.26Å; A571-L575 PolarHBondContact O-N 2.95Å; A571-S593 WeakPolarHBondContact CB-O 3.48Å; A571-S593 WeakPolarHBondContact O-CB 3.5Å; A571-F596 HydrophobicContact CB-CB 3.79Å; A571-Y597 HydrophobicContact CB-CD1 4.39Å; A571-Y597 HydrophobicContact CB-CD2 3.48Å; A571-Y597 VanDerWaalsContact CB-CD2 3.48Å; A571-Y597 HydrophobicContact CB-CE1 4.43Å; A571-Y597 HydrophobicContact CB-CE2 3.52Å; A571-Y597 HydrophobicContact CB-CG 3.93Å
572	E	94.8	Very high	90.3	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-69.6	-35	177.9	-72.3	-66.7	131.8	0	0	112.4	H539 F568 H570 C574 L575 T576 Y597 R624 L789	H539-E572 HydrophobicContact CB-CB 4.21Å; H539-E572 WeakPolarHBondContact CD2-CB 3.38Å; F568-E572 PolarHBondContact O-N 3.32Å; H570-E572 VanDerWaalsContact C-N 3.34Å; H570-E572 PolarHBondContact O-N 3.44Å; E572-C574 VanDerWaalsContact C-N 3.32Å; E572-C574 PolarHBondContact O-N 2.9Å; E572-L575 PolarHBondContact O-N 2.99Å; E572-T576 PolarHBondContact O-N 3.07Å; E572-Y597 VanDerWaalsContact CG-OH 3.25Å; E572-Y597 WeakPolarHBondContact CG-OH 3.28Å; E572-Y597 PolarHBondContact OE1-OH 3.46Å; E572-R624 IonicContact OE1-CZ 3.25Å; E572-R624 IonicContact OE1-NE 2.61Å; E572-R624 PolarHBondContact OE1-NE 2.92Å; E572-R624 IonicContact OE1-NH2 3.55Å; E572-R624 PolarHBondContact OE1-NH2 3.14Å; E572-R624 IonicContact OE2-NH2 2.75Å; E572-L789 VanDerWaalsContact CD-CB 3.46Å; E572-L789 HydrophobicContact CG-CB 4.17Å; E572-L789 WeakPolarHBondContact OE2-CB 3.41Å; E572-L789 PolarHBondContact OE2-N 2.8Å; E572-L789 VanDerWaalsContact OE2-N 3.14Å
573	Q	92.3	Very high	89.1	Confident	49 Å²	49	39 Å²	39	23%	0.229	21%	0.206	C	C	.	.	H	α-helix	trans	-58	-44.2	171.4	179.1	178.3	28.3	0	0	111.5	D540 K543 S569 H570 L575 T576	D540-Q573 PolarHBondContact OD1-NE2 2.99Å; K543-Q573 VanDerWaalsContact NZ-OE1 3.07Å; S569-Q573 WeakPolarHBondContact O-CB 3.26Å; S569-Q573 PolarHBondContact O-N 3.49Å; H570-Q573 WeakPolarHBondContact O-CB 3.39Å; H570-Q573 PolarHBondContact O-N 3.41Å; Q573-L575 VanDerWaalsContact C-N 3.28Å; Q573-L575 PolarHBondContact O-N 3.13Å; Q573-T576 PolarHBondContact O-N 3.32Å; Q573-T576 PolarHBondContact O-OG1 3.49Å
574	C	90.3	Very high	87.9	Confident	22 Å²	22	42.1 Å²	42.1	15%	0.149	23%	0.23	C	C	.	.	H	α-helix	trans	-59.4	-38.2	177.7	-66.3	0	0	0	0	112.4	H570 A571 E572 T576 G577	H570-C574 PolarHBondContact O-N 3.23Å; H570-C574 PolarHBondContact O-SG 3.41Å; A571-C574 WeakPolarHBondContact O-CB 3.43Å; A571-C574 PolarHBondContact O-N 3.26Å; E572-C574 VanDerWaalsContact C-N 3.32Å; E572-C574 PolarHBondContact O-N 2.9Å; C574-T576 VanDerWaalsContact C-N 3.31Å; C574-T576 PolarHBondContact O-N 2.94Å; C574-G577 PolarHBondContact O-N 3.47Å
575	L	89.4	Confident	87.1	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-69.5	-26.6	-179.8	-68.3	173.9	0	0	0	113.1	A571 E572 Q573 G577 L578 I590 L628	A571-L575 PolarHBondContact O-N 2.95Å; E572-L575 PolarHBondContact O-N 2.99Å; Q573-L575 VanDerWaalsContact C-N 3.28Å; Q573-L575 PolarHBondContact O-N 3.13Å; L575-G577 PolarHBondContact O-N 3.13Å; L575-L578 WeakPolarHBondContact O-CD1 3.39Å; L575-L578 VanDerWaalsContact O-CG 3.3Å; L575-L578 WeakPolarHBondContact O-CG 3.46Å; L575-I590 HydrophobicContact CD2-CG1 4.37Å; L575-L628 HydrophobicContact CD1-CD1 4.2Å; L575-L628 HydrophobicContact CD1-CD2 4.11Å
576	T	82.3	Confident	86.4	Confident	78 Å²	78	43.6 Å²	43.6	48%	0.479	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-15.9	175.3	64.5	0	0	0	0	113.8	E572 Q573 C574 L578	E572-T576 PolarHBondContact O-N 3.07Å; Q573-T576 PolarHBondContact O-N 3.32Å; Q573-T576 PolarHBondContact O-OG1 3.49Å; C574-T576 VanDerWaalsContact C-N 3.31Å; C574-T576 PolarHBondContact O-N 2.94Å; T576-L578 VanDerWaalsContact C-N 3.3Å; T576-L578 PolarHBondContact O-N 2.91Å
577	G	76.3	Confident	85.9	Confident	54 Å²	54	44.4 Å²	44.4	56%	0.557	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.8	4.5	180	0	0	0	0	0	115.3	C574 L575 Q579	C574-G577 PolarHBondContact O-N 3.47Å; L575-G577 PolarHBondContact O-N 3.13Å; G577-Q579 PolarHBondContact O-N 3.12Å
578	L	84.6	Confident	85.4	Confident	9 Å²	9	47 Å²	47	5%	0.047	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-67.3	126.1	-179.9	-68.9	172.6	0	0	0	111.7	L575 T576 A586 C589 I782 L785 K786	L575-L578 WeakPolarHBondContact O-CD1 3.39Å; L575-L578 VanDerWaalsContact O-CG 3.3Å; L575-L578 WeakPolarHBondContact O-CG 3.46Å; T576-L578 VanDerWaalsContact C-N 3.3Å; T576-L578 PolarHBondContact O-N 2.91Å; L578-A586 HydrophobicContact CD2-CB 3.89Å; L578-C589 HydrophobicContact CD2-CB 3.7Å; L578-I782 HydrophobicContact CD1-CD1 4.13Å; L578-I782 HydrophobicContact CD2-CD1 4.38Å; L578-L785 HydrophobicContact CD1-CB 3.71Å; L578-L785 HydrophobicContact CD1-CD1 4.05Å; L578-K786 VanDerWaalsContact O-CE 3.31Å; L578-K786 WeakPolarHBondContact O-CE 3.46Å
579	Q	80.9	Confident	85.1	Confident	125 Å²	125	48.1 Å²	48.1	58%	0.584	27%	0.273	S	S	*	.	P	Polyproline II helix	trans	-85.4	146.6	173.5	-69.8	-173.8	-20.4	0	0	111.5	G577 N582	G577-Q579 PolarHBondContact O-N 3.12Å; Q579-N582 HydrophobicContact CB-CB 4.05Å; Q579-N582 PolarHBondContact OE1-ND2 3.1Å
580	E	76.9	Confident	84.9	Confident	130 Å²	130	48 Å²	48	61%	0.607	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	141.6	171.1	-132.1	93.1	-119.8	0	0	110.1	N582 K786	E580-N582 PolarHBondContact O-N 3.42Å; E580-K786 IonicContact OE1-NZ 2.85Å; E580-K786 PolarHBondContact OE1-NZ 3.28Å; E580-K786 IonicContact OE2-NZ 3.66Å; E580-K786 PolarHBondContact OE2-NZ 2.93Å
581	E	72.9	Confident	84.7	Confident	146 Å²	146	48.8 Å²	48.8	68%	0.682	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.1	8.3	172.8	-54.7	-175	165.9	0	0	116.6
582	N	76.8	Confident	84.7	Confident	48 Å²	48	53 Å²	53	26%	0.257	31%	0.305	S	S	.	.			trans	-104.5	83.1	179.9	-170.2	-5.5	0	0	0	112.4	Q579 E580 S584 S585 A586	Q579-N582 HydrophobicContact CB-CB 4.05Å; Q579-N582 PolarHBondContact OE1-ND2 3.1Å; E580-N582 PolarHBondContact O-N 3.42Å; N582-S584 PolarHBondContact O-N 3.38Å; N582-S584 PolarHBondContact OD1-OG 3.08Å; N582-S584 VanDerWaalsContact OD1-OG 3.09Å; N582-S585 PolarHBondContact ND2-OG 3.1Å; N582-S585 PolarHBondContact O-OG 3.12Å; N582-S585 PolarHBondContact OD1-OG 2.83Å; N582-A586 PolarHBondContact O-N 3.47Å
583	Y	73.3	Confident	84.7	Confident	40 Å²	40	52.9 Å²	52.9	16%	0.157	31%	0.305	C	S	.	.	H	α-helix	trans	-72.6	-22.2	-174.3	-46.4	-63.8	0	0	0	114.8	C778 N779	Y583-C778 HydrophobicContact CD1-CB 3.58Å; Y583-C778 HydrophobicContact CE1-CB 3.36Å; Y583-N779 PolarHBondContact OH-OD1 2.93Å
584	S	73.8	Confident	85	Confident	94 Å²	94	51.5 Å²	51.5	66%	0.657	30%	0.299	S	S	*	.	H	α-helix	trans	-77.5	-41.3	-177.4	54.1	0	0	0	0	112.1	N582 A586	N582-S584 PolarHBondContact O-N 3.38Å; N582-S584 PolarHBondContact OD1-OG 3.08Å; N582-S584 VanDerWaalsContact OD1-OG 3.09Å; S584-A586 VanDerWaalsContact C-N 3.32Å
585	S	80.3	Confident	85.3	Confident	32 Å²	32	55.9 Å²	55.9	22%	0.224	32%	0.315	C	S	.	.	H	α-helix	trans	-70.8	-29.8	174.5	62.7	0	0	0	0	112.2	N582 L587 S588 C589	N582-S585 PolarHBondContact ND2-OG 3.1Å; N582-S585 PolarHBondContact O-OG 3.12Å; N582-S585 PolarHBondContact OD1-OG 2.83Å; S585-L587 PolarHBondContact O-N 3.06Å; S585-S588 PolarHBondContact O-N 3.25Å; S585-S588 VanDerWaalsContact O-N 3.16Å; S585-S588 PolarHBondContact O-OG 3.32Å; S585-C589 PolarHBondContact O-N 3.44Å; S585-C589 PolarHBondContact O-SG 2.94Å; S585-C589 VanDerWaalsContact O-SG 3.32Å
586	A	84.3	Confident	85.8	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.008	32%	0.318	C	S	.	.	H	α-helix	trans	-57.5	-43.5	178	0	0	0	0	0	113.3	L578 N582 S584 S588 C589 I590 I782	L578-A586 HydrophobicContact CD2-CB 3.89Å; N582-A586 PolarHBondContact O-N 3.47Å; S584-A586 VanDerWaalsContact C-N 3.32Å; A586-S588 VanDerWaalsContact C-N 3.34Å; A586-S588 PolarHBondContact O-N 3.46Å; A586-C589 PolarHBondContact O-N 2.96Å; A586-I590 VanDerWaalsContact O-CG1 3.26Å; A586-I590 WeakPolarHBondContact O-CG1 3.43Å; A586-I590 PolarHBondContact O-N 2.96Å; A586-I782 HydrophobicContact CB-CD1 3.61Å
587	L	87.8	Confident	86.5	Confident	42 Å²	42	53 Å²	53	22%	0.22	30%	0.296	C	S	.	.	H	α-helix	trans	-63.1	-39.6	177.7	-74.1	175.7	0	0	0	112.2	S585 A591 I635	S585-L587 PolarHBondContact O-N 3.06Å; L587-A591 WeakPolarHBondContact O-CB 3.43Å; L587-A591 PolarHBondContact O-N 2.89Å; L587-I635 HydrophobicContact CD1-CG2 4.26Å; L587-I635 HydrophobicContact CD2-CB 3.96Å; L587-I635 HydrophobicContact CD2-CG2 3.75Å; L587-I635 HydrophobicContact CG-CG2 3.87Å
588	S	89.2	Confident	87.6	Confident	73 Å²	73	54.2 Å²	54.2	51%	0.51	29%	0.287	S	S	.	.	H	α-helix	trans	-66.7	-41.3	175.8	53.3	0	0	0	0	112.6	S585 A586 A591 E592	S585-S588 PolarHBondContact O-N 3.25Å; S585-S588 VanDerWaalsContact O-N 3.16Å; S585-S588 PolarHBondContact O-OG 3.32Å; A586-S588 VanDerWaalsContact C-N 3.34Å; A586-S588 PolarHBondContact O-N 3.46Å; S588-A591 PolarHBondContact O-N 3.48Å; S588-E592 WeakPolarHBondContact O-CB 3.39Å; S588-E592 PolarHBondContact O-N 3.22Å
589	C	90.9	Very high	88.2	Confident	24 Å²	24	58.7 Å²	58.7	16%	0.162	31%	0.306	C	S	.	.	H	α-helix	trans	-64.5	-42.7	176.6	-65.6	0	0	0	0	111.6	L578 S585 A586 E592 S593	L578-C589 HydrophobicContact CD2-CB 3.7Å; S585-C589 PolarHBondContact O-N 3.44Å; S585-C589 PolarHBondContact O-SG 2.94Å; S585-C589 VanDerWaalsContact O-SG 3.32Å; A586-C589 PolarHBondContact O-N 2.96Å; C589-E592 PolarHBondContact O-N 2.72Å; C589-S593 WeakPolarHBondContact O-CB 3.46Å; C589-S593 PolarHBondContact O-N 3.02Å; C589-S593 PolarHBondContact O-OG 3.05Å
590	I	92.6	Very high	89.1	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-63.7	-45.1	176.2	-65.4	165.2	0	0	0	110.1	L575 A586 E592 S593 L594 I635 L785	L575-I590 HydrophobicContact CD2-CG1 4.37Å; A586-I590 VanDerWaalsContact O-CG1 3.26Å; A586-I590 WeakPolarHBondContact O-CG1 3.43Å; A586-I590 PolarHBondContact O-N 2.96Å; I590-E592 PolarHBondContact O-N 3.19Å; I590-S593 WeakPolarHBondContact CA-OG 3.33Å; I590-S593 PolarHBondContact O-N 3.46Å; I590-S593 PolarHBondContact O-OG 3.01Å; I590-L594 HydrophobicContact CG2-CD1 3.95Å; I590-L594 HydrophobicContact CG2-CG 4.32Å; I590-L594 WeakPolarHBondContact O-CB 3.38Å; I590-L594 WeakPolarHBondContact O-CG 3.31Å; I590-L594 PolarHBondContact O-N 3.47Å; I590-I635 HydrophobicContact CD1-CD1 3.69Å; I590-L785 HydrophobicContact CD1-CD1 3.92Å; I590-L785 HydrophobicContact CG1-CD1 4.08Å
591	A	93.7	Very high	90.1	Very high	55 Å²	55	47.8 Å²	47.8	46%	0.455	26%	0.256	S	S	.	.	H	α-helix	trans	-60.7	-42	177.6	0	0	0	0	0	112.7	L587 S588 L594 K595	L587-A591 WeakPolarHBondContact O-CB 3.43Å; L587-A591 PolarHBondContact O-N 2.89Å; S588-A591 PolarHBondContact O-N 3.48Å; A591-L594 PolarHBondContact O-N 2.94Å; A591-K595 PolarHBondContact O-N 2.99Å; A591-K595 VanDerWaalsContact O-N 3.09Å
592	E	94.6	Very high	91.3	Very high	88 Å²	88	43.8 Å²	43.8	41%	0.411	25%	0.248	S	C	.	.	H	α-helix	trans	-65.7	-45.2	175.9	-177.9	171.2	-145.5	0	0	112	S588 C589 I590 L594 K595 F596	S588-E592 WeakPolarHBondContact O-CB 3.39Å; S588-E592 PolarHBondContact O-N 3.22Å; C589-E592 PolarHBondContact O-N 2.72Å; I590-E592 PolarHBondContact O-N 3.19Å; E592-L594 VanDerWaalsContact C-N 3.34Å; E592-L594 PolarHBondContact O-N 3.28Å; E592-K595 WeakPolarHBondContact O-CB 3.31Å; E592-K595 PolarHBondContact O-N 3.29Å; E592-F596 HydrophobicContact CG-CD2 3.95Å; E592-F596 HydrophobicContact CG-CE2 3.51Å; E592-F596 HydrophobicContact CG-CZ 4.44Å; E592-F596 WeakPolarHBondContact O-CD2 3.43Å; E592-F596 PolarHBondContact O-N 3.01Å; E592-F596 VanDerWaalsContact O-N 3.15Å
593	S	95.9	Very high	92.3	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-60.8	-42	176.4	70.7	0	0	0	0	111.9	A571 C589 I590 K595 F596 Y597	A571-S593 WeakPolarHBondContact CB-O 3.48Å; A571-S593 WeakPolarHBondContact O-CB 3.5Å; C589-S593 WeakPolarHBondContact O-CB 3.46Å; C589-S593 PolarHBondContact O-N 3.02Å; C589-S593 PolarHBondContact O-OG 3.05Å; I590-S593 WeakPolarHBondContact CA-OG 3.33Å; I590-S593 PolarHBondContact O-N 3.46Å; I590-S593 PolarHBondContact O-OG 3.01Å; S593-K595 VanDerWaalsContact C-N 3.34Å; S593-K595 PolarHBondContact O-N 3.31Å; S593-F596 PolarHBondContact O-N 3.17Å; S593-Y597 WeakPolarHBondContact O-CD2 3.47Å; S593-Y597 PolarHBondContact O-N 3.48Å
594	L	97.7	Very high	93.5	Very high	20 Å²	20	40 Å²	40	11%	0.105	23%	0.231	C	C	.	.	H	α-helix	trans	-59.9	-42.2	175.4	-79.1	171.7	0	0	0	111.9	I590 A591 E592 F596 Y597 H598 I625 L628 Q629	I590-L594 HydrophobicContact CG2-CD1 3.95Å; I590-L594 HydrophobicContact CG2-CG 4.32Å; I590-L594 WeakPolarHBondContact O-CB 3.38Å; I590-L594 WeakPolarHBondContact O-CG 3.31Å; I590-L594 PolarHBondContact O-N 3.47Å; A591-L594 PolarHBondContact O-N 2.94Å; E592-L594 VanDerWaalsContact C-N 3.34Å; E592-L594 PolarHBondContact O-N 3.28Å; L594-F596 VanDerWaalsContact C-N 3.34Å; L594-F596 PolarHBondContact O-N 2.96Å; L594-Y597 PolarHBondContact O-N 3.35Å; L594-H598 WeakPolarHBondContact O-CB 3.44Å; L594-H598 PolarHBondContact O-CD2 2.97Å; L594-H598 PolarHBondContact O-N 3.33Å; L594-I625 HydrophobicContact CD2-CG2 4.09Å; L594-L628 HydrophobicContact CD2-CB 3.69Å; L594-L628 HydrophobicContact CD2-CD1 4.42Å; L594-L628 HydrophobicContact CG-CB 4.19Å; L594-Q629 HydrophobicContact CD1-CG 3.91Å; L594-Q629 HydrophobicContact CD2-CG 3.76Å
595	K	97.9	Very high	94.6	Very high	113 Å²	113	39.4 Å²	39.4	49%	0.491	22%	0.223	S	C	.	.	H	α-helix	trans	-58.7	-45.2	175.1	168.6	-172.8	163.7	-167.2	0	111.4	A591 E592 S593 H598 K599	A591-K595 PolarHBondContact O-N 2.99Å; A591-K595 VanDerWaalsContact O-N 3.09Å; E592-K595 WeakPolarHBondContact O-CB 3.31Å; E592-K595 PolarHBondContact O-N 3.29Å; S593-K595 VanDerWaalsContact C-N 3.34Å; S593-K595 PolarHBondContact O-N 3.31Å; K595-H598 PolarHBondContact O-N 2.9Å; K595-K599 WeakPolarHBondContact O-CG 3.47Å; K595-K599 PolarHBondContact O-N 3.31Å; K595-K599 VanDerWaalsContact O-N 3.13Å
596	F	98.2	Very high	95.3	Very high	17 Å²	17	40.3 Å²	40.3	8%	0.075	23%	0.233	C	C	.	.	H	α-helix	trans	-69.1	-39.9	177.9	-70.2	-53.3	0	0	0	112.3	E567 H570 A571 E592 S593 L594 H598 K599 G600	E567-F596 WeakPolarHBondContact OE2-CD1 3.49Å; H570-F596 AromaticContact CE1-CE1 3.68Å; H570-F596 AromaticContact CE1-CE2 3.61Å; H570-F596 AromaticContact CE1-CZ 3.21Å; H570-F596 WeakPolarHBondContact CE1-CZ 3.44Å; H570-F596 AromaticContact ND1-CD1 3.85Å; H570-F596 AromaticContact ND1-CE1 3.47Å; H570-F596 WeakPolarHBondContact ND1-CE1 3.34Å; H570-F596 AromaticContact ND1-CE2 3.75Å; H570-F596 AromaticContact ND1-CZ 3.43Å; H570-F596 WeakPolarHBondContact ND1-CZ 3.29Å; H570-F596 AromaticContact NE2-CE2 3.86Å; H570-F596 AromaticContact NE2-CZ 3.89Å; A571-F596 HydrophobicContact CB-CB 3.79Å; E592-F596 HydrophobicContact CG-CD2 3.95Å; E592-F596 HydrophobicContact CG-CE2 3.51Å; E592-F596 HydrophobicContact CG-CZ 4.44Å; E592-F596 WeakPolarHBondContact O-CD2 3.43Å; E592-F596 PolarHBondContact O-N 3.01Å; E592-F596 VanDerWaalsContact O-N 3.15Å; S593-F596 PolarHBondContact O-N 3.17Å; L594-F596 VanDerWaalsContact C-N 3.34Å; L594-F596 PolarHBondContact O-N 2.96Å; F596-H598 PolarHBondContact O-N 3.45Å; F596-K599 HydrophobicContact CD1-CD 4.4Å; F596-K599 WeakPolarHBondContact O-CB 3.29Å; F596-K599 PolarHBondContact O-N 3.25Å; F596-G600 PolarHBondContact O-N 2.85Å
597	Y	98.4	Very high	95.8	Very high	1 Å²	1	40.6 Å²	40.6	0%	0.004	24%	0.235	C	C	.	.	H	α-helix	trans	-59.6	-43.5	172.9	-90.1	-61.1	0	0	0	113	F568 A571 E572 S593 L594 K599 G600 I601 V621 R624 I625 L628	F568-Y597 HydrophobicContact CB-CE1 4.37Å; F568-Y597 AromaticContact CD1-CD1 3.55Å; F568-Y597 HydrophobicContact CD1-CD1 3.55Å; F568-Y597 AromaticContact CD1-CE1 3.79Å; F568-Y597 HydrophobicContact CD1-CE1 3.79Å; F568-Y597 HydrophobicContact CE1-CD1 4.02Å; F568-Y597 HydrophobicContact CG-CE1 4.36Å; A571-Y597 HydrophobicContact CB-CD1 4.39Å; A571-Y597 HydrophobicContact CB-CD2 3.48Å; A571-Y597 VanDerWaalsContact CB-CD2 3.48Å; A571-Y597 HydrophobicContact CB-CE1 4.43Å; A571-Y597 HydrophobicContact CB-CE2 3.52Å; A571-Y597 HydrophobicContact CB-CG 3.93Å; E572-Y597 VanDerWaalsContact CG-OH 3.25Å; E572-Y597 WeakPolarHBondContact CG-OH 3.28Å; E572-Y597 PolarHBondContact OE1-OH 3.46Å; S593-Y597 WeakPolarHBondContact O-CD2 3.47Å; S593-Y597 PolarHBondContact O-N 3.48Å; L594-Y597 PolarHBondContact O-N 3.35Å; Y597-K599 VanDerWaalsContact C-N 3.35Å; Y597-K599 PolarHBondContact O-N 2.89Å; Y597-G600 PolarHBondContact O-N 3.2Å; Y597-I601 WeakPolarHBondContact O-CG2 3.27Å; Y597-I601 PolarHBondContact O-N 3.36Å; Y597-V621 HydrophobicContact CD1-CG1 4.15Å; Y597-R624 HydrophobicContact CE1-CG 4.26Å; Y597-R624 HydrophobicContact CE2-CG 4.28Å; Y597-I625 HydrophobicContact CD1-CG1 4.47Å; Y597-I625 HydrophobicContact CG-CG1 4.16Å; Y597-L628 HydrophobicContact CD2-CD1 3.63Å; Y597-L628 HydrophobicContact CE2-CD1 3.53Å
598	H	98.5	Very high	96.1	Very high	81 Å²	81	40.6 Å²	40.6	38%	0.375	24%	0.239	S	C	.	.	H	α-helix	trans	-63.1	-38.5	176	-78.2	-57	0	0	0	112.7	L594 K595 F596 I601 A602 I625 Q629	L594-H598 WeakPolarHBondContact O-CB 3.44Å; L594-H598 PolarHBondContact O-CD2 2.97Å; L594-H598 PolarHBondContact O-N 3.33Å; K595-H598 PolarHBondContact O-N 2.9Å; F596-H598 PolarHBondContact O-N 3.45Å; H598-I601 VanDerWaalsContact O-CG2 3.31Å; H598-I601 WeakPolarHBondContact O-CG2 3.08Å; H598-A602 WeakPolarHBondContact O-CB 3.31Å; H598-A602 PolarHBondContact O-N 3.12Å; H598-I625 VanDerWaalsContact CE1-CG2 3.46Å; H598-I625 WeakPolarHBondContact CE1-CG2 3.25Å; H598-Q629 PolarHBondContact NE2-NE2 2.91Å
599	K	98.3	Very high	96.3	Very high	103 Å²	103	38.8 Å²	38.8	45%	0.448	23%	0.225	S	C	.	.	H	α-helix	trans	-64.3	-43.8	171.4	-71.3	177.7	175.9	-166.5	0	111.8	E567 K595 F596 Y597 A602 S603	E567-K599 HydrophobicContact CG-CB 4.27Å; K595-K599 WeakPolarHBondContact O-CG 3.47Å; K595-K599 PolarHBondContact O-N 3.31Å; K595-K599 VanDerWaalsContact O-N 3.13Å; F596-K599 HydrophobicContact CD1-CD 4.4Å; F596-K599 WeakPolarHBondContact O-CB 3.29Å; F596-K599 PolarHBondContact O-N 3.25Å; Y597-K599 VanDerWaalsContact C-N 3.35Å; Y597-K599 PolarHBondContact O-N 2.89Å; K599-A602 PolarHBondContact O-N 3.23Å; K599-S603 PolarHBondContact O-N 3.27Å; K599-S603 VanDerWaalsContact O-N 3.09Å
600	G	98.4	Very high	96.1	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-62.3	-47.9	179.8	0	0	0	0	0	112.6	S564 F568 F596 Y597 A602 S603 L604	S564-G600 VanDerWaalsContact CB-O 3.26Å; S564-G600 WeakPolarHBondContact CB-O 3.5Å; F568-G600 VanDerWaalsContact CE1-C 3.41Å; F568-G600 VanDerWaalsContact CE1-CA 3.47Å; F568-G600 VanDerWaalsContact CZ-C 3.45Å; F596-G600 PolarHBondContact O-N 2.85Å; Y597-G600 PolarHBondContact O-N 3.2Å; G600-A602 PolarHBondContact O-N 3.36Å; G600-S603 WeakPolarHBondContact O-CB 3.3Å; G600-S603 PolarHBondContact O-N 2.99Å; G600-L604 WeakPolarHBondContact O-CB 3.33Å; G600-L604 PolarHBondContact O-N 3.06Å
601	I	98.3	Very high	95.7	Very high	25 Å²	25	51.2 Å²	51.2	13%	0.128	30%	0.296	C	S	.	.	H	α-helix	trans	-67.2	-34.8	179.8	-171.6	56.4	0	0	0	112.4	Y597 H598 L604 T605 C618 V621 I625	Y597-I601 WeakPolarHBondContact O-CG2 3.27Å; Y597-I601 PolarHBondContact O-N 3.36Å; H598-I601 VanDerWaalsContact O-CG2 3.31Å; H598-I601 WeakPolarHBondContact O-CG2 3.08Å; I601-L604 HydrophobicContact CD1-CB 4.45Å; I601-L604 HydrophobicContact CD1-CD2 3.97Å; I601-L604 PolarHBondContact O-N 3.21Å; I601-T605 WeakPolarHBondContact O-CB 3.48Å; I601-T605 PolarHBondContact O-N 2.87Å; I601-T605 PolarHBondContact O-OG1 3.36Å; I601-C618 HydrophobicContact CD1-CB 4.15Å; I601-V621 HydrophobicContact CB-CG1 3.99Å; I601-V621 HydrophobicContact CD1-CB 4.21Å; I601-V621 HydrophobicContact CD1-CG1 4.09Å; I601-V621 HydrophobicContact CG1-CG1 4.35Å; I601-I625 HydrophobicContact CB-CD1 4.19Å; I601-I625 HydrophobicContact CG2-CD1 3.81Å
602	A	98.1	Very high	95.2	Very high	63 Å²	63	52.6 Å²	52.6	52%	0.521	30%	0.296	S	S	.	.	H	α-helix	trans	-62.4	-45.5	173.3	0	0	0	0	0	111	H598 K599 G600 T605 A606	H598-A602 WeakPolarHBondContact O-CB 3.31Å; H598-A602 PolarHBondContact O-N 3.12Å; K599-A602 PolarHBondContact O-N 3.23Å; G600-A602 PolarHBondContact O-N 3.36Å; A602-T605 PolarHBondContact O-N 2.95Å; A602-A606 PolarHBondContact O-N 3.13Å; A602-A606 VanDerWaalsContact O-N 3.17Å
603	S	97.9	Very high	95	Very high	9 Å²	9	52.3 Å²	52.3	6%	0.063	30%	0.302	C	S	.	.	H	α-helix	trans	-63.1	-43.7	174.3	-168.5	0	0	0	0	111.9	F560 N563 K599 G600 T605 A606 A607	F560-S603 WeakPolarHBondContact CB-O 3.48Å; F560-S603 PolarHBondContact O-OG 3.39Å; N563-S603 PolarHBondContact ND2-OG 3.24Å; K599-S603 PolarHBondContact O-N 3.27Å; K599-S603 VanDerWaalsContact O-N 3.09Å; G600-S603 WeakPolarHBondContact O-CB 3.3Å; G600-S603 PolarHBondContact O-N 2.99Å; S603-T605 VanDerWaalsContact C-N 3.34Å; S603-T605 PolarHBondContact O-N 3.41Å; S603-A606 WeakPolarHBondContact O-CB 3.44Å; S603-A606 PolarHBondContact O-N 2.84Å; S603-A607 PolarHBondContact O-N 2.98Å; S603-A607 VanDerWaalsContact O-N 3.09Å
604	L	98.1	Very high	94.9	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-62.8	-41.4	179.5	-177.3	67.6	0	0	0	111.9	W561 F568 G600 I601 A606 A607 S608 L614 Q617 V621	W561-L604 HydrophobicContact CE3-CD1 3.53Å; W561-L604 HydrophobicContact CZ3-CD1 3.52Å; F568-L604 HydrophobicContact CE2-CD2 4.19Å; F568-L604 HydrophobicContact CZ-CB 4.25Å; F568-L604 HydrophobicContact CZ-CD2 4.11Å; G600-L604 WeakPolarHBondContact O-CB 3.33Å; G600-L604 PolarHBondContact O-N 3.06Å; I601-L604 HydrophobicContact CD1-CB 4.45Å; I601-L604 HydrophobicContact CD1-CD2 3.97Å; I601-L604 PolarHBondContact O-N 3.21Å; L604-A606 VanDerWaalsContact C-N 3.3Å; L604-A606 PolarHBondContact O-N 2.93Å; L604-A607 WeakPolarHBondContact O-CB 3.16Å; L604-A607 PolarHBondContact O-N 2.61Å; L604-A607 VanDerWaalsContact O-N 3.09Å; L604-S608 PolarHBondContact O-N 2.83Å; L604-L614 HydrophobicContact CD1-CD1 3.76Å; L604-Q617 HydrophobicContact CD1-CB 4.41Å; L604-Q617 HydrophobicContact CD2-CB 3.82Å; L604-V621 HydrophobicContact CD2-CG2 4.47Å
605	T	96.6	Very high	94.7	Very high	80 Å²	80	56 Å²	56	49%	0.491	33%	0.328	S	S	.	.	H	α-helix	trans	-63.8	-38.5	177	-54.8	0	0	0	0	110.9	I601 A602 S603 A607 S608	I601-T605 WeakPolarHBondContact O-CB 3.48Å; I601-T605 PolarHBondContact O-N 2.87Å; I601-T605 PolarHBondContact O-OG1 3.36Å; A602-T605 PolarHBondContact O-N 2.95Å; S603-T605 VanDerWaalsContact C-N 3.34Å; S603-T605 PolarHBondContact O-N 3.41Å; T605-A607 VanDerWaalsContact C-N 3.27Å; T605-A607 PolarHBondContact O-N 2.79Å; T605-S608 WeakPolarHBondContact O-CB 3.4Å; T605-S608 PolarHBondContact O-N 2.6Å; T605-S608 VanDerWaalsContact O-N 3.17Å
606	A	95.3	Very high	94.6	Very high	51 Å²	51	51.6 Å²	51.6	42%	0.421	31%	0.309	S	S	.	.	H	α-helix	trans	-66.9	-25	173.7	0	0	0	0	0	113.6	F560 A602 S603 L604	F560-A606 HydrophobicContact CD1-CB 4.17Å; F560-A606 HydrophobicContact CD2-CB 4.32Å; F560-A606 HydrophobicContact CE1-CB 4.42Å; F560-A606 HydrophobicContact CG-CB 4.13Å; A602-A606 PolarHBondContact O-N 3.13Å; A602-A606 VanDerWaalsContact O-N 3.17Å; S603-A606 WeakPolarHBondContact O-CB 3.44Å; S603-A606 PolarHBondContact O-N 2.84Å; L604-A606 VanDerWaalsContact C-N 3.3Å; L604-A606 PolarHBondContact O-N 2.93Å
607	A	95.4	Very high	94.6	Very high	7 Å²	7	51.9 Å²	51.9	6%	0.058	31%	0.31	C	S	.	.	H	α-helix	trans	-78.7	-21	173	0	0	0	0	0	113.3	H557 F560 W561 S603 L604 T605 L614	H557-A607 WeakPolarHBondContact O-CB 3.37Å; F560-A607 HydrophobicContact CB-CB 3.77Å; W561-A607 HydrophobicContact CB-CB 4.37Å; S603-A607 PolarHBondContact O-N 2.98Å; S603-A607 VanDerWaalsContact O-N 3.09Å; L604-A607 WeakPolarHBondContact O-CB 3.16Å; L604-A607 PolarHBondContact O-N 2.61Å; L604-A607 VanDerWaalsContact O-N 3.09Å; T605-A607 VanDerWaalsContact C-N 3.27Å; T605-A607 PolarHBondContact O-N 2.79Å; A607-L614 HydrophobicContact CB-CD1 4.07Å
608	S	93.9	Very high	94.6	Very high	42 Å²	42	52.8 Å²	52.8	29%	0.294	32%	0.317	S	S	.	.			trans	-76.4	131.7	-177.5	-172.3	0	0	0	0	110.9	L604 T605 L614	L604-S608 PolarHBondContact O-N 2.83Å; T605-S608 WeakPolarHBondContact O-CB 3.4Å; T605-S608 PolarHBondContact O-N 2.6Å; T605-S608 VanDerWaalsContact O-N 3.17Å; S608-L614 PolarHBondContact OG-N 3.04Å; S608-L614 VanDerWaalsContact OG-N 3.11Å
609	T	92.4	Very high	94.6	Very high	35 Å²	35	53.7 Å²	53.7	22%	0.215	32%	0.321	C	S	.	.			trans	-125.6	159.6	179	62	0	0	0	0	110.6	L611 N612 P613	T609-L611 PolarHBondContact O-N 3.07Å; T609-N612 PolarHBondContact N-O 3.44Å; T609-N612 CarbonylContact O-C 3.51Å; T609-N612 PolarHBondContact O-N 3.37Å; T609-N612 PolarHBondContact OG1-N 3.44Å; T609-N612 VanDerWaalsContact OG1-N 3.16Å; T609-P613 WeakPolarHBondContact O-CA 3.32Å; T609-P613 VanDerWaalsContact O-N 3.1Å
610	P	88.8	Confident	94.6	Very high	138 Å²	138	49.1 Å²	49.1	90%	0.896	30%	0.301	S	S	*	.	S	Bend	trans	-58.3	-31.9	173.4	-26	35.5	0	0	0	113.5
611	L	83.5	Confident	94.6	Very high	147 Å²	147	49.2 Å²	49.2	77%	0.77	30%	0.302	S	S	*	.	S	Bend	trans	-73.8	-34.9	179.3	-175.5	64.9	0	0	0	112.4	T609	T609-L611 PolarHBondContact O-N 3.07Å
612	N	82.4	Confident	94.6	Very high	84 Å²	84	52 Å²	52	45%	0.449	31%	0.313	S	S	.	.	S	Bend	trans	-136.5	81.1	177.6	-176.7	57.7	0	0	0	110	T609	T609-N612 PolarHBondContact N-O 3.44Å; T609-N612 CarbonylContact O-C 3.51Å; T609-N612 PolarHBondContact O-N 3.37Å; T609-N612 PolarHBondContact OG1-N 3.44Å; T609-N612 VanDerWaalsContact OG1-N 3.16Å
613	P	90	Very high	94.6	Very high	83 Å²	83	49.2 Å²	49.2	54%	0.539	29%	0.289	S	S	.	.			trans	-74.7	130.1	-177.4	28.7	-33.9	0	0	0	111.2	T609 S615	T609-P613 WeakPolarHBondContact O-CA 3.32Å; T609-P613 VanDerWaalsContact O-N 3.1Å; P613-S615 VanDerWaalsContact C-N 3.26Å; P613-S615 PolarHBondContact O-N 3.08Å
614	L	94.7	Very high	94.6	Very high	17 Å²	17	49.3 Å²	49.3	9%	0.089	29%	0.288	C	S	.	.			trans	-91.9	46.2	179.2	-58.6	178.2	0	0	0	112	W561 L604 A607 S608 F616 Q617 C618	W561-L614 HydrophobicContact CE3-CD1 3.91Å; W561-L614 HydrophobicContact CZ3-CD1 4.15Å; L604-L614 HydrophobicContact CD1-CD1 3.76Å; A607-L614 HydrophobicContact CB-CD1 4.07Å; S608-L614 PolarHBondContact OG-N 3.04Å; S608-L614 VanDerWaalsContact OG-N 3.11Å; L614-F616 PolarHBondContact O-N 2.99Å; L614-Q617 VanDerWaalsContact C-OE1 3.22Å; L614-Q617 HydrophobicContact CB-CB 4.47Å; L614-Q617 PolarHBondContact O-N 3.37Å; L614-Q617 PolarHBondContact O-OE1 2.87Å; L614-C618 PolarHBondContact O-N 3.24Å; L614-C618 PolarHBondContact O-SG 3.31Å; L614-C618 VanDerWaalsContact O-SG 3.37Å
615	S	93.3	Very high	94.6	Very high	80 Å²	80	49.3 Å²	49.3	56%	0.559	29%	0.288	S	S	*	.	H	α-helix	trans	-60.5	-49.4	-169.4	173	0	0	0	0	113.1	P613 Q617 C618 E619	P613-S615 VanDerWaalsContact C-N 3.26Å; P613-S615 PolarHBondContact O-N 3.08Å; S615-Q617 VanDerWaalsContact C-N 3.33Å; S615-Q617 PolarHBondContact O-N 3.44Å; S615-C618 PolarHBondContact O-N 3.01Å; S615-E619 WeakPolarHBondContact O-CG 3.29Å; S615-E619 PolarHBondContact O-N 3.39Å
616	F	96.6	Very high	94.7	Very high	20 Å²	20	46.2 Å²	46.2	9%	0.088	27%	0.268	C	S	.	.	H	α-helix	trans	-60.5	-43.4	179.6	173.9	-96.6	0	0	0	111.9	L614 F620 L688 T699 Y794 F795	L614-F616 PolarHBondContact O-N 2.99Å; F616-F620 HydrophobicContact CE1-CB 4.38Å; F616-F620 HydrophobicContact CZ-CB 4.39Å; F616-F620 HydrophobicContact CZ-CD2 4.31Å; F616-F620 HydrophobicContact CZ-CG 4.46Å; F616-F620 WeakPolarHBondContact O-CB 3.49Å; F616-F620 PolarHBondContact O-N 3.16Å; F616-L688 HydrophobicContact CD2-CD1 3.82Å; F616-L688 HydrophobicContact CD2-CG 4.4Å; F616-L688 HydrophobicContact CE2-CD1 4.13Å; F616-L688 HydrophobicContact CE2-CD2 4.22Å; F616-L688 HydrophobicContact CE2-CG 4.2Å; F616-T699 HydrophobicContact CE1-CG2 4.26Å; F616-T699 HydrophobicContact CE2-CG2 4.21Å; F616-T699 HydrophobicContact CZ-CG2 3.57Å; F616-Y794 HydrophobicContact CB-CD1 4.44Å; F616-Y794 HydrophobicContact CB-CE1 3.88Å; F616-Y794 AromaticContact CD1-CD1 3.64Å; F616-Y794 HydrophobicContact CD1-CD1 3.64Å; F616-Y794 AromaticContact CD1-CE1 3.96Å; F616-Y794 HydrophobicContact CD1-CE1 3.96Å; F616-Y794 AromaticContact CD2-CD1 3.88Å; F616-Y794 HydrophobicContact CD2-CD1 3.88Å; F616-Y794 AromaticContact CD2-CE1 3.69Å; F616-Y794 HydrophobicContact CD2-CE1 3.69Å; F616-Y794 AromaticContact CE1-CD1 3.78Å; F616-Y794 HydrophobicContact CE1-CD1 3.78Å; F616-Y794 HydrophobicContact CE1-CE1 4.47Å; F616-Y794 AromaticContact CE2-CD1 4Å; F616-Y794 HydrophobicContact CE2-CD1 4Å; F616-Y794 HydrophobicContact CE2-CE1 4.22Å; F616-Y794 AromaticContact CG-CD1 3.7Å; F616-Y794 HydrophobicContact CG-CD1 3.7Å; F616-Y794 AromaticContact CG-CE1 3.55Å; F616-Y794 HydrophobicContact CG-CE1 3.55Å; F616-Y794 AromaticContact CZ-CD1 3.96Å; F616-Y794 HydrophobicContact CZ-CD1 3.96Å; F616-F795 HydrophobicContact CE1-CD2 4.25Å
617	Q	98.1	Very high	94.8	Very high	24 Å²	24	43.8 Å²	43.8	11%	0.112	25%	0.248	C	C	.	.	H	α-helix	trans	-65.6	-43.8	-177.4	-62.7	80.1	-1.3	0	0	110.9	W561 L604 L614 S615 V621 F795	W561-Q617 HydrophobicContact CH2-CG 4.13Å; W561-Q617 HydrophobicContact CZ3-CG 4.09Å; L604-Q617 HydrophobicContact CD1-CB 4.41Å; L604-Q617 HydrophobicContact CD2-CB 3.82Å; L614-Q617 VanDerWaalsContact C-OE1 3.22Å; L614-Q617 HydrophobicContact CB-CB 4.47Å; L614-Q617 PolarHBondContact O-N 3.37Å; L614-Q617 PolarHBondContact O-OE1 2.87Å; S615-Q617 VanDerWaalsContact C-N 3.33Å; S615-Q617 PolarHBondContact O-N 3.44Å; Q617-V621 WeakPolarHBondContact O-CB 3.37Å; Q617-V621 VanDerWaalsContact O-CG2 3.25Å; Q617-V621 WeakPolarHBondContact O-CG2 3.38Å; Q617-V621 PolarHBondContact O-N 3.32Å; Q617-V621 VanDerWaalsContact O-N 3.07Å; Q617-F795 HydrophobicContact CB-CD2 4.32Å; Q617-F795 HydrophobicContact CB-CE2 3.8Å; Q617-F795 HydrophobicContact CB-CZ 3.98Å; Q617-F795 HydrophobicContact CG-CD1 4.31Å; Q617-F795 HydrophobicContact CG-CD2 3.92Å; Q617-F795 HydrophobicContact CG-CE1 4.24Å; Q617-F795 HydrophobicContact CG-CE2 3.85Å; Q617-F795 HydrophobicContact CG-CG 4.15Å; Q617-F795 HydrophobicContact CG-CZ 4.02Å; Q617-F795 WeakPolarHBondContact CG-O 3.31Å; Q617-F795 PolarHBondContact NE2-O 2.75Å
618	C	97.9	Very high	94.9	Very high	20 Å²	20	43.4 Å²	43.4	14%	0.135	25%	0.246	C	C	.	.	H	α-helix	trans	-62.7	-49.4	177.2	-70.4	0	0	0	0	111.8	I601 L614 S615 V621 K622	I601-C618 HydrophobicContact CD1-CB 4.15Å; L614-C618 PolarHBondContact O-N 3.24Å; L614-C618 PolarHBondContact O-SG 3.31Å; L614-C618 VanDerWaalsContact O-SG 3.37Å; S615-C618 PolarHBondContact O-N 3.01Å; C618-V621 PolarHBondContact O-N 3.23Å; C618-K622 VanDerWaalsContact O-CB 3.29Å; C618-K622 WeakPolarHBondContact O-CB 3.35Å; C618-K622 PolarHBondContact O-N 3.04Å
619	E	97.9	Very high	95.1	Very high	100 Å²	100	45.3 Å²	45.3	47%	0.467	25%	0.25	S	C	.	.	H	α-helix	trans	-64.5	-44	-180	-69.1	-55.3	135.6	0	0	112.1	S615 V621 K622 L623 L688	S615-E619 WeakPolarHBondContact O-CG 3.29Å; S615-E619 PolarHBondContact O-N 3.39Å; E619-V621 PolarHBondContact O-N 3.06Å; E619-K622 PolarHBondContact O-N 3.03Å; E619-L623 WeakPolarHBondContact O-CG 3.35Å; E619-L623 PolarHBondContact O-N 2.89Å; E619-L688 HydrophobicContact CB-CD1 3.92Å
620	F	98.5	Very high	95.3	Very high	7 Å²	7	44 Å²	44	3%	0.031	24%	0.243	C	C	.	.	H	α-helix	trans	-60.3	-46	178.2	179.8	-98.8	0	0	0	112.1	F616 L623 R624 L688 L789 F791 F795	F616-F620 HydrophobicContact CE1-CB 4.38Å; F616-F620 HydrophobicContact CZ-CB 4.39Å; F616-F620 HydrophobicContact CZ-CD2 4.31Å; F616-F620 HydrophobicContact CZ-CG 4.46Å; F616-F620 WeakPolarHBondContact O-CB 3.49Å; F616-F620 PolarHBondContact O-N 3.16Å; F620-L623 PolarHBondContact O-N 3.41Å; F620-R624 PolarHBondContact O-N 3.06Å; F620-L688 HydrophobicContact CB-CD2 4.09Å; F620-L688 HydrophobicContact CD2-CD2 4.11Å; F620-L789 HydrophobicContact CE1-CD2 4.16Å; F620-L789 HydrophobicContact CZ-CD1 4.34Å; F620-L789 HydrophobicContact CZ-CD2 4.37Å; F620-F791 HydrophobicContact CE1-CD1 4.15Å; F620-F791 HydrophobicContact CE1-CE1 4.04Å; F620-F795 HydrophobicContact CD1-CD2 4.15Å; F620-F795 HydrophobicContact CD1-CE2 4.01Å
621	V	98.5	Very high	95.7	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.006	20%	0.201	C	C	.	.	H	α-helix	trans	-67.9	-39.1	178.1	170.5	0	0	0	0	111	F568 Y597 I601 L604 Q617 C618 E619 R624 I625 F795	F568-V621 HydrophobicContact CD1-CG1 4.32Å; F568-V621 HydrophobicContact CD2-CG2 4.45Å; F568-V621 HydrophobicContact CE1-CB 4.46Å; F568-V621 HydrophobicContact CE1-CG1 3.51Å; F568-V621 HydrophobicContact CE1-CG2 4.11Å; F568-V621 HydrophobicContact CE2-CG2 3.92Å; F568-V621 HydrophobicContact CZ-CB 4.3Å; F568-V621 HydrophobicContact CZ-CG1 3.74Å; F568-V621 HydrophobicContact CZ-CG2 3.73Å; Y597-V621 HydrophobicContact CD1-CG1 4.15Å; I601-V621 HydrophobicContact CB-CG1 3.99Å; I601-V621 HydrophobicContact CD1-CB 4.21Å; I601-V621 HydrophobicContact CD1-CG1 4.09Å; I601-V621 HydrophobicContact CG1-CG1 4.35Å; L604-V621 HydrophobicContact CD2-CG2 4.47Å; Q617-V621 WeakPolarHBondContact O-CB 3.37Å; Q617-V621 VanDerWaalsContact O-CG2 3.25Å; Q617-V621 WeakPolarHBondContact O-CG2 3.38Å; Q617-V621 PolarHBondContact O-N 3.32Å; Q617-V621 VanDerWaalsContact O-N 3.07Å; C618-V621 PolarHBondContact O-N 3.23Å; E619-V621 PolarHBondContact O-N 3.06Å; V621-R624 PolarHBondContact O-N 2.85Å; V621-I625 HydrophobicContact CG1-CD1 4.04Å; V621-I625 WeakPolarHBondContact O-CG1 3.07Å; V621-I625 PolarHBondContact O-N 3.38Å; V621-F795 HydrophobicContact CG2-CE2 4.09Å; V621-F795 HydrophobicContact CG2-CZ 4.18Å
622	K	98.4	Very high	96.2	Very high	84 Å²	84	31.9 Å²	31.9	37%	0.365	17%	0.173	S	C	.	.	H	α-helix	trans	-62.1	-43.9	176.9	-179.9	54.1	178.3	153.6	0	111.5	C618 E619 R624 I625 D626	C618-K622 VanDerWaalsContact O-CB 3.29Å; C618-K622 WeakPolarHBondContact O-CB 3.35Å; C618-K622 PolarHBondContact O-N 3.04Å; E619-K622 PolarHBondContact O-N 3.03Å; K622-R624 VanDerWaalsContact C-N 3.34Å; K622-R624 PolarHBondContact O-N 3.29Å; K622-I625 WeakPolarHBondContact O-CB 3.33Å; K622-I625 PolarHBondContact O-N 3.48Å; K622-D626 WeakPolarHBondContact CE-OD1 3.47Å; K622-D626 IonicContact NZ-OD1 2.8Å; K622-D626 PolarHBondContact NZ-OD1 2.95Å; K622-D626 IonicContact NZ-OD2 2.75Å; K622-D626 VanDerWaalsContact O-CG 3.26Å; K622-D626 PolarHBondContact O-N 2.97Å
623	L	98.5	Very high	96.8	Very high	4 Å²	4	32.8 Å²	32.8	2%	0.021	18%	0.175	C	C	.	.	H	α-helix	trans	-63.5	-38.9	174.6	-71.4	171.7	0	0	0	112.4	E619 F620 I625 D626 L627 L681 R684 Y685 L688	E619-L623 WeakPolarHBondContact O-CG 3.35Å; E619-L623 PolarHBondContact O-N 2.89Å; F620-L623 PolarHBondContact O-N 3.41Å; L623-I625 PolarHBondContact O-N 2.86Å; L623-D626 PolarHBondContact O-N 3.28Å; L623-L627 VanDerWaalsContact O-CB 3.31Å; L623-L627 WeakPolarHBondContact O-CB 3.27Å; L623-L627 PolarHBondContact O-N 3.06Å; L623-L681 HydrophobicContact CD2-CD2 4.34Å; L623-R684 HydrophobicContact CD2-CB 3.51Å; L623-R684 HydrophobicContact CD2-CG 4.42Å; L623-Y685 HydrophobicContact CB-CD1 4.38Å; L623-Y685 HydrophobicContact CB-CE1 3.7Å; L623-Y685 HydrophobicContact CB-CE2 4.48Å; L623-Y685 HydrophobicContact CD1-CD1 3.76Å; L623-Y685 HydrophobicContact CD1-CE1 3.9Å; L623-Y685 HydrophobicContact CD1-CG 4.32Å; L623-Y685 HydrophobicContact CG-CE1 4.4Å; L623-L688 HydrophobicContact CD1-CB 4.08Å; L623-L688 HydrophobicContact CD1-CD2 3.84Å
624	R	97.8	Very high	97	Very high	11 Å²	11	28.9 Å²	28.9	4%	0.042	15%	0.149	C	C	.	.	H	α-helix	trans	-62.3	-41.6	173.8	179.9	57	171	179.1	-1.2	112.1	E572 Y597 F620 V621 K622 L627 L628 L789	E572-R624 IonicContact OE1-CZ 3.25Å; E572-R624 IonicContact OE1-NE 2.61Å; E572-R624 PolarHBondContact OE1-NE 2.92Å; E572-R624 IonicContact OE1-NH2 3.55Å; E572-R624 PolarHBondContact OE1-NH2 3.14Å; E572-R624 IonicContact OE2-NH2 2.75Å; Y597-R624 HydrophobicContact CE1-CG 4.26Å; Y597-R624 HydrophobicContact CE2-CG 4.28Å; F620-R624 PolarHBondContact O-N 3.06Å; V621-R624 PolarHBondContact O-N 2.85Å; K622-R624 VanDerWaalsContact C-N 3.34Å; K622-R624 PolarHBondContact O-N 3.29Å; R624-L627 PolarHBondContact O-N 3.37Å; R624-L628 WeakPolarHBondContact O-CG 3.48Å; R624-L628 PolarHBondContact O-N 2.89Å; R624-L789 HydrophobicContact CG-CD2 4.32Å
625	I	98.5	Very high	96.9	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-59.6	-51.3	174.3	-72.7	166.4	0	0	0	110.5	L594 Y597 H598 I601 V621 K622 L623 L627 L628 Q629	L594-I625 HydrophobicContact CD2-CG2 4.09Å; Y597-I625 HydrophobicContact CD1-CG1 4.47Å; Y597-I625 HydrophobicContact CG-CG1 4.16Å; H598-I625 VanDerWaalsContact CE1-CG2 3.46Å; H598-I625 WeakPolarHBondContact CE1-CG2 3.25Å; I601-I625 HydrophobicContact CB-CD1 4.19Å; I601-I625 HydrophobicContact CG2-CD1 3.81Å; V621-I625 HydrophobicContact CG1-CD1 4.04Å; V621-I625 WeakPolarHBondContact O-CG1 3.07Å; V621-I625 PolarHBondContact O-N 3.38Å; K622-I625 WeakPolarHBondContact O-CB 3.33Å; K622-I625 PolarHBondContact O-N 3.48Å; L623-I625 PolarHBondContact O-N 2.86Å; I625-L627 VanDerWaalsContact C-N 3.29Å; I625-L627 PolarHBondContact O-N 3.37Å; I625-L628 PolarHBondContact O-N 3.42Å; I625-Q629 WeakPolarHBondContact O-CG 3.5Å; I625-Q629 PolarHBondContact O-N 2.96Å
626	D	98.5	Very high	96.7	Very high	14 Å²	14	26.8 Å²	26.8	8%	0.075	14%	0.135	C	C	.	.	H	α-helix	trans	-64.4	-36.8	-176.6	-64.1	-7.2	0	0	0	111.1	K622 L623 Q629 A630 L681 R684	K622-D626 WeakPolarHBondContact CE-OD1 3.47Å; K622-D626 IonicContact NZ-OD1 2.8Å; K622-D626 PolarHBondContact NZ-OD1 2.95Å; K622-D626 IonicContact NZ-OD2 2.75Å; K622-D626 VanDerWaalsContact O-CG 3.26Å; K622-D626 PolarHBondContact O-N 2.97Å; L623-D626 PolarHBondContact O-N 3.28Å; D626-Q629 PolarHBondContact O-N 2.89Å; D626-A630 WeakPolarHBondContact O-CB 3.45Å; D626-A630 PolarHBondContact O-N 2.79Å; D626-L681 HydrophobicContact CB-CD2 3.76Å; D626-R684 IonicContact OD2-CZ 2.88Å; D626-R684 IonicContact OD2-NH1 3.02Å; D626-R684 PolarHBondContact OD2-NH1 3.47Å; D626-R684 IonicContact OD2-NH2 2.97Å; D626-R684 PolarHBondContact OD2-NH2 3.44Å
627	L	97.9	Very high	96.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-62.2	-45.4	172.7	178.7	59.6	0	0	0	112.4	L623 R624 I625 Q629 A630 F631 F678 L681 Y685	L623-L627 VanDerWaalsContact O-CB 3.31Å; L623-L627 WeakPolarHBondContact O-CB 3.27Å; L623-L627 PolarHBondContact O-N 3.06Å; R624-L627 PolarHBondContact O-N 3.37Å; I625-L627 VanDerWaalsContact C-N 3.29Å; I625-L627 PolarHBondContact O-N 3.37Å; L627-Q629 VanDerWaalsContact C-N 3.3Å; L627-Q629 PolarHBondContact O-N 3.49Å; L627-A630 PolarHBondContact O-N 3.36Å; L627-F631 HydrophobicContact CD1-CD2 4.35Å; L627-F631 HydrophobicContact CD1-CE1 3.98Å; L627-F631 HydrophobicContact CD1-CE2 3.81Å; L627-F631 HydrophobicContact CD1-CZ 3.6Å; L627-F631 HydrophobicContact CD2-CE2 4.1Å; L627-F631 HydrophobicContact CD2-CZ 4.36Å; L627-F631 HydrophobicContact CG-CD2 4.15Å; L627-F631 HydrophobicContact CG-CE2 3.67Å; L627-F631 HydrophobicContact CG-CZ 3.98Å; L627-F631 WeakPolarHBondContact O-CG 3.31Å; L627-F631 PolarHBondContact O-N 3.49Å; L627-F678 HydrophobicContact CD1-CD1 4.26Å; L627-F678 HydrophobicContact CD1-CE1 3.95Å; L627-L681 HydrophobicContact CB-CD1 4.47Å; L627-L681 HydrophobicContact CD1-CD1 4.18Å; L627-Y685 HydrophobicContact CD2-CE2 4.45Å
628	L	97.1	Very high	95.9	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-64.8	-35.2	176.4	-70.5	178.5	0	0	0	112.1	L575 L594 Y597 R624 I625 F631 S632 L785	L575-L628 HydrophobicContact CD1-CD1 4.2Å; L575-L628 HydrophobicContact CD1-CD2 4.11Å; L594-L628 HydrophobicContact CD2-CB 3.69Å; L594-L628 HydrophobicContact CD2-CD1 4.42Å; L594-L628 HydrophobicContact CG-CB 4.19Å; Y597-L628 HydrophobicContact CD2-CD1 3.63Å; Y597-L628 HydrophobicContact CE2-CD1 3.53Å; R624-L628 WeakPolarHBondContact O-CG 3.48Å; R624-L628 PolarHBondContact O-N 2.89Å; I625-L628 PolarHBondContact O-N 3.42Å; L628-F631 HydrophobicContact CD2-CD2 4.36Å; L628-F631 PolarHBondContact O-N 2.93Å; L628-S632 WeakPolarHBondContact O-CB 3.31Å; L628-S632 PolarHBondContact O-N 2.78Å; L628-L785 HydrophobicContact CD2-CD2 3.41Å; L628-L785 VanDerWaalsContact CD2-CD2 3.41Å
629	Q	97.6	Very high	95.3	Very high	81 Å²	81	26.5 Å²	26.5	38%	0.379	13%	0.134	S	C	.	.	H	α-helix	trans	-65.4	-43.8	172.8	-70.7	176.7	-9.8	0	0	111.4	L594 H598 I625 D626 L627 F631 S632 Q633	L594-Q629 HydrophobicContact CD1-CG 3.91Å; L594-Q629 HydrophobicContact CD2-CG 3.76Å; H598-Q629 PolarHBondContact NE2-NE2 2.91Å; I625-Q629 WeakPolarHBondContact O-CG 3.5Å; I625-Q629 PolarHBondContact O-N 2.96Å; D626-Q629 PolarHBondContact O-N 2.89Å; L627-Q629 VanDerWaalsContact C-N 3.3Å; L627-Q629 PolarHBondContact O-N 3.49Å; Q629-F631 VanDerWaalsContact C-N 3.34Å; Q629-F631 PolarHBondContact O-N 3.34Å; Q629-S632 PolarHBondContact O-N 3.19Å; Q629-Q633 WeakPolarHBondContact O-CB 3.32Å; Q629-Q633 PolarHBondContact O-N 3Å
630	A	97.8	Very high	94.6	Very high	9 Å²	9	23.2 Å²	23.2	7%	0.074	12%	0.123	C	C	.	.	H	α-helix	trans	-61.9	-40.7	175.4	0	0	0	0	0	111.9	D626 L627 Q633 L634 E677 F678 L681	D626-A630 WeakPolarHBondContact O-CB 3.45Å; D626-A630 PolarHBondContact O-N 2.79Å; L627-A630 PolarHBondContact O-N 3.36Å; A630-Q633 PolarHBondContact O-N 2.93Å; A630-L634 WeakPolarHBondContact O-CB 3.33Å; A630-L634 PolarHBondContact O-N 3.13Å; A630-E677 HydrophobicContact CB-CG 4.11Å; A630-F678 HydrophobicContact CB-CD1 4.35Å; A630-F678 HydrophobicContact CB-CE1 3.7Å; A630-F678 HydrophobicContact CB-CZ 3.8Å; A630-L681 HydrophobicContact CB-CD1 3.79Å
631	F	96	Very high	93.5	Very high	2 Å²	2	24.7 Å²	24.7	1%	0.009	13%	0.131	C	C	.	.	H	α-helix	trans	-63.4	-45.1	172.4	-71.8	-30.5	0	0	0	113	L627 L628 Q629 Q633 L634 I635 F678 I713 I781 L784 L785	L627-F631 HydrophobicContact CD1-CD2 4.35Å; L627-F631 HydrophobicContact CD1-CE1 3.98Å; L627-F631 HydrophobicContact CD1-CE2 3.81Å; L627-F631 HydrophobicContact CD1-CZ 3.6Å; L627-F631 HydrophobicContact CD2-CE2 4.1Å; L627-F631 HydrophobicContact CD2-CZ 4.36Å; L627-F631 HydrophobicContact CG-CD2 4.15Å; L627-F631 HydrophobicContact CG-CE2 3.67Å; L627-F631 HydrophobicContact CG-CZ 3.98Å; L627-F631 WeakPolarHBondContact O-CG 3.31Å; L627-F631 PolarHBondContact O-N 3.49Å; L628-F631 HydrophobicContact CD2-CD2 4.36Å; L628-F631 PolarHBondContact O-N 2.93Å; Q629-F631 VanDerWaalsContact C-N 3.34Å; Q629-F631 PolarHBondContact O-N 3.34Å; F631-Q633 VanDerWaalsContact C-N 3.31Å; F631-Q633 PolarHBondContact O-N 3.28Å; F631-L634 PolarHBondContact O-N 3.34Å; F631-I635 WeakPolarHBondContact O-CG1 3.34Å; F631-I635 PolarHBondContact O-N 2.66Å; F631-F678 AromaticContact CD1-CE1 3.73Å; F631-F678 HydrophobicContact CD1-CE1 3.73Å; F631-F678 AromaticContact CD1-CZ 3.71Å; F631-F678 HydrophobicContact CD1-CZ 3.71Å; F631-F678 AromaticContact CE1-CE1 3.64Å; F631-F678 HydrophobicContact CE1-CE1 3.64Å; F631-F678 AromaticContact CE1-CZ 3.99Å; F631-F678 HydrophobicContact CE1-CZ 3.99Å; F631-I713 HydrophobicContact CE1-CG1 4.15Å; F631-I781 HydrophobicContact CB-CG2 3.82Å; F631-I781 HydrophobicContact CD1-CB 4.49Å; F631-I781 HydrophobicContact CD1-CD1 4.29Å; F631-I781 HydrophobicContact CD1-CG1 3.87Å; F631-I781 HydrophobicContact CD1-CG2 3.95Å; F631-I781 HydrophobicContact CD2-CG2 4.25Å; F631-I781 HydrophobicContact CE1-CG1 4.28Å; F631-I781 HydrophobicContact CG-CG2 3.77Å; F631-L784 HydrophobicContact CZ-CD1 4.26Å; F631-L785 HydrophobicContact CD2-CD1 4.47Å; F631-L785 HydrophobicContact CD2-CD2 3.86Å; F631-L785 HydrophobicContact CD2-CG 4.28Å; F631-L785 HydrophobicContact CE2-CD2 4.03Å
632	S	94.8	Very high	92.2	Very high	27 Å²	27	31.8 Å²	31.8	19%	0.189	16%	0.162	C	C	.	.	H	α-helix	trans	-58.7	-45.3	175.4	-173.9	0	0	0	0	111.3	L628 Q629 I635 C636	L628-S632 WeakPolarHBondContact O-CB 3.31Å; L628-S632 PolarHBondContact O-N 2.78Å; Q629-S632 PolarHBondContact O-N 3.19Å; S632-I635 PolarHBondContact O-N 3.18Å; S632-C636 WeakPolarHBondContact O-CB 3.34Å; S632-C636 PolarHBondContact O-N 2.92Å; S632-C636 PolarHBondContact O-SG 3.15Å
633	Q	94.3	Very high	90.8	Very high	104 Å²	104	33.5 Å²	33.5	49%	0.486	18%	0.179	S	C	.	.	H	α-helix	trans	-62.6	-45	177.6	-174.8	58.1	38	0	0	111.3	Q629 A630 F631 I635 C636 T637	Q629-Q633 WeakPolarHBondContact O-CB 3.32Å; Q629-Q633 PolarHBondContact O-N 3Å; A630-Q633 PolarHBondContact O-N 2.93Å; F631-Q633 VanDerWaalsContact C-N 3.31Å; F631-Q633 PolarHBondContact O-N 3.28Å; Q633-I635 PolarHBondContact O-N 3.43Å; Q633-C636 WeakPolarHBondContact O-CB 3.46Å; Q633-C636 PolarHBondContact O-N 3.43Å; Q633-T637 WeakPolarHBondContact O-CG2 3.22Å; Q633-T637 PolarHBondContact O-N 3.05Å
634	L	94.2	Very high	89.2	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61.2	-46.1	178.3	-178.2	57.8	0	0	0	111.6	A630 F631 C636 T637 C638 M671 F678 I713 I717 I781	A630-L634 WeakPolarHBondContact O-CB 3.33Å; A630-L634 PolarHBondContact O-N 3.13Å; F631-L634 PolarHBondContact O-N 3.34Å; L634-C636 VanDerWaalsContact C-N 3.31Å; L634-C636 PolarHBondContact O-N 3.17Å; L634-T637 WeakPolarHBondContact CA-OG1 3.48Å; L634-T637 PolarHBondContact O-N 3.38Å; L634-T637 VanDerWaalsContact O-N 3.13Å; L634-T637 PolarHBondContact O-OG1 3.28Å; L634-C638 PolarHBondContact O-N 3.16Å; L634-C638 PolarHBondContact O-SG 2.89Å; L634-M671 HydrophobicContact CD1-CE 4.42Å; L634-M671 HydrophobicContact CD1-SD 3.85Å; L634-F678 HydrophobicContact CB-CE2 4.37Å; L634-F678 HydrophobicContact CB-CZ 4.47Å; L634-F678 HydrophobicContact CD2-CE2 3.75Å; L634-F678 HydrophobicContact CD2-CZ 4.06Å; L634-I713 HydrophobicContact CD2-CG2 3.62Å; L634-I717 HydrophobicContact CD1-CD1 4.08Å; L634-I717 HydrophobicContact CD1-CG1 4.41Å; L634-I717 HydrophobicContact CD2-CD1 4.11Å; L634-I781 HydrophobicContact CB-CD1 4.09Å; L634-I781 HydrophobicContact CD2-CD1 3.55Å; L634-I781 HydrophobicContact CD2-CG1 4.31Å; L634-I781 HydrophobicContact CG-CD1 3.84Å
635	I	91.9	Very high	87.4	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-60.2	-42.1	175.4	-65.4	168.9	0	0	0	111	L587 I590 F631 S632 Q633 T637 C638 N639 I781	L587-I635 HydrophobicContact CD1-CG2 4.26Å; L587-I635 HydrophobicContact CD2-CB 3.96Å; L587-I635 HydrophobicContact CD2-CG2 3.75Å; L587-I635 HydrophobicContact CG-CG2 3.87Å; I590-I635 HydrophobicContact CD1-CD1 3.69Å; F631-I635 WeakPolarHBondContact O-CG1 3.34Å; F631-I635 PolarHBondContact O-N 2.66Å; S632-I635 PolarHBondContact O-N 3.18Å; Q633-I635 PolarHBondContact O-N 3.43Å; I635-T637 PolarHBondContact O-N 3.36Å; I635-C638 PolarHBondContact O-N 3.27Å; I635-N639 PolarHBondContact O-N 3.08Å; I635-N639 PolarHBondContact O-ND2 3.27Å; I635-I781 HydrophobicContact CD1-CD1 4.41Å; I635-I781 HydrophobicContact CD1-CG2 3.96Å; I635-I781 HydrophobicContact CG1-CD1 3.77Å; I635-I781 HydrophobicContact CG1-CG2 4.46Å
636	C	90.6	Very high	85.6	Confident	52 Å²	52	41.2 Å²	41.2	35%	0.351	23%	0.232	S	C	.	.	H	α-helix	trans	-60.2	-43.2	174.6	-74.4	0	0	0	0	112.1	S632 Q633 L634 N639 S640	S632-C636 WeakPolarHBondContact O-CB 3.34Å; S632-C636 PolarHBondContact O-N 2.92Å; S632-C636 PolarHBondContact O-SG 3.15Å; Q633-C636 WeakPolarHBondContact O-CB 3.46Å; Q633-C636 PolarHBondContact O-N 3.43Å; L634-C636 VanDerWaalsContact C-N 3.31Å; L634-C636 PolarHBondContact O-N 3.17Å; C636-N639 PolarHBondContact O-N 3.41Å; C636-S640 PolarHBondContact O-N 2.95Å
637	T	89.2	Confident	83.7	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.006	26%	0.26	C	S	.	.	H	α-helix	trans	-64.7	-42.9	176.6	62.3	0	0	0	0	111.8	Q633 L634 I635 N639 S640 I667 Q670	Q633-T637 WeakPolarHBondContact O-CG2 3.22Å; Q633-T637 PolarHBondContact O-N 3.05Å; L634-T637 WeakPolarHBondContact CA-OG1 3.48Å; L634-T637 PolarHBondContact O-N 3.38Å; L634-T637 VanDerWaalsContact O-N 3.13Å; L634-T637 PolarHBondContact O-OG1 3.28Å; I635-T637 PolarHBondContact O-N 3.36Å; T637-N639 VanDerWaalsContact C-N 3.33Å; T637-N639 PolarHBondContact O-N 3.48Å; T637-S640 WeakPolarHBondContact O-CB 3.41Å; T637-S640 PolarHBondContact O-N 3.39Å; T637-S640 VanDerWaalsContact O-N 3.14Å; T637-S640 PolarHBondContact O-OG 3.41Å; T637-I667 WeakPolarHBondContact O-CD1 3.42Å; T637-Q670 HydrophobicContact CG2-CB 3.81Å
638	C	88.8	Confident	81.8	Confident	6 Å²	6	49 Å²	49	4%	0.041	29%	0.289	C	S	.	.	H	α-helix	trans	-57.9	-43.5	173.4	-72.7	0	0	0	0	111.8	L634 I635 S640 L641 T774	L634-C638 PolarHBondContact O-N 3.16Å; L634-C638 PolarHBondContact O-SG 2.89Å; I635-C638 PolarHBondContact O-N 3.27Å; C638-S640 VanDerWaalsContact C-N 3.31Å; C638-S640 PolarHBondContact O-N 2.98Å; C638-L641 VanDerWaalsContact O-CB 3.26Å; C638-L641 WeakPolarHBondContact O-CB 3.41Å; C638-L641 PolarHBondContact O-N 2.77Å; C638-T774 HydrophobicContact CB-CG2 4.25Å
639	N	85.4	Confident	80.1	Confident	50 Å²	50	53.4 Å²	53.4	27%	0.267	31%	0.312	S	S	.	.	H	α-helix	trans	-66.9	-30.8	177.8	-77.8	-28.2	0	0	0	113.1	I635 C636 T637 L641 K642	I635-N639 PolarHBondContact O-N 3.08Å; I635-N639 PolarHBondContact O-ND2 3.27Å; C636-N639 PolarHBondContact O-N 3.41Å; T637-N639 VanDerWaalsContact C-N 3.33Å; T637-N639 PolarHBondContact O-N 3.48Å; N639-L641 PolarHBondContact O-N 3.02Å; N639-K642 PolarHBondContact O-N 3.25Å
640	S	81.9	Confident	78.5	Confident	31 Å²	31	49.8 Å²	49.8	22%	0.217	30%	0.296	C	S	.	.	H	α-helix	trans	-69.3	-11.9	176.8	80.4	0	0	0	0	114	C636 T637 C638 K642 T643 S644	C636-S640 PolarHBondContact O-N 2.95Å; T637-S640 WeakPolarHBondContact O-CB 3.41Å; T637-S640 PolarHBondContact O-N 3.39Å; T637-S640 VanDerWaalsContact O-N 3.14Å; T637-S640 PolarHBondContact O-OG 3.41Å; C638-S640 VanDerWaalsContact C-N 3.31Å; C638-S640 PolarHBondContact O-N 2.98Å; S640-K642 PolarHBondContact O-N 2.87Å; S640-T643 PolarHBondContact O-N 3.46Å; S640-T643 PolarHBondContact O-OG1 2.82Å; S640-S644 PolarHBondContact O-N 3.36Å; S640-S644 PolarHBondContact O-OG 3.16Å; S640-S644 VanDerWaalsContact O-OG 3.12Å
641	L	76.5	Confident	76.9	Confident	39 Å²	39	51.6 Å²	51.6	20%	0.204	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-57.9	-36.6	171.7	-175.2	59.7	0	0	0	111.2	C638 N639 T643 S644 I667 V769 T774	C638-L641 VanDerWaalsContact O-CB 3.26Å; C638-L641 WeakPolarHBondContact O-CB 3.41Å; C638-L641 PolarHBondContact O-N 2.77Å; N639-L641 PolarHBondContact O-N 3.02Å; L641-T643 PolarHBondContact O-N 3.35Å; L641-S644 PolarHBondContact O-N 3.48Å; L641-I667 HydrophobicContact CB-CD1 3.71Å; L641-I667 HydrophobicContact CD1-CD1 3.86Å; L641-I667 HydrophobicContact CD1-CG2 4.39Å; L641-I667 HydrophobicContact CG-CD1 4.29Å; L641-V769 HydrophobicContact CD1-CG1 3.61Å; L641-V769 HydrophobicContact CD2-CG1 4.25Å; L641-T774 HydrophobicContact CD2-CG2 3.66Å
642	K	70	Confident	75.4	Confident	150 Å²	150	55.8 Å²	55.8	65%	0.652	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-64.3	-19.3	178.4	-64.1	179.8	-179.6	175.6	0	113.4	N639 S640	N639-K642 PolarHBondContact O-N 3.25Å; S640-K642 PolarHBondContact O-N 2.87Å
643	T	69.8	Low	74	Confident	120 Å²	120	58.2 Å²	58.2	74%	0.736	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-114.2	8.7	-177	58	0	0	0	0	112.9	S640 L641	S640-T643 PolarHBondContact O-N 3.46Å; S640-T643 PolarHBondContact O-OG1 2.82Å; L641-T643 PolarHBondContact O-N 3.35Å
644	S	64.9	Low	72.8	Confident	39 Å²	39	53.2 Å²	53.2	27%	0.273	32%	0.319	S	S	.	.	S	Bend	trans	-73.2	144.7	178	-68.6	0	0	0	0	111.8	S640 L641	S640-S644 PolarHBondContact O-N 3.36Å; S640-S644 PolarHBondContact O-OG 3.16Å; S640-S644 VanDerWaalsContact O-OG 3.12Å; L641-S644 PolarHBondContact O-N 3.48Å
645	P	60.2	Low	71.4	Confident	56 Å²	56	59.4 Å²	59.4	36%	0.364	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-63.5	149.6	-175.8	24.1	-32	0	0	0	111.9	I649	P645-I649 HydrophobicContact CB-CB 4.47Å
646	P	60.6	Low	70.3	Confident	82 Å²	82	64.8 Å²	64.8	53%	0.532	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-54.2	150.8	-177	-25.7	32	0	0	0	113.7	A648 I649	P646-A648 PolarHBondContact O-N 3.23Å; P646-I649 PolarHBondContact O-N 3.26Å
647	P	58.7	Low	69.1	Low	104 Å²	104	67.7 Å²	67.7	68%	0.675	39%	0.393	S	S	*	.	H	α-helix	trans	-49.9	-29.5	-177	-29.4	34.4	0	0	0	115.6	I649 T651	P647-I649 PolarHBondContact O-N 3.23Å; P647-T651 WeakPolarHBondContact O-CB 3.4Å; P647-T651 PolarHBondContact O-N 3.04Å; P647-T651 PolarHBondContact O-OG1 3.46Å
648	A	57.8	Low	67.7	Low	73 Å²	73	71.1 Å²	71.1	60%	0.603	43%	0.429	S	S	*	.	H	α-helix	trans	-64	-36.9	178.5	0	0	0	0	0	113.9	P646 T652	P646-A648 PolarHBondContact O-N 3.23Å; A648-T652 PolarHBondContact O-OG1 3.04Å
649	I	60.8	Low	66.6	Low	93 Å²	93	73.9 Å²	73.9	48%	0.477	44%	0.444	S	S	.	.	H	α-helix	trans	-78.5	-41.1	179.6	-62	173.8	0	0	0	110.2	P645 P646 P647 T651 T652 I653	P645-I649 HydrophobicContact CB-CB 4.47Å; P646-I649 PolarHBondContact O-N 3.26Å; P647-I649 PolarHBondContact O-N 3.23Å; I649-T651 PolarHBondContact O-N 3.11Å; I649-T652 PolarHBondContact O-N 2.91Å; I649-I653 HydrophobicContact CG2-CD1 3.96Å; I649-I653 WeakPolarHBondContact O-CG1 3.43Å; I649-I653 PolarHBondContact O-N 2.89Å
650	A	64.3	Low	65.5	Low	5 Å²	5	76.5 Å²	76.5	4%	0.041	46%	0.458	C	S	.	.	H	α-helix	trans	-64.7	-38.8	178.7	0	0	0	0	0	112.6	T652 I653 A654 R663	A650-T652 PolarHBondContact O-N 3.38Å; A650-I653 PolarHBondContact O-N 3.38Å; A650-A654 WeakPolarHBondContact O-CB 3.44Å; A650-A654 PolarHBondContact O-N 3.34Å; A650-R663 WeakPolarHBondContact CB-O 3.13Å
651	T	65.6	Low	64.7	Low	47 Å²	47	78.4 Å²	78.4	29%	0.288	47%	0.465	S	S	.	.	H	α-helix	trans	-65.1	-39.9	178.3	-54.5	0	0	0	0	112.1	P647 I649 A654 M655	P647-T651 WeakPolarHBondContact O-CB 3.4Å; P647-T651 PolarHBondContact O-N 3.04Å; P647-T651 PolarHBondContact O-OG1 3.46Å; I649-T651 PolarHBondContact O-N 3.11Å; T651-A654 PolarHBondContact O-N 3.48Å; T651-M655 HydrophobicContact CG2-CE 3.94Å; T651-M655 HydrophobicContact CG2-SD 4.32Å; T651-M655 WeakPolarHBondContact O-CG 3.2Å; T651-M655 PolarHBondContact O-N 3.37Å
652	T	64.1	Low	64.1	Low	90 Å²	90	78.3 Å²	78.3	55%	0.552	46%	0.464	S	S	*	.	H	α-helix	trans	-66	-40.2	178.7	-52.7	0	0	0	0	111.4	A648 I649 A650 T656	A648-T652 PolarHBondContact O-OG1 3.04Å; I649-T652 PolarHBondContact O-N 2.91Å; A650-T652 PolarHBondContact O-N 3.38Å; T652-T656 PolarHBondContact O-N 2.84Å; T652-T656 VanDerWaalsContact O-N 3.14Å; T652-T656 PolarHBondContact O-OG1 2.73Å
653	I	65.1	Low	63.8	Low	78 Å²	78	76.8 Å²	76.8	40%	0.4	45%	0.454	S	S	.	.	H	α-helix	trans	-65.9	-44	176.6	-66.3	167.6	0	0	0	110.8	I649 A650 M655 T656 L657	I649-I653 HydrophobicContact CG2-CD1 3.96Å; I649-I653 WeakPolarHBondContact O-CG1 3.43Å; I649-I653 PolarHBondContact O-N 2.89Å; A650-I653 PolarHBondContact O-N 3.38Å; I653-M655 PolarHBondContact O-N 3.29Å; I653-T656 PolarHBondContact O-N 3.46Å; I653-L657 HydrophobicContact CG2-CD1 3.79Å; I653-L657 PolarHBondContact O-N 2.92Å
654	A	68.1	Low	63.5	Low	0 Å²	0	72.8 Å²	72.8	0%	0	43%	0.43	C	S	.	.	H	α-helix	trans	-62.3	-41.7	178.2	0	0	0	0	0	113.1	A650 T651 T656 L657 G658 N659 Q662 R663	A650-A654 WeakPolarHBondContact O-CB 3.44Å; A650-A654 PolarHBondContact O-N 3.34Å; T651-A654 PolarHBondContact O-N 3.48Å; A654-T656 VanDerWaalsContact C-N 3.32Å; A654-T656 PolarHBondContact O-N 3.31Å; A654-L657 PolarHBondContact O-N 3.47Å; A654-G658 PolarHBondContact O-N 3.28Å; A654-N659 WeakPolarHBondContact CB-O 3.17Å; A654-N659 PolarHBondContact O-N 3.44Å; A654-Q662 HydrophobicContact CB-CB 3.93Å; A654-R663 HydrophobicContact CB-CB 4.24Å; A654-R663 HydrophobicContact CB-CG 3.39Å
655	M	65.7	Low	63.7	Low	130 Å²	130	71.6 Å²	71.6	64%	0.64	42%	0.424	S	S	*	.	H	α-helix	trans	-65.5	-34.4	175.1	-73	178.1	171.7	0	0	112.4	T651 I653	T651-M655 HydrophobicContact CG2-CE 3.94Å; T651-M655 HydrophobicContact CG2-SD 4.32Å; T651-M655 WeakPolarHBondContact O-CG 3.2Å; T651-M655 PolarHBondContact O-N 3.37Å; I653-M655 PolarHBondContact O-N 3.29Å
656	T	67.7	Low	64.4	Low	114 Å²	114	78.6 Å²	78.6	70%	0.699	44%	0.443	S	S	*	.	H	α-helix	trans	-74.7	-32.8	-180	-50.6	0	0	0	0	112.4	T652 I653 A654	T652-T656 PolarHBondContact O-N 2.84Å; T652-T656 VanDerWaalsContact O-N 3.14Å; T652-T656 PolarHBondContact O-OG1 2.73Å; I653-T656 PolarHBondContact O-N 3.46Å; A654-T656 VanDerWaalsContact C-N 3.32Å; A654-T656 PolarHBondContact O-N 3.31Å
657	L	66.6	Low	65.3	Low	113 Å²	113	74.8 Å²	74.8	59%	0.592	42%	0.418	S	S	*	.	H	α-helix	trans	-99.8	-2.8	-176.5	-71.5	164.9	0	0	0	113.9	I653 A654 N659	I653-L657 HydrophobicContact CG2-CD1 3.79Å; I653-L657 PolarHBondContact O-N 2.92Å; A654-L657 PolarHBondContact O-N 3.47Å; L657-N659 VanDerWaalsContact C-N 3.28Å; L657-N659 PolarHBondContact O-N 3.07Å
658	G	59.3	Low	66.2	Low	74 Å²	74	70 Å²	70	76%	0.763	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.6	25.8	178	0	0	0	0	0	114.4	A654	A654-G658 PolarHBondContact O-N 3.28Å
659	N	65.4	Low	67.4	Low	63 Å²	63	70.5 Å²	70.5	34%	0.337	38%	0.38	S	S	.	.			trans	-127.1	103.4	-176.2	-173.8	-8.6	0	0	0	110.9	A654 L657 L661 Q662	A654-N659 WeakPolarHBondContact CB-O 3.17Å; A654-N659 PolarHBondContact O-N 3.44Å; L657-N659 VanDerWaalsContact C-N 3.28Å; L657-N659 PolarHBondContact O-N 3.07Å; N659-L661 PolarHBondContact O-N 3.39Å; N659-L661 WeakPolarHBondContact OD1-CB 3.49Å; N659-L661 PolarHBondContact OD1-N 3.04Å; N659-Q662 HydrophobicContact CB-CG 4.17Å; N659-Q662 WeakPolarHBondContact O-CB 3.43Å; N659-Q662 PolarHBondContact O-N 3.49Å
660	D	63.3	Low	68.6	Low	106 Å²	106	69.5 Å²	69.5	57%	0.567	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-63.9	-24.5	-175.4	-76.9	-36.5	0	0	0	113.7	Q662 R663	D660-Q662 PolarHBondContact O-N 2.89Å; D660-R663 VanDerWaalsContact O-CB 3.24Å; D660-R663 WeakPolarHBondContact O-CB 3.42Å; D660-R663 VanDerWaalsContact O-CG 3.29Å; D660-R663 WeakPolarHBondContact O-CG 3.28Å; D660-R663 PolarHBondContact O-N 3.04Å; D660-R663 IonicContact OD1-CZ 2.74Å; D660-R663 IonicContact OD1-NE 3.83Å; D660-R663 PolarHBondContact OD1-NE 3.24Å; D660-R663 IonicContact OD1-NH2 2.66Å; D660-R663 PolarHBondContact OD1-NH2 3.5Å
661	L	64	Low	69.8	Low	71 Å²	71	69.3 Å²	69.3	37%	0.372	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-63.6	-22.2	172.7	-89.7	142.4	0	0	0	113.4	N659 R663 C664 S668 L722	N659-L661 PolarHBondContact O-N 3.39Å; N659-L661 WeakPolarHBondContact OD1-CB 3.49Å; N659-L661 PolarHBondContact OD1-N 3.04Å; L661-R663 VanDerWaalsContact C-N 3.25Å; L661-R663 PolarHBondContact O-N 3.35Å; L661-C664 PolarHBondContact O-N 3.49Å; L661-S668 PolarHBondContact O-OG 2.92Å; L661-L722 HydrophobicContact CD2-CB 4.5Å; L661-L722 HydrophobicContact CD2-CD2 3.95Å
662	Q	65.3	Low	70.9	Confident	37 Å²	37	72.1 Å²	72.1	17%	0.173	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-77.1	-10.7	175.4	-66.6	-168.6	-7.2	0	0	113.1	A654 N659 D660 C664 G665	A654-Q662 HydrophobicContact CB-CB 3.93Å; N659-Q662 HydrophobicContact CB-CG 4.17Å; N659-Q662 WeakPolarHBondContact O-CB 3.43Å; N659-Q662 PolarHBondContact O-N 3.49Å; D660-Q662 PolarHBondContact O-N 2.89Å; Q662-C664 PolarHBondContact O-N 3.06Å; Q662-G665 PolarHBondContact O-N 3.5Å
663	R	62.3	Low	72.3	Confident	117 Å²	117	74.1 Å²	74.1	44%	0.442	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-61.3	-24.3	170.8	-64.9	-176	-170.9	-161.9	5.4	111.5	A650 A654 D660 L661	A650-R663 WeakPolarHBondContact CB-O 3.13Å; A654-R663 HydrophobicContact CB-CB 4.24Å; A654-R663 HydrophobicContact CB-CG 3.39Å; D660-R663 VanDerWaalsContact O-CB 3.24Å; D660-R663 WeakPolarHBondContact O-CB 3.42Å; D660-R663 VanDerWaalsContact O-CG 3.29Å; D660-R663 WeakPolarHBondContact O-CG 3.28Å; D660-R663 PolarHBondContact O-N 3.04Å; D660-R663 IonicContact OD1-CZ 2.74Å; D660-R663 IonicContact OD1-NE 3.83Å; D660-R663 PolarHBondContact OD1-NE 3.24Å; D660-R663 IonicContact OD1-NH2 2.66Å; D660-R663 PolarHBondContact OD1-NH2 3.5Å; L661-R663 VanDerWaalsContact C-N 3.25Å; L661-R663 PolarHBondContact O-N 3.35Å
664	C	63.3	Low	73.7	Confident	37 Å²	37	70.9 Å²	70.9	25%	0.25	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-86.7	1.3	174.9	-57.3	0	0	0	0	113.8	L661 Q662 I667 S668 V769	L661-C664 PolarHBondContact O-N 3.49Å; Q662-C664 PolarHBondContact O-N 3.06Å; C664-I667 VanDerWaalsContact O-CG2 3.31Å; C664-I667 WeakPolarHBondContact O-CG2 3.17Å; C664-S668 WeakPolarHBondContact CB-OG 3.49Å; C664-V769 HydrophobicContact CB-CB 4.13Å; C664-V769 HydrophobicContact CB-CG2 3.66Å
665	G	70.6	Confident	75	Confident	13 Å²	13	71.3 Å²	71.3	13%	0.134	37%	0.369	C	S	.	.			trans	87.6	-165.9	174.5	0	0	0	0	0	115.6	Q662 I667	Q662-G665 PolarHBondContact O-N 3.5Å; G665-I667 PolarHBondContact O-N 3.02Å
666	R	74.2	Confident	76.4	Confident	204 Å²	204	69.9 Å²	69.9	77%	0.77	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-19.8	-176.8	-67.8	-177.5	-179	177.7	0.3	113.6	S668 N669	R666-S668 VanDerWaalsContact C-N 3.3Å; R666-S668 PolarHBondContact O-N 3.46Å; R666-N669 PolarHBondContact O-N 3.07Å
667	I	79.1	Confident	77.9	Confident	2 Å²	2	68.1 Å²	68.1	1%	0.01	34%	0.344	C	S	.	.	H	α-helix	trans	-64.4	-32.1	-179	-166	172.2	0	0	0	112.3	T637 L641 C664 G665 N669 Q670 M671 V769	T637-I667 WeakPolarHBondContact O-CD1 3.42Å; L641-I667 HydrophobicContact CB-CD1 3.71Å; L641-I667 HydrophobicContact CD1-CD1 3.86Å; L641-I667 HydrophobicContact CD1-CG2 4.39Å; L641-I667 HydrophobicContact CG-CD1 4.29Å; C664-I667 VanDerWaalsContact O-CG2 3.31Å; C664-I667 WeakPolarHBondContact O-CG2 3.17Å; G665-I667 PolarHBondContact O-N 3.02Å; I667-N669 VanDerWaalsContact C-N 3.3Å; I667-N669 PolarHBondContact O-N 2.74Å; I667-Q670 PolarHBondContact O-N 2.66Å; I667-Q670 VanDerWaalsContact O-N 3.12Å; I667-M671 HydrophobicContact CD1-CE 3.91Å; I667-M671 HydrophobicContact CG1-CE 3.98Å; I667-M671 HydrophobicContact CG1-CG 4.14Å; I667-M671 WeakPolarHBondContact O-CB 3.49Å; I667-M671 VanDerWaalsContact O-CG 3.28Å; I667-M671 WeakPolarHBondContact O-CG 3.46Å; I667-M671 PolarHBondContact O-N 3.09Å; I667-V769 HydrophobicContact CD1-CG1 4.3Å; I667-V769 HydrophobicContact CG2-CG1 3.77Å
668	S	77.9	Confident	79.4	Confident	4 Å²	4	62.7 Å²	62.7	3%	0.028	32%	0.316	C	S	.	.	H	α-helix	trans	-58.9	-40.1	177.7	-49.9	0	0	0	0	112.5	L661 C664 R666 M671 K672	L661-S668 PolarHBondContact O-OG 2.92Å; C664-S668 WeakPolarHBondContact CB-OG 3.49Å; R666-S668 VanDerWaalsContact C-N 3.3Å; R666-S668 PolarHBondContact O-N 3.46Å; S668-M671 PolarHBondContact O-N 3.5Å; S668-K672 WeakPolarHBondContact O-CB 3.41Å; S668-K672 PolarHBondContact O-N 3.15Å
669	N	82	Confident	81.2	Confident	83 Å²	83	64 Å²	64	44%	0.444	30%	0.298	S	S	.	.	H	α-helix	trans	-69.3	-38.5	177.3	-70.1	-20.7	0	0	0	111.8	R666 I667 K672 Q673	R666-N669 PolarHBondContact O-N 3.07Å; I667-N669 VanDerWaalsContact C-N 3.3Å; I667-N669 PolarHBondContact O-N 2.74Å; N669-K672 PolarHBondContact O-N 2.97Å; N669-Q673 WeakPolarHBondContact O-CG 3.33Å; N669-Q673 PolarHBondContact O-N 3.14Å
670	Q	87.6	Confident	82.8	Confident	72 Å²	72	63.5 Å²	63.5	34%	0.336	30%	0.3	S	S	.	.	H	α-helix	trans	-67.8	-40.8	176.7	-66.4	-178.1	-10	0	0	111.3	T637 I667 K672 Q673 S674	T637-Q670 HydrophobicContact CG2-CB 3.81Å; I667-Q670 PolarHBondContact O-N 2.66Å; I667-Q670 VanDerWaalsContact O-N 3.12Å; Q670-K672 VanDerWaalsContact C-N 3.34Å; Q670-K672 PolarHBondContact O-N 3.13Å; Q670-Q673 WeakPolarHBondContact O-CB 3.13Å; Q670-Q673 PolarHBondContact O-N 3.49Å; Q670-S674 PolarHBondContact O-N 3.04Å; Q670-S674 PolarHBondContact O-OG 3.48Å
671	M	88.8	Confident	84.4	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.9	-41.5	174.2	-70.8	-68	177.1	0	0	111.6	L634 I667 S668 S674 M675 I717 I721 L722 T774	L634-M671 HydrophobicContact CD1-CE 4.42Å; L634-M671 HydrophobicContact CD1-SD 3.85Å; I667-M671 HydrophobicContact CD1-CE 3.91Å; I667-M671 HydrophobicContact CG1-CE 3.98Å; I667-M671 HydrophobicContact CG1-CG 4.14Å; I667-M671 WeakPolarHBondContact O-CB 3.49Å; I667-M671 VanDerWaalsContact O-CG 3.28Å; I667-M671 WeakPolarHBondContact O-CG 3.46Å; I667-M671 PolarHBondContact O-N 3.09Å; S668-M671 PolarHBondContact O-N 3.5Å; M671-S674 PolarHBondContact O-N 3.48Å; M671-M675 WeakPolarHBondContact O-CB 3.36Å; M671-M675 PolarHBondContact O-N 3.37Å; M671-I717 HydrophobicContact CB-CG2 4Å; M671-I717 HydrophobicContact SD-CG2 4.43Å; M671-I721 HydrophobicContact CB-CG2 4.04Å; M671-I721 HydrophobicContact CG-CG2 3.93Å; M671-L722 HydrophobicContact CB-CD2 4.43Å; M671-T774 HydrophobicContact CE-CG2 4.49Å
672	K	89	Confident	86.1	Confident	107 Å²	107	55.2 Å²	55.2	47%	0.465	26%	0.256	S	S	.	.	H	α-helix	trans	-61	-44.4	173.8	-172.2	177.7	178.6	179.7	0	112.1	S668 N669 Q670 M675 E676 L722	S668-K672 WeakPolarHBondContact O-CB 3.41Å; S668-K672 PolarHBondContact O-N 3.15Å; N669-K672 PolarHBondContact O-N 2.97Å; Q670-K672 VanDerWaalsContact C-N 3.34Å; Q670-K672 PolarHBondContact O-N 3.13Å; K672-M675 HydrophobicContact CG-CE 4.39Å; K672-M675 WeakPolarHBondContact O-CB 3.36Å; K672-M675 PolarHBondContact O-N 2.72Å; K672-E676 WeakPolarHBondContact CE-OE1 3.24Å; K672-E676 WeakPolarHBondContact O-CG 3.36Å; K672-E676 PolarHBondContact O-N 2.99Å; K672-L722 HydrophobicContact CB-CD1 4.29Å
673	Q	92.9	Very high	87.6	Confident	132 Å²	132	56.9 Å²	56.9	62%	0.617	27%	0.272	S	S	*	.	H	α-helix	trans	-61.5	-43.6	174.9	-72.7	174.8	5.3	0	0	111.9	N669 Q670 M675 E676 E677	N669-Q673 WeakPolarHBondContact O-CG 3.33Å; N669-Q673 PolarHBondContact O-N 3.14Å; Q670-Q673 WeakPolarHBondContact O-CB 3.13Å; Q670-Q673 PolarHBondContact O-N 3.49Å; Q673-M675 PolarHBondContact O-N 3.2Å; Q673-E676 PolarHBondContact O-N 3.48Å; Q673-E677 PolarHBondContact O-N 3.5Å
674	S	95	Very high	89.3	Confident	9 Å²	9	54.9 Å²	54.9	6%	0.063	26%	0.264	C	S	.	.	H	α-helix	trans	-61.3	-43.6	175.2	-67.3	0	0	0	0	112	Q670 M671 E677 F678	Q670-S674 PolarHBondContact O-N 3.04Å; Q670-S674 PolarHBondContact O-OG 3.48Å; M671-S674 PolarHBondContact O-N 3.48Å; S674-E677 PolarHBondContact O-N 2.84Å; S674-F678 WeakPolarHBondContact O-CD2 3.38Å; S674-F678 PolarHBondContact O-N 2.91Å
675	M	94.7	Very high	91	Very high	10 Å²	10	53.2 Å²	53.2	5%	0.049	25%	0.253	C	S	.	.	H	α-helix	trans	-59.4	-47	175.6	-176.6	-170.1	67.7	0	0	111.8	M671 K672 Q673 E677 F678 R679 S714 I717 E718 L722	M671-M675 WeakPolarHBondContact O-CB 3.36Å; M671-M675 PolarHBondContact O-N 3.37Å; K672-M675 HydrophobicContact CG-CE 4.39Å; K672-M675 WeakPolarHBondContact O-CB 3.36Å; K672-M675 PolarHBondContact O-N 2.72Å; Q673-M675 PolarHBondContact O-N 3.2Å; M675-E677 VanDerWaalsContact C-N 3.33Å; M675-E677 PolarHBondContact O-N 3.12Å; M675-F678 PolarHBondContact O-N 3.31Å; M675-R679 WeakPolarHBondContact O-CG 3.49Å; M675-R679 PolarHBondContact O-N 3.43Å; M675-S714 VanDerWaalsContact CG-OG 3.29Å; M675-S714 WeakPolarHBondContact CG-OG 3.41Å; M675-I717 HydrophobicContact CB-CB 4.47Å; M675-I717 HydrophobicContact CB-CD1 4.45Å; M675-I717 HydrophobicContact CB-CG2 4.09Å; M675-E718 HydrophobicContact SD-CB 3.83Å; M675-E718 HydrophobicContact SD-CG 4.17Å; M675-L722 HydrophobicContact CE-CD1 3.93Å; M675-L722 HydrophobicContact SD-CD1 3.73Å
676	E	95.9	Very high	92.3	Very high	100 Å²	100	53.2 Å²	53.2	47%	0.467	25%	0.253	S	S	.	.	H	α-helix	trans	-61.5	-39.6	176.6	-73	171.7	-168.5	0	0	111.9	K672 Q673 R679 S680	K672-E676 WeakPolarHBondContact CE-OE1 3.24Å; K672-E676 WeakPolarHBondContact O-CG 3.36Å; K672-E676 PolarHBondContact O-N 2.99Å; Q673-E676 PolarHBondContact O-N 3.48Å; E676-R679 PolarHBondContact O-N 3.1Å; E676-S680 WeakPolarHBondContact O-CB 3.3Å; E676-S680 PolarHBondContact O-N 3.15Å
677	E	97.9	Very high	93.3	Very high	76 Å²	76	46.5 Å²	46.5	36%	0.355	23%	0.232	S	C	.	.	H	α-helix	trans	-63.6	-43.4	174.8	-175.9	57.4	-148.6	0	0	111.9	A630 Q673 S674 M675 R679 S680 L681 R684	A630-E677 HydrophobicContact CB-CG 4.11Å; Q673-E677 PolarHBondContact O-N 3.5Å; S674-E677 PolarHBondContact O-N 2.84Å; M675-E677 VanDerWaalsContact C-N 3.33Å; M675-E677 PolarHBondContact O-N 3.12Å; E677-R679 PolarHBondContact O-N 3.14Å; E677-S680 WeakPolarHBondContact O-CB 3.44Å; E677-S680 PolarHBondContact O-N 2.96Å; E677-L681 HydrophobicContact CG-CD1 4.3Å; E677-L681 WeakPolarHBondContact O-CG 3.29Å; E677-L681 PolarHBondContact O-N 3.3Å; E677-R684 IonicContact OE1-NH2 3.34Å; E677-R684 PolarHBondContact OE1-NH2 3.29Å
678	F	98.1	Very high	94.2	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-65.5	-35.9	175.5	-73.3	-64	0	0	0	112.8	L627 A630 F631 L634 S674 M675 L681 A682 I713 I717	L627-F678 HydrophobicContact CD1-CD1 4.26Å; L627-F678 HydrophobicContact CD1-CE1 3.95Å; A630-F678 HydrophobicContact CB-CD1 4.35Å; A630-F678 HydrophobicContact CB-CE1 3.7Å; A630-F678 HydrophobicContact CB-CZ 3.8Å; F631-F678 AromaticContact CD1-CE1 3.73Å; F631-F678 HydrophobicContact CD1-CE1 3.73Å; F631-F678 AromaticContact CD1-CZ 3.71Å; F631-F678 HydrophobicContact CD1-CZ 3.71Å; F631-F678 AromaticContact CE1-CE1 3.64Å; F631-F678 HydrophobicContact CE1-CE1 3.64Å; F631-F678 AromaticContact CE1-CZ 3.99Å; F631-F678 HydrophobicContact CE1-CZ 3.99Å; L634-F678 HydrophobicContact CB-CE2 4.37Å; L634-F678 HydrophobicContact CB-CZ 4.47Å; L634-F678 HydrophobicContact CD2-CE2 3.75Å; L634-F678 HydrophobicContact CD2-CZ 4.06Å; S674-F678 WeakPolarHBondContact O-CD2 3.38Å; S674-F678 PolarHBondContact O-N 2.91Å; M675-F678 PolarHBondContact O-N 3.31Å; F678-L681 HydrophobicContact CD1-CD1 4.19Å; F678-L681 PolarHBondContact O-N 3.37Å; F678-A682 WeakPolarHBondContact O-CB 3.45Å; F678-A682 PolarHBondContact O-N 2.8Å; F678-I713 HydrophobicContact CD1-CG2 4.44Å; F678-I713 HydrophobicContact CD2-CG2 3.81Å; F678-I713 HydrophobicContact CE1-CG2 4.21Å; F678-I713 HydrophobicContact CE2-CG2 3.58Å; F678-I713 HydrophobicContact CG-CG2 4.28Å; F678-I713 HydrophobicContact CZ-CG2 3.8Å; F678-I717 HydrophobicContact CD2-CD1 3.92Å; F678-I717 HydrophobicContact CE2-CD1 4.06Å
679	R	97.6	Very high	95.1	Very high	101 Å²	101	48.6 Å²	48.6	38%	0.381	24%	0.241	S	C	.	.	H	α-helix	trans	-65.5	-41.2	172.5	-71.5	177.5	178.6	174.5	-2.6	111.6	M675 E676 E677 A682 S683 S714 E718	M675-R679 WeakPolarHBondContact O-CG 3.49Å; M675-R679 PolarHBondContact O-N 3.43Å; E676-R679 PolarHBondContact O-N 3.1Å; E677-R679 PolarHBondContact O-N 3.14Å; R679-A682 PolarHBondContact O-N 3.4Å; R679-S683 PolarHBondContact O-N 3.44Å; R679-S714 WeakPolarHBondContact CG-OG 3.22Å; R679-S714 PolarHBondContact NE-OG 3.5Å; R679-E718 IonicContact CZ-OE1 3.72Å; R679-E718 IonicContact NH2-OE1 3.07Å; R679-E718 PolarHBondContact NH2-OE1 3.31Å; R679-E718 IonicContact NH2-OE2 3.31Å; R679-E718 PolarHBondContact NH2-OE2 3.15Å
680	S	98.3	Very high	95.8	Very high	53 Å²	53	47.6 Å²	47.6	37%	0.371	23%	0.233	S	C	.	.	H	α-helix	trans	-60.6	-47.8	173.4	174.8	0	0	0	0	111.5	E676 E677 A682 S683 R684	E676-S680 WeakPolarHBondContact O-CB 3.3Å; E676-S680 PolarHBondContact O-N 3.15Å; E677-S680 WeakPolarHBondContact O-CB 3.44Å; E677-S680 PolarHBondContact O-N 2.96Å; S680-A682 PolarHBondContact O-N 3.46Å; S680-S683 WeakPolarHBondContact O-CB 3.21Å; S680-S683 PolarHBondContact O-N 3.32Å; S680-R684 WeakPolarHBondContact O-CG 3.31Å; S680-R684 PolarHBondContact O-N 3.14Å
681	L	98.4	Very high	96.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-58.2	-45.5	174.3	-77.1	165.6	0	0	0	112	L623 D626 L627 A630 E677 F678 S683 R684 Y685	L623-L681 HydrophobicContact CD2-CD2 4.34Å; D626-L681 HydrophobicContact CB-CD2 3.76Å; L627-L681 HydrophobicContact CB-CD1 4.47Å; L627-L681 HydrophobicContact CD1-CD1 4.18Å; A630-L681 HydrophobicContact CB-CD1 3.79Å; E677-L681 HydrophobicContact CG-CD1 4.3Å; E677-L681 WeakPolarHBondContact O-CG 3.29Å; E677-L681 PolarHBondContact O-N 3.3Å; F678-L681 HydrophobicContact CD1-CD1 4.19Å; F678-L681 PolarHBondContact O-N 3.37Å; L681-S683 VanDerWaalsContact C-N 3.32Å; L681-S683 PolarHBondContact O-N 3.32Å; L681-R684 PolarHBondContact O-N 2.92Å; L681-Y685 VanDerWaalsContact O-CD2 3.28Å; L681-Y685 WeakPolarHBondContact O-CD2 3.28Å; L681-Y685 PolarHBondContact O-N 2.85Å
682	A	98.3	Very high	96.4	Very high	3 Å²	3	46.5 Å²	46.5	3%	0.025	24%	0.236	C	C	.	.	H	α-helix	trans	-61.1	-40.1	176.6	0	0	0	0	0	112.1	F678 R679 S680 Y685 G686 Q707 C710 L711	F678-A682 WeakPolarHBondContact O-CB 3.45Å; F678-A682 PolarHBondContact O-N 2.8Å; R679-A682 PolarHBondContact O-N 3.4Å; S680-A682 PolarHBondContact O-N 3.46Å; A682-Y685 PolarHBondContact O-N 3.38Å; A682-G686 PolarHBondContact O-N 2.59Å; A682-Q707 HydrophobicContact CB-CG 4.13Å; A682-Q707 WeakPolarHBondContact O-CG 3.07Å; A682-Q707 PolarHBondContact O-NE2 3.44Å; A682-C710 HydrophobicContact CB-CB 4.05Å; A682-L711 HydrophobicContact CB-CD2 3.58Å; A682-L711 HydrophobicContact CB-CG 3.73Å
683	S	97.9	Very high	96.6	Very high	71 Å²	71	41.5 Å²	41.5	50%	0.497	22%	0.215	S	C	.	.	H	α-helix	trans	-61.3	-47	173.4	-172.3	0	0	0	0	111.4	R679 S680 L681 Y685 G686 D687	R679-S683 PolarHBondContact O-N 3.44Å; S680-S683 WeakPolarHBondContact O-CB 3.21Å; S680-S683 PolarHBondContact O-N 3.32Å; L681-S683 VanDerWaalsContact C-N 3.32Å; L681-S683 PolarHBondContact O-N 3.32Å; S683-Y685 PolarHBondContact O-N 2.64Å; S683-G686 CarbonylContact O-C 3.49Å; S683-G686 WeakPolarHBondContact O-CA 3.35Å; S683-G686 PolarHBondContact O-N 2.89Å; S683-D687 PolarHBondContact O-N 2.74Å
684	R	98.3	Very high	96.6	Very high	76 Å²	76	35.4 Å²	35.4	29%	0.287	19%	0.186	S	C	.	.	H	α-helix	trans	-66	-34.1	-180	-67.2	-171.3	-75.5	157.3	-9.6	113.1	L623 D626 E677 S680 L681 G686 D687 L688	L623-R684 HydrophobicContact CD2-CB 3.51Å; L623-R684 HydrophobicContact CD2-CG 4.42Å; D626-R684 IonicContact OD2-CZ 2.88Å; D626-R684 IonicContact OD2-NH1 3.02Å; D626-R684 PolarHBondContact OD2-NH1 3.47Å; D626-R684 IonicContact OD2-NH2 2.97Å; D626-R684 PolarHBondContact OD2-NH2 3.44Å; E677-R684 IonicContact OE1-NH2 3.34Å; E677-R684 PolarHBondContact OE1-NH2 3.29Å; S680-R684 WeakPolarHBondContact O-CG 3.31Å; S680-R684 PolarHBondContact O-N 3.14Å; L681-R684 PolarHBondContact O-N 2.92Å; R684-G686 VanDerWaalsContact C-N 3.33Å; R684-D687 PolarHBondContact O-N 3Å; R684-L688 PolarHBondContact O-N 3.42Å
685	Y	98.4	Very high	96.6	Very high	1 Å²	1	35 Å²	35	0%	0.004	18%	0.183	C	C	.	.	H	α-helix	trans	-64.2	-38.9	169.3	-81.8	-60.5	0	0	0	111.9	L623 L627 L681 A682 S683 D687 L688 Y689 V703 Q706	L623-Y685 HydrophobicContact CB-CD1 4.38Å; L623-Y685 HydrophobicContact CB-CE1 3.7Å; L623-Y685 HydrophobicContact CB-CE2 4.48Å; L623-Y685 HydrophobicContact CD1-CD1 3.76Å; L623-Y685 HydrophobicContact CD1-CE1 3.9Å; L623-Y685 HydrophobicContact CD1-CG 4.32Å; L623-Y685 HydrophobicContact CG-CE1 4.4Å; L627-Y685 HydrophobicContact CD2-CE2 4.45Å; L681-Y685 VanDerWaalsContact O-CD2 3.28Å; L681-Y685 WeakPolarHBondContact O-CD2 3.28Å; L681-Y685 PolarHBondContact O-N 2.85Å; A682-Y685 PolarHBondContact O-N 3.38Å; S683-Y685 PolarHBondContact O-N 2.64Å; Y685-D687 VanDerWaalsContact C-N 3.34Å; Y685-L688 PolarHBondContact O-N 3.21Å; Y685-Y689 WeakPolarHBondContact O-CB 3.43Å; Y685-Y689 PolarHBondContact O-N 3.31Å; Y685-V703 HydrophobicContact CD1-CG1 4.28Å; Y685-V703 WeakPolarHBondContact O-CG1 3.27Å; Y685-Q706 HydrophobicContact CD1-CB 4.32Å; Y685-Q706 HydrophobicContact CE1-CB 3.97Å; Y685-Q706 HydrophobicContact CE2-CB 4.26Å
686	G	97.5	Very high	96.6	Very high	14 Å²	14	35.5 Å²	35.5	14%	0.144	19%	0.186	C	C	.	.	H	α-helix	trans	-62	-39.4	172.2	0	0	0	0	0	112.8	A682 S683 R684 Y689 Q690	A682-G686 PolarHBondContact O-N 2.59Å; S683-G686 CarbonylContact O-C 3.49Å; S683-G686 WeakPolarHBondContact O-CA 3.35Å; S683-G686 PolarHBondContact O-N 2.89Å; R684-G686 VanDerWaalsContact C-N 3.33Å; G686-Y689 WeakPolarHBondContact O-CB 3.27Å; G686-Y689 PolarHBondContact O-N 3.03Å; G686-Q690 WeakPolarHBondContact O-CG 3.47Å; G686-Q690 PolarHBondContact O-N 3.39Å
687	D	96.5	Very high	96.5	Very high	62 Å²	62	35.2 Å²	35.2	33%	0.332	20%	0.196	S	C	.	.	H	α-helix	trans	-66.8	-43.8	173.9	-71.4	-38.5	0	0	0	111.9	S683 R684 Y685 Y689 Q690 A691 K919	S683-D687 PolarHBondContact O-N 2.74Å; R684-D687 PolarHBondContact O-N 3Å; Y685-D687 VanDerWaalsContact C-N 3.34Å; D687-Y689 VanDerWaalsContact C-N 3.3Å; D687-Y689 PolarHBondContact O-N 3.39Å; D687-Q690 PolarHBondContact O-N 3.26Å; D687-A691 VanDerWaalsContact O-CB 3.29Å; D687-A691 WeakPolarHBondContact O-CB 3.48Å; D687-A691 PolarHBondContact O-N 3.49Å; D687-K919 IonicContact OD1-NZ 3.84Å; D687-K919 PolarHBondContact OD1-NZ 3.44Å
688	L	97.5	Very high	96.3	Very high	14 Å²	14	33.8 Å²	33.8	7%	0.073	20%	0.196	C	C	.	.	H	α-helix	trans	-60.3	-41.3	174.7	-179.4	63	0	0	0	111.3	F616 E619 F620 L623 R684 Y685 A691 S692	F616-L688 HydrophobicContact CD2-CD1 3.82Å; F616-L688 HydrophobicContact CD2-CG 4.4Å; F616-L688 HydrophobicContact CE2-CD1 4.13Å; F616-L688 HydrophobicContact CE2-CD2 4.22Å; F616-L688 HydrophobicContact CE2-CG 4.2Å; E619-L688 HydrophobicContact CB-CD1 3.92Å; F620-L688 HydrophobicContact CB-CD2 4.09Å; F620-L688 HydrophobicContact CD2-CD2 4.11Å; L623-L688 HydrophobicContact CD1-CB 4.08Å; L623-L688 HydrophobicContact CD1-CD2 3.84Å; R684-L688 PolarHBondContact O-N 3.42Å; Y685-L688 PolarHBondContact O-N 3.21Å; L688-A691 PolarHBondContact O-N 2.95Å; L688-S692 VanDerWaalsContact O-CB 3.29Å; L688-S692 WeakPolarHBondContact O-CB 3.46Å; L688-S692 PolarHBondContact O-N 2.94Å; L688-S692 PolarHBondContact O-OG 3.44Å; L688-S692 VanDerWaalsContact O-OG 3.06Å
689	Y	97.3	Very high	96.2	Very high	37 Å²	37	33.9 Å²	33.9	15%	0.145	20%	0.197	C	C	.	.	H	α-helix	trans	-54.4	-58.9	173.2	-174.2	-81.7	0	0	0	109.5	Y685 G686 D687 A691 S692 L700 V703 E704 W918	Y685-Y689 WeakPolarHBondContact O-CB 3.43Å; Y685-Y689 PolarHBondContact O-N 3.31Å; G686-Y689 WeakPolarHBondContact O-CB 3.27Å; G686-Y689 PolarHBondContact O-N 3.03Å; D687-Y689 VanDerWaalsContact C-N 3.3Å; D687-Y689 PolarHBondContact O-N 3.39Å; Y689-A691 VanDerWaalsContact C-N 3.28Å; Y689-A691 PolarHBondContact O-N 2.86Å; Y689-S692 PolarHBondContact O-N 3.29Å; Y689-S692 PolarHBondContact O-OG 3.3Å; Y689-L700 HydrophobicContact CD1-CD2 4.5Å; Y689-L700 HydrophobicContact CD2-CB 4.3Å; Y689-L700 HydrophobicContact CD2-CD2 3.83Å; Y689-L700 HydrophobicContact CE1-CD2 4.43Å; Y689-L700 HydrophobicContact CE2-CB 3.62Å; Y689-L700 HydrophobicContact CE2-CD2 3.76Å; Y689-L700 HydrophobicContact CE2-CG 4.15Å; Y689-L700 HydrophobicContact CG-CD2 4.22Å; Y689-V703 HydrophobicContact CD2-CB 4.45Å; Y689-V703 HydrophobicContact CD2-CG1 4.33Å; Y689-E704 HydrophobicContact CD2-CG 3.96Å; Y689-E704 HydrophobicContact CE2-CG 3.53Å; Y689-E704 WeakPolarHBondContact CE2-OE1 3.4Å; Y689-E704 VanDerWaalsContact CZ-OE1 3.3Å; Y689-E704 PolarHBondContact OH-OE1 3.4Å; Y689-W918 HydrophobicContact CD1-CH2 4.03Å; Y689-W918 AromaticContact CD1-CZ3 3.95Å; Y689-W918 HydrophobicContact CD1-CZ3 3.95Å; Y689-W918 AromaticContact CE1-CH2 3.5Å; Y689-W918 HydrophobicContact CE1-CH2 3.5Å; Y689-W918 VanDerWaalsContact CE1-CH2 3.5Å; Y689-W918 HydrophobicContact CE1-CZ2 4.24Å; Y689-W918 AromaticContact CE1-CZ3 3.92Å; Y689-W918 HydrophobicContact CE1-CZ3 3.92Å; Y689-W918 WeakPolarHBondContact O-CZ3 3.47Å
690	Q	95.5	Very high	96.2	Very high	62 Å²	62	29.5 Å²	29.5	29%	0.29	18%	0.181	S	C	.	.	H	α-helix	trans	-66.1	-25.9	-177.3	-68.5	179.4	-5.4	0	0	113.9	G686 D687 S692 W918 K919 T920	G686-Q690 WeakPolarHBondContact O-CG 3.47Å; G686-Q690 PolarHBondContact O-N 3.39Å; D687-Q690 PolarHBondContact O-N 3.26Å; Q690-S692 VanDerWaalsContact C-N 3.26Å; Q690-S692 PolarHBondContact O-N 3.48Å; Q690-W918 CarbonylContact O-C 3.38Å; Q690-W918 WeakPolarHBondContact O-CA 3.31Å; Q690-W918 WeakPolarHBondContact O-CB 3.01Å; Q690-K919 HydrophobicContact CB-CB 4.46Å; Q690-K919 HydrophobicContact CB-CD 4.48Å; Q690-K919 HydrophobicContact CB-CG 4.26Å; Q690-K919 PolarHBondContact O-N 3.45Å; Q690-T920 PolarHBondContact O-OG1 3.25Å
691	A	94.6	Very high	96.1	Very high	46 Å²	46	29.9 Å²	29.9	38%	0.38	18%	0.175	S	C	.	.	H	α-helix	trans	-74.3	-18.4	174	0	0	0	0	0	112.6	D687 L688 Y689 F693 T920	D687-A691 VanDerWaalsContact O-CB 3.29Å; D687-A691 WeakPolarHBondContact O-CB 3.48Å; D687-A691 PolarHBondContact O-N 3.49Å; L688-A691 PolarHBondContact O-N 2.95Å; Y689-A691 VanDerWaalsContact C-N 3.28Å; Y689-A691 PolarHBondContact O-N 2.86Å; A691-F693 PolarHBondContact O-N 3.28Å; A691-T920 PolarHBondContact O-OG1 3.05Å
692	S	94.6	Very high	96	Very high	3 Å²	3	30.1 Å²	30.1	2%	0.021	18%	0.176	C	C	.	.			trans	-99.8	46.4	-170.8	68.5	0	0	0	0	114.6	L688 Y689 Q690 D694 A695	L688-S692 VanDerWaalsContact O-CB 3.29Å; L688-S692 WeakPolarHBondContact O-CB 3.46Å; L688-S692 PolarHBondContact O-N 2.94Å; L688-S692 PolarHBondContact O-OG 3.44Å; L688-S692 VanDerWaalsContact O-OG 3.06Å; Y689-S692 PolarHBondContact O-N 3.29Å; Y689-S692 PolarHBondContact O-OG 3.3Å; Q690-S692 VanDerWaalsContact C-N 3.26Å; Q690-S692 PolarHBondContact O-N 3.48Å; S692-D694 PolarHBondContact O-N 3.44Å; S692-A695 VanDerWaalsContact O-CB 3.23Å; S692-A695 WeakPolarHBondContact O-CB 3.48Å; S692-A695 PolarHBondContact O-N 3.45Å
693	F	93.9	Very high	96	Very high	2 Å²	2	30 Å²	30	1%	0.009	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-28.3	-179	178.1	-101.7	0	0	0	115.2	A691 T802 R845 I847 V910 D912 W918 T920	A691-F693 PolarHBondContact O-N 3.28Å; F693-T802 HydrophobicContact CD1-CG2 4.25Å; F693-T802 HydrophobicContact CE1-CG2 3.97Å; F693-R845 HydrophobicContact CE2-CB 3.89Å; F693-R845 HydrophobicContact CZ-CB 3.86Å; F693-R845 VanDerWaalsContact O-CZ 3.23Å; F693-R845 PolarHBondContact O-NE 3.47Å; F693-R845 PolarHBondContact O-NH2 3.44Å; F693-I847 HydrophobicContact CE1-CG1 4.19Å; F693-I847 HydrophobicContact CZ-CG1 3.78Å; F693-V910 HydrophobicContact CB-CG2 4.48Å; F693-V910 HydrophobicContact CD1-CG2 4.47Å; F693-V910 HydrophobicContact CD2-CG2 3.61Å; F693-V910 HydrophobicContact CE2-CG2 3.86Å; F693-V910 HydrophobicContact CG-CG2 3.94Å; F693-V910 HydrophobicContact CZ-CG2 4.39Å; F693-D912 HydrophobicContact CE2-CB 4.33Å; F693-W918 HydrophobicContact CB-CB 4.18Å; F693-W918 HydrophobicContact CB-CD2 4.25Å; F693-W918 HydrophobicContact CB-CE3 4.17Å; F693-W918 HydrophobicContact CB-CG 4.27Å; F693-W918 HydrophobicContact CD2-CB 4.02Å; F693-W918 AromaticContact CD2-CD1 3.62Å; F693-W918 AromaticContact CD2-CD2 3.83Å; F693-W918 HydrophobicContact CD2-CD2 3.83Å; F693-W918 AromaticContact CD2-CG 3.55Å; F693-W918 HydrophobicContact CD2-CG 3.55Å; F693-W918 AromaticContact CD2-NE1 3.91Å; F693-W918 HydrophobicContact CE2-CG 4.41Å; F693-W918 HydrophobicContact CG-CG 4.39Å; F693-T920 HydrophobicContact CB-CG2 4Å; F693-T920 VanDerWaalsContact CB-OG1 3.28Å; F693-T920 WeakPolarHBondContact CB-OG1 3.46Å
694	D	92.8	Very high	95.9	Very high	3 Å²	3	29 Å²	29	2%	0.016	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-1.6	-177.7	-71.1	-34.6	0	0	0	113.9	S692 Y794 K798 Q800 S801 T802	S692-D694 PolarHBondContact O-N 3.44Å; D694-Y794 HydrophobicContact CB-CE2 3.86Å; D694-K798 WeakPolarHBondContact OD2-CE 3.24Å; D694-K798 IonicContact OD2-NZ 3.81Å; D694-K798 PolarHBondContact OD2-NZ 3.2Å; D694-Q800 HydrophobicContact CB-CB 4.41Å; D694-Q800 VanDerWaalsContact CB-O 3.26Å; D694-Q800 WeakPolarHBondContact CB-O 3.47Å; D694-Q800 VanDerWaalsContact CG-O 3.25Å; D694-Q800 WeakPolarHBondContact OD1-CG 3.49Å; D694-S801 WeakPolarHBondContact OD2-CA 3.11Å; D694-T802 WeakPolarHBondContact OD1-CB 3.3Å; D694-T802 PolarHBondContact OD1-N 3.48Å; D694-T802 PolarHBondContact OD1-OG1 3.32Å; D694-T802 PolarHBondContact OD2-N 3.14Å
695	A	94.9	Very high	95.8	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.149	C	C	.	.			trans	-76.2	135.8	-174.9	0	0	0	0	0	113.8	S692 T699 L700 Y794 R845	S692-A695 VanDerWaalsContact O-CB 3.23Å; S692-A695 WeakPolarHBondContact O-CB 3.48Å; S692-A695 PolarHBondContact O-N 3.45Å; A695-T699 HydrophobicContact CB-CG2 3.97Å; A695-L700 HydrophobicContact CB-CD2 4.02Å; A695-L700 HydrophobicContact CB-CG 4.17Å; A695-Y794 HydrophobicContact CB-CD1 3.61Å; A695-Y794 HydrophobicContact CB-CD2 4.14Å; A695-Y794 HydrophobicContact CB-CE1 3.92Å; A695-Y794 HydrophobicContact CB-CE2 4.4Å; A695-Y794 HydrophobicContact CB-CG 3.74Å; A695-R845 VanDerWaalsContact O-CZ 3.3Å; A695-R845 PolarHBondContact O-NH1 3.07Å; A695-R845 PolarHBondContact O-NH2 2.88Å
696	D	94.3	Very high	95.8	Very high	21 Å²	21	25.7 Å²	25.7	11%	0.112	15%	0.15	C	C	.	.			trans	-67.7	163	178.4	63.5	-26.4	0	0	0	112.8	A698 T699 L700 R793 F844	D696-A698 PolarHBondContact O-N 3.41Å; D696-A698 VanDerWaalsContact O-N 3.15Å; D696-T699 WeakPolarHBondContact O-CB 3.17Å; D696-T699 PolarHBondContact O-N 3.35Å; D696-T699 WeakPolarHBondContact OD1-CB 3.29Å; D696-T699 PolarHBondContact OD1-OG1 3.18Å; D696-L700 PolarHBondContact O-N 3.38Å; D696-L700 VanDerWaalsContact O-N 3.1Å; D696-R793 VanDerWaalsContact OD2-CB 3.31Å; D696-R793 WeakPolarHBondContact OD2-CB 3.34Å; D696-F844 HydrophobicContact CB-CE1 4.04Å; D696-F844 HydrophobicContact CB-CE2 4.09Å; D696-F844 HydrophobicContact CB-CZ 3.74Å
697	S	93.6	Very high	95.8	Very high	95 Å²	95	27.4 Å²	27.4	66%	0.664	15%	0.154	S	C	*	.	H	α-helix	trans	-55.2	-36.6	-174.6	-165.9	0	0	0	0	113.2	R701	S697-R701 VanDerWaalsContact O-CB 3.31Å; S697-R701 WeakPolarHBondContact O-CB 3.41Å; S697-R701 PolarHBondContact O-N 3.36Å
698	A	94.1	Very high	95.8	Very high	45 Å²	45	27.9 Å²	27.9	37%	0.372	16%	0.155	S	C	.	.	H	α-helix	trans	-67	-37.6	177.9	0	0	0	0	0	112.3	D696 N702	D696-A698 PolarHBondContact O-N 3.41Å; D696-A698 VanDerWaalsContact O-N 3.15Å; A698-N702 WeakPolarHBondContact O-CB 3.43Å; A698-N702 PolarHBondContact O-N 3.06Å
699	T	97.1	Very high	95.7	Very high	3 Å²	3	27.4 Å²	27.4	2%	0.018	15%	0.152	C	C	.	.	H	α-helix	trans	-66.1	-48.2	175.1	-58.6	0	0	0	0	111.2	F616 A695 D696 R701 N702 V703 Q792 Y794	F616-T699 HydrophobicContact CE1-CG2 4.26Å; F616-T699 HydrophobicContact CE2-CG2 4.21Å; F616-T699 HydrophobicContact CZ-CG2 3.57Å; A695-T699 HydrophobicContact CB-CG2 3.97Å; D696-T699 WeakPolarHBondContact O-CB 3.17Å; D696-T699 PolarHBondContact O-N 3.35Å; D696-T699 WeakPolarHBondContact OD1-CB 3.29Å; D696-T699 PolarHBondContact OD1-OG1 3.18Å; T699-R701 VanDerWaalsContact C-N 3.35Å; T699-R701 PolarHBondContact O-N 2.89Å; T699-N702 WeakPolarHBondContact O-CB 3.4Å; T699-N702 PolarHBondContact O-N 3.47Å; T699-V703 WeakPolarHBondContact O-CG2 3.48Å; T699-V703 PolarHBondContact O-N 3.37Å; T699-Q792 HydrophobicContact CG2-CB 4.38Å; T699-Q792 WeakPolarHBondContact OG1-CB 3.17Å; T699-Y794 HydrophobicContact CG2-CD1 4.21Å; T699-Y794 HydrophobicContact CG2-CG 4.44Å; T699-Y794 WeakPolarHBondContact OG1-CB 3.4Å; T699-Y794 PolarHBondContact OG1-N 2.85Å
700	L	96.4	Very high	95.8	Very high	8 Å²	8	25.6 Å²	25.6	4%	0.042	15%	0.145	C	C	.	.	H	α-helix	trans	-60.4	-45	178.6	-69.4	179.1	0	0	0	111.5	Y689 A695 D696 N702 V703 E704 R845 W918	Y689-L700 HydrophobicContact CD1-CD2 4.5Å; Y689-L700 HydrophobicContact CD2-CB 4.3Å; Y689-L700 HydrophobicContact CD2-CD2 3.83Å; Y689-L700 HydrophobicContact CE1-CD2 4.43Å; Y689-L700 HydrophobicContact CE2-CB 3.62Å; Y689-L700 HydrophobicContact CE2-CD2 3.76Å; Y689-L700 HydrophobicContact CE2-CG 4.15Å; Y689-L700 HydrophobicContact CG-CD2 4.22Å; A695-L700 HydrophobicContact CB-CD2 4.02Å; A695-L700 HydrophobicContact CB-CG 4.17Å; D696-L700 PolarHBondContact O-N 3.38Å; D696-L700 VanDerWaalsContact O-N 3.1Å; L700-N702 VanDerWaalsContact C-N 3.31Å; L700-N702 PolarHBondContact O-N 2.93Å; L700-V703 PolarHBondContact O-N 2.81Å; L700-E704 WeakPolarHBondContact O-CG 3.32Å; L700-E704 PolarHBondContact O-N 2.71Å; L700-R845 VanDerWaalsContact CD1-NH1 3.28Å; L700-W918 HydrophobicContact CD1-CH2 3.7Å; L700-W918 HydrophobicContact CD1-CZ3 4.43Å; L700-W918 HydrophobicContact CD2-CH2 3.95Å; L700-W918 HydrophobicContact CD2-CZ3 3.93Å
701	R	95.9	Very high	95.8	Very high	62 Å²	62	26.6 Å²	26.6	23%	0.234	15%	0.152	C	C	.	.	H	α-helix	trans	-61.4	-39.1	175.9	-173.6	57.5	176.2	145.6	8.2	112.4	S697 T699 E704 L705 E745	S697-R701 VanDerWaalsContact O-CB 3.31Å; S697-R701 WeakPolarHBondContact O-CB 3.41Å; S697-R701 PolarHBondContact O-N 3.36Å; T699-R701 VanDerWaalsContact C-N 3.35Å; T699-R701 PolarHBondContact O-N 2.89Å; R701-E704 WeakPolarHBondContact CD-OE2 3.38Å; R701-E704 IonicContact NH1-OE2 3.49Å; R701-E704 PolarHBondContact NH1-OE2 3.15Å; R701-E704 WeakPolarHBondContact O-CB 3.26Å; R701-E704 PolarHBondContact O-N 3.02Å; R701-L705 HydrophobicContact CG-CD1 4.43Å; R701-L705 VanDerWaalsContact O-CG 3.27Å; R701-L705 WeakPolarHBondContact O-CG 3.48Å; R701-L705 PolarHBondContact O-N 3.46Å; R701-E745 IonicContact CZ-OE1 2.79Å; R701-E745 VanDerWaalsContact CZ-OE1 3.25Å; R701-E745 IonicContact NE-OE1 3.44Å; R701-E745 PolarHBondContact NE-OE1 3.24Å; R701-E745 IonicContact NH2-OE1 3.35Å; R701-E745 PolarHBondContact NH2-OE1 3.06Å
702	N	96.8	Very high	95.9	Very high	4 Å²	4	25.1 Å²	25.1	2%	0.021	14%	0.138	C	C	.	.	H	α-helix	trans	-64	-43.1	175	-175.3	37.4	0	0	0	112.2	A698 T699 L700 L705 Q706 Y744 S790 Q792	A698-N702 WeakPolarHBondContact O-CB 3.43Å; A698-N702 PolarHBondContact O-N 3.06Å; T699-N702 WeakPolarHBondContact O-CB 3.4Å; T699-N702 PolarHBondContact O-N 3.47Å; L700-N702 VanDerWaalsContact C-N 3.31Å; L700-N702 PolarHBondContact O-N 2.93Å; N702-L705 PolarHBondContact O-N 3.4Å; N702-Q706 WeakPolarHBondContact O-CG 3.48Å; N702-Q706 PolarHBondContact O-N 3.4Å; N702-Y744 WeakPolarHBondContact OD1-CE1 3.49Å; N702-S790 PolarHBondContact ND2-O 3.32Å; N702-S790 VanDerWaalsContact ND2-O 3.12Å; N702-Q792 HydrophobicContact CB-CG 3.68Å
703	V	98.1	Very high	96	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-62.9	-42.3	175.5	174.7	0	0	0	0	111	Y685 Y689 T699 L700 L705 Q706 Q707	Y685-V703 HydrophobicContact CD1-CG1 4.28Å; Y685-V703 WeakPolarHBondContact O-CG1 3.27Å; Y689-V703 HydrophobicContact CD2-CB 4.45Å; Y689-V703 HydrophobicContact CD2-CG1 4.33Å; T699-V703 WeakPolarHBondContact O-CG2 3.48Å; T699-V703 PolarHBondContact O-N 3.37Å; L700-V703 PolarHBondContact O-N 2.81Å; V703-L705 PolarHBondContact O-N 2.94Å; V703-Q706 PolarHBondContact O-N 2.99Å; V703-Q707 PolarHBondContact O-N 3.29Å
704	E	96.8	Very high	96	Very high	51 Å²	51	25.1 Å²	25.1	24%	0.238	14%	0.138	C	C	.	.	H	α-helix	trans	-59.3	-44.7	173.5	-73.6	167.6	-170	0	0	111.9	Y689 L700 R701 Q706 Q707 Q708	Y689-E704 HydrophobicContact CD2-CG 3.96Å; Y689-E704 HydrophobicContact CE2-CG 3.53Å; Y689-E704 WeakPolarHBondContact CE2-OE1 3.4Å; Y689-E704 VanDerWaalsContact CZ-OE1 3.3Å; Y689-E704 PolarHBondContact OH-OE1 3.4Å; L700-E704 WeakPolarHBondContact O-CG 3.32Å; L700-E704 PolarHBondContact O-N 2.71Å; R701-E704 WeakPolarHBondContact CD-OE2 3.38Å; R701-E704 IonicContact NH1-OE2 3.49Å; R701-E704 PolarHBondContact NH1-OE2 3.15Å; R701-E704 WeakPolarHBondContact O-CB 3.26Å; R701-E704 PolarHBondContact O-N 3.02Å; E704-Q706 PolarHBondContact O-N 3.42Å; E704-Q707 WeakPolarHBondContact O-CB 3.44Å; E704-Q707 PolarHBondContact O-N 3.03Å; E704-Q708 WeakPolarHBondContact O-CB 3.25Å; E704-Q708 VanDerWaalsContact O-CG 3.28Å; E704-Q708 WeakPolarHBondContact O-CG 3.29Å; E704-Q708 PolarHBondContact O-N 2.85Å
705	L	96.3	Very high	96	Very high	1 Å²	1	27 Å²	27	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-60.7	-46.2	176.5	-70.4	168.3	0	0	0	110.4	R701 N702 V703 Q707 Q708 S709 Y744 E745 M748 M749 Y752	R701-L705 HydrophobicContact CG-CD1 4.43Å; R701-L705 VanDerWaalsContact O-CG 3.27Å; R701-L705 WeakPolarHBondContact O-CG 3.48Å; R701-L705 PolarHBondContact O-N 3.46Å; N702-L705 PolarHBondContact O-N 3.4Å; V703-L705 PolarHBondContact O-N 2.94Å; L705-Q707 VanDerWaalsContact C-N 3.29Å; L705-Q707 PolarHBondContact O-N 3.21Å; L705-Q708 WeakPolarHBondContact O-CB 3.33Å; L705-Q708 PolarHBondContact O-N 3.23Å; L705-Q708 VanDerWaalsContact O-N 3.16Å; L705-S709 PolarHBondContact O-N 3.25Å; L705-Y744 HydrophobicContact CD1-CD1 4.08Å; L705-Y744 HydrophobicContact CD1-CE1 3.86Å; L705-E745 HydrophobicContact CD1-CB 4.03Å; L705-E745 HydrophobicContact CD1-CG 4.16Å; L705-M748 HydrophobicContact CD1-CB 4.47Å; L705-M748 HydrophobicContact CD1-CG 4.47Å; L705-M748 HydrophobicContact CD2-CB 4.2Å; L705-M749 HydrophobicContact CD2-SD 4.15Å; L705-Y752 HydrophobicContact CD2-CE2 3.92Å; L705-Y752 PolarHBondContact O-OH 3.07Å
706	Q	97.5	Very high	95.9	Very high	7 Å²	7	27 Å²	27	3%	0.033	15%	0.147	C	C	.	.	H	α-helix	trans	-62.4	-34.9	176.3	-64.6	-65.2	-30.6	0	0	112.9	Y685 N702 V703 E704 S709 C710 Y744	Y685-Q706 HydrophobicContact CD1-CB 4.32Å; Y685-Q706 HydrophobicContact CE1-CB 3.97Å; Y685-Q706 HydrophobicContact CE2-CB 4.26Å; N702-Q706 WeakPolarHBondContact O-CG 3.48Å; N702-Q706 PolarHBondContact O-N 3.4Å; V703-Q706 PolarHBondContact O-N 2.99Å; E704-Q706 PolarHBondContact O-N 3.42Å; Q706-S709 PolarHBondContact O-OG 3.4Å; Q706-C710 PolarHBondContact O-N 3.47Å; Q706-C710 PolarHBondContact O-SG 2.85Å; Q706-Y744 PolarHBondContact NE2-OH 3.36Å
707	Q	97.9	Very high	95.7	Very high	49 Å²	49	26 Å²	26	23%	0.229	14%	0.141	C	C	.	.	H	α-helix	trans	-66.3	-44.4	172.8	-171.3	-179.4	27	0	0	111.6	A682 V703 E704 L705 S709 C710 L711	A682-Q707 HydrophobicContact CB-CG 4.13Å; A682-Q707 WeakPolarHBondContact O-CG 3.07Å; A682-Q707 PolarHBondContact O-NE2 3.44Å; V703-Q707 PolarHBondContact O-N 3.29Å; E704-Q707 WeakPolarHBondContact O-CB 3.44Å; E704-Q707 PolarHBondContact O-N 3.03Å; L705-Q707 VanDerWaalsContact C-N 3.29Å; L705-Q707 PolarHBondContact O-N 3.21Å; Q707-S709 VanDerWaalsContact C-N 3.33Å; Q707-S709 PolarHBondContact O-N 3.15Å; Q707-C710 WeakPolarHBondContact O-CB 3.16Å; Q707-C710 PolarHBondContact O-N 3.5Å; Q707-L711 HydrophobicContact CG-CD1 4.42Å; Q707-L711 PolarHBondContact O-N 2.82Å
708	Q	96.1	Very high	95.5	Very high	73 Å²	73	24.4 Å²	24.4	34%	0.341	12%	0.123	S	C	.	.	H	α-helix	trans	-62.3	-38.4	178.2	-74.9	176.9	-15.3	0	0	112	E704 L705 C710 L711 L712 Y752	E704-Q708 WeakPolarHBondContact O-CB 3.25Å; E704-Q708 VanDerWaalsContact O-CG 3.28Å; E704-Q708 WeakPolarHBondContact O-CG 3.29Å; E704-Q708 PolarHBondContact O-N 2.85Å; L705-Q708 WeakPolarHBondContact O-CB 3.33Å; L705-Q708 PolarHBondContact O-N 3.23Å; L705-Q708 VanDerWaalsContact O-N 3.16Å; Q708-C710 VanDerWaalsContact C-N 3.34Å; Q708-C710 PolarHBondContact O-N 3.44Å; Q708-L711 PolarHBondContact O-N 3.46Å; Q708-L712 VanDerWaalsContact O-CB 3.29Å; Q708-L712 WeakPolarHBondContact O-CB 3.42Å; Q708-L712 PolarHBondContact O-N 2.92Å; Q708-Y752 HydrophobicContact CB-CE2 3.9Å
709	S	96.4	Very high	95.1	Very high	3 Å²	3	22.3 Å²	22.3	2%	0.021	11%	0.106	C	C	.	.	H	α-helix	trans	-63.8	-39	175.9	70.5	0	0	0	0	112	L705 Q706 Q707 L712 I713	L705-S709 PolarHBondContact O-N 3.25Å; Q706-S709 PolarHBondContact O-OG 3.4Å; Q707-S709 VanDerWaalsContact C-N 3.33Å; Q707-S709 PolarHBondContact O-N 3.15Å; S709-L712 PolarHBondContact O-N 3.32Å; S709-I713 WeakPolarHBondContact O-CG1 3.16Å; S709-I713 PolarHBondContact O-N 2.98Å; S709-I713 VanDerWaalsContact O-N 3.13Å
710	C	97.8	Very high	94.6	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-63.3	-46.4	174.6	-61.7	0	0	0	0	111.5	A682 Q706 Q707 Q708 I713 S714	A682-C710 HydrophobicContact CB-CB 4.05Å; Q706-C710 PolarHBondContact O-N 3.47Å; Q706-C710 PolarHBondContact O-SG 2.85Å; Q707-C710 WeakPolarHBondContact O-CB 3.16Å; Q707-C710 PolarHBondContact O-N 3.5Å; Q708-C710 VanDerWaalsContact C-N 3.34Å; Q708-C710 PolarHBondContact O-N 3.44Å; C710-I713 PolarHBondContact O-N 3.26Å; C710-S714 PolarHBondContact O-N 2.8Å
711	L	96.8	Very high	93.9	Very high	83 Å²	83	22 Å²	22	44%	0.435	10%	0.104	S	C	.	.	H	α-helix	trans	-65.7	-38	178.9	-69.5	173.7	0	0	0	112.3	A682 Q707 Q708 S714 H715	A682-L711 HydrophobicContact CB-CD2 3.58Å; A682-L711 HydrophobicContact CB-CG 3.73Å; Q707-L711 HydrophobicContact CG-CD1 4.42Å; Q707-L711 PolarHBondContact O-N 2.82Å; Q708-L711 PolarHBondContact O-N 3.46Å; L711-S714 WeakPolarHBondContact O-CB 3.38Å; L711-S714 PolarHBondContact O-N 2.74Å; L711-H715 WeakPolarHBondContact O-CB 3.42Å; L711-H715 PolarHBondContact O-N 3.08Å
712	L	95.4	Very high	93	Very high	15 Å²	15	20.4 Å²	20.4	8%	0.079	10%	0.1	C	C	.	.	H	α-helix	trans	-60.9	-46.9	175.7	176.2	63.2	0	0	0	111.4	Q708 S709 H715 A716 Y752 V755 L756	Q708-L712 VanDerWaalsContact O-CB 3.29Å; Q708-L712 WeakPolarHBondContact O-CB 3.42Å; Q708-L712 PolarHBondContact O-N 2.92Å; S709-L712 PolarHBondContact O-N 3.32Å; L712-H715 PolarHBondContact O-N 3.18Å; L712-A716 WeakPolarHBondContact O-CB 3.19Å; L712-A716 PolarHBondContact O-N 3.37Å; L712-Y752 HydrophobicContact CD2-CD1 3.5Å; L712-Y752 HydrophobicContact CD2-CE1 4.27Å; L712-Y752 HydrophobicContact CD2-CG 4.05Å; L712-V755 HydrophobicContact CD1-CG1 4Å; L712-V755 HydrophobicContact CD2-CB 4.04Å; L712-V755 HydrophobicContact CD2-CG1 4Å; L712-V755 HydrophobicContact CG-CG1 3.99Å; L712-L756 HydrophobicContact CD1-CD2 3.62Å; L712-L756 HydrophobicContact CD1-CG 3.81Å
713	I	96.5	Very high	92	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-67.9	-40.1	177.7	-63.7	-62	0	0	0	111.2	F631 L634 F678 S709 C710 H715 A716 I717 A780 I781 L784	F631-I713 HydrophobicContact CE1-CG1 4.15Å; L634-I713 HydrophobicContact CD2-CG2 3.62Å; F678-I713 HydrophobicContact CD1-CG2 4.44Å; F678-I713 HydrophobicContact CD2-CG2 3.81Å; F678-I713 HydrophobicContact CE1-CG2 4.21Å; F678-I713 HydrophobicContact CE2-CG2 3.58Å; F678-I713 HydrophobicContact CG-CG2 4.28Å; F678-I713 HydrophobicContact CZ-CG2 3.8Å; S709-I713 WeakPolarHBondContact O-CG1 3.16Å; S709-I713 PolarHBondContact O-N 2.98Å; S709-I713 VanDerWaalsContact O-N 3.13Å; C710-I713 PolarHBondContact O-N 3.26Å; I713-H715 VanDerWaalsContact C-N 3.28Å; I713-H715 PolarHBondContact O-N 3.34Å; I713-A716 PolarHBondContact O-N 2.9Å; I713-I717 HydrophobicContact CG2-CD1 4.18Å; I713-I717 VanDerWaalsContact O-CG1 3.3Å; I713-I717 WeakPolarHBondContact O-CG1 3.49Å; I713-I717 PolarHBondContact O-N 3.46Å; I713-A780 HydrophobicContact CD1-CB 3.9Å; I713-I781 HydrophobicContact CD1-CG1 4.5Å; I713-L784 HydrophobicContact CD1-CD1 3.84Å; I713-L784 HydrophobicContact CG1-CD1 3.81Å
714	S	95.4	Very high	90.7	Very high	4 Å²	4	24.3 Å²	24.3	3%	0.028	12%	0.123	C	C	.	.	H	α-helix	trans	-56.7	-44.3	171.4	176.6	0	0	0	0	111.6	M675 R679 C710 L711 E718	M675-S714 VanDerWaalsContact CG-OG 3.29Å; M675-S714 WeakPolarHBondContact CG-OG 3.41Å; R679-S714 WeakPolarHBondContact CG-OG 3.22Å; R679-S714 PolarHBondContact NE-OG 3.5Å; C710-S714 PolarHBondContact O-N 2.8Å; L711-S714 WeakPolarHBondContact O-CB 3.38Å; L711-S714 PolarHBondContact O-N 2.74Å; S714-E718 WeakPolarHBondContact O-CB 3.25Å; S714-E718 PolarHBondContact O-N 3.11Å
715	H	91.9	Very high	89.3	Confident	43 Å²	43	29.7 Å²	29.7	20%	0.199	15%	0.148	C	C	.	.	H	α-helix	trans	-67.2	-43.1	179.2	177.3	63.9	0	0	0	111.7	L711 L712 I713 I717 E718 A719 F729	L711-H715 WeakPolarHBondContact O-CB 3.42Å; L711-H715 PolarHBondContact O-N 3.08Å; L712-H715 PolarHBondContact O-N 3.18Å; I713-H715 VanDerWaalsContact C-N 3.28Å; I713-H715 PolarHBondContact O-N 3.34Å; H715-I717 VanDerWaalsContact C-N 3.3Å; H715-I717 PolarHBondContact O-N 3.13Å; H715-E718 PolarHBondContact O-N 3.26Å; H715-E718 VanDerWaalsContact O-N 3.15Å; H715-A719 VanDerWaalsContact O-CB 3.31Å; H715-A719 WeakPolarHBondContact O-CB 3.49Å; H715-A719 PolarHBondContact O-N 3.38Å; H715-F729 AromaticContact NE2-CD2 3.86Å
716	A	92.3	Very high	87.8	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.008	18%	0.176	C	C	.	.	H	α-helix	trans	-60.3	-40	177.3	0	0	0	0	0	111.9	L712 I713 L720 V759 L777	L712-A716 WeakPolarHBondContact O-CB 3.19Å; L712-A716 PolarHBondContact O-N 3.37Å; I713-A716 PolarHBondContact O-N 2.9Å; A716-L720 VanDerWaalsContact O-CB 3.28Å; A716-L720 WeakPolarHBondContact O-CB 3.4Å; A716-L720 WeakPolarHBondContact O-CG 3.49Å; A716-L720 PolarHBondContact O-N 3.01Å; A716-V759 HydrophobicContact CB-CG2 3.77Å; A716-L777 HydrophobicContact CB-CD2 3.64Å
717	I	91.3	Very high	86	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63.4	-48.6	173.3	-63.6	163.8	0	0	0	110.3	L634 M671 M675 F678 I713 H715 I721 L722 L777	L634-I717 HydrophobicContact CD1-CD1 4.08Å; L634-I717 HydrophobicContact CD1-CG1 4.41Å; L634-I717 HydrophobicContact CD2-CD1 4.11Å; M671-I717 HydrophobicContact CB-CG2 4Å; M671-I717 HydrophobicContact SD-CG2 4.43Å; M675-I717 HydrophobicContact CB-CB 4.47Å; M675-I717 HydrophobicContact CB-CD1 4.45Å; M675-I717 HydrophobicContact CB-CG2 4.09Å; F678-I717 HydrophobicContact CD2-CD1 3.92Å; F678-I717 HydrophobicContact CE2-CD1 4.06Å; I713-I717 HydrophobicContact CG2-CD1 4.18Å; I713-I717 VanDerWaalsContact O-CG1 3.3Å; I713-I717 WeakPolarHBondContact O-CG1 3.49Å; I713-I717 PolarHBondContact O-N 3.46Å; H715-I717 VanDerWaalsContact C-N 3.3Å; H715-I717 PolarHBondContact O-N 3.13Å; I717-I721 VanDerWaalsContact O-CB 3.22Å; I717-I721 WeakPolarHBondContact O-CB 3.41Å; I717-I721 PolarHBondContact O-N 3.22Å; I717-L722 HydrophobicContact CG2-CD1 4.2Å; I717-L722 HydrophobicContact CG2-CG 4.45Å; I717-L722 PolarHBondContact O-N 3.33Å; I717-L777 HydrophobicContact CG1-CD1 4.38Å; I717-L777 HydrophobicContact CG1-CD2 4.19Å
718	E	89.4	Confident	84	Confident	60 Å²	60	35.2 Å²	35.2	28%	0.28	19%	0.194	S	C	.	.	I	π-helix	trans	-60.3	-51.4	-179.1	-171.8	165.3	-139	0	0	111.8	M675 R679 S714 H715 L722 D723	M675-E718 HydrophobicContact SD-CB 3.83Å; M675-E718 HydrophobicContact SD-CG 4.17Å; R679-E718 IonicContact CZ-OE1 3.72Å; R679-E718 IonicContact NH2-OE1 3.07Å; R679-E718 PolarHBondContact NH2-OE1 3.31Å; R679-E718 IonicContact NH2-OE2 3.31Å; R679-E718 PolarHBondContact NH2-OE2 3.15Å; S714-E718 WeakPolarHBondContact O-CB 3.25Å; S714-E718 PolarHBondContact O-N 3.11Å; H715-E718 PolarHBondContact O-N 3.26Å; H715-E718 VanDerWaalsContact O-N 3.15Å; E718-L722 PolarHBondContact O-N 3.21Å; E718-L722 VanDerWaalsContact O-N 3.13Å; E718-D723 PolarHBondContact O-N 3.45Å
719	A	86.3	Confident	82.1	Confident	2 Å²	2	37.2 Å²	37.2	2%	0.017	20%	0.201	C	C	.	.	I	π-helix	trans	-72.5	-36	-174	0	0	0	0	0	114	H715 P724 A727 V759	H715-A719 VanDerWaalsContact O-CB 3.31Å; H715-A719 WeakPolarHBondContact O-CB 3.49Å; H715-A719 PolarHBondContact O-N 3.38Å; A719-P724 VanDerWaalsContact O-CA 3.31Å; A719-P724 WeakPolarHBondContact O-CA 3.35Å; A719-P724 WeakPolarHBondContact O-CB 3.44Å; A719-A727 HydrophobicContact CB-CB 3.88Å; A719-V759 HydrophobicContact CB-CG1 4.27Å
720	L	85.3	Confident	79.9	Confident	3 Å²	3	46 Å²	46	2%	0.016	24%	0.242	C	C	.	.	I	π-helix	trans	-90	-27.1	-178.2	-66	178.8	0	0	0	114	A716 V759 L762 H773 C776	A716-L720 VanDerWaalsContact O-CB 3.28Å; A716-L720 WeakPolarHBondContact O-CB 3.4Å; A716-L720 WeakPolarHBondContact O-CG 3.49Å; A716-L720 PolarHBondContact O-N 3.01Å; L720-V759 HydrophobicContact CD1-CG2 3.99Å; L720-V759 HydrophobicContact CD2-CG1 4.15Å; L720-V759 WeakPolarHBondContact CD2-O 3.31Å; L720-V759 HydrophobicContact CG-CG1 4.07Å; L720-V759 HydrophobicContact CG-CG2 4.43Å; L720-L762 HydrophobicContact CD2-CB 3.88Å; L720-H773 HydrophobicContact CB-CB 4.27Å; L720-H773 HydrophobicContact CD1-CB 4.5Å; L720-H773 PolarHBondContact O-ND1 3.46Å; L720-C776 HydrophobicContact CD1-CB 4.46Å
721	I	81.4	Confident	77.3	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.01	28%	0.277	C	S	.	.	I	π-helix	trans	-116.3	-48.6	-168	-53.6	-61.6	0	0	0	112.1	M671 I717 V769 H773 L777	M671-I721 HydrophobicContact CB-CG2 4.04Å; M671-I721 HydrophobicContact CG-CG2 3.93Å; I717-I721 VanDerWaalsContact O-CB 3.22Å; I717-I721 WeakPolarHBondContact O-CB 3.41Å; I717-I721 PolarHBondContact O-N 3.22Å; I721-V769 HydrophobicContact CD1-CG2 4.24Å; I721-V769 HydrophobicContact CG2-CG2 3.58Å; I721-H773 HydrophobicContact CD1-CB 3.76Å; I721-L777 HydrophobicContact CG1-CD1 4.27Å
722	L	78.3	Confident	75	Confident	28 Å²	28	56.6 Å²	56.6	15%	0.147	28%	0.284	C	S	.	.	I	π-helix	trans	-96.3	-42.6	-165.4	-59.9	176.9	0	0	0	113.8	L661 M671 K672 M675 I717 E718	L661-L722 HydrophobicContact CD2-CB 4.5Å; L661-L722 HydrophobicContact CD2-CD2 3.95Å; M671-L722 HydrophobicContact CB-CD2 4.43Å; K672-L722 HydrophobicContact CB-CD1 4.29Å; M675-L722 HydrophobicContact CE-CD1 3.93Å; M675-L722 HydrophobicContact SD-CD1 3.73Å; I717-L722 HydrophobicContact CG2-CD1 4.2Å; I717-L722 HydrophobicContact CG2-CG 4.45Å; I717-L722 PolarHBondContact O-N 3.33Å; E718-L722 PolarHBondContact O-N 3.21Å; E718-L722 VanDerWaalsContact O-N 3.13Å
723	D	74.2	Confident	72.7	Confident	60 Å²	60	58 Å²	58	32%	0.321	30%	0.302	S	S	.	.			trans	-148.5	67.7	-173.1	-166.6	-3.6	0	0	0	112.7	E718 E725 S726 A727	E718-D723 PolarHBondContact O-N 3.45Å; D723-E725 PolarHBondContact O-N 3.17Å; D723-S726 VanDerWaalsContact CG-CB 3.44Å; D723-S726 VanDerWaalsContact OD1-CB 3.24Å; D723-S726 WeakPolarHBondContact OD1-CB 3.01Å; D723-S726 PolarHBondContact OD1-N 3.19Å; D723-S726 PolarHBondContact OD1-OG 3.24Å; D723-S726 WeakPolarHBondContact OD2-CB 3.1Å; D723-S726 PolarHBondContact OD2-OG 3.47Å; D723-A727 WeakPolarHBondContact O-CB 3.33Å; D723-A727 PolarHBondContact O-N 2.97Å; D723-A727 VanDerWaalsContact O-N 3.15Å
724	P	71.7	Confident	70.3	Confident	26 Å²	26	62.4 Å²	62.4	17%	0.169	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-15.6	179.7	28.1	-34.7	0	0	0	114	A719 P768	A719-P724 VanDerWaalsContact O-CA 3.31Å; A719-P724 WeakPolarHBondContact O-CA 3.35Å; A719-P724 WeakPolarHBondContact O-CB 3.44Å; P724-P768 HydrophobicContact CG-CG 4.29Å
725	E	67.4	Low	68.3	Low	163 Å²	163	66.4 Å²	66.4	76%	0.762	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-41.8	-179	-65.5	-167	174.2	0	0	111.6	D723 R764	D723-E725 PolarHBondContact O-N 3.17Å; E725-R764 PolarHBondContact O-NH2 3Å
726	S	64.9	Low	66.1	Low	87 Å²	87	66.9 Å²	66.9	61%	0.608	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-25.6	-178.5	-40.1	0	0	0	0	113.3	D723 S728	D723-S726 VanDerWaalsContact CG-CB 3.44Å; D723-S726 VanDerWaalsContact OD1-CB 3.24Å; D723-S726 WeakPolarHBondContact OD1-CB 3.01Å; D723-S726 PolarHBondContact OD1-N 3.19Å; D723-S726 PolarHBondContact OD1-OG 3.24Å; D723-S726 WeakPolarHBondContact OD2-CB 3.1Å; D723-S726 PolarHBondContact OD2-OG 3.47Å; S726-S728 PolarHBondContact O-N 2.68Å
727	A	60.3	Low	64	Low	20 Å²	20	72.5 Å²	72.5	17%	0.165	41%	0.409	C	S	.	.			trans	-82.4	56.3	177.6	0	0	0	0	0	112.3	A719 D723 F729	A719-A727 HydrophobicContact CB-CB 3.88Å; D723-A727 WeakPolarHBondContact O-CB 3.33Å; D723-A727 PolarHBondContact O-N 2.97Å; D723-A727 VanDerWaalsContact O-N 3.15Å; A727-F729 PolarHBondContact O-N 3.24Å
728	S	56	Low	62	Low	66 Å²	66	76.7 Å²	76.7	46%	0.462	44%	0.443	S	S	.	.			trans	-85.2	106.6	166.8	60.1	0	0	0	0	109.7	S726 Q730	S726-S728 PolarHBondContact O-N 2.68Å; S728-Q730 PolarHBondContact O-N 2.92Å
729	F	56	Low	60.8	Low	115 Å²	115	81.2 Å²	81.2	50%	0.504	46%	0.464	S	S	.	.			trans	-68.3	120.4	174.7	-153.5	-96.6	0	0	0	109.5	H715 A727 E731	H715-F729 AromaticContact NE2-CD2 3.86Å; A727-F729 PolarHBondContact O-N 3.24Å; F729-E731 HydrophobicContact CE1-CB 4.35Å; F729-E731 WeakPolarHBondContact CE1-O 3.4Å
730	Q	48.8	Very low	60.3	Low	187 Å²	187	82.6 Å²	82.6	87%	0.874	48%	0.475	S	S	*	.			trans	-106.2	6.6	-178.3	-91.2	-169.8	-10.6	0	0	114.9	S728	S728-Q730 PolarHBondContact O-N 2.92Å
731	E	44.7	Very low	60	Low	156 Å²	156	86.4 Å²	86.4	73%	0.729	50%	0.496	S	S	*	.			trans	-117.9	75.6	-179.9	-74.8	-172.1	157	0	0	113	F729 G733	F729-E731 HydrophobicContact CE1-CB 4.35Å; F729-E731 WeakPolarHBondContact CE1-O 3.4Å; E731-G733 PolarHBondContact O-N 3.01Å
732	Y	46.7	Very low	60.2	Low	150 Å²	150	87.5 Å²	87.5	59%	0.588	50%	0.504	S	S	*	.			trans	-75.3	59.6	149.4	-93.6	-88.9	0	0	0	109.6	E760	Y732-E760 VanDerWaalsContact CE2-CD 3.44Å; Y732-E760 WeakPolarHBondContact CE2-OE1 3.44Å; Y732-E760 WeakPolarHBondContact CE2-OE2 3.38Å; Y732-E760 PolarHBondContact OH-OE2 3.14Å
733	G	47.6	Very low	60.5	Low	45 Å²	45	88.1 Å²	88.1	46%	0.464	51%	0.506	S	S	.	.	S	Bend	trans	-80.4	137.5	156	0	0	0	0	0	107.2	E731 T735	E731-G733 PolarHBondContact O-N 3.01Å; G733-T735 PolarHBondContact O-N 2.92Å
734	S	47	Very low	61.2	Low	92 Å²	92	86.2 Å²	86.2	64%	0.643	49%	0.494	S	S	*	.			trans	-46.3	97.2	175	177.7	0	0	0	0	111.3	G736 T737	S734-G736 PolarHBondContact O-N 3.42Å; S734-T737 PolarHBondContact OG-OG1 2.87Å
735	T	52.7	Low	62.1	Low	89 Å²	89	86 Å²	86	55%	0.546	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	15.9	-178.8	17.1	0	0	0	0	112.8	G733 M749	G733-T735 PolarHBondContact O-N 2.92Å; T735-M749 WeakPolarHBondContact O-CE 3.28Å
736	G	46	Very low	63.1	Low	53 Å²	53	81.5 Å²	81.5	55%	0.546	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-156.5	37.9	-163.1	0	0	0	0	0	117.8	S734	S734-G736 PolarHBondContact O-N 3.42Å
737	T	48.7	Very low	64.3	Low	119 Å²	119	81.3 Å²	81.3	73%	0.73	45%	0.453	S	S	*	.			trans	-123.4	7.9	172.1	45.7	0	0	0	0	117	S734	S734-T737 PolarHBondContact OG-OG1 2.87Å
738	A	47.7	Very low	65.8	Low	88 Å²	88	80.5 Å²	80.5	73%	0.727	45%	0.446	S	S	*	.	S	Bend	trans	-109.8	89.4	177.9	0	0	0	0	0	113.2	A740	A738-A740 PolarHBondContact O-N 3.26Å
739	H	64.6	Low	67.5	Low	154 Å²	154	79.2 Å²	79.2	71%	0.713	43%	0.433	S	S	*	.			trans	51.4	60.2	152	-52.6	-51	0	0	0	119.1	D741	H739-D741 PolarHBondContact O-N 3.47Å
740	A	76.3	Confident	69.2	Low	31 Å²	31	77.5 Å²	77.5	26%	0.256	44%	0.435	S	S	.	.			trans	-65	116.9	164.7	0	0	0	0	0	110.9	A738 E745 R746	A738-A740 PolarHBondContact O-N 3.26Å; A740-E745 WeakPolarHBondContact CA-OE2 3.33Å; A740-E745 HydrophobicContact CB-CB 4.37Å; A740-E745 HydrophobicContact CB-CG 3.84Å; A740-R746 HydrophobicContact CB-CG 3.56Å; A740-R746 PolarHBondContact O-NH1 2.89Å
741	D	78.6	Confident	71.4	Confident	83 Å²	83	69.6 Å²	69.6	44%	0.444	40%	0.4	S	S	.	.			trans	-89.5	-4	-173.6	-82	-33.4	0	0	0	113	K421 H739 E745	K421-D741 IonicContact NZ-OD1 2.73Å; K421-D741 PolarHBondContact NZ-OD1 3.32Å; H739-D741 PolarHBondContact O-N 3.47Å; D741-E745 PolarHBondContact N-OE2 3.26Å
742	S	85.3	Confident	73.7	Confident	26 Å²	26	62.8 Å²	62.8	18%	0.182	37%	0.367	C	S	.	.	S	Bend	trans	-137.1	157	178.4	75.3	0	0	0	0	113.3	E745 R746	S742-E745 WeakPolarHBondContact OG-CB 3.43Å; S742-E745 PolarHBondContact OG-N 3.46Å; S742-R746 PolarHBondContact O-N 2.93Å
743	E	84.3	Confident	75.8	Confident	41 Å²	41	57.9 Å²	57.9	19%	0.192	35%	0.352	C	S	.	.	H	α-helix	trans	-69.8	-38.2	175.9	-160.4	-140.1	-179.7	0	0	112.6	P461 Q502 E745 R746 R747	P461-E743 HydrophobicContact CB-CG 4.32Å; P461-E743 HydrophobicContact CG-CB 4.3Å; P461-E743 HydrophobicContact CG-CG 3.84Å; Q502-E743 PolarHBondContact OE1-OE1 3.17Å; Q502-E743 PolarHBondContact OE1-OE2 3.46Å; E743-E745 VanDerWaalsContact C-N 3.31Å; E743-E745 PolarHBondContact O-N 2.88Å; E743-R746 PolarHBondContact O-N 3.21Å; E743-R746 VanDerWaalsContact O-N 3.14Å; E743-R747 VanDerWaalsContact CD-NE 3.26Å; E743-R747 WeakPolarHBondContact O-CG 3.43Å; E743-R747 PolarHBondContact O-N 3.07Å; E743-R747 IonicContact OE1-CZ 3.59Å; E743-R747 IonicContact OE1-NE 2.94Å; E743-R747 PolarHBondContact OE1-NE 3.04Å; E743-R747 IonicContact OE1-NH2 3.61Å; E743-R747 PolarHBondContact OE1-NH2 2.49Å; E743-R747 IonicContact OE2-CZ 3.79Å; E743-R747 IonicContact OE2-NE 2.68Å; E743-R747 PolarHBondContact OE2-NE 2.89Å; E743-R747 IonicContact OE2-NH2 2.81Å; E743-R747 PolarHBondContact OE2-NH2 3.34Å
744	Y	89.3	Confident	78	Confident	20 Å²	20	60.9 Å²	60.9	8%	0.078	35%	0.353	C	S	.	.	H	α-helix	trans	-54	-48.2	174.3	175.7	-100.3	0	0	0	111.6	N702 L705 Q706 R746 R747 M748 V787 P788	N702-Y744 WeakPolarHBondContact OD1-CE1 3.49Å; L705-Y744 HydrophobicContact CD1-CD1 4.08Å; L705-Y744 HydrophobicContact CD1-CE1 3.86Å; Q706-Y744 PolarHBondContact NE2-OH 3.36Å; Y744-R746 PolarHBondContact O-N 3.45Å; Y744-R747 PolarHBondContact O-N 3.32Å; Y744-M748 HydrophobicContact CD1-CG 4.35Å; Y744-M748 HydrophobicContact CD2-CG 4.5Å; Y744-M748 HydrophobicContact CE1-CG 3.87Å; Y744-M748 HydrophobicContact CE2-CG 4.03Å; Y744-M748 HydrophobicContact CE2-SD 4.13Å; Y744-M748 WeakPolarHBondContact O-CG 3.43Å; Y744-M748 PolarHBondContact O-N 2.94Å; Y744-V787 HydrophobicContact CD2-CG1 3.72Å; Y744-V787 HydrophobicContact CE2-CG1 3.61Å; Y744-P788 WeakPolarHBondContact CD2-O 3.49Å; Y744-P788 VanDerWaalsContact CE2-O 3.31Å; Y744-P788 WeakPolarHBondContact CE2-O 3.41Å
745	E	90.8	Very high	80.1	Confident	21 Å²	21	56.5 Å²	56.5	10%	0.098	32%	0.323	C	S	.	.	H	α-helix	trans	-60.3	-45.8	176.1	177.2	176.1	-164.9	0	0	112.1	R701 L705 A740 D741 S742 E743 R747 M748 M749	R701-E745 IonicContact CZ-OE1 2.79Å; R701-E745 VanDerWaalsContact CZ-OE1 3.25Å; R701-E745 IonicContact NE-OE1 3.44Å; R701-E745 PolarHBondContact NE-OE1 3.24Å; R701-E745 IonicContact NH2-OE1 3.35Å; R701-E745 PolarHBondContact NH2-OE1 3.06Å; L705-E745 HydrophobicContact CD1-CB 4.03Å; L705-E745 HydrophobicContact CD1-CG 4.16Å; A740-E745 WeakPolarHBondContact CA-OE2 3.33Å; A740-E745 HydrophobicContact CB-CB 4.37Å; A740-E745 HydrophobicContact CB-CG 3.84Å; D741-E745 PolarHBondContact N-OE2 3.26Å; S742-E745 WeakPolarHBondContact OG-CB 3.43Å; S742-E745 PolarHBondContact OG-N 3.46Å; E743-E745 VanDerWaalsContact C-N 3.31Å; E743-E745 PolarHBondContact O-N 2.88Å; E745-R747 VanDerWaalsContact C-N 3.32Å; E745-R747 PolarHBondContact O-N 3.43Å; E745-M748 PolarHBondContact O-N 2.97Å; E745-M749 HydrophobicContact CG-CG 4.34Å; E745-M749 WeakPolarHBondContact O-CB 3.47Å; E745-M749 VanDerWaalsContact O-CG 3.3Å; E745-M749 WeakPolarHBondContact O-CG 3.31Å; E745-M749 PolarHBondContact O-N 3.23Å
746	R	88.4	Confident	81.9	Confident	69 Å²	69	54.4 Å²	54.4	26%	0.26	31%	0.308	S	S	.	.	H	α-helix	trans	-59.5	-42.2	177.3	-73.4	-174.2	-70.7	-89.8	-1.2	112.1	M458 Q459 P461 A740 S742 E743 Y744 S750	M458-R746 PolarHBondContact O-NH1 3.46Å; M458-R746 PolarHBondContact O-NH2 2.7Å; Q459-R746 PolarHBondContact O-NH1 3.41Å; P461-R746 VanDerWaalsContact CD-NH2 3.33Å; A740-R746 HydrophobicContact CB-CG 3.56Å; A740-R746 PolarHBondContact O-NH1 2.89Å; S742-R746 PolarHBondContact O-N 2.93Å; E743-R746 PolarHBondContact O-N 3.21Å; E743-R746 VanDerWaalsContact O-N 3.14Å; Y744-R746 PolarHBondContact O-N 3.45Å; R746-S750 WeakPolarHBondContact O-CB 3.37Å; R746-S750 PolarHBondContact O-N 3.42Å
747	R	89.9	Confident	84	Confident	82 Å²	82	57 Å²	57	31%	0.309	31%	0.306	S	S	.	.	H	α-helix	trans	-64.4	-46.7	176.9	-71.1	-175.9	-177.9	-167	5.7	111.6	Q502 E743 Y744 E745 M749 S750 V751 V787	Q502-R747 PolarHBondContact O-NH2 3.2Å; E743-R747 VanDerWaalsContact CD-NE 3.26Å; E743-R747 WeakPolarHBondContact O-CG 3.43Å; E743-R747 PolarHBondContact O-N 3.07Å; E743-R747 IonicContact OE1-CZ 3.59Å; E743-R747 IonicContact OE1-NE 2.94Å; E743-R747 PolarHBondContact OE1-NE 3.04Å; E743-R747 IonicContact OE1-NH2 3.61Å; E743-R747 PolarHBondContact OE1-NH2 2.49Å; E743-R747 IonicContact OE2-CZ 3.79Å; E743-R747 IonicContact OE2-NE 2.68Å; E743-R747 PolarHBondContact OE2-NE 2.89Å; E743-R747 IonicContact OE2-NH2 2.81Å; E743-R747 PolarHBondContact OE2-NH2 3.34Å; Y744-R747 PolarHBondContact O-N 3.32Å; E745-R747 VanDerWaalsContact C-N 3.32Å; E745-R747 PolarHBondContact O-N 3.43Å; R747-M749 PolarHBondContact O-N 3.1Å; R747-S750 WeakPolarHBondContact O-CB 3.21Å; R747-S750 PolarHBondContact O-N 2.87Å; R747-V751 WeakPolarHBondContact O-CG2 3.48Å; R747-V751 PolarHBondContact O-N 3.49Å; R747-V787 HydrophobicContact CB-CG1 4.05Å; R747-V787 HydrophobicContact CB-CG2 4.31Å
748	M	92.8	Very high	85.9	Confident	4 Å²	4	53.4 Å²	53.4	2%	0.02	28%	0.281	C	S	.	.	H	α-helix	trans	-59.9	-47.3	177	-67.5	-61.8	-65.1	0	0	111.4	L705 Y744 E745 S750 V751 Y752 L784 V787	L705-M748 HydrophobicContact CD1-CB 4.47Å; L705-M748 HydrophobicContact CD1-CG 4.47Å; L705-M748 HydrophobicContact CD2-CB 4.2Å; Y744-M748 HydrophobicContact CD1-CG 4.35Å; Y744-M748 HydrophobicContact CD2-CG 4.5Å; Y744-M748 HydrophobicContact CE1-CG 3.87Å; Y744-M748 HydrophobicContact CE2-CG 4.03Å; Y744-M748 HydrophobicContact CE2-SD 4.13Å; Y744-M748 WeakPolarHBondContact O-CG 3.43Å; Y744-M748 PolarHBondContact O-N 2.94Å; E745-M748 PolarHBondContact O-N 2.97Å; M748-S750 VanDerWaalsContact C-N 3.34Å; M748-S750 PolarHBondContact O-N 3.21Å; M748-V751 PolarHBondContact O-N 3.29Å; M748-Y752 HydrophobicContact CB-CE2 4.42Å; M748-Y752 HydrophobicContact CE-CE1 3.8Å; M748-Y752 WeakPolarHBondContact CE-OH 3.28Å; M748-Y752 WeakPolarHBondContact O-CD1 3.3Å; M748-Y752 PolarHBondContact O-N 3.44Å; M748-L784 HydrophobicContact CE-CD2 4Å; M748-V787 HydrophobicContact CG-CG1 4.23Å; M748-V787 HydrophobicContact SD-CB 3.78Å; M748-V787 HydrophobicContact SD-CG1 3.74Å; M748-V787 HydrophobicContact SD-CG2 3.99Å
749	M	91.6	Very high	87.9	Confident	39 Å²	39	49.5 Å²	49.5	19%	0.192	25%	0.248	C	C	.	.	H	α-helix	trans	-63.2	-38.1	178	-68	-57.2	-56.9	0	0	112.6	L705 T735 E745 R747 Y752 N753	L705-M749 HydrophobicContact CD2-SD 4.15Å; T735-M749 WeakPolarHBondContact O-CE 3.28Å; E745-M749 HydrophobicContact CG-CG 4.34Å; E745-M749 WeakPolarHBondContact O-CB 3.47Å; E745-M749 VanDerWaalsContact O-CG 3.3Å; E745-M749 WeakPolarHBondContact O-CG 3.31Å; E745-M749 PolarHBondContact O-N 3.23Å; R747-M749 PolarHBondContact O-N 3.1Å; M749-Y752 HydrophobicContact CE-CD2 4.45Å; M749-Y752 PolarHBondContact O-N 3.28Å; M749-Y752 HydrophobicContact SD-CD2 3.74Å; M749-Y752 HydrophobicContact SD-CE2 4.11Å; M749-N753 VanDerWaalsContact O-CG 3.31Å; M749-N753 PolarHBondContact O-N 2.92Å; M749-N753 PolarHBondContact O-ND2 2.94Å
750	S	91.4	Very high	88.9	Confident	78 Å²	78	46.9 Å²	46.9	55%	0.545	24%	0.236	S	C	.	.	H	α-helix	trans	-60.8	-44.7	173.7	-172	0	0	0	0	111.5	R746 R747 M748 Y752 N753 H754	R746-S750 WeakPolarHBondContact O-CB 3.37Å; R746-S750 PolarHBondContact O-N 3.42Å; R747-S750 WeakPolarHBondContact O-CB 3.21Å; R747-S750 PolarHBondContact O-N 2.87Å; M748-S750 VanDerWaalsContact C-N 3.34Å; M748-S750 PolarHBondContact O-N 3.21Å; S750-Y752 VanDerWaalsContact C-N 3.34Å; S750-Y752 PolarHBondContact O-N 3.41Å; S750-N753 PolarHBondContact O-N 3.47Å; S750-H754 WeakPolarHBondContact O-CB 3.31Å; S750-H754 PolarHBondContact O-N 3.34Å
751	V	94.1	Very high	89.4	Confident	22 Å²	22	48.9 Å²	48.9	13%	0.133	25%	0.248	C	C	.	.	H	α-helix	trans	-62.6	-41.5	174.5	174	0	0	0	0	110.9	R747 M748 N753 H754 V755 A783 L784 V787	R747-V751 WeakPolarHBondContact O-CG2 3.48Å; R747-V751 PolarHBondContact O-N 3.49Å; M748-V751 PolarHBondContact O-N 3.29Å; V751-N753 PolarHBondContact O-N 2.92Å; V751-H754 PolarHBondContact O-N 2.87Å; V751-V755 HydrophobicContact CG1-CG2 4.28Å; V751-V755 VanDerWaalsContact O-CG2 3.29Å; V751-V755 WeakPolarHBondContact O-CG2 3.49Å; V751-V755 PolarHBondContact O-N 3.39Å; V751-A783 HydrophobicContact CG1-CB 3.84Å; V751-A783 HydrophobicContact CG2-CB 4.42Å; V751-L784 HydrophobicContact CG1-CD2 3.69Å; V751-L784 HydrophobicContact CG1-CG 4Å; V751-V787 HydrophobicContact CG2-CG2 4.07Å
752	Y	93.8	Very high	89.8	Confident	12 Å²	12	45.4 Å²	45.4	5%	0.047	23%	0.229	C	C	.	.	H	α-helix	trans	-61.3	-46.5	178.2	-61.2	-14.1	0	0	0	112.1	L705 Q708 L712 M748 M749 S750 V755 L756 L784	L705-Y752 HydrophobicContact CD2-CE2 3.92Å; L705-Y752 PolarHBondContact O-OH 3.07Å; Q708-Y752 HydrophobicContact CB-CE2 3.9Å; L712-Y752 HydrophobicContact CD2-CD1 3.5Å; L712-Y752 HydrophobicContact CD2-CE1 4.27Å; L712-Y752 HydrophobicContact CD2-CG 4.05Å; M748-Y752 HydrophobicContact CB-CE2 4.42Å; M748-Y752 HydrophobicContact CE-CE1 3.8Å; M748-Y752 WeakPolarHBondContact CE-OH 3.28Å; M748-Y752 WeakPolarHBondContact O-CD1 3.3Å; M748-Y752 PolarHBondContact O-N 3.44Å; M749-Y752 HydrophobicContact CE-CD2 4.45Å; M749-Y752 PolarHBondContact O-N 3.28Å; M749-Y752 HydrophobicContact SD-CD2 3.74Å; M749-Y752 HydrophobicContact SD-CE2 4.11Å; S750-Y752 VanDerWaalsContact C-N 3.34Å; S750-Y752 PolarHBondContact O-N 3.41Å; Y752-V755 PolarHBondContact O-N 2.97Å; Y752-L756 WeakPolarHBondContact O-CB 3.3Å; Y752-L756 VanDerWaalsContact O-CG 3.29Å; Y752-L756 WeakPolarHBondContact O-CG 3.05Å; Y752-L756 PolarHBondContact O-N 2.83Å; Y752-L784 HydrophobicContact CD1-CD2 4.14Å; Y752-L784 HydrophobicContact CE1-CD2 3.67Å
753	N	91.2	Very high	89.5	Confident	48 Å²	48	46 Å²	46	26%	0.257	23%	0.23	S	C	.	.	H	α-helix	trans	-62.4	-45	177.7	-67.3	-16.7	0	0	0	111.1	M749 S750 V751 V755 L756 E757	M749-N753 VanDerWaalsContact O-CG 3.31Å; M749-N753 PolarHBondContact O-N 2.92Å; M749-N753 PolarHBondContact O-ND2 2.94Å; S750-N753 PolarHBondContact O-N 3.47Å; V751-N753 PolarHBondContact O-N 2.92Å; N753-V755 PolarHBondContact O-N 3.14Å; N753-L756 PolarHBondContact O-N 3.13Å; N753-E757 WeakPolarHBondContact O-CB 3.16Å; N753-E757 VanDerWaalsContact O-CG 3.31Å; N753-E757 WeakPolarHBondContact O-CG 3.25Å; N753-E757 PolarHBondContact O-N 2.88Å
754	H	92.6	Very high	89	Confident	107 Å²	107	52.2 Å²	52.2	50%	0.495	25%	0.252	S	S	.	.	H	α-helix	trans	-59.7	-44.5	178.2	-177.3	56.7	0	0	0	112.6	S750 V751 E757 E758	S750-H754 WeakPolarHBondContact O-CB 3.31Å; S750-H754 PolarHBondContact O-N 3.34Å; V751-H754 PolarHBondContact O-N 2.87Å; H754-E757 PolarHBondContact O-N 3.5Å; H754-E758 WeakPolarHBondContact O-CB 3.16Å; H754-E758 PolarHBondContact O-N 3.46Å
755	V	92.4	Very high	88.3	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.006	28%	0.276	C	S	.	.	H	α-helix	trans	-65.4	-41.7	177.5	172.2	0	0	0	0	111.2	L712 V751 Y752 N753 E758 V759 A780	L712-V755 HydrophobicContact CD1-CG1 4Å; L712-V755 HydrophobicContact CD2-CB 4.04Å; L712-V755 HydrophobicContact CD2-CG1 4Å; L712-V755 HydrophobicContact CG-CG1 3.99Å; V751-V755 HydrophobicContact CG1-CG2 4.28Å; V751-V755 VanDerWaalsContact O-CG2 3.29Å; V751-V755 WeakPolarHBondContact O-CG2 3.49Å; V751-V755 PolarHBondContact O-N 3.39Å; Y752-V755 PolarHBondContact O-N 2.97Å; N753-V755 PolarHBondContact O-N 3.14Å; V755-E758 PolarHBondContact O-N 3.42Å; V755-V759 HydrophobicContact CG1-CG2 4.17Å; V755-V759 WeakPolarHBondContact O-CB 3.49Å; V755-V759 WeakPolarHBondContact O-CG2 3.33Å; V755-V759 PolarHBondContact O-N 3.36Å; V755-A780 HydrophobicContact CB-CB 4.44Å; V755-A780 HydrophobicContact CG1-CB 3.95Å; V755-A780 HydrophobicContact CG2-CB 3.57Å
756	L	90.1	Very high	87.6	Confident	44 Å²	44	61 Å²	61	23%	0.23	29%	0.288	C	S	.	.	H	α-helix	trans	-63.3	-44.7	177.5	-73.5	170.4	0	0	0	111.9	L712 Y752 N753 E758 V759 E760	L712-L756 HydrophobicContact CD1-CD2 3.62Å; L712-L756 HydrophobicContact CD1-CG 3.81Å; Y752-L756 WeakPolarHBondContact O-CB 3.3Å; Y752-L756 VanDerWaalsContact O-CG 3.29Å; Y752-L756 WeakPolarHBondContact O-CG 3.05Å; Y752-L756 PolarHBondContact O-N 2.83Å; N753-L756 PolarHBondContact O-N 3.13Å; L756-E758 VanDerWaalsContact C-N 3.35Å; L756-E758 PolarHBondContact O-N 2.86Å; L756-V759 PolarHBondContact O-N 2.96Å; L756-E760 WeakPolarHBondContact O-CB 3.39Å; L756-E760 PolarHBondContact O-N 3.35Å
757	E	89.9	Confident	86.7	Confident	108 Å²	108	62.9 Å²	62.9	51%	0.505	31%	0.308	S	S	.	.	H	α-helix	trans	-59.5	-44.4	175.1	-73.5	170.8	-169.3	0	0	111.3	N753 H754 S761	N753-E757 WeakPolarHBondContact O-CB 3.16Å; N753-E757 VanDerWaalsContact O-CG 3.31Å; N753-E757 WeakPolarHBondContact O-CG 3.25Å; N753-E757 PolarHBondContact O-N 2.88Å; H754-E757 PolarHBondContact O-N 3.5Å; E757-S761 WeakPolarHBondContact O-CB 3.46Å; E757-S761 PolarHBondContact O-N 3.4Å; E757-S761 PolarHBondContact O-OG 3.12Å
758	E	90	Very high	85.5	Confident	44 Å²	44	61.9 Å²	61.9	21%	0.206	31%	0.312	C	S	.	.	H	α-helix	trans	-65.6	-46.8	178.5	-164.9	-174.4	-174.1	0	0	111.5	H754 V755 L756 E760 S761 L762 C776	H754-E758 WeakPolarHBondContact O-CB 3.16Å; H754-E758 PolarHBondContact O-N 3.46Å; V755-E758 PolarHBondContact O-N 3.42Å; L756-E758 VanDerWaalsContact C-N 3.35Å; L756-E758 PolarHBondContact O-N 2.86Å; E758-E760 PolarHBondContact O-N 2.67Å; E758-S761 PolarHBondContact O-N 2.67Å; E758-S761 PolarHBondContact O-OG 2.89Å; E758-L762 HydrophobicContact CG-CD1 3.98Å; E758-L762 WeakPolarHBondContact O-CG 3.3Å; E758-L762 PolarHBondContact O-N 3.13Å; E758-L762 VanDerWaalsContact O-N 3.09Å; E758-C776 HydrophobicContact CG-CB 4.26Å; E758-C776 WeakPolarHBondContact OE1-CB 3.45Å; E758-C776 PolarHBondContact OE2-SG 2.94Å
759	V	89.2	Confident	84.5	Confident	6 Å²	6	62.6 Å²	62.6	4%	0.036	32%	0.316	C	S	.	.	H	α-helix	trans	-58.3	-45.9	177.9	166.3	0	0	0	0	111	A716 A719 L720 V755 L756 L762 N763	A716-V759 HydrophobicContact CB-CG2 3.77Å; A719-V759 HydrophobicContact CB-CG1 4.27Å; L720-V759 HydrophobicContact CD1-CG2 3.99Å; L720-V759 HydrophobicContact CD2-CG1 4.15Å; L720-V759 WeakPolarHBondContact CD2-O 3.31Å; L720-V759 HydrophobicContact CG-CG1 4.07Å; L720-V759 HydrophobicContact CG-CG2 4.43Å; V755-V759 HydrophobicContact CG1-CG2 4.17Å; V755-V759 WeakPolarHBondContact O-CB 3.49Å; V755-V759 WeakPolarHBondContact O-CG2 3.33Å; V755-V759 PolarHBondContact O-N 3.36Å; L756-V759 PolarHBondContact O-N 2.96Å; V759-L762 PolarHBondContact O-N 3.48Å; V759-N763 PolarHBondContact O-N 3.04Å
760	E	85.7	Confident	83.8	Confident	99 Å²	99	61.5 Å²	61.5	46%	0.463	31%	0.313	S	S	.	.	H	α-helix	trans	-65.7	-43.3	178.4	-170.6	-168.9	-160.5	0	0	111.7	Y732 L756 E758 L762 N763	Y732-E760 VanDerWaalsContact CE2-CD 3.44Å; Y732-E760 WeakPolarHBondContact CE2-OE1 3.44Å; Y732-E760 WeakPolarHBondContact CE2-OE2 3.38Å; Y732-E760 PolarHBondContact OH-OE2 3.14Å; L756-E760 WeakPolarHBondContact O-CB 3.39Å; L756-E760 PolarHBondContact O-N 3.35Å; E758-E760 PolarHBondContact O-N 2.67Å; E760-L762 PolarHBondContact O-N 3.38Å; E760-N763 WeakPolarHBondContact O-CB 3.26Å; E760-N763 PolarHBondContact O-N 2.94Å; E760-N763 VanDerWaalsContact O-N 3.1Å
761	S	86.6	Confident	83.4	Confident	72 Å²	72	64.3 Å²	64.3	50%	0.503	31%	0.312	S	S	.	.	H	α-helix	trans	-62.8	-27.7	-179.7	79.2	0	0	0	0	113.6	E757 E758	E757-S761 WeakPolarHBondContact O-CB 3.46Å; E757-S761 PolarHBondContact O-N 3.4Å; E757-S761 PolarHBondContact O-OG 3.12Å; E758-S761 PolarHBondContact O-N 2.67Å; E758-S761 PolarHBondContact O-OG 2.89Å
762	L	86.1	Confident	83	Confident	11 Å²	11	67.3 Å²	67.3	6%	0.058	33%	0.326	C	S	.	.	H	α-helix	trans	-89.9	-20.5	178.1	-71.1	169.5	0	0	0	112.4	L720 E758 V759 E760 R764 K765 Y766 M772 C776	L720-L762 HydrophobicContact CD2-CB 3.88Å; E758-L762 HydrophobicContact CG-CD1 3.98Å; E758-L762 WeakPolarHBondContact O-CG 3.3Å; E758-L762 PolarHBondContact O-N 3.13Å; E758-L762 VanDerWaalsContact O-N 3.09Å; V759-L762 PolarHBondContact O-N 3.48Å; E760-L762 PolarHBondContact O-N 3.38Å; L762-R764 PolarHBondContact O-N 3.49Å; L762-K765 WeakPolarHBondContact O-CB 3.35Å; L762-K765 PolarHBondContact O-N 2.96Å; L762-K765 VanDerWaalsContact O-N 3.16Å; L762-Y766 HydrophobicContact CD2-CD2 4.09Å; L762-Y766 HydrophobicContact CD2-CE2 3.71Å; L762-M772 HydrophobicContact CD2-CB 4.17Å; L762-C776 HydrophobicContact CD1-CB 3.47Å; L762-C776 VanDerWaalsContact CD1-CB 3.47Å
763	N	78.6	Confident	82.6	Confident	37 Å²	37	67 Å²	67	20%	0.198	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	129.2	-179.5	-165.1	3.3	0	0	0	110.1	V759 E760 K765	V759-N763 PolarHBondContact O-N 3.04Å; E760-N763 WeakPolarHBondContact O-CB 3.26Å; E760-N763 PolarHBondContact O-N 2.94Å; E760-N763 VanDerWaalsContact O-N 3.1Å; N763-K765 PolarHBondContact O-N 2.96Å
764	R	73.9	Confident	82.5	Confident	173 Å²	173	65 Å²	65	65%	0.653	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.7	5.3	-179	-49.6	179.4	177.9	174.7	-4.6	116.2	E725 L762	E725-R764 PolarHBondContact O-NH2 3Å; L762-R764 PolarHBondContact O-N 3.49Å
765	K	75.5	Confident	82.3	Confident	132 Å²	132	60.6 Å²	60.6	57%	0.574	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-31.5	-179.1	-169.7	173	178.6	178.1	0	113.4	L762 N763	L762-K765 WeakPolarHBondContact O-CB 3.35Å; L762-K765 PolarHBondContact O-N 2.96Å; L762-K765 VanDerWaalsContact O-N 3.16Å; N763-K765 PolarHBondContact O-N 2.96Å
766	Y	75.4	Confident	82.3	Confident	93 Å²	93	60.5 Å²	60.5	37%	0.365	30%	0.296	S	S	.	.	S	Bend	trans	-128.9	164.1	-179.9	-56.1	-78.5	0	0	0	110.6	L762 M772 H773	L762-Y766 HydrophobicContact CD2-CD2 4.09Å; L762-Y766 HydrophobicContact CD2-CE2 3.71Å; Y766-M772 HydrophobicContact CD2-CB 4.2Å; Y766-M772 HydrophobicContact CD2-CG 4.39Å; Y766-M772 HydrophobicContact CE2-CB 4.11Å; Y766-M772 HydrophobicContact CE2-CG 4.03Å; Y766-H773 AromaticContact CD2-NE2 3.88Å
767	T	69.8	Low	82.4	Confident	109 Å²	109	58.4 Å²	58.4	67%	0.669	29%	0.285	S	S	*	.			trans	-60.2	144.6	171.9	51.2	0	0	0	0	110.6	V769 H773	T767-V769 PolarHBondContact O-N 2.94Å; T767-H773 PolarHBondContact O-CE1 3.06Å
768	P	65.4	Low	82.5	Confident	61 Å²	61	53.5 Å²	53.5	40%	0.396	26%	0.262	S	S	.	.	S	Bend	trans	-52	136.1	177.9	-27	34.8	0	0	0	112.1	P724	P724-P768 HydrophobicContact CG-CG 4.29Å
769	V	72.3	Confident	82.6	Confident	18 Å²	18	53.6 Å²	53.6	11%	0.109	26%	0.264	C	S	.	.	S	Bend	trans	63.7	64.7	-173.4	-163.4	0	0	0	0	113.9	L641 C664 I667 I721 T767	L641-V769 HydrophobicContact CD1-CG1 3.61Å; L641-V769 HydrophobicContact CD2-CG1 4.25Å; C664-V769 HydrophobicContact CB-CB 4.13Å; C664-V769 HydrophobicContact CB-CG2 3.66Å; I667-V769 HydrophobicContact CD1-CG1 4.3Å; I667-V769 HydrophobicContact CG2-CG1 3.77Å; I721-V769 HydrophobicContact CD1-CG2 4.24Å; I721-V769 HydrophobicContact CG2-CG2 3.58Å; T767-V769 PolarHBondContact O-N 2.94Å
770	S	76.8	Confident	82.8	Confident	17 Å²	17	53.4 Å²	53.4	12%	0.119	26%	0.263	C	S	.	.			trans	-98.1	161.3	171.6	78.3	0	0	0	0	112.2	M772 H773 T774	S770-M772 PolarHBondContact O-N 2.87Å; S770-M772 PolarHBondContact OG-N 3.25Å; S770-H773 PolarHBondContact N-ND1 3.44Å; S770-H773 PolarHBondContact O-N 3.47Å; S770-H773 VanDerWaalsContact O-N 3.13Å; S770-H773 PolarHBondContact OG-CD2 3.34Å; S770-H773 VanDerWaalsContact OG-CD2 3.28Å; S770-H773 PolarHBondContact OG-CE1 3Å; S770-H773 VanDerWaalsContact OG-CG 3.23Å; S770-H773 PolarHBondContact OG-N 3.33Å; S770-H773 PolarHBondContact OG-ND1 3.12Å; S770-H773 PolarHBondContact OG-NE2 3.36Å; S770-T774 PolarHBondContact O-N 3.14Å; S770-T774 VanDerWaalsContact O-N 3.15Å; S770-T774 PolarHBondContact O-OG1 2.99Å
771	Y	81.8	Confident	83.2	Confident	136 Å²	136	48.7 Å²	48.7	53%	0.533	24%	0.241	S	C	.	.	H	α-helix	trans	-55.7	-35.4	170.7	175.2	-101	0	0	0	112	T774 A775	Y771-T774 WeakPolarHBondContact CA-OG1 3.39Å; Y771-T774 PolarHBondContact O-N 3.38Å; Y771-T774 PolarHBondContact O-OG1 3.22Å; Y771-A775 WeakPolarHBondContact O-CB 3.26Å; Y771-A775 PolarHBondContact O-N 3.13Å
772	M	85.6	Confident	83.5	Confident	86 Å²	86	45.5 Å²	45.5	42%	0.424	22%	0.219	S	C	.	.	H	α-helix	trans	-65	-40.8	177.8	-59.6	-58.7	-68.3	0	0	111.7	L762 Y766 S770 A775 C776	L762-M772 HydrophobicContact CD2-CB 4.17Å; Y766-M772 HydrophobicContact CD2-CB 4.2Å; Y766-M772 HydrophobicContact CD2-CG 4.39Å; Y766-M772 HydrophobicContact CE2-CB 4.11Å; Y766-M772 HydrophobicContact CE2-CG 4.03Å; S770-M772 PolarHBondContact O-N 2.87Å; S770-M772 PolarHBondContact OG-N 3.25Å; M772-A775 PolarHBondContact O-N 3.15Å; M772-C776 PolarHBondContact O-N 3Å
773	H	86.9	Confident	83.9	Confident	5 Å²	5	46 Å²	46	2%	0.023	23%	0.225	C	C	.	.	H	α-helix	trans	-65.9	-43.5	177	-54.7	160.1	0	0	0	111.2	L720 I721 Y766 T767 S770 A775 C776 L777	L720-H773 HydrophobicContact CB-CB 4.27Å; L720-H773 HydrophobicContact CD1-CB 4.5Å; L720-H773 PolarHBondContact O-ND1 3.46Å; I721-H773 HydrophobicContact CD1-CB 3.76Å; Y766-H773 AromaticContact CD2-NE2 3.88Å; T767-H773 PolarHBondContact O-CE1 3.06Å; S770-H773 PolarHBondContact N-ND1 3.44Å; S770-H773 PolarHBondContact O-N 3.47Å; S770-H773 VanDerWaalsContact O-N 3.13Å; S770-H773 PolarHBondContact OG-CD2 3.34Å; S770-H773 VanDerWaalsContact OG-CD2 3.28Å; S770-H773 PolarHBondContact OG-CE1 3Å; S770-H773 VanDerWaalsContact OG-CG 3.23Å; S770-H773 PolarHBondContact OG-N 3.33Å; S770-H773 PolarHBondContact OG-ND1 3.12Å; S770-H773 PolarHBondContact OG-NE2 3.36Å; H773-A775 VanDerWaalsContact C-N 3.32Å; H773-A775 PolarHBondContact O-N 3.3Å; H773-C776 PolarHBondContact O-N 2.71Å; H773-L777 WeakPolarHBondContact O-CG 3.45Å; H773-L777 PolarHBondContact O-N 3.11Å; H773-L777 VanDerWaalsContact O-N 3.07Å
774	T	87.9	Confident	84.6	Confident	6 Å²	6	44.8 Å²	44.8	4%	0.037	22%	0.218	C	C	.	.	H	α-helix	trans	-67.4	-32.5	176.9	53.5	0	0	0	0	113.1	C638 L641 M671 S770 Y771 C778	C638-T774 HydrophobicContact CB-CG2 4.25Å; L641-T774 HydrophobicContact CD2-CG2 3.66Å; M671-T774 HydrophobicContact CE-CG2 4.49Å; S770-T774 PolarHBondContact O-N 3.14Å; S770-T774 VanDerWaalsContact O-N 3.15Å; S770-T774 PolarHBondContact O-OG1 2.99Å; Y771-T774 WeakPolarHBondContact CA-OG1 3.39Å; Y771-T774 PolarHBondContact O-N 3.38Å; Y771-T774 PolarHBondContact O-OG1 3.22Å; T774-C778 PolarHBondContact O-N 3.21Å; T774-C778 PolarHBondContact O-SG 3.45Å; T774-C778 VanDerWaalsContact O-SG 3.33Å
775	A	89	Confident	85.5	Confident	14 Å²	14	36.6 Å²	36.6	12%	0.116	19%	0.187	C	C	.	.	H	α-helix	trans	-66.8	-45.9	175	0	0	0	0	0	111.1	Y771 M772 H773 L777 C778 N779	Y771-A775 WeakPolarHBondContact O-CB 3.26Å; Y771-A775 PolarHBondContact O-N 3.13Å; M772-A775 PolarHBondContact O-N 3.15Å; H773-A775 VanDerWaalsContact C-N 3.32Å; H773-A775 PolarHBondContact O-N 3.3Å; A775-L777 PolarHBondContact O-N 3.4Å; A775-C778 PolarHBondContact O-N 3.46Å; A775-N779 WeakPolarHBondContact O-CB 3.35Å; A775-N779 PolarHBondContact O-N 2.93Å; A775-N779 PolarHBondContact O-ND2 2.75Å
776	C	90.9	Very high	86.2	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-55.3	-48.4	173.1	170.6	0	0	0	0	111.7	L720 E758 L762 M772 H773 C778 N779 A780	L720-C776 HydrophobicContact CD1-CB 4.46Å; E758-C776 HydrophobicContact CG-CB 4.26Å; E758-C776 WeakPolarHBondContact OE1-CB 3.45Å; E758-C776 PolarHBondContact OE2-SG 2.94Å; L762-C776 HydrophobicContact CD1-CB 3.47Å; L762-C776 VanDerWaalsContact CD1-CB 3.47Å; M772-C776 PolarHBondContact O-N 3Å; H773-C776 PolarHBondContact O-N 2.71Å; C776-C778 PolarHBondContact O-N 3.17Å; C776-N779 PolarHBondContact O-N 2.8Å; C776-A780 WeakPolarHBondContact O-CB 3.32Å; C776-A780 PolarHBondContact O-N 3.35Å
777	L	92.3	Very high	86.9	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-59.7	-43.9	177	-69.2	174.6	0	0	0	112.4	A716 I717 I721 H773 A775 A780 I781	A716-L777 HydrophobicContact CB-CD2 3.64Å; I717-L777 HydrophobicContact CG1-CD1 4.38Å; I717-L777 HydrophobicContact CG1-CD2 4.19Å; I721-L777 HydrophobicContact CG1-CD1 4.27Å; H773-L777 WeakPolarHBondContact O-CG 3.45Å; H773-L777 PolarHBondContact O-N 3.11Å; H773-L777 VanDerWaalsContact O-N 3.07Å; A775-L777 PolarHBondContact O-N 3.4Å; L777-A780 PolarHBondContact O-N 3.09Å; L777-I781 VanDerWaalsContact O-CG1 3.3Å; L777-I781 WeakPolarHBondContact O-CG1 3.43Å; L777-I781 PolarHBondContact O-N 3.09Å; L777-I781 VanDerWaalsContact O-N 3.15Å
778	C	92.3	Very high	87.7	Confident	4 Å²	4	25.7 Å²	25.7	3%	0.027	14%	0.136	C	C	.	.	H	α-helix	trans	-64.7	-44.1	176.4	-72.5	0	0	0	0	111.8	Y583 T774 A775 C776 A780 I781 I782	Y583-C778 HydrophobicContact CD1-CB 3.58Å; Y583-C778 HydrophobicContact CE1-CB 3.36Å; T774-C778 PolarHBondContact O-N 3.21Å; T774-C778 PolarHBondContact O-SG 3.45Å; T774-C778 VanDerWaalsContact O-SG 3.33Å; A775-C778 PolarHBondContact O-N 3.46Å; C776-C778 PolarHBondContact O-N 3.17Å; C778-A780 VanDerWaalsContact C-N 3.34Å; C778-A780 PolarHBondContact O-N 3.31Å; C778-I781 PolarHBondContact O-N 3.48Å; C778-I782 WeakPolarHBondContact O-CG1 3.29Å; C778-I782 PolarHBondContact O-N 3.25Å
779	N	92.6	Very high	88.9	Confident	47 Å²	47	22.9 Å²	22.9	25%	0.251	12%	0.117	S	C	.	.	H	α-helix	trans	-61	-43.1	177.7	-72.4	-15.7	0	0	0	111.5	Y583 A775 C776 I781 I782 A783	Y583-N779 PolarHBondContact OH-OD1 2.93Å; A775-N779 WeakPolarHBondContact O-CB 3.35Å; A775-N779 PolarHBondContact O-N 2.93Å; A775-N779 PolarHBondContact O-ND2 2.75Å; C776-N779 PolarHBondContact O-N 2.8Å; N779-I781 PolarHBondContact O-N 2.9Å; N779-I782 PolarHBondContact O-N 3.42Å; N779-A783 WeakPolarHBondContact O-CB 3.38Å; N779-A783 PolarHBondContact O-N 3.5Å
780	A	94.1	Very high	89.9	Confident	2 Å²	2	22.4 Å²	22.4	2%	0.017	12%	0.115	C	C	.	.	H	α-helix	trans	-57.8	-45.9	175	0	0	0	0	0	111.9	I713 V755 C776 L777 C778 A783 L784	I713-A780 HydrophobicContact CD1-CB 3.9Å; V755-A780 HydrophobicContact CB-CB 4.44Å; V755-A780 HydrophobicContact CG1-CB 3.95Å; V755-A780 HydrophobicContact CG2-CB 3.57Å; C776-A780 WeakPolarHBondContact O-CB 3.32Å; C776-A780 PolarHBondContact O-N 3.35Å; L777-A780 PolarHBondContact O-N 3.09Å; C778-A780 VanDerWaalsContact C-N 3.34Å; C778-A780 PolarHBondContact O-N 3.31Å; A780-A783 PolarHBondContact O-N 3.4Å; A780-L784 VanDerWaalsContact O-CG 3.28Å; A780-L784 WeakPolarHBondContact O-CG 3.32Å; A780-L784 PolarHBondContact O-N 2.76Å
781	I	94.1	Very high	90.9	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-62.1	-46.5	176.9	-64.9	165.4	0	0	0	111	F631 L634 I635 I713 L777 C778 N779 A783 L784 L785	F631-I781 HydrophobicContact CB-CG2 3.82Å; F631-I781 HydrophobicContact CD1-CB 4.49Å; F631-I781 HydrophobicContact CD1-CD1 4.29Å; F631-I781 HydrophobicContact CD1-CG1 3.87Å; F631-I781 HydrophobicContact CD1-CG2 3.95Å; F631-I781 HydrophobicContact CD2-CG2 4.25Å; F631-I781 HydrophobicContact CE1-CG1 4.28Å; F631-I781 HydrophobicContact CG-CG2 3.77Å; L634-I781 HydrophobicContact CB-CD1 4.09Å; L634-I781 HydrophobicContact CD2-CD1 3.55Å; L634-I781 HydrophobicContact CD2-CG1 4.31Å; L634-I781 HydrophobicContact CG-CD1 3.84Å; I635-I781 HydrophobicContact CD1-CD1 4.41Å; I635-I781 HydrophobicContact CD1-CG2 3.96Å; I635-I781 HydrophobicContact CG1-CD1 3.77Å; I635-I781 HydrophobicContact CG1-CG2 4.46Å; I713-I781 HydrophobicContact CD1-CG1 4.5Å; L777-I781 VanDerWaalsContact O-CG1 3.3Å; L777-I781 WeakPolarHBondContact O-CG1 3.43Å; L777-I781 PolarHBondContact O-N 3.09Å; L777-I781 VanDerWaalsContact O-N 3.15Å; C778-I781 PolarHBondContact O-N 3.48Å; N779-I781 PolarHBondContact O-N 2.9Å; I781-A783 VanDerWaalsContact C-N 3.34Å; I781-A783 PolarHBondContact O-N 3.45Å; I781-L784 PolarHBondContact O-N 3.09Å; I781-L785 HydrophobicContact CG2-CD1 3.82Å; I781-L785 HydrophobicContact CG2-CG 4.28Å; I781-L785 WeakPolarHBondContact O-CB 3.46Å; I781-L785 VanDerWaalsContact O-CG 3.31Å; I781-L785 WeakPolarHBondContact O-CG 3.36Å; I781-L785 PolarHBondContact O-N 3.47Å
782	I	92.6	Very high	91.5	Very high	5 Å²	5	16.3 Å²	16.3	3%	0.026	9%	0.089	C	C	.	.	H	α-helix	trans	-62.9	-42.6	179.6	-63.3	-61.1	0	0	0	110.9	L578 A586 C778 N779 L784 L785 K786	L578-I782 HydrophobicContact CD1-CD1 4.13Å; L578-I782 HydrophobicContact CD2-CD1 4.38Å; A586-I782 HydrophobicContact CB-CD1 3.61Å; C778-I782 WeakPolarHBondContact O-CG1 3.29Å; C778-I782 PolarHBondContact O-N 3.25Å; N779-I782 PolarHBondContact O-N 3.42Å; I782-L784 VanDerWaalsContact C-N 3.35Å; I782-L784 PolarHBondContact O-N 3.48Å; I782-L785 PolarHBondContact O-N 3.37Å; I782-K786 HydrophobicContact CG2-CD 4.29Å; I782-K786 HydrophobicContact CG2-CG 4.48Å; I782-K786 WeakPolarHBondContact O-CB 3.14Å; I782-K786 WeakPolarHBondContact O-CG 3.49Å; I782-K786 PolarHBondContact O-N 2.81Å
783	A	93.3	Very high	92	Very high	22 Å²	22	17.2 Å²	17.2	18%	0.182	9%	0.088	C	C	.	.	H	α-helix	trans	-60.7	-43	176.5	0	0	0	0	0	111.9	V751 N779 A780 I781	V751-A783 HydrophobicContact CG1-CB 3.84Å; V751-A783 HydrophobicContact CG2-CB 4.42Å; N779-A783 WeakPolarHBondContact O-CB 3.38Å; N779-A783 PolarHBondContact O-N 3.5Å; A780-A783 PolarHBondContact O-N 3.4Å; I781-A783 VanDerWaalsContact C-N 3.34Å; I781-A783 PolarHBondContact O-N 3.45Å
784	L	94	Very high	92.4	Very high	11 Å²	11	18.3 Å²	18.3	6%	0.058	9%	0.092	C	C	.	.	H	α-helix	trans	-64.9	-41.2	175.7	-71.8	171	0	0	0	112.6	F631 I713 M748 V751 Y752 A780 I781 I782 V787	F631-L784 HydrophobicContact CZ-CD1 4.26Å; I713-L784 HydrophobicContact CD1-CD1 3.84Å; I713-L784 HydrophobicContact CG1-CD1 3.81Å; M748-L784 HydrophobicContact CE-CD2 4Å; V751-L784 HydrophobicContact CG1-CD2 3.69Å; V751-L784 HydrophobicContact CG1-CG 4Å; Y752-L784 HydrophobicContact CD1-CD2 4.14Å; Y752-L784 HydrophobicContact CE1-CD2 3.67Å; A780-L784 VanDerWaalsContact O-CG 3.28Å; A780-L784 WeakPolarHBondContact O-CG 3.32Å; A780-L784 PolarHBondContact O-N 2.76Å; I781-L784 PolarHBondContact O-N 3.09Å; I782-L784 VanDerWaalsContact C-N 3.35Å; I782-L784 PolarHBondContact O-N 3.48Å; L784-V787 PolarHBondContact O-N 3.21Å
785	L	92.7	Very high	92.9	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.005	9%	0.091	C	C	.	.	H	α-helix	trans	-73.1	-26.3	-179.6	-70.4	178.1	0	0	0	113.6	L578 I590 L628 F631 I781 I782 V787	L578-L785 HydrophobicContact CD1-CB 3.71Å; L578-L785 HydrophobicContact CD1-CD1 4.05Å; I590-L785 HydrophobicContact CD1-CD1 3.92Å; I590-L785 HydrophobicContact CG1-CD1 4.08Å; L628-L785 HydrophobicContact CD2-CD2 3.41Å; L628-L785 VanDerWaalsContact CD2-CD2 3.41Å; F631-L785 HydrophobicContact CD2-CD1 4.47Å; F631-L785 HydrophobicContact CD2-CD2 3.86Å; F631-L785 HydrophobicContact CD2-CG 4.28Å; F631-L785 HydrophobicContact CE2-CD2 4.03Å; I781-L785 HydrophobicContact CG2-CD1 3.82Å; I781-L785 HydrophobicContact CG2-CG 4.28Å; I781-L785 WeakPolarHBondContact O-CB 3.46Å; I781-L785 VanDerWaalsContact O-CG 3.31Å; I781-L785 WeakPolarHBondContact O-CG 3.36Å; I781-L785 PolarHBondContact O-N 3.47Å; I782-L785 PolarHBondContact O-N 3.37Å; L785-V787 VanDerWaalsContact C-N 3.26Å; L785-V787 PolarHBondContact O-N 3.41Å
786	K	89.7	Confident	93.2	Very high	69 Å²	69	18.8 Å²	18.8	30%	0.3	9%	0.091	S	C	.	.	H	α-helix	trans	-68.7	-22.8	175.5	-87.9	179.7	154.7	-175.1	0	113.3	L578 E580 I782 P788	L578-K786 VanDerWaalsContact O-CE 3.31Å; L578-K786 WeakPolarHBondContact O-CE 3.46Å; E580-K786 IonicContact OE1-NZ 2.85Å; E580-K786 PolarHBondContact OE1-NZ 3.28Å; E580-K786 IonicContact OE2-NZ 3.66Å; E580-K786 PolarHBondContact OE2-NZ 2.93Å; I782-K786 HydrophobicContact CG2-CD 4.29Å; I782-K786 HydrophobicContact CG2-CG 4.48Å; I782-K786 WeakPolarHBondContact O-CB 3.14Å; I782-K786 WeakPolarHBondContact O-CG 3.49Å; I782-K786 PolarHBondContact O-N 2.81Å; K786-P788 VanDerWaalsContact O-CD 3.3Å; K786-P788 WeakPolarHBondContact O-CD 3.46Å
787	V	90.5	Very high	93.2	Very high	11 Å²	11	21.8 Å²	21.8	7%	0.067	11%	0.105	C	C	.	.	S	Bend	trans	-75.5	113.1	173.7	-171.5	0	0	0	0	108.1	Y744 R747 M748 V751 L784 L785 L789	Y744-V787 HydrophobicContact CD2-CG1 3.72Å; Y744-V787 HydrophobicContact CE2-CG1 3.61Å; R747-V787 HydrophobicContact CB-CG1 4.05Å; R747-V787 HydrophobicContact CB-CG2 4.31Å; M748-V787 HydrophobicContact CG-CG1 4.23Å; M748-V787 HydrophobicContact SD-CB 3.78Å; M748-V787 HydrophobicContact SD-CG1 3.74Å; M748-V787 HydrophobicContact SD-CG2 3.99Å; V751-V787 HydrophobicContact CG2-CG2 4.07Å; L784-V787 PolarHBondContact O-N 3.21Å; L785-V787 VanDerWaalsContact C-N 3.26Å; L785-V787 PolarHBondContact O-N 3.41Å; V787-L789 PolarHBondContact O-N 3.49Å
788	P	85.9	Confident	93	Very high	25 Å²	25	26.2 Å²	26.2	16%	0.162	12%	0.124	C	C	.	.			trans	-63.9	134.7	-175.6	26.4	-33.9	0	0	0	110.2	Y744 K786 S790	Y744-P788 WeakPolarHBondContact CD2-O 3.49Å; Y744-P788 VanDerWaalsContact CE2-O 3.31Å; Y744-P788 WeakPolarHBondContact CE2-O 3.41Å; K786-P788 VanDerWaalsContact O-CD 3.3Å; K786-P788 WeakPolarHBondContact O-CD 3.46Å; P788-S790 PolarHBondContact O-N 3.08Å
789	L	92.1	Very high	92.8	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.005	14%	0.14	C	C	.	.			trans	-63.4	132.8	-180	-173.5	66.2	0	0	0	110.6	H539 E572 F620 R624 V787 F791	H539-L789 PolarHBondContact CE1-O 2.94Å; H539-L789 PolarHBondContact NE2-O 3.34Å; E572-L789 VanDerWaalsContact CD-CB 3.46Å; E572-L789 HydrophobicContact CG-CB 4.17Å; E572-L789 WeakPolarHBondContact OE2-CB 3.41Å; E572-L789 PolarHBondContact OE2-N 2.8Å; E572-L789 VanDerWaalsContact OE2-N 3.14Å; F620-L789 HydrophobicContact CE1-CD2 4.16Å; F620-L789 HydrophobicContact CZ-CD1 4.34Å; F620-L789 HydrophobicContact CZ-CD2 4.37Å; R624-L789 HydrophobicContact CG-CD2 4.32Å; V787-L789 PolarHBondContact O-N 3.49Å; L789-F791 HydrophobicContact CD2-CE1 3.99Å; L789-F791 HydrophobicContact CD2-CE2 4.48Å; L789-F791 HydrophobicContact CD2-CZ 3.9Å
790	S	93.6	Very high	92.7	Very high	9 Å²	9	27.1 Å²	27.1	6%	0.063	13%	0.129	C	C	.	.			trans	-98.3	111.4	175.8	179.3	0	0	0	0	110.3	R535 N702 P788 Q792	R535-S790 PolarHBondContact O-OG 3.49Å; N702-S790 PolarHBondContact ND2-O 3.32Å; N702-S790 VanDerWaalsContact ND2-O 3.12Å; P788-S790 PolarHBondContact O-N 3.08Å; S790-Q792 PolarHBondContact O-N 2.87Å; S790-Q792 PolarHBondContact OG-NE2 3.43Å
791	F	96.1	Very high	92.4	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.009	15%	0.145	C	C	.	.			trans	-77	106.2	173.2	-68.7	-75.4	0	0	0	110.1	S534 R535 H539 F568 F620 L789 F795 F796	S534-F791 WeakPolarHBondContact OG-CD2 3.25Å; R535-F791 WeakPolarHBondContact CA-O 3.39Å; R535-F791 WeakPolarHBondContact CG-O 3.33Å; H539-F791 AromaticContact CE1-CD2 3.84Å; H539-F791 AromaticContact CE1-CE2 3.79Å; F568-F791 HydrophobicContact CB-CZ 4.05Å; F620-F791 HydrophobicContact CE1-CD1 4.15Å; F620-F791 HydrophobicContact CE1-CE1 4.04Å; L789-F791 HydrophobicContact CD2-CE1 3.99Å; L789-F791 HydrophobicContact CD2-CE2 4.48Å; L789-F791 HydrophobicContact CD2-CZ 3.9Å; F791-F795 HydrophobicContact CD1-CD1 4.31Å; F791-F795 HydrophobicContact CD1-CD2 4.11Å; F791-F795 HydrophobicContact CD1-CE1 4.34Å; F791-F795 HydrophobicContact CD1-CE2 4.14Å; F791-F795 HydrophobicContact CD1-CG 4.2Å; F791-F795 HydrophobicContact CD1-CZ 4.25Å; F791-F795 HydrophobicContact CE1-CE2 4.3Å; F791-F795 HydrophobicContact CE1-CZ 4.31Å; F791-F796 HydrophobicContact CB-CE2 3.71Å; F791-F796 HydrophobicContact CB-CZ 3.79Å
792	Q	96	Very high	92.2	Very high	22 Å²	22	30.1 Å²	30.1	10%	0.103	15%	0.149	C	C	.	.			trans	-75.2	165.9	-173.9	-59	-60.5	-20.9	0	0	112.8	T699 N702 S790 Y794 F795	T699-Q792 HydrophobicContact CG2-CB 4.38Å; T699-Q792 WeakPolarHBondContact OG1-CB 3.17Å; N702-Q792 HydrophobicContact CB-CG 3.68Å; S790-Q792 PolarHBondContact O-N 2.87Å; S790-Q792 PolarHBondContact OG-NE2 3.43Å; Q792-Y794 VanDerWaalsContact C-N 3.27Å; Q792-Y794 PolarHBondContact O-N 3.47Å; Q792-Y794 VanDerWaalsContact O-N 3.17Å; Q792-F795 WeakPolarHBondContact O-CB 3.34Å; Q792-F795 PolarHBondContact O-N 2.63Å
793	R	94.5	Very high	92.1	Very high	106 Å²	106	32.4 Å²	32.4	40%	0.4	17%	0.165	S	C	.	.	H	α-helix	trans	-52.8	-42.5	-172.3	-174.5	-178	-175	154	10.3	113.4	D696 F795 F796 Q797 L799	D696-R793 VanDerWaalsContact OD2-CB 3.31Å; D696-R793 WeakPolarHBondContact OD2-CB 3.34Å; R793-F795 PolarHBondContact O-N 2.89Å; R793-F796 PolarHBondContact O-N 2.86Å; R793-Q797 HydrophobicContact CG-CG 3.75Å; R793-Q797 PolarHBondContact O-N 3.18Å; R793-L799 VanDerWaalsContact NE-CD1 3.34Å; R793-L799 VanDerWaalsContact NH2-CD1 3.34Å
794	Y	96.3	Very high	91.9	Very high	28 Å²	28	32 Å²	32	11%	0.11	16%	0.16	C	C	.	.	H	α-helix	trans	-61.8	-25	-177.4	-170.4	-116.1	0	0	0	113	F616 D694 A695 T699 Q792 F796 K798	F616-Y794 HydrophobicContact CB-CD1 4.44Å; F616-Y794 HydrophobicContact CB-CE1 3.88Å; F616-Y794 AromaticContact CD1-CD1 3.64Å; F616-Y794 HydrophobicContact CD1-CD1 3.64Å; F616-Y794 AromaticContact CD1-CE1 3.96Å; F616-Y794 HydrophobicContact CD1-CE1 3.96Å; F616-Y794 AromaticContact CD2-CD1 3.88Å; F616-Y794 HydrophobicContact CD2-CD1 3.88Å; F616-Y794 AromaticContact CD2-CE1 3.69Å; F616-Y794 HydrophobicContact CD2-CE1 3.69Å; F616-Y794 AromaticContact CE1-CD1 3.78Å; F616-Y794 HydrophobicContact CE1-CD1 3.78Å; F616-Y794 HydrophobicContact CE1-CE1 4.47Å; F616-Y794 AromaticContact CE2-CD1 4Å; F616-Y794 HydrophobicContact CE2-CD1 4Å; F616-Y794 HydrophobicContact CE2-CE1 4.22Å; F616-Y794 AromaticContact CG-CD1 3.7Å; F616-Y794 HydrophobicContact CG-CD1 3.7Å; F616-Y794 AromaticContact CG-CE1 3.55Å; F616-Y794 HydrophobicContact CG-CE1 3.55Å; F616-Y794 AromaticContact CZ-CD1 3.96Å; F616-Y794 HydrophobicContact CZ-CD1 3.96Å; D694-Y794 HydrophobicContact CB-CE2 3.86Å; A695-Y794 HydrophobicContact CB-CD1 3.61Å; A695-Y794 HydrophobicContact CB-CD2 4.14Å; A695-Y794 HydrophobicContact CB-CE1 3.92Å; A695-Y794 HydrophobicContact CB-CE2 4.4Å; A695-Y794 HydrophobicContact CB-CG 3.74Å; T699-Y794 HydrophobicContact CG2-CD1 4.21Å; T699-Y794 HydrophobicContact CG2-CG 4.44Å; T699-Y794 WeakPolarHBondContact OG1-CB 3.4Å; T699-Y794 PolarHBondContact OG1-N 2.85Å; Q792-Y794 VanDerWaalsContact C-N 3.27Å; Q792-Y794 PolarHBondContact O-N 3.47Å; Q792-Y794 VanDerWaalsContact O-N 3.17Å; Y794-F796 PolarHBondContact O-N 3.24Å; Y794-K798 HydrophobicContact CE2-CB 4.42Å; Y794-K798 HydrophobicContact CE2-CD 4.45Å; Y794-K798 HydrophobicContact CE2-CG 4.05Å
795	F	97.7	Very high	91.5	Very high	3 Å²	3	36 Å²	36	1%	0.013	18%	0.177	C	C	.	.	H	α-helix	trans	-60.6	-34.2	174.2	-166	-89.6	0	0	0	112.2	W561 L565 F568 F616 Q617 F620 V621 F791 Q792 R793	W561-F795 HydrophobicContact CH2-CD1 4.08Å; W561-F795 AromaticContact CH2-CE1 3.85Å; W561-F795 HydrophobicContact CH2-CE1 3.85Å; W561-F795 WeakPolarHBondContact CH2-O 3.48Å; W561-F795 HydrophobicContact CZ3-CE1 4.47Å; L565-F795 HydrophobicContact CD2-CD1 4.43Å; L565-F795 HydrophobicContact CD2-CE1 3.72Å; F568-F795 HydrophobicContact CD2-CZ 4.46Å; F568-F795 HydrophobicContact CE2-CZ 4.34Å; F616-F795 HydrophobicContact CE1-CD2 4.25Å; Q617-F795 HydrophobicContact CB-CD2 4.32Å; Q617-F795 HydrophobicContact CB-CE2 3.8Å; Q617-F795 HydrophobicContact CB-CZ 3.98Å; Q617-F795 HydrophobicContact CG-CD1 4.31Å; Q617-F795 HydrophobicContact CG-CD2 3.92Å; Q617-F795 HydrophobicContact CG-CE1 4.24Å; Q617-F795 HydrophobicContact CG-CE2 3.85Å; Q617-F795 HydrophobicContact CG-CG 4.15Å; Q617-F795 HydrophobicContact CG-CZ 4.02Å; Q617-F795 WeakPolarHBondContact CG-O 3.31Å; Q617-F795 PolarHBondContact NE2-O 2.75Å; F620-F795 HydrophobicContact CD1-CD2 4.15Å; F620-F795 HydrophobicContact CD1-CE2 4.01Å; V621-F795 HydrophobicContact CG2-CE2 4.09Å; V621-F795 HydrophobicContact CG2-CZ 4.18Å; F791-F795 HydrophobicContact CD1-CD1 4.31Å; F791-F795 HydrophobicContact CD1-CD2 4.11Å; F791-F795 HydrophobicContact CD1-CE1 4.34Å; F791-F795 HydrophobicContact CD1-CE2 4.14Å; F791-F795 HydrophobicContact CD1-CG 4.2Å; F791-F795 HydrophobicContact CD1-CZ 4.25Å; F791-F795 HydrophobicContact CE1-CE2 4.3Å; F791-F795 HydrophobicContact CE1-CZ 4.31Å; Q792-F795 WeakPolarHBondContact O-CB 3.34Å; Q792-F795 PolarHBondContact O-N 2.63Å; R793-F795 PolarHBondContact O-N 2.89Å
796	F	95.9	Very high	91.3	Very high	27 Å²	27	37 Å²	37	12%	0.118	18%	0.182	C	C	.	.	H	α-helix	trans	-106.2	-31.7	-174	-55.5	-84.9	0	0	0	114.3	R531 W561 L565 F791 R793 Y794	R531-F796 VanDerWaalsContact CD-CG 3.48Å; R531-F796 HydrophobicContact CG-CB 4.23Å; R531-F796 HydrophobicContact CG-CD1 3.75Å; R531-F796 HydrophobicContact CG-CD2 3.65Å; R531-F796 HydrophobicContact CG-CE1 3.95Å; R531-F796 HydrophobicContact CG-CE2 3.84Å; R531-F796 HydrophobicContact CG-CG 3.61Å; R531-F796 HydrophobicContact CG-CZ 3.99Å; W561-F796 AromaticContact CZ2-CD1 3.98Å; W561-F796 HydrophobicContact CZ2-CD1 3.98Å; L565-F796 HydrophobicContact CD1-CD1 4.49Å; L565-F796 HydrophobicContact CD1-CE1 4.11Å; L565-F796 HydrophobicContact CD2-CE1 3.8Å; F791-F796 HydrophobicContact CB-CE2 3.71Å; F791-F796 HydrophobicContact CB-CZ 3.79Å; R793-F796 PolarHBondContact O-N 2.86Å; Y794-F796 PolarHBondContact O-N 3.24Å
797	Q	91.3	Very high	91.1	Very high	63 Å²	63	35.1 Å²	35.1	29%	0.294	18%	0.18	S	C	.	.			trans	-147	126.1	-174.8	65.3	-173.6	6.8	0	0	111.7	R793 L799	R793-Q797 HydrophobicContact CG-CG 3.75Å; R793-Q797 PolarHBondContact O-N 3.18Å; Q797-L799 HydrophobicContact CG-CD2 4.47Å
798	K	87.7	Confident	91	Very high	92 Å²	92	35.3 Å²	35.3	40%	0.4	18%	0.18	S	C	.	.			trans	-91.7	114.4	175.8	-177.2	169.1	-173.3	-170.9	0	109.4	D694 Y794 Q800 S801	D694-K798 WeakPolarHBondContact OD2-CE 3.24Å; D694-K798 IonicContact OD2-NZ 3.81Å; D694-K798 PolarHBondContact OD2-NZ 3.2Å; Y794-K798 HydrophobicContact CE2-CB 4.42Å; Y794-K798 HydrophobicContact CE2-CD 4.45Å; Y794-K798 HydrophobicContact CE2-CG 4.05Å; K798-Q800 WeakPolarHBondContact CE-O 3.36Å; K798-Q800 WeakPolarHBondContact CG-O 2.99Å; K798-S801 VanDerWaalsContact CE-CA 3.49Å; K798-S801 WeakPolarHBondContact CE-OG 3.41Å; K798-S801 PolarHBondContact NZ-OG 3.39Å
799	L	88.7	Confident	90.9	Very high	67 Å²	67	35.9 Å²	35.9	35%	0.351	19%	0.185	S	C	.	.	S	Bend	trans	-94.6	-30.2	-179	-59.9	-176.4	0	0	0	113.7	R793 Q797 L843 F844	R793-L799 VanDerWaalsContact NE-CD1 3.34Å; R793-L799 VanDerWaalsContact NH2-CD1 3.34Å; Q797-L799 HydrophobicContact CG-CD2 4.47Å; L799-L843 HydrophobicContact CB-CD2 3.7Å; L799-L843 HydrophobicContact CD1-CD2 4.35Å; L799-F844 HydrophobicContact CB-CE2 4.01Å; L799-F844 HydrophobicContact CB-CZ 4.34Å; L799-F844 HydrophobicContact CD1-CE2 4.21Å; L799-F844 HydrophobicContact CD1-CZ 3.72Å
800	Q	89.7	Confident	90.6	Very high	4 Å²	4	38.3 Å²	38.3	2%	0.019	20%	0.201	C	C	.	.			trans	-111.9	136.1	173.5	-175.1	172.5	-29.4	0	0	106.5	D694 K798 T802 F844 R845	D694-Q800 HydrophobicContact CB-CB 4.41Å; D694-Q800 VanDerWaalsContact CB-O 3.26Å; D694-Q800 WeakPolarHBondContact CB-O 3.47Å; D694-Q800 VanDerWaalsContact CG-O 3.25Å; D694-Q800 WeakPolarHBondContact OD1-CG 3.49Å; K798-Q800 WeakPolarHBondContact CE-O 3.36Å; K798-Q800 WeakPolarHBondContact CG-O 2.99Å; Q800-T802 PolarHBondContact NE2-OG1 3.02Å; Q800-F844 HydrophobicContact CB-CD2 4.08Å; Q800-F844 HydrophobicContact CB-CE2 4.49Å; Q800-R845 PolarHBondContact NE2-O 3.11Å
801	S	88.8	Confident	89.7	Confident	53 Å²	53	42.2 Å²	42.2	37%	0.371	23%	0.228	S	C	.	.			trans	-131.2	116.4	172.5	-164.5	0	0	0	0	109.2	D694 K798 H837 G838	D694-S801 WeakPolarHBondContact OD2-CA 3.11Å; K798-S801 VanDerWaalsContact CE-CA 3.49Å; K798-S801 WeakPolarHBondContact CE-OG 3.41Å; K798-S801 PolarHBondContact NZ-OG 3.39Å; S801-H837 CarbonylContact O-C 3.56Å; S801-H837 WeakPolarHBondContact O-CA 3.34Å; S801-G838 PolarHBondContact O-N 3.37Å
802	T	89.8	Confident	88.8	Confident	11 Å²	11	44.1 Å²	44.1	7%	0.067	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	126.8	-178.7	-44.4	0	0	0	0	108.5	F693 D694 Q800 V835 Q836 I847	F693-T802 HydrophobicContact CD1-CG2 4.25Å; F693-T802 HydrophobicContact CE1-CG2 3.97Å; D694-T802 WeakPolarHBondContact OD1-CB 3.3Å; D694-T802 PolarHBondContact OD1-N 3.48Å; D694-T802 PolarHBondContact OD1-OG1 3.32Å; D694-T802 PolarHBondContact OD2-N 3.14Å; Q800-T802 PolarHBondContact NE2-OG1 3.02Å; T802-V835 HydrophobicContact CG2-CG1 4.2Å; T802-Q836 WeakPolarHBondContact CA-O 3.45Å; T802-I847 HydrophobicContact CG2-CD1 3.54Å
803	S	89.1	Confident	87.5	Confident	53 Å²	53	54.6 Å²	54.6	37%	0.371	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	151.9	173.1	59	0	0	0	0	110	Q836	S803-Q836 PolarHBondContact N-O 2.91Å; S803-Q836 PolarHBondContact O-N 2.72Å
804	I	89.2	Confident	86.6	Confident	15 Å²	15	54.4 Å²	54.4	8%	0.077	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	131.8	170.8	-69.5	174	0	0	0	107	L806 V834 V835 V850 F888 V910 P922	I804-L806 HydrophobicContact CG2-CD2 3.77Å; I804-L806 HydrophobicContact CG2-CG 4.07Å; I804-V834 WeakPolarHBondContact CA-O 3.34Å; I804-V835 HydrophobicContact CG1-CG2 4.34Å; I804-V850 HydrophobicContact CD1-CG1 4.07Å; I804-V850 HydrophobicContact CD1-CG2 4.14Å; I804-F888 HydrophobicContact CG2-CE1 4.14Å; I804-F888 HydrophobicContact CG2-CZ 3.87Å; I804-V910 HydrophobicContact CD1-CG1 3.34Å; I804-V910 HydrophobicContact CG1-CG1 4.37Å; I804-P922 HydrophobicContact CB-CG 4.47Å; I804-P922 HydrophobicContact CG2-CG 4.35Å; I804-P922 WeakPolarHBondContact O-CD 3.39Å; I804-P922 VanDerWaalsContact O-CG 3.24Å; I804-P922 WeakPolarHBondContact O-CG 3.33Å
805	K	87.2	Confident	85.4	Confident	93 Å²	93	58.5 Å²	58.5	40%	0.404	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	118.9	168.3	-168.3	172.2	-170.3	176.2	0	108.4	F57 G833 V834	F57-K805 HydrophobicContact CE1-CD 4.22Å; F57-K805 HydrophobicContact CZ-CD 3.89Å; K805-G833 CarbonylContact O-C 3.59Å; K805-G833 VanDerWaalsContact O-CA 3.23Å; K805-G833 WeakPolarHBondContact O-CA 3.26Å; K805-V834 PolarHBondContact N-O 2.92Å; K805-V834 PolarHBondContact O-N 2.91Å
806	L	88.3	Confident	84.5	Confident	22 Å²	22	62.3 Å²	62.3	12%	0.115	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	145.5	175.5	-64.7	179.9	0	0	0	110.9	I804 V831 E832 L852 F888 V906 P922	I804-L806 HydrophobicContact CG2-CD2 3.77Å; I804-L806 HydrophobicContact CG2-CG 4.07Å; L806-V831 HydrophobicContact CD2-CG1 4.25Å; L806-E832 CarbonylContact C-O 3.59Å; L806-E832 WeakPolarHBondContact CA-O 3.49Å; L806-L852 HydrophobicContact CD2-CD2 4.18Å; L806-F888 HydrophobicContact CD2-CE2 3.93Å; L806-F888 HydrophobicContact CD2-CZ 3.73Å; L806-V906 HydrophobicContact CD1-CG1 4.17Å; L806-P922 HydrophobicContact CB-CG 4.46Å; L806-P922 HydrophobicContact CD1-CG 3.91Å; L806-P922 HydrophobicContact CG-CG 3.79Å
807	A	85.2	Confident	84	Confident	31 Å²	31	66 Å²	66	26%	0.256	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	126.9	168.1	0	0	0	0	0	108.4	F57 E832	F57-A807 HydrophobicContact CE1-CB 4.46Å; A807-E832 PolarHBondContact N-O 3.27Å; A807-E832 PolarHBondContact O-N 3.02Å
808	L	87.8	Confident	83.7	Confident	15 Å²	15	65.1 Å²	65.1	8%	0.079	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	131.6	-177.5	-57.7	-179.7	0	0	0	109.5	S811 L829 V831 V906 T924 I926	L808-S811 PolarHBondContact O-OG 2.92Å; L808-L829 HydrophobicContact CB-CD1 4.29Å; L808-V831 HydrophobicContact CD2-CB 4.17Å; L808-V831 HydrophobicContact CD2-CG1 3.88Å; L808-V831 HydrophobicContact CD2-CG2 3.77Å; L808-V906 HydrophobicContact CD1-CB 4.46Å; L808-V906 HydrophobicContact CD1-CG2 4.02Å; L808-V906 HydrophobicContact CD2-CB 4.22Å; L808-V906 HydrophobicContact CD2-CG1 4.32Å; L808-V906 HydrophobicContact CD2-CG2 3.85Å; L808-T924 HydrophobicContact CD1-CG2 3.6Å; L808-T924 HydrophobicContact CG-CG2 4.35Å; L808-I926 HydrophobicContact CD1-CG2 3.68Å
809	S	85	Confident	83.8	Confident	36 Å²	36	62.2 Å²	62.2	25%	0.252	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	132.6	176	51.7	0	0	0	0	110.5	K830	S809-K830 PolarHBondContact N-O 3.41Å; S809-K830 PolarHBondContact O-N 2.94Å; S809-K830 WeakPolarHBondContact OG-CB 3.49Å; S809-K830 PolarHBondContact OG-O 2.94Å
810	P	84	Confident	83.8	Confident	53 Å²	53	62.5 Å²	62.5	34%	0.344	37%	0.366	S	S	.	.	S	Bend	cis	-67.4	142.5	4.5	27.3	-34.2	0	0	0	113.9	I819 L827 A828	P810-I819 HydrophobicContact CB-CD1 4.26Å; P810-I819 HydrophobicContact CG-CD1 3.91Å; P810-I819 WeakPolarHBondContact O-CD1 3.48Å; P810-L827 HydrophobicContact CG-CD1 3.95Å; P810-A828 WeakPolarHBondContact CD-O 3.35Å
811	S	76.2	Confident	83.8	Confident	91 Å²	91	62.8 Å²	62.8	64%	0.636	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-98	133.4	175.2	-44.5	0	0	0	0	109.4	L808	L808-S811 PolarHBondContact O-OG 2.92Å
812	P	75.9	Confident	83.7	Confident	42 Å²	42	63 Å²	63	27%	0.273	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-70	151.5	178.4	32.1	-36.4	0	0	0	110.6	N814 E817 I819	P812-N814 VanDerWaalsContact C-N 3.25Å; P812-N814 WeakPolarHBondContact CB-O 3.38Å; P812-N814 PolarHBondContact O-N 3.13Å; P812-E817 WeakPolarHBondContact CB-O 3.42Å; P812-I819 HydrophobicContact CB-CG1 4.27Å
813	R	68.9	Low	83.4	Confident	241 Å²	241	64.6 Å²	64.6	91%	0.909	37%	0.371	S	S	*	.	S	Bend	trans	-62.9	-35.8	178.3	-125.7	179	-179	158.5	-0.2	111.7
814	N	76.6	Confident	83.1	Confident	102 Å²	102	66.7 Å²	66.7	55%	0.545	38%	0.378	S	S	.	.	S	Bend	trans	-124.9	135.6	169.7	-77.9	-27.9	0	0	0	109.4	P812 A816 E817	P812-N814 VanDerWaalsContact C-N 3.25Å; P812-N814 WeakPolarHBondContact CB-O 3.38Å; P812-N814 PolarHBondContact O-N 3.13Å; N814-A816 PolarHBondContact O-N 3.11Å; N814-E817 HydrophobicContact CB-CB 4.14Å; N814-E817 PolarHBondContact O-N 3.12Å
815	P	71.3	Confident	82.8	Confident	114 Å²	114	70.8 Å²	70.8	74%	0.74	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-26.7	-176.9	-26.8	34.4	0	0	0	115.5
816	A	77.6	Confident	82.8	Confident	84 Å²	84	71.7 Å²	71.7	69%	0.694	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-8.7	179.5	0	0	0	0	0	113.8	N814	N814-A816 PolarHBondContact O-N 3.11Å
817	E	84.9	Confident	82.9	Confident	104 Å²	104	71.3 Å²	71.3	49%	0.486	40%	0.401	S	S	.	.	S	Bend	trans	-88.7	127.6	-178	-171.1	178.5	-177.5	0	0	110.6	P812 N814	P812-E817 WeakPolarHBondContact CB-O 3.42Å; N814-E817 HydrophobicContact CB-CB 4.14Å; N814-E817 PolarHBondContact O-N 3.12Å
818	P	86.8	Confident	83.3	Confident	45 Å²	45	72.3 Å²	72.3	29%	0.292	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-74.9	142.4	179	29.8	-33.5	0	0	0	111.8	A820 F927 K929	P818-A820 PolarHBondContact O-N 3.33Å; P818-F927 CarbonylContact C-O 3.52Å; P818-F927 VanDerWaalsContact CA-O 3.31Å; P818-F927 WeakPolarHBondContact CA-O 3.37Å; P818-F927 HydrophobicContact CB-CB 3.92Å; P818-K929 HydrophobicContact CB-CB 3.87Å; P818-K929 HydrophobicContact CG-CB 4.04Å
819	I	89.3	Confident	83.5	Confident	31 Å²	31	71.6 Å²	71.6	16%	0.159	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	124.1	173.4	-53.8	178.6	0	0	0	108.5	P810 P812 V821 F927 V928 K929	P810-I819 HydrophobicContact CB-CD1 4.26Å; P810-I819 HydrophobicContact CG-CD1 3.91Å; P810-I819 WeakPolarHBondContact O-CD1 3.48Å; P812-I819 HydrophobicContact CB-CG1 4.27Å; I819-V821 HydrophobicContact CG2-CG2 4.41Å; I819-F927 PolarHBondContact N-O 2.88Å; I819-V928 HydrophobicContact CB-CG2 4.28Å; I819-V928 CarbonylContact O-C 3.54Å; I819-V928 WeakPolarHBondContact O-CA 3.45Å; I819-K929 PolarHBondContact O-N 3.45Å
820	A	88.9	Confident	83.8	Confident	72 Å²	72	72.6 Å²	72.6	60%	0.595	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77	125.8	178.3	0	0	0	0	0	110.8	P818 L931	P818-A820 PolarHBondContact O-N 3.33Å; A820-L931 HydrophobicContact CB-CD1 3.94Å
821	V	89.1	Confident	84.1	Confident	10 Å²	10	70.1 Å²	70.1	6%	0.061	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	137.6	176.5	-178.4	0	0	0	0	108.1	I819 Q825 L827 F896 V928 K929 S930 L931	I819-V821 HydrophobicContact CG2-CG2 4.41Å; V821-Q825 HydrophobicContact CG1-CB 4.32Å; V821-L827 HydrophobicContact CG2-CB 4.36Å; V821-L827 HydrophobicContact CG2-CD1 4.07Å; V821-L827 HydrophobicContact CG2-CD2 4.44Å; V821-F896 HydrophobicContact CG1-CD2 4.34Å; V821-V928 HydrophobicContact CB-CG1 4.14Å; V821-V928 HydrophobicContact CG2-CG1 3.75Å; V821-K929 PolarHBondContact N-O 2.91Å; V821-S930 WeakPolarHBondContact O-CA 3.15Å; V821-L931 PolarHBondContact O-N 3.13Å
822	Q	86.9	Confident	84.7	Confident	58 Å²	58	66.4 Å²	66.4	27%	0.271	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	141.4	173.8	-63.3	179.2	-15.8	0	0	109.6	N824 Q825	Q822-N824 VanDerWaalsContact CB-OD1 3.23Å; Q822-N824 WeakPolarHBondContact CB-OD1 3.36Å; Q822-N824 PolarHBondContact O-N 3.5Å; Q822-N824 VanDerWaalsContact O-N 3.08Å; Q822-Q825 HydrophobicContact CB-CB 4.35Å; Q822-Q825 HydrophobicContact CB-CG 4.01Å; Q822-Q825 PolarHBondContact O-N 3.42Å
823	N	83.4	Confident	85.3	Confident	44 Å²	44	64.5 Å²	64.5	24%	0.235	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-16.6	-174.9	68.1	-23.9	0	0	0	115	F896 L899 S930 L931 D933	N823-F896 WeakPolarHBondContact CA-O 3.4Å; N823-L899 HydrophobicContact CB-CD2 3.75Å; N823-S930 WeakPolarHBondContact CB-OG 3.47Å; N823-L931 WeakPolarHBondContact CB-O 3.29Å; N823-L931 PolarHBondContact N-O 3.43Å; N823-D933 WeakPolarHBondContact OD1-CB 3.35Å; N823-D933 PolarHBondContact OD1-N 2.99Å; N823-D933 VanDerWaalsContact OD1-N 3.1Å
824	N	81.9	Confident	86.1	Confident	97 Å²	97	53.5 Å²	53.5	52%	0.519	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-1.3	173.6	62.1	-7.4	0	0	0	113.8	Q822 D933	Q822-N824 VanDerWaalsContact CB-OD1 3.23Å; Q822-N824 WeakPolarHBondContact CB-OD1 3.36Å; Q822-N824 PolarHBondContact O-N 3.5Å; Q822-N824 VanDerWaalsContact O-N 3.08Å; N824-D933 PolarHBondContact ND2-OD1 2.9Å
825	Q	83.9	Confident	86.7	Confident	101 Å²	101	48.9 Å²	48.9	47%	0.472	29%	0.285	S	S	.	.	S	Bend	trans	-106.5	153.1	179.3	-67	-180	-4.7	0	0	111.4	V821 Q822	V821-Q825 HydrophobicContact CG1-CB 4.32Å; Q822-Q825 HydrophobicContact CB-CB 4.35Å; Q822-Q825 HydrophobicContact CB-CG 4.01Å; Q822-Q825 PolarHBondContact O-N 3.42Å
826	Q	87.3	Confident	87.3	Confident	113 Å²	113	46.8 Å²	46.8	53%	0.528	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	145.4	171.2	-50.8	-168.5	-51.7	0	0	110	L894 N895	Q826-L894 WeakPolarHBondContact CA-O 3.47Å; Q826-N895 WeakPolarHBondContact CG-OD1 3.48Å; Q826-N895 PolarHBondContact NE2-OD1 3.21Å
827	L	90.4	Very high	87.6	Confident	14 Å²	14	45.7 Å²	45.7	7%	0.073	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	120.2	169.5	-178.7	63.7	0	0	0	109.8	P810 V821 L829 L893 L894 F896 I904 V928	P810-L827 HydrophobicContact CG-CD1 3.95Å; V821-L827 HydrophobicContact CG2-CB 4.36Å; V821-L827 HydrophobicContact CG2-CD1 4.07Å; V821-L827 HydrophobicContact CG2-CD2 4.44Å; L827-L829 PolarHBondContact O-N 2.87Å; L827-L893 WeakPolarHBondContact O-CA 3.33Å; L827-L894 PolarHBondContact N-O 3.36Å; L827-L894 PolarHBondContact O-N 3.18Å; L827-F896 HydrophobicContact CB-CD2 4.29Å; L827-F896 HydrophobicContact CB-CE2 3.71Å; L827-F896 HydrophobicContact CD2-CE2 3.93Å; L827-F896 HydrophobicContact CD2-CZ 4.47Å; L827-F896 HydrophobicContact CG-CE2 4.5Å; L827-I904 HydrophobicContact CD2-CD1 3.93Å; L827-V928 HydrophobicContact CD2-CG2 3.71Å
828	A	92.6	Very high	87.3	Confident	51 Å²	51	42.5 Å²	42.5	42%	0.421	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	108.1	166.7	0	0	0	0	0	109.9	P810 L893	P810-A828 WeakPolarHBondContact CD-O 3.35Å; A828-L893 HydrophobicContact CB-CD2 3.84Å
829	L	92.4	Very high	86.3	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	105.2	173.4	-178.5	66.3	0	0	0	109.2	L808 L827 V831 V854 Q891 F892 L894 I904 V906 I926	L808-L829 HydrophobicContact CB-CD1 4.29Å; L827-L829 PolarHBondContact O-N 2.87Å; L829-V831 HydrophobicContact CD2-CG2 4.21Å; L829-V831 HydrophobicContact CG-CG2 4.06Å; L829-V854 HydrophobicContact CD2-CG1 4.13Å; L829-Q891 WeakPolarHBondContact O-CA 3.49Å; L829-F892 HydrophobicContact CB-CB 4.43Å; L829-F892 PolarHBondContact N-O 3.37Å; L829-F892 PolarHBondContact O-N 3.48Å; L829-L894 HydrophobicContact CB-CD1 4.23Å; L829-L894 HydrophobicContact CD2-CD1 4.08Å; L829-I904 HydrophobicContact CD2-CG2 4.05Å; L829-V906 HydrophobicContact CD2-CG2 3.81Å; L829-I926 HydrophobicContact CD1-CD1 3.64Å
830	K	91.3	Very high	85.7	Confident	58 Å²	58	50.7 Å²	50.7	25%	0.252	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	121.1	170.5	-179.8	-171	-166.9	-157.8	0	109.2	S809 E832 T890 Q891	S809-K830 PolarHBondContact N-O 3.41Å; S809-K830 PolarHBondContact O-N 2.94Å; S809-K830 WeakPolarHBondContact OG-CB 3.49Å; S809-K830 PolarHBondContact OG-O 2.94Å; K830-E832 HydrophobicContact CD-CG 4.26Å; K830-E832 VanDerWaalsContact CE-OE1 3.29Å; K830-E832 WeakPolarHBondContact CE-OE1 3.49Å; K830-E832 HydrophobicContact CG-CG 4.16Å; K830-E832 IonicContact NZ-OE1 3.35Å; K830-E832 PolarHBondContact NZ-OE1 3.4Å; K830-T890 CarbonylContact C-O 3.59Å; K830-T890 WeakPolarHBondContact CA-O 2.99Å; K830-Q891 HydrophobicContact CB-CG 4.07Å; K830-Q891 HydrophobicContact CG-CG 4.08Å
831	V	91.4	Very high	85.2	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	118.7	179.1	-176.8	0	0	0	0	108.2	L806 L808 L829 L852 S889 T890 F892 V906	L806-V831 HydrophobicContact CD2-CG1 4.25Å; L808-V831 HydrophobicContact CD2-CB 4.17Å; L808-V831 HydrophobicContact CD2-CG1 3.88Å; L808-V831 HydrophobicContact CD2-CG2 3.77Å; L829-V831 HydrophobicContact CD2-CG2 4.21Å; L829-V831 HydrophobicContact CG-CG2 4.06Å; V831-L852 HydrophobicContact CB-CD1 4.38Å; V831-L852 HydrophobicContact CG1-CD1 3.94Å; V831-L852 HydrophobicContact CG1-CD2 4.22Å; V831-S889 CarbonylContact O-C 3.6Å; V831-S889 WeakPolarHBondContact O-CA 3.43Å; V831-T890 HydrophobicContact CB-CG2 4.23Å; V831-T890 PolarHBondContact N-O 3.42Å; V831-T890 PolarHBondContact O-N 3.03Å; V831-F892 HydrophobicContact CB-CE2 4.37Å; V831-F892 HydrophobicContact CG2-CD2 3.72Å; V831-F892 HydrophobicContact CG2-CE2 3.85Å; V831-V906 HydrophobicContact CG1-CG1 4.03Å; V831-V906 HydrophobicContact CG2-CG1 4.24Å; V831-V906 HydrophobicContact CG2-CG2 4.44Å
832	E	87.7	Confident	84.7	Confident	14 Å²	14	52.4 Å²	52.4	7%	0.065	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	145.4	176.1	-59.2	-174.5	120.1	0	0	109.1	L806 A807 K830 Y887 F888	L806-E832 CarbonylContact C-O 3.59Å; L806-E832 WeakPolarHBondContact CA-O 3.49Å; A807-E832 PolarHBondContact N-O 3.27Å; A807-E832 PolarHBondContact O-N 3.02Å; K830-E832 HydrophobicContact CD-CG 4.26Å; K830-E832 VanDerWaalsContact CE-OE1 3.29Å; K830-E832 WeakPolarHBondContact CE-OE1 3.49Å; K830-E832 HydrophobicContact CG-CG 4.16Å; K830-E832 IonicContact NZ-OE1 3.35Å; K830-E832 PolarHBondContact NZ-OE1 3.4Å; E832-Y887 HydrophobicContact CB-CE2 4.1Å; E832-Y887 PolarHBondContact OE1-OH 3.27Å; E832-F888 WeakPolarHBondContact CA-O 3.4Å
833	G	88.4	Confident	84.8	Confident	2 Å²	2	53 Å²	53	2%	0.021	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	150.2	177.4	0	0	0	0	0	113.7	K805 Y887 F888	K805-G833 CarbonylContact O-C 3.59Å; K805-G833 VanDerWaalsContact O-CA 3.23Å; K805-G833 WeakPolarHBondContact O-CA 3.26Å; G833-Y887 WeakPolarHBondContact O-CA 3.43Å; G833-Y887 VanDerWaalsContact O-CD2 3.26Å; G833-Y887 WeakPolarHBondContact O-CD2 3.46Å; G833-F888 VanDerWaalsContact CA-CZ 3.45Å; G833-F888 PolarHBondContact N-O 3.24Å; G833-F888 WeakPolarHBondContact O-CD1 3.42Å; G833-F888 PolarHBondContact O-N 3.29Å
834	V	87.1	Confident	85.1	Confident	9 Å²	9	54.5 Å²	54.5	6%	0.055	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	127.1	174.2	-178.4	0	0	0	0	108.9	P56 I804 K805 Q836 D886 Y887	P56-V834 HydrophobicContact CB-CG1 4.01Å; P56-V834 HydrophobicContact CB-CG2 4.41Å; P56-V834 HydrophobicContact CG-CB 4.27Å; P56-V834 HydrophobicContact CG-CG1 3.72Å; P56-V834 HydrophobicContact CG-CG2 4.24Å; P56-V834 WeakPolarHBondContact O-CG2 3.07Å; I804-V834 WeakPolarHBondContact CA-O 3.34Å; K805-V834 PolarHBondContact N-O 2.92Å; K805-V834 PolarHBondContact O-N 2.91Å; V834-Q836 HydrophobicContact CG1-CG 4.45Å; V834-D886 CarbonylContact C-O 3.55Å; V834-D886 VanDerWaalsContact CA-O 3.27Å; V834-D886 WeakPolarHBondContact CA-O 3.44Å; V834-D886 WeakPolarHBondContact CG1-O 3.36Å; V834-Y887 HydrophobicContact CG2-CD2 4.06Å
835	V	88.6	Confident	85.5	Confident	6 Å²	6	51.5 Å²	51.5	4%	0.036	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	126.8	169.7	-175.7	0	0	0	0	108.1	T802 I804 H837 I847 D886 F888	T802-V835 HydrophobicContact CG2-CG1 4.2Å; I804-V835 HydrophobicContact CG1-CG2 4.34Å; V835-H837 WeakPolarHBondContact CG1-CE1 3.43Å; V835-H837 WeakPolarHBondContact CG1-NE2 3.42Å; V835-I847 HydrophobicContact CG1-CD1 3.53Å; V835-I847 HydrophobicContact CG2-CD1 4.3Å; V835-D886 PolarHBondContact N-O 3.43Å; V835-F888 HydrophobicContact CG2-CE1 4.31Å
836	Q	84.2	Confident	85.8	Confident	70 Å²	70	54.1 Å²	54.1	33%	0.327	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	130.7	174.9	-65.1	-179.5	-36.6	0	0	108.6	T802 S803 V834	T802-Q836 WeakPolarHBondContact CA-O 3.45Å; S803-Q836 PolarHBondContact N-O 2.91Å; S803-Q836 PolarHBondContact O-N 2.72Å; V834-Q836 HydrophobicContact CG1-CG 4.45Å
837	H	82.9	Confident	86	Confident	60 Å²	60	49.5 Å²	49.5	28%	0.278	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	144.1	175.7	-59.5	-64.9	0	0	0	109	S801 V835 P841 D886	S801-H837 CarbonylContact O-C 3.56Å; S801-H837 WeakPolarHBondContact O-CA 3.34Å; V835-H837 WeakPolarHBondContact CG1-CE1 3.43Å; V835-H837 WeakPolarHBondContact CG1-NE2 3.42Å; H837-P841 HydrophobicContact CB-CB 4.04Å; H837-D886 IonicContact CD2-OD1 2.78Å; H837-D886 IonicContact NE2-OD1 3.43Å
838	G	78.3	Confident	86.1	Confident	37 Å²	37	53 Å²	53	38%	0.381	29%	0.293	S	S	.	.			trans	-67.1	-148.9	164.2	0	0	0	0	0	111.5	S801 K840	S801-G838 PolarHBondContact O-N 3.37Å; G838-K840 VanDerWaalsContact C-N 3.3Å; G838-K840 PolarHBondContact O-N 3.35Å; G838-K840 VanDerWaalsContact O-N 3.15Å
839	S	67.1	Low	86.2	Confident	113 Å²	113	51 Å²	51	79%	0.79	28%	0.275	S	S	*	.	S	Bend	trans	-62.8	-29.9	-168.2	-35.2	0	0	0	0	115.1
840	K	75.4	Confident	86.4	Confident	135 Å²	135	51 Å²	51	59%	0.587	28%	0.275	S	S	*	.			trans	-141.7	107.8	-178.3	-171.1	167.7	179.7	176.3	0	112.3	G838 L843	G838-K840 VanDerWaalsContact C-N 3.3Å; G838-K840 PolarHBondContact O-N 3.35Å; G838-K840 VanDerWaalsContact O-N 3.15Å; K840-L843 HydrophobicContact CD-CD1 4.36Å
841	P	79.1	Confident	86.5	Confident	78 Å²	78	48.3 Å²	48.3	51%	0.506	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	149.1	172.1	27.3	-32.6	0	0	0	110.9	H837 L843	H837-P841 HydrophobicContact CB-CB 4.04Å; P841-L843 VanDerWaalsContact C-N 3.33Å; P841-L843 PolarHBondContact O-N 3.49Å
842	G	79.3	Confident	86.7	Confident	41 Å²	41	48.3 Å²	48.3	42%	0.423	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.5	26.5	173	0	0	0	0	0	115.1	R845	G842-R845 WeakPolarHBondContact CA-O 3.39Å
843	L	88.4	Confident	87	Confident	69 Å²	69	49.9 Å²	49.9	36%	0.361	27%	0.272	S	S	.	.	S	Bend	trans	-64.3	-48.5	178.5	179.2	64.4	0	0	0	111.8	L799 K840 P841	L799-L843 HydrophobicContact CB-CD2 3.7Å; L799-L843 HydrophobicContact CD1-CD2 4.35Å; K840-L843 HydrophobicContact CD-CD1 4.36Å; P841-L843 VanDerWaalsContact C-N 3.33Å; P841-L843 PolarHBondContact O-N 3.49Å
844	F	89.7	Confident	87.2	Confident	77 Å²	77	49.8 Å²	49.8	34%	0.338	27%	0.271	S	S	.	.	S	Bend	trans	-110.2	-46.6	175.4	-59.2	-59.6	0	0	0	111.6	D696 L799 Q800	D696-F844 HydrophobicContact CB-CE1 4.04Å; D696-F844 HydrophobicContact CB-CE2 4.09Å; D696-F844 HydrophobicContact CB-CZ 3.74Å; L799-F844 HydrophobicContact CB-CE2 4.01Å; L799-F844 HydrophobicContact CB-CZ 4.34Å; L799-F844 HydrophobicContact CD1-CE2 4.21Å; L799-F844 HydrophobicContact CD1-CZ 3.72Å; Q800-F844 HydrophobicContact CB-CD2 4.08Å; Q800-F844 HydrophobicContact CB-CE2 4.49Å
845	R	90.9	Very high	87.5	Confident	34 Å²	34	50.3 Å²	50.3	13%	0.128	28%	0.276	C	S	.	.			trans	-137.8	146.7	-177.8	-76.4	168.6	-66.7	-76.9	-17.7	110.9	F693 A695 L700 Q800 G842	F693-R845 HydrophobicContact CE2-CB 3.89Å; F693-R845 HydrophobicContact CZ-CB 3.86Å; F693-R845 VanDerWaalsContact O-CZ 3.23Å; F693-R845 PolarHBondContact O-NE 3.47Å; F693-R845 PolarHBondContact O-NH2 3.44Å; A695-R845 VanDerWaalsContact O-CZ 3.3Å; A695-R845 PolarHBondContact O-NH1 3.07Å; A695-R845 PolarHBondContact O-NH2 2.88Å; L700-R845 VanDerWaalsContact CD1-NH1 3.28Å; Q800-R845 PolarHBondContact NE2-O 3.11Å; G842-R845 WeakPolarHBondContact CA-O 3.39Å
846	K	90.2	Very high	87.5	Confident	155 Å²	155	50.2 Å²	50.2	67%	0.674	28%	0.275	S	S	*	.			trans	-110.4	139.4	175.1	-174.5	-175.9	173.9	-171.9	0	109.2	D912	K846-D912 WeakPolarHBondContact O-CA 3.49Å
847	I	91.5	Very high	87.7	Confident	17 Å²	17	50.2 Å²	50.2	9%	0.087	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	127.1	172.1	-64.6	170.6	0	0	0	108.5	F693 T802 V835 V850 P883 V910	F693-I847 HydrophobicContact CE1-CG1 4.19Å; F693-I847 HydrophobicContact CZ-CG1 3.78Å; T802-I847 HydrophobicContact CG2-CD1 3.54Å; V835-I847 HydrophobicContact CG1-CD1 3.53Å; V835-I847 HydrophobicContact CG2-CD1 4.3Å; I847-V850 HydrophobicContact CG2-CG2 4.35Å; I847-P883 HydrophobicContact CG2-CG 4.24Å; I847-V910 HydrophobicContact CD1-CB 4.33Å; I847-V910 HydrophobicContact CD1-CG1 3.79Å; I847-V910 HydrophobicContact CG1-CB 4.11Å; I847-V910 HydrophobicContact CG1-CG1 4.11Å; I847-V910 HydrophobicContact CG1-CG2 4.5Å; I847-V910 HydrophobicContact CG2-CB 4.38Å; I847-V910 HydrophobicContact CG2-CG1 4.39Å
848	Q	92.8	Very high	87.8	Confident	88 Å²	88	50.2 Å²	50.2	41%	0.411	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	-43.7	172.4	-175.3	-174.9	30.4	0	0	111	E882 K911 D912	Q848-E882 WeakPolarHBondContact O-CG 3.34Å; Q848-K911 PolarHBondContact N-O 3.3Å; Q848-D912 PolarHBondContact OE1-O 2.91Å
849	S	94.4	Very high	87.8	Confident	8 Å²	8	53.9 Å²	53.9	6%	0.056	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	163.1	176.4	57.2	0	0	0	0	111.5	R880 V881 K911	S849-R880 PolarHBondContact OG-NH1 3.2Å; S849-V881 CarbonylContact C-O 3.24Å; S849-V881 WeakPolarHBondContact CA-O 3.44Å; S849-V881 WeakPolarHBondContact CB-O 3.39Å; S849-K911 PolarHBondContact N-O 2.98Å; S849-K911 PolarHBondContact O-N 3.07Å; S849-K911 WeakPolarHBondContact OG-CB 3.3Å
850	V	95	Very high	87.7	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	123.9	172.1	-175.8	0	0	0	0	107.8	I804 I847 L852 V881 F888 S909	I804-V850 HydrophobicContact CD1-CG1 4.07Å; I804-V850 HydrophobicContact CD1-CG2 4.14Å; I847-V850 HydrophobicContact CG2-CG2 4.35Å; V850-L852 HydrophobicContact CG1-CD2 4.05Å; V850-L852 HydrophobicContact CG1-CG 4.25Å; V850-V881 HydrophobicContact CB-CG1 4.14Å; V850-V881 PolarHBondContact N-O 3.04Å; V850-V881 PolarHBondContact O-N 3.45Å; V850-F888 HydrophobicContact CB-CD1 4.46Å; V850-F888 HydrophobicContact CB-CE1 4.25Å; V850-F888 HydrophobicContact CB-CZ 4.27Å; V850-F888 HydrophobicContact CG1-CE1 4.18Å; V850-F888 HydrophobicContact CG1-CE2 4.18Å; V850-F888 HydrophobicContact CG1-CZ 3.79Å; V850-F888 HydrophobicContact CG2-CD1 3.95Å; V850-F888 HydrophobicContact CG2-CE1 3.75Å; V850-F888 HydrophobicContact CG2-CZ 4.23Å; V850-S909 CarbonylContact C-O 3.51Å; V850-S909 WeakPolarHBondContact CA-O 3.39Å
851	C	94.9	Very high	87	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.014	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	125.4	167.1	-63.1	0	0	0	0	108.4	Q879 R880 S908 S909	C851-Q879 WeakPolarHBondContact CA-O 3.17Å; C851-R880 PolarHBondContact SG-NH1 3.34Å; C851-R880 PolarHBondContact SG-NH2 3.11Å; C851-R880 VanDerWaalsContact SG-NH2 3.37Å; C851-S908 CarbonylContact O-C 3.55Å; C851-S908 WeakPolarHBondContact O-CA 3.45Å; C851-S909 PolarHBondContact N-O 3.42Å; C851-S909 PolarHBondContact O-N 2.77Å
852	L	94.9	Very high	85.4	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	121.6	175	-65.2	169.8	0	0	0	108.4	L806 V831 V850 E878 Q879 V881 F888 T890 F892 E907	L806-L852 HydrophobicContact CD2-CD2 4.18Å; V831-L852 HydrophobicContact CB-CD1 4.38Å; V831-L852 HydrophobicContact CG1-CD1 3.94Å; V831-L852 HydrophobicContact CG1-CD2 4.22Å; V850-L852 HydrophobicContact CG1-CD2 4.05Å; V850-L852 HydrophobicContact CG1-CG 4.25Å; L852-E878 WeakPolarHBondContact O-CA 3.4Å; L852-Q879 PolarHBondContact N-O 3.36Å; L852-Q879 PolarHBondContact O-N 3.45Å; L852-V881 HydrophobicContact CD1-CG1 4.19Å; L852-F888 HydrophobicContact CD1-CD2 4.06Å; L852-F888 HydrophobicContact CD1-CE2 3.79Å; L852-F888 HydrophobicContact CD2-CE2 3.95Å; L852-F888 HydrophobicContact CD2-CZ 4.46Å; L852-F888 HydrophobicContact CG-CE2 4.27Å; L852-T890 HydrophobicContact CD1-CG2 3.43Å; L852-T890 VanDerWaalsContact CD1-CG2 3.43Å; L852-F892 HydrophobicContact CB-CE2 4.17Å; L852-F892 HydrophobicContact CB-CZ 3.9Å; L852-E907 WeakPolarHBondContact CA-O 3.34Å
853	N	93.4	Very high	84	Confident	46 Å²	46	56.2 Å²	56.2	25%	0.246	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	127	176.6	-63.3	-35.5	0	0	0	108.6	M877 E878 V906 E907	N853-M877 WeakPolarHBondContact CA-O 3.31Å; N853-E878 WeakPolarHBondContact OD1-CB 3.5Å; N853-E878 VanDerWaalsContact OD1-CG 3.25Å; N853-E878 WeakPolarHBondContact OD1-CG 3.26Å; N853-V906 CarbonylContact O-C 3.55Å; N853-V906 WeakPolarHBondContact O-CA 3.4Å; N853-E907 HydrophobicContact CB-CB 4.41Å; N853-E907 PolarHBondContact N-O 3.3Å; N853-E907 PolarHBondContact O-N 3.41Å
854	V	94.1	Very high	81.7	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	120.4	176	-176.8	0	0	0	0	109	L829 E876 M877 F892 L894 I904 T905 V906	L829-V854 HydrophobicContact CD2-CG1 4.13Å; V854-E876 WeakPolarHBondContact O-CA 3.46Å; V854-M877 PolarHBondContact N-O 2.91Å; V854-M877 PolarHBondContact O-N 3.49Å; V854-F892 HydrophobicContact CB-CD1 4.22Å; V854-F892 HydrophobicContact CB-CE1 4.38Å; V854-F892 HydrophobicContact CB-CG 4.31Å; V854-F892 HydrophobicContact CG2-CB 4.44Å; V854-F892 HydrophobicContact CG2-CD1 3.84Å; V854-F892 HydrophobicContact CG2-CD2 3.49Å; V854-F892 VanDerWaalsContact CG2-CD2 3.49Å; V854-F892 HydrophobicContact CG2-CE1 3.82Å; V854-F892 HydrophobicContact CG2-CE2 3.47Å; V854-F892 VanDerWaalsContact CG2-CE2 3.47Å; V854-F892 HydrophobicContact CG2-CG 3.66Å; V854-F892 HydrophobicContact CG2-CZ 3.64Å; V854-L894 HydrophobicContact CG1-CD1 4.07Å; V854-L894 HydrophobicContact CG1-CD2 3.89Å; V854-I904 HydrophobicContact CG1-CG2 3.69Å; V854-T905 WeakPolarHBondContact CA-O 3.46Å; V854-V906 HydrophobicContact CG1-CG2 4.41Å; V854-V906 HydrophobicContact CG2-CG1 4.22Å; V854-V906 HydrophobicContact CG2-CG2 4Å
855	S	91.9	Very high	79.3	Confident	21 Å²	21	65 Å²	65	15%	0.147	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	146.6	177.2	54.5	0	0	0	0	111.3	N875 E876 I904 T905	S855-N875 CarbonylContact C-O 3.52Å; S855-N875 WeakPolarHBondContact CA-O 3.44Å; S855-E876 VanDerWaalsContact CB-CD 3.45Å; S855-E876 WeakPolarHBondContact CB-OE1 3.46Å; S855-E876 WeakPolarHBondContact CB-OE2 3.39Å; S855-I904 CarbonylContact O-C 3.52Å; S855-I904 VanDerWaalsContact O-CA 3.32Å; S855-I904 WeakPolarHBondContact O-CA 3.34Å; S855-T905 PolarHBondContact N-O 2.68Å; S855-T905 PolarHBondContact O-N 2.91Å; S855-T905 WeakPolarHBondContact OG-CB 3.36Å
856	S	89.4	Confident	76.9	Confident	3 Å²	3	72.6 Å²	72.6	2%	0.021	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	123.7	176.1	-177.4	0	0	0	0	112.5	T874 N875 F896 H902 N903	S856-T874 WeakPolarHBondContact O-CG2 3.39Å; S856-N875 PolarHBondContact N-O 2.9Å; S856-F896 WeakPolarHBondContact OG-CE1 3.11Å; S856-H902 PolarHBondContact OG-ND1 3.35Å; S856-N903 CarbonylContact C-O 3.6Å; S856-N903 WeakPolarHBondContact CA-O 3.46Å
857	T	88	Confident	74.5	Confident	70 Å²	70	75.1 Å²	75.1	43%	0.429	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	141.7	179.3	55.3	0	0	0	0	111.9	H902 N903	T857-H902 CarbonylContact O-C 3.51Å; T857-H902 WeakPolarHBondContact O-CA 3.49Å; T857-N903 PolarHBondContact N-O 3.43Å; T857-N903 PolarHBondContact O-N 3.26Å
858	L	85.1	Confident	72.3	Confident	61 Å²	61	80.6 Å²	80.6	32%	0.319	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	127.9	177.4	-177.4	71	0	0	0	110.7	S860 I898 T901	L858-S860 WeakPolarHBondContact CD2-O 3.4Å; L858-S860 WeakPolarHBondContact CG-O 3.46Å; L858-I898 HydrophobicContact CD1-CG2 4.46Å; L858-I898 HydrophobicContact CD2-CG2 4.17Å; L858-T901 WeakPolarHBondContact CD1-O 3.47Å
859	Q	78.1	Confident	70.1	Confident	113 Å²	113	80.7 Å²	80.7	53%	0.528	43%	0.43	S	S	.	.	S	Bend	trans	-81.9	-25.6	-174.9	-163.9	-179.1	22.3	0	0	113.5	T901	Q859-T901 WeakPolarHBondContact CB-O 3.44Å; Q859-T901 PolarHBondContact N-O 3.28Å
860	S	65.9	Low	68.2	Low	75 Å²	75	85.1 Å²	85.1	52%	0.524	45%	0.452	S	S	.	.			trans	-137.9	125.9	-177.7	178.2	0	0	0	0	111.3	L858 S862	L858-S860 WeakPolarHBondContact CD2-O 3.4Å; L858-S860 WeakPolarHBondContact CG-O 3.46Å; S860-S862 PolarHBondContact O-N 3.41Å
861	K	59.6	Low	66.1	Low	172 Å²	172	91.8 Å²	91.8	75%	0.748	49%	0.488	S	S	*	.			trans	-72.7	105.4	162.7	-68	-177.8	178.8	-178.1	0	107.6
862	S	46.9	Very low	63.9	Low	95 Å²	95	98.2 Å²	98.2	66%	0.664	52%	0.522	S	S	*	.			trans	-59.7	136	160.2	39.1	0	0	0	0	108.2	S860	S860-S862 PolarHBondContact O-N 3.41Å
863	G	48.5	Very low	61.9	Low	74 Å²	74	104.2 Å²	104.2	76%	0.763	55%	0.552	S	S	*	*	S	Bend	trans	-56.4	163.9	-159.8	0	0	0	0	0	118.3
864	Q	40.8	Very low	60.7	Low	172 Å²	172	104.4 Å²	104.4	80%	0.804	56%	0.555	S	S	*	*	S	Bend	trans	75.6	122.1	-179	-67.1	-168.8	-10.2	0	0	117.4	Y866	Q864-Y866 PolarHBondContact O-N 3.45Å
865	D	38.7	Very low	60	Low	160 Å²	160	105.2 Å²	105.2	86%	0.856	56%	0.559	S	S	*	*			trans	-57.4	84.7	178.7	-70.9	-56	0	0	0	112.8
866	Y	40.1	Very low	59.7	Low	193 Å²	193	110 Å²	110	76%	0.757	58%	0.579	S	S	*	*			trans	-103.2	108.9	150.7	-73.2	-83.2	0	0	0	107.7	Q864 I868	Q864-Y866 PolarHBondContact O-N 3.45Å; Y866-I868 PolarHBondContact O-N 3.34Å
867	K	39.6	Very low	59.9	Low	208 Å²	208	113 Å²	113	90%	0.904	59%	0.593	S	S	*	*			trans	-65.7	77.1	168.9	-75.1	179.9	175.7	177.6	0	109.2
868	I	46	Very low	60.1	Low	131 Å²	131	115.5 Å²	115.5	67%	0.672	60%	0.6	S	S	*	*			trans	-85.5	124.8	158.1	-55.4	176.9	0	0	0	105.6	Y866 I870	Y866-I868 PolarHBondContact O-N 3.34Å; I868-I870 PolarHBondContact O-N 3.32Å
869	P	47.6	Very low	60.5	Low	90 Å²	90	116 Å²	116	58%	0.584	60%	0.601	S	S	*	*			trans	-58.4	112.5	174.1	-18.8	30.2	0	0	0	109.1	D871	P869-D871 PolarHBondContact O-N 3.27Å
870	I	54	Low	61.3	Low	101 Å²	101	116 Å²	116	52%	0.518	60%	0.596	S	S	.	*	G	3₁₀ helix	trans	-67	-18.8	-176.1	-61.8	170.9	0	0	0	110.9	I868 N872 M873 T874	I868-I870 PolarHBondContact O-N 3.32Å; I870-N872 PolarHBondContact O-N 3.3Å; I870-N872 VanDerWaalsContact O-N 3.11Å; I870-M873 PolarHBondContact O-N 3.06Å; I870-T874 PolarHBondContact O-OG1 2.94Å
871	D	50.8	Low	62.6	Low	141 Å²	141	113.6 Å²	113.6	75%	0.754	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-64.1	-19.8	-171.9	-60.9	-26.3	0	0	0	114.6	P869	P869-D871 PolarHBondContact O-N 3.27Å
872	N	47.3	Very low	64.2	Low	136 Å²	136	112.4 Å²	112.4	73%	0.727	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-91.9	-3.8	-175.7	-75.2	-9.2	0	0	0	115.2	I870	I870-N872 PolarHBondContact O-N 3.3Å; I870-N872 VanDerWaalsContact O-N 3.11Å
873	M	54.1	Low	66.2	Low	127 Å²	127	108.8 Å²	108.8	63%	0.626	55%	0.55	S	S	*	.	S	Bend	trans	-128.8	23.2	-175.1	-67.2	-78.7	123.4	0	0	113.2	I870 I898	I870-M873 PolarHBondContact O-N 3.06Å; M873-I898 HydrophobicContact CB-CD1 4.05Å
874	T	67.9	Low	67.7	Low	49 Å²	49	110.9 Å²	110.9	30%	0.301	54%	0.54	S	S	.	.			trans	-92.5	126.3	177	-52.9	0	0	0	0	108.8	S856 I870 E876	S856-T874 WeakPolarHBondContact O-CG2 3.39Å; I870-T874 PolarHBondContact O-OG1 2.94Å; T874-E876 HydrophobicContact CG2-CG 4.07Å; T874-E876 PolarHBondContact O-N 3.4Å
875	N	79.2	Confident	69.6	Low	17 Å²	17	106.8 Å²	106.8	9%	0.091	52%	0.523	C	S	.	.			trans	-73.3	110.8	171.2	-59.7	-71.9	0	0	0	108.2	S855 S856 L894 N895	S855-N875 CarbonylContact C-O 3.52Å; S855-N875 WeakPolarHBondContact CA-O 3.44Å; S856-N875 PolarHBondContact N-O 2.9Å; N875-L894 HydrophobicContact CB-CD2 3.67Å; N875-N895 PolarHBondContact ND2-O 3.31Å; N875-N895 PolarHBondContact OD1-N 3.44Å; N875-N895 PolarHBondContact OD1-O 3.44Å
876	E	86.9	Confident	71.8	Confident	121 Å²	121	101.3 Å²	101.3	57%	0.565	49%	0.494	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.6	116	169.7	-71.1	-63.7	153.6	0	0	108.4	V854 S855 T874	V854-E876 WeakPolarHBondContact O-CA 3.46Å; S855-E876 VanDerWaalsContact CB-CD 3.45Å; S855-E876 WeakPolarHBondContact CB-OE1 3.46Å; S855-E876 WeakPolarHBondContact CB-OE2 3.39Å; T874-E876 HydrophobicContact CG2-CG 4.07Å; T874-E876 PolarHBondContact O-N 3.4Å
877	M	91.9	Very high	74	Confident	66 Å²	66	93.6 Å²	93.6	33%	0.325	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	128.7	-179.8	-61.9	-173	-179.6	0	0	110.3	N853 V854 F892 L893 L894	N853-M877 WeakPolarHBondContact CA-O 3.31Å; V854-M877 PolarHBondContact N-O 2.91Å; V854-M877 PolarHBondContact O-N 3.49Å; M877-F892 HydrophobicContact CB-CD1 3.58Å; M877-F892 HydrophobicContact CB-CE1 3.77Å; M877-F892 HydrophobicContact CG-CD1 4.39Å; M877-F892 HydrophobicContact SD-CB 4.43Å; M877-F892 HydrophobicContact SD-CD1 4.02Å; M877-L893 WeakPolarHBondContact CE-O 3.47Å; M877-L894 HydrophobicContact SD-CD2 4.46Å
878	E	92.9	Very high	76.4	Confident	124 Å²	124	83.9 Å²	83.9	58%	0.579	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.8	134	169.2	176.8	178.1	-179.6	0	0	109.1	L852 N853	L852-E878 WeakPolarHBondContact O-CA 3.4Å; N853-E878 WeakPolarHBondContact OD1-CB 3.5Å; N853-E878 VanDerWaalsContact OD1-CG 3.25Å; N853-E878 WeakPolarHBondContact OD1-CG 3.26Å
879	Q	94.4	Very high	78.4	Confident	70 Å²	70	80 Å²	80	33%	0.327	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	143.7	165.5	-70.4	-172.1	21.1	0	0	111.5	C851 L852 T890 Q891 F892	C851-Q879 WeakPolarHBondContact CA-O 3.17Å; L852-Q879 PolarHBondContact N-O 3.36Å; L852-Q879 PolarHBondContact O-N 3.45Å; Q879-T890 PolarHBondContact OE1-OG1 3.32Å; Q879-Q891 PolarHBondContact NE2-O 2.95Å; Q879-Q891 VanDerWaalsContact NE2-O 3.12Å; Q879-F892 HydrophobicContact CB-CE1 4.04Å; Q879-F892 HydrophobicContact CB-CZ 3.9Å; Q879-F892 HydrophobicContact CG-CD1 4.48Å; Q879-F892 HydrophobicContact CG-CE1 3.68Å; Q879-F892 HydrophobicContact CG-CZ 4.04Å
880	R	94.2	Very high	80.6	Confident	113 Å²	113	76.8 Å²	76.8	43%	0.426	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	126	174.9	-179.3	-177.7	-58.3	-68.6	-7.1	109.2	S849 C851	S849-R880 PolarHBondContact OG-NH1 3.2Å; C851-R880 PolarHBondContact SG-NH1 3.34Å; C851-R880 PolarHBondContact SG-NH2 3.11Å; C851-R880 VanDerWaalsContact SG-NH2 3.37Å
881	V	94.1	Very high	82.5	Confident	26 Å²	26	77.7 Å²	77.7	16%	0.158	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	131.1	176.8	61.4	0	0	0	0	110.2	S849 V850 L852 F888	S849-V881 CarbonylContact C-O 3.24Å; S849-V881 WeakPolarHBondContact CA-O 3.44Å; S849-V881 WeakPolarHBondContact CB-O 3.39Å; V850-V881 HydrophobicContact CB-CG1 4.14Å; V850-V881 PolarHBondContact N-O 3.04Å; V850-V881 PolarHBondContact O-N 3.45Å; L852-V881 HydrophobicContact CD1-CG1 4.19Å; V881-F888 HydrophobicContact CB-CB 4.46Å; V881-F888 HydrophobicContact CG1-CB 3.77Å; V881-F888 HydrophobicContact CG1-CD2 3.66Å; V881-F888 HydrophobicContact CG1-CE2 4.48Å; V881-F888 HydrophobicContact CG1-CG 3.87Å; V881-F888 HydrophobicContact CG2-CB 3.82Å
882	E	92.8	Very high	84.5	Confident	146 Å²	146	71.1 Å²	71.1	68%	0.682	35%	0.351	S	S	*	.			trans	-83.2	118.2	169.5	179.3	158.8	-165.6	0	0	108.2	Q848 H884	Q848-E882 WeakPolarHBondContact O-CG 3.34Å; E882-H884 PolarHBondContact O-N 3.14Å
883	P	88.1	Confident	86.7	Confident	19 Å²	19	68.8 Å²	68.8	12%	0.123	34%	0.339	C	S	.	.			trans	-66.2	132.8	178.3	27.8	-32.9	0	0	0	109.7	I847 Y887 F888	I847-P883 HydrophobicContact CG2-CG 4.24Å; P883-Y887 CarbonylContact C-O 3.53Å; P883-Y887 WeakPolarHBondContact CA-O 3.36Å; P883-F888 HydrophobicContact CB-CB 4.3Å; P883-F888 HydrophobicContact CB-CD1 4.28Å
884	H	81.3	Confident	88.4	Confident	119 Å²	119	62.8 Å²	62.8	55%	0.551	31%	0.309	S	S	*	.	B	Isolated β-bridge	trans	-87.9	116	170.1	-160.9	-92.6	0	0	0	107.8	E95 E882 D886 Y887	E95-H884 IonicContact OE1-CE1 2.95Å; E95-H884 PolarHBondContact OE1-CE1 3.4Å; E95-H884 IonicContact OE1-ND1 4Å; E95-H884 PolarHBondContact OE1-ND1 3.44Å; E95-H884 IonicContact OE2-CE1 2.64Å; E95-H884 PolarHBondContact OE2-CE1 2.8Å; E95-H884 VanDerWaalsContact OE2-CE1 3.24Å; E95-H884 IonicContact OE2-CG 2.91Å; E95-H884 IonicContact OE2-ND1 3.69Å; E95-H884 PolarHBondContact OE2-ND1 2.96Å; E882-H884 PolarHBondContact O-N 3.14Å; H884-D886 PolarHBondContact O-N 3.44Å; H884-Y887 PolarHBondContact N-O 3.05Å; H884-Y887 PolarHBondContact O-N 3.02Å; H884-Y887 VanDerWaalsContact O-N 3.09Å
885	N	80	Confident	89.4	Confident	85 Å²	85	64.2 Å²	64.2	46%	0.455	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	-108.1	-161.9	-72.4	-47.2	0	0	0	111.6	E95	E95-N885 PolarHBondContact OE1-ND2 3.25Å; E95-N885 PolarHBondContact OE2-ND2 2.91Å
886	D	85.4	Confident	89.8	Confident	45 Å²	45	63.5 Å²	63.5	24%	0.241	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	10.8	-176.7	-65.4	-23.8	0	0	0	112	V834 V835 H837 H884	V834-D886 CarbonylContact C-O 3.55Å; V834-D886 VanDerWaalsContact CA-O 3.27Å; V834-D886 WeakPolarHBondContact CA-O 3.44Å; V834-D886 WeakPolarHBondContact CG1-O 3.36Å; V835-D886 PolarHBondContact N-O 3.43Å; H837-D886 IonicContact CD2-OD1 2.78Å; H837-D886 IonicContact NE2-OD1 3.43Å; H884-D886 PolarHBondContact O-N 3.44Å
887	Y	86.4	Confident	89.5	Confident	31 Å²	31	60.8 Å²	60.8	12%	0.122	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	146.2	-174.7	169.6	-97.4	0	0	0	113	P58 K96 E832 G833 V834 P883 H884 S889	P58-Y887 HydrophobicContact CG-CD2 3.94Å; P58-Y887 HydrophobicContact CG-CE1 4.26Å; P58-Y887 HydrophobicContact CG-CE2 3.17Å; P58-Y887 WeakPolarHBondContact CG-OH 3.45Å; K96-Y887 HydrophobicContact CG-CG 4.45Å; E832-Y887 HydrophobicContact CB-CE2 4.1Å; E832-Y887 PolarHBondContact OE1-OH 3.27Å; G833-Y887 WeakPolarHBondContact O-CA 3.43Å; G833-Y887 VanDerWaalsContact O-CD2 3.26Å; G833-Y887 WeakPolarHBondContact O-CD2 3.46Å; V834-Y887 HydrophobicContact CG2-CD2 4.06Å; P883-Y887 CarbonylContact C-O 3.53Å; P883-Y887 WeakPolarHBondContact CA-O 3.36Å; H884-Y887 PolarHBondContact N-O 3.05Å; H884-Y887 PolarHBondContact O-N 3.02Å; H884-Y887 VanDerWaalsContact O-N 3.09Å; Y887-S889 WeakPolarHBondContact OH-CB 3.36Å
888	F	89.2	Confident	89	Confident	4 Å²	4	60.8 Å²	60.8	2%	0.018	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	155.8	172.8	60.7	-90.5	0	0	0	110.9	I804 L806 E832 G833 V835 V850 L852 V881 P883	I804-F888 HydrophobicContact CG2-CE1 4.14Å; I804-F888 HydrophobicContact CG2-CZ 3.87Å; L806-F888 HydrophobicContact CD2-CE2 3.93Å; L806-F888 HydrophobicContact CD2-CZ 3.73Å; E832-F888 WeakPolarHBondContact CA-O 3.4Å; G833-F888 VanDerWaalsContact CA-CZ 3.45Å; G833-F888 PolarHBondContact N-O 3.24Å; G833-F888 WeakPolarHBondContact O-CD1 3.42Å; G833-F888 PolarHBondContact O-N 3.29Å; V835-F888 HydrophobicContact CG2-CE1 4.31Å; V850-F888 HydrophobicContact CB-CD1 4.46Å; V850-F888 HydrophobicContact CB-CE1 4.25Å; V850-F888 HydrophobicContact CB-CZ 4.27Å; V850-F888 HydrophobicContact CG1-CE1 4.18Å; V850-F888 HydrophobicContact CG1-CE2 4.18Å; V850-F888 HydrophobicContact CG1-CZ 3.79Å; V850-F888 HydrophobicContact CG2-CD1 3.95Å; V850-F888 HydrophobicContact CG2-CE1 3.75Å; V850-F888 HydrophobicContact CG2-CZ 4.23Å; L852-F888 HydrophobicContact CD1-CD2 4.06Å; L852-F888 HydrophobicContact CD1-CE2 3.79Å; L852-F888 HydrophobicContact CD2-CE2 3.95Å; L852-F888 HydrophobicContact CD2-CZ 4.46Å; L852-F888 HydrophobicContact CG-CE2 4.27Å; V881-F888 HydrophobicContact CB-CB 4.46Å; V881-F888 HydrophobicContact CG1-CB 3.77Å; V881-F888 HydrophobicContact CG1-CD2 3.66Å; V881-F888 HydrophobicContact CG1-CE2 4.48Å; V881-F888 HydrophobicContact CG1-CG 3.87Å; V881-F888 HydrophobicContact CG2-CB 3.82Å; P883-F888 HydrophobicContact CB-CB 4.3Å; P883-F888 HydrophobicContact CB-CD1 4.28Å
889	S	88.2	Confident	88.5	Confident	51 Å²	51	57.9 Å²	57.9	36%	0.357	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	144.5	171.3	67.9	0	0	0	0	111.1	V831 Y887	V831-S889 CarbonylContact O-C 3.6Å; V831-S889 WeakPolarHBondContact O-CA 3.43Å; Y887-S889 WeakPolarHBondContact OH-CB 3.36Å
890	T	92.8	Very high	88.1	Confident	22 Å²	22	55.7 Å²	55.7	14%	0.135	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	171.2	171.2	-164.5	0	0	0	0	111.7	K830 V831 L852 Q879 F892	K830-T890 CarbonylContact C-O 3.59Å; K830-T890 WeakPolarHBondContact CA-O 2.99Å; V831-T890 HydrophobicContact CB-CG2 4.23Å; V831-T890 PolarHBondContact N-O 3.42Å; V831-T890 PolarHBondContact O-N 3.03Å; L852-T890 HydrophobicContact CD1-CG2 3.43Å; L852-T890 VanDerWaalsContact CD1-CG2 3.43Å; Q879-T890 PolarHBondContact OE1-OG1 3.32Å; T890-F892 HydrophobicContact CG2-CD2 4.06Å; T890-F892 HydrophobicContact CG2-CE2 3.39Å; T890-F892 HydrophobicContact CG2-CZ 3.99Å
891	Q	93.8	Very high	87.8	Confident	120 Å²	120	52 Å²	52	56%	0.561	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.1	138	177	-60.8	-174.1	6.5	0	0	111.2	L829 K830 Q879	L829-Q891 WeakPolarHBondContact O-CA 3.49Å; K830-Q891 HydrophobicContact CB-CG 4.07Å; K830-Q891 HydrophobicContact CG-CG 4.08Å; Q879-Q891 PolarHBondContact NE2-O 2.95Å; Q879-Q891 VanDerWaalsContact NE2-O 3.12Å
892	F	93.9	Very high	87.5	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.009	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	141.8	172.5	-64.1	-89	0	0	0	109.1	L829 V831 L852 V854 M877 Q879 T890 L894	L829-F892 HydrophobicContact CB-CB 4.43Å; L829-F892 PolarHBondContact N-O 3.37Å; L829-F892 PolarHBondContact O-N 3.48Å; V831-F892 HydrophobicContact CB-CE2 4.37Å; V831-F892 HydrophobicContact CG2-CD2 3.72Å; V831-F892 HydrophobicContact CG2-CE2 3.85Å; L852-F892 HydrophobicContact CB-CE2 4.17Å; L852-F892 HydrophobicContact CB-CZ 3.9Å; V854-F892 HydrophobicContact CB-CD1 4.22Å; V854-F892 HydrophobicContact CB-CE1 4.38Å; V854-F892 HydrophobicContact CB-CG 4.31Å; V854-F892 HydrophobicContact CG2-CB 4.44Å; V854-F892 HydrophobicContact CG2-CD1 3.84Å; V854-F892 HydrophobicContact CG2-CD2 3.49Å; V854-F892 VanDerWaalsContact CG2-CD2 3.49Å; V854-F892 HydrophobicContact CG2-CE1 3.82Å; V854-F892 HydrophobicContact CG2-CE2 3.47Å; V854-F892 VanDerWaalsContact CG2-CE2 3.47Å; V854-F892 HydrophobicContact CG2-CG 3.66Å; V854-F892 HydrophobicContact CG2-CZ 3.64Å; M877-F892 HydrophobicContact CB-CD1 3.58Å; M877-F892 HydrophobicContact CB-CE1 3.77Å; M877-F892 HydrophobicContact CG-CD1 4.39Å; M877-F892 HydrophobicContact SD-CB 4.43Å; M877-F892 HydrophobicContact SD-CD1 4.02Å; Q879-F892 HydrophobicContact CB-CE1 4.04Å; Q879-F892 HydrophobicContact CB-CZ 3.9Å; Q879-F892 HydrophobicContact CG-CD1 4.48Å; Q879-F892 HydrophobicContact CG-CE1 3.68Å; Q879-F892 HydrophobicContact CG-CZ 4.04Å; T890-F892 HydrophobicContact CG2-CD2 4.06Å; T890-F892 HydrophobicContact CG2-CE2 3.39Å; T890-F892 HydrophobicContact CG2-CZ 3.99Å; F892-L894 HydrophobicContact CB-CD2 4.49Å
893	L	92.8	Very high	87.3	Confident	88 Å²	88	45.6 Å²	45.6	46%	0.461	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	115.2	175	-71.3	170.9	0	0	0	108.5	L827 A828 M877	L827-L893 WeakPolarHBondContact O-CA 3.33Å; A828-L893 HydrophobicContact CB-CD2 3.84Å; M877-L893 WeakPolarHBondContact CE-O 3.47Å
894	L	90.8	Very high	87.5	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	135.5	-173.3	-55.2	173.6	0	0	0	110.6	Q826 L827 L829 V854 N875 M877 F892 F896 I904	Q826-L894 WeakPolarHBondContact CA-O 3.47Å; L827-L894 PolarHBondContact N-O 3.36Å; L827-L894 PolarHBondContact O-N 3.18Å; L829-L894 HydrophobicContact CB-CD1 4.23Å; L829-L894 HydrophobicContact CD2-CD1 4.08Å; V854-L894 HydrophobicContact CG1-CD1 4.07Å; V854-L894 HydrophobicContact CG1-CD2 3.89Å; N875-L894 HydrophobicContact CB-CD2 3.67Å; M877-L894 HydrophobicContact SD-CD2 4.46Å; F892-L894 HydrophobicContact CB-CD2 4.49Å; L894-F896 HydrophobicContact CB-CE2 3.69Å; L894-F896 HydrophobicContact CB-CZ 3.72Å; L894-F896 HydrophobicContact CD1-CZ 4.18Å; L894-I904 HydrophobicContact CD1-CD1 3.65Å; L894-I904 HydrophobicContact CD1-CG1 4.13Å; L894-I904 HydrophobicContact CD1-CG2 3.8Å
895	N	88.5	Confident	88	Confident	80 Å²	80	39.4 Å²	39.4	43%	0.428	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	134.6	179.9	-65.1	-28.9	0	0	0	110.5	Q826 N875	Q826-N895 WeakPolarHBondContact CG-OD1 3.48Å; Q826-N895 PolarHBondContact NE2-OD1 3.21Å; N875-N895 PolarHBondContact ND2-O 3.31Å; N875-N895 PolarHBondContact OD1-N 3.44Å; N875-N895 PolarHBondContact OD1-O 3.44Å
896	F	86.5	Confident	88.6	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.009	20%	0.202	C	C	.	.			trans	-124.7	60.9	-178.2	-63	-73.6	0	0	0	112.5	V821 N823 L827 S856 L894 I898 H902 I904 V928 S930	V821-F896 HydrophobicContact CG1-CD2 4.34Å; N823-F896 WeakPolarHBondContact CA-O 3.4Å; L827-F896 HydrophobicContact CB-CD2 4.29Å; L827-F896 HydrophobicContact CB-CE2 3.71Å; L827-F896 HydrophobicContact CD2-CE2 3.93Å; L827-F896 HydrophobicContact CD2-CZ 4.47Å; L827-F896 HydrophobicContact CG-CE2 4.5Å; S856-F896 WeakPolarHBondContact OG-CE1 3.11Å; L894-F896 HydrophobicContact CB-CE2 3.69Å; L894-F896 HydrophobicContact CB-CZ 3.72Å; L894-F896 HydrophobicContact CD1-CZ 4.18Å; F896-I898 PolarHBondContact O-N 3.3Å; F896-H902 HydrophobicContact CD1-CB 4.06Å; F896-H902 AromaticContact CD1-CG 3.7Å; F896-H902 AromaticContact CD1-ND1 3.61Å; F896-H902 HydrophobicContact CE1-CB 3.85Å; F896-H902 AromaticContact CE1-CG 3.94Å; F896-H902 AromaticContact CE1-ND1 3.88Å; F896-I904 HydrophobicContact CE1-CD1 4.34Å; F896-I904 HydrophobicContact CE1-CG1 4.28Å; F896-I904 HydrophobicContact CE2-CD1 4.37Å; F896-I904 HydrophobicContact CZ-CD1 3.56Å; F896-I904 HydrophobicContact CZ-CG1 3.93Å; F896-V928 HydrophobicContact CD1-CG1 4.46Å; F896-V928 HydrophobicContact CD2-CG1 4.08Å; F896-V928 HydrophobicContact CE1-CG1 4.38Å; F896-V928 HydrophobicContact CE2-CG1 3.98Å; F896-V928 HydrophobicContact CG-CG1 4.35Å; F896-V928 HydrophobicContact CZ-CB 4.4Å; F896-V928 HydrophobicContact CZ-CG1 4.18Å; F896-S930 PolarHBondContact O-OG 3.07Å
897	A	80.9	Confident	88.9	Confident	64 Å²	64	36.3 Å²	36.3	53%	0.529	21%	0.205	S	C	.	.			trans	-64.8	-25.7	-179.2	0	0	0	0	0	113.7
898	I	81.7	Confident	89.3	Confident	65 Å²	65	34.9 Å²	34.9	33%	0.333	20%	0.199	S	C	.	.	S	Bend	trans	-88.5	129.9	179.5	-56	178.1	0	0	0	109.3	L858 M873 F896 H902 S930	L858-I898 HydrophobicContact CD1-CG2 4.46Å; L858-I898 HydrophobicContact CD2-CG2 4.17Å; M873-I898 HydrophobicContact CB-CD1 4.05Å; F896-I898 PolarHBondContact O-N 3.3Å; I898-H902 PolarHBondContact O-NE2 3.22Å; I898-S930 WeakPolarHBondContact O-CB 3.41Å; I898-S930 PolarHBondContact O-OG 2.83Å
899	L	83.6	Confident	89.5	Confident	64 Å²	64	35.2 Å²	35.2	34%	0.335	20%	0.202	S	C	.	.			trans	-72.8	138.2	176.1	-61.7	-180	0	0	0	111	N823 L931 E932	N823-L899 HydrophobicContact CB-CD2 3.75Å; L899-L931 VanDerWaalsContact CD2-C 3.43Å; L899-E932 HydrophobicContact CD1-CB 4.03Å; L899-E932 HydrophobicContact CD1-CG 4.43Å; L899-E932 HydrophobicContact CD2-CB 4.06Å; L899-E932 VanDerWaalsContact CD2-N 3.33Å
900	G	85.7	Confident	89.8	Confident	23 Å²	23	33 Å²	33	24%	0.237	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	133.9	-172.3	178.7	0	0	0	0	0	113.2	K929 S930	G900-K929 WeakPolarHBondContact O-CA 3.29Å; G900-S930 PolarHBondContact N-O 2.97Å; G900-S930 VanDerWaalsContact N-O 3.17Å; G900-S930 PolarHBondContact O-N 3.1Å
901	T	87.8	Confident	89.8	Confident	35 Å²	35	34.3 Å²	34.3	22%	0.215	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	123.2	178.3	-52.4	0	0	0	0	110	L858 Q859 V928	L858-T901 WeakPolarHBondContact CD1-O 3.47Å; Q859-T901 WeakPolarHBondContact CB-O 3.44Å; Q859-T901 PolarHBondContact N-O 3.28Å; T901-V928 CarbonylContact C-O 3.09Å; T901-V928 WeakPolarHBondContact CA-O 3.48Å
902	H	88.2	Confident	89.8	Confident	8 Å²	8	28.8 Å²	28.8	4%	0.037	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	142.2	175.4	-72.4	-121.6	0	0	0	110.5	S856 T857 F896 I898 V928	S856-H902 PolarHBondContact OG-ND1 3.35Å; T857-H902 CarbonylContact O-C 3.51Å; T857-H902 WeakPolarHBondContact O-CA 3.49Å; F896-H902 HydrophobicContact CD1-CB 4.06Å; F896-H902 AromaticContact CD1-CG 3.7Å; F896-H902 AromaticContact CD1-ND1 3.61Å; F896-H902 HydrophobicContact CE1-CB 3.85Å; F896-H902 AromaticContact CE1-CG 3.94Å; F896-H902 AromaticContact CE1-ND1 3.88Å; I898-H902 PolarHBondContact O-NE2 3.22Å; H902-V928 PolarHBondContact N-O 2.93Å; H902-V928 PolarHBondContact O-N 3.31Å
903	N	88.9	Confident	89.6	Confident	31 Å²	31	32 Å²	32	17%	0.166	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	115.3	168.6	-63.5	-20.1	0	0	0	108.1	S856 T857 T925 F927	S856-N903 CarbonylContact C-O 3.6Å; S856-N903 WeakPolarHBondContact CA-O 3.46Å; T857-N903 PolarHBondContact N-O 3.43Å; T857-N903 PolarHBondContact O-N 3.26Å; N903-T925 HydrophobicContact CB-CG2 4.29Å; N903-F927 WeakPolarHBondContact OD1-CD1 3.46Å; N903-F927 WeakPolarHBondContact OD1-CE1 3.48Å
904	I	90.7	Very high	89.4	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	122.2	170.9	-55.3	165.1	0	0	0	107.4	L827 L829 V854 S855 L894 F896 T925 I926 V928	L827-I904 HydrophobicContact CD2-CD1 3.93Å; L829-I904 HydrophobicContact CD2-CG2 4.05Å; V854-I904 HydrophobicContact CG1-CG2 3.69Å; S855-I904 CarbonylContact O-C 3.52Å; S855-I904 VanDerWaalsContact O-CA 3.32Å; S855-I904 WeakPolarHBondContact O-CA 3.34Å; L894-I904 HydrophobicContact CD1-CD1 3.65Å; L894-I904 HydrophobicContact CD1-CG1 4.13Å; L894-I904 HydrophobicContact CD1-CG2 3.8Å; F896-I904 HydrophobicContact CE1-CD1 4.34Å; F896-I904 HydrophobicContact CE1-CG1 4.28Å; F896-I904 HydrophobicContact CE2-CD1 4.37Å; F896-I904 HydrophobicContact CZ-CD1 3.56Å; F896-I904 HydrophobicContact CZ-CG1 3.93Å; I904-T925 CarbonylContact O-C 3.52Å; I904-T925 VanDerWaalsContact O-CA 3.26Å; I904-T925 WeakPolarHBondContact O-CA 3.37Å; I904-T925 WeakPolarHBondContact O-CG2 3.44Å; I904-I926 HydrophobicContact CB-CD1 4.43Å; I904-I926 HydrophobicContact CB-CG1 3.78Å; I904-I926 HydrophobicContact CD1-CD1 4.04Å; I904-I926 HydrophobicContact CD1-CG1 4.07Å; I904-I926 HydrophobicContact CG1-CG1 4.44Å; I904-I926 HydrophobicContact CG2-CG1 4.38Å; I904-I926 PolarHBondContact N-O 3.45Å; I904-I926 PolarHBondContact O-N 2.83Å; I904-V928 HydrophobicContact CD1-CB 4.15Å; I904-V928 HydrophobicContact CD1-CG2 3.32Å; I904-V928 HydrophobicContact CG1-CG2 4.26Å
905	T	91.9	Very high	89.3	Confident	7 Å²	7	36 Å²	36	4%	0.043	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	129	175.4	-57.6	0	0	0	0	108.9	V854 S855 E907 R923	V854-T905 WeakPolarHBondContact CA-O 3.46Å; S855-T905 PolarHBondContact N-O 2.68Å; S855-T905 PolarHBondContact O-N 2.91Å; S855-T905 WeakPolarHBondContact OG-CB 3.36Å; T905-E907 HydrophobicContact CG2-CG 4.01Å; T905-R923 HydrophobicContact CG2-CG 3.51Å
906	V	92.6	Very high	89.5	Confident	0 Å²	0	35 Å²	35	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	119.2	169.8	-174.7	0	0	0	0	108.4	L806 L808 L829 V831 N853 V854 R923 T924	L806-V906 HydrophobicContact CD1-CG1 4.17Å; L808-V906 HydrophobicContact CD1-CB 4.46Å; L808-V906 HydrophobicContact CD1-CG2 4.02Å; L808-V906 HydrophobicContact CD2-CB 4.22Å; L808-V906 HydrophobicContact CD2-CG1 4.32Å; L808-V906 HydrophobicContact CD2-CG2 3.85Å; L829-V906 HydrophobicContact CD2-CG2 3.81Å; V831-V906 HydrophobicContact CG1-CG1 4.03Å; V831-V906 HydrophobicContact CG2-CG1 4.24Å; V831-V906 HydrophobicContact CG2-CG2 4.44Å; N853-V906 CarbonylContact O-C 3.55Å; N853-V906 WeakPolarHBondContact O-CA 3.4Å; V854-V906 HydrophobicContact CG1-CG2 4.41Å; V854-V906 HydrophobicContact CG2-CG1 4.22Å; V854-V906 HydrophobicContact CG2-CG2 4Å; V906-R923 CarbonylContact O-C 3.43Å; V906-R923 WeakPolarHBondContact O-CA 3.25Å; V906-T924 PolarHBondContact N-O 3.31Å; V906-T924 PolarHBondContact O-N 3.07Å
907	E	92.9	Very high	89.8	Confident	65 Å²	65	37.4 Å²	37.4	30%	0.304	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	140.6	174.1	-68.6	-179.2	-179.4	0	0	109.5	L852 N853 T905 R923	L852-E907 WeakPolarHBondContact CA-O 3.34Å; N853-E907 HydrophobicContact CB-CB 4.41Å; N853-E907 PolarHBondContact N-O 3.3Å; N853-E907 PolarHBondContact O-N 3.41Å; T905-E907 HydrophobicContact CG2-CG 4.01Å; E907-R923 HydrophobicContact CG-CB 4.03Å; E907-R923 HydrophobicContact CG-CG 3.72Å; E907-R923 VanDerWaalsContact OE1-CD 3.22Å; E907-R923 WeakPolarHBondContact OE1-CD 3.27Å; E907-R923 IonicContact OE1-CZ 3.23Å; E907-R923 IonicContact OE1-NE 3.84Å; E907-R923 PolarHBondContact OE1-NE 3.44Å; E907-R923 VanDerWaalsContact OE1-NE 3.15Å; E907-R923 IonicContact OE1-NH1 2.78Å; E907-R923 PolarHBondContact OE1-NH1 3.36Å; E907-R923 IonicContact OE1-NH2 3.55Å
908	S	93.1	Very high	90.5	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.014	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	137.5	172.5	51.4	0	0	0	0	110.3	C851 G921 P922	C851-S908 CarbonylContact O-C 3.55Å; C851-S908 WeakPolarHBondContact O-CA 3.45Å; S908-G921 CarbonylContact O-C 3.6Å; S908-G921 WeakPolarHBondContact O-CA 3.11Å; S908-G921 PolarHBondContact O-N 3.14Å; S908-G921 VanDerWaalsContact O-N 3.09Å; S908-G921 VanDerWaalsContact OG-CA 3.26Å; S908-G921 WeakPolarHBondContact OG-CA 3.34Å; S908-P922 PolarHBondContact N-O 3.43Å; S908-P922 VanDerWaalsContact N-O 3.15Å; S908-P922 WeakPolarHBondContact OG-CD 3.33Å; S908-P922 PolarHBondContact OG-O 3.1Å
909	S	93.6	Very high	90.9	Very high	10 Å²	10	36.5 Å²	36.5	7%	0.07	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	145	173.2	-66	0	0	0	0	108.5	V850 C851 W918	V850-S909 CarbonylContact C-O 3.51Å; V850-S909 WeakPolarHBondContact CA-O 3.39Å; C851-S909 PolarHBondContact N-O 3.42Å; C851-S909 PolarHBondContact O-N 2.77Å; S909-W918 CarbonylContact C-O 3.59Å; S909-W918 WeakPolarHBondContact CA-O 3.36Å; S909-W918 VanDerWaalsContact CB-O 3.29Å; S909-W918 WeakPolarHBondContact CB-O 3.26Å
910	V	94.4	Very high	90.9	Very high	4 Å²	4	35.6 Å²	35.6	2%	0.024	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	141.5	177.2	-62.6	0	0	0	0	110	F693 I804 I847 W918	F693-V910 HydrophobicContact CB-CG2 4.48Å; F693-V910 HydrophobicContact CD1-CG2 4.47Å; F693-V910 HydrophobicContact CD2-CG2 3.61Å; F693-V910 HydrophobicContact CE2-CG2 3.86Å; F693-V910 HydrophobicContact CG-CG2 3.94Å; F693-V910 HydrophobicContact CZ-CG2 4.39Å; I804-V910 HydrophobicContact CD1-CG1 3.34Å; I804-V910 HydrophobicContact CG1-CG1 4.37Å; I847-V910 HydrophobicContact CD1-CB 4.33Å; I847-V910 HydrophobicContact CD1-CG1 3.79Å; I847-V910 HydrophobicContact CG1-CB 4.11Å; I847-V910 HydrophobicContact CG1-CG1 4.11Å; I847-V910 HydrophobicContact CG1-CG2 4.5Å; I847-V910 HydrophobicContact CG2-CB 4.38Å; I847-V910 HydrophobicContact CG2-CG1 4.39Å; V910-W918 HydrophobicContact CG2-CB 3.65Å; V910-W918 HydrophobicContact CG2-CG 4.28Å; V910-W918 PolarHBondContact N-O 3.44Å; V910-W918 WeakPolarHBondContact O-CB 3.47Å; V910-W918 PolarHBondContact O-N 3.37Å
911	K	94.4	Very high	90.6	Very high	51 Å²	51	35.3 Å²	35.3	22%	0.222	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	129.4	168.8	-172.5	174.7	179.6	175.1	0	109.2	Q848 S849 G915 I916	Q848-K911 PolarHBondContact N-O 3.3Å; S849-K911 PolarHBondContact N-O 2.98Å; S849-K911 PolarHBondContact O-N 3.07Å; S849-K911 WeakPolarHBondContact OG-CB 3.3Å; K911-G915 WeakPolarHBondContact CE-O 3.48Å; K911-I916 VanDerWaalsContact CA-O 3.3Å; K911-I916 WeakPolarHBondContact CA-O 3.39Å
912	D	92.7	Very high	90.6	Very high	3 Å²	3	35.6 Å²	35.6	2%	0.016	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	177.9	177	70.3	15.4	0	0	0	112.4	F693 K846 Q848 N914 G915 I916 W918	F693-D912 HydrophobicContact CE2-CB 4.33Å; K846-D912 WeakPolarHBondContact O-CA 3.49Å; Q848-D912 PolarHBondContact OE1-O 2.91Å; D912-N914 PolarHBondContact O-N 3.09Å; D912-N914 WeakPolarHBondContact OD1-CA 3.38Å; D912-N914 WeakPolarHBondContact OD1-CB 3.47Å; D912-N914 PolarHBondContact OD1-N 3.18Å; D912-G915 PolarHBondContact O-N 3.27Å; D912-G915 PolarHBondContact OD1-N 3.31Å; D912-I916 PolarHBondContact N-O 3.45Å; D912-I916 PolarHBondContact OD1-N 3.27Å; D912-W918 PolarHBondContact OD2-NE1 3.26Å
913	A	89.6	Confident	90.7	Very high	71 Å²	71	43.1 Å²	43.1	59%	0.587	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-20	179.4	0	0	0	0	0	114.4	G915	A913-G915 VanDerWaalsContact C-N 3.28Å
914	N	89.3	Confident	90.8	Very high	140 Å²	140	43.8 Å²	43.8	75%	0.749	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-6.4	175.5	-64.2	-20.3	0	0	0	111.7	D912	D912-N914 PolarHBondContact O-N 3.09Å; D912-N914 WeakPolarHBondContact OD1-CA 3.38Å; D912-N914 WeakPolarHBondContact OD1-CB 3.47Å; D912-N914 PolarHBondContact OD1-N 3.18Å
915	G	89.3	Confident	90.7	Very high	31 Å²	31	46.8 Å²	46.8	32%	0.32	26%	0.26	S	S	.	.			trans	87.4	12.4	177.3	0	0	0	0	0	114.9	K911 D912 A913	K911-G915 WeakPolarHBondContact CE-O 3.48Å; D912-G915 PolarHBondContact O-N 3.27Å; D912-G915 PolarHBondContact OD1-N 3.31Å; A913-G915 VanDerWaalsContact C-N 3.28Å
916	I	92.3	Very high	90.6	Very high	59 Å²	59	47.1 Å²	47.1	30%	0.303	26%	0.261	S	S	.	.			trans	-78.5	133.7	176.2	-58.5	173.9	0	0	0	109	K911 D912 W918	K911-I916 VanDerWaalsContact CA-O 3.3Å; K911-I916 WeakPolarHBondContact CA-O 3.39Å; D912-I916 PolarHBondContact N-O 3.45Å; D912-I916 PolarHBondContact OD1-N 3.27Å; I916-W918 HydrophobicContact CB-CZ2 4.34Å; I916-W918 HydrophobicContact CD1-CZ2 4.37Å; I916-W918 HydrophobicContact CG2-CD2 4.31Å; I916-W918 HydrophobicContact CG2-CZ2 3.89Å; I916-W918 PolarHBondContact O-NE1 3.41Å
917	V	92.7	Very high	90.5	Very high	53 Å²	53	49.8 Å²	49.8	32%	0.321	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	128.3	174.1	-178.7	0	0	0	0	109.5
918	W	94.8	Very high	90.3	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.008	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	119.1	-177.3	-59.1	88.5	0	0	0	110.1	Y689 Q690 F693 L700 S909 V910 D912 I916 T920	Y689-W918 HydrophobicContact CD1-CH2 4.03Å; Y689-W918 AromaticContact CD1-CZ3 3.95Å; Y689-W918 HydrophobicContact CD1-CZ3 3.95Å; Y689-W918 AromaticContact CE1-CH2 3.5Å; Y689-W918 HydrophobicContact CE1-CH2 3.5Å; Y689-W918 VanDerWaalsContact CE1-CH2 3.5Å; Y689-W918 HydrophobicContact CE1-CZ2 4.24Å; Y689-W918 AromaticContact CE1-CZ3 3.92Å; Y689-W918 HydrophobicContact CE1-CZ3 3.92Å; Y689-W918 WeakPolarHBondContact O-CZ3 3.47Å; Q690-W918 CarbonylContact O-C 3.38Å; Q690-W918 WeakPolarHBondContact O-CA 3.31Å; Q690-W918 WeakPolarHBondContact O-CB 3.01Å; F693-W918 HydrophobicContact CB-CB 4.18Å; F693-W918 HydrophobicContact CB-CD2 4.25Å; F693-W918 HydrophobicContact CB-CE3 4.17Å; F693-W918 HydrophobicContact CB-CG 4.27Å; F693-W918 HydrophobicContact CD2-CB 4.02Å; F693-W918 AromaticContact CD2-CD1 3.62Å; F693-W918 AromaticContact CD2-CD2 3.83Å; F693-W918 HydrophobicContact CD2-CD2 3.83Å; F693-W918 AromaticContact CD2-CG 3.55Å; F693-W918 HydrophobicContact CD2-CG 3.55Å; F693-W918 AromaticContact CD2-NE1 3.91Å; F693-W918 HydrophobicContact CE2-CG 4.41Å; F693-W918 HydrophobicContact CG-CG 4.39Å; L700-W918 HydrophobicContact CD1-CH2 3.7Å; L700-W918 HydrophobicContact CD1-CZ3 4.43Å; L700-W918 HydrophobicContact CD2-CH2 3.95Å; L700-W918 HydrophobicContact CD2-CZ3 3.93Å; S909-W918 CarbonylContact C-O 3.59Å; S909-W918 WeakPolarHBondContact CA-O 3.36Å; S909-W918 VanDerWaalsContact CB-O 3.29Å; S909-W918 WeakPolarHBondContact CB-O 3.26Å; V910-W918 HydrophobicContact CG2-CB 3.65Å; V910-W918 HydrophobicContact CG2-CG 4.28Å; V910-W918 PolarHBondContact N-O 3.44Å; V910-W918 WeakPolarHBondContact O-CB 3.47Å; V910-W918 PolarHBondContact O-N 3.37Å; D912-W918 PolarHBondContact OD2-NE1 3.26Å; I916-W918 HydrophobicContact CB-CZ2 4.34Å; I916-W918 HydrophobicContact CD1-CZ2 4.37Å; I916-W918 HydrophobicContact CG2-CD2 4.31Å; I916-W918 HydrophobicContact CG2-CZ2 3.89Å; I916-W918 PolarHBondContact O-NE1 3.41Å; W918-T920 PolarHBondContact O-N 3.12Å
919	K	91.3	Very high	90.2	Very high	108 Å²	108	51.2 Å²	51.2	47%	0.47	28%	0.278	S	S	.	.			trans	-78.9	51.1	-179.9	-60.1	176.9	-179	172.6	0	111.3	D687 Q690	D687-K919 IonicContact OD1-NZ 3.84Å; D687-K919 PolarHBondContact OD1-NZ 3.44Å; Q690-K919 HydrophobicContact CB-CB 4.46Å; Q690-K919 HydrophobicContact CB-CD 4.48Å; Q690-K919 HydrophobicContact CB-CG 4.26Å; Q690-K919 PolarHBondContact O-N 3.45Å
920	T	81.9	Confident	90	Very high	44 Å²	44	50.9 Å²	50.9	27%	0.27	28%	0.276	S	S	.	.			trans	-105	-9.4	-173.6	-52.2	0	0	0	0	113.4	Q690 A691 F693 W918	Q690-T920 PolarHBondContact O-OG1 3.25Å; A691-T920 PolarHBondContact O-OG1 3.05Å; F693-T920 HydrophobicContact CB-CG2 4Å; F693-T920 VanDerWaalsContact CB-OG1 3.28Å; F693-T920 WeakPolarHBondContact CB-OG1 3.46Å; W918-T920 PolarHBondContact O-N 3.12Å
921	G	80.5	Confident	89.6	Confident	18 Å²	18	54.1 Å²	54.1	19%	0.186	29%	0.292	C	S	.	.	S	Bend	trans	-79	160.4	179.4	0	0	0	0	0	112.8	S908	S908-G921 CarbonylContact O-C 3.6Å; S908-G921 WeakPolarHBondContact O-CA 3.11Å; S908-G921 PolarHBondContact O-N 3.14Å; S908-G921 VanDerWaalsContact O-N 3.09Å; S908-G921 VanDerWaalsContact OG-CA 3.26Å; S908-G921 WeakPolarHBondContact OG-CA 3.34Å
922	P	88	Confident	89.1	Confident	41 Å²	41	53.3 Å²	53.3	27%	0.266	29%	0.289	S	S	.	.			trans	-63.2	152.3	177.3	29.4	-39.9	0	0	0	112.1	I804 L806 S908	I804-P922 HydrophobicContact CB-CG 4.47Å; I804-P922 HydrophobicContact CG2-CG 4.35Å; I804-P922 WeakPolarHBondContact O-CD 3.39Å; I804-P922 VanDerWaalsContact O-CG 3.24Å; I804-P922 WeakPolarHBondContact O-CG 3.33Å; L806-P922 HydrophobicContact CB-CG 4.46Å; L806-P922 HydrophobicContact CD1-CG 3.91Å; L806-P922 HydrophobicContact CG-CG 3.79Å; S908-P922 PolarHBondContact N-O 3.43Å; S908-P922 VanDerWaalsContact N-O 3.15Å; S908-P922 WeakPolarHBondContact OG-CD 3.33Å; S908-P922 PolarHBondContact OG-O 3.1Å
923	R	90.2	Very high	88.6	Confident	165 Å²	165	54.1 Å²	54.1	62%	0.623	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105	117.1	165	179.5	174.1	-177.1	164.5	9.2	108.4	T905 V906 E907	T905-R923 HydrophobicContact CG2-CG 3.51Å; V906-R923 CarbonylContact O-C 3.43Å; V906-R923 WeakPolarHBondContact O-CA 3.25Å; E907-R923 HydrophobicContact CG-CB 4.03Å; E907-R923 HydrophobicContact CG-CG 3.72Å; E907-R923 VanDerWaalsContact OE1-CD 3.22Å; E907-R923 WeakPolarHBondContact OE1-CD 3.27Å; E907-R923 IonicContact OE1-CZ 3.23Å; E907-R923 IonicContact OE1-NE 3.84Å; E907-R923 PolarHBondContact OE1-NE 3.44Å; E907-R923 VanDerWaalsContact OE1-NE 3.15Å; E907-R923 IonicContact OE1-NH1 2.78Å; E907-R923 PolarHBondContact OE1-NH1 3.36Å; E907-R923 IonicContact OE1-NH2 3.55Å
924	T	90	Very high	88	Confident	46 Å²	46	53.7 Å²	53.7	28%	0.282	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	132.7	-178.6	-51.4	0	0	0	0	109.7	L808 V906	L808-T924 HydrophobicContact CD1-CG2 3.6Å; L808-T924 HydrophobicContact CG-CG2 4.35Å; V906-T924 PolarHBondContact N-O 3.31Å; V906-T924 PolarHBondContact O-N 3.07Å
925	T	89.4	Confident	87.3	Confident	63 Å²	63	54.5 Å²	54.5	39%	0.387	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	136.6	-178.9	-53.8	0	0	0	0	110.7	N903 I904	N903-T925 HydrophobicContact CB-CG2 4.29Å; I904-T925 CarbonylContact O-C 3.52Å; I904-T925 VanDerWaalsContact O-CA 3.26Å; I904-T925 WeakPolarHBondContact O-CA 3.37Å; I904-T925 WeakPolarHBondContact O-CG2 3.44Å
926	I	89.9	Confident	86.7	Confident	14 Å²	14	55.4 Å²	55.4	7%	0.072	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	152.9	170.6	63.9	173.3	0	0	0	110.5	L808 L829 I904	L808-I926 HydrophobicContact CD1-CG2 3.68Å; L829-I926 HydrophobicContact CD1-CD1 3.64Å; I904-I926 HydrophobicContact CB-CD1 4.43Å; I904-I926 HydrophobicContact CB-CG1 3.78Å; I904-I926 HydrophobicContact CD1-CD1 4.04Å; I904-I926 HydrophobicContact CD1-CG1 4.07Å; I904-I926 HydrophobicContact CG1-CG1 4.44Å; I904-I926 HydrophobicContact CG2-CG1 4.38Å; I904-I926 PolarHBondContact N-O 3.45Å; I904-I926 PolarHBondContact O-N 2.83Å
927	F	89.8	Confident	85.8	Confident	56 Å²	56	57.3 Å²	57.3	25%	0.246	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	136.5	-179.1	-56.1	-70.7	0	0	0	110.8	P818 I819 N903	P818-F927 CarbonylContact C-O 3.52Å; P818-F927 VanDerWaalsContact CA-O 3.31Å; P818-F927 WeakPolarHBondContact CA-O 3.37Å; P818-F927 HydrophobicContact CB-CB 3.92Å; I819-F927 PolarHBondContact N-O 2.88Å; N903-F927 WeakPolarHBondContact OD1-CD1 3.46Å; N903-F927 WeakPolarHBondContact OD1-CE1 3.48Å
928	V	89.9	Confident	85	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	135	175.9	172.8	0	0	0	0	109	I819 V821 L827 F896 T901 H902 I904	I819-V928 HydrophobicContact CB-CG2 4.28Å; I819-V928 CarbonylContact O-C 3.54Å; I819-V928 WeakPolarHBondContact O-CA 3.45Å; V821-V928 HydrophobicContact CB-CG1 4.14Å; V821-V928 HydrophobicContact CG2-CG1 3.75Å; L827-V928 HydrophobicContact CD2-CG2 3.71Å; F896-V928 HydrophobicContact CD1-CG1 4.46Å; F896-V928 HydrophobicContact CD2-CG1 4.08Å; F896-V928 HydrophobicContact CE1-CG1 4.38Å; F896-V928 HydrophobicContact CE2-CG1 3.98Å; F896-V928 HydrophobicContact CG-CG1 4.35Å; F896-V928 HydrophobicContact CZ-CB 4.4Å; F896-V928 HydrophobicContact CZ-CG1 4.18Å; T901-V928 CarbonylContact C-O 3.09Å; T901-V928 WeakPolarHBondContact CA-O 3.48Å; H902-V928 PolarHBondContact N-O 2.93Å; H902-V928 PolarHBondContact O-N 3.31Å; I904-V928 HydrophobicContact CD1-CB 4.15Å; I904-V928 HydrophobicContact CD1-CG2 3.32Å; I904-V928 HydrophobicContact CG1-CG2 4.26Å
929	K	90.1	Very high	84.1	Confident	96 Å²	96	63.1 Å²	63.1	42%	0.417	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	110.9	174.7	-171.8	174.8	-177.3	179.4	0	108.8	P818 I819 V821 G900 L931	P818-K929 HydrophobicContact CB-CB 3.87Å; P818-K929 HydrophobicContact CG-CB 4.04Å; I819-K929 PolarHBondContact O-N 3.45Å; V821-K929 PolarHBondContact N-O 2.91Å; G900-K929 WeakPolarHBondContact O-CA 3.29Å; K929-L931 HydrophobicContact CD-CD2 3.95Å; K929-L931 HydrophobicContact CG-CD2 3.89Å; K929-L931 HydrophobicContact CG-CG 4.48Å; K929-L931 PolarHBondContact O-N 2.82Å
930	S	88.9	Confident	83.4	Confident	3 Å²	3	63.4 Å²	63.4	2%	0.021	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	118.4	171.4	-173.9	0	0	0	0	109.3	V821 N823 F896 I898 G900	V821-S930 WeakPolarHBondContact O-CA 3.15Å; N823-S930 WeakPolarHBondContact CB-OG 3.47Å; F896-S930 PolarHBondContact O-OG 3.07Å; I898-S930 WeakPolarHBondContact O-CB 3.41Å; I898-S930 PolarHBondContact O-OG 2.83Å; G900-S930 PolarHBondContact N-O 2.97Å; G900-S930 VanDerWaalsContact N-O 3.17Å; G900-S930 PolarHBondContact O-N 3.1Å
931	L	86.9	Confident	83	Confident	72 Å²	72	65.3 Å²	65.3	38%	0.377	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	150.5	179.3	-61	177.6	0	0	0	109.9	A820 V821 N823 L899 K929 D933	A820-L931 HydrophobicContact CB-CD1 3.94Å; V821-L931 PolarHBondContact O-N 3.13Å; N823-L931 WeakPolarHBondContact CB-O 3.29Å; N823-L931 PolarHBondContact N-O 3.43Å; L899-L931 VanDerWaalsContact CD2-C 3.43Å; K929-L931 HydrophobicContact CD-CD2 3.95Å; K929-L931 HydrophobicContact CG-CD2 3.89Å; K929-L931 HydrophobicContact CG-CG 4.48Å; K929-L931 PolarHBondContact O-N 2.82Å; L931-D933 PolarHBondContact O-N 3.35Å
932	E	83.1	Confident	82.7	Confident	34 Å²	34	70.5 Å²	70.5	16%	0.159	34%	0.338	C	S	.	.			trans	-66.5	136.7	173.8	-169.7	173	-178.5	0	0	110	L899 Q937 R940	L899-E932 HydrophobicContact CD1-CB 4.03Å; L899-E932 HydrophobicContact CD1-CG 4.43Å; L899-E932 HydrophobicContact CD2-CB 4.06Å; L899-E932 VanDerWaalsContact CD2-N 3.33Å; E932-Q937 HydrophobicContact CG-CB 4.43Å; E932-R940 IonicContact OE1-CZ 3.85Å; E932-R940 IonicContact OE1-NE 2.72Å; E932-R940 PolarHBondContact OE1-NE 2.95Å; E932-R940 IonicContact OE1-NH1 2.77Å; E932-R940 IonicContact OE1-NH2 3.2Å; E932-R940 PolarHBondContact OE1-NH2 2.94Å; E932-R940 IonicContact OE2-CZ 3.78Å; E932-R940 IonicContact OE2-NE 3.65Å; E932-R940 IonicContact OE2-NH1 3.16Å; E932-R940 PolarHBondContact OE2-NH1 3.36Å; E932-R940 IonicContact OE2-NH2 2.97Å; E932-R940 PolarHBondContact OE2-NH2 3.05Å
933	D	82	Confident	81.7	Confident	21 Å²	21	74.3 Å²	74.3	11%	0.112	35%	0.353	C	S	.	.			trans	-54.9	130.3	172.7	168.8	66.5	0	0	0	111.5	N823 N824 L931 Y935 S936 Q937	N823-D933 WeakPolarHBondContact OD1-CB 3.35Å; N823-D933 PolarHBondContact OD1-N 2.99Å; N823-D933 VanDerWaalsContact OD1-N 3.1Å; N824-D933 PolarHBondContact ND2-OD1 2.9Å; L931-D933 PolarHBondContact O-N 3.35Å; D933-Y935 PolarHBondContact O-N 3.2Å; D933-Y935 VanDerWaalsContact O-N 3.17Å; D933-Y935 WeakPolarHBondContact OD2-CB 3.49Å; D933-Y935 PolarHBondContact OD2-N 3.12Å; D933-S936 WeakPolarHBondContact O-CB 3.11Å; D933-S936 PolarHBondContact O-N 3.06Å; D933-S936 PolarHBondContact OD2-N 3.12Å; D933-S936 PolarHBondContact OD2-OG 3.34Å; D933-Q937 PolarHBondContact O-N 3.36Å
934	P	77	Confident	80.6	Confident	61 Å²	61	71.7 Å²	71.7	40%	0.396	35%	0.347	S	S	.	.	H	α-helix	trans	-57.2	-33.1	-175.7	-27.3	34.4	0	0	0	114.4	Q937 Q938	P934-Q937 PolarHBondContact O-N 3.21Å; P934-Q938 WeakPolarHBondContact O-CB 3.4Å; P934-Q938 WeakPolarHBondContact O-CG 3.32Å; P934-Q938 PolarHBondContact O-N 3.09Å
935	Y	76.2	Confident	79.3	Confident	158 Å²	158	75.7 Å²	75.7	62%	0.62	36%	0.363	S	S	*	.	H	α-helix	trans	-71.1	-42.6	177.8	-178.6	-102	0	0	0	111	D933 Q937 Q938 I939	D933-Y935 PolarHBondContact O-N 3.2Å; D933-Y935 VanDerWaalsContact O-N 3.17Å; D933-Y935 WeakPolarHBondContact OD2-CB 3.49Å; D933-Y935 PolarHBondContact OD2-N 3.12Å; Y935-Q937 VanDerWaalsContact C-N 3.32Å; Y935-Q937 PolarHBondContact O-N 3.26Å; Y935-Q938 PolarHBondContact O-N 3.15Å; Y935-I939 HydrophobicContact CD1-CD1 3.73Å; Y935-I939 HydrophobicContact CE1-CD1 3.31Å; Y935-I939 HydrophobicContact CE1-CG1 4.3Å; Y935-I939 WeakPolarHBondContact O-CG1 3.21Å; Y935-I939 PolarHBondContact O-N 2.91Å
936	S	75.2	Confident	77.8	Confident	49 Å²	49	76 Å²	76	34%	0.343	37%	0.372	S	S	.	.	H	α-helix	trans	-61.2	-40.6	172.8	-55.4	0	0	0	0	112	D933 I939 R940	D933-S936 WeakPolarHBondContact O-CB 3.11Å; D933-S936 PolarHBondContact O-N 3.06Å; D933-S936 PolarHBondContact OD2-N 3.12Å; D933-S936 PolarHBondContact OD2-OG 3.34Å; S936-I939 PolarHBondContact O-N 3.46Å; S936-R940 PolarHBondContact O-N 3.35Å
937	Q	74.9	Confident	76.1	Confident	100 Å²	100	81.8 Å²	81.8	47%	0.467	40%	0.398	S	S	.	.	H	α-helix	trans	-64.9	-41.3	175.2	-165.2	179.7	12.9	0	0	111.9	E932 D933 P934 Y935 R940 L941	E932-Q937 HydrophobicContact CG-CB 4.43Å; D933-Q937 PolarHBondContact O-N 3.36Å; P934-Q937 PolarHBondContact O-N 3.21Å; Y935-Q937 VanDerWaalsContact C-N 3.32Å; Y935-Q937 PolarHBondContact O-N 3.26Å; Q937-R940 PolarHBondContact O-N 2.99Å; Q937-L941 HydrophobicContact CG-CD1 4.29Å; Q937-L941 WeakPolarHBondContact O-CB 3.43Å; Q937-L941 VanDerWaalsContact O-CG 3.31Å; Q937-L941 WeakPolarHBondContact O-CG 3.47Å; Q937-L941 PolarHBondContact O-N 3.23Å
938	Q	74.9	Confident	74.3	Confident	116 Å²	116	85.4 Å²	85.4	54%	0.542	42%	0.416	S	S	.	.	H	α-helix	trans	-63.9	-42.1	174.4	-80.7	-179.7	-4.3	0	0	112.4	P934 Y935 R940 L941 Q942	P934-Q938 WeakPolarHBondContact O-CB 3.4Å; P934-Q938 WeakPolarHBondContact O-CG 3.32Å; P934-Q938 PolarHBondContact O-N 3.09Å; Y935-Q938 PolarHBondContact O-N 3.15Å; Q938-R940 VanDerWaalsContact C-N 3.33Å; Q938-R940 PolarHBondContact O-N 3.36Å; Q938-L941 PolarHBondContact O-N 3.45Å; Q938-Q942 WeakPolarHBondContact O-CB 3.13Å; Q938-Q942 WeakPolarHBondContact O-CG 3.36Å; Q938-Q942 PolarHBondContact O-N 3.36Å
939	I	75.4	Confident	72.5	Confident	60 Å²	60	89.3 Å²	89.3	31%	0.308	44%	0.441	S	S	.	.	H	α-helix	trans	-61	-44.7	175	-71.9	171.3	0	0	0	110.3	Y935 S936 L941 Q942 Q943	Y935-I939 HydrophobicContact CD1-CD1 3.73Å; Y935-I939 HydrophobicContact CE1-CD1 3.31Å; Y935-I939 HydrophobicContact CE1-CG1 4.3Å; Y935-I939 WeakPolarHBondContact O-CG1 3.21Å; Y935-I939 PolarHBondContact O-N 2.91Å; S936-I939 PolarHBondContact O-N 3.46Å; I939-L941 PolarHBondContact O-N 3.03Å; I939-Q942 PolarHBondContact O-N 3.25Å; I939-Q943 HydrophobicContact CG2-CG 4.43Å; I939-Q943 WeakPolarHBondContact O-CB 3.35Å; I939-Q943 WeakPolarHBondContact O-CG 3.49Å; I939-Q943 PolarHBondContact O-N 3.16Å
940	R	77	Confident	70.5	Confident	114 Å²	114	90.2 Å²	90.2	43%	0.43	45%	0.45	S	S	.	.	H	α-helix	trans	-62.7	-42.5	177.9	-168.6	-172.2	-64.5	167.5	-1.4	111.8	E932 S936 Q937 Q938 Q943 Q944	E932-R940 IonicContact OE1-CZ 3.85Å; E932-R940 IonicContact OE1-NE 2.72Å; E932-R940 PolarHBondContact OE1-NE 2.95Å; E932-R940 IonicContact OE1-NH1 2.77Å; E932-R940 IonicContact OE1-NH2 3.2Å; E932-R940 PolarHBondContact OE1-NH2 2.94Å; E932-R940 IonicContact OE2-CZ 3.78Å; E932-R940 IonicContact OE2-NE 3.65Å; E932-R940 IonicContact OE2-NH1 3.16Å; E932-R940 PolarHBondContact OE2-NH1 3.36Å; E932-R940 IonicContact OE2-NH2 2.97Å; E932-R940 PolarHBondContact OE2-NH2 3.05Å; S936-R940 PolarHBondContact O-N 3.35Å; Q937-R940 PolarHBondContact O-N 2.99Å; Q938-R940 VanDerWaalsContact C-N 3.33Å; Q938-R940 PolarHBondContact O-N 3.36Å; R940-Q943 PolarHBondContact O-N 3.32Å; R940-Q944 WeakPolarHBondContact O-CB 3.49Å; R940-Q944 WeakPolarHBondContact O-CG 3.49Å; R940-Q944 PolarHBondContact O-N 3Å
941	L	74.4	Confident	68.5	Low	84 Å²	84	97 Å²	97	44%	0.44	48%	0.481	S	S	.	.	H	α-helix	trans	-67.2	-38.2	176.5	-72.8	167.6	0	0	0	112.1	Q937 Q938 I939 Q944 Q945	Q937-L941 HydrophobicContact CG-CD1 4.29Å; Q937-L941 WeakPolarHBondContact O-CB 3.43Å; Q937-L941 VanDerWaalsContact O-CG 3.31Å; Q937-L941 WeakPolarHBondContact O-CG 3.47Å; Q937-L941 PolarHBondContact O-N 3.23Å; Q938-L941 PolarHBondContact O-N 3.45Å; I939-L941 PolarHBondContact O-N 3.03Å; L941-Q944 PolarHBondContact O-N 3.01Å; L941-Q945 WeakPolarHBondContact O-CB 3.11Å; L941-Q945 WeakPolarHBondContact O-CG 3.42Å; L941-Q945 PolarHBondContact O-N 2.76Å
942	Q	72.8	Confident	66.6	Low	127 Å²	127	100.7 Å²	100.7	59%	0.593	50%	0.497	S	S	*	.	H	α-helix	trans	-65.8	-40	172.9	-80.7	-178.4	3.1	0	0	111.9	Q938 I939 Q945 A946	Q938-Q942 WeakPolarHBondContact O-CB 3.13Å; Q938-Q942 WeakPolarHBondContact O-CG 3.36Å; Q938-Q942 PolarHBondContact O-N 3.36Å; I939-Q942 PolarHBondContact O-N 3.25Å; Q942-Q945 PolarHBondContact O-N 3.21Å; Q942-A946 WeakPolarHBondContact O-CB 3.34Å; Q942-A946 PolarHBondContact O-N 2.68Å
943	Q	68.5	Low	64.9	Low	122 Å²	122	105.5 Å²	105.5	57%	0.57	52%	0.519	S	S	*	.	H	α-helix	trans	-66.5	-38.1	174.3	-74.9	178.8	4.1	0	0	111.9	I939 R940 A946 Q947	I939-Q943 HydrophobicContact CG2-CG 4.43Å; I939-Q943 WeakPolarHBondContact O-CB 3.35Å; I939-Q943 WeakPolarHBondContact O-CG 3.49Å; I939-Q943 PolarHBondContact O-N 3.16Å; R940-Q943 PolarHBondContact O-N 3.32Å; Q943-A946 PolarHBondContact O-N 2.62Å; Q943-Q947 WeakPolarHBondContact O-CG 3.49Å; Q943-Q947 PolarHBondContact O-N 3.36Å
944	Q	65.9	Low	63.3	Low	109 Å²	109	111.7 Å²	111.7	51%	0.509	55%	0.548	S	S	.	.	H	α-helix	trans	-69.3	-37.7	174.2	-77.6	179.2	-4.7	0	0	112.5	R940 L941 Q947 Q948	R940-Q944 WeakPolarHBondContact O-CB 3.49Å; R940-Q944 WeakPolarHBondContact O-CG 3.49Å; R940-Q944 PolarHBondContact O-N 3Å; L941-Q944 PolarHBondContact O-N 3.01Å; Q944-Q947 PolarHBondContact O-N 2.95Å; Q944-Q948 PolarHBondContact O-N 3.47Å
945	Q	62.2	Low	61.8	Low	131 Å²	131	116.1 Å²	116.1	61%	0.612	56%	0.563	S	S	*	*	H	α-helix	trans	-71.4	-33.9	173.7	-78.2	179.8	-8.3	0	0	112.4	L941 Q942 Q947 Q948 P949	L941-Q945 WeakPolarHBondContact O-CB 3.11Å; L941-Q945 WeakPolarHBondContact O-CG 3.42Å; L941-Q945 PolarHBondContact O-N 2.76Å; Q942-Q945 PolarHBondContact O-N 3.21Å; Q945-Q947 PolarHBondContact O-N 2.9Å; Q945-Q948 PolarHBondContact O-N 3.3Å; Q945-P949 WeakPolarHBondContact O-CD 3.31Å
946	A	57.9	Low	60.3	Low	69 Å²	69	118.4 Å²	118.4	57%	0.57	57%	0.57	S	S	*	*	H	α-helix	trans	-69.4	-17.7	173.5	0	0	0	0	0	113.1	Q942 Q943 P949	Q942-A946 WeakPolarHBondContact O-CB 3.34Å; Q942-A946 PolarHBondContact O-N 2.68Å; Q943-A946 PolarHBondContact O-N 2.62Å; A946-P949 WeakPolarHBondContact O-CD 2.85Å
947	Q	55	Low	58.9	Low	135 Å²	135	122.6 Å²	122.6	63%	0.631	59%	0.589	S	S	*	*	H	α-helix	trans	-86.7	-15.3	172.2	-76.2	177.5	-3.8	0	0	113.8	Q943 Q944 Q945 L950	Q943-Q947 WeakPolarHBondContact O-CG 3.49Å; Q943-Q947 PolarHBondContact O-N 3.36Å; Q944-Q947 PolarHBondContact O-N 2.95Å; Q945-Q947 PolarHBondContact O-N 2.9Å; Q947-L950 PolarHBondContact O-N 3.09Å
948	Q	51.9	Low	57.7	Low	133 Å²	133	121.6 Å²	121.6	62%	0.621	60%	0.598	S	S	*	*	H	α-helix	trans	-68.3	-30.6	178.9	-78.1	-176	-9.9	0	0	115.9	Q944 Q945 L950 Q951	Q944-Q948 PolarHBondContact O-N 3.47Å; Q945-Q948 PolarHBondContact O-N 3.3Å; Q948-L950 PolarHBondContact O-N 2.99Å; Q948-Q951 PolarHBondContact O-N 3.02Å
949	P	51.7	Low	56.5	Low	81 Å²	81	126.3 Å²	126.3	53%	0.526	61%	0.612	S	S	.	*	H	α-helix	trans	-67.6	-22.8	177.3	-17.5	30.1	0	0	0	113.6	Q945 A946 Q953	Q945-P949 WeakPolarHBondContact O-CD 3.31Å; A946-P949 WeakPolarHBondContact O-CD 2.85Å; P949-Q953 PolarHBondContact O-N 3.04Å
950	L	49.3	Very low	55.1	Low	115 Å²	115	129 Å²	129	60%	0.602	63%	0.632	S	S	*	*	H	α-helix	trans	-75.2	-21.7	-179.2	-88.1	142.8	0	0	0	113.4	Q947 Q948	Q947-L950 PolarHBondContact O-N 3.09Å; Q948-L950 PolarHBondContact O-N 2.99Å
951	Q	47.1	Very low	53.5	Low	146 Å²	146	135.1 Å²	135.1	68%	0.682	66%	0.655	S	S	*	*	H	α-helix	trans	-83.5	-29.9	174.6	-84.5	-179.1	-5.1	0	0	113.4	Q948 Q955	Q948-Q951 PolarHBondContact O-N 3.02Å; Q951-Q955 PolarHBondContact O-N 3.44Å
952	Q	46.6	Very low	51.8	Low	150 Å²	150	144.8 Å²	144.8	70%	0.701	69%	0.694	S	S	*	*	H	α-helix	trans	-77.1	-24.9	174.1	-82.7	-176.3	0.1	0	0	113.3	R956	Q952-R956 PolarHBondContact O-N 3.29Å
953	Q	47	Very low	50.8	Low	135 Å²	135	145.7 Å²	145.7	63%	0.631	70%	0.699	S	S	*	*	H	α-helix	trans	-77.5	-23.7	173.9	-122.7	173.2	3.1	0	0	113.2	P949	P949-Q953 PolarHBondContact O-N 3.04Å
954	Q	48.4	Very low	49.9	Very low	151 Å²	151	146.9 Å²	146.9	71%	0.706	71%	0.705	S	S	*	*	H	α-helix	trans	-78.5	-25.2	172	-82.8	-177.9	-13.1	0	0	113.6
955	Q	45.6	Very low	49	Very low	153 Å²	153	149 Å²	149	72%	0.715	72%	0.716	S	S	*	*	H	α-helix	trans	-80	-25.2	174	-85.3	-178.4	-12.7	0	0	114.1	Q951	Q951-Q955 PolarHBondContact O-N 3.44Å
956	R	45.4	Very low	48.2	Very low	206 Å²	206	150.1 Å²	150.1	78%	0.777	72%	0.722	S	S	*	*	H	α-helix	trans	-78.9	-22.6	176.8	-98.1	-177.8	174.8	176.5	-0.6	114.7	Q952 A958	Q952-R956 PolarHBondContact O-N 3.29Å; R956-A958 VanDerWaalsContact C-N 3.32Å; R956-A958 PolarHBondContact O-N 2.72Å
957	N	45.5	Very low	47.6	Very low	137 Å²	137	155.1 Å²	155.1	73%	0.733	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-2.5	179	-78.7	-16.7	0	0	0	114.4
958	A	49.7	Very low	47.1	Very low	79 Å²	79	156.5 Å²	156.5	65%	0.653	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-9.5	176.9	0	0	0	0	0	114.3	R956	R956-A958 VanDerWaalsContact C-N 3.32Å; R956-A958 PolarHBondContact O-N 2.72Å
959	Y	48.8	Very low	46.7	Very low	215 Å²	215	158.1 Å²	158.1	84%	0.843	75%	0.747	S	S	*	*	S	Bend	trans	-110	8.1	-174	-83.9	-79.9	0	0	0	115.8
960	T	46.2	Very low	46.4	Very low	117 Å²	117	164.1 Å²	164.1	72%	0.718	76%	0.764	S	S	*	*			trans	-124.4	52.1	-179.1	-0.9	0	0	0	0	113
961	R	43.7	Very low	46.1	Very low	243 Å²	243	168.2 Å²	168.2	92%	0.917	78%	0.777	S	S	*	*			trans	-139.6	82.4	155.4	-79.9	-168.6	-178.5	175.6	0.4	109.5
962	F	39.5	Very low	46	Very low	286 Å²	286	170.2 Å²	170.2	100%	1.254	79%	0.786	S	S	*	*			trans	-115.4	0	139.1	-101	-78.6	0	0	0	106.8

Retrieved 962 of 962 residues in 1968 ms (Link to these results)

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