A0A077ZE81_TRITR Loading...

Inositol polyphosphate 5 phosphatase

AlphaFold DB , UniProt , Accession A0A077ZE81, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,099 aa.

						>A0A077ZE81_TRITR|A0A077ZE81
MALFASYLDAAETERSDSPSLLNLSQPASSSWLSNVSFQPVVAEAVEKRKLSRNEKKRLSRKKKKEKEKKEERKRKEDRKARAPSSAFPRKARFHFVPDCRSGAEFAEDKFYDIENLIYDSFYSKETASYTYLSGIVHCLGCSAQAHSLCAVIHSGKYWSDILSKRYFKRKKKKGSSALVNCQYNEQAPNVDEKVILEDFVPVETTITDESGAKCKYDFALKMYRPIDSDSNENPSVDLADYSGNVMFAGAIQNAEHRHLSQELNSSPDNVKLWLRLLALEDELYDLSQTKAFRSQSVSRMAFLERKQSIVDKAIQSCPRIVELHLARLEILREMSWSKADLQKEWRALEFTFVNRSEIWIERLRHNLLAFRDFTVAQQLSIFDSSLEKSFVVLSGQLVTHRPLADTAVHLMNCLLGKIVFLRESGHYERAVRTVQALLELMFSVPGSGVDTPSLSAKRQMLEARWADTFLHFGEFGWKSWSKAAGCEEDLPKSSPFSENVTKHLDDQARQEEDTLCSESVNLSLKDFWQKLEHSREKFHWFPFPESEEAECEDTERVVLFEDIEPGLYDLSTPVEKCWFLVEALKALRLASFPPFQSSNRQDWYEERDIDYYLDEFTSLPRPHVPWQSMSSKEEVFTLFCDHSCQFLPAFPWSLYLSSSQIFSKSRSLLRNNDLSSKGRLKVFRTYCKSIMSDCKLRNSVLLYAVYIQSLASLEAREEARQTAYSILTTLDSRWYSQPYGSPEQIAPLMLASSYAKFCFEAVESPSFYEDALRVLACFLSDGKVSASCGQPSVEEIRDLKNALSSRMELQFEQLYTADLQDSSDWYFRLGWLGSPYVMLLHILALLTYATEGIRSCFDIYRRGREKVRSVVGALQLDQKSQSRHIWALDREVERLWEWEIDLLRLNMLNKKRKYDLPPSVLLNSVSDALKEFPNHVGFLRLFCSVQLKNSLMVQLRRSLGVTQSKCSVARFVAAIFAEFCYFVKLRDTEMCHADPSLLYNVFDLAANAQQHSVVLWRLRLAFEGLLCQSGVDKRQDVAYRALQSCPWSKSLFDDAVQCFPAEKTQVVVDLMVEKGLRLRVPWEELLLLSKASAQQESD
					

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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	25.2	Very low	32.6	Very low	253 Å²	253	143.5 Å²	143.5	100%	1.246	82%	0.821	S	S	*	*				0	44.8	0	-83	-93.2	-130.1	0	0	111.5
2	A	28.9	Very low	32.5	Very low	98 Å²	98	146.2 Å²	146.2	81%	0.81	82%	0.821	S	S	*	*			trans	-165	47.6	173.3	0	0	0	0	0	111.9
3	L	27.8	Very low	32.2	Very low	154 Å²	154	144.4 Å²	144.4	81%	0.806	82%	0.816	S	S	*	*			trans	-136	27.3	-178.9	-94.9	169.3	0	0	0	113.2
4	F	35.7	Very low	32	Very low	200 Å²	200	147.6 Å²	147.6	88%	0.877	82%	0.821	S	S	*	*	S	Bend	trans	-129.1	17.8	-177.6	-84.2	-74.6	0	0	0	115
5	A	34.1	Very low	31.7	Very low	92 Å²	92	154.7 Å²	154.7	76%	0.76	83%	0.83	S	S	*	*	S	Bend	trans	-107.9	-2.9	177.2	0	0	0	0	0	115
6	S	33.5	Very low	31.4	Very low	98 Å²	98	151.5 Å²	151.5	69%	0.685	82%	0.823	S	S	*	*	S	Bend	trans	-113.4	13.8	-178.7	69.4	0	0	0	0	114.6
7	Y	32.4	Very low	31.3	Very low	211 Å²	211	152.5 Å²	152.5	83%	0.827	83%	0.828	S	S	*	*	S	Bend	trans	-99.7	-6.9	179.4	-143.5	-90	0	0	0	113.6
8	L	37	Very low	30.9	Very low	147 Å²	147	149.8 Å²	149.8	77%	0.77	82%	0.822	S	S	*	*	S	Bend	trans	-97.6	-30	179.7	-75.7	166.1	0	0	0	113.5	A10	L8-A10 PolarHBondContact O-N 3.14Å
9	D	36.1	Very low	30.9	Very low	151 Å²	151	148.7 Å²	148.7	81%	0.807	82%	0.823	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-2.3	-174.4	-69.8	-10.4	0	0	0	115.4
10	A	35.4	Very low	30.8	Very low	87 Å²	87	146.4 Å²	146.4	72%	0.719	82%	0.817	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.9	2.8	-179.6	0	0	0	0	0	114.4	L8	L8-A10 PolarHBondContact O-N 3.14Å
11	A	32.7	Very low	30.5	Very low	87 Å²	87	147.6 Å²	147.6	72%	0.719	82%	0.822	S	S	*	*	S	Bend	trans	-105.1	0.9	-178.8	0	0	0	0	0	114.2
12	E	31.5	Very low	30.6	Very low	176 Å²	176	142.9 Å²	142.9	82%	0.822	80%	0.8	S	S	*	*			trans	-108.2	64.9	175	-73.5	-169	167.3	0	0	112
13	T	28.8	Very low	30.4	Very low	123 Å²	123	146 Å²	146	76%	0.755	80%	0.803	S	S	*	*	S	Bend	trans	-149.9	122.8	152.5	36.9	0	0	0	0	108.8
14	E	28.7	Very low	30.3	Very low	189 Å²	189	145.8 Å²	145.8	88%	0.883	80%	0.803	S	S	*	*			trans	74.4	73.5	165.4	-56.4	-175.4	174.5	0	0	117.4
15	R	28.1	Very low	29.8	Very low	255 Å²	255	140.1 Å²	140.1	96%	0.962	79%	0.787	S	S	*	*			trans	-110	88.6	148.2	-84.3	-174.6	177.9	171.8	1.2	109.5
16	S	27.2	Very low	29.5	Very low	103 Å²	103	140.4 Å²	140.4	72%	0.72	77%	0.773	S	S	*	*			trans	-75.9	118.6	160.1	52.9	0	0	0	0	109.6	S18	S16-S18 PolarHBondContact O-N 3.35Å
17	D	28.2	Very low	29.3	Very low	168 Å²	168	137.6 Å²	137.6	90%	0.898	75%	0.753	S	S	*	*	S	Bend	trans	34	82	150.2	-58.7	-26.1	0	0	0	118.1
18	S	25.8	Very low	29.1	Very low	104 Å²	104	130.8 Å²	130.8	73%	0.727	74%	0.74	S	S	*	*			trans	-142.7	124.6	148.1	51	0	0	0	0	109.4	S16 S20	S16-S18 PolarHBondContact O-N 3.35Å; S18-S20 PolarHBondContact O-N 3.46Å
19	P	30.7	Very low	28.7	Very low	130 Å²	130	127 Å²	127	84%	0.844	73%	0.726	S	S	*	*			trans	-71.1	123.7	-170.5	28.7	-32.3	0	0	0	109.6	L21	P19-L21 PolarHBondContact O-N 3.38Å
20	S	28.6	Very low	28.3	Very low	101 Å²	101	122.4 Å²	122.4	71%	0.706	71%	0.706	S	S	*	*			trans	-48.3	117.7	175.5	49.3	0	0	0	0	111.7	S18 L22	S18-S20 PolarHBondContact O-N 3.46Å; S20-L22 PolarHBondContact O-N 3.35Å
21	L	24.3	Very low	27.9	Very low	173 Å²	173	121.9 Å²	121.9	91%	0.906	70%	0.697	S	S	*	*			trans	-54.4	99.8	164.7	-80.5	157.1	0	0	0	109.1	P19 N23	P19-L21 PolarHBondContact O-N 3.38Å; L21-N23 PolarHBondContact O-N 3.04Å
22	L	26.2	Very low	27.7	Very low	153 Å²	153	126.8 Å²	126.8	80%	0.801	70%	0.697	S	S	*	*			trans	-64.1	118.4	170.1	-79.3	158.2	0	0	0	108.5	S20 L24	S20-L22 PolarHBondContact O-N 3.35Å; L22-L24 PolarHBondContact O-N 3.39Å
23	N	25	Very low	27.4	Very low	163 Å²	163	124.9 Å²	124.9	87%	0.872	69%	0.691	S	S	*	*			trans	-50.1	109.4	170.9	-80.8	-38.2	0	0	0	109.6	L21 S25	L21-N23 PolarHBondContact O-N 3.04Å; N23-S25 PolarHBondContact O-N 3.1Å
24	L	26.1	Very low	27.3	Very low	151 Å²	151	122.6 Å²	122.6	79%	0.791	68%	0.68	S	S	*	*			trans	-66	94.6	174.8	-78.5	152.6	0	0	0	109.1	L22 Q26	L22-L24 PolarHBondContact O-N 3.39Å; L24-Q26 PolarHBondContact O-N 3.16Å
25	S	25.7	Very low	27.1	Very low	80 Å²	80	120.1 Å²	120.1	56%	0.559	67%	0.673	S	S	*	*			trans	-61.9	113.5	162.8	51.7	0	0	0	0	108.5	N23	N23-S25 PolarHBondContact O-N 3.1Å
26	Q	27	Very low	27.1	Very low	98 Å²	98	114 Å²	114	46%	0.458	66%	0.664	S	S	.	*			trans	-107	146.1	178.1	-79.7	-174.7	-14.5	0	0	110.5	L24	L24-Q26 PolarHBondContact O-N 3.16Å
27	P	30.7	Very low	27	Very low	40 Å²	40	114.2 Å²	114.2	26%	0.26	67%	0.666	S	S	.	*	P	Polyproline II helix	trans	-69.2	143.1	-155.8	27.9	-35.2	0	0	0	112.2	A279 E283 S965	P27-A279 HydrophobicContact CB-CB 4.38Å; P27-A279 HydrophobicContact CG-CB 3.9Å; P27-E283 HydrophobicContact CB-CG 4.1Å; P27-S965 WeakPolarHBondContact O-CB 3.12Å; P27-S965 PolarHBondContact O-OG 3.43Å
28	A	28.4	Very low	26.8	Very low	68 Å²	68	114.8 Å²	114.8	56%	0.562	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-70	137.5	173.3	0	0	0	0	0	109.5	D286	A28-D286 VanDerWaalsContact O-OD2 3.12Å
29	S	26.9	Very low	26.8	Very low	67 Å²	67	118.4 Å²	118.4	47%	0.469	67%	0.666	S	S	.	*	P	Polyproline II helix	trans	-89.2	124.9	167.8	50.4	0	0	0	0	108.8	S31	S29-S31 PolarHBondContact O-N 3.41Å
30	S	28.2	Very low	26.5	Very low	55 Å²	55	117.2 Å²	117.2	39%	0.385	66%	0.658	S	S	.	*	P	Polyproline II helix	trans	-63.9	124.5	-171.1	3.3	0	0	0	0	113	D286	S30-D286 WeakPolarHBondContact CB-OD1 3.41Å; S30-D286 PolarHBondContact OG-OD1 3.37Å; S30-D286 PolarHBondContact OG-OD2 3.44Å
31	S	27.8	Very low	26.5	Very low	76 Å²	76	118.9 Å²	118.9	53%	0.531	66%	0.663	S	S	.	*	S	Bend	trans	-59.8	131.9	167.3	66.7	0	0	0	0	110.8	S29	S29-S31 PolarHBondContact O-N 3.41Å
32	W	27.5	Very low	26.6	Very low	190 Å²	190	116.7 Å²	116.7	72%	0.72	66%	0.657	S	S	*	*			trans	130.3	22.5	152.5	84.6	-28.8	0	0	0	118.7	S34	W32-S34 PolarHBondContact O-N 3.04Å
33	L	25.2	Very low	26.7	Very low	135 Å²	135	113.7 Å²	113.7	71%	0.707	65%	0.654	S	S	*	*			trans	-68.4	70.4	160.5	-77.6	163.7	0	0	0	110.5
34	S	27.5	Very low	26.9	Very low	75 Å²	75	114 Å²	114	52%	0.524	65%	0.651	S	S	.	*			trans	-122.3	5.9	178.2	67.2	0	0	0	0	114.5	W32	W32-S34 PolarHBondContact O-N 3.04Å
35	N	25	Very low	27.1	Very low	137 Å²	137	111.8 Å²	111.8	73%	0.733	65%	0.654	S	S	*	*			trans	-146.1	63	179.6	-81.5	-44.8	0	0	0	113.8
36	V	27.2	Very low	27.5	Very low	128 Å²	128	113.9 Å²	113.9	78%	0.776	66%	0.663	S	S	*	*			trans	-106	61.3	160.5	-163.6	0	0	0	0	109.4
37	S	25.8	Very low	27.7	Very low	107 Å²	107	117.2 Å²	117.2	75%	0.748	68%	0.678	S	S	*	*			trans	-120.2	46	158	58.6	0	0	0	0	109.3
38	F	23.8	Very low	27.9	Very low	180 Å²	180	125 Å²	125	79%	0.789	71%	0.708	S	S	*	*			trans	-121.2	86.5	167	-146.9	-90.5	0	0	0	108.4	P40	F38-P40 WeakPolarHBondContact O-CD 3.45Å
39	Q	24.8	Very low	28.3	Very low	179 Å²	179	132.5 Å²	132.5	84%	0.836	72%	0.722	S	S	*	*			trans	-63.9	118.4	162	-74.9	-173.5	-21.9	0	0	107.2	V41	Q39-V41 PolarHBondContact O-N 3.29Å
40	P	25.5	Very low	29	Very low	106 Å²	106	139.4 Å²	139.4	69%	0.688	74%	0.743	S	S	*	*			trans	-67.4	106.5	171.6	27.7	-29.5	0	0	0	106.9	F38 V42	F38-P40 WeakPolarHBondContact O-CD 3.45Å; P40-V42 PolarHBondContact O-N 3.32Å
41	V	27.4	Very low	29.8	Very low	135 Å²	135	141.9 Å²	141.9	82%	0.818	75%	0.752	S	S	*	*			trans	-54.7	112.3	163.4	176.9	0	0	0	0	105.8	Q39 A43	Q39-V41 PolarHBondContact O-N 3.29Å; V41-A43 VanDerWaalsContact C-N 3.32Å; V41-A43 PolarHBondContact O-N 3.15Å
42	V	27.8	Very low	31	Very low	128 Å²	128	141.4 Å²	141.4	78%	0.776	75%	0.748	S	S	*	*			trans	-56.1	101.6	173.3	177.1	0	0	0	0	105.9	P40 E44	P40-V42 PolarHBondContact O-N 3.32Å; V42-E44 VanDerWaalsContact C-N 3.32Å; V42-E44 PolarHBondContact O-N 2.98Å
43	A	28	Very low	32.7	Very low	89 Å²	89	142.5 Å²	142.5	74%	0.736	75%	0.753	S	S	*	*			trans	-66.4	99.2	176.4	0	0	0	0	0	106.6	V41 A45	V41-A43 VanDerWaalsContact C-N 3.32Å; V41-A43 PolarHBondContact O-N 3.15Å; A43-A45 PolarHBondContact O-N 3.13Å
44	E	29.1	Very low	34.8	Very low	171 Å²	171	141.9 Å²	141.9	80%	0.799	75%	0.75	S	S	*	*			trans	-46	128.6	166.2	-75.7	-176.4	157.9	0	0	108	V42 V46	V42-E44 VanDerWaalsContact C-N 3.32Å; V42-E44 PolarHBondContact O-N 2.98Å; E44-V46 PolarHBondContact O-N 3.17Å
45	A	30	Very low	36.5	Very low	103 Å²	103	142.9 Å²	142.9	85%	0.851	75%	0.746	S	S	*	*			trans	-65.4	81.7	-176.7	0	0	0	0	0	109.9	A43 E47	A43-A45 PolarHBondContact O-N 3.13Å; A45-E47 PolarHBondContact O-N 3.33Å
46	V	33.1	Very low	38.2	Very low	124 Å²	124	143.3 Å²	143.3	75%	0.752	74%	0.742	S	S	*	*			trans	-69.6	104.4	171.9	179.5	0	0	0	0	107.1	E44 K48	E44-V46 PolarHBondContact O-N 3.17Å; V46-K48 PolarHBondContact O-N 3.06Å
47	E	33	Very low	40.1	Very low	168 Å²	168	143.9 Å²	143.9	79%	0.785	73%	0.734	S	S	*	*			trans	-46.5	113.8	170.7	-84	-169.7	143.4	0	0	110.2	A45 R49	A45-E47 PolarHBondContact O-N 3.33Å; E47-R49 VanDerWaalsContact C-N 3.29Å; E47-R49 PolarHBondContact O-N 2.95Å
48	K	33.6	Very low	42.3	Very low	204 Å²	204	148.5 Å²	148.5	89%	0.887	74%	0.735	S	S	*	*			trans	-67.3	83.6	180	-70.9	177	179.9	169.2	0	110.4	V46 K50	V46-K48 PolarHBondContact O-N 3.06Å; K48-K50 PolarHBondContact O-N 3.38Å
49	R	37.2	Very low	44.2	Very low	226 Å²	226	144.8 Å²	144.8	85%	0.853	72%	0.722	S	S	*	*			trans	-63.5	118.3	164.4	-80.5	-175.7	174.5	-178.5	-0.7	109	E47 L51	E47-R49 VanDerWaalsContact C-N 3.29Å; E47-R49 PolarHBondContact O-N 2.95Å; R49-L51 PolarHBondContact O-N 3.39Å
50	K	41.2	Very low	46.4	Very low	211 Å²	211	139.9 Å²	139.9	92%	0.917	71%	0.708	S	S	*	*			trans	-61.3	101.3	-179.3	-74.3	175.6	177.1	171.4	0	110.2	K48	K48-K50 PolarHBondContact O-N 3.38Å
51	L	45.1	Very low	48.8	Very low	107 Å²	107	144.3 Å²	144.3	56%	0.56	71%	0.711	S	S	*	*			trans	-57.3	135.9	175	-73.2	159.6	0	0	0	111.7	R49 E55	R49-L51 PolarHBondContact O-N 3.39Å; L51-E55 WeakPolarHBondContact CD2-OE2 3.2Å
52	S	52.8	Low	51	Low	66 Å²	66	144.7 Å²	144.7	46%	0.462	70%	0.702	S	S	.	*			trans	-68.9	154.6	-173.8	85.7	0	0	0	0	112.2	N54 E55 K56	S52-N54 PolarHBondContact O-N 3.25Å; S52-E55 PolarHBondContact O-N 3.06Å; S52-K56 PolarHBondContact O-N 3.11Å
53	R	64.1	Low	52.9	Low	214 Å²	214	145.7 Å²	145.7	81%	0.808	70%	0.696	S	S	*	*	H	α-helix	trans	-56.9	-25.8	-175.1	-159.2	174.4	-177.8	172.8	-0.6	113.4	K57	R53-K57 PolarHBondContact O-N 3.02Å
54	N	69.5	Low	55.1	Low	122 Å²	122	148.1 Å²	148.1	65%	0.652	69%	0.689	S	S	*	*	H	α-helix	trans	-75.8	-35.4	178.8	-77.2	-13.7	0	0	0	113	S52 K57 R58	S52-N54 PolarHBondContact O-N 3.25Å; N54-K57 PolarHBondContact O-N 3.31Å; N54-R58 PolarHBondContact O-N 3.07Å
55	E	62.4	Low	57.3	Low	95 Å²	95	147.3 Å²	147.3	44%	0.444	68%	0.684	S	S	.	*	H	α-helix	trans	-70.1	-38.4	176.5	-79	174.5	132.8	0	0	112.2	L51 S52 K57 R58 L59	L51-E55 WeakPolarHBondContact CD2-OE2 3.2Å; S52-E55 PolarHBondContact O-N 3.06Å; E55-K57 VanDerWaalsContact C-N 3.3Å; E55-K57 PolarHBondContact O-N 3.47Å; E55-R58 PolarHBondContact O-N 3.45Å; E55-R58 VanDerWaalsContact O-N 3.13Å; E55-L59 PolarHBondContact O-N 3.27Å
56	K	61.5	Low	59.3	Low	147 Å²	147	148.3 Å²	148.3	64%	0.639	67%	0.671	S	S	*	*	H	α-helix	trans	-58.6	-40.1	173.4	-76.9	-174.8	177.3	179.3	0	112.3	S52 S60	S52-K56 PolarHBondContact O-N 3.11Å; K56-S60 WeakPolarHBondContact O-CB 3.5Å; K56-S60 PolarHBondContact O-N 3.06Å; K56-S60 VanDerWaalsContact O-N 3.11Å
57	K	66.8	Low	61	Low	139 Å²	139	149.3 Å²	149.3	60%	0.604	67%	0.665	S	S	*	*	H	α-helix	trans	-66.9	-37.2	175.5	-85.4	-175.7	174.4	179.5	0	112.4	R53 N54 E55 R61	R53-K57 PolarHBondContact O-N 3.02Å; N54-K57 PolarHBondContact O-N 3.31Å; E55-K57 VanDerWaalsContact C-N 3.3Å; E55-K57 PolarHBondContact O-N 3.47Å; K57-R61 PolarHBondContact O-N 3.39Å; K57-R61 VanDerWaalsContact O-N 3.15Å
58	R	71.1	Confident	63.1	Low	205 Å²	205	146.3 Å²	146.3	77%	0.774	65%	0.651	S	S	*	*	H	α-helix	trans	-65.1	-45.8	175.6	-99.1	-177.5	159	-170.9	-4.5	112.2	N54 E55 R61 K62	N54-R58 PolarHBondContact O-N 3.07Å; E55-R58 PolarHBondContact O-N 3.45Å; E55-R58 VanDerWaalsContact O-N 3.13Å; R58-R61 PolarHBondContact O-N 3.43Å; R58-K62 PolarHBondContact O-N 3.28Å
59	L	65.1	Low	65.1	Low	101 Å²	101	143.8 Å²	143.8	53%	0.529	64%	0.64	S	S	.	*	H	α-helix	trans	-62.9	-40.9	177.5	-91.8	149.5	0	0	0	112.8	E55 K62 K63	E55-L59 PolarHBondContact O-N 3.27Å; L59-K62 PolarHBondContact O-N 3.02Å; L59-K63 PolarHBondContact O-N 3.38Å
60	S	70.4	Confident	66.6	Low	77 Å²	77	141 Å²	141	54%	0.538	63%	0.634	S	S	.	*	H	α-helix	trans	-59.8	-46.9	174.1	156.3	0	0	0	0	112.3	K56 K62 K63 K64	K56-S60 WeakPolarHBondContact O-CB 3.5Å; K56-S60 PolarHBondContact O-N 3.06Å; K56-S60 VanDerWaalsContact O-N 3.11Å; S60-K62 VanDerWaalsContact C-N 3.32Å; S60-K62 PolarHBondContact O-N 3.13Å; S60-K63 PolarHBondContact O-N 3.23Å; S60-K64 PolarHBondContact O-N 3.2Å; S60-K64 VanDerWaalsContact O-N 3.1Å
61	R	75.1	Confident	68	Low	198 Å²	198	136.1 Å²	136.1	75%	0.747	61%	0.614	S	S	*	*	H	α-helix	trans	-63.5	-35.6	176.5	-78.1	-178.7	169.6	174.5	-3.4	112.6	K57 R58 K65	K57-R61 PolarHBondContact O-N 3.39Å; K57-R61 VanDerWaalsContact O-N 3.15Å; R58-R61 PolarHBondContact O-N 3.43Å; R61-K65 PolarHBondContact O-N 3.02Å; R61-K65 VanDerWaalsContact O-N 3.16Å
62	K	73.9	Confident	69.3	Low	143 Å²	143	136.1 Å²	136.1	62%	0.622	61%	0.611	S	S	*	*	H	α-helix	trans	-66.8	-46.9	177.9	-156	180	-177.9	-174.1	0	111.6	R58 L59 S60 K64 K65 E66	R58-K62 PolarHBondContact O-N 3.28Å; L59-K62 PolarHBondContact O-N 3.02Å; S60-K62 VanDerWaalsContact C-N 3.32Å; S60-K62 PolarHBondContact O-N 3.13Å; K62-K64 VanDerWaalsContact C-N 3.33Å; K62-K64 PolarHBondContact O-N 3.32Å; K62-K65 PolarHBondContact O-N 3.15Å; K62-E66 PolarHBondContact O-N 3.09Å; K62-E66 VanDerWaalsContact O-N 3.07Å
63	K	68.4	Low	70.2	Confident	149 Å²	149	142.1 Å²	142.1	65%	0.648	62%	0.624	S	S	*	*	H	α-helix	trans	-60.8	-38.6	175.7	-77.3	-170.5	174.2	-174.5	0	112.8	L59 S60 E66 K67	L59-K63 PolarHBondContact O-N 3.38Å; S60-K63 PolarHBondContact O-N 3.23Å; K63-E66 PolarHBondContact O-N 3.17Å; K63-K67 PolarHBondContact O-N 3.03Å; K63-K67 VanDerWaalsContact O-N 3.15Å
64	K	74.1	Confident	70.2	Confident	140 Å²	140	138.7 Å²	138.7	61%	0.609	62%	0.615	S	S	*	*	H	α-helix	trans	-64.9	-44	177.2	-167.2	176	177.5	-178	0	111.9	S60 K62 E66 K67 E68	S60-K64 PolarHBondContact O-N 3.2Å; S60-K64 VanDerWaalsContact O-N 3.1Å; K62-K64 VanDerWaalsContact C-N 3.33Å; K62-K64 PolarHBondContact O-N 3.32Å; K64-E66 PolarHBondContact O-N 3.1Å; K64-K67 PolarHBondContact O-N 3.3Å; K64-E68 PolarHBondContact O-N 3.06Å; K64-E68 VanDerWaalsContact O-N 3.11Å
65	K	74.8	Confident	70.2	Confident	155 Å²	155	141.7 Å²	141.7	67%	0.674	62%	0.617	S	S	*	*	H	α-helix	trans	-62.8	-37.4	175.7	-98.4	-173	171.8	-175.6	0	113.5	R61 K62 K69	R61-K65 PolarHBondContact O-N 3.02Å; R61-K65 VanDerWaalsContact O-N 3.16Å; K62-K65 PolarHBondContact O-N 3.15Å; K65-K69 PolarHBondContact O-N 3.05Å
66	E	73	Confident	70.4	Confident	124 Å²	124	143.2 Å²	143.2	58%	0.579	62%	0.622	S	S	*	*	H	α-helix	trans	-66.7	-39.9	176	-85.4	177.4	169.9	0	0	112.4	K62 K63 K64 K69 K70	K62-E66 PolarHBondContact O-N 3.09Å; K62-E66 VanDerWaalsContact O-N 3.07Å; K63-E66 PolarHBondContact O-N 3.17Å; K64-E66 PolarHBondContact O-N 3.1Å; E66-K69 PolarHBondContact O-N 3.15Å; E66-K70 PolarHBondContact O-N 3.27Å
67	K	68.9	Low	70.2	Confident	144 Å²	144	142.6 Å²	142.6	63%	0.626	62%	0.621	S	S	*	*	H	α-helix	trans	-64.8	-43.2	177.7	-159.6	177.5	-179.6	-175.2	0	111.6	K63 K64 K70 E71	K63-K67 PolarHBondContact O-N 3.03Å; K63-K67 VanDerWaalsContact O-N 3.15Å; K64-K67 PolarHBondContact O-N 3.3Å; K67-K70 PolarHBondContact O-N 3.28Å; K67-E71 PolarHBondContact O-N 3.23Å
68	E	76.5	Confident	69.7	Low	105 Å²	105	141 Å²	141	49%	0.491	62%	0.62	S	S	.	*	H	α-helix	trans	-62.3	-43.5	175.1	-76.2	170	-177.2	0	0	112	K64 K70 E71 E72	K64-E68 PolarHBondContact O-N 3.06Å; K64-E68 VanDerWaalsContact O-N 3.11Å; E68-K70 VanDerWaalsContact C-N 3.31Å; E68-K70 PolarHBondContact O-N 3.44Å; E68-E71 PolarHBondContact O-N 2.97Å; E68-E72 PolarHBondContact O-N 3.11Å
69	K	75.1	Confident	68.8	Low	152 Å²	152	141.4 Å²	141.4	66%	0.661	62%	0.621	S	S	*	*	H	α-helix	trans	-61.4	-37.2	174.7	-87.7	-172.7	172.7	-174.2	0	113	K65 E66 R73	K65-K69 PolarHBondContact O-N 3.05Å; E66-K69 PolarHBondContact O-N 3.15Å; K69-R73 PolarHBondContact O-N 3.39Å; K69-R73 VanDerWaalsContact O-N 3.1Å
70	K	68.8	Low	68.1	Low	167 Å²	167	145.3 Å²	145.3	73%	0.726	63%	0.634	S	S	*	*	H	α-helix	trans	-69.2	-40.1	179.1	-161.5	175.4	-176.1	177.8	0	111.3	E66 K67 E68 K74	E66-K70 PolarHBondContact O-N 3.27Å; K67-K70 PolarHBondContact O-N 3.28Å; E68-K70 VanDerWaalsContact C-N 3.31Å; E68-K70 PolarHBondContact O-N 3.44Å; K70-K74 PolarHBondContact O-N 3.42Å
71	E	70	Confident	67.1	Low	109 Å²	109	145.6 Å²	145.6	51%	0.509	64%	0.641	S	S	.	*	H	α-helix	trans	-68.2	-37.5	174.4	-78.3	-179.6	179.6	0	0	112.7	K67 E68 K74 R75	K67-E71 PolarHBondContact O-N 3.23Å; E68-E71 PolarHBondContact O-N 2.97Å; E71-K74 PolarHBondContact O-N 2.99Å; E71-R75 PolarHBondContact O-N 3.04Å
72	E	73.4	Confident	65	Low	106 Å²	106	147.1 Å²	147.1	50%	0.495	65%	0.647	S	S	.	*	H	α-helix	trans	-66.7	-39.4	176.9	-161.9	-168.2	150.5	0	0	112.2	E68 K74 R75 K76	E68-E72 PolarHBondContact O-N 3.11Å; E72-K74 VanDerWaalsContact C-N 3.35Å; E72-R75 PolarHBondContact O-N 3.33Å; E72-K76 PolarHBondContact O-N 3.33Å; E72-K76 IonicContact OE1-NZ 2.63Å; E72-K76 PolarHBondContact OE1-NZ 2.79Å; E72-K76 VanDerWaalsContact OE1-NZ 3.14Å
73	R	71.2	Confident	63.1	Low	193 Å²	193	144 Å²	144	73%	0.728	65%	0.647	S	S	*	*	H	α-helix	trans	-59.5	-45.6	172.2	-83.4	-174.8	171.2	-176.1	-3.4	111.6	K69 R75 K76 E77	K69-R73 PolarHBondContact O-N 3.39Å; K69-R73 VanDerWaalsContact O-N 3.1Å; R73-R75 PolarHBondContact O-N 3.03Å; R73-K76 PolarHBondContact O-N 2.76Å; R73-K76 VanDerWaalsContact O-N 3.13Å; R73-E77 PolarHBondContact O-N 3.1Å
74	K	64.9	Low	61.5	Low	142 Å²	142	143.4 Å²	143.4	62%	0.617	66%	0.659	S	S	*	*	H	α-helix	trans	-60.1	-44.2	178.4	-137	-179.7	-178	-171.1	0	111.9	K70 E71 E72 K76 E77 D78	K70-K74 PolarHBondContact O-N 3.42Å; E71-K74 PolarHBondContact O-N 2.99Å; E72-K74 VanDerWaalsContact C-N 3.35Å; K74-K76 VanDerWaalsContact C-N 3.32Å; K74-K76 PolarHBondContact O-N 3.27Å; K74-E77 PolarHBondContact O-N 3.32Å; K74-D78 PolarHBondContact O-N 3.08Å
75	R	69.4	Low	59.5	Low	184 Å²	184	141.6 Å²	141.6	69%	0.694	66%	0.664	S	S	*	*	H	α-helix	trans	-65	-31	175.8	-74	-178.3	175.1	-177	0	113.7	E71 E72 R73 R79	E71-R75 PolarHBondContact O-N 3.04Å; E72-R75 PolarHBondContact O-N 3.33Å; R73-R75 PolarHBondContact O-N 3.03Å; R75-R79 PolarHBondContact O-N 3.17Å
76	K	65.4	Low	57.4	Low	127 Å²	127	139.1 Å²	139.1	55%	0.552	67%	0.666	S	S	*	*	H	α-helix	trans	-73.4	-36.5	175.6	-80.5	-179.9	177.5	164.8	0	112.1	E72 R73 K74 K80	E72-K76 PolarHBondContact O-N 3.33Å; E72-K76 IonicContact OE1-NZ 2.63Å; E72-K76 PolarHBondContact OE1-NZ 2.79Å; E72-K76 VanDerWaalsContact OE1-NZ 3.14Å; R73-K76 PolarHBondContact O-N 2.76Å; R73-K76 VanDerWaalsContact O-N 3.13Å; K74-K76 VanDerWaalsContact C-N 3.32Å; K74-K76 PolarHBondContact O-N 3.27Å; K76-K80 PolarHBondContact O-N 2.71Å
77	E	59	Low	55.5	Low	134 Å²	134	138 Å²	138	63%	0.626	68%	0.678	S	S	*	*	H	α-helix	trans	-65.6	-45.2	173	-76.3	172.1	172.7	0	0	111.2	R73 K74 R79 K80 A81	R73-E77 PolarHBondContact O-N 3.1Å; K74-E77 PolarHBondContact O-N 3.32Å; E77-R79 VanDerWaalsContact C-N 3.27Å; E77-R79 PolarHBondContact O-N 3.48Å; E77-K80 PolarHBondContact O-N 3.23Å; E77-K80 VanDerWaalsContact O-N 3.09Å; E77-A81 PolarHBondContact O-N 2.88Å; E77-A81 VanDerWaalsContact O-N 3.15Å
78	D	56.4	Low	53.8	Low	106 Å²	106	139.8 Å²	139.8	57%	0.567	69%	0.686	S	S	*	*	H	α-helix	trans	-62.3	-33.1	177.9	-71	-20.9	0	0	0	112.9	K74	K74-D78 PolarHBondContact O-N 3.08Å
79	R	51.4	Low	51.7	Low	214 Å²	214	140.7 Å²	140.7	81%	0.808	70%	0.701	S	S	*	*	H	α-helix	trans	-74.1	-33	174.8	-83.5	-173.5	171.4	-172	-2.8	113.1	R75 E77 A81 R82	R75-R79 PolarHBondContact O-N 3.17Å; E77-R79 VanDerWaalsContact C-N 3.27Å; E77-R79 PolarHBondContact O-N 3.48Å; R79-A81 VanDerWaalsContact C-N 3.29Å; R79-R82 PolarHBondContact O-N 3.4Å
80	K	50.2	Low	49.7	Very low	182 Å²	182	145 Å²	145	79%	0.791	71%	0.713	S	S	*	*	H	α-helix	trans	-71.4	-24.5	176	-79.8	-173.9	174.3	-172.7	0	112.7	K76 E77 R82	K76-K80 PolarHBondContact O-N 2.71Å; E77-K80 PolarHBondContact O-N 3.23Å; E77-K80 VanDerWaalsContact O-N 3.09Å; K80-R82 PolarHBondContact O-N 3.16Å
81	A	48.5	Very low	48	Very low	83 Å²	83	146.6 Å²	146.6	69%	0.686	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-7.5	174.7	0	0	0	0	0	114.1	E77 R79	E77-A81 PolarHBondContact O-N 2.88Å; E77-A81 VanDerWaalsContact O-N 3.15Å; R79-A81 VanDerWaalsContact C-N 3.29Å
82	R	31.3	Very low	46	Very low	231 Å²	231	145.8 Å²	145.8	87%	0.872	73%	0.732	S	S	*	*			trans	-110.3	66.7	176.4	-73.8	-177.7	178.3	179.3	-0.1	111.5	R79 K80	R79-R82 PolarHBondContact O-N 3.4Å; K80-R82 PolarHBondContact O-N 3.16Å
83	A	33.8	Very low	43.9	Very low	77 Å²	77	151.8 Å²	151.8	64%	0.636	75%	0.75	S	S	*	*	S	Bend	trans	-131.8	131.6	157.1	0	0	0	0	0	107.8	S85	A83-S85 PolarHBondContact O-N 3.01Å
84	P	36.3	Very low	41.9	Very low	137 Å²	137	152.5 Å²	152.5	89%	0.89	76%	0.758	S	S	*	*			trans	-85	108.9	-160.4	32.5	-30	0	0	0	110.6
85	S	31.8	Very low	40	Very low	102 Å²	102	153.3 Å²	153.3	71%	0.713	76%	0.764	S	S	*	*			trans	-79.7	123.6	170.6	57	0	0	0	0	110.4	A83	A83-S85 PolarHBondContact O-N 3.01Å
86	S	31	Very low	38.2	Very low	103 Å²	103	154.2 Å²	154.2	72%	0.72	77%	0.774	S	S	*	*			trans	-51.6	134.2	177.6	49	0	0	0	0	115.2
87	A	33.1	Very low	36.5	Very low	99 Å²	99	153.4 Å²	153.4	82%	0.818	78%	0.779	S	S	*	*			trans	36	80.7	145.7	0	0	0	0	0	118.4
88	F	31.6	Very low	35.7	Very low	183 Å²	183	152.3 Å²	152.3	80%	0.803	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-80.3	133.5	154.6	-80.8	-85.1	0	0	0	110
89	P	32.6	Very low	34.7	Very low	123 Å²	123	154.2 Å²	154.2	80%	0.799	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-69.9	141.3	-178.5	30.1	-32.3	0	0	0	110.2	K91	P89-K91 PolarHBondContact O-N 3.32Å
90	R	34.3	Very low	33.8	Very low	244 Å²	244	150 Å²	150	92%	0.921	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-56.4	126.3	-171.8	-73.5	171.9	167.7	172.6	-4.9	111.6	A92	R90-A92 PolarHBondContact O-N 3.31Å
91	K	32	Very low	33.1	Very low	200 Å²	200	152.2 Å²	152.2	87%	0.87	80%	0.799	S	S	*	*			trans	-36.8	126.9	168.8	-71.8	176.7	171.5	-178.1	0	111.8	P89 R93	P89-K91 PolarHBondContact O-N 3.32Å; K91-R93 PolarHBondContact O-N 2.98Å
92	A	28.3	Very low	32.8	Very low	92 Å²	92	154.1 Å²	154.1	76%	0.76	81%	0.807	S	S	*	*			trans	-54.2	118	167.3	0	0	0	0	0	109	R90 F94	R90-A92 PolarHBondContact O-N 3.31Å; A92-F94 PolarHBondContact O-N 3.25Å
93	R	29.8	Very low	33.1	Very low	232 Å²	232	146.3 Å²	146.3	88%	0.875	80%	0.799	S	S	*	*			trans	-68.3	116.8	169.6	-89.7	177	166.6	170.8	-5.4	107.4	K91 H95	K91-R93 PolarHBondContact O-N 2.98Å; R93-H95 PolarHBondContact O-N 3.46Å; R93-H95 VanDerWaalsContact O-N 3.16Å
94	F	28	Very low	33.5	Very low	207 Å²	207	147.8 Å²	147.8	91%	0.908	81%	0.811	S	S	*	*			trans	-51.7	114.8	168.2	-82.5	-99.6	0	0	0	109.7	A92	A92-F94 PolarHBondContact O-N 3.25Å
95	H	26.6	Very low	34.1	Very low	160 Å²	160	149.3 Å²	149.3	74%	0.741	81%	0.806	S	S	*	*			trans	-100.1	118.8	165.3	-97.7	-79.4	0	0	0	107.7	R93 V97	R93-H95 PolarHBondContact O-N 3.46Å; R93-H95 VanDerWaalsContact O-N 3.16Å; H95-V97 HydrophobicContact CB-CG2 4.38Å; H95-V97 PolarHBondContact O-N 3.28Å
96	F	30.2	Very low	34.3	Very low	203 Å²	203	153.8 Å²	153.8	89%	0.89	81%	0.813	S	S	*	*			trans	-67.4	106.4	161.6	-86.7	-91.6	0	0	0	107.3
97	V	31.3	Very low	34.8	Very low	109 Å²	109	153.1 Å²	153.1	66%	0.661	81%	0.814	S	S	*	*			trans	-112.3	108.6	163.6	-176.4	0	0	0	0	106.7	H95 D99	H95-V97 HydrophobicContact CB-CG2 4.38Å; H95-V97 PolarHBondContact O-N 3.28Å; V97-D99 PolarHBondContact O-N 3.05Å
98	P	41	Very low	35	Very low	111 Å²	111	156.8 Å²	156.8	72%	0.721	81%	0.814	S	S	*	*			trans	-88.5	95.2	172.6	32.8	-25.2	0	0	0	108.1
99	D	35.8	Very low	35.6	Very low	146 Å²	146	152.3 Å²	152.3	78%	0.781	80%	0.799	S	S	*	*			trans	-114.8	82	161.7	-94.7	-28.7	0	0	0	108.7	V97 R101	V97-D99 PolarHBondContact O-N 3.05Å; D99-R101 PolarHBondContact O-N 3.03Å
100	C	31.9	Very low	36.1	Very low	125 Å²	125	154.6 Å²	154.6	85%	0.845	80%	0.796	S	S	*	*			trans	-65.9	119.1	166.1	-67.7	0	0	0	0	109.5
101	R	36	Very low	36.7	Very low	229 Å²	229	150.3 Å²	150.3	86%	0.864	78%	0.784	S	S	*	*			trans	-125.9	125.4	155.5	-72.1	-171.7	179.8	-170.1	1.3	109.6	D99	D99-R101 PolarHBondContact O-N 3.03Å
102	S	41.9	Very low	37.5	Very low	123 Å²	123	149.2 Å²	149.2	86%	0.86	78%	0.776	S	S	*	*	S	Bend	trans	65.9	106.6	165.9	52.3	0	0	0	0	119.6
103	G	37.9	Very low	38.5	Very low	68 Å²	68	145.9 Å²	145.9	70%	0.701	75%	0.746	S	S	*	*	S	Bend		104.1	60.2	128.3	0	0	0	0	0	119.2	E105	G103-E105 PolarHBondContact O-N 3.36Å
104	A	41.4	Very low	39.5	Very low	108 Å²	108	139.2 Å²	139.2	89%	0.893	73%	0.726	S	S	*	*			trans	43.4	60.8	154.9	0	0	0	0	0	117.2
105	E	50.1	Low	40.3	Very low	169 Å²	169	132.5 Å²	132.5	79%	0.79	70%	0.698	S	S	*	*			trans	-87.9	-1.9	175.5	-70.6	-173.4	157.5	0	0	114.6	G103	G103-E105 PolarHBondContact O-N 3.36Å
106	F	36.4	Very low	41.6	Very low	195 Å²	195	128.3 Å²	128.3	86%	0.855	68%	0.681	S	S	*	*			trans	-117.3	118.8	-176.7	-58.8	-77.3	0	0	0	111.7
107	A	40	Very low	42.4	Very low	90 Å²	90	124.1 Å²	124.1	74%	0.744	67%	0.667	S	S	*	*			trans	-96.6	121.8	162.7	0	0	0	0	0	108.2	D109	A107-D109 PolarHBondContact O-N 3.28Å
108	E	37.9	Very low	43	Very low	175 Å²	175	122.8 Å²	122.8	82%	0.818	66%	0.655	S	S	*	*			trans	-75.6	110.4	172.9	-104.5	-178.5	170.8	0	0	109.6	K110	E108-K110 PolarHBondContact O-N 3.34Å
109	D	44	Very low	42.9	Very low	89 Å²	89	124.7 Å²	124.7	48%	0.476	65%	0.649	S	S	.	*			trans	-73.9	111.3	167.1	-169.4	-10.3	0	0	0	109.1	A107 F111	A107-D109 PolarHBondContact O-N 3.28Å; D109-F111 VanDerWaalsContact C-N 3.3Å; D109-F111 PolarHBondContact OD1-N 3.14Å
110	K	42.5	Very low	43.3	Very low	172 Å²	172	124 Å²	124	75%	0.748	65%	0.645	S	S	*	*			trans	-83	-4.9	-177.4	-66.4	-170.8	177.6	-175	0	113.6	E108	E108-K110 PolarHBondContact O-N 3.34Å
111	F	47	Very low	44.3	Very low	153 Å²	153	118.5 Å²	118.5	67%	0.671	61%	0.608	S	S	*	*	S	Bend	trans	-112.1	111.1	-174.1	-60.2	-78.1	0	0	0	110.3	D109	D109-F111 VanDerWaalsContact C-N 3.3Å; D109-F111 PolarHBondContact OD1-N 3.14Å
112	Y	49	Very low	44.6	Very low	178 Å²	178	108.4 Å²	108.4	70%	0.698	57%	0.571	S	S	*	*			trans	-65	143.1	175.2	61.5	-86.2	0	0	0	110.9	I114 R958	Y112-I114 HydrophobicContact CD2-CG1 4.07Å; Y112-I114 HydrophobicContact CE2-CD1 4.48Å; Y112-I114 HydrophobicContact CE2-CG1 3.59Å; Y112-I114 PolarHBondContact O-N 3.12Å; Y112-R958 PolarHBondContact O-NH2 3.17Å
113	D	50.5	Low	45.1	Very low	22 Å²	22	103.5 Å²	103.5	12%	0.118	53%	0.534	C	S	.	.			trans	-79.4	99.4	-179.4	-165.6	9.4	0	0	0	111.9	E115 N116 Y123 V954 R958	D113-E115 PolarHBondContact O-N 2.97Å; D113-E115 PolarHBondContact OD1-N 3.23Å; D113-N116 HydrophobicContact CB-CB 3.93Å; D113-N116 WeakPolarHBondContact O-CB 3.26Å; D113-N116 PolarHBondContact O-N 3.49Å; D113-Y123 WeakPolarHBondContact OD2-CE2 3.49Å; D113-V954 HydrophobicContact CB-CG1 3.83Å; D113-R958 IonicContact OD1-CZ 3.07Å; D113-R958 IonicContact OD1-NE 3.29Å; D113-R958 PolarHBondContact OD1-NE 2.97Å; D113-R958 IonicContact OD1-NH2 2.65Å; D113-R958 PolarHBondContact OD1-NH2 3.15Å
114	I	50.2	Low	45.9	Very low	91 Å²	91	102.4 Å²	102.4	47%	0.467	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-58.8	-37.1	-179.8	-61.9	161.6	0	0	0	110.8	Y112 N116 L117 I118	Y112-I114 HydrophobicContact CD2-CG1 4.07Å; Y112-I114 HydrophobicContact CE2-CD1 4.48Å; Y112-I114 HydrophobicContact CE2-CG1 3.59Å; Y112-I114 PolarHBondContact O-N 3.12Å; I114-N116 PolarHBondContact O-N 3.39Å; I114-L117 PolarHBondContact O-N 2.97Å; I114-I118 HydrophobicContact CG2-CD1 4.02Å
115	E	45.6	Very low	46.5	Very low	66 Å²	66	104.9 Å²	104.9	31%	0.308	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-64.5	-27.1	177.3	-70.8	-146.3	175.2	0	0	111.6	D113 L117 I118 S121	D113-E115 PolarHBondContact O-N 2.97Å; D113-E115 PolarHBondContact OD1-N 3.23Å; E115-L117 PolarHBondContact O-N 3.2Å; E115-I118 PolarHBondContact O-N 3.48Å; E115-S121 WeakPolarHBondContact O-CB 3.13Å; E115-S121 PolarHBondContact O-OG 3.43Å
116	N	52.8	Low	46.2	Very low	73 Å²	73	102 Å²	102	39%	0.39	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-59.2	-20.3	177.9	-149.7	3.8	0	0	0	113.9	D113 I114 Y123	D113-N116 HydrophobicContact CB-CB 3.93Å; D113-N116 WeakPolarHBondContact O-CB 3.26Å; D113-N116 PolarHBondContact O-N 3.49Å; I114-N116 PolarHBondContact O-N 3.39Å; N116-Y123 HydrophobicContact CB-CD2 3.99Å; N116-Y123 HydrophobicContact CB-CE2 4.22Å; N116-Y123 WeakPolarHBondContact OD1-CB 3.4Å; N116-Y123 WeakPolarHBondContact OD1-CD2 3.44Å
117	L	46.9	Very low	46.8	Very low	114 Å²	114	96 Å²	96	60%	0.597	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-100.3	-13.5	177.1	-70.1	166.8	0	0	0	114.4	I114 E115 Y242	I114-L117 PolarHBondContact O-N 2.97Å; E115-L117 PolarHBondContact O-N 3.2Å; L117-Y242 PolarHBondContact O-OH 3.11Å
118	I	43.4	Very low	47	Very low	82 Å²	82	94.9 Å²	94.9	42%	0.421	46%	0.462	S	S	.	.	S	Bend	trans	-86.4	123	-173.5	-63.4	172.9	0	0	0	109.2	I114 E115 D120 S121	I114-I118 HydrophobicContact CG2-CD1 4.02Å; E115-I118 PolarHBondContact O-N 3.48Å; I118-D120 PolarHBondContact O-N 2.92Å; I118-S121 WeakPolarHBondContact O-CB 3.41Å; I118-S121 PolarHBondContact O-N 3.46Å; I118-S121 PolarHBondContact O-OG 3.44Å
119	Y	39.8	Very low	47.5	Very low	151 Å²	151	91.5 Å²	91.5	59%	0.592	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	130.4	166	-79.7	-88.4	0	0	0	108.2
120	D	43.5	Very low	47.5	Very low	130 Å²	130	97.4 Å²	97.4	70%	0.695	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	89	6.8	-164.4	-55.1	-27.3	0	0	0	116.3	I118	I118-D120 PolarHBondContact O-N 2.92Å
121	S	53.1	Low	47.5	Very low	10 Å²	10	95.3 Å²	95.3	7%	0.07	48%	0.477	C	S	.	.	S	Bend	trans	-85.8	173.4	166.5	79.7	0	0	0	0	114.1	E115 I118 Y123 S124	E115-S121 WeakPolarHBondContact O-CB 3.13Å; E115-S121 PolarHBondContact O-OG 3.43Å; I118-S121 WeakPolarHBondContact O-CB 3.41Å; I118-S121 PolarHBondContact O-N 3.46Å; I118-S121 PolarHBondContact O-OG 3.44Å; S121-Y123 PolarHBondContact O-N 3.41Å; S121-Y123 PolarHBondContact OG-N 3.44Å; S121-S124 PolarHBondContact O-N 3.5Å; S121-S124 PolarHBondContact O-OG 2.92Å
122	F	42.1	Very low	47.3	Very low	17 Å²	17	96.5 Å²	96.5	8%	0.075	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-42.6	-31.5	171.1	-111.1	-88.1	0	0	0	114.9	V962 L998 N1001 V1002	F122-V962 HydrophobicContact CE2-CG2 4.07Å; F122-L998 HydrophobicContact CD1-CD2 3.52Å; F122-L998 HydrophobicContact CE1-CB 4.21Å; F122-L998 HydrophobicContact CE1-CD2 3.98Å; F122-N1001 HydrophobicContact CD1-CB 4.25Å; F122-N1001 HydrophobicContact CE1-CB 4.33Å; F122-N1001 PolarHBondContact O-ND2 2.82Å; F122-V1002 HydrophobicContact CE1-CG2 3.86Å; F122-V1002 HydrophobicContact CE2-CG2 4.38Å; F122-V1002 HydrophobicContact CZ-CG2 3.36Å
123	Y	53	Low	46.9	Very low	21 Å²	21	94.4 Å²	94.4	8%	0.082	48%	0.479	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.7	7.9	-166.7	-48.2	-86.7	0	0	0	114.2	D113 N116 S121 K125 E126 T127 R957 L998	D113-Y123 WeakPolarHBondContact OD2-CE2 3.49Å; N116-Y123 HydrophobicContact CB-CD2 3.99Å; N116-Y123 HydrophobicContact CB-CE2 4.22Å; N116-Y123 WeakPolarHBondContact OD1-CB 3.4Å; N116-Y123 WeakPolarHBondContact OD1-CD2 3.44Å; S121-Y123 PolarHBondContact O-N 3.41Å; S121-Y123 PolarHBondContact OG-N 3.44Å; Y123-K125 PolarHBondContact O-N 3.1Å; Y123-E126 PolarHBondContact O-N 3.14Å; Y123-T127 PolarHBondContact O-N 3.11Å; Y123-R957 PolarHBondContact OH-NH1 3.37Å; Y123-L998 HydrophobicContact CD1-CD2 4.39Å; Y123-L998 HydrophobicContact CE1-CD2 4.06Å
124	S	55.6	Low	46.5	Very low	45 Å²	45	99.3 Å²	99.3	32%	0.315	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-20.6	-177.5	62	0	0	0	0	114.5	S121	S121-S124 PolarHBondContact O-N 3.5Å; S121-S124 PolarHBondContact O-OG 2.92Å
125	K	52.9	Low	46.3	Very low	160 Å²	160	98.4 Å²	98.4	70%	0.696	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-14.4	176	-64	180	-174.1	161.3	0	114	Y123	Y123-K125 PolarHBondContact O-N 3.1Å
126	E	45.1	Very low	46.1	Very low	107 Å²	107	100.3 Å²	100.3	50%	0.5	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-16.3	-174.6	-64.2	-175.4	177.1	0	0	113.4	Y123 A128	Y123-E126 PolarHBondContact O-N 3.14Å; E126-A128 PolarHBondContact O-N 2.77Å
127	T	47.8	Very low	46	Very low	70 Å²	70	101.8 Å²	101.8	43%	0.429	55%	0.55	S	S	.	*	S	Bend	trans	-68.2	108.3	175.5	8.4	0	0	0	0	109.9	Y123 S129	Y123-T127 PolarHBondContact O-N 3.11Å; T127-S129 PolarHBondContact O-N 2.89Å
128	A	44.5	Very low	46.1	Very low	66 Å²	66	102.6 Å²	102.6	55%	0.545	55%	0.551	S	S	.	*			trans	-59.2	112.1	179.3	0	0	0	0	0	110.9	E126 Y130	E126-A128 PolarHBondContact O-N 2.77Å; A128-Y130 HydrophobicContact CB-CE2 4.22Å; A128-Y130 WeakPolarHBondContact O-CD2 3.4Å; A128-Y130 PolarHBondContact O-N 3.37Å
129	S	47.6	Very low	46.6	Very low	104 Å²	104	102 Å²	102	73%	0.727	55%	0.553	S	S	*	*			trans	-73.1	98.7	167.9	60.1	0	0	0	0	108.9	T127 T131	T127-S129 PolarHBondContact O-N 2.89Å; S129-T131 PolarHBondContact O-N 3.13Å; S129-T131 VanDerWaalsContact O-N 3.13Å
130	Y	44.6	Very low	46.8	Very low	214 Å²	214	103.6 Å²	103.6	84%	0.839	57%	0.571	S	S	*	*			trans	-66.5	111.6	175.2	-68.3	-85.3	0	0	0	109.5	A128	A128-Y130 HydrophobicContact CB-CE2 4.22Å; A128-Y130 WeakPolarHBondContact O-CD2 3.4Å; A128-Y130 PolarHBondContact O-N 3.37Å
131	T	42.2	Very low	47.3	Very low	128 Å²	128	101.5 Å²	101.5	79%	0.785	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-98.2	128.2	164.8	38.1	0	0	0	0	108.3	S129 L133	S129-T131 PolarHBondContact O-N 3.13Å; S129-T131 VanDerWaalsContact O-N 3.13Å; T131-L133 PolarHBondContact O-N 2.83Å
132	Y	42.9	Very low	47.1	Very low	178 Å²	178	103.8 Å²	103.8	70%	0.698	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-56.6	133.6	179.5	-70.6	-85.5	0	0	0	110.8	S134	Y132-S134 PolarHBondContact O-N 2.97Å
133	L	40.1	Very low	48	Very low	134 Å²	134	106.3 Å²	106.3	70%	0.702	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-55.6	128.2	175.9	-92.2	132.7	0	0	0	110.4	T131 G135 I136	T131-L133 PolarHBondContact O-N 2.83Å; L133-G135 PolarHBondContact O-N 2.97Å; L133-G135 VanDerWaalsContact O-N 3.08Å; L133-I136 HydrophobicContact CB-CD1 4.13Å; L133-I136 HydrophobicContact CB-CG1 4.46Å; L133-I136 PolarHBondContact O-N 3.08Å
134	S	42.6	Very low	48.5	Very low	125 Å²	125	109.4 Å²	109.4	87%	0.874	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.2	115.4	-178.9	59.6	0	0	0	0	111.2	Y132	Y132-S134 PolarHBondContact O-N 2.97Å
135	G	47.2	Very low	48.6	Very low	72 Å²	72	114.9 Å²	114.9	74%	0.742	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	106.9	-16.6	-179.9	0	0	0	0	0	114.6	L133 V137	L133-G135 PolarHBondContact O-N 2.97Å; L133-G135 VanDerWaalsContact O-N 3.08Å; G135-V137 PolarHBondContact O-N 3.18Å
136	I	41	Very low	48.7	Very low	105 Å²	105	109 Å²	109	54%	0.538	65%	0.647	S	S	.	*			trans	-90.7	89.9	168.7	-56.4	179	0	0	0	107.2	L133 H138	L133-I136 HydrophobicContact CB-CD1 4.13Å; L133-I136 HydrophobicContact CB-CG1 4.46Å; L133-I136 PolarHBondContact O-N 3.08Å; I136-H138 VanDerWaalsContact C-N 3.33Å
137	V	50.6	Low	49.3	Very low	105 Å²	105	106.3 Å²	106.3	64%	0.636	63%	0.634	S	S	*	*			trans	-86	-10.7	177.2	-170.9	0	0	0	0	111.4	G135 H147	G135-V137 PolarHBondContact O-N 3.18Å; V137-H147 PolarHBondContact O-CE1 3.39Å
138	H	47.7	Very low	49.8	Very low	131 Å²	131	106 Å²	106	61%	0.606	64%	0.635	S	S	*	*			trans	-119.8	121.6	-169.1	-54	-60.6	0	0	0	111.4	I136 L140 H147	I136-H138 VanDerWaalsContact C-N 3.33Å; H138-L140 PolarHBondContact O-N 2.94Å; H138-H147 AromaticContact ND1-CE1 3.9Å; H138-H147 AromaticContact ND1-NE2 3.68Å
139	C	53.7	Low	50.1	Low	68 Å²	68	107.3 Å²	107.3	46%	0.459	63%	0.632	S	S	.	*			trans	-72.2	122.7	156	-89.2	0	0	0	0	107.3	G141 C142	C139-G141 PolarHBondContact O-N 2.98Å; C139-G141 VanDerWaalsContact O-N 3.14Å; C139-C142 HydrophobicContact CB-CB 4.2Å; C139-C142 PolarHBondContact O-N 3.29Å; C139-C142 VanDerWaalsContact O-N 3.11Å
140	L	44.3	Very low	50.4	Low	186 Å²	186	105.1 Å²	105.1	97%	0.974	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.6	121.6	171.3	-81.9	160.6	0	0	0	108.7	H138	H138-L140 PolarHBondContact O-N 2.94Å
141	G	55.2	Low	50.9	Low	85 Å²	85	97.9 Å²	97.9	88%	0.876	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	99.2	-4.4	-179.9	0	0	0	0	0	116.3	C139	C139-G141 PolarHBondContact O-N 2.98Å; C139-G141 VanDerWaalsContact O-N 3.14Å
142	C	49	Very low	51.5	Low	58 Å²	58	93.9 Å²	93.9	39%	0.392	58%	0.576	S	S	.	*			trans	-83.3	128.4	179	-142.4	0	0	0	0	111.8	C139	C139-C142 HydrophobicContact CB-CB 4.2Å; C139-C142 PolarHBondContact O-N 3.29Å; C139-C142 VanDerWaalsContact O-N 3.11Å
143	S	60.9	Low	51.7	Low	70 Å²	70	89.7 Å²	89.7	49%	0.49	57%	0.565	S	S	.	*			trans	-67.9	152.8	-179.2	74.8	0	0	0	0	112	Q145 A146 H147	S143-Q145 PolarHBondContact O-N 3.2Å; S143-Q145 VanDerWaalsContact O-N 3.12Å; S143-A146 PolarHBondContact O-N 2.97Å; S143-A146 PolarHBondContact OG-N 2.75Å; S143-H147 PolarHBondContact O-N 3.34Å
144	A	63.2	Low	52.1	Low	87 Å²	87	90.6 Å²	90.6	72%	0.719	57%	0.565	S	S	*	*	H	α-helix	trans	-57.6	-29.6	179.7	0	0	0	0	0	113.1	H147 S148	A144-H147 WeakPolarHBondContact O-CB 3.4Å; A144-H147 PolarHBondContact O-N 2.62Å; A144-S148 PolarHBondContact O-N 3.12Å
145	Q	57.5	Low	53	Low	160 Å²	160	87.6 Å²	87.6	75%	0.748	54%	0.544	S	S	*	.	H	α-helix	trans	-74.4	-44.1	178.7	-127.9	170.7	4.3	0	0	112.1	S143 H147 S148 L149	S143-Q145 PolarHBondContact O-N 3.2Å; S143-Q145 VanDerWaalsContact O-N 3.12Å; Q145-H147 PolarHBondContact O-N 3.1Å; Q145-S148 PolarHBondContact O-N 3.1Å; Q145-S148 PolarHBondContact O-OG 3.25Å; Q145-S148 VanDerWaalsContact O-OG 3.14Å; Q145-L149 PolarHBondContact O-N 2.94Å
146	A	55.1	Low	53.3	Low	37 Å²	37	86.7 Å²	86.7	31%	0.306	54%	0.535	S	S	.	.	H	α-helix	trans	-60.3	-38.2	171.3	0	0	0	0	0	110.6	S143 L149 C150	S143-A146 PolarHBondContact O-N 2.97Å; S143-A146 PolarHBondContact OG-N 2.75Å; A146-L149 WeakPolarHBondContact O-CB 3.35Å; A146-L149 PolarHBondContact O-N 3.11Å; A146-C150 PolarHBondContact O-N 3.16Å; A146-C150 PolarHBondContact O-SG 3.19Å
147	H	56.9	Low	53.8	Low	50 Å²	50	88 Å²	88	23%	0.231	54%	0.537	C	S	.	.	H	α-helix	trans	-62.3	-44.5	173.8	-101.9	-60.8	0	0	0	113.7	V137 H138 S143 A144 Q145 L149 C150 A151	V137-H147 PolarHBondContact O-CE1 3.39Å; H138-H147 AromaticContact ND1-CE1 3.9Å; H138-H147 AromaticContact ND1-NE2 3.68Å; S143-H147 PolarHBondContact O-N 3.34Å; A144-H147 WeakPolarHBondContact O-CB 3.4Å; A144-H147 PolarHBondContact O-N 2.62Å; Q145-H147 PolarHBondContact O-N 3.1Å; H147-L149 VanDerWaalsContact C-N 3.27Å; H147-L149 PolarHBondContact O-N 3.22Å; H147-C150 PolarHBondContact O-N 2.9Å; H147-A151 WeakPolarHBondContact O-CB 3.35Å; H147-A151 PolarHBondContact O-N 2.96Å
148	S	59.1	Low	53.7	Low	64 Å²	64	86.4 Å²	86.4	45%	0.448	52%	0.52	S	S	.	.	H	α-helix	trans	-63.8	-38.3	176.2	83.7	0	0	0	0	110.8	A144 Q145 A151 V152	A144-S148 PolarHBondContact O-N 3.12Å; Q145-S148 PolarHBondContact O-N 3.1Å; Q145-S148 PolarHBondContact O-OG 3.25Å; Q145-S148 VanDerWaalsContact O-OG 3.14Å; S148-A151 PolarHBondContact O-N 3.39Å; S148-V152 WeakPolarHBondContact O-CB 3.33Å; S148-V152 WeakPolarHBondContact O-CG2 3.44Å; S148-V152 PolarHBondContact O-N 3.19Å
149	L	51.8	Low	53.3	Low	92 Å²	92	88.3 Å²	88.3	48%	0.482	52%	0.522	S	S	.	.	H	α-helix	trans	-63.6	-49.8	177	-133.7	93.8	0	0	0	111.3	Q145 A146 H147 A151 V152 I153	Q145-L149 PolarHBondContact O-N 2.94Å; A146-L149 WeakPolarHBondContact O-CB 3.35Å; A146-L149 PolarHBondContact O-N 3.11Å; H147-L149 VanDerWaalsContact C-N 3.27Å; H147-L149 PolarHBondContact O-N 3.22Å; L149-A151 VanDerWaalsContact C-N 3.34Å; L149-A151 PolarHBondContact O-N 3.28Å; L149-V152 PolarHBondContact O-N 3.02Å; L149-I153 HydrophobicContact CD2-CD1 4.42Å; L149-I153 VanDerWaalsContact O-CG1 3.28Å; L149-I153 WeakPolarHBondContact O-CG1 3.42Å; L149-I153 PolarHBondContact O-N 3.36Å
150	C	52.1	Low	53.2	Low	59 Å²	59	88.6 Å²	88.6	40%	0.399	52%	0.524	S	S	.	.	H	α-helix	trans	-60.4	-42	176.8	-74.5	0	0	0	0	111.9	A146 H147 V152 I153 H154	A146-C150 PolarHBondContact O-N 3.16Å; A146-C150 PolarHBondContact O-SG 3.19Å; H147-C150 PolarHBondContact O-N 2.9Å; C150-V152 VanDerWaalsContact C-N 3.34Å; C150-V152 PolarHBondContact O-N 3.15Å; C150-I153 PolarHBondContact O-N 3.24Å; C150-H154 WeakPolarHBondContact O-CB 3.45Å; C150-H154 PolarHBondContact O-N 3.4Å; C150-H154 PolarHBondContact O-ND1 2.95Å
151	A	56.4	Low	53.4	Low	61 Å²	61	84 Å²	84	50%	0.504	50%	0.501	S	S	.	.	H	α-helix	trans	-63.5	-39.7	176.9	0	0	0	0	0	111.9	H147 S148 L149 H154 S155	H147-A151 WeakPolarHBondContact O-CB 3.35Å; H147-A151 PolarHBondContact O-N 2.96Å; S148-A151 PolarHBondContact O-N 3.39Å; L149-A151 VanDerWaalsContact C-N 3.34Å; L149-A151 PolarHBondContact O-N 3.28Å; A151-H154 PolarHBondContact O-N 2.95Å; A151-S155 WeakPolarHBondContact O-CB 3.5Å; A151-S155 PolarHBondContact O-N 3.05Å; A151-S155 PolarHBondContact O-OG 2.66Å
152	V	54.6	Low	53.1	Low	45 Å²	45	83.1 Å²	83.1	27%	0.273	48%	0.475	S	S	.	.	H	α-helix	trans	-68	-40.7	177	173.6	0	0	0	0	111.1	S148 L149 C150 S155 Y158	S148-V152 WeakPolarHBondContact O-CB 3.33Å; S148-V152 WeakPolarHBondContact O-CG2 3.44Å; S148-V152 PolarHBondContact O-N 3.19Å; L149-V152 PolarHBondContact O-N 3.02Å; C150-V152 VanDerWaalsContact C-N 3.34Å; C150-V152 PolarHBondContact O-N 3.15Å; V152-S155 PolarHBondContact O-N 3Å; V152-S155 PolarHBondContact O-OG 3.49Å; V152-Y158 HydrophobicContact CG1-CD2 3.83Å; V152-Y158 HydrophobicContact CG1-CG 4.35Å; V152-Y158 PolarHBondContact O-N 3.37Å
153	I	47.2	Very low	52.9	Low	89 Å²	89	85 Å²	85	46%	0.456	48%	0.481	S	S	.	.	H	α-helix	trans	-61	-50	173.7	-67.6	165.1	0	0	0	110.6	L149 C150 S155 G156 Y158	L149-I153 HydrophobicContact CD2-CD1 4.42Å; L149-I153 VanDerWaalsContact O-CG1 3.28Å; L149-I153 WeakPolarHBondContact O-CG1 3.42Å; L149-I153 PolarHBondContact O-N 3.36Å; C150-I153 PolarHBondContact O-N 3.24Å; I153-S155 VanDerWaalsContact C-N 3.31Å; I153-S155 PolarHBondContact O-N 2.99Å; I153-G156 PolarHBondContact O-N 3.42Å; I153-G156 VanDerWaalsContact O-N 3.1Å; I153-Y158 HydrophobicContact CG1-CD2 3.91Å; I153-Y158 HydrophobicContact CG1-CE2 4.31Å; I153-Y158 HydrophobicContact CG1-CG 4.08Å
154	H	48.9	Very low	52.2	Low	153 Å²	153	85.9 Å²	85.9	71%	0.708	49%	0.487	S	S	*	.	H	α-helix	trans	-67.3	-29.2	-179.6	-75.7	81.7	0	0	0	113.2	C150 A151 G156	C150-H154 WeakPolarHBondContact O-CB 3.45Å; C150-H154 PolarHBondContact O-N 3.4Å; C150-H154 PolarHBondContact O-ND1 2.95Å; A151-H154 PolarHBondContact O-N 2.95Å; H154-G156 PolarHBondContact O-N 3.09Å
155	S	60.5	Low	51.1	Low	63 Å²	63	90 Å²	90	44%	0.441	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-7.8	175.2	75.8	0	0	0	0	113.7	A151 V152 I153 K157	A151-S155 WeakPolarHBondContact O-CB 3.5Å; A151-S155 PolarHBondContact O-N 3.05Å; A151-S155 PolarHBondContact O-OG 2.66Å; V152-S155 PolarHBondContact O-N 3Å; V152-S155 PolarHBondContact O-OG 3.49Å; I153-S155 VanDerWaalsContact C-N 3.31Å; I153-S155 PolarHBondContact O-N 2.99Å; S155-K157 PolarHBondContact O-N 2.84Å; S155-K157 VanDerWaalsContact O-N 3.1Å; S155-K157 WeakPolarHBondContact OG-CB 3.4Å; S155-K157 PolarHBondContact OG-N 2.98Å
156	G	53.2	Low	49.8	Very low	53 Å²	53	91.1 Å²	91.1	55%	0.546	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	69	-1.5	-174.7	0	0	0	0	0	114.4	I153 H154	I153-G156 PolarHBondContact O-N 3.42Å; I153-G156 VanDerWaalsContact O-N 3.1Å; H154-G156 PolarHBondContact O-N 3.09Å
157	K	52.3	Low	48.8	Very low	133 Å²	133	99.4 Å²	99.4	58%	0.578	51%	0.511	S	S	*	.			trans	-85.3	-6.1	-178.9	-65	-174.6	-177	-178.4	0	114.2	S155 W159 S160 D161	S155-K157 PolarHBondContact O-N 2.84Å; S155-K157 VanDerWaalsContact O-N 3.1Å; S155-K157 WeakPolarHBondContact OG-CB 3.4Å; S155-K157 PolarHBondContact OG-N 2.98Å; K157-W159 VanDerWaalsContact C-N 3.27Å; K157-W159 PolarHBondContact O-N 3.47Å; K157-S160 WeakPolarHBondContact O-CB 3.5Å; K157-S160 PolarHBondContact O-N 3.48Å; K157-D161 PolarHBondContact O-N 2.98Å
158	Y	47.5	Very low	47.4	Very low	71 Å²	71	106.5 Å²	106.5	28%	0.278	54%	0.542	S	S	.	.	H	α-helix	trans	-49.9	-46.6	-179.3	-176	-104.8	0	0	0	113.2	V152 I153 S160 D161 I162	V152-Y158 HydrophobicContact CG1-CD2 3.83Å; V152-Y158 HydrophobicContact CG1-CG 4.35Å; V152-Y158 PolarHBondContact O-N 3.37Å; I153-Y158 HydrophobicContact CG1-CD2 3.91Å; I153-Y158 HydrophobicContact CG1-CE2 4.31Å; I153-Y158 HydrophobicContact CG1-CG 4.08Å; Y158-S160 PolarHBondContact O-N 3.19Å; Y158-D161 PolarHBondContact O-N 3.47Å; Y158-I162 HydrophobicContact CD1-CD1 4.11Å; Y158-I162 HydrophobicContact CD2-CD1 4.05Å; Y158-I162 HydrophobicContact CE1-CD1 3.51Å; Y158-I162 HydrophobicContact CE2-CD1 3.44Å; Y158-I162 VanDerWaalsContact CE2-CD1 3.44Å; Y158-I162 HydrophobicContact CE2-CG1 4.47Å; Y158-I162 HydrophobicContact CG-CD1 4.35Å; Y158-I162 PolarHBondContact O-N 3.14Å; Y158-I162 VanDerWaalsContact O-N 3.08Å; Y158-I162 VanDerWaalsContact OH-CD1 3.29Å; Y158-I162 WeakPolarHBondContact OH-CD1 3.46Å
159	W	40.5	Very low	46.1	Very low	171 Å²	171	113.5 Å²	113.5	65%	0.648	56%	0.564	S	S	*	*	H	α-helix	trans	-68.9	-34.2	178.8	-65.1	105.7	0	0	0	112.6	K157 L163	K157-W159 VanDerWaalsContact C-N 3.27Å; K157-W159 PolarHBondContact O-N 3.47Å; W159-L163 WeakPolarHBondContact O-CB 3.42Å; W159-L163 WeakPolarHBondContact O-CD1 3.3Å; W159-L163 WeakPolarHBondContact O-CG 3.32Å; W159-L163 PolarHBondContact O-N 3.08Å
160	S	50.2	Low	45.2	Very low	74 Å²	74	120.8 Å²	120.8	52%	0.517	59%	0.585	S	S	.	*	H	α-helix	trans	-65.9	-44.4	177.4	-43.4	0	0	0	0	111.6	K157 Y158 S164	K157-S160 WeakPolarHBondContact O-CB 3.5Å; K157-S160 PolarHBondContact O-N 3.48Å; Y158-S160 PolarHBondContact O-N 3.19Å; S160-S164 VanDerWaalsContact O-CB 3.32Å; S160-S164 WeakPolarHBondContact O-CB 3.33Å; S160-S164 PolarHBondContact O-N 2.71Å
161	D	49.6	Very low	44.2	Very low	89 Å²	89	127.1 Å²	127.1	48%	0.476	61%	0.606	S	S	.	*	H	α-helix	trans	-73	-37.6	-178.3	-79.1	-16.4	0	0	0	112.2	K157 Y158 S164 K165	K157-D161 PolarHBondContact O-N 2.98Å; Y158-D161 PolarHBondContact O-N 3.47Å; D161-S164 PolarHBondContact O-OG 2.96Å; D161-K165 PolarHBondContact O-N 3.41Å
162	I	49.5	Very low	42.9	Very low	66 Å²	66	133.9 Å²	133.9	34%	0.338	62%	0.624	S	S	.	*	H	α-helix	trans	-73.5	-40.3	175.9	-71.5	-179.6	0	0	0	111.9	Y158 S164 K165 R166	Y158-I162 HydrophobicContact CD1-CD1 4.11Å; Y158-I162 HydrophobicContact CD2-CD1 4.05Å; Y158-I162 HydrophobicContact CE1-CD1 3.51Å; Y158-I162 HydrophobicContact CE2-CD1 3.44Å; Y158-I162 VanDerWaalsContact CE2-CD1 3.44Å; Y158-I162 HydrophobicContact CE2-CG1 4.47Å; Y158-I162 HydrophobicContact CG-CD1 4.35Å; Y158-I162 PolarHBondContact O-N 3.14Å; Y158-I162 VanDerWaalsContact O-N 3.08Å; Y158-I162 VanDerWaalsContact OH-CD1 3.29Å; Y158-I162 WeakPolarHBondContact OH-CD1 3.46Å; I162-S164 VanDerWaalsContact C-N 3.27Å; I162-S164 PolarHBondContact O-N 3.17Å; I162-K165 CarbonylContact O-C 3.48Å; I162-K165 PolarHBondContact O-N 3.47Å; I162-R166 PolarHBondContact O-N 2.97Å
163	L	43.8	Very low	41.7	Very low	99 Å²	99	141.7 Å²	141.7	52%	0.518	65%	0.654	S	S	.	*	H	α-helix	trans	-67	-30.5	175.3	-70.1	169.4	0	0	0	111.6	W159 K165 R166	W159-L163 WeakPolarHBondContact O-CB 3.42Å; W159-L163 WeakPolarHBondContact O-CD1 3.3Å; W159-L163 WeakPolarHBondContact O-CG 3.32Å; W159-L163 PolarHBondContact O-N 3.08Å; L163-K165 PolarHBondContact O-N 3.48Å; L163-R166 PolarHBondContact O-N 3.23Å
164	S	46.4	Very low	40.7	Very low	88 Å²	88	147.8 Å²	147.8	62%	0.615	68%	0.677	S	S	*	*	H	α-helix	trans	-64.6	-20.8	172.6	82.7	0	0	0	0	113.5	S160 D161 I162	S160-S164 VanDerWaalsContact O-CB 3.32Å; S160-S164 WeakPolarHBondContact O-CB 3.33Å; S160-S164 PolarHBondContact O-N 2.71Å; D161-S164 PolarHBondContact O-OG 2.96Å; I162-S164 VanDerWaalsContact C-N 3.27Å; I162-S164 PolarHBondContact O-N 3.17Å
165	K	39.4	Very low	39.7	Very low	174 Å²	174	144.4 Å²	144.4	76%	0.757	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	15.2	179.6	-70.1	-176.8	177.4	177.9	0	113.9	D161 I162 L163 Y167	D161-K165 PolarHBondContact O-N 3.41Å; I162-K165 CarbonylContact O-C 3.48Å; I162-K165 PolarHBondContact O-N 3.47Å; L163-K165 PolarHBondContact O-N 3.48Å; K165-Y167 PolarHBondContact O-N 3.03Å
166	R	31.5	Very low	38.1	Very low	182 Å²	182	147.3 Å²	147.3	69%	0.687	70%	0.704	S	S	*	*			trans	-79	100.7	168.7	-79.7	-168.4	178.7	-161.9	-1	111.6	I162 L163 F168	I162-R166 PolarHBondContact O-N 2.97Å; L163-R166 PolarHBondContact O-N 3.23Å; R166-F168 PolarHBondContact O-N 3.33Å
167	Y	33.5	Very low	36.8	Very low	212 Å²	212	150.1 Å²	150.1	83%	0.831	72%	0.715	S	S	*	*	S	Bend		24.9	72.4	129.1	-88.7	-99	0	0	0	116.2	K165	K165-Y167 PolarHBondContact O-N 3.03Å
168	F	28.2	Very low	35.6	Very low	199 Å²	199	147.9 Å²	147.9	87%	0.873	72%	0.722	S	S	*	*			trans	175.8	67.9	141.3	-84.7	-61.4	0	0	0	109.2	R166	R166-F168 PolarHBondContact O-N 3.33Å
169	K	30.8	Very low	34.6	Very low	211 Å²	211	153.4 Å²	153.4	92%	0.917	76%	0.755	S	S	*	*			trans	-104.9	80.5	158.2	-77.6	-166.7	179.7	176.7	0	109.6	K171	K169-K171 PolarHBondContact O-N 3.5Å
170	R	32.9	Very low	33.9	Very low	244 Å²	244	151 Å²	151	92%	0.921	76%	0.759	S	S	*	*			trans	-67.5	78	169	-169.8	-179.4	174.2	-173.1	-1.1	109.1
171	K	30.3	Very low	32.7	Very low	193 Å²	193	154.2 Å²	154.2	84%	0.839	77%	0.77	S	S	*	*			trans	-173.5	97.6	164.6	-106.8	170.5	-167	-176.2	0	111.3	K169	K169-K171 PolarHBondContact O-N 3.5Å
172	K	31	Very low	31.4	Very low	203 Å²	203	156.1 Å²	156.1	88%	0.883	79%	0.789	S	S	*	*				165.5	91.6	120.6	-90.7	179.3	177.2	-178.9	0	109.8	K174	K172-K174 PolarHBondContact O-N 2.88Å
173	K	27.9	Very low	30.2	Very low	208 Å²	208	161.7 Å²	161.7	90%	0.904	81%	0.814	S	S	*	*			trans	-57.1	120.6	144.5	-93.9	179.5	169.6	179.4	0	107.2
174	K	26.6	Very low	29.4	Very low	218 Å²	218	167.9 Å²	167.9	95%	0.948	83%	0.832	S	S	*	*			trans	175.8	128.6	140.8	-102.6	177.9	178.9	-172.5	0	110.3	K172	K172-K174 PolarHBondContact O-N 2.88Å
175	G	28.2	Very low	28.6	Very low	81 Å²	81	171 Å²	171	84%	0.835	84%	0.842	S	S	*	*			trans	110.4	82.7	155.7	0	0	0	0	0	115.5
176	S	26.1	Very low	28	Very low	124 Å²	124	171.1 Å²	171.1	87%	0.867	85%	0.845	S	S	*	*			trans	-67.7	129.9	153.5	-61.5	0	0	0	0	109.4
177	S	26.5	Very low	27.7	Very low	112 Å²	112	171.9 Å²	171.9	78%	0.783	86%	0.856	S	S	*	*			trans	175.9	125.2	131.9	63.8	0	0	0	0	111.4
178	A	27.9	Very low	27.5	Very low	87 Å²	87	166.3 Å²	166.3	72%	0.719	85%	0.854	S	S	*	*			trans	61.9	90.1	147.1	0	0	0	0	0	118.2	V180	A178-V180 HydrophobicContact CB-CG2 4.4Å; A178-V180 PolarHBondContact O-N 3.27Å; A178-V180 VanDerWaalsContact O-N 3.14Å
179	L	24.8	Very low	27.6	Very low	187 Å²	187	162.6 Å²	162.6	98%	0.979	85%	0.85	S	S	*	*			trans	-57.5	102.4	149.7	-79.7	147.4	0	0	0	109.1
180	V	26.1	Very low	27.5	Very low	121 Å²	121	159.7 Å²	159.7	73%	0.733	85%	0.845	S	S	*	*			trans	-109.2	105.1	167.2	175.6	0	0	0	0	108.2	A178	A178-V180 HydrophobicContact CB-CG2 4.4Å; A178-V180 PolarHBondContact O-N 3.27Å; A178-V180 VanDerWaalsContact O-N 3.14Å
181	N	25.5	Very low	27.4	Very low	140 Å²	140	154.4 Å²	154.4	75%	0.749	84%	0.839	S	S	*	*			trans	7.1	111.2	142.2	-89.9	-9.8	0	0	0	117.1
182	C	23.4	Very low	27.5	Very low	130 Å²	130	151.9 Å²	151.9	88%	0.878	84%	0.835	S	S	*	*			trans	-105.2	102.1	153.7	-73.3	0	0	0	0	108.2
183	Q	23.8	Very low	27.6	Very low	182 Å²	182	151 Å²	151	85%	0.85	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-68.3	130.2	170.9	-70	168.6	-31.3	0	0	109.6
184	Y	26.5	Very low	27.7	Very low	229 Å²	229	150.2 Å²	150.2	90%	0.898	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-103.9	128.2	171.2	-133.8	-95.5	0	0	0	108.9
185	N	29.3	Very low	28	Very low	155 Å²	155	146.3 Å²	146.3	83%	0.829	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-79.4	128.4	-164.6	-152.1	6.6	0	0	0	111.3
186	E	26.4	Very low	28.2	Very low	176 Å²	176	149.1 Å²	149.1	82%	0.822	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-87.7	120.1	-176.3	-65.3	171.8	157.8	0	0	110.5
187	Q	26.4	Very low	28.4	Very low	197 Å²	197	150 Å²	150	92%	0.921	81%	0.814	S	S	*	*			trans	-168.6	84	160.1	-107.2	163.5	41.6	0	0	111
188	A	29.5	Very low	28.6	Very low	96 Å²	96	153.4 Å²	153.4	79%	0.793	82%	0.817	S	S	*	*	S	Bend	trans	-151.3	147.3	156.1	0	0	0	0	0	108.6
189	P	29.7	Very low	28.9	Very low	120 Å²	120	156.2 Å²	156.2	78%	0.779	82%	0.82	S	S	*	*			trans	-85.9	147	-152.2	33.3	-33.5	0	0	0	113.9	V191	P189-V191 PolarHBondContact O-N 3.04Å
190	N	29.1	Very low	29.4	Very low	151 Å²	151	156.1 Å²	156.1	81%	0.807	81%	0.812	S	S	*	*			trans	-22.8	102.3	171.5	-147	13	0	0	0	115.4
191	V	30.7	Very low	29.8	Very low	133 Å²	133	156 Å²	156	81%	0.806	81%	0.811	S	S	*	*			trans	-113	114.7	161.1	176.9	0	0	0	0	105.9	P189 E193	P189-V191 PolarHBondContact O-N 3.04Å; V191-E193 PolarHBondContact O-N 2.89Å
192	D	32.3	Very low	30.5	Very low	140 Å²	140	154.3 Å²	154.3	75%	0.749	81%	0.808	S	S	*	*			trans	-53.2	126.1	-179.6	-76.2	-45.8	0	0	0	111.6
193	E	32.3	Very low	31.6	Very low	183 Å²	183	151.7 Å²	151.7	86%	0.855	79%	0.787	S	S	*	*	S	Bend	trans	15.7	94.5	160.3	-66	-179.9	157.7	0	0	118.4	V191 V195	V191-E193 PolarHBondContact O-N 2.89Å; E193-V195 PolarHBondContact O-N 3.4Å
194	K	31.4	Very low	33.2	Very low	192 Å²	192	149.6 Å²	149.6	84%	0.835	78%	0.778	S	S	*	*			trans	29.4	89.5	133.3	-69.3	-178.9	179.4	175.9	0	116	I196	K194-I196 VanDerWaalsContact C-N 3.29Å; K194-I196 PolarHBondContact O-N 3.43Å
195	V	31.8	Very low	35.1	Very low	137 Å²	137	142.6 Å²	142.6	83%	0.83	76%	0.759	S	S	*	*			trans	-58.6	98.1	143.7	179.6	0	0	0	0	107.3	E193 L197	E193-V195 PolarHBondContact O-N 3.4Å; V195-L197 PolarHBondContact O-N 3.35Å
196	I	33.2	Very low	37	Very low	139 Å²	139	138.5 Å²	138.5	71%	0.713	74%	0.739	S	S	*	*			trans	-66.6	108.3	165.2	-62.2	171	0	0	0	104.8	K194 E198	K194-I196 VanDerWaalsContact C-N 3.29Å; K194-I196 PolarHBondContact O-N 3.43Å; I196-E198 PolarHBondContact O-N 3.1Å; I196-E198 VanDerWaalsContact O-N 3.12Å
197	L	29.3	Very low	39.3	Very low	144 Å²	144	132.7 Å²	132.7	75%	0.754	71%	0.714	S	S	*	*			trans	-56.1	116.8	164.5	-75.8	158.1	0	0	0	106	V195 D199	V195-L197 PolarHBondContact O-N 3.35Å; L197-D199 VanDerWaalsContact C-N 3.27Å; L197-D199 PolarHBondContact O-N 3.07Å
198	E	31.2	Very low	41.8	Very low	182 Å²	182	127.7 Å²	127.7	85%	0.85	70%	0.697	S	S	*	*			trans	-59	97	173.2	-69.5	-179	168.6	0	0	107.4	I196 F200	I196-E198 PolarHBondContact O-N 3.1Å; I196-E198 VanDerWaalsContact O-N 3.12Å; E198-F200 PolarHBondContact O-N 3.26Å
199	D	34.5	Very low	43.9	Very low	147 Å²	147	126 Å²	126	79%	0.786	67%	0.674	S	S	*	*			trans	-53.2	108.1	167	-80.2	-34.1	0	0	0	106.6	L197 V201	L197-D199 VanDerWaalsContact C-N 3.27Å; L197-D199 PolarHBondContact O-N 3.07Å; D199-V201 PolarHBondContact O-N 3.05Å
200	F	34.3	Very low	45.9	Very low	185 Å²	185	130.4 Å²	130.4	81%	0.811	68%	0.684	S	S	*	*			trans	14.9	98.5	157	-153.3	-93.9	0	0	0	113.2	E198 P202	E198-F200 PolarHBondContact O-N 3.26Å; F200-P202 WeakPolarHBondContact O-CD 3.48Å
201	V	36.3	Very low	47.9	Very low	117 Å²	117	127.8 Å²	127.8	71%	0.709	68%	0.678	S	S	*	*			trans	-44.3	109.1	178.4	-179.9	0	0	0	0	108.6	D199 V203	D199-V201 PolarHBondContact O-N 3.05Å; V201-V203 PolarHBondContact O-N 3.19Å; V201-V203 VanDerWaalsContact O-N 3.11Å
202	P	39.8	Very low	49.9	Very low	105 Å²	105	124 Å²	124	68%	0.682	67%	0.666	S	S	*	*			trans	-62.6	120.5	-179.3	-18.5	30.4	0	0	0	107.1	F200 E204	F200-P202 WeakPolarHBondContact O-CD 3.48Å; P202-E204 PolarHBondContact O-N 3.06Å
203	V	46.9	Very low	51.8	Low	75 Å²	75	118.9 Å²	118.9	46%	0.455	64%	0.643	S	S	.	*			trans	-65.3	104.7	172.1	-176.4	0	0	0	0	106	V201 T205 Y217 Y224	V201-V203 PolarHBondContact O-N 3.19Å; V201-V203 VanDerWaalsContact O-N 3.11Å; V203-T205 PolarHBondContact O-N 2.94Å; V203-T205 VanDerWaalsContact O-N 3.11Å; V203-Y217 HydrophobicContact CG1-CD1 4.26Å; V203-Y217 HydrophobicContact CG1-CD2 4.3Å; V203-Y217 HydrophobicContact CG1-CE1 4.47Å; V203-Y217 HydrophobicContact CG1-CG 4.16Å; V203-Y224 VanDerWaalsContact CG1-OH 3.24Å; V203-Y224 WeakPolarHBondContact CG1-OH 3.49Å
204	E	56.5	Low	53.9	Low	138 Å²	138	117.2 Å²	117.2	65%	0.645	63%	0.633	S	S	*	*			trans	-56.4	118.7	176.7	-72.2	-175.2	161.6	0	0	108.1	P202 T206 I207 Y224	P202-E204 PolarHBondContact O-N 3.06Å; E204-T206 PolarHBondContact O-N 3.41Å; E204-I207 HydrophobicContact CB-CG2 4.35Å; E204-Y224 WeakPolarHBondContact O-CE1 3.17Å; E204-Y224 PolarHBondContact O-OH 3.32Å
205	T	66.5	Low	56	Low	82 Å²	82	108.3 Å²	108.3	50%	0.503	60%	0.595	S	S	.	*	S	Bend	trans	-63.2	-15.7	-174.7	48.5	0	0	0	0	112.9	V203 K216 Y217	V203-T205 PolarHBondContact O-N 2.94Å; V203-T205 VanDerWaalsContact O-N 3.11Å; T205-K216 CarbonylContact O-C 3.59Å; T205-K216 VanDerWaalsContact O-CA 3.23Å; T205-K216 WeakPolarHBondContact O-CA 3.32Å; T205-K216 WeakPolarHBondContact O-CG 3.19Å; T205-Y217 PolarHBondContact O-N 3.4Å
206	T	69.9	Low	58.2	Low	69 Å²	69	106.1 Å²	106.1	42%	0.423	57%	0.574	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-139.7	120.8	176.7	24.8	0	0	0	0	110	E204 C215 K216 I227	E204-T206 PolarHBondContact O-N 3.41Å; T206-C215 CarbonylContact C-O 3.57Å; T206-C215 WeakPolarHBondContact CA-O 3.39Å; T206-K216 HydrophobicContact CG2-CB 3.98Å; T206-K216 HydrophobicContact CG2-CG 4.19Å; T206-I227 HydrophobicContact CG2-CD1 3.61Å
207	I	74.2	Confident	59.9	Low	55 Å²	55	102 Å²	102	28%	0.282	55%	0.55	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-111.6	163.5	171.4	63.6	174.9	0	0	0	109.6	E204 K214 C215 Y224	E204-I207 HydrophobicContact CB-CG2 4.35Å; I207-K214 CarbonylContact O-C 3.31Å; I207-C215 HydrophobicContact CG1-CB 4.15Å; I207-C215 PolarHBondContact N-O 2.99Å; I207-C215 PolarHBondContact O-N 2.83Å; I207-C215 VanDerWaalsContact O-O 3.14Å; I207-Y224 HydrophobicContact CB-CD1 4.41Å; I207-Y224 HydrophobicContact CB-CE1 4.18Å; I207-Y224 HydrophobicContact CD1-CD1 3.65Å; I207-Y224 HydrophobicContact CD1-CD2 3.36Å; I207-Y224 HydrophobicContact CD1-CE1 3.88Å; I207-Y224 HydrophobicContact CD1-CE2 3.63Å; I207-Y224 HydrophobicContact CD1-CG 3.36Å; I207-Y224 HydrophobicContact CG1-CD1 3.45Å; I207-Y224 VanDerWaalsContact CG1-CD1 3.45Å; I207-Y224 HydrophobicContact CG1-CD2 4.16Å; I207-Y224 HydrophobicContact CG1-CE1 3.67Å; I207-Y224 HydrophobicContact CG1-CE2 4.36Å; I207-Y224 HydrophobicContact CG1-CG 3.7Å; I207-Y224 HydrophobicContact CG2-CD1 4.37Å; I207-Y224 HydrophobicContact CG2-CE1 3.66Å; I207-Y224 HydrophobicContact CG2-CE2 4.42Å
208	T	77.8	Confident	61.7	Low	91 Å²	91	97.2 Å²	97.2	56%	0.558	53%	0.525	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.2	122.3	168.4	-15.5	0	0	0	0	106.5	G212 A213 K214	T208-G212 WeakPolarHBondContact CG2-O 3.28Å; T208-A213 WeakPolarHBondContact CA-O 3.48Å; T208-K214 HydrophobicContact CG2-CG 3.9Å
209	D	74.2	Confident	63.3	Low	61 Å²	61	94.5 Å²	94.5	33%	0.326	51%	0.511	S	S	.	.			trans	-72.6	174.9	179.7	73.4	5.6	0	0	0	111.9	S211 G212 A213	D209-S211 PolarHBondContact O-N 2.88Å; D209-S211 VanDerWaalsContact O-N 3.1Å; D209-S211 WeakPolarHBondContact OD1-CA 3.36Å; D209-S211 WeakPolarHBondContact OD1-CB 3.32Å; D209-S211 PolarHBondContact OD1-N 3.12Å; D209-S211 PolarHBondContact OD1-OG 3.24Å; D209-S211 PolarHBondContact OD2-OG 3.27Å; D209-S211 VanDerWaalsContact OD2-OG 3.06Å; D209-G212 PolarHBondContact O-N 3.1Å; D209-G212 PolarHBondContact OD1-N 3.25Å; D209-G212 VanDerWaalsContact OD1-N 3.08Å; D209-A213 PolarHBondContact N-O 3.14Å; D209-A213 WeakPolarHBondContact OD1-CB 3.42Å; D209-A213 PolarHBondContact OD1-N 3.46Å
210	E	70.9	Confident	64.1	Low	212 Å²	212	91.3 Å²	91.3	99%	0.991	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-17.2	178.5	-64	-174.2	168.6	0	0	113.2	G212	E210-G212 VanDerWaalsContact C-N 3.33Å
211	S	70.9	Confident	65.2	Low	97 Å²	97	86.8 Å²	86.8	68%	0.678	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-4.7	175.9	81.8	0	0	0	0	113.3	D209 A213	D209-S211 PolarHBondContact O-N 2.88Å; D209-S211 VanDerWaalsContact O-N 3.1Å; D209-S211 WeakPolarHBondContact OD1-CA 3.36Å; D209-S211 WeakPolarHBondContact OD1-CB 3.32Å; D209-S211 PolarHBondContact OD1-N 3.12Å; D209-S211 PolarHBondContact OD1-OG 3.24Å; D209-S211 PolarHBondContact OD2-OG 3.27Å; D209-S211 VanDerWaalsContact OD2-OG 3.06Å; S211-A213 VanDerWaalsContact C-N 3.31Å
212	G	73.5	Confident	66.1	Low	54 Å²	54	89 Å²	89	56%	0.557	49%	0.489	S	S	*	.	S	Bend	trans	82.1	6.6	-176.2	0	0	0	0	0	113.8	T208 D209 E210	T208-G212 WeakPolarHBondContact CG2-O 3.28Å; D209-G212 PolarHBondContact O-N 3.1Å; D209-G212 PolarHBondContact OD1-N 3.25Å; D209-G212 VanDerWaalsContact OD1-N 3.08Å; E210-G212 VanDerWaalsContact C-N 3.33Å
213	A	72.4	Confident	67.3	Low	31 Å²	31	89.1 Å²	89.1	26%	0.256	48%	0.482	S	S	.	.			trans	-77.7	129.6	175.4	0	0	0	0	0	110	T208 D209 S211 C215	T208-A213 WeakPolarHBondContact CA-O 3.48Å; D209-A213 PolarHBondContact N-O 3.14Å; D209-A213 WeakPolarHBondContact OD1-CB 3.42Å; D209-A213 PolarHBondContact OD1-N 3.46Å; S211-A213 VanDerWaalsContact C-N 3.31Å; A213-C215 PolarHBondContact O-N 3.46Å; A213-C215 PolarHBondContact O-SG 2.71Å
214	K	76.2	Confident	68.7	Low	148 Å²	148	89 Å²	89	64%	0.643	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.6	118.1	173.6	-76.7	-178.5	177.7	177.8	0	109.1	I207 T208 P226 I227	I207-K214 CarbonylContact O-C 3.31Å; T208-K214 HydrophobicContact CG2-CG 3.9Å; K214-P226 WeakPolarHBondContact O-CA 3.32Å; K214-I227 HydrophobicContact CB-CD1 4.38Å; K214-I227 PolarHBondContact O-N 2.91Å
215	C	75.8	Confident	69.4	Low	6 Å²	6	88.8 Å²	88.8	4%	0.041	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	132.5	-179.2	-53	0	0	0	0	111.6	T206 I207 A213 R225	T206-C215 CarbonylContact C-O 3.57Å; T206-C215 WeakPolarHBondContact CA-O 3.39Å; I207-C215 HydrophobicContact CG1-CB 4.15Å; I207-C215 PolarHBondContact N-O 2.99Å; I207-C215 PolarHBondContact O-N 2.83Å; I207-C215 VanDerWaalsContact O-O 3.14Å; A213-C215 PolarHBondContact O-N 3.46Å; A213-C215 PolarHBondContact O-SG 2.71Å; C215-R225 CarbonylContact C-O 3.38Å; C215-R225 WeakPolarHBondContact CA-O 3.44Å; C215-R225 WeakPolarHBondContact CB-O 3.46Å
216	K	78.6	Confident	69.8	Low	91 Å²	91	88.4 Å²	88.4	40%	0.396	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	141	175.3	-169.5	175.8	176.9	-179.5	0	110.3	T205 T206 D218 Y224 R225 I227 E233	T205-K216 CarbonylContact O-C 3.59Å; T205-K216 VanDerWaalsContact O-CA 3.23Å; T205-K216 WeakPolarHBondContact O-CA 3.32Å; T205-K216 WeakPolarHBondContact O-CG 3.19Å; T206-K216 HydrophobicContact CG2-CB 3.98Å; T206-K216 HydrophobicContact CG2-CG 4.19Å; K216-D218 PolarHBondContact O-N 2.68Å; K216-Y224 CarbonylContact O-C 3.5Å; K216-Y224 WeakPolarHBondContact O-CA 3.38Å; K216-R225 PolarHBondContact N-O 3.35Å; K216-R225 PolarHBondContact O-N 3.05Å; K216-I227 HydrophobicContact CB-CD1 4.1Å; K216-I227 HydrophobicContact CB-CG1 3.86Å; K216-E233 IonicContact NZ-OE1 2.8Å; K216-E233 PolarHBondContact NZ-OE1 3.34Å
217	Y	68.6	Low	70.1	Confident	52 Å²	52	89.3 Å²	89.3	20%	0.204	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	118.7	177.5	-162.3	-109.4	0	0	0	110.4	V203 T205 F219 K222 Y224	V203-Y217 HydrophobicContact CG1-CD1 4.26Å; V203-Y217 HydrophobicContact CG1-CD2 4.3Å; V203-Y217 HydrophobicContact CG1-CE1 4.47Å; V203-Y217 HydrophobicContact CG1-CG 4.16Å; T205-Y217 PolarHBondContact O-N 3.4Å; Y217-F219 AromaticContact CD1-CD1 3.88Å; Y217-F219 HydrophobicContact CD1-CD1 3.88Å; Y217-F219 AromaticContact CD1-CE1 3.84Å; Y217-F219 HydrophobicContact CD1-CE1 3.84Å; Y217-F219 HydrophobicContact CD1-CG 4.25Å; Y217-F219 HydrophobicContact CD1-CZ 4.16Å; Y217-F219 HydrophobicContact CE1-CD1 4.08Å; Y217-F219 HydrophobicContact CE1-CE1 4.25Å; Y217-K222 WeakPolarHBondContact OH-CA 3.33Å; Y217-K222 PolarHBondContact OH-O 2.96Å; Y217-Y224 VanDerWaalsContact CB-CE1 3.49Å; Y217-Y224 AromaticContact CD2-CD1 3.84Å; Y217-Y224 HydrophobicContact CD2-CD1 3.84Å; Y217-Y224 AromaticContact CD2-CD2 3.57Å; Y217-Y224 HydrophobicContact CD2-CD2 3.57Å; Y217-Y224 AromaticContact CD2-CE1 3.68Å; Y217-Y224 HydrophobicContact CD2-CE1 3.68Å; Y217-Y224 AromaticContact CD2-CE2 3.37Å; Y217-Y224 HydrophobicContact CD2-CE2 3.37Å; Y217-Y224 AromaticContact CD2-CG 3.8Å; Y217-Y224 HydrophobicContact CD2-CG 3.8Å; Y217-Y224 AromaticContact CD2-CZ 3.43Å; Y217-Y224 VanDerWaalsContact CD2-CZ 3.43Å; Y217-Y224 HydrophobicContact CE2-CD2 4.07Å; Y217-Y224 AromaticContact CE2-CE2 3.83Å; Y217-Y224 HydrophobicContact CE2-CE2 3.83Å; Y217-Y224 HydrophobicContact CG-CD1 4.31Å; Y217-Y224 HydrophobicContact CG-CE1 4.02Å; Y217-Y224 HydrophobicContact CG-CE2 4.42Å
218	D	67.3	Low	69.3	Low	44 Å²	44	93.6 Å²	93.6	24%	0.235	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	106.8	173.7	-174.4	-25.9	0	0	0	109.2	K216 A220 L221 K222 M223 R225	K216-D218 PolarHBondContact O-N 2.68Å; D218-A220 VanDerWaalsContact C-N 3.29Å; D218-A220 PolarHBondContact O-N 3.21Å; D218-A220 WeakPolarHBondContact OD1-CB 3.21Å; D218-A220 PolarHBondContact OD1-N 3.21Å; D218-L221 HydrophobicContact CB-CB 4.43Å; D218-L221 PolarHBondContact O-N 3.5Å; D218-L221 PolarHBondContact OD1-N 2.85Å; D218-K222 WeakPolarHBondContact O-CA 3.45Å; D218-K222 PolarHBondContact O-N 3.21Å; D218-M223 WeakPolarHBondContact CB-O 3.22Å; D218-M223 PolarHBondContact N-O 3.09Å; D218-M223 PolarHBondContact O-N 3.06Å; D218-R225 IonicContact OD2-NE 3.13Å
219	F	63.4	Low	67.6	Low	124 Å²	124	94.4 Å²	94.4	54%	0.544	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-26.9	-178.8	-67.4	-83.5	0	0	0	113.5	Y217	Y217-F219 AromaticContact CD1-CD1 3.88Å; Y217-F219 HydrophobicContact CD1-CD1 3.88Å; Y217-F219 AromaticContact CD1-CE1 3.84Å; Y217-F219 HydrophobicContact CD1-CE1 3.84Å; Y217-F219 HydrophobicContact CD1-CG 4.25Å; Y217-F219 HydrophobicContact CD1-CZ 4.16Å; Y217-F219 HydrophobicContact CE1-CD1 4.08Å; Y217-F219 HydrophobicContact CE1-CE1 4.25Å
220	A	52.6	Low	65.6	Low	81 Å²	81	98.5 Å²	98.5	67%	0.669	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-35.1	178.6	0	0	0	0	0	111.1	D218	D218-A220 VanDerWaalsContact C-N 3.29Å; D218-A220 PolarHBondContact O-N 3.21Å; D218-A220 WeakPolarHBondContact OD1-CB 3.21Å; D218-A220 PolarHBondContact OD1-N 3.21Å
221	L	56	Low	63.7	Low	89 Å²	89	93.6 Å²	93.6	47%	0.466	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-9.5	-178.4	-63.1	177	0	0	0	114.5	D218 M223	D218-L221 HydrophobicContact CB-CB 4.43Å; D218-L221 PolarHBondContact O-N 3.5Å; D218-L221 PolarHBondContact OD1-N 2.85Å; L221-M223 VanDerWaalsContact C-N 3.33Å; L221-M223 HydrophobicContact CB-CG 3.85Å; L221-M223 HydrophobicContact CB-SD 4.17Å; L221-M223 PolarHBondContact O-N 3.25Å
222	K	55.1	Low	61.7	Low	165 Å²	165	96.6 Å²	96.6	72%	0.717	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	37.3	-177	-58.8	-177.2	176.2	-178.6	0	114	Y217 D218	Y217-K222 WeakPolarHBondContact OH-CA 3.33Å; Y217-K222 PolarHBondContact OH-O 2.96Å; D218-K222 WeakPolarHBondContact O-CA 3.45Å; D218-K222 PolarHBondContact O-N 3.21Å
223	M	66.3	Low	59.6	Low	106 Å²	106	101.7 Å²	101.7	52%	0.522	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	159.1	-179.3	62.8	-170.6	-65.6	0	0	111.9	D218 L221	D218-M223 WeakPolarHBondContact CB-O 3.22Å; D218-M223 PolarHBondContact N-O 3.09Å; D218-M223 PolarHBondContact O-N 3.06Å; L221-M223 VanDerWaalsContact C-N 3.33Å; L221-M223 HydrophobicContact CB-CG 3.85Å; L221-M223 HydrophobicContact CB-SD 4.17Å; L221-M223 PolarHBondContact O-N 3.25Å
224	Y	76.2	Confident	57.4	Low	72 Å²	72	107.6 Å²	107.6	28%	0.282	56%	0.556	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.4	136.2	177	-70.9	-85.5	0	0	0	111.6	V203 E204 I207 K216 Y217	V203-Y224 VanDerWaalsContact CG1-OH 3.24Å; V203-Y224 WeakPolarHBondContact CG1-OH 3.49Å; E204-Y224 WeakPolarHBondContact O-CE1 3.17Å; E204-Y224 PolarHBondContact O-OH 3.32Å; I207-Y224 HydrophobicContact CB-CD1 4.41Å; I207-Y224 HydrophobicContact CB-CE1 4.18Å; I207-Y224 HydrophobicContact CD1-CD1 3.65Å; I207-Y224 HydrophobicContact CD1-CD2 3.36Å; I207-Y224 HydrophobicContact CD1-CE1 3.88Å; I207-Y224 HydrophobicContact CD1-CE2 3.63Å; I207-Y224 HydrophobicContact CD1-CG 3.36Å; I207-Y224 HydrophobicContact CG1-CD1 3.45Å; I207-Y224 VanDerWaalsContact CG1-CD1 3.45Å; I207-Y224 HydrophobicContact CG1-CD2 4.16Å; I207-Y224 HydrophobicContact CG1-CE1 3.67Å; I207-Y224 HydrophobicContact CG1-CE2 4.36Å; I207-Y224 HydrophobicContact CG1-CG 3.7Å; I207-Y224 HydrophobicContact CG2-CD1 4.37Å; I207-Y224 HydrophobicContact CG2-CE1 3.66Å; I207-Y224 HydrophobicContact CG2-CE2 4.42Å; K216-Y224 CarbonylContact O-C 3.5Å; K216-Y224 WeakPolarHBondContact O-CA 3.38Å; Y217-Y224 VanDerWaalsContact CB-CE1 3.49Å; Y217-Y224 AromaticContact CD2-CD1 3.84Å; Y217-Y224 HydrophobicContact CD2-CD1 3.84Å; Y217-Y224 AromaticContact CD2-CD2 3.57Å; Y217-Y224 HydrophobicContact CD2-CD2 3.57Å; Y217-Y224 AromaticContact CD2-CE1 3.68Å; Y217-Y224 HydrophobicContact CD2-CE1 3.68Å; Y217-Y224 AromaticContact CD2-CE2 3.37Å; Y217-Y224 HydrophobicContact CD2-CE2 3.37Å; Y217-Y224 AromaticContact CD2-CG 3.8Å; Y217-Y224 HydrophobicContact CD2-CG 3.8Å; Y217-Y224 AromaticContact CD2-CZ 3.43Å; Y217-Y224 VanDerWaalsContact CD2-CZ 3.43Å; Y217-Y224 HydrophobicContact CE2-CD2 4.07Å; Y217-Y224 AromaticContact CE2-CE2 3.83Å; Y217-Y224 HydrophobicContact CE2-CE2 3.83Å; Y217-Y224 HydrophobicContact CG-CD1 4.31Å; Y217-Y224 HydrophobicContact CG-CE1 4.02Å; Y217-Y224 HydrophobicContact CG-CE2 4.42Å
225	R	70.7	Confident	55.2	Low	134 Å²	134	106 Å²	106	51%	0.506	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.7	139.1	176	-74.2	-172.7	172.7	-158.6	-2	111.6	C215 K216 D218	C215-R225 CarbonylContact C-O 3.38Å; C215-R225 WeakPolarHBondContact CA-O 3.44Å; C215-R225 WeakPolarHBondContact CB-O 3.46Å; K216-R225 PolarHBondContact N-O 3.35Å; K216-R225 PolarHBondContact O-N 3.05Å; D218-R225 IonicContact OD2-NE 3.13Å
226	P	76.2	Confident	52.9	Low	74 Å²	74	111.5 Å²	111.5	48%	0.481	60%	0.599	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-53	137.4	171.1	-23.1	33.6	0	0	0	111.9	K214 D228	K214-P226 WeakPolarHBondContact O-CA 3.32Å; P226-D228 PolarHBondContact O-N 3.42Å
227	I	74.9	Confident	50.6	Low	89 Å²	89	113.1 Å²	113.1	46%	0.456	62%	0.617	S	S	.	*			trans	-81.3	102.3	174.9	-61.7	167.8	0	0	0	107.6	T206 K214 K216 S229	T206-I227 HydrophobicContact CG2-CD1 3.61Å; K214-I227 HydrophobicContact CB-CD1 4.38Å; K214-I227 PolarHBondContact O-N 2.91Å; K216-I227 HydrophobicContact CB-CD1 4.1Å; K216-I227 HydrophobicContact CB-CG1 3.86Å; I227-S229 PolarHBondContact O-N 3.08Å
228	D	57.4	Low	48.7	Very low	145 Å²	145	117.2 Å²	117.2	78%	0.775	64%	0.642	S	S	*	*			trans	-68.8	114.8	170.1	-64.2	-39.3	0	0	0	108.8	P226 D230	P226-D228 PolarHBondContact O-N 3.42Å; D228-D230 VanDerWaalsContact C-N 3.25Å; D228-D230 PolarHBondContact O-N 3.4Å
229	S	42	Very low	46.8	Very low	107 Å²	107	122 Å²	122	75%	0.748	67%	0.667	S	S	*	*	S	Bend	trans	-72.5	81.5	173.6	56	0	0	0	0	109.1	I227	I227-S229 PolarHBondContact O-N 3.08Å
230	D	32.8	Very low	45.2	Very low	148 Å²	148	120.3 Å²	120.3	79%	0.791	68%	0.675	S	S	*	*			trans	177.9	128.1	136.7	-89.5	-26.7	0	0	0	113.1	D228	D228-D230 VanDerWaalsContact C-N 3.25Å; D228-D230 PolarHBondContact O-N 3.4Å
231	S	30.4	Very low	44.1	Very low	108 Å²	108	123.3 Å²	123.3	76%	0.755	68%	0.68	S	S	*	*	S	Bend	trans	80.2	110.1	152.9	70.4	0	0	0	0	121.5
232	N	29.7	Very low	43.1	Very low	160 Å²	160	126.3 Å²	126.3	86%	0.856	69%	0.687	S	S	*	*			trans	65.5	76.8	145	-67.4	-14.6	0	0	0	119.5	N234	N232-N234 PolarHBondContact O-N 2.73Å
233	E	29.3	Very low	42.1	Very low	162 Å²	162	123.3 Å²	123.3	76%	0.757	69%	0.686	S	S	*	*			trans	-62.1	110.7	161.3	-66.9	-176	146.2	0	0	111.5	K216	K216-E233 IonicContact NZ-OE1 2.8Å; K216-E233 PolarHBondContact NZ-OE1 3.34Å
234	N	26.8	Very low	40.7	Very low	154 Å²	154	120.1 Å²	120.1	82%	0.824	68%	0.681	S	S	*	*			trans	-71.1	133.7	152.3	-83.3	-30.3	0	0	0	108.1	N232 S236	N232-N234 PolarHBondContact O-N 2.73Å; N234-S236 PolarHBondContact O-N 3.22Å; N234-S236 VanDerWaalsContact O-N 3.07Å
235	P	29.3	Very low	39.1	Very low	115 Å²	115	121.3 Å²	121.3	75%	0.747	69%	0.692	S	S	*	*			trans	-69.2	112	-168.8	27.3	-33.1	0	0	0	110.7	V237	P235-V237 PolarHBondContact O-N 2.85Å
236	S	27.3	Very low	37.9	Very low	122 Å²	122	117.4 Å²	117.4	85%	0.853	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-69.9	120.1	167.2	47.6	0	0	0	0	108.9	N234	N234-S236 PolarHBondContact O-N 3.22Å; N234-S236 VanDerWaalsContact O-N 3.07Å
237	V	30.1	Very low	36.4	Very low	125 Å²	125	119.5 Å²	119.5	76%	0.758	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-96	128.3	-179	175.4	0	0	0	0	109.1	P235	P235-V237 PolarHBondContact O-N 2.85Å
238	D	28	Very low	35.4	Very low	137 Å²	137	121.9 Å²	121.9	73%	0.733	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-51.2	130.4	-179.7	-78.8	-44.7	0	0	0	114.3	A240	D238-A240 PolarHBondContact O-N 2.96Å
239	L	28.8	Very low	35.4	Very low	145 Å²	145	116.9 Å²	116.9	76%	0.759	67%	0.674	S	S	*	*			trans	-90.3	91.4	178.3	-79.2	128.9	0	0	0	111
240	A	29.2	Very low	36.4	Very low	88 Å²	88	112.1 Å²	112.1	73%	0.727	64%	0.641	S	S	*	*			trans	-138.1	131	165	0	0	0	0	0	112.1	D238	D238-A240 PolarHBondContact O-N 2.96Å
241	D	30.7	Very low	38.2	Very low	145 Å²	145	107.8 Å²	107.8	78%	0.775	63%	0.626	S	S	*	*			trans	72.8	114.8	169.8	-70	-18.8	0	0	0	121	S243 G244	D241-S243 VanDerWaalsContact C-N 3.28Å; D241-S243 PolarHBondContact O-N 2.98Å; D241-G244 PolarHBondContact O-N 2.99Å
242	Y	34.5	Very low	40.2	Very low	152 Å²	152	106.7 Å²	106.7	60%	0.596	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.7	-22.1	-170.8	-121.7	-104.1	0	0	0	117.5	L117 G244	L117-Y242 PolarHBondContact O-OH 3.11Å; Y242-G244 VanDerWaalsContact C-N 3.32Å
243	S	34.5	Very low	42.2	Very low	102 Å²	102	100.5 Å²	100.5	71%	0.713	58%	0.577	S	S	*	*	H	α-helix	trans	-78.5	-19.1	177.6	115.2	0	0	0	0	112.5	D241	D241-S243 VanDerWaalsContact C-N 3.28Å; D241-S243 PolarHBondContact O-N 2.98Å
244	G	36	Very low	44.6	Very low	39 Å²	39	96.1 Å²	96.1	40%	0.402	56%	0.559	S	S	.	*	H	α-helix	trans	-71.9	-40.7	175.1	0	0	0	0	0	112.5	D241 Y242 V246 M247 F248	D241-G244 PolarHBondContact O-N 2.99Å; Y242-G244 VanDerWaalsContact C-N 3.32Å; G244-V246 PolarHBondContact O-N 3.06Å; G244-M247 PolarHBondContact O-N 2.91Å; G244-F248 WeakPolarHBondContact O-CB 3.25Å; G244-F248 PolarHBondContact O-N 3.41Å
245	N	42.1	Very low	47.2	Very low	97 Å²	97	91.2 Å²	91.2	52%	0.519	54%	0.54	S	S	.	.	H	α-helix	trans	-61.2	-41.5	-174	-79.9	1.3	0	0	0	113.4	F248 A249	N245-F248 PolarHBondContact O-N 3.34Å; N245-A249 PolarHBondContact O-N 3.21Å
246	V	45.8	Very low	49.7	Very low	51 Å²	51	88.6 Å²	88.6	31%	0.309	52%	0.517	S	S	.	.	H	α-helix	trans	-70.5	-40.6	-178.7	-174.7	0	0	0	0	111.1	G244 F248 A249 G250 A292 F293	G244-V246 PolarHBondContact O-N 3.06Å; V246-F248 VanDerWaalsContact C-N 3.31Å; V246-F248 PolarHBondContact O-N 2.97Å; V246-A249 PolarHBondContact O-N 3.49Å; V246-G250 PolarHBondContact O-N 3.18Å; V246-G250 VanDerWaalsContact O-N 3.14Å; V246-A292 HydrophobicContact CG1-CB 3.86Å; V246-F293 HydrophobicContact CG1-CD2 4.15Å; V246-F293 HydrophobicContact CG1-CE2 3.34Å; V246-F293 HydrophobicContact CG1-CZ 3.91Å; V246-F293 WeakPolarHBondContact O-CZ 3.41Å
247	M	45.2	Very low	52.6	Low	118 Å²	118	84.7 Å²	84.7	58%	0.581	49%	0.485	S	S	*	.	H	α-helix	trans	-65.1	-36	173.7	-70.9	-73.3	-112	0	0	111.8	G244 A251 F293	G244-M247 PolarHBondContact O-N 2.91Å; M247-A251 WeakPolarHBondContact O-CB 3.04Å; M247-A251 PolarHBondContact O-N 3.21Å; M247-F293 HydrophobicContact SD-CD1 4.47Å; M247-F293 HydrophobicContact SD-CE1 3.64Å; M247-F293 HydrophobicContact SD-CZ 4.26Å
248	F	53.5	Low	55.2	Low	139 Å²	139	86.7 Å²	86.7	61%	0.61	48%	0.479	S	S	*	.	H	α-helix	trans	-67.5	-45.1	176.8	-167.9	-106.2	0	0	0	111.8	G244 N245 V246 G250 A251 I252	G244-F248 WeakPolarHBondContact O-CB 3.25Å; G244-F248 PolarHBondContact O-N 3.41Å; N245-F248 PolarHBondContact O-N 3.34Å; V246-F248 VanDerWaalsContact C-N 3.31Å; V246-F248 PolarHBondContact O-N 2.97Å; F248-G250 PolarHBondContact O-N 2.99Å; F248-A251 WeakPolarHBondContact O-CB 3.38Å; F248-A251 PolarHBondContact O-N 3.34Å; F248-A251 VanDerWaalsContact O-N 3.14Å; F248-I252 HydrophobicContact CD1-CD1 3.41Å; F248-I252 VanDerWaalsContact CD1-CD1 3.41Å; F248-I252 HydrophobicContact CD1-CG1 4.22Å; F248-I252 HydrophobicContact CE1-CD1 3.28Å; F248-I252 HydrophobicContact CE1-CG1 4.06Å; F248-I252 HydrophobicContact CG-CD1 4.31Å; F248-I252 HydrophobicContact CZ-CD1 4.07Å; F248-I252 HydrophobicContact CZ-CG1 4.41Å; F248-I252 WeakPolarHBondContact O-CG1 3.45Å; F248-I252 PolarHBondContact O-N 2.95Å
249	A	57.2	Low	58	Low	40 Å²	40	85.4 Å²	85.4	33%	0.331	47%	0.469	S	S	.	.	H	α-helix	trans	-58.4	-48.4	175.7	0	0	0	0	0	112	N245 V246 A251 I252 Q253	N245-A249 PolarHBondContact O-N 3.21Å; V246-A249 PolarHBondContact O-N 3.49Å; A249-A251 VanDerWaalsContact C-N 3.3Å; A249-A251 PolarHBondContact O-N 3.34Å; A249-I252 PolarHBondContact O-N 3.06Å; A249-Q253 PolarHBondContact O-N 2.7Å
250	G	63.1	Low	60.7	Low	7 Å²	7	79 Å²	79	7%	0.072	44%	0.435	C	S	.	.	H	α-helix	trans	-63	-34.1	175.7	0	0	0	0	0	113	V246 F248 N254	V246-G250 PolarHBondContact O-N 3.18Å; V246-G250 VanDerWaalsContact O-N 3.14Å; F248-G250 PolarHBondContact O-N 2.99Å; G250-N254 WeakPolarHBondContact O-CB 3.47Å; G250-N254 PolarHBondContact O-N 3.16Å; G250-N254 PolarHBondContact O-ND2 2.9Å
251	A	70.1	Confident	63.5	Low	57 Å²	57	76.5 Å²	76.5	47%	0.471	41%	0.412	S	S	.	.	H	α-helix	trans	-68.9	-39.7	175.1	0	0	0	0	0	112.6	M247 F248 A249 N254 A255	M247-A251 WeakPolarHBondContact O-CB 3.04Å; M247-A251 PolarHBondContact O-N 3.21Å; F248-A251 WeakPolarHBondContact O-CB 3.38Å; F248-A251 PolarHBondContact O-N 3.34Å; F248-A251 VanDerWaalsContact O-N 3.14Å; A249-A251 VanDerWaalsContact C-N 3.3Å; A249-A251 PolarHBondContact O-N 3.34Å; A251-N254 PolarHBondContact O-N 2.94Å; A251-A255 WeakPolarHBondContact O-CB 3.45Å; A251-A255 PolarHBondContact O-N 3.25Å
252	I	73.8	Confident	66.1	Low	86 Å²	86	75.9 Å²	75.9	44%	0.441	41%	0.405	S	S	.	.	H	α-helix	trans	-61.4	-50.9	175.2	-68.9	162.9	0	0	0	110.3	F248 A249 N254 A255 E256	F248-I252 HydrophobicContact CD1-CD1 3.41Å; F248-I252 VanDerWaalsContact CD1-CD1 3.41Å; F248-I252 HydrophobicContact CD1-CG1 4.22Å; F248-I252 HydrophobicContact CE1-CD1 3.28Å; F248-I252 HydrophobicContact CE1-CG1 4.06Å; F248-I252 HydrophobicContact CG-CD1 4.31Å; F248-I252 HydrophobicContact CZ-CD1 4.07Å; F248-I252 HydrophobicContact CZ-CG1 4.41Å; F248-I252 WeakPolarHBondContact O-CG1 3.45Å; F248-I252 PolarHBondContact O-N 2.95Å; A249-I252 PolarHBondContact O-N 3.06Å; I252-N254 VanDerWaalsContact C-N 3.34Å; I252-N254 PolarHBondContact O-N 3.28Å; I252-A255 CarbonylContact O-C 3.53Å; I252-A255 WeakPolarHBondContact O-CA 3.48Å; I252-A255 WeakPolarHBondContact O-CB 3Å; I252-A255 PolarHBondContact O-N 3.49Å; I252-E256 PolarHBondContact O-N 2.8Å
253	Q	72	Confident	68.6	Low	29 Å²	29	72 Å²	72	14%	0.136	39%	0.392	C	S	.	.	H	α-helix	trans	-66.7	-35.3	-179.1	-71.8	169.7	-33.4	0	0	112.5	A249 A255 E256 H257 E283 L284 L287	A249-Q253 PolarHBondContact O-N 2.7Å; Q253-A255 VanDerWaalsContact C-N 3.28Å; Q253-A255 PolarHBondContact O-N 3.06Å; Q253-E256 PolarHBondContact O-N 3.42Å; Q253-H257 WeakPolarHBondContact O-CB 3.45Å; Q253-H257 PolarHBondContact O-N 3.06Å; Q253-E283 PolarHBondContact NE2-OE2 3.37Å; Q253-E283 VanDerWaalsContact NE2-OE2 3.15Å; Q253-L284 HydrophobicContact CB-CD2 3.62Å; Q253-L284 HydrophobicContact CB-CG 4.38Å; Q253-L287 VanDerWaalsContact CD-CD1 3.49Å
254	N	78.4	Confident	71.2	Confident	71 Å²	71	67.4 Å²	67.4	38%	0.38	36%	0.36	S	S	.	.	H	α-helix	trans	-65.4	-32.1	171.7	-81.7	-58.8	0	0	0	112.3	G250 A251 I252 R258	G250-N254 WeakPolarHBondContact O-CB 3.47Å; G250-N254 PolarHBondContact O-N 3.16Å; G250-N254 PolarHBondContact O-ND2 2.9Å; A251-N254 PolarHBondContact O-N 2.94Å; I252-N254 VanDerWaalsContact C-N 3.34Å; I252-N254 PolarHBondContact O-N 3.28Å; N254-R258 WeakPolarHBondContact O-CG 3.48Å; N254-R258 PolarHBondContact O-N 3.41Å
255	A	81.3	Confident	73.5	Confident	51 Å²	51	72.1 Å²	72.1	42%	0.421	38%	0.376	S	S	.	.	H	α-helix	trans	-70.8	-43.1	173.1	0	0	0	0	0	111.2	A251 I252 Q253 R258 H259	A251-A255 WeakPolarHBondContact O-CB 3.45Å; A251-A255 PolarHBondContact O-N 3.25Å; I252-A255 CarbonylContact O-C 3.53Å; I252-A255 WeakPolarHBondContact O-CA 3.48Å; I252-A255 WeakPolarHBondContact O-CB 3Å; I252-A255 PolarHBondContact O-N 3.49Å; Q253-A255 VanDerWaalsContact C-N 3.28Å; Q253-A255 PolarHBondContact O-N 3.06Å; A255-R258 PolarHBondContact O-N 2.9Å; A255-H259 PolarHBondContact O-N 3.45Å
256	E	83.1	Confident	75.6	Confident	60 Å²	60	72 Å²	72	28%	0.28	38%	0.383	S	S	.	.	H	α-helix	trans	-60.3	-43.8	173.4	-173.2	-176.8	171.1	0	0	111	I252 Q253 R258 H259 L260 R276 L280	I252-E256 PolarHBondContact O-N 2.8Å; Q253-E256 PolarHBondContact O-N 3.42Å; E256-R258 VanDerWaalsContact C-N 3.32Å; E256-R258 PolarHBondContact O-N 2.8Å; E256-H259 WeakPolarHBondContact O-CB 3.38Å; E256-H259 PolarHBondContact O-N 2.77Å; E256-H259 VanDerWaalsContact O-N 3.15Å; E256-L260 HydrophobicContact CG-CD1 4.08Å; E256-L260 HydrophobicContact CG-CG 4.32Å; E256-L260 WeakPolarHBondContact O-CB 3.42Å; E256-L260 WeakPolarHBondContact O-CG 3.29Å; E256-L260 PolarHBondContact O-N 2.87Å; E256-R276 IonicContact OE1-CZ 3.7Å; E256-R276 IonicContact OE1-NE 2.74Å; E256-R276 PolarHBondContact OE1-NE 3.17Å; E256-R276 IonicContact OE1-NH2 2.77Å; E256-R276 PolarHBondContact OE1-NH2 3.41Å; E256-R276 IonicContact OE2-NH2 3.46Å; E256-R276 PolarHBondContact OE2-NH2 3.28Å; E256-L280 HydrophobicContact CB-CD1 3.79Å; E256-L280 VanDerWaalsContact CD-CD1 3.41Å; E256-L280 HydrophobicContact CG-CD1 3.56Å
257	H	87.7	Confident	77.6	Confident	39 Å²	39	71.5 Å²	71.5	18%	0.181	38%	0.381	C	S	.	.	H	α-helix	trans	-55.3	-45.9	173.8	-173	-65.9	0	0	0	112	Q253 S261 L280 E281 L284	Q253-H257 WeakPolarHBondContact O-CB 3.45Å; Q253-H257 PolarHBondContact O-N 3.06Å; H257-S261 PolarHBondContact CE1-OG 3.23Å; H257-S261 PolarHBondContact ND1-OG 2.91Å; H257-S261 VanDerWaalsContact O-CB 3.29Å; H257-S261 WeakPolarHBondContact O-CB 3.38Å; H257-S261 PolarHBondContact O-N 3.23Å; H257-S261 PolarHBondContact O-OG 3.23Å; H257-L280 HydrophobicContact CB-CD2 3.63Å; H257-E281 IonicContact CD2-OE1 3.33Å; H257-E281 IonicContact NE2-OE1 3.42Å; H257-E281 PolarHBondContact NE2-OE1 3.03Å; H257-L284 HydrophobicContact CB-CD1 4.46Å
258	R	85	Confident	79.5	Confident	167 Å²	167	68.2 Å²	68.2	63%	0.63	37%	0.369	S	S	*	.	H	α-helix	trans	-65.4	-42.2	178	-71	175.1	-160.9	153.4	6.9	111.3	N254 A255 E256 S261 Q262	N254-R258 WeakPolarHBondContact O-CG 3.48Å; N254-R258 PolarHBondContact O-N 3.41Å; A255-R258 PolarHBondContact O-N 2.9Å; E256-R258 VanDerWaalsContact C-N 3.32Å; E256-R258 PolarHBondContact O-N 2.8Å; R258-S261 PolarHBondContact O-N 2.94Å; R258-Q262 WeakPolarHBondContact O-CB 3.12Å; R258-Q262 VanDerWaalsContact O-CG 3.25Å; R258-Q262 WeakPolarHBondContact O-CG 3.38Å; R258-Q262 PolarHBondContact O-N 3.12Å
259	H	86.4	Confident	81.1	Confident	110 Å²	110	67.3 Å²	67.3	51%	0.509	37%	0.37	S	S	.	.	H	α-helix	trans	-60.9	-52.2	177.2	-175.5	-81.9	0	0	0	111	A255 E256 S261 Q262 E263	A255-H259 PolarHBondContact O-N 3.45Å; E256-H259 WeakPolarHBondContact O-CB 3.38Å; E256-H259 PolarHBondContact O-N 2.77Å; E256-H259 VanDerWaalsContact O-N 3.15Å; H259-S261 VanDerWaalsContact C-N 3.31Å; H259-S261 PolarHBondContact O-N 3.47Å; H259-Q262 WeakPolarHBondContact O-CB 3.29Å; H259-Q262 PolarHBondContact O-N 2.94Å; H259-Q262 VanDerWaalsContact O-N 3.08Å; H259-E263 IonicContact CE1-OE2 2.72Å; H259-E263 PolarHBondContact CE1-OE2 3.46Å; H259-E263 VanDerWaalsContact CE1-OE2 3.32Å; H259-E263 IonicContact ND1-OE2 3.24Å; H259-E263 PolarHBondContact ND1-OE2 3.02Å; H259-E263 WeakPolarHBondContact O-CB 3.48Å; H259-E263 PolarHBondContact O-N 3.15Å
260	L	85.9	Confident	82.5	Confident	10 Å²	10	68.1 Å²	68.1	5%	0.052	37%	0.369	C	S	.	.	H	α-helix	trans	-58.9	-42.5	177.2	-69.6	173.4	0	0	0	111.8	E256 Q262 E263 L264 L273 R276 L277 L280	E256-L260 HydrophobicContact CG-CD1 4.08Å; E256-L260 HydrophobicContact CG-CG 4.32Å; E256-L260 WeakPolarHBondContact O-CB 3.42Å; E256-L260 WeakPolarHBondContact O-CG 3.29Å; E256-L260 PolarHBondContact O-N 2.87Å; L260-Q262 VanDerWaalsContact C-N 3.31Å; L260-Q262 PolarHBondContact O-N 3.25Å; L260-E263 PolarHBondContact O-N 2.96Å; L260-L264 VanDerWaalsContact O-CB 3.3Å; L260-L264 WeakPolarHBondContact O-CB 3.38Å; L260-L264 VanDerWaalsContact O-CG 3.3Å; L260-L264 WeakPolarHBondContact O-CG 3.45Å; L260-L264 PolarHBondContact O-N 3.38Å; L260-L273 HydrophobicContact CD2-CD2 3.7Å; L260-R276 HydrophobicContact CD1-CB 4.48Å; L260-R276 HydrophobicContact CD1-CG 3.79Å; L260-R276 HydrophobicContact CD2-CG 4.35Å; L260-L277 HydrophobicContact CB-CD1 4.34Å; L260-L280 HydrophobicContact CD1-CD1 4.02Å
261	S	86.8	Confident	83.6	Confident	36 Å²	36	69.3 Å²	69.3	25%	0.252	38%	0.375	S	S	.	.	H	α-helix	trans	-63.4	-37.1	176.6	-61.6	0	0	0	0	112.2	H257 R258 H259 N265	H257-S261 PolarHBondContact CE1-OG 3.23Å; H257-S261 PolarHBondContact ND1-OG 2.91Å; H257-S261 VanDerWaalsContact O-CB 3.29Å; H257-S261 WeakPolarHBondContact O-CB 3.38Å; H257-S261 PolarHBondContact O-N 3.23Å; H257-S261 PolarHBondContact O-OG 3.23Å; R258-S261 PolarHBondContact O-N 2.94Å; H259-S261 VanDerWaalsContact C-N 3.31Å; H259-S261 PolarHBondContact O-N 3.47Å; S261-N265 VanDerWaalsContact O-CG 3.24Å; S261-N265 PolarHBondContact O-N 2.74Å; S261-N265 PolarHBondContact O-ND2 3.35Å; S261-N265 VanDerWaalsContact O-ND2 3.11Å
262	Q	87	Confident	84.5	Confident	132 Å²	132	74.9 Å²	74.9	62%	0.617	39%	0.389	S	S	*	.	H	α-helix	trans	-69.1	-43.6	175.1	-74.5	172	-2.6	0	0	111.4	R258 H259 L260 L264 N265 S266	R258-Q262 WeakPolarHBondContact O-CB 3.12Å; R258-Q262 VanDerWaalsContact O-CG 3.25Å; R258-Q262 WeakPolarHBondContact O-CG 3.38Å; R258-Q262 PolarHBondContact O-N 3.12Å; H259-Q262 WeakPolarHBondContact O-CB 3.29Å; H259-Q262 PolarHBondContact O-N 2.94Å; H259-Q262 VanDerWaalsContact O-N 3.08Å; L260-Q262 VanDerWaalsContact C-N 3.31Å; L260-Q262 PolarHBondContact O-N 3.25Å; Q262-L264 VanDerWaalsContact C-N 3.33Å; Q262-L264 PolarHBondContact O-N 3.24Å; Q262-N265 WeakPolarHBondContact O-CB 3.44Å; Q262-N265 PolarHBondContact O-N 3.23Å; Q262-N265 VanDerWaalsContact O-N 3.15Å; Q262-S266 PolarHBondContact O-N 3.01Å
263	E	86.6	Confident	85.2	Confident	71 Å²	71	71.7 Å²	71.7	33%	0.332	37%	0.372	S	S	.	.	H	α-helix	trans	-66.8	-34.8	180	-161.5	177.8	169.3	0	0	112.2	H259 L260 S266 S267 L273	H259-E263 IonicContact CE1-OE2 2.72Å; H259-E263 PolarHBondContact CE1-OE2 3.46Å; H259-E263 VanDerWaalsContact CE1-OE2 3.32Å; H259-E263 IonicContact ND1-OE2 3.24Å; H259-E263 PolarHBondContact ND1-OE2 3.02Å; H259-E263 WeakPolarHBondContact O-CB 3.48Å; H259-E263 PolarHBondContact O-N 3.15Å; L260-E263 PolarHBondContact O-N 2.96Å; E263-S266 WeakPolarHBondContact CA-OG 3.44Å; E263-S266 CarbonylContact O-C 3.54Å; E263-S266 PolarHBondContact O-N 3.13Å; E263-S266 PolarHBondContact O-OG 2.99Å; E263-S267 PolarHBondContact O-N 2.64Å; E263-S267 PolarHBondContact O-OG 2.87Å; E263-L273 HydrophobicContact CB-CD1 4.08Å; E263-L273 HydrophobicContact CG-CD1 3.64Å
264	L	88.1	Confident	86.2	Confident	5 Å²	5	71.5 Å²	71.5	3%	0.026	37%	0.37	C	S	.	.	H	α-helix	trans	-67.9	-33	171.7	-79.9	168.8	0	0	0	112.8	L260 Q262 S266 S267 P268 L273 W274 L277	L260-L264 VanDerWaalsContact O-CB 3.3Å; L260-L264 WeakPolarHBondContact O-CB 3.38Å; L260-L264 VanDerWaalsContact O-CG 3.3Å; L260-L264 WeakPolarHBondContact O-CG 3.45Å; L260-L264 PolarHBondContact O-N 3.38Å; Q262-L264 VanDerWaalsContact C-N 3.33Å; Q262-L264 PolarHBondContact O-N 3.24Å; L264-S266 VanDerWaalsContact C-N 3.26Å; L264-S266 PolarHBondContact O-N 2.88Å; L264-S267 CarbonylContact O-C 3.6Å; L264-S267 VanDerWaalsContact O-C 3.31Å; L264-S267 PolarHBondContact O-N 3.49Å; L264-P268 VanDerWaalsContact O-CA 3.23Å; L264-P268 WeakPolarHBondContact O-CA 3.11Å; L264-P268 WeakPolarHBondContact O-CD 3.47Å; L264-L273 HydrophobicContact CD1-CB 4.38Å; L264-L273 HydrophobicContact CD2-CB 3.48Å; L264-L273 VanDerWaalsContact CD2-CB 3.48Å; L264-L273 HydrophobicContact CD2-CD1 4.29Å; L264-L273 HydrophobicContact CG-CB 3.79Å; L264-L273 HydrophobicContact CG-CD1 4.42Å; L264-W274 HydrophobicContact CB-CZ2 4.47Å; L264-W274 HydrophobicContact CD1-CD2 3.87Å; L264-W274 HydrophobicContact CD1-CE3 3.66Å; L264-W274 HydrophobicContact CD1-CG 4.49Å; L264-W274 HydrophobicContact CD1-CH2 4.26Å; L264-W274 HydrophobicContact CD1-CZ2 4.44Å; L264-W274 HydrophobicContact CD1-CZ3 3.87Å; L264-W274 HydrophobicContact CD2-CD2 3.65Å; L264-W274 HydrophobicContact CD2-CE3 4.33Å; L264-W274 HydrophobicContact CD2-CG 3.79Å; L264-W274 HydrophobicContact CD2-CZ2 4.06Å; L264-W274 HydrophobicContact CG-CD2 4.37Å; L264-L277 HydrophobicContact CD1-CB 4.31Å; L264-L277 HydrophobicContact CD1-CD2 3.69Å
265	N	84.2	Confident	86.7	Confident	139 Å²	139	70.9 Å²	70.9	74%	0.743	37%	0.367	S	S	*	.	H	α-helix	trans	-66.5	-31.7	172.3	-68.7	-33.7	0	0	0	111.6	S261 Q262	S261-N265 VanDerWaalsContact O-CG 3.24Å; S261-N265 PolarHBondContact O-N 2.74Å; S261-N265 PolarHBondContact O-ND2 3.35Å; S261-N265 VanDerWaalsContact O-ND2 3.11Å; Q262-N265 WeakPolarHBondContact O-CB 3.44Å; Q262-N265 PolarHBondContact O-N 3.23Å; Q262-N265 VanDerWaalsContact O-N 3.15Å
266	S	86.8	Confident	87.1	Confident	95 Å²	95	71.2 Å²	71.2	66%	0.664	36%	0.357	S	S	*	.	H	α-helix	trans	-81	-29.6	173.3	47.7	0	0	0	0	114	Q262 E263 L264	Q262-S266 PolarHBondContact O-N 3.01Å; E263-S266 WeakPolarHBondContact CA-OG 3.44Å; E263-S266 CarbonylContact O-C 3.54Å; E263-S266 PolarHBondContact O-N 3.13Å; E263-S266 PolarHBondContact O-OG 2.99Å; L264-S266 VanDerWaalsContact C-N 3.26Å; L264-S266 PolarHBondContact O-N 2.88Å
267	S	86.7	Confident	87.4	Confident	39 Å²	39	68.6 Å²	68.6	27%	0.273	35%	0.345	S	S	.	.			trans	-137.8	69.7	-176	59.9	0	0	0	0	111.8	E263 L264 D269 N270	E263-S267 PolarHBondContact O-N 2.64Å; E263-S267 PolarHBondContact O-OG 2.87Å; L264-S267 CarbonylContact O-C 3.6Å; L264-S267 VanDerWaalsContact O-C 3.31Å; L264-S267 PolarHBondContact O-N 3.49Å; S267-D269 PolarHBondContact O-N 2.9Å; S267-D269 VanDerWaalsContact O-N 3.16Å; S267-N270 WeakPolarHBondContact O-CB 3.5Å; S267-N270 PolarHBondContact O-N 3.17Å; S267-N270 VanDerWaalsContact O-N 3.15Å
268	P	86.8	Confident	87.4	Confident	50 Å²	50	67.3 Å²	67.3	33%	0.325	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-20.9	-174.8	26.7	-35.2	0	0	0	113.2	L264 N270 W274 S317	L264-P268 VanDerWaalsContact O-CA 3.23Å; L264-P268 WeakPolarHBondContact O-CA 3.11Å; L264-P268 WeakPolarHBondContact O-CD 3.47Å; P268-N270 PolarHBondContact O-N 3.42Å; P268-W274 PolarHBondContact O-NE1 3.39Å; P268-S317 WeakPolarHBondContact O-CB 3.28Å
269	D	85.3	Confident	87.5	Confident	120 Å²	120	60.2 Å²	60.2	64%	0.642	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-2.8	-180	-57.2	-22.6	0	0	0	113.2	S267 V271	S267-D269 PolarHBondContact O-N 2.9Å; S267-D269 VanDerWaalsContact O-N 3.16Å; D269-V271 PolarHBondContact O-N 2.71Å; D269-V271 VanDerWaalsContact O-N 3.14Å
270	N	88.3	Confident	87.5	Confident	57 Å²	57	55 Å²	55	31%	0.305	29%	0.292	S	S	.	.			trans	-83.4	93.6	-176	-168.1	-19.5	0	0	0	111.9	S267 P268 K272 L273 W274	S267-N270 WeakPolarHBondContact O-CB 3.5Å; S267-N270 PolarHBondContact O-N 3.17Å; S267-N270 VanDerWaalsContact O-N 3.15Å; P268-N270 PolarHBondContact O-N 3.42Å; N270-K272 VanDerWaalsContact C-N 3.26Å; N270-K272 PolarHBondContact O-N 3.38Å; N270-K272 PolarHBondContact OD1-N 3.26Å; N270-L273 HydrophobicContact CB-CB 4.33Å; N270-L273 HydrophobicContact CB-CD1 3.88Å; N270-L273 HydrophobicContact CB-CG 4.11Å; N270-L273 WeakPolarHBondContact ND2-CD1 3.34Å; N270-L273 WeakPolarHBondContact ND2-CG 3.31Å; N270-L273 PolarHBondContact O-N 2.95Å; N270-W274 PolarHBondContact O-N 3.24Å
271	V	86.2	Confident	87.5	Confident	32 Å²	32	54.7 Å²	54.7	19%	0.194	29%	0.291	C	S	.	.	H	α-helix	trans	-54	-39.9	179.2	-173.1	0	0	0	0	113	D269 L273 W274 L275 C318 I321	D269-V271 PolarHBondContact O-N 2.71Å; D269-V271 VanDerWaalsContact O-N 3.14Å; V271-L273 VanDerWaalsContact C-N 3.31Å; V271-L273 PolarHBondContact O-N 3.46Å; V271-W274 PolarHBondContact O-N 2.95Å; V271-L275 HydrophobicContact CG1-CD1 4.05Å; V271-L275 HydrophobicContact CG1-CG 4.31Å; V271-L275 WeakPolarHBondContact O-CG 3.46Å; V271-L275 PolarHBondContact O-N 3.28Å; V271-C318 HydrophobicContact CG2-CB 4.46Å; V271-I321 HydrophobicContact CG1-CG1 4.41Å; V271-I321 HydrophobicContact CG1-CG2 3.78Å; V271-I321 HydrophobicContact CG2-CD1 3.76Å; V271-I321 HydrophobicContact CG2-CG1 3.63Å
272	K	88.4	Confident	87.5	Confident	174 Å²	174	54.7 Å²	54.7	76%	0.757	29%	0.287	S	S	*	.	H	α-helix	trans	-64.6	-38.5	-176.8	-69.4	-177.8	178.1	179.5	0	111.6	N270 L275 R276	N270-K272 VanDerWaalsContact C-N 3.26Å; N270-K272 PolarHBondContact O-N 3.38Å; N270-K272 PolarHBondContact OD1-N 3.26Å; K272-L275 PolarHBondContact O-N 3.26Å; K272-R276 WeakPolarHBondContact O-CB 3.29Å; K272-R276 PolarHBondContact O-N 3.47Å
273	L	89.1	Confident	87.3	Confident	19 Å²	19	49.9 Å²	49.9	10%	0.099	27%	0.265	C	S	.	.	H	α-helix	trans	-66.8	-40.6	176.8	-67.3	178.5	0	0	0	111.3	L260 E263 L264 N270 V271 R276 L277	L260-L273 HydrophobicContact CD2-CD2 3.7Å; E263-L273 HydrophobicContact CB-CD1 4.08Å; E263-L273 HydrophobicContact CG-CD1 3.64Å; L264-L273 HydrophobicContact CD1-CB 4.38Å; L264-L273 HydrophobicContact CD2-CB 3.48Å; L264-L273 VanDerWaalsContact CD2-CB 3.48Å; L264-L273 HydrophobicContact CD2-CD1 4.29Å; L264-L273 HydrophobicContact CG-CB 3.79Å; L264-L273 HydrophobicContact CG-CD1 4.42Å; N270-L273 HydrophobicContact CB-CB 4.33Å; N270-L273 HydrophobicContact CB-CD1 3.88Å; N270-L273 HydrophobicContact CB-CG 4.11Å; N270-L273 WeakPolarHBondContact ND2-CD1 3.34Å; N270-L273 WeakPolarHBondContact ND2-CG 3.31Å; N270-L273 PolarHBondContact O-N 2.95Å; V271-L273 VanDerWaalsContact C-N 3.31Å; V271-L273 PolarHBondContact O-N 3.46Å; L273-R276 PolarHBondContact O-N 3.24Å; L273-L277 WeakPolarHBondContact O-CB 3.46Å; L273-L277 PolarHBondContact O-N 2.94Å
274	W	93.1	Very high	87.1	Confident	24 Å²	24	47.7 Å²	47.7	9%	0.091	26%	0.256	C	S	.	.	H	α-helix	trans	-61.9	-46.6	174.5	-74	116.5	0	0	0	112.3	L264 P268 N270 V271 R276 L277 L278 I310 K313 A314 L324	L264-W274 HydrophobicContact CB-CZ2 4.47Å; L264-W274 HydrophobicContact CD1-CD2 3.87Å; L264-W274 HydrophobicContact CD1-CE3 3.66Å; L264-W274 HydrophobicContact CD1-CG 4.49Å; L264-W274 HydrophobicContact CD1-CH2 4.26Å; L264-W274 HydrophobicContact CD1-CZ2 4.44Å; L264-W274 HydrophobicContact CD1-CZ3 3.87Å; L264-W274 HydrophobicContact CD2-CD2 3.65Å; L264-W274 HydrophobicContact CD2-CE3 4.33Å; L264-W274 HydrophobicContact CD2-CG 3.79Å; L264-W274 HydrophobicContact CD2-CZ2 4.06Å; L264-W274 HydrophobicContact CG-CD2 4.37Å; P268-W274 PolarHBondContact O-NE1 3.39Å; N270-W274 PolarHBondContact O-N 3.24Å; V271-W274 PolarHBondContact O-N 2.95Å; W274-R276 PolarHBondContact O-N 2.97Å; W274-L277 HydrophobicContact CE3-CD2 4.12Å; W274-L277 HydrophobicContact CZ3-CD2 4.08Å; W274-L277 WeakPolarHBondContact O-CB 3.48Å; W274-L277 PolarHBondContact O-N 3.39Å; W274-L278 WeakPolarHBondContact O-CG 3.35Å; W274-L278 PolarHBondContact O-N 3.29Å; W274-I310 HydrophobicContact CE3-CG2 4.08Å; W274-I310 HydrophobicContact CZ3-CG2 4.01Å; W274-K313 HydrophobicContact CH2-CB 4.08Å; W274-A314 HydrophobicContact CB-CB 3.99Å; W274-A314 HydrophobicContact CD2-CB 3.43Å; W274-A314 VanDerWaalsContact CD2-CB 3.43Å; W274-A314 HydrophobicContact CE3-CB 3.67Å; W274-A314 HydrophobicContact CG-CB 3.58Å; W274-A314 HydrophobicContact CZ3-CB 4.34Å; W274-L324 HydrophobicContact CB-CD2 4.31Å
275	L	87.8	Confident	86.9	Confident	58 Å²	58	48.6 Å²	48.6	30%	0.304	26%	0.259	S	S	.	.	H	α-helix	trans	-64.2	-39.4	177.8	-67.6	174.4	0	0	0	112.1	V271 K272 L277 L278 A279 E323 L324	V271-L275 HydrophobicContact CG1-CD1 4.05Å; V271-L275 HydrophobicContact CG1-CG 4.31Å; V271-L275 WeakPolarHBondContact O-CG 3.46Å; V271-L275 PolarHBondContact O-N 3.28Å; K272-L275 PolarHBondContact O-N 3.26Å; L275-L277 VanDerWaalsContact C-N 3.34Å; L275-L278 HydrophobicContact CD2-CD1 4.5Å; L275-L278 PolarHBondContact O-N 2.93Å; L275-A279 PolarHBondContact O-N 3.35Å; L275-E323 WeakPolarHBondContact CD1-OE2 3.38Å; L275-L324 HydrophobicContact CD2-CD2 3.99Å
276	R	89.1	Confident	86.6	Confident	59 Å²	59	43.3 Å²	43.3	22%	0.223	23%	0.23	C	C	.	.	H	α-helix	trans	-64.6	-39.9	174.4	-179.5	59.1	-178.3	153.3	5.1	111.4	E256 L260 K272 L273 W274 L278 A279 L280 E283	E256-R276 IonicContact OE1-CZ 3.7Å; E256-R276 IonicContact OE1-NE 2.74Å; E256-R276 PolarHBondContact OE1-NE 3.17Å; E256-R276 IonicContact OE1-NH2 2.77Å; E256-R276 PolarHBondContact OE1-NH2 3.41Å; E256-R276 IonicContact OE2-NH2 3.46Å; E256-R276 PolarHBondContact OE2-NH2 3.28Å; L260-R276 HydrophobicContact CD1-CB 4.48Å; L260-R276 HydrophobicContact CD1-CG 3.79Å; L260-R276 HydrophobicContact CD2-CG 4.35Å; K272-R276 WeakPolarHBondContact O-CB 3.29Å; K272-R276 PolarHBondContact O-N 3.47Å; L273-R276 PolarHBondContact O-N 3.24Å; W274-R276 PolarHBondContact O-N 2.97Å; R276-L278 VanDerWaalsContact C-N 3.33Å; R276-L278 PolarHBondContact O-N 3.09Å; R276-A279 PolarHBondContact O-N 3.38Å; R276-L280 WeakPolarHBondContact O-CB 3.49Å; R276-L280 PolarHBondContact O-N 3.28Å; R276-E283 IonicContact CZ-OE1 3.44Å; R276-E283 IonicContact NH1-OE1 3.16Å; R276-E283 PolarHBondContact NH1-OE1 3.2Å; R276-E283 IonicContact NH2-OE1 3.6Å
277	L	90.1	Very high	86	Confident	5 Å²	5	40.8 Å²	40.8	3%	0.026	21%	0.209	C	C	.	.	H	α-helix	trans	-61.5	-42.3	176	-176.2	65.2	0	0	0	111.6	L260 L264 L273 W274 L275 L280 E281 I310	L260-L277 HydrophobicContact CB-CD1 4.34Å; L264-L277 HydrophobicContact CD1-CB 4.31Å; L264-L277 HydrophobicContact CD1-CD2 3.69Å; L273-L277 WeakPolarHBondContact O-CB 3.46Å; L273-L277 PolarHBondContact O-N 2.94Å; W274-L277 HydrophobicContact CE3-CD2 4.12Å; W274-L277 HydrophobicContact CZ3-CD2 4.08Å; W274-L277 WeakPolarHBondContact O-CB 3.48Å; W274-L277 PolarHBondContact O-N 3.39Å; L275-L277 VanDerWaalsContact C-N 3.34Å; L277-L280 PolarHBondContact O-N 2.9Å; L277-E281 PolarHBondContact O-N 2.94Å; L277-I310 HydrophobicContact CD2-CG2 3.73Å; L277-I310 HydrophobicContact CG-CG2 4.3Å
278	L	88.3	Confident	85.6	Confident	11 Å²	11	39.6 Å²	39.6	6%	0.058	20%	0.201	C	C	.	.	H	α-helix	trans	-64.2	-42.6	176.4	-67.2	170.4	0	0	0	112.5	W274 L275 R276 L280 E281 D282 K307 I310 V311 L324 A327	W274-L278 WeakPolarHBondContact O-CG 3.35Å; W274-L278 PolarHBondContact O-N 3.29Å; L275-L278 HydrophobicContact CD2-CD1 4.5Å; L275-L278 PolarHBondContact O-N 2.93Å; R276-L278 VanDerWaalsContact C-N 3.33Å; R276-L278 PolarHBondContact O-N 3.09Å; L278-L280 VanDerWaalsContact C-N 3.32Å; L278-E281 PolarHBondContact O-N 3.23Å; L278-D282 PolarHBondContact O-N 3.31Å; L278-K307 HydrophobicContact CD2-CG 3.83Å; L278-I310 HydrophobicContact CD2-CB 4.31Å; L278-I310 HydrophobicContact CD2-CG2 3.83Å; L278-V311 HydrophobicContact CD1-CG2 3.69Å; L278-V311 HydrophobicContact CD2-CG2 3.34Å; L278-V311 HydrophobicContact CG-CG2 4.15Å; L278-L324 HydrophobicContact CD1-CD2 4.38Å; L278-A327 HydrophobicContact CD1-CB 4.49Å
279	A	86.3	Confident	85.1	Confident	18 Å²	18	40.1 Å²	40.1	15%	0.149	20%	0.199	C	C	.	.	H	α-helix	trans	-63.3	-40.4	175.2	0	0	0	0	0	111.7	P27 L275 R276 E281 D282 E283	P27-A279 HydrophobicContact CB-CB 4.38Å; P27-A279 HydrophobicContact CG-CB 3.9Å; L275-A279 PolarHBondContact O-N 3.35Å; R276-A279 PolarHBondContact O-N 3.38Å; A279-E281 VanDerWaalsContact C-N 3.35Å; A279-D282 WeakPolarHBondContact O-CB 3.46Å; A279-D282 PolarHBondContact O-N 3.42Å; A279-E283 WeakPolarHBondContact O-CG 3.46Å; A279-E283 PolarHBondContact O-N 3.35Å
280	L	85.8	Confident	84.4	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-67.4	-35.3	178.4	-171	149.4	0	0	0	112	E256 H257 L260 R276 L277 L278 D282 E283 L284	E256-L280 HydrophobicContact CB-CD1 3.79Å; E256-L280 VanDerWaalsContact CD-CD1 3.41Å; E256-L280 HydrophobicContact CG-CD1 3.56Å; H257-L280 HydrophobicContact CB-CD2 3.63Å; L260-L280 HydrophobicContact CD1-CD1 4.02Å; R276-L280 WeakPolarHBondContact O-CB 3.49Å; R276-L280 PolarHBondContact O-N 3.28Å; L277-L280 PolarHBondContact O-N 2.9Å; L278-L280 VanDerWaalsContact C-N 3.32Å; L280-D282 VanDerWaalsContact C-N 3.33Å; L280-E283 PolarHBondContact O-N 2.98Å; L280-L284 HydrophobicContact CD2-CD1 3.44Å; L280-L284 VanDerWaalsContact CD2-CD1 3.44Å; L280-L284 HydrophobicContact CD2-CG 3.8Å; L280-L284 WeakPolarHBondContact O-CB 3.23Å; L280-L284 WeakPolarHBondContact O-CG 3.43Å; L280-L284 PolarHBondContact O-N 3.48Å
281	E	87.6	Confident	83.3	Confident	5 Å²	5	42.1 Å²	42.1	2%	0.023	20%	0.203	C	C	.	.	H	α-helix	trans	-61.8	-40.2	171.8	-78.8	-78	-175.1	0	0	111.8	H257 L277 L278 A279 L284 Y285 F303 R306 I310	H257-E281 IonicContact CD2-OE1 3.33Å; H257-E281 IonicContact NE2-OE1 3.42Å; H257-E281 PolarHBondContact NE2-OE1 3.03Å; L277-E281 PolarHBondContact O-N 2.94Å; L278-E281 PolarHBondContact O-N 3.23Å; A279-E281 VanDerWaalsContact C-N 3.35Å; E281-L284 PolarHBondContact O-N 3.09Å; E281-Y285 WeakPolarHBondContact O-CB 3.5Å; E281-Y285 PolarHBondContact O-N 3.46Å; E281-F303 HydrophobicContact CB-CE2 4.12Å; E281-F303 VanDerWaalsContact O-CE2 3.28Å; E281-F303 WeakPolarHBondContact O-CE2 3.41Å; E281-R306 VanDerWaalsContact OE1-CD 3.28Å; E281-R306 WeakPolarHBondContact OE1-CD 3.29Å; E281-R306 IonicContact OE2-NH1 3.16Å; E281-I310 HydrophobicContact CG-CD1 3.81Å; E281-I310 WeakPolarHBondContact OE1-CD1 3.43Å
282	D	85.2	Confident	82.4	Confident	35 Å²	35	43.8 Å²	43.8	19%	0.187	22%	0.22	C	C	.	.	H	α-helix	trans	-61.5	-47.3	173.1	-68.2	-43.6	0	0	0	111.2	L278 A279 L280 L284 Y285 D286 F303 K307	L278-D282 PolarHBondContact O-N 3.31Å; A279-D282 WeakPolarHBondContact O-CB 3.46Å; A279-D282 PolarHBondContact O-N 3.42Å; L280-D282 VanDerWaalsContact C-N 3.33Å; D282-L284 PolarHBondContact O-N 3.35Å; D282-Y285 PolarHBondContact O-N 2.85Å; D282-D286 PolarHBondContact O-N 3.33Å; D282-F303 VanDerWaalsContact OD1-CZ 3.3Å; D282-F303 WeakPolarHBondContact OD1-CZ 3.46Å; D282-K307 IonicContact OD1-NZ 3.48Å; D282-K307 PolarHBondContact OD1-NZ 2.88Å; D282-K307 IonicContact OD2-NZ 3.56Å; D282-K307 PolarHBondContact OD2-NZ 2.78Å
283	E	82.9	Confident	81	Confident	31 Å²	31	36.3 Å²	36.3	15%	0.145	19%	0.188	C	C	.	.	H	α-helix	trans	-59.2	-44.6	177.2	-67.7	174.2	-154.8	0	0	112.2	P27 Q253 R276 A279 L280 D286 L287	P27-E283 HydrophobicContact CB-CG 4.1Å; Q253-E283 PolarHBondContact NE2-OE2 3.37Å; Q253-E283 VanDerWaalsContact NE2-OE2 3.15Å; R276-E283 IonicContact CZ-OE1 3.44Å; R276-E283 IonicContact NH1-OE1 3.16Å; R276-E283 PolarHBondContact NH1-OE1 3.2Å; R276-E283 IonicContact NH2-OE1 3.6Å; A279-E283 WeakPolarHBondContact O-CG 3.46Å; A279-E283 PolarHBondContact O-N 3.35Å; L280-E283 PolarHBondContact O-N 2.98Å; E283-D286 PolarHBondContact O-N 3.47Å; E283-L287 WeakPolarHBondContact O-CG 3.49Å; E283-L287 PolarHBondContact O-N 3.42Å
284	L	82.6	Confident	79.8	Confident	26 Å²	26	44.2 Å²	44.2	14%	0.136	22%	0.216	C	C	.	.	H	α-helix	trans	-65.7	-38.1	177.5	-76.7	179.8	0	0	0	112	Q253 H257 L280 E281 D282 S288	Q253-L284 HydrophobicContact CB-CD2 3.62Å; Q253-L284 HydrophobicContact CB-CG 4.38Å; H257-L284 HydrophobicContact CB-CD1 4.46Å; L280-L284 HydrophobicContact CD2-CD1 3.44Å; L280-L284 VanDerWaalsContact CD2-CD1 3.44Å; L280-L284 HydrophobicContact CD2-CG 3.8Å; L280-L284 WeakPolarHBondContact O-CB 3.23Å; L280-L284 WeakPolarHBondContact O-CG 3.43Å; L280-L284 PolarHBondContact O-N 3.48Å; E281-L284 PolarHBondContact O-N 3.09Å; D282-L284 PolarHBondContact O-N 3.35Å; L284-S288 WeakPolarHBondContact O-CB 3.33Å; L284-S288 PolarHBondContact O-N 2.95Å
285	Y	84.5	Confident	78.5	Confident	23 Å²	23	48.6 Å²	48.6	9%	0.09	25%	0.251	C	S	.	.	H	α-helix	trans	-63.3	-49.4	175.9	177.4	-98.5	0	0	0	110.8	E281 D282 L287 S288 Q289 R300 F303	E281-Y285 WeakPolarHBondContact O-CB 3.5Å; E281-Y285 PolarHBondContact O-N 3.46Å; D282-Y285 PolarHBondContact O-N 2.85Å; Y285-L287 VanDerWaalsContact C-N 3.31Å; Y285-L287 PolarHBondContact O-N 2.97Å; Y285-S288 WeakPolarHBondContact O-CA 3.42Å; Y285-S288 WeakPolarHBondContact O-CB 3.48Å; Y285-S288 PolarHBondContact O-N 3.44Å; Y285-S288 PolarHBondContact O-OG 2.82Å; Y285-Q289 HydrophobicContact CD1-CG 4.25Å; Y285-Q289 HydrophobicContact CE1-CG 3.77Å; Y285-Q289 HydrophobicContact CE2-CG 4.3Å; Y285-Q289 VanDerWaalsContact CE2-NE2 3.29Å; Y285-Q289 WeakPolarHBondContact O-CG 3.35Å; Y285-Q289 PolarHBondContact O-N 3.28Å; Y285-Q289 VanDerWaalsContact O-N 3.09Å; Y285-R300 VanDerWaalsContact CZ-CD 3.43Å; Y285-R300 WeakPolarHBondContact OH-CD 3.37Å; Y285-F303 HydrophobicContact CD1-CD1 4.47Å; Y285-F303 HydrophobicContact CD2-CB 3.51Å; Y285-F303 AromaticContact CD2-CD1 3.93Å; Y285-F303 HydrophobicContact CD2-CD1 3.93Å; Y285-F303 AromaticContact CD2-CD2 3.66Å; Y285-F303 HydrophobicContact CD2-CD2 3.66Å; Y285-F303 HydrophobicContact CD2-CE2 4.38Å; Y285-F303 AromaticContact CD2-CG 3.37Å; Y285-F303 HydrophobicContact CD2-CG 3.37Å; Y285-F303 HydrophobicContact CE2-CB 3.73Å; Y285-F303 HydrophobicContact CE2-CD1 4.27Å; Y285-F303 AromaticContact CE2-CG 3.94Å; Y285-F303 HydrophobicContact CE2-CG 3.94Å; Y285-F303 HydrophobicContact CG-CB 4.39Å; Y285-F303 HydrophobicContact CG-CD1 4.02Å; Y285-F303 AromaticContact CG-CD2 3.82Å; Y285-F303 HydrophobicContact CG-CD2 3.82Å; Y285-F303 HydrophobicContact CG-CE1 4.27Å; Y285-F303 HydrophobicContact CG-CE2 4.07Å; Y285-F303 AromaticContact CG-CG 3.77Å; Y285-F303 HydrophobicContact CG-CG 3.77Å; Y285-F303 HydrophobicContact CG-CZ 4.27Å
286	D	76.7	Confident	77.6	Confident	28 Å²	28	51.5 Å²	51.5	15%	0.15	26%	0.263	C	S	.	.	H	α-helix	trans	-58.5	-44.9	179.5	-74.8	-4.9	0	0	0	111.3	A28 S30 D282 E283 S288 Q289 T290	A28-D286 VanDerWaalsContact O-OD2 3.12Å; S30-D286 WeakPolarHBondContact CB-OD1 3.41Å; S30-D286 PolarHBondContact OG-OD1 3.37Å; S30-D286 PolarHBondContact OG-OD2 3.44Å; D282-D286 PolarHBondContact O-N 3.33Å; E283-D286 PolarHBondContact O-N 3.47Å; D286-S288 VanDerWaalsContact C-N 3.33Å; D286-S288 PolarHBondContact O-N 3Å; D286-Q289 PolarHBondContact O-N 2.85Å; D286-Q289 VanDerWaalsContact O-N 3.08Å; D286-T290 PolarHBondContact O-N 2.87Å
287	L	75.5	Confident	77	Confident	42 Å²	42	51.7 Å²	51.7	22%	0.22	27%	0.273	C	S	.	.	H	α-helix	trans	-60.6	-40.8	173.5	-78.7	162.4	0	0	0	112.5	Q253 E283 Y285 Q289 T290 F293	Q253-L287 VanDerWaalsContact CD-CD1 3.49Å; E283-L287 WeakPolarHBondContact O-CG 3.49Å; E283-L287 PolarHBondContact O-N 3.42Å; Y285-L287 VanDerWaalsContact C-N 3.31Å; Y285-L287 PolarHBondContact O-N 2.97Å; L287-Q289 PolarHBondContact O-N 2.87Å; L287-T290 WeakPolarHBondContact O-CB 3.38Å; L287-T290 PolarHBondContact O-N 2.91Å; L287-T290 PolarHBondContact O-OG1 2.69Å; L287-F293 VanDerWaalsContact O-CD2 3.27Å; L287-F293 WeakPolarHBondContact O-CD2 3.31Å
288	S	78.2	Confident	76.4	Confident	15 Å²	15	53.5 Å²	53.5	11%	0.105	28%	0.284	C	S	.	.	H	α-helix	trans	-62.7	-25.4	176.5	82.7	0	0	0	0	113.4	L284 Y285 D286	L284-S288 WeakPolarHBondContact O-CB 3.33Å; L284-S288 PolarHBondContact O-N 2.95Å; Y285-S288 WeakPolarHBondContact O-CA 3.42Å; Y285-S288 WeakPolarHBondContact O-CB 3.48Å; Y285-S288 PolarHBondContact O-N 3.44Å; Y285-S288 PolarHBondContact O-OG 2.82Å; D286-S288 VanDerWaalsContact C-N 3.33Å; D286-S288 PolarHBondContact O-N 3Å
289	Q	75.1	Confident	76.3	Confident	61 Å²	61	56.6 Å²	56.6	29%	0.285	31%	0.307	S	S	.	.	H	α-helix	trans	-82.9	-16.1	176.3	-59.6	-51.1	-53.3	0	0	113	Y285 D286 L287 V298	Y285-Q289 HydrophobicContact CD1-CG 4.25Å; Y285-Q289 HydrophobicContact CE1-CG 3.77Å; Y285-Q289 HydrophobicContact CE2-CG 4.3Å; Y285-Q289 VanDerWaalsContact CE2-NE2 3.29Å; Y285-Q289 WeakPolarHBondContact O-CG 3.35Å; Y285-Q289 PolarHBondContact O-N 3.28Å; Y285-Q289 VanDerWaalsContact O-N 3.09Å; D286-Q289 PolarHBondContact O-N 2.85Å; D286-Q289 VanDerWaalsContact O-N 3.08Å; L287-Q289 PolarHBondContact O-N 2.87Å; Q289-V298 PolarHBondContact NE2-O 3.47Å
290	T	72.4	Confident	76.3	Confident	42 Å²	42	58.9 Å²	58.9	26%	0.258	31%	0.311	S	S	.	.	S	Bend	trans	-64.3	152.4	176.6	69.1	0	0	0	0	111.6	D286 L287 A292 F293	D286-T290 PolarHBondContact O-N 2.87Å; L287-T290 WeakPolarHBondContact O-CB 3.38Å; L287-T290 PolarHBondContact O-N 2.91Å; L287-T290 PolarHBondContact O-OG1 2.69Å; T290-A292 PolarHBondContact O-N 2.66Å; T290-F293 PolarHBondContact O-N 3.38Å
291	K	65	Low	76.4	Confident	177 Å²	177	62.8 Å²	62.8	77%	0.77	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-55.9	-28.4	-176.1	-69.2	179.7	-175.9	169	0	113.3	F293	K291-F293 VanDerWaalsContact C-N 3.32Å; K291-F293 PolarHBondContact O-N 3.18Å
292	A	65.9	Low	76.5	Confident	67 Å²	67	64.2 Å²	64.2	55%	0.554	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-66.8	-29.7	180	0	0	0	0	0	113.3	V246 T290	V246-A292 HydrophobicContact CG1-CB 3.86Å; T290-A292 PolarHBondContact O-N 2.66Å
293	F	60.1	Low	76.7	Confident	17 Å²	17	62.7 Å²	62.7	8%	0.075	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-112.7	18.3	-173	-66.4	-75.4	0	0	0	114.4	V246 M247 L287 T290 K291 S295 Q296 S297	V246-F293 HydrophobicContact CG1-CD2 4.15Å; V246-F293 HydrophobicContact CG1-CE2 3.34Å; V246-F293 HydrophobicContact CG1-CZ 3.91Å; V246-F293 WeakPolarHBondContact O-CZ 3.41Å; M247-F293 HydrophobicContact SD-CD1 4.47Å; M247-F293 HydrophobicContact SD-CE1 3.64Å; M247-F293 HydrophobicContact SD-CZ 4.26Å; L287-F293 VanDerWaalsContact O-CD2 3.27Å; L287-F293 WeakPolarHBondContact O-CD2 3.31Å; T290-F293 PolarHBondContact O-N 3.38Å; K291-F293 VanDerWaalsContact C-N 3.32Å; K291-F293 PolarHBondContact O-N 3.18Å; F293-S295 PolarHBondContact O-N 3.31Å; F293-Q296 CarbonylContact O-C 3.51Å; F293-Q296 WeakPolarHBondContact O-CA 3.41Å; F293-Q296 PolarHBondContact O-N 2.9Å; F293-S297 PolarHBondContact O-N 2.8Å
294	R	62.7	Low	77.2	Confident	185 Å²	185	61.2 Å²	61.2	70%	0.698	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-50.3	-29.4	-179.5	-97.9	-177.3	176.1	169.6	-1.5	115.3	Q296 S297	R294-Q296 VanDerWaalsContact C-N 3.29Å; R294-S297 PolarHBondContact O-OG 3.27Å
295	S	66.3	Low	77.6	Confident	116 Å²	116	65.9 Å²	65.9	81%	0.811	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-73.7	-19.6	176.4	57.8	0	0	0	0	114	F293	F293-S295 PolarHBondContact O-N 3.31Å
296	Q	69.2	Low	77.9	Confident	119 Å²	119	70.3 Å²	70.3	56%	0.556	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-108.4	7.6	178.3	-63.3	177.7	5.1	0	0	111.9	F293 R294 V298	F293-Q296 CarbonylContact O-C 3.51Å; F293-Q296 WeakPolarHBondContact O-CA 3.41Å; F293-Q296 PolarHBondContact O-N 2.9Å; R294-Q296 VanDerWaalsContact C-N 3.29Å; Q296-V298 PolarHBondContact O-N 3.38Å
297	S	75.9	Confident	78.7	Confident	62 Å²	62	70.4 Å²	70.4	43%	0.434	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-59.9	123	-178.6	66.1	0	0	0	0	110.1	F293 R294	F293-S297 PolarHBondContact O-N 2.8Å; R294-S297 PolarHBondContact O-OG 3.27Å
298	V	78.6	Confident	79.5	Confident	43 Å²	43	70 Å²	70	26%	0.261	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-89.1	143.9	175.2	-176.1	0	0	0	0	108.3	Q289 Q296 A302 F303	Q289-V298 PolarHBondContact NE2-O 3.47Å; Q296-V298 PolarHBondContact O-N 3.38Å; V298-A302 HydrophobicContact CG1-CB 3.82Å; V298-F303 HydrophobicContact CG1-CB 4.38Å
299	S	86.3	Confident	80.3	Confident	76 Å²	76	72 Å²	72	53%	0.531	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-67.2	145.2	172.6	64.8	0	0	0	0	110.1	M301 A302 F303	S299-M301 VanDerWaalsContact C-N 3.26Å; S299-M301 PolarHBondContact O-N 2.99Å; S299-A302 PolarHBondContact O-N 3.03Å; S299-A302 VanDerWaalsContact O-N 3.11Å; S299-A302 VanDerWaalsContact OG-CB 3.26Å; S299-A302 WeakPolarHBondContact OG-CB 3.44Å; S299-A302 PolarHBondContact OG-N 3.07Å; S299-F303 PolarHBondContact O-N 2.88Å
300	R	85.6	Confident	81.1	Confident	66 Å²	66	70 Å²	70	25%	0.249	37%	0.367	C	S	.	.	H	α-helix	trans	-55.4	-41.2	-178.6	-172.2	66.4	-179.1	166.4	0.1	112.5	Y285 F303 L304 E334	Y285-R300 VanDerWaalsContact CZ-CD 3.43Å; Y285-R300 WeakPolarHBondContact OH-CD 3.37Å; R300-F303 WeakPolarHBondContact O-CB 3.31Å; R300-F303 PolarHBondContact O-N 3.3Å; R300-L304 HydrophobicContact CG-CD1 4.27Å; R300-L304 HydrophobicContact CG-CG 4.48Å; R300-L304 WeakPolarHBondContact O-CG 3.38Å; R300-L304 PolarHBondContact O-N 3.02Å; R300-E334 IonicContact CZ-OE1 3.06Å; R300-E334 IonicContact CZ-OE2 2.93Å; R300-E334 IonicContact NE-OE1 3.3Å; R300-E334 PolarHBondContact NE-OE1 3.22Å; R300-E334 IonicContact NE-OE2 3.64Å; R300-E334 IonicContact NH2-OE1 3.79Å; R300-E334 PolarHBondContact NH2-OE1 2.83Å; R300-E334 IonicContact NH2-OE2 3.36Å; R300-E334 PolarHBondContact NH2-OE2 3.34Å
301	M	89.1	Confident	82.1	Confident	83 Å²	83	68 Å²	68	41%	0.409	35%	0.354	S	S	.	.	H	α-helix	trans	-63.3	-45.1	177	-70.5	-60	108.8	0	0	112.7	S299 F303 L304 E305	S299-M301 VanDerWaalsContact C-N 3.26Å; S299-M301 PolarHBondContact O-N 2.99Å; M301-F303 VanDerWaalsContact C-N 3.26Å; M301-F303 PolarHBondContact O-N 3.19Å; M301-L304 HydrophobicContact CE-CD1 3.6Å; M301-L304 PolarHBondContact O-N 2.66Å; M301-L304 VanDerWaalsContact O-N 3.16Å; M301-E305 WeakPolarHBondContact O-CG 3.13Å; M301-E305 PolarHBondContact O-N 3.05Å
302	A	88.3	Confident	83.6	Confident	34 Å²	34	61.7 Å²	61.7	28%	0.281	33%	0.329	S	S	.	.	H	α-helix	trans	-65.5	-32.4	178.1	0	0	0	0	0	112.2	V298 S299 R306	V298-A302 HydrophobicContact CG1-CB 3.82Å; S299-A302 PolarHBondContact O-N 3.03Å; S299-A302 VanDerWaalsContact O-N 3.11Å; S299-A302 VanDerWaalsContact OG-CB 3.26Å; S299-A302 WeakPolarHBondContact OG-CB 3.44Å; S299-A302 PolarHBondContact OG-N 3.07Å; A302-R306 PolarHBondContact O-N 3.18Å
303	F	90.3	Very high	84.8	Confident	3 Å²	3	63.9 Å²	63.9	1%	0.013	33%	0.326	C	S	.	.	H	α-helix	trans	-63.4	-50.4	170.6	164.3	-102.7	0	0	0	111.5	E281 D282 Y285 V298 S299 R300 M301 E305 R306 K307	E281-F303 HydrophobicContact CB-CE2 4.12Å; E281-F303 VanDerWaalsContact O-CE2 3.28Å; E281-F303 WeakPolarHBondContact O-CE2 3.41Å; D282-F303 VanDerWaalsContact OD1-CZ 3.3Å; D282-F303 WeakPolarHBondContact OD1-CZ 3.46Å; Y285-F303 HydrophobicContact CD1-CD1 4.47Å; Y285-F303 HydrophobicContact CD2-CB 3.51Å; Y285-F303 AromaticContact CD2-CD1 3.93Å; Y285-F303 HydrophobicContact CD2-CD1 3.93Å; Y285-F303 AromaticContact CD2-CD2 3.66Å; Y285-F303 HydrophobicContact CD2-CD2 3.66Å; Y285-F303 HydrophobicContact CD2-CE2 4.38Å; Y285-F303 AromaticContact CD2-CG 3.37Å; Y285-F303 HydrophobicContact CD2-CG 3.37Å; Y285-F303 HydrophobicContact CE2-CB 3.73Å; Y285-F303 HydrophobicContact CE2-CD1 4.27Å; Y285-F303 AromaticContact CE2-CG 3.94Å; Y285-F303 HydrophobicContact CE2-CG 3.94Å; Y285-F303 HydrophobicContact CG-CB 4.39Å; Y285-F303 HydrophobicContact CG-CD1 4.02Å; Y285-F303 AromaticContact CG-CD2 3.82Å; Y285-F303 HydrophobicContact CG-CD2 3.82Å; Y285-F303 HydrophobicContact CG-CE1 4.27Å; Y285-F303 HydrophobicContact CG-CE2 4.07Å; Y285-F303 AromaticContact CG-CG 3.77Å; Y285-F303 HydrophobicContact CG-CG 3.77Å; Y285-F303 HydrophobicContact CG-CZ 4.27Å; V298-F303 HydrophobicContact CG1-CB 4.38Å; S299-F303 PolarHBondContact O-N 2.88Å; R300-F303 WeakPolarHBondContact O-CB 3.31Å; R300-F303 PolarHBondContact O-N 3.3Å; M301-F303 VanDerWaalsContact C-N 3.26Å; M301-F303 PolarHBondContact O-N 3.19Å; F303-E305 VanDerWaalsContact C-N 3.34Å; F303-E305 PolarHBondContact O-N 3.41Å; F303-R306 WeakPolarHBondContact O-CB 3.42Å; F303-R306 PolarHBondContact O-N 3.31Å; F303-K307 HydrophobicContact CE1-CD 4.17Å; F303-K307 HydrophobicContact CZ-CD 3.84Å; F303-K307 PolarHBondContact O-N 3.46Å
304	L	92.1	Very high	86.4	Confident	0 Å²	0	63 Å²	63	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-63.2	-39.6	179.1	-66.8	175.6	0	0	0	111.8	R300 M301 R306 K307 Q308 I331 E334 M335	R300-L304 HydrophobicContact CG-CD1 4.27Å; R300-L304 HydrophobicContact CG-CG 4.48Å; R300-L304 WeakPolarHBondContact O-CG 3.38Å; R300-L304 PolarHBondContact O-N 3.02Å; M301-L304 HydrophobicContact CE-CD1 3.6Å; M301-L304 PolarHBondContact O-N 2.66Å; M301-L304 VanDerWaalsContact O-N 3.16Å; L304-R306 VanDerWaalsContact C-N 3.31Å; L304-R306 PolarHBondContact O-N 3.24Å; L304-K307 CarbonylContact O-C 3.57Å; L304-K307 PolarHBondContact O-N 3.4Å; L304-K307 VanDerWaalsContact O-N 3.17Å; L304-Q308 WeakPolarHBondContact O-CB 3.43Å; L304-Q308 PolarHBondContact O-N 2.94Å; L304-I331 HydrophobicContact CB-CG2 4.22Å; L304-I331 HydrophobicContact CD2-CG2 4.27Å; L304-E334 HydrophobicContact CD1-CB 3.92Å; L304-E334 HydrophobicContact CD1-CG 3.81Å; L304-E334 HydrophobicContact CD2-CB 4.45Å; L304-E334 WeakPolarHBondContact CD2-OE2 3.29Å; L304-M335 HydrophobicContact CB-CE 3.52Å; L304-M335 HydrophobicContact CB-CG 3.83Å; L304-M335 HydrophobicContact CD1-CG 3.91Å; L304-M335 WeakPolarHBondContact O-CE 3.32Å
305	E	92.7	Very high	87.9	Confident	124 Å²	124	55.3 Å²	55.3	58%	0.579	30%	0.295	S	S	*	.	H	α-helix	trans	-60.7	-41.5	176.8	-75.8	173	176.1	0	0	111.7	M301 F303 S309 M335	M301-E305 WeakPolarHBondContact O-CG 3.13Å; M301-E305 PolarHBondContact O-N 3.05Å; F303-E305 VanDerWaalsContact C-N 3.34Å; F303-E305 PolarHBondContact O-N 3.41Å; E305-S309 PolarHBondContact O-N 3.07Å; E305-M335 VanDerWaalsContact CA-CE 3.43Å; E305-M335 HydrophobicContact CB-CE 4.32Å; E305-M335 HydrophobicContact CG-CE 4Å
306	R	90.1	Very high	89.1	Confident	117 Å²	117	57.3 Å²	57.3	44%	0.442	29%	0.291	S	S	.	.	H	α-helix	trans	-62.7	-48.5	173	-174.3	-171.6	-57.5	166.3	2.6	110.8	E281 A302 F303 L304 Q308 S309 I310	E281-R306 VanDerWaalsContact OE1-CD 3.28Å; E281-R306 WeakPolarHBondContact OE1-CD 3.29Å; E281-R306 IonicContact OE2-NH1 3.16Å; A302-R306 PolarHBondContact O-N 3.18Å; F303-R306 WeakPolarHBondContact O-CB 3.42Å; F303-R306 PolarHBondContact O-N 3.31Å; L304-R306 VanDerWaalsContact C-N 3.31Å; L304-R306 PolarHBondContact O-N 3.24Å; R306-Q308 VanDerWaalsContact C-N 3.32Å; R306-Q308 PolarHBondContact O-N 3.08Å; R306-S309 PolarHBondContact O-N 3.09Å; R306-S309 VanDerWaalsContact O-N 3.16Å; R306-I310 HydrophobicContact CG-CD1 4.09Å; R306-I310 WeakPolarHBondContact O-CG1 3.27Å; R306-I310 PolarHBondContact O-N 2.63Å
307	K	93	Very high	90.2	Very high	29 Å²	29	53.7 Å²	53.7	13%	0.126	28%	0.279	C	S	.	.	H	α-helix	trans	-60.7	-43	-179.4	-153.6	-177.7	173.7	178.6	0	111	L278 D282 F303 L304 S309 I310 V311 I331	L278-K307 HydrophobicContact CD2-CG 3.83Å; D282-K307 IonicContact OD1-NZ 3.48Å; D282-K307 PolarHBondContact OD1-NZ 2.88Å; D282-K307 IonicContact OD2-NZ 3.56Å; D282-K307 PolarHBondContact OD2-NZ 2.78Å; F303-K307 HydrophobicContact CE1-CD 4.17Å; F303-K307 HydrophobicContact CZ-CD 3.84Å; F303-K307 PolarHBondContact O-N 3.46Å; L304-K307 CarbonylContact O-C 3.57Å; L304-K307 PolarHBondContact O-N 3.4Å; L304-K307 VanDerWaalsContact O-N 3.17Å; K307-S309 PolarHBondContact O-N 3.11Å; K307-I310 PolarHBondContact O-N 3.23Å; K307-V311 WeakPolarHBondContact O-CG2 3.39Å; K307-V311 PolarHBondContact O-N 3.01Å; K307-I331 HydrophobicContact CB-CD1 4.02Å; K307-I331 HydrophobicContact CD-CD1 3.84Å; K307-I331 HydrophobicContact CD-CG1 4.04Å; K307-I331 HydrophobicContact CG-CD1 3.69Å; K307-I331 HydrophobicContact CG-CG1 4.38Å
308	Q	93.7	Very high	90.9	Very high	35 Å²	35	51.2 Å²	51.2	16%	0.164	26%	0.261	C	S	.	.	H	α-helix	trans	-58.4	-47.8	173.6	-175.2	-172	-14.6	0	0	111.3	L304 R306 I310 V311 D312 I331 L332 M335	L304-Q308 WeakPolarHBondContact O-CB 3.43Å; L304-Q308 PolarHBondContact O-N 2.94Å; R306-Q308 VanDerWaalsContact C-N 3.32Å; R306-Q308 PolarHBondContact O-N 3.08Å; Q308-I310 VanDerWaalsContact C-N 3.27Å; Q308-I310 PolarHBondContact O-N 2.93Å; Q308-V311 PolarHBondContact O-N 3Å; Q308-D312 WeakPolarHBondContact O-CB 3.46Å; Q308-D312 PolarHBondContact O-N 3.41Å; Q308-I331 HydrophobicContact CB-CG2 3.97Å; Q308-L332 HydrophobicContact CG-CD2 4.28Å; Q308-M335 HydrophobicContact CB-CE 3.84Å; Q308-M335 VanDerWaalsContact OE1-CE 3.25Å; Q308-M335 PolarHBondContact OE1-SD 3.42Å
309	S	94.1	Very high	91.4	Very high	56 Å²	56	52.7 Å²	52.7	39%	0.392	27%	0.272	S	S	.	.	H	α-helix	trans	-60.8	-36.6	178.3	178.8	0	0	0	0	112.8	E305 R306 K307 K313	E305-S309 PolarHBondContact O-N 3.07Å; R306-S309 PolarHBondContact O-N 3.09Å; R306-S309 VanDerWaalsContact O-N 3.16Å; K307-S309 PolarHBondContact O-N 3.11Å; S309-K313 WeakPolarHBondContact O-CG 3.2Å; S309-K313 PolarHBondContact O-N 3.47Å
310	I	92.4	Very high	91.4	Very high	19 Å²	19	59.5 Å²	59.5	10%	0.097	29%	0.286	C	S	.	.	H	α-helix	trans	-66.5	-47.7	175.5	-67.2	167.9	0	0	0	110	W274 L277 L278 E281 R306 K307 Q308 D312 K313 A314	W274-I310 HydrophobicContact CE3-CG2 4.08Å; W274-I310 HydrophobicContact CZ3-CG2 4.01Å; L277-I310 HydrophobicContact CD2-CG2 3.73Å; L277-I310 HydrophobicContact CG-CG2 4.3Å; L278-I310 HydrophobicContact CD2-CB 4.31Å; L278-I310 HydrophobicContact CD2-CG2 3.83Å; E281-I310 HydrophobicContact CG-CD1 3.81Å; E281-I310 WeakPolarHBondContact OE1-CD1 3.43Å; R306-I310 HydrophobicContact CG-CD1 4.09Å; R306-I310 WeakPolarHBondContact O-CG1 3.27Å; R306-I310 PolarHBondContact O-N 2.63Å; K307-I310 PolarHBondContact O-N 3.23Å; Q308-I310 VanDerWaalsContact C-N 3.27Å; Q308-I310 PolarHBondContact O-N 2.93Å; I310-D312 PolarHBondContact O-N 3.32Å; I310-K313 PolarHBondContact O-N 3.23Å; I310-A314 PolarHBondContact O-N 3Å
311	V	93.9	Very high	91.6	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-64.3	-40.9	178.6	179.2	0	0	0	0	111.8	L278 K307 Q308 K313 A314 I315 L324 R328 I331	L278-V311 HydrophobicContact CD1-CG2 3.69Å; L278-V311 HydrophobicContact CD2-CG2 3.34Å; L278-V311 HydrophobicContact CG-CG2 4.15Å; K307-V311 WeakPolarHBondContact O-CG2 3.39Å; K307-V311 PolarHBondContact O-N 3.01Å; Q308-V311 PolarHBondContact O-N 3Å; V311-K313 VanDerWaalsContact C-N 3.3Å; V311-K313 PolarHBondContact O-N 2.98Å; V311-A314 CarbonylContact O-C 3.35Å; V311-A314 WeakPolarHBondContact O-CB 3.39Å; V311-A314 PolarHBondContact O-N 3.03Å; V311-A314 VanDerWaalsContact O-N 3.12Å; V311-I315 HydrophobicContact CG1-CD1 3.71Å; V311-I315 HydrophobicContact CG1-CG1 4.19Å; V311-I315 WeakPolarHBondContact O-CG1 3.21Å; V311-I315 PolarHBondContact O-N 3.39Å; V311-L324 VanDerWaalsContact CG1-O 3.28Å; V311-L324 WeakPolarHBondContact CG1-O 3.26Å; V311-R328 HydrophobicContact CG1-CB 3.62Å; V311-R328 HydrophobicContact CG1-CG 4.31Å; V311-I331 HydrophobicContact CB-CD1 4.43Å; V311-I331 HydrophobicContact CG2-CD1 3.58Å
312	D	94.7	Very high	91.7	Very high	45 Å²	45	55.4 Å²	55.4	24%	0.241	27%	0.271	C	S	.	.	H	α-helix	trans	-61.1	-40.1	177.5	-75.3	-26.7	0	0	0	111.2	Q308 I310 I315 Q316 R328	Q308-D312 WeakPolarHBondContact O-CB 3.46Å; Q308-D312 PolarHBondContact O-N 3.41Å; I310-D312 PolarHBondContact O-N 3.32Å; D312-I315 PolarHBondContact O-N 3.03Å; D312-Q316 VanDerWaalsContact O-CG 3.27Å; D312-Q316 WeakPolarHBondContact O-CG 3.07Å; D312-Q316 PolarHBondContact O-N 2.91Å; D312-R328 WeakPolarHBondContact OD1-CD 3.41Å; D312-R328 IonicContact OD1-CZ 3.32Å; D312-R328 IonicContact OD1-NE 2.69Å; D312-R328 PolarHBondContact OD1-NE 3.17Å
313	K	92.8	Very high	91.8	Very high	112 Å²	112	58.5 Å²	58.5	49%	0.487	28%	0.28	S	S	.	.	H	α-helix	trans	-64.9	-43.9	172.3	-73.8	173	-178.4	176.3	0	111.8	W274 S309 I310 V311 I315 Q316 S317	W274-K313 HydrophobicContact CH2-CB 4.08Å; S309-K313 WeakPolarHBondContact O-CG 3.2Å; S309-K313 PolarHBondContact O-N 3.47Å; I310-K313 PolarHBondContact O-N 3.23Å; V311-K313 VanDerWaalsContact C-N 3.3Å; V311-K313 PolarHBondContact O-N 2.98Å; K313-I315 VanDerWaalsContact C-N 3.3Å; K313-I315 PolarHBondContact O-N 3.29Å; K313-Q316 WeakPolarHBondContact O-CB 3.43Å; K313-Q316 PolarHBondContact O-N 2.93Å; K313-S317 PolarHBondContact O-N 2.59Å; K313-S317 VanDerWaalsContact O-N 3.08Å; K313-S317 PolarHBondContact O-OG 3.29Å
314	A	92.9	Very high	91.9	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-60	-41.3	177.1	0	0	0	0	0	111.6	W274 I310 V311 S317 C318 L324	W274-A314 HydrophobicContact CB-CB 3.99Å; W274-A314 HydrophobicContact CD2-CB 3.43Å; W274-A314 VanDerWaalsContact CD2-CB 3.43Å; W274-A314 HydrophobicContact CE3-CB 3.67Å; W274-A314 HydrophobicContact CG-CB 3.58Å; W274-A314 HydrophobicContact CZ3-CB 4.34Å; I310-A314 PolarHBondContact O-N 3Å; V311-A314 CarbonylContact O-C 3.35Å; V311-A314 WeakPolarHBondContact O-CB 3.39Å; V311-A314 PolarHBondContact O-N 3.03Å; V311-A314 VanDerWaalsContact O-N 3.12Å; A314-S317 PolarHBondContact O-N 3.06Å; A314-C318 WeakPolarHBondContact O-CB 3.34Å; A314-C318 PolarHBondContact O-N 2.97Å; A314-L324 HydrophobicContact CB-CD1 3.87Å; A314-L324 HydrophobicContact CB-CD2 4.03Å
315	I	93.8	Very high	92	Very high	23 Å²	23	59.7 Å²	59.7	12%	0.118	29%	0.285	C	S	.	.	H	α-helix	trans	-67.8	-37.8	176.5	-70.3	167.5	0	0	0	111.3	V311 D312 K313 S317 C318 P319 L324 H325 R328	V311-I315 HydrophobicContact CG1-CD1 3.71Å; V311-I315 HydrophobicContact CG1-CG1 4.19Å; V311-I315 WeakPolarHBondContact O-CG1 3.21Å; V311-I315 PolarHBondContact O-N 3.39Å; D312-I315 PolarHBondContact O-N 3.03Å; K313-I315 VanDerWaalsContact C-N 3.3Å; K313-I315 PolarHBondContact O-N 3.29Å; I315-S317 VanDerWaalsContact C-N 3.29Å; I315-S317 PolarHBondContact O-N 2.94Å; I315-C318 CarbonylContact O-C 3.54Å; I315-C318 PolarHBondContact O-N 3.08Å; I315-P319 WeakPolarHBondContact O-CA 3.42Å; I315-P319 WeakPolarHBondContact O-CB 3.37Å; I315-P319 WeakPolarHBondContact O-CD 3.27Å; I315-L324 HydrophobicContact CG1-CB 3.8Å; I315-H325 WeakPolarHBondContact CG2-CE1 3.18Å; I315-R328 HydrophobicContact CD1-CB 3.96Å; I315-R328 VanDerWaalsContact CD1-CD 3.5Å; I315-R328 HydrophobicContact CD1-CG 4.37Å
316	Q	92.6	Very high	92	Very high	157 Å²	157	55 Å²	55	73%	0.734	26%	0.264	S	S	*	.	H	α-helix	trans	-61.6	-39	175.1	-75	170.1	17.4	0	0	112	D312 K313	D312-Q316 VanDerWaalsContact O-CG 3.27Å; D312-Q316 WeakPolarHBondContact O-CG 3.07Å; D312-Q316 PolarHBondContact O-N 2.91Å; K313-Q316 WeakPolarHBondContact O-CB 3.43Å; K313-Q316 PolarHBondContact O-N 2.93Å
317	S	91.1	Very high	92	Very high	43 Å²	43	50.9 Å²	50.9	30%	0.301	25%	0.254	S	S	.	.	H	α-helix	trans	-76.4	-40.6	175.4	-59.3	0	0	0	0	112.6	P268 K313 A314 I315 P319	P268-S317 WeakPolarHBondContact O-CB 3.28Å; K313-S317 PolarHBondContact O-N 2.59Å; K313-S317 VanDerWaalsContact O-N 3.08Å; K313-S317 PolarHBondContact O-OG 3.29Å; A314-S317 PolarHBondContact O-N 3.06Å; I315-S317 VanDerWaalsContact C-N 3.29Å; I315-S317 PolarHBondContact O-N 2.94Å; S317-P319 VanDerWaalsContact C-CD 3.45Å; S317-P319 VanDerWaalsContact O-CD 3.32Å; S317-P319 WeakPolarHBondContact O-CD 3.19Å
318	C	90.6	Very high	92.1	Very high	10 Å²	10	51.5 Å²	51.5	7%	0.068	26%	0.256	C	S	.	.			trans	-123.2	64.1	-173.3	-59.3	0	0	0	0	112.4	V271 A314 I315 R320 I321 L324	V271-C318 HydrophobicContact CG2-CB 4.46Å; A314-C318 WeakPolarHBondContact O-CB 3.34Å; A314-C318 PolarHBondContact O-N 2.97Å; I315-C318 CarbonylContact O-C 3.54Å; I315-C318 PolarHBondContact O-N 3.08Å; C318-R320 PolarHBondContact O-N 3.18Å; C318-R320 VanDerWaalsContact O-N 3.11Å; C318-I321 HydrophobicContact CB-CB 4.47Å; C318-I321 HydrophobicContact CB-CG1 3.83Å; C318-I321 PolarHBondContact O-N 3.46Å; C318-L324 HydrophobicContact CB-CD1 3.84Å
319	P	88.9	Confident	92	Very high	75 Å²	75	50 Å²	50	49%	0.487	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-20.1	-167.6	25.2	-35.5	0	0	0	114.6	I315 S317 H325 F353	I315-P319 WeakPolarHBondContact O-CA 3.42Å; I315-P319 WeakPolarHBondContact O-CB 3.37Å; I315-P319 WeakPolarHBondContact O-CD 3.27Å; S317-P319 VanDerWaalsContact C-CD 3.45Å; S317-P319 VanDerWaalsContact O-CD 3.32Å; S317-P319 WeakPolarHBondContact O-CD 3.19Å; P319-H325 PolarHBondContact O-NE2 2.94Å; P319-F353 WeakPolarHBondContact O-CZ 3.38Å
320	R	87.7	Confident	91.7	Very high	219 Å²	219	50.8 Å²	50.8	83%	0.826	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-1.7	-177.2	-64.7	-176.4	179	179	0.2	114.1	C318	C318-R320 PolarHBondContact O-N 3.18Å; C318-R320 VanDerWaalsContact O-N 3.11Å
321	I	90	Very high	91.6	Very high	51 Å²	51	50.1 Å²	50.1	26%	0.262	24%	0.243	S	C	.	.			trans	-91.1	110.5	-174.4	-57.8	-62.4	0	0	0	110.1	V271 C318 E323 L324 H325	V271-I321 HydrophobicContact CG1-CG1 4.41Å; V271-I321 HydrophobicContact CG1-CG2 3.78Å; V271-I321 HydrophobicContact CG2-CD1 3.76Å; V271-I321 HydrophobicContact CG2-CG1 3.63Å; C318-I321 HydrophobicContact CB-CB 4.47Å; C318-I321 HydrophobicContact CB-CG1 3.83Å; C318-I321 PolarHBondContact O-N 3.46Å; I321-E323 HydrophobicContact CG2-CB 4.13Å; I321-E323 PolarHBondContact O-N 3.16Å; I321-L324 HydrophobicContact CB-CD1 4.1Å; I321-L324 HydrophobicContact CB-CG 4.28Å; I321-L324 HydrophobicContact CG2-CB 4.48Å; I321-L324 HydrophobicContact CG2-CD1 4.21Å; I321-L324 HydrophobicContact CG2-CG 3.94Å; I321-L324 PolarHBondContact O-N 3.09Å; I321-H325 PolarHBondContact O-CD2 3.42Å; I321-H325 VanDerWaalsContact O-CD2 3.25Å
322	V	90.5	Very high	91.5	Very high	12 Å²	12	50.1 Å²	50.1	7%	0.073	24%	0.243	C	C	.	.	H	α-helix	trans	-61.4	-41.2	-178.4	171	0	0	0	0	112.2	L324 H325 L326 F353 R356 E358 I359	V322-L324 PolarHBondContact O-N 3.34Å; V322-H325 PolarHBondContact O-N 3.47Å; V322-H325 VanDerWaalsContact O-N 3.08Å; V322-L326 HydrophobicContact CG1-CD1 3.57Å; V322-L326 HydrophobicContact CG1-CG 4Å; V322-L326 WeakPolarHBondContact O-CG 3.48Å; V322-L326 PolarHBondContact O-N 3.36Å; V322-F353 HydrophobicContact CG2-CB 4.44Å; V322-F353 HydrophobicContact CG2-CD1 3.85Å; V322-F353 HydrophobicContact CG2-CE1 4.18Å; V322-F353 HydrophobicContact CG2-CG 4.03Å; V322-R356 HydrophobicContact CG2-CB 4.19Å; V322-R356 HydrophobicContact CG2-CG 3.93Å; V322-E358 HydrophobicContact CG1-CB 3.96Å; V322-I359 HydrophobicContact CG1-CD1 3.47Å; V322-I359 VanDerWaalsContact CG1-CD1 3.47Å; V322-I359 HydrophobicContact CG1-CG1 3.8Å; V322-I359 HydrophobicContact CG2-CG1 4.47Å
323	E	89.9	Confident	91.1	Very high	99 Å²	99	51.2 Å²	51.2	46%	0.463	24%	0.244	S	C	.	.	H	α-helix	trans	-55.3	-37.3	-179.1	-64.1	169.5	174.2	0	0	112.8	L275 I321 A327	L275-E323 WeakPolarHBondContact CD1-OE2 3.38Å; I321-E323 HydrophobicContact CG2-CB 4.13Å; I321-E323 PolarHBondContact O-N 3.16Å; E323-A327 WeakPolarHBondContact O-CB 3.11Å; E323-A327 PolarHBondContact O-N 2.93Å
324	L	92.7	Very high	90.8	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-71.7	-40.5	178.4	-65.8	176.6	0	0	0	112	W274 L275 L278 V311 A314 I315 C318 I321 V322 L326 A327 R328	W274-L324 HydrophobicContact CB-CD2 4.31Å; L275-L324 HydrophobicContact CD2-CD2 3.99Å; L278-L324 HydrophobicContact CD1-CD2 4.38Å; V311-L324 VanDerWaalsContact CG1-O 3.28Å; V311-L324 WeakPolarHBondContact CG1-O 3.26Å; A314-L324 HydrophobicContact CB-CD1 3.87Å; A314-L324 HydrophobicContact CB-CD2 4.03Å; I315-L324 HydrophobicContact CG1-CB 3.8Å; C318-L324 HydrophobicContact CB-CD1 3.84Å; I321-L324 HydrophobicContact CB-CD1 4.1Å; I321-L324 HydrophobicContact CB-CG 4.28Å; I321-L324 HydrophobicContact CG2-CB 4.48Å; I321-L324 HydrophobicContact CG2-CD1 4.21Å; I321-L324 HydrophobicContact CG2-CG 3.94Å; I321-L324 PolarHBondContact O-N 3.09Å; V322-L324 PolarHBondContact O-N 3.34Å; L324-L326 VanDerWaalsContact C-N 3.34Å; L324-A327 PolarHBondContact O-N 3.2Å; L324-R328 PolarHBondContact O-N 3.25Å
325	H	94.2	Very high	90.6	Very high	27 Å²	27	50.2 Å²	50.2	13%	0.125	24%	0.241	C	C	.	.	H	α-helix	trans	-65.1	-39.2	176.1	-72.7	-74.6	0	0	0	111.9	I315 P319 I321 V322 R328 L329 L349 F353	I315-H325 WeakPolarHBondContact CG2-CE1 3.18Å; P319-H325 PolarHBondContact O-NE2 2.94Å; I321-H325 PolarHBondContact O-CD2 3.42Å; I321-H325 VanDerWaalsContact O-CD2 3.25Å; V322-H325 PolarHBondContact O-N 3.47Å; V322-H325 VanDerWaalsContact O-N 3.08Å; H325-R328 WeakPolarHBondContact O-CB 3.44Å; H325-R328 PolarHBondContact O-N 2.93Å; H325-L329 PolarHBondContact O-N 3.39Å; H325-L349 HydrophobicContact CB-CD1 3.92Å; H325-L349 HydrophobicContact CB-CD2 3.75Å; H325-F353 AromaticContact CD2-CE2 3.58Å; H325-F353 AromaticContact CD2-CZ 3.79Å; H325-F353 AromaticContact NE2-CE2 3.76Å; H325-F353 AromaticContact NE2-CZ 3.8Å
326	L	92.9	Very high	90.2	Very high	27 Å²	27	54.1 Å²	54.1	14%	0.141	27%	0.27	C	S	.	.	H	α-helix	trans	-66	-44.2	174.7	-67.6	172.4	0	0	0	111.5	V322 L324 R328 L329 E330 W346 E358 I359 E362	V322-L326 HydrophobicContact CG1-CD1 3.57Å; V322-L326 HydrophobicContact CG1-CG 4Å; V322-L326 WeakPolarHBondContact O-CG 3.48Å; V322-L326 PolarHBondContact O-N 3.36Å; L324-L326 VanDerWaalsContact C-N 3.34Å; L326-R328 VanDerWaalsContact C-N 3.26Å; L326-R328 PolarHBondContact O-N 3.44Å; L326-L329 PolarHBondContact O-N 2.76Å; L326-E330 PolarHBondContact O-N 3.06Å; L326-W346 HydrophobicContact CD2-CH2 3.86Å; L326-W346 HydrophobicContact CD2-CZ3 4.05Å; L326-E358 HydrophobicContact CD1-CB 4.4Å; L326-I359 HydrophobicContact CD2-CD1 3.94Å; L326-I359 HydrophobicContact CG-CD1 4.22Å; L326-E362 HydrophobicContact CD1-CB 4.22Å; L326-E362 HydrophobicContact CD1-CG 3.87Å; L326-E362 HydrophobicContact CD2-CB 3.58Å; L326-E362 HydrophobicContact CD2-CG 4.13Å; L326-E362 HydrophobicContact CG-CB 4.46Å
327	A	90.2	Very high	89.8	Confident	29 Å²	29	50.9 Å²	50.9	24%	0.24	25%	0.252	C	S	.	.	H	α-helix	trans	-59.2	-38	173.8	0	0	0	0	0	112.1	L278 E323 L324 I331	L278-A327 HydrophobicContact CD1-CB 4.49Å; E323-A327 WeakPolarHBondContact O-CB 3.11Å; E323-A327 PolarHBondContact O-N 2.93Å; L324-A327 PolarHBondContact O-N 3.2Å; A327-I331 WeakPolarHBondContact O-CD1 3.42Å; A327-I331 VanDerWaalsContact O-CG1 3.28Å; A327-I331 WeakPolarHBondContact O-CG1 3.19Å; A327-I331 PolarHBondContact O-N 3.42Å
328	R	94.5	Very high	89.6	Confident	42 Å²	42	51.3 Å²	51.3	16%	0.158	26%	0.255	C	S	.	.	H	α-helix	trans	-61.3	-50.2	173.9	-172.8	170.3	167.4	-91.9	-1.2	111.5	V311 D312 I315 L324 H325 L326 E330 I331 L332 E345	V311-R328 HydrophobicContact CG1-CB 3.62Å; V311-R328 HydrophobicContact CG1-CG 4.31Å; D312-R328 WeakPolarHBondContact OD1-CD 3.41Å; D312-R328 IonicContact OD1-CZ 3.32Å; D312-R328 IonicContact OD1-NE 2.69Å; D312-R328 PolarHBondContact OD1-NE 3.17Å; I315-R328 HydrophobicContact CD1-CB 3.96Å; I315-R328 VanDerWaalsContact CD1-CD 3.5Å; I315-R328 HydrophobicContact CD1-CG 4.37Å; L324-R328 PolarHBondContact O-N 3.25Å; H325-R328 WeakPolarHBondContact O-CB 3.44Å; H325-R328 PolarHBondContact O-N 2.93Å; L326-R328 VanDerWaalsContact C-N 3.26Å; L326-R328 PolarHBondContact O-N 3.44Å; R328-E330 VanDerWaalsContact C-N 3.27Å; R328-E330 PolarHBondContact O-N 3.33Å; R328-I331 WeakPolarHBondContact O-CB 3.43Å; R328-I331 PolarHBondContact O-N 2.94Å; R328-I331 VanDerWaalsContact O-N 3.15Å; R328-L332 HydrophobicContact CG-CD1 4.26Å; R328-L332 HydrophobicContact CG-CG 4.35Å; R328-L332 WeakPolarHBondContact O-CG 3.31Å; R328-L332 PolarHBondContact O-N 2.9Å; R328-E345 IonicContact CZ-OE2 3.87Å; R328-E345 IonicContact NH1-OE2 3.99Å; R328-E345 PolarHBondContact NH1-OE2 2.83Å; R328-E345 IonicContact NH2-OE1 3.21Å; R328-E345 IonicContact NH2-OE2 3.49Å
329	L	91.8	Very high	89.3	Confident	3 Å²	3	54.4 Å²	54.4	2%	0.016	27%	0.267	C	S	.	.	H	α-helix	trans	-60.2	-38.1	-179.3	-81.1	171.9	0	0	0	112.9	H325 L326 L332 R333 L342 E345 W346 L349	H325-L329 PolarHBondContact O-N 3.39Å; L326-L329 PolarHBondContact O-N 2.76Å; L329-L332 PolarHBondContact O-N 3.42Å; L329-R333 WeakPolarHBondContact O-CB 3.46Å; L329-R333 PolarHBondContact O-N 2.89Å; L329-L342 HydrophobicContact CD2-CD2 4.45Å; L329-E345 HydrophobicContact CD2-CB 3.63Å; L329-W346 HydrophobicContact CB-CZ2 4.47Å; L329-W346 HydrophobicContact CD1-CD2 3.62Å; L329-W346 HydrophobicContact CD1-CE3 3.62Å; L329-W346 HydrophobicContact CD1-CG 4.41Å; L329-W346 HydrophobicContact CD1-CH2 3.62Å; L329-W346 HydrophobicContact CD1-CZ2 3.61Å; L329-W346 HydrophobicContact CD1-CZ3 3.62Å; L329-L349 HydrophobicContact CD1-CD1 3.26Å; L329-L349 HydrophobicContact CD1-CG 4.45Å; L329-L349 HydrophobicContact CG-CD1 4.21Å
330	E	88.1	Confident	89.3	Confident	73 Å²	73	54.1 Å²	54.1	34%	0.341	27%	0.271	S	S	.	.	H	α-helix	trans	-62.6	-43.2	175.7	-178.1	53.9	-152.6	0	0	111.7	L326 R328 R333 E334	L326-E330 PolarHBondContact O-N 3.06Å; R328-E330 VanDerWaalsContact C-N 3.27Å; R328-E330 PolarHBondContact O-N 3.33Å; E330-R333 VanDerWaalsContact CD-CZ 3.44Å; E330-R333 WeakPolarHBondContact O-CB 3.44Å; E330-R333 PolarHBondContact O-N 3.29Å; E330-R333 IonicContact OE1-CZ 3.29Å; E330-R333 IonicContact OE1-NE 2.69Å; E330-R333 IonicContact OE1-NH1 3.44Å; E330-R333 IonicContact OE1-NH2 2.76Å; E330-R333 PolarHBondContact OE1-NH2 3.44Å; E330-R333 IonicContact OE2-CZ 2.96Å; E330-R333 IonicContact OE2-NE 3.34Å; E330-R333 PolarHBondContact OE2-NE 3.3Å; E330-R333 IonicContact OE2-NH1 3.68Å; E330-R333 PolarHBondContact OE2-NH1 3.12Å; E330-R333 IonicContact OE2-NH2 2.64Å; E330-R333 PolarHBondContact OE2-NH2 3.41Å; E330-E334 PolarHBondContact O-N 3.03Å
331	I	90.7	Very high	89.4	Confident	5 Å²	5	47.3 Å²	47.3	3%	0.026	25%	0.251	C	S	.	.	H	α-helix	trans	-62.7	-47	174.2	-64.9	162	0	0	0	111.1	L304 K307 Q308 V311 A327 R328 R333 E334 M335	L304-I331 HydrophobicContact CB-CG2 4.22Å; L304-I331 HydrophobicContact CD2-CG2 4.27Å; K307-I331 HydrophobicContact CB-CD1 4.02Å; K307-I331 HydrophobicContact CD-CD1 3.84Å; K307-I331 HydrophobicContact CD-CG1 4.04Å; K307-I331 HydrophobicContact CG-CD1 3.69Å; K307-I331 HydrophobicContact CG-CG1 4.38Å; Q308-I331 HydrophobicContact CB-CG2 3.97Å; V311-I331 HydrophobicContact CB-CD1 4.43Å; V311-I331 HydrophobicContact CG2-CD1 3.58Å; A327-I331 WeakPolarHBondContact O-CD1 3.42Å; A327-I331 VanDerWaalsContact O-CG1 3.28Å; A327-I331 WeakPolarHBondContact O-CG1 3.19Å; A327-I331 PolarHBondContact O-N 3.42Å; R328-I331 WeakPolarHBondContact O-CB 3.43Å; R328-I331 PolarHBondContact O-N 2.94Å; R328-I331 VanDerWaalsContact O-N 3.15Å; I331-R333 VanDerWaalsContact C-N 3.3Å; I331-R333 PolarHBondContact O-N 3.37Å; I331-E334 PolarHBondContact O-N 3.04Å; I331-M335 HydrophobicContact CG2-CE 3.88Å; I331-M335 HydrophobicContact CG2-SD 4.37Å; I331-M335 WeakPolarHBondContact O-CG 3.33Å; I331-M335 PolarHBondContact O-N 3.4Å
332	L	91	Very high	89.4	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.3	-38.8	-179.9	-65	-177.9	0	0	0	112.1	Q308 R328 L329 M335 W337 L342 E345	Q308-L332 HydrophobicContact CG-CD2 4.28Å; R328-L332 HydrophobicContact CG-CD1 4.26Å; R328-L332 HydrophobicContact CG-CG 4.35Å; R328-L332 WeakPolarHBondContact O-CG 3.31Å; R328-L332 PolarHBondContact O-N 2.9Å; L329-L332 PolarHBondContact O-N 3.42Å; L332-M335 HydrophobicContact CD2-SD 4.34Å; L332-M335 WeakPolarHBondContact O-CB 3.37Å; L332-M335 PolarHBondContact O-N 3.01Å; L332-W337 HydrophobicContact CB-CD2 4.31Å; L332-W337 HydrophobicContact CB-CG 4.25Å; L332-W337 HydrophobicContact CD1-CE3 4.45Å; L332-W337 HydrophobicContact CD1-CZ3 4.45Å; L332-W337 HydrophobicContact CD2-CD2 4.08Å; L332-W337 HydrophobicContact CD2-CH2 4.15Å; L332-W337 HydrophobicContact CD2-CZ2 3.63Å; L332-W337 WeakPolarHBondContact O-CB 3.38Å; L332-W337 PolarHBondContact O-N 2.89Å; L332-L342 HydrophobicContact CB-CD2 3.86Å; L332-E345 HydrophobicContact CD1-CG 4.29Å
333	R	87.2	Confident	89.4	Confident	68 Å²	68	46.8 Å²	46.8	26%	0.257	25%	0.247	S	C	.	.	H	α-helix	trans	-60.7	-47.7	173.8	-173.7	-162.6	70.7	170.3	10.5	111.1	L329 E330 I331 M335 S336	L329-R333 WeakPolarHBondContact O-CB 3.46Å; L329-R333 PolarHBondContact O-N 2.89Å; E330-R333 VanDerWaalsContact CD-CZ 3.44Å; E330-R333 WeakPolarHBondContact O-CB 3.44Å; E330-R333 PolarHBondContact O-N 3.29Å; E330-R333 IonicContact OE1-CZ 3.29Å; E330-R333 IonicContact OE1-NE 2.69Å; E330-R333 IonicContact OE1-NH1 3.44Å; E330-R333 IonicContact OE1-NH2 2.76Å; E330-R333 PolarHBondContact OE1-NH2 3.44Å; E330-R333 IonicContact OE2-CZ 2.96Å; E330-R333 IonicContact OE2-NE 3.34Å; E330-R333 PolarHBondContact OE2-NE 3.3Å; E330-R333 IonicContact OE2-NH1 3.68Å; E330-R333 PolarHBondContact OE2-NH1 3.12Å; E330-R333 IonicContact OE2-NH2 2.64Å; E330-R333 PolarHBondContact OE2-NH2 3.41Å; I331-R333 VanDerWaalsContact C-N 3.3Å; I331-R333 PolarHBondContact O-N 3.37Å; R333-M335 VanDerWaalsContact C-N 3.27Å; R333-M335 PolarHBondContact O-N 3.36Å; R333-S336 WeakPolarHBondContact O-CA 3.39Å; R333-S336 PolarHBondContact O-N 3.42Å
334	E	86	Confident	89.5	Confident	66 Å²	66	48.8 Å²	48.8	31%	0.308	25%	0.254	S	S	.	.	H	α-helix	trans	-65.8	-32.9	-179.1	-161.9	-174	160	0	0	112.4	R300 L304 E330 I331 S336	R300-E334 IonicContact CZ-OE1 3.06Å; R300-E334 IonicContact CZ-OE2 2.93Å; R300-E334 IonicContact NE-OE1 3.3Å; R300-E334 PolarHBondContact NE-OE1 3.22Å; R300-E334 IonicContact NE-OE2 3.64Å; R300-E334 IonicContact NH2-OE1 3.79Å; R300-E334 PolarHBondContact NH2-OE1 2.83Å; R300-E334 IonicContact NH2-OE2 3.36Å; R300-E334 PolarHBondContact NH2-OE2 3.34Å; L304-E334 HydrophobicContact CD1-CB 3.92Å; L304-E334 HydrophobicContact CD1-CG 3.81Å; L304-E334 HydrophobicContact CD2-CB 4.45Å; L304-E334 WeakPolarHBondContact CD2-OE2 3.29Å; E330-E334 PolarHBondContact O-N 3.03Å; I331-E334 PolarHBondContact O-N 3.04Å; E334-S336 PolarHBondContact O-N 2.91Å
335	M	88.4	Confident	89.5	Confident	26 Å²	26	51 Å²	51	13%	0.128	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-0.5	168.8	-70.3	-179.5	170.9	0	0	114.2	L304 E305 Q308 I331 L332 R333 W337	L304-M335 HydrophobicContact CB-CE 3.52Å; L304-M335 HydrophobicContact CB-CG 3.83Å; L304-M335 HydrophobicContact CD1-CG 3.91Å; L304-M335 WeakPolarHBondContact O-CE 3.32Å; E305-M335 VanDerWaalsContact CA-CE 3.43Å; E305-M335 HydrophobicContact CB-CE 4.32Å; E305-M335 HydrophobicContact CG-CE 4Å; Q308-M335 HydrophobicContact CB-CE 3.84Å; Q308-M335 VanDerWaalsContact OE1-CE 3.25Å; Q308-M335 PolarHBondContact OE1-SD 3.42Å; I331-M335 HydrophobicContact CG2-CE 3.88Å; I331-M335 HydrophobicContact CG2-SD 4.37Å; I331-M335 WeakPolarHBondContact O-CG 3.33Å; I331-M335 PolarHBondContact O-N 3.4Å; L332-M335 HydrophobicContact CD2-SD 4.34Å; L332-M335 WeakPolarHBondContact O-CB 3.37Å; L332-M335 PolarHBondContact O-N 3.01Å; R333-M335 VanDerWaalsContact C-N 3.27Å; R333-M335 PolarHBondContact O-N 3.36Å; M335-W337 VanDerWaalsContact C-N 3.35Å; M335-W337 PolarHBondContact O-N 2.92Å
336	S	84.2	Confident	89.5	Confident	104 Å²	104	49.9 Å²	49.9	73%	0.727	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	37.2	179.1	-51.1	0	0	0	0	113.6	R333 E334	R333-S336 WeakPolarHBondContact O-CA 3.39Å; R333-S336 PolarHBondContact O-N 3.42Å; E334-S336 PolarHBondContact O-N 2.91Å
337	W	85.8	Confident	89.5	Confident	90 Å²	90	56 Å²	56	34%	0.341	28%	0.28	S	S	.	.			trans	-56.6	152.6	171.5	-81.5	46	0	0	0	111.5	L332 M335 D341 L342	L332-W337 HydrophobicContact CB-CD2 4.31Å; L332-W337 HydrophobicContact CB-CG 4.25Å; L332-W337 HydrophobicContact CD1-CE3 4.45Å; L332-W337 HydrophobicContact CD1-CZ3 4.45Å; L332-W337 HydrophobicContact CD2-CD2 4.08Å; L332-W337 HydrophobicContact CD2-CH2 4.15Å; L332-W337 HydrophobicContact CD2-CZ2 3.63Å; L332-W337 WeakPolarHBondContact O-CB 3.38Å; L332-W337 PolarHBondContact O-N 2.89Å; M335-W337 VanDerWaalsContact C-N 3.35Å; M335-W337 PolarHBondContact O-N 2.92Å; W337-D341 HydrophobicContact CE3-CB 3.72Å; W337-D341 HydrophobicContact CZ3-CB 4.24Å; W337-L342 HydrophobicContact CB-CD1 4.34Å; W337-L342 HydrophobicContact CB-CD2 4.18Å; W337-L342 HydrophobicContact CB-CG 3.95Å
338	S	87.2	Confident	89.6	Confident	52 Å²	52	57 Å²	57	36%	0.364	29%	0.288	S	S	.	.			trans	-65.1	150.4	179.9	87.8	0	0	0	0	110.7	A340 D341 L342	S338-A340 PolarHBondContact O-N 3.38Å; S338-A340 PolarHBondContact OG-N 3Å; S338-D341 WeakPolarHBondContact CB-OD2 3.34Å; S338-D341 PolarHBondContact O-N 3.37Å; S338-D341 VanDerWaalsContact O-N 3.17Å; S338-D341 PolarHBondContact OG-N 2.89Å; S338-D341 PolarHBondContact OG-OD2 3.16Å; S338-L342 PolarHBondContact O-N 3.2Å
339	K	84.3	Confident	89.6	Confident	75 Å²	75	55.6 Å²	55.6	33%	0.326	28%	0.284	S	S	.	.	H	α-helix	trans	-53.6	-39.9	174.5	-177.2	178.3	-174.8	169.5	0	111.3	Q343 D373 Q378	K339-Q343 HydrophobicContact CG-CG 4.16Å; K339-Q343 WeakPolarHBondContact O-CB 3.18Å; K339-Q343 WeakPolarHBondContact O-CG 3.06Å; K339-Q343 PolarHBondContact O-N 2.93Å; K339-D373 HydrophobicContact CD-CB 4.09Å; K339-Q378 VanDerWaalsContact NZ-CD 3.34Å
340	A	88	Confident	89.6	Confident	68 Å²	68	57 Å²	57	56%	0.562	29%	0.291	S	S	*	.	H	α-helix	trans	-64.7	-41.6	-178.7	0	0	0	0	0	112.4	S338 Q343 K344	S338-A340 PolarHBondContact O-N 3.38Å; S338-A340 PolarHBondContact OG-N 3Å; A340-Q343 PolarHBondContact O-N 3.34Å; A340-K344 PolarHBondContact O-N 2.92Å
341	D	90.5	Very high	89.8	Confident	76 Å²	76	61.6 Å²	61.6	41%	0.406	31%	0.31	S	S	.	.	H	α-helix	trans	-70.2	-45.2	179.6	-59.3	-48.2	0	0	0	111	W337 S338 Q343 K344 E345	W337-D341 HydrophobicContact CE3-CB 3.72Å; W337-D341 HydrophobicContact CZ3-CB 4.24Å; S338-D341 WeakPolarHBondContact CB-OD2 3.34Å; S338-D341 PolarHBondContact O-N 3.37Å; S338-D341 VanDerWaalsContact O-N 3.17Å; S338-D341 PolarHBondContact OG-N 2.89Å; S338-D341 PolarHBondContact OG-OD2 3.16Å; D341-Q343 VanDerWaalsContact C-N 3.29Å; D341-Q343 PolarHBondContact O-N 2.85Å; D341-K344 WeakPolarHBondContact O-CB 3.47Å; D341-K344 PolarHBondContact O-N 2.95Å; D341-K344 VanDerWaalsContact O-N 3.08Å; D341-E345 PolarHBondContact O-N 3.49Å; D341-E345 VanDerWaalsContact O-N 3.1Å
342	L	89.8	Confident	89.8	Confident	15 Å²	15	64.7 Å²	64.7	8%	0.079	33%	0.329	C	S	.	.	H	α-helix	trans	-59.7	-41.2	174.9	-71.7	170.8	0	0	0	111.5	L329 L332 W337 S338 K344 E345 W346	L329-L342 HydrophobicContact CD2-CD2 4.45Å; L332-L342 HydrophobicContact CB-CD2 3.86Å; W337-L342 HydrophobicContact CB-CD1 4.34Å; W337-L342 HydrophobicContact CB-CD2 4.18Å; W337-L342 HydrophobicContact CB-CG 3.95Å; S338-L342 PolarHBondContact O-N 3.2Å; L342-K344 VanDerWaalsContact C-N 3.29Å; L342-K344 PolarHBondContact O-N 3.02Å; L342-E345 PolarHBondContact O-N 3.01Å; L342-W346 PolarHBondContact O-N 3.48Å
343	Q	89.7	Confident	89.9	Confident	37 Å²	37	65.6 Å²	65.6	17%	0.173	33%	0.333	C	S	.	.	H	α-helix	trans	-63.1	-34.7	176	-74.4	-71.7	-23.1	0	0	112.4	K339 A340 D341 R347	K339-Q343 HydrophobicContact CG-CG 4.16Å; K339-Q343 WeakPolarHBondContact O-CB 3.18Å; K339-Q343 WeakPolarHBondContact O-CG 3.06Å; K339-Q343 PolarHBondContact O-N 2.93Å; A340-Q343 PolarHBondContact O-N 3.34Å; D341-Q343 VanDerWaalsContact C-N 3.29Å; D341-Q343 PolarHBondContact O-N 2.85Å; Q343-R347 WeakPolarHBondContact O-CB 3.39Å; Q343-R347 VanDerWaalsContact O-CG 3.28Å; Q343-R347 WeakPolarHBondContact O-CG 3.49Å; Q343-R347 PolarHBondContact O-N 2.69Å
344	K	92.2	Very high	90.1	Very high	142 Å²	142	62.9 Å²	62.9	62%	0.617	32%	0.324	S	S	*	.	H	α-helix	trans	-65.9	-43.9	174.7	-177.4	-176.8	175.2	-173.1	0	111.5	A340 D341 L342 R347 A348	A340-K344 PolarHBondContact O-N 2.92Å; D341-K344 WeakPolarHBondContact O-CB 3.47Å; D341-K344 PolarHBondContact O-N 2.95Å; D341-K344 VanDerWaalsContact O-N 3.08Å; L342-K344 VanDerWaalsContact C-N 3.29Å; L342-K344 PolarHBondContact O-N 3.02Å; K344-R347 PolarHBondContact O-N 2.87Å; K344-A348 PolarHBondContact O-N 3Å; K344-A348 VanDerWaalsContact O-N 3.12Å
345	E	92.8	Very high	90.4	Very high	47 Å²	47	60.9 Å²	60.9	22%	0.22	32%	0.315	C	S	.	.	H	α-helix	trans	-63.9	-43.7	176.3	-63.9	-64.2	145	0	0	111.3	R328 L329 L332 D341 L342 R347 A348 L349	R328-E345 IonicContact CZ-OE2 3.87Å; R328-E345 IonicContact NH1-OE2 3.99Å; R328-E345 PolarHBondContact NH1-OE2 2.83Å; R328-E345 IonicContact NH2-OE1 3.21Å; R328-E345 IonicContact NH2-OE2 3.49Å; L329-E345 HydrophobicContact CD2-CB 3.63Å; L332-E345 HydrophobicContact CD1-CG 4.29Å; D341-E345 PolarHBondContact O-N 3.49Å; D341-E345 VanDerWaalsContact O-N 3.1Å; L342-E345 PolarHBondContact O-N 3.01Å; E345-R347 PolarHBondContact O-N 3.2Å; E345-A348 WeakPolarHBondContact O-CB 3.38Å; E345-A348 PolarHBondContact O-N 3.27Å; E345-L349 PolarHBondContact O-N 2.98Å; E345-L349 VanDerWaalsContact O-N 3.08Å
346	W	93.8	Very high	90.5	Very high	3 Å²	3	64.1 Å²	64.1	1%	0.011	33%	0.326	C	S	.	.	H	α-helix	trans	-59.6	-47.1	175	-82.2	116.9	0	0	0	112.4	L326 L329 L342 A348 L349 E350 I359 E362 R363 H366	L326-W346 HydrophobicContact CD2-CH2 3.86Å; L326-W346 HydrophobicContact CD2-CZ3 4.05Å; L329-W346 HydrophobicContact CB-CZ2 4.47Å; L329-W346 HydrophobicContact CD1-CD2 3.62Å; L329-W346 HydrophobicContact CD1-CE3 3.62Å; L329-W346 HydrophobicContact CD1-CG 4.41Å; L329-W346 HydrophobicContact CD1-CH2 3.62Å; L329-W346 HydrophobicContact CD1-CZ2 3.61Å; L329-W346 HydrophobicContact CD1-CZ3 3.62Å; L342-W346 PolarHBondContact O-N 3.48Å; W346-A348 PolarHBondContact O-N 3.28Å; W346-L349 HydrophobicContact CE3-CD1 4.45Å; W346-L349 PolarHBondContact O-N 3Å; W346-E350 WeakPolarHBondContact O-CB 3.49Å; W346-E350 VanDerWaalsContact O-CG 3.29Å; W346-E350 WeakPolarHBondContact O-CG 3.27Å; W346-E350 PolarHBondContact O-N 3.06Å; W346-I359 HydrophobicContact CZ3-CG2 4.31Å; W346-E362 HydrophobicContact CH2-CB 4.24Å; W346-R363 VanDerWaalsContact CD2-CD 3.5Å; W346-R363 HydrophobicContact CE3-CB 4.14Å; W346-R363 HydrophobicContact CE3-CG 4.42Å; W346-R363 HydrophobicContact CH2-CB 4.16Å; W346-R363 HydrophobicContact CZ3-CB 3.87Å; W346-H366 HydrophobicContact CZ2-CB 3.65Å; W346-H366 AromaticContact CZ2-CG 3.74Å; W346-H366 AromaticContact NE1-CD2 3.4Å; W346-H366 PolarHBondContact NE1-CD2 3.24Å; W346-H366 AromaticContact NE1-CE1 3.8Å; W346-H366 AromaticContact NE1-CG 3.74Å; W346-H366 AromaticContact NE1-ND1 3.98Å; W346-H366 AromaticContact NE1-NE2 3.44Å; W346-H366 PolarHBondContact NE1-NE2 3.11Å
347	R	93.1	Very high	90.8	Very high	156 Å²	156	59.8 Å²	59.8	59%	0.589	30%	0.296	S	S	*	.	H	α-helix	trans	-59.4	-35.4	176.2	-74.1	175.6	-170.7	141.3	0.1	112.7	Q343 K344 E345 F351	Q343-R347 WeakPolarHBondContact O-CB 3.39Å; Q343-R347 VanDerWaalsContact O-CG 3.28Å; Q343-R347 WeakPolarHBondContact O-CG 3.49Å; Q343-R347 PolarHBondContact O-N 2.69Å; K344-R347 PolarHBondContact O-N 2.87Å; E345-R347 PolarHBondContact O-N 3.2Å; R347-F351 WeakPolarHBondContact O-CB 3.16Å; R347-F351 PolarHBondContact O-N 2.63Å
348	A	93.4	Very high	91	Very high	49 Å²	49	59.2 Å²	59.2	41%	0.405	30%	0.297	S	S	.	.	H	α-helix	trans	-65.8	-40.5	175.6	0	0	0	0	0	111.7	K344 E345 W346 T352	K344-A348 PolarHBondContact O-N 3Å; K344-A348 VanDerWaalsContact O-N 3.12Å; E345-A348 WeakPolarHBondContact O-CB 3.38Å; E345-A348 PolarHBondContact O-N 3.27Å; W346-A348 PolarHBondContact O-N 3.28Å; A348-T352 WeakPolarHBondContact O-CB 3.38Å; A348-T352 PolarHBondContact O-N 3.03Å; A348-T352 PolarHBondContact O-OG1 3.05Å
349	L	93.6	Very high	91.3	Very high	13 Å²	13	56.7 Å²	56.7	7%	0.068	28%	0.279	C	S	.	.	H	α-helix	trans	-71.5	-43.4	175.4	-63.7	-172.5	0	0	0	112.7	H325 L329 E345 W346 F351 T352 F353 I359	H325-L349 HydrophobicContact CB-CD1 3.92Å; H325-L349 HydrophobicContact CB-CD2 3.75Å; L329-L349 HydrophobicContact CD1-CD1 3.26Å; L329-L349 HydrophobicContact CD1-CG 4.45Å; L329-L349 HydrophobicContact CG-CD1 4.21Å; E345-L349 PolarHBondContact O-N 2.98Å; E345-L349 VanDerWaalsContact O-N 3.08Å; W346-L349 HydrophobicContact CE3-CD1 4.45Å; W346-L349 PolarHBondContact O-N 3Å; L349-F351 PolarHBondContact O-N 3.14Å; L349-T352 PolarHBondContact O-N 2.68Å; L349-T352 VanDerWaalsContact O-N 3.12Å; L349-F353 HydrophobicContact CD2-CD2 3.97Å; L349-F353 HydrophobicContact CD2-CE2 3.92Å; L349-F353 PolarHBondContact O-N 2.78Å; L349-I359 HydrophobicContact CB-CD1 4.19Å; L349-I359 HydrophobicContact CB-CG2 4.34Å; L349-I359 HydrophobicContact CD1-CD1 4.03Å
350	E	92.2	Very high	91.8	Very high	33 Å²	33	53.2 Å²	53.2	15%	0.154	26%	0.264	C	S	.	.	H	α-helix	trans	-56.1	-37.3	175.1	-72.5	168.8	-172.7	0	0	110.7	W346 V354 W360 R363	W346-E350 WeakPolarHBondContact O-CB 3.49Å; W346-E350 VanDerWaalsContact O-CG 3.29Å; W346-E350 WeakPolarHBondContact O-CG 3.27Å; W346-E350 PolarHBondContact O-N 3.06Å; E350-V354 WeakPolarHBondContact O-CA 3.48Å; E350-V354 VanDerWaalsContact O-CB 3.3Å; E350-V354 WeakPolarHBondContact O-CB 3.42Å; E350-V354 PolarHBondContact O-N 2.92Å; E350-W360 HydrophobicContact CB-CH2 4.2Å; E350-W360 HydrophobicContact CG-CH2 3.95Å; E350-W360 HydrophobicContact CG-CZ3 4.07Å; E350-R363 IonicContact OE1-CZ 3.81Å; E350-R363 IonicContact OE1-NE 3.65Å; E350-R363 PolarHBondContact OE1-NE 3.43Å; E350-R363 IonicContact OE1-NH2 3.79Å; E350-R363 PolarHBondContact OE1-NH2 3.13Å
351	F	91	Very high	92	Very high	169 Å²	169	52 Å²	52	74%	0.741	25%	0.248	S	C	*	.	H	α-helix	trans	-72.7	-43.7	174.3	179.2	-97.1	0	0	0	113.2	R347 L349	R347-F351 WeakPolarHBondContact O-CB 3.16Å; R347-F351 PolarHBondContact O-N 2.63Å; L349-F351 PolarHBondContact O-N 3.14Å
352	T	91.4	Very high	92	Very high	70 Å²	70	51.1 Å²	51.1	43%	0.429	24%	0.241	S	C	.	.	H	α-helix	trans	-78.8	-32.2	-171.8	-54.7	0	0	0	0	113.1	A348 L349 H401	A348-T352 WeakPolarHBondContact O-CB 3.38Å; A348-T352 PolarHBondContact O-N 3.03Å; A348-T352 PolarHBondContact O-OG1 3.05Å; L349-T352 PolarHBondContact O-N 2.68Å; L349-T352 VanDerWaalsContact O-N 3.12Å; T352-H401 PolarHBondContact O-NE2 3.19Å
353	F	92.6	Very high	92.1	Very high	19 Å²	19	50.9 Å²	50.9	8%	0.083	24%	0.239	C	C	.	.	S	Bend	trans	-127.6	34.5	-171.1	-61.9	-68.2	0	0	0	111.4	P319 V322 H325 L349 N355 R356 I359	P319-F353 WeakPolarHBondContact O-CZ 3.38Å; V322-F353 HydrophobicContact CG2-CB 4.44Å; V322-F353 HydrophobicContact CG2-CD1 3.85Å; V322-F353 HydrophobicContact CG2-CE1 4.18Å; V322-F353 HydrophobicContact CG2-CG 4.03Å; H325-F353 AromaticContact CD2-CE2 3.58Å; H325-F353 AromaticContact CD2-CZ 3.79Å; H325-F353 AromaticContact NE2-CE2 3.76Å; H325-F353 AromaticContact NE2-CZ 3.8Å; L349-F353 HydrophobicContact CD2-CD2 3.97Å; L349-F353 HydrophobicContact CD2-CE2 3.92Å; L349-F353 PolarHBondContact O-N 2.78Å; F353-N355 PolarHBondContact O-N 2.76Å; F353-R356 HydrophobicContact CB-CB 4.13Å; F353-R356 HydrophobicContact CB-CG 4.06Å; F353-R356 HydrophobicContact CD1-CG 4.32Å; F353-R356 WeakPolarHBondContact O-CB 3.31Å; F353-R356 PolarHBondContact O-N 3.36Å; F353-I359 HydrophobicContact CB-CD1 4.46Å; F353-I359 HydrophobicContact CB-CG1 3.76Å; F353-I359 HydrophobicContact CD2-CD1 4.45Å
354	V	91.5	Very high	92.2	Very high	11 Å²	11	49.2 Å²	49.2	7%	0.067	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-32	-176.3	66.6	0	0	0	0	114.3	E350 W360 K389 V393 L398 H401	E350-V354 WeakPolarHBondContact O-CA 3.48Å; E350-V354 VanDerWaalsContact O-CB 3.3Å; E350-V354 WeakPolarHBondContact O-CB 3.42Å; E350-V354 PolarHBondContact O-N 2.92Å; V354-W360 HydrophobicContact CG2-CZ2 4.35Å; V354-W360 PolarHBondContact O-NE1 3.18Å; V354-K389 HydrophobicContact CG2-CB 3.8Å; V354-K389 HydrophobicContact CG2-CD 4.39Å; V354-K389 HydrophobicContact CG2-CG 4.23Å; V354-V393 HydrophobicContact CG1-CG2 4.17Å; V354-V393 HydrophobicContact CG2-CG2 4.17Å; V354-L398 HydrophobicContact CB-CD2 4.45Å; V354-L398 HydrophobicContact CG1-CD2 3.36Å; V354-L398 HydrophobicContact CG2-CD2 4.33Å; V354-H401 HydrophobicContact CG1-CB 4.04Å
355	N	91.7	Very high	92.1	Very high	24 Å²	24	48.8 Å²	48.8	13%	0.128	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	3.2	179.8	69.3	-24.9	0	0	0	114.3	F353 V393 H401 R402 L404	F353-N355 PolarHBondContact O-N 2.76Å; N355-V393 HydrophobicContact CB-CG1 3.75Å; N355-V393 HydrophobicContact CB-CG2 4.27Å; N355-H401 HydrophobicContact CB-CB 3.93Å; N355-R402 PolarHBondContact ND2-O 3.42Å; N355-L404 VanDerWaalsContact O-CD1 3.26Å; N355-L404 WeakPolarHBondContact O-CD1 3.39Å
356	R	91.2	Very high	91.9	Very high	94 Å²	94	47.4 Å²	47.4	36%	0.355	22%	0.219	S	C	.	.			trans	-98.9	115.8	179	-66.4	-72.2	179.7	-177.3	0.6	109.7	V322 F353 E358 I359	V322-R356 HydrophobicContact CG2-CB 4.19Å; V322-R356 HydrophobicContact CG2-CG 3.93Å; F353-R356 HydrophobicContact CB-CB 4.13Å; F353-R356 HydrophobicContact CB-CG 4.06Å; F353-R356 HydrophobicContact CD1-CG 4.32Å; F353-R356 WeakPolarHBondContact O-CB 3.31Å; F353-R356 PolarHBondContact O-N 3.36Å; R356-E358 VanDerWaalsContact CB-OE2 3.32Å; R356-E358 WeakPolarHBondContact CB-OE2 3.29Å; R356-E358 PolarHBondContact O-N 2.94Å; R356-I359 HydrophobicContact CB-CG1 4.35Å; R356-I359 PolarHBondContact O-N 3.42Å
357	S	90.2	Very high	91.6	Very high	13 Å²	13	47.6 Å²	47.6	9%	0.091	22%	0.22	C	C	.	.	H	α-helix	trans	-62.5	-31.8	-178.8	55.9	0	0	0	0	112.1	I359 W360 I361 D406	S357-I359 VanDerWaalsContact C-N 3.29Å; S357-I359 PolarHBondContact O-N 3.45Å; S357-W360 PolarHBondContact O-N 2.86Å; S357-W360 VanDerWaalsContact O-N 3.09Å; S357-I361 WeakPolarHBondContact O-CG1 3.14Å; S357-I361 PolarHBondContact O-N 3.37Å; S357-D406 WeakPolarHBondContact CB-OD2 3.16Å; S357-D406 PolarHBondContact OG-OD2 3.17Å
358	E	91	Very high	91.4	Very high	77 Å²	77	41 Å²	41	36%	0.36	20%	0.197	S	C	.	.	H	α-helix	trans	-61.2	-36.4	-176	-52.4	92.4	148.3	0	0	112.3	V322 L326 R356 E362	V322-E358 HydrophobicContact CG1-CB 3.96Å; L326-E358 HydrophobicContact CD1-CB 4.4Å; R356-E358 VanDerWaalsContact CB-OE2 3.32Å; R356-E358 WeakPolarHBondContact CB-OE2 3.29Å; R356-E358 PolarHBondContact O-N 2.94Å; E358-E362 WeakPolarHBondContact O-CB 3.34Å; E358-E362 PolarHBondContact O-N 2.63Å
359	I	93.4	Very high	90.8	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.6	-45.3	176.5	-66.5	-65.6	0	0	0	110.5	V322 L326 W346 L349 F353 R356 S357 R363	V322-I359 HydrophobicContact CG1-CD1 3.47Å; V322-I359 VanDerWaalsContact CG1-CD1 3.47Å; V322-I359 HydrophobicContact CG1-CG1 3.8Å; V322-I359 HydrophobicContact CG2-CG1 4.47Å; L326-I359 HydrophobicContact CD2-CD1 3.94Å; L326-I359 HydrophobicContact CG-CD1 4.22Å; W346-I359 HydrophobicContact CZ3-CG2 4.31Å; L349-I359 HydrophobicContact CB-CD1 4.19Å; L349-I359 HydrophobicContact CB-CG2 4.34Å; L349-I359 HydrophobicContact CD1-CD1 4.03Å; F353-I359 HydrophobicContact CB-CD1 4.46Å; F353-I359 HydrophobicContact CB-CG1 3.76Å; F353-I359 HydrophobicContact CD2-CD1 4.45Å; R356-I359 HydrophobicContact CB-CG1 4.35Å; R356-I359 PolarHBondContact O-N 3.42Å; S357-I359 VanDerWaalsContact C-N 3.29Å; S357-I359 PolarHBondContact O-N 3.45Å; I359-R363 WeakPolarHBondContact O-CB 3.15Å; I359-R363 PolarHBondContact O-N 2.79Å
360	W	94	Very high	90.4	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.008	19%	0.194	C	C	.	.	H	α-helix	trans	-70.1	-39.6	-178.3	-64.3	108.2	0	0	0	112.2	E350 V354 S357 R363 L364 K389 H410	E350-W360 HydrophobicContact CB-CH2 4.2Å; E350-W360 HydrophobicContact CG-CH2 3.95Å; E350-W360 HydrophobicContact CG-CZ3 4.07Å; V354-W360 HydrophobicContact CG2-CZ2 4.35Å; V354-W360 PolarHBondContact O-NE1 3.18Å; S357-W360 PolarHBondContact O-N 2.86Å; S357-W360 VanDerWaalsContact O-N 3.09Å; W360-R363 WeakPolarHBondContact O-CB 3.39Å; W360-R363 PolarHBondContact O-N 3.19Å; W360-L364 WeakPolarHBondContact O-CB 3.48Å; W360-L364 WeakPolarHBondContact O-CG 3.47Å; W360-L364 PolarHBondContact O-N 3.07Å; W360-K389 HydrophobicContact CH2-CB 4.05Å; W360-K389 HydrophobicContact CH2-CG 3.74Å; W360-K389 HydrophobicContact CZ2-CB 3.55Å; W360-K389 HydrophobicContact CZ2-CG 3.71Å; W360-H410 AromaticContact CD1-NE2 3.85Å; W360-H410 AromaticContact CG-NE2 3.86Å
361	I	92.1	Very high	90.1	Very high	42 Å²	42	42.1 Å²	42.1	22%	0.215	20%	0.198	C	C	.	.	H	α-helix	trans	-62.1	-50.7	176.2	-65.5	167.7	0	0	0	109.9	S357 R363 L364 R365 W604	S357-I361 WeakPolarHBondContact O-CG1 3.14Å; S357-I361 PolarHBondContact O-N 3.37Å; I361-R363 VanDerWaalsContact C-N 3.3Å; I361-R363 PolarHBondContact O-N 2.76Å; I361-L364 PolarHBondContact O-N 2.85Å; I361-R365 WeakPolarHBondContact O-CB 3.33Å; I361-R365 PolarHBondContact O-N 3.37Å; I361-W604 HydrophobicContact CG1-CG 4.4Å; I361-W604 HydrophobicContact CG2-CB 4.02Å; I361-W604 HydrophobicContact CG2-CD2 4.45Å; I361-W604 HydrophobicContact CG2-CG 3.9Å
362	E	90.9	Very high	89.9	Confident	57 Å²	57	42.7 Å²	42.7	27%	0.266	20%	0.196	S	C	.	.	H	α-helix	trans	-70.8	-27.2	179.4	-75.1	-59.5	138.6	0	0	112.6	L326 W346 E358 R365 H366	L326-E362 HydrophobicContact CD1-CB 4.22Å; L326-E362 HydrophobicContact CD1-CG 3.87Å; L326-E362 HydrophobicContact CD2-CB 3.58Å; L326-E362 HydrophobicContact CD2-CG 4.13Å; L326-E362 HydrophobicContact CG-CB 4.46Å; W346-E362 HydrophobicContact CH2-CB 4.24Å; E358-E362 WeakPolarHBondContact O-CB 3.34Å; E358-E362 PolarHBondContact O-N 2.63Å; E362-R365 PolarHBondContact O-N 3.45Å; E362-R365 WeakPolarHBondContact OE1-CD 3.09Å; E362-R365 IonicContact OE1-NH1 2.88Å; E362-R365 PolarHBondContact OE1-NH1 2.91Å; E362-R365 WeakPolarHBondContact OE2-CD 3.3Å; E362-H366 WeakPolarHBondContact O-CB 3.39Å; E362-H366 PolarHBondContact O-N 2.66Å
363	R	92.7	Very high	89.6	Confident	11 Å²	11	41.4 Å²	41.4	4%	0.042	19%	0.186	C	C	.	.	H	α-helix	trans	-63.6	-48.5	170.5	178.3	59.6	159.9	154.2	11.6	111.8	W346 E350 I359 W360 I361 R365 H366 N367 I382	W346-R363 VanDerWaalsContact CD2-CD 3.5Å; W346-R363 HydrophobicContact CE3-CB 4.14Å; W346-R363 HydrophobicContact CE3-CG 4.42Å; W346-R363 HydrophobicContact CH2-CB 4.16Å; W346-R363 HydrophobicContact CZ3-CB 3.87Å; E350-R363 IonicContact OE1-CZ 3.81Å; E350-R363 IonicContact OE1-NE 3.65Å; E350-R363 PolarHBondContact OE1-NE 3.43Å; E350-R363 IonicContact OE1-NH2 3.79Å; E350-R363 PolarHBondContact OE1-NH2 3.13Å; I359-R363 WeakPolarHBondContact O-CB 3.15Å; I359-R363 PolarHBondContact O-N 2.79Å; W360-R363 WeakPolarHBondContact O-CB 3.39Å; W360-R363 PolarHBondContact O-N 3.19Å; I361-R363 VanDerWaalsContact C-N 3.3Å; I361-R363 PolarHBondContact O-N 2.76Å; R363-R365 VanDerWaalsContact C-N 3.32Å; R363-H366 PolarHBondContact O-N 2.82Å; R363-N367 PolarHBondContact O-N 2.96Å; R363-I382 HydrophobicContact CG-CG2 3.77Å
364	L	92	Very high	89.6	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-61.1	-43	175	-76.1	165.4	0	0	0	110.7	W360 I361 L368 Q379 I382 F383 W604	W360-L364 WeakPolarHBondContact O-CB 3.48Å; W360-L364 WeakPolarHBondContact O-CG 3.47Å; W360-L364 PolarHBondContact O-N 3.07Å; I361-L364 PolarHBondContact O-N 2.85Å; L364-L368 WeakPolarHBondContact O-CG 3.36Å; L364-Q379 PolarHBondContact O-NE2 3.34Å; L364-I382 HydrophobicContact CD2-CB 4.14Å; L364-I382 HydrophobicContact CD2-CG2 3.59Å; L364-I382 HydrophobicContact CG-CG2 3.98Å; L364-F383 HydrophobicContact CD1-CD1 4.24Å; L364-F383 HydrophobicContact CD1-CE1 4.04Å; L364-F383 HydrophobicContact CD1-CZ 4.45Å; L364-F383 HydrophobicContact CD2-CD1 4.01Å; L364-F383 HydrophobicContact CD2-CD2 3.82Å; L364-F383 HydrophobicContact CD2-CE1 4.12Å; L364-F383 HydrophobicContact CD2-CE2 3.89Å; L364-F383 HydrophobicContact CD2-CG 3.87Å; L364-F383 HydrophobicContact CD2-CZ 4.04Å; L364-W604 HydrophobicContact CD1-CH2 3.7Å; L364-W604 HydrophobicContact CD1-CZ2 4.12Å; L364-W604 HydrophobicContact CD1-CZ3 4.19Å
365	R	89.3	Confident	89.8	Confident	133 Å²	133	41.5 Å²	41.5	50%	0.502	19%	0.188	S	C	.	.	H	α-helix	trans	-62.4	-52.1	176.8	-164.8	-168.3	-176.1	153.3	1.9	110.9	I361 E362 R363 N367 L368 L369	I361-R365 WeakPolarHBondContact O-CB 3.33Å; I361-R365 PolarHBondContact O-N 3.37Å; E362-R365 PolarHBondContact O-N 3.45Å; E362-R365 WeakPolarHBondContact OE1-CD 3.09Å; E362-R365 IonicContact OE1-NH1 2.88Å; E362-R365 PolarHBondContact OE1-NH1 2.91Å; E362-R365 WeakPolarHBondContact OE2-CD 3.3Å; R363-R365 VanDerWaalsContact C-N 3.32Å; R365-N367 VanDerWaalsContact C-N 3.28Å; R365-N367 PolarHBondContact O-N 3.31Å; R365-L368 WeakPolarHBondContact O-CA 3.37Å; R365-L368 VanDerWaalsContact O-CB 3.3Å; R365-L368 WeakPolarHBondContact O-CB 3.4Å; R365-L368 PolarHBondContact O-N 3.3Å; R365-L369 HydrophobicContact CG-CD1 4.16Å; R365-L369 VanDerWaalsContact O-CG 3.32Å; R365-L369 WeakPolarHBondContact O-CG 3.5Å; R365-L369 PolarHBondContact O-N 3.36Å
366	H	88.5	Confident	90.1	Very high	18 Å²	18	40.6 Å²	40.6	8%	0.083	18%	0.183	C	C	.	.	H	α-helix	trans	-54.4	-41	-177.3	177.4	96.1	0	0	0	113.2	W346 E362 R363 L368 L369	W346-H366 HydrophobicContact CZ2-CB 3.65Å; W346-H366 AromaticContact CZ2-CG 3.74Å; W346-H366 AromaticContact NE1-CD2 3.4Å; W346-H366 PolarHBondContact NE1-CD2 3.24Å; W346-H366 AromaticContact NE1-CE1 3.8Å; W346-H366 AromaticContact NE1-CG 3.74Å; W346-H366 AromaticContact NE1-ND1 3.98Å; W346-H366 AromaticContact NE1-NE2 3.44Å; W346-H366 PolarHBondContact NE1-NE2 3.11Å; E362-H366 WeakPolarHBondContact O-CB 3.39Å; E362-H366 PolarHBondContact O-N 2.66Å; R363-H366 PolarHBondContact O-N 2.82Å; H366-L368 VanDerWaalsContact C-N 3.3Å; H366-L368 PolarHBondContact O-N 3.23Å; H366-L369 WeakPolarHBondContact O-CB 3.34Å; H366-L369 PolarHBondContact O-N 3.44Å; H366-L369 VanDerWaalsContact O-N 3.1Å
367	N	88.4	Confident	90.3	Very high	7 Å²	7	39.4 Å²	39.4	4%	0.037	19%	0.194	C	C	.	.	H	α-helix	trans	-67	-32	178.7	-169.5	62.5	0	0	0	112.6	R363 R365 L369 A370 Q379 I382	R363-N367 PolarHBondContact O-N 2.96Å; R365-N367 VanDerWaalsContact C-N 3.28Å; R365-N367 PolarHBondContact O-N 3.31Å; N367-L369 PolarHBondContact O-N 2.89Å; N367-A370 PolarHBondContact O-N 3.34Å; N367-Q379 PolarHBondContact ND2-OE1 3.45Å; N367-I382 HydrophobicContact CB-CD1 3.59Å
368	L	87.9	Confident	90.5	Very high	17 Å²	17	41.7 Å²	41.7	9%	0.089	20%	0.203	C	C	.	.	H	α-helix	trans	-68.4	-24.5	172.9	-60.9	173.6	0	0	0	112.6	L364 R365 H366 A370 F374 Q379 F421 W1048	L364-L368 WeakPolarHBondContact O-CG 3.36Å; R365-L368 WeakPolarHBondContact O-CA 3.37Å; R365-L368 VanDerWaalsContact O-CB 3.3Å; R365-L368 WeakPolarHBondContact O-CB 3.4Å; R365-L368 PolarHBondContact O-N 3.3Å; H366-L368 VanDerWaalsContact C-N 3.3Å; H366-L368 PolarHBondContact O-N 3.23Å; L368-A370 VanDerWaalsContact C-N 3.34Å; L368-F374 HydrophobicContact CD2-CD2 4.22Å; L368-F374 HydrophobicContact CD2-CE2 3.63Å; L368-F374 HydrophobicContact CD2-CZ 4.4Å; L368-Q379 HydrophobicContact CD2-CG 4.29Å; L368-F421 HydrophobicContact CD2-CE2 3.95Å; L368-W1048 HydrophobicContact CB-CE3 3.85Å; L368-W1048 HydrophobicContact CB-CH2 4.33Å; L368-W1048 HydrophobicContact CB-CZ3 3.6Å; L368-W1048 HydrophobicContact CD1-CE3 4.5Å; L368-W1048 HydrophobicContact CD2-CB 4.31Å; L368-W1048 HydrophobicContact CD2-CD2 3.89Å; L368-W1048 HydrophobicContact CD2-CE3 3.57Å; L368-W1048 HydrophobicContact CD2-CG 4.21Å; L368-W1048 HydrophobicContact CD2-CZ3 4.22Å; L368-W1048 HydrophobicContact CG-CE3 4.16Å; L368-W1048 HydrophobicContact CG-CZ3 4.31Å
369	L	81.8	Confident	90.7	Very high	38 Å²	38	38 Å²	38	20%	0.199	19%	0.186	C	C	.	.	H	α-helix	trans	-80.4	-14.3	-178.8	-56	172.8	0	0	0	112.9	R365 H366 N367 F371 H1012	R365-L369 HydrophobicContact CG-CD1 4.16Å; R365-L369 VanDerWaalsContact O-CG 3.32Å; R365-L369 WeakPolarHBondContact O-CG 3.5Å; R365-L369 PolarHBondContact O-N 3.36Å; H366-L369 WeakPolarHBondContact O-CB 3.34Å; H366-L369 PolarHBondContact O-N 3.44Å; H366-L369 VanDerWaalsContact O-N 3.1Å; N367-L369 PolarHBondContact O-N 2.89Å; L369-F371 PolarHBondContact O-N 3.48Å; L369-H1012 WeakPolarHBondContact CD2-CD2 3.43Å; L369-H1012 WeakPolarHBondContact CD2-CE1 3.47Å; L369-H1012 WeakPolarHBondContact CD2-NE2 3.37Å
370	A	83.6	Confident	90.9	Very high	27 Å²	27	38.6 Å²	38.6	22%	0.223	19%	0.189	C	C	.	.			trans	-99.7	69.8	-174.2	0	0	0	0	0	112.3	N367 L368 R372 D373 F374	N367-A370 PolarHBondContact O-N 3.34Å; L368-A370 VanDerWaalsContact C-N 3.34Å; A370-R372 VanDerWaalsContact C-N 3.26Å; A370-R372 PolarHBondContact O-N 3.46Å; A370-D373 PolarHBondContact O-N 2.94Å; A370-F374 WeakPolarHBondContact O-CB 3.3Å; A370-F374 PolarHBondContact O-N 3.43Å
371	F	86.1	Confident	91	Very high	54 Å²	54	42.1 Å²	42.1	24%	0.237	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-43.7	-46.1	-175	177.8	-96.9	0	0	0	115	L369 D373 L1043 Q1044 P1047 L1071 K1075	L369-F371 PolarHBondContact O-N 3.48Å; F371-D373 VanDerWaalsContact C-N 3.32Å; F371-D373 PolarHBondContact O-N 3.18Å; F371-L1043 WeakPolarHBondContact CD2-O 3.44Å; F371-L1043 VanDerWaalsContact CE2-O 3.29Å; F371-L1043 WeakPolarHBondContact CE2-O 3.49Å; F371-Q1044 HydrophobicContact CD1-CG 4.36Å; F371-Q1044 VanDerWaalsContact CD2-CA 3.45Å; F371-Q1044 HydrophobicContact CD2-CB 4.42Å; F371-Q1044 HydrophobicContact CD2-CG 4.39Å; F371-Q1044 HydrophobicContact CG-CG 4.3Å; F371-P1047 HydrophobicContact CD2-CB 3.68Å; F371-P1047 HydrophobicContact CD2-CG 4.07Å; F371-P1047 HydrophobicContact CE2-CB 3.99Å; F371-L1071 HydrophobicContact CZ-CD1 4.08Å; F371-L1071 HydrophobicContact CZ-CD2 4.02Å; F371-K1075 VanDerWaalsContact O-CE 3.31Å; F371-K1075 WeakPolarHBondContact O-CE 3.28Å; F371-K1075 PolarHBondContact O-NZ 3.01Å
372	R	87.1	Confident	91.1	Very high	182 Å²	182	40.9 Å²	40.9	69%	0.687	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-42.1	-177.9	-174.4	-175	67.1	-154.4	-9.3	112	A370 K1075	A370-R372 VanDerWaalsContact C-N 3.26Å; A370-R372 PolarHBondContact O-N 3.46Å; R372-K1075 PolarHBondContact O-NZ 3.14Å
373	D	85.4	Confident	91.4	Very high	42 Å²	42	38.2 Å²	38.2	23%	0.225	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-13.5	-167.3	-58.4	-27.8	0	0	0	112.5	K339 A370 F371 Q378	K339-D373 HydrophobicContact CD-CB 4.09Å; A370-D373 PolarHBondContact O-N 2.94Å; F371-D373 VanDerWaalsContact C-N 3.32Å; F371-D373 PolarHBondContact O-N 3.18Å; D373-Q378 PolarHBondContact O-NE2 3.16Å; D373-Q378 PolarHBondContact O-OE1 3.43Å; D373-Q378 VanDerWaalsContact O-OE1 3.06Å
374	F	93.3	Very high	91.6	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.202	C	C	.	.			trans	-62.2	135	178.8	170.4	-95.8	0	0	0	111.8	L368 A370 V376 Q379 F421 P1047 W1048 K1075	L368-F374 HydrophobicContact CD2-CD2 4.22Å; L368-F374 HydrophobicContact CD2-CE2 3.63Å; L368-F374 HydrophobicContact CD2-CZ 4.4Å; A370-F374 WeakPolarHBondContact O-CB 3.3Å; A370-F374 PolarHBondContact O-N 3.43Å; F374-V376 HydrophobicContact CZ-CG2 4.35Å; F374-Q379 HydrophobicContact CE2-CB 4.15Å; F374-F421 HydrophobicContact CE2-CE2 4.37Å; F374-F421 HydrophobicContact CE2-CZ 4.16Å; F374-F421 HydrophobicContact CZ-CE2 4.26Å; F374-F421 AromaticContact CZ-CZ 3.98Å; F374-F421 HydrophobicContact CZ-CZ 3.98Å; F374-P1047 HydrophobicContact CB-CG 4.44Å; F374-P1047 HydrophobicContact CD1-CB 3.63Å; F374-P1047 HydrophobicContact CD1-CG 3.74Å; F374-P1047 HydrophobicContact CE1-CB 3.97Å; F374-P1047 HydrophobicContact CE1-CG 4.2Å; F374-P1047 HydrophobicContact CG-CB 4.4Å; F374-P1047 HydrophobicContact CG-CG 4.04Å; F374-W1048 HydrophobicContact CE1-CB 4.11Å; F374-W1048 HydrophobicContact CE2-CB 4.29Å; F374-W1048 HydrophobicContact CZ-CB 3.53Å; F374-K1075 HydrophobicContact CD1-CD 4.28Å; F374-K1075 HydrophobicContact CE1-CB 4.43Å; F374-K1075 WeakPolarHBondContact O-CD 3.39Å
375	T	95.9	Very high	91.8	Very high	33 Å²	33	40.9 Å²	40.9	20%	0.202	21%	0.213	C	C	.	.			trans	-143.9	154.6	161.6	68.4	0	0	0	0	109.4	A377 Q378 Q379 K1075	T375-A377 VanDerWaalsContact C-N 3.31Å; T375-A377 PolarHBondContact O-N 3.25Å; T375-Q378 PolarHBondContact O-N 3.38Å; T375-Q378 VanDerWaalsContact OG1-CG 3.27Å; T375-Q378 WeakPolarHBondContact OG1-CG 3.34Å; T375-Q378 PolarHBondContact OG1-N 3.45Å; T375-Q378 PolarHBondContact OG1-NE2 2.95Å; T375-Q379 PolarHBondContact O-N 3.05Å; T375-Q379 VanDerWaalsContact O-N 3.1Å; T375-K1075 CarbonylContact C-O 3.59Å; T375-K1075 WeakPolarHBondContact CA-O 3.4Å
376	V	96.7	Very high	92	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.024	19%	0.189	C	C	.	.	H	α-helix	trans	-56.2	-45.3	175.8	169	0	0	0	0	111	F374 Q378 Q379 L380 F421 K1075 G1076 L1077	F374-V376 HydrophobicContact CZ-CG2 4.35Å; V376-Q378 PolarHBondContact O-N 3.21Å; V376-Q379 PolarHBondContact O-N 3.35Å; V376-Q379 VanDerWaalsContact O-N 3.16Å; V376-L380 HydrophobicContact CG1-CD1 3.96Å; V376-L380 HydrophobicContact CG1-CG 4.36Å; V376-L380 WeakPolarHBondContact O-CG 3.08Å; V376-L380 PolarHBondContact O-N 2.61Å; V376-F421 HydrophobicContact CB-CE1 4.4Å; V376-F421 HydrophobicContact CB-CZ 4.49Å; V376-F421 HydrophobicContact CG1-CE1 3.92Å; V376-F421 HydrophobicContact CG1-CZ 4.46Å; V376-F421 HydrophobicContact CG2-CE1 4.46Å; V376-F421 HydrophobicContact CG2-CZ 4.21Å; V376-K1075 WeakPolarHBondContact CG2-O 3.44Å; V376-K1075 PolarHBondContact N-O 3.44Å; V376-G1076 WeakPolarHBondContact CB-O 3.14Å; V376-G1076 WeakPolarHBondContact CG2-O 3.41Å; V376-L1077 HydrophobicContact CG2-CD2 4.03Å
377	A	96.1	Very high	92.4	Very high	70 Å²	70	33.7 Å²	33.7	58%	0.579	19%	0.185	S	C	*	.	H	α-helix	trans	-59.5	-41.7	178.3	0	0	0	0	0	113.1	T375 L380 S381	T375-A377 VanDerWaalsContact C-N 3.31Å; T375-A377 PolarHBondContact O-N 3.25Å; A377-L380 PolarHBondContact O-N 2.82Å; A377-S381 PolarHBondContact O-N 2.97Å
378	Q	94.7	Very high	92.7	Very high	60 Å²	60	37.3 Å²	37.3	28%	0.28	20%	0.202	S	C	.	.	H	α-helix	trans	-65	-41.4	176.2	-73.9	176	45.7	0	0	111.6	K339 D373 T375 V376 S381 I382	K339-Q378 VanDerWaalsContact NZ-CD 3.34Å; D373-Q378 PolarHBondContact O-NE2 3.16Å; D373-Q378 PolarHBondContact O-OE1 3.43Å; D373-Q378 VanDerWaalsContact O-OE1 3.06Å; T375-Q378 PolarHBondContact O-N 3.38Å; T375-Q378 VanDerWaalsContact OG1-CG 3.27Å; T375-Q378 WeakPolarHBondContact OG1-CG 3.34Å; T375-Q378 PolarHBondContact OG1-N 3.45Å; T375-Q378 PolarHBondContact OG1-NE2 2.95Å; V376-Q378 PolarHBondContact O-N 3.21Å; Q378-S381 PolarHBondContact O-N 2.92Å; Q378-I382 WeakPolarHBondContact O-CG1 3.43Å; Q378-I382 PolarHBondContact O-N 3.42Å; Q378-I382 VanDerWaalsContact O-N 3.13Å
379	Q	95.8	Very high	93	Very high	1 Å²	1	40 Å²	40	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-63.5	-43.6	177	-170	72.1	5.8	0	0	111.5	L364 N367 L368 F374 T375 V376 S381 I382 F383 F421	L364-Q379 PolarHBondContact O-NE2 3.34Å; N367-Q379 PolarHBondContact ND2-OE1 3.45Å; L368-Q379 HydrophobicContact CD2-CG 4.29Å; F374-Q379 HydrophobicContact CE2-CB 4.15Å; T375-Q379 PolarHBondContact O-N 3.05Å; T375-Q379 VanDerWaalsContact O-N 3.1Å; V376-Q379 PolarHBondContact O-N 3.35Å; V376-Q379 VanDerWaalsContact O-N 3.16Å; Q379-S381 VanDerWaalsContact C-N 3.33Å; Q379-S381 PolarHBondContact O-N 3.3Å; Q379-I382 PolarHBondContact O-N 2.85Å; Q379-F383 HydrophobicContact CG-CD2 4.03Å; Q379-F383 HydrophobicContact CG-CE2 3.86Å; Q379-F383 VanDerWaalsContact O-CD2 3.3Å; Q379-F383 WeakPolarHBondContact O-CD2 3.36Å; Q379-F383 PolarHBondContact O-N 3.5Å; Q379-F421 HydrophobicContact CB-CE1 3.68Å; Q379-F421 HydrophobicContact CB-CE2 4.17Å; Q379-F421 HydrophobicContact CB-CZ 3.47Å; Q379-F421 VanDerWaalsContact CB-CZ 3.47Å; Q379-F421 HydrophobicContact CG-CD1 4.19Å; Q379-F421 HydrophobicContact CG-CD2 4.13Å; Q379-F421 HydrophobicContact CG-CE1 3.73Å; Q379-F421 HydrophobicContact CG-CE2 3.68Å; Q379-F421 HydrophobicContact CG-CG 4.37Å; Q379-F421 HydrophobicContact CG-CZ 3.47Å; Q379-F421 VanDerWaalsContact CG-CZ 3.47Å
380	L	97	Very high	93.6	Very high	11 Å²	11	38.3 Å²	38.3	6%	0.058	20%	0.204	C	C	.	.	H	α-helix	trans	-61.3	-41.4	176.9	-68.7	174.3	0	0	0	111.6	V376 A377 I382 F383 D384 K418 F421 L422	V376-L380 HydrophobicContact CG1-CD1 3.96Å; V376-L380 HydrophobicContact CG1-CG 4.36Å; V376-L380 WeakPolarHBondContact O-CG 3.08Å; V376-L380 PolarHBondContact O-N 2.61Å; A377-L380 PolarHBondContact O-N 2.82Å; L380-I382 VanDerWaalsContact C-N 3.3Å; L380-I382 PolarHBondContact O-N 3.4Å; L380-F383 WeakPolarHBondContact O-CA 3.45Å; L380-F383 VanDerWaalsContact O-CB 3.29Å; L380-F383 WeakPolarHBondContact O-CB 2.82Å; L380-F383 PolarHBondContact O-N 3.41Å; L380-F383 VanDerWaalsContact O-N 3.11Å; L380-D384 PolarHBondContact O-N 2.72Å; L380-K418 HydrophobicContact CD2-CG 4.09Å; L380-F421 HydrophobicContact CD2-CD1 3.89Å; L380-F421 HydrophobicContact CD2-CE1 4.22Å; L380-F421 HydrophobicContact CG-CD1 4.39Å; L380-F421 HydrophobicContact CG-CE1 4.22Å; L380-L422 HydrophobicContact CD1-CD2 3.99Å; L380-L422 HydrophobicContact CD2-CD2 3.82Å; L380-L422 HydrophobicContact CD2-CG 4.12Å
381	S	95.7	Very high	94	Very high	76 Å²	76	38.7 Å²	38.7	53%	0.531	20%	0.201	S	C	.	.	H	α-helix	trans	-60.8	-37.4	174.4	176	0	0	0	0	113	A377 Q378 Q379 D384 S385	A377-S381 PolarHBondContact O-N 2.97Å; Q378-S381 PolarHBondContact O-N 2.92Å; Q379-S381 VanDerWaalsContact C-N 3.33Å; Q379-S381 PolarHBondContact O-N 3.3Å; S381-D384 PolarHBondContact O-N 2.65Å; S381-S385 PolarHBondContact O-N 2.96Å
382	I	95.2	Very high	94.3	Very high	16 Å²	16	37.7 Å²	37.7	8%	0.082	20%	0.199	C	C	.	.	H	α-helix	trans	-67.7	-40.1	174.7	-63.7	167	0	0	0	110.7	R363 L364 N367 Q378 Q379 L380 S385 S386	R363-I382 HydrophobicContact CG-CG2 3.77Å; L364-I382 HydrophobicContact CD2-CB 4.14Å; L364-I382 HydrophobicContact CD2-CG2 3.59Å; L364-I382 HydrophobicContact CG-CG2 3.98Å; N367-I382 HydrophobicContact CB-CD1 3.59Å; Q378-I382 WeakPolarHBondContact O-CG1 3.43Å; Q378-I382 PolarHBondContact O-N 3.42Å; Q378-I382 VanDerWaalsContact O-N 3.13Å; Q379-I382 PolarHBondContact O-N 2.85Å; L380-I382 VanDerWaalsContact C-N 3.3Å; L380-I382 PolarHBondContact O-N 3.4Å; I382-S385 PolarHBondContact O-N 3.4Å; I382-S386 WeakPolarHBondContact O-CB 3.48Å; I382-S386 PolarHBondContact O-N 3.18Å
383	F	96.7	Very high	94.5	Very high	1 Å²	1	29 Å²	29	0%	0.004	17%	0.166	C	C	.	.	H	α-helix	trans	-57.8	-48.9	172.1	-87.9	-73.1	0	0	0	111.6	L364 Q379 L380 S385 S386 L387 G417 K418 F421 W604	L364-F383 HydrophobicContact CD1-CD1 4.24Å; L364-F383 HydrophobicContact CD1-CE1 4.04Å; L364-F383 HydrophobicContact CD1-CZ 4.45Å; L364-F383 HydrophobicContact CD2-CD1 4.01Å; L364-F383 HydrophobicContact CD2-CD2 3.82Å; L364-F383 HydrophobicContact CD2-CE1 4.12Å; L364-F383 HydrophobicContact CD2-CE2 3.89Å; L364-F383 HydrophobicContact CD2-CG 3.87Å; L364-F383 HydrophobicContact CD2-CZ 4.04Å; Q379-F383 HydrophobicContact CG-CD2 4.03Å; Q379-F383 HydrophobicContact CG-CE2 3.86Å; Q379-F383 VanDerWaalsContact O-CD2 3.3Å; Q379-F383 WeakPolarHBondContact O-CD2 3.36Å; Q379-F383 PolarHBondContact O-N 3.5Å; L380-F383 WeakPolarHBondContact O-CA 3.45Å; L380-F383 VanDerWaalsContact O-CB 3.29Å; L380-F383 WeakPolarHBondContact O-CB 2.82Å; L380-F383 PolarHBondContact O-N 3.41Å; L380-F383 VanDerWaalsContact O-N 3.11Å; F383-S385 VanDerWaalsContact C-N 3.35Å; F383-S385 PolarHBondContact O-N 2.6Å; F383-S386 WeakPolarHBondContact O-CB 3.09Å; F383-S386 PolarHBondContact O-N 3.17Å; F383-S386 VanDerWaalsContact O-N 3.15Å; F383-L387 WeakPolarHBondContact O-CB 3.4Å; F383-L387 VanDerWaalsContact O-CG 3.28Å; F383-L387 WeakPolarHBondContact O-CG 3.48Å; F383-L387 PolarHBondContact O-N 2.98Å; F383-G417 VanDerWaalsContact CE1-C 3.48Å; F383-G417 VanDerWaalsContact CZ-C 3.48Å; F383-G417 WeakPolarHBondContact CZ-O 3.39Å; F383-K418 HydrophobicContact CB-CB 4.43Å; F383-K418 HydrophobicContact CB-CD 4.22Å; F383-K418 HydrophobicContact CB-CG 4.26Å; F383-K418 HydrophobicContact CD1-CB 3.82Å; F383-K418 HydrophobicContact CD1-CG 4.48Å; F383-K418 HydrophobicContact CE1-CB 4.05Å; F383-K418 VanDerWaalsContact CE1-N 3.3Å; F383-K418 HydrophobicContact CG-CB 4.05Å; F383-K418 HydrophobicContact CG-CG 4.22Å; F383-F421 HydrophobicContact CE2-CB 3.82Å; F383-F421 HydrophobicContact CE2-CD1 4.16Å; F383-F421 AromaticContact CE2-CG 3.91Å; F383-F421 HydrophobicContact CE2-CG 3.91Å; F383-F421 HydrophobicContact CZ-CB 4.13Å; F383-W604 AromaticContact CE1-CH2 3.64Å; F383-W604 HydrophobicContact CE1-CH2 3.64Å; F383-W604 HydrophobicContact CE1-CZ3 4.41Å; F383-W604 AromaticContact CZ-CH2 3.89Å; F383-W604 HydrophobicContact CZ-CH2 3.89Å; F383-W604 HydrophobicContact CZ-CZ3 4.22Å
384	D	96.9	Very high	94.7	Very high	36 Å²	36	29 Å²	29	19%	0.193	17%	0.166	C	C	.	.	H	α-helix	trans	-61.6	-43.9	-178.8	-64.5	-27.8	0	0	0	111.4	L380 S381 S386 L387 E388 K418 P566	L380-D384 PolarHBondContact O-N 2.72Å; S381-D384 PolarHBondContact O-N 2.65Å; D384-S386 PolarHBondContact O-N 3.27Å; D384-L387 PolarHBondContact O-N 3.32Å; D384-E388 WeakPolarHBondContact O-CB 3.49Å; D384-E388 PolarHBondContact O-N 3.31Å; D384-K418 IonicContact OD1-NZ 3.2Å; D384-K418 PolarHBondContact OD1-NZ 3.18Å; D384-K418 IonicContact OD2-NZ 3.54Å; D384-P566 HydrophobicContact CB-CB 4.12Å
385	S	95.1	Very high	94.5	Very high	33 Å²	33	31.7 Å²	31.7	23%	0.231	18%	0.184	C	C	.	.	H	α-helix	trans	-61.5	-43.9	173.5	-178.1	0	0	0	0	112	S381 I382 F383 L387 K389	S381-S385 PolarHBondContact O-N 2.96Å; I382-S385 PolarHBondContact O-N 3.4Å; F383-S385 VanDerWaalsContact C-N 3.35Å; F383-S385 PolarHBondContact O-N 2.6Å; S385-L387 VanDerWaalsContact C-N 3.34Å; S385-L387 PolarHBondContact O-N 3.32Å; S385-K389 WeakPolarHBondContact O-CB 3.36Å; S385-K389 VanDerWaalsContact O-CG 3.28Å; S385-K389 WeakPolarHBondContact O-CG 3.49Å; S385-K389 PolarHBondContact O-N 2.95Å
386	S	95.2	Very high	94	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.1	-43.7	178.4	-179.2	0	0	0	0	111.3	I382 F383 D384 S390 H410 C414	I382-S386 WeakPolarHBondContact O-CB 3.48Å; I382-S386 PolarHBondContact O-N 3.18Å; F383-S386 WeakPolarHBondContact O-CB 3.09Å; F383-S386 PolarHBondContact O-N 3.17Å; F383-S386 VanDerWaalsContact O-N 3.15Å; D384-S386 PolarHBondContact O-N 3.27Å; S386-S390 WeakPolarHBondContact O-CB 3.38Å; S386-S390 PolarHBondContact O-N 3.22Å; S386-S390 PolarHBondContact O-OG 2.9Å; S386-H410 PolarHBondContact OG-NE2 3.36Å; S386-C414 PolarHBondContact OG-SG 2.94Å
387	L	96.5	Very high	93.5	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.8	-48.6	178.6	-71.1	169.5	0	0	0	111.5	F383 D384 S385 S390 F391 L411 C414 L415 K418 Y569	F383-L387 WeakPolarHBondContact O-CB 3.4Å; F383-L387 VanDerWaalsContact O-CG 3.28Å; F383-L387 WeakPolarHBondContact O-CG 3.48Å; F383-L387 PolarHBondContact O-N 2.98Å; D384-L387 PolarHBondContact O-N 3.32Å; S385-L387 VanDerWaalsContact C-N 3.34Å; S385-L387 PolarHBondContact O-N 3.32Å; L387-S390 PolarHBondContact O-N 3.06Å; L387-F391 VanDerWaalsContact O-CB 3.27Å; L387-F391 WeakPolarHBondContact O-CB 3Å; L387-F391 PolarHBondContact O-N 3.07Å; L387-L411 HydrophobicContact CD2-CD1 3.82Å; L387-C414 HydrophobicContact CD2-CB 3.49Å; L387-C414 VanDerWaalsContact CD2-CB 3.49Å; L387-C414 HydrophobicContact CG-CB 4.12Å; L387-L415 HydrophobicContact CD1-CD2 3.94Å; L387-L415 HydrophobicContact CD2-CD2 3.62Å; L387-L415 HydrophobicContact CD2-CG 3.7Å; L387-L415 HydrophobicContact CG-CD2 4.44Å; L387-K418 HydrophobicContact CD1-CD 4.24Å; L387-Y569 HydrophobicContact CB-CD2 3.74Å; L387-Y569 HydrophobicContact CB-CE2 3.41Å; L387-Y569 VanDerWaalsContact CB-CE2 3.41Å; L387-Y569 HydrophobicContact CD1-CD2 4.33Å; L387-Y569 HydrophobicContact CD1-CE2 4.36Å; L387-Y569 HydrophobicContact CD2-CD2 4.5Å; L387-Y569 HydrophobicContact CG-CD2 4.42Å; L387-Y569 HydrophobicContact CG-CE2 4.42Å
388	E	95	Very high	93	Very high	82 Å²	82	37.2 Å²	37.2	38%	0.383	21%	0.209	S	C	.	.	H	α-helix	trans	-56	-54.4	176.9	-171.8	-154.6	134.3	0	0	110.9	D384 S390 F391 V392 Y569	D384-E388 WeakPolarHBondContact O-CB 3.49Å; D384-E388 PolarHBondContact O-N 3.31Å; E388-S390 PolarHBondContact O-N 3.21Å; E388-F391 PolarHBondContact O-N 3.44Å; E388-V392 VanDerWaalsContact O-CG2 3.23Å; E388-V392 WeakPolarHBondContact O-CG2 3.32Å; E388-V392 PolarHBondContact O-N 2.91Å; E388-Y569 WeakPolarHBondContact CA-OH 3.22Å; E388-Y569 WeakPolarHBondContact CB-OH 3.34Å; E388-Y569 PolarHBondContact N-OH 3.4Å
389	K	93.9	Very high	92.3	Very high	74 Å²	74	40.8 Å²	40.8	32%	0.322	24%	0.235	S	C	.	.	H	α-helix	trans	-65.6	-40.7	-177.3	-63.2	-52.1	174.3	-146	0	112.4	V354 W360 S385 F391 V392 V393	V354-K389 HydrophobicContact CG2-CB 3.8Å; V354-K389 HydrophobicContact CG2-CD 4.39Å; V354-K389 HydrophobicContact CG2-CG 4.23Å; W360-K389 HydrophobicContact CH2-CB 4.05Å; W360-K389 HydrophobicContact CH2-CG 3.74Å; W360-K389 HydrophobicContact CZ2-CB 3.55Å; W360-K389 HydrophobicContact CZ2-CG 3.71Å; S385-K389 WeakPolarHBondContact O-CB 3.36Å; S385-K389 VanDerWaalsContact O-CG 3.28Å; S385-K389 WeakPolarHBondContact O-CG 3.49Å; S385-K389 PolarHBondContact O-N 2.95Å; K389-F391 VanDerWaalsContact C-N 3.31Å; K389-F391 PolarHBondContact O-N 3.22Å; K389-V392 PolarHBondContact O-N 3.17Å; K389-V393 VanDerWaalsContact O-CG2 3.25Å; K389-V393 WeakPolarHBondContact O-CG2 3.37Å; K389-V393 PolarHBondContact O-N 3.47Å
390	S	92.9	Very high	91.8	Very high	3 Å²	3	45.9 Å²	45.9	2%	0.021	27%	0.267	C	S	.	.	H	α-helix	trans	-62.5	-40.3	176.2	-58.7	0	0	0	0	111.4	S386 L387 E388 V393 L394 H410	S386-S390 WeakPolarHBondContact O-CB 3.38Å; S386-S390 PolarHBondContact O-N 3.22Å; S386-S390 PolarHBondContact O-OG 2.9Å; L387-S390 PolarHBondContact O-N 3.06Å; E388-S390 PolarHBondContact O-N 3.21Å; S390-V393 PolarHBondContact O-N 3.43Å; S390-L394 VanDerWaalsContact O-CB 3.29Å; S390-L394 WeakPolarHBondContact O-CB 2.89Å; S390-L394 PolarHBondContact O-N 3.49Å; S390-H410 PolarHBondContact OG-CD2 3.39Å; S390-H410 VanDerWaalsContact OG-CD2 3.24Å
391	F	93.2	Very high	91.3	Very high	35 Å²	35	47.6 Å²	47.6	15%	0.154	27%	0.274	C	S	.	.	H	α-helix	trans	-68.8	-42.6	177	-176.2	-94.5	0	0	0	112.7	L387 E388 K389 V393 L394 S395 L411 L455 Y569	L387-F391 VanDerWaalsContact O-CB 3.27Å; L387-F391 WeakPolarHBondContact O-CB 3Å; L387-F391 PolarHBondContact O-N 3.07Å; E388-F391 PolarHBondContact O-N 3.44Å; K389-F391 VanDerWaalsContact C-N 3.31Å; K389-F391 PolarHBondContact O-N 3.22Å; F391-V393 VanDerWaalsContact C-N 3.29Å; F391-V393 PolarHBondContact O-N 3.34Å; F391-L394 PolarHBondContact O-N 3.31Å; F391-S395 VanDerWaalsContact O-CB 3.28Å; F391-S395 WeakPolarHBondContact O-CB 3.38Å; F391-S395 PolarHBondContact O-N 3.41Å; F391-S395 PolarHBondContact O-OG 3.1Å; F391-L411 HydrophobicContact CB-CD1 4.28Å; F391-L411 HydrophobicContact CD2-CD2 4.14Å; F391-L455 HydrophobicContact CD1-CD2 4.08Å; F391-L455 HydrophobicContact CE1-CB 4.33Å; F391-L455 HydrophobicContact CE1-CD2 3.61Å; F391-L455 HydrophobicContact CE2-CD2 4.12Å; F391-L455 HydrophobicContact CZ-CB 4.02Å; F391-L455 HydrophobicContact CZ-CD2 3.64Å; F391-L455 HydrophobicContact CZ-CG 4.37Å; F391-Y569 HydrophobicContact CB-CD1 3.57Å; F391-Y569 HydrophobicContact CB-CE1 3.65Å; F391-Y569 HydrophobicContact CB-CG 4.48Å; F391-Y569 AromaticContact CD1-CD1 3.97Å; F391-Y569 HydrophobicContact CD1-CD1 3.97Å; F391-Y569 AromaticContact CD1-CE1 3.99Å; F391-Y569 HydrophobicContact CD1-CE1 3.99Å; F391-Y569 AromaticContact CD2-CD1 3.62Å; F391-Y569 HydrophobicContact CD2-CD1 3.62Å; F391-Y569 HydrophobicContact CD2-CE1 4.4Å; F391-Y569 HydrophobicContact CD2-CG 4.44Å; F391-Y569 HydrophobicContact CE2-CD1 4.3Å; F391-Y569 AromaticContact CG-CD1 3.42Å; F391-Y569 HydrophobicContact CG-CD1 3.42Å; F391-Y569 VanDerWaalsContact CG-CD1 3.42Å; F391-Y569 AromaticContact CG-CE1 3.75Å; F391-Y569 HydrophobicContact CG-CE1 3.75Å
392	V	92	Very high	90.8	Very high	32 Å²	32	54.2 Å²	54.2	19%	0.194	29%	0.288	C	S	.	.	H	α-helix	trans	-62.7	-37.4	176.8	176.3	0	0	0	0	110.9	E388 K389 S395 Q397 L398	E388-V392 VanDerWaalsContact O-CG2 3.23Å; E388-V392 WeakPolarHBondContact O-CG2 3.32Å; E388-V392 PolarHBondContact O-N 2.91Å; K389-V392 PolarHBondContact O-N 3.17Å; V392-S395 WeakPolarHBondContact CA-OG 3.34Å; V392-S395 PolarHBondContact O-OG 3.27Å; V392-Q397 HydrophobicContact CG1-CB 3.74Å; V392-Q397 PolarHBondContact O-N 3.45Å; V392-Q397 VanDerWaalsContact O-N 3.16Å; V392-L398 HydrophobicContact CG1-CB 3.94Å; V392-L398 PolarHBondContact O-N 3.15Å
393	V	91.7	Very high	90.4	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-66.6	-48.5	172.7	171.9	0	0	0	0	111	V354 N355 K389 S390 F391 G396 L398 P403 T407	V354-V393 HydrophobicContact CG1-CG2 4.17Å; V354-V393 HydrophobicContact CG2-CG2 4.17Å; N355-V393 HydrophobicContact CB-CG1 3.75Å; N355-V393 HydrophobicContact CB-CG2 4.27Å; K389-V393 VanDerWaalsContact O-CG2 3.25Å; K389-V393 WeakPolarHBondContact O-CG2 3.37Å; K389-V393 PolarHBondContact O-N 3.47Å; S390-V393 PolarHBondContact O-N 3.43Å; F391-V393 VanDerWaalsContact C-N 3.29Å; F391-V393 PolarHBondContact O-N 3.34Å; V393-G396 PolarHBondContact O-N 3.48Å; V393-L398 HydrophobicContact CG2-CB 4.47Å; V393-L398 HydrophobicContact CG2-CD2 3.86Å; V393-P403 HydrophobicContact CG1-CB 4.1Å; V393-T407 HydrophobicContact CB-CG2 4.48Å; V393-T407 HydrophobicContact CG1-CG2 4.07Å
394	L	89.7	Confident	90	Very high	42 Å²	42	58.7 Å²	58.7	22%	0.22	32%	0.315	C	S	.	.	H	α-helix	trans	-65.6	-40.2	-176.6	-173	64.6	0	0	0	112.8	S390 F391 G396 P403 T407 A408 L411	S390-L394 VanDerWaalsContact O-CB 3.29Å; S390-L394 WeakPolarHBondContact O-CB 2.89Å; S390-L394 PolarHBondContact O-N 3.49Å; F391-L394 PolarHBondContact O-N 3.31Å; L394-G396 PolarHBondContact O-N 2.97Å; L394-P403 HydrophobicContact CD1-CB 4.47Å; L394-T407 HydrophobicContact CB-CG2 4.1Å; L394-T407 HydrophobicContact CD1-CG2 4.29Å; L394-A408 HydrophobicContact CD1-CB 4.04Å; L394-A408 HydrophobicContact CD2-CB 4.06Å; L394-L411 HydrophobicContact CD2-CD2 3.87Å
395	S	88	Confident	89.1	Confident	56 Å²	56	62.1 Å²	62.1	39%	0.392	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-5.8	178.1	58.9	0	0	0	0	113.8	F391 V392 Q397	F391-S395 VanDerWaalsContact O-CB 3.28Å; F391-S395 WeakPolarHBondContact O-CB 3.38Å; F391-S395 PolarHBondContact O-N 3.41Å; F391-S395 PolarHBondContact O-OG 3.1Å; V392-S395 WeakPolarHBondContact CA-OG 3.34Å; V392-S395 PolarHBondContact O-OG 3.27Å; S395-Q397 PolarHBondContact O-N 2.69Å; S395-Q397 WeakPolarHBondContact OG-CG 3.1Å
396	G	85.7	Confident	88.5	Confident	46 Å²	46	62.7 Å²	62.7	47%	0.474	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.8	8.8	-177.9	0	0	0	0	0	114.3	V393 L394 L398	V393-G396 PolarHBondContact O-N 3.48Å; L394-G396 PolarHBondContact O-N 2.97Å; G396-L398 PolarHBondContact O-N 2.86Å
397	Q	86.2	Confident	88.2	Confident	128 Å²	128	63 Å²	63	60%	0.598	35%	0.35	S	S	*	.			trans	-63.6	-33.4	173.8	-70.8	178.7	1.8	0	0	111.4	V392 S395 V399	V392-Q397 HydrophobicContact CG1-CB 3.74Å; V392-Q397 PolarHBondContact O-N 3.45Å; V392-Q397 VanDerWaalsContact O-N 3.16Å; S395-Q397 PolarHBondContact O-N 2.69Å; S395-Q397 WeakPolarHBondContact OG-CG 3.1Å; Q397-V399 PolarHBondContact O-N 2.79Å
398	L	86.3	Confident	87.8	Confident	49 Å²	49	63.8 Å²	63.8	26%	0.257	36%	0.356	S	S	.	.			trans	-85.6	96.8	174.3	-166.3	70.7	0	0	0	111.7	V354 V392 V393 G396 T400 H401	V354-L398 HydrophobicContact CB-CD2 4.45Å; V354-L398 HydrophobicContact CG1-CD2 3.36Å; V354-L398 HydrophobicContact CG2-CD2 4.33Å; V392-L398 HydrophobicContact CG1-CB 3.94Å; V392-L398 PolarHBondContact O-N 3.15Å; V393-L398 HydrophobicContact CG2-CB 4.47Å; V393-L398 HydrophobicContact CG2-CD2 3.86Å; G396-L398 PolarHBondContact O-N 2.86Å; L398-T400 VanDerWaalsContact C-N 3.26Å; L398-T400 WeakPolarHBondContact CG-OG1 3.36Å; L398-T400 PolarHBondContact O-N 3.02Å; L398-H401 HydrophobicContact CD2-CB 4.02Å; L398-H401 VanDerWaalsContact O-O 3.07Å
399	V	80.5	Confident	87.5	Confident	136 Å²	136	61.6 Å²	61.6	82%	0.824	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-27.2	-178.6	-176	0	0	0	0	113.2	Q397 H401	Q397-V399 PolarHBondContact O-N 2.79Å; V399-H401 VanDerWaalsContact C-N 3.35Å; V399-H401 PolarHBondContact O-N 2.72Å
400	T	84.4	Confident	87.4	Confident	108 Å²	108	58.5 Å²	58.5	66%	0.663	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-24.9	-173.9	52.5	0	0	0	0	113.8	L398	L398-T400 VanDerWaalsContact C-N 3.26Å; L398-T400 WeakPolarHBondContact CG-OG1 3.36Å; L398-T400 PolarHBondContact O-N 3.02Å
401	H	85.8	Confident	87.4	Confident	46 Å²	46	58.3 Å²	58.3	21%	0.213	33%	0.334	C	S	.	.	S	Bend	trans	-133.3	122.5	-177.1	-61.3	80.2	0	0	0	109.9	T352 V354 N355 L398 V399	T352-H401 PolarHBondContact O-NE2 3.19Å; V354-H401 HydrophobicContact CG1-CB 4.04Å; N355-H401 HydrophobicContact CB-CB 3.93Å; L398-H401 HydrophobicContact CD2-CB 4.02Å; L398-H401 VanDerWaalsContact O-O 3.07Å; V399-H401 VanDerWaalsContact C-N 3.35Å; V399-H401 PolarHBondContact O-N 2.72Å
402	R	86.5	Confident	87.5	Confident	216 Å²	216	56.7 Å²	56.7	82%	0.815	33%	0.327	S	S	*	.	P	Polyproline II helix	trans	-73.8	145.8	173.8	-64.4	-176.6	-177.3	-178.4	0.1	110.2	N355	N355-R402 PolarHBondContact ND2-O 3.42Å
403	P	86.7	Confident	87.5	Confident	61 Å²	61	55.7 Å²	55.7	40%	0.396	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-60.6	139.7	170.4	26.1	-33.1	0	0	0	110.1	V393 L394	V393-P403 HydrophobicContact CG1-CB 4.1Å; L394-P403 HydrophobicContact CD1-CB 4.47Å
404	L	87.1	Confident	87.7	Confident	50 Å²	50	55.7 Å²	55.7	26%	0.262	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-90.1	163.4	172.4	-60.2	-178.6	0	0	0	109.5	N355 D406 T407	N355-L404 VanDerWaalsContact O-CD1 3.26Å; N355-L404 WeakPolarHBondContact O-CD1 3.39Å; L404-D406 VanDerWaalsContact CB-OD1 3.29Å; L404-D406 WeakPolarHBondContact CB-OD1 3.48Å; L404-D406 PolarHBondContact O-N 3.03Å; L404-D406 VanDerWaalsContact O-N 3.12Å; L404-T407 PolarHBondContact N-OG1 2.89Å; L404-T407 WeakPolarHBondContact O-CB 3.22Å; L404-T407 PolarHBondContact O-N 3.41Å; L404-T407 PolarHBondContact O-OG1 3.06Å; L404-T407 VanDerWaalsContact O-OG1 3.05Å
405	A	78.9	Confident	88.1	Confident	107 Å²	107	53.9 Å²	53.9	88%	0.884	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-28.5	-176.3	0	0	0	0	0	113.4
406	D	83.5	Confident	88.4	Confident	46 Å²	46	51.2 Å²	51.2	25%	0.246	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-2.9	-180	69.8	-39	0	0	0	113.8	S357 L404 A408 V409 H410	S357-D406 WeakPolarHBondContact CB-OD2 3.16Å; S357-D406 PolarHBondContact OG-OD2 3.17Å; L404-D406 VanDerWaalsContact CB-OD1 3.29Å; L404-D406 WeakPolarHBondContact CB-OD1 3.48Å; L404-D406 PolarHBondContact O-N 3.03Å; L404-D406 VanDerWaalsContact O-N 3.12Å; D406-A408 PolarHBondContact O-N 2.77Å; D406-V409 WeakPolarHBondContact O-CB 3.5Å; D406-V409 PolarHBondContact O-N 3.44Å; D406-V409 VanDerWaalsContact O-N 3.11Å; D406-H410 WeakPolarHBondContact O-CB 3.36Å; D406-H410 PolarHBondContact O-N 3.26Å
407	T	88.6	Confident	88.9	Confident	6 Å²	6	49 Å²	49	4%	0.037	27%	0.27	C	S	.	.	H	α-helix	trans	-61.6	-41.3	-173	-58.3	0	0	0	0	112.6	V393 L394 L404 H410 L411	V393-T407 HydrophobicContact CB-CG2 4.48Å; V393-T407 HydrophobicContact CG1-CG2 4.07Å; L394-T407 HydrophobicContact CB-CG2 4.1Å; L394-T407 HydrophobicContact CD1-CG2 4.29Å; L404-T407 PolarHBondContact N-OG1 2.89Å; L404-T407 WeakPolarHBondContact O-CB 3.22Å; L404-T407 PolarHBondContact O-N 3.41Å; L404-T407 PolarHBondContact O-OG1 3.06Å; L404-T407 VanDerWaalsContact O-OG1 3.05Å; T407-H410 PolarHBondContact O-N 3.14Å; T407-L411 PolarHBondContact O-N 2.86Å
408	A	88.4	Confident	89.4	Confident	16 Å²	16	43.3 Å²	43.3	13%	0.132	24%	0.243	C	C	.	.	H	α-helix	trans	-67	-38.9	175.8	0	0	0	0	0	112.1	L394 D406 H410 L411 M412	L394-A408 HydrophobicContact CD1-CB 4.04Å; L394-A408 HydrophobicContact CD2-CB 4.06Å; D406-A408 PolarHBondContact O-N 2.77Å; A408-H410 VanDerWaalsContact C-N 3.34Å; A408-L411 PolarHBondContact O-N 3.5Å; A408-M412 PolarHBondContact O-N 3.03Å
409	V	87.7	Confident	89.9	Confident	36 Å²	36	41 Å²	41	22%	0.218	23%	0.231	C	C	.	.	H	α-helix	trans	-62.2	-44.7	175.8	176.7	0	0	0	0	110.4	D406 M412 N413	D406-V409 WeakPolarHBondContact O-CB 3.5Å; D406-V409 PolarHBondContact O-N 3.44Å; D406-V409 VanDerWaalsContact O-N 3.11Å; V409-M412 PolarHBondContact O-N 3.48Å; V409-N413 VanDerWaalsContact O-CB 3.3Å; V409-N413 WeakPolarHBondContact O-CB 3.41Å; V409-N413 VanDerWaalsContact O-CG 3.32Å; V409-N413 PolarHBondContact O-N 3.25Å
410	H	91.1	Very high	90.6	Very high	9 Å²	9	34.9 Å²	34.9	4%	0.042	19%	0.194	C	C	.	.	H	α-helix	trans	-62.5	-46.8	176.7	179.8	64.2	0	0	0	112	W360 S386 S390 D406 T407 A408 M412 N413 C414	W360-H410 AromaticContact CD1-NE2 3.85Å; W360-H410 AromaticContact CG-NE2 3.86Å; S386-H410 PolarHBondContact OG-NE2 3.36Å; S390-H410 PolarHBondContact OG-CD2 3.39Å; S390-H410 VanDerWaalsContact OG-CD2 3.24Å; D406-H410 WeakPolarHBondContact O-CB 3.36Å; D406-H410 PolarHBondContact O-N 3.26Å; T407-H410 PolarHBondContact O-N 3.14Å; A408-H410 VanDerWaalsContact C-N 3.34Å; H410-M412 VanDerWaalsContact C-N 3.34Å; H410-M412 PolarHBondContact O-N 3.21Å; H410-N413 CarbonylContact O-C 3.55Å; H410-N413 PolarHBondContact O-N 3.1Å; H410-N413 VanDerWaalsContact O-N 3.14Å; H410-C414 PolarHBondContact CE1-SG 2.93Å; H410-C414 PolarHBondContact O-N 3.4Å
411	L	94.4	Very high	91.2	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-55.1	-49.8	175.7	179.7	69	0	0	0	111.2	L387 F391 L394 T407 A408 N413 C414 L415 L571	L387-L411 HydrophobicContact CD2-CD1 3.82Å; F391-L411 HydrophobicContact CB-CD1 4.28Å; F391-L411 HydrophobicContact CD2-CD2 4.14Å; L394-L411 HydrophobicContact CD2-CD2 3.87Å; T407-L411 PolarHBondContact O-N 2.86Å; A408-L411 PolarHBondContact O-N 3.5Å; L411-N413 PolarHBondContact O-N 3.24Å; L411-C414 PolarHBondContact O-N 3.26Å; L411-L415 PolarHBondContact O-N 3.21Å; L411-L415 VanDerWaalsContact O-N 3.08Å; L411-L571 HydrophobicContact CD2-CD2 4.21Å
412	M	93.6	Very high	91.7	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-61.4	-44.2	176.3	177.6	168.7	25.9	0	0	112	A408 V409 H410 C414 L415 L416 L571 F580	A408-M412 PolarHBondContact O-N 3.03Å; V409-M412 PolarHBondContact O-N 3.48Å; H410-M412 VanDerWaalsContact C-N 3.34Å; H410-M412 PolarHBondContact O-N 3.21Å; M412-C414 VanDerWaalsContact C-N 3.29Å; M412-C414 PolarHBondContact O-N 3.29Å; M412-L415 WeakPolarHBondContact O-CB 3.46Å; M412-L415 PolarHBondContact O-N 3.3Å; M412-L416 HydrophobicContact CG-CD1 3.99Å; M412-L416 HydrophobicContact CG-CG 4.46Å; M412-L416 WeakPolarHBondContact O-CG 3.45Å; M412-L416 PolarHBondContact O-N 3.38Å; M412-L571 HydrophobicContact CB-CD2 4.41Å; M412-L571 HydrophobicContact SD-CD1 4.42Å; M412-F580 HydrophobicContact CG-CB 4.39Å; M412-F580 HydrophobicContact CG-CD2 3.85Å; M412-F580 HydrophobicContact SD-CB 3.7Å; M412-F580 HydrophobicContact SD-CD2 4.2Å; M412-F580 HydrophobicContact SD-CG 4.47Å
413	N	93.2	Very high	92.1	Very high	11 Å²	11	18 Å²	18	6%	0.059	12%	0.116	C	C	.	.	H	α-helix	trans	-64	-33.7	178.7	-82.1	-0.2	0	0	0	112.1	V409 H410 L411 G417 D603 Y605 R884	V409-N413 VanDerWaalsContact O-CB 3.3Å; V409-N413 WeakPolarHBondContact O-CB 3.41Å; V409-N413 VanDerWaalsContact O-CG 3.32Å; V409-N413 PolarHBondContact O-N 3.25Å; H410-N413 CarbonylContact O-C 3.55Å; H410-N413 PolarHBondContact O-N 3.1Å; H410-N413 VanDerWaalsContact O-N 3.14Å; L411-N413 PolarHBondContact O-N 3.24Å; N413-G417 WeakPolarHBondContact O-CA 3.45Å; N413-G417 PolarHBondContact O-N 3.1Å; N413-D603 PolarHBondContact ND2-OD1 3.38Å; N413-D603 VanDerWaalsContact ND2-OD1 3.07Å; N413-Y605 HydrophobicContact CB-CE1 3.71Å; N413-Y605 WeakPolarHBondContact O-CE1 3.45Å; N413-Y605 PolarHBondContact OD1-OH 3.44Å; N413-Y605 VanDerWaalsContact OD1-OH 3.08Å; N413-R884 PolarHBondContact OD1-NH2 3.18Å
414	C	95.5	Very high	92.4	Very high	0 Å²	0	16 Å²	16	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-67.4	-40.8	171.9	-79.1	0	0	0	0	112.3	S386 L387 H410 L411 M412 G417 K418	S386-C414 PolarHBondContact OG-SG 2.94Å; L387-C414 HydrophobicContact CD2-CB 3.49Å; L387-C414 VanDerWaalsContact CD2-CB 3.49Å; L387-C414 HydrophobicContact CG-CB 4.12Å; H410-C414 PolarHBondContact CE1-SG 2.93Å; H410-C414 PolarHBondContact O-N 3.4Å; L411-C414 PolarHBondContact O-N 3.26Å; M412-C414 VanDerWaalsContact C-N 3.29Å; M412-C414 PolarHBondContact O-N 3.29Å; C414-G417 PolarHBondContact O-N 3.23Å; C414-K418 WeakPolarHBondContact O-CB 3.44Å; C414-K418 PolarHBondContact O-N 3.24Å
415	L	97.2	Very high	92.8	Very high	3 Å²	3	13.7 Å²	13.7	2%	0.016	9%	0.09	C	C	.	.	H	α-helix	trans	-60.3	-49.9	175.1	-69.8	172.2	0	0	0	110.7	L387 L411 M412 G417 K418 I419 L438 M442 G567 L571 F580	L387-L415 HydrophobicContact CD1-CD2 3.94Å; L387-L415 HydrophobicContact CD2-CD2 3.62Å; L387-L415 HydrophobicContact CD2-CG 3.7Å; L387-L415 HydrophobicContact CG-CD2 4.44Å; L411-L415 PolarHBondContact O-N 3.21Å; L411-L415 VanDerWaalsContact O-N 3.08Å; M412-L415 WeakPolarHBondContact O-CB 3.46Å; M412-L415 PolarHBondContact O-N 3.3Å; L415-G417 PolarHBondContact O-N 3.4Å; L415-K418 PolarHBondContact O-N 3.46Å; L415-I419 WeakPolarHBondContact O-CG1 3.27Å; L415-I419 PolarHBondContact O-N 3.25Å; L415-I419 VanDerWaalsContact O-N 3.13Å; L415-L438 HydrophobicContact CD2-CD1 4.33Å; L415-L438 HydrophobicContact CD2-CD2 4.31Å; L415-M442 HydrophobicContact CD1-CE 4.41Å; L415-G567 WeakPolarHBondContact CD2-O 3.24Å; L415-L571 HydrophobicContact CD1-CD2 4.4Å; L415-F580 HydrophobicContact CB-CE2 3.66Å; L415-F580 HydrophobicContact CB-CZ 4.22Å; L415-F580 HydrophobicContact CD1-CE2 4.21Å
416	L	95.9	Very high	93.6	Very high	1 Å²	1	8.6 Å²	8.6	1%	0.005	5%	0.048	C	C	.	.	H	α-helix	trans	-62.4	-43.2	176.9	-67.3	170.1	0	0	0	111.7	M412 K418 I419 V420 F580 E583 A584 Y605	M412-L416 HydrophobicContact CG-CD1 3.99Å; M412-L416 HydrophobicContact CG-CG 4.46Å; M412-L416 WeakPolarHBondContact O-CG 3.45Å; M412-L416 PolarHBondContact O-N 3.38Å; L416-K418 VanDerWaalsContact C-N 3.31Å; L416-K418 PolarHBondContact O-N 3.46Å; L416-I419 PolarHBondContact O-N 3.28Å; L416-V420 WeakPolarHBondContact O-CG2 3.28Å; L416-V420 PolarHBondContact O-N 3.05Å; L416-F580 HydrophobicContact CD2-CD2 3.89Å; L416-F580 HydrophobicContact CD2-CE2 3.68Å; L416-F580 HydrophobicContact CG-CD2 4.01Å; L416-F580 HydrophobicContact CG-CE2 3.9Å; L416-E583 HydrophobicContact CD1-CB 3.6Å; L416-E583 HydrophobicContact CD1-CG 4.15Å; L416-E583 HydrophobicContact CD2-CB 3.62Å; L416-E583 HydrophobicContact CG-CB 4.28Å; L416-A584 HydrophobicContact CD2-CB 4.23Å; L416-Y605 HydrophobicContact CB-CD2 4.48Å; L416-Y605 HydrophobicContact CB-CE2 3.73Å; L416-Y605 VanDerWaalsContact CD1-OH 3.28Å; L416-Y605 WeakPolarHBondContact CD1-OH 3.07Å
417	G	95.7	Very high	94.2	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-60	-38.3	176.2	0	0	0	0	0	112.9	F383 N413 C414 L415 F421	F383-G417 VanDerWaalsContact CE1-C 3.48Å; F383-G417 VanDerWaalsContact CZ-C 3.48Å; F383-G417 WeakPolarHBondContact CZ-O 3.39Å; N413-G417 WeakPolarHBondContact O-CA 3.45Å; N413-G417 PolarHBondContact O-N 3.1Å; C414-G417 PolarHBondContact O-N 3.23Å; L415-G417 PolarHBondContact O-N 3.4Å; G417-F421 VanDerWaalsContact O-CB 3.26Å; G417-F421 WeakPolarHBondContact O-CB 3.39Å; G417-F421 PolarHBondContact O-N 2.87Å
418	K	97.2	Very high	94.6	Very high	8 Å²	8	7.6 Å²	7.6	4%	0.035	4%	0.041	C	C	.	.	H	α-helix	trans	-66.6	-44.8	176.2	-172.1	179.3	178.8	-179	0	111.2	L380 F383 D384 L387 C414 L415 L416 F421 L422	L380-K418 HydrophobicContact CD2-CG 4.09Å; F383-K418 HydrophobicContact CB-CB 4.43Å; F383-K418 HydrophobicContact CB-CD 4.22Å; F383-K418 HydrophobicContact CB-CG 4.26Å; F383-K418 HydrophobicContact CD1-CB 3.82Å; F383-K418 HydrophobicContact CD1-CG 4.48Å; F383-K418 HydrophobicContact CE1-CB 4.05Å; F383-K418 VanDerWaalsContact CE1-N 3.3Å; F383-K418 HydrophobicContact CG-CB 4.05Å; F383-K418 HydrophobicContact CG-CG 4.22Å; D384-K418 IonicContact OD1-NZ 3.2Å; D384-K418 PolarHBondContact OD1-NZ 3.18Å; D384-K418 IonicContact OD2-NZ 3.54Å; L387-K418 HydrophobicContact CD1-CD 4.24Å; C414-K418 WeakPolarHBondContact O-CB 3.44Å; C414-K418 PolarHBondContact O-N 3.24Å; L415-K418 PolarHBondContact O-N 3.46Å; L416-K418 VanDerWaalsContact C-N 3.31Å; L416-K418 PolarHBondContact O-N 3.46Å; K418-F421 PolarHBondContact O-N 3.34Å; K418-L422 WeakPolarHBondContact O-CG 3.34Å; K418-L422 PolarHBondContact O-N 3.28Å
419	I	96.9	Very high	94.9	Very high	0 Å²	0	6.9 Å²	6.9	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-60.2	-48.3	176	-65.3	158.4	0	0	0	110.4	L415 L416 F421 L422 R423 A431 T434 V435 L438 F580 A584 A587 L588	L415-I419 WeakPolarHBondContact O-CG1 3.27Å; L415-I419 PolarHBondContact O-N 3.25Å; L415-I419 VanDerWaalsContact O-N 3.13Å; L416-I419 PolarHBondContact O-N 3.28Å; I419-F421 VanDerWaalsContact C-N 3.31Å; I419-F421 PolarHBondContact O-N 3.24Å; I419-L422 PolarHBondContact O-N 3.01Å; I419-R423 PolarHBondContact O-N 3.22Å; I419-R423 VanDerWaalsContact O-N 3.11Å; I419-A431 HydrophobicContact CG2-CB 4.48Å; I419-T434 HydrophobicContact CG1-CG2 4.22Å; I419-V435 HydrophobicContact CD1-CG2 3.67Å; I419-V435 HydrophobicContact CG1-CG2 4.02Å; I419-V435 HydrophobicContact CG2-CG2 3.91Å; I419-L438 HydrophobicContact CD1-CD1 4.27Å; I419-F580 HydrophobicContact CD1-CE2 4.32Å; I419-F580 HydrophobicContact CD1-CZ 3.94Å; I419-A584 HydrophobicContact CD1-CB 4.4Å; I419-A587 HydrophobicContact CG2-CB 3.91Å; I419-L588 HydrophobicContact CG2-CD2 4.16Å
420	V	95.2	Very high	95.3	Very high	8 Å²	8	7.8 Å²	7.8	5%	0.048	3%	0.034	C	C	.	.	H	α-helix	trans	-60.9	-41.8	176.6	170.2	0	0	0	0	110.8	L416 R423 E424 A587 Y605	L416-V420 WeakPolarHBondContact O-CG2 3.28Å; L416-V420 PolarHBondContact O-N 3.05Å; V420-R423 WeakPolarHBondContact O-CB 3.48Å; V420-R423 PolarHBondContact O-N 3.33Å; V420-E424 HydrophobicContact CG1-CG 4.19Å; V420-E424 WeakPolarHBondContact O-CG 3.24Å; V420-E424 PolarHBondContact O-N 2.86Å; V420-A587 HydrophobicContact CG2-CB 3.89Å; V420-Y605 HydrophobicContact CG2-CD2 4.13Å
421	F	95.9	Very high	95.6	Very high	1 Å²	1	7.4 Å²	7.4	0%	0.004	3%	0.032	C	C	.	.	H	α-helix	trans	-63.7	-47.5	179.1	-178.8	-102.3	0	0	0	112.5	L368 F374 V376 Q379 L380 F383 G417 K418 I419 R423 E424 S425 W1048	L368-F421 HydrophobicContact CD2-CE2 3.95Å; F374-F421 HydrophobicContact CE2-CE2 4.37Å; F374-F421 HydrophobicContact CE2-CZ 4.16Å; F374-F421 HydrophobicContact CZ-CE2 4.26Å; F374-F421 AromaticContact CZ-CZ 3.98Å; F374-F421 HydrophobicContact CZ-CZ 3.98Å; V376-F421 HydrophobicContact CB-CE1 4.4Å; V376-F421 HydrophobicContact CB-CZ 4.49Å; V376-F421 HydrophobicContact CG1-CE1 3.92Å; V376-F421 HydrophobicContact CG1-CZ 4.46Å; V376-F421 HydrophobicContact CG2-CE1 4.46Å; V376-F421 HydrophobicContact CG2-CZ 4.21Å; Q379-F421 HydrophobicContact CB-CE1 3.68Å; Q379-F421 HydrophobicContact CB-CE2 4.17Å; Q379-F421 HydrophobicContact CB-CZ 3.47Å; Q379-F421 VanDerWaalsContact CB-CZ 3.47Å; Q379-F421 HydrophobicContact CG-CD1 4.19Å; Q379-F421 HydrophobicContact CG-CD2 4.13Å; Q379-F421 HydrophobicContact CG-CE1 3.73Å; Q379-F421 HydrophobicContact CG-CE2 3.68Å; Q379-F421 HydrophobicContact CG-CG 4.37Å; Q379-F421 HydrophobicContact CG-CZ 3.47Å; Q379-F421 VanDerWaalsContact CG-CZ 3.47Å; L380-F421 HydrophobicContact CD2-CD1 3.89Å; L380-F421 HydrophobicContact CD2-CE1 4.22Å; L380-F421 HydrophobicContact CG-CD1 4.39Å; L380-F421 HydrophobicContact CG-CE1 4.22Å; F383-F421 HydrophobicContact CE2-CB 3.82Å; F383-F421 HydrophobicContact CE2-CD1 4.16Å; F383-F421 AromaticContact CE2-CG 3.91Å; F383-F421 HydrophobicContact CE2-CG 3.91Å; F383-F421 HydrophobicContact CZ-CB 4.13Å; G417-F421 VanDerWaalsContact O-CB 3.26Å; G417-F421 WeakPolarHBondContact O-CB 3.39Å; G417-F421 PolarHBondContact O-N 2.87Å; K418-F421 PolarHBondContact O-N 3.34Å; I419-F421 VanDerWaalsContact C-N 3.31Å; I419-F421 PolarHBondContact O-N 3.24Å; F421-R423 VanDerWaalsContact C-N 3.3Å; F421-R423 PolarHBondContact O-N 3.4Å; F421-E424 PolarHBondContact O-N 3.16Å; F421-E424 VanDerWaalsContact O-N 3.17Å; F421-S425 PolarHBondContact O-N 3.48Å; F421-S425 PolarHBondContact O-OG 2.84Å; F421-W1048 HydrophobicContact CD2-CB 4.44Å; F421-W1048 HydrophobicContact CE2-CB 3.58Å; F421-W1048 HydrophobicContact CE2-CG 4.18Å; F421-W1048 HydrophobicContact CZ-CB 4.27Å
422	L	96.9	Very high	95.7	Very high	2 Å²	2	7.5 Å²	7.5	1%	0.01	3%	0.033	C	C	.	.	H	α-helix	trans	-54	-49.2	175.6	-74.8	168.5	0	0	0	110.9	L380 K418 I419 E424 S425 G426 H427 R430 A431	L380-L422 HydrophobicContact CD1-CD2 3.99Å; L380-L422 HydrophobicContact CD2-CD2 3.82Å; L380-L422 HydrophobicContact CD2-CG 4.12Å; K418-L422 WeakPolarHBondContact O-CG 3.34Å; K418-L422 PolarHBondContact O-N 3.28Å; I419-L422 PolarHBondContact O-N 3.01Å; L422-E424 PolarHBondContact O-N 3.46Å; L422-S425 WeakPolarHBondContact CA-OG 3.32Å; L422-S425 PolarHBondContact O-N 3.01Å; L422-S425 PolarHBondContact O-OG 3.01Å; L422-G426 PolarHBondContact O-N 3.01Å; L422-H427 HydrophobicContact CB-CB 4.47Å; L422-H427 HydrophobicContact CD2-CB 4.16Å; L422-H427 PolarHBondContact O-N 3.46Å; L422-R430 HydrophobicContact CD1-CB 4.3Å; L422-R430 HydrophobicContact CD2-CB 4.14Å; L422-A431 HydrophobicContact CB-CB 3.93Å
423	R	94.8	Very high	95.8	Very high	11 Å²	11	7.5 Å²	7.5	4%	0.042	3%	0.033	C	C	.	.	H	α-helix	trans	-55.9	-50.2	175.7	-169.2	-163.2	69.5	-138.4	-0.5	112.5	I419 V420 F421 S425 G426 Y428 A587	I419-R423 PolarHBondContact O-N 3.22Å; I419-R423 VanDerWaalsContact O-N 3.11Å; V420-R423 WeakPolarHBondContact O-CB 3.48Å; V420-R423 PolarHBondContact O-N 3.33Å; F421-R423 VanDerWaalsContact C-N 3.3Å; F421-R423 PolarHBondContact O-N 3.4Å; R423-S425 VanDerWaalsContact C-N 3.28Å; R423-S425 PolarHBondContact O-N 3.24Å; R423-G426 PolarHBondContact O-N 3.39Å; R423-Y428 HydrophobicContact CB-CE1 4.42Å; R423-Y428 HydrophobicContact CG-CD1 3.71Å; R423-Y428 HydrophobicContact CG-CE1 3.2Å; R423-A587 WeakPolarHBondContact CD-O 3.43Å; R423-A587 PolarHBondContact NH1-O 3.22Å
424	E	93.3	Very high	96.1	Very high	21 Å²	21	7.2 Å²	7.2	10%	0.098	3%	0.031	C	C	.	.	H	α-helix	trans	-66.3	-30.2	-178.1	-69.2	-67.9	135.4	0	0	113.2	V420 F421 L422 G426 W1048 S1049 K1050	V420-E424 HydrophobicContact CG1-CG 4.19Å; V420-E424 WeakPolarHBondContact O-CG 3.24Å; V420-E424 PolarHBondContact O-N 2.86Å; F421-E424 PolarHBondContact O-N 3.16Å; F421-E424 VanDerWaalsContact O-N 3.17Å; L422-E424 PolarHBondContact O-N 3.46Å; E424-G426 PolarHBondContact O-N 3.48Å; E424-W1048 CarbonylContact C-O 3.58Å; E424-S1049 WeakPolarHBondContact O-CA 3.47Å; E424-K1050 PolarHBondContact O-N 2.95Å
425	S	95.8	Very high	96.2	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	3%	0.031	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-0.5	172.7	57.8	0	0	0	0	113.9	F421 L422 R423 H427 W1048 R1078	F421-S425 PolarHBondContact O-N 3.48Å; F421-S425 PolarHBondContact O-OG 2.84Å; L422-S425 WeakPolarHBondContact CA-OG 3.32Å; L422-S425 PolarHBondContact O-N 3.01Å; L422-S425 PolarHBondContact O-OG 3.01Å; R423-S425 VanDerWaalsContact C-N 3.28Å; R423-S425 PolarHBondContact O-N 3.24Å; S425-H427 PolarHBondContact OG-CD2 3.35Å; S425-W1048 WeakPolarHBondContact CA-O 3.43Å; S425-R1078 PolarHBondContact O-N 2.96Å
426	G	95.1	Very high	96.1	Very high	1 Å²	1	7 Å²	7	1%	0.01	3%	0.031	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.6	-0.3	176.8	0	0	0	0	0	115.8	L422 R423 E424 Y428 R1078 R1080	L422-G426 PolarHBondContact O-N 3.01Å; R423-G426 PolarHBondContact O-N 3.39Å; E424-G426 PolarHBondContact O-N 3.48Å; G426-Y428 WeakPolarHBondContact O-CD2 3.49Å; G426-Y428 PolarHBondContact O-N 2.91Å; G426-R1078 WeakPolarHBondContact O-CB 3.49Å; G426-R1078 VanDerWaalsContact O-CG 3.29Å; G426-R1078 WeakPolarHBondContact O-CG 3.31Å; G426-R1080 PolarHBondContact O-NH1 3.33Å; G426-R1080 VanDerWaalsContact O-NH1 3.16Å; G426-R1080 PolarHBondContact O-NH2 3.19Å
427	H	96.6	Very high	96.1	Very high	14 Å²	14	7 Å²	7	7%	0.065	3%	0.03	C	C	.	.			trans	-81.7	59.5	178.9	-68.8	-83.6	0	0	0	110.5	L422 S425 R430 A431 G1076	L422-H427 HydrophobicContact CB-CB 4.47Å; L422-H427 HydrophobicContact CD2-CB 4.16Å; L422-H427 PolarHBondContact O-N 3.46Å; S425-H427 PolarHBondContact OG-CD2 3.35Å; H427-R430 HydrophobicContact CB-CB 4.22Å; H427-R430 HydrophobicContact CB-CG 4.41Å; H427-R430 PolarHBondContact O-N 3.03Å; H427-A431 PolarHBondContact O-N 3.21Å; H427-G1076 PolarHBondContact NE2-O 3.49Å
428	Y	95.3	Very high	96.2	Very high	17 Å²	17	7 Å²	7	7%	0.067	3%	0.031	C	C	.	.	H	α-helix	trans	-63.2	-41.8	-175.8	-78.2	-83.5	0	0	0	112.5	R423 G426 R430 A431 V432 E537 W541 P626 M630	R423-Y428 HydrophobicContact CB-CE1 4.42Å; R423-Y428 HydrophobicContact CG-CD1 3.71Å; R423-Y428 HydrophobicContact CG-CE1 3.2Å; G426-Y428 WeakPolarHBondContact O-CD2 3.49Å; G426-Y428 PolarHBondContact O-N 2.91Å; Y428-R430 VanDerWaalsContact C-N 3.32Å; Y428-R430 PolarHBondContact O-N 3.16Å; Y428-A431 WeakPolarHBondContact O-CB 3.32Å; Y428-A431 PolarHBondContact O-N 3.2Å; Y428-A431 VanDerWaalsContact O-N 3.09Å; Y428-V432 WeakPolarHBondContact O-CG2 3.49Å; Y428-V432 PolarHBondContact O-N 3.15Å; Y428-E537 HydrophobicContact CE2-CG 4.46Å; Y428-W541 CarbonylContact C-O 3.6Å; Y428-W541 HydrophobicContact CG-CB 4.46Å; Y428-P626 HydrophobicContact CE2-CB 4.5Å; Y428-M630 HydrophobicContact CD1-CE 3.37Å; Y428-M630 HydrophobicContact CD1-SD 4.3Å; Y428-M630 HydrophobicContact CD2-CE 3.59Å; Y428-M630 HydrophobicContact CE1-CE 3.28Å; Y428-M630 HydrophobicContact CE1-SD 4.27Å; Y428-M630 HydrophobicContact CE2-CE 3.55Å; Y428-M630 HydrophobicContact CG-CE 3.51Å; Y428-M630 VanDerWaalsContact CZ-CE 3.4Å
429	E	95.8	Very high	96.1	Very high	0 Å²	0	6.7 Å²	6.7	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-54.8	-48.1	174.8	55.4	-76	177.7	0	0	110.7	A431 V432 R433 W541 P543 V559 R1078 R1080	E429-A431 PolarHBondContact O-N 2.83Å; E429-V432 PolarHBondContact O-N 3.22Å; E429-R433 WeakPolarHBondContact O-CB 3.32Å; E429-R433 PolarHBondContact O-N 3.41Å; E429-W541 VanDerWaalsContact CA-O 3.31Å; E429-W541 WeakPolarHBondContact CA-O 3.43Å; E429-W541 PolarHBondContact N-O 2.88Å; E429-W541 VanDerWaalsContact N-O 3.09Å; E429-P543 HydrophobicContact CB-CG 4.43Å; E429-P543 WeakPolarHBondContact O-CG 3.35Å; E429-V559 HydrophobicContact CB-CG2 4.12Å; E429-V559 HydrophobicContact CG-CG2 4.04Å; E429-R1078 WeakPolarHBondContact OE1-CD 3.35Å; E429-R1078 IonicContact OE1-CZ 2.76Å; E429-R1078 IonicContact OE1-NE 3.77Å; E429-R1078 PolarHBondContact OE1-NE 3.28Å; E429-R1078 IonicContact OE1-NH2 3.33Å; E429-R1080 IonicContact OE2-CZ 3.92Å; E429-R1080 IonicContact OE2-NH2 2.68Å; E429-R1080 PolarHBondContact OE2-NH2 2.79Å
430	R	96.5	Very high	96	Very high	56 Å²	56	6.8 Å²	6.8	21%	0.211	3%	0.029	C	C	.	.	H	α-helix	trans	-66.1	-38.7	176.6	-63.7	-175.7	67.5	177.2	6.5	111.8	L422 H427 Y428 T434 V559 D563	L422-R430 HydrophobicContact CD1-CB 4.3Å; L422-R430 HydrophobicContact CD2-CB 4.14Å; H427-R430 HydrophobicContact CB-CB 4.22Å; H427-R430 HydrophobicContact CB-CG 4.41Å; H427-R430 PolarHBondContact O-N 3.03Å; Y428-R430 VanDerWaalsContact C-N 3.32Å; Y428-R430 PolarHBondContact O-N 3.16Å; R430-T434 VanDerWaalsContact O-CB 3.22Å; R430-T434 WeakPolarHBondContact O-CB 3.43Å; R430-T434 PolarHBondContact O-N 3.01Å; R430-T434 PolarHBondContact O-OG1 3.32Å; R430-V559 HydrophobicContact CB-CG2 4.42Å; R430-V559 HydrophobicContact CG-CG1 4.05Å; R430-V559 HydrophobicContact CG-CG2 3.69Å; R430-D563 PolarHBondContact NH2-O 2.79Å; R430-D563 VanDerWaalsContact NH2-O 3.16Å
431	A	97	Very high	96	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-63	-46.9	177.1	0	0	0	0	0	111.6	I419 L422 H427 Y428 E429 T434 V435 L588	I419-A431 HydrophobicContact CG2-CB 4.48Å; L422-A431 HydrophobicContact CB-CB 3.93Å; H427-A431 PolarHBondContact O-N 3.21Å; Y428-A431 WeakPolarHBondContact O-CB 3.32Å; Y428-A431 PolarHBondContact O-N 3.2Å; Y428-A431 VanDerWaalsContact O-N 3.09Å; E429-A431 PolarHBondContact O-N 2.83Å; A431-T434 PolarHBondContact O-N 3.07Å; A431-V435 WeakPolarHBondContact O-CG2 3.43Å; A431-V435 PolarHBondContact O-N 3.33Å; A431-V435 VanDerWaalsContact O-N 3.09Å; A431-L588 HydrophobicContact CB-CD2 4.22Å
432	V	97	Very high	95.8	Very high	3 Å²	3	6.9 Å²	6.9	2%	0.018	3%	0.03	C	C	.	.	H	α-helix	trans	-61.2	-53.2	176.5	173.6	0	0	0	0	109.8	Y428 E429 T434 V435 Q436 W541 F542 P543 L588 F640	Y428-V432 WeakPolarHBondContact O-CG2 3.49Å; Y428-V432 PolarHBondContact O-N 3.15Å; E429-V432 PolarHBondContact O-N 3.22Å; V432-T434 VanDerWaalsContact C-N 3.29Å; V432-T434 PolarHBondContact O-N 2.96Å; V432-V435 PolarHBondContact O-N 3.11Å; V432-Q436 HydrophobicContact CG1-CG 4.25Å; V432-Q436 WeakPolarHBondContact O-CG 2.95Å; V432-Q436 PolarHBondContact O-N 3.13Å; V432-W541 HydrophobicContact CG2-CE3 4.01Å; V432-W541 HydrophobicContact CG2-CZ3 3.81Å; V432-F542 HydrophobicContact CG1-CD2 4.08Å; V432-F542 HydrophobicContact CG1-CE2 3.79Å; V432-P543 HydrophobicContact CB-CG 4.06Å; V432-P543 HydrophobicContact CG1-CG 3.96Å; V432-L588 HydrophobicContact CG2-CD2 4.17Å; V432-F640 HydrophobicContact CG1-CZ 4.31Å
433	R	96.2	Very high	95.6	Very high	1 Å²	1	8.4 Å²	8.4	0%	0.004	4%	0.036	C	C	.	.	H	α-helix	trans	-58.1	-40.9	-179.8	-167.3	73.4	81.6	167.6	-0.1	112.4	E429 V435 Q436 A437 W466 H472 P543 F544 V559 I564	E429-R433 WeakPolarHBondContact O-CB 3.32Å; E429-R433 PolarHBondContact O-N 3.41Å; R433-V435 VanDerWaalsContact C-N 3.34Å; R433-V435 PolarHBondContact O-N 3.25Å; R433-Q436 PolarHBondContact O-N 3.26Å; R433-A437 WeakPolarHBondContact O-CB 3.44Å; R433-A437 PolarHBondContact O-N 3.42Å; R433-W466 HydrophobicContact CG-CH2 4.04Å; R433-W466 HydrophobicContact CG-CZ3 3.96Å; R433-H472 PolarHBondContact NH1-CE1 2.7Å; R433-H472 PolarHBondContact NH1-ND1 3.07Å; R433-H472 PolarHBondContact NH1-NE2 3.31Å; R433-P543 HydrophobicContact CB-CG 3.99Å; R433-F544 PolarHBondContact NH2-O 3.16Å; R433-V559 HydrophobicContact CB-CB 4.04Å; R433-V559 HydrophobicContact CB-CG1 3.9Å; R433-V559 HydrophobicContact CB-CG2 4.45Å; R433-V559 HydrophobicContact CG-CB 3.96Å; R433-V559 HydrophobicContact CG-CG1 3.84Å; R433-I564 HydrophobicContact CG-CD1 4.15Å; R433-I564 HydrophobicContact CG-CG2 4.45Å
434	T	97.4	Very high	95.4	Very high	4 Å²	4	7.9 Å²	7.9	3%	0.025	3%	0.034	C	C	.	.	H	α-helix	trans	-59.9	-43.7	175	-60.5	0	0	0	0	111.4	I419 R430 A431 V432 L438 I564	I419-T434 HydrophobicContact CG1-CG2 4.22Å; R430-T434 VanDerWaalsContact O-CB 3.22Å; R430-T434 WeakPolarHBondContact O-CB 3.43Å; R430-T434 PolarHBondContact O-N 3.01Å; R430-T434 PolarHBondContact O-OG1 3.32Å; A431-T434 PolarHBondContact O-N 3.07Å; V432-T434 VanDerWaalsContact C-N 3.29Å; V432-T434 PolarHBondContact O-N 2.96Å; T434-L438 HydrophobicContact CG2-CD1 3.79Å; T434-L438 HydrophobicContact CG2-CG 4.42Å; T434-L438 WeakPolarHBondContact O-CB 3.25Å; T434-L438 VanDerWaalsContact O-CG 3.28Å; T434-L438 WeakPolarHBondContact O-CG 3.33Å; T434-L438 PolarHBondContact O-N 3.29Å; T434-I564 WeakPolarHBondContact OG1-CG2 3.44Å
435	V	97.8	Very high	95.2	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-67.6	-43.8	177.1	172.5	0	0	0	0	111.1	I419 A431 V432 R433 A437 L438 L439 A584 L588 F640	I419-V435 HydrophobicContact CD1-CG2 3.67Å; I419-V435 HydrophobicContact CG1-CG2 4.02Å; I419-V435 HydrophobicContact CG2-CG2 3.91Å; A431-V435 WeakPolarHBondContact O-CG2 3.43Å; A431-V435 PolarHBondContact O-N 3.33Å; A431-V435 VanDerWaalsContact O-N 3.09Å; V432-V435 PolarHBondContact O-N 3.11Å; R433-V435 VanDerWaalsContact C-N 3.34Å; R433-V435 PolarHBondContact O-N 3.25Å; V435-A437 VanDerWaalsContact C-N 3.34Å; V435-A437 PolarHBondContact O-N 2.8Å; V435-L438 PolarHBondContact O-N 3.23Å; V435-L439 HydrophobicContact CG1-CD1 3.82Å; V435-L439 HydrophobicContact CG1-CG 4.1Å; V435-L439 WeakPolarHBondContact O-CB 3.34Å; V435-L439 VanDerWaalsContact O-CG 3.26Å; V435-L439 WeakPolarHBondContact O-CG 3.22Å; V435-L439 PolarHBondContact O-N 2.96Å; V435-A584 HydrophobicContact CG1-CB 4.22Å; V435-A584 HydrophobicContact CG2-CB 4.27Å; V435-L588 HydrophobicContact CB-CD1 3.99Å; V435-L588 HydrophobicContact CB-CD2 4.27Å; V435-L588 HydrophobicContact CB-CG 4.32Å; V435-L588 HydrophobicContact CG1-CD1 3.89Å; V435-L588 HydrophobicContact CG1-CG 4.46Å; V435-L588 HydrophobicContact CG2-CD1 4.12Å; V435-L588 HydrophobicContact CG2-CD2 3.72Å; V435-L588 HydrophobicContact CG2-CG 3.89Å; V435-F640 HydrophobicContact CG1-CE1 4.08Å
436	Q	96.3	Very high	94.4	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-54.3	-52.3	175.7	-63.1	177	-61.6	0	0	110.4	V432 R433 L439 E440 H472 F473 E475 F640	V432-Q436 HydrophobicContact CG1-CG 4.25Å; V432-Q436 WeakPolarHBondContact O-CG 2.95Å; V432-Q436 PolarHBondContact O-N 3.13Å; R433-Q436 PolarHBondContact O-N 3.26Å; Q436-L439 PolarHBondContact O-N 2.93Å; Q436-E440 WeakPolarHBondContact O-CG 3.37Å; Q436-E440 PolarHBondContact O-N 2.96Å; Q436-H472 HydrophobicContact CB-CB 4.39Å; Q436-F473 HydrophobicContact CB-CB 4.43Å; Q436-F473 WeakPolarHBondContact CG-O 3.35Å; Q436-F473 PolarHBondContact NE2-O 2.92Å; Q436-E475 PolarHBondContact NE2-OE1 2.77Å; Q436-E475 VanDerWaalsContact NE2-OE1 3.09Å; Q436-F640 HydrophobicContact CG-CE1 4.15Å; Q436-F640 HydrophobicContact CG-CZ 3.73Å
437	A	96	Very high	93.2	Very high	0 Å²	0	13 Å²	13	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-62.8	-44.2	179.6	0	0	0	0	0	113.5	R433 V435 L439 E440 L441 L462 W466 I564 L568	R433-A437 WeakPolarHBondContact O-CB 3.44Å; R433-A437 PolarHBondContact O-N 3.42Å; V435-A437 VanDerWaalsContact C-N 3.34Å; V435-A437 PolarHBondContact O-N 2.8Å; A437-L439 PolarHBondContact O-N 3.3Å; A437-E440 PolarHBondContact O-N 3.22Å; A437-L441 VanDerWaalsContact O-CB 3.23Å; A437-L441 WeakPolarHBondContact O-CB 3.29Å; A437-L441 PolarHBondContact O-N 3.04Å; A437-L462 HydrophobicContact CB-CD2 4.46Å; A437-W466 HydrophobicContact CB-CH2 3.57Å; A437-W466 HydrophobicContact CB-CZ2 3.69Å; A437-W466 HydrophobicContact CB-CZ3 4.45Å; A437-I564 HydrophobicContact CB-CD1 3.44Å; A437-I564 VanDerWaalsContact CB-CD1 3.44Å; A437-L568 HydrophobicContact CB-CD1 4.33Å; A437-L568 HydrophobicContact CB-CD2 3.6Å
438	L	97.1	Very high	91.1	Very high	1 Å²	1	16.6 Å²	16.6	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-63.1	-41.9	178.3	-77.6	169.7	0	0	0	111.7	L415 I419 T434 V435 L441 M442 L568 F580	L415-L438 HydrophobicContact CD2-CD1 4.33Å; L415-L438 HydrophobicContact CD2-CD2 4.31Å; I419-L438 HydrophobicContact CD1-CD1 4.27Å; T434-L438 HydrophobicContact CG2-CD1 3.79Å; T434-L438 HydrophobicContact CG2-CG 4.42Å; T434-L438 WeakPolarHBondContact O-CB 3.25Å; T434-L438 VanDerWaalsContact O-CG 3.28Å; T434-L438 WeakPolarHBondContact O-CG 3.33Å; T434-L438 PolarHBondContact O-N 3.29Å; V435-L438 PolarHBondContact O-N 3.23Å; L438-L441 PolarHBondContact O-N 3.02Å; L438-M442 HydrophobicContact CD2-CE 4.36Å; L438-M442 WeakPolarHBondContact O-CB 3.44Å; L438-M442 WeakPolarHBondContact O-CG 3.43Å; L438-M442 PolarHBondContact O-N 3.39Å; L438-L568 HydrophobicContact CD2-CD2 3.95Å; L438-L568 HydrophobicContact CG-CD2 3.95Å; L438-F580 HydrophobicContact CB-CE1 3.98Å; L438-F580 HydrophobicContact CB-CZ 4.37Å; L438-F580 HydrophobicContact CD1-CE1 4.17Å; L438-F580 HydrophobicContact CD1-CZ 3.69Å
439	L	96.2	Very high	89.4	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-68.3	-40.7	178.2	-64.5	-175.8	0	0	0	111.6	V435 Q436 A437 M442 F443 F473 F580 L581 F640	V435-L439 HydrophobicContact CG1-CD1 3.82Å; V435-L439 HydrophobicContact CG1-CG 4.1Å; V435-L439 WeakPolarHBondContact O-CB 3.34Å; V435-L439 VanDerWaalsContact O-CG 3.26Å; V435-L439 WeakPolarHBondContact O-CG 3.22Å; V435-L439 PolarHBondContact O-N 2.96Å; Q436-L439 PolarHBondContact O-N 2.93Å; A437-L439 PolarHBondContact O-N 3.3Å; L439-M442 PolarHBondContact O-N 3.17Å; L439-F443 HydrophobicContact CD2-CE2 4.22Å; L439-F443 WeakPolarHBondContact O-CB 3.25Å; L439-F443 WeakPolarHBondContact O-CD2 3.38Å; L439-F443 PolarHBondContact O-N 3.11Å; L439-F473 HydrophobicContact CB-CD1 4.44Å; L439-F473 HydrophobicContact CB-CD2 4.36Å; L439-F473 HydrophobicContact CB-CE2 4.43Å; L439-F473 HydrophobicContact CB-CG 4.37Å; L439-F473 HydrophobicContact CD1-CD1 4.01Å; L439-F473 HydrophobicContact CD1-CE1 3.68Å; L439-F473 HydrophobicContact CD1-CZ 4.11Å; L439-F580 HydrophobicContact CD2-CD1 4.42Å; L439-F580 HydrophobicContact CD2-CE1 4.43Å; L439-L581 HydrophobicContact CD1-CD1 4.5Å; L439-L581 HydrophobicContact CD1-CG 4.24Å; L439-L581 HydrophobicContact CD2-CB 3.81Å; L439-L581 HydrophobicContact CD2-CD1 4.01Å; L439-L581 HydrophobicContact CD2-CG 3.75Å; L439-F640 HydrophobicContact CD1-CD1 4.27Å; L439-F640 HydrophobicContact CD1-CE1 4.4Å
440	E	94.7	Very high	87.4	Confident	2 Å²	2	26 Å²	26	1%	0.009	18%	0.177	C	C	.	.	H	α-helix	trans	-64	-43.1	173.6	-71.1	-165.7	-162.4	0	0	112.6	Q436 A437 M442 F443 S444 V445 L462 W466 H472 F473 W478	Q436-E440 WeakPolarHBondContact O-CG 3.37Å; Q436-E440 PolarHBondContact O-N 2.96Å; A437-E440 PolarHBondContact O-N 3.22Å; E440-M442 VanDerWaalsContact C-N 3.27Å; E440-M442 PolarHBondContact O-N 3.31Å; E440-F443 PolarHBondContact O-N 3.01Å; E440-S444 WeakPolarHBondContact O-CA 2.99Å; E440-S444 WeakPolarHBondContact O-CB 3.49Å; E440-S444 PolarHBondContact O-N 3.47Å; E440-V445 PolarHBondContact O-N 3.14Å; E440-V445 VanDerWaalsContact O-N 3.15Å; E440-L462 HydrophobicContact CB-CD1 3.81Å; E440-W466 PolarHBondContact OE2-NE1 3.04Å; E440-H472 WeakPolarHBondContact OE1-CA 3.45Å; E440-F473 HydrophobicContact CG-CB 3.75Å; E440-F473 HydrophobicContact CG-CD2 4.48Å; E440-F473 PolarHBondContact OE1-N 2.9Å; E440-W478 HydrophobicContact CG-CZ2 3.94Å; E440-W478 PolarHBondContact OE1-NE1 3.38Å
441	L	94.1	Very high	85.5	Confident	1 Å²	1	29.5 Å²	29.5	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-57.2	-42.9	175.5	-172.3	80.2	0	0	0	111.3	A437 L438 V445 L455 K458 R459 L462 L568 D570	A437-L441 VanDerWaalsContact O-CB 3.23Å; A437-L441 WeakPolarHBondContact O-CB 3.29Å; A437-L441 PolarHBondContact O-N 3.04Å; L438-L441 PolarHBondContact O-N 3.02Å; L441-V445 HydrophobicContact CD1-CG2 4.48Å; L441-L455 HydrophobicContact CD2-CD1 4.3Å; L441-K458 HydrophobicContact CD1-CB 3.72Å; L441-R459 HydrophobicContact CD1-CG 4.46Å; L441-L462 HydrophobicContact CB-CD2 4.15Å; L441-L462 HydrophobicContact CD1-CD2 4.07Å; L441-L568 HydrophobicContact CD2-CB 4.13Å; L441-D570 HydrophobicContact CD2-CB 4.48Å
442	M	93	Very high	84	Confident	11 Å²	11	33.4 Å²	33.4	5%	0.054	22%	0.224	C	C	.	.	H	α-helix	trans	-76.7	-34.4	-175.1	-74.1	-178.5	-169.5	0	0	113.6	L415 L438 L439 E440 Y569 L571 K577 F580	L415-M442 HydrophobicContact CD1-CE 4.41Å; L438-M442 HydrophobicContact CD2-CE 4.36Å; L438-M442 WeakPolarHBondContact O-CB 3.44Å; L438-M442 WeakPolarHBondContact O-CG 3.43Å; L438-M442 PolarHBondContact O-N 3.39Å; L439-M442 PolarHBondContact O-N 3.17Å; E440-M442 VanDerWaalsContact C-N 3.27Å; E440-M442 PolarHBondContact O-N 3.31Å; M442-Y569 WeakPolarHBondContact CE-O 3.36Å; M442-L571 HydrophobicContact CE-CD1 3.89Å; M442-L571 HydrophobicContact CE-CG 3.81Å; M442-L571 HydrophobicContact SD-CD1 4.28Å; M442-K577 HydrophobicContact CB-CD 4.17Å; M442-K577 HydrophobicContact CB-CG 4.37Å; M442-K577 HydrophobicContact CG-CG 4.38Å; M442-K577 PolarHBondContact O-NZ 2.84Å; M442-K577 VanDerWaalsContact O-NZ 3.1Å; M442-K577 HydrophobicContact SD-CB 4.43Å; M442-K577 HydrophobicContact SD-CG 4.25Å; M442-F580 HydrophobicContact CE-CD1 3.57Å; M442-F580 HydrophobicContact CE-CE1 3.74Å; M442-F580 HydrophobicContact CE-CG 4.17Å; M442-F580 HydrophobicContact CE-CZ 4.46Å; M442-F580 HydrophobicContact SD-CD1 3.52Å; M442-F580 VanDerWaalsContact SD-CD1 3.52Å; M442-F580 HydrophobicContact SD-CE1 4.06Å; M442-F580 HydrophobicContact SD-CG 4.33Å
443	F	91.9	Very high	82.8	Confident	34 Å²	34	34.4 Å²	34.4	15%	0.149	23%	0.23	C	C	.	.	H	α-helix	trans	-123.6	-22.7	-167.4	-65.5	-75.4	0	0	0	115.8	L439 E440 K577 L581 F647 L648	L439-F443 HydrophobicContact CD2-CE2 4.22Å; L439-F443 WeakPolarHBondContact O-CB 3.25Å; L439-F443 WeakPolarHBondContact O-CD2 3.38Å; L439-F443 PolarHBondContact O-N 3.11Å; E440-F443 PolarHBondContact O-N 3.01Å; F443-K577 HydrophobicContact CE1-CB 4.03Å; F443-K577 HydrophobicContact CE2-CB 4.22Å; F443-K577 HydrophobicContact CZ-CB 3.58Å; F443-L581 HydrophobicContact CD2-CD1 4.29Å; F443-L581 HydrophobicContact CE2-CB 4.23Å; F443-L581 HydrophobicContact CE2-CD1 3.69Å; F443-L581 HydrophobicContact CZ-CD1 4.09Å; F443-F647 HydrophobicContact CB-CB 4.16Å; F443-F647 HydrophobicContact CB-CD1 3.88Å; F443-F647 HydrophobicContact CB-CD2 4.16Å; F443-F647 HydrophobicContact CB-CE1 4.29Å; F443-F647 HydrophobicContact CB-CG 3.79Å; F443-F647 HydrophobicContact CD1-CB 3.76Å; F443-F647 HydrophobicContact CD1-CG 4.33Å; F443-F647 HydrophobicContact CE1-CB 4.42Å; F443-F647 HydrophobicContact CG-CB 4.13Å; F443-F647 HydrophobicContact CG-CG 4.26Å; F443-F647 WeakPolarHBondContact O-CE1 3.36Å; F443-L648 HydrophobicContact CE1-CD2 4.38Å; F443-L648 HydrophobicContact CZ-CD2 4.28Å
444	S	90.1	Very high	82.3	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.3	-17.5	-170.1	-54.5	0	0	0	0	114.2	E440 P446 W478 W481 S482 F647	E440-S444 WeakPolarHBondContact O-CA 2.99Å; E440-S444 WeakPolarHBondContact O-CB 3.49Å; E440-S444 PolarHBondContact O-N 3.47Å; S444-P446 WeakPolarHBondContact O-CD 3.32Å; S444-W478 WeakPolarHBondContact OG-CH2 3.31Å; S444-W478 WeakPolarHBondContact OG-CZ2 3.3Å; S444-W481 VanDerWaalsContact CB-NE1 3.33Å; S444-W481 PolarHBondContact O-NE1 3.42Å; S444-S482 VanDerWaalsContact O-CB 3.26Å; S444-S482 WeakPolarHBondContact O-CB 3.2Å; S444-S482 PolarHBondContact O-N 2.91Å; S444-S482 VanDerWaalsContact O-N 3.15Å; S444-F647 WeakPolarHBondContact OG-CZ 3.36Å
445	V	88.4	Confident	81.9	Confident	16 Å²	16	38.8 Å²	38.8	10%	0.097	26%	0.259	C	S	.	.	S	Bend	trans	-66.2	123.7	172.6	179.1	0	0	0	0	110.3	E440 L441 P453 K458 M461 W481	E440-V445 PolarHBondContact O-N 3.14Å; E440-V445 VanDerWaalsContact O-N 3.15Å; L441-V445 HydrophobicContact CD1-CG2 4.48Å; V445-P453 HydrophobicContact CG1-CG 4.44Å; V445-K458 HydrophobicContact CG1-CB 4.32Å; V445-K458 HydrophobicContact CG1-CG 4.02Å; V445-M461 HydrophobicContact CG1-CB 4.36Å; V445-M461 HydrophobicContact CG1-SD 3.96Å; V445-W481 HydrophobicContact CB-CZ2 4.39Å; V445-W481 HydrophobicContact CG2-CH2 4.17Å; V445-W481 HydrophobicContact CG2-CZ2 3.77Å
446	P	80.2	Confident	81.4	Confident	57 Å²	57	42.2 Å²	42.2	37%	0.37	28%	0.283	S	S	.	.			trans	-62.7	138.4	178.4	-20.7	31.4	0	0	0	113.3	S444 W481	S444-P446 WeakPolarHBondContact O-CD 3.32Å; P446-W481 HydrophobicContact CG-CE3 4.18Å; P446-W481 HydrophobicContact CG-CZ3 4.47Å
447	G	70.5	Confident	81.1	Confident	56 Å²	56	43.3 Å²	43.3	58%	0.577	29%	0.292	S	S	*	.			trans	161.4	139.8	174.5	0	0	0	0	0	112
448	S	51.5	Low	80.9	Confident	90 Å²	90	44 Å²	44	63%	0.629	30%	0.295	S	S	*	.			trans	-132.6	127.6	-177.9	63.4	0	0	0	0	112.7	V450 D451	S448-V450 PolarHBondContact O-N 3.03Å; S448-D451 PolarHBondContact O-N 3.42Å
449	G	59.3	Low	80.7	Confident	62 Å²	62	45.6 Å²	45.6	64%	0.639	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	62.3	-119.8	165.4	0	0	0	0	0	114.2	D451 T452	G449-D451 PolarHBondContact O-N 3.49Å; G449-T452 PolarHBondContact O-N 3.23Å; G449-T452 PolarHBondContact O-OG1 3.36Å
450	V	54.4	Low	80.5	Confident	152 Å²	152	51.6 Å²	51.6	92%	0.921	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-64.6	-24.4	-175.9	-174.5	0	0	0	0	111.9	S448 T452	S448-V450 PolarHBondContact O-N 3.03Å; V450-T452 VanDerWaalsContact C-N 3.34Å; V450-T452 PolarHBondContact O-N 2.98Å
451	D	56.2	Low	80.3	Confident	130 Å²	130	55.4 Å²	55.4	70%	0.695	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-95.9	25.7	178.8	-59.9	-37.9	0	0	0	112.6	S448 G449 P453	S448-D451 PolarHBondContact O-N 3.42Å; G449-D451 PolarHBondContact O-N 3.49Å; D451-P453 WeakPolarHBondContact O-CD 3.5Å
452	T	66.2	Low	80.2	Confident	82 Å²	82	55.3 Å²	55.3	50%	0.503	35%	0.347	S	S	.	.			trans	-61	115.6	175.8	-54.6	0	0	0	0	108.5	G449 V450	G449-T452 PolarHBondContact O-N 3.23Å; G449-T452 PolarHBondContact O-OG1 3.36Å; V450-T452 VanDerWaalsContact C-N 3.34Å; V450-T452 PolarHBondContact O-N 2.98Å
453	P	72	Confident	80.1	Confident	24 Å²	24	58.9 Å²	58.9	16%	0.156	36%	0.364	C	S	.	.			trans	-61.6	145.5	-174.9	17.8	-26.2	0	0	0	110.6	V445 D451 A457 K458 M461	V445-P453 HydrophobicContact CG1-CG 4.44Å; D451-P453 WeakPolarHBondContact O-CD 3.5Å; P453-A457 HydrophobicContact CB-CB 3.86Å; P453-K458 HydrophobicContact CB-CG 4.02Å; P453-K458 HydrophobicContact CG-CD 4.42Å; P453-K458 HydrophobicContact CG-CG 3.68Å; P453-K458 WeakPolarHBondContact O-CE 3.37Å; P453-M461 HydrophobicContact CB-CE 4.37Å; P453-M461 HydrophobicContact CG-SD 4.44Å
454	S	85	Confident	80	Confident	68 Å²	68	59.9 Å²	59.9	48%	0.476	38%	0.378	S	S	.	.			trans	-56.6	157.5	172	66.4	0	0	0	0	110.3	S456 A457 K458	S454-S456 PolarHBondContact O-N 2.78Å; S454-S456 PolarHBondContact OG-OG 3.43Å; S454-A457 PolarHBondContact O-N 3.26Å; S454-A457 WeakPolarHBondContact OG-CB 3.39Å; S454-A457 PolarHBondContact OG-N 3.16Å; S454-K458 PolarHBondContact O-N 2.79Å
455	L	88.8	Confident	79.9	Confident	29 Å²	29	63.5 Å²	63.5	15%	0.152	39%	0.392	C	S	.	.	H	α-helix	trans	-53.8	-41.5	177.8	-179.4	64.6	0	0	0	112	F391 L441 A457 K458 R459 Y569 D570	F391-L455 HydrophobicContact CD1-CD2 4.08Å; F391-L455 HydrophobicContact CE1-CB 4.33Å; F391-L455 HydrophobicContact CE1-CD2 3.61Å; F391-L455 HydrophobicContact CE2-CD2 4.12Å; F391-L455 HydrophobicContact CZ-CB 4.02Å; F391-L455 HydrophobicContact CZ-CD2 3.64Å; F391-L455 HydrophobicContact CZ-CG 4.37Å; L441-L455 HydrophobicContact CD2-CD1 4.3Å; L455-A457 PolarHBondContact O-N 2.93Å; L455-K458 PolarHBondContact O-N 3.4Å; L455-R459 WeakPolarHBondContact O-CG 3.4Å; L455-R459 PolarHBondContact O-N 3.05Å; L455-Y569 HydrophobicContact CD2-CD1 3.51Å; L455-Y569 HydrophobicContact CD2-CE1 3.82Å; L455-Y569 HydrophobicContact CD2-CG 4.46Å; L455-D570 HydrophobicContact CD1-CB 4.22Å
456	S	88.7	Confident	80	Confident	72 Å²	72	63 Å²	63	50%	0.503	39%	0.388	S	S	.	.	H	α-helix	trans	-61.6	-43	177.1	63.8	0	0	0	0	112.1	S454 R459 Q460	S454-S456 PolarHBondContact O-N 2.78Å; S454-S456 PolarHBondContact OG-OG 3.43Å; S456-R459 PolarHBondContact O-N 2.98Å; S456-Q460 WeakPolarHBondContact O-CG 3.38Å; S456-Q460 PolarHBondContact O-N 3.01Å
457	A	89.3	Confident	80.1	Confident	22 Å²	22	63.8 Å²	63.8	18%	0.182	40%	0.399	C	S	.	.	H	α-helix	trans	-66.5	-39.6	176.7	0	0	0	0	0	111.4	P453 S454 L455 R459 Q460 M461	P453-A457 HydrophobicContact CB-CB 3.86Å; S454-A457 PolarHBondContact O-N 3.26Å; S454-A457 WeakPolarHBondContact OG-CB 3.39Å; S454-A457 PolarHBondContact OG-N 3.16Å; L455-A457 PolarHBondContact O-N 2.93Å; A457-R459 PolarHBondContact O-N 3.48Å; A457-Q460 PolarHBondContact O-N 3.31Å; A457-M461 WeakPolarHBondContact O-CB 3.5Å; A457-M461 VanDerWaalsContact O-CG 3.23Å; A457-M461 WeakPolarHBondContact O-CG 3.36Å; A457-M461 PolarHBondContact O-N 3.23Å
458	K	91	Very high	80.4	Confident	16 Å²	16	67.2 Å²	67.2	7%	0.07	40%	0.404	C	S	.	.	H	α-helix	trans	-60.9	-44.2	174.9	-70	-169.4	178	-166.2	0	112.5	L441 V445 P453 S454 L455 M461 L462 D570	L441-K458 HydrophobicContact CD1-CB 3.72Å; V445-K458 HydrophobicContact CG1-CB 4.32Å; V445-K458 HydrophobicContact CG1-CG 4.02Å; P453-K458 HydrophobicContact CB-CG 4.02Å; P453-K458 HydrophobicContact CG-CD 4.42Å; P453-K458 HydrophobicContact CG-CG 3.68Å; P453-K458 WeakPolarHBondContact O-CE 3.37Å; S454-K458 PolarHBondContact O-N 2.79Å; L455-K458 PolarHBondContact O-N 3.4Å; K458-M461 PolarHBondContact O-N 3.02Å; K458-L462 WeakPolarHBondContact O-CB 3.46Å; K458-L462 PolarHBondContact O-N 3.23Å; K458-D570 IonicContact NZ-OD2 2.66Å; K458-D570 PolarHBondContact NZ-OD2 2.86Å
459	R	92.9	Very high	81.5	Confident	34 Å²	34	64.6 Å²	64.6	13%	0.128	39%	0.385	C	S	.	.	H	α-helix	trans	-62.1	-47.1	176.6	-72.7	-178.2	-178.9	-174.7	-0.3	111.4	L441 L455 S456 A457 M461 L462 E463 E565 L568	L441-R459 HydrophobicContact CD1-CG 4.46Å; L455-R459 WeakPolarHBondContact O-CG 3.4Å; L455-R459 PolarHBondContact O-N 3.05Å; S456-R459 PolarHBondContact O-N 2.98Å; A457-R459 PolarHBondContact O-N 3.48Å; R459-M461 PolarHBondContact O-N 3.15Å; R459-L462 PolarHBondContact O-N 3.37Å; R459-E463 WeakPolarHBondContact O-CB 3.32Å; R459-E463 PolarHBondContact O-N 2.92Å; R459-E565 IonicContact NH1-OE1 3.28Å; R459-E565 PolarHBondContact NH2-O 2.88Å; R459-L568 HydrophobicContact CG-CB 4.45Å; R459-L568 PolarHBondContact NE-O 3.44Å; R459-L568 PolarHBondContact NH2-O 3.46Å
460	Q	92	Very high	82.1	Confident	126 Å²	126	66.7 Å²	66.7	59%	0.589	38%	0.376	S	S	*	.	H	α-helix	trans	-61.7	-41.2	177.4	-72.8	172.8	-1.5	0	0	112.8	S456 A457 L462 A464	S456-Q460 WeakPolarHBondContact O-CG 3.38Å; S456-Q460 PolarHBondContact O-N 3.01Å; A457-Q460 PolarHBondContact O-N 3.31Å; Q460-L462 VanDerWaalsContact C-N 3.34Å; Q460-A464 WeakPolarHBondContact O-CB 3.24Å; Q460-A464 PolarHBondContact O-N 3.05Å
461	M	90.2	Very high	83.7	Confident	81 Å²	81	63.3 Å²	63.3	40%	0.399	35%	0.352	S	S	.	.	H	α-helix	trans	-63.6	-42.6	175.4	-71.9	174.5	-176.3	0	0	111.3	V445 P453 A457 K458 R459 R465 W481	V445-M461 HydrophobicContact CG1-CB 4.36Å; V445-M461 HydrophobicContact CG1-SD 3.96Å; P453-M461 HydrophobicContact CB-CE 4.37Å; P453-M461 HydrophobicContact CG-SD 4.44Å; A457-M461 WeakPolarHBondContact O-CB 3.5Å; A457-M461 VanDerWaalsContact O-CG 3.23Å; A457-M461 WeakPolarHBondContact O-CG 3.36Å; A457-M461 PolarHBondContact O-N 3.23Å; K458-M461 PolarHBondContact O-N 3.02Å; R459-M461 PolarHBondContact O-N 3.15Å; M461-R465 WeakPolarHBondContact O-CB 3.46Å; M461-R465 PolarHBondContact O-N 2.76Å; M461-W481 HydrophobicContact CB-CH2 4.04Å; M461-W481 HydrophobicContact CB-CZ3 4.44Å; M461-W481 WeakPolarHBondContact O-CH2 3.36Å
462	L	91.8	Very high	85.3	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-66.2	-45.6	178.9	-174.5	67.7	0	0	0	111.4	A437 E440 L441 K458 R459 Q460 R465 W466 W481 F561 L568	A437-L462 HydrophobicContact CB-CD2 4.46Å; E440-L462 HydrophobicContact CB-CD1 3.81Å; L441-L462 HydrophobicContact CB-CD2 4.15Å; L441-L462 HydrophobicContact CD1-CD2 4.07Å; K458-L462 WeakPolarHBondContact O-CB 3.46Å; K458-L462 PolarHBondContact O-N 3.23Å; R459-L462 PolarHBondContact O-N 3.37Å; Q460-L462 VanDerWaalsContact C-N 3.34Å; L462-R465 WeakPolarHBondContact O-CB 3.36Å; L462-R465 PolarHBondContact O-N 2.96Å; L462-R465 VanDerWaalsContact O-N 3.16Å; L462-W466 VanDerWaalsContact O-CD1 3.24Å; L462-W466 PolarHBondContact O-N 2.69Å; L462-W481 HydrophobicContact CD1-CZ2 3.91Å; L462-F561 HydrophobicContact CB-CE2 4.41Å; L462-F561 HydrophobicContact CD2-CE2 4Å; L462-F561 HydrophobicContact CG-CE2 4.05Å; L462-L568 HydrophobicContact CD2-CD1 4.09Å
463	E	92.4	Very high	86.6	Confident	86 Å²	86	53.4 Å²	53.4	40%	0.402	30%	0.296	S	S	.	.	H	α-helix	trans	-57.7	-50.3	176	-173.8	-178.9	-174.9	0	0	111.3	R459 R465 W466 A467 F561	R459-E463 WeakPolarHBondContact O-CB 3.32Å; R459-E463 PolarHBondContact O-N 2.92Å; E463-R465 VanDerWaalsContact C-N 3.26Å; E463-R465 PolarHBondContact O-N 2.72Å; E463-W466 PolarHBondContact O-N 2.94Å; E463-A467 PolarHBondContact O-N 3.36Å; E463-F561 HydrophobicContact CB-CD1 3.98Å; E463-F561 HydrophobicContact CB-CE1 3.61Å; E463-F561 HydrophobicContact CB-CE2 4.19Å; E463-F561 HydrophobicContact CB-CG 4.41Å; E463-F561 HydrophobicContact CB-CZ 3.73Å; E463-F561 HydrophobicContact CG-CD1 3.71Å; E463-F561 HydrophobicContact CG-CE1 3.83Å; E463-F561 HydrophobicContact CG-CG 4.19Å; E463-F561 HydrophobicContact CG-CZ 4.39Å
464	A	89.7	Confident	87.6	Confident	54 Å²	54	52.3 Å²	52.3	45%	0.446	29%	0.289	S	S	.	.	H	α-helix	trans	-59.2	-39.2	176.2	0	0	0	0	0	111.7	Q460 A467 D468	Q460-A464 WeakPolarHBondContact O-CB 3.24Å; Q460-A464 PolarHBondContact O-N 3.05Å; A464-A467 PolarHBondContact O-N 3.15Å; A464-D468 PolarHBondContact O-N 3.17Å
465	R	87.9	Confident	87.9	Confident	77 Å²	77	50 Å²	50	29%	0.291	27%	0.271	S	S	.	.	H	α-helix	trans	-65.9	-42.6	176.9	177	59	179.3	-179.6	0.7	112.3	M461 L462 E463 A467 D468 T469 W481	M461-R465 WeakPolarHBondContact O-CB 3.46Å; M461-R465 PolarHBondContact O-N 2.76Å; L462-R465 WeakPolarHBondContact O-CB 3.36Å; L462-R465 PolarHBondContact O-N 2.96Å; L462-R465 VanDerWaalsContact O-N 3.16Å; E463-R465 VanDerWaalsContact C-N 3.26Å; E463-R465 PolarHBondContact O-N 2.72Å; R465-A467 VanDerWaalsContact C-N 3.29Å; R465-D468 PolarHBondContact O-N 3.18Å; R465-T469 PolarHBondContact NE-OG1 2.96Å; R465-T469 VanDerWaalsContact NE-OG1 3.16Å; R465-T469 PolarHBondContact O-N 3.35Å; R465-T469 PolarHBondContact O-OG1 2.93Å; R465-T469 VanDerWaalsContact O-OG1 3.05Å; R465-W481 HydrophobicContact CB-CD2 4.42Å; R465-W481 HydrophobicContact CB-CE3 4.11Å; R465-W481 HydrophobicContact CB-CH2 3.69Å; R465-W481 HydrophobicContact CB-CZ2 4.01Å; R465-W481 HydrophobicContact CB-CZ3 3.73Å; R465-W481 HydrophobicContact CG-CD2 3.84Å; R465-W481 HydrophobicContact CG-CE3 3.92Å; R465-W481 HydrophobicContact CG-CG 4.37Å; R465-W481 HydrophobicContact CG-CH2 4.14Å; R465-W481 HydrophobicContact CG-CZ2 4.06Å; R465-W481 HydrophobicContact CG-CZ3 4.06Å
466	W	89.8	Confident	87.8	Confident	6 Å²	6	51.4 Å²	51.4	2%	0.023	28%	0.276	C	S	.	.	H	α-helix	trans	-69	-30.9	179.6	-78.2	32.6	0	0	0	111.7	R433 A437 E440 L462 E463 D468 H472 F561 I564	R433-W466 HydrophobicContact CG-CH2 4.04Å; R433-W466 HydrophobicContact CG-CZ3 3.96Å; A437-W466 HydrophobicContact CB-CH2 3.57Å; A437-W466 HydrophobicContact CB-CZ2 3.69Å; A437-W466 HydrophobicContact CB-CZ3 4.45Å; E440-W466 PolarHBondContact OE2-NE1 3.04Å; L462-W466 VanDerWaalsContact O-CD1 3.24Å; L462-W466 PolarHBondContact O-N 2.69Å; E463-W466 PolarHBondContact O-N 2.94Å; W466-D468 VanDerWaalsContact C-N 3.33Å; W466-H472 AromaticContact CD2-CD2 3.54Å; W466-H472 AromaticContact CD2-NE2 3.63Å; W466-H472 AromaticContact CE2-CD2 3.35Å; W466-H472 AromaticContact CE2-NE2 3.96Å; W466-H472 AromaticContact CE3-CD2 3.85Å; W466-H472 AromaticContact CE3-NE2 3.71Å; W466-H472 AromaticContact CH2-CD2 3.76Å; W466-H472 AromaticContact CZ2-CD2 3.45Å; W466-H472 VanDerWaalsContact CZ2-CD2 3.45Å; W466-H472 WeakPolarHBondContact CZ2-CD2 3.43Å; W466-H472 AromaticContact CZ3-CD2 3.97Å; W466-H472 AromaticContact NE1-CD2 3.78Å; W466-F561 HydrophobicContact CD2-CD2 4.35Å; W466-F561 HydrophobicContact CE3-CD2 4.05Å; W466-I564 HydrophobicContact CH2-CD1 3.89Å; W466-I564 HydrophobicContact CZ3-CD1 3.65Å
467	A	83.4	Confident	87.7	Confident	73 Å²	73	50.1 Å²	50.1	60%	0.603	27%	0.274	S	S	*	.	H	α-helix	trans	-65.9	-33.7	169.7	0	0	0	0	0	113	E463 A464 R465	E463-A467 PolarHBondContact O-N 3.36Å; A464-A467 PolarHBondContact O-N 3.15Å; R465-A467 VanDerWaalsContact C-N 3.29Å
468	D	76.5	Confident	87.7	Confident	127 Å²	127	49.9 Å²	49.9	68%	0.679	27%	0.269	S	S	*	.	H	α-helix	trans	-85.8	-28.5	-179.1	-76	-16.6	0	0	0	113.8	A464 R465 W466	A464-D468 PolarHBondContact O-N 3.17Å; R465-D468 PolarHBondContact O-N 3.18Å; W466-D468 VanDerWaalsContact C-N 3.33Å
469	T	73.8	Confident	87.4	Confident	36 Å²	36	54.5 Å²	54.5	22%	0.221	29%	0.289	C	S	.	.			trans	-134.6	128.7	-175.4	61.9	0	0	0	0	113.3	R465	R465-T469 PolarHBondContact NE-OG1 2.96Å; R465-T469 VanDerWaalsContact NE-OG1 3.16Å; R465-T469 PolarHBondContact O-N 3.35Å; R465-T469 PolarHBondContact O-OG1 2.93Å; R465-T469 VanDerWaalsContact O-OG1 3.05Å
470	F	73.1	Confident	86.9	Confident	106 Å²	106	53.1 Å²	53.1	47%	0.465	29%	0.285	S	S	.	.			trans	-86.9	-3.6	-177.5	-50.8	-62.9	0	0	0	115.2	H472 S547	F470-H472 VanDerWaalsContact C-CE1 3.42Å; F470-H472 PolarHBondContact O-CE1 3.43Å; F470-H472 PolarHBondContact O-ND1 3.18Å; F470-H472 VanDerWaalsContact O-ND1 3.09Å; F470-S547 VanDerWaalsContact CD1-CB 3.44Å; F470-S547 VanDerWaalsContact CE1-CB 3.46Å
471	L	86.7	Confident	86.6	Confident	80 Å²	80	49.2 Å²	49.2	42%	0.419	26%	0.264	S	S	.	.			trans	-97.4	135.8	178.2	-65.3	176.9	0	0	0	110.3	E475	L471-E475 WeakPolarHBondContact CA-OE2 3.45Å
472	H	91.1	Very high	86	Confident	5 Å²	5	47.5 Å²	47.5	2%	0.023	26%	0.261	C	S	.	.			trans	-124.4	166.6	-175.1	-50.7	83.9	0	0	0	112.3	R433 Q436 E440 W466 F470 G474 E475 W478	R433-H472 PolarHBondContact NH1-CE1 2.7Å; R433-H472 PolarHBondContact NH1-ND1 3.07Å; R433-H472 PolarHBondContact NH1-NE2 3.31Å; Q436-H472 HydrophobicContact CB-CB 4.39Å; E440-H472 WeakPolarHBondContact OE1-CA 3.45Å; W466-H472 AromaticContact CD2-CD2 3.54Å; W466-H472 AromaticContact CD2-NE2 3.63Å; W466-H472 AromaticContact CE2-CD2 3.35Å; W466-H472 AromaticContact CE2-NE2 3.96Å; W466-H472 AromaticContact CE3-CD2 3.85Å; W466-H472 AromaticContact CE3-NE2 3.71Å; W466-H472 AromaticContact CH2-CD2 3.76Å; W466-H472 AromaticContact CZ2-CD2 3.45Å; W466-H472 VanDerWaalsContact CZ2-CD2 3.45Å; W466-H472 WeakPolarHBondContact CZ2-CD2 3.43Å; W466-H472 AromaticContact CZ3-CD2 3.97Å; W466-H472 AromaticContact NE1-CD2 3.78Å; F470-H472 VanDerWaalsContact C-CE1 3.42Å; F470-H472 PolarHBondContact O-CE1 3.43Å; F470-H472 PolarHBondContact O-ND1 3.18Å; F470-H472 VanDerWaalsContact O-ND1 3.09Å; H472-G474 PolarHBondContact O-N 2.56Å; H472-E475 IonicContact CG-OE1 3.23Å; H472-E475 PolarHBondContact N-OE2 2.92Å; H472-E475 IonicContact ND1-OE1 3.1Å; H472-E475 PolarHBondContact ND1-OE1 3.36Å; H472-E475 IonicContact ND1-OE2 2.91Å; H472-E475 PolarHBondContact ND1-OE2 3.46Å; H472-E475 VanDerWaalsContact O-CB 3.25Å; H472-E475 WeakPolarHBondContact O-CB 3.28Å; H472-E475 PolarHBondContact O-N 3.03Å; H472-W478 VanDerWaalsContact CA-CD1 3.44Å; H472-W478 VanDerWaalsContact O-CB 3.31Å; H472-W478 WeakPolarHBondContact O-CB 3.37Å
473	F	93.3	Very high	84.8	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	139	176.5	-167.8	-75.3	0	0	0	111	Q436 L439 E440 E475 W478 F640 H643 S644 F647	Q436-F473 HydrophobicContact CB-CB 4.43Å; Q436-F473 WeakPolarHBondContact CG-O 3.35Å; Q436-F473 PolarHBondContact NE2-O 2.92Å; L439-F473 HydrophobicContact CB-CD1 4.44Å; L439-F473 HydrophobicContact CB-CD2 4.36Å; L439-F473 HydrophobicContact CB-CE2 4.43Å; L439-F473 HydrophobicContact CB-CG 4.37Å; L439-F473 HydrophobicContact CD1-CD1 4.01Å; L439-F473 HydrophobicContact CD1-CE1 3.68Å; L439-F473 HydrophobicContact CD1-CZ 4.11Å; E440-F473 HydrophobicContact CG-CB 3.75Å; E440-F473 HydrophobicContact CG-CD2 4.48Å; E440-F473 PolarHBondContact OE1-N 2.9Å; F473-E475 VanDerWaalsContact C-N 3.27Å; F473-E475 PolarHBondContact O-N 3.41Å; F473-W478 HydrophobicContact CB-CZ2 4.24Å; F473-W478 HydrophobicContact CD2-CE3 4.42Å; F473-W478 AromaticContact CD2-CH2 3.39Å; F473-W478 HydrophobicContact CD2-CH2 3.39Å; F473-W478 AromaticContact CD2-CZ2 3.79Å; F473-W478 HydrophobicContact CD2-CZ2 3.79Å; F473-W478 AromaticContact CD2-CZ3 3.76Å; F473-W478 HydrophobicContact CD2-CZ3 3.76Å; F473-W478 AromaticContact CE2-CH2 3.94Å; F473-W478 HydrophobicContact CE2-CH2 3.94Å; F473-W478 HydrophobicContact CE2-CZ3 4.11Å; F473-W478 HydrophobicContact CG-CH2 4.37Å; F473-W478 HydrophobicContact CG-CZ2 4.48Å; F473-F640 AromaticContact CD1-CD1 3.56Å; F473-F640 HydrophobicContact CD1-CD1 3.56Å; F473-F640 AromaticContact CD1-CE1 3.72Å; F473-F640 HydrophobicContact CD1-CE1 3.72Å; F473-F640 HydrophobicContact CD1-CG 4.49Å; F473-F640 AromaticContact CE1-CD1 3.57Å; F473-F640 HydrophobicContact CE1-CD1 3.57Å; F473-F640 HydrophobicContact CE1-CE1 4.18Å; F473-F640 HydrophobicContact CE1-CG 4.38Å; F473-H643 HydrophobicContact CD1-CB 4.36Å; F473-H643 HydrophobicContact CD2-CB 4.21Å; F473-H643 HydrophobicContact CE1-CB 3.87Å; F473-H643 HydrophobicContact CE2-CB 3.73Å; F473-H643 HydrophobicContact CZ-CB 3.55Å; F473-S644 WeakPolarHBondContact CZ-OG 2.94Å; F473-F647 HydrophobicContact CE2-CD2 4.24Å; F473-F647 AromaticContact CE2-CE2 3.83Å; F473-F647 HydrophobicContact CE2-CE2 3.83Å
474	G	92.4	Very high	83.1	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.4	-0.3	-174.6	0	0	0	0	0	115.4	H472 L639 H643	H472-G474 PolarHBondContact O-N 2.56Å; G474-L639 VanDerWaalsContact O-CB 3.28Å; G474-L639 WeakPolarHBondContact O-CB 3.46Å; G474-L639 WeakPolarHBondContact O-CD1 3.42Å; G474-H643 PolarHBondContact N-ND1 3.01Å
475	E	91.7	Very high	81.1	Confident	20 Å²	20	54.8 Å²	54.8	9%	0.093	31%	0.313	C	S	.	.	S	Bend	trans	-102	145.4	174.9	-65.1	169.5	-167.6	0	0	112.5	Q436 L471 H472 F473 G477 W478 F542 H643	Q436-E475 PolarHBondContact NE2-OE1 2.77Å; Q436-E475 VanDerWaalsContact NE2-OE1 3.09Å; L471-E475 WeakPolarHBondContact CA-OE2 3.45Å; H472-E475 IonicContact CG-OE1 3.23Å; H472-E475 PolarHBondContact N-OE2 2.92Å; H472-E475 IonicContact ND1-OE1 3.1Å; H472-E475 PolarHBondContact ND1-OE1 3.36Å; H472-E475 IonicContact ND1-OE2 2.91Å; H472-E475 PolarHBondContact ND1-OE2 3.46Å; H472-E475 VanDerWaalsContact O-CB 3.25Å; H472-E475 WeakPolarHBondContact O-CB 3.28Å; H472-E475 PolarHBondContact O-N 3.03Å; F473-E475 VanDerWaalsContact C-N 3.27Å; F473-E475 PolarHBondContact O-N 3.41Å; E475-G477 PolarHBondContact O-N 3.08Å; E475-W478 WeakPolarHBondContact O-CB 3.38Å; E475-W478 PolarHBondContact O-N 3.05Å; E475-F542 HydrophobicContact CG-CE1 3.9Å; E475-F542 HydrophobicContact CG-CZ 3.64Å; E475-H643 PolarHBondContact O-CE1 2.59Å
476	F	87.2	Confident	78.9	Confident	58 Å²	58	54.1 Å²	54.1	25%	0.254	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	132.6	-178.1	-177.5	-97.9	0	0	0	111.6	W478 S495 L639	F476-W478 VanDerWaalsContact C-N 3.31Å; F476-W478 PolarHBondContact O-N 2.91Å; F476-S495 WeakPolarHBondContact CE2-OG 3.4Å; F476-L639 HydrophobicContact CB-CD1 4.3Å; F476-L639 HydrophobicContact CD2-CD2 4.38Å
477	G	84.7	Confident	76.4	Confident	46 Å²	46	58.1 Å²	58.1	47%	0.474	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.9	-6.1	178.9	0	0	0	0	0	115.5	E475	E475-G477 PolarHBondContact O-N 3.08Å
478	W	90	Very high	74.1	Confident	16 Å²	16	64.5 Å²	64.5	6%	0.061	38%	0.375	C	S	.	.			trans	-59.8	140.7	174	177.3	91.8	0	0	0	111.9	E440 S444 H472 F473 E475 F476 H643 F647	E440-W478 HydrophobicContact CG-CZ2 3.94Å; E440-W478 PolarHBondContact OE1-NE1 3.38Å; S444-W478 WeakPolarHBondContact OG-CH2 3.31Å; S444-W478 WeakPolarHBondContact OG-CZ2 3.3Å; H472-W478 VanDerWaalsContact CA-CD1 3.44Å; H472-W478 VanDerWaalsContact O-CB 3.31Å; H472-W478 WeakPolarHBondContact O-CB 3.37Å; F473-W478 HydrophobicContact CB-CZ2 4.24Å; F473-W478 HydrophobicContact CD2-CE3 4.42Å; F473-W478 AromaticContact CD2-CH2 3.39Å; F473-W478 HydrophobicContact CD2-CH2 3.39Å; F473-W478 AromaticContact CD2-CZ2 3.79Å; F473-W478 HydrophobicContact CD2-CZ2 3.79Å; F473-W478 AromaticContact CD2-CZ3 3.76Å; F473-W478 HydrophobicContact CD2-CZ3 3.76Å; F473-W478 AromaticContact CE2-CH2 3.94Å; F473-W478 HydrophobicContact CE2-CH2 3.94Å; F473-W478 HydrophobicContact CE2-CZ3 4.11Å; F473-W478 HydrophobicContact CG-CH2 4.37Å; F473-W478 HydrophobicContact CG-CZ2 4.48Å; E475-W478 WeakPolarHBondContact O-CB 3.38Å; E475-W478 PolarHBondContact O-N 3.05Å; F476-W478 VanDerWaalsContact C-N 3.31Å; F476-W478 PolarHBondContact O-N 2.91Å; W478-H643 AromaticContact CD2-ND1 3.94Å; W478-H643 HydrophobicContact CE3-CB 4.16Å; W478-H643 AromaticContact CE3-CE1 3.85Å; W478-H643 AromaticContact CE3-CG 3.71Å; W478-H643 AromaticContact CE3-ND1 3.27Å; W478-H643 VanDerWaalsContact CE3-ND1 3.27Å; W478-H643 HydrophobicContact CZ3-CB 3.94Å; W478-H643 AromaticContact CZ3-ND1 3.92Å; W478-F647 AromaticContact CH2-CE2 3.74Å; W478-F647 HydrophobicContact CH2-CE2 3.74Å; W478-F647 AromaticContact CH2-CZ 3.64Å; W478-F647 HydrophobicContact CH2-CZ 3.64Å; W478-F647 AromaticContact CZ3-CE2 3.99Å; W478-F647 HydrophobicContact CZ3-CE2 3.99Å; W478-F647 HydrophobicContact CZ3-CZ 4.13Å
479	K	84.4	Confident	72.2	Confident	113 Å²	113	65.8 Å²	65.8	49%	0.491	38%	0.377	S	S	.	.			trans	-131.4	141.8	178.6	-69.1	-175.7	178.3	-175.6	0	110.6	W481	K479-W481 PolarHBondContact O-N 3.33Å
480	S	83.9	Confident	70.5	Confident	6 Å²	6	71.7 Å²	71.7	4%	0.042	41%	0.407	C	S	.	.			trans	-64.4	122.1	176	-167.6	0	0	0	0	112.3	S482 K483 A484 F647	S480-S482 PolarHBondContact OG-OG 3.07Å; S480-K483 PolarHBondContact O-N 3.27Å; S480-A484 WeakPolarHBondContact O-CB 3.46Å; S480-A484 PolarHBondContact O-N 3.1Å; S480-F647 VanDerWaalsContact CB-CZ 3.48Å; S480-F647 WeakPolarHBondContact OG-CE1 3.44Å; S480-F647 WeakPolarHBondContact OG-CZ 3.32Å
481	W	85.6	Confident	69	Low	43 Å²	43	72.4 Å²	72.4	16%	0.163	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-17.5	177.2	56.4	-63.9	0	0	0	113.4	S444 V445 P446 M461 L462 R465 K479 K483	S444-W481 VanDerWaalsContact CB-NE1 3.33Å; S444-W481 PolarHBondContact O-NE1 3.42Å; V445-W481 HydrophobicContact CB-CZ2 4.39Å; V445-W481 HydrophobicContact CG2-CH2 4.17Å; V445-W481 HydrophobicContact CG2-CZ2 3.77Å; P446-W481 HydrophobicContact CG-CE3 4.18Å; P446-W481 HydrophobicContact CG-CZ3 4.47Å; M461-W481 HydrophobicContact CB-CH2 4.04Å; M461-W481 HydrophobicContact CB-CZ3 4.44Å; M461-W481 WeakPolarHBondContact O-CH2 3.36Å; L462-W481 HydrophobicContact CD1-CZ2 3.91Å; R465-W481 HydrophobicContact CB-CD2 4.42Å; R465-W481 HydrophobicContact CB-CE3 4.11Å; R465-W481 HydrophobicContact CB-CH2 3.69Å; R465-W481 HydrophobicContact CB-CZ2 4.01Å; R465-W481 HydrophobicContact CB-CZ3 3.73Å; R465-W481 HydrophobicContact CG-CD2 3.84Å; R465-W481 HydrophobicContact CG-CE3 3.92Å; R465-W481 HydrophobicContact CG-CG 4.37Å; R465-W481 HydrophobicContact CG-CH2 4.14Å; R465-W481 HydrophobicContact CG-CZ2 4.06Å; R465-W481 HydrophobicContact CG-CZ3 4.06Å; K479-W481 PolarHBondContact O-N 3.33Å; W481-K483 PolarHBondContact O-N 3.28Å
482	S	76.3	Confident	66.6	Low	46 Å²	46	74.1 Å²	74.1	32%	0.322	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-22.1	165.2	59.3	0	0	0	0	113.8	S444 S480	S444-S482 VanDerWaalsContact O-CB 3.26Å; S444-S482 WeakPolarHBondContact O-CB 3.2Å; S444-S482 PolarHBondContact O-N 2.91Å; S444-S482 VanDerWaalsContact O-N 3.15Å; S480-S482 PolarHBondContact OG-OG 3.07Å
483	K	66.4	Low	64	Low	120 Å²	120	83.2 Å²	83.2	52%	0.522	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	-14.1	-178.4	-62.7	-174.7	-176.5	176.5	0	113.7	S480 W481 A485 Q646	S480-K483 PolarHBondContact O-N 3.27Å; W481-K483 PolarHBondContact O-N 3.28Å; K483-A485 PolarHBondContact O-N 3.12Å; K483-A485 VanDerWaalsContact O-N 3.1Å; K483-Q646 PolarHBondContact NZ-O 2.92Å
484	A	56.6	Low	61.2	Low	63 Å²	63	89 Å²	89	52%	0.521	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-14.3	-172.3	0	0	0	0	0	114.5	S480 G486	S480-A484 WeakPolarHBondContact O-CB 3.46Å; S480-A484 PolarHBondContact O-N 3.1Å; A484-G486 PolarHBondContact O-N 3Å
485	A	49.2	Very low	58.6	Low	109 Å²	109	91.6 Å²	91.6	90%	0.901	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	12.2	-178.9	0	0	0	0	0	115.4	K483	K483-A485 PolarHBondContact O-N 3.12Å; K483-A485 VanDerWaalsContact O-N 3.1Å
486	G	41.4	Very low	56.3	Low	63 Å²	63	97.6 Å²	97.6	65%	0.649	57%	0.57	S	S	*	*	S	Bend	trans	-151.8	-7.4	-177.2	0	0	0	0	0	120.3	A484	A484-G486 PolarHBondContact O-N 3Å
487	C	37.1	Very low	54.3	Low	90 Å²	90	97.1 Å²	97.1	61%	0.608	57%	0.568	S	S	*	*			trans	-139.2	93.1	-174.4	-70.9	0	0	0	0	113.2	E489	C487-E489 PolarHBondContact O-N 3.05Å; C487-E489 VanDerWaalsContact O-N 3.11Å
488	E	34.5	Very low	52.6	Low	208 Å²	208	97.8 Å²	97.8	97%	0.972	57%	0.566	S	S	*	*			trans	-73.5	77.5	151.4	-72.7	-175	164.4	0	0	108.4
489	E	37.3	Very low	51.1	Low	153 Å²	153	104.7 Å²	104.7	72%	0.715	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-103.9	135.2	164.9	-76.5	-171.4	169.9	0	0	110.2	C487	C487-E489 PolarHBondContact O-N 3.05Å; C487-E489 VanDerWaalsContact O-N 3.11Å
490	D	38.4	Very low	50.7	Low	161 Å²	161	101.2 Å²	101.2	86%	0.861	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-51.1	143.2	-171.4	-72.4	-51.1	0	0	0	114.1
491	L	40.1	Very low	50.7	Low	120 Å²	120	101.2 Å²	101.2	63%	0.628	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-47.6	125.2	173	-110.8	77.4	0	0	0	110.6	K493	L491-K493 PolarHBondContact O-N 3.1Å
492	P	38.1	Very low	50.7	Low	117 Å²	117	99.4 Å²	99.4	76%	0.76	58%	0.579	S	S	*	*			trans	-63.7	108.6	169	22.3	-26.7	0	0	0	108.7
493	K	34.5	Very low	51.1	Low	195 Å²	195	101.2 Å²	101.2	85%	0.848	58%	0.581	S	S	*	*			trans	-60	136.1	169.8	-66.9	177.3	-179.8	174.8	0	108.3	L491	L491-K493 PolarHBondContact O-N 3.1Å
494	S	35	Very low	52	Low	123 Å²	123	98.6 Å²	98.6	86%	0.86	57%	0.57	S	S	*	*			trans	94	70	174.7	77	0	0	0	0	117.4
495	S	38.9	Very low	53.7	Low	54 Å²	54	95.6 Å²	95.6	38%	0.378	55%	0.545	S	S	.	.			trans	-122.9	133.1	130.7	102.6	0	0	0	0	107.2	F476 F497	F476-S495 WeakPolarHBondContact CE2-OG 3.4Å; S495-F497 PolarHBondContact O-N 3.43Å; S495-F497 VanDerWaalsContact O-N 3.1Å
496	P	42	Very low	55.6	Low	146 Å²	146	91.3 Å²	91.3	95%	0.948	51%	0.507	S	S	*	.			trans	-76.2	14.8	-179.7	32.2	-34.5	0	0	0	112.8
497	F	46.6	Very low	57.9	Low	47 Å²	47	92.1 Å²	92.1	21%	0.206	50%	0.497	C	S	.	.	S	Bend	trans	-89.1	130.3	-176.1	-165.5	-91.1	0	0	0	110.2	S495 V501 E635	S495-F497 PolarHBondContact O-N 3.43Å; S495-F497 VanDerWaalsContact O-N 3.1Å; F497-V501 HydrophobicContact CD1-CG2 4.43Å; F497-V501 HydrophobicContact CE1-CB 4.07Å; F497-V501 HydrophobicContact CE1-CG2 3.36Å; F497-V501 HydrophobicContact CZ-CB 4.26Å; F497-V501 HydrophobicContact CZ-CG1 4.27Å; F497-V501 HydrophobicContact CZ-CG2 3.85Å; F497-E635 HydrophobicContact CD2-CG 4.34Å; F497-E635 HydrophobicContact CE2-CB 4.4Å; F497-E635 HydrophobicContact CE2-CG 4.23Å
498	S	48.9	Very low	60.5	Low	61 Å²	61	90.5 Å²	90.5	43%	0.427	48%	0.48	S	S	.	.			trans	-49.1	138.7	179.1	176.9	0	0	0	0	111.4	N500	S498-N500 PolarHBondContact O-N 3.1Å
499	E	58.6	Low	63.2	Low	160 Å²	160	80.7 Å²	80.7	75%	0.748	44%	0.435	S	S	*	.	S	Bend	trans	-56.8	-11	180	-75.6	177.9	161.2	0	0	114
500	N	75.8	Confident	65.8	Low	40 Å²	40	79.4 Å²	79.4	21%	0.214	42%	0.424	C	S	.	.			trans	-140	101.8	178.3	-162.5	-20	0	0	0	111.6	S498 T502 K503 H504	S498-N500 PolarHBondContact O-N 3.1Å; N500-T502 PolarHBondContact O-N 3.44Å; N500-T502 PolarHBondContact OD1-N 3.4Å; N500-K503 HydrophobicContact CB-CB 4.2Å; N500-K503 HydrophobicContact CB-CD 4.24Å; N500-K503 HydrophobicContact CB-CG 4.18Å; N500-K503 PolarHBondContact O-N 3.11Å; N500-H504 PolarHBondContact O-N 3.08Å
501	V	83.4	Confident	68.3	Low	7 Å²	7	78 Å²	78	4%	0.042	41%	0.412	C	S	.	.	H	α-helix	trans	-50.2	-44.3	176.9	178.3	0	0	0	0	110.1	F497 H504 L505 V636	F497-V501 HydrophobicContact CD1-CG2 4.43Å; F497-V501 HydrophobicContact CE1-CB 4.07Å; F497-V501 HydrophobicContact CE1-CG2 3.36Å; F497-V501 HydrophobicContact CZ-CB 4.26Å; F497-V501 HydrophobicContact CZ-CG1 4.27Å; F497-V501 HydrophobicContact CZ-CG2 3.85Å; V501-H504 WeakPolarHBondContact O-CB 3.41Å; V501-H504 PolarHBondContact O-N 2.99Å; V501-L505 HydrophobicContact CG1-CD1 3.77Å; V501-L505 HydrophobicContact CG1-CG 4.26Å; V501-L505 WeakPolarHBondContact O-CG 3.28Å; V501-L505 PolarHBondContact O-N 3.19Å; V501-V636 HydrophobicContact CG1-CG2 4.18Å
502	T	85.3	Confident	70.8	Confident	4 Å²	4	75 Å²	75	3%	0.025	40%	0.395	C	S	.	.	H	α-helix	trans	-64.3	-46.2	-175	-51.4	0	0	0	0	111.8	N500 H504 L505 D506 P543 F544	N500-T502 PolarHBondContact O-N 3.44Å; N500-T502 PolarHBondContact OD1-N 3.4Å; T502-H504 VanDerWaalsContact C-N 3.3Å; T502-H504 PolarHBondContact O-N 3.43Å; T502-L505 PolarHBondContact O-N 3.42Å; T502-D506 PolarHBondContact O-N 3.21Å; T502-P543 PolarHBondContact OG1-O 3.5Å; T502-F544 HydrophobicContact CG2-CD2 3.39Å; T502-F544 HydrophobicContact CG2-CE2 3.79Å; T502-F544 HydrophobicContact CG2-CG 4.16Å
503	K	84.3	Confident	73.3	Confident	85 Å²	85	70.7 Å²	70.7	37%	0.37	36%	0.364	S	S	.	.	H	α-helix	trans	-61.5	-40.4	176.5	-70.8	-175.4	-179.7	179.6	0	112	N500 L505 D506 D507 E548	N500-K503 HydrophobicContact CB-CB 4.2Å; N500-K503 HydrophobicContact CB-CD 4.24Å; N500-K503 HydrophobicContact CB-CG 4.18Å; N500-K503 PolarHBondContact O-N 3.11Å; K503-L505 VanDerWaalsContact C-N 3.35Å; K503-L505 PolarHBondContact O-N 3.47Å; K503-D506 PolarHBondContact O-N 3.38Å; K503-D507 PolarHBondContact O-N 3.1Å; K503-E548 VanDerWaalsContact CE-OE1 3.29Å; K503-E548 WeakPolarHBondContact CE-OE1 3.24Å; K503-E548 WeakPolarHBondContact CE-OE2 3.31Å; K503-E548 IonicContact NZ-OE1 3.01Å; K503-E548 PolarHBondContact NZ-OE1 3.34Å; K503-E548 IonicContact NZ-OE2 3.91Å; K503-E548 PolarHBondContact NZ-OE2 3.21Å
504	H	86.6	Confident	76	Confident	64 Å²	64	67 Å²	67	30%	0.296	35%	0.354	S	S	.	.	H	α-helix	trans	-62.9	-42	176.4	-177.4	56.3	0	0	0	112.5	N500 V501 T502 Q508	N500-H504 PolarHBondContact O-N 3.08Å; V501-H504 WeakPolarHBondContact O-CB 3.41Å; V501-H504 PolarHBondContact O-N 2.99Å; T502-H504 VanDerWaalsContact C-N 3.3Å; T502-H504 PolarHBondContact O-N 3.43Å; H504-Q508 PolarHBondContact CE1-NE2 2.85Å; H504-Q508 VanDerWaalsContact CE1-NE2 3.31Å; H504-Q508 PolarHBondContact NE2-NE2 2.96Å; H504-Q508 WeakPolarHBondContact O-CG 3.46Å; H504-Q508 PolarHBondContact O-N 2.75Å
505	L	90.7	Very high	78.6	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-66.1	-41.7	176.8	-70.2	173.2	0	0	0	111.7	V501 T502 K503 Q508 A509 F539 F542	V501-L505 HydrophobicContact CG1-CD1 3.77Å; V501-L505 HydrophobicContact CG1-CG 4.26Å; V501-L505 WeakPolarHBondContact O-CG 3.28Å; V501-L505 PolarHBondContact O-N 3.19Å; T502-L505 PolarHBondContact O-N 3.42Å; K503-L505 VanDerWaalsContact C-N 3.35Å; K503-L505 PolarHBondContact O-N 3.47Å; L505-Q508 PolarHBondContact O-N 3.26Å; L505-A509 WeakPolarHBondContact O-CB 3.34Å; L505-A509 PolarHBondContact O-N 3.21Å; L505-F539 HydrophobicContact CB-CB 4.49Å; L505-F539 HydrophobicContact CD2-CD1 4.16Å; L505-F542 HydrophobicContact CD1-CB 4.04Å
506	D	89.8	Confident	81.2	Confident	19 Å²	19	62.6 Å²	62.6	10%	0.102	32%	0.319	C	S	.	.	H	α-helix	trans	-66.8	-39.4	178.7	-76.8	15.2	0	0	0	112	T502 K503 Q508 A509 R510 H540 F544 R557	T502-D506 PolarHBondContact O-N 3.21Å; K503-D506 PolarHBondContact O-N 3.38Å; D506-Q508 VanDerWaalsContact C-N 3.31Å; D506-Q508 PolarHBondContact O-N 3.45Å; D506-A509 WeakPolarHBondContact O-CB 3.17Å; D506-A509 PolarHBondContact O-N 3.02Å; D506-R510 WeakPolarHBondContact O-CG 3.45Å; D506-R510 PolarHBondContact O-N 2.75Å; D506-H540 IonicContact OD1-CD2 2.72Å; D506-H540 IonicContact OD1-NE2 3.97Å; D506-F544 WeakPolarHBondContact OD2-CE2 3.33Å; D506-R557 IonicContact OD1-CZ 3.24Å; D506-R557 VanDerWaalsContact OD1-CZ 3.24Å; D506-R557 IonicContact OD1-NH1 3.08Å; D506-R557 PolarHBondContact OD1-NH1 3.28Å; D506-R557 IonicContact OD1-NH2 3.5Å; D506-R557 PolarHBondContact OD1-NH2 3.26Å; D506-R557 IonicContact OD2-NH1 2.82Å; D506-R557 PolarHBondContact OD2-NH1 3.23Å; D506-R557 IonicContact OD2-NH2 3.76Å
507	D	89.5	Confident	83.4	Confident	80 Å²	80	56.8 Å²	56.8	43%	0.428	28%	0.281	S	S	.	.	H	α-helix	trans	-63.8	-37.7	174.6	-73.4	-20.8	0	0	0	111.9	K503 R510 Q511	K503-D507 PolarHBondContact O-N 3.1Å; D507-R510 IonicContact OD1-NH1 3.83Å; D507-R510 PolarHBondContact OD1-NH1 3.17Å; D507-Q511 WeakPolarHBondContact O-CG 3.26Å; D507-Q511 PolarHBondContact O-N 3.45Å
508	Q	91.5	Very high	85.3	Confident	56 Å²	56	58.3 Å²	58.3	26%	0.262	30%	0.298	S	S	.	.	H	α-helix	trans	-69.2	-39.6	173	-72.7	-177.7	-13.9	0	0	112.1	H504 L505 D506 Q511 E512 F539 S631	H504-Q508 PolarHBondContact CE1-NE2 2.85Å; H504-Q508 VanDerWaalsContact CE1-NE2 3.31Å; H504-Q508 PolarHBondContact NE2-NE2 2.96Å; H504-Q508 WeakPolarHBondContact O-CG 3.46Å; H504-Q508 PolarHBondContact O-N 2.75Å; L505-Q508 PolarHBondContact O-N 3.26Å; D506-Q508 VanDerWaalsContact C-N 3.31Å; D506-Q508 PolarHBondContact O-N 3.45Å; Q508-Q511 PolarHBondContact O-N 2.94Å; Q508-E512 PolarHBondContact O-N 2.92Å; Q508-F539 HydrophobicContact CB-CD1 3.92Å; Q508-F539 HydrophobicContact CB-CE1 3.53Å; Q508-F539 HydrophobicContact CB-CZ 4.04Å; Q508-F539 HydrophobicContact CG-CE1 4.48Å; Q508-S631 PolarHBondContact OE1-OG 3.45Å
509	A	92.2	Very high	87.1	Confident	2 Å²	2	59.6 Å²	59.6	2%	0.017	30%	0.297	C	S	.	.	H	α-helix	trans	-60.3	-49.7	177.3	0	0	0	0	0	110.8	L505 D506 Q511 E512 E513 F539 H540	L505-A509 WeakPolarHBondContact O-CB 3.34Å; L505-A509 PolarHBondContact O-N 3.21Å; D506-A509 WeakPolarHBondContact O-CB 3.17Å; D506-A509 PolarHBondContact O-N 3.02Å; A509-Q511 VanDerWaalsContact C-N 3.32Å; A509-Q511 PolarHBondContact O-N 3.42Å; A509-E512 PolarHBondContact O-N 3.35Å; A509-E512 VanDerWaalsContact O-N 3.13Å; A509-E513 WeakPolarHBondContact O-CB 3.32Å; A509-E513 WeakPolarHBondContact O-CG 3.13Å; A509-E513 PolarHBondContact O-N 3.42Å; A509-F539 HydrophobicContact CB-CB 3.71Å; A509-F539 HydrophobicContact CB-CD2 3.79Å; A509-F539 HydrophobicContact CB-CG 3.9Å; A509-H540 WeakPolarHBondContact CB-NE2 3.43Å
510	R	91	Very high	88.4	Confident	127 Å²	127	52.5 Å²	52.5	48%	0.479	27%	0.265	S	S	.	.	H	α-helix	trans	-56.7	-43.9	177.3	-70.6	175.6	-170	144.5	-0.6	112.3	D506 D507 E512 E513 D514	D506-R510 WeakPolarHBondContact O-CG 3.45Å; D506-R510 PolarHBondContact O-N 2.75Å; D507-R510 IonicContact OD1-NH1 3.83Å; D507-R510 PolarHBondContact OD1-NH1 3.17Å; R510-E512 PolarHBondContact O-N 3.26Å; R510-E513 PolarHBondContact O-N 2.89Å; R510-D514 WeakPolarHBondContact O-CB 3.36Å; R510-D514 VanDerWaalsContact O-CG 3.3Å; R510-D514 PolarHBondContact O-N 3.17Å
511	Q	91.2	Very high	88.8	Confident	131 Å²	131	53.7 Å²	53.7	61%	0.612	27%	0.274	S	S	*	.	H	α-helix	trans	-62.1	-42.8	177.4	-71.7	171.9	25.5	0	0	112.3	D507 Q508 A509 T515	D507-Q511 WeakPolarHBondContact O-CG 3.26Å; D507-Q511 PolarHBondContact O-N 3.45Å; Q508-Q511 PolarHBondContact O-N 2.94Å; A509-Q511 VanDerWaalsContact C-N 3.32Å; A509-Q511 PolarHBondContact O-N 3.42Å; Q511-T515 WeakPolarHBondContact O-CG2 3.25Å; Q511-T515 PolarHBondContact O-N 3.17Å
512	E	92.3	Very high	88.8	Confident	57 Å²	57	60 Å²	60	27%	0.266	31%	0.308	S	S	.	.	H	α-helix	trans	-71	-39.6	178.1	-162.1	170	133.9	0	0	111.3	Q508 A509 R510 T515 L516 S535 K538 F539	Q508-E512 PolarHBondContact O-N 2.92Å; A509-E512 PolarHBondContact O-N 3.35Å; A509-E512 VanDerWaalsContact O-N 3.13Å; R510-E512 PolarHBondContact O-N 3.26Å; E512-T515 PolarHBondContact O-N 3.34Å; E512-T515 PolarHBondContact O-OG1 3.4Å; E512-L516 HydrophobicContact CG-CD1 4.48Å; E512-L516 VanDerWaalsContact O-CG 3.31Å; E512-L516 WeakPolarHBondContact O-CG 3.48Å; E512-L516 PolarHBondContact O-N 2.93Å; E512-S535 WeakPolarHBondContact CG-OG 3.08Å; E512-S535 PolarHBondContact OE1-OG 2.97Å; E512-K538 IonicContact OE1-NZ 3.6Å; E512-K538 IonicContact OE2-NZ 3.78Å; E512-K538 PolarHBondContact OE2-NZ 3.23Å; E512-F539 HydrophobicContact CB-CE2 3.94Å; E512-F539 HydrophobicContact CB-CZ 4.47Å; E512-F539 HydrophobicContact CG-CE2 4.37Å; E512-F539 WeakPolarHBondContact OE2-CE2 3.47Å; E512-F539 WeakPolarHBondContact OE2-CZ 3.34Å
513	E	91.7	Very high	88.9	Confident	26 Å²	26	62 Å²	62	12%	0.121	32%	0.318	C	S	.	.	H	α-helix	trans	-61.9	-43.9	175.1	-74.1	-170.8	-165	0	0	112.4	A509 R510 T515 L516 C517 L532 R536	A509-E513 WeakPolarHBondContact O-CB 3.32Å; A509-E513 WeakPolarHBondContact O-CG 3.13Å; A509-E513 PolarHBondContact O-N 3.42Å; R510-E513 PolarHBondContact O-N 2.89Å; E513-T515 VanDerWaalsContact C-N 3.3Å; E513-T515 PolarHBondContact O-N 3.22Å; E513-L516 PolarHBondContact O-N 3.16Å; E513-L516 VanDerWaalsContact O-N 3.16Å; E513-C517 WeakPolarHBondContact O-CB 3.38Å; E513-C517 PolarHBondContact O-N 3.37Å; E513-C517 PolarHBondContact O-SG 3.22Å; E513-C517 VanDerWaalsContact O-SG 3.34Å; E513-L532 HydrophobicContact CG-CD2 4.09Å; E513-R536 WeakPolarHBondContact OE1-CG 3.45Å; E513-R536 IonicContact OE1-CZ 3.47Å; E513-R536 IonicContact OE1-NE 3.37Å; E513-R536 PolarHBondContact OE1-NE 2.73Å; E513-R536 IonicContact OE1-NH2 2.64Å; E513-R536 IonicContact OE2-CZ 2.75Å; E513-R536 IonicContact OE2-NE 3.73Å; E513-R536 IonicContact OE2-NH2 3.1Å; E513-R536 PolarHBondContact OE2-NH2 3.41Å
514	D	90.1	Very high	89.2	Confident	117 Å²	117	60.1 Å²	60.1	63%	0.626	32%	0.315	S	S	*	.	H	α-helix	trans	-58.2	-43.4	175.4	-75.7	-22.4	0	0	0	111.2	R510 C517 S518	R510-D514 WeakPolarHBondContact O-CB 3.36Å; R510-D514 VanDerWaalsContact O-CG 3.3Å; R510-D514 PolarHBondContact O-N 3.17Å; D514-C517 PolarHBondContact O-N 3.38Å; D514-S518 PolarHBondContact O-N 3.34Å
515	T	91	Very high	89.4	Confident	73 Å²	73	60.6 Å²	60.6	45%	0.448	32%	0.319	S	S	.	.	H	α-helix	trans	-64.2	-43.5	175.9	61.8	0	0	0	0	111.9	Q511 E512 E513 C517 S518 E519	Q511-T515 WeakPolarHBondContact O-CG2 3.25Å; Q511-T515 PolarHBondContact O-N 3.17Å; E512-T515 PolarHBondContact O-N 3.34Å; E512-T515 PolarHBondContact O-OG1 3.4Å; E513-T515 VanDerWaalsContact C-N 3.3Å; E513-T515 PolarHBondContact O-N 3.22Å; T515-C517 PolarHBondContact O-N 3.32Å; T515-S518 PolarHBondContact O-N 3.47Å; T515-S518 PolarHBondContact O-OG 3.34Å; T515-E519 PolarHBondContact O-N 3.22Å
516	L	91.9	Very high	89.4	Confident	13 Å²	13	61.7 Å²	61.7	7%	0.068	32%	0.324	C	S	.	.	H	α-helix	trans	-65.8	-38.6	178.4	-70.9	176.8	0	0	0	112.4	E512 E513 S518 E519 S520 F528 K531 L532	E512-L516 HydrophobicContact CG-CD1 4.48Å; E512-L516 VanDerWaalsContact O-CG 3.31Å; E512-L516 WeakPolarHBondContact O-CG 3.48Å; E512-L516 PolarHBondContact O-N 2.93Å; E513-L516 PolarHBondContact O-N 3.16Å; E513-L516 VanDerWaalsContact O-N 3.16Å; L516-S518 VanDerWaalsContact C-N 3.35Å; L516-E519 PolarHBondContact O-N 3.13Å; L516-S520 PolarHBondContact O-N 2.88Å; L516-F528 HydrophobicContact CB-CE2 4.36Å; L516-F528 WeakPolarHBondContact O-CE2 3.47Å; L516-K531 HydrophobicContact CD1-CB 4.22Å; L516-K531 HydrophobicContact CD2-CB 3.86Å; L516-K531 HydrophobicContact CD2-CD 3.6Å; L516-K531 HydrophobicContact CD2-CG 4.32Å; L516-L532 HydrophobicContact CB-CD2 4.08Å; L516-L532 HydrophobicContact CD1-CD2 3.94Å; L516-L532 HydrophobicContact CD1-CG 4.48Å
517	C	89	Confident	89.5	Confident	23 Å²	23	64.1 Å²	64.1	16%	0.155	34%	0.337	C	S	.	.	H	α-helix	trans	-62.9	-41.4	174.9	-76.3	0	0	0	0	111.3	E513 D514 T515 E519 S520 S1093	E513-C517 WeakPolarHBondContact O-CB 3.38Å; E513-C517 PolarHBondContact O-N 3.37Å; E513-C517 PolarHBondContact O-SG 3.22Å; E513-C517 VanDerWaalsContact O-SG 3.34Å; D514-C517 PolarHBondContact O-N 3.38Å; T515-C517 PolarHBondContact O-N 3.32Å; C517-E519 VanDerWaalsContact C-N 3.33Å; C517-E519 PolarHBondContact O-N 3Å; C517-S520 VanDerWaalsContact O-CB 3.3Å; C517-S520 WeakPolarHBondContact O-CB 3.43Å; C517-S520 PolarHBondContact O-N 3.35Å; C517-S520 PolarHBondContact O-OG 3.04Å; C517-S1093 WeakPolarHBondContact O-CB 3.36Å
518	S	86.2	Confident	89.7	Confident	79 Å²	79	60.4 Å²	60.4	55%	0.552	32%	0.317	S	S	*	.	H	α-helix	trans	-65.8	-33.5	174.6	75.7	0	0	0	0	113.1	D514 T515 L516 S520	D514-S518 PolarHBondContact O-N 3.34Å; T515-S518 PolarHBondContact O-N 3.47Å; T515-S518 PolarHBondContact O-OG 3.34Å; L516-S518 VanDerWaalsContact C-N 3.35Å; S518-S520 VanDerWaalsContact C-N 3.33Å
519	E	87.3	Confident	89.9	Confident	89 Å²	89	57.8 Å²	57.8	42%	0.416	31%	0.305	S	S	.	.	H	α-helix	trans	-77.9	-16.4	175.8	-71.2	-174.9	-178.7	0	0	113.6	T515 L516 C517 V521 N522 L523 K531	T515-E519 PolarHBondContact O-N 3.22Å; L516-E519 PolarHBondContact O-N 3.13Å; C517-E519 VanDerWaalsContact C-N 3.33Å; C517-E519 PolarHBondContact O-N 3Å; E519-V521 PolarHBondContact O-N 3.36Å; E519-V521 VanDerWaalsContact O-N 3.15Å; E519-N522 PolarHBondContact O-N 2.89Å; E519-L523 HydrophobicContact CB-CD1 4.35Å; E519-K531 IonicContact OE2-NZ 3.34Å; E519-K531 PolarHBondContact OE2-NZ 3.46Å
520	S	85.8	Confident	89.9	Confident	10 Å²	10	58.4 Å²	58.4	7%	0.07	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-60.3	-29.9	-167.5	70.8	0	0	0	0	114.1	L516 C517 S518 N522 L523 S1093	L516-S520 PolarHBondContact O-N 2.88Å; C517-S520 VanDerWaalsContact O-CB 3.3Å; C517-S520 WeakPolarHBondContact O-CB 3.43Å; C517-S520 PolarHBondContact O-N 3.35Å; C517-S520 PolarHBondContact O-OG 3.04Å; S518-S520 VanDerWaalsContact C-N 3.33Å; S520-N522 PolarHBondContact O-N 3.39Å; S520-L523 PolarHBondContact O-N 3.22Å; S520-S1093 WeakPolarHBondContact OG-CB 3.48Å; S520-S1093 PolarHBondContact OG-OG 2.91Å
521	V	83.3	Confident	90	Very high	66 Å²	66	56 Å²	56	40%	0.4	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-59.8	-29.4	177.6	-177.6	0	0	0	0	111.9	E519 E1097	E519-V521 PolarHBondContact O-N 3.36Å; E519-V521 VanDerWaalsContact O-N 3.15Å; V521-E1097 WeakPolarHBondContact CG1-OE2 3.34Å
522	N	84.7	Confident	90.2	Very high	140 Å²	140	49.7 Å²	49.7	75%	0.749	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-94.6	1.5	-179.4	-65	-54.8	0	0	0	113.7	E519 S520	E519-N522 PolarHBondContact O-N 2.89Å; S520-N522 PolarHBondContact O-N 3.39Å
523	L	87.1	Confident	90.3	Very high	46 Å²	46	47 Å²	47	24%	0.241	26%	0.259	C	S	.	.	S	Bend	trans	-111.7	149.2	-175	-62	174.8	0	0	0	111	E519 S520 F528 K531	E519-L523 HydrophobicContact CB-CD1 4.35Å; S520-L523 PolarHBondContact O-N 3.22Å; L523-F528 HydrophobicContact CB-CB 4.24Å; L523-F528 HydrophobicContact CD1-CB 4.48Å; L523-K531 HydrophobicContact CD1-CD 3.84Å
524	S	89.9	Confident	90.5	Very high	45 Å²	45	47.4 Å²	47.4	32%	0.315	26%	0.26	S	S	.	.			trans	-67.3	151	164	79.3	0	0	0	0	109.3	K526 D527 F528	S524-K526 PolarHBondContact O-N 3.38Å; S524-K526 VanDerWaalsContact O-N 3.1Å; S524-D527 PolarHBondContact O-N 2.81Å; S524-D527 PolarHBondContact OG-N 2.94Å; S524-D527 PolarHBondContact OG-OD2 3.01Å; S524-F528 PolarHBondContact O-N 3.14Å
525	L	90.5	Very high	90.7	Very high	73 Å²	73	42 Å²	42	38%	0.382	23%	0.231	S	C	.	.	H	α-helix	trans	-53.7	-34.1	175.7	-74.6	175.7	0	0	0	112.4	W529 W1083 L1086 L1087	L525-W529 VanDerWaalsContact O-CB 3.29Å; L525-W529 WeakPolarHBondContact O-CB 3.39Å; L525-W529 PolarHBondContact O-N 3.17Å; L525-W1083 HydrophobicContact CB-CH2 4.34Å; L525-L1086 HydrophobicContact CB-CD2 4.47Å; L525-L1086 HydrophobicContact CD2-CD2 4.43Å; L525-L1087 HydrophobicContact CD1-CD2 4.07Å
526	K	91.7	Very high	90.9	Very high	24 Å²	24	39.1 Å²	39.1	10%	0.104	21%	0.212	C	C	.	.	H	α-helix	trans	-61.4	-50.4	174.9	170	-177.8	161.8	177.2	0	111.9	S524 F528 Q530 V1057 Q1058 F1060 A1062 T1065	S524-K526 PolarHBondContact O-N 3.38Å; S524-K526 VanDerWaalsContact O-N 3.1Å; K526-F528 VanDerWaalsContact C-N 3.35Å; K526-Q530 PolarHBondContact O-N 2.99Å; K526-V1057 WeakPolarHBondContact CE-O 3.43Å; K526-V1057 HydrophobicContact CG-CG1 4.06Å; K526-V1057 PolarHBondContact NZ-O 3.26Å; K526-Q1058 VanDerWaalsContact NZ-C 3.29Å; K526-Q1058 PolarHBondContact NZ-O 3.01Å; K526-F1060 PolarHBondContact NZ-O 2.62Å; K526-A1062 HydrophobicContact CB-CB 4.04Å; K526-A1062 HydrophobicContact CD-CB 4.43Å; K526-T1065 HydrophobicContact CB-CG2 4.46Å; K526-T1065 WeakPolarHBondContact CB-OG1 3.49Å; K526-T1065 HydrophobicContact CG-CG2 4.43Å; K526-T1065 WeakPolarHBondContact CG-OG1 3.07Å
527	D	91.7	Very high	91	Very high	69 Å²	69	38.6 Å²	38.6	37%	0.369	21%	0.21	S	C	.	.	H	α-helix	trans	-71.3	-36.1	-177.1	-56.4	-44.4	0	0	0	110.7	S524 Q530 K531	S524-D527 PolarHBondContact O-N 2.81Å; S524-D527 PolarHBondContact OG-N 2.94Å; S524-D527 PolarHBondContact OG-OD2 3.01Å; D527-Q530 PolarHBondContact O-N 3.18Å; D527-K531 WeakPolarHBondContact O-CB 3.37Å; D527-K531 WeakPolarHBondContact O-CG 3.3Å; D527-K531 PolarHBondContact O-N 3.12Å
528	F	93.9	Very high	91.2	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.009	21%	0.214	C	C	.	.	H	α-helix	trans	-62.6	-48.1	174.3	-177.2	-139.3	0	0	0	111.6	L516 L523 S524 K526 Q530 K531 L532 L1086 L1089	L516-F528 HydrophobicContact CB-CE2 4.36Å; L516-F528 WeakPolarHBondContact O-CE2 3.47Å; L523-F528 HydrophobicContact CB-CB 4.24Å; L523-F528 HydrophobicContact CD1-CB 4.48Å; S524-F528 PolarHBondContact O-N 3.14Å; K526-F528 VanDerWaalsContact C-N 3.35Å; F528-Q530 VanDerWaalsContact C-N 3.35Å; F528-Q530 PolarHBondContact O-N 3.03Å; F528-K531 PolarHBondContact O-N 3.2Å; F528-L532 HydrophobicContact CD1-CD1 4.33Å; F528-L532 HydrophobicContact CD2-CD1 3.98Å; F528-L532 HydrophobicContact CD2-CG 4.08Å; F528-L532 HydrophobicContact CE1-CD1 3.87Å; F528-L532 HydrophobicContact CE2-CD1 3.47Å; F528-L532 VanDerWaalsContact CE2-CD1 3.47Å; F528-L532 HydrophobicContact CE2-CD2 4.18Å; F528-L532 HydrophobicContact CE2-CG 3.7Å; F528-L532 HydrophobicContact CG-CD1 4.39Å; F528-L532 HydrophobicContact CZ-CD1 3.42Å; F528-L532 VanDerWaalsContact CZ-CD1 3.42Å; F528-L532 HydrophobicContact CZ-CG 4.17Å; F528-L532 PolarHBondContact O-N 3.35Å; F528-L1086 HydrophobicContact CD1-CD1 3.44Å; F528-L1086 VanDerWaalsContact CD1-CD1 3.44Å; F528-L1086 HydrophobicContact CD1-CG 4.28Å; F528-L1086 HydrophobicContact CE1-CD1 3.83Å; F528-L1086 HydrophobicContact CG-CD1 4.09Å; F528-L1089 HydrophobicContact CE1-CB 4.15Å; F528-L1089 HydrophobicContact CZ-CB 4.21Å
529	W	94.8	Very high	91.7	Very high	1 Å²	1	36.7 Å²	36.7	0%	0.004	19%	0.189	C	C	.	.	H	α-helix	trans	-56	-49.2	174.7	178.8	79.9	0	0	0	111.7	L525 K531 L532 E533 V1057 T1065 V1069 M1072 L1079 V1081 W1083 L1086	L525-W529 VanDerWaalsContact O-CB 3.29Å; L525-W529 WeakPolarHBondContact O-CB 3.39Å; L525-W529 PolarHBondContact O-N 3.17Å; W529-K531 PolarHBondContact O-N 3.38Å; W529-L532 PolarHBondContact O-N 2.95Å; W529-E533 HydrophobicContact CH2-CB 4.42Å; W529-E533 HydrophobicContact CH2-CG 4.17Å; W529-E533 HydrophobicContact CZ2-CB 4.24Å; W529-E533 HydrophobicContact CZ2-CG 4.06Å; W529-E533 WeakPolarHBondContact O-CB 3.47Å; W529-E533 PolarHBondContact O-N 3.42Å; W529-V1057 HydrophobicContact CE3-CG1 4.12Å; W529-V1057 HydrophobicContact CH2-CG2 4.28Å; W529-V1057 HydrophobicContact CZ3-CB 4.21Å; W529-V1057 HydrophobicContact CZ3-CG1 3.95Å; W529-V1057 HydrophobicContact CZ3-CG2 3.84Å; W529-T1065 HydrophobicContact CE3-CG2 4.45Å; W529-V1069 HydrophobicContact CD2-CG2 4.27Å; W529-V1069 HydrophobicContact CH2-CG2 4.27Å; W529-V1069 HydrophobicContact CZ2-CG2 3.7Å; W529-M1072 HydrophobicContact CH2-SD 4.29Å; W529-L1079 HydrophobicContact CZ2-CD1 3.56Å; W529-V1081 PolarHBondContact NE1-O 3.17Å; W529-W1083 HydrophobicContact CB-CZ3 4.24Å; W529-W1083 HydrophobicContact CG-CE3 4.48Å; W529-W1083 HydrophobicContact CG-CZ3 4.2Å; W529-L1086 HydrophobicContact CB-CD1 3.89Å; W529-L1086 HydrophobicContact CB-CD2 3.68Å; W529-L1086 HydrophobicContact CB-CG 4.4Å; W529-L1086 HydrophobicContact CG-CD2 4.24Å
530	Q	93.3	Very high	92	Very high	15 Å²	15	33.2 Å²	33.2	7%	0.07	17%	0.173	C	C	.	.	H	α-helix	trans	-64.3	-41.5	-177.4	-178.4	164.5	40.3	0	0	112.3	K526 D527 F528 H534 D1054 Q1058	K526-Q530 PolarHBondContact O-N 2.99Å; D527-Q530 PolarHBondContact O-N 3.18Å; F528-Q530 VanDerWaalsContact C-N 3.35Å; F528-Q530 PolarHBondContact O-N 3.03Å; Q530-H534 PolarHBondContact NE2-CE1 3.4Å; Q530-H534 WeakPolarHBondContact O-CB 3.49Å; Q530-H534 VanDerWaalsContact O-CG 3.24Å; Q530-H534 PolarHBondContact O-N 3.5Å; Q530-D1054 PolarHBondContact NE2-O 2.69Å; Q530-Q1058 VanDerWaalsContact CD-NE2 3.27Å
531	K	93.8	Very high	92.4	Very high	76 Å²	76	32.8 Å²	32.8	33%	0.33	17%	0.169	S	C	.	.	H	α-helix	trans	-61.8	-46	175.9	-76.1	-171.1	-179.4	-177	0	111.2	L516 E519 L523 D527 F528 W529 S535	L516-K531 HydrophobicContact CD1-CB 4.22Å; L516-K531 HydrophobicContact CD2-CB 3.86Å; L516-K531 HydrophobicContact CD2-CD 3.6Å; L516-K531 HydrophobicContact CD2-CG 4.32Å; E519-K531 IonicContact OE2-NZ 3.34Å; E519-K531 PolarHBondContact OE2-NZ 3.46Å; L523-K531 HydrophobicContact CD1-CD 3.84Å; D527-K531 WeakPolarHBondContact O-CB 3.37Å; D527-K531 WeakPolarHBondContact O-CG 3.3Å; D527-K531 PolarHBondContact O-N 3.12Å; F528-K531 PolarHBondContact O-N 3.2Å; W529-K531 PolarHBondContact O-N 3.38Å; K531-S535 VanDerWaalsContact O-CB 3.31Å; K531-S535 WeakPolarHBondContact O-CB 3.28Å; K531-S535 PolarHBondContact O-N 3.27Å
532	L	94.4	Very high	92.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-64.3	-45.5	177.6	-76.1	174.5	0	0	0	112	E513 L516 F528 W529 H534 S535 R536 V1081 L1086 L1089	E513-L532 HydrophobicContact CG-CD2 4.09Å; L516-L532 HydrophobicContact CB-CD2 4.08Å; L516-L532 HydrophobicContact CD1-CD2 3.94Å; L516-L532 HydrophobicContact CD1-CG 4.48Å; F528-L532 HydrophobicContact CD1-CD1 4.33Å; F528-L532 HydrophobicContact CD2-CD1 3.98Å; F528-L532 HydrophobicContact CD2-CG 4.08Å; F528-L532 HydrophobicContact CE1-CD1 3.87Å; F528-L532 HydrophobicContact CE2-CD1 3.47Å; F528-L532 VanDerWaalsContact CE2-CD1 3.47Å; F528-L532 HydrophobicContact CE2-CD2 4.18Å; F528-L532 HydrophobicContact CE2-CG 3.7Å; F528-L532 HydrophobicContact CG-CD1 4.39Å; F528-L532 HydrophobicContact CZ-CD1 3.42Å; F528-L532 VanDerWaalsContact CZ-CD1 3.42Å; F528-L532 HydrophobicContact CZ-CG 4.17Å; F528-L532 PolarHBondContact O-N 3.35Å; W529-L532 PolarHBondContact O-N 2.95Å; L532-H534 PolarHBondContact O-N 2.8Å; L532-S535 PolarHBondContact O-N 3.16Å; L532-S535 VanDerWaalsContact O-N 3.17Å; L532-R536 PolarHBondContact O-N 3.43Å; L532-V1081 HydrophobicContact CB-CG2 3.79Å; L532-V1081 HydrophobicContact CD1-CG1 4.46Å; L532-L1086 HydrophobicContact CD1-CD1 3.93Å; L532-L1089 HydrophobicContact CD1-CD1 3.94Å
533	E	95.1	Very high	93.3	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-60.8	-45.4	179.5	-178.2	62.5	-150.1	0	0	111.2	W529 E537 K1050 R1080 V1081	W529-E533 HydrophobicContact CH2-CB 4.42Å; W529-E533 HydrophobicContact CH2-CG 4.17Å; W529-E533 HydrophobicContact CZ2-CB 4.24Å; W529-E533 HydrophobicContact CZ2-CG 4.06Å; W529-E533 WeakPolarHBondContact O-CB 3.47Å; W529-E533 PolarHBondContact O-N 3.42Å; E533-E537 VanDerWaalsContact O-CB 3.29Å; E533-E537 WeakPolarHBondContact O-CB 3.34Å; E533-E537 PolarHBondContact O-N 3.09Å; E533-K1050 WeakPolarHBondContact OE1-CE 3.24Å; E533-K1050 IonicContact OE1-NZ 3.23Å; E533-K1050 PolarHBondContact OE1-NZ 2.87Å; E533-R1080 PolarHBondContact OE1-N 3.11Å; E533-R1080 WeakPolarHBondContact OE2-CA 3.49Å; E533-R1080 WeakPolarHBondContact OE2-CB 3.25Å; E533-R1080 PolarHBondContact OE2-N 2.99Å; E533-V1081 HydrophobicContact CB-CG2 4.38Å; E533-V1081 PolarHBondContact OE2-N 3.12Å
534	H	94.8	Very high	93.5	Very high	35 Å²	35	21.2 Å²	21.2	16%	0.162	11%	0.105	C	C	.	.	H	α-helix	trans	-65.4	-37.5	175.2	-69.2	174.7	0	0	0	112.5	Q530 L532 E537 K538 H624	Q530-H534 PolarHBondContact NE2-CE1 3.4Å; Q530-H534 WeakPolarHBondContact O-CB 3.49Å; Q530-H534 VanDerWaalsContact O-CG 3.24Å; Q530-H534 PolarHBondContact O-N 3.5Å; L532-H534 PolarHBondContact O-N 2.8Å; H534-E537 PolarHBondContact O-N 3.42Å; H534-K538 VanDerWaalsContact O-CB 3.31Å; H534-K538 WeakPolarHBondContact O-CB 3.41Å; H534-K538 PolarHBondContact O-N 2.94Å; H534-H624 AromaticContact CD2-CD2 3.97Å; H534-H624 AromaticContact CE1-CD2 3.75Å; H534-H624 AromaticContact NE2-CD2 3.69Å
535	S	94.8	Very high	93.3	Very high	2 Å²	2	19.9 Å²	19.9	1%	0.014	10%	0.095	C	C	.	.	H	α-helix	trans	-64.7	-50.1	177.8	-163	0	0	0	0	110.7	E512 K531 L532 E537 K538 F539	E512-S535 WeakPolarHBondContact CG-OG 3.08Å; E512-S535 PolarHBondContact OE1-OG 2.97Å; K531-S535 VanDerWaalsContact O-CB 3.31Å; K531-S535 WeakPolarHBondContact O-CB 3.28Å; K531-S535 PolarHBondContact O-N 3.27Å; L532-S535 PolarHBondContact O-N 3.16Å; L532-S535 VanDerWaalsContact O-N 3.17Å; S535-E537 VanDerWaalsContact C-N 3.32Å; S535-E537 PolarHBondContact O-N 3.03Å; S535-K538 WeakPolarHBondContact O-CA 2.87Å; S535-K538 VanDerWaalsContact O-CB 3.3Å; S535-K538 WeakPolarHBondContact O-CB 3.37Å; S535-K538 PolarHBondContact O-N 3.04Å; S535-F539 WeakPolarHBondContact O-CD2 3.31Å; S535-F539 PolarHBondContact O-N 2.78Å
536	R	94.6	Very high	92.9	Very high	13 Å²	13	18.9 Å²	18.9	5%	0.049	9%	0.089	C	C	.	.	H	α-helix	trans	-62.7	-37	174.6	-69.7	-171.5	175	170.9	0.3	112.1	E513 L532 K538 F539 H540 R1080 E1085	E513-R536 WeakPolarHBondContact OE1-CG 3.45Å; E513-R536 IonicContact OE1-CZ 3.47Å; E513-R536 IonicContact OE1-NE 3.37Å; E513-R536 PolarHBondContact OE1-NE 2.73Å; E513-R536 IonicContact OE1-NH2 2.64Å; E513-R536 IonicContact OE2-CZ 2.75Å; E513-R536 IonicContact OE2-NE 3.73Å; E513-R536 IonicContact OE2-NH2 3.1Å; E513-R536 PolarHBondContact OE2-NH2 3.41Å; L532-R536 PolarHBondContact O-N 3.43Å; R536-K538 VanDerWaalsContact C-N 3.27Å; R536-K538 PolarHBondContact O-N 2.86Å; R536-F539 PolarHBondContact O-N 2.78Å; R536-H540 WeakPolarHBondContact O-CA 3.2Å; R536-H540 WeakPolarHBondContact O-CB 3.38Å; R536-H540 PolarHBondContact O-N 2.89Å; R536-R1080 VanDerWaalsContact C-CD 3.43Å; R536-R1080 HydrophobicContact CB-CB 3.73Å; R536-R1080 HydrophobicContact CB-CG 4.31Å; R536-R1080 WeakPolarHBondContact CD-O 3.42Å; R536-R1080 PolarHBondContact NH1-O 2.8Å; R536-E1085 IonicContact CZ-OE1 3.76Å; R536-E1085 VanDerWaalsContact CZ-OE1 3.23Å; R536-E1085 IonicContact CZ-OE2 2.85Å; R536-E1085 IonicContact NH1-OE1 2.9Å; R536-E1085 PolarHBondContact NH1-OE1 2.93Å; R536-E1085 IonicContact NH1-OE2 3.78Å; R536-E1085 PolarHBondContact NH1-OE2 3.32Å; R536-E1085 IonicContact NH2-OE1 2.65Å; R536-E1085 PolarHBondContact NH2-OE1 3.16Å
537	E	93.8	Very high	92.2	Very high	3 Å²	3	20.5 Å²	20.5	1%	0.014	10%	0.103	C	C	.	.	H	α-helix	trans	-65.8	-31.7	174.6	-174.7	163.7	-112.8	0	0	112.8	Y428 E533 H534 S535 P626 K1050 R1080	Y428-E537 HydrophobicContact CE2-CG 4.46Å; E533-E537 VanDerWaalsContact O-CB 3.29Å; E533-E537 WeakPolarHBondContact O-CB 3.34Å; E533-E537 PolarHBondContact O-N 3.09Å; H534-E537 PolarHBondContact O-N 3.42Å; S535-E537 VanDerWaalsContact C-N 3.32Å; S535-E537 PolarHBondContact O-N 3.03Å; E537-P626 HydrophobicContact CG-CB 4.19Å; E537-P626 WeakPolarHBondContact OE2-CB 3.37Å; E537-P626 VanDerWaalsContact OE2-CG 3.25Å; E537-P626 WeakPolarHBondContact OE2-CG 3.43Å; E537-K1050 WeakPolarHBondContact OE1-CD 3.08Å; E537-K1050 WeakPolarHBondContact OE1-CE 3.21Å; E537-K1050 IonicContact OE1-NZ 2.87Å; E537-K1050 PolarHBondContact OE1-NZ 2.97Å; E537-R1080 IonicContact OE1-NH1 2.78Å
538	K	94.8	Very high	91.6	Very high	56 Å²	56	19.2 Å²	19.2	24%	0.243	10%	0.095	C	C	.	.	H	α-helix	trans	-68.3	-31.4	175.1	157.3	179.8	-178.8	-156	0	113.2	E512 H534 S535 R536 W541 S629 S631	E512-K538 IonicContact OE1-NZ 3.6Å; E512-K538 IonicContact OE2-NZ 3.78Å; E512-K538 PolarHBondContact OE2-NZ 3.23Å; H534-K538 VanDerWaalsContact O-CB 3.31Å; H534-K538 WeakPolarHBondContact O-CB 3.41Å; H534-K538 PolarHBondContact O-N 2.94Å; S535-K538 WeakPolarHBondContact O-CA 2.87Å; S535-K538 VanDerWaalsContact O-CB 3.3Å; S535-K538 WeakPolarHBondContact O-CB 3.37Å; S535-K538 PolarHBondContact O-N 3.04Å; R536-K538 VanDerWaalsContact C-N 3.27Å; R536-K538 PolarHBondContact O-N 2.86Å; K538-W541 VanDerWaalsContact O-CD1 3.27Å; K538-S629 VanDerWaalsContact CG-O 3.3Å; K538-S629 WeakPolarHBondContact CG-O 3.45Å; K538-S631 PolarHBondContact O-N 2.82Å
539	F	95	Very high	90.9	Very high	5 Å²	5	24 Å²	24	2%	0.022	12%	0.118	C	C	.	.	H	α-helix	trans	-111	-39.3	-175.7	-59.2	-68	0	0	0	114.2	L505 Q508 A509 E512 S535 R536 W541	L505-F539 HydrophobicContact CB-CB 4.49Å; L505-F539 HydrophobicContact CD2-CD1 4.16Å; Q508-F539 HydrophobicContact CB-CD1 3.92Å; Q508-F539 HydrophobicContact CB-CE1 3.53Å; Q508-F539 HydrophobicContact CB-CZ 4.04Å; Q508-F539 HydrophobicContact CG-CE1 4.48Å; A509-F539 HydrophobicContact CB-CB 3.71Å; A509-F539 HydrophobicContact CB-CD2 3.79Å; A509-F539 HydrophobicContact CB-CG 3.9Å; E512-F539 HydrophobicContact CB-CE2 3.94Å; E512-F539 HydrophobicContact CB-CZ 4.47Å; E512-F539 HydrophobicContact CG-CE2 4.37Å; E512-F539 WeakPolarHBondContact OE2-CE2 3.47Å; E512-F539 WeakPolarHBondContact OE2-CZ 3.34Å; S535-F539 WeakPolarHBondContact O-CD2 3.31Å; S535-F539 PolarHBondContact O-N 2.78Å; R536-F539 PolarHBondContact O-N 2.78Å; F539-W541 VanDerWaalsContact C-N 3.29Å; F539-W541 PolarHBondContact O-N 3.38Å
540	H	93.8	Very high	90.2	Very high	17 Å²	17	29.2 Å²	29.2	8%	0.079	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	44.4	-177.8	-54	170.5	0	0	0	112.1	D506 A509 R536 R557 R1080	D506-H540 IonicContact OD1-CD2 2.72Å; D506-H540 IonicContact OD1-NE2 3.97Å; A509-H540 WeakPolarHBondContact CB-NE2 3.43Å; R536-H540 WeakPolarHBondContact O-CA 3.2Å; R536-H540 WeakPolarHBondContact O-CB 3.38Å; R536-H540 PolarHBondContact O-N 2.89Å; H540-R557 HydrophobicContact CB-CG 4.48Å; H540-R557 PolarHBondContact CD2-NH1 3.29Å; H540-R1080 PolarHBondContact O-NE 2.95Å; H540-R1080 PolarHBondContact O-NH2 3.39Å
541	W	94.4	Very high	89.7	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-23.1	174.9	69.1	-89.9	0	0	0	112.5	Y428 E429 V432 K538 F539 L590 M630 S631 K633 V636	Y428-W541 CarbonylContact C-O 3.6Å; Y428-W541 HydrophobicContact CG-CB 4.46Å; E429-W541 VanDerWaalsContact CA-O 3.31Å; E429-W541 WeakPolarHBondContact CA-O 3.43Å; E429-W541 PolarHBondContact N-O 2.88Å; E429-W541 VanDerWaalsContact N-O 3.09Å; V432-W541 HydrophobicContact CG2-CE3 4.01Å; V432-W541 HydrophobicContact CG2-CZ3 3.81Å; K538-W541 VanDerWaalsContact O-CD1 3.27Å; F539-W541 VanDerWaalsContact C-N 3.29Å; F539-W541 PolarHBondContact O-N 3.38Å; W541-L590 HydrophobicContact CH2-CD2 3.79Å; W541-L590 HydrophobicContact CZ3-CD2 3.69Å; W541-M630 HydrophobicContact CB-CE 3.71Å; W541-M630 HydrophobicContact CB-CG 4.33Å; W541-M630 HydrophobicContact CB-SD 4.05Å; W541-M630 HydrophobicContact CD2-CB 4.49Å; W541-M630 HydrophobicContact CD2-CG 4.32Å; W541-M630 HydrophobicContact CD2-SD 3.86Å; W541-M630 HydrophobicContact CE3-SD 4.21Å; W541-M630 HydrophobicContact CG-CB 4.35Å; W541-M630 HydrophobicContact CG-CE 4.11Å; W541-M630 HydrophobicContact CG-CG 3.88Å; W541-M630 HydrophobicContact CG-SD 3.78Å; W541-S631 PolarHBondContact NE1-O 3.17Å; W541-K633 HydrophobicContact CZ2-CB 4.16Å; W541-V636 HydrophobicContact CH2-CB 3.91Å; W541-V636 HydrophobicContact CH2-CG1 3.86Å; W541-V636 HydrophobicContact CH2-CG2 3.89Å; W541-V636 HydrophobicContact CZ2-CB 4.49Å; W541-V636 HydrophobicContact CZ2-CG2 4.13Å
542	F	94.3	Very high	89.2	Confident	2 Å²	2	31.9 Å²	31.9	1%	0.009	18%	0.176	C	C	.	.	S	Bend	trans	-87.2	139.8	178.2	-160.8	-98	0	0	0	110.2	V432 E475 L505 V636	V432-F542 HydrophobicContact CG1-CD2 4.08Å; V432-F542 HydrophobicContact CG1-CE2 3.79Å; E475-F542 HydrophobicContact CG-CE1 3.9Å; E475-F542 HydrophobicContact CG-CZ 3.64Å; L505-F542 HydrophobicContact CD1-CB 4.04Å; F542-V636 HydrophobicContact CD2-CG1 4.26Å; F542-V636 HydrophobicContact CD2-CG2 4.26Å; F542-V636 HydrophobicContact CE2-CG1 3.79Å; F542-V636 HydrophobicContact CE2-CG2 4.22Å
543	P	93.4	Very high	88.7	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.006	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-56.8	138.9	-179.2	-23.6	32.9	0	0	0	112.8	E429 V432 R433 T502	E429-P543 HydrophobicContact CB-CG 4.43Å; E429-P543 WeakPolarHBondContact O-CG 3.35Å; V432-P543 HydrophobicContact CB-CG 4.06Å; V432-P543 HydrophobicContact CG1-CG 3.96Å; R433-P543 HydrophobicContact CB-CG 3.99Å; T502-P543 PolarHBondContact OG1-O 3.5Å
544	F	90.2	Very high	88.5	Confident	6 Å²	6	41.2 Å²	41.2	3%	0.026	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-81	139.6	172.8	-160.6	-86.4	0	0	0	110.1	R433 T502 D506 E546 E548 C552 R557 V558	R433-F544 PolarHBondContact NH2-O 3.16Å; T502-F544 HydrophobicContact CG2-CD2 3.39Å; T502-F544 HydrophobicContact CG2-CE2 3.79Å; T502-F544 HydrophobicContact CG2-CG 4.16Å; D506-F544 WeakPolarHBondContact OD2-CE2 3.33Å; F544-E546 PolarHBondContact O-N 2.9Å; F544-E548 HydrophobicContact CE1-CB 3.61Å; F544-E548 VanDerWaalsContact CE1-O 3.31Å; F544-E548 WeakPolarHBondContact CE1-O 2.97Å; F544-E548 HydrophobicContact CZ-CB 4.19Å; F544-C552 HydrophobicContact CD1-CB 3.69Å; F544-C552 HydrophobicContact CD2-CB 4.46Å; F544-C552 HydrophobicContact CE1-CB 3.8Å; F544-C552 HydrophobicContact CG-CB 4.05Å; F544-C552 WeakPolarHBondContact CG-SG 3.5Å; F544-C552 HydrophobicContact CZ-CB 4.24Å; F544-R557 HydrophobicContact CB-CB 3.81Å; F544-R557 PolarHBondContact N-O 3.38Å; F544-V558 HydrophobicContact CB-CG2 4.11Å; F544-V558 HydrophobicContact CD1-CG2 4.14Å
545	P	85.5	Confident	88.2	Confident	17 Å²	17	44.4 Å²	44.4	11%	0.11	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-61.7	132.1	178.8	-23.3	33.1	0	0	0	113.1	S547 E548	P545-S547 VanDerWaalsContact C-N 3.25Å; P545-S547 PolarHBondContact O-N 3.22Å; P545-E548 PolarHBondContact O-N 3.2Å; P545-E548 VanDerWaalsContact O-N 3.17Å
546	E	82	Confident	88	Confident	52 Å²	52	49 Å²	49	24%	0.243	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-61.8	-31.9	177.9	-63.4	179.4	-165.1	0	0	112.4	F544 E548 E549 V558 V559 L560	F544-E546 PolarHBondContact O-N 2.9Å; E546-E548 PolarHBondContact O-N 3.15Å; E546-E548 VanDerWaalsContact O-N 3.16Å; E546-E549 WeakPolarHBondContact O-CB 3.31Å; E546-E549 PolarHBondContact O-N 3.23Å; E546-V558 HydrophobicContact CG-CG1 4.13Å; E546-V559 VanDerWaalsContact OE1-O 3.12Å; E546-L560 HydrophobicContact CG-CD2 4.38Å
547	S	78.4	Confident	88	Confident	59 Å²	59	48.7 Å²	48.7	41%	0.413	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-57.8	-29.7	176.1	46.7	0	0	0	0	114.4	F470 P545	F470-S547 VanDerWaalsContact CD1-CB 3.44Å; F470-S547 VanDerWaalsContact CE1-CB 3.46Å; P545-S547 VanDerWaalsContact C-N 3.25Å; P545-S547 PolarHBondContact O-N 3.22Å
548	E	79.7	Confident	87.9	Confident	41 Å²	41	49 Å²	49	19%	0.192	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-109.4	18.5	-173.9	-64.6	-179.4	168	0	0	110.4	K503 F544 P545 E546 A550 E551	K503-E548 VanDerWaalsContact CE-OE1 3.29Å; K503-E548 WeakPolarHBondContact CE-OE1 3.24Å; K503-E548 WeakPolarHBondContact CE-OE2 3.31Å; K503-E548 IonicContact NZ-OE1 3.01Å; K503-E548 PolarHBondContact NZ-OE1 3.34Å; K503-E548 IonicContact NZ-OE2 3.91Å; K503-E548 PolarHBondContact NZ-OE2 3.21Å; F544-E548 HydrophobicContact CE1-CB 3.61Å; F544-E548 VanDerWaalsContact CE1-O 3.31Å; F544-E548 WeakPolarHBondContact CE1-O 2.97Å; F544-E548 HydrophobicContact CZ-CB 4.19Å; P545-E548 PolarHBondContact O-N 3.2Å; P545-E548 VanDerWaalsContact O-N 3.17Å; E546-E548 PolarHBondContact O-N 3.15Å; E546-E548 VanDerWaalsContact O-N 3.16Å; E548-A550 PolarHBondContact O-N 2.98Å; E548-E551 WeakPolarHBondContact O-CA 3.41Å; E548-E551 WeakPolarHBondContact O-CB 3.49Å; E548-E551 PolarHBondContact O-N 3.24Å
549	E	78.7	Confident	87.9	Confident	104 Å²	104	46.3 Å²	46.3	49%	0.486	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-47.7	-38.9	-177.6	179.2	-176.9	179.2	0	0	112.9	E546 E551 C552 V558	E546-E549 WeakPolarHBondContact O-CB 3.31Å; E546-E549 PolarHBondContact O-N 3.23Å; E549-E551 PolarHBondContact O-N 3.02Å; E549-C552 WeakPolarHBondContact O-CB 3.44Å; E549-C552 PolarHBondContact O-N 3.45Å; E549-V558 HydrophobicContact CB-CG1 4.37Å; E549-V558 HydrophobicContact CB-CG2 4.4Å; E549-V558 HydrophobicContact CG-CG1 4.2Å; E549-V558 HydrophobicContact CG-CG2 4.2Å
550	A	79.9	Confident	87.7	Confident	110 Å²	110	49.2 Å²	49.2	91%	0.909	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-65.1	-20.3	179.1	0	0	0	0	0	114.6	E548	E548-A550 PolarHBondContact O-N 2.98Å
551	E	82.1	Confident	87.6	Confident	131 Å²	131	49.1 Å²	49.1	61%	0.612	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-91.2	-12.1	175.3	-59.3	-174.2	176	0	0	112.2	E548 E549 E553	E548-E551 WeakPolarHBondContact O-CA 3.41Å; E548-E551 WeakPolarHBondContact O-CB 3.49Å; E548-E551 PolarHBondContact O-N 3.24Å; E549-E551 PolarHBondContact O-N 3.02Å; E551-E553 PolarHBondContact O-N 3.49Å
552	C	84.4	Confident	87.5	Confident	16 Å²	16	56.1 Å²	56.1	11%	0.108	30%	0.301	C	S	.	.			trans	-81.1	117	-176.7	-158.9	0	0	0	0	110.9	F544 E549 D554 V558	F544-C552 HydrophobicContact CD1-CB 3.69Å; F544-C552 HydrophobicContact CD2-CB 4.46Å; F544-C552 HydrophobicContact CE1-CB 3.8Å; F544-C552 HydrophobicContact CG-CB 4.05Å; F544-C552 WeakPolarHBondContact CG-SG 3.5Å; F544-C552 HydrophobicContact CZ-CB 4.24Å; E549-C552 WeakPolarHBondContact O-CB 3.44Å; E549-C552 PolarHBondContact O-N 3.45Å; C552-D554 VanDerWaalsContact C-N 3.26Å; C552-D554 PolarHBondContact O-N 3.19Å; C552-D554 PolarHBondContact SG-O 2.82Å; C552-V558 HydrophobicContact CB-CG2 3.9Å
553	E	83.7	Confident	87.4	Confident	165 Å²	165	59 Å²	59	77%	0.771	32%	0.316	S	S	*	.	S	Bend	trans	-68.8	-28.4	176	-64.3	178.4	178.5	0	0	112.4	E551	E551-E553 PolarHBondContact O-N 3.49Å
554	D	90.1	Very high	87.5	Confident	30 Å²	30	59 Å²	59	16%	0.16	32%	0.316	C	S	.	.			trans	-116.4	95.4	-174.6	180	-3.4	0	0	0	110.2	C552 E556 R557 R1078	C552-D554 VanDerWaalsContact C-N 3.26Å; C552-D554 PolarHBondContact O-N 3.19Å; C552-D554 PolarHBondContact SG-O 2.82Å; D554-E556 PolarHBondContact O-N 3.16Å; D554-E556 VanDerWaalsContact O-N 3.11Å; D554-E556 PolarHBondContact OD1-N 3.49Å; D554-R557 HydrophobicContact CB-CG 3.97Å; D554-R557 VanDerWaalsContact O-CB 3.31Å; D554-R557 WeakPolarHBondContact O-CB 3.42Å; D554-R557 PolarHBondContact O-N 3.19Å; D554-R1078 IonicContact OD1-CZ 3.42Å; D554-R1078 IonicContact OD1-NH1 2.69Å; D554-R1078 PolarHBondContact OD1-NH1 2.71Å; D554-R1078 IonicContact OD1-NH2 2.76Å; D554-R1078 PolarHBondContact OD1-NH2 3.4Å; D554-R1078 VanDerWaalsContact OD1-NH2 3.16Å; D554-R1078 IonicContact OD2-CZ 3.59Å; D554-R1078 IonicContact OD2-NH1 3.18Å; D554-R1078 IonicContact OD2-NH2 3.03Å; D554-R1078 PolarHBondContact OD2-NH2 3.3Å
555	T	89.4	Confident	87.7	Confident	103 Å²	103	62 Å²	62	63%	0.632	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-59.1	-26.6	-174	58	0	0	0	0	113.4	R557 V558	T555-R557 PolarHBondContact O-N 2.98Å; T555-V558 PolarHBondContact O-N 3.17Å; T555-V558 VanDerWaalsContact O-N 3.13Å
556	E	90.5	Very high	88.1	Confident	97 Å²	97	63.4 Å²	63.4	45%	0.453	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-70.8	-14.9	178.2	-65.7	-170.3	165.6	0	0	112.7	D554 V558 R1078	D554-E556 PolarHBondContact O-N 3.16Å; D554-E556 VanDerWaalsContact O-N 3.11Å; D554-E556 PolarHBondContact OD1-N 3.49Å; E556-V558 VanDerWaalsContact C-N 3.3Å; E556-R1078 WeakPolarHBondContact OE2-CD 3.3Å; E556-R1078 IonicContact OE2-CZ 2.63Å; E556-R1078 IonicContact OE2-NE 2.66Å; E556-R1078 PolarHBondContact OE2-NE 3.35Å; E556-R1078 IonicContact OE2-NH1 2.91Å; E556-R1078 PolarHBondContact OE2-NH1 3.09Å
557	R	93.1	Very high	88.7	Confident	7 Å²	7	61 Å²	61	3%	0.026	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-73.6	-23.9	171.4	-62.1	179	65.8	-169.1	0.3	112.8	D506 H540 F544 D554 T555 V559	D506-R557 IonicContact OD1-CZ 3.24Å; D506-R557 VanDerWaalsContact OD1-CZ 3.24Å; D506-R557 IonicContact OD1-NH1 3.08Å; D506-R557 PolarHBondContact OD1-NH1 3.28Å; D506-R557 IonicContact OD1-NH2 3.5Å; D506-R557 PolarHBondContact OD1-NH2 3.26Å; D506-R557 IonicContact OD2-NH1 2.82Å; D506-R557 PolarHBondContact OD2-NH1 3.23Å; D506-R557 IonicContact OD2-NH2 3.76Å; H540-R557 HydrophobicContact CB-CG 4.48Å; H540-R557 PolarHBondContact CD2-NH1 3.29Å; F544-R557 HydrophobicContact CB-CB 3.81Å; F544-R557 PolarHBondContact N-O 3.38Å; D554-R557 HydrophobicContact CB-CG 3.97Å; D554-R557 VanDerWaalsContact O-CB 3.31Å; D554-R557 WeakPolarHBondContact O-CB 3.42Å; D554-R557 PolarHBondContact O-N 3.19Å; T555-R557 PolarHBondContact O-N 2.98Å; R557-V559 PolarHBondContact O-N 3.32Å
558	V	93	Very high	89.5	Confident	9 Å²	9	58.2 Å²	58.2	6%	0.055	31%	0.309	C	S	.	.	S	Bend	trans	-85.5	102.7	175.6	-176	0	0	0	0	107.2	F544 E546 E549 C552 T555 E556 L560	F544-V558 HydrophobicContact CB-CG2 4.11Å; F544-V558 HydrophobicContact CD1-CG2 4.14Å; E546-V558 HydrophobicContact CG-CG1 4.13Å; E549-V558 HydrophobicContact CB-CG1 4.37Å; E549-V558 HydrophobicContact CB-CG2 4.4Å; E549-V558 HydrophobicContact CG-CG1 4.2Å; E549-V558 HydrophobicContact CG-CG2 4.2Å; C552-V558 HydrophobicContact CB-CG2 3.9Å; T555-V558 PolarHBondContact O-N 3.17Å; T555-V558 VanDerWaalsContact O-N 3.13Å; E556-V558 VanDerWaalsContact C-N 3.3Å; V558-L560 HydrophobicContact CG1-CD2 4.07Å
559	V	93.5	Very high	90.2	Very high	1 Å²	1	57.1 Å²	57.1	1%	0.006	30%	0.303	C	S	.	.			trans	-98.1	106.5	-178.6	-177	0	0	0	0	108.2	E429 R430 R433 E546 R557 D563 I564	E429-V559 HydrophobicContact CB-CG2 4.12Å; E429-V559 HydrophobicContact CG-CG2 4.04Å; R430-V559 HydrophobicContact CB-CG2 4.42Å; R430-V559 HydrophobicContact CG-CG1 4.05Å; R430-V559 HydrophobicContact CG-CG2 3.69Å; R433-V559 HydrophobicContact CB-CB 4.04Å; R433-V559 HydrophobicContact CB-CG1 3.9Å; R433-V559 HydrophobicContact CB-CG2 4.45Å; R433-V559 HydrophobicContact CG-CB 3.96Å; R433-V559 HydrophobicContact CG-CG1 3.84Å; E546-V559 VanDerWaalsContact OE1-O 3.12Å; R557-V559 PolarHBondContact O-N 3.32Å; V559-D563 HydrophobicContact CG1-CB 4.06Å; V559-I564 HydrophobicContact CG1-CG2 3.8Å
560	L	91.9	Very high	90.8	Very high	65 Å²	65	53.1 Å²	53.1	34%	0.34	29%	0.285	S	S	.	.			trans	-74.6	158.7	-177.8	-58.3	176.6	0	0	0	110.8	E546 V558 E562 D563	E546-L560 HydrophobicContact CG-CD2 4.38Å; V558-L560 HydrophobicContact CG1-CD2 4.07Å; L560-E562 PolarHBondContact O-N 3.46Å; L560-D563 PolarHBondContact N-OD2 2.87Å; L560-D563 WeakPolarHBondContact O-CB 3.34Å; L560-D563 PolarHBondContact O-N 2.73Å
561	F	91.8	Very high	91.3	Very high	15 Å²	15	48.1 Å²	48.1	7%	0.066	24%	0.243	C	C	.	.	H	α-helix	trans	-55.7	-38.7	174.8	-171.8	-96.7	0	0	0	112.7	L462 E463 W466 D563 I564 E565 L568	L462-F561 HydrophobicContact CB-CE2 4.41Å; L462-F561 HydrophobicContact CD2-CE2 4Å; L462-F561 HydrophobicContact CG-CE2 4.05Å; E463-F561 HydrophobicContact CB-CD1 3.98Å; E463-F561 HydrophobicContact CB-CE1 3.61Å; E463-F561 HydrophobicContact CB-CE2 4.19Å; E463-F561 HydrophobicContact CB-CG 4.41Å; E463-F561 HydrophobicContact CB-CZ 3.73Å; E463-F561 HydrophobicContact CG-CD1 3.71Å; E463-F561 HydrophobicContact CG-CE1 3.83Å; E463-F561 HydrophobicContact CG-CG 4.19Å; E463-F561 HydrophobicContact CG-CZ 4.39Å; W466-F561 HydrophobicContact CD2-CD2 4.35Å; W466-F561 HydrophobicContact CE3-CD2 4.05Å; F561-D563 PolarHBondContact O-N 3.17Å; F561-I564 HydrophobicContact CD2-CD1 4.42Å; F561-I564 WeakPolarHBondContact O-CG1 3.49Å; F561-I564 PolarHBondContact O-N 3.18Å; F561-I564 VanDerWaalsContact O-N 3.16Å; F561-E565 HydrophobicContact CD1-CB 4.18Å; F561-E565 HydrophobicContact CD1-CG 4.36Å; F561-E565 HydrophobicContact CE1-CB 3.96Å; F561-E565 HydrophobicContact CE1-CG 3.69Å; F561-E565 HydrophobicContact CZ-CG 4.31Å; F561-E565 WeakPolarHBondContact O-CB 3.04Å; F561-E565 PolarHBondContact O-N 3.01Å; F561-L568 HydrophobicContact CE2-CD1 3.8Å; F561-L568 HydrophobicContact CZ-CD1 3.8Å
562	E	92.2	Very high	91.4	Very high	148 Å²	148	46.3 Å²	46.3	69%	0.692	25%	0.245	S	C	*	.	H	α-helix	trans	-60.2	-30.5	178	-60.8	-179.3	-176.1	0	0	112.8	L560 I564 P566	L560-E562 PolarHBondContact O-N 3.46Å; E562-I564 VanDerWaalsContact C-N 3.26Å; E562-I564 PolarHBondContact O-N 2.91Å; E562-P566 WeakPolarHBondContact O-CD 3.14Å
563	D	92.6	Very high	91.4	Very high	62 Å²	62	48.1 Å²	48.1	33%	0.332	26%	0.256	S	S	.	.	H	α-helix	trans	-71.6	-21.8	-179.2	-68.2	-48.8	0	0	0	113.4	R430 V559 L560 F561	R430-D563 PolarHBondContact NH2-O 2.79Å; R430-D563 VanDerWaalsContact NH2-O 3.16Å; V559-D563 HydrophobicContact CG1-CB 4.06Å; L560-D563 PolarHBondContact N-OD2 2.87Å; L560-D563 WeakPolarHBondContact O-CB 3.34Å; L560-D563 PolarHBondContact O-N 2.73Å; F561-D563 PolarHBondContact O-N 3.17Å
564	I	94.6	Very high	91.6	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-113.6	-26.3	-174.3	57.5	165.2	0	0	0	112.6	R433 T434 A437 W466 V559 F561 E562 P566 G567	R433-I564 HydrophobicContact CG-CD1 4.15Å; R433-I564 HydrophobicContact CG-CG2 4.45Å; T434-I564 WeakPolarHBondContact OG1-CG2 3.44Å; A437-I564 HydrophobicContact CB-CD1 3.44Å; A437-I564 VanDerWaalsContact CB-CD1 3.44Å; W466-I564 HydrophobicContact CH2-CD1 3.89Å; W466-I564 HydrophobicContact CZ3-CD1 3.65Å; V559-I564 HydrophobicContact CG1-CG2 3.8Å; F561-I564 HydrophobicContact CD2-CD1 4.42Å; F561-I564 WeakPolarHBondContact O-CG1 3.49Å; F561-I564 PolarHBondContact O-N 3.18Å; F561-I564 VanDerWaalsContact O-N 3.16Å; E562-I564 VanDerWaalsContact C-N 3.26Å; E562-I564 PolarHBondContact O-N 2.91Å; I564-P566 VanDerWaalsContact C-N 3.32Å; I564-G567 WeakPolarHBondContact O-CA 3.22Å; I564-G567 PolarHBondContact O-N 2.83Å
565	E	94.8	Very high	91.5	Very high	69 Å²	69	45 Å²	45	32%	0.322	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-47.7	-44.2	-177.1	-165.6	-153.6	167.9	0	0	113.8	R459 F561 G567 L568	R459-E565 IonicContact NH1-OE1 3.28Å; R459-E565 PolarHBondContact NH2-O 2.88Å; F561-E565 HydrophobicContact CD1-CB 4.18Å; F561-E565 HydrophobicContact CD1-CG 4.36Å; F561-E565 HydrophobicContact CE1-CB 3.96Å; F561-E565 HydrophobicContact CE1-CG 3.69Å; F561-E565 HydrophobicContact CZ-CG 4.31Å; F561-E565 WeakPolarHBondContact O-CB 3.04Å; F561-E565 PolarHBondContact O-N 3.01Å; E565-G567 PolarHBondContact O-N 2.87Å; E565-L568 WeakPolarHBondContact O-CB 3.29Å; E565-L568 PolarHBondContact O-N 3.36Å
566	P	93.4	Very high	91.5	Very high	48 Å²	48	42 Å²	42	31%	0.312	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-59.8	-23	179.6	-25.9	36.5	0	0	0	113.9	D384 E562 I564 Y569	D384-P566 HydrophobicContact CB-CB 4.12Å; E562-P566 WeakPolarHBondContact O-CD 3.14Å; I564-P566 VanDerWaalsContact C-N 3.32Å; P566-Y569 WeakPolarHBondContact O-CE2 3.35Å
567	G	94.1	Very high	91.6	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.01	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-92.2	-4.5	176.8	0	0	0	0	0	115.2	L415 I564 E565 Y569	L415-G567 WeakPolarHBondContact CD2-O 3.24Å; I564-G567 WeakPolarHBondContact O-CA 3.22Å; I564-G567 PolarHBondContact O-N 2.83Å; E565-G567 PolarHBondContact O-N 2.87Å; G567-Y569 PolarHBondContact O-N 2.88Å; G567-Y569 VanDerWaalsContact O-N 3.13Å
568	L	95.8	Very high	91.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.214	C	C	.	.			trans	-84.4	86.8	-171.1	-63.5	-173	0	0	0	112.4	A437 L438 L441 R459 L462 F561 E565	A437-L568 HydrophobicContact CB-CD1 4.33Å; A437-L568 HydrophobicContact CB-CD2 3.6Å; L438-L568 HydrophobicContact CD2-CD2 3.95Å; L438-L568 HydrophobicContact CG-CD2 3.95Å; L441-L568 HydrophobicContact CD2-CB 4.13Å; R459-L568 HydrophobicContact CG-CB 4.45Å; R459-L568 PolarHBondContact NE-O 3.44Å; R459-L568 PolarHBondContact NH2-O 3.46Å; L462-L568 HydrophobicContact CD2-CD1 4.09Å; F561-L568 HydrophobicContact CE2-CD1 3.8Å; F561-L568 HydrophobicContact CZ-CD1 3.8Å; E565-L568 WeakPolarHBondContact O-CB 3.29Å; E565-L568 PolarHBondContact O-N 3.36Å
569	Y	94.7	Very high	91.7	Very high	18 Å²	18	38.5 Å²	38.5	7%	0.071	21%	0.213	C	C	.	.			trans	-114.8	138.1	176.1	-67.9	-85.5	0	0	0	111.8	L387 E388 F391 M442 L455 P566 G567	L387-Y569 HydrophobicContact CB-CD2 3.74Å; L387-Y569 HydrophobicContact CB-CE2 3.41Å; L387-Y569 VanDerWaalsContact CB-CE2 3.41Å; L387-Y569 HydrophobicContact CD1-CD2 4.33Å; L387-Y569 HydrophobicContact CD1-CE2 4.36Å; L387-Y569 HydrophobicContact CD2-CD2 4.5Å; L387-Y569 HydrophobicContact CG-CD2 4.42Å; L387-Y569 HydrophobicContact CG-CE2 4.42Å; E388-Y569 WeakPolarHBondContact CA-OH 3.22Å; E388-Y569 WeakPolarHBondContact CB-OH 3.34Å; E388-Y569 PolarHBondContact N-OH 3.4Å; F391-Y569 HydrophobicContact CB-CD1 3.57Å; F391-Y569 HydrophobicContact CB-CE1 3.65Å; F391-Y569 HydrophobicContact CB-CG 4.48Å; F391-Y569 AromaticContact CD1-CD1 3.97Å; F391-Y569 HydrophobicContact CD1-CD1 3.97Å; F391-Y569 AromaticContact CD1-CE1 3.99Å; F391-Y569 HydrophobicContact CD1-CE1 3.99Å; F391-Y569 AromaticContact CD2-CD1 3.62Å; F391-Y569 HydrophobicContact CD2-CD1 3.62Å; F391-Y569 HydrophobicContact CD2-CE1 4.4Å; F391-Y569 HydrophobicContact CD2-CG 4.44Å; F391-Y569 HydrophobicContact CE2-CD1 4.3Å; F391-Y569 AromaticContact CG-CD1 3.42Å; F391-Y569 HydrophobicContact CG-CD1 3.42Å; F391-Y569 VanDerWaalsContact CG-CD1 3.42Å; F391-Y569 AromaticContact CG-CE1 3.75Å; F391-Y569 HydrophobicContact CG-CE1 3.75Å; M442-Y569 WeakPolarHBondContact CE-O 3.36Å; L455-Y569 HydrophobicContact CD2-CD1 3.51Å; L455-Y569 HydrophobicContact CD2-CE1 3.82Å; L455-Y569 HydrophobicContact CD2-CG 4.46Å; P566-Y569 WeakPolarHBondContact O-CE2 3.35Å; G567-Y569 PolarHBondContact O-N 2.88Å; G567-Y569 VanDerWaalsContact O-N 3.13Å
570	D	92.1	Very high	91.7	Very high	21 Å²	21	38.5 Å²	38.5	11%	0.112	21%	0.213	C	C	.	.			trans	-87.1	150.6	174.6	-164.5	17.1	0	0	0	111.1	L441 L455 K458 K577	L441-D570 HydrophobicContact CD2-CB 4.48Å; L455-D570 HydrophobicContact CD1-CB 4.22Å; K458-D570 IonicContact NZ-OD2 2.66Å; K458-D570 PolarHBondContact NZ-OD2 2.86Å; D570-K577 WeakPolarHBondContact OD1-CE 3.33Å; D570-K577 IonicContact OD1-NZ 3.34Å; D570-K577 PolarHBondContact OD1-NZ 3.07Å; D570-K577 IonicContact OD2-NZ 3.62Å; D570-K577 PolarHBondContact OD2-NZ 3.45Å; D570-K577 VanDerWaalsContact OD2-NZ 3.08Å
571	L	90.2	Very high	92	Very high	5 Å²	5	35.4 Å²	35.4	3%	0.026	20%	0.196	C	C	.	.			trans	-99.5	146.2	175.9	-60.7	174.4	0	0	0	110.1	L411 M412 L415 M442 E576 K577 F580	L411-L571 HydrophobicContact CD2-CD2 4.21Å; M412-L571 HydrophobicContact CB-CD2 4.41Å; M412-L571 HydrophobicContact SD-CD1 4.42Å; L415-L571 HydrophobicContact CD1-CD2 4.4Å; M442-L571 HydrophobicContact CE-CD1 3.89Å; M442-L571 HydrophobicContact CE-CG 3.81Å; M442-L571 HydrophobicContact SD-CD1 4.28Å; L571-E576 HydrophobicContact CB-CB 4.2Å; L571-E576 HydrophobicContact CD1-CB 4.19Å; L571-K577 HydrophobicContact CB-CG 4.01Å; L571-K577 WeakPolarHBondContact O-CE 3.46Å; L571-F580 HydrophobicContact CD1-CB 3.57Å; L571-F580 HydrophobicContact CD1-CG 3.99Å
572	S	82.7	Confident	92.1	Very high	92 Å²	92	34.7 Å²	34.7	64%	0.643	19%	0.193	S	C	*	.	S	Bend	trans	-73	-42.3	-170.4	-57.1	0	0	0	0	112.8
573	T	85.3	Confident	92.2	Very high	55 Å²	55	27.9 Å²	27.9	34%	0.337	16%	0.162	S	C	.	.	S	Bend	trans	-100.9	143.4	-173.9	70.1	0	0	0	0	112.4	V575 E576 K577	T573-V575 PolarHBondContact O-N 3.2Å; T573-E576 PolarHBondContact N-OE2 3.38Å; T573-E576 VanDerWaalsContact N-OE2 3.15Å; T573-E576 PolarHBondContact O-N 2.92Å; T573-E576 VanDerWaalsContact OG1-CB 3.29Å; T573-E576 WeakPolarHBondContact OG1-CB 3.38Å; T573-E576 WeakPolarHBondContact OG1-CG 3.23Å; T573-E576 PolarHBondContact OG1-N 3.33Å; T573-E576 PolarHBondContact OG1-OE2 3.35Å; T573-K577 WeakPolarHBondContact O-CG 3.37Å; T573-K577 PolarHBondContact O-N 2.78Å
574	P	87.9	Confident	92.4	Very high	99 Å²	99	25 Å²	25	64%	0.643	15%	0.146	S	C	*	.	H	α-helix	trans	-56.5	-33.4	175.5	-26.2	34.5	0	0	0	113.4	K577 C578	P574-K577 WeakPolarHBondContact O-CB 3.36Å; P574-K577 PolarHBondContact O-N 2.94Å; P574-C578 PolarHBondContact O-N 3.04Å; P574-C578 VanDerWaalsContact O-N 3.09Å; P574-C578 PolarHBondContact O-SG 3.44Å
575	V	87.8	Confident	92.5	Very high	31 Å²	31	25 Å²	25	19%	0.188	15%	0.146	C	C	.	.	H	α-helix	trans	-72.9	-40.3	-178.9	-175	0	0	0	0	111.8	T573 K577 C578 W579 W653 S824 D825	T573-V575 PolarHBondContact O-N 3.2Å; V575-K577 VanDerWaalsContact C-N 3.25Å; V575-K577 PolarHBondContact O-N 3.22Å; V575-C578 PolarHBondContact O-N 3.33Å; V575-W579 WeakPolarHBondContact O-CB 3.42Å; V575-W579 PolarHBondContact O-N 3.28Å; V575-W653 HydrophobicContact CG1-CH2 4.46Å; V575-W653 HydrophobicContact CG1-CZ2 3.8Å; V575-S824 WeakPolarHBondContact CB-OG 3.49Å; V575-S824 WeakPolarHBondContact CG1-OG 3.31Å; V575-D825 HydrophobicContact CG1-CB 4.17Å
576	E	89.1	Confident	92.4	Very high	40 Å²	40	24.2 Å²	24.2	19%	0.187	14%	0.141	C	C	.	.	H	α-helix	trans	-60.5	-37.6	172.7	-74.8	164	154.1	0	0	111.5	L571 T573 W579 F580	L571-E576 HydrophobicContact CB-CB 4.2Å; L571-E576 HydrophobicContact CD1-CB 4.19Å; T573-E576 PolarHBondContact N-OE2 3.38Å; T573-E576 VanDerWaalsContact N-OE2 3.15Å; T573-E576 PolarHBondContact O-N 2.92Å; T573-E576 VanDerWaalsContact OG1-CB 3.29Å; T573-E576 WeakPolarHBondContact OG1-CB 3.38Å; T573-E576 WeakPolarHBondContact OG1-CG 3.23Å; T573-E576 PolarHBondContact OG1-N 3.33Å; T573-E576 PolarHBondContact OG1-OE2 3.35Å; E576-W579 PolarHBondContact O-N 3.35Å; E576-F580 VanDerWaalsContact O-CB 3.27Å; E576-F580 WeakPolarHBondContact O-CB 3.38Å; E576-F580 PolarHBondContact O-N 3.31Å
577	K	93.6	Very high	92.4	Very high	25 Å²	25	22.3 Å²	22.3	11%	0.109	13%	0.13	C	C	.	.	H	α-helix	trans	-61.7	-45.1	173.5	-63.5	179.4	178.1	-153.2	0	111.9	M442 F443 D570 L571 T573 P574 V575 W579 F580 L581	M442-K577 HydrophobicContact CB-CD 4.17Å; M442-K577 HydrophobicContact CB-CG 4.37Å; M442-K577 HydrophobicContact CG-CG 4.38Å; M442-K577 PolarHBondContact O-NZ 2.84Å; M442-K577 VanDerWaalsContact O-NZ 3.1Å; M442-K577 HydrophobicContact SD-CB 4.43Å; M442-K577 HydrophobicContact SD-CG 4.25Å; F443-K577 HydrophobicContact CE1-CB 4.03Å; F443-K577 HydrophobicContact CE2-CB 4.22Å; F443-K577 HydrophobicContact CZ-CB 3.58Å; D570-K577 WeakPolarHBondContact OD1-CE 3.33Å; D570-K577 IonicContact OD1-NZ 3.34Å; D570-K577 PolarHBondContact OD1-NZ 3.07Å; D570-K577 IonicContact OD2-NZ 3.62Å; D570-K577 PolarHBondContact OD2-NZ 3.45Å; D570-K577 VanDerWaalsContact OD2-NZ 3.08Å; L571-K577 HydrophobicContact CB-CG 4.01Å; L571-K577 WeakPolarHBondContact O-CE 3.46Å; T573-K577 WeakPolarHBondContact O-CG 3.37Å; T573-K577 PolarHBondContact O-N 2.78Å; P574-K577 WeakPolarHBondContact O-CB 3.36Å; P574-K577 PolarHBondContact O-N 2.94Å; V575-K577 VanDerWaalsContact C-N 3.25Å; V575-K577 PolarHBondContact O-N 3.22Å; K577-W579 VanDerWaalsContact C-N 3.34Å; K577-F580 PolarHBondContact O-N 3.18Å; K577-L581 WeakPolarHBondContact O-CB 3.35Å; K577-L581 PolarHBondContact O-N 2.93Å
578	C	94.4	Very high	92.4	Very high	7 Å²	7	22.5 Å²	22.5	5%	0.047	13%	0.131	C	C	.	.	H	α-helix	trans	-63.4	-41.9	177.3	-61.9	0	0	0	0	111.5	P574 V575 L581 V582 L648 W653	P574-C578 PolarHBondContact O-N 3.04Å; P574-C578 VanDerWaalsContact O-N 3.09Å; P574-C578 PolarHBondContact O-SG 3.44Å; V575-C578 PolarHBondContact O-N 3.33Å; C578-L581 PolarHBondContact O-N 3.4Å; C578-V582 PolarHBondContact O-N 3.5Å; C578-L648 HydrophobicContact CB-CD2 3.86Å; C578-L648 WeakPolarHBondContact SG-CD2 3.29Å; C578-W653 HydrophobicContact CB-CD2 3.45Å; C578-W653 VanDerWaalsContact CB-CD2 3.45Å; C578-W653 VanDerWaalsContact CB-CE2 3.47Å; C578-W653 HydrophobicContact CB-CE3 3.8Å; C578-W653 HydrophobicContact CB-CG 3.86Å; C578-W653 HydrophobicContact CB-CH2 4.19Å; C578-W653 HydrophobicContact CB-CZ2 3.89Å; C578-W653 HydrophobicContact CB-CZ3 4.14Å
579	W	92.3	Very high	92.1	Very high	7 Å²	7	24.2 Å²	24.2	3%	0.027	14%	0.137	C	C	.	.	H	α-helix	trans	-63.3	-49.4	176.5	-161	-61.5	0	0	0	111.4	V575 E576 K577 L581 V582 E583 F596 Q597 W653 F828 R884	V575-W579 WeakPolarHBondContact O-CB 3.42Å; V575-W579 PolarHBondContact O-N 3.28Å; E576-W579 PolarHBondContact O-N 3.35Å; K577-W579 VanDerWaalsContact C-N 3.34Å; W579-L581 VanDerWaalsContact C-N 3.28Å; W579-L581 PolarHBondContact O-N 3.43Å; W579-V582 PolarHBondContact O-N 2.8Å; W579-E583 VanDerWaalsContact CD1-CG 3.5Å; W579-E583 PolarHBondContact NE1-OE1 3.33Å; W579-E583 VanDerWaalsContact NE1-OE1 3.1Å; W579-E583 WeakPolarHBondContact O-CG 3.38Å; W579-E583 PolarHBondContact O-N 3.33Å; W579-F596 HydrophobicContact CZ2-CD2 4.1Å; W579-F596 AromaticContact CZ2-CE2 3.76Å; W579-F596 HydrophobicContact CZ2-CE2 3.76Å; W579-Q597 HydrophobicContact CZ2-CG 4.29Å; W579-W653 HydrophobicContact CB-CH2 4.14Å; W579-W653 HydrophobicContact CB-CZ3 4.41Å; W579-W653 HydrophobicContact CD2-CH2 4.34Å; W579-W653 AromaticContact CE3-CH2 3.86Å; W579-W653 HydrophobicContact CE3-CH2 3.86Å; W579-F828 HydrophobicContact CD2-CD2 4.24Å; W579-F828 HydrophobicContact CE3-CB 4.1Å; W579-F828 HydrophobicContact CE3-CD2 4.02Å; W579-F828 HydrophobicContact CE3-CG 4.5Å; W579-F828 HydrophobicContact CH2-CB 4.1Å; W579-F828 AromaticContact CH2-CD2 3.93Å; W579-F828 HydrophobicContact CH2-CD2 3.93Å; W579-F828 HydrophobicContact CZ2-CD2 4.13Å; W579-F828 HydrophobicContact CZ3-CB 3.56Å; W579-F828 AromaticContact CZ3-CD2 3.88Å; W579-F828 HydrophobicContact CZ3-CD2 3.88Å; W579-F828 HydrophobicContact CZ3-CG 4.22Å; W579-R884 VanDerWaalsContact CE2-CD 3.47Å; W579-R884 HydrophobicContact CH2-CB 4.14Å; W579-R884 HydrophobicContact CZ2-CB 4.12Å; W579-R884 HydrophobicContact CZ2-CG 4.37Å
580	F	95.3	Very high	91.9	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-56.7	-43.8	177.5	175.6	-101.4	0	0	0	111.2	M412 L415 L416 I419 L438 L439 M442 L571 E576 K577 V582 E583 A584	M412-F580 HydrophobicContact CG-CB 4.39Å; M412-F580 HydrophobicContact CG-CD2 3.85Å; M412-F580 HydrophobicContact SD-CB 3.7Å; M412-F580 HydrophobicContact SD-CD2 4.2Å; M412-F580 HydrophobicContact SD-CG 4.47Å; L415-F580 HydrophobicContact CB-CE2 3.66Å; L415-F580 HydrophobicContact CB-CZ 4.22Å; L415-F580 HydrophobicContact CD1-CE2 4.21Å; L416-F580 HydrophobicContact CD2-CD2 3.89Å; L416-F580 HydrophobicContact CD2-CE2 3.68Å; L416-F580 HydrophobicContact CG-CD2 4.01Å; L416-F580 HydrophobicContact CG-CE2 3.9Å; I419-F580 HydrophobicContact CD1-CE2 4.32Å; I419-F580 HydrophobicContact CD1-CZ 3.94Å; L438-F580 HydrophobicContact CB-CE1 3.98Å; L438-F580 HydrophobicContact CB-CZ 4.37Å; L438-F580 HydrophobicContact CD1-CE1 4.17Å; L438-F580 HydrophobicContact CD1-CZ 3.69Å; L439-F580 HydrophobicContact CD2-CD1 4.42Å; L439-F580 HydrophobicContact CD2-CE1 4.43Å; M442-F580 HydrophobicContact CE-CD1 3.57Å; M442-F580 HydrophobicContact CE-CE1 3.74Å; M442-F580 HydrophobicContact CE-CG 4.17Å; M442-F580 HydrophobicContact CE-CZ 4.46Å; M442-F580 HydrophobicContact SD-CD1 3.52Å; M442-F580 VanDerWaalsContact SD-CD1 3.52Å; M442-F580 HydrophobicContact SD-CE1 4.06Å; M442-F580 HydrophobicContact SD-CG 4.33Å; L571-F580 HydrophobicContact CD1-CB 3.57Å; L571-F580 HydrophobicContact CD1-CG 3.99Å; E576-F580 VanDerWaalsContact O-CB 3.27Å; E576-F580 WeakPolarHBondContact O-CB 3.38Å; E576-F580 PolarHBondContact O-N 3.31Å; K577-F580 PolarHBondContact O-N 3.18Å; F580-V582 PolarHBondContact O-N 3.39Å; F580-E583 PolarHBondContact O-N 3.23Å; F580-A584 HydrophobicContact CD1-CB 4.44Å; F580-A584 HydrophobicContact CE1-CB 4.04Å; F580-A584 HydrophobicContact CE2-CB 4.41Å; F580-A584 HydrophobicContact CZ-CB 4.02Å; F580-A584 WeakPolarHBondContact O-CB 3.42Å; F580-A584 PolarHBondContact O-N 3.48Å
581	L	96.6	Very high	91.8	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-55.9	-50.6	177.3	-177.6	158.9	0	0	0	111.3	L439 F443 K577 C578 W579 E583 A584 L585 L648 L657	L439-L581 HydrophobicContact CD1-CD1 4.5Å; L439-L581 HydrophobicContact CD1-CG 4.24Å; L439-L581 HydrophobicContact CD2-CB 3.81Å; L439-L581 HydrophobicContact CD2-CD1 4.01Å; L439-L581 HydrophobicContact CD2-CG 3.75Å; F443-L581 HydrophobicContact CD2-CD1 4.29Å; F443-L581 HydrophobicContact CE2-CB 4.23Å; F443-L581 HydrophobicContact CE2-CD1 3.69Å; F443-L581 HydrophobicContact CZ-CD1 4.09Å; K577-L581 WeakPolarHBondContact O-CB 3.35Å; K577-L581 PolarHBondContact O-N 2.93Å; C578-L581 PolarHBondContact O-N 3.4Å; W579-L581 VanDerWaalsContact C-N 3.28Å; W579-L581 PolarHBondContact O-N 3.43Å; L581-E583 PolarHBondContact O-N 2.9Å; L581-A584 PolarHBondContact O-N 3.04Å; L581-L585 HydrophobicContact CD2-CD1 3.81Å; L581-L585 HydrophobicContact CD2-CG 4.32Å; L581-L585 WeakPolarHBondContact O-CG 3.47Å; L581-L585 PolarHBondContact O-N 3.35Å; L581-L648 HydrophobicContact CD1-CD1 4.07Å; L581-L648 HydrophobicContact CD1-CD2 4.19Å; L581-L648 HydrophobicContact CD1-CG 4.27Å; L581-L648 HydrophobicContact CD2-CD1 3.96Å; L581-L657 HydrophobicContact CD2-CD1 3.96Å; L581-L657 HydrophobicContact CD2-CD2 4.39Å
582	V	95.1	Very high	91.7	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-59.8	-46.5	179	169.9	0	0	0	0	111.5	C578 W579 F580 L585 K586 F596 W653 Y656 L657 F828	C578-V582 PolarHBondContact O-N 3.5Å; W579-V582 PolarHBondContact O-N 2.8Å; F580-V582 PolarHBondContact O-N 3.39Å; V582-L585 PolarHBondContact O-N 3.02Å; V582-K586 PolarHBondContact O-N 2.8Å; V582-K586 VanDerWaalsContact O-N 3.08Å; V582-F596 HydrophobicContact CG1-CE1 4.27Å; V582-F596 HydrophobicContact CG1-CZ 4.3Å; V582-W653 HydrophobicContact CG2-CE3 3.96Å; V582-W653 HydrophobicContact CG2-CZ3 4.23Å; V582-Y656 HydrophobicContact CG1-CD1 3.97Å; V582-Y656 HydrophobicContact CG1-CE1 3.4Å; V582-Y656 HydrophobicContact CG2-CD1 4.07Å; V582-Y656 HydrophobicContact CG2-CE1 4.34Å; V582-L657 HydrophobicContact CG2-CD2 4.2Å; V582-F828 HydrophobicContact CG1-CE2 4.29Å; V582-F828 HydrophobicContact CG1-CZ 4.35Å; V582-F828 HydrophobicContact CG2-CZ 4.4Å
583	E	94	Very high	92.1	Very high	6 Å²	6	20.4 Å²	20.4	3%	0.028	11%	0.111	C	C	.	.	H	α-helix	trans	-68.7	-34.3	179.9	-64.6	-76.9	-168.1	0	0	112.6	L416 W579 F580 L581 K586 A587 F596 R601	L416-E583 HydrophobicContact CD1-CB 3.6Å; L416-E583 HydrophobicContact CD1-CG 4.15Å; L416-E583 HydrophobicContact CD2-CB 3.62Å; L416-E583 HydrophobicContact CG-CB 4.28Å; W579-E583 VanDerWaalsContact CD1-CG 3.5Å; W579-E583 PolarHBondContact NE1-OE1 3.33Å; W579-E583 VanDerWaalsContact NE1-OE1 3.1Å; W579-E583 WeakPolarHBondContact O-CG 3.38Å; W579-E583 PolarHBondContact O-N 3.33Å; F580-E583 PolarHBondContact O-N 3.23Å; L581-E583 PolarHBondContact O-N 2.9Å; E583-K586 CarbonylContact O-C 3.58Å; E583-K586 WeakPolarHBondContact O-CB 3.46Å; E583-K586 PolarHBondContact O-N 2.88Å; E583-K586 IonicContact OE2-NZ 3.95Å; E583-A587 VanDerWaalsContact O-CB 3.28Å; E583-A587 WeakPolarHBondContact O-CB 3.38Å; E583-A587 PolarHBondContact O-N 3.32Å; E583-F596 WeakPolarHBondContact OE1-CE2 3.35Å; E583-F596 VanDerWaalsContact OE1-CZ 3.23Å; E583-F596 WeakPolarHBondContact OE1-CZ 3.28Å; E583-R601 IonicContact OE1-CZ 3.07Å; E583-R601 IonicContact OE1-NH1 3.89Å; E583-R601 PolarHBondContact OE1-NH1 3.08Å; E583-R601 IonicContact OE1-NH2 3.07Å; E583-R601 PolarHBondContact OE1-NH2 3.18Å; E583-R601 IonicContact OE2-NH1 3.43Å
584	A	96.7	Very high	92.2	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-67.4	-41.9	177.7	0	0	0	0	0	110.7	L416 I419 V435 F580 L581 K586 A587 L588	L416-A584 HydrophobicContact CD2-CB 4.23Å; I419-A584 HydrophobicContact CD1-CB 4.4Å; V435-A584 HydrophobicContact CG1-CB 4.22Å; V435-A584 HydrophobicContact CG2-CB 4.27Å; F580-A584 HydrophobicContact CD1-CB 4.44Å; F580-A584 HydrophobicContact CE1-CB 4.04Å; F580-A584 HydrophobicContact CE2-CB 4.41Å; F580-A584 HydrophobicContact CZ-CB 4.02Å; F580-A584 WeakPolarHBondContact O-CB 3.42Å; F580-A584 PolarHBondContact O-N 3.48Å; L581-A584 PolarHBondContact O-N 3.04Å; A584-K586 VanDerWaalsContact C-N 3.34Å; A584-K586 PolarHBondContact O-N 3.19Å; A584-A587 CarbonylContact O-C 3.59Å; A584-A587 WeakPolarHBondContact O-CA 3.32Å; A584-A587 WeakPolarHBondContact O-CB 3.28Å; A584-A587 PolarHBondContact O-N 2.75Å; A584-A587 VanDerWaalsContact O-N 3.12Å; A584-L588 PolarHBondContact O-N 3.19Å
585	L	96.1	Very high	92.3	Very high	1 Å²	1	17.4 Å²	17.4	1%	0.005	9%	0.093	C	C	.	.	H	α-helix	trans	-64.6	-38.9	173.4	-63.2	-176.3	0	0	0	111.9	L581 V582 A587 L588 F593 F640 L657	L581-L585 HydrophobicContact CD2-CD1 3.81Å; L581-L585 HydrophobicContact CD2-CG 4.32Å; L581-L585 WeakPolarHBondContact O-CG 3.47Å; L581-L585 PolarHBondContact O-N 3.35Å; V582-L585 PolarHBondContact O-N 3.02Å; L585-A587 VanDerWaalsContact C-N 3.31Å; L585-L588 PolarHBondContact O-N 3.33Å; L585-F593 HydrophobicContact CB-CZ 3.8Å; L585-F640 HydrophobicContact CD2-CB 3.78Å; L585-F640 HydrophobicContact CD2-CD1 3.53Å; L585-F640 HydrophobicContact CD2-CE1 4.35Å; L585-F640 HydrophobicContact CD2-CG 3.81Å; L585-L657 HydrophobicContact CD1-CD2 3.96Å
586	K	92.6	Very high	92.4	Very high	52 Å²	52	16.3 Å²	16.3	23%	0.226	9%	0.086	C	C	.	.	H	α-helix	trans	-63	-38.7	170.8	-178.6	-173.2	165.1	-155.6	0	111.3	V582 E583 A584 R589 F593 E606	V582-K586 PolarHBondContact O-N 2.8Å; V582-K586 VanDerWaalsContact O-N 3.08Å; E583-K586 CarbonylContact O-C 3.58Å; E583-K586 WeakPolarHBondContact O-CB 3.46Å; E583-K586 PolarHBondContact O-N 2.88Å; E583-K586 IonicContact OE2-NZ 3.95Å; A584-K586 VanDerWaalsContact C-N 3.34Å; A584-K586 PolarHBondContact O-N 3.19Å; K586-R589 WeakPolarHBondContact O-CD 3.16Å; K586-R589 PolarHBondContact O-N 2.95Å; K586-F593 HydrophobicContact CB-CD2 4.01Å; K586-F593 HydrophobicContact CB-CE2 4.08Å; K586-F593 HydrophobicContact CB-CG 4.49Å; K586-F593 HydrophobicContact CG-CD2 4.25Å; K586-E606 IonicContact NZ-OE1 3.94Å; K586-E606 PolarHBondContact NZ-OE1 2.77Å
587	A	93.6	Very high	92.5	Very high	8 Å²	8	15.1 Å²	15.1	7%	0.066	8%	0.08	C	C	.	.	H	α-helix	trans	-68.8	-28.4	178.1	0	0	0	0	0	113.1	I419 V420 R423 E583 A584 L585 R589	I419-A587 HydrophobicContact CG2-CB 3.91Å; V420-A587 HydrophobicContact CG2-CB 3.89Å; R423-A587 WeakPolarHBondContact CD-O 3.43Å; R423-A587 PolarHBondContact NH1-O 3.22Å; E583-A587 VanDerWaalsContact O-CB 3.28Å; E583-A587 WeakPolarHBondContact O-CB 3.38Å; E583-A587 PolarHBondContact O-N 3.32Å; A584-A587 CarbonylContact O-C 3.59Å; A584-A587 WeakPolarHBondContact O-CA 3.32Å; A584-A587 WeakPolarHBondContact O-CB 3.28Å; A584-A587 PolarHBondContact O-N 2.75Å; A584-A587 VanDerWaalsContact O-N 3.12Å; L585-A587 VanDerWaalsContact C-N 3.31Å; A587-R589 VanDerWaalsContact C-N 3.27Å; A587-R589 PolarHBondContact O-N 3.06Å
588	L	94	Very high	92.4	Very high	5 Å²	5	14.1 Å²	14.1	3%	0.026	8%	0.076	C	C	.	.	H	α-helix	trans	-70.9	-21.6	173.4	-70.5	-178.1	0	0	0	113.6	I419 A431 V432 V435 A584 L585 L590 F640	I419-L588 HydrophobicContact CG2-CD2 4.16Å; A431-L588 HydrophobicContact CB-CD2 4.22Å; V432-L588 HydrophobicContact CG2-CD2 4.17Å; V435-L588 HydrophobicContact CB-CD1 3.99Å; V435-L588 HydrophobicContact CB-CD2 4.27Å; V435-L588 HydrophobicContact CB-CG 4.32Å; V435-L588 HydrophobicContact CG1-CD1 3.89Å; V435-L588 HydrophobicContact CG1-CG 4.46Å; V435-L588 HydrophobicContact CG2-CD1 4.12Å; V435-L588 HydrophobicContact CG2-CD2 3.72Å; V435-L588 HydrophobicContact CG2-CG 3.89Å; A584-L588 PolarHBondContact O-N 3.19Å; L585-L588 PolarHBondContact O-N 3.33Å; L588-L590 HydrophobicContact CB-CD1 4.35Å; L588-L590 HydrophobicContact CB-CG 3.98Å; L588-L590 HydrophobicContact CD1-CD1 4.23Å; L588-F640 HydrophobicContact CD1-CE1 4.49Å; L588-F640 HydrophobicContact CD1-CZ 4.23Å
589	R	90.7	Very high	92.2	Very high	36 Å²	36	14.9 Å²	14.9	14%	0.136	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	51.9	-177	-59.3	-67.3	-176.4	169.7	1	112.4	K586 A587 D609 W627	K586-R589 WeakPolarHBondContact O-CD 3.16Å; K586-R589 PolarHBondContact O-N 2.95Å; A587-R589 VanDerWaalsContact C-N 3.27Å; A587-R589 PolarHBondContact O-N 3.06Å; R589-D609 IonicContact CZ-OD2 2.72Å; R589-D609 IonicContact NH1-OD1 2.78Å; R589-D609 IonicContact NH1-OD2 3.62Å; R589-D609 PolarHBondContact NH1-OD2 2.99Å; R589-D609 VanDerWaalsContact NH2-CB 3.28Å; R589-D609 IonicContact NH2-OD2 2.69Å; R589-D609 PolarHBondContact NH2-OD2 3.17Å; R589-W627 HydrophobicContact CB-CB 4.25Å; R589-W627 HydrophobicContact CB-CD2 3.69Å; R589-W627 HydrophobicContact CB-CE3 3.92Å; R589-W627 HydrophobicContact CB-CG 3.87Å; R589-W627 HydrophobicContact CB-CZ3 4.36Å; R589-W627 WeakPolarHBondContact O-CZ3 3.42Å
590	L	90.5	Very high	92.1	Very high	5 Å²	5	15.7 Å²	15.7	3%	0.026	9%	0.087	C	C	.	.	S	Bend	trans	-93.6	-20.5	170.4	-54	179	0	0	0	112.2	W541 L588 K633 V636 F637 F640	W541-L590 HydrophobicContact CH2-CD2 3.79Å; W541-L590 HydrophobicContact CZ3-CD2 3.69Å; L588-L590 HydrophobicContact CB-CD1 4.35Å; L588-L590 HydrophobicContact CB-CG 3.98Å; L588-L590 HydrophobicContact CD1-CD1 4.23Å; L590-K633 HydrophobicContact CD2-CB 4.25Å; L590-V636 HydrophobicContact CD1-CG1 3.98Å; L590-F637 HydrophobicContact CB-CB 3.83Å; L590-F637 HydrophobicContact CB-CD2 4.19Å; L590-F637 HydrophobicContact CB-CG 4.31Å; L590-F637 HydrophobicContact CD1-CB 4.48Å; L590-F640 HydrophobicContact CD1-CD2 4.24Å; L590-F640 HydrophobicContact CD1-CE2 4.4Å
591	A	90	Very high	91.6	Very high	3 Å²	3	16.7 Å²	16.7	3%	0.025	9%	0.091	C	C	.	.	S	Bend	trans	-149.8	162.4	-175.1	0	0	0	0	0	112.6	F593 F637 S664	A591-F593 HydrophobicContact CB-CE2 4.26Å; A591-F593 WeakPolarHBondContact O-CD2 3.39Å; A591-F637 HydrophobicContact CB-CD1 3.44Å; A591-F637 VanDerWaalsContact CB-CD1 3.44Å; A591-F637 HydrophobicContact CB-CD2 3.81Å; A591-F637 HydrophobicContact CB-CE1 3.33Å; A591-F637 HydrophobicContact CB-CE2 3.74Å; A591-F637 HydrophobicContact CB-CG 3.66Å; A591-F637 HydrophobicContact CB-CZ 3.49Å; A591-F637 VanDerWaalsContact CB-CZ 3.49Å; A591-S664 WeakPolarHBondContact CA-OG 3.35Å; A591-S664 WeakPolarHBondContact CB-OG 3.39Å
592	S	87.3	Confident	90.7	Very high	20 Å²	20	20.9 Å²	20.9	14%	0.14	11%	0.11	C	C	.	.			trans	-86.3	135.7	168	-66.1	0	0	0	0	110.3	F663 S664	S592-F663 WeakPolarHBondContact O-CD1 3.48Å; S592-S664 PolarHBondContact N-OG 2.86Å; S592-S664 VanDerWaalsContact N-OG 3.16Å; S592-S664 WeakPolarHBondContact O-CB 3.27Å
593	F	90.6	Very high	90.1	Very high	28 Å²	28	21.4 Å²	21.4	12%	0.123	11%	0.113	C	C	.	.			trans	-111.3	143.9	179.1	-72.1	-98.1	0	0	0	111.1	L585 K586 A591 F637 Y656 L657 S660	L585-F593 HydrophobicContact CB-CZ 3.8Å; K586-F593 HydrophobicContact CB-CD2 4.01Å; K586-F593 HydrophobicContact CB-CE2 4.08Å; K586-F593 HydrophobicContact CB-CG 4.49Å; K586-F593 HydrophobicContact CG-CD2 4.25Å; A591-F593 HydrophobicContact CB-CE2 4.26Å; A591-F593 WeakPolarHBondContact O-CD2 3.39Å; F593-F637 HydrophobicContact CE1-CE2 4.27Å; F593-F637 HydrophobicContact CE1-CZ 4.17Å; F593-F637 HydrophobicContact CE2-CE2 4.16Å; F593-F637 HydrophobicContact CE2-CZ 4.39Å; F593-F637 AromaticContact CZ-CE2 3.53Å; F593-F637 HydrophobicContact CZ-CE2 3.53Å; F593-F637 AromaticContact CZ-CZ 3.78Å; F593-F637 HydrophobicContact CZ-CZ 3.78Å; F593-Y656 AromaticContact CD1-CE1 3.83Å; F593-Y656 HydrophobicContact CD1-CE1 3.83Å; F593-Y656 HydrophobicContact CE1-CE1 4.35Å; F593-L657 HydrophobicContact CE1-CD2 4.47Å; F593-S660 WeakPolarHBondContact CD1-OG 3.38Å
594	P	88.9	Confident	89.6	Confident	18 Å²	18	24.2 Å²	24.2	12%	0.117	12%	0.123	C	C	.	.			trans	-65.1	147.1	170.1	28.3	-32.1	0	0	0	110.5	F596 Y656 S660 F663	P594-F596 PolarHBondContact O-N 3.38Å; P594-Y656 HydrophobicContact CG-CE2 3.77Å; P594-Y656 PolarHBondContact O-OH 3.34Å; P594-S660 WeakPolarHBondContact CD-OG 3.29Å; P594-F663 HydrophobicContact CB-CG 4.49Å
595	P	88.9	Confident	89	Confident	74 Å²	74	24.6 Å²	24.6	48%	0.481	13%	0.125	S	C	.	.			trans	-67.5	134.8	178.5	28.1	-33.8	0	0	0	110.9
596	F	90.9	Very high	87.9	Confident	7 Å²	7	26.8 Å²	26.8	3%	0.031	14%	0.135	C	C	.	.			trans	-127.6	5.4	175.7	62.6	-85.5	0	0	0	113.2	W579 V582 E583 P594 Y656 F828 G831 W832	W579-F596 HydrophobicContact CZ2-CD2 4.1Å; W579-F596 AromaticContact CZ2-CE2 3.76Å; W579-F596 HydrophobicContact CZ2-CE2 3.76Å; V582-F596 HydrophobicContact CG1-CE1 4.27Å; V582-F596 HydrophobicContact CG1-CZ 4.3Å; E583-F596 WeakPolarHBondContact OE1-CE2 3.35Å; E583-F596 VanDerWaalsContact OE1-CZ 3.23Å; E583-F596 WeakPolarHBondContact OE1-CZ 3.28Å; P594-F596 PolarHBondContact O-N 3.38Å; F596-Y656 HydrophobicContact CB-CE2 4.29Å; F596-Y656 HydrophobicContact CD1-CE2 4.17Å; F596-Y656 AromaticContact CD1-CZ 3.78Å; F596-Y656 WeakPolarHBondContact CD1-OH 3.44Å; F596-Y656 WeakPolarHBondContact CE1-OH 3.42Å; F596-F828 HydrophobicContact CB-CE2 4.44Å; F596-F828 AromaticContact CD2-CD2 3.84Å; F596-F828 HydrophobicContact CD2-CD2 3.84Å; F596-F828 AromaticContact CD2-CE2 3.55Å; F596-F828 HydrophobicContact CD2-CE2 3.55Å; F596-F828 HydrophobicContact CD2-CZ 4.5Å; F596-F828 HydrophobicContact CE2-CD2 4.24Å; F596-F828 AromaticContact CE2-CE2 3.85Å; F596-F828 HydrophobicContact CE2-CE2 3.85Å; F596-F828 AromaticContact CG-CE2 3.92Å; F596-F828 HydrophobicContact CG-CE2 3.92Å; F596-F828 HydrophobicContact CG-CZ 4.47Å; F596-F828 HydrophobicContact CZ-CE2 4.43Å; F596-G831 CarbonylContact C-O 3.58Å; F596-G831 WeakPolarHBondContact CA-O 3.23Å; F596-G831 CarbonylContact O-C 3.6Å; F596-G831 WeakPolarHBondContact O-CA 3.45Å; F596-W832 HydrophobicContact CB-CB 3.9Å
597	Q	90.5	Very high	86.6	Confident	15 Å²	15	28 Å²	28	7%	0.07	14%	0.141	C	C	.	.	S	Bend	trans	-143.5	162.1	174.3	-76.3	-169	-43.5	0	0	110.2	W579 R601 R884 W887	W579-Q597 HydrophobicContact CZ2-CG 4.29Å; Q597-R601 VanDerWaalsContact OE1-NE 3.11Å; Q597-R884 PolarHBondContact NE2-O 3.2Å; Q597-W887 HydrophobicContact CB-CB 4.3Å; Q597-W887 HydrophobicContact CG-CB 4.36Å
598	S	92	Very high	85.1	Confident	4 Å²	4	29.1 Å²	29.1	3%	0.028	14%	0.144	C	C	.	.			trans	-60.2	145.7	-176.8	-177.1	0	0	0	0	112.6	N600 R601 W887 E894	S598-N600 PolarHBondContact O-N 2.97Å; S598-N600 VanDerWaalsContact O-N 3.15Å; S598-N600 PolarHBondContact OG-N 3.07Å; S598-R601 VanDerWaalsContact O-CB 3.22Å; S598-R601 WeakPolarHBondContact O-CB 3.45Å; S598-R601 PolarHBondContact O-N 3.28Å; S598-W887 WeakPolarHBondContact CB-O 3.5Å; S598-W887 PolarHBondContact N-O 2.7Å; S598-W887 VanDerWaalsContact N-O 3.07Å; S598-E894 WeakPolarHBondContact CA-OE2 3.23Å; S598-E894 PolarHBondContact OG-OE2 3.49Å
599	S	90.4	Very high	83.9	Confident	23 Å²	23	30.1 Å²	30.1	16%	0.161	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-15	170	62.6	0	0	0	0	113.7	R601 E894 N935 H936	S599-R601 PolarHBondContact O-N 3.44Å; S599-E894 WeakPolarHBondContact CB-OE1 3.34Å; S599-E894 PolarHBondContact N-OE1 3.1Å; S599-E894 PolarHBondContact N-OE2 3.41Å; S599-E894 PolarHBondContact OG-OE1 3.19Å; S599-N935 WeakPolarHBondContact O-CB 3.36Å; S599-H936 PolarHBondContact OG-N 3.14Å
600	N	88.5	Confident	83.4	Confident	25 Å²	25	28.9 Å²	28.9	13%	0.134	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-10.3	172.7	-73	-13.5	0	0	0	113.6	S598 Q602 W887 E932 P934	S598-N600 PolarHBondContact O-N 2.97Å; S598-N600 VanDerWaalsContact O-N 3.15Å; S598-N600 PolarHBondContact OG-N 3.07Å; N600-Q602 PolarHBondContact O-N 3.38Å; N600-W887 HydrophobicContact CB-CE3 4.3Å; N600-W887 HydrophobicContact CB-CZ3 3.7Å; N600-W887 WeakPolarHBondContact O-CH2 3.49Å; N600-E932 PolarHBondContact ND2-O 3.5Å; N600-P934 VanDerWaalsContact OD1-CD 3.24Å; N600-P934 WeakPolarHBondContact OD1-CD 3.4Å
601	R	86.1	Confident	82.7	Confident	21 Å²	21	28.8 Å²	28.8	8%	0.079	15%	0.145	C	C	.	.			trans	-58.7	123.6	171.7	-173.6	-166.6	-177.2	-176.9	-15.5	109.3	E583 Q597 S598 S599 D603 E606 W887	E583-R601 IonicContact OE1-CZ 3.07Å; E583-R601 IonicContact OE1-NH1 3.89Å; E583-R601 PolarHBondContact OE1-NH1 3.08Å; E583-R601 IonicContact OE1-NH2 3.07Å; E583-R601 PolarHBondContact OE1-NH2 3.18Å; E583-R601 IonicContact OE2-NH1 3.43Å; Q597-R601 VanDerWaalsContact OE1-NE 3.11Å; S598-R601 VanDerWaalsContact O-CB 3.22Å; S598-R601 WeakPolarHBondContact O-CB 3.45Å; S598-R601 PolarHBondContact O-N 3.28Å; S599-R601 PolarHBondContact O-N 3.44Å; R601-D603 IonicContact CZ-OD2 3.18Å; R601-D603 IonicContact NE-OD2 2.78Å; R601-D603 PolarHBondContact NE-OD2 2.79Å; R601-D603 IonicContact NH2-OD2 3.43Å; R601-D603 PolarHBondContact NH2-OD2 3.12Å; R601-E606 VanDerWaalsContact CD-OE2 3.28Å; R601-E606 WeakPolarHBondContact CD-OE2 3.49Å; R601-E606 IonicContact CZ-OE1 2.87Å; R601-E606 IonicContact CZ-OE2 3.35Å; R601-E606 IonicContact NE-OE1 3.86Å; R601-E606 PolarHBondContact NE-OE1 3.44Å; R601-E606 IonicContact NE-OE2 3Å; R601-E606 PolarHBondContact NE-OE2 3.31Å; R601-E606 IonicContact NH1-OE1 2.66Å; R601-E606 PolarHBondContact NH1-OE1 2.84Å; R601-E606 IonicContact NH2-OE1 3.64Å; R601-E606 PolarHBondContact NH2-OE1 2.89Å; R601-W887 HydrophobicContact CB-CD2 4.26Å; R601-W887 HydrophobicContact CB-CG 4.27Å; R601-W887 HydrophobicContact CG-CG 4.36Å
602	Q	77.2	Confident	82.2	Confident	87 Å²	87	33.4 Å²	33.4	41%	0.407	16%	0.162	S	C	.	.			trans	-134.1	64.5	-178.6	-72.3	-177.6	-29.9	0	0	109.8	N600 N935	N600-Q602 PolarHBondContact O-N 3.38Å; Q602-N935 PolarHBondContact NE2-ND2 3.2Å
603	D	82.4	Confident	82.2	Confident	12 Å²	12	33.8 Å²	33.8	6%	0.064	16%	0.161	C	C	.	.			trans	-67	141.2	170.1	-78.4	-47.5	0	0	0	109.7	N413 R601 Y605 E606	N413-D603 PolarHBondContact ND2-OD1 3.38Å; N413-D603 VanDerWaalsContact ND2-OD1 3.07Å; R601-D603 IonicContact CZ-OD2 3.18Å; R601-D603 IonicContact NE-OD2 2.78Å; R601-D603 PolarHBondContact NE-OD2 2.79Å; R601-D603 IonicContact NH2-OD2 3.43Å; R601-D603 PolarHBondContact NH2-OD2 3.12Å; D603-Y605 HydrophobicContact CB-CD1 4.18Å; D603-Y605 HydrophobicContact CB-CE1 3.74Å; D603-Y605 PolarHBondContact O-N 3.43Å; D603-E606 HydrophobicContact CB-CB 4.39Å; D603-E606 HydrophobicContact CB-CG 3.83Å; D603-E606 PolarHBondContact O-N 2.83Å
604	W	82.9	Confident	81.9	Confident	65 Å²	65	32.5 Å²	32.5	25%	0.246	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-13.8	-171.9	60.2	-95.6	0	0	0	115.2	I361 L364 F383	I361-W604 HydrophobicContact CG1-CG 4.4Å; I361-W604 HydrophobicContact CG2-CB 4.02Å; I361-W604 HydrophobicContact CG2-CD2 4.45Å; I361-W604 HydrophobicContact CG2-CG 3.9Å; L364-W604 HydrophobicContact CD1-CH2 3.7Å; L364-W604 HydrophobicContact CD1-CZ2 4.12Å; L364-W604 HydrophobicContact CD1-CZ3 4.19Å; F383-W604 AromaticContact CE1-CH2 3.64Å; F383-W604 HydrophobicContact CE1-CH2 3.64Å; F383-W604 HydrophobicContact CE1-CZ3 4.41Å; F383-W604 AromaticContact CZ-CH2 3.89Å; F383-W604 HydrophobicContact CZ-CH2 3.89Å; F383-W604 HydrophobicContact CZ-CZ3 4.22Å
605	Y	84.6	Confident	81.6	Confident	8 Å²	8	33.2 Å²	33.2	3%	0.031	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-10.5	177.4	59.7	-88.9	0	0	0	114.2	N413 L416 V420 D603 R608	N413-Y605 HydrophobicContact CB-CE1 3.71Å; N413-Y605 WeakPolarHBondContact O-CE1 3.45Å; N413-Y605 PolarHBondContact OD1-OH 3.44Å; N413-Y605 VanDerWaalsContact OD1-OH 3.08Å; L416-Y605 HydrophobicContact CB-CD2 4.48Å; L416-Y605 HydrophobicContact CB-CE2 3.73Å; L416-Y605 VanDerWaalsContact CD1-OH 3.28Å; L416-Y605 WeakPolarHBondContact CD1-OH 3.07Å; V420-Y605 HydrophobicContact CG2-CD2 4.13Å; D603-Y605 HydrophobicContact CB-CD1 4.18Å; D603-Y605 HydrophobicContact CB-CE1 3.74Å; D603-Y605 PolarHBondContact O-N 3.43Å; Y605-R608 PolarHBondContact O-NE 2.68Å
606	E	74	Confident	81.4	Confident	46 Å²	46	32.2 Å²	32.2	22%	0.215	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-17.6	-169.8	-75.4	-171.3	136.8	0	0	114.9	K586 R601 D603 R608	K586-E606 IonicContact NZ-OE1 3.94Å; K586-E606 PolarHBondContact NZ-OE1 2.77Å; R601-E606 VanDerWaalsContact CD-OE2 3.28Å; R601-E606 WeakPolarHBondContact CD-OE2 3.49Å; R601-E606 IonicContact CZ-OE1 2.87Å; R601-E606 IonicContact CZ-OE2 3.35Å; R601-E606 IonicContact NE-OE1 3.86Å; R601-E606 PolarHBondContact NE-OE1 3.44Å; R601-E606 IonicContact NE-OE2 3Å; R601-E606 PolarHBondContact NE-OE2 3.31Å; R601-E606 IonicContact NH1-OE1 2.66Å; R601-E606 PolarHBondContact NH1-OE1 2.84Å; R601-E606 IonicContact NH2-OE1 3.64Å; R601-E606 PolarHBondContact NH2-OE1 2.89Å; D603-E606 HydrophobicContact CB-CB 4.39Å; D603-E606 HydrophobicContact CB-CG 3.83Å; D603-E606 PolarHBondContact O-N 2.83Å; E606-R608 PolarHBondContact O-N 2.92Å
607	E	64.9	Low	81.3	Confident	77 Å²	77	31.9 Å²	31.9	36%	0.36	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	17.4	-170.9	-66.2	-168.9	150.8	0	0	116.6
608	R	60.8	Low	81.1	Confident	32 Å²	32	36.1 Å²	36.1	12%	0.121	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	3.2	-164.4	-50	-171.3	-165.9	-149.1	-4.7	115.2	Y605 E606 I610	Y605-R608 PolarHBondContact O-NE 2.68Å; E606-R608 PolarHBondContact O-N 2.92Å; R608-I610 PolarHBondContact O-N 3.47Å
609	D	70.2	Confident	80.8	Confident	26 Å²	26	38.3 Å²	38.3	14%	0.139	19%	0.188	C	C	.	.			trans	-92.2	96.5	-173.4	-165.1	-7.4	0	0	0	113.3	R589 D611 Y612 Y613	R589-D609 IonicContact CZ-OD2 2.72Å; R589-D609 IonicContact NH1-OD1 2.78Å; R589-D609 IonicContact NH1-OD2 3.62Å; R589-D609 PolarHBondContact NH1-OD2 2.99Å; R589-D609 VanDerWaalsContact NH2-CB 3.28Å; R589-D609 IonicContact NH2-OD2 2.69Å; R589-D609 PolarHBondContact NH2-OD2 3.17Å; D609-D611 VanDerWaalsContact C-N 3.33Å; D609-D611 WeakPolarHBondContact OD1-CB 3.04Å; D609-D611 PolarHBondContact OD1-N 2.9Å; D609-Y612 PolarHBondContact OD1-N 3.36Å; D609-Y612 WeakPolarHBondContact OD2-CB 3.45Å; D609-Y613 WeakPolarHBondContact O-CD2 3.37Å; D609-Y613 VanDerWaalsContact O-CE2 3.31Å; D609-Y613 WeakPolarHBondContact O-CE2 3.23Å
610	I	79.6	Confident	80.9	Confident	10 Å²	10	37.4 Å²	37.4	5%	0.051	18%	0.181	C	C	.	.	H	α-helix	trans	-69	-31.7	173.9	-166.5	158.5	0	0	0	112.3	R608 Y612 Y613 L614 P623 V625 V1015 R1018 L1019	R608-I610 PolarHBondContact O-N 3.47Å; I610-Y612 PolarHBondContact O-N 3.11Å; I610-Y613 PolarHBondContact O-N 2.98Å; I610-L614 HydrophobicContact CD1-CD1 4.36Å; I610-L614 HydrophobicContact CG1-CD1 3.78Å; I610-L614 HydrophobicContact CG1-CG 3.98Å; I610-L614 HydrophobicContact CG2-CD1 4.47Å; I610-L614 WeakPolarHBondContact O-CG 3.46Å; I610-L614 PolarHBondContact O-N 3.01Å; I610-P623 HydrophobicContact CD1-CG 3.86Å; I610-V625 HydrophobicContact CG2-CG2 4.01Å; I610-V1015 HydrophobicContact CB-CG1 4.33Å; I610-V1015 HydrophobicContact CB-CG2 4.05Å; I610-V1015 HydrophobicContact CD1-CG1 4.36Å; I610-V1015 HydrophobicContact CG1-CG1 4.03Å; I610-R1018 HydrophobicContact CD1-CB 3.97Å; I610-L1019 HydrophobicContact CD1-CD2 4.41Å; I610-L1019 HydrophobicContact CD1-CG 4.26Å
611	D	75.7	Confident	80.8	Confident	4 Å²	4	37.4 Å²	37.4	2%	0.021	18%	0.183	C	C	.	.	H	α-helix	trans	-69.5	-39.1	-173.7	-77.3	-30.6	0	0	0	112.7	D609 Y613 L614 D615 V625 W627 Q628	D609-D611 VanDerWaalsContact C-N 3.33Å; D609-D611 WeakPolarHBondContact OD1-CB 3.04Å; D609-D611 PolarHBondContact OD1-N 2.9Å; D611-Y613 PolarHBondContact O-N 3.4Å; D611-Y613 VanDerWaalsContact O-N 3.17Å; D611-L614 PolarHBondContact O-N 2.74Å; D611-L614 VanDerWaalsContact O-N 3.12Å; D611-D615 WeakPolarHBondContact O-CB 3.25Å; D611-D615 PolarHBondContact O-N 3.5Å; D611-V625 WeakPolarHBondContact OD1-CG2 3.26Å; D611-V625 WeakPolarHBondContact OD2-CG1 3.02Å; D611-W627 HydrophobicContact CB-CZ2 4.21Å; D611-W627 WeakPolarHBondContact OD2-CZ2 3.4Å; D611-W627 PolarHBondContact OD2-NE1 3.48Å; D611-Q628 PolarHBondContact OD1-NE2 2.86Å; D611-Q628 PolarHBondContact OD2-NE2 3.43Å
612	Y	79.3	Confident	80.8	Confident	100 Å²	100	42 Å²	42	39%	0.392	20%	0.2	S	C	.	.	H	α-helix	trans	-52.1	-37.9	174.3	179.2	-115.5	0	0	0	111.7	D609 I610 V937	D609-Y612 PolarHBondContact OD1-N 3.36Å; D609-Y612 WeakPolarHBondContact OD2-CB 3.45Å; I610-Y612 PolarHBondContact O-N 3.11Å; Y612-V937 HydrophobicContact CD1-CG2 3.92Å; Y612-V937 HydrophobicContact CE1-CB 3.99Å; Y612-V937 HydrophobicContact CE1-CG2 3.27Å
613	Y	87.5	Confident	81.2	Confident	27 Å²	27	38.7 Å²	38.7	11%	0.106	19%	0.186	C	C	.	.	H	α-helix	trans	-78.6	-44.4	174.9	-60.1	-70.1	0	0	0	113.3	D609 I610 D611 D615 E616 F617 V937 V969 A970 V973 V1015	D609-Y613 WeakPolarHBondContact O-CD2 3.37Å; D609-Y613 VanDerWaalsContact O-CE2 3.31Å; D609-Y613 WeakPolarHBondContact O-CE2 3.23Å; I610-Y613 PolarHBondContact O-N 2.98Å; D611-Y613 PolarHBondContact O-N 3.4Å; D611-Y613 VanDerWaalsContact O-N 3.17Å; Y613-D615 VanDerWaalsContact C-N 3.27Å; Y613-D615 PolarHBondContact O-N 2.88Å; Y613-E616 PolarHBondContact O-N 3.32Å; Y613-F617 WeakPolarHBondContact O-CB 3.29Å; Y613-F617 WeakPolarHBondContact O-CD2 3.39Å; Y613-F617 PolarHBondContact O-N 3.4Å; Y613-V937 HydrophobicContact CD1-CG1 4.16Å; Y613-V937 HydrophobicContact CD1-CG2 3.73Å; Y613-V937 HydrophobicContact CE1-CG2 3.59Å; Y613-V969 HydrophobicContact CE2-CG1 4.23Å; Y613-A970 HydrophobicContact CE1-CB 3.8Å; Y613-V973 HydrophobicContact CD1-CB 4.26Å; Y613-V973 HydrophobicContact CD1-CG1 4.15Å; Y613-V973 HydrophobicContact CD1-CG2 4.3Å; Y613-V973 HydrophobicContact CD2-CG2 4.47Å; Y613-V973 HydrophobicContact CG-CG1 4.16Å; Y613-V973 HydrophobicContact CG-CG2 4.25Å; Y613-V1015 HydrophobicContact CD2-CG1 3.89Å; Y613-V1015 HydrophobicContact CE2-CG1 4.2Å; Y613-V1015 HydrophobicContact CE2-CG2 4.41Å
614	L	84.6	Confident	81.4	Confident	1 Å²	1	41 Å²	41	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-66.5	-27.4	-176.5	-67.7	176.4	0	0	0	113.2	I610 D611 F617 L620 R622 L1019	I610-L614 HydrophobicContact CD1-CD1 4.36Å; I610-L614 HydrophobicContact CG1-CD1 3.78Å; I610-L614 HydrophobicContact CG1-CG 3.98Å; I610-L614 HydrophobicContact CG2-CD1 4.47Å; I610-L614 WeakPolarHBondContact O-CG 3.46Å; I610-L614 PolarHBondContact O-N 3.01Å; D611-L614 PolarHBondContact O-N 2.74Å; D611-L614 VanDerWaalsContact O-N 3.12Å; L614-F617 CarbonylContact O-C 3.32Å; L614-L620 HydrophobicContact CD2-CB 3.83Å; L614-L620 HydrophobicContact CD2-CD1 4.39Å; L614-R622 HydrophobicContact CD1-CB 4.21Å; L614-R622 HydrophobicContact CD1-CG 4.06Å; L614-R622 HydrophobicContact CD2-CG 4.3Å; L614-R622 PolarHBondContact O-NH2 3.48Å; L614-L1019 HydrophobicContact CD2-CD2 4.16Å
615	D	81.9	Confident	81.6	Confident	34 Å²	34	38.5 Å²	38.5	18%	0.182	19%	0.188	C	C	.	.	H	α-helix	trans	-66.4	-38.9	173.3	-86.3	-7.1	0	0	0	112.8	D611 Y613 T618 R622 R667 R671	D611-D615 WeakPolarHBondContact O-CB 3.25Å; D611-D615 PolarHBondContact O-N 3.5Å; Y613-D615 VanDerWaalsContact C-N 3.27Å; Y613-D615 PolarHBondContact O-N 2.88Å; D615-T618 WeakPolarHBondContact O-CG2 3.36Å; D615-R622 IonicContact OD1-NH2 3.4Å; D615-R667 IonicContact OD2-NH1 3.82Å; D615-R671 IonicContact OD1-CZ 3.16Å; D615-R671 VanDerWaalsContact OD1-CZ 3.28Å; D615-R671 IonicContact OD1-NE 3.32Å; D615-R671 PolarHBondContact OD1-NE 3.45Å; D615-R671 IonicContact OD1-NH2 2.73Å; D615-R671 PolarHBondContact OD1-NH2 2.89Å; D615-R671 IonicContact OD2-CZ 3.88Å; D615-R671 IonicContact OD2-NH2 3.32Å; D615-R671 PolarHBondContact OD2-NH2 3.49Å
616	E	85.6	Confident	81.6	Confident	52 Å²	52	38.4 Å²	38.4	24%	0.243	19%	0.189	C	C	.	.	H	α-helix	trans	-81.6	-45.8	176.7	-70.7	-66.7	146.2	0	0	110.5	Y613 T618 V937 R941	Y613-E616 PolarHBondContact O-N 3.32Å; E616-T618 PolarHBondContact O-N 2.81Å; E616-V937 HydrophobicContact CB-CG1 3.52Å; E616-V937 HydrophobicContact CG-CB 4.37Å; E616-V937 HydrophobicContact CG-CG1 3.68Å; E616-R941 WeakPolarHBondContact O-CD 3.3Å; E616-R941 WeakPolarHBondContact OE2-CD 3.41Å; E616-R941 IonicContact OE2-CZ 2.79Å; E616-R941 IonicContact OE2-NE 3.89Å; E616-R941 PolarHBondContact OE2-NE 3.45Å; E616-R941 IonicContact OE2-NH2 3.2Å
617	F	89.7	Confident	82.1	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.182	C	C	.	.			trans	-95.4	64.7	-177.6	-62.5	-70	0	0	0	112.3	Y613 L614 S619 L620 V937 L940 R941 V973 A974 F977	Y613-F617 WeakPolarHBondContact O-CB 3.29Å; Y613-F617 WeakPolarHBondContact O-CD2 3.39Å; Y613-F617 PolarHBondContact O-N 3.4Å; L614-F617 CarbonylContact O-C 3.32Å; F617-S619 PolarHBondContact O-N 3.29Å; F617-L620 HydrophobicContact CB-CD1 3.63Å; F617-L620 HydrophobicContact CB-CG 3.96Å; F617-L620 HydrophobicContact CG-CD1 4.32Å; F617-L620 WeakPolarHBondContact O-CB 3.49Å; F617-L620 PolarHBondContact O-N 2.97Å; F617-V937 HydrophobicContact CD2-CG1 4.11Å; F617-V937 HydrophobicContact CE2-CG1 3.59Å; F617-V937 HydrophobicContact CZ-CG1 4.29Å; F617-L940 HydrophobicContact CZ-CB 4.17Å; F617-R941 HydrophobicContact CD1-CB 4.2Å; F617-R941 HydrophobicContact CD1-CG 4.27Å; F617-R941 HydrophobicContact CE1-CB 3.77Å; F617-R941 HydrophobicContact CE1-CG 4.29Å; F617-R941 HydrophobicContact CZ-CB 4.2Å; F617-V973 HydrophobicContact CD2-CG1 3.77Å; F617-V973 HydrophobicContact CE2-CG1 3.91Å; F617-A974 HydrophobicContact CE1-CB 4.39Å; F617-A974 HydrophobicContact CZ-CB 3.84Å; F617-F977 HydrophobicContact CB-CB 4.49Å; F617-F977 HydrophobicContact CB-CD2 3.81Å; F617-F977 HydrophobicContact CB-CE2 4.33Å; F617-F977 HydrophobicContact CB-CG 4.31Å; F617-F977 HydrophobicContact CD1-CB 3.77Å; F617-F977 AromaticContact CD1-CD1 3.63Å; F617-F977 HydrophobicContact CD1-CD1 3.63Å; F617-F977 AromaticContact CD1-CD2 3.54Å; F617-F977 HydrophobicContact CD1-CD2 3.54Å; F617-F977 HydrophobicContact CD1-CE1 4.07Å; F617-F977 AromaticContact CD1-CE2 3.92Å; F617-F977 HydrophobicContact CD1-CE2 3.92Å; F617-F977 AromaticContact CD1-CG 3.35Å; F617-F977 HydrophobicContact CD1-CG 3.35Å; F617-F977 HydrophobicContact CD1-CZ 4.2Å; F617-F977 HydrophobicContact CE1-CB 4.17Å; F617-F977 AromaticContact CE1-CD1 3.8Å; F617-F977 HydrophobicContact CE1-CD1 3.8Å; F617-F977 HydrophobicContact CE1-CD2 4.49Å; F617-F977 HydrophobicContact CE1-CE1 4.31Å; F617-F977 AromaticContact CE1-CG 3.91Å; F617-F977 HydrophobicContact CE1-CG 3.91Å; F617-F977 HydrophobicContact CG-CB 4.23Å; F617-F977 HydrophobicContact CG-CD2 4.09Å; F617-F977 HydrophobicContact CG-CG 4.13Å
618	T	85.5	Confident	83	Confident	104 Å²	104	36.6 Å²	36.6	64%	0.638	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-17.2	-170.8	58.1	0	0	0	0	116.3	D615 E616	D615-T618 WeakPolarHBondContact O-CG2 3.36Å; E616-T618 PolarHBondContact O-N 2.81Å
619	S	86.5	Confident	84.3	Confident	50 Å²	50	37.1 Å²	37.1	35%	0.35	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-12.4	176.2	65.5	0	0	0	0	113.8	F617 F977 F980 C981	F617-S619 PolarHBondContact O-N 3.29Å; S619-F977 VanDerWaalsContact OG-CD2 3.25Å; S619-F977 WeakPolarHBondContact OG-CD2 3.42Å; S619-F977 WeakPolarHBondContact OG-CE2 3.42Å; S619-F980 VanDerWaalsContact O-CE1 3.27Å; S619-F980 WeakPolarHBondContact O-CE1 3.49Å; S619-C981 PolarHBondContact OG-SG 3.2Å
620	L	90.7	Very high	85.4	Confident	5 Å²	5	36.2 Å²	36.2	3%	0.026	18%	0.182	C	C	.	.	S	Bend	trans	-66.2	145.9	175	-71.5	177.8	0	0	0	110.7	L614 F617 R622 V973 I976 F977 L1019 F1023	L614-L620 HydrophobicContact CD2-CB 3.83Å; L614-L620 HydrophobicContact CD2-CD1 4.39Å; F617-L620 HydrophobicContact CB-CD1 3.63Å; F617-L620 HydrophobicContact CB-CG 3.96Å; F617-L620 HydrophobicContact CG-CD1 4.32Å; F617-L620 WeakPolarHBondContact O-CB 3.49Å; F617-L620 PolarHBondContact O-N 2.97Å; L620-R622 PolarHBondContact O-N 3.35Å; L620-V973 HydrophobicContact CD1-CG1 3.83Å; L620-I976 HydrophobicContact CD2-CG2 4.06Å; L620-F977 HydrophobicContact CD1-CB 4.35Å; L620-F977 HydrophobicContact CD2-CB 4.03Å; L620-F977 HydrophobicContact CG-CB 4.22Å; L620-F977 HydrophobicContact CG-CD2 4.29Å; L620-L1019 HydrophobicContact CD1-CD1 4.47Å; L620-L1019 HydrophobicContact CD1-CD2 4.32Å; L620-F1023 HydrophobicContact CD2-CE2 4.17Å; L620-F1023 HydrophobicContact CD2-CZ 3.68Å
621	P	86.9	Confident	86	Confident	24 Å²	24	36.9 Å²	36.9	16%	0.156	19%	0.188	C	C	.	.			trans	-60.2	137.6	169.9	26.7	-32.8	0	0	0	109.7	P623 A1022 F1023 L1026	P621-P623 WeakPolarHBondContact O-CD 3.34Å; P621-A1022 HydrophobicContact CB-CB 4.05Å; P621-A1022 HydrophobicContact CG-CB 4.05Å; P621-F1023 HydrophobicContact CG-CD1 3.99Å; P621-F1023 HydrophobicContact CG-CD2 4.16Å; P621-F1023 HydrophobicContact CG-CE1 3.65Å; P621-F1023 HydrophobicContact CG-CE2 3.9Å; P621-F1023 HydrophobicContact CG-CG 4.23Å; P621-F1023 HydrophobicContact CG-CZ 3.66Å; P621-L1026 HydrophobicContact CB-CD1 3.88Å; P621-L1026 HydrophobicContact CG-CD1 4.14Å
622	R	85.8	Confident	86.8	Confident	119 Å²	119	37.3 Å²	37.3	45%	0.449	19%	0.191	S	C	.	.			trans	-101.6	107.4	-178.3	-64.1	-170.5	169.3	-140.1	-6	110	L614 D615 L620	L614-R622 HydrophobicContact CD1-CB 4.21Å; L614-R622 HydrophobicContact CD1-CG 4.06Å; L614-R622 HydrophobicContact CD2-CG 4.3Å; L614-R622 PolarHBondContact O-NH2 3.48Å; D615-R622 IonicContact OD1-NH2 3.4Å; L620-R622 PolarHBondContact O-N 3.35Å
623	P	87	Confident	87.4	Confident	16 Å²	16	34 Å²	34	10%	0.104	18%	0.179	C	C	.	.			trans	-60.2	162.6	166.7	-20.1	33.7	0	0	0	111.1	I610 P621 V625 R1018 A1022	I610-P623 HydrophobicContact CD1-CG 3.86Å; P621-P623 WeakPolarHBondContact O-CD 3.34Å; P623-V625 WeakPolarHBondContact O-CG2 3.29Å; P623-V625 PolarHBondContact O-N 2.84Å; P623-R1018 HydrophobicContact CG-CB 4.17Å; P623-A1022 HydrophobicContact CG-CB 4.15Å
624	H	86	Confident	87.6	Confident	61 Å²	61	34.8 Å²	34.8	28%	0.282	18%	0.184	S	C	.	.			trans	-62.8	134.3	174.3	176.4	63.7	0	0	0	110.6	H534 S629 R1018	H534-H624 AromaticContact CD2-CD2 3.97Å; H534-H624 AromaticContact CE1-CD2 3.75Å; H534-H624 AromaticContact NE2-CD2 3.69Å; H624-S629 PolarHBondContact CE1-OG 3.27Å; H624-R1018 PolarHBondContact O-NH1 3.17Å; H624-R1018 PolarHBondContact O-NH2 3.1Å
625	V	86.3	Confident	87.9	Confident	12 Å²	12	39 Å²	39	7%	0.073	20%	0.203	C	C	.	.			trans	-121.2	102.5	-179.8	-172.2	0	0	0	0	109.7	I610 D611 P623 W627 Q628	I610-V625 HydrophobicContact CG2-CG2 4.01Å; D611-V625 WeakPolarHBondContact OD1-CG2 3.26Å; D611-V625 WeakPolarHBondContact OD2-CG1 3.02Å; P623-V625 WeakPolarHBondContact O-CG2 3.29Å; P623-V625 PolarHBondContact O-N 2.84Å; V625-W627 HydrophobicContact CG1-CG 4.35Å; V625-W627 PolarHBondContact O-N 2.99Å; V625-Q628 HydrophobicContact CB-CB 4.4Å; V625-Q628 HydrophobicContact CB-CG 4.01Å; V625-Q628 HydrophobicContact CG1-CG 4.03Å; V625-Q628 WeakPolarHBondContact O-CB 3.38Å; V625-Q628 PolarHBondContact O-N 3.43Å
626	P	85.4	Confident	88.4	Confident	7 Å²	7	37.3 Å²	37.3	5%	0.045	19%	0.194	C	C	.	.	H	α-helix	trans	-51.6	-47.6	-168.1	-35.4	38.4	0	0	0	115.3	Y428 E537 Q628 S629 M630	Y428-P626 HydrophobicContact CE2-CB 4.5Å; E537-P626 HydrophobicContact CG-CB 4.19Å; E537-P626 WeakPolarHBondContact OE2-CB 3.37Å; E537-P626 VanDerWaalsContact OE2-CG 3.25Å; E537-P626 WeakPolarHBondContact OE2-CG 3.43Å; P626-Q628 PolarHBondContact O-N 2.77Å; P626-Q628 VanDerWaalsContact O-N 3.15Å; P626-S629 PolarHBondContact O-N 3.23Å; P626-S629 VanDerWaalsContact O-N 3.07Å; P626-S629 PolarHBondContact O-OG 2.78Å; P626-M630 PolarHBondContact O-N 3.47Å
627	W	83.9	Confident	88.9	Confident	23 Å²	23	35.1 Å²	35.1	9%	0.087	18%	0.184	C	C	.	.	H	α-helix	trans	-67.6	-17.2	-178.4	75.1	-84.9	0	0	0	113.4	R589 D611 V625 M630 K633	R589-W627 HydrophobicContact CB-CB 4.25Å; R589-W627 HydrophobicContact CB-CD2 3.69Å; R589-W627 HydrophobicContact CB-CE3 3.92Å; R589-W627 HydrophobicContact CB-CG 3.87Å; R589-W627 HydrophobicContact CB-CZ3 4.36Å; R589-W627 WeakPolarHBondContact O-CZ3 3.42Å; D611-W627 HydrophobicContact CB-CZ2 4.21Å; D611-W627 WeakPolarHBondContact OD2-CZ2 3.4Å; D611-W627 PolarHBondContact OD2-NE1 3.48Å; V625-W627 HydrophobicContact CG1-CG 4.35Å; V625-W627 PolarHBondContact O-N 2.99Å; W627-M630 HydrophobicContact CB-CE 4.43Å; W627-M630 HydrophobicContact CB-SD 4.09Å; W627-K633 VanDerWaalsContact O-CD 3.24Å; W627-K633 WeakPolarHBondContact O-CD 3.34Å; W627-K633 PolarHBondContact O-NZ 3.43Å
628	Q	85.1	Confident	89	Confident	61 Å²	61	36.6 Å²	36.6	29%	0.285	19%	0.193	S	C	.	.	H	α-helix	trans	-71.3	-35	173.1	-67.7	-166.3	-0.8	0	0	112.1	D611 V625 P626 K633	D611-Q628 PolarHBondContact OD1-NE2 2.86Å; D611-Q628 PolarHBondContact OD2-NE2 3.43Å; V625-Q628 HydrophobicContact CB-CB 4.4Å; V625-Q628 HydrophobicContact CB-CG 4.01Å; V625-Q628 HydrophobicContact CG1-CG 4.03Å; V625-Q628 WeakPolarHBondContact O-CB 3.38Å; V625-Q628 PolarHBondContact O-N 3.43Å; P626-Q628 PolarHBondContact O-N 2.77Å; P626-Q628 VanDerWaalsContact O-N 3.15Å; Q628-K633 PolarHBondContact O-NZ 2.65Å
629	S	87.7	Confident	89.5	Confident	43 Å²	43	32.8 Å²	32.8	30%	0.301	17%	0.169	S	C	.	.	H	α-helix	trans	-86.9	-12.4	-178.7	38.4	0	0	0	0	114.9	K538 H624 P626 S631	K538-S629 VanDerWaalsContact CG-O 3.3Å; K538-S629 WeakPolarHBondContact CG-O 3.45Å; H624-S629 PolarHBondContact CE1-OG 3.27Å; P626-S629 PolarHBondContact O-N 3.23Å; P626-S629 VanDerWaalsContact O-N 3.07Å; P626-S629 PolarHBondContact O-OG 2.78Å; S629-S631 PolarHBondContact O-N 2.63Å
630	M	92.5	Very high	89.9	Confident	7 Å²	7	30.4 Å²	30.4	3%	0.034	15%	0.152	C	C	.	.			trans	-53.5	123.8	-179.4	-75	176.4	177.7	0	0	112.9	Y428 W541 P626 W627 K633	Y428-M630 HydrophobicContact CD1-CE 3.37Å; Y428-M630 HydrophobicContact CD1-SD 4.3Å; Y428-M630 HydrophobicContact CD2-CE 3.59Å; Y428-M630 HydrophobicContact CE1-CE 3.28Å; Y428-M630 HydrophobicContact CE1-SD 4.27Å; Y428-M630 HydrophobicContact CE2-CE 3.55Å; Y428-M630 HydrophobicContact CG-CE 3.51Å; Y428-M630 VanDerWaalsContact CZ-CE 3.4Å; W541-M630 HydrophobicContact CB-CE 3.71Å; W541-M630 HydrophobicContact CB-CG 4.33Å; W541-M630 HydrophobicContact CB-SD 4.05Å; W541-M630 HydrophobicContact CD2-CB 4.49Å; W541-M630 HydrophobicContact CD2-CG 4.32Å; W541-M630 HydrophobicContact CD2-SD 3.86Å; W541-M630 HydrophobicContact CE3-SD 4.21Å; W541-M630 HydrophobicContact CG-CB 4.35Å; W541-M630 HydrophobicContact CG-CE 4.11Å; W541-M630 HydrophobicContact CG-CG 3.88Å; W541-M630 HydrophobicContact CG-SD 3.78Å; P626-M630 PolarHBondContact O-N 3.47Å; W627-M630 HydrophobicContact CB-CE 4.43Å; W627-M630 HydrophobicContact CB-SD 4.09Å; M630-K633 HydrophobicContact CB-CB 4.18Å; M630-K633 HydrophobicContact CB-CD 4.17Å
631	S	92.7	Very high	90.1	Very high	24 Å²	24	30.2 Å²	30.2	17%	0.168	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	148.4	176.9	-167.9	0	0	0	0	110.6	Q508 K538 W541 S629 K633	Q508-S631 PolarHBondContact OE1-OG 3.45Å; K538-S631 PolarHBondContact O-N 2.82Å; W541-S631 PolarHBondContact NE1-O 3.17Å; S629-S631 PolarHBondContact O-N 2.63Å; S631-K633 PolarHBondContact O-N 2.84Å
632	S	92	Very high	90.2	Very high	13 Å²	13	32.9 Å²	32.9	9%	0.091	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	13.2	-179.8	-55.4	0	0	0	0	117.1	E634 E635 V636	S632-E634 VanDerWaalsContact C-N 3.35Å; S632-E634 PolarHBondContact O-N 3.36Å; S632-E635 WeakPolarHBondContact CA-OE2 3.5Å; S632-E635 PolarHBondContact O-N 2.63Å; S632-V636 WeakPolarHBondContact O-CG2 3.45Å; S632-V636 PolarHBondContact O-N 3.24Å
633	K	92.7	Very high	90.6	Very high	31 Å²	31	27.8 Å²	27.8	14%	0.135	15%	0.145	C	C	.	.	H	α-helix	trans	-65.9	-32.2	-176.1	73.1	-178.4	-179.6	-176.5	0	114.1	W541 L590 W627 Q628 M630 S631 F637	W541-K633 HydrophobicContact CZ2-CB 4.16Å; L590-K633 HydrophobicContact CD2-CB 4.25Å; W627-K633 VanDerWaalsContact O-CD 3.24Å; W627-K633 WeakPolarHBondContact O-CD 3.34Å; W627-K633 PolarHBondContact O-NZ 3.43Å; Q628-K633 PolarHBondContact O-NZ 2.65Å; M630-K633 HydrophobicContact CB-CB 4.18Å; M630-K633 HydrophobicContact CB-CD 4.17Å; S631-K633 PolarHBondContact O-N 2.84Å; K633-F637 VanDerWaalsContact O-CB 3.26Å; K633-F637 WeakPolarHBondContact O-CB 3.4Å; K633-F637 PolarHBondContact O-N 2.66Å
634	E	90.6	Very high	90.9	Very high	43 Å²	43	27 Å²	27	20%	0.201	14%	0.14	C	C	.	.	H	α-helix	trans	-72.1	-36.8	-178.8	-69.9	-170	179.2	0	0	110.4	S632 T638 K665 S668	S632-E634 VanDerWaalsContact C-N 3.35Å; S632-E634 PolarHBondContact O-N 3.36Å; E634-T638 WeakPolarHBondContact O-CB 3.35Å; E634-T638 PolarHBondContact O-N 2.82Å; E634-T638 PolarHBondContact O-OG1 3.16Å; E634-K665 IonicContact OE2-NZ 3.16Å; E634-K665 PolarHBondContact OE2-NZ 3.03Å; E634-S668 VanDerWaalsContact OE1-CB 3.23Å; E634-S668 WeakPolarHBondContact OE1-CB 3.39Å; E634-S668 PolarHBondContact OE1-OG 3Å
635	E	90.7	Very high	91.1	Very high	89 Å²	89	24.8 Å²	24.8	42%	0.416	13%	0.131	S	C	.	.	H	α-helix	trans	-65.4	-50.4	174.7	-64.2	77.9	-177.7	0	0	110.1	F497 S632 F637 T638 L639	F497-E635 HydrophobicContact CD2-CG 4.34Å; F497-E635 HydrophobicContact CE2-CB 4.4Å; F497-E635 HydrophobicContact CE2-CG 4.23Å; S632-E635 WeakPolarHBondContact CA-OE2 3.5Å; S632-E635 PolarHBondContact O-N 2.63Å; E635-F637 VanDerWaalsContact C-N 3.35Å; E635-F637 PolarHBondContact O-N 2.65Å; E635-T638 WeakPolarHBondContact O-CB 3.42Å; E635-T638 PolarHBondContact O-N 3.09Å; E635-T638 VanDerWaalsContact O-N 3.11Å; E635-L639 PolarHBondContact O-N 3.09Å
636	V	94.1	Very high	91.1	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-59.6	-45.8	175.5	174.1	0	0	0	0	110.8	V501 W541 F542 L590 S632 T638 L639 F640	V501-V636 HydrophobicContact CG1-CG2 4.18Å; W541-V636 HydrophobicContact CH2-CB 3.91Å; W541-V636 HydrophobicContact CH2-CG1 3.86Å; W541-V636 HydrophobicContact CH2-CG2 3.89Å; W541-V636 HydrophobicContact CZ2-CB 4.49Å; W541-V636 HydrophobicContact CZ2-CG2 4.13Å; F542-V636 HydrophobicContact CD2-CG1 4.26Å; F542-V636 HydrophobicContact CD2-CG2 4.26Å; F542-V636 HydrophobicContact CE2-CG1 3.79Å; F542-V636 HydrophobicContact CE2-CG2 4.22Å; L590-V636 HydrophobicContact CD1-CG1 3.98Å; S632-V636 WeakPolarHBondContact O-CG2 3.45Å; S632-V636 PolarHBondContact O-N 3.24Å; V636-T638 VanDerWaalsContact C-N 3.25Å; V636-T638 PolarHBondContact O-N 3.47Å; V636-L639 WeakPolarHBondContact O-CB 3.22Å; V636-L639 PolarHBondContact O-N 2.89Å; V636-L639 VanDerWaalsContact O-N 3.14Å; V636-F640 HydrophobicContact CG1-CD2 3.69Å; V636-F640 HydrophobicContact CG1-CE2 3.6Å; V636-F640 WeakPolarHBondContact O-CD2 3.35Å; V636-F640 PolarHBondContact O-N 3.05Å
637	F	95	Very high	91.2	Very high	5 Å²	5	29 Å²	29	2%	0.022	15%	0.149	C	C	.	.	H	α-helix	trans	-57.6	-39.5	175.5	178	-116	0	0	0	112.8	L590 A591 F593 K633 E635 F640 C641 Q661	L590-F637 HydrophobicContact CB-CB 3.83Å; L590-F637 HydrophobicContact CB-CD2 4.19Å; L590-F637 HydrophobicContact CB-CG 4.31Å; L590-F637 HydrophobicContact CD1-CB 4.48Å; A591-F637 HydrophobicContact CB-CD1 3.44Å; A591-F637 VanDerWaalsContact CB-CD1 3.44Å; A591-F637 HydrophobicContact CB-CD2 3.81Å; A591-F637 HydrophobicContact CB-CE1 3.33Å; A591-F637 HydrophobicContact CB-CE2 3.74Å; A591-F637 HydrophobicContact CB-CG 3.66Å; A591-F637 HydrophobicContact CB-CZ 3.49Å; A591-F637 VanDerWaalsContact CB-CZ 3.49Å; F593-F637 HydrophobicContact CE1-CE2 4.27Å; F593-F637 HydrophobicContact CE1-CZ 4.17Å; F593-F637 HydrophobicContact CE2-CE2 4.16Å; F593-F637 HydrophobicContact CE2-CZ 4.39Å; F593-F637 AromaticContact CZ-CE2 3.53Å; F593-F637 HydrophobicContact CZ-CE2 3.53Å; F593-F637 AromaticContact CZ-CZ 3.78Å; F593-F637 HydrophobicContact CZ-CZ 3.78Å; K633-F637 VanDerWaalsContact O-CB 3.26Å; K633-F637 WeakPolarHBondContact O-CB 3.4Å; K633-F637 PolarHBondContact O-N 2.66Å; E635-F637 VanDerWaalsContact C-N 3.35Å; E635-F637 PolarHBondContact O-N 2.65Å; F637-F640 PolarHBondContact O-N 3.25Å; F637-C641 VanDerWaalsContact CE2-SG 3.55Å; F637-C641 WeakPolarHBondContact CZ-SG 3.44Å; F637-C641 PolarHBondContact O-N 2.89Å; F637-C641 PolarHBondContact O-SG 3.38Å; F637-Q661 HydrophobicContact CD1-CG 4.37Å; F637-Q661 HydrophobicContact CE1-CG 3.76Å; F637-Q661 HydrophobicContact CZ-CG 4.46Å
638	T	93.2	Very high	91.6	Very high	31 Å²	31	28.5 Å²	28.5	19%	0.19	15%	0.148	C	C	.	.	H	α-helix	trans	-63.1	-45.4	176.6	-60.7	0	0	0	0	110.7	E634 E635 V636 F640 C641 D642 Y687	E634-T638 WeakPolarHBondContact O-CB 3.35Å; E634-T638 PolarHBondContact O-N 2.82Å; E634-T638 PolarHBondContact O-OG1 3.16Å; E635-T638 WeakPolarHBondContact O-CB 3.42Å; E635-T638 PolarHBondContact O-N 3.09Å; E635-T638 VanDerWaalsContact O-N 3.11Å; V636-T638 VanDerWaalsContact C-N 3.25Å; V636-T638 PolarHBondContact O-N 3.47Å; T638-F640 PolarHBondContact O-N 3.43Å; T638-C641 WeakPolarHBondContact O-CB 3.34Å; T638-C641 PolarHBondContact O-N 2.91Å; T638-C641 VanDerWaalsContact O-N 3.15Å; T638-D642 PolarHBondContact O-N 3.42Å; T638-Y687 PolarHBondContact OG1-OH 3.14Å
639	L	93.9	Very high	91.8	Very high	25 Å²	25	28.7 Å²	28.7	13%	0.131	15%	0.154	C	C	.	.	H	α-helix	trans	-60.2	-44.9	175.4	-67.5	170.8	0	0	0	112.4	G474 F476 E635 V636 C641 D642 H643	G474-L639 VanDerWaalsContact O-CB 3.28Å; G474-L639 WeakPolarHBondContact O-CB 3.46Å; G474-L639 WeakPolarHBondContact O-CD1 3.42Å; F476-L639 HydrophobicContact CB-CD1 4.3Å; F476-L639 HydrophobicContact CD2-CD2 4.38Å; E635-L639 PolarHBondContact O-N 3.09Å; V636-L639 WeakPolarHBondContact O-CB 3.22Å; V636-L639 PolarHBondContact O-N 2.89Å; V636-L639 VanDerWaalsContact O-N 3.14Å; L639-C641 VanDerWaalsContact C-N 3.3Å; L639-C641 PolarHBondContact O-N 3.44Å; L639-D642 PolarHBondContact O-N 3.2Å; L639-H643 WeakPolarHBondContact O-CB 3.34Å; L639-H643 PolarHBondContact O-CD2 3.44Å; L639-H643 VanDerWaalsContact O-CD2 3.25Å; L639-H643 PolarHBondContact O-N 2.96Å
640	F	96	Very high	91.8	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-56.9	-44	174.1	-89.4	-83.5	0	0	0	111.7	V432 V435 Q436 L439 F473 L585 L588 L590 V636 F637 T638 S644	V432-F640 HydrophobicContact CG1-CZ 4.31Å; V435-F640 HydrophobicContact CG1-CE1 4.08Å; Q436-F640 HydrophobicContact CG-CE1 4.15Å; Q436-F640 HydrophobicContact CG-CZ 3.73Å; L439-F640 HydrophobicContact CD1-CD1 4.27Å; L439-F640 HydrophobicContact CD1-CE1 4.4Å; F473-F640 AromaticContact CD1-CD1 3.56Å; F473-F640 HydrophobicContact CD1-CD1 3.56Å; F473-F640 AromaticContact CD1-CE1 3.72Å; F473-F640 HydrophobicContact CD1-CE1 3.72Å; F473-F640 HydrophobicContact CD1-CG 4.49Å; F473-F640 AromaticContact CE1-CD1 3.57Å; F473-F640 HydrophobicContact CE1-CD1 3.57Å; F473-F640 HydrophobicContact CE1-CE1 4.18Å; F473-F640 HydrophobicContact CE1-CG 4.38Å; L585-F640 HydrophobicContact CD2-CB 3.78Å; L585-F640 HydrophobicContact CD2-CD1 3.53Å; L585-F640 HydrophobicContact CD2-CE1 4.35Å; L585-F640 HydrophobicContact CD2-CG 3.81Å; L588-F640 HydrophobicContact CD1-CE1 4.49Å; L588-F640 HydrophobicContact CD1-CZ 4.23Å; L590-F640 HydrophobicContact CD1-CD2 4.24Å; L590-F640 HydrophobicContact CD1-CE2 4.4Å; V636-F640 HydrophobicContact CG1-CD2 3.69Å; V636-F640 HydrophobicContact CG1-CE2 3.6Å; V636-F640 WeakPolarHBondContact O-CD2 3.35Å; V636-F640 PolarHBondContact O-N 3.05Å; F637-F640 PolarHBondContact O-N 3.25Å; T638-F640 PolarHBondContact O-N 3.43Å; F640-S644 VanDerWaalsContact O-CB 3.25Å; F640-S644 WeakPolarHBondContact O-CB 3.42Å; F640-S644 PolarHBondContact O-N 3.25Å; F640-S644 PolarHBondContact O-OG 3.38Å
641	C	94.3	Very high	91.6	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-65	-48.3	177.9	-67.8	0	0	0	0	111.9	F637 T638 L639 H643 S644 C645 Q661	F637-C641 VanDerWaalsContact CE2-SG 3.55Å; F637-C641 WeakPolarHBondContact CZ-SG 3.44Å; F637-C641 PolarHBondContact O-N 2.89Å; F637-C641 PolarHBondContact O-SG 3.38Å; T638-C641 WeakPolarHBondContact O-CB 3.34Å; T638-C641 PolarHBondContact O-N 2.91Å; T638-C641 VanDerWaalsContact O-N 3.15Å; L639-C641 VanDerWaalsContact C-N 3.3Å; L639-C641 PolarHBondContact O-N 3.44Å; C641-H643 VanDerWaalsContact C-N 3.32Å; C641-H643 PolarHBondContact O-N 3.45Å; C641-S644 WeakPolarHBondContact O-CB 3.49Å; C641-S644 PolarHBondContact O-N 2.97Å; C641-S644 VanDerWaalsContact O-N 3.14Å; C641-C645 PolarHBondContact O-N 2.93Å; C641-C645 PolarHBondContact O-SG 3.38Å; C641-Q661 HydrophobicContact CB-CG 4.17Å
642	D	90.2	Very high	91.6	Very high	81 Å²	81	29.5 Å²	29.5	43%	0.433	16%	0.16	S	C	.	.	H	α-helix	trans	-62.4	-40.9	-176.9	-67.5	-8.7	0	0	0	111.3	T638 L639	T638-D642 PolarHBondContact O-N 3.42Å; L639-D642 PolarHBondContact O-N 3.2Å
643	H	93.3	Very high	91.6	Very high	12 Å²	12	29 Å²	29	6%	0.056	16%	0.157	C	C	.	.	H	α-helix	trans	-68	-41.6	175.1	-65.2	-173.1	0	0	0	111.5	F473 G474 E475 W478 L639 C641 C645 Q646 F647	F473-H643 HydrophobicContact CD1-CB 4.36Å; F473-H643 HydrophobicContact CD2-CB 4.21Å; F473-H643 HydrophobicContact CE1-CB 3.87Å; F473-H643 HydrophobicContact CE2-CB 3.73Å; F473-H643 HydrophobicContact CZ-CB 3.55Å; G474-H643 PolarHBondContact N-ND1 3.01Å; E475-H643 PolarHBondContact O-CE1 2.59Å; W478-H643 AromaticContact CD2-ND1 3.94Å; W478-H643 HydrophobicContact CE3-CB 4.16Å; W478-H643 AromaticContact CE3-CE1 3.85Å; W478-H643 AromaticContact CE3-CG 3.71Å; W478-H643 AromaticContact CE3-ND1 3.27Å; W478-H643 VanDerWaalsContact CE3-ND1 3.27Å; W478-H643 HydrophobicContact CZ3-CB 3.94Å; W478-H643 AromaticContact CZ3-ND1 3.92Å; L639-H643 WeakPolarHBondContact O-CB 3.34Å; L639-H643 PolarHBondContact O-CD2 3.44Å; L639-H643 VanDerWaalsContact O-CD2 3.25Å; L639-H643 PolarHBondContact O-N 2.96Å; C641-H643 VanDerWaalsContact C-N 3.32Å; C641-H643 PolarHBondContact O-N 3.45Å; H643-C645 VanDerWaalsContact C-N 3.33Å; H643-C645 PolarHBondContact O-N 2.89Å; H643-Q646 VanDerWaalsContact O-CB 3.32Å; H643-Q646 WeakPolarHBondContact O-CB 3.36Å; H643-Q646 WeakPolarHBondContact O-CG 3.47Å; H643-Q646 PolarHBondContact O-N 3.48Å; H643-Q646 VanDerWaalsContact O-N 3.16Å; H643-F647 VanDerWaalsContact O-CD2 3.26Å; H643-F647 WeakPolarHBondContact O-CD2 3.23Å; H643-F647 WeakPolarHBondContact O-CE2 3.46Å
644	S	93.7	Very high	91.6	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.8	-42.7	177.7	-61.5	0	0	0	0	111.9	F473 F640 C641 Q646 F647 L648 L657	F473-S644 WeakPolarHBondContact CZ-OG 2.94Å; F640-S644 VanDerWaalsContact O-CB 3.25Å; F640-S644 WeakPolarHBondContact O-CB 3.42Å; F640-S644 PolarHBondContact O-N 3.25Å; F640-S644 PolarHBondContact O-OG 3.38Å; C641-S644 WeakPolarHBondContact O-CB 3.49Å; C641-S644 PolarHBondContact O-N 2.97Å; C641-S644 VanDerWaalsContact O-N 3.14Å; S644-Q646 PolarHBondContact O-N 3.45Å; S644-F647 PolarHBondContact O-N 2.9Å; S644-L648 WeakPolarHBondContact O-CG 3.47Å; S644-L648 PolarHBondContact O-N 3.03Å; S644-L648 VanDerWaalsContact O-N 3.1Å; S644-L657 VanDerWaalsContact CB-CD1 3.48Å
645	C	89.5	Confident	91.7	Very high	13 Å²	13	26.1 Å²	26.1	9%	0.088	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-12.5	179	-73.3	0	0	0	0	114.2	C641 H643 K696	C641-C645 PolarHBondContact O-N 2.93Å; C641-C645 PolarHBondContact O-SG 3.38Å; H643-C645 VanDerWaalsContact C-N 3.33Å; H643-C645 PolarHBondContact O-N 2.89Å; C645-K696 PolarHBondContact O-NZ 3.49Å
646	Q	86.9	Confident	91.9	Very high	71 Å²	71	21.9 Å²	21.9	33%	0.332	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-26	173.8	-55.9	-179.6	33.2	0	0	112.8	K483 H643 S644	K483-Q646 PolarHBondContact NZ-O 2.92Å; H643-Q646 VanDerWaalsContact O-CB 3.32Å; H643-Q646 WeakPolarHBondContact O-CB 3.36Å; H643-Q646 WeakPolarHBondContact O-CG 3.47Å; H643-Q646 PolarHBondContact O-N 3.48Å; H643-Q646 VanDerWaalsContact O-N 3.16Å; S644-Q646 PolarHBondContact O-N 3.45Å
647	F	88	Confident	91.9	Very high	38 Å²	38	21.9 Å²	21.9	17%	0.167	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.5	-31.2	-175.4	-53.7	-75.6	0	0	0	112.9	F443 S444 F473 W478 S480 H643 S644	F443-F647 HydrophobicContact CB-CB 4.16Å; F443-F647 HydrophobicContact CB-CD1 3.88Å; F443-F647 HydrophobicContact CB-CD2 4.16Å; F443-F647 HydrophobicContact CB-CE1 4.29Å; F443-F647 HydrophobicContact CB-CG 3.79Å; F443-F647 HydrophobicContact CD1-CB 3.76Å; F443-F647 HydrophobicContact CD1-CG 4.33Å; F443-F647 HydrophobicContact CE1-CB 4.42Å; F443-F647 HydrophobicContact CG-CB 4.13Å; F443-F647 HydrophobicContact CG-CG 4.26Å; F443-F647 WeakPolarHBondContact O-CE1 3.36Å; S444-F647 WeakPolarHBondContact OG-CZ 3.36Å; F473-F647 HydrophobicContact CE2-CD2 4.24Å; F473-F647 AromaticContact CE2-CE2 3.83Å; F473-F647 HydrophobicContact CE2-CE2 3.83Å; W478-F647 AromaticContact CH2-CE2 3.74Å; W478-F647 HydrophobicContact CH2-CE2 3.74Å; W478-F647 AromaticContact CH2-CZ 3.64Å; W478-F647 HydrophobicContact CH2-CZ 3.64Å; W478-F647 AromaticContact CZ3-CE2 3.99Å; W478-F647 HydrophobicContact CZ3-CE2 3.99Å; W478-F647 HydrophobicContact CZ3-CZ 4.13Å; S480-F647 VanDerWaalsContact CB-CZ 3.48Å; S480-F647 WeakPolarHBondContact OG-CE1 3.44Å; S480-F647 WeakPolarHBondContact OG-CZ 3.32Å; H643-F647 VanDerWaalsContact O-CD2 3.26Å; H643-F647 WeakPolarHBondContact O-CD2 3.23Å; H643-F647 WeakPolarHBondContact O-CE2 3.46Å; S644-F647 PolarHBondContact O-N 2.9Å
648	L	90.7	Very high	91.9	Very high	11 Å²	11	21.8 Å²	21.8	6%	0.058	13%	0.125	C	C	.	.	S	Bend	trans	-78	141.7	-173	-67.7	176.3	0	0	0	112	F443 C578 L581 S644 A650 W653 S654 L657	F443-L648 HydrophobicContact CE1-CD2 4.38Å; F443-L648 HydrophobicContact CZ-CD2 4.28Å; C578-L648 HydrophobicContact CB-CD2 3.86Å; C578-L648 WeakPolarHBondContact SG-CD2 3.29Å; L581-L648 HydrophobicContact CD1-CD1 4.07Å; L581-L648 HydrophobicContact CD1-CD2 4.19Å; L581-L648 HydrophobicContact CD1-CG 4.27Å; L581-L648 HydrophobicContact CD2-CD1 3.96Å; S644-L648 WeakPolarHBondContact O-CG 3.47Å; S644-L648 PolarHBondContact O-N 3.03Å; S644-L648 VanDerWaalsContact O-N 3.1Å; L648-A650 PolarHBondContact O-N 3.36Å; L648-W653 HydrophobicContact CB-CB 3.94Å; L648-W653 HydrophobicContact CD1-CB 4.09Å; L648-W653 HydrophobicContact CD2-CB 4.13Å; L648-W653 HydrophobicContact CG-CB 4.28Å; L648-S654 WeakPolarHBondContact CB-OG 3.26Å; L648-S654 PolarHBondContact O-OG 3.41Å; L648-S654 VanDerWaalsContact O-OG 3.14Å; L648-L657 HydrophobicContact CD1-CD1 3.49Å; L648-L657 VanDerWaalsContact CD1-CD1 3.49Å; L648-L657 HydrophobicContact CD1-CG 4.39Å
649	P	89.5	Confident	91.9	Very high	65 Å²	65	20.4 Å²	20.4	42%	0.422	12%	0.116	S	C	.	.			trans	-54.3	139.3	166.8	-22.9	32.1	0	0	0	110.8	F651 S654	P649-F651 PolarHBondContact O-N 3.43Å; P649-S654 PolarHBondContact O-N 3.15Å; P649-S654 PolarHBondContact O-OG 3.46Å
650	A	88	Confident	91.9	Very high	59 Å²	59	19.2 Å²	19.2	49%	0.488	11%	0.11	S	C	.	.	I	π-helix	trans	-52.8	-42.3	-178.3	0	0	0	0	0	112.1	L648 L655	L648-A650 PolarHBondContact O-N 3.36Å; A650-L655 WeakPolarHBondContact O-CB 3.37Å; A650-L655 PolarHBondContact O-N 3.06Å; A650-L655 VanDerWaalsContact O-N 3.11Å
651	F	88.8	Confident	91.9	Very high	32 Å²	32	19.4 Å²	19.4	14%	0.14	11%	0.111	C	C	.	.	I	π-helix	trans	-124.7	135.5	175	-179.2	-109.9	0	0	0	110.8	P649 L655 P743 R829 L833	P649-F651 PolarHBondContact O-N 3.43Å; F651-L655 HydrophobicContact CD2-CD2 3.75Å; F651-L655 HydrophobicContact CE2-CD2 4.34Å; F651-P743 HydrophobicContact CB-CG 4.33Å; F651-P743 HydrophobicContact CD1-CG 4.13Å; F651-P743 HydrophobicContact CD2-CB 3.87Å; F651-P743 HydrophobicContact CD2-CG 3.93Å; F651-P743 HydrophobicContact CE1-CG 4.38Å; F651-P743 HydrophobicContact CE2-CB 3.87Å; F651-P743 HydrophobicContact CE2-CG 4.25Å; F651-P743 HydrophobicContact CG-CB 4.33Å; F651-P743 HydrophobicContact CG-CG 3.88Å; F651-P743 HydrophobicContact CZ-CB 4.29Å; F651-P743 HydrophobicContact CZ-CG 4.46Å; F651-R829 HydrophobicContact CE1-CG 4.06Å; F651-R829 VanDerWaalsContact CE1-CZ 3.43Å; F651-R829 VanDerWaalsContact CE1-NH1 3.3Å; F651-R829 HydrophobicContact CZ-CG 3.88Å; F651-L833 HydrophobicContact CE2-CD1 3.93Å; F651-L833 HydrophobicContact CZ-CD1 4.23Å
652	P	91.7	Very high	91.9	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.111	C	C	.	.	I	π-helix	cis	-85.5	-13.1	-3.3	34.9	-36.7	0	0	0	114.9	Y656 D825 F828 R829 W832	P652-Y656 VanDerWaalsContact O-CB 3.28Å; P652-Y656 WeakPolarHBondContact O-CB 3.35Å; P652-Y656 PolarHBondContact O-N 3.08Å; P652-D825 HydrophobicContact CG-CB 4.47Å; P652-F828 HydrophobicContact CB-CD1 4.03Å; P652-F828 HydrophobicContact CB-CE1 4.36Å; P652-F828 HydrophobicContact CG-CD1 3.8Å; P652-F828 HydrophobicContact CG-CE1 4.43Å; P652-R829 HydrophobicContact CB-CG 3.65Å; P652-R829 HydrophobicContact CG-CG 3.77Å; P652-W832 HydrophobicContact CB-CE3 4.36Å; P652-W832 HydrophobicContact CB-CZ3 4.2Å; P652-W832 WeakPolarHBondContact O-CZ3 3.36Å
653	W	93.4	Very high	92	Very high	4 Å²	4	17.5 Å²	17.5	2%	0.015	10%	0.099	C	C	.	.	I	π-helix	trans	-72	-57.6	-159.1	-55	106	0	0	0	114.3	V575 C578 W579 V582 L648 L655 Y656 L657 D825 F828	V575-W653 HydrophobicContact CG1-CH2 4.46Å; V575-W653 HydrophobicContact CG1-CZ2 3.8Å; C578-W653 HydrophobicContact CB-CD2 3.45Å; C578-W653 VanDerWaalsContact CB-CD2 3.45Å; C578-W653 VanDerWaalsContact CB-CE2 3.47Å; C578-W653 HydrophobicContact CB-CE3 3.8Å; C578-W653 HydrophobicContact CB-CG 3.86Å; C578-W653 HydrophobicContact CB-CH2 4.19Å; C578-W653 HydrophobicContact CB-CZ2 3.89Å; C578-W653 HydrophobicContact CB-CZ3 4.14Å; W579-W653 HydrophobicContact CB-CH2 4.14Å; W579-W653 HydrophobicContact CB-CZ3 4.41Å; W579-W653 HydrophobicContact CD2-CH2 4.34Å; W579-W653 AromaticContact CE3-CH2 3.86Å; W579-W653 HydrophobicContact CE3-CH2 3.86Å; V582-W653 HydrophobicContact CG2-CE3 3.96Å; V582-W653 HydrophobicContact CG2-CZ3 4.23Å; L648-W653 HydrophobicContact CB-CB 3.94Å; L648-W653 HydrophobicContact CD1-CB 4.09Å; L648-W653 HydrophobicContact CD2-CB 4.13Å; L648-W653 HydrophobicContact CG-CB 4.28Å; W653-L655 PolarHBondContact O-N 2.62Å; W653-Y656 WeakPolarHBondContact O-CB 3.48Å; W653-Y656 PolarHBondContact O-N 3.16Å; W653-Y656 VanDerWaalsContact O-N 3.1Å; W653-L657 PolarHBondContact O-N 2.9Å; W653-D825 HydrophobicContact CZ2-CB 3.9Å; W653-F828 HydrophobicContact CE3-CD1 4.08Å; W653-F828 HydrophobicContact CE3-CD2 4.46Å; W653-F828 AromaticContact CE3-CE1 3.94Å; W653-F828 HydrophobicContact CE3-CE1 3.94Å; W653-F828 HydrophobicContact CE3-CE2 4.34Å; W653-F828 HydrophobicContact CE3-CG 4.34Å; W653-F828 HydrophobicContact CE3-CZ 4.08Å; W653-F828 HydrophobicContact CH2-CB 3.73Å; W653-F828 AromaticContact CH2-CD1 3.98Å; W653-F828 HydrophobicContact CH2-CD1 3.98Å; W653-F828 AromaticContact CH2-CD2 3.66Å; W653-F828 HydrophobicContact CH2-CD2 3.66Å; W653-F828 HydrophobicContact CH2-CE2 4.27Å; W653-F828 AromaticContact CH2-CG 3.49Å; W653-F828 HydrophobicContact CH2-CG 3.49Å; W653-F828 VanDerWaalsContact CH2-CG 3.49Å; W653-F828 HydrophobicContact CZ2-CB 4.18Å; W653-F828 HydrophobicContact CZ2-CD1 4.47Å; W653-F828 HydrophobicContact CZ2-CG 4.23Å; W653-F828 HydrophobicContact CZ3-CB 4.31Å; W653-F828 AromaticContact CZ3-CD1 3.77Å; W653-F828 HydrophobicContact CZ3-CD1 3.77Å; W653-F828 AromaticContact CZ3-CD2 3.47Å; W653-F828 HydrophobicContact CZ3-CD2 3.47Å; W653-F828 VanDerWaalsContact CZ3-CD2 3.47Å; W653-F828 AromaticContact CZ3-CE1 3.88Å; W653-F828 HydrophobicContact CZ3-CE1 3.88Å; W653-F828 AromaticContact CZ3-CE2 3.6Å; W653-F828 HydrophobicContact CZ3-CE2 3.6Å; W653-F828 AromaticContact CZ3-CG 3.56Å; W653-F828 HydrophobicContact CZ3-CG 3.56Å; W653-F828 AromaticContact CZ3-CZ 3.8Å; W653-F828 HydrophobicContact CZ3-CZ 3.8Å
654	S	92.8	Very high	92	Very high	6 Å²	6	17.7 Å²	17.7	4%	0.042	10%	0.101	C	C	.	.	I	π-helix	trans	-61.3	-37.2	179.2	-54.5	0	0	0	0	111.6	L648 P649 L657 S658	L648-S654 WeakPolarHBondContact CB-OG 3.26Å; L648-S654 PolarHBondContact O-OG 3.41Å; L648-S654 VanDerWaalsContact O-OG 3.14Å; P649-S654 PolarHBondContact O-N 3.15Å; P649-S654 PolarHBondContact O-OG 3.46Å; S654-L657 PolarHBondContact O-N 2.86Å; S654-S658 WeakPolarHBondContact O-CB 3.44Å; S654-S658 PolarHBondContact O-N 2.97Å; S654-S658 PolarHBondContact O-OG 2.96Å
655	L	92.6	Very high	92	Very high	6 Å²	6	19.2 Å²	19.2	3%	0.031	11%	0.108	C	C	.	.	H	α-helix	trans	-65.6	-37.8	176	-163.4	62.9	0	0	0	112.5	A650 F651 W653 S659 L697 S700 L702 L703 P743 W832	A650-L655 WeakPolarHBondContact O-CB 3.37Å; A650-L655 PolarHBondContact O-N 3.06Å; A650-L655 VanDerWaalsContact O-N 3.11Å; F651-L655 HydrophobicContact CD2-CD2 3.75Å; F651-L655 HydrophobicContact CE2-CD2 4.34Å; W653-L655 PolarHBondContact O-N 2.62Å; L655-S659 VanDerWaalsContact O-CB 3.28Å; L655-S659 WeakPolarHBondContact O-CB 3.36Å; L655-S659 PolarHBondContact O-N 3.39Å; L655-S659 PolarHBondContact O-OG 2.73Å; L655-L697 HydrophobicContact CD1-CD2 3.9Å; L655-S700 WeakPolarHBondContact CD1-OG 3.13Å; L655-L702 HydrophobicContact CD2-CB 4.02Å; L655-L702 HydrophobicContact CD2-CD2 3.24Å; L655-L702 HydrophobicContact CD2-CG 4.18Å; L655-L702 HydrophobicContact CG-CD2 3.93Å; L655-L703 HydrophobicContact CD1-CD1 4.09Å; L655-L703 HydrophobicContact CD1-CD2 3.8Å; L655-L703 HydrophobicContact CD1-CG 3.57Å; L655-P743 HydrophobicContact CD2-CB 4.4Å; L655-W832 HydrophobicContact CB-CH2 4.24Å; L655-W832 HydrophobicContact CG-CH2 4.11Å
656	Y	94.7	Very high	92.2	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-65.4	-43.5	174.2	176.7	-93	0	0	0	112	V582 F593 P594 F596 P652 W653 S659 S660 F828 W832	V582-Y656 HydrophobicContact CG1-CD1 3.97Å; V582-Y656 HydrophobicContact CG1-CE1 3.4Å; V582-Y656 HydrophobicContact CG2-CD1 4.07Å; V582-Y656 HydrophobicContact CG2-CE1 4.34Å; F593-Y656 AromaticContact CD1-CE1 3.83Å; F593-Y656 HydrophobicContact CD1-CE1 3.83Å; F593-Y656 HydrophobicContact CE1-CE1 4.35Å; P594-Y656 HydrophobicContact CG-CE2 3.77Å; P594-Y656 PolarHBondContact O-OH 3.34Å; F596-Y656 HydrophobicContact CB-CE2 4.29Å; F596-Y656 HydrophobicContact CD1-CE2 4.17Å; F596-Y656 AromaticContact CD1-CZ 3.78Å; F596-Y656 WeakPolarHBondContact CD1-OH 3.44Å; F596-Y656 WeakPolarHBondContact CE1-OH 3.42Å; P652-Y656 VanDerWaalsContact O-CB 3.28Å; P652-Y656 WeakPolarHBondContact O-CB 3.35Å; P652-Y656 PolarHBondContact O-N 3.08Å; W653-Y656 WeakPolarHBondContact O-CB 3.48Å; W653-Y656 PolarHBondContact O-N 3.16Å; W653-Y656 VanDerWaalsContact O-N 3.1Å; Y656-S659 WeakPolarHBondContact O-CB 3.42Å; Y656-S659 PolarHBondContact O-N 3.1Å; Y656-S660 WeakPolarHBondContact CE1-OG 3.25Å; Y656-S660 WeakPolarHBondContact O-CB 3.45Å; Y656-S660 PolarHBondContact O-N 2.77Å; Y656-S660 PolarHBondContact O-OG 3.08Å; Y656-F828 HydrophobicContact CD1-CE1 4.38Å; Y656-F828 AromaticContact CD1-CZ 3.78Å; Y656-F828 HydrophobicContact CD1-CZ 3.78Å; Y656-F828 AromaticContact CD2-CE1 3.96Å; Y656-F828 HydrophobicContact CD2-CE1 3.96Å; Y656-F828 AromaticContact CD2-CZ 3.76Å; Y656-F828 HydrophobicContact CD2-CZ 3.76Å; Y656-F828 HydrophobicContact CE1-CZ 4.09Å; Y656-F828 HydrophobicContact CE2-CZ 4.05Å; Y656-F828 AromaticContact CG-CE1 3.82Å; Y656-F828 HydrophobicContact CG-CE1 3.82Å; Y656-F828 AromaticContact CG-CZ 3.62Å; Y656-F828 HydrophobicContact CG-CZ 3.62Å; Y656-W832 VanDerWaalsContact CA-CH2 3.48Å; Y656-W832 HydrophobicContact CD2-CB 4.48Å; Y656-W832 AromaticContact CD2-CD1 3.96Å; Y656-W832 AromaticContact CD2-CD2 3.5Å; Y656-W832 HydrophobicContact CD2-CD2 3.5Å; Y656-W832 AromaticContact CD2-CE2 3.63Å; Y656-W832 AromaticContact CD2-CE3 3.87Å; Y656-W832 HydrophobicContact CD2-CE3 3.87Å; Y656-W832 AromaticContact CD2-CG 3.76Å; Y656-W832 HydrophobicContact CD2-CG 3.76Å; Y656-W832 HydrophobicContact CD2-CH2 4.46Å; Y656-W832 HydrophobicContact CD2-CZ2 4.14Å; Y656-W832 HydrophobicContact CD2-CZ3 4.33Å; Y656-W832 AromaticContact CD2-NE1 3.9Å; Y656-W832 HydrophobicContact CE2-CD2 4.27Å; Y656-W832 HydrophobicContact CE2-CG 4.06Å; Y656-W832 HydrophobicContact CG-CD2 4.45Å; Y656-W832 HydrophobicContact CG-CE3 4.43Å
657	L	94.6	Very high	92.2	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-62.2	-46	176.2	-66.7	-176.7	0	0	0	111.5	L581 V582 L585 F593 S644 L648 W653 S654 S659 S660 Q661	L581-L657 HydrophobicContact CD2-CD1 3.96Å; L581-L657 HydrophobicContact CD2-CD2 4.39Å; V582-L657 HydrophobicContact CG2-CD2 4.2Å; L585-L657 HydrophobicContact CD1-CD2 3.96Å; F593-L657 HydrophobicContact CE1-CD2 4.47Å; S644-L657 VanDerWaalsContact CB-CD1 3.48Å; L648-L657 HydrophobicContact CD1-CD1 3.49Å; L648-L657 VanDerWaalsContact CD1-CD1 3.49Å; L648-L657 HydrophobicContact CD1-CG 4.39Å; W653-L657 PolarHBondContact O-N 2.9Å; S654-L657 PolarHBondContact O-N 2.86Å; L657-S659 VanDerWaalsContact C-N 3.3Å; L657-S659 PolarHBondContact O-N 3.27Å; L657-S660 CarbonylContact O-C 3.52Å; L657-S660 WeakPolarHBondContact O-CA 3.03Å; L657-S660 WeakPolarHBondContact O-CB 3.47Å; L657-S660 PolarHBondContact O-N 2.82Å; L657-Q661 PolarHBondContact O-N 3.11Å
658	S	93.6	Very high	92.2	Very high	4 Å²	4	18.9 Å²	18.9	3%	0.028	11%	0.107	C	C	.	.	H	α-helix	trans	-61.6	-39.9	176.1	-58.1	0	0	0	0	112.1	S654 S660 Q661 I662 L697	S654-S658 WeakPolarHBondContact O-CB 3.44Å; S654-S658 PolarHBondContact O-N 2.97Å; S654-S658 PolarHBondContact O-OG 2.96Å; S658-S660 VanDerWaalsContact C-N 3.31Å; S658-S660 PolarHBondContact O-N 3.49Å; S658-Q661 PolarHBondContact O-N 3.1Å; S658-I662 WeakPolarHBondContact O-CG1 3.3Å; S658-I662 PolarHBondContact O-N 3.36Å; S658-I662 VanDerWaalsContact O-N 3.16Å; S658-L697 WeakPolarHBondContact OG-CD1 3.47Å
659	S	93.8	Very high	92.2	Very high	2 Å²	2	18.6 Å²	18.6	1%	0.014	11%	0.105	C	C	.	.	H	α-helix	trans	-65.1	-37.1	173.8	-60.3	0	0	0	0	111.8	L655 Y656 L657 I662 F663 W832	L655-S659 VanDerWaalsContact O-CB 3.28Å; L655-S659 WeakPolarHBondContact O-CB 3.36Å; L655-S659 PolarHBondContact O-N 3.39Å; L655-S659 PolarHBondContact O-OG 2.73Å; Y656-S659 WeakPolarHBondContact O-CB 3.42Å; Y656-S659 PolarHBondContact O-N 3.1Å; L657-S659 VanDerWaalsContact C-N 3.3Å; L657-S659 PolarHBondContact O-N 3.27Å; S659-I662 PolarHBondContact O-N 3.48Å; S659-F663 VanDerWaalsContact O-CB 3.27Å; S659-F663 WeakPolarHBondContact O-CB 3.3Å; S659-F663 PolarHBondContact O-N 3.39Å; S659-W832 WeakPolarHBondContact OG-CZ2 3.36Å
660	S	94.7	Very high	92.1	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-67.8	-37	176.9	-57.8	0	0	0	0	111.7	F593 P594 Y656 L657 S658 F663 S664	F593-S660 WeakPolarHBondContact CD1-OG 3.38Å; P594-S660 WeakPolarHBondContact CD-OG 3.29Å; Y656-S660 WeakPolarHBondContact CE1-OG 3.25Å; Y656-S660 WeakPolarHBondContact O-CB 3.45Å; Y656-S660 PolarHBondContact O-N 2.77Å; Y656-S660 PolarHBondContact O-OG 3.08Å; L657-S660 CarbonylContact O-C 3.52Å; L657-S660 WeakPolarHBondContact O-CA 3.03Å; L657-S660 WeakPolarHBondContact O-CB 3.47Å; L657-S660 PolarHBondContact O-N 2.82Å; S658-S660 VanDerWaalsContact C-N 3.31Å; S658-S660 PolarHBondContact O-N 3.49Å; S660-F663 PolarHBondContact O-N 2.86Å; S660-S664 WeakPolarHBondContact O-CB 3.44Å; S660-S664 PolarHBondContact O-N 3.21Å
661	Q	94.8	Very high	91.6	Very high	4 Å²	4	20.4 Å²	20.4	2%	0.019	10%	0.097	C	C	.	.	H	α-helix	trans	-60.1	-49.1	171.1	-71.7	173.1	-61	0	0	111.5	F637 C641 L657 S658 K665 Y687 I691	F637-Q661 HydrophobicContact CD1-CG 4.37Å; F637-Q661 HydrophobicContact CE1-CG 3.76Å; F637-Q661 HydrophobicContact CZ-CG 4.46Å; C641-Q661 HydrophobicContact CB-CG 4.17Å; L657-Q661 PolarHBondContact O-N 3.11Å; S658-Q661 PolarHBondContact O-N 3.1Å; Q661-K665 WeakPolarHBondContact O-CB 3.4Å; Q661-K665 PolarHBondContact O-N 3.31Å; Q661-Y687 HydrophobicContact CB-CE1 4.32Å; Q661-I691 HydrophobicContact CB-CD1 3.67Å
662	I	95	Very high	91.2	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-60.6	-48.6	177.3	-64.3	172.6	0	0	0	110.7	S658 S659 K665 S666 F684 I691 L703 V706	S658-I662 WeakPolarHBondContact O-CG1 3.3Å; S658-I662 PolarHBondContact O-N 3.36Å; S658-I662 VanDerWaalsContact O-N 3.16Å; S659-I662 PolarHBondContact O-N 3.48Å; I662-K665 PolarHBondContact O-N 2.83Å; I662-S666 PolarHBondContact O-N 3.12Å; I662-S666 VanDerWaalsContact O-N 3.07Å; I662-F684 HydrophobicContact CG2-CE2 4.15Å; I662-F684 HydrophobicContact CG2-CZ 3.84Å; I662-I691 HydrophobicContact CG1-CD1 4.11Å; I662-L703 HydrophobicContact CD1-CD2 4.13Å; I662-V706 HydrophobicContact CB-CG1 4.24Å; I662-V706 HydrophobicContact CG2-CG1 4.08Å
663	F	92.8	Very high	90.6	Very high	41 Å²	41	28.2 Å²	28.2	18%	0.18	14%	0.14	C	C	.	.	H	α-helix	trans	-59.7	-51.9	179.8	178.3	-99.4	0	0	0	111.5	S592 P594 S659 S660 K665 S666 R667	S592-F663 WeakPolarHBondContact O-CD1 3.48Å; P594-F663 HydrophobicContact CB-CG 4.49Å; S659-F663 VanDerWaalsContact O-CB 3.27Å; S659-F663 WeakPolarHBondContact O-CB 3.3Å; S659-F663 PolarHBondContact O-N 3.39Å; S660-F663 PolarHBondContact O-N 2.86Å; F663-K665 VanDerWaalsContact C-N 3.33Å; F663-K665 PolarHBondContact O-N 3.15Å; F663-S666 PolarHBondContact O-N 2.94Å; F663-S666 PolarHBondContact O-OG 3.42Å; F663-R667 VanDerWaalsContact CZ-CZ 3.48Å; F663-R667 VanDerWaalsContact CZ-NE 3.31Å; F663-R667 PolarHBondContact O-N 3.43Å
664	S	91.9	Very high	90.3	Very high	15 Å²	15	35.3 Å²	35.3	11%	0.105	18%	0.178	C	C	.	.	H	α-helix	trans	-58.8	-44.3	178.7	-169.7	0	0	0	0	111.6	A591 S592 S660 S666 R667 S668	A591-S664 WeakPolarHBondContact CA-OG 3.35Å; A591-S664 WeakPolarHBondContact CB-OG 3.39Å; S592-S664 PolarHBondContact N-OG 2.86Å; S592-S664 VanDerWaalsContact N-OG 3.16Å; S592-S664 WeakPolarHBondContact O-CB 3.27Å; S660-S664 WeakPolarHBondContact O-CB 3.44Å; S660-S664 PolarHBondContact O-N 3.21Å; S664-S666 VanDerWaalsContact C-N 3.35Å; S664-S666 PolarHBondContact O-N 3.38Å; S664-R667 PolarHBondContact O-N 3.08Å; S664-S668 WeakPolarHBondContact O-CB 3.35Å; S664-S668 PolarHBondContact O-N 3.41Å
665	K	93.9	Very high	90.1	Very high	32 Å²	32	37.9 Å²	37.9	14%	0.139	19%	0.191	C	C	.	.	H	α-helix	trans	-63.2	-40.5	-179.8	-168	61.6	167.1	178.4	0	112.4	E634 Q661 I662 F663 S668 L669 F684 Y687	E634-K665 IonicContact OE2-NZ 3.16Å; E634-K665 PolarHBondContact OE2-NZ 3.03Å; Q661-K665 WeakPolarHBondContact O-CB 3.4Å; Q661-K665 PolarHBondContact O-N 3.31Å; I662-K665 PolarHBondContact O-N 2.83Å; F663-K665 VanDerWaalsContact C-N 3.33Å; F663-K665 PolarHBondContact O-N 3.15Å; K665-S668 PolarHBondContact O-N 3.19Å; K665-L669 HydrophobicContact CG-CD1 4.16Å; K665-L669 WeakPolarHBondContact O-CB 3.32Å; K665-L669 VanDerWaalsContact O-CG 3.32Å; K665-L669 WeakPolarHBondContact O-CG 3.41Å; K665-L669 PolarHBondContact O-N 3.46Å; K665-F684 HydrophobicContact CG-CD2 4.36Å; K665-Y687 HydrophobicContact CB-CD1 3.75Å; K665-Y687 HydrophobicContact CB-CE1 3.67Å; K665-Y687 HydrophobicContact CD-CD1 4.37Å; K665-Y687 HydrophobicContact CD-CE1 4.48Å; K665-Y687 HydrophobicContact CD-CG 4.39Å; K665-Y687 HydrophobicContact CG-CD1 3.58Å; K665-Y687 HydrophobicContact CG-CE1 3.91Å; K665-Y687 HydrophobicContact CG-CG 3.92Å
666	S	93.3	Very high	90	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.014	22%	0.217	C	C	.	.	H	α-helix	trans	-62.5	-43	176.2	70.6	0	0	0	0	112.2	I662 F663 S664 L669 L670 L714	I662-S666 PolarHBondContact O-N 3.12Å; I662-S666 VanDerWaalsContact O-N 3.07Å; F663-S666 PolarHBondContact O-N 2.94Å; F663-S666 PolarHBondContact O-OG 3.42Å; S664-S666 VanDerWaalsContact C-N 3.35Å; S664-S666 PolarHBondContact O-N 3.38Å; S666-L669 PolarHBondContact O-N 3.24Å; S666-L670 PolarHBondContact O-N 3.48Å; S666-L714 WeakPolarHBondContact O-CD2 3.49Å
667	R	88.2	Confident	89.7	Confident	74 Å²	74	43.9 Å²	43.9	28%	0.279	23%	0.234	S	C	.	.	H	α-helix	trans	-65.3	-44.2	176.2	-78.2	-167.7	164	-168.3	-3.4	112.6	D615 F663 S664 L669 L670 R671	D615-R667 IonicContact OD2-NH1 3.82Å; F663-R667 VanDerWaalsContact CZ-CZ 3.48Å; F663-R667 VanDerWaalsContact CZ-NE 3.31Å; F663-R667 PolarHBondContact O-N 3.43Å; S664-R667 PolarHBondContact O-N 3.08Å; R667-L669 VanDerWaalsContact C-N 3.33Å; R667-L669 PolarHBondContact O-N 2.9Å; R667-L670 WeakPolarHBondContact O-CB 3.48Å; R667-L670 PolarHBondContact O-N 3.4Å; R667-R671 WeakPolarHBondContact O-CG 3.21Å; R667-R671 PolarHBondContact O-N 3.47Å
668	S	87.7	Confident	89.5	Confident	39 Å²	39	52.3 Å²	52.3	27%	0.273	27%	0.27	S	S	.	.	H	α-helix	trans	-57	-47.8	176.3	176.7	0	0	0	0	111	E634 S664 K665 L670 R671 N672	E634-S668 VanDerWaalsContact OE1-CB 3.23Å; E634-S668 WeakPolarHBondContact OE1-CB 3.39Å; E634-S668 PolarHBondContact OE1-OG 3Å; S664-S668 WeakPolarHBondContact O-CB 3.35Å; S664-S668 PolarHBondContact O-N 3.41Å; K665-S668 PolarHBondContact O-N 3.19Å; S668-L670 PolarHBondContact O-N 2.95Å; S668-R671 PolarHBondContact O-N 2.97Å; S668-N672 PolarHBondContact O-N 2.82Å; S668-N672 VanDerWaalsContact O-N 3.15Å
669	L	91.5	Very high	89.4	Confident	5 Å²	5	53 Å²	53	3%	0.026	28%	0.278	C	S	.	.	H	α-helix	trans	-65.9	-34.8	177.2	-70.7	171.7	0	0	0	113	K665 S666 R667 R671 N672 L675 R680 V683 F684 L714	K665-L669 HydrophobicContact CG-CD1 4.16Å; K665-L669 WeakPolarHBondContact O-CB 3.32Å; K665-L669 VanDerWaalsContact O-CG 3.32Å; K665-L669 WeakPolarHBondContact O-CG 3.41Å; K665-L669 PolarHBondContact O-N 3.46Å; S666-L669 PolarHBondContact O-N 3.24Å; R667-L669 VanDerWaalsContact C-N 3.33Å; R667-L669 PolarHBondContact O-N 2.9Å; L669-R671 PolarHBondContact O-N 3.24Å; L669-N672 PolarHBondContact O-N 2.78Å; L669-L675 HydrophobicContact CD2-CD1 4.02Å; L669-R680 HydrophobicContact CB-CB 4.44Å; L669-R680 WeakPolarHBondContact O-CD 3.34Å; L669-V683 HydrophobicContact CD1-CG1 4.43Å; L669-V683 HydrophobicContact CD2-CB 4.35Å; L669-V683 HydrophobicContact CD2-CG1 4.11Å; L669-F684 HydrophobicContact CD1-CB 3.61Å; L669-F684 HydrophobicContact CD1-CD2 4.09Å; L669-F684 HydrophobicContact CD1-CG 4.31Å; L669-L714 HydrophobicContact CB-CD2 4.18Å
670	L	85.5	Confident	89.4	Confident	78 Å²	78	54.6 Å²	54.6	41%	0.408	28%	0.284	S	S	.	.	H	α-helix	trans	-61.5	-34.8	176.7	-169.6	68.7	0	0	0	111.8	S666 R667 S668 R680 L714	S666-L670 PolarHBondContact O-N 3.48Å; R667-L670 WeakPolarHBondContact O-CB 3.48Å; R667-L670 PolarHBondContact O-N 3.4Å; S668-L670 PolarHBondContact O-N 2.95Å; L670-R680 PolarHBondContact O-NH1 3.02Å; L670-L714 HydrophobicContact CB-CD2 4.33Å
671	R	77.7	Confident	89.4	Confident	84 Å²	84	55.5 Å²	55.5	32%	0.317	29%	0.289	S	S	.	.	H	α-helix	trans	-80.6	-21.6	177.7	-62.8	179.4	-176	-178.1	7.5	113.6	D615 R667 S668 L669 N673	D615-R671 IonicContact OD1-CZ 3.16Å; D615-R671 VanDerWaalsContact OD1-CZ 3.28Å; D615-R671 IonicContact OD1-NE 3.32Å; D615-R671 PolarHBondContact OD1-NE 3.45Å; D615-R671 IonicContact OD1-NH2 2.73Å; D615-R671 PolarHBondContact OD1-NH2 2.89Å; D615-R671 IonicContact OD2-CZ 3.88Å; D615-R671 IonicContact OD2-NH2 3.32Å; D615-R671 PolarHBondContact OD2-NH2 3.49Å; R667-R671 WeakPolarHBondContact O-CG 3.21Å; R667-R671 PolarHBondContact O-N 3.47Å; S668-R671 PolarHBondContact O-N 2.97Å; L669-R671 PolarHBondContact O-N 3.24Å; R671-N673 PolarHBondContact O-N 3.34Å
672	N	81.9	Confident	89.4	Confident	54 Å²	54	62.5 Å²	62.5	29%	0.289	32%	0.319	S	S	.	.			trans	-77.8	105.9	179.8	-171.8	-27.8	0	0	0	110.7	S668 L669 D674	S668-N672 PolarHBondContact O-N 2.82Å; S668-N672 VanDerWaalsContact O-N 3.15Å; L669-N672 PolarHBondContact O-N 2.78Å; N672-D674 WeakPolarHBondContact OD1-CB 3.42Å; N672-D674 PolarHBondContact OD1-N 3Å
673	N	78.5	Confident	89.4	Confident	142 Å²	142	65.4 Å²	65.4	76%	0.759	34%	0.336	S	S	*	.			trans	-84.6	-12.6	180	-68.7	-29.8	0	0	0	113.7	R671 L675	R671-N673 PolarHBondContact O-N 3.34Å; N673-L675 PolarHBondContact O-N 2.97Å
674	D	86.4	Confident	89.5	Confident	153 Å²	153	63.4 Å²	63.4	82%	0.818	33%	0.328	S	S	*	.	S	Bend	trans	-73	-21.7	-178.1	-55.6	-33.5	0	0	0	111.7	N672	N672-D674 WeakPolarHBondContact OD1-CB 3.42Å; N672-D674 PolarHBondContact OD1-N 3Å
675	L	88	Confident	89.6	Confident	60 Å²	60	66.7 Å²	66.7	31%	0.314	34%	0.338	S	S	.	.	S	Bend	trans	-98.1	129.4	178.6	-66.3	174.3	0	0	0	111.3	L669 N673 R680 V683	L669-L675 HydrophobicContact CD2-CD1 4.02Å; N673-L675 PolarHBondContact O-N 2.97Å; L675-R680 HydrophobicContact CB-CG 3.57Å; L675-R680 HydrophobicContact CD1-CG 4.34Å; L675-V683 HydrophobicContact CD1-CG2 4.35Å
676	S	90.4	Very high	89.6	Confident	81 Å²	81	69.6 Å²	69.6	57%	0.566	36%	0.358	S	S	*	.			trans	-55.5	154.7	165.4	70.3	0	0	0	0	111.2	K678 G679 R680	S676-K678 PolarHBondContact O-N 2.97Å; S676-G679 WeakPolarHBondContact O-CA 3.29Å; S676-G679 PolarHBondContact O-N 3.08Å; S676-G679 PolarHBondContact OG-N 3.19Å; S676-R680 PolarHBondContact O-N 3.38Å
677	S	88.5	Confident	89.6	Confident	51 Å²	51	71.6 Å²	71.6	36%	0.357	37%	0.366	S	S	.	.	H	α-helix	trans	-49.5	-43.7	176.1	174.9	0	0	0	0	112.8	G679 R680 L681	S677-G679 PolarHBondContact O-N 2.97Å; S677-R680 PolarHBondContact O-N 2.91Å; S677-L681 WeakPolarHBondContact O-CG 3.34Å; S677-L681 PolarHBondContact O-N 3.01Å; S677-L681 VanDerWaalsContact O-N 3.15Å
678	K	90.8	Very high	89.8	Confident	177 Å²	177	68 Å²	68	77%	0.77	35%	0.353	S	S	*	.	H	α-helix	trans	-64.8	-37.8	174.6	-69	-176.5	179.5	178.5	0	113.1	S676 K682	S676-K678 PolarHBondContact O-N 2.97Å; K678-K682 PolarHBondContact O-N 3.25Å
679	G	92.7	Very high	89.9	Confident	19 Å²	19	72.9 Å²	72.9	20%	0.196	37%	0.369	C	S	.	.	H	α-helix	trans	-62.7	-47.2	175.6	0	0	0	0	0	112	S676 S677 L681 K682 V683	S676-G679 WeakPolarHBondContact O-CA 3.29Å; S676-G679 PolarHBondContact O-N 3.08Å; S676-G679 PolarHBondContact OG-N 3.19Å; S677-G679 PolarHBondContact O-N 2.97Å; G679-L681 VanDerWaalsContact C-N 3.35Å; G679-L681 PolarHBondContact O-N 3.28Å; G679-K682 PolarHBondContact O-N 2.83Å; G679-K682 VanDerWaalsContact O-N 3.16Å; G679-V683 PolarHBondContact O-N 3.12Å; G679-V683 VanDerWaalsContact O-N 3.08Å
680	R	93.6	Very high	89.8	Confident	36 Å²	36	76 Å²	76	14%	0.136	39%	0.391	C	S	.	.	H	α-helix	trans	-55.3	-48.4	175.5	-66.6	-172.6	-77.5	173.8	4.2	111.5	L669 L670 L675 S676 S677 K682 V683 F684	L669-R680 HydrophobicContact CB-CB 4.44Å; L669-R680 WeakPolarHBondContact O-CD 3.34Å; L670-R680 PolarHBondContact O-NH1 3.02Å; L675-R680 HydrophobicContact CB-CG 3.57Å; L675-R680 HydrophobicContact CD1-CG 4.34Å; S676-R680 PolarHBondContact O-N 3.38Å; S677-R680 PolarHBondContact O-N 2.91Å; R680-K682 PolarHBondContact O-N 3.28Å; R680-V683 PolarHBondContact O-N 2.72Å; R680-F684 WeakPolarHBondContact O-CB 3.24Å; R680-F684 PolarHBondContact O-N 3.03Å
681	L	94.3	Very high	89.9	Confident	18 Å²	18	73.1 Å²	73.1	9%	0.094	38%	0.376	C	S	.	.	H	α-helix	trans	-63.4	-38.4	178	-68.5	171.5	0	0	0	113	S677 G679 F684 R685 L711 L714 A716	S677-L681 WeakPolarHBondContact O-CG 3.34Å; S677-L681 PolarHBondContact O-N 3.01Å; S677-L681 VanDerWaalsContact O-N 3.15Å; G679-L681 VanDerWaalsContact C-N 3.35Å; G679-L681 PolarHBondContact O-N 3.28Å; L681-F684 PolarHBondContact O-N 3.38Å; L681-R685 WeakPolarHBondContact O-CB 3.17Å; L681-R685 VanDerWaalsContact O-CG 3.25Å; L681-R685 WeakPolarHBondContact O-CG 3.35Å; L681-R685 PolarHBondContact O-N 3.45Å; L681-L711 HydrophobicContact CD2-CD2 4.08Å; L681-L714 HydrophobicContact CD2-CB 3.93Å; L681-L714 HydrophobicContact CD2-CD1 4.21Å; L681-A716 HydrophobicContact CD1-CB 3.91Å; L681-A716 HydrophobicContact CD2-CB 3.7Å; L681-A716 HydrophobicContact CG-CB 4.47Å
682	K	95	Very high	90.3	Very high	152 Å²	152	70.4 Å²	70.4	66%	0.661	37%	0.367	S	S	*	.	H	α-helix	trans	-61.9	-48.2	177	-174.6	-178.3	177.6	-174.8	0	111.2	K678 G679 R680 R685 T686	K678-K682 PolarHBondContact O-N 3.25Å; G679-K682 PolarHBondContact O-N 2.83Å; G679-K682 VanDerWaalsContact O-N 3.16Å; R680-K682 PolarHBondContact O-N 3.28Å; K682-R685 PolarHBondContact O-N 2.92Å; K682-T686 PolarHBondContact O-N 3.46Å; K682-T686 PolarHBondContact O-OG1 3.09Å; K682-T686 VanDerWaalsContact O-OG1 3.14Å
683	V	94.1	Very high	90.3	Very high	60 Å²	60	71.9 Å²	71.9	36%	0.364	38%	0.382	S	S	.	.	H	α-helix	trans	-61.9	-47	177.8	175.4	0	0	0	0	110.5	L669 L675 G679 R680 R685 T686 Y687	L669-V683 HydrophobicContact CD1-CG1 4.43Å; L669-V683 HydrophobicContact CD2-CB 4.35Å; L669-V683 HydrophobicContact CD2-CG1 4.11Å; L675-V683 HydrophobicContact CD1-CG2 4.35Å; G679-V683 PolarHBondContact O-N 3.12Å; G679-V683 VanDerWaalsContact O-N 3.08Å; R680-V683 PolarHBondContact O-N 2.72Å; V683-R685 PolarHBondContact O-N 2.97Å; V683-T686 PolarHBondContact O-N 3.45Å; V683-Y687 PolarHBondContact O-N 3.27Å
684	F	95.4	Very high	90.2	Very high	0 Å²	0	67.9 Å²	67.9	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-56.6	-49.1	178.7	-175.8	-111.8	0	0	0	112.4	I662 K665 L669 R680 L681 T686 Y687 C688 Y707 S710 L711 L714	I662-F684 HydrophobicContact CG2-CE2 4.15Å; I662-F684 HydrophobicContact CG2-CZ 3.84Å; K665-F684 HydrophobicContact CG-CD2 4.36Å; L669-F684 HydrophobicContact CD1-CB 3.61Å; L669-F684 HydrophobicContact CD1-CD2 4.09Å; L669-F684 HydrophobicContact CD1-CG 4.31Å; R680-F684 WeakPolarHBondContact O-CB 3.24Å; R680-F684 PolarHBondContact O-N 3.03Å; L681-F684 PolarHBondContact O-N 3.38Å; F684-T686 PolarHBondContact O-N 3.47Å; F684-Y687 PolarHBondContact O-N 3.19Å; F684-C688 VanDerWaalsContact CE2-SG 3.52Å; F684-C688 WeakPolarHBondContact CZ-SG 3.42Å; F684-C688 PolarHBondContact O-N 3.16Å; F684-C688 PolarHBondContact O-SG 3.43Å; F684-C688 VanDerWaalsContact O-SG 3.37Å; F684-Y707 HydrophobicContact CD1-CE2 4.07Å; F684-Y707 AromaticContact CE1-CD2 3.64Å; F684-Y707 HydrophobicContact CE1-CD2 3.64Å; F684-Y707 AromaticContact CE1-CE2 3.56Å; F684-Y707 HydrophobicContact CE1-CE2 3.56Å; F684-Y707 HydrophobicContact CZ-CD2 4.09Å; F684-Y707 HydrophobicContact CZ-CE2 4.42Å; F684-S710 VanDerWaalsContact CZ-CB 3.45Å; F684-L711 HydrophobicContact CD1-CD2 3.92Å; F684-L711 HydrophobicContact CE1-CD2 3.92Å; F684-L711 HydrophobicContact CE1-CG 4.16Å; F684-L714 HydrophobicContact CB-CD1 3.95Å; F684-L714 HydrophobicContact CD1-CD1 3.77Å; F684-L714 HydrophobicContact CD2-CD1 3.91Å; F684-L714 HydrophobicContact CE1-CD1 4.25Å; F684-L714 HydrophobicContact CE2-CD1 4.39Å; F684-L714 HydrophobicContact CG-CD1 3.59Å
685	R	94.5	Very high	89.1	Confident	83 Å²	83	65.9 Å²	65.9	31%	0.313	36%	0.357	S	S	.	.	H	α-helix	trans	-61.8	-42.6	179.8	-72.1	177.9	-165.8	137.3	2.3	112.4	L681 K682 V683 Y687 C688 K689 E719	L681-R685 WeakPolarHBondContact O-CB 3.17Å; L681-R685 VanDerWaalsContact O-CG 3.25Å; L681-R685 WeakPolarHBondContact O-CG 3.35Å; L681-R685 PolarHBondContact O-N 3.45Å; K682-R685 PolarHBondContact O-N 2.92Å; V683-R685 PolarHBondContact O-N 2.97Å; R685-Y687 VanDerWaalsContact C-N 3.31Å; R685-C688 PolarHBondContact O-N 3.4Å; R685-K689 WeakPolarHBondContact O-CB 3.43Å; R685-K689 WeakPolarHBondContact O-CG 3.39Å; R685-K689 PolarHBondContact O-N 3.28Å; R685-E719 IonicContact CZ-OE1 3.9Å; R685-E719 VanDerWaalsContact CZ-OE1 3.29Å; R685-E719 IonicContact CZ-OE2 3.72Å; R685-E719 IonicContact NE-OE1 3.64Å; R685-E719 PolarHBondContact NE-OE1 2.76Å; R685-E719 IonicContact NE-OE2 2.63Å; R685-E719 IonicContact NH2-OE1 2.98Å; R685-E719 PolarHBondContact NH2-OE1 3Å; R685-E719 IonicContact NH2-OE2 3.68Å; R685-E719 PolarHBondContact NH2-OE2 3.33Å
686	T	94.1	Very high	88.4	Confident	93 Å²	93	69.1 Å²	69.1	57%	0.571	37%	0.368	S	S	*	.	H	α-helix	trans	-61.8	-43.2	177.6	-58.6	0	0	0	0	110.8	K682 V683 F684 K689 S690	K682-T686 PolarHBondContact O-N 3.46Å; K682-T686 PolarHBondContact O-OG1 3.09Å; K682-T686 VanDerWaalsContact O-OG1 3.14Å; V683-T686 PolarHBondContact O-N 3.45Å; F684-T686 PolarHBondContact O-N 3.47Å; T686-K689 PolarHBondContact O-N 2.9Å; T686-S690 PolarHBondContact O-N 3.16Å
687	Y	93.3	Very high	87.6	Confident	44 Å²	44	65.9 Å²	65.9	17%	0.173	34%	0.344	C	S	.	.	H	α-helix	trans	-64.6	-46.9	177.6	-174.6	-98.4	0	0	0	112.5	T638 Q661 K665 V683 F684 R685 K689 S690 I691	T638-Y687 PolarHBondContact OG1-OH 3.14Å; Q661-Y687 HydrophobicContact CB-CE1 4.32Å; K665-Y687 HydrophobicContact CB-CD1 3.75Å; K665-Y687 HydrophobicContact CB-CE1 3.67Å; K665-Y687 HydrophobicContact CD-CD1 4.37Å; K665-Y687 HydrophobicContact CD-CE1 4.48Å; K665-Y687 HydrophobicContact CD-CG 4.39Å; K665-Y687 HydrophobicContact CG-CD1 3.58Å; K665-Y687 HydrophobicContact CG-CE1 3.91Å; K665-Y687 HydrophobicContact CG-CG 3.92Å; V683-Y687 PolarHBondContact O-N 3.27Å; F684-Y687 PolarHBondContact O-N 3.19Å; R685-Y687 VanDerWaalsContact C-N 3.31Å; Y687-K689 VanDerWaalsContact C-N 3.28Å; Y687-K689 PolarHBondContact O-N 3.3Å; Y687-S690 PolarHBondContact O-N 2.98Å; Y687-S690 PolarHBondContact O-OG 2.87Å; Y687-I691 HydrophobicContact CD1-CD1 3.9Å; Y687-I691 HydrophobicContact CE1-CD1 3.39Å; Y687-I691 HydrophobicContact CE1-CG1 4.49Å; Y687-I691 PolarHBondContact O-N 2.84Å
688	C	92.3	Very high	86.7	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-66.5	-31.6	178.2	-63.2	0	0	0	0	112.4	F684 R685 S690 I691 M692 Y707	F684-C688 VanDerWaalsContact CE2-SG 3.52Å; F684-C688 WeakPolarHBondContact CZ-SG 3.42Å; F684-C688 PolarHBondContact O-N 3.16Å; F684-C688 PolarHBondContact O-SG 3.43Å; F684-C688 VanDerWaalsContact O-SG 3.37Å; R685-C688 PolarHBondContact O-N 3.4Å; C688-S690 VanDerWaalsContact C-N 3.33Å; C688-S690 PolarHBondContact O-N 2.93Å; C688-I691 PolarHBondContact O-N 3.46Å; C688-M692 HydrophobicContact CB-CE 3.9Å; C688-M692 WeakPolarHBondContact O-CB 3.47Å; C688-M692 WeakPolarHBondContact O-CE 3.37Å; C688-M692 VanDerWaalsContact O-CG 3.27Å; C688-M692 WeakPolarHBondContact O-CG 3.48Å; C688-M692 PolarHBondContact O-N 2.98Å; C688-Y707 HydrophobicContact CB-CD2 3.77Å; C688-Y707 HydrophobicContact CB-CE2 3.97Å
689	K	90	Very high	85.9	Confident	140 Å²	140	69 Å²	69	61%	0.609	35%	0.353	S	S	*	.	H	α-helix	trans	-62.9	-37.3	175.8	-80.1	174.5	-178.8	-174	0	112.5	R685 T686 Y687 S693	R685-K689 WeakPolarHBondContact O-CB 3.43Å; R685-K689 WeakPolarHBondContact O-CG 3.39Å; R685-K689 PolarHBondContact O-N 3.28Å; T686-K689 PolarHBondContact O-N 2.9Å; Y687-K689 VanDerWaalsContact C-N 3.28Å; Y687-K689 PolarHBondContact O-N 3.3Å; K689-S693 VanDerWaalsContact O-CB 3.24Å; K689-S693 WeakPolarHBondContact O-CB 3.3Å; K689-S693 PolarHBondContact O-N 3.41Å; K689-S693 VanDerWaalsContact O-N 3.08Å; K689-S693 PolarHBondContact O-OG 3.5Å
690	S	88.6	Confident	85.7	Confident	70 Å²	70	69.2 Å²	69.2	49%	0.49	35%	0.352	S	S	.	.	H	α-helix	trans	-66	-46.6	176.5	62.7	0	0	0	0	110.9	T686 Y687 C688 M692 S693	T686-S690 PolarHBondContact O-N 3.16Å; Y687-S690 PolarHBondContact O-N 2.98Å; Y687-S690 PolarHBondContact O-OG 2.87Å; C688-S690 VanDerWaalsContact C-N 3.33Å; C688-S690 PolarHBondContact O-N 2.93Å; S690-M692 PolarHBondContact O-N 2.92Å; S690-S693 PolarHBondContact O-N 3.23Å; S690-S693 PolarHBondContact O-OG 3.26Å
691	I	88.3	Confident	85.6	Confident	18 Å²	18	69.1 Å²	69.1	9%	0.092	36%	0.355	C	S	.	.	H	α-helix	trans	-61.5	-48.4	178.4	-62.3	173	0	0	0	111.2	Q661 I662 Y687 C688 S693 D694	Q661-I691 HydrophobicContact CB-CD1 3.67Å; I662-I691 HydrophobicContact CG1-CD1 4.11Å; Y687-I691 HydrophobicContact CD1-CD1 3.9Å; Y687-I691 HydrophobicContact CE1-CD1 3.39Å; Y687-I691 HydrophobicContact CE1-CG1 4.49Å; Y687-I691 PolarHBondContact O-N 2.84Å; C688-I691 PolarHBondContact O-N 3.46Å; I691-S693 PolarHBondContact O-N 3.06Å; I691-D694 WeakPolarHBondContact O-CB 3.22Å; I691-D694 PolarHBondContact O-N 3.47Å
692	M	85.6	Confident	85.5	Confident	28 Å²	28	68.3 Å²	68.3	14%	0.138	35%	0.351	C	S	.	.	H	α-helix	trans	-72.4	-10.9	-178.5	-65.7	-175.2	-62.8	0	0	113.5	C688 S690 Y704	C688-M692 HydrophobicContact CB-CE 3.9Å; C688-M692 WeakPolarHBondContact O-CB 3.47Å; C688-M692 WeakPolarHBondContact O-CE 3.37Å; C688-M692 VanDerWaalsContact O-CG 3.27Å; C688-M692 WeakPolarHBondContact O-CG 3.48Å; C688-M692 PolarHBondContact O-N 2.98Å; S690-M692 PolarHBondContact O-N 2.92Å; M692-Y704 HydrophobicContact CE-CE1 4.42Å; M692-Y704 HydrophobicContact SD-CD1 4.12Å; M692-Y704 HydrophobicContact SD-CE1 3.92Å
693	S	81.6	Confident	85.3	Confident	85 Å²	85	61.1 Å²	61.1	59%	0.594	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-12.3	175.1	72	0	0	0	0	113.8	K689 S690 I691 C695	K689-S693 VanDerWaalsContact O-CB 3.24Å; K689-S693 WeakPolarHBondContact O-CB 3.3Å; K689-S693 PolarHBondContact O-N 3.41Å; K689-S693 VanDerWaalsContact O-N 3.08Å; K689-S693 PolarHBondContact O-OG 3.5Å; S690-S693 PolarHBondContact O-N 3.23Å; S690-S693 PolarHBondContact O-OG 3.26Å; I691-S693 PolarHBondContact O-N 3.06Å; S693-C695 PolarHBondContact O-N 3.36Å
694	D	77.3	Confident	85.2	Confident	57 Å²	57	62.1 Å²	62.1	31%	0.305	32%	0.317	S	S	.	.			trans	-55.4	124.9	173.9	-179.2	-15.5	0	0	0	110	I691 K696 L697 R698	I691-D694 WeakPolarHBondContact O-CB 3.22Å; I691-D694 PolarHBondContact O-N 3.47Å; D694-K696 PolarHBondContact O-N 3.5Å; D694-K696 VanDerWaalsContact O-N 3.17Å; D694-K696 PolarHBondContact OD1-N 2.87Å; D694-L697 HydrophobicContact CB-CB 4.32Å; D694-L697 HydrophobicContact CB-CD1 4.39Å; D694-L697 CarbonylContact O-C 3.34Å; D694-L697 PolarHBondContact O-N 3.15Å; D694-R698 WeakPolarHBondContact O-CA 3.18Å; D694-R698 WeakPolarHBondContact O-CB 3.28Å; D694-R698 PolarHBondContact O-N 2.98Å
695	C	62.4	Low	85.1	Confident	111 Å²	111	62.1 Å²	62.1	75%	0.75	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-29.5	-177	63.7	0	0	0	0	113.6	S693	S693-C695 PolarHBondContact O-N 3.36Å
696	K	72.9	Confident	85.1	Confident	129 Å²	129	58.8 Å²	58.8	56%	0.561	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-28	177.1	-70.4	-179.5	178.9	176	0	113.1	C645 D694	C645-K696 PolarHBondContact O-NZ 3.49Å; D694-K696 PolarHBondContact O-N 3.5Å; D694-K696 VanDerWaalsContact O-N 3.17Å; D694-K696 PolarHBondContact OD1-N 2.87Å
697	L	73.6	Confident	85.1	Confident	12 Å²	12	55.4 Å²	55.4	6%	0.063	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-4.7	-173.6	-60.6	172.5	0	0	0	112.4	L655 S658 D694 N699 S700 L703	L655-L697 HydrophobicContact CD1-CD2 3.9Å; S658-L697 WeakPolarHBondContact OG-CD1 3.47Å; D694-L697 HydrophobicContact CB-CB 4.32Å; D694-L697 HydrophobicContact CB-CD1 4.39Å; D694-L697 CarbonylContact O-C 3.34Å; D694-L697 PolarHBondContact O-N 3.15Å; L697-N699 PolarHBondContact O-N 3.45Å; L697-S700 WeakPolarHBondContact O-CB 3.4Å; L697-S700 PolarHBondContact O-N 2.89Å; L697-L703 HydrophobicContact CB-CD1 3.81Å; L697-L703 HydrophobicContact CD1-CD1 4.24Å; L697-L703 HydrophobicContact CG-CD1 4.44Å
698	R	70	Confident	85.2	Confident	172 Å²	172	53.3 Å²	53.3	65%	0.649	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	132.7	179.1	-172.1	177.7	178.5	-172.4	1.4	109.4	D694 S700	D694-R698 WeakPolarHBondContact O-CA 3.18Å; D694-R698 WeakPolarHBondContact O-CB 3.28Å; D694-R698 PolarHBondContact O-N 2.98Å; R698-S700 PolarHBondContact O-N 3.28Å
699	N	75.6	Confident	85.3	Confident	122 Å²	122	57.4 Å²	57.4	65%	0.652	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.1	14.2	-176.3	-46.3	-38.5	0	0	0	114.5	L697 V701	L697-N699 PolarHBondContact O-N 3.45Å; N699-V701 PolarHBondContact O-N 3.17Å
700	S	87.9	Confident	85.5	Confident	24 Å²	24	51 Å²	51	17%	0.168	27%	0.267	C	S	.	.			trans	-64	105.2	170.5	179	0	0	0	0	110.2	L655 L697 R698 L702 L703 Y704	L655-S700 WeakPolarHBondContact CD1-OG 3.13Å; L697-S700 WeakPolarHBondContact O-CB 3.4Å; L697-S700 PolarHBondContact O-N 2.89Å; R698-S700 PolarHBondContact O-N 3.28Å; S700-L702 PolarHBondContact O-N 3.17Å; S700-L703 PolarHBondContact O-N 3.1Å; S700-L703 PolarHBondContact OG-N 3.36Å; S700-Y704 WeakPolarHBondContact O-CD2 3.36Å; S700-Y704 PolarHBondContact O-N 3.46Å
701	V	90.5	Very high	85.8	Confident	34 Å²	34	47.7 Å²	47.7	21%	0.206	24%	0.243	C	C	.	.	H	α-helix	trans	-58.4	-30.4	175.9	-176	0	0	0	0	110.5	N699 Y704 A705 I727 L731 A747 L751	N699-V701 PolarHBondContact O-N 3.17Å; V701-Y704 WeakPolarHBondContact O-CB 3.28Å; V701-Y704 PolarHBondContact O-N 3.3Å; V701-A705 PolarHBondContact O-N 3.33Å; V701-I727 HydrophobicContact CG1-CG2 4.32Å; V701-L731 HydrophobicContact CG1-CD1 4.45Å; V701-L731 HydrophobicContact CG1-CD2 4.18Å; V701-L731 HydrophobicContact CG2-CD2 3.87Å; V701-A747 HydrophobicContact CB-CB 3.81Å; V701-A747 HydrophobicContact CG1-CB 3.72Å; V701-L751 HydrophobicContact CG1-CD1 3.37Å
702	L	91.7	Very high	86.1	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-67.9	-41.6	178.9	-165.2	67.7	0	0	0	112.2	L655 S700 Y704 A705 V706 I746 A747 M750 W832 L833	L655-L702 HydrophobicContact CD2-CB 4.02Å; L655-L702 HydrophobicContact CD2-CD2 3.24Å; L655-L702 HydrophobicContact CD2-CG 4.18Å; L655-L702 HydrophobicContact CG-CD2 3.93Å; S700-L702 PolarHBondContact O-N 3.17Å; L702-Y704 VanDerWaalsContact C-N 3.26Å; L702-Y704 PolarHBondContact O-N 3.29Å; L702-A705 WeakPolarHBondContact O-CB 3.4Å; L702-A705 PolarHBondContact O-N 3.42Å; L702-A705 VanDerWaalsContact O-N 3.1Å; L702-V706 PolarHBondContact O-N 3.33Å; L702-I746 HydrophobicContact CD1-CG2 4.46Å; L702-A747 HydrophobicContact CB-CB 3.82Å; L702-A747 HydrophobicContact CD1-CB 3.76Å; L702-A747 HydrophobicContact CG-CB 4.42Å; L702-M750 HydrophobicContact CD1-CE 4.49Å; L702-M750 HydrophobicContact CD1-SD 3.46Å; L702-M750 WeakPolarHBondContact CD1-SD 3.38Å; L702-W832 HydrophobicContact CD2-CH2 3.89Å; L702-W832 HydrophobicContact CD2-CZ2 4.39Å; L702-W832 HydrophobicContact CD2-CZ3 4.43Å; L702-L833 HydrophobicContact CD1-CD2 4.08Å; L702-L833 HydrophobicContact CD2-CD1 3.84Å; L702-L833 HydrophobicContact CD2-CD2 4.04Å
703	L	92.3	Very high	86.3	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-63.1	-36.7	174.7	-72.6	178.7	0	0	0	111.6	L655 I662 L697 S700 A705 V706 Y707	L655-L703 HydrophobicContact CD1-CD1 4.09Å; L655-L703 HydrophobicContact CD1-CD2 3.8Å; L655-L703 HydrophobicContact CD1-CG 3.57Å; I662-L703 HydrophobicContact CD1-CD2 4.13Å; L697-L703 HydrophobicContact CB-CD1 3.81Å; L697-L703 HydrophobicContact CD1-CD1 4.24Å; L697-L703 HydrophobicContact CG-CD1 4.44Å; S700-L703 PolarHBondContact O-N 3.1Å; S700-L703 PolarHBondContact OG-N 3.36Å; L703-A705 VanDerWaalsContact C-N 3.33Å; L703-A705 PolarHBondContact O-N 2.98Å; L703-V706 PolarHBondContact O-N 3.39Å; L703-Y707 VanDerWaalsContact O-CB 3.31Å; L703-Y707 WeakPolarHBondContact O-CB 3.47Å; L703-Y707 PolarHBondContact O-N 3.49Å
704	Y	92.2	Very high	86.7	Confident	80 Å²	80	44.9 Å²	44.9	31%	0.314	23%	0.228	S	C	.	.	H	α-helix	trans	-63.1	-39.3	172.7	-79.7	-73.6	0	0	0	112.4	M692 S700 V701 L702 V706 Y707 I708 I727	M692-Y704 HydrophobicContact CE-CE1 4.42Å; M692-Y704 HydrophobicContact SD-CD1 4.12Å; M692-Y704 HydrophobicContact SD-CE1 3.92Å; S700-Y704 WeakPolarHBondContact O-CD2 3.36Å; S700-Y704 PolarHBondContact O-N 3.46Å; V701-Y704 WeakPolarHBondContact O-CB 3.28Å; V701-Y704 PolarHBondContact O-N 3.3Å; L702-Y704 VanDerWaalsContact C-N 3.26Å; L702-Y704 PolarHBondContact O-N 3.29Å; Y704-V706 VanDerWaalsContact C-N 3.34Å; Y704-V706 PolarHBondContact O-N 3.27Å; Y704-Y707 PolarHBondContact O-N 2.8Å; Y704-I708 WeakPolarHBondContact O-CB 3.16Å; Y704-I708 WeakPolarHBondContact O-CD1 3.25Å; Y704-I708 VanDerWaalsContact O-CG1 3.24Å; Y704-I708 WeakPolarHBondContact O-CG1 3.5Å; Y704-I708 PolarHBondContact O-N 3.38Å; Y704-I727 HydrophobicContact CD1-CD1 3.68Å; Y704-I727 HydrophobicContact CE1-CD1 4.49Å; Y704-I727 HydrophobicContact CG-CD1 3.73Å
705	A	93.6	Very high	87.3	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.3	-43.9	175	0	0	0	0	0	111.7	V701 L702 L703 I708 Q709 M750 L751	V701-A705 PolarHBondContact O-N 3.33Å; L702-A705 WeakPolarHBondContact O-CB 3.4Å; L702-A705 PolarHBondContact O-N 3.42Å; L702-A705 VanDerWaalsContact O-N 3.1Å; L703-A705 VanDerWaalsContact C-N 3.33Å; L703-A705 PolarHBondContact O-N 2.98Å; A705-I708 PolarHBondContact O-N 2.91Å; A705-Q709 WeakPolarHBondContact O-CG 3.48Å; A705-Q709 PolarHBondContact O-N 3.27Å; A705-Q709 VanDerWaalsContact O-N 3.12Å; A705-M750 HydrophobicContact CB-CB 4.21Å; A705-L751 HydrophobicContact CB-CD2 3.79Å; A705-L751 HydrophobicContact CB-CG 4Å
706	V	93.3	Very high	88.8	Confident	14 Å²	14	43.9 Å²	43.9	9%	0.085	21%	0.213	C	C	.	.	H	α-helix	trans	-65.9	-43.6	175.9	176.7	0	0	0	0	111.5	I662 L702 L703 Y704 I708 Q709 S710	I662-V706 HydrophobicContact CB-CG1 4.24Å; I662-V706 HydrophobicContact CG2-CG1 4.08Å; L702-V706 PolarHBondContact O-N 3.33Å; L703-V706 PolarHBondContact O-N 3.39Å; Y704-V706 VanDerWaalsContact C-N 3.34Å; Y704-V706 PolarHBondContact O-N 3.27Å; V706-I708 VanDerWaalsContact C-N 3.34Å; V706-I708 PolarHBondContact O-N 2.9Å; V706-Q709 PolarHBondContact O-N 2.99Å; V706-S710 WeakPolarHBondContact O-CB 3.28Å; V706-S710 PolarHBondContact O-N 3.13Å; V706-S710 PolarHBondContact O-OG 3.05Å
707	Y	94.8	Very high	89.6	Confident	22 Å²	22	44 Å²	44	9%	0.086	21%	0.21	C	C	.	.	H	α-helix	trans	-57.7	-45	175.4	168.5	-103.1	0	0	0	111.8	F684 C688 L703 Y704 S710 L711 T723	F684-Y707 HydrophobicContact CD1-CE2 4.07Å; F684-Y707 AromaticContact CE1-CD2 3.64Å; F684-Y707 HydrophobicContact CE1-CD2 3.64Å; F684-Y707 AromaticContact CE1-CE2 3.56Å; F684-Y707 HydrophobicContact CE1-CE2 3.56Å; F684-Y707 HydrophobicContact CZ-CD2 4.09Å; F684-Y707 HydrophobicContact CZ-CE2 4.42Å; C688-Y707 HydrophobicContact CB-CD2 3.77Å; C688-Y707 HydrophobicContact CB-CE2 3.97Å; L703-Y707 VanDerWaalsContact O-CB 3.31Å; L703-Y707 WeakPolarHBondContact O-CB 3.47Å; L703-Y707 PolarHBondContact O-N 3.49Å; Y704-Y707 PolarHBondContact O-N 2.8Å; Y707-S710 WeakPolarHBondContact O-CB 3.46Å; Y707-S710 PolarHBondContact O-N 3.08Å; Y707-L711 HydrophobicContact CD1-CD1 3.99Å; Y707-L711 HydrophobicContact CD1-CG 4.42Å; Y707-L711 HydrophobicContact CD2-CG 4.5Å; Y707-L711 HydrophobicContact CE1-CD1 3.31Å; Y707-L711 HydrophobicContact CE1-CG 3.96Å; Y707-L711 HydrophobicContact CE2-CD1 4.27Å; Y707-L711 HydrophobicContact CE2-CD2 4.2Å; Y707-L711 HydrophobicContact CE2-CG 4.05Å; Y707-L711 VanDerWaalsContact CZ-CD1 3.48Å; Y707-L711 WeakPolarHBondContact O-CG 3.5Å; Y707-L711 PolarHBondContact O-N 2.76Å; Y707-T723 HydrophobicContact CE1-CG2 4.43Å
708	I	95.3	Very high	90.5	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62.6	-45.9	178.6	-77.1	161.5	0	0	0	111.5	Y704 A705 V706 S710 L711 A712 A720 T723 A724 I727 L751 F758	Y704-I708 WeakPolarHBondContact O-CB 3.16Å; Y704-I708 WeakPolarHBondContact O-CD1 3.25Å; Y704-I708 VanDerWaalsContact O-CG1 3.24Å; Y704-I708 WeakPolarHBondContact O-CG1 3.5Å; Y704-I708 PolarHBondContact O-N 3.38Å; A705-I708 PolarHBondContact O-N 2.91Å; V706-I708 VanDerWaalsContact C-N 3.34Å; V706-I708 PolarHBondContact O-N 2.9Å; I708-S710 VanDerWaalsContact C-N 3.26Å; I708-S710 PolarHBondContact O-N 3.18Å; I708-L711 WeakPolarHBondContact O-CB 3.39Å; I708-L711 PolarHBondContact O-N 3.33Å; I708-A712 PolarHBondContact O-N 3.13Å; I708-A720 HydrophobicContact CG2-CB 4.11Å; I708-A720 WeakPolarHBondContact O-CB 3.37Å; I708-T723 HydrophobicContact CD1-CG2 4.17Å; I708-T723 HydrophobicContact CG1-CG2 4.03Å; I708-A724 HydrophobicContact CD1-CB 3.89Å; I708-A724 HydrophobicContact CG2-CB 4.19Å; I708-I727 HydrophobicContact CD1-CD1 3.87Å; I708-L751 HydrophobicContact CD1-CD2 3.39Å; I708-F758 HydrophobicContact CG2-CE2 3.52Å; I708-F758 HydrophobicContact CG2-CZ 4.14Å
709	Q	94.2	Very high	91.6	Very high	86 Å²	86	41.6 Å²	41.6	40%	0.402	21%	0.206	S	C	.	.	H	α-helix	trans	-62.3	-38.8	176.1	-71.2	-179.1	-4.4	0	0	111.4	A705 V706 A712 S713 S754	A705-Q709 WeakPolarHBondContact O-CG 3.48Å; A705-Q709 PolarHBondContact O-N 3.27Å; A705-Q709 VanDerWaalsContact O-N 3.12Å; V706-Q709 PolarHBondContact O-N 2.99Å; Q709-A712 PolarHBondContact O-N 2.89Å; Q709-S713 PolarHBondContact O-N 2.92Å; Q709-S754 PolarHBondContact NE2-OG 3.3Å
710	S	94.7	Very high	92.5	Very high	5 Å²	5	35.8 Å²	35.8	4%	0.035	18%	0.175	C	C	.	.	H	α-helix	trans	-67.7	-39.6	177.5	-56.9	0	0	0	0	112	F684 V706 Y707 I708 A712 S713 L714	F684-S710 VanDerWaalsContact CZ-CB 3.45Å; V706-S710 WeakPolarHBondContact O-CB 3.28Å; V706-S710 PolarHBondContact O-N 3.13Å; V706-S710 PolarHBondContact O-OG 3.05Å; Y707-S710 WeakPolarHBondContact O-CB 3.46Å; Y707-S710 PolarHBondContact O-N 3.08Å; I708-S710 VanDerWaalsContact C-N 3.26Å; I708-S710 PolarHBondContact O-N 3.18Å; S710-A712 VanDerWaalsContact C-N 3.34Å; S710-A712 PolarHBondContact O-N 2.89Å; S710-S713 WeakPolarHBondContact O-CB 3.42Å; S710-S713 PolarHBondContact O-N 3.39Å; S710-S713 PolarHBondContact O-OG 3Å; S710-L714 PolarHBondContact O-N 3.24Å; S710-L714 VanDerWaalsContact O-N 3.12Å
711	L	95	Very high	92.8	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-58.6	-45	171.1	-79	178.8	0	0	0	111.9	L681 F684 Y707 I708 S713 L714 A716 E719 A720	L681-L711 HydrophobicContact CD2-CD2 4.08Å; F684-L711 HydrophobicContact CD1-CD2 3.92Å; F684-L711 HydrophobicContact CE1-CD2 3.92Å; F684-L711 HydrophobicContact CE1-CG 4.16Å; Y707-L711 HydrophobicContact CD1-CD1 3.99Å; Y707-L711 HydrophobicContact CD1-CG 4.42Å; Y707-L711 HydrophobicContact CD2-CG 4.5Å; Y707-L711 HydrophobicContact CE1-CD1 3.31Å; Y707-L711 HydrophobicContact CE1-CG 3.96Å; Y707-L711 HydrophobicContact CE2-CD1 4.27Å; Y707-L711 HydrophobicContact CE2-CD2 4.2Å; Y707-L711 HydrophobicContact CE2-CG 4.05Å; Y707-L711 VanDerWaalsContact CZ-CD1 3.48Å; Y707-L711 WeakPolarHBondContact O-CG 3.5Å; Y707-L711 PolarHBondContact O-N 2.76Å; I708-L711 WeakPolarHBondContact O-CB 3.39Å; I708-L711 PolarHBondContact O-N 3.33Å; L711-S713 VanDerWaalsContact C-N 3.26Å; L711-S713 PolarHBondContact O-N 3.09Å; L711-L714 CarbonylContact O-C 3.58Å; L711-L714 PolarHBondContact O-N 3.5Å; L711-L714 VanDerWaalsContact O-N 3.13Å; L711-A716 PolarHBondContact O-N 2.97Å; L711-A716 VanDerWaalsContact O-N 3.07Å; L711-E719 HydrophobicContact CD1-CG 4.19Å; L711-A720 HydrophobicContact CB-CB 4.02Å
712	A	93.1	Very high	92.9	Very high	13 Å²	13	39.6 Å²	39.6	11%	0.107	19%	0.187	C	C	.	.	H	α-helix	trans	-62.5	-35.6	177.9	0	0	0	0	0	112	I708 Q709 S710 L714 E715 R717 A720 F758	I708-A712 PolarHBondContact O-N 3.13Å; Q709-A712 PolarHBondContact O-N 2.89Å; S710-A712 VanDerWaalsContact C-N 3.34Å; S710-A712 PolarHBondContact O-N 2.89Å; A712-L714 VanDerWaalsContact C-N 3.31Å; A712-L714 PolarHBondContact O-N 2.91Å; A712-E715 PolarHBondContact O-N 3.38Å; A712-R717 HydrophobicContact CB-CG 4.37Å; A712-A720 HydrophobicContact CB-CB 4.03Å; A712-F758 HydrophobicContact CB-CD1 4.4Å; A712-F758 HydrophobicContact CB-CE1 3.49Å; A712-F758 VanDerWaalsContact CB-CE1 3.49Å; A712-F758 HydrophobicContact CB-CZ 3.62Å
713	S	89.8	Confident	93	Very high	54 Å²	54	41.3 Å²	41.3	38%	0.378	20%	0.197	S	C	.	.	H	α-helix	trans	-67.4	-29.5	175.1	81.6	0	0	0	0	113.4	Q709 S710 L711 E715	Q709-S713 PolarHBondContact O-N 2.92Å; S710-S713 WeakPolarHBondContact O-CB 3.42Å; S710-S713 PolarHBondContact O-N 3.39Å; S710-S713 PolarHBondContact O-OG 3Å; L711-S713 VanDerWaalsContact C-N 3.26Å; L711-S713 PolarHBondContact O-N 3.09Å; S713-E715 PolarHBondContact O-N 2.95Å
714	L	91.5	Very high	93.1	Very high	5 Å²	5	41.2 Å²	41.2	3%	0.026	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	21.2	173	-68.2	173.9	0	0	0	112.8	S666 L669 L670 L681 F684 S710 L711 A712 A716	S666-L714 WeakPolarHBondContact O-CD2 3.49Å; L669-L714 HydrophobicContact CB-CD2 4.18Å; L670-L714 HydrophobicContact CB-CD2 4.33Å; L681-L714 HydrophobicContact CD2-CB 3.93Å; L681-L714 HydrophobicContact CD2-CD1 4.21Å; F684-L714 HydrophobicContact CB-CD1 3.95Å; F684-L714 HydrophobicContact CD1-CD1 3.77Å; F684-L714 HydrophobicContact CD2-CD1 3.91Å; F684-L714 HydrophobicContact CE1-CD1 4.25Å; F684-L714 HydrophobicContact CE2-CD1 4.39Å; F684-L714 HydrophobicContact CG-CD1 3.59Å; S710-L714 PolarHBondContact O-N 3.24Å; S710-L714 VanDerWaalsContact O-N 3.12Å; L711-L714 CarbonylContact O-C 3.58Å; L711-L714 PolarHBondContact O-N 3.5Å; L711-L714 VanDerWaalsContact O-N 3.13Å; A712-L714 VanDerWaalsContact C-N 3.31Å; A712-L714 PolarHBondContact O-N 2.91Å; L714-A716 PolarHBondContact O-N 3.12Å; L714-A716 VanDerWaalsContact O-N 3.1Å
715	E	89	Confident	93.2	Very high	136 Å²	136	40.2 Å²	40.2	64%	0.636	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.6	6.1	178.9	-52.4	176.8	156	0	0	115	A712 S713 R717	A712-E715 PolarHBondContact O-N 3.38Å; S713-E715 PolarHBondContact O-N 2.95Å; E715-R717 PolarHBondContact O-N 3.08Å; E715-R717 VanDerWaalsContact O-N 3.09Å
716	A	92.8	Very high	93.2	Very high	12 Å²	12	43.3 Å²	43.3	10%	0.099	21%	0.214	C	C	.	.			trans	-87.1	52.2	176.1	0	0	0	0	0	112.2	L681 L711 L714 E718 E719 A720	L681-A716 HydrophobicContact CD1-CB 3.91Å; L681-A716 HydrophobicContact CD2-CB 3.7Å; L681-A716 HydrophobicContact CG-CB 4.47Å; L711-A716 PolarHBondContact O-N 2.97Å; L711-A716 VanDerWaalsContact O-N 3.07Å; L714-A716 PolarHBondContact O-N 3.12Å; L714-A716 VanDerWaalsContact O-N 3.1Å; A716-E718 PolarHBondContact O-N 3.03Å; A716-E719 HydrophobicContact CB-CB 4.37Å; A716-E719 PolarHBondContact O-N 2.94Å; A716-A720 WeakPolarHBondContact O-CB 3.49Å; A716-A720 PolarHBondContact O-N 3.16Å
717	R	91	Very high	93.1	Very high	132 Å²	132	43.6 Å²	43.6	50%	0.498	22%	0.215	S	C	.	.	H	α-helix	trans	-66.1	-37.6	-171.6	-62.2	-171.5	-171.8	-177.5	10.6	114.1	A712 E715 A720 R721 E761	A712-R717 HydrophobicContact CB-CG 4.37Å; E715-R717 PolarHBondContact O-N 3.08Å; E715-R717 VanDerWaalsContact O-N 3.09Å; R717-A720 WeakPolarHBondContact O-CB 3.35Å; R717-A720 PolarHBondContact O-N 2.81Å; R717-R721 WeakPolarHBondContact O-CB 3.47Å; R717-R721 PolarHBondContact O-N 3.49Å; R717-E761 WeakPolarHBondContact CD-OE2 3.44Å; R717-E761 IonicContact CZ-OE2 2.8Å; R717-E761 IonicContact NE-OE2 3.94Å; R717-E761 IonicContact NH1-OE2 3.22Å; R717-E761 PolarHBondContact NH1-OE2 3.48Å
718	E	91.5	Very high	92.9	Very high	85 Å²	85	42.6 Å²	42.6	40%	0.397	21%	0.211	S	C	.	.	H	α-helix	trans	-66.8	-42.2	179	178.1	55.8	-163	0	0	111.4	A716 R721 Q722	A716-E718 PolarHBondContact O-N 3.03Å; E718-R721 PolarHBondContact O-N 2.89Å; E718-R721 IonicContact OE1-CZ 2.67Å; E718-R721 IonicContact OE1-NE 3.08Å; E718-R721 IonicContact OE1-NH2 2.64Å; E718-R721 PolarHBondContact OE1-NH2 3Å; E718-R721 IonicContact OE2-CZ 2.79Å; E718-R721 IonicContact OE2-NE 3.64Å; E718-R721 PolarHBondContact OE2-NE 2.94Å; E718-R721 IonicContact OE2-NH2 3.36Å; E718-R721 PolarHBondContact OE2-NH2 3.29Å; E718-Q722 VanDerWaalsContact O-CG 3.31Å; E718-Q722 WeakPolarHBondContact O-CG 3.46Å; E718-Q722 PolarHBondContact O-N 3.31Å; E718-Q722 PolarHBondContact OE1-NE2 3.45Å
719	E	93.6	Very high	92.7	Very high	48 Å²	48	45 Å²	45	22%	0.224	23%	0.226	C	C	.	.	H	α-helix	trans	-64.4	-41.6	173.6	-178.4	179.8	173.2	0	0	111.6	R685 L711 A716 R721 Q722 T723	R685-E719 IonicContact CZ-OE1 3.9Å; R685-E719 VanDerWaalsContact CZ-OE1 3.29Å; R685-E719 IonicContact CZ-OE2 3.72Å; R685-E719 IonicContact NE-OE1 3.64Å; R685-E719 PolarHBondContact NE-OE1 2.76Å; R685-E719 IonicContact NE-OE2 2.63Å; R685-E719 IonicContact NH2-OE1 2.98Å; R685-E719 PolarHBondContact NH2-OE1 3Å; R685-E719 IonicContact NH2-OE2 3.68Å; R685-E719 PolarHBondContact NH2-OE2 3.33Å; L711-E719 HydrophobicContact CD1-CG 4.19Å; A716-E719 HydrophobicContact CB-CB 4.37Å; A716-E719 PolarHBondContact O-N 2.94Å; E719-R721 VanDerWaalsContact C-N 3.33Å; E719-R721 PolarHBondContact O-N 3.4Å; E719-Q722 PolarHBondContact O-N 2.71Å; E719-T723 VanDerWaalsContact O-CB 3.26Å; E719-T723 WeakPolarHBondContact O-CB 3.44Å; E719-T723 PolarHBondContact O-N 3.28Å; E719-T723 PolarHBondContact O-OG1 3.42Å
720	A	94.8	Very high	92.4	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-58.3	-45.5	175	0	0	0	0	0	111.3	I708 L711 A712 A716 R717 T723 A724 F758	I708-A720 HydrophobicContact CG2-CB 4.11Å; I708-A720 WeakPolarHBondContact O-CB 3.37Å; L711-A720 HydrophobicContact CB-CB 4.02Å; A712-A720 HydrophobicContact CB-CB 4.03Å; A716-A720 WeakPolarHBondContact O-CB 3.49Å; A716-A720 PolarHBondContact O-N 3.16Å; R717-A720 WeakPolarHBondContact O-CB 3.35Å; R717-A720 PolarHBondContact O-N 2.81Å; A720-T723 PolarHBondContact O-N 2.82Å; A720-A724 WeakPolarHBondContact O-CB 3.43Å; A720-A724 PolarHBondContact O-N 3.45Å; A720-F758 HydrophobicContact CB-CD2 4.48Å; A720-F758 HydrophobicContact CB-CE2 4.14Å; A720-F758 HydrophobicContact CB-CZ 4.43Å
721	R	94	Very high	92.1	Very high	27 Å²	27	47.3 Å²	47.3	10%	0.102	24%	0.244	C	C	.	.	H	α-helix	trans	-63.5	-48.1	177.6	-171.8	-176.4	70.4	86	1.1	112.3	R717 E718 E719 T723 A724 Y725 Y755 F758	R717-R721 WeakPolarHBondContact O-CB 3.47Å; R717-R721 PolarHBondContact O-N 3.49Å; E718-R721 PolarHBondContact O-N 2.89Å; E718-R721 IonicContact OE1-CZ 2.67Å; E718-R721 IonicContact OE1-NE 3.08Å; E718-R721 IonicContact OE1-NH2 2.64Å; E718-R721 PolarHBondContact OE1-NH2 3Å; E718-R721 IonicContact OE2-CZ 2.79Å; E718-R721 IonicContact OE2-NE 3.64Å; E718-R721 PolarHBondContact OE2-NE 2.94Å; E718-R721 IonicContact OE2-NH2 3.36Å; E718-R721 PolarHBondContact OE2-NH2 3.29Å; E719-R721 VanDerWaalsContact C-N 3.33Å; E719-R721 PolarHBondContact O-N 3.4Å; R721-T723 VanDerWaalsContact C-N 3.34Å; R721-T723 PolarHBondContact O-N 3.09Å; R721-A724 PolarHBondContact O-N 2.94Å; R721-Y725 PolarHBondContact O-N 3.17Å; R721-Y755 HydrophobicContact CG-CD2 4.03Å; R721-Y755 HydrophobicContact CG-CE2 3.9Å; R721-F758 HydrophobicContact CB-CB 4Å; R721-F758 HydrophobicContact CB-CD2 4.47Å; R721-F758 HydrophobicContact CG-CB 4.08Å
722	Q	93.8	Very high	91.5	Very high	111 Å²	111	51.1 Å²	51.1	52%	0.519	27%	0.265	S	S	.	.	H	α-helix	trans	-62.8	-41.7	178.4	-71.4	176.6	5.7	0	0	111.7	E718 E719 Y725 S726	E718-Q722 VanDerWaalsContact O-CG 3.31Å; E718-Q722 WeakPolarHBondContact O-CG 3.46Å; E718-Q722 PolarHBondContact O-N 3.31Å; E718-Q722 PolarHBondContact OE1-NE2 3.45Å; E719-Q722 PolarHBondContact O-N 2.71Å; Q722-Y725 PolarHBondContact O-N 3.29Å; Q722-S726 WeakPolarHBondContact O-CB 3.35Å; Q722-S726 PolarHBondContact O-N 3.39Å
723	T	93.6	Very high	91	Very high	36 Å²	36	53.5 Å²	53.5	22%	0.221	28%	0.28	C	S	.	.	H	α-helix	trans	-66.6	-43.2	178.3	-54.3	0	0	0	0	111.1	Y707 I708 E719 A720 R721 Y725 S726 I727	Y707-T723 HydrophobicContact CE1-CG2 4.43Å; I708-T723 HydrophobicContact CD1-CG2 4.17Å; I708-T723 HydrophobicContact CG1-CG2 4.03Å; E719-T723 VanDerWaalsContact O-CB 3.26Å; E719-T723 WeakPolarHBondContact O-CB 3.44Å; E719-T723 PolarHBondContact O-N 3.28Å; E719-T723 PolarHBondContact O-OG1 3.42Å; A720-T723 PolarHBondContact O-N 2.82Å; R721-T723 VanDerWaalsContact C-N 3.34Å; R721-T723 PolarHBondContact O-N 3.09Å; T723-Y725 PolarHBondContact O-N 3.49Å; T723-S726 PolarHBondContact O-N 3.2Å; T723-I727 HydrophobicContact CG2-CD1 3.94Å; T723-I727 WeakPolarHBondContact O-CG1 3.11Å; T723-I727 PolarHBondContact O-N 3.07Å
724	A	94.1	Very high	90.7	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-59.3	-46.8	174.8	0	0	0	0	0	111.8	I708 A720 R721 I727 L728 Y755	I708-A724 HydrophobicContact CD1-CB 3.89Å; I708-A724 HydrophobicContact CG2-CB 4.19Å; A720-A724 WeakPolarHBondContact O-CB 3.43Å; A720-A724 PolarHBondContact O-N 3.45Å; R721-A724 PolarHBondContact O-N 2.94Å; A724-I727 PolarHBondContact O-N 3.47Å; A724-L728 WeakPolarHBondContact O-CB 3.49Å; A724-L728 VanDerWaalsContact O-CG 3.29Å; A724-L728 WeakPolarHBondContact O-CG 3.46Å; A724-L728 PolarHBondContact O-N 3.19Å; A724-Y755 HydrophobicContact CB-CD2 4.34Å
725	Y	93.4	Very high	90.3	Very high	59 Å²	59	58.8 Å²	58.8	23%	0.231	29%	0.292	C	S	.	.	H	α-helix	trans	-60.2	-48.7	176.4	-175.3	-105.6	0	0	0	111.9	R721 Q722 T723 I727 L728 T729 Y755 V775 V785	R721-Y725 PolarHBondContact O-N 3.17Å; Q722-Y725 PolarHBondContact O-N 3.29Å; T723-Y725 PolarHBondContact O-N 3.49Å; Y725-I727 VanDerWaalsContact C-N 3.29Å; Y725-I727 PolarHBondContact O-N 3.24Å; Y725-L728 PolarHBondContact O-N 3.13Å; Y725-T729 HydrophobicContact CD1-CG2 4.17Å; Y725-T729 HydrophobicContact CD2-CG2 4.44Å; Y725-T729 HydrophobicContact CE1-CG2 3.78Å; Y725-T729 HydrophobicContact CE2-CG2 4.07Å; Y725-T729 HydrophobicContact CG-CG2 4.5Å; Y725-T729 WeakPolarHBondContact O-CG2 3.32Å; Y725-T729 PolarHBondContact O-N 3.12Å; Y725-T729 PolarHBondContact O-OG1 2.65Å; Y725-Y755 HydrophobicContact CD2-CE1 4.46Å; Y725-Y755 AromaticContact CD2-CE2 3.83Å; Y725-Y755 HydrophobicContact CD2-CE2 3.83Å; Y725-Y755 AromaticContact CD2-CZ 3.73Å; Y725-Y755 HydrophobicContact CG-CE2 4.12Å; Y725-V775 HydrophobicContact CD2-CG2 4.01Å; Y725-V775 HydrophobicContact CE2-CG2 3.62Å; Y725-V785 HydrophobicContact CE2-CG1 4.12Å
726	S	92.9	Very high	89.9	Confident	64 Å²	64	58.4 Å²	58.4	45%	0.448	29%	0.285	S	S	.	.	H	α-helix	trans	-55	-46.7	178.9	-175.1	0	0	0	0	111.2	Q722 T723 T729 T730	Q722-S726 WeakPolarHBondContact O-CB 3.35Å; Q722-S726 PolarHBondContact O-N 3.39Å; T723-S726 PolarHBondContact O-N 3.2Å; S726-T729 PolarHBondContact O-N 3.39Å; S726-T729 PolarHBondContact O-OG1 3.04Å; S726-T730 WeakPolarHBondContact O-CG2 3.29Å; S726-T730 PolarHBondContact O-N 3Å
727	I	91.3	Very high	89.4	Confident	20 Å²	20	62.2 Å²	62.2	10%	0.103	31%	0.312	C	S	.	.	H	α-helix	trans	-66.8	-46.7	179.9	-67	158.5	0	0	0	110.5	V701 Y704 I708 T723 A724 Y725 T729 T730 L731 L751	V701-I727 HydrophobicContact CG1-CG2 4.32Å; Y704-I727 HydrophobicContact CD1-CD1 3.68Å; Y704-I727 HydrophobicContact CE1-CD1 4.49Å; Y704-I727 HydrophobicContact CG-CD1 3.73Å; I708-I727 HydrophobicContact CD1-CD1 3.87Å; T723-I727 HydrophobicContact CG2-CD1 3.94Å; T723-I727 WeakPolarHBondContact O-CG1 3.11Å; T723-I727 PolarHBondContact O-N 3.07Å; A724-I727 PolarHBondContact O-N 3.47Å; Y725-I727 VanDerWaalsContact C-N 3.29Å; Y725-I727 PolarHBondContact O-N 3.24Å; I727-T729 PolarHBondContact O-N 2.96Å; I727-T730 WeakPolarHBondContact CA-OG1 3.5Å; I727-T730 WeakPolarHBondContact O-CA 3.33Å; I727-T730 PolarHBondContact O-N 3.14Å; I727-T730 PolarHBondContact O-OG1 3.11Å; I727-L731 HydrophobicContact CG2-CG 4.48Å; I727-L731 WeakPolarHBondContact O-CG 3.18Å; I727-L731 PolarHBondContact O-N 3.41Å; I727-L731 VanDerWaalsContact O-N 3.13Å; I727-L751 HydrophobicContact CB-CD1 4.34Å; I727-L751 HydrophobicContact CG2-CD1 3.56Å
728	L	91.2	Very high	89.1	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-55.9	-36.6	177.3	-74.1	168.9	0	0	0	112.9	A724 Y725 T730 L731 L751 A752 Y755 V775 F779 V785	A724-L728 WeakPolarHBondContact O-CB 3.49Å; A724-L728 VanDerWaalsContact O-CG 3.29Å; A724-L728 WeakPolarHBondContact O-CG 3.46Å; A724-L728 PolarHBondContact O-N 3.19Å; Y725-L728 PolarHBondContact O-N 3.13Å; L728-T730 VanDerWaalsContact C-N 3.3Å; L728-T730 PolarHBondContact O-N 2.97Å; L728-L731 HydrophobicContact CD2-CD1 4.15Å; L728-L731 PolarHBondContact O-N 3.07Å; L728-L751 HydrophobicContact CD2-CB 3.82Å; L728-L751 HydrophobicContact CG-CB 4.12Å; L728-A752 HydrophobicContact CD2-CB 4.24Å; L728-Y755 HydrophobicContact CD1-CG 4.17Å; L728-V775 HydrophobicContact CD1-CG1 4.3Å; L728-F779 HydrophobicContact CD2-CD2 4.37Å; L728-F779 HydrophobicContact CD2-CE2 4.33Å; L728-V785 HydrophobicContact CB-CG2 4.06Å
729	T	90.8	Very high	88.6	Confident	52 Å²	52	58.9 Å²	58.9	32%	0.319	31%	0.309	S	S	.	.	H	α-helix	trans	-73.5	-18.8	176	58.3	0	0	0	0	114.2	Y725 S726 I727 V785	Y725-T729 HydrophobicContact CD1-CG2 4.17Å; Y725-T729 HydrophobicContact CD2-CG2 4.44Å; Y725-T729 HydrophobicContact CE1-CG2 3.78Å; Y725-T729 HydrophobicContact CE2-CG2 4.07Å; Y725-T729 HydrophobicContact CG-CG2 4.5Å; Y725-T729 WeakPolarHBondContact O-CG2 3.32Å; Y725-T729 PolarHBondContact O-N 3.12Å; Y725-T729 PolarHBondContact O-OG1 2.65Å; S726-T729 PolarHBondContact O-N 3.39Å; S726-T729 PolarHBondContact O-OG1 3.04Å; I727-T729 PolarHBondContact O-N 2.96Å; T729-V785 HydrophobicContact CG2-CB 4.19Å; T729-V785 HydrophobicContact CG2-CG1 3.93Å
730	T	88.6	Confident	87.9	Confident	106 Å²	106	59.7 Å²	59.7	65%	0.65	31%	0.31	S	S	*	.	H	α-helix	trans	-90.9	-15.6	175.7	60.1	0	0	0	0	113.5	S726 I727 L728	S726-T730 WeakPolarHBondContact O-CG2 3.29Å; S726-T730 PolarHBondContact O-N 3Å; I727-T730 WeakPolarHBondContact CA-OG1 3.5Å; I727-T730 WeakPolarHBondContact O-CA 3.33Å; I727-T730 PolarHBondContact O-N 3.14Å; I727-T730 PolarHBondContact O-OG1 3.11Å; L728-T730 VanDerWaalsContact C-N 3.3Å; L728-T730 PolarHBondContact O-N 2.97Å
731	L	87.8	Confident	87.2	Confident	32 Å²	32	59.7 Å²	59.7	17%	0.168	31%	0.311	C	S	.	.			trans	-70.9	137.3	177.5	-67.2	174.3	0	0	0	110.4	V701 I727 L728 P748 L751	V701-L731 HydrophobicContact CG1-CD1 4.45Å; V701-L731 HydrophobicContact CG1-CD2 4.18Å; V701-L731 HydrophobicContact CG2-CD2 3.87Å; I727-L731 HydrophobicContact CG2-CG 4.48Å; I727-L731 WeakPolarHBondContact O-CG 3.18Å; I727-L731 PolarHBondContact O-N 3.41Å; I727-L731 VanDerWaalsContact O-N 3.13Å; L728-L731 HydrophobicContact CD2-CD1 4.15Å; L728-L731 PolarHBondContact O-N 3.07Å; L731-P748 HydrophobicContact CD1-CB 3.8Å; L731-P748 HydrophobicContact CD1-CG 3.84Å; L731-L751 HydrophobicContact CD1-CD1 4.47Å
732	D	82	Confident	86.8	Confident	81 Å²	81	59 Å²	59	43%	0.433	31%	0.31	S	S	.	.			trans	-83.5	169.6	169.7	69.3	17.6	0	0	0	111	R734	D732-R734 PolarHBondContact O-N 3.29Å; D732-R734 VanDerWaalsContact O-N 3.12Å; D732-R734 WeakPolarHBondContact OD1-CB 3.47Å; D732-R734 WeakPolarHBondContact OD1-CG 3.41Å; D732-R734 PolarHBondContact OD1-N 3.25Å; D732-R734 WeakPolarHBondContact OD2-CD 3.16Å; D732-R734 WeakPolarHBondContact OD2-CG 3.34Å; D732-R734 IonicContact OD2-CZ 2.84Å; D732-R734 IonicContact OD2-NE 3.87Å; D732-R734 PolarHBondContact OD2-NE 3.02Å
733	S	83	Confident	86.5	Confident	62 Å²	62	54.8 Å²	54.8	43%	0.434	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-72.4	2.7	178.8	60.6	0	0	0	0	114.2	W735 Y736 D782 G783	S733-W735 VanDerWaalsContact C-N 3.3Å; S733-W735 PolarHBondContact O-N 3.41Å; S733-Y736 WeakPolarHBondContact O-CB 3.35Å; S733-Y736 PolarHBondContact O-N 2.96Å; S733-D782 VanDerWaalsContact CB-O 3.23Å; S733-D782 WeakPolarHBondContact CB-O 3.27Å; S733-G783 WeakPolarHBondContact CA-O 3.34Å
734	R	83.4	Confident	86.2	Confident	162 Å²	162	57.8 Å²	57.8	61%	0.611	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-74.5	-19.9	-174	-59.4	179.8	-175.1	173.6	0.1	113.1	D732 Y736 S737 Q738	D732-R734 PolarHBondContact O-N 3.29Å; D732-R734 VanDerWaalsContact O-N 3.12Å; D732-R734 WeakPolarHBondContact OD1-CB 3.47Å; D732-R734 WeakPolarHBondContact OD1-CG 3.41Å; D732-R734 PolarHBondContact OD1-N 3.25Å; D732-R734 WeakPolarHBondContact OD2-CD 3.16Å; D732-R734 WeakPolarHBondContact OD2-CG 3.34Å; D732-R734 IonicContact OD2-CZ 2.84Å; D732-R734 IonicContact OD2-NE 3.87Å; D732-R734 PolarHBondContact OD2-NE 3.02Å; R734-Y736 PolarHBondContact O-N 3.43Å; R734-Y736 VanDerWaalsContact O-N 3.11Å; R734-S737 PolarHBondContact O-N 2.99Å; R734-S737 PolarHBondContact O-OG 3.43Å; R734-Q738 WeakPolarHBondContact O-CG 3.43Å; R734-Q738 PolarHBondContact O-N 3.44Å; R734-Q738 PolarHBondContact O-NE2 2.89Å
735	W	84.4	Confident	85.9	Confident	9 Å²	9	58 Å²	58	3%	0.034	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-54.6	-31.2	175.7	72.4	-95.7	0	0	0	111.6	S733 S737 Q738 E744 Q745 P748 L749 F779 G783	S733-W735 VanDerWaalsContact C-N 3.3Å; S733-W735 PolarHBondContact O-N 3.41Å; W735-S737 VanDerWaalsContact C-N 3.3Å; W735-S737 PolarHBondContact O-N 3.44Å; W735-Q738 WeakPolarHBondContact O-CB 3.45Å; W735-Q738 PolarHBondContact O-N 2.77Å; W735-E744 WeakPolarHBondContact CB-O 3.28Å; W735-Q745 HydrophobicContact CE3-CG 4.46Å; W735-P748 HydrophobicContact CB-CB 4.26Å; W735-P748 HydrophobicContact CB-CG 3.76Å; W735-P748 HydrophobicContact CD2-CB 4.26Å; W735-P748 HydrophobicContact CG-CB 4.04Å; W735-P748 HydrophobicContact CG-CG 4.09Å; W735-L749 HydrophobicContact CH2-CD2 4.02Å; W735-L749 HydrophobicContact CZ3-CD2 3.74Å; W735-L749 HydrophobicContact CZ3-CG 4.3Å; W735-F779 HydrophobicContact CD2-CE2 4.28Å; W735-F779 HydrophobicContact CD2-CZ 4.1Å; W735-F779 AromaticContact CE2-CE2 3.48Å; W735-F779 VanDerWaalsContact CE2-CE2 3.48Å; W735-F779 AromaticContact CE2-CZ 3.49Å; W735-F779 VanDerWaalsContact CE2-CZ 3.49Å; W735-F779 HydrophobicContact CE3-CZ 4.43Å; W735-F779 AromaticContact CH2-CE1 3.76Å; W735-F779 HydrophobicContact CH2-CE1 3.76Å; W735-F779 HydrophobicContact CH2-CE2 4.43Å; W735-F779 AromaticContact CH2-CZ 3.67Å; W735-F779 HydrophobicContact CH2-CZ 3.67Å; W735-F779 HydrophobicContact CZ2-CD1 4.16Å; W735-F779 HydrophobicContact CZ2-CD2 4.17Å; W735-F779 AromaticContact CZ2-CE1 3.58Å; W735-F779 HydrophobicContact CZ2-CE1 3.58Å; W735-F779 AromaticContact CZ2-CE2 3.59Å; W735-F779 HydrophobicContact CZ2-CE2 3.59Å; W735-F779 HydrophobicContact CZ2-CG 4.43Å; W735-F779 AromaticContact CZ2-CZ 3.26Å; W735-F779 HydrophobicContact CZ2-CZ 3.26Å; W735-F779 HydrophobicContact CZ3-CZ 4.24Å; W735-F779 AromaticContact NE1-CE2 3.44Å; W735-F779 AromaticContact NE1-CZ 3.96Å; W735-G783 PolarHBondContact NE1-O 3Å
736	Y	79.4	Confident	85.8	Confident	127 Å²	127	55.4 Å²	55.4	50%	0.498	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-62.7	-36.7	178	-172.4	-87.1	0	0	0	112.7	S733 R734 R807	S733-Y736 WeakPolarHBondContact O-CB 3.35Å; S733-Y736 PolarHBondContact O-N 2.96Å; R734-Y736 PolarHBondContact O-N 3.43Å; R734-Y736 VanDerWaalsContact O-N 3.11Å; Y736-R807 VanDerWaalsContact CD2-NH1 3.33Å
737	S	82.7	Confident	85.7	Confident	93 Å²	93	52.3 Å²	52.3	65%	0.65	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-91.2	0.8	-179.2	55.9	0	0	0	0	113.8	R734 W735	R734-S737 PolarHBondContact O-N 2.99Å; R734-S737 PolarHBondContact O-OG 3.43Å; W735-S737 VanDerWaalsContact C-N 3.3Å; W735-S737 PolarHBondContact O-N 3.44Å
738	Q	84.8	Confident	85.8	Confident	60 Å²	60	51.5 Å²	51.5	28%	0.28	27%	0.269	S	S	.	.	S	Bend	trans	-70.4	153.7	179.7	-65.2	-58.3	-37	0	0	111.6	R734 W735 Y740 E744 Q745	R734-Q738 WeakPolarHBondContact O-CG 3.43Å; R734-Q738 PolarHBondContact O-N 3.44Å; R734-Q738 PolarHBondContact O-NE2 2.89Å; W735-Q738 WeakPolarHBondContact O-CB 3.45Å; W735-Q738 PolarHBondContact O-N 2.77Å; Q738-Y740 PolarHBondContact O-N 2.91Å; Q738-E744 HydrophobicContact CB-CB 4.35Å; Q738-E744 HydrophobicContact CG-CB 3.73Å; Q738-Q745 HydrophobicContact CB-CB 4.15Å; Q738-Q745 PolarHBondContact O-NE2 3.44Å
739	P	81.2	Confident	85.9	Confident	86 Å²	86	51.5 Å²	51.5	56%	0.558	27%	0.27	S	S	*	.	P	Polyproline II helix	trans	-51.5	140	174.9	-24.1	33.4	0	0	0	111.1	G741 S742	P739-G741 PolarHBondContact O-N 3.17Å; P739-S742 VanDerWaalsContact O-CB 3.25Å; P739-S742 WeakPolarHBondContact O-CB 3.48Å; P739-S742 PolarHBondContact O-N 3Å; P739-S742 PolarHBondContact O-OG 3.09Å
740	Y	79.5	Confident	86.1	Confident	65 Å²	65	49.9 Å²	49.9	26%	0.255	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	129.6	-177.5	-174.8	-80	0	0	0	110.6	Q738 S742 Q745 Q811 L815 W826 P836 Y837	Q738-Y740 PolarHBondContact O-N 2.91Å; Y740-S742 PolarHBondContact O-N 3.09Å; Y740-Q745 VanDerWaalsContact CA-OE1 3.31Å; Y740-Q811 HydrophobicContact CD2-CB 4.49Å; Y740-Q811 HydrophobicContact CD2-CG 4.12Å; Y740-Q811 HydrophobicContact CE2-CB 3.81Å; Y740-Q811 VanDerWaalsContact CE2-CD 3.45Å; Y740-Q811 HydrophobicContact CE2-CG 3.83Å; Y740-L815 HydrophobicContact CD1-CD1 3.66Å; Y740-L815 HydrophobicContact CE1-CD1 2.97Å; Y740-L815 HydrophobicContact CE1-CG 4.37Å; Y740-W826 HydrophobicContact CE1-CH2 4.27Å; Y740-P836 HydrophobicContact CD1-CG 4Å; Y740-P836 HydrophobicContact CD2-CB 4.22Å; Y740-P836 HydrophobicContact CD2-CG 4.19Å; Y740-P836 HydrophobicContact CE1-CB 4.13Å; Y740-P836 VanDerWaalsContact CE1-CD 3.41Å; Y740-P836 HydrophobicContact CE1-CG 3.48Å; Y740-P836 VanDerWaalsContact CE1-CG 3.48Å; Y740-P836 HydrophobicContact CE2-CB 3.54Å; Y740-P836 HydrophobicContact CE2-CG 3.77Å; Y740-P836 HydrophobicContact CG-CG 4.32Å; Y740-P836 VanDerWaalsContact CZ-CD 3.49Å; Y740-P836 VanDerWaalsContact CZ-CG 3.44Å; Y740-P836 WeakPolarHBondContact OH-CD 3.45Å; Y740-Y837 WeakPolarHBondContact OH-CB 3.34Å; Y740-Y837 PolarHBondContact OH-N 2.83Å
741	G	80.6	Confident	86.3	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.01	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.8	8.6	-179.5	0	0	0	0	0	114.6	P739 I746	P739-G741 PolarHBondContact O-N 3.17Å; G741-I746 WeakPolarHBondContact O-CD1 3.38Å
742	S	84.8	Confident	86.6	Confident	13 Å²	13	43.3 Å²	43.3	9%	0.091	22%	0.22	C	C	.	.			trans	-67.3	154.1	169.3	96.6	0	0	0	0	110.6	P739 Y740 E744 Q745 I746	P739-S742 VanDerWaalsContact O-CB 3.25Å; P739-S742 WeakPolarHBondContact O-CB 3.48Å; P739-S742 PolarHBondContact O-N 3Å; P739-S742 PolarHBondContact O-OG 3.09Å; Y740-S742 PolarHBondContact O-N 3.09Å; S742-E744 VanDerWaalsContact CB-OE2 3.27Å; S742-E744 WeakPolarHBondContact CB-OE2 3.25Å; S742-E744 PolarHBondContact O-N 2.9Å; S742-E744 PolarHBondContact OG-N 3.23Å; S742-E744 PolarHBondContact OG-OE2 3.43Å; S742-Q745 PolarHBondContact O-N 3.1Å; S742-Q745 PolarHBondContact OG-N 3.39Å; S742-I746 WeakPolarHBondContact O-CG1 3.31Å; S742-I746 PolarHBondContact O-N 3.18Å
743	P	87.2	Confident	87.3	Confident	22 Å²	22	39.9 Å²	39.9	14%	0.143	20%	0.202	C	C	.	.	H	α-helix	trans	-61.6	-31.8	178.2	23.7	-29.9	0	0	0	112	F651 L655 Q745 I746 A747	F651-P743 HydrophobicContact CB-CG 4.33Å; F651-P743 HydrophobicContact CD1-CG 4.13Å; F651-P743 HydrophobicContact CD2-CB 3.87Å; F651-P743 HydrophobicContact CD2-CG 3.93Å; F651-P743 HydrophobicContact CE1-CG 4.38Å; F651-P743 HydrophobicContact CE2-CB 3.87Å; F651-P743 HydrophobicContact CE2-CG 4.25Å; F651-P743 HydrophobicContact CG-CB 4.33Å; F651-P743 HydrophobicContact CG-CG 3.88Å; F651-P743 HydrophobicContact CZ-CB 4.29Å; F651-P743 HydrophobicContact CZ-CG 4.46Å; L655-P743 HydrophobicContact CD2-CB 4.4Å; P743-Q745 VanDerWaalsContact C-N 3.27Å; P743-Q745 PolarHBondContact O-N 3.37Å; P743-I746 PolarHBondContact O-N 3.32Å; P743-A747 WeakPolarHBondContact O-CB 3.48Å; P743-A747 PolarHBondContact O-N 2.96Å
744	E	87.9	Confident	87.8	Confident	99 Å²	99	37.3 Å²	37.3	46%	0.463	18%	0.184	S	C	.	.	H	α-helix	trans	-68.6	-23.9	176.6	-56.9	75.3	-160.9	0	0	112.9	W735 Q738 S742 P748	W735-E744 WeakPolarHBondContact CB-O 3.28Å; Q738-E744 HydrophobicContact CB-CB 4.35Å; Q738-E744 HydrophobicContact CG-CB 3.73Å; S742-E744 VanDerWaalsContact CB-OE2 3.27Å; S742-E744 WeakPolarHBondContact CB-OE2 3.25Å; S742-E744 PolarHBondContact O-N 2.9Å; S742-E744 PolarHBondContact OG-N 3.23Å; S742-E744 PolarHBondContact OG-OE2 3.43Å; E744-P748 WeakPolarHBondContact O-CD 3.37Å; E744-P748 VanDerWaalsContact O-CG 3.23Å; E744-P748 WeakPolarHBondContact O-CG 3.37Å
745	Q	87.9	Confident	88.4	Confident	5 Å²	5	29.8 Å²	29.8	2%	0.023	16%	0.155	C	C	.	.	H	α-helix	trans	-86.6	-45.4	172.3	-170.7	-177.2	68.7	0	0	111.8	W735 Q738 Y740 S742 P743 P748 L749 P836	W735-Q745 HydrophobicContact CE3-CG 4.46Å; Q738-Q745 HydrophobicContact CB-CB 4.15Å; Q738-Q745 PolarHBondContact O-NE2 3.44Å; Y740-Q745 VanDerWaalsContact CA-OE1 3.31Å; S742-Q745 PolarHBondContact O-N 3.1Å; S742-Q745 PolarHBondContact OG-N 3.39Å; P743-Q745 VanDerWaalsContact C-N 3.27Å; P743-Q745 PolarHBondContact O-N 3.37Å; Q745-P748 WeakPolarHBondContact O-CD 3.25Å; Q745-L749 WeakPolarHBondContact O-CG 3.36Å; Q745-P836 VanDerWaalsContact OE1-CG 3.27Å
746	I	90.1	Very high	88.8	Confident	3 Å²	3	29.3 Å²	29.3	2%	0.015	15%	0.154	C	C	.	.	H	α-helix	trans	-69.2	-42.8	-174.8	-67.3	173.8	0	0	0	111.3	L702 G741 S742 P743 L749 M750 L833 P836	L702-I746 HydrophobicContact CD1-CG2 4.46Å; G741-I746 WeakPolarHBondContact O-CD1 3.38Å; S742-I746 WeakPolarHBondContact O-CG1 3.31Å; S742-I746 PolarHBondContact O-N 3.18Å; P743-I746 PolarHBondContact O-N 3.32Å; I746-L749 WeakPolarHBondContact O-CB 3.45Å; I746-L749 PolarHBondContact O-N 3.49Å; I746-L749 VanDerWaalsContact O-N 3.15Å; I746-M750 HydrophobicContact CG2-CG 4.05Å; I746-M750 HydrophobicContact CG2-SD 3.83Å; I746-M750 WeakPolarHBondContact O-CG 3.41Å; I746-M750 PolarHBondContact O-N 2.95Å; I746-L833 HydrophobicContact CD1-CB 4.49Å; I746-L833 HydrophobicContact CD1-CD1 4.14Å; I746-L833 HydrophobicContact CG2-CB 4.11Å; I746-L833 HydrophobicContact CG2-CD1 4.19Å; I746-P836 HydrophobicContact CG1-CG 4.11Å
747	A	92.1	Very high	89.4	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.6	-44.8	-173.2	0	0	0	0	0	113.6	V701 L702 P743 L749 M750 L751	V701-A747 HydrophobicContact CB-CB 3.81Å; V701-A747 HydrophobicContact CG1-CB 3.72Å; L702-A747 HydrophobicContact CB-CB 3.82Å; L702-A747 HydrophobicContact CD1-CB 3.76Å; L702-A747 HydrophobicContact CG-CB 4.42Å; P743-A747 WeakPolarHBondContact O-CB 3.48Å; P743-A747 PolarHBondContact O-N 2.96Å; A747-L749 VanDerWaalsContact C-N 3.31Å; A747-L749 PolarHBondContact O-N 2.64Å; A747-M750 PolarHBondContact O-N 3.43Å; A747-L751 WeakPolarHBondContact O-CG 3.36Å; A747-L751 PolarHBondContact O-N 3.45Å
748	P	93.1	Very high	89.9	Confident	2 Å²	2	22.1 Å²	22.1	1%	0.013	11%	0.113	C	C	.	.	H	α-helix	trans	-58.4	-39.3	172.5	-28.8	39.4	0	0	0	113.5	L731 W735 E744 Q745 L751 A752 F779	L731-P748 HydrophobicContact CD1-CB 3.8Å; L731-P748 HydrophobicContact CD1-CG 3.84Å; W735-P748 HydrophobicContact CB-CB 4.26Å; W735-P748 HydrophobicContact CB-CG 3.76Å; W735-P748 HydrophobicContact CD2-CB 4.26Å; W735-P748 HydrophobicContact CG-CB 4.04Å; W735-P748 HydrophobicContact CG-CG 4.09Å; E744-P748 WeakPolarHBondContact O-CD 3.37Å; E744-P748 VanDerWaalsContact O-CG 3.23Å; E744-P748 WeakPolarHBondContact O-CG 3.37Å; Q745-P748 WeakPolarHBondContact O-CD 3.25Å; P748-L751 PolarHBondContact O-N 3.14Å; P748-A752 WeakPolarHBondContact O-CB 3.34Å; P748-A752 PolarHBondContact O-N 3.19Å; P748-F779 HydrophobicContact CB-CE2 3.96Å; P748-F779 HydrophobicContact CB-CZ 3.94Å
749	L	93.2	Very high	90.2	Very high	2 Å²	2	19.3 Å²	19.3	1%	0.01	10%	0.1	C	C	.	.	H	α-helix	trans	-64	-42.7	176.3	-62.1	173.4	0	0	0	111.5	W735 Q745 I746 A747 A752 S753 F779 P836 M839 L840 I843	W735-L749 HydrophobicContact CH2-CD2 4.02Å; W735-L749 HydrophobicContact CZ3-CD2 3.74Å; W735-L749 HydrophobicContact CZ3-CG 4.3Å; Q745-L749 WeakPolarHBondContact O-CG 3.36Å; I746-L749 WeakPolarHBondContact O-CB 3.45Å; I746-L749 PolarHBondContact O-N 3.49Å; I746-L749 VanDerWaalsContact O-N 3.15Å; A747-L749 VanDerWaalsContact C-N 3.31Å; A747-L749 PolarHBondContact O-N 2.64Å; L749-A752 PolarHBondContact O-N 3.04Å; L749-S753 WeakPolarHBondContact O-CB 3.49Å; L749-S753 PolarHBondContact O-N 3.3Å; L749-F779 HydrophobicContact CD2-CE1 3.99Å; L749-F779 HydrophobicContact CD2-CZ 4.21Å; L749-P836 HydrophobicContact CD1-CB 4.15Å; L749-M839 HydrophobicContact CB-CB 4.18Å; L749-M839 HydrophobicContact CB-CE 4.21Å; L749-M839 HydrophobicContact CD1-CB 4.21Å; L749-L840 HydrophobicContact CD1-CD2 4.46Å; L749-L840 HydrophobicContact CD1-CG 4.27Å; L749-L840 HydrophobicContact CD2-CD2 3.57Å; L749-L840 HydrophobicContact CD2-CG 4.24Å; L749-I843 HydrophobicContact CB-CD1 4.12Å; L749-I843 HydrophobicContact CD2-CD1 3.66Å
750	M	93.9	Very high	90.5	Very high	18 Å²	18	15.2 Å²	15.2	9%	0.089	7%	0.074	C	C	.	.	H	α-helix	trans	-62	-42.3	175	-70.8	-179.1	69.7	0	0	112.3	L702 A705 I746 A747 S754 L833 M839	L702-M750 HydrophobicContact CD1-CE 4.49Å; L702-M750 HydrophobicContact CD1-SD 3.46Å; L702-M750 WeakPolarHBondContact CD1-SD 3.38Å; A705-M750 HydrophobicContact CB-CB 4.21Å; I746-M750 HydrophobicContact CG2-CG 4.05Å; I746-M750 HydrophobicContact CG2-SD 3.83Å; I746-M750 WeakPolarHBondContact O-CG 3.41Å; I746-M750 PolarHBondContact O-N 2.95Å; A747-M750 PolarHBondContact O-N 3.43Å; M750-S754 VanDerWaalsContact O-CB 3.29Å; M750-S754 WeakPolarHBondContact O-CB 3.48Å; M750-S754 PolarHBondContact O-N 2.63Å; M750-S754 PolarHBondContact O-OG 3.25Å; M750-L833 HydrophobicContact CE-CD2 4.41Å; M750-L833 HydrophobicContact SD-CD2 3.97Å; M750-M839 VanDerWaalsContact CA-CE 3.4Å; M750-M839 HydrophobicContact CB-CE 3.97Å; M750-M839 HydrophobicContact CG-CE 3.38Å; M750-M839 HydrophobicContact CG-SD 4.29Å
751	L	94.2	Very high	90.8	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-65.8	-46.2	177.9	-73	174.5	0	0	0	112	V701 A705 I708 I727 L728 L731 A747 P748 S753 S754 Y755	V701-L751 HydrophobicContact CG1-CD1 3.37Å; A705-L751 HydrophobicContact CB-CD2 3.79Å; A705-L751 HydrophobicContact CB-CG 4Å; I708-L751 HydrophobicContact CD1-CD2 3.39Å; I727-L751 HydrophobicContact CB-CD1 4.34Å; I727-L751 HydrophobicContact CG2-CD1 3.56Å; L728-L751 HydrophobicContact CD2-CB 3.82Å; L728-L751 HydrophobicContact CG-CB 4.12Å; L731-L751 HydrophobicContact CD1-CD1 4.47Å; A747-L751 WeakPolarHBondContact O-CG 3.36Å; A747-L751 PolarHBondContact O-N 3.45Å; P748-L751 PolarHBondContact O-N 3.14Å; L751-S753 PolarHBondContact O-N 2.88Å; L751-S754 PolarHBondContact O-N 2.94Å; L751-Y755 WeakPolarHBondContact O-CB 3.38Å; L751-Y755 PolarHBondContact O-N 3.32Å
752	A	94.1	Very high	91	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-60.8	-45.7	178.8	0	0	0	0	0	111.4	L728 P748 L749 A756 L776 F779	L728-A752 HydrophobicContact CD2-CB 4.24Å; P748-A752 WeakPolarHBondContact O-CB 3.34Å; P748-A752 PolarHBondContact O-N 3.19Å; L749-A752 PolarHBondContact O-N 3.04Å; A752-A756 PolarHBondContact O-N 2.7Å; A752-A756 VanDerWaalsContact O-N 3.12Å; A752-L776 HydrophobicContact CB-CD2 4.14Å; A752-F779 HydrophobicContact CB-CD1 3.84Å; A752-F779 HydrophobicContact CB-CE1 3.74Å; A752-F779 HydrophobicContact CB-CG 4.28Å; A752-F779 HydrophobicContact CB-CZ 4.09Å
753	S	95.1	Very high	90.2	Very high	9 Å²	9	17.6 Å²	17.6	6%	0.063	9%	0.094	C	C	.	.	H	α-helix	trans	-59.5	-50.3	173.6	168	0	0	0	0	112.1	L749 L751 Y755 A756 K757 H842	L749-S753 WeakPolarHBondContact O-CB 3.49Å; L749-S753 PolarHBondContact O-N 3.3Å; L751-S753 PolarHBondContact O-N 2.88Å; S753-Y755 PolarHBondContact O-N 3.08Å; S753-A756 PolarHBondContact O-N 3.47Å; S753-K757 PolarHBondContact O-N 2.82Å; S753-H842 PolarHBondContact OG-CD2 3.39Å; S753-H842 PolarHBondContact OG-NE2 2.6Å
754	S	94.8	Very high	89.4	Confident	8 Å²	8	25 Å²	25	6%	0.056	13%	0.126	C	C	.	.	H	α-helix	trans	-63	-43.1	-178.2	-58	0	0	0	0	111.7	Q709 M750 L751 A756 K757 F758	Q709-S754 PolarHBondContact NE2-OG 3.3Å; M750-S754 VanDerWaalsContact O-CB 3.29Å; M750-S754 WeakPolarHBondContact O-CB 3.48Å; M750-S754 PolarHBondContact O-N 2.63Å; M750-S754 PolarHBondContact O-OG 3.25Å; L751-S754 PolarHBondContact O-N 2.94Å; S754-A756 PolarHBondContact O-N 2.83Å; S754-K757 PolarHBondContact O-N 3.22Å; S754-F758 WeakPolarHBondContact O-CD2 3.48Å; S754-F758 WeakPolarHBondContact O-CE2 3.23Å; S754-F758 WeakPolarHBondContact O-CG 3.35Å; S754-F758 PolarHBondContact O-N 3.37Å
755	Y	95.1	Very high	88.6	Confident	3 Å²	3	21.8 Å²	21.8	1%	0.012	12%	0.115	C	C	.	.	H	α-helix	trans	-58.5	-49	176.4	172.7	-99.7	0	0	0	111.9	R721 A724 Y725 L728 L751 S753 K757 F758 C759 V775	R721-Y755 HydrophobicContact CG-CD2 4.03Å; R721-Y755 HydrophobicContact CG-CE2 3.9Å; A724-Y755 HydrophobicContact CB-CD2 4.34Å; Y725-Y755 HydrophobicContact CD2-CE1 4.46Å; Y725-Y755 AromaticContact CD2-CE2 3.83Å; Y725-Y755 HydrophobicContact CD2-CE2 3.83Å; Y725-Y755 AromaticContact CD2-CZ 3.73Å; Y725-Y755 HydrophobicContact CG-CE2 4.12Å; L728-Y755 HydrophobicContact CD1-CG 4.17Å; L751-Y755 WeakPolarHBondContact O-CB 3.38Å; L751-Y755 PolarHBondContact O-N 3.32Å; S753-Y755 PolarHBondContact O-N 3.08Å; Y755-K757 VanDerWaalsContact C-N 3.34Å; Y755-K757 PolarHBondContact O-N 3.23Å; Y755-F758 PolarHBondContact O-N 3.44Å; Y755-C759 PolarHBondContact O-N 2.79Å; Y755-C759 PolarHBondContact O-SG 3.35Å; Y755-V775 HydrophobicContact CD1-CB 4.12Å; Y755-V775 HydrophobicContact CD1-CG1 3.74Å; Y755-V775 HydrophobicContact CD1-CG2 4.48Å; Y755-V775 HydrophobicContact CE1-CB 3.61Å; Y755-V775 HydrophobicContact CE1-CG1 3.69Å; Y755-V775 HydrophobicContact CE1-CG2 3.6Å
756	A	94	Very high	87.8	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-61.2	-43.2	178.4	0	0	0	0	0	111.4	A752 S753 S754 F758 C759 F760 A772 L776 L846	A752-A756 PolarHBondContact O-N 2.7Å; A752-A756 VanDerWaalsContact O-N 3.12Å; S753-A756 PolarHBondContact O-N 3.47Å; S754-A756 PolarHBondContact O-N 2.83Å; A756-F758 PolarHBondContact O-N 3.06Å; A756-C759 WeakPolarHBondContact O-CB 3.46Å; A756-C759 PolarHBondContact O-N 2.85Å; A756-F760 HydrophobicContact CB-CE2 4.19Å; A756-F760 HydrophobicContact CB-CZ 4.47Å; A756-F760 WeakPolarHBondContact O-CD2 3.32Å; A756-F760 VanDerWaalsContact O-CG 3.27Å; A756-F760 WeakPolarHBondContact O-CG 3.32Å; A756-F760 PolarHBondContact O-N 3.15Å; A756-A772 HydrophobicContact CB-CB 4.4Å; A756-L776 HydrophobicContact CB-CD1 3.81Å; A756-L776 HydrophobicContact CB-CD2 4.24Å; A756-L776 HydrophobicContact CB-CG 4.15Å; A756-L846 HydrophobicContact CB-CD1 4.08Å
757	K	92	Very high	87.4	Confident	52 Å²	52	28.6 Å²	28.6	23%	0.226	16%	0.161	C	C	.	.	H	α-helix	trans	-57.1	-47.9	174.5	-173.4	177.7	-178.7	172.6	0	112	S753 S754 Y755 C759 F760 E761 D902 L906	S753-K757 PolarHBondContact O-N 2.82Å; S754-K757 PolarHBondContact O-N 3.22Å; Y755-K757 VanDerWaalsContact C-N 3.34Å; Y755-K757 PolarHBondContact O-N 3.23Å; K757-C759 VanDerWaalsContact C-N 3.3Å; K757-C759 PolarHBondContact O-N 3.15Å; K757-F760 PolarHBondContact O-N 3.16Å; K757-F760 VanDerWaalsContact O-N 3.15Å; K757-E761 PolarHBondContact O-N 3.44Å; K757-D902 IonicContact NZ-OD2 3.69Å; K757-D902 PolarHBondContact NZ-OD2 2.79Å; K757-L906 HydrophobicContact CG-CD1 3.9Å
758	F	92.2	Very high	87	Confident	17 Å²	17	30.1 Å²	30.1	8%	0.075	17%	0.168	C	C	.	.	H	α-helix	trans	-64.7	-34.1	178.7	-58.7	-38.7	0	0	0	112.9	I708 A712 A720 R721 S754 Y755 A756 E761 A762	I708-F758 HydrophobicContact CG2-CE2 3.52Å; I708-F758 HydrophobicContact CG2-CZ 4.14Å; A712-F758 HydrophobicContact CB-CD1 4.4Å; A712-F758 HydrophobicContact CB-CE1 3.49Å; A712-F758 VanDerWaalsContact CB-CE1 3.49Å; A712-F758 HydrophobicContact CB-CZ 3.62Å; A720-F758 HydrophobicContact CB-CD2 4.48Å; A720-F758 HydrophobicContact CB-CE2 4.14Å; A720-F758 HydrophobicContact CB-CZ 4.43Å; R721-F758 HydrophobicContact CB-CB 4Å; R721-F758 HydrophobicContact CB-CD2 4.47Å; R721-F758 HydrophobicContact CG-CB 4.08Å; S754-F758 WeakPolarHBondContact O-CD2 3.48Å; S754-F758 WeakPolarHBondContact O-CE2 3.23Å; S754-F758 WeakPolarHBondContact O-CG 3.35Å; S754-F758 PolarHBondContact O-N 3.37Å; Y755-F758 PolarHBondContact O-N 3.44Å; A756-F758 PolarHBondContact O-N 3.06Å; F758-E761 PolarHBondContact O-N 3.41Å; F758-A762 PolarHBondContact O-N 3.24Å
759	C	91.6	Very high	86.6	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-64.2	-40.9	172.9	-67.3	0	0	0	0	111.7	Y755 A756 K757 E761 A762 F768 A772	Y755-C759 PolarHBondContact O-N 2.79Å; Y755-C759 PolarHBondContact O-SG 3.35Å; A756-C759 WeakPolarHBondContact O-CB 3.46Å; A756-C759 PolarHBondContact O-N 2.85Å; K757-C759 VanDerWaalsContact C-N 3.3Å; K757-C759 PolarHBondContact O-N 3.15Å; C759-E761 VanDerWaalsContact C-N 3.33Å; C759-E761 PolarHBondContact O-N 3.19Å; C759-A762 PolarHBondContact O-N 3.14Å; C759-F768 HydrophobicContact CB-CB 4.13Å; C759-F768 WeakPolarHBondContact CB-O 3.36Å; C759-A772 HydrophobicContact CB-CB 3.8Å
760	F	88.3	Confident	86.2	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-72	-24.9	178	-58.4	-33.9	0	0	0	114.1	A756 K757 Y769 A772 L846 Y849 A850 N910	A756-F760 HydrophobicContact CB-CE2 4.19Å; A756-F760 HydrophobicContact CB-CZ 4.47Å; A756-F760 WeakPolarHBondContact O-CD2 3.32Å; A756-F760 VanDerWaalsContact O-CG 3.27Å; A756-F760 WeakPolarHBondContact O-CG 3.32Å; A756-F760 PolarHBondContact O-N 3.15Å; K757-F760 PolarHBondContact O-N 3.16Å; K757-F760 VanDerWaalsContact O-N 3.15Å; F760-Y769 AromaticContact CD1-CD1 3.57Å; F760-Y769 HydrophobicContact CD1-CD1 3.57Å; F760-Y769 AromaticContact CD1-CE1 3.53Å; F760-Y769 HydrophobicContact CD1-CE1 3.53Å; F760-Y769 HydrophobicContact CD1-CG 4.2Å; F760-Y769 AromaticContact CE1-CD1 3.75Å; F760-Y769 HydrophobicContact CE1-CD1 3.75Å; F760-Y769 HydrophobicContact CE1-CE1 4.11Å; F760-Y769 HydrophobicContact CE1-CG 4.43Å; F760-Y769 HydrophobicContact CG-CE1 4.31Å; F760-Y769 PolarHBondContact O-OH 3.36Å; F760-A772 HydrophobicContact CD1-CB 4.42Å; F760-A772 HydrophobicContact CE1-CB 3.66Å; F760-A772 HydrophobicContact CZ-CB 3.96Å; F760-L846 HydrophobicContact CD2-CD2 4.19Å; F760-L846 HydrophobicContact CE2-CB 4.23Å; F760-L846 HydrophobicContact CE2-CD2 3.84Å; F760-Y849 HydrophobicContact CB-CE1 4.25Å; F760-Y849 HydrophobicContact CD1-CD1 4.48Å; F760-Y849 HydrophobicContact CD1-CE1 4.24Å; F760-Y849 AromaticContact CD2-CD1 3.82Å; F760-Y849 HydrophobicContact CD2-CD1 3.82Å; F760-Y849 AromaticContact CD2-CE1 3.92Å; F760-Y849 HydrophobicContact CD2-CE1 3.92Å; F760-Y849 HydrophobicContact CE1-CD1 4.46Å; F760-Y849 AromaticContact CE2-CD1 3.79Å; F760-Y849 HydrophobicContact CE2-CD1 3.79Å; F760-Y849 HydrophobicContact CE2-CE1 4.32Å; F760-Y849 HydrophobicContact CG-CD1 4.19Å; F760-Y849 AromaticContact CG-CE1 3.88Å; F760-Y849 HydrophobicContact CG-CE1 3.88Å; F760-Y849 HydrophobicContact CZ-CD1 4.13Å; F760-A850 HydrophobicContact CE1-CB 3.95Å; F760-A850 HydrophobicContact CZ-CB 3.81Å; F760-N910 PolarHBondContact O-ND2 3.35Å
761	E	85.9	Confident	85.9	Confident	44 Å²	44	37.8 Å²	37.8	21%	0.206	20%	0.203	C	C	.	.	H	α-helix	trans	-73.3	-26.8	172.7	-80.1	179.4	-165.9	0	0	113.2	R717 K757 F758 C759 V763 L906	R717-E761 WeakPolarHBondContact CD-OE2 3.44Å; R717-E761 IonicContact CZ-OE2 2.8Å; R717-E761 IonicContact NE-OE2 3.94Å; R717-E761 IonicContact NH1-OE2 3.22Å; R717-E761 PolarHBondContact NH1-OE2 3.48Å; K757-E761 PolarHBondContact O-N 3.44Å; F758-E761 PolarHBondContact O-N 3.41Å; C759-E761 VanDerWaalsContact C-N 3.33Å; C759-E761 PolarHBondContact O-N 3.19Å; E761-V763 VanDerWaalsContact C-N 3.35Å; E761-V763 WeakPolarHBondContact O-CG2 3.48Å; E761-V763 PolarHBondContact O-N 3.25Å; E761-L906 HydrophobicContact CB-CD2 4.45Å; E761-L906 HydrophobicContact CG-CD1 4.48Å; E761-L906 HydrophobicContact CG-CD2 3.22Å; E761-L906 HydrophobicContact CG-CG 4.48Å
762	A	84.3	Confident	85.8	Confident	26 Å²	26	37.8 Å²	37.8	22%	0.215	20%	0.203	C	C	.	.			trans	-79.9	78.5	-178.6	0	0	0	0	0	111.4	F758 C759 E764 F768	F758-A762 PolarHBondContact O-N 3.24Å; C759-A762 PolarHBondContact O-N 3.14Å; A762-E764 PolarHBondContact O-N 3.26Å; A762-F768 HydrophobicContact CB-CD2 3.37Å; A762-F768 HydrophobicContact CB-CE2 3.62Å; A762-F768 HydrophobicContact CB-CG 4.3Å
763	V	68.1	Low	85.6	Confident	59 Å²	59	38.9 Å²	38.9	36%	0.358	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-18.4	-173.2	-163.3	0	0	0	0	114.3	E761 N910 K912	E761-V763 VanDerWaalsContact C-N 3.35Å; E761-V763 WeakPolarHBondContact O-CG2 3.48Å; E761-V763 PolarHBondContact O-N 3.25Å; V763-N910 VanDerWaalsContact CG2-OD1 3.29Å; V763-N910 WeakPolarHBondContact CG2-OD1 3.48Å; V763-K912 PolarHBondContact O-NZ 3.15Å
764	E	69.5	Low	85.4	Confident	177 Å²	177	39.7 Å²	39.7	83%	0.827	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-43.7	-167.4	-65.5	-174.2	175.8	0	0	112.8	A762 K912	A762-E764 PolarHBondContact O-N 3.26Å; E764-K912 PolarHBondContact O-NZ 3.02Å
765	S	71.4	Confident	85.3	Confident	32 Å²	32	39.3 Å²	39.3	22%	0.224	21%	0.208	C	C	.	.			trans	-119.3	123.5	-175.3	53.4	0	0	0	0	113.9	S767 F768	S765-S767 PolarHBondContact O-N 3.11Å; S765-F768 PolarHBondContact O-N 3.3Å; S765-F768 WeakPolarHBondContact OG-CD2 3.32Å; S765-F768 WeakPolarHBondContact OG-CE2 3.34Å; S765-F768 WeakPolarHBondContact OG-CZ 3.12Å
766	P	71.3	Confident	85.1	Confident	97 Å²	97	39.2 Å²	39.2	63%	0.63	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-23.4	178.2	25.4	-32.8	0	0	0	113.1	F768 Y769	P766-F768 PolarHBondContact O-N 3.44Å; P766-F768 VanDerWaalsContact O-N 3.13Å; P766-Y769 PolarHBondContact O-N 3.3Å; P766-Y769 VanDerWaalsContact O-N 3.13Å
767	S	80.9	Confident	85	Confident	54 Å²	54	39.5 Å²	39.5	38%	0.378	21%	0.21	S	C	.	.	H	α-helix	trans	-56.2	-27.5	175.2	57.4	0	0	0	0	113.4	S765 Y769 E770 D771	S765-S767 PolarHBondContact O-N 3.11Å; S767-Y769 VanDerWaalsContact C-N 3.29Å; S767-Y769 PolarHBondContact O-N 3.33Å; S767-E770 PolarHBondContact O-N 3.07Å; S767-D771 WeakPolarHBondContact O-CB 3.5Å; S767-D771 PolarHBondContact O-N 3.42Å
768	F	84	Confident	84.9	Confident	33 Å²	33	37.1 Å²	37.1	15%	0.145	20%	0.2	C	C	.	.	H	α-helix	trans	-68.9	-27.5	-179.9	-69	-40.3	0	0	0	113.5	C759 A762 S765 P766 A772	C759-F768 HydrophobicContact CB-CB 4.13Å; C759-F768 WeakPolarHBondContact CB-O 3.36Å; A762-F768 HydrophobicContact CB-CD2 3.37Å; A762-F768 HydrophobicContact CB-CE2 3.62Å; A762-F768 HydrophobicContact CB-CG 4.3Å; S765-F768 PolarHBondContact O-N 3.3Å; S765-F768 WeakPolarHBondContact OG-CD2 3.32Å; S765-F768 WeakPolarHBondContact OG-CE2 3.34Å; S765-F768 WeakPolarHBondContact OG-CZ 3.12Å; P766-F768 PolarHBondContact O-N 3.44Å; P766-F768 VanDerWaalsContact O-N 3.13Å; F768-A772 WeakPolarHBondContact O-CB 3.28Å; F768-A772 PolarHBondContact O-N 3.2Å
769	Y	84	Confident	84.8	Confident	36 Å²	36	36.4 Å²	36.4	14%	0.141	20%	0.197	C	C	.	.	H	α-helix	trans	-69.8	-44.1	173.8	-77.3	-100.5	0	0	0	110.8	F760 P766 S767 D771 A772 L773 Y849 N910	F760-Y769 AromaticContact CD1-CD1 3.57Å; F760-Y769 HydrophobicContact CD1-CD1 3.57Å; F760-Y769 AromaticContact CD1-CE1 3.53Å; F760-Y769 HydrophobicContact CD1-CE1 3.53Å; F760-Y769 HydrophobicContact CD1-CG 4.2Å; F760-Y769 AromaticContact CE1-CD1 3.75Å; F760-Y769 HydrophobicContact CE1-CD1 3.75Å; F760-Y769 HydrophobicContact CE1-CE1 4.11Å; F760-Y769 HydrophobicContact CE1-CG 4.43Å; F760-Y769 HydrophobicContact CG-CE1 4.31Å; F760-Y769 PolarHBondContact O-OH 3.36Å; P766-Y769 PolarHBondContact O-N 3.3Å; P766-Y769 VanDerWaalsContact O-N 3.13Å; S767-Y769 VanDerWaalsContact C-N 3.29Å; S767-Y769 PolarHBondContact O-N 3.33Å; Y769-D771 VanDerWaalsContact C-N 3.31Å; Y769-A772 PolarHBondContact O-N 2.92Å; Y769-L773 WeakPolarHBondContact O-CG 3.3Å; Y769-L773 PolarHBondContact O-N 3.43Å; Y769-Y849 HydrophobicContact CE1-CE1 4.15Å; Y769-N910 PolarHBondContact OH-ND2 3.37Å
770	E	86	Confident	84.7	Confident	106 Å²	106	37.6 Å²	37.6	50%	0.495	20%	0.203	S	C	.	.	H	α-helix	trans	-63.9	-37.5	175.3	-66.6	-179.1	-176.3	0	0	111.4	S767 R774 Q791	S767-E770 PolarHBondContact O-N 3.07Å; E770-R774 VanDerWaalsContact O-CB 3.24Å; E770-R774 WeakPolarHBondContact O-CB 3.39Å; E770-R774 PolarHBondContact O-N 3.05Å; E770-Q791 PolarHBondContact O-NE2 3.39Å; E770-Q791 PolarHBondContact O-OE1 2.87Å
771	D	88.4	Confident	84.5	Confident	41 Å²	41	40.9 Å²	40.9	22%	0.219	23%	0.226	C	C	.	.	H	α-helix	trans	-66.2	-45.4	173.4	-80.3	-39.2	0	0	0	112.1	S767 Y769 L773 R774 V775	S767-D771 WeakPolarHBondContact O-CB 3.5Å; S767-D771 PolarHBondContact O-N 3.42Å; Y769-D771 VanDerWaalsContact C-N 3.31Å; D771-L773 VanDerWaalsContact C-N 3.31Å; D771-L773 PolarHBondContact O-N 3.24Å; D771-R774 PolarHBondContact O-N 3.45Å; D771-R774 IonicContact OD1-CZ 3.5Å; D771-R774 IonicContact OD1-NE 3.74Å; D771-R774 PolarHBondContact OD1-NE 3.37Å; D771-R774 IonicContact OD1-NH2 3.46Å; D771-R774 PolarHBondContact OD1-NH2 2.82Å; D771-V775 WeakPolarHBondContact O-CB 3.43Å; D771-V775 VanDerWaalsContact O-CG2 3.24Å; D771-V775 WeakPolarHBondContact O-CG2 3.37Å; D771-V775 PolarHBondContact O-N 2.73Å
772	A	90.6	Very high	84.2	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-58.9	-44.9	176.4	0	0	0	0	0	111.1	A756 C759 F760 F768 Y769 V775 L776	A756-A772 HydrophobicContact CB-CB 4.4Å; C759-A772 HydrophobicContact CB-CB 3.8Å; F760-A772 HydrophobicContact CD1-CB 4.42Å; F760-A772 HydrophobicContact CE1-CB 3.66Å; F760-A772 HydrophobicContact CZ-CB 3.96Å; F768-A772 WeakPolarHBondContact O-CB 3.28Å; F768-A772 PolarHBondContact O-N 3.2Å; Y769-A772 PolarHBondContact O-N 2.92Å; A772-V775 PolarHBondContact O-N 3.39Å; A772-L776 WeakPolarHBondContact O-CB 3.25Å; A772-L776 VanDerWaalsContact O-CG 3.28Å; A772-L776 WeakPolarHBondContact O-CG 3.45Å; A772-L776 PolarHBondContact O-N 2.63Å
773	L	90.9	Very high	84.2	Confident	22 Å²	22	41.5 Å²	41.5	12%	0.115	23%	0.228	C	C	.	.	H	α-helix	trans	-61.1	-51.3	176.3	-78.7	175.5	0	0	0	112.2	Y769 D771 V775 L776 A777 L847 A850 T851	Y769-L773 WeakPolarHBondContact O-CG 3.3Å; Y769-L773 PolarHBondContact O-N 3.43Å; D771-L773 VanDerWaalsContact C-N 3.31Å; D771-L773 PolarHBondContact O-N 3.24Å; L773-V775 VanDerWaalsContact C-N 3.32Å; L773-V775 PolarHBondContact O-N 3.46Å; L773-L776 PolarHBondContact O-N 3.43Å; L773-A777 VanDerWaalsContact O-CB 3.23Å; L773-A777 WeakPolarHBondContact O-CB 3.49Å; L773-A777 PolarHBondContact O-N 2.93Å; L773-L847 HydrophobicContact CD2-CD1 3.78Å; L773-A850 HydrophobicContact CD1-CB 4Å; L773-A850 HydrophobicContact CD2-CB 3.35Å; L773-A850 HydrophobicContact CG-CB 3.59Å; L773-T851 HydrophobicContact CD1-CG2 4.43Å; L773-T851 HydrophobicContact CD2-CG2 3.83Å
774	R	90.8	Very high	84.9	Confident	27 Å²	27	43.4 Å²	43.4	10%	0.102	23%	0.232	C	C	.	.	H	α-helix	trans	-56.7	-46.7	178.1	177.7	-177.2	61.2	81.4	-0.4	111.5	E770 D771 C778 C789	E770-R774 VanDerWaalsContact O-CB 3.24Å; E770-R774 WeakPolarHBondContact O-CB 3.39Å; E770-R774 PolarHBondContact O-N 3.05Å; D771-R774 PolarHBondContact O-N 3.45Å; D771-R774 IonicContact OD1-CZ 3.5Å; D771-R774 IonicContact OD1-NE 3.74Å; D771-R774 PolarHBondContact OD1-NE 3.37Å; D771-R774 IonicContact OD1-NH2 3.46Å; D771-R774 PolarHBondContact OD1-NH2 2.82Å; R774-C778 WeakPolarHBondContact O-CB 3.4Å; R774-C778 PolarHBondContact O-N 3Å; R774-C789 VanDerWaalsContact CD-O 3.23Å; R774-C789 WeakPolarHBondContact CD-O 3.5Å; R774-C789 HydrophobicContact CG-CB 4.49Å
775	V	91.4	Very high	85.6	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66.7	-46.2	-179.1	170.9	0	0	0	0	111.3	Y725 L728 Y755 D771 A772 L773 F779 V785	Y725-V775 HydrophobicContact CD2-CG2 4.01Å; Y725-V775 HydrophobicContact CE2-CG2 3.62Å; L728-V775 HydrophobicContact CD1-CG1 4.3Å; Y755-V775 HydrophobicContact CD1-CB 4.12Å; Y755-V775 HydrophobicContact CD1-CG1 3.74Å; Y755-V775 HydrophobicContact CD1-CG2 4.48Å; Y755-V775 HydrophobicContact CE1-CB 3.61Å; Y755-V775 HydrophobicContact CE1-CG1 3.69Å; Y755-V775 HydrophobicContact CE1-CG2 3.6Å; D771-V775 WeakPolarHBondContact O-CB 3.43Å; D771-V775 VanDerWaalsContact O-CG2 3.24Å; D771-V775 WeakPolarHBondContact O-CG2 3.37Å; D771-V775 PolarHBondContact O-N 2.73Å; A772-V775 PolarHBondContact O-N 3.39Å; L773-V775 VanDerWaalsContact C-N 3.32Å; L773-V775 PolarHBondContact O-N 3.46Å; V775-F779 WeakPolarHBondContact O-CB 3.45Å; V775-F779 PolarHBondContact O-N 3.38Å; V775-V785 HydrophobicContact CB-CG1 4.44Å; V775-V785 HydrophobicContact CG1-CG1 4.06Å; V775-V785 HydrophobicContact CG1-CG2 3.96Å; V775-V785 HydrophobicContact CG2-CG1 4.02Å
776	L	92.5	Very high	86.1	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64.5	-42.5	177.8	-71.5	-179.3	0	0	0	111.9	A752 A756 A772 L773 F779 L780 I843 L846	A752-L776 HydrophobicContact CB-CD2 4.14Å; A756-L776 HydrophobicContact CB-CD1 3.81Å; A756-L776 HydrophobicContact CB-CD2 4.24Å; A756-L776 HydrophobicContact CB-CG 4.15Å; A772-L776 WeakPolarHBondContact O-CB 3.25Å; A772-L776 VanDerWaalsContact O-CG 3.28Å; A772-L776 WeakPolarHBondContact O-CG 3.45Å; A772-L776 PolarHBondContact O-N 2.63Å; L773-L776 PolarHBondContact O-N 3.43Å; L776-F779 PolarHBondContact O-N 3.45Å; L776-L780 WeakPolarHBondContact O-CB 3.23Å; L776-L780 WeakPolarHBondContact O-CG 3.15Å; L776-L780 PolarHBondContact O-N 2.85Å; L776-I843 HydrophobicContact CD2-CG2 4.17Å; L776-L846 HydrophobicContact CD1-CB 4.16Å
777	A	91.3	Very high	86.1	Confident	7 Å²	7	34.5 Å²	34.5	6%	0.058	20%	0.196	C	C	.	.	H	α-helix	trans	-62	-52.2	177.4	0	0	0	0	0	111	L773 F779 L780 S781 P792 L800	L773-A777 VanDerWaalsContact O-CB 3.23Å; L773-A777 WeakPolarHBondContact O-CB 3.49Å; L773-A777 PolarHBondContact O-N 2.93Å; A777-F779 VanDerWaalsContact C-N 3.34Å; A777-F779 PolarHBondContact O-N 3.38Å; A777-L780 PolarHBondContact O-N 2.78Å; A777-S781 WeakPolarHBondContact O-CB 3.3Å; A777-S781 PolarHBondContact O-N 3.15Å; A777-S781 PolarHBondContact O-OG 2.97Å; A777-P792 HydrophobicContact CB-CB 3.92Å; A777-P792 HydrophobicContact CB-CG 3.85Å; A777-L800 HydrophobicContact CB-CD1 4.34Å; A777-L800 WeakPolarHBondContact O-CD1 3.22Å
778	C	89.7	Confident	85.6	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.007	22%	0.217	C	C	.	.	H	α-helix	trans	-61.6	-41.6	178.9	-169.2	0	0	0	0	111.9	R774 L780 S781 D782 K784 S786 C789	R774-C778 WeakPolarHBondContact O-CB 3.4Å; R774-C778 PolarHBondContact O-N 3Å; C778-L780 PolarHBondContact O-N 3.22Å; C778-S781 PolarHBondContact O-N 3.16Å; C778-S781 PolarHBondContact O-OG 3.41Å; C778-D782 PolarHBondContact O-N 2.93Å; C778-K784 CarbonylContact C-O 3.42Å; C778-K784 VanDerWaalsContact O-O 3.05Å; C778-K784 PolarHBondContact SG-O 2.8Å; C778-S786 PolarHBondContact SG-N 3.39Å; C778-S786 VanDerWaalsContact SG-N 3.4Å; C778-C789 HydrophobicContact CB-CB 4.35Å
779	F	90.4	Very high	84.8	Confident	2 Å²	2	38 Å²	38	1%	0.009	23%	0.225	C	C	.	.	H	α-helix	trans	-60.5	-42.7	176.3	175.3	-104.2	0	0	0	112.5	L728 W735 P748 L749 A752 V775 L776 A777 G783 V785	L728-F779 HydrophobicContact CD2-CD2 4.37Å; L728-F779 HydrophobicContact CD2-CE2 4.33Å; W735-F779 HydrophobicContact CD2-CE2 4.28Å; W735-F779 HydrophobicContact CD2-CZ 4.1Å; W735-F779 AromaticContact CE2-CE2 3.48Å; W735-F779 VanDerWaalsContact CE2-CE2 3.48Å; W735-F779 AromaticContact CE2-CZ 3.49Å; W735-F779 VanDerWaalsContact CE2-CZ 3.49Å; W735-F779 HydrophobicContact CE3-CZ 4.43Å; W735-F779 AromaticContact CH2-CE1 3.76Å; W735-F779 HydrophobicContact CH2-CE1 3.76Å; W735-F779 HydrophobicContact CH2-CE2 4.43Å; W735-F779 AromaticContact CH2-CZ 3.67Å; W735-F779 HydrophobicContact CH2-CZ 3.67Å; W735-F779 HydrophobicContact CZ2-CD1 4.16Å; W735-F779 HydrophobicContact CZ2-CD2 4.17Å; W735-F779 AromaticContact CZ2-CE1 3.58Å; W735-F779 HydrophobicContact CZ2-CE1 3.58Å; W735-F779 AromaticContact CZ2-CE2 3.59Å; W735-F779 HydrophobicContact CZ2-CE2 3.59Å; W735-F779 HydrophobicContact CZ2-CG 4.43Å; W735-F779 AromaticContact CZ2-CZ 3.26Å; W735-F779 HydrophobicContact CZ2-CZ 3.26Å; W735-F779 HydrophobicContact CZ3-CZ 4.24Å; W735-F779 AromaticContact NE1-CE2 3.44Å; W735-F779 AromaticContact NE1-CZ 3.96Å; P748-F779 HydrophobicContact CB-CE2 3.96Å; P748-F779 HydrophobicContact CB-CZ 3.94Å; L749-F779 HydrophobicContact CD2-CE1 3.99Å; L749-F779 HydrophobicContact CD2-CZ 4.21Å; A752-F779 HydrophobicContact CB-CD1 3.84Å; A752-F779 HydrophobicContact CB-CE1 3.74Å; A752-F779 HydrophobicContact CB-CG 4.28Å; A752-F779 HydrophobicContact CB-CZ 4.09Å; V775-F779 WeakPolarHBondContact O-CB 3.45Å; V775-F779 PolarHBondContact O-N 3.38Å; L776-F779 PolarHBondContact O-N 3.45Å; A777-F779 VanDerWaalsContact C-N 3.34Å; A777-F779 PolarHBondContact O-N 3.38Å; F779-G783 WeakPolarHBondContact O-CA 3.16Å; F779-G783 PolarHBondContact O-N 3.45Å; F779-V785 HydrophobicContact CB-CG2 3.97Å; F779-V785 HydrophobicContact CD2-CG2 4.38Å
780	L	88.4	Confident	84.6	Confident	25 Å²	25	38.7 Å²	38.7	13%	0.131	24%	0.242	C	C	.	.	H	α-helix	trans	-80.2	-30.8	-178.6	-70.5	171.6	0	0	0	113.3	L776 A777 C778 L800 L804 L840 I843	L776-L780 WeakPolarHBondContact O-CB 3.23Å; L776-L780 WeakPolarHBondContact O-CG 3.15Å; L776-L780 PolarHBondContact O-N 2.85Å; A777-L780 PolarHBondContact O-N 2.78Å; C778-L780 PolarHBondContact O-N 3.22Å; L780-L800 HydrophobicContact CB-CD1 4.19Å; L780-L800 HydrophobicContact CB-CD2 3.54Å; L780-L800 HydrophobicContact CB-CG 4.1Å; L780-L800 HydrophobicContact CD1-CD2 3.43Å; L780-L800 VanDerWaalsContact CD1-CD2 3.43Å; L780-L800 HydrophobicContact CG-CD2 4.14Å; L780-L804 HydrophobicContact CD1-CD2 4.13Å; L780-L804 HydrophobicContact CD2-CD1 4.39Å; L780-L840 HydrophobicContact CD2-CD2 4.48Å; L780-I843 HydrophobicContact CD1-CG2 3.85Å; L780-I843 HydrophobicContact CD2-CG2 4.29Å; L780-I843 HydrophobicContact CG-CG2 4.42Å
781	S	85.3	Confident	84.4	Confident	69 Å²	69	38.3 Å²	38.3	48%	0.483	24%	0.241	S	C	.	.	H	α-helix	trans	-79.2	-53.3	179.3	67.7	0	0	0	0	112.1	A777 C778	A777-S781 WeakPolarHBondContact O-CB 3.3Å; A777-S781 PolarHBondContact O-N 3.15Å; A777-S781 PolarHBondContact O-OG 2.97Å; C778-S781 PolarHBondContact O-N 3.16Å; C778-S781 PolarHBondContact O-OG 3.41Å
782	D	80	Confident	84.3	Confident	79 Å²	79	37.4 Å²	37.4	42%	0.422	24%	0.237	S	C	.	.	H	α-helix	trans	-100.5	-9.1	-167.7	-60.3	0.5	0	0	0	111.7	S733 C778 K784	S733-D782 VanDerWaalsContact CB-O 3.23Å; S733-D782 WeakPolarHBondContact CB-O 3.27Å; C778-D782 PolarHBondContact O-N 2.93Å; D782-K784 HydrophobicContact CB-CG 3.73Å; D782-K784 PolarHBondContact O-N 3.07Å
783	G	82.5	Confident	84.1	Confident	5 Å²	5	39.4 Å²	39.4	5%	0.052	25%	0.251	C	S	.	.	S	Bend	trans	68.8	1.6	-168.2	0	0	0	0	0	113.4	S733 W735 F779	S733-G783 WeakPolarHBondContact CA-O 3.34Å; W735-G783 PolarHBondContact NE1-O 3Å; F779-G783 WeakPolarHBondContact O-CA 3.16Å; F779-G783 PolarHBondContact O-N 3.45Å
784	K	83.9	Confident	83.9	Confident	98 Å²	98	43.7 Å²	43.7	43%	0.426	28%	0.277	S	S	.	.	S	Bend	trans	-138.1	152.9	-176.5	63	177.8	-178.5	178.9	0	110.1	C778 D782	C778-K784 CarbonylContact C-O 3.42Å; C778-K784 VanDerWaalsContact O-O 3.05Å; C778-K784 PolarHBondContact SG-O 2.8Å; D782-K784 HydrophobicContact CB-CG 3.73Å; D782-K784 PolarHBondContact O-N 3.07Å
785	V	84.9	Confident	83.8	Confident	7 Å²	7	47.9 Å²	47.9	4%	0.042	30%	0.298	C	S	.	.			trans	-101.3	108.2	174.6	-177.3	0	0	0	0	109.1	Y725 L728 T729 V775 F779	Y725-V785 HydrophobicContact CE2-CG1 4.12Å; L728-V785 HydrophobicContact CB-CG2 4.06Å; T729-V785 HydrophobicContact CG2-CB 4.19Å; T729-V785 HydrophobicContact CG2-CG1 3.93Å; V775-V785 HydrophobicContact CB-CG1 4.44Å; V775-V785 HydrophobicContact CG1-CG1 4.06Å; V775-V785 HydrophobicContact CG1-CG2 3.96Å; V775-V785 HydrophobicContact CG2-CG1 4.02Å; F779-V785 HydrophobicContact CB-CG2 3.97Å; F779-V785 HydrophobicContact CD2-CG2 4.38Å
786	S	80.3	Confident	83.7	Confident	28 Å²	28	52.9 Å²	52.9	20%	0.196	32%	0.322	C	S	.	.			trans	-95.5	132.7	177.7	-56	0	0	0	0	111	C778 S788 C789	C778-S786 PolarHBondContact SG-N 3.39Å; C778-S786 VanDerWaalsContact SG-N 3.4Å; S786-S788 PolarHBondContact O-N 3.41Å; S786-C789 PolarHBondContact O-N 3.29Å
787	A	72.2	Confident	83.5	Confident	85 Å²	85	53.9 Å²	53.9	70%	0.702	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-21.5	177.3	0	0	0	0	0	113.5
788	S	69.9	Low	83.5	Confident	115 Å²	115	60.2 Å²	60.2	80%	0.804	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	0.4	-178.3	57	0	0	0	0	114.8	S786 G790	S786-S788 PolarHBondContact O-N 3.41Å; S788-G790 PolarHBondContact O-N 3.14Å
789	C	68	Low	83.5	Confident	46 Å²	46	64.1 Å²	64.1	31%	0.311	37%	0.37	S	S	.	.			trans	-69.4	131.1	-178.9	-168.2	0	0	0	0	110.3	R774 C778 S786	R774-C789 VanDerWaalsContact CD-O 3.23Å; R774-C789 WeakPolarHBondContact CD-O 3.5Å; R774-C789 HydrophobicContact CG-CB 4.49Å; C778-C789 HydrophobicContact CB-CB 4.35Å; S786-C789 PolarHBondContact O-N 3.29Å
790	G	78.4	Confident	83.6	Confident	50 Å²	50	65 Å²	65	52%	0.515	38%	0.375	S	S	.	.			trans	-72.2	178.4	174	0	0	0	0	0	112.5	S788	S788-G790 PolarHBondContact O-N 3.14Å
791	Q	83.5	Confident	83.7	Confident	98 Å²	98	64.8 Å²	64.8	46%	0.458	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-65.4	132	169.7	-74.9	-61.5	-41.6	0	0	109.6	E770	E770-Q791 PolarHBondContact O-NE2 3.39Å; E770-Q791 PolarHBondContact O-OE1 2.87Å
792	P	85.6	Confident	83.9	Confident	22 Å²	22	65.6 Å²	65.6	14%	0.143	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-67.7	142.2	-178.8	28	-34.2	0	0	0	110.9	A777 E796 I797	A777-P792 HydrophobicContact CB-CB 3.92Å; A777-P792 HydrophobicContact CB-CG 3.85Å; P792-E796 WeakPolarHBondContact CA-OE2 3.38Å; P792-E796 HydrophobicContact CB-CB 4.5Å; P792-I797 HydrophobicContact CB-CD1 4.49Å; P792-I797 HydrophobicContact CB-CG1 4.04Å; P792-I797 HydrophobicContact CG-CD1 4.12Å; P792-I797 HydrophobicContact CG-CG1 4.06Å
793	S	87.4	Confident	84.3	Confident	41 Å²	41	64.8 Å²	64.8	29%	0.287	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-69.3	159.4	174.6	64.9	0	0	0	0	111.6	E795 E796 I797	S793-E795 PolarHBondContact O-N 2.97Å; S793-E796 PolarHBondContact N-OE2 3.43Å; S793-E796 PolarHBondContact O-N 2.66Å; S793-E796 WeakPolarHBondContact OG-CB 3.35Å; S793-E796 WeakPolarHBondContact OG-CG 3.36Å; S793-E796 PolarHBondContact OG-N 2.9Å; S793-E796 PolarHBondContact OG-OE1 3.24Å; S793-E796 VanDerWaalsContact OG-OE1 3.12Å; S793-I797 WeakPolarHBondContact O-CG1 3.33Å; S793-I797 PolarHBondContact O-N 3.41Å
794	V	86.7	Confident	84.6	Confident	112 Å²	112	64.9 Å²	64.9	68%	0.679	38%	0.375	S	S	*	.	H	α-helix	trans	-61.4	-36.9	177.8	178	0	0	0	0	110.4	R798	V794-R798 WeakPolarHBondContact O-CB 3.43Å; V794-R798 PolarHBondContact O-N 3.41Å; V794-R798 VanDerWaalsContact O-N 3.08Å
795	E	88	Confident	84.8	Confident	115 Å²	115	62.2 Å²	62.2	54%	0.537	37%	0.369	S	S	.	.	H	α-helix	trans	-63.9	-47.6	175.3	-66.9	70.7	-155.2	0	0	111.6	S793 I797 R798 D799	S793-E795 PolarHBondContact O-N 2.97Å; E795-I797 VanDerWaalsContact C-N 3.34Å; E795-I797 PolarHBondContact O-N 2.9Å; E795-R798 PolarHBondContact O-N 2.92Å; E795-D799 WeakPolarHBondContact O-CB 3.34Å; E795-D799 PolarHBondContact O-N 3.41Å
796	E	88.8	Confident	84.8	Confident	105 Å²	105	65.5 Å²	65.5	49%	0.491	39%	0.392	S	S	.	.	H	α-helix	trans	-58	-45.9	176.2	-79.2	158.1	-151.1	0	0	111.7	P792 S793 R798 D799 L800	P792-E796 WeakPolarHBondContact CA-OE2 3.38Å; P792-E796 HydrophobicContact CB-CB 4.5Å; S793-E796 PolarHBondContact N-OE2 3.43Å; S793-E796 PolarHBondContact O-N 2.66Å; S793-E796 WeakPolarHBondContact OG-CB 3.35Å; S793-E796 WeakPolarHBondContact OG-CG 3.36Å; S793-E796 PolarHBondContact OG-N 2.9Å; S793-E796 PolarHBondContact OG-OE1 3.24Å; S793-E796 VanDerWaalsContact OG-OE1 3.12Å; E796-R798 VanDerWaalsContact C-N 3.32Å; E796-R798 PolarHBondContact O-N 2.91Å; E796-D799 PolarHBondContact O-N 3.31Å; E796-L800 WeakPolarHBondContact O-CB 3.42Å; E796-L800 PolarHBondContact O-N 3.16Å
797	I	88.9	Confident	84.8	Confident	22 Å²	22	65.8 Å²	65.8	11%	0.113	39%	0.389	C	S	.	.	H	α-helix	trans	-59.1	-46.5	178.1	-69	171.2	0	0	0	110.5	P792 S793 E795 L800 K801 T851	P792-I797 HydrophobicContact CB-CD1 4.49Å; P792-I797 HydrophobicContact CB-CG1 4.04Å; P792-I797 HydrophobicContact CG-CD1 4.12Å; P792-I797 HydrophobicContact CG-CG1 4.06Å; S793-I797 WeakPolarHBondContact O-CG1 3.33Å; S793-I797 PolarHBondContact O-N 3.41Å; E795-I797 VanDerWaalsContact C-N 3.34Å; E795-I797 PolarHBondContact O-N 2.9Å; I797-L800 PolarHBondContact O-N 2.98Å; I797-K801 WeakPolarHBondContact O-CG 3.28Å; I797-K801 PolarHBondContact O-N 3.01Å; I797-T851 HydrophobicContact CD1-CG2 3.91Å; I797-T851 HydrophobicContact CG2-CG2 3.76Å
798	R	90.1	Very high	85.4	Confident	140 Å²	140	62.5 Å²	62.5	53%	0.528	36%	0.359	S	S	.	.	H	α-helix	trans	-63.7	-45.6	-179.5	-178.6	-173.4	61.9	104.6	17.1	111.3	V794 E795 E796 L800 K801 N802	V794-R798 WeakPolarHBondContact O-CB 3.43Å; V794-R798 PolarHBondContact O-N 3.41Å; V794-R798 VanDerWaalsContact O-N 3.08Å; E795-R798 PolarHBondContact O-N 2.92Å; E796-R798 VanDerWaalsContact C-N 3.32Å; E796-R798 PolarHBondContact O-N 2.91Å; R798-L800 VanDerWaalsContact C-N 3.27Å; R798-L800 PolarHBondContact O-N 3.26Å; R798-K801 PolarHBondContact O-N 3.27Å; R798-N802 VanDerWaalsContact O-CG 3.25Å; R798-N802 PolarHBondContact O-N 2.54Å; R798-N802 PolarHBondContact O-ND2 3.46Å
799	D	91.2	Very high	85.8	Confident	82 Å²	82	62.7 Å²	62.7	44%	0.439	35%	0.347	S	S	.	.	H	α-helix	trans	-64.2	-37.8	179.7	-67.2	-9.5	0	0	0	110.9	E795 E796 N802 A803	E795-D799 WeakPolarHBondContact O-CB 3.34Å; E795-D799 PolarHBondContact O-N 3.41Å; E796-D799 PolarHBondContact O-N 3.31Å; D799-N802 PolarHBondContact O-N 3.47Å; D799-A803 WeakPolarHBondContact O-CB 3.17Å; D799-A803 PolarHBondContact O-N 3.07Å
800	L	91	Very high	86.3	Confident	22 Å²	22	65.5 Å²	65.5	12%	0.115	36%	0.359	C	S	.	.	H	α-helix	trans	-72.2	-36.7	179.7	-164.8	152.7	0	0	0	112.2	A777 L780 E796 I797 R798 L804 L847	A777-L800 HydrophobicContact CB-CD1 4.34Å; A777-L800 WeakPolarHBondContact O-CD1 3.22Å; L780-L800 HydrophobicContact CB-CD1 4.19Å; L780-L800 HydrophobicContact CB-CD2 3.54Å; L780-L800 HydrophobicContact CB-CG 4.1Å; L780-L800 HydrophobicContact CD1-CD2 3.43Å; L780-L800 VanDerWaalsContact CD1-CD2 3.43Å; L780-L800 HydrophobicContact CG-CD2 4.14Å; E796-L800 WeakPolarHBondContact O-CB 3.42Å; E796-L800 PolarHBondContact O-N 3.16Å; I797-L800 PolarHBondContact O-N 2.98Å; R798-L800 VanDerWaalsContact C-N 3.27Å; R798-L800 PolarHBondContact O-N 3.26Å; L800-L804 VanDerWaalsContact O-CB 3.24Å; L800-L804 WeakPolarHBondContact O-CB 3.47Å; L800-L804 PolarHBondContact O-N 2.72Å; L800-L847 HydrophobicContact CD2-CD2 3.93Å
801	K	91.3	Very high	86.1	Confident	20 Å²	20	63.8 Å²	63.8	9%	0.087	34%	0.337	C	S	.	.	H	α-helix	trans	-61.9	-43.3	168.3	-74.5	-175	-174.6	-166.8	0	112.2	I797 R798 L804 S805 L844 L847 T848 T851 E852	I797-K801 WeakPolarHBondContact O-CG 3.28Å; I797-K801 PolarHBondContact O-N 3.01Å; R798-K801 PolarHBondContact O-N 3.27Å; K801-L804 PolarHBondContact O-N 3Å; K801-S805 WeakPolarHBondContact O-CB 3.17Å; K801-S805 PolarHBondContact O-N 3.08Å; K801-S805 PolarHBondContact O-OG 2.76Å; K801-L844 HydrophobicContact CB-CD1 4.04Å; K801-L844 HydrophobicContact CD-CD1 4.44Å; K801-L844 HydrophobicContact CG-CD1 3.81Å; K801-L847 HydrophobicContact CG-CD2 3.65Å; K801-L847 HydrophobicContact CG-CG 4.44Å; K801-T848 PolarHBondContact NZ-OG1 3.3Å; K801-T851 PolarHBondContact NZ-OG1 3.13Å; K801-E852 IonicContact NZ-OE1 3.25Å; K801-E852 PolarHBondContact NZ-OE1 3.12Å
802	N	89.8	Confident	85.8	Confident	86 Å²	86	59.6 Å²	59.6	46%	0.46	32%	0.317	S	S	.	.	H	α-helix	trans	-64.4	-47.4	178	-69.1	-24	0	0	0	110.7	R798 D799 L804 S805 S806	R798-N802 VanDerWaalsContact O-CG 3.25Å; R798-N802 PolarHBondContact O-N 2.54Å; R798-N802 PolarHBondContact O-ND2 3.46Å; D799-N802 PolarHBondContact O-N 3.47Å; N802-L804 VanDerWaalsContact C-N 3.33Å; N802-L804 PolarHBondContact O-N 2.69Å; N802-S805 PolarHBondContact O-N 2.9Å; N802-S806 PolarHBondContact O-N 2.62Å; N802-S806 PolarHBondContact O-OG 2.99Å
803	A	88	Confident	85	Confident	61 Å²	61	62.6 Å²	62.6	50%	0.504	33%	0.33	S	S	.	.	H	α-helix	trans	-59.6	-43.3	176.4	0	0	0	0	0	112.1	D799 R807	D799-A803 WeakPolarHBondContact O-CB 3.17Å; D799-A803 PolarHBondContact O-N 3.07Å; A803-R807 WeakPolarHBondContact O-CB 3.43Å; A803-R807 PolarHBondContact O-N 3.32Å
804	L	88.6	Confident	84.1	Confident	7 Å²	7	65.9 Å²	65.9	4%	0.037	34%	0.341	C	S	.	.	H	α-helix	trans	-63.7	-41.3	176.8	-176.1	58.3	0	0	0	111.7	L780 L800 K801 N802 R807 M808 L840 L844	L780-L804 HydrophobicContact CD1-CD2 4.13Å; L780-L804 HydrophobicContact CD2-CD1 4.39Å; L800-L804 VanDerWaalsContact O-CB 3.24Å; L800-L804 WeakPolarHBondContact O-CB 3.47Å; L800-L804 PolarHBondContact O-N 2.72Å; K801-L804 PolarHBondContact O-N 3Å; N802-L804 VanDerWaalsContact C-N 3.33Å; N802-L804 PolarHBondContact O-N 2.69Å; L804-R807 PolarHBondContact O-N 2.78Å; L804-M808 HydrophobicContact CD1-CG 4.46Å; L804-M808 HydrophobicContact CG-CE 4.46Å; L804-M808 VanDerWaalsContact O-CG 3.31Å; L804-M808 WeakPolarHBondContact O-CG 3.45Å; L804-M808 PolarHBondContact O-N 3.37Å; L804-L840 HydrophobicContact CD1-CB 4.13Å; L804-L840 HydrophobicContact CD1-CD2 3.75Å; L804-L840 HydrophobicContact CD1-CG 4.36Å; L804-L844 HydrophobicContact CD2-CB 3.67Å; L804-L844 HydrophobicContact CD2-CD1 4Å; L804-L844 HydrophobicContact CD2-CG 4.38Å; L804-L844 HydrophobicContact CG-CB 4.46Å
805	S	87.4	Confident	83.3	Confident	42 Å²	42	61.9 Å²	61.9	29%	0.294	32%	0.315	S	S	.	.	H	α-helix	trans	-63	-49.4	177.8	-58.3	0	0	0	0	111.7	K801 N802 R807 M808 E809	K801-S805 WeakPolarHBondContact O-CB 3.17Å; K801-S805 PolarHBondContact O-N 3.08Å; K801-S805 PolarHBondContact O-OG 2.76Å; N802-S805 PolarHBondContact O-N 2.9Å; S805-R807 VanDerWaalsContact C-N 3.27Å; S805-R807 PolarHBondContact O-N 3.48Å; S805-M808 PolarHBondContact O-N 3.44Å; S805-E809 PolarHBondContact O-N 3.29Å
806	S	85.1	Confident	82.3	Confident	76 Å²	76	57 Å²	57	53%	0.531	29%	0.292	S	S	.	.	H	α-helix	trans	-59.6	-38	175.6	-55.1	0	0	0	0	112.2	N802 L810	N802-S806 PolarHBondContact O-N 2.62Å; N802-S806 PolarHBondContact O-OG 2.99Å; S806-L810 PolarHBondContact O-N 3.36Å; S806-L810 VanDerWaalsContact O-N 3.16Å
807	R	81.8	Confident	81	Confident	35 Å²	35	56.3 Å²	56.3	13%	0.132	30%	0.295	C	S	.	.	H	α-helix	trans	-65.4	-45.9	176.3	-178.4	-177.7	-178.3	-176.9	10.3	112	Y736 A803 L804 S805 E809 L810 Q811	Y736-R807 VanDerWaalsContact CD2-NH1 3.33Å; A803-R807 WeakPolarHBondContact O-CB 3.43Å; A803-R807 PolarHBondContact O-N 3.32Å; L804-R807 PolarHBondContact O-N 2.78Å; S805-R807 VanDerWaalsContact C-N 3.27Å; S805-R807 PolarHBondContact O-N 3.48Å; R807-E809 VanDerWaalsContact C-N 3.28Å; R807-E809 PolarHBondContact O-N 2.95Å; R807-L810 PolarHBondContact O-N 3.37Å; R807-Q811 HydrophobicContact CG-CG 4.4Å; R807-Q811 WeakPolarHBondContact O-CB 3.49Å; R807-Q811 WeakPolarHBondContact O-CG 3.5Å; R807-Q811 PolarHBondContact O-N 3.19Å
808	M	83.8	Confident	79.3	Confident	15 Å²	15	57.9 Å²	57.9	7%	0.074	31%	0.311	C	S	.	.	H	α-helix	trans	-61.9	-38.4	179.2	-75	-172.2	-58	0	0	111.6	L804 S805 Q811 F812 Y837 L840 L841 L844	L804-M808 HydrophobicContact CD1-CG 4.46Å; L804-M808 HydrophobicContact CG-CE 4.46Å; L804-M808 VanDerWaalsContact O-CG 3.31Å; L804-M808 WeakPolarHBondContact O-CG 3.45Å; L804-M808 PolarHBondContact O-N 3.37Å; S805-M808 PolarHBondContact O-N 3.44Å; M808-Q811 PolarHBondContact O-N 3.24Å; M808-F812 VanDerWaalsContact O-CB 3.3Å; M808-F812 WeakPolarHBondContact O-CB 3.23Å; M808-F812 PolarHBondContact O-N 3.45Å; M808-Y837 HydrophobicContact CB-CD2 4.01Å; M808-Y837 HydrophobicContact CB-CE2 3.95Å; M808-Y837 HydrophobicContact CG-CD2 4.44Å; M808-Y837 WeakPolarHBondContact O-CD2 3.39Å; M808-L840 HydrophobicContact CG-CB 3.95Å; M808-L840 HydrophobicContact SD-CB 4.09Å; M808-L841 WeakPolarHBondContact SD-CA 3.47Å; M808-L841 HydrophobicContact SD-CB 3.79Å; M808-L841 HydrophobicContact SD-CG 4.46Å; M808-L841 PolarHBondContact SD-N 3.49Å; M808-L841 VanDerWaalsContact SD-N 3.39Å; M808-L844 HydrophobicContact CE-CB 4.38Å; M808-L844 HydrophobicContact CE-CD2 3.44Å; M808-L844 VanDerWaalsContact CE-CD2 3.44Å; M808-L844 HydrophobicContact CE-CG 4.48Å
809	E	79.6	Confident	77.4	Confident	119 Å²	119	57.1 Å²	57.1	56%	0.556	32%	0.318	S	S	*	.	H	α-helix	trans	-61	-50.8	174.2	-72.9	178.1	174.6	0	0	111.3	S805 R807 Q811 F812 E813	S805-E809 PolarHBondContact O-N 3.29Å; R807-E809 VanDerWaalsContact C-N 3.28Å; R807-E809 PolarHBondContact O-N 2.95Å; E809-Q811 VanDerWaalsContact C-N 3.34Å; E809-Q811 PolarHBondContact O-N 3.37Å; E809-F812 PolarHBondContact O-N 3.33Å; E809-E813 WeakPolarHBondContact O-CG 3.46Å; E809-E813 PolarHBondContact O-N 3.45Å
810	L	77	Confident	75.6	Confident	105 Å²	105	55.3 Å²	55.3	55%	0.55	31%	0.308	S	S	.	.	H	α-helix	trans	-57.6	-45.3	177.3	-176.2	71.2	0	0	0	112.3	S806 R807 E813 Q814	S806-L810 PolarHBondContact O-N 3.36Å; S806-L810 VanDerWaalsContact O-N 3.16Å; R807-L810 PolarHBondContact O-N 3.37Å; L810-E813 PolarHBondContact O-N 2.85Å; L810-Q814 WeakPolarHBondContact O-CB 3.48Å; L810-Q814 VanDerWaalsContact O-CG 3.28Å; L810-Q814 WeakPolarHBondContact O-CG 3.23Å; L810-Q814 PolarHBondContact O-N 2.93Å
811	Q	73.9	Confident	73.9	Confident	14 Å²	14	61.2 Å²	61.2	7%	0.065	34%	0.335	C	S	.	.	H	α-helix	trans	-68.4	-36.4	-179.1	-75.9	-173.8	-23.5	0	0	112.8	Y740 R807 M808 E809 Q814 L815	Y740-Q811 HydrophobicContact CD2-CB 4.49Å; Y740-Q811 HydrophobicContact CD2-CG 4.12Å; Y740-Q811 HydrophobicContact CE2-CB 3.81Å; Y740-Q811 VanDerWaalsContact CE2-CD 3.45Å; Y740-Q811 HydrophobicContact CE2-CG 3.83Å; R807-Q811 HydrophobicContact CG-CG 4.4Å; R807-Q811 WeakPolarHBondContact O-CB 3.49Å; R807-Q811 WeakPolarHBondContact O-CG 3.5Å; R807-Q811 PolarHBondContact O-N 3.19Å; M808-Q811 PolarHBondContact O-N 3.24Å; E809-Q811 VanDerWaalsContact C-N 3.34Å; E809-Q811 PolarHBondContact O-N 3.37Å; Q811-Q814 PolarHBondContact O-N 2.92Å; Q811-L815 WeakPolarHBondContact O-CB 3.42Å; Q811-L815 PolarHBondContact O-N 3.1Å
812	F	77.1	Confident	72	Confident	10 Å²	10	68.4 Å²	68.4	4%	0.044	37%	0.374	C	S	.	.	H	α-helix	trans	-62.6	-48.3	174.3	177.9	-83.9	0	0	0	111	M808 E809 Q814 L815 Y816 Y837 K867 V871	M808-F812 VanDerWaalsContact O-CB 3.3Å; M808-F812 WeakPolarHBondContact O-CB 3.23Å; M808-F812 PolarHBondContact O-N 3.45Å; E809-F812 PolarHBondContact O-N 3.33Å; F812-Q814 VanDerWaalsContact C-N 3.34Å; F812-Q814 PolarHBondContact O-N 2.93Å; F812-L815 PolarHBondContact O-N 2.8Å; F812-Y816 HydrophobicContact CD1-CD2 4.34Å; F812-Y816 AromaticContact CD2-CD2 3.29Å; F812-Y816 HydrophobicContact CD2-CD2 3.29Å; F812-Y816 AromaticContact CD2-CE2 3.48Å; F812-Y816 HydrophobicContact CD2-CE2 3.48Å; F812-Y816 VanDerWaalsContact CD2-CE2 3.48Å; F812-Y816 HydrophobicContact CD2-CG 4.46Å; F812-Y816 HydrophobicContact CE1-CD2 4.34Å; F812-Y816 AromaticContact CE2-CD2 3.26Å; F812-Y816 HydrophobicContact CE2-CD2 3.26Å; F812-Y816 AromaticContact CE2-CE2 3.53Å; F812-Y816 HydrophobicContact CE2-CE2 3.53Å; F812-Y816 HydrophobicContact CE2-CG 4.12Å; F812-Y816 AromaticContact CG-CD2 3.86Å; F812-Y816 HydrophobicContact CG-CD2 3.86Å; F812-Y816 HydrophobicContact CG-CE2 4.4Å; F812-Y816 AromaticContact CZ-CD2 3.85Å; F812-Y816 HydrophobicContact CZ-CD2 3.85Å; F812-Y816 HydrophobicContact CZ-CG 4.35Å; F812-Y816 PolarHBondContact O-N 2.77Å; F812-Y837 HydrophobicContact CB-CD2 3.92Å; F812-Y837 HydrophobicContact CB-CE2 3.89Å; F812-Y837 HydrophobicContact CD2-CD1 4.24Å; F812-Y837 HydrophobicContact CD2-CD2 4.42Å; F812-Y837 AromaticContact CD2-CE1 3.97Å; F812-Y837 HydrophobicContact CD2-CE1 3.97Å; F812-Y837 HydrophobicContact CD2-CE2 4.14Å; F812-Y837 HydrophobicContact CD2-CG 4.47Å; F812-Y837 AromaticContact CD2-CZ 3.92Å; F812-Y837 HydrophobicContact CG-CE2 4.41Å; F812-K867 HydrophobicContact CD1-CD 4.19Å; F812-K867 HydrophobicContact CD1-CG 4.11Å; F812-K867 HydrophobicContact CD2-CD 4.36Å; F812-K867 HydrophobicContact CD2-CG 3.7Å; F812-K867 HydrophobicContact CE1-CD 4.12Å; F812-K867 HydrophobicContact CE1-CG 3.72Å; F812-K867 HydrophobicContact CE2-CB 4.23Å; F812-K867 HydrophobicContact CE2-CD 4.33Å; F812-K867 HydrophobicContact CE2-CG 3.29Å; F812-K867 WeakPolarHBondContact CE2-O 3.49Å; F812-K867 HydrophobicContact CG-CD 4.29Å; F812-K867 HydrophobicContact CG-CG 4.09Å; F812-K867 HydrophobicContact CZ-CB 4.39Å; F812-K867 HydrophobicContact CZ-CD 4.17Å; F812-K867 HydrophobicContact CZ-CG 3.27Å; F812-K867 VanDerWaalsContact CZ-O 3.24Å; F812-K867 WeakPolarHBondContact CZ-O 3.45Å; F812-V871 HydrophobicContact CE1-CG2 4.22Å; F812-V871 HydrophobicContact CE2-CG2 3.85Å; F812-V871 HydrophobicContact CZ-CG2 3.32Å
813	E	70.3	Confident	70.7	Confident	86 Å²	86	66.7 Å²	66.7	40%	0.402	37%	0.369	S	S	.	.	H	α-helix	trans	-59.2	-48.2	177.6	-64.2	-53.3	138.8	0	0	110.1	E809 L810 L815 T817 K867	E809-E813 WeakPolarHBondContact O-CG 3.46Å; E809-E813 PolarHBondContact O-N 3.45Å; L810-E813 PolarHBondContact O-N 2.85Å; E813-L815 VanDerWaalsContact C-N 3.26Å; E813-L815 PolarHBondContact O-N 3.32Å; E813-T817 VanDerWaalsContact O-CB 3.32Å; E813-T817 WeakPolarHBondContact O-CB 3.16Å; E813-T817 PolarHBondContact O-N 3.49Å; E813-T817 VanDerWaalsContact O-N 3.08Å; E813-T817 PolarHBondContact O-OG1 3.1Å; E813-T817 VanDerWaalsContact OE2-CG2 3.3Å; E813-T817 WeakPolarHBondContact OE2-CG2 3.09Å; E813-K867 IonicContact OE1-NZ 3.44Å; E813-K867 PolarHBondContact OE1-NZ 2.91Å
814	Q	68.5	Low	69.5	Low	110 Å²	110	65.2 Å²	65.2	51%	0.514	36%	0.355	S	S	.	.	H	α-helix	trans	-57.2	-36.5	177.9	-75.8	175.4	-8.6	0	0	113.6	L810 Q811 F812 A818	L810-Q814 WeakPolarHBondContact O-CB 3.48Å; L810-Q814 VanDerWaalsContact O-CG 3.28Å; L810-Q814 WeakPolarHBondContact O-CG 3.23Å; L810-Q814 PolarHBondContact O-N 2.93Å; Q811-Q814 PolarHBondContact O-N 2.92Å; F812-Q814 VanDerWaalsContact C-N 3.34Å; F812-Q814 PolarHBondContact O-N 2.93Å; Q814-A818 WeakPolarHBondContact O-CB 3.46Å
815	L	68.9	Low	69.2	Low	27 Å²	27	66 Å²	66	14%	0.141	36%	0.359	C	S	.	.	H	α-helix	trans	-84.9	-43	-173.2	-169.1	124.3	0	0	0	113.8	Y740 Q811 F812 E813 W826	Y740-L815 HydrophobicContact CD1-CD1 3.66Å; Y740-L815 HydrophobicContact CE1-CD1 2.97Å; Y740-L815 HydrophobicContact CE1-CG 4.37Å; Q811-L815 WeakPolarHBondContact O-CB 3.42Å; Q811-L815 PolarHBondContact O-N 3.1Å; F812-L815 PolarHBondContact O-N 2.8Å; E813-L815 VanDerWaalsContact C-N 3.26Å; E813-L815 PolarHBondContact O-N 3.32Å; L815-W826 HydrophobicContact CD1-CH2 3.61Å; L815-W826 HydrophobicContact CD1-CZ2 3.55Å; L815-W826 HydrophobicContact CD2-CZ2 3.9Å; L815-W826 HydrophobicContact CG-CZ2 4.13Å
816	Y	67.5	Low	69	Low	13 Å²	13	66.1 Å²	66.1	5%	0.051	35%	0.353	C	S	.	.	H	α-helix	trans	-101	-12.7	-168.8	-66	-69.3	0	0	0	113.2	F812 V871 L889	F812-Y816 HydrophobicContact CD1-CD2 4.34Å; F812-Y816 AromaticContact CD2-CD2 3.29Å; F812-Y816 HydrophobicContact CD2-CD2 3.29Å; F812-Y816 AromaticContact CD2-CE2 3.48Å; F812-Y816 HydrophobicContact CD2-CE2 3.48Å; F812-Y816 VanDerWaalsContact CD2-CE2 3.48Å; F812-Y816 HydrophobicContact CD2-CG 4.46Å; F812-Y816 HydrophobicContact CE1-CD2 4.34Å; F812-Y816 AromaticContact CE2-CD2 3.26Å; F812-Y816 HydrophobicContact CE2-CD2 3.26Å; F812-Y816 AromaticContact CE2-CE2 3.53Å; F812-Y816 HydrophobicContact CE2-CE2 3.53Å; F812-Y816 HydrophobicContact CE2-CG 4.12Å; F812-Y816 AromaticContact CG-CD2 3.86Å; F812-Y816 HydrophobicContact CG-CD2 3.86Å; F812-Y816 HydrophobicContact CG-CE2 4.4Å; F812-Y816 AromaticContact CZ-CD2 3.85Å; F812-Y816 HydrophobicContact CZ-CD2 3.85Å; F812-Y816 HydrophobicContact CZ-CG 4.35Å; F812-Y816 PolarHBondContact O-N 2.77Å; Y816-V871 HydrophobicContact CD1-CB 4.07Å; Y816-V871 HydrophobicContact CD1-CG1 3.56Å; Y816-V871 HydrophobicContact CD1-CG2 3.89Å; Y816-V871 HydrophobicContact CD2-CG2 4.13Å; Y816-V871 HydrophobicContact CE1-CG1 4.38Å; Y816-V871 HydrophobicContact CG-CB 4.28Å; Y816-V871 HydrophobicContact CG-CG1 3.98Å; Y816-V871 HydrophobicContact CG-CG2 3.61Å; Y816-L889 HydrophobicContact CE1-CD2 3.98Å
817	T	61.2	Low	69.1	Low	90 Å²	90	63.4 Å²	63.4	55%	0.552	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	-29.8	176.3	72.7	0	0	0	0	113.9	E813 D819	E813-T817 VanDerWaalsContact O-CB 3.32Å; E813-T817 WeakPolarHBondContact O-CB 3.16Å; E813-T817 PolarHBondContact O-N 3.49Å; E813-T817 VanDerWaalsContact O-N 3.08Å; E813-T817 PolarHBondContact O-OG1 3.1Å; E813-T817 VanDerWaalsContact OE2-CG2 3.3Å; E813-T817 WeakPolarHBondContact OE2-CG2 3.09Å; T817-D819 PolarHBondContact O-N 3.31Å; T817-D819 VanDerWaalsContact O-N 3.12Å
818	A	53.8	Low	69.5	Low	55 Å²	55	61.8 Å²	61.8	46%	0.455	33%	0.325	S	S	.	.	S	Bend	trans	-90.4	71.4	-175.6	0	0	0	0	0	110.7	Q814	Q814-A818 WeakPolarHBondContact O-CB 3.46Å
819	D	50.7	Low	69.8	Low	125 Å²	125	63.6 Å²	63.6	67%	0.668	33%	0.331	S	S	*	.			trans	50.1	116.2	175.5	-62.7	-34	0	0	0	113.9	T817 Q821	T817-D819 PolarHBondContact O-N 3.31Å; T817-D819 VanDerWaalsContact O-N 3.12Å; D819-Q821 HydrophobicContact CB-CG 3.9Å; D819-Q821 WeakPolarHBondContact O-CG 3.28Å; D819-Q821 PolarHBondContact O-N 3.03Å
820	L	53.2	Low	70.2	Confident	44 Å²	44	58 Å²	58	23%	0.23	31%	0.305	C	S	.	.			trans	-66	84.4	164.8	-73.4	109.4	0	0	0	108.8	D822 Y827 L875	L820-D822 VanDerWaalsContact C-N 3.35Å; L820-D822 PolarHBondContact O-N 2.74Å; L820-Y827 HydrophobicContact CD2-CE1 3.89Å; L820-Y827 WeakPolarHBondContact CD2-OH 3.44Å; L820-L875 HydrophobicContact CD1-CD1 3.34Å; L820-L875 HydrophobicContact CD1-CD2 3.01Å; L820-L875 HydrophobicContact CD1-CG 3.72Å; L820-L875 HydrophobicContact CD2-CD1 3.9Å; L820-L875 HydrophobicContact CG-CD1 4.28Å; L820-L875 HydrophobicContact CG-CD2 4.48Å
821	Q	53.7	Low	70.9	Confident	145 Å²	145	53 Å²	53	68%	0.678	28%	0.279	S	S	*	.			trans	-69.9	91.8	-172.8	-79	175.4	5.7	0	0	108.2	D819 S823	D819-Q821 HydrophobicContact CB-CG 3.9Å; D819-Q821 WeakPolarHBondContact O-CG 3.28Å; D819-Q821 PolarHBondContact O-N 3.03Å; Q821-S823 PolarHBondContact O-N 3.44Å
822	D	52.7	Low	71.7	Confident	172 Å²	172	53.5 Å²	53.5	92%	0.92	28%	0.28	S	S	*	.	S	Bend	trans	46.6	0.5	135.1	-93.3	-13.3	0	0	0	121.2	L820	L820-D822 VanDerWaalsContact C-N 3.35Å; L820-D822 PolarHBondContact O-N 2.74Å
823	S	61.5	Low	72.4	Confident	50 Å²	50	53.3 Å²	53.3	35%	0.35	28%	0.28	S	S	.	.			trans	-109.3	105.9	178.8	86.4	0	0	0	0	109.5	Q821 D825 W826	Q821-S823 PolarHBondContact O-N 3.44Å; S823-D825 WeakPolarHBondContact CB-OD1 3.43Å; S823-D825 PolarHBondContact O-N 3.27Å; S823-D825 PolarHBondContact OG-OD1 2.85Å; S823-W826 WeakPolarHBondContact O-CB 3.46Å; S823-W826 PolarHBondContact O-N 3.42Å
824	S	64	Low	73.3	Confident	30 Å²	30	49.3 Å²	49.3	21%	0.21	26%	0.261	C	S	.	.	H	α-helix	trans	-58.6	-14.1	178.7	31	0	0	0	0	113.6	V575 F828	V575-S824 WeakPolarHBondContact CB-OG 3.49Å; V575-S824 WeakPolarHBondContact CG1-OG 3.31Å; S824-F828 PolarHBondContact O-N 3.46Å
825	D	82.1	Confident	74.3	Confident	23 Å²	23	44 Å²	44	12%	0.123	24%	0.237	C	C	.	.	H	α-helix	trans	-74.5	-25.3	174.3	74.1	-31.7	0	0	0	112.8	V575 P652 W653 S823 F828 R829	V575-D825 HydrophobicContact CG1-CB 4.17Å; P652-D825 HydrophobicContact CG-CB 4.47Å; W653-D825 HydrophobicContact CZ2-CB 3.9Å; S823-D825 WeakPolarHBondContact CB-OD1 3.43Å; S823-D825 PolarHBondContact O-N 3.27Å; S823-D825 PolarHBondContact OG-OD1 2.85Å; D825-F828 WeakPolarHBondContact O-CB 3.36Å; D825-F828 PolarHBondContact O-N 3.28Å; D825-R829 VanDerWaalsContact O-CG 3.29Å; D825-R829 WeakPolarHBondContact O-CG 3.37Å; D825-R829 PolarHBondContact O-N 3.05Å; D825-R829 IonicContact OD2-CZ 2.7Å; D825-R829 IonicContact OD2-NE 3.49Å; D825-R829 PolarHBondContact OD2-NE 2.74Å; D825-R829 IonicContact OD2-NH2 3.2Å; D825-R829 PolarHBondContact OD2-NH2 3.01Å
826	W	83.1	Confident	75.2	Confident	44 Å²	44	42.8 Å²	42.8	17%	0.167	23%	0.23	C	C	.	.	H	α-helix	trans	-59.3	-48.9	173.3	167.6	-111.4	0	0	0	110.8	Y740 L815 S823 F828 R829 L830	Y740-W826 HydrophobicContact CE1-CH2 4.27Å; L815-W826 HydrophobicContact CD1-CH2 3.61Å; L815-W826 HydrophobicContact CD1-CZ2 3.55Å; L815-W826 HydrophobicContact CD2-CZ2 3.9Å; L815-W826 HydrophobicContact CG-CZ2 4.13Å; S823-W826 WeakPolarHBondContact O-CB 3.46Å; S823-W826 PolarHBondContact O-N 3.42Å; W826-F828 VanDerWaalsContact C-N 3.28Å; W826-F828 PolarHBondContact O-N 3.04Å; W826-R829 WeakPolarHBondContact O-CB 3.35Å; W826-R829 PolarHBondContact O-N 2.91Å; W826-R829 VanDerWaalsContact O-N 3.14Å; W826-L830 HydrophobicContact CH2-CD1 4.46Å; W826-L830 HydrophobicContact CZ2-CD1 3.87Å; W826-L830 WeakPolarHBondContact O-CB 3.18Å; W826-L830 PolarHBondContact O-N 3.25Å
827	Y	86.5	Confident	76.3	Confident	20 Å²	20	42.9 Å²	42.9	8%	0.078	23%	0.231	C	C	.	.	H	α-helix	trans	-65.9	-33.2	179.4	-64.7	-85.1	0	0	0	112.3	L820 L830 G831 H885 A888 L889	L820-Y827 HydrophobicContact CD2-CE1 3.89Å; L820-Y827 WeakPolarHBondContact CD2-OH 3.44Å; Y827-L830 PolarHBondContact O-N 2.95Å; Y827-G831 PolarHBondContact O-N 3.48Å; Y827-H885 HydrophobicContact CD1-CB 3.68Å; Y827-H885 AromaticContact CD1-ND1 3.71Å; Y827-H885 HydrophobicContact CD2-CB 4.37Å; Y827-H885 AromaticContact CD2-CE1 3.5Å; Y827-H885 VanDerWaalsContact CD2-CE1 3.5Å; Y827-H885 WeakPolarHBondContact CD2-CE1 3.27Å; Y827-H885 AromaticContact CD2-CG 3.84Å; Y827-H885 AromaticContact CD2-ND1 2.89Å; Y827-H885 WeakPolarHBondContact CD2-ND1 3.33Å; Y827-H885 HydrophobicContact CE1-CB 3.56Å; Y827-H885 AromaticContact CE1-ND1 3.99Å; Y827-H885 HydrophobicContact CE2-CB 4.23Å; Y827-H885 AromaticContact CE2-CE1 3.73Å; Y827-H885 AromaticContact CE2-CG 3.77Å; Y827-H885 AromaticContact CE2-ND1 3.2Å; Y827-H885 WeakPolarHBondContact CE2-ND1 3.34Å; Y827-H885 HydrophobicContact CG-CB 4.05Å; Y827-H885 AromaticContact CG-CG 3.92Å; Y827-H885 AromaticContact CG-ND1 3.11Å; Y827-H885 AromaticContact CZ-CG 3.83Å; Y827-H885 AromaticContact CZ-ND1 3.72Å; Y827-A888 HydrophobicContact CD1-CB 4.26Å; Y827-A888 WeakPolarHBondContact O-CB 3.42Å; Y827-L889 HydrophobicContact CE1-CD1 4.37Å
828	F	90.7	Very high	77.7	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62.3	-47.6	171.2	-172.8	-95	0	0	0	111.5	W579 V582 F596 P652 W653 Y656 S824 D825 W826 L830 G831 W832	W579-F828 HydrophobicContact CD2-CD2 4.24Å; W579-F828 HydrophobicContact CE3-CB 4.1Å; W579-F828 HydrophobicContact CE3-CD2 4.02Å; W579-F828 HydrophobicContact CE3-CG 4.5Å; W579-F828 HydrophobicContact CH2-CB 4.1Å; W579-F828 AromaticContact CH2-CD2 3.93Å; W579-F828 HydrophobicContact CH2-CD2 3.93Å; W579-F828 HydrophobicContact CZ2-CD2 4.13Å; W579-F828 HydrophobicContact CZ3-CB 3.56Å; W579-F828 AromaticContact CZ3-CD2 3.88Å; W579-F828 HydrophobicContact CZ3-CD2 3.88Å; W579-F828 HydrophobicContact CZ3-CG 4.22Å; V582-F828 HydrophobicContact CG1-CE2 4.29Å; V582-F828 HydrophobicContact CG1-CZ 4.35Å; V582-F828 HydrophobicContact CG2-CZ 4.4Å; F596-F828 HydrophobicContact CB-CE2 4.44Å; F596-F828 AromaticContact CD2-CD2 3.84Å; F596-F828 HydrophobicContact CD2-CD2 3.84Å; F596-F828 AromaticContact CD2-CE2 3.55Å; F596-F828 HydrophobicContact CD2-CE2 3.55Å; F596-F828 HydrophobicContact CD2-CZ 4.5Å; F596-F828 HydrophobicContact CE2-CD2 4.24Å; F596-F828 AromaticContact CE2-CE2 3.85Å; F596-F828 HydrophobicContact CE2-CE2 3.85Å; F596-F828 AromaticContact CG-CE2 3.92Å; F596-F828 HydrophobicContact CG-CE2 3.92Å; F596-F828 HydrophobicContact CG-CZ 4.47Å; F596-F828 HydrophobicContact CZ-CE2 4.43Å; P652-F828 HydrophobicContact CB-CD1 4.03Å; P652-F828 HydrophobicContact CB-CE1 4.36Å; P652-F828 HydrophobicContact CG-CD1 3.8Å; P652-F828 HydrophobicContact CG-CE1 4.43Å; W653-F828 HydrophobicContact CE3-CD1 4.08Å; W653-F828 HydrophobicContact CE3-CD2 4.46Å; W653-F828 AromaticContact CE3-CE1 3.94Å; W653-F828 HydrophobicContact CE3-CE1 3.94Å; W653-F828 HydrophobicContact CE3-CE2 4.34Å; W653-F828 HydrophobicContact CE3-CG 4.34Å; W653-F828 HydrophobicContact CE3-CZ 4.08Å; W653-F828 HydrophobicContact CH2-CB 3.73Å; W653-F828 AromaticContact CH2-CD1 3.98Å; W653-F828 HydrophobicContact CH2-CD1 3.98Å; W653-F828 AromaticContact CH2-CD2 3.66Å; W653-F828 HydrophobicContact CH2-CD2 3.66Å; W653-F828 HydrophobicContact CH2-CE2 4.27Å; W653-F828 AromaticContact CH2-CG 3.49Å; W653-F828 HydrophobicContact CH2-CG 3.49Å; W653-F828 VanDerWaalsContact CH2-CG 3.49Å; W653-F828 HydrophobicContact CZ2-CB 4.18Å; W653-F828 HydrophobicContact CZ2-CD1 4.47Å; W653-F828 HydrophobicContact CZ2-CG 4.23Å; W653-F828 HydrophobicContact CZ3-CB 4.31Å; W653-F828 AromaticContact CZ3-CD1 3.77Å; W653-F828 HydrophobicContact CZ3-CD1 3.77Å; W653-F828 AromaticContact CZ3-CD2 3.47Å; W653-F828 HydrophobicContact CZ3-CD2 3.47Å; W653-F828 VanDerWaalsContact CZ3-CD2 3.47Å; W653-F828 AromaticContact CZ3-CE1 3.88Å; W653-F828 HydrophobicContact CZ3-CE1 3.88Å; W653-F828 AromaticContact CZ3-CE2 3.6Å; W653-F828 HydrophobicContact CZ3-CE2 3.6Å; W653-F828 AromaticContact CZ3-CG 3.56Å; W653-F828 HydrophobicContact CZ3-CG 3.56Å; W653-F828 AromaticContact CZ3-CZ 3.8Å; W653-F828 HydrophobicContact CZ3-CZ 3.8Å; Y656-F828 HydrophobicContact CD1-CE1 4.38Å; Y656-F828 AromaticContact CD1-CZ 3.78Å; Y656-F828 HydrophobicContact CD1-CZ 3.78Å; Y656-F828 AromaticContact CD2-CE1 3.96Å; Y656-F828 HydrophobicContact CD2-CE1 3.96Å; Y656-F828 AromaticContact CD2-CZ 3.76Å; Y656-F828 HydrophobicContact CD2-CZ 3.76Å; Y656-F828 HydrophobicContact CE1-CZ 4.09Å; Y656-F828 HydrophobicContact CE2-CZ 4.05Å; Y656-F828 AromaticContact CG-CE1 3.82Å; Y656-F828 HydrophobicContact CG-CE1 3.82Å; Y656-F828 AromaticContact CG-CZ 3.62Å; Y656-F828 HydrophobicContact CG-CZ 3.62Å; S824-F828 PolarHBondContact O-N 3.46Å; D825-F828 WeakPolarHBondContact O-CB 3.36Å; D825-F828 PolarHBondContact O-N 3.28Å; W826-F828 VanDerWaalsContact C-N 3.28Å; W826-F828 PolarHBondContact O-N 3.04Å; F828-L830 VanDerWaalsContact C-N 3.34Å; F828-L830 PolarHBondContact O-N 3.36Å; F828-G831 PolarHBondContact O-N 2.99Å; F828-W832 HydrophobicContact CE1-CE3 4.34Å; F828-W832 WeakPolarHBondContact O-CB 3.26Å; F828-W832 PolarHBondContact O-N 3.46Å
829	R	89.7	Confident	79.5	Confident	53 Å²	53	36.2 Å²	36.2	20%	0.2	18%	0.184	C	C	.	.	H	α-helix	trans	-58.3	-46.3	176.3	-67	163.5	-163.9	-157	2.6	111.6	F651 P652 D825 W826 W832 L833	F651-R829 HydrophobicContact CE1-CG 4.06Å; F651-R829 VanDerWaalsContact CE1-CZ 3.43Å; F651-R829 VanDerWaalsContact CE1-NH1 3.3Å; F651-R829 HydrophobicContact CZ-CG 3.88Å; P652-R829 HydrophobicContact CB-CG 3.65Å; P652-R829 HydrophobicContact CG-CG 3.77Å; D825-R829 VanDerWaalsContact O-CG 3.29Å; D825-R829 WeakPolarHBondContact O-CG 3.37Å; D825-R829 PolarHBondContact O-N 3.05Å; D825-R829 IonicContact OD2-CZ 2.7Å; D825-R829 IonicContact OD2-NE 3.49Å; D825-R829 PolarHBondContact OD2-NE 2.74Å; D825-R829 IonicContact OD2-NH2 3.2Å; D825-R829 PolarHBondContact OD2-NH2 3.01Å; W826-R829 WeakPolarHBondContact O-CB 3.35Å; W826-R829 PolarHBondContact O-N 2.91Å; W826-R829 VanDerWaalsContact O-N 3.14Å; R829-W832 PolarHBondContact O-N 3.35Å; R829-L833 PolarHBondContact O-N 2.92Å
830	L	88.7	Confident	81.5	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-58.2	-54.5	179.7	-173.5	72.9	0	0	0	110.9	W826 Y827 F828 W832 G834 A888 L889 E892 R895	W826-L830 HydrophobicContact CH2-CD1 4.46Å; W826-L830 HydrophobicContact CZ2-CD1 3.87Å; W826-L830 WeakPolarHBondContact O-CB 3.18Å; W826-L830 PolarHBondContact O-N 3.25Å; Y827-L830 PolarHBondContact O-N 2.95Å; F828-L830 VanDerWaalsContact C-N 3.34Å; F828-L830 PolarHBondContact O-N 3.36Å; L830-W832 VanDerWaalsContact C-N 3.32Å; L830-W832 PolarHBondContact O-N 2.84Å; L830-G834 WeakPolarHBondContact O-CA 3.33Å; L830-G834 PolarHBondContact O-N 3.4Å; L830-A888 HydrophobicContact CD2-CB 4.42Å; L830-L889 HydrophobicContact CD2-CD2 3.71Å; L830-L889 HydrophobicContact CD2-CG 4.16Å; L830-E892 HydrophobicContact CD1-CG 3.61Å; L830-E892 WeakPolarHBondContact CD1-OE1 3.35Å; L830-E892 HydrophobicContact CD2-CG 4Å; L830-E892 HydrophobicContact CG-CG 3.67Å; L830-E892 VanDerWaalsContact O-OE1 3.08Å; L830-R895 PolarHBondContact O-NH2 3.49Å
831	G	90.5	Very high	83.5	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-64.7	-34.4	-178.8	0	0	0	0	0	113.4	F596 Y827 F828 R891 R895	F596-G831 CarbonylContact C-O 3.58Å; F596-G831 WeakPolarHBondContact CA-O 3.23Å; F596-G831 CarbonylContact O-C 3.6Å; F596-G831 WeakPolarHBondContact O-CA 3.45Å; Y827-G831 PolarHBondContact O-N 3.48Å; F828-G831 PolarHBondContact O-N 2.99Å; G831-R891 VanDerWaalsContact O-CG 3.27Å; G831-R891 WeakPolarHBondContact O-CG 2.96Å; G831-R895 PolarHBondContact O-NH2 2.92Å
832	W	91.8	Very high	85.5	Confident	25 Å²	25	21.9 Å²	21.9	10%	0.095	11%	0.112	C	C	.	.	H	α-helix	trans	-74	-65.2	174.5	174.7	30.4	0	0	0	113	F596 P652 L655 Y656 S659 L702 F828 R829 L830 R895	F596-W832 HydrophobicContact CB-CB 3.9Å; P652-W832 HydrophobicContact CB-CE3 4.36Å; P652-W832 HydrophobicContact CB-CZ3 4.2Å; P652-W832 WeakPolarHBondContact O-CZ3 3.36Å; L655-W832 HydrophobicContact CB-CH2 4.24Å; L655-W832 HydrophobicContact CG-CH2 4.11Å; Y656-W832 VanDerWaalsContact CA-CH2 3.48Å; Y656-W832 HydrophobicContact CD2-CB 4.48Å; Y656-W832 AromaticContact CD2-CD1 3.96Å; Y656-W832 AromaticContact CD2-CD2 3.5Å; Y656-W832 HydrophobicContact CD2-CD2 3.5Å; Y656-W832 AromaticContact CD2-CE2 3.63Å; Y656-W832 AromaticContact CD2-CE3 3.87Å; Y656-W832 HydrophobicContact CD2-CE3 3.87Å; Y656-W832 AromaticContact CD2-CG 3.76Å; Y656-W832 HydrophobicContact CD2-CG 3.76Å; Y656-W832 HydrophobicContact CD2-CH2 4.46Å; Y656-W832 HydrophobicContact CD2-CZ2 4.14Å; Y656-W832 HydrophobicContact CD2-CZ3 4.33Å; Y656-W832 AromaticContact CD2-NE1 3.9Å; Y656-W832 HydrophobicContact CE2-CD2 4.27Å; Y656-W832 HydrophobicContact CE2-CG 4.06Å; Y656-W832 HydrophobicContact CG-CD2 4.45Å; Y656-W832 HydrophobicContact CG-CE3 4.43Å; S659-W832 WeakPolarHBondContact OG-CZ2 3.36Å; L702-W832 HydrophobicContact CD2-CH2 3.89Å; L702-W832 HydrophobicContact CD2-CZ2 4.39Å; L702-W832 HydrophobicContact CD2-CZ3 4.43Å; F828-W832 HydrophobicContact CE1-CE3 4.34Å; F828-W832 WeakPolarHBondContact O-CB 3.26Å; F828-W832 PolarHBondContact O-N 3.46Å; R829-W832 PolarHBondContact O-N 3.35Å; L830-W832 VanDerWaalsContact C-N 3.32Å; L830-W832 PolarHBondContact O-N 2.84Å; W832-R895 PolarHBondContact O-NH2 3.23Å
833	L	90.9	Very high	87.5	Confident	6 Å²	6	13.7 Å²	13.7	3%	0.031	7%	0.068	C	C	.	.	H	α-helix	trans	-93	-32.5	-165.3	-63.4	175.1	0	0	0	113.9	F651 L702 I746 M750 R829	F651-L833 HydrophobicContact CE2-CD1 3.93Å; F651-L833 HydrophobicContact CZ-CD1 4.23Å; L702-L833 HydrophobicContact CD1-CD2 4.08Å; L702-L833 HydrophobicContact CD2-CD1 3.84Å; L702-L833 HydrophobicContact CD2-CD2 4.04Å; I746-L833 HydrophobicContact CD1-CB 4.49Å; I746-L833 HydrophobicContact CD1-CD1 4.14Å; I746-L833 HydrophobicContact CG2-CB 4.11Å; I746-L833 HydrophobicContact CG2-CD1 4.19Å; M750-L833 HydrophobicContact CE-CD2 4.41Å; M750-L833 HydrophobicContact SD-CD2 3.97Å; R829-L833 PolarHBondContact O-N 2.92Å
834	G	90.5	Very high	89	Confident	2 Å²	2	11.9 Å²	11.9	2%	0.021	6%	0.055	C	C	.	.			trans	102.4	150.6	-166.5	0	0	0	0	0	113.2	L830 E892 R895	L830-G834 WeakPolarHBondContact O-CA 3.33Å; L830-G834 PolarHBondContact O-N 3.4Å; G834-E892 WeakPolarHBondContact CA-OE1 3.48Å; G834-R895 VanDerWaalsContact CA-CZ 3.5Å; G834-R895 VanDerWaalsContact CA-NH1 3.29Å; G834-R895 VanDerWaalsContact N-NH2 3.18Å
835	S	88.7	Confident	90.5	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	5%	0.045	C	C	.	.			trans	-69.1	146.4	166.3	62	0	0	0	0	110.5	Y837 V838 M839 E892	S835-Y837 PolarHBondContact O-N 2.96Å; S835-Y837 VanDerWaalsContact O-N 3.17Å; S835-V838 PolarHBondContact O-N 3.18Å; S835-V838 WeakPolarHBondContact OG-CB 3.41Å; S835-V838 WeakPolarHBondContact OG-CG2 3.33Å; S835-V838 PolarHBondContact OG-N 2.98Å; S835-M839 WeakPolarHBondContact O-CG 3.47Å; S835-M839 PolarHBondContact O-N 3.43Å; S835-E892 VanDerWaalsContact CB-OE2 3.23Å; S835-E892 WeakPolarHBondContact CB-OE2 3.43Å; S835-E892 PolarHBondContact N-OE1 2.76Å; S835-E892 PolarHBondContact N-OE2 3.4Å; S835-E892 PolarHBondContact OG-OE2 3.11Å
836	P	88.6	Confident	91.1	Very high	1 Å²	1	9.5 Å²	9.5	1%	0.006	4%	0.039	C	C	.	.	H	α-helix	trans	-52.9	-33.2	169.9	-24.1	28.1	0	0	0	113	Y740 Q745 I746 L749 M839 L840	Y740-P836 HydrophobicContact CD1-CG 4Å; Y740-P836 HydrophobicContact CD2-CB 4.22Å; Y740-P836 HydrophobicContact CD2-CG 4.19Å; Y740-P836 HydrophobicContact CE1-CB 4.13Å; Y740-P836 VanDerWaalsContact CE1-CD 3.41Å; Y740-P836 HydrophobicContact CE1-CG 3.48Å; Y740-P836 VanDerWaalsContact CE1-CG 3.48Å; Y740-P836 HydrophobicContact CE2-CB 3.54Å; Y740-P836 HydrophobicContact CE2-CG 3.77Å; Y740-P836 HydrophobicContact CG-CG 4.32Å; Y740-P836 VanDerWaalsContact CZ-CD 3.49Å; Y740-P836 VanDerWaalsContact CZ-CG 3.44Å; Y740-P836 WeakPolarHBondContact OH-CD 3.45Å; Q745-P836 VanDerWaalsContact OE1-CG 3.27Å; I746-P836 HydrophobicContact CG1-CG 4.11Å; L749-P836 HydrophobicContact CD1-CB 4.15Å; P836-M839 PolarHBondContact O-N 2.98Å; P836-L840 WeakPolarHBondContact O-CB 3.35Å; P836-L840 VanDerWaalsContact O-CG 3.25Å; P836-L840 WeakPolarHBondContact O-CG 3.27Å; P836-L840 PolarHBondContact O-N 3.02Å
837	Y	89.4	Confident	91.6	Very high	14 Å²	14	7.4 Å²	7.4	6%	0.055	3%	0.032	C	C	.	.	H	α-helix	trans	-55.7	-55.6	171.2	170.8	-102	0	0	0	112.2	Y740 M808 F812 S835 M839 L840 L841 V868	Y740-Y837 WeakPolarHBondContact OH-CB 3.34Å; Y740-Y837 PolarHBondContact OH-N 2.83Å; M808-Y837 HydrophobicContact CB-CD2 4.01Å; M808-Y837 HydrophobicContact CB-CE2 3.95Å; M808-Y837 HydrophobicContact CG-CD2 4.44Å; M808-Y837 WeakPolarHBondContact O-CD2 3.39Å; F812-Y837 HydrophobicContact CB-CD2 3.92Å; F812-Y837 HydrophobicContact CB-CE2 3.89Å; F812-Y837 HydrophobicContact CD2-CD1 4.24Å; F812-Y837 HydrophobicContact CD2-CD2 4.42Å; F812-Y837 AromaticContact CD2-CE1 3.97Å; F812-Y837 HydrophobicContact CD2-CE1 3.97Å; F812-Y837 HydrophobicContact CD2-CE2 4.14Å; F812-Y837 HydrophobicContact CD2-CG 4.47Å; F812-Y837 AromaticContact CD2-CZ 3.92Å; F812-Y837 HydrophobicContact CG-CE2 4.41Å; S835-Y837 PolarHBondContact O-N 2.96Å; S835-Y837 VanDerWaalsContact O-N 3.17Å; Y837-M839 VanDerWaalsContact C-N 3.31Å; Y837-M839 PolarHBondContact O-N 3.49Å; Y837-L840 PolarHBondContact O-N 3.43Å; Y837-L841 HydrophobicContact CE1-CD1 4.28Å; Y837-L841 WeakPolarHBondContact O-CB 3.44Å; Y837-L841 PolarHBondContact O-N 2.82Å; Y837-V868 HydrophobicContact CE1-CG2 4.09Å
838	V	91.6	Very high	91.9	Very high	0 Å²	0	6.7 Å²	6.7	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-62.7	-38.6	179.7	162.4	0	0	0	0	111	S835 L841 H842 V868 E892 L896 W899	S835-V838 PolarHBondContact O-N 3.18Å; S835-V838 WeakPolarHBondContact OG-CB 3.41Å; S835-V838 WeakPolarHBondContact OG-CG2 3.33Å; S835-V838 PolarHBondContact OG-N 2.98Å; V838-L841 PolarHBondContact O-N 3.38Å; V838-H842 PolarHBondContact O-N 2.87Å; V838-V868 HydrophobicContact CG2-CG2 4.35Å; V838-E892 WeakPolarHBondContact CB-OE2 3.37Å; V838-E892 HydrophobicContact CG2-CB 4.36Å; V838-E892 WeakPolarHBondContact CG2-OE2 3.42Å; V838-L896 HydrophobicContact CB-CD2 4.49Å; V838-L896 HydrophobicContact CG1-CD2 3.76Å; V838-L896 HydrophobicContact CG1-CG 4.03Å; V838-L896 HydrophobicContact CG2-CD1 4.29Å; V838-L896 HydrophobicContact CG2-CD2 4.39Å; V838-L896 HydrophobicContact CG2-CG 4.37Å; V838-W899 HydrophobicContact CB-CZ3 4.49Å; V838-W899 HydrophobicContact CG1-CE3 4.28Å; V838-W899 HydrophobicContact CG1-CH2 3.75Å; V838-W899 HydrophobicContact CG1-CZ3 3.29Å; V838-W899 WeakPolarHBondContact O-CZ3 3.4Å
839	M	92.1	Very high	91.9	Very high	5 Å²	5	6.7 Å²	6.7	3%	0.025	3%	0.029	C	C	.	.	H	α-helix	trans	-63.8	-45.4	174.7	-68.3	-64.6	-61.3	0	0	113.1	L749 M750 S835 P836 Y837 L841 H842 I843 W899	L749-M839 HydrophobicContact CB-CB 4.18Å; L749-M839 HydrophobicContact CB-CE 4.21Å; L749-M839 HydrophobicContact CD1-CB 4.21Å; M750-M839 VanDerWaalsContact CA-CE 3.4Å; M750-M839 HydrophobicContact CB-CE 3.97Å; M750-M839 HydrophobicContact CG-CE 3.38Å; M750-M839 HydrophobicContact CG-SD 4.29Å; S835-M839 WeakPolarHBondContact O-CG 3.47Å; S835-M839 PolarHBondContact O-N 3.43Å; P836-M839 PolarHBondContact O-N 2.98Å; Y837-M839 VanDerWaalsContact C-N 3.31Å; Y837-M839 PolarHBondContact O-N 3.49Å; M839-L841 VanDerWaalsContact C-N 3.33Å; M839-H842 WeakPolarHBondContact O-CB 3.48Å; M839-H842 PolarHBondContact O-N 3.37Å; M839-I843 WeakPolarHBondContact O-CG1 3.49Å; M839-I843 PolarHBondContact O-N 2.97Å; M839-W899 HydrophobicContact CG-CH2 4.39Å; M839-W899 HydrophobicContact SD-CH2 3.39Å; M839-W899 WeakPolarHBondContact SD-CH2 3.46Å; M839-W899 HydrophobicContact SD-CZ2 3.67Å
840	L	92	Very high	91.8	Very high	1 Å²	1	4.5 Å²	4.5	1%	0.005	2%	0.023	C	C	.	.	H	α-helix	trans	-66.7	-36.7	177.4	-74.9	168.5	0	0	0	111.6	L749 L780 L804 M808 P836 Y837 H842 I843 L844	L749-L840 HydrophobicContact CD1-CD2 4.46Å; L749-L840 HydrophobicContact CD1-CG 4.27Å; L749-L840 HydrophobicContact CD2-CD2 3.57Å; L749-L840 HydrophobicContact CD2-CG 4.24Å; L780-L840 HydrophobicContact CD2-CD2 4.48Å; L804-L840 HydrophobicContact CD1-CB 4.13Å; L804-L840 HydrophobicContact CD1-CD2 3.75Å; L804-L840 HydrophobicContact CD1-CG 4.36Å; M808-L840 HydrophobicContact CG-CB 3.95Å; M808-L840 HydrophobicContact SD-CB 4.09Å; P836-L840 WeakPolarHBondContact O-CB 3.35Å; P836-L840 VanDerWaalsContact O-CG 3.25Å; P836-L840 WeakPolarHBondContact O-CG 3.27Å; P836-L840 PolarHBondContact O-N 3.02Å; Y837-L840 PolarHBondContact O-N 3.43Å; L840-H842 VanDerWaalsContact C-N 3.31Å; L840-H842 PolarHBondContact O-N 2.76Å; L840-I843 PolarHBondContact O-N 3.38Å; L840-L844 PolarHBondContact O-N 3.47Å
841	L	94	Very high	91.8	Very high	5 Å²	5	7 Å²	7	3%	0.026	4%	0.038	C	C	.	.	H	α-helix	trans	-62.7	-41.1	173.9	-171.6	154	0	0	0	111	M808 Y837 V838 M839 L844 A845 I860 Y861 L896	M808-L841 WeakPolarHBondContact SD-CA 3.47Å; M808-L841 HydrophobicContact SD-CB 3.79Å; M808-L841 HydrophobicContact SD-CG 4.46Å; M808-L841 PolarHBondContact SD-N 3.49Å; M808-L841 VanDerWaalsContact SD-N 3.39Å; Y837-L841 HydrophobicContact CE1-CD1 4.28Å; Y837-L841 WeakPolarHBondContact O-CB 3.44Å; Y837-L841 PolarHBondContact O-N 2.82Å; V838-L841 PolarHBondContact O-N 3.38Å; M839-L841 VanDerWaalsContact C-N 3.33Å; L841-L844 WeakPolarHBondContact O-CB 3.47Å; L841-L844 PolarHBondContact O-N 3.05Å; L841-A845 PolarHBondContact O-N 2.74Å; L841-I860 HydrophobicContact CD2-CG2 3.63Å; L841-I860 HydrophobicContact CG-CG2 3.78Å; L841-Y861 HydrophobicContact CD2-CD1 3.83Å; L841-Y861 HydrophobicContact CD2-CE1 4.21Å; L841-L896 HydrophobicContact CD2-CD2 3.83Å
842	H	95.7	Very high	91.6	Very high	7 Å²	7	12.5 Å²	12.5	3%	0.032	6%	0.064	C	C	.	.	H	α-helix	trans	-64.2	-42.6	173.1	-173.4	75.8	0	0	0	112.4	S753 V838 M839 L840 L844 A845 L846 Y861 W899	S753-H842 PolarHBondContact OG-CD2 3.39Å; S753-H842 PolarHBondContact OG-NE2 2.6Å; V838-H842 PolarHBondContact O-N 2.87Å; M839-H842 WeakPolarHBondContact O-CB 3.48Å; M839-H842 PolarHBondContact O-N 3.37Å; L840-H842 VanDerWaalsContact C-N 3.31Å; L840-H842 PolarHBondContact O-N 2.76Å; H842-L844 VanDerWaalsContact C-N 3.32Å; H842-L844 PolarHBondContact O-N 2.89Å; H842-A845 CarbonylContact O-C 3.49Å; H842-A845 WeakPolarHBondContact O-CB 3.38Å; H842-A845 PolarHBondContact O-N 2.86Å; H842-A845 VanDerWaalsContact O-N 3.12Å; H842-L846 WeakPolarHBondContact NE2-CD1 3.48Å; H842-L846 WeakPolarHBondContact O-CG 3.48Å; H842-L846 PolarHBondContact O-N 3.32Å; H842-Y861 PolarHBondContact CE1-OH 3Å; H842-Y861 AromaticContact ND1-CE1 3.88Å; H842-Y861 AromaticContact ND1-CZ 3.85Å; H842-Y861 PolarHBondContact ND1-OH 3.05Å; H842-W899 HydrophobicContact CB-CD2 4.06Å; H842-W899 HydrophobicContact CB-CE3 3.46Å; H842-W899 VanDerWaalsContact CB-CE3 3.46Å; H842-W899 HydrophobicContact CB-CH2 4.11Å; H842-W899 HydrophobicContact CB-CZ3 3.46Å; H842-W899 VanDerWaalsContact CB-CZ3 3.46Å; H842-W899 VanDerWaalsContact CE1-CB 3.44Å; H842-W899 WeakPolarHBondContact CE1-CB 3.21Å; H842-W899 AromaticContact CE1-CD1 3.78Å; H842-W899 AromaticContact CE1-CD2 3.79Å; H842-W899 AromaticContact CE1-CG 3.36Å; H842-W899 AromaticContact CG-CD2 3.62Å; H842-W899 AromaticContact CG-CE3 3.53Å; H842-W899 AromaticContact CG-CZ3 3.96Å; H842-W899 VanDerWaalsContact ND1-CB 3.27Å; H842-W899 WeakPolarHBondContact ND1-CB 3.04Å; H842-W899 AromaticContact ND1-CD2 3.27Å; H842-W899 VanDerWaalsContact ND1-CD2 3.27Å; H842-W899 AromaticContact ND1-CE3 3.4Å; H842-W899 AromaticContact ND1-CG 3.23Å
843	I	94.7	Very high	91.3	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-61.6	-41	174.8	-69	166.7	0	0	0	111	L749 L776 L780 M839 L840 A845 L846 L847	L749-I843 HydrophobicContact CB-CD1 4.12Å; L749-I843 HydrophobicContact CD2-CD1 3.66Å; L776-I843 HydrophobicContact CD2-CG2 4.17Å; L780-I843 HydrophobicContact CD1-CG2 3.85Å; L780-I843 HydrophobicContact CD2-CG2 4.29Å; L780-I843 HydrophobicContact CG-CG2 4.42Å; M839-I843 WeakPolarHBondContact O-CG1 3.49Å; M839-I843 PolarHBondContact O-N 2.97Å; L840-I843 PolarHBondContact O-N 3.38Å; I843-A845 VanDerWaalsContact C-N 3.3Å; I843-A845 PolarHBondContact O-N 3.18Å; I843-L846 PolarHBondContact O-N 3Å; I843-L847 WeakPolarHBondContact O-CB 3.42Å; I843-L847 PolarHBondContact O-N 3.03Å
844	L	94.8	Very high	91.3	Very high	13 Å²	13	12 Å²	12	7%	0.068	7%	0.066	C	C	.	.	H	α-helix	trans	-59.4	-42.9	173	179.6	65.8	0	0	0	111.1	K801 L804 M808 L840 L841 H842 L847 T848 I860	K801-L844 HydrophobicContact CB-CD1 4.04Å; K801-L844 HydrophobicContact CD-CD1 4.44Å; K801-L844 HydrophobicContact CG-CD1 3.81Å; L804-L844 HydrophobicContact CD2-CB 3.67Å; L804-L844 HydrophobicContact CD2-CD1 4Å; L804-L844 HydrophobicContact CD2-CG 4.38Å; L804-L844 HydrophobicContact CG-CB 4.46Å; M808-L844 HydrophobicContact CE-CB 4.38Å; M808-L844 HydrophobicContact CE-CD2 3.44Å; M808-L844 VanDerWaalsContact CE-CD2 3.44Å; M808-L844 HydrophobicContact CE-CG 4.48Å; L840-L844 PolarHBondContact O-N 3.47Å; L841-L844 WeakPolarHBondContact O-CB 3.47Å; L841-L844 PolarHBondContact O-N 3.05Å; H842-L844 VanDerWaalsContact C-N 3.32Å; H842-L844 PolarHBondContact O-N 2.89Å; L844-L847 PolarHBondContact O-N 2.99Å; L844-T848 VanDerWaalsContact O-CB 3.29Å; L844-T848 WeakPolarHBondContact O-CB 3.31Å; L844-T848 PolarHBondContact O-N 2.89Å; L844-T848 PolarHBondContact O-OG1 3.31Å; L844-I860 HydrophobicContact CD2-CD1 4.26Å; L844-I860 HydrophobicContact CD2-CG1 4.44Å; L844-I860 HydrophobicContact CD2-CG2 4.18Å; L844-I860 HydrophobicContact CG-CD1 4.07Å
845	A	95.4	Very high	91.2	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-64.7	-38.7	177.1	0	0	0	0	0	112	L841 H842 I843 T848 Y849 C857 I860 Y861	L841-A845 PolarHBondContact O-N 2.74Å; H842-A845 CarbonylContact O-C 3.49Å; H842-A845 WeakPolarHBondContact O-CB 3.38Å; H842-A845 PolarHBondContact O-N 2.86Å; H842-A845 VanDerWaalsContact O-N 3.12Å; I843-A845 VanDerWaalsContact C-N 3.3Å; I843-A845 PolarHBondContact O-N 3.18Å; A845-T848 PolarHBondContact O-N 3.16Å; A845-Y849 WeakPolarHBondContact O-CB 3.43Å; A845-Y849 PolarHBondContact O-N 3.05Å; A845-C857 PolarHBondContact O-SG 3.37Å; A845-I860 HydrophobicContact CB-CG2 4.22Å; A845-Y861 HydrophobicContact CB-CD2 4.48Å; A845-Y861 HydrophobicContact CB-CE1 3.96Å; A845-Y861 HydrophobicContact CB-CE2 3.74Å; A845-Y861 VanDerWaalsContact CB-CZ 3.42Å; A845-Y861 WeakPolarHBondContact CB-OH 3.5Å
846	L	94.5	Very high	91.2	Very high	2 Å²	2	21.3 Å²	21.3	1%	0.01	11%	0.106	C	C	.	.	H	α-helix	trans	-66.3	-42.7	174.8	-67.4	172.5	0	0	0	112.2	A756 F760 L776 H842 I843 T848 Y849 A850 L903	A756-L846 HydrophobicContact CB-CD1 4.08Å; F760-L846 HydrophobicContact CD2-CD2 4.19Å; F760-L846 HydrophobicContact CE2-CB 4.23Å; F760-L846 HydrophobicContact CE2-CD2 3.84Å; L776-L846 HydrophobicContact CD1-CB 4.16Å; H842-L846 WeakPolarHBondContact NE2-CD1 3.48Å; H842-L846 WeakPolarHBondContact O-CG 3.48Å; H842-L846 PolarHBondContact O-N 3.32Å; I843-L846 PolarHBondContact O-N 3Å; L846-T848 VanDerWaalsContact C-N 3.28Å; L846-T848 PolarHBondContact O-N 3.18Å; L846-Y849 PolarHBondContact O-N 3.32Å; L846-A850 PolarHBondContact O-N 2.83Å; L846-A850 VanDerWaalsContact O-N 3.1Å; L846-L903 HydrophobicContact CD2-CD1 3.95Å
847	L	92.6	Very high	91.5	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-61.6	-40.6	174.1	-174.6	67.9	0	0	0	110.8	L773 L800 K801 I843 L844 T851	L773-L847 HydrophobicContact CD2-CD1 3.78Å; L800-L847 HydrophobicContact CD2-CD2 3.93Å; K801-L847 HydrophobicContact CG-CD2 3.65Å; K801-L847 HydrophobicContact CG-CG 4.44Å; I843-L847 WeakPolarHBondContact O-CB 3.42Å; I843-L847 PolarHBondContact O-N 3.03Å; L844-L847 PolarHBondContact O-N 2.99Å; L847-T851 WeakPolarHBondContact O-CG2 3.41Å; L847-T851 PolarHBondContact O-N 3.42Å; L847-T851 PolarHBondContact O-OG1 3.23Å
848	T	92.3	Very high	91.7	Very high	4 Å²	4	22.8 Å²	22.8	3%	0.025	11%	0.113	C	C	.	.	H	α-helix	trans	-69.1	-40	177.1	-59	0	0	0	0	112.2	K801 L844 A845 L846 A850 T851 E852 G853 I860	K801-T848 PolarHBondContact NZ-OG1 3.3Å; L844-T848 VanDerWaalsContact O-CB 3.29Å; L844-T848 WeakPolarHBondContact O-CB 3.31Å; L844-T848 PolarHBondContact O-N 2.89Å; L844-T848 PolarHBondContact O-OG1 3.31Å; A845-T848 PolarHBondContact O-N 3.16Å; L846-T848 VanDerWaalsContact C-N 3.28Å; L846-T848 PolarHBondContact O-N 3.18Å; T848-A850 VanDerWaalsContact C-N 3.31Å; T848-A850 PolarHBondContact O-N 2.91Å; T848-T851 WeakPolarHBondContact CA-OG1 2.8Å; T848-T851 PolarHBondContact O-N 3.05Å; T848-T851 PolarHBondContact O-OG1 3.32Å; T848-E852 HydrophobicContact CG2-CB 4.17Å; T848-E852 PolarHBondContact O-N 2.95Å; T848-G853 PolarHBondContact O-N 3.35Å; T848-I860 HydrophobicContact CG2-CD1 3.89Å; T848-I860 WeakPolarHBondContact OG1-CD1 3.25Å
849	Y	91.1	Very high	91.7	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-60.3	-41.5	175.9	173.5	-110.4	0	0	0	112.5	F760 Y769 A845 L846 G853 I854 L903 N907 R913	F760-Y849 HydrophobicContact CB-CE1 4.25Å; F760-Y849 HydrophobicContact CD1-CD1 4.48Å; F760-Y849 HydrophobicContact CD1-CE1 4.24Å; F760-Y849 AromaticContact CD2-CD1 3.82Å; F760-Y849 HydrophobicContact CD2-CD1 3.82Å; F760-Y849 AromaticContact CD2-CE1 3.92Å; F760-Y849 HydrophobicContact CD2-CE1 3.92Å; F760-Y849 HydrophobicContact CE1-CD1 4.46Å; F760-Y849 AromaticContact CE2-CD1 3.79Å; F760-Y849 HydrophobicContact CE2-CD1 3.79Å; F760-Y849 HydrophobicContact CE2-CE1 4.32Å; F760-Y849 HydrophobicContact CG-CD1 4.19Å; F760-Y849 AromaticContact CG-CE1 3.88Å; F760-Y849 HydrophobicContact CG-CE1 3.88Å; F760-Y849 HydrophobicContact CZ-CD1 4.13Å; Y769-Y849 HydrophobicContact CE1-CE1 4.15Å; A845-Y849 WeakPolarHBondContact O-CB 3.43Å; A845-Y849 PolarHBondContact O-N 3.05Å; L846-Y849 PolarHBondContact O-N 3.32Å; Y849-G853 WeakPolarHBondContact O-CA 3.41Å; Y849-G853 PolarHBondContact O-N 2.79Å; Y849-I854 HydrophobicContact CD2-CB 4.05Å; Y849-I854 HydrophobicContact CD2-CD1 4.24Å; Y849-I854 HydrophobicContact CE2-CB 4.14Å; Y849-L903 HydrophobicContact CD1-CD1 3.8Å; Y849-L903 HydrophobicContact CD2-CD1 4.15Å; Y849-L903 HydrophobicContact CD2-CD2 4.35Å; Y849-L903 HydrophobicContact CD2-CG 4.16Å; Y849-L903 HydrophobicContact CE1-CD1 4.15Å; Y849-L903 HydrophobicContact CE2-CD1 4.48Å; Y849-L903 HydrophobicContact CG-CD1 3.8Å; Y849-L903 HydrophobicContact CG-CD2 4.23Å; Y849-L903 HydrophobicContact CG-CG 4.2Å; Y849-N907 HydrophobicContact CE2-CB 3.96Å; Y849-R913 PolarHBondContact O-NH1 3.26Å
850	A	88	Confident	91.8	Very high	8 Å²	8	27 Å²	27	7%	0.066	14%	0.135	C	C	.	.	H	α-helix	trans	-71	-31.4	179.1	0	0	0	0	0	112.8	F760 L773 L846 T848 R913	F760-A850 HydrophobicContact CE1-CB 3.95Å; F760-A850 HydrophobicContact CZ-CB 3.81Å; L773-A850 HydrophobicContact CD1-CB 4Å; L773-A850 HydrophobicContact CD2-CB 3.35Å; L773-A850 HydrophobicContact CG-CB 3.59Å; L846-A850 PolarHBondContact O-N 2.83Å; L846-A850 VanDerWaalsContact O-N 3.1Å; T848-A850 VanDerWaalsContact C-N 3.31Å; T848-A850 PolarHBondContact O-N 2.91Å; A850-R913 PolarHBondContact O-NH2 2.96Å
851	T	88.8	Confident	92	Very high	52 Å²	52	27 Å²	27	32%	0.319	14%	0.135	S	C	.	.	H	α-helix	trans	-94.7	-52.6	-175	47	0	0	0	0	114.6	L773 I797 K801 L847 T848	L773-T851 HydrophobicContact CD1-CG2 4.43Å; L773-T851 HydrophobicContact CD2-CG2 3.83Å; I797-T851 HydrophobicContact CD1-CG2 3.91Å; I797-T851 HydrophobicContact CG2-CG2 3.76Å; K801-T851 PolarHBondContact NZ-OG1 3.13Å; L847-T851 WeakPolarHBondContact O-CG2 3.41Å; L847-T851 PolarHBondContact O-N 3.42Å; L847-T851 PolarHBondContact O-OG1 3.23Å; T848-T851 WeakPolarHBondContact CA-OG1 2.8Å; T848-T851 PolarHBondContact O-N 3.05Å; T848-T851 PolarHBondContact O-OG1 3.32Å
852	E	86.7	Confident	92.1	Very high	117 Å²	117	32.1 Å²	32.1	55%	0.547	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-15.3	-173.4	-64.1	170.5	-145.2	0	0	112.6	K801 T848 S856	K801-E852 IonicContact NZ-OE1 3.25Å; K801-E852 PolarHBondContact NZ-OE1 3.12Å; T848-E852 HydrophobicContact CG2-CB 4.17Å; T848-E852 PolarHBondContact O-N 2.95Å; E852-S856 WeakPolarHBondContact OE2-CB 3.38Å; E852-S856 PolarHBondContact OE2-OG 3.32Å
853	G	85.7	Confident	91.9	Very high	13 Å²	13	39.4 Å²	39.4	13%	0.134	18%	0.181	C	C	.	.			trans	90.6	-178.3	-176.8	0	0	0	0	0	113.4	T848 Y849 R855 C857	T848-G853 PolarHBondContact O-N 3.35Å; Y849-G853 WeakPolarHBondContact O-CA 3.41Å; Y849-G853 PolarHBondContact O-N 2.79Å; G853-R855 PolarHBondContact O-N 2.88Å; G853-C857 PolarHBondContact O-SG 3.44Å
854	I	89.5	Confident	91.8	Very high	7 Å²	7	39.4 Å²	39.4	4%	0.036	18%	0.182	C	C	.	.	H	α-helix	trans	-68.8	-29.1	-167.4	-176.7	62.1	0	0	0	114.6	Y849 S856 C857 F858 L903 L904 N907 L917	Y849-I854 HydrophobicContact CD2-CB 4.05Å; Y849-I854 HydrophobicContact CD2-CD1 4.24Å; Y849-I854 HydrophobicContact CE2-CB 4.14Å; I854-S856 PolarHBondContact O-N 3.16Å; I854-C857 HydrophobicContact CD1-CB 4.3Å; I854-C857 VanDerWaalsContact O-CB 3.3Å; I854-C857 WeakPolarHBondContact O-CB 3.21Å; I854-C857 PolarHBondContact O-N 3.37Å; I854-C857 VanDerWaalsContact O-N 3.11Å; I854-F858 HydrophobicContact CG1-CE1 4.36Å; I854-F858 HydrophobicContact CG1-CZ 4.19Å; I854-L903 HydrophobicContact CD1-CB 4.32Å; I854-L903 HydrophobicContact CD1-CD2 3.88Å; I854-L903 HydrophobicContact CD1-CG 3.82Å; I854-L904 HydrophobicContact CD1-CD2 4.09Å; I854-L904 HydrophobicContact CD1-CG 4.37Å; I854-L904 HydrophobicContact CG1-CD2 3.7Å; I854-N907 HydrophobicContact CB-CB 4.43Å; I854-N907 HydrophobicContact CG1-CB 4.43Å; I854-L917 HydrophobicContact CB-CD1 4.36Å; I854-L917 HydrophobicContact CG1-CD1 4.08Å; I854-L917 HydrophobicContact CG2-CD1 3.37Å; I854-L917 HydrophobicContact CG2-CG 4.09Å
855	R	89.3	Confident	91.8	Very high	160 Å²	160	39.3 Å²	39.3	60%	0.604	18%	0.18	S	C	*	.	H	α-helix	trans	-63.6	-41.6	-176.2	-70.2	-175.3	-177.4	-150.7	2.1	112	G853 C857 F858 D916 L917	G853-R855 PolarHBondContact O-N 2.88Å; R855-C857 PolarHBondContact O-N 3.15Å; R855-F858 WeakPolarHBondContact O-CD2 3.39Å; R855-F858 PolarHBondContact O-N 3.46Å; R855-D916 PolarHBondContact NH2-O 3.3Å; R855-L917 HydrophobicContact CG-CD2 3.97Å
856	S	89.6	Confident	91.6	Very high	38 Å²	38	43.9 Å²	43.9	27%	0.266	20%	0.202	S	C	.	.	H	α-helix	trans	-65.2	-23.9	176.8	-62.8	0	0	0	0	112.9	E852 I854 F858	E852-S856 WeakPolarHBondContact OE2-CB 3.38Å; E852-S856 PolarHBondContact OE2-OG 3.32Å; I854-S856 PolarHBondContact O-N 3.16Å; S856-F858 VanDerWaalsContact C-N 3.33Å; S856-F858 PolarHBondContact O-N 3.25Å
857	C	93.3	Very high	91.3	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-69.6	-29.1	179	-55.4	0	0	0	0	112.8	A845 G853 I854 R855 D859 I860 Y861 L903	A845-C857 PolarHBondContact O-SG 3.37Å; G853-C857 PolarHBondContact O-SG 3.44Å; I854-C857 HydrophobicContact CD1-CB 4.3Å; I854-C857 VanDerWaalsContact O-CB 3.3Å; I854-C857 WeakPolarHBondContact O-CB 3.21Å; I854-C857 PolarHBondContact O-N 3.37Å; I854-C857 VanDerWaalsContact O-N 3.11Å; R855-C857 PolarHBondContact O-N 3.15Å; C857-D859 VanDerWaalsContact C-N 3.34Å; C857-D859 PolarHBondContact O-N 3.01Å; C857-I860 WeakPolarHBondContact O-CB 3.44Å; C857-I860 PolarHBondContact O-N 3.14Å; C857-Y861 HydrophobicContact CB-CD2 4.39Å; C857-Y861 HydrophobicContact CB-CE2 4.21Å; C857-Y861 VanDerWaalsContact O-CD2 3.22Å; C857-Y861 WeakPolarHBondContact O-CD2 3.39Å; C857-Y861 PolarHBondContact O-N 3.04Å; C857-Y861 VanDerWaalsContact O-N 3.1Å; C857-L903 HydrophobicContact CB-CD2 4.15Å
858	F	94.1	Very high	91.1	Very high	45 Å²	45	46.6 Å²	46.6	20%	0.197	21%	0.213	C	C	.	.	H	α-helix	trans	-61.9	-42	-178.7	-62	-40.7	0	0	0	112.5	I854 R855 S856 I860 Y861 R862 E900 L904 L917 V921	I854-F858 HydrophobicContact CG1-CE1 4.36Å; I854-F858 HydrophobicContact CG1-CZ 4.19Å; R855-F858 WeakPolarHBondContact O-CD2 3.39Å; R855-F858 PolarHBondContact O-N 3.46Å; S856-F858 VanDerWaalsContact C-N 3.33Å; S856-F858 PolarHBondContact O-N 3.25Å; F858-I860 VanDerWaalsContact C-N 3.27Å; F858-I860 PolarHBondContact O-N 2.95Å; F858-Y861 PolarHBondContact O-N 3.39Å; F858-R862 VanDerWaalsContact O-CB 3.26Å; F858-R862 WeakPolarHBondContact O-CB 3.4Å; F858-R862 PolarHBondContact O-N 2.87Å; F858-E900 HydrophobicContact CD1-CG 4.22Å; F858-E900 HydrophobicContact CE1-CG 4.44Å; F858-L904 HydrophobicContact CE1-CD1 3.85Å; F858-L904 HydrophobicContact CE1-CD2 3.48Å; F858-L904 VanDerWaalsContact CE1-CD2 3.48Å; F858-L904 HydrophobicContact CE1-CG 3.83Å; F858-L904 HydrophobicContact CZ-CD1 4.4Å; F858-L904 HydrophobicContact CZ-CD2 3.4Å; F858-L904 VanDerWaalsContact CZ-CD2 3.4Å; F858-L904 HydrophobicContact CZ-CG 4.26Å; F858-L917 HydrophobicContact CE2-CD1 4.36Å; F858-L917 HydrophobicContact CZ-CD1 4.09Å; F858-V921 HydrophobicContact CE2-CG1 4.18Å; F858-V921 HydrophobicContact CZ-CG1 3.75Å
859	D	92.3	Very high	90.8	Very high	66 Å²	66	50.4 Å²	50.4	35%	0.353	23%	0.227	S	C	.	.	H	α-helix	trans	-64.7	-35.9	179	-74.3	-25.7	0	0	0	111.6	C857 R862 R863	C857-D859 VanDerWaalsContact C-N 3.34Å; C857-D859 PolarHBondContact O-N 3.01Å; D859-R862 IonicContact OD1-CZ 3.61Å; D859-R862 IonicContact OD1-NH1 3.99Å; D859-R862 IonicContact OD1-NH2 2.75Å; D859-R862 PolarHBondContact OD1-NH2 2.76Å; D859-R863 WeakPolarHBondContact O-CB 3.26Å; D859-R863 VanDerWaalsContact O-CG 3.24Å; D859-R863 WeakPolarHBondContact O-CG 3.29Å; D859-R863 PolarHBondContact O-N 2.95Å
860	I	93.9	Very high	90.5	Very high	27 Å²	27	53.9 Å²	53.9	14%	0.138	25%	0.251	C	S	.	.	H	α-helix	trans	-64.1	-52.4	177.2	-61.9	168.5	0	0	0	109.9	L841 L844 A845 T848 C857 F858 G864	L841-I860 HydrophobicContact CD2-CG2 3.63Å; L841-I860 HydrophobicContact CG-CG2 3.78Å; L844-I860 HydrophobicContact CD2-CD1 4.26Å; L844-I860 HydrophobicContact CD2-CG1 4.44Å; L844-I860 HydrophobicContact CD2-CG2 4.18Å; L844-I860 HydrophobicContact CG-CD1 4.07Å; A845-I860 HydrophobicContact CB-CG2 4.22Å; T848-I860 HydrophobicContact CG2-CD1 3.89Å; T848-I860 WeakPolarHBondContact OG1-CD1 3.25Å; C857-I860 WeakPolarHBondContact O-CB 3.44Å; C857-I860 PolarHBondContact O-N 3.14Å; F858-I860 VanDerWaalsContact C-N 3.27Å; F858-I860 PolarHBondContact O-N 2.95Å; I860-G864 PolarHBondContact O-N 3.33Å
861	Y	96.1	Very high	89.9	Confident	1 Å²	1	53.9 Å²	53.9	0%	0.004	25%	0.25	C	S	.	.	H	α-helix	trans	-66.3	-41.2	-179.8	-69.8	-59.8	0	0	0	112.7	L841 H842 A845 C857 F858 G864 R865 L896 W899 E900 L903	L841-Y861 HydrophobicContact CD2-CD1 3.83Å; L841-Y861 HydrophobicContact CD2-CE1 4.21Å; H842-Y861 PolarHBondContact CE1-OH 3Å; H842-Y861 AromaticContact ND1-CE1 3.88Å; H842-Y861 AromaticContact ND1-CZ 3.85Å; H842-Y861 PolarHBondContact ND1-OH 3.05Å; A845-Y861 HydrophobicContact CB-CD2 4.48Å; A845-Y861 HydrophobicContact CB-CE1 3.96Å; A845-Y861 HydrophobicContact CB-CE2 3.74Å; A845-Y861 VanDerWaalsContact CB-CZ 3.42Å; A845-Y861 WeakPolarHBondContact CB-OH 3.5Å; C857-Y861 HydrophobicContact CB-CD2 4.39Å; C857-Y861 HydrophobicContact CB-CE2 4.21Å; C857-Y861 VanDerWaalsContact O-CD2 3.22Å; C857-Y861 WeakPolarHBondContact O-CD2 3.39Å; C857-Y861 PolarHBondContact O-N 3.04Å; C857-Y861 VanDerWaalsContact O-N 3.1Å; F858-Y861 PolarHBondContact O-N 3.39Å; Y861-G864 PolarHBondContact O-N 3.16Å; Y861-R865 WeakPolarHBondContact O-CG 3.38Å; Y861-R865 PolarHBondContact O-N 3.45Å; Y861-L896 HydrophobicContact CD1-CD2 4.14Å; Y861-W899 HydrophobicContact CE1-CB 4.17Å; Y861-E900 WeakPolarHBondContact CB-OE2 3.5Å; Y861-E900 HydrophobicContact CD2-CB 3.64Å; Y861-E900 HydrophobicContact CD2-CG 3.73Å; Y861-E900 HydrophobicContact CE2-CB 3.97Å; Y861-E900 HydrophobicContact CE2-CG 4.28Å; Y861-E900 HydrophobicContact CG-CB 3.95Å; Y861-E900 HydrophobicContact CG-CG 4.31Å; Y861-L903 HydrophobicContact CE2-CD2 4.12Å
862	R	95.5	Very high	89.1	Confident	113 Å²	113	52.8 Å²	52.8	43%	0.426	24%	0.244	S	C	.	.	H	α-helix	trans	-59.3	-52.1	177.4	-176.5	-175.8	65.5	-147.7	-14.8	111.4	F858 D859 G864 R865 E866	F858-R862 VanDerWaalsContact O-CB 3.26Å; F858-R862 WeakPolarHBondContact O-CB 3.4Å; F858-R862 PolarHBondContact O-N 2.87Å; D859-R862 IonicContact OD1-CZ 3.61Å; D859-R862 IonicContact OD1-NH1 3.99Å; D859-R862 IonicContact OD1-NH2 2.75Å; D859-R862 PolarHBondContact OD1-NH2 2.76Å; R862-G864 VanDerWaalsContact C-N 3.28Å; R862-G864 PolarHBondContact O-N 2.66Å; R862-R865 PolarHBondContact O-N 3.35Å; R862-E866 WeakPolarHBondContact CG-OE1 3.29Å; R862-E866 WeakPolarHBondContact O-CG 3.48Å; R862-E866 PolarHBondContact O-N 3.49Å
863	R	92.2	Very high	88.5	Confident	160 Å²	160	49.9 Å²	49.9	60%	0.604	25%	0.245	S	C	*	.	H	α-helix	trans	-60.5	-39.8	178	-71.3	178.8	-164	173.6	8.2	111.6	D859 E866 K867	D859-R863 WeakPolarHBondContact O-CB 3.26Å; D859-R863 VanDerWaalsContact O-CG 3.24Å; D859-R863 WeakPolarHBondContact O-CG 3.29Å; D859-R863 PolarHBondContact O-N 2.95Å; R863-E866 PolarHBondContact O-N 3.27Å; R863-K867 VanDerWaalsContact O-CB 3.26Å; R863-K867 WeakPolarHBondContact O-CB 3.28Å; R863-K867 PolarHBondContact O-N 3.42Å
864	G	92.4	Very high	87.7	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-57.7	-48.9	175	0	0	0	0	0	112.8	I860 Y861 R862 K867 V868	I860-G864 PolarHBondContact O-N 3.33Å; Y861-G864 PolarHBondContact O-N 3.16Å; R862-G864 VanDerWaalsContact C-N 3.28Å; R862-G864 PolarHBondContact O-N 2.66Å; G864-K867 PolarHBondContact O-N 2.8Å; G864-V868 WeakPolarHBondContact O-CG2 3.46Å; G864-V868 PolarHBondContact O-N 3.33Å
865	R	94.4	Very high	86.7	Confident	11 Å²	11	54.9 Å²	54.9	4%	0.042	28%	0.279	C	S	.	.	H	α-helix	trans	-63.2	-46.6	177.6	-71.4	-170.4	-67	-88	3.7	112.4	Y861 R862 K867 V868 R869 V893 L896 W897 E900	Y861-R865 WeakPolarHBondContact O-CG 3.38Å; Y861-R865 PolarHBondContact O-N 3.45Å; R862-R865 PolarHBondContact O-N 3.35Å; R865-K867 VanDerWaalsContact C-N 3.27Å; R865-K867 PolarHBondContact O-N 2.97Å; R865-V868 PolarHBondContact O-N 3.4Å; R865-R869 WeakPolarHBondContact O-CB 3.3Å; R865-R869 VanDerWaalsContact O-CG 3.31Å; R865-R869 WeakPolarHBondContact O-CG 3.35Å; R865-R869 PolarHBondContact O-N 3.39Å; R865-V893 HydrophobicContact CB-CG1 4.32Å; R865-V893 HydrophobicContact CG-CG1 4.02Å; R865-L896 HydrophobicContact CG-CB 3.92Å; R865-L896 HydrophobicContact CG-CD1 3.78Å; R865-W897 VanDerWaalsContact CD-CE2 3.41Å; R865-W897 VanDerWaalsContact CD-NE1 3.28Å; R865-W897 VanDerWaalsContact NE-CE2 3.33Å; R865-W897 VanDerWaalsContact NE-CZ2 3.34Å; R865-W897 VanDerWaalsContact NH2-CH2 3.33Å; R865-E900 IonicContact CZ-OE2 3.94Å; R865-E900 VanDerWaalsContact CZ-OE2 3.22Å; R865-E900 IonicContact NH1-OE2 2.65Å; R865-E900 PolarHBondContact NH1-OE2 3.37Å; R865-E900 IonicContact NH2-OE2 3.7Å; R865-E900 PolarHBondContact NH2-OE2 2.92Å
866	E	92.2	Very high	85.1	Confident	96 Å²	96	55.7 Å²	55.7	45%	0.449	29%	0.29	S	S	.	.	H	α-helix	trans	-57.4	-43.1	177.9	-73.1	166.4	179.9	0	0	111.6	R862 R863 R869 S870	R862-E866 WeakPolarHBondContact CG-OE1 3.29Å; R862-E866 WeakPolarHBondContact O-CG 3.48Å; R862-E866 PolarHBondContact O-N 3.49Å; R863-E866 PolarHBondContact O-N 3.27Å; E866-R869 PolarHBondContact O-N 3.34Å; E866-S870 PolarHBondContact O-N 3.28Å
867	K	88.5	Confident	83.6	Confident	59 Å²	59	56 Å²	56	26%	0.257	29%	0.288	S	S	.	.	H	α-helix	trans	-69.1	-40	-179.7	-170.1	136.7	-179.3	170.2	0	112.4	F812 E813 R863 G864 R865 S870	F812-K867 HydrophobicContact CD1-CD 4.19Å; F812-K867 HydrophobicContact CD1-CG 4.11Å; F812-K867 HydrophobicContact CD2-CD 4.36Å; F812-K867 HydrophobicContact CD2-CG 3.7Å; F812-K867 HydrophobicContact CE1-CD 4.12Å; F812-K867 HydrophobicContact CE1-CG 3.72Å; F812-K867 HydrophobicContact CE2-CB 4.23Å; F812-K867 HydrophobicContact CE2-CD 4.33Å; F812-K867 HydrophobicContact CE2-CG 3.29Å; F812-K867 WeakPolarHBondContact CE2-O 3.49Å; F812-K867 HydrophobicContact CG-CD 4.29Å; F812-K867 HydrophobicContact CG-CG 4.09Å; F812-K867 HydrophobicContact CZ-CB 4.39Å; F812-K867 HydrophobicContact CZ-CD 4.17Å; F812-K867 HydrophobicContact CZ-CG 3.27Å; F812-K867 VanDerWaalsContact CZ-O 3.24Å; F812-K867 WeakPolarHBondContact CZ-O 3.45Å; E813-K867 IonicContact OE1-NZ 3.44Å; E813-K867 PolarHBondContact OE1-NZ 2.91Å; R863-K867 VanDerWaalsContact O-CB 3.26Å; R863-K867 WeakPolarHBondContact O-CB 3.28Å; R863-K867 PolarHBondContact O-N 3.42Å; G864-K867 PolarHBondContact O-N 2.8Å; R865-K867 VanDerWaalsContact C-N 3.27Å; R865-K867 PolarHBondContact O-N 2.97Å; K867-S870 PolarHBondContact O-OG 3.21Å
868	V	87	Confident	81.6	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-66	-40.8	172.9	176.5	0	0	0	0	111.3	Y837 V838 G864 R865 S870 V871 V872 E892 V893	Y837-V868 HydrophobicContact CE1-CG2 4.09Å; V838-V868 HydrophobicContact CG2-CG2 4.35Å; G864-V868 WeakPolarHBondContact O-CG2 3.46Å; G864-V868 PolarHBondContact O-N 3.33Å; R865-V868 PolarHBondContact O-N 3.4Å; V868-S870 PolarHBondContact O-N 3.36Å; V868-V871 WeakPolarHBondContact O-CB 3.22Å; V868-V871 PolarHBondContact O-N 2.79Å; V868-V872 PolarHBondContact O-N 3.14Å; V868-E892 HydrophobicContact CG1-CB 4.12Å; V868-V893 HydrophobicContact CB-CG2 4.08Å; V868-V893 HydrophobicContact CG1-CG2 3.68Å
869	R	86.9	Confident	79.6	Confident	85 Å²	85	66.8 Å²	66.8	32%	0.321	34%	0.342	S	S	.	.	H	α-helix	trans	-63.9	-37.6	178	-73.6	-178	-156.7	127.9	3.6	113.5	R865 E866 V871 V872 G873 V893 E932	R865-R869 WeakPolarHBondContact O-CB 3.3Å; R865-R869 VanDerWaalsContact O-CG 3.31Å; R865-R869 WeakPolarHBondContact O-CG 3.35Å; R865-R869 PolarHBondContact O-N 3.39Å; E866-R869 PolarHBondContact O-N 3.34Å; R869-V871 PolarHBondContact O-N 2.98Å; R869-V872 PolarHBondContact O-N 2.95Å; R869-V872 VanDerWaalsContact O-N 3.14Å; R869-G873 PolarHBondContact O-N 2.92Å; R869-V893 HydrophobicContact CG-CG2 4.3Å; R869-E932 IonicContact CZ-OE1 3.47Å; R869-E932 IonicContact CZ-OE2 3.46Å; R869-E932 IonicContact NE-OE2 2.73Å; R869-E932 IonicContact NH2-OE1 2.9Å; R869-E932 PolarHBondContact NH2-OE1 2.94Å; R869-E932 IonicContact NH2-OE2 3.43Å; R869-E932 PolarHBondContact NH2-OE2 2.94Å
870	S	83.6	Confident	77.6	Confident	72 Å²	72	71.6 Å²	71.6	50%	0.503	36%	0.36	S	S	.	.	H	α-helix	trans	-59.5	-31.4	178.5	65.4	0	0	0	0	111.4	E866 K867 V868 A874	E866-S870 PolarHBondContact O-N 3.28Å; K867-S870 PolarHBondContact O-OG 3.21Å; V868-S870 PolarHBondContact O-N 3.36Å; S870-A874 VanDerWaalsContact O-CB 3.29Å; S870-A874 WeakPolarHBondContact O-CB 3.48Å; S870-A874 PolarHBondContact O-N 2.63Å
871	V	76.5	Confident	75.4	Confident	8 Å²	8	72.3 Å²	72.3	5%	0.048	37%	0.367	C	S	.	.	H	α-helix	trans	-70.2	-51	173.8	-173.2	0	0	0	0	111.2	F812 Y816 V868 R869 G873 A874 L875	F812-V871 HydrophobicContact CE1-CG2 4.22Å; F812-V871 HydrophobicContact CE2-CG2 3.85Å; F812-V871 HydrophobicContact CZ-CG2 3.32Å; Y816-V871 HydrophobicContact CD1-CB 4.07Å; Y816-V871 HydrophobicContact CD1-CG1 3.56Å; Y816-V871 HydrophobicContact CD1-CG2 3.89Å; Y816-V871 HydrophobicContact CD2-CG2 4.13Å; Y816-V871 HydrophobicContact CE1-CG1 4.38Å; Y816-V871 HydrophobicContact CG-CB 4.28Å; Y816-V871 HydrophobicContact CG-CG1 3.98Å; Y816-V871 HydrophobicContact CG-CG2 3.61Å; V868-V871 WeakPolarHBondContact O-CB 3.22Å; V868-V871 PolarHBondContact O-N 2.79Å; R869-V871 PolarHBondContact O-N 2.98Å; V871-G873 PolarHBondContact O-N 2.97Å; V871-G873 VanDerWaalsContact O-N 3.14Å; V871-A874 WeakPolarHBondContact O-CA 3.47Å; V871-A874 PolarHBondContact O-N 2.67Å; V871-L875 HydrophobicContact CG1-CD1 3.9Å; V871-L875 HydrophobicContact CG1-CD2 4.42Å; V871-L875 HydrophobicContact CG1-CG 3.95Å; V871-L875 WeakPolarHBondContact O-CG 3.5Å; V871-L875 PolarHBondContact O-N 3.01Å
872	V	72.2	Confident	73.6	Confident	30 Å²	30	77.1 Å²	77.1	18%	0.182	39%	0.39	C	S	.	.	H	α-helix	trans	-51.7	-41.6	178.4	-179.8	0	0	0	0	110.8	V868 R869 L889	V868-V872 PolarHBondContact O-N 3.14Å; R869-V872 PolarHBondContact O-N 2.95Å; R869-V872 VanDerWaalsContact O-N 3.14Å; V872-L889 HydrophobicContact CG2-CB 3.74Å; V872-L889 HydrophobicContact CG2-CD1 4.16Å; V872-L889 HydrophobicContact CG2-CG 4.42Å
873	G	72.7	Confident	72.3	Confident	56 Å²	56	72.7 Å²	72.7	58%	0.577	38%	0.376	S	S	*	.	H	α-helix	trans	-68	-40.7	174.2	0	0	0	0	0	114.2	R869 V871 L875	R869-G873 PolarHBondContact O-N 2.92Å; V871-G873 PolarHBondContact O-N 2.97Å; V871-G873 VanDerWaalsContact O-N 3.14Å; G873-L875 VanDerWaalsContact C-N 3.34Å; G873-L875 PolarHBondContact O-N 2.92Å
874	A	70.2	Confident	71.6	Confident	75 Å²	75	66.1 Å²	66.1	62%	0.62	35%	0.351	S	S	*	.	H	α-helix	trans	-68	-30.8	-179.3	0	0	0	0	0	113.4	S870 V871 Q876	S870-A874 VanDerWaalsContact O-CB 3.29Å; S870-A874 WeakPolarHBondContact O-CB 3.48Å; S870-A874 PolarHBondContact O-N 2.63Å; V871-A874 WeakPolarHBondContact O-CA 3.47Å; V871-A874 PolarHBondContact O-N 2.67Å; A874-Q876 PolarHBondContact O-N 2.81Å; A874-Q876 VanDerWaalsContact O-N 3.09Å
875	L	67	Low	71	Confident	50 Å²	50	68.8 Å²	68.8	26%	0.262	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-5	-177.6	-64.2	178.5	0	0	0	114.8	L820 V871 G873 L877 L889	L820-L875 HydrophobicContact CD1-CD1 3.34Å; L820-L875 HydrophobicContact CD1-CD2 3.01Å; L820-L875 HydrophobicContact CD1-CG 3.72Å; L820-L875 HydrophobicContact CD2-CD1 3.9Å; L820-L875 HydrophobicContact CG-CD1 4.28Å; L820-L875 HydrophobicContact CG-CD2 4.48Å; V871-L875 HydrophobicContact CG1-CD1 3.9Å; V871-L875 HydrophobicContact CG1-CD2 4.42Å; V871-L875 HydrophobicContact CG1-CG 3.95Å; V871-L875 WeakPolarHBondContact O-CG 3.5Å; V871-L875 PolarHBondContact O-N 3.01Å; G873-L875 VanDerWaalsContact C-N 3.34Å; G873-L875 PolarHBondContact O-N 2.92Å; L875-L877 HydrophobicContact CB-CD1 3.86Å; L875-L877 HydrophobicContact CB-CG 3.78Å; L875-L877 HydrophobicContact CD1-CD1 3.89Å; L875-L877 PolarHBondContact O-N 3.02Å; L875-L889 HydrophobicContact CD1-CD1 4Å
876	Q	56	Low	70.3	Confident	177 Å²	177	69.1 Å²	69.1	83%	0.827	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.5	25.9	-176.9	-59.5	-175.7	2.2	0	0	112.6	A874 D878	A874-Q876 PolarHBondContact O-N 2.81Å; A874-Q876 VanDerWaalsContact O-N 3.09Å; Q876-D878 PolarHBondContact O-N 3.11Å
877	L	58.4	Low	70.1	Confident	43 Å²	43	65.9 Å²	65.9	23%	0.225	35%	0.349	C	S	.	.			trans	-59.1	111.2	174.4	-70.2	162.5	0	0	0	104	L875 Q879 I886 L889	L875-L877 HydrophobicContact CB-CD1 3.86Å; L875-L877 HydrophobicContact CB-CG 3.78Å; L875-L877 HydrophobicContact CD1-CD1 3.89Å; L875-L877 PolarHBondContact O-N 3.02Å; L877-Q879 PolarHBondContact O-N 2.82Å; L877-I886 HydrophobicContact CB-CD1 3.74Å; L877-I886 HydrophobicContact CB-CG1 3.74Å; L877-I886 HydrophobicContact CD1-CG1 3.81Å; L877-I886 HydrophobicContact CG-CG1 4.29Å; L877-L889 HydrophobicContact CD1-CD1 4.06Å
878	D	51.5	Low	70	Confident	93 Å²	93	63 Å²	63	50%	0.497	34%	0.337	S	S	.	.			trans	-53	111.7	-175.5	176	11.6	0	0	0	106.6	Q876 K880 S881	Q876-D878 PolarHBondContact O-N 3.11Å; D878-K880 PolarHBondContact O-N 3.12Å; D878-K880 WeakPolarHBondContact OD1-CB 3.35Å; D878-K880 PolarHBondContact OD1-N 2.93Å; D878-K880 VanDerWaalsContact OD1-N 3.14Å; D878-S881 CarbonylContact O-C 3.18Å; D878-S881 WeakPolarHBondContact O-CA 3.43Å; D878-S881 WeakPolarHBondContact O-CB 3.27Å; D878-S881 PolarHBondContact O-N 3.24Å; D878-S881 VanDerWaalsContact O-O 3.1Å; D878-S881 PolarHBondContact O-OG 3.34Å
879	Q	51.8	Low	70	Confident	180 Å²	180	63 Å²	63	84%	0.841	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-21.1	-176.7	-71.9	-179.1	-9.2	0	0	111.1	L877	L877-Q879 PolarHBondContact O-N 2.82Å
880	K	50.1	Low	70.1	Confident	167 Å²	167	60.7 Å²	60.7	73%	0.726	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-34.5	173.1	-62.7	-171	172	-163.6	0	113.2	D878 Q882	D878-K880 PolarHBondContact O-N 3.12Å; D878-K880 WeakPolarHBondContact OD1-CB 3.35Å; D878-K880 PolarHBondContact OD1-N 2.93Å; D878-K880 VanDerWaalsContact OD1-N 3.14Å; K880-Q882 PolarHBondContact O-N 3.05Å
881	S	48.9	Very low	70.6	Confident	42 Å²	42	58 Å²	58	29%	0.294	31%	0.31	S	S	.	.	S	Bend	trans	-73.3	94.1	170.8	74	0	0	0	0	107.9	D878 S883 I886	D878-S881 CarbonylContact O-C 3.18Å; D878-S881 WeakPolarHBondContact O-CA 3.43Å; D878-S881 WeakPolarHBondContact O-CB 3.27Å; D878-S881 PolarHBondContact O-N 3.24Å; D878-S881 VanDerWaalsContact O-O 3.1Å; D878-S881 PolarHBondContact O-OG 3.34Å; S881-S883 PolarHBondContact O-N 2.91Å; S881-I886 VanDerWaalsContact O-CD1 3.25Å; S881-I886 WeakPolarHBondContact O-CD1 3.38Å
882	Q	56.9	Low	71.3	Confident	102 Å²	102	57.7 Å²	57.7	48%	0.477	31%	0.308	S	S	.	.			trans	-66.5	66.4	176.3	-67.3	-177.8	-20.8	0	0	110.6	K880 W887	K880-Q882 PolarHBondContact O-N 3.05Å; Q882-W887 HydrophobicContact CB-CZ2 4.04Å; Q882-W887 HydrophobicContact CG-CZ2 3.98Å
883	S	68.3	Low	72.3	Confident	20 Å²	20	56.4 Å²	56.4	14%	0.14	30%	0.3	C	S	.	.			trans	-77.3	144.7	-176.3	73.5	0	0	0	0	109.9	S881 H885 I886 W887	S881-S883 PolarHBondContact O-N 2.91Å; S883-H885 PolarHBondContact O-N 3.41Å; S883-I886 PolarHBondContact O-N 3.5Å; S883-I886 WeakPolarHBondContact OG-CG1 3.44Å; S883-I886 PolarHBondContact OG-N 2.86Å; S883-W887 PolarHBondContact O-N 2.85Å
884	R	78.5	Confident	73.4	Confident	22 Å²	22	53.8 Å²	53.8	8%	0.083	27%	0.273	C	S	.	.	H	α-helix	trans	-56.4	-24.2	176	-64.4	-170.6	-174.9	84.7	7	112.9	N413 W579 Q597 A888	N413-R884 PolarHBondContact OD1-NH2 3.18Å; W579-R884 VanDerWaalsContact CE2-CD 3.47Å; W579-R884 HydrophobicContact CH2-CB 4.14Å; W579-R884 HydrophobicContact CZ2-CB 4.12Å; W579-R884 HydrophobicContact CZ2-CG 4.37Å; Q597-R884 PolarHBondContact NE2-O 3.2Å; R884-A888 PolarHBondContact O-N 3.4Å; R884-A888 VanDerWaalsContact O-N 3.13Å
885	H	78.8	Confident	74.6	Confident	56 Å²	56	50.8 Å²	50.8	26%	0.259	25%	0.246	S	C	.	.	H	α-helix	trans	-66.8	-45.3	175.9	-54.1	-49.8	0	0	0	112.4	Y827 S883 W887 A888 L889	Y827-H885 HydrophobicContact CD1-CB 3.68Å; Y827-H885 AromaticContact CD1-ND1 3.71Å; Y827-H885 HydrophobicContact CD2-CB 4.37Å; Y827-H885 AromaticContact CD2-CE1 3.5Å; Y827-H885 VanDerWaalsContact CD2-CE1 3.5Å; Y827-H885 WeakPolarHBondContact CD2-CE1 3.27Å; Y827-H885 AromaticContact CD2-CG 3.84Å; Y827-H885 AromaticContact CD2-ND1 2.89Å; Y827-H885 WeakPolarHBondContact CD2-ND1 3.33Å; Y827-H885 HydrophobicContact CE1-CB 3.56Å; Y827-H885 AromaticContact CE1-ND1 3.99Å; Y827-H885 HydrophobicContact CE2-CB 4.23Å; Y827-H885 AromaticContact CE2-CE1 3.73Å; Y827-H885 AromaticContact CE2-CG 3.77Å; Y827-H885 AromaticContact CE2-ND1 3.2Å; Y827-H885 WeakPolarHBondContact CE2-ND1 3.34Å; Y827-H885 HydrophobicContact CG-CB 4.05Å; Y827-H885 AromaticContact CG-CG 3.92Å; Y827-H885 AromaticContact CG-ND1 3.11Å; Y827-H885 AromaticContact CZ-CG 3.83Å; Y827-H885 AromaticContact CZ-ND1 3.72Å; S883-H885 PolarHBondContact O-N 3.41Å; H885-W887 VanDerWaalsContact C-N 3.34Å; H885-W887 PolarHBondContact O-N 3.49Å; H885-A888 PolarHBondContact O-N 3.16Å; H885-L889 PolarHBondContact O-N 3.27Å; H885-L889 VanDerWaalsContact O-N 3.1Å
886	I	81.3	Confident	76	Confident	18 Å²	18	48.4 Å²	48.4	9%	0.092	23%	0.233	C	C	.	.	H	α-helix	trans	-60.7	-47	175.8	-67.4	163.7	0	0	0	109.6	L877 S881 S883 A888 L889 D890	L877-I886 HydrophobicContact CB-CD1 3.74Å; L877-I886 HydrophobicContact CB-CG1 3.74Å; L877-I886 HydrophobicContact CD1-CG1 3.81Å; L877-I886 HydrophobicContact CG-CG1 4.29Å; S881-I886 VanDerWaalsContact O-CD1 3.25Å; S881-I886 WeakPolarHBondContact O-CD1 3.38Å; S883-I886 PolarHBondContact O-N 3.5Å; S883-I886 WeakPolarHBondContact OG-CG1 3.44Å; S883-I886 PolarHBondContact OG-N 2.86Å; I886-A888 PolarHBondContact O-N 3.07Å; I886-L889 PolarHBondContact O-N 2.64Å; I886-L889 VanDerWaalsContact O-N 3.09Å; I886-D890 PolarHBondContact O-N 3.09Å
887	W	86.8	Confident	78	Confident	28 Å²	28	40.5 Å²	40.5	11%	0.106	20%	0.196	C	C	.	.	H	α-helix	trans	-64.8	-26.6	179.9	-56.9	129.2	0	0	0	114.1	Q597 S598 N600 R601 Q882 S883 H885 R891	Q597-W887 HydrophobicContact CB-CB 4.3Å; Q597-W887 HydrophobicContact CG-CB 4.36Å; S598-W887 WeakPolarHBondContact CB-O 3.5Å; S598-W887 PolarHBondContact N-O 2.7Å; S598-W887 VanDerWaalsContact N-O 3.07Å; N600-W887 HydrophobicContact CB-CE3 4.3Å; N600-W887 HydrophobicContact CB-CZ3 3.7Å; N600-W887 WeakPolarHBondContact O-CH2 3.49Å; R601-W887 HydrophobicContact CB-CD2 4.26Å; R601-W887 HydrophobicContact CB-CG 4.27Å; R601-W887 HydrophobicContact CG-CG 4.36Å; Q882-W887 HydrophobicContact CB-CZ2 4.04Å; Q882-W887 HydrophobicContact CG-CZ2 3.98Å; S883-W887 PolarHBondContact O-N 2.85Å; H885-W887 VanDerWaalsContact C-N 3.34Å; H885-W887 PolarHBondContact O-N 3.49Å; W887-R891 WeakPolarHBondContact O-CB 3.11Å; W887-R891 PolarHBondContact O-N 3.25Å
888	A	87.4	Confident	79.8	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-74.2	-38.6	172.9	0	0	0	0	0	112.2	Y827 L830 R884 H885 I886 R891 E892	Y827-A888 HydrophobicContact CD1-CB 4.26Å; Y827-A888 WeakPolarHBondContact O-CB 3.42Å; L830-A888 HydrophobicContact CD2-CB 4.42Å; R884-A888 PolarHBondContact O-N 3.4Å; R884-A888 VanDerWaalsContact O-N 3.13Å; H885-A888 PolarHBondContact O-N 3.16Å; I886-A888 PolarHBondContact O-N 3.07Å; A888-R891 WeakPolarHBondContact O-CB 3.49Å; A888-R891 PolarHBondContact O-N 3.05Å; A888-E892 PolarHBondContact O-N 3.42Å
889	L	85.4	Confident	81.9	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-70.1	-43	175.3	-70.8	163.3	0	0	0	111.6	Y816 Y827 L830 V872 L875 L877 H885 I886 R891 E892	Y816-L889 HydrophobicContact CE1-CD2 3.98Å; Y827-L889 HydrophobicContact CE1-CD1 4.37Å; L830-L889 HydrophobicContact CD2-CD2 3.71Å; L830-L889 HydrophobicContact CD2-CG 4.16Å; V872-L889 HydrophobicContact CG2-CB 3.74Å; V872-L889 HydrophobicContact CG2-CD1 4.16Å; V872-L889 HydrophobicContact CG2-CG 4.42Å; L875-L889 HydrophobicContact CD1-CD1 4Å; L877-L889 HydrophobicContact CD1-CD1 4.06Å; H885-L889 PolarHBondContact O-N 3.27Å; H885-L889 VanDerWaalsContact O-N 3.1Å; I886-L889 PolarHBondContact O-N 2.64Å; I886-L889 VanDerWaalsContact O-N 3.09Å; L889-R891 PolarHBondContact O-N 3.04Å; L889-E892 VanDerWaalsContact O-CB 3.3Å; L889-E892 WeakPolarHBondContact O-CB 3.34Å; L889-E892 PolarHBondContact O-N 3.07Å
890	D	90.2	Very high	84.1	Confident	36 Å²	36	29.5 Å²	29.5	19%	0.193	14%	0.139	C	C	.	.	H	α-helix	trans	-58.8	-34	173.7	-84.3	1.3	0	0	0	111.4	I886 E892 V893 E894 F933	I886-D890 PolarHBondContact O-N 3.09Å; D890-E892 VanDerWaalsContact C-N 3.31Å; D890-E892 PolarHBondContact O-N 2.83Å; D890-V893 PolarHBondContact O-N 3.43Å; D890-E894 WeakPolarHBondContact O-CB 3.46Å; D890-E894 PolarHBondContact O-N 2.68Å; D890-F933 HydrophobicContact CB-CE1 4.42Å; D890-F933 WeakPolarHBondContact O-CE1 3.42Å; D890-F933 WeakPolarHBondContact O-CZ 3.26Å
891	R	92.9	Very high	86.3	Confident	16 Å²	16	21.7 Å²	21.7	6%	0.06	11%	0.105	C	C	.	.	H	α-helix	trans	-65.4	-30.1	175.9	-173.3	57.2	-174.6	158.7	13.9	113.1	G831 W887 A888 L889 E894 R895 E898	G831-R891 VanDerWaalsContact O-CG 3.27Å; G831-R891 WeakPolarHBondContact O-CG 2.96Å; W887-R891 WeakPolarHBondContact O-CB 3.11Å; W887-R891 PolarHBondContact O-N 3.25Å; A888-R891 WeakPolarHBondContact O-CB 3.49Å; A888-R891 PolarHBondContact O-N 3.05Å; L889-R891 PolarHBondContact O-N 3.04Å; R891-E894 WeakPolarHBondContact CD-OE2 3.45Å; R891-E894 IonicContact NH1-OE1 3.44Å; R891-E894 PolarHBondContact NH1-OE1 3.02Å; R891-E894 IonicContact NH1-OE2 2.63Å; R891-E894 PolarHBondContact NH1-OE2 3.3Å; R891-E894 VanDerWaalsContact NH1-OE2 3.13Å; R891-E894 PolarHBondContact O-N 3.44Å; R891-R895 WeakPolarHBondContact O-CB 3.27Å; R891-R895 PolarHBondContact O-N 3.11Å; R891-E898 IonicContact CZ-OE1 2.64Å; R891-E898 VanDerWaalsContact CZ-OE1 3.23Å; R891-E898 IonicContact CZ-OE2 3.6Å; R891-E898 IonicContact NH1-OE1 2.68Å; R891-E898 PolarHBondContact NH1-OE1 3.2Å; R891-E898 VanDerWaalsContact NH2-CD 3.35Å; R891-E898 IonicContact NH2-OE1 3.22Å; R891-E898 PolarHBondContact NH2-OE1 2.9Å; R891-E898 IonicContact NH2-OE2 2.86Å; R891-E898 PolarHBondContact NH2-OE2 3.43Å; R891-E898 VanDerWaalsContact NH2-OE2 3.1Å
892	E	91.5	Very high	88.4	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-61.6	-47.8	172	-68.7	-68.8	98.6	0	0	111.1	L830 G834 S835 V838 V868 A888 L889 D890 E894 R895 L896	L830-E892 HydrophobicContact CD1-CG 3.61Å; L830-E892 WeakPolarHBondContact CD1-OE1 3.35Å; L830-E892 HydrophobicContact CD2-CG 4Å; L830-E892 HydrophobicContact CG-CG 3.67Å; L830-E892 VanDerWaalsContact O-OE1 3.08Å; G834-E892 WeakPolarHBondContact CA-OE1 3.48Å; S835-E892 VanDerWaalsContact CB-OE2 3.23Å; S835-E892 WeakPolarHBondContact CB-OE2 3.43Å; S835-E892 PolarHBondContact N-OE1 2.76Å; S835-E892 PolarHBondContact N-OE2 3.4Å; S835-E892 PolarHBondContact OG-OE2 3.11Å; V838-E892 WeakPolarHBondContact CB-OE2 3.37Å; V838-E892 HydrophobicContact CG2-CB 4.36Å; V838-E892 WeakPolarHBondContact CG2-OE2 3.42Å; V868-E892 HydrophobicContact CG1-CB 4.12Å; A888-E892 PolarHBondContact O-N 3.42Å; L889-E892 VanDerWaalsContact O-CB 3.3Å; L889-E892 WeakPolarHBondContact O-CB 3.34Å; L889-E892 PolarHBondContact O-N 3.07Å; D890-E892 VanDerWaalsContact C-N 3.31Å; D890-E892 PolarHBondContact O-N 2.83Å; E892-E894 VanDerWaalsContact C-N 3.34Å; E892-R895 PolarHBondContact O-N 3.48Å; E892-R895 IonicContact OE1-CZ 3.83Å; E892-R895 IonicContact OE1-NH1 3.83Å; E892-R895 PolarHBondContact OE1-NH1 2.92Å; E892-R895 IonicContact OE1-NH2 2.9Å; E892-L896 WeakPolarHBondContact O-CG 3.27Å; E892-L896 PolarHBondContact O-N 3.41Å; E892-L896 VanDerWaalsContact O-N 3.11Å
893	V	94.2	Very high	90.1	Very high	4 Å²	4	17.1 Å²	17.1	2%	0.024	8%	0.08	C	C	.	.	H	α-helix	trans	-65.1	-42.1	179.9	-179.1	0	0	0	0	110.2	R865 V868 R869 D890 R895 L896 W897 F933	R865-V893 HydrophobicContact CB-CG1 4.32Å; R865-V893 HydrophobicContact CG-CG1 4.02Å; V868-V893 HydrophobicContact CB-CG2 4.08Å; V868-V893 HydrophobicContact CG1-CG2 3.68Å; R869-V893 HydrophobicContact CG-CG2 4.3Å; D890-V893 PolarHBondContact O-N 3.43Å; V893-R895 PolarHBondContact O-N 3.31Å; V893-L896 WeakPolarHBondContact O-CB 3.2Å; V893-L896 PolarHBondContact O-N 3.03Å; V893-W897 PolarHBondContact O-N 3.4Å; V893-F933 HydrophobicContact CB-CE2 4.48Å; V893-F933 HydrophobicContact CB-CZ 3.98Å; V893-F933 HydrophobicContact CG1-CE2 3.98Å; V893-F933 HydrophobicContact CG1-CZ 3.92Å
894	E	96	Very high	91.2	Very high	1 Å²	1	16.3 Å²	16.3	1%	0.005	7%	0.074	C	C	.	.	H	α-helix	trans	-59.5	-44.4	175	-166.3	174.3	-171.8	0	0	111.9	S598 S599 D890 R891 E892 L896 W897 E898 F933 H936	S598-E894 WeakPolarHBondContact CA-OE2 3.23Å; S598-E894 PolarHBondContact OG-OE2 3.49Å; S599-E894 WeakPolarHBondContact CB-OE1 3.34Å; S599-E894 PolarHBondContact N-OE1 3.1Å; S599-E894 PolarHBondContact N-OE2 3.41Å; S599-E894 PolarHBondContact OG-OE1 3.19Å; D890-E894 WeakPolarHBondContact O-CB 3.46Å; D890-E894 PolarHBondContact O-N 2.68Å; R891-E894 WeakPolarHBondContact CD-OE2 3.45Å; R891-E894 IonicContact NH1-OE1 3.44Å; R891-E894 PolarHBondContact NH1-OE1 3.02Å; R891-E894 IonicContact NH1-OE2 2.63Å; R891-E894 PolarHBondContact NH1-OE2 3.3Å; R891-E894 VanDerWaalsContact NH1-OE2 3.13Å; R891-E894 PolarHBondContact O-N 3.44Å; E892-E894 VanDerWaalsContact C-N 3.34Å; E894-L896 VanDerWaalsContact C-N 3.33Å; E894-L896 PolarHBondContact O-N 3.44Å; E894-W897 WeakPolarHBondContact O-CB 3.44Å; E894-W897 PolarHBondContact O-N 3.21Å; E894-W897 VanDerWaalsContact O-N 3.1Å; E894-E898 PolarHBondContact O-N 2.99Å; E894-F933 HydrophobicContact CB-CD1 3.87Å; E894-F933 HydrophobicContact CB-CD2 4.4Å; E894-F933 HydrophobicContact CB-CE1 3.58Å; E894-F933 HydrophobicContact CB-CE2 4.16Å; E894-F933 HydrophobicContact CB-CG 4.28Å; E894-F933 HydrophobicContact CB-CZ 3.74Å; E894-F933 HydrophobicContact CG-CD1 3.77Å; E894-F933 HydrophobicContact CG-CD2 4.31Å; E894-F933 HydrophobicContact CG-CE1 4.04Å; E894-F933 HydrophobicContact CG-CG 3.92Å; E894-F933 HydrophobicContact CG-CZ 4.43Å; E894-H936 IonicContact OE1-CD2 3.74Å; E894-H936 PolarHBondContact OE1-CD2 3.4Å; E894-H936 IonicContact OE1-CG 2.77Å; E894-H936 IonicContact OE1-NE2 2.56Å
895	R	95.8	Very high	91.7	Very high	12 Å²	12	19.3 Å²	19.3	5%	0.045	9%	0.085	C	C	.	.	H	α-helix	trans	-62.5	-38.7	177.9	-169.8	-178.7	-60.2	104.3	-10.7	112.3	L830 G831 W832 G834 R891 E892 V893 W897 E898 W899	L830-R895 PolarHBondContact O-NH2 3.49Å; G831-R895 PolarHBondContact O-NH2 2.92Å; W832-R895 PolarHBondContact O-NH2 3.23Å; G834-R895 VanDerWaalsContact CA-CZ 3.5Å; G834-R895 VanDerWaalsContact CA-NH1 3.29Å; G834-R895 VanDerWaalsContact N-NH2 3.18Å; R891-R895 WeakPolarHBondContact O-CB 3.27Å; R891-R895 PolarHBondContact O-N 3.11Å; E892-R895 PolarHBondContact O-N 3.48Å; E892-R895 IonicContact OE1-CZ 3.83Å; E892-R895 IonicContact OE1-NH1 3.83Å; E892-R895 PolarHBondContact OE1-NH1 2.92Å; E892-R895 IonicContact OE1-NH2 2.9Å; V893-R895 PolarHBondContact O-N 3.31Å; R895-W897 VanDerWaalsContact C-N 3.29Å; R895-W897 PolarHBondContact O-N 3.13Å; R895-E898 WeakPolarHBondContact O-CB 3.48Å; R895-E898 PolarHBondContact O-N 2.99Å; R895-W899 VanDerWaalsContact CD-CH2 3.49Å; R895-W899 HydrophobicContact CG-CD2 4.06Å; R895-W899 HydrophobicContact CG-CE3 4.25Å; R895-W899 HydrophobicContact CG-CH2 3.95Å; R895-W899 HydrophobicContact CG-CZ2 3.71Å; R895-W899 HydrophobicContact CG-CZ3 4.22Å; R895-W899 WeakPolarHBondContact O-CB 3.29Å; R895-W899 PolarHBondContact O-N 3Å
896	L	96.3	Very high	92.1	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-61.6	-38.7	174.3	-71	173.5	0	0	0	111.6	V838 L841 Y861 R865 E892 V893 E894 W899 E900	V838-L896 HydrophobicContact CB-CD2 4.49Å; V838-L896 HydrophobicContact CG1-CD2 3.76Å; V838-L896 HydrophobicContact CG1-CG 4.03Å; V838-L896 HydrophobicContact CG2-CD1 4.29Å; V838-L896 HydrophobicContact CG2-CD2 4.39Å; V838-L896 HydrophobicContact CG2-CG 4.37Å; L841-L896 HydrophobicContact CD2-CD2 3.83Å; Y861-L896 HydrophobicContact CD1-CD2 4.14Å; R865-L896 HydrophobicContact CG-CB 3.92Å; R865-L896 HydrophobicContact CG-CD1 3.78Å; E892-L896 WeakPolarHBondContact O-CG 3.27Å; E892-L896 PolarHBondContact O-N 3.41Å; E892-L896 VanDerWaalsContact O-N 3.11Å; V893-L896 WeakPolarHBondContact O-CB 3.2Å; V893-L896 PolarHBondContact O-N 3.03Å; E894-L896 VanDerWaalsContact C-N 3.33Å; E894-L896 PolarHBondContact O-N 3.44Å; L896-W899 HydrophobicContact CD2-CE3 4.16Å; L896-W899 HydrophobicContact CD2-CZ3 4.29Å; L896-E900 WeakPolarHBondContact O-CB 3.44Å; L896-E900 PolarHBondContact O-N 3.26Å
897	W	97.5	Very high	92.3	Very high	11 Å²	11	17.4 Å²	17.4	4%	0.042	8%	0.077	C	C	.	.	H	α-helix	trans	-66	-45.5	172.4	-78	119.1	0	0	0	112.4	R865 V893 E894 R895 W899 E900 I901 D928 A929 E932 F933 F939	R865-W897 VanDerWaalsContact CD-CE2 3.41Å; R865-W897 VanDerWaalsContact CD-NE1 3.28Å; R865-W897 VanDerWaalsContact NE-CE2 3.33Å; R865-W897 VanDerWaalsContact NE-CZ2 3.34Å; R865-W897 VanDerWaalsContact NH2-CH2 3.33Å; V893-W897 PolarHBondContact O-N 3.4Å; E894-W897 WeakPolarHBondContact O-CB 3.44Å; E894-W897 PolarHBondContact O-N 3.21Å; E894-W897 VanDerWaalsContact O-N 3.1Å; R895-W897 VanDerWaalsContact C-N 3.29Å; R895-W897 PolarHBondContact O-N 3.13Å; W897-W899 PolarHBondContact O-N 3.27Å; W897-E900 PolarHBondContact O-N 2.98Å; W897-I901 WeakPolarHBondContact O-CB 3.28Å; W897-I901 WeakPolarHBondContact O-CG1 3.42Å; W897-I901 PolarHBondContact O-N 3.2Å; W897-D928 HydrophobicContact CH2-CB 3.94Å; W897-D928 HydrophobicContact CZ2-CB 4.45Å; W897-A929 HydrophobicContact CB-CB 4.15Å; W897-A929 HydrophobicContact CD2-CB 3.72Å; W897-A929 HydrophobicContact CE3-CB 3.88Å; W897-A929 HydrophobicContact CG-CB 3.89Å; W897-A929 HydrophobicContact CZ3-CB 4.46Å; W897-E932 PolarHBondContact NE1-OE2 3.33Å; W897-F933 AromaticContact CD1-CD2 3.81Å; W897-F933 AromaticContact CD1-CE2 3.48Å; W897-F933 VanDerWaalsContact CD1-CE2 3.48Å; W897-F933 AromaticContact NE1-CE2 3.89Å; W897-F939 HydrophobicContact CB-CE2 4Å; W897-F939 HydrophobicContact CB-CZ 3.76Å
898	E	96.3	Very high	92.1	Very high	43 Å²	43	19 Å²	19	20%	0.201	9%	0.087	C	C	.	.	H	α-helix	trans	-53.8	-45.9	177.2	-72.7	174.2	170.8	0	0	110.6	R891 E894 R895 D902 H936 F939	R891-E898 IonicContact CZ-OE1 2.64Å; R891-E898 VanDerWaalsContact CZ-OE1 3.23Å; R891-E898 IonicContact CZ-OE2 3.6Å; R891-E898 IonicContact NH1-OE1 2.68Å; R891-E898 PolarHBondContact NH1-OE1 3.2Å; R891-E898 VanDerWaalsContact NH2-CD 3.35Å; R891-E898 IonicContact NH2-OE1 3.22Å; R891-E898 PolarHBondContact NH2-OE1 2.9Å; R891-E898 IonicContact NH2-OE2 2.86Å; R891-E898 PolarHBondContact NH2-OE2 3.43Å; R891-E898 VanDerWaalsContact NH2-OE2 3.1Å; E894-E898 PolarHBondContact O-N 2.99Å; R895-E898 WeakPolarHBondContact O-CB 3.48Å; R895-E898 PolarHBondContact O-N 2.99Å; E898-D902 VanDerWaalsContact O-CB 3.23Å; E898-D902 WeakPolarHBondContact O-CB 3.28Å; E898-D902 PolarHBondContact O-N 3.37Å; E898-H936 IonicContact OE1-NE2 2.93Å; E898-H936 PolarHBondContact OE1-NE2 2.81Å; E898-H936 VanDerWaalsContact OE1-NE2 3.16Å; E898-F939 HydrophobicContact CB-CZ 4.42Å; E898-F939 HydrophobicContact CG-CE1 4Å; E898-F939 HydrophobicContact CG-CZ 3.78Å
899	W	96.1	Very high	91.7	Very high	36 Å²	36	24.6 Å²	24.6	14%	0.136	12%	0.116	C	C	.	.	H	α-helix	trans	-69.6	-42.3	178.8	-75.5	-18.1	0	0	0	114.9	V838 M839 H842 Y861 R895 L896 W897 I901 D902 L903	V838-W899 HydrophobicContact CB-CZ3 4.49Å; V838-W899 HydrophobicContact CG1-CE3 4.28Å; V838-W899 HydrophobicContact CG1-CH2 3.75Å; V838-W899 HydrophobicContact CG1-CZ3 3.29Å; V838-W899 WeakPolarHBondContact O-CZ3 3.4Å; M839-W899 HydrophobicContact CG-CH2 4.39Å; M839-W899 HydrophobicContact SD-CH2 3.39Å; M839-W899 WeakPolarHBondContact SD-CH2 3.46Å; M839-W899 HydrophobicContact SD-CZ2 3.67Å; H842-W899 HydrophobicContact CB-CD2 4.06Å; H842-W899 HydrophobicContact CB-CE3 3.46Å; H842-W899 VanDerWaalsContact CB-CE3 3.46Å; H842-W899 HydrophobicContact CB-CH2 4.11Å; H842-W899 HydrophobicContact CB-CZ3 3.46Å; H842-W899 VanDerWaalsContact CB-CZ3 3.46Å; H842-W899 VanDerWaalsContact CE1-CB 3.44Å; H842-W899 WeakPolarHBondContact CE1-CB 3.21Å; H842-W899 AromaticContact CE1-CD1 3.78Å; H842-W899 AromaticContact CE1-CD2 3.79Å; H842-W899 AromaticContact CE1-CG 3.36Å; H842-W899 AromaticContact CG-CD2 3.62Å; H842-W899 AromaticContact CG-CE3 3.53Å; H842-W899 AromaticContact CG-CZ3 3.96Å; H842-W899 VanDerWaalsContact ND1-CB 3.27Å; H842-W899 WeakPolarHBondContact ND1-CB 3.04Å; H842-W899 AromaticContact ND1-CD2 3.27Å; H842-W899 VanDerWaalsContact ND1-CD2 3.27Å; H842-W899 AromaticContact ND1-CE3 3.4Å; H842-W899 AromaticContact ND1-CG 3.23Å; Y861-W899 HydrophobicContact CE1-CB 4.17Å; R895-W899 VanDerWaalsContact CD-CH2 3.49Å; R895-W899 HydrophobicContact CG-CD2 4.06Å; R895-W899 HydrophobicContact CG-CE3 4.25Å; R895-W899 HydrophobicContact CG-CH2 3.95Å; R895-W899 HydrophobicContact CG-CZ2 3.71Å; R895-W899 HydrophobicContact CG-CZ3 4.22Å; R895-W899 WeakPolarHBondContact O-CB 3.29Å; R895-W899 PolarHBondContact O-N 3Å; L896-W899 HydrophobicContact CD2-CE3 4.16Å; L896-W899 HydrophobicContact CD2-CZ3 4.29Å; W897-W899 PolarHBondContact O-N 3.27Å; W899-I901 VanDerWaalsContact C-N 3.34Å; W899-D902 PolarHBondContact O-N 2.88Å; W899-L903 WeakPolarHBondContact O-CB 3.32Å; W899-L903 PolarHBondContact O-N 3.45Å
900	E	96.8	Very high	91.2	Very high	6 Å²	6	25 Å²	25	3%	0.028	12%	0.118	C	C	.	.	H	α-helix	trans	-59.5	-47.9	174.7	-177.3	-176.5	142.5	0	0	110.5	F858 Y861 R865 L896 W897 L903 L904 S925	F858-E900 HydrophobicContact CD1-CG 4.22Å; F858-E900 HydrophobicContact CE1-CG 4.44Å; Y861-E900 WeakPolarHBondContact CB-OE2 3.5Å; Y861-E900 HydrophobicContact CD2-CB 3.64Å; Y861-E900 HydrophobicContact CD2-CG 3.73Å; Y861-E900 HydrophobicContact CE2-CB 3.97Å; Y861-E900 HydrophobicContact CE2-CG 4.28Å; Y861-E900 HydrophobicContact CG-CB 3.95Å; Y861-E900 HydrophobicContact CG-CG 4.31Å; R865-E900 IonicContact CZ-OE2 3.94Å; R865-E900 VanDerWaalsContact CZ-OE2 3.22Å; R865-E900 IonicContact NH1-OE2 2.65Å; R865-E900 PolarHBondContact NH1-OE2 3.37Å; R865-E900 IonicContact NH2-OE2 3.7Å; R865-E900 PolarHBondContact NH2-OE2 2.92Å; L896-E900 WeakPolarHBondContact O-CB 3.44Å; L896-E900 PolarHBondContact O-N 3.26Å; W897-E900 PolarHBondContact O-N 2.98Å; E900-L903 PolarHBondContact O-N 2.79Å; E900-L904 HydrophobicContact CG-CD1 4.37Å; E900-L904 WeakPolarHBondContact O-CB 3.25Å; E900-L904 WeakPolarHBondContact O-CG 3.26Å; E900-L904 PolarHBondContact O-N 3.48Å; E900-S925 PolarHBondContact OE1-OG 3.13Å
901	I	96	Very high	89.9	Confident	2 Å²	2	30.3 Å²	30.3	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-66.1	-41.5	-179.7	-71.4	165.9	0	0	0	110.8	W897 W899 L904 R905 L922 V926 A929 F939 L942	W897-I901 WeakPolarHBondContact O-CB 3.28Å; W897-I901 WeakPolarHBondContact O-CG1 3.42Å; W897-I901 PolarHBondContact O-N 3.2Å; W899-I901 VanDerWaalsContact C-N 3.34Å; I901-L904 WeakPolarHBondContact O-CB 3.4Å; I901-L904 PolarHBondContact O-N 2.88Å; I901-R905 VanDerWaalsContact O-CG 3.25Å; I901-R905 WeakPolarHBondContact O-CG 3.4Å; I901-R905 PolarHBondContact O-N 3.26Å; I901-L922 HydrophobicContact CG2-CD1 4.19Å; I901-V926 HydrophobicContact CD1-CG2 3.96Å; I901-V926 HydrophobicContact CG1-CG2 4.1Å; I901-V926 HydrophobicContact CG2-CG2 4.02Å; I901-A929 HydrophobicContact CD1-CB 3.79Å; I901-F939 HydrophobicContact CD1-CD1 3.76Å; I901-F939 HydrophobicContact CD1-CE1 3.49Å; I901-F939 VanDerWaalsContact CD1-CE1 3.49Å; I901-F939 HydrophobicContact CD1-CE2 4.31Å; I901-F939 HydrophobicContact CD1-CG 4.31Å; I901-F939 HydrophobicContact CD1-CZ 3.8Å; I901-L942 HydrophobicContact CG2-CD2 3.34Å
902	D	93.3	Very high	88.3	Confident	44 Å²	44	36.7 Å²	36.7	24%	0.235	17%	0.168	C	C	.	.	H	α-helix	trans	-61.7	-45	175.2	-92	-0.4	0	0	0	111.5	K757 E898 W899 L904 R905 L906	K757-D902 IonicContact NZ-OD2 3.69Å; K757-D902 PolarHBondContact NZ-OD2 2.79Å; E898-D902 VanDerWaalsContact O-CB 3.23Å; E898-D902 WeakPolarHBondContact O-CB 3.28Å; E898-D902 PolarHBondContact O-N 3.37Å; W899-D902 PolarHBondContact O-N 2.88Å; D902-L904 VanDerWaalsContact C-N 3.33Å; D902-L904 PolarHBondContact O-N 3.01Å; D902-R905 WeakPolarHBondContact O-CB 3.42Å; D902-R905 PolarHBondContact O-N 2.96Å; D902-R905 IonicContact OD1-NH1 3.46Å; D902-R905 PolarHBondContact OD1-NH1 3.36Å; D902-L906 VanDerWaalsContact O-CG 3.31Å; D902-L906 WeakPolarHBondContact O-CG 3.45Å; D902-L906 PolarHBondContact O-N 3.41Å
903	L	92	Very high	86.5	Confident	4 Å²	4	40.8 Å²	40.8	2%	0.021	18%	0.183	C	C	.	.	H	α-helix	trans	-64.5	-38.6	178.1	-166.6	64.7	0	0	0	111.9	L846 Y849 I854 C857 Y861 W899 E900 L906 N907	L846-L903 HydrophobicContact CD2-CD1 3.95Å; Y849-L903 HydrophobicContact CD1-CD1 3.8Å; Y849-L903 HydrophobicContact CD2-CD1 4.15Å; Y849-L903 HydrophobicContact CD2-CD2 4.35Å; Y849-L903 HydrophobicContact CD2-CG 4.16Å; Y849-L903 HydrophobicContact CE1-CD1 4.15Å; Y849-L903 HydrophobicContact CE2-CD1 4.48Å; Y849-L903 HydrophobicContact CG-CD1 3.8Å; Y849-L903 HydrophobicContact CG-CD2 4.23Å; Y849-L903 HydrophobicContact CG-CG 4.2Å; I854-L903 HydrophobicContact CD1-CB 4.32Å; I854-L903 HydrophobicContact CD1-CD2 3.88Å; I854-L903 HydrophobicContact CD1-CG 3.82Å; C857-L903 HydrophobicContact CB-CD2 4.15Å; Y861-L903 HydrophobicContact CE2-CD2 4.12Å; W899-L903 WeakPolarHBondContact O-CB 3.32Å; W899-L903 PolarHBondContact O-N 3.45Å; E900-L903 PolarHBondContact O-N 2.79Å; L903-L906 PolarHBondContact O-N 2.97Å; L903-N907 WeakPolarHBondContact O-CB 3.26Å; L903-N907 PolarHBondContact O-N 3.28Å
904	L	91.9	Very high	84.5	Confident	3 Å²	3	49 Å²	49	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-59.5	-45.7	171.7	-81.2	170.6	0	0	0	112.2	I854 F858 E900 I901 D902 N907 M908 L917 V921 L922 S925	I854-L904 HydrophobicContact CD1-CD2 4.09Å; I854-L904 HydrophobicContact CD1-CG 4.37Å; I854-L904 HydrophobicContact CG1-CD2 3.7Å; F858-L904 HydrophobicContact CE1-CD1 3.85Å; F858-L904 HydrophobicContact CE1-CD2 3.48Å; F858-L904 VanDerWaalsContact CE1-CD2 3.48Å; F858-L904 HydrophobicContact CE1-CG 3.83Å; F858-L904 HydrophobicContact CZ-CD1 4.4Å; F858-L904 HydrophobicContact CZ-CD2 3.4Å; F858-L904 VanDerWaalsContact CZ-CD2 3.4Å; F858-L904 HydrophobicContact CZ-CG 4.26Å; E900-L904 HydrophobicContact CG-CD1 4.37Å; E900-L904 WeakPolarHBondContact O-CB 3.25Å; E900-L904 WeakPolarHBondContact O-CG 3.26Å; E900-L904 PolarHBondContact O-N 3.48Å; I901-L904 WeakPolarHBondContact O-CB 3.4Å; I901-L904 PolarHBondContact O-N 2.88Å; D902-L904 VanDerWaalsContact C-N 3.33Å; D902-L904 PolarHBondContact O-N 3.01Å; L904-N907 PolarHBondContact O-N 3.2Å; L904-M908 WeakPolarHBondContact O-CG 3.41Å; L904-M908 PolarHBondContact O-N 3.05Å; L904-L917 HydrophobicContact CD2-CD1 4.07Å; L904-V921 HydrophobicContact CD2-CG1 4.32Å; L904-L922 HydrophobicContact CB-CD1 4.01Å; L904-L922 HydrophobicContact CD1-CD1 4.39Å; L904-S925 WeakPolarHBondContact CD1-OG 3.24Å
905	R	89.4	Confident	82.5	Confident	85 Å²	85	56.6 Å²	56.6	32%	0.321	25%	0.248	S	C	.	.	H	α-helix	trans	-62.9	-43.1	177.8	-71.6	170.6	69.4	-151.2	-2.1	111.5	I901 D902 N907 M908 L909 L922 L942	I901-R905 VanDerWaalsContact O-CG 3.25Å; I901-R905 WeakPolarHBondContact O-CG 3.4Å; I901-R905 PolarHBondContact O-N 3.26Å; D902-R905 WeakPolarHBondContact O-CB 3.42Å; D902-R905 PolarHBondContact O-N 2.96Å; D902-R905 IonicContact OD1-NH1 3.46Å; D902-R905 PolarHBondContact OD1-NH1 3.36Å; R905-N907 VanDerWaalsContact C-N 3.34Å; R905-N907 PolarHBondContact O-N 3.04Å; R905-M908 PolarHBondContact O-N 2.88Å; R905-L909 WeakPolarHBondContact O-CG 3.39Å; R905-L909 PolarHBondContact O-N 3.44Å; R905-L922 HydrophobicContact CG-CD1 4.08Å; R905-L922 HydrophobicContact CG-CD2 4.22Å; R905-L942 HydrophobicContact CG-CD2 4.36Å
906	L	86.4	Confident	80.9	Confident	14 Å²	14	60.6 Å²	60.6	7%	0.073	27%	0.271	C	S	.	.	H	α-helix	trans	-58.6	-46.8	174.7	-69.5	176.4	0	0	0	111.3	K757 E761 D902 L903 M908 L909 N910	K757-L906 HydrophobicContact CG-CD1 3.9Å; E761-L906 HydrophobicContact CB-CD2 4.45Å; E761-L906 HydrophobicContact CG-CD1 4.48Å; E761-L906 HydrophobicContact CG-CD2 3.22Å; E761-L906 HydrophobicContact CG-CG 4.48Å; D902-L906 VanDerWaalsContact O-CG 3.31Å; D902-L906 WeakPolarHBondContact O-CG 3.45Å; D902-L906 PolarHBondContact O-N 3.41Å; L903-L906 PolarHBondContact O-N 2.97Å; L906-M908 VanDerWaalsContact C-N 3.3Å; L906-M908 PolarHBondContact O-N 3.39Å; L906-L909 PolarHBondContact O-N 2.95Å; L906-N910 WeakPolarHBondContact O-CB 3.36Å; L906-N910 PolarHBondContact O-N 3Å; L906-N910 VanDerWaalsContact O-N 3.09Å; L906-N910 PolarHBondContact O-ND2 3.49Å
907	N	86.7	Confident	79.9	Confident	20 Å²	20	61.6 Å²	61.6	11%	0.107	28%	0.276	C	S	.	.	H	α-helix	trans	-59.4	-41.1	176.9	-173.8	80.6	0	0	0	112.1	Y849 I854 L903 L904 R905 N910	Y849-N907 HydrophobicContact CE2-CB 3.96Å; I854-N907 HydrophobicContact CB-CB 4.43Å; I854-N907 HydrophobicContact CG1-CB 4.43Å; L903-N907 WeakPolarHBondContact O-CB 3.26Å; L903-N907 PolarHBondContact O-N 3.28Å; L904-N907 PolarHBondContact O-N 3.2Å; R905-N907 VanDerWaalsContact C-N 3.34Å; R905-N907 PolarHBondContact O-N 3.04Å; N907-N910 PolarHBondContact O-N 3.47Å
908	M	82.4	Confident	79	Confident	61 Å²	61	64.3 Å²	64.3	30%	0.3	30%	0.295	S	S	.	.	H	α-helix	trans	-69.8	-31	178.5	-70.8	-174.6	72.8	0	0	114	L904 R905 L906 P919 L922	L904-M908 WeakPolarHBondContact O-CG 3.41Å; L904-M908 PolarHBondContact O-N 3.05Å; R905-M908 PolarHBondContact O-N 2.88Å; L906-M908 VanDerWaalsContact C-N 3.3Å; L906-M908 PolarHBondContact O-N 3.39Å; M908-P919 HydrophobicContact CE-CB 3.75Å; M908-P919 HydrophobicContact CE-CG 3.9Å; M908-L922 HydrophobicContact SD-CB 3.68Å; M908-L922 HydrophobicContact SD-CD2 3.66Å; M908-L922 HydrophobicContact SD-CG 4.26Å
909	L	78.2	Confident	78.1	Confident	119 Å²	119	65.3 Å²	65.3	62%	0.623	31%	0.305	S	S	*	.	H	α-helix	trans	-74	-30.2	175.6	-71.1	171.2	0	0	0	111.9	R905 L906 K911	R905-L909 WeakPolarHBondContact O-CG 3.39Å; R905-L909 PolarHBondContact O-N 3.44Å; L906-L909 PolarHBondContact O-N 2.95Å; L909-K911 VanDerWaalsContact C-N 3.29Å; L909-K911 PolarHBondContact O-N 3.44Å
910	N	75.6	Confident	77.5	Confident	7 Å²	7	66.2 Å²	66.2	4%	0.037	32%	0.317	C	S	.	.			trans	-76.4	71.9	179	-78	-43.5	0	0	0	112.4	F760 V763 Y769 L906 N907 K912 R913	F760-N910 PolarHBondContact O-ND2 3.35Å; V763-N910 VanDerWaalsContact CG2-OD1 3.29Å; V763-N910 WeakPolarHBondContact CG2-OD1 3.48Å; Y769-N910 PolarHBondContact OH-ND2 3.37Å; L906-N910 WeakPolarHBondContact O-CB 3.36Å; L906-N910 PolarHBondContact O-N 3Å; L906-N910 VanDerWaalsContact O-N 3.09Å; L906-N910 PolarHBondContact O-ND2 3.49Å; N907-N910 PolarHBondContact O-N 3.47Å; N910-K912 PolarHBondContact O-N 2.92Å; N910-R913 PolarHBondContact O-N 3.45Å
911	K	62.5	Low	77.1	Confident	149 Å²	149	67.4 Å²	67.4	65%	0.648	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-18.4	-179.8	-58	-172.8	178.5	-179.9	0	115.3	L909 R913 Y915	L909-K911 VanDerWaalsContact C-N 3.29Å; L909-K911 PolarHBondContact O-N 3.44Å; K911-R913 CarbonylContact C-O 3.57Å; K911-Y915 WeakPolarHBondContact CD-OH 2.86Å; K911-Y915 WeakPolarHBondContact CG-OH 3.32Å
912	K	59.3	Low	76.8	Confident	150 Å²	150	67.7 Å²	67.7	65%	0.652	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-32.5	-176.5	-74.7	-176.9	179.7	169.4	0	113.5	V763 E764 N910 K914	V763-K912 PolarHBondContact O-NZ 3.15Å; E764-K912 PolarHBondContact O-NZ 3.02Å; N910-K912 PolarHBondContact O-N 2.92Å; K912-K914 PolarHBondContact O-N 3.4Å
913	R	53.5	Low	76.6	Confident	85 Å²	85	66.3 Å²	66.3	32%	0.321	32%	0.319	S	S	.	.	S	Bend	trans	-76	121.9	161.8	-80	-173.7	171.7	-177.4	-5.1	104.6	Y849 A850 N910 K911 Y915	Y849-R913 PolarHBondContact O-NH1 3.26Å; A850-R913 PolarHBondContact O-NH2 2.96Å; N910-R913 PolarHBondContact O-N 3.45Å; K911-R913 CarbonylContact C-O 3.57Å; R913-Y915 PolarHBondContact O-N 3.45Å
914	K	51.5	Low	76.5	Confident	176 Å²	176	70.8 Å²	70.8	77%	0.765	34%	0.342	S	S	*	.			trans	-39.2	137.6	176.3	-78	171.4	174.2	173.9	0	108.5	K912 D916	K912-K914 PolarHBondContact O-N 3.4Å; K914-D916 VanDerWaalsContact O-CG 3.25Å; K914-D916 PolarHBondContact O-N 2.98Å
915	Y	54.3	Low	76.6	Confident	161 Å²	161	71.2 Å²	71.2	63%	0.631	35%	0.346	S	S	*	.			trans	-57.8	78.5	179	-67.1	-87.3	0	0	0	110.7	K911 R913 L917	K911-Y915 WeakPolarHBondContact CD-OH 2.86Å; K911-Y915 WeakPolarHBondContact CG-OH 3.32Å; R913-Y915 PolarHBondContact O-N 3.45Å; Y915-L917 PolarHBondContact O-N 3.21Å
916	D	63.2	Low	76.8	Confident	97 Å²	97	67.3 Å²	67.3	52%	0.519	33%	0.331	S	S	.	.			trans	-79.6	-14.1	-171.4	-73	-19.5	0	0	0	111.8	R855 K914	R855-D916 PolarHBondContact NH2-O 3.3Å; K914-D916 VanDerWaalsContact O-CG 3.25Å; K914-D916 PolarHBondContact O-N 2.98Å
917	L	75.3	Confident	77.1	Confident	20 Å²	20	68.3 Å²	68.3	11%	0.105	34%	0.34	C	S	.	.	S	Bend	trans	-127.2	130.8	179.2	-65.5	179.8	0	0	0	111.5	I854 R855 F858 L904 Y915 V921	I854-L917 HydrophobicContact CB-CD1 4.36Å; I854-L917 HydrophobicContact CG1-CD1 4.08Å; I854-L917 HydrophobicContact CG2-CD1 3.37Å; I854-L917 HydrophobicContact CG2-CG 4.09Å; R855-L917 HydrophobicContact CG-CD2 3.97Å; F858-L917 HydrophobicContact CE2-CD1 4.36Å; F858-L917 HydrophobicContact CZ-CD1 4.09Å; L904-L917 HydrophobicContact CD2-CD1 4.07Å; Y915-L917 PolarHBondContact O-N 3.21Å; L917-V921 HydrophobicContact CB-CG2 4.38Å; L917-V921 HydrophobicContact CD1-CG1 4.27Å; L917-V921 HydrophobicContact CD2-CG2 4.22Å
918	P	78	Confident	77.5	Confident	68 Å²	68	70.5 Å²	70.5	44%	0.442	35%	0.351	S	S	.	.			trans	-69.1	151.5	172	27.5	-31.3	0	0	0	110.9	S920 V921	P918-S920 WeakPolarHBondContact CG-OG 3.43Å; P918-S920 PolarHBondContact O-N 3.5Å; P918-V921 HydrophobicContact CG-CG2 3.99Å; P918-V921 PolarHBondContact O-N 2.74Å
919	P	77.7	Confident	78.1	Confident	64 Å²	64	67.6 Å²	67.6	42%	0.416	34%	0.337	S	S	.	.	H	α-helix	trans	-54.6	-22.3	175.7	-27.2	35	0	0	0	115	M908 V921 L922 L923	M908-P919 HydrophobicContact CE-CB 3.75Å; M908-P919 HydrophobicContact CE-CG 3.9Å; P919-V921 PolarHBondContact O-N 2.7Å; P919-L922 PolarHBondContact O-N 3.3Å; P919-L923 PolarHBondContact O-N 3.1Å
920	S	83	Confident	78.9	Confident	55 Å²	55	62.7 Å²	62.7	39%	0.385	31%	0.312	S	S	.	.	H	α-helix	trans	-60.6	-27.7	174.7	56.9	0	0	0	0	113.2	P918 L923 N924	P918-S920 WeakPolarHBondContact CG-OG 3.43Å; P918-S920 PolarHBondContact O-N 3.5Å; S920-L923 PolarHBondContact O-N 2.9Å; S920-N924 WeakPolarHBondContact O-CB 3.37Å; S920-N924 PolarHBondContact O-N 3.39Å; S920-N924 PolarHBondContact O-ND2 3.01Å; S920-N924 PolarHBondContact O-OD1 3.45Å
921	V	88.9	Confident	79.7	Confident	31 Å²	31	69.3 Å²	69.3	19%	0.188	34%	0.34	C	S	.	.	H	α-helix	trans	-65.8	-45.2	177.6	177.4	0	0	0	0	110.5	F858 L904 L917 P918 P919 L923 N924 S925	F858-V921 HydrophobicContact CE2-CG1 4.18Å; F858-V921 HydrophobicContact CZ-CG1 3.75Å; L904-V921 HydrophobicContact CD2-CG1 4.32Å; L917-V921 HydrophobicContact CB-CG2 4.38Å; L917-V921 HydrophobicContact CD1-CG1 4.27Å; L917-V921 HydrophobicContact CD2-CG2 4.22Å; P918-V921 HydrophobicContact CG-CG2 3.99Å; P918-V921 PolarHBondContact O-N 2.74Å; P919-V921 PolarHBondContact O-N 2.7Å; V921-L923 VanDerWaalsContact C-N 3.32Å; V921-L923 PolarHBondContact O-N 2.9Å; V921-N924 PolarHBondContact O-N 3.31Å; V921-S925 PolarHBondContact O-N 3.04Å; V921-S925 PolarHBondContact O-OG 3.38Å
922	L	89.5	Confident	81.1	Confident	9 Å²	9	65.1 Å²	65.1	5%	0.047	32%	0.323	C	S	.	.	H	α-helix	trans	-60.5	-44.3	174.5	177	65	0	0	0	110.9	I901 L904 R905 M908 P919 N924 S925 V926 L942 V946	I901-L922 HydrophobicContact CG2-CD1 4.19Å; L904-L922 HydrophobicContact CB-CD1 4.01Å; L904-L922 HydrophobicContact CD1-CD1 4.39Å; R905-L922 HydrophobicContact CG-CD1 4.08Å; R905-L922 HydrophobicContact CG-CD2 4.22Å; M908-L922 HydrophobicContact SD-CB 3.68Å; M908-L922 HydrophobicContact SD-CD2 3.66Å; M908-L922 HydrophobicContact SD-CG 4.26Å; P919-L922 PolarHBondContact O-N 3.3Å; L922-N924 VanDerWaalsContact C-N 3.34Å; L922-N924 PolarHBondContact O-N 3.1Å; L922-S925 PolarHBondContact O-N 3.15Å; L922-V926 HydrophobicContact CD1-CG2 3.94Å; L922-V926 HydrophobicContact CG-CG2 4.29Å; L922-V926 WeakPolarHBondContact O-CB 3.31Å; L922-V926 WeakPolarHBondContact O-CG2 3.12Å; L922-V926 PolarHBondContact O-N 3.37Å; L922-L942 HydrophobicContact CD1-CD2 4.35Å; L922-V946 HydrophobicContact CD2-CG2 4.14Å
923	L	88.6	Confident	82.7	Confident	15 Å²	15	58.2 Å²	58.2	8%	0.079	29%	0.293	C	S	.	.	H	α-helix	trans	-61.7	-40.9	177.8	-76.9	175.2	0	0	0	112.5	P919 S920 V921 S927 F943 V946 Q947	P919-L923 PolarHBondContact O-N 3.1Å; S920-L923 PolarHBondContact O-N 2.9Å; V921-L923 VanDerWaalsContact C-N 3.32Å; V921-L923 PolarHBondContact O-N 2.9Å; L923-S927 WeakPolarHBondContact O-CB 3.48Å; L923-S927 PolarHBondContact O-N 3.21Å; L923-F943 HydrophobicContact CD2-CD2 4.16Å; L923-F943 HydrophobicContact CD2-CE2 4.23Å; L923-V946 HydrophobicContact CD1-CG1 3.96Å; L923-V946 HydrophobicContact CD2-CB 3.72Å; L923-V946 HydrophobicContact CD2-CG1 3.46Å; L923-V946 VanDerWaalsContact CD2-CG1 3.46Å; L923-V946 HydrophobicContact CG-CB 4.43Å; L923-V946 HydrophobicContact CG-CG1 3.64Å; L923-Q947 HydrophobicContact CD2-CG 4.05Å
924	N	90.6	Very high	84.5	Confident	97 Å²	97	55.5 Å²	55.5	52%	0.519	29%	0.286	S	S	.	.	H	α-helix	trans	-65.6	-49.3	177.7	-69.7	-11.1	0	0	0	111	S920 V921 L922 V926 S927 D928	S920-N924 WeakPolarHBondContact O-CB 3.37Å; S920-N924 PolarHBondContact O-N 3.39Å; S920-N924 PolarHBondContact O-ND2 3.01Å; S920-N924 PolarHBondContact O-OD1 3.45Å; V921-N924 PolarHBondContact O-N 3.31Å; L922-N924 VanDerWaalsContact C-N 3.34Å; L922-N924 PolarHBondContact O-N 3.1Å; N924-V926 VanDerWaalsContact C-N 3.34Å; N924-V926 PolarHBondContact O-N 3.13Å; N924-S927 WeakPolarHBondContact O-CB 3.46Å; N924-S927 PolarHBondContact O-N 2.98Å; N924-S927 VanDerWaalsContact O-N 3.14Å; N924-D928 PolarHBondContact O-N 2.98Å
925	S	93.6	Very high	86.3	Confident	13 Å²	13	48 Å²	48	9%	0.091	25%	0.254	C	S	.	.	H	α-helix	trans	-59.8	-43	177.3	-66.7	0	0	0	0	112.2	E900 L904 V921 L922 D928 A929	E900-S925 PolarHBondContact OE1-OG 3.13Å; L904-S925 WeakPolarHBondContact CD1-OG 3.24Å; V921-S925 PolarHBondContact O-N 3.04Å; V921-S925 PolarHBondContact O-OG 3.38Å; L922-S925 PolarHBondContact O-N 3.15Å; S925-D928 PolarHBondContact O-N 3.15Å; S925-A929 WeakPolarHBondContact O-CB 3.37Å; S925-A929 PolarHBondContact O-N 2.81Å
926	V	94.5	Very high	88.2	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.012	23%	0.228	C	C	.	.	H	α-helix	trans	-66.9	-39.2	176.3	176.5	0	0	0	0	111	I901 L922 N924 D928 A929 L930 F939 L942 F943	I901-V926 HydrophobicContact CD1-CG2 3.96Å; I901-V926 HydrophobicContact CG1-CG2 4.1Å; I901-V926 HydrophobicContact CG2-CG2 4.02Å; L922-V926 HydrophobicContact CD1-CG2 3.94Å; L922-V926 HydrophobicContact CG-CG2 4.29Å; L922-V926 WeakPolarHBondContact O-CB 3.31Å; L922-V926 WeakPolarHBondContact O-CG2 3.12Å; L922-V926 PolarHBondContact O-N 3.37Å; N924-V926 VanDerWaalsContact C-N 3.34Å; N924-V926 PolarHBondContact O-N 3.13Å; V926-D928 VanDerWaalsContact C-N 3.34Å; V926-D928 PolarHBondContact O-N 3.18Å; V926-A929 PolarHBondContact O-N 3.18Å; V926-L930 HydrophobicContact CG1-CD1 4.03Å; V926-L930 HydrophobicContact CG1-CG 4.39Å; V926-L930 WeakPolarHBondContact O-CB 3.32Å; V926-L930 VanDerWaalsContact O-CG 3.3Å; V926-L930 WeakPolarHBondContact O-CG 3.22Å; V926-L930 PolarHBondContact O-N 2.88Å; V926-F939 HydrophobicContact CG1-CB 4.35Å; V926-L942 HydrophobicContact CG2-CD2 3.69Å; V926-L942 HydrophobicContact CG2-CG 4.3Å; V926-F943 HydrophobicContact CB-CD2 4.48Å; V926-F943 HydrophobicContact CG1-CB 3.74Å; V926-F943 HydrophobicContact CG1-CD2 3.96Å; V926-F943 HydrophobicContact CG1-CG 4.32Å
927	S	92.4	Very high	89.5	Confident	36 Å²	36	36.6 Å²	36.6	25%	0.252	20%	0.204	S	C	.	.	H	α-helix	trans	-64.2	-38.9	176.2	-175.4	0	0	0	0	112	L923 N924 L930 K931	L923-S927 WeakPolarHBondContact O-CB 3.48Å; L923-S927 PolarHBondContact O-N 3.21Å; N924-S927 WeakPolarHBondContact O-CB 3.46Å; N924-S927 PolarHBondContact O-N 2.98Å; N924-S927 VanDerWaalsContact O-N 3.14Å; S927-L930 PolarHBondContact O-N 2.85Å; S927-K931 WeakPolarHBondContact O-CG 3.46Å; S927-K931 PolarHBondContact O-N 3.33Å
928	D	94.5	Very high	90.3	Very high	65 Å²	65	36.3 Å²	36.3	35%	0.348	21%	0.205	S	C	.	.	H	α-helix	trans	-70.1	-42	177	-70.5	-25.6	0	0	0	110.9	W897 N924 S925 V926 L930 K931	W897-D928 HydrophobicContact CH2-CB 3.94Å; W897-D928 HydrophobicContact CZ2-CB 4.45Å; N924-D928 PolarHBondContact O-N 2.98Å; S925-D928 PolarHBondContact O-N 3.15Å; V926-D928 VanDerWaalsContact C-N 3.34Å; V926-D928 PolarHBondContact O-N 3.18Å; D928-L930 VanDerWaalsContact C-N 3.3Å; D928-L930 PolarHBondContact O-N 3.43Å; D928-K931 WeakPolarHBondContact O-CB 3.15Å; D928-K931 PolarHBondContact O-N 2.83Å; D928-K931 VanDerWaalsContact O-N 3.16Å; D928-K931 IonicContact OD1-NZ 2.69Å; D928-K931 PolarHBondContact OD1-NZ 3.31Å
929	A	96.2	Very high	91.1	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-59.1	-39.9	172.1	0	0	0	0	0	112.3	W897 I901 S925 V926 K931 E932 F933 F939	W897-A929 HydrophobicContact CB-CB 4.15Å; W897-A929 HydrophobicContact CD2-CB 3.72Å; W897-A929 HydrophobicContact CE3-CB 3.88Å; W897-A929 HydrophobicContact CG-CB 3.89Å; W897-A929 HydrophobicContact CZ3-CB 4.46Å; I901-A929 HydrophobicContact CD1-CB 3.79Å; S925-A929 WeakPolarHBondContact O-CB 3.37Å; S925-A929 PolarHBondContact O-N 2.81Å; V926-A929 PolarHBondContact O-N 3.18Å; A929-K931 VanDerWaalsContact C-N 3.31Å; A929-K931 PolarHBondContact O-N 3.47Å; A929-E932 PolarHBondContact O-N 3.07Å; A929-F933 PolarHBondContact O-N 2.99Å; A929-F939 HydrophobicContact CB-CD2 3.84Å; A929-F939 HydrophobicContact CB-CE2 3.76Å; A929-F939 HydrophobicContact CB-CZ 4.46Å
930	L	94.4	Very high	91.9	Very high	17 Å²	17	30.4 Å²	30.4	9%	0.089	17%	0.166	C	C	.	.	H	α-helix	trans	-72	-18.6	177.9	-77	173.2	0	0	0	114.5	V926 S927 D928 E932 P934 F939 L940 F943	V926-L930 HydrophobicContact CG1-CD1 4.03Å; V926-L930 HydrophobicContact CG1-CG 4.39Å; V926-L930 WeakPolarHBondContact O-CB 3.32Å; V926-L930 VanDerWaalsContact O-CG 3.3Å; V926-L930 WeakPolarHBondContact O-CG 3.22Å; V926-L930 PolarHBondContact O-N 2.88Å; S927-L930 PolarHBondContact O-N 2.85Å; D928-L930 VanDerWaalsContact C-N 3.3Å; D928-L930 PolarHBondContact O-N 3.43Å; L930-E932 VanDerWaalsContact C-N 3.32Å; L930-P934 VanDerWaalsContact O-CA 3.29Å; L930-P934 WeakPolarHBondContact O-CA 3.34Å; L930-F939 HydrophobicContact CD2-CB 3.65Å; L930-F939 HydrophobicContact CG-CB 3.99Å; L930-L940 HydrophobicContact CD1-CD2 4.13Å; L930-L940 HydrophobicContact CD2-CD2 3.64Å; L930-L940 HydrophobicContact CD2-CG 3.72Å; L930-F943 HydrophobicContact CD1-CB 3.8Å; L930-F943 HydrophobicContact CD1-CD1 4.39Å; L930-F943 HydrophobicContact CD1-CD2 4.13Å; L930-F943 HydrophobicContact CD1-CG 3.85Å
931	K	91.7	Very high	92.4	Very high	145 Å²	145	31 Å²	31	63%	0.63	16%	0.16	S	C	*	.	H	α-helix	trans	-69.6	-36.2	169.9	-70.5	167.7	-169.4	161.4	0	110.6	S927 D928 A929	S927-K931 WeakPolarHBondContact O-CG 3.46Å; S927-K931 PolarHBondContact O-N 3.33Å; D928-K931 WeakPolarHBondContact O-CB 3.15Å; D928-K931 PolarHBondContact O-N 2.83Å; D928-K931 VanDerWaalsContact O-N 3.16Å; D928-K931 IonicContact OD1-NZ 2.69Å; D928-K931 PolarHBondContact OD1-NZ 3.31Å; A929-K931 VanDerWaalsContact C-N 3.31Å; A929-K931 PolarHBondContact O-N 3.47Å
932	E	92	Very high	92.6	Very high	62 Å²	62	30 Å²	30	29%	0.29	15%	0.154	S	C	.	.	H	α-helix	trans	-87.1	-39.9	179.8	-65.8	-179.5	-150.1	0	0	112.8	N600 R869 W897 A929 L930 P934	N600-E932 PolarHBondContact ND2-O 3.5Å; R869-E932 IonicContact CZ-OE1 3.47Å; R869-E932 IonicContact CZ-OE2 3.46Å; R869-E932 IonicContact NE-OE2 2.73Å; R869-E932 IonicContact NH2-OE1 2.9Å; R869-E932 PolarHBondContact NH2-OE1 2.94Å; R869-E932 IonicContact NH2-OE2 3.43Å; R869-E932 PolarHBondContact NH2-OE2 2.94Å; W897-E932 PolarHBondContact NE1-OE2 3.33Å; A929-E932 PolarHBondContact O-N 3.07Å; L930-E932 VanDerWaalsContact C-N 3.32Å; E932-P934 WeakPolarHBondContact O-CD 3.27Å
933	F	93.7	Very high	92.7	Very high	5 Å²	5	29.9 Å²	29.9	2%	0.022	15%	0.153	C	C	.	.			trans	-119.6	67.2	-177.5	-59	-78.6	0	0	0	110.1	D890 V893 E894 W897 A929 N935 H936	D890-F933 HydrophobicContact CB-CE1 4.42Å; D890-F933 WeakPolarHBondContact O-CE1 3.42Å; D890-F933 WeakPolarHBondContact O-CZ 3.26Å; V893-F933 HydrophobicContact CB-CE2 4.48Å; V893-F933 HydrophobicContact CB-CZ 3.98Å; V893-F933 HydrophobicContact CG1-CE2 3.98Å; V893-F933 HydrophobicContact CG1-CZ 3.92Å; E894-F933 HydrophobicContact CB-CD1 3.87Å; E894-F933 HydrophobicContact CB-CD2 4.4Å; E894-F933 HydrophobicContact CB-CE1 3.58Å; E894-F933 HydrophobicContact CB-CE2 4.16Å; E894-F933 HydrophobicContact CB-CG 4.28Å; E894-F933 HydrophobicContact CB-CZ 3.74Å; E894-F933 HydrophobicContact CG-CD1 3.77Å; E894-F933 HydrophobicContact CG-CD2 4.31Å; E894-F933 HydrophobicContact CG-CE1 4.04Å; E894-F933 HydrophobicContact CG-CG 3.92Å; E894-F933 HydrophobicContact CG-CZ 4.43Å; W897-F933 AromaticContact CD1-CD2 3.81Å; W897-F933 AromaticContact CD1-CE2 3.48Å; W897-F933 VanDerWaalsContact CD1-CE2 3.48Å; W897-F933 AromaticContact NE1-CE2 3.89Å; A929-F933 PolarHBondContact O-N 2.99Å; F933-N935 PolarHBondContact O-N 3.28Å; F933-H936 HydrophobicContact CB-CB 4.06Å; F933-H936 PolarHBondContact O-N 2.93Å; F933-H936 VanDerWaalsContact O-N 3.16Å
934	P	90.5	Very high	92.9	Very high	28 Å²	28	29.2 Å²	29.2	18%	0.182	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-21.3	-175.3	27	-41	0	0	0	114.7	N600 L930 E932 R971	N600-P934 VanDerWaalsContact OD1-CD 3.24Å; N600-P934 WeakPolarHBondContact OD1-CD 3.4Å; L930-P934 VanDerWaalsContact O-CA 3.29Å; L930-P934 WeakPolarHBondContact O-CA 3.34Å; E932-P934 WeakPolarHBondContact O-CD 3.27Å; P934-R971 VanDerWaalsContact CB-CZ 3.46Å
935	N	90.2	Very high	92.8	Very high	18 Å²	18	26 Å²	26	10%	0.096	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.5	0.1	-174.9	-62.5	-29.7	0	0	0	113.4	S599 Q602 F933 V937 S968 A970	S599-N935 WeakPolarHBondContact O-CB 3.36Å; Q602-N935 PolarHBondContact NE2-ND2 3.2Å; F933-N935 PolarHBondContact O-N 3.28Å; N935-V937 PolarHBondContact O-N 3.26Å; N935-S968 WeakPolarHBondContact OD1-CB 3.06Å; N935-S968 PolarHBondContact OD1-OG 3.21Å; N935-A970 HydrophobicContact CB-CB 4.44Å
936	H	93	Very high	92.4	Very high	18 Å²	18	26.4 Å²	26.4	8%	0.083	14%	0.136	C	C	.	.			trans	-68.9	104.4	-179.7	-171.3	-40.2	0	0	0	110.5	S599 E894 E898 F933 G938 F939 L940	S599-H936 PolarHBondContact OG-N 3.14Å; E894-H936 IonicContact OE1-CD2 3.74Å; E894-H936 PolarHBondContact OE1-CD2 3.4Å; E894-H936 IonicContact OE1-CG 2.77Å; E894-H936 IonicContact OE1-NE2 2.56Å; E898-H936 IonicContact OE1-NE2 2.93Å; E898-H936 PolarHBondContact OE1-NE2 2.81Å; E898-H936 VanDerWaalsContact OE1-NE2 3.16Å; F933-H936 HydrophobicContact CB-CB 4.06Å; F933-H936 PolarHBondContact O-N 2.93Å; F933-H936 VanDerWaalsContact O-N 3.16Å; H936-G938 PolarHBondContact ND1-N 3.27Å; H936-G938 PolarHBondContact O-N 3.16Å; H936-F939 HydrophobicContact CB-CB 4.13Å; H936-F939 HydrophobicContact CB-CD2 3.58Å; H936-F939 HydrophobicContact CB-CE2 4.18Å; H936-F939 HydrophobicContact CB-CG 4Å; H936-F939 AromaticContact CD2-CD2 3.53Å; H936-F939 AromaticContact CD2-CE1 3.94Å; H936-F939 AromaticContact CD2-CE2 3.33Å; H936-F939 WeakPolarHBondContact CD2-CE2 3.24Å; H936-F939 AromaticContact CD2-CG 3.9Å; H936-F939 AromaticContact CD2-CZ 3.54Å; H936-F939 AromaticContact CE1-CD1 3.96Å; H936-F939 AromaticContact CG-CD2 3.46Å; H936-F939 VanDerWaalsContact CG-CD2 3.46Å; H936-F939 AromaticContact CG-CE2 3.79Å; H936-F939 AromaticContact CG-CG 3.63Å; H936-F939 AromaticContact ND1-CG 3.82Å; H936-F939 PolarHBondContact ND1-N 2.92Å; H936-F939 VanDerWaalsContact ND1-N 3.17Å; H936-F939 AromaticContact NE2-CD1 3.99Å; H936-F939 AromaticContact NE2-CE1 3.69Å; H936-F939 AromaticContact NE2-CE2 3.96Å; H936-F939 AromaticContact NE2-CZ 3.67Å; H936-F939 PolarHBondContact O-N 3.39Å; H936-L940 PolarHBondContact O-N 3.47Å
937	V	91.9	Very high	91.9	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.006	14%	0.136	C	C	.	.	H	α-helix	trans	-62.3	-41.7	-174.6	-178.2	0	0	0	0	112.3	Y612 Y613 E616 F617 N935 F939 L940 R941 A970	Y612-V937 HydrophobicContact CD1-CG2 3.92Å; Y612-V937 HydrophobicContact CE1-CB 3.99Å; Y612-V937 HydrophobicContact CE1-CG2 3.27Å; Y613-V937 HydrophobicContact CD1-CG1 4.16Å; Y613-V937 HydrophobicContact CD1-CG2 3.73Å; Y613-V937 HydrophobicContact CE1-CG2 3.59Å; E616-V937 HydrophobicContact CB-CG1 3.52Å; E616-V937 HydrophobicContact CG-CB 4.37Å; E616-V937 HydrophobicContact CG-CG1 3.68Å; F617-V937 HydrophobicContact CD2-CG1 4.11Å; F617-V937 HydrophobicContact CE2-CG1 3.59Å; F617-V937 HydrophobicContact CZ-CG1 4.29Å; N935-V937 PolarHBondContact O-N 3.26Å; V937-F939 PolarHBondContact O-N 3.03Å; V937-L940 PolarHBondContact O-N 2.88Å; V937-R941 WeakPolarHBondContact O-CB 3.43Å; V937-R941 PolarHBondContact O-N 3.42Å; V937-A970 HydrophobicContact CG2-CB 4.42Å
938	G	92	Very high	91.5	Very high	13 Å²	13	26 Å²	26	13%	0.134	13%	0.131	C	C	.	.	H	α-helix	trans	-59	-41.2	174.7	0	0	0	0	0	114.4	H936 L942	H936-G938 PolarHBondContact ND1-N 3.27Å; H936-G938 PolarHBondContact O-N 3.16Å; G938-L942 WeakPolarHBondContact O-CB 3.31Å; G938-L942 PolarHBondContact O-N 2.71Å
939	F	95	Very high	90.9	Very high	7 Å²	7	31 Å²	31	3%	0.031	15%	0.15	C	C	.	.	H	α-helix	trans	-68.3	-43.2	174.4	-64.5	-16.1	0	0	0	111.7	W897 E898 I901 V926 A929 L930 H936 V937 R941 L942 F943	W897-F939 HydrophobicContact CB-CE2 4Å; W897-F939 HydrophobicContact CB-CZ 3.76Å; E898-F939 HydrophobicContact CB-CZ 4.42Å; E898-F939 HydrophobicContact CG-CE1 4Å; E898-F939 HydrophobicContact CG-CZ 3.78Å; I901-F939 HydrophobicContact CD1-CD1 3.76Å; I901-F939 HydrophobicContact CD1-CE1 3.49Å; I901-F939 VanDerWaalsContact CD1-CE1 3.49Å; I901-F939 HydrophobicContact CD1-CE2 4.31Å; I901-F939 HydrophobicContact CD1-CG 4.31Å; I901-F939 HydrophobicContact CD1-CZ 3.8Å; V926-F939 HydrophobicContact CG1-CB 4.35Å; A929-F939 HydrophobicContact CB-CD2 3.84Å; A929-F939 HydrophobicContact CB-CE2 3.76Å; A929-F939 HydrophobicContact CB-CZ 4.46Å; L930-F939 HydrophobicContact CD2-CB 3.65Å; L930-F939 HydrophobicContact CG-CB 3.99Å; H936-F939 HydrophobicContact CB-CB 4.13Å; H936-F939 HydrophobicContact CB-CD2 3.58Å; H936-F939 HydrophobicContact CB-CE2 4.18Å; H936-F939 HydrophobicContact CB-CG 4Å; H936-F939 AromaticContact CD2-CD2 3.53Å; H936-F939 AromaticContact CD2-CE1 3.94Å; H936-F939 AromaticContact CD2-CE2 3.33Å; H936-F939 WeakPolarHBondContact CD2-CE2 3.24Å; H936-F939 AromaticContact CD2-CG 3.9Å; H936-F939 AromaticContact CD2-CZ 3.54Å; H936-F939 AromaticContact CE1-CD1 3.96Å; H936-F939 AromaticContact CG-CD2 3.46Å; H936-F939 VanDerWaalsContact CG-CD2 3.46Å; H936-F939 AromaticContact CG-CE2 3.79Å; H936-F939 AromaticContact CG-CG 3.63Å; H936-F939 AromaticContact ND1-CG 3.82Å; H936-F939 PolarHBondContact ND1-N 2.92Å; H936-F939 VanDerWaalsContact ND1-N 3.17Å; H936-F939 AromaticContact NE2-CD1 3.99Å; H936-F939 AromaticContact NE2-CE1 3.69Å; H936-F939 AromaticContact NE2-CE2 3.96Å; H936-F939 AromaticContact NE2-CZ 3.67Å; H936-F939 PolarHBondContact O-N 3.39Å; V937-F939 PolarHBondContact O-N 3.03Å; F939-R941 PolarHBondContact O-N 3.49Å; F939-L942 PolarHBondContact O-N 2.9Å; F939-F943 VanDerWaalsContact O-CB 3.23Å; F939-F943 WeakPolarHBondContact O-CB 3.48Å; F939-F943 PolarHBondContact O-N 3.4Å
940	L	94.2	Very high	90	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.01	17%	0.167	C	C	.	.	H	α-helix	trans	-60.2	-45.3	175.9	-72.6	170.5	0	0	0	111.6	F617 L930 H936 V937 F943 C944 L960 A970 R971 A974	F617-L940 HydrophobicContact CZ-CB 4.17Å; L930-L940 HydrophobicContact CD1-CD2 4.13Å; L930-L940 HydrophobicContact CD2-CD2 3.64Å; L930-L940 HydrophobicContact CD2-CG 3.72Å; H936-L940 PolarHBondContact O-N 3.47Å; V937-L940 PolarHBondContact O-N 2.88Å; L940-F943 PolarHBondContact O-N 3.26Å; L940-C944 WeakPolarHBondContact O-CB 3.49Å; L940-C944 PolarHBondContact O-N 3.35Å; L940-C944 PolarHBondContact O-SG 3.2Å; L940-L960 HydrophobicContact CD2-CD2 3.93Å; L940-A970 HydrophobicContact CD1-CB 3.8Å; L940-R971 HydrophobicContact CD1-CG 4.43Å; L940-R971 HydrophobicContact CD2-CG 4.26Å; L940-A974 HydrophobicContact CB-CB 3.94Å; L940-A974 HydrophobicContact CD1-CB 4.26Å; L940-A974 HydrophobicContact CD2-CB 4.21Å; L940-A974 HydrophobicContact CG-CB 4.38Å
941	R	93.7	Very high	89	Confident	66 Å²	66	37.2 Å²	37.2	25%	0.249	19%	0.189	C	C	.	.	H	α-helix	trans	-58.8	-50.1	174.5	179.5	-169.4	64.4	81	2.8	111.4	E616 F617 V937 F939 F943 C944 S945	E616-R941 WeakPolarHBondContact O-CD 3.3Å; E616-R941 WeakPolarHBondContact OE2-CD 3.41Å; E616-R941 IonicContact OE2-CZ 2.79Å; E616-R941 IonicContact OE2-NE 3.89Å; E616-R941 PolarHBondContact OE2-NE 3.45Å; E616-R941 IonicContact OE2-NH2 3.2Å; F617-R941 HydrophobicContact CD1-CB 4.2Å; F617-R941 HydrophobicContact CD1-CG 4.27Å; F617-R941 HydrophobicContact CE1-CB 3.77Å; F617-R941 HydrophobicContact CE1-CG 4.29Å; F617-R941 HydrophobicContact CZ-CB 4.2Å; V937-R941 WeakPolarHBondContact O-CB 3.43Å; V937-R941 PolarHBondContact O-N 3.42Å; F939-R941 PolarHBondContact O-N 3.49Å; R941-F943 VanDerWaalsContact C-N 3.35Å; R941-F943 PolarHBondContact O-N 3.23Å; R941-C944 PolarHBondContact O-N 3.08Å; R941-S945 VanDerWaalsContact O-CB 3.29Å; R941-S945 WeakPolarHBondContact O-CB 3.35Å; R941-S945 PolarHBondContact O-N 3.48Å; R941-S945 PolarHBondContact O-OG 2.98Å
942	L	92.2	Very high	88.3	Confident	11 Å²	11	32.8 Å²	32.8	6%	0.058	17%	0.172	C	C	.	.	H	α-helix	trans	-59.7	-48.4	179.2	179.5	62	0	0	0	110.7	I901 R905 L922 V926 G938 F939 C944 S945 V946	I901-L942 HydrophobicContact CG2-CD2 3.34Å; R905-L942 HydrophobicContact CG-CD2 4.36Å; L922-L942 HydrophobicContact CD1-CD2 4.35Å; V926-L942 HydrophobicContact CG2-CD2 3.69Å; V926-L942 HydrophobicContact CG2-CG 4.3Å; G938-L942 WeakPolarHBondContact O-CB 3.31Å; G938-L942 PolarHBondContact O-N 2.71Å; F939-L942 PolarHBondContact O-N 2.9Å; L942-C944 PolarHBondContact O-N 3.49Å; L942-S945 PolarHBondContact O-N 2.85Å; L942-S945 PolarHBondContact O-OG 3.48Å; L942-V946 HydrophobicContact CD1-CG2 4.14Å; L942-V946 WeakPolarHBondContact O-CG2 3.38Å; L942-V946 PolarHBondContact O-N 3.46Å
943	F	92.5	Very high	87.7	Confident	7 Å²	7	30.3 Å²	30.3	3%	0.031	16%	0.161	C	C	.	.	H	α-helix	trans	-56.8	-52.2	178.3	-172.8	-98.2	0	0	0	111.7	L923 V926 L930 F939 L940 R941 S945 V946 Q947 L956 S959	L923-F943 HydrophobicContact CD2-CD2 4.16Å; L923-F943 HydrophobicContact CD2-CE2 4.23Å; V926-F943 HydrophobicContact CB-CD2 4.48Å; V926-F943 HydrophobicContact CG1-CB 3.74Å; V926-F943 HydrophobicContact CG1-CD2 3.96Å; V926-F943 HydrophobicContact CG1-CG 4.32Å; L930-F943 HydrophobicContact CD1-CB 3.8Å; L930-F943 HydrophobicContact CD1-CD1 4.39Å; L930-F943 HydrophobicContact CD1-CD2 4.13Å; L930-F943 HydrophobicContact CD1-CG 3.85Å; F939-F943 VanDerWaalsContact O-CB 3.23Å; F939-F943 WeakPolarHBondContact O-CB 3.48Å; F939-F943 PolarHBondContact O-N 3.4Å; L940-F943 PolarHBondContact O-N 3.26Å; R941-F943 VanDerWaalsContact C-N 3.35Å; R941-F943 PolarHBondContact O-N 3.23Å; F943-S945 VanDerWaalsContact C-N 3.33Å; F943-S945 PolarHBondContact O-N 2.9Å; F943-V946 PolarHBondContact O-N 3.28Å; F943-Q947 HydrophobicContact CD1-CG 4.24Å; F943-Q947 HydrophobicContact CE1-CG 3.91Å; F943-Q947 HydrophobicContact CE2-CG 4.39Å; F943-Q947 HydrophobicContact CZ-CG 4.01Å; F943-Q947 VanDerWaalsContact O-CG 3.28Å; F943-Q947 WeakPolarHBondContact O-CG 3.45Å; F943-Q947 PolarHBondContact O-N 3Å; F943-L956 HydrophobicContact CD1-CD1 3.61Å; F943-L956 HydrophobicContact CE1-CD1 3.46Å; F943-L956 VanDerWaalsContact CE1-CD1 3.46Å; F943-S959 WeakPolarHBondContact CE1-OG 3.16Å; F943-S959 VanDerWaalsContact CZ-OG 3.25Å; F943-S959 WeakPolarHBondContact CZ-OG 3.5Å
944	C	92	Very high	86.9	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-58.5	-45.6	176.9	-65.7	0	0	0	0	111.2	L940 R941 L942 V946 Q947 L948 F977	L940-C944 WeakPolarHBondContact O-CB 3.49Å; L940-C944 PolarHBondContact O-N 3.35Å; L940-C944 PolarHBondContact O-SG 3.2Å; R941-C944 PolarHBondContact O-N 3.08Å; L942-C944 PolarHBondContact O-N 3.49Å; C944-V946 VanDerWaalsContact C-N 3.33Å; C944-V946 PolarHBondContact O-N 2.67Å; C944-Q947 PolarHBondContact O-N 3.14Å; C944-L948 VanDerWaalsContact O-CB 3.28Å; C944-L948 WeakPolarHBondContact O-CB 3.39Å; C944-L948 WeakPolarHBondContact O-CD1 3.47Å; C944-L948 VanDerWaalsContact O-CG 3.24Å; C944-L948 WeakPolarHBondContact O-CG 3.19Å; C944-L948 PolarHBondContact O-N 3.26Å; C944-F977 HydrophobicContact CB-CD1 3.82Å; C944-F977 HydrophobicContact CB-CE1 3.69Å
945	S	87.9	Confident	86.2	Confident	29 Å²	29	35 Å²	35	20%	0.203	18%	0.182	C	C	.	.	H	α-helix	trans	-63.2	-36	-177.8	76	0	0	0	0	113.4	R941 L942 F943 K949	R941-S945 VanDerWaalsContact O-CB 3.29Å; R941-S945 WeakPolarHBondContact O-CB 3.35Å; R941-S945 PolarHBondContact O-N 3.48Å; R941-S945 PolarHBondContact O-OG 2.98Å; L942-S945 PolarHBondContact O-N 2.85Å; L942-S945 PolarHBondContact O-OG 3.48Å; F943-S945 VanDerWaalsContact C-N 3.33Å; F943-S945 PolarHBondContact O-N 2.9Å; S945-K949 WeakPolarHBondContact O-CD 3.24Å; S945-K949 VanDerWaalsContact O-CG 3.25Å; S945-K949 WeakPolarHBondContact O-CG 3.26Å; S945-K949 PolarHBondContact O-N 3.32Å
946	V	85.4	Confident	85.8	Confident	22 Å²	22	34.2 Å²	34.2	13%	0.133	18%	0.178	C	C	.	.	H	α-helix	trans	-75.3	-43.5	178.1	178.8	0	0	0	0	110.3	L922 L923 L942 F943 C944 K949 N950	L922-V946 HydrophobicContact CD2-CG2 4.14Å; L923-V946 HydrophobicContact CD1-CG1 3.96Å; L923-V946 HydrophobicContact CD2-CB 3.72Å; L923-V946 HydrophobicContact CD2-CG1 3.46Å; L923-V946 VanDerWaalsContact CD2-CG1 3.46Å; L923-V946 HydrophobicContact CG-CB 4.43Å; L923-V946 HydrophobicContact CG-CG1 3.64Å; L942-V946 HydrophobicContact CD1-CG2 4.14Å; L942-V946 WeakPolarHBondContact O-CG2 3.38Å; L942-V946 PolarHBondContact O-N 3.46Å; F943-V946 PolarHBondContact O-N 3.28Å; C944-V946 VanDerWaalsContact C-N 3.33Å; C944-V946 PolarHBondContact O-N 2.67Å; V946-K949 PolarHBondContact O-N 2.67Å; V946-N950 PolarHBondContact O-N 3.43Å; V946-N950 PolarHBondContact O-ND2 3.32Å
947	Q	85.4	Confident	85.4	Confident	1 Å²	1	35 Å²	35	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-65.6	-40.5	178.9	-64.7	-68.2	9.7	0	0	112.6	L923 F943 C944 K949 N950 S951 L952 L956	L923-Q947 HydrophobicContact CD2-CG 4.05Å; F943-Q947 HydrophobicContact CD1-CG 4.24Å; F943-Q947 HydrophobicContact CE1-CG 3.91Å; F943-Q947 HydrophobicContact CE2-CG 4.39Å; F943-Q947 HydrophobicContact CZ-CG 4.01Å; F943-Q947 VanDerWaalsContact O-CG 3.28Å; F943-Q947 WeakPolarHBondContact O-CG 3.45Å; F943-Q947 PolarHBondContact O-N 3Å; C944-Q947 PolarHBondContact O-N 3.14Å; Q947-K949 VanDerWaalsContact C-N 3.33Å; Q947-K949 PolarHBondContact O-N 3.21Å; Q947-N950 CarbonylContact O-C 3.58Å; Q947-N950 PolarHBondContact O-N 3.22Å; Q947-S951 PolarHBondContact O-N 3.05Å; Q947-S951 VanDerWaalsContact O-N 3.1Å; Q947-L952 PolarHBondContact O-N 3.4Å; Q947-L952 VanDerWaalsContact O-N 3.14Å; Q947-L952 VanDerWaalsContact OE1-CD1 3.24Å; Q947-L956 HydrophobicContact CB-CB 4.13Å; Q947-L956 HydrophobicContact CB-CD1 4.29Å; Q947-L956 HydrophobicContact CB-CD2 4.13Å; Q947-L956 HydrophobicContact CB-CG 4.43Å; Q947-L956 HydrophobicContact CG-CB 4.4Å; Q947-L956 HydrophobicContact CG-CD1 4.27Å
948	L	84.1	Confident	84.8	Confident	28 Å²	28	39.9 Å²	39.9	15%	0.147	20%	0.198	C	C	.	.	H	α-helix	trans	-61.7	-38.9	175.5	-77.1	165	0	0	0	112.5	C944 N950 S951 M953 F977 C981	C944-L948 VanDerWaalsContact O-CB 3.28Å; C944-L948 WeakPolarHBondContact O-CB 3.39Å; C944-L948 WeakPolarHBondContact O-CD1 3.47Å; C944-L948 VanDerWaalsContact O-CG 3.24Å; C944-L948 WeakPolarHBondContact O-CG 3.19Å; C944-L948 PolarHBondContact O-N 3.26Å; L948-N950 VanDerWaalsContact C-N 3.29Å; L948-N950 PolarHBondContact O-N 3.43Å; L948-S951 PolarHBondContact O-N 2.86Å; L948-M953 HydrophobicContact CB-CE 4.31Å; L948-M953 HydrophobicContact CD2-CE 3.35Å; L948-M953 HydrophobicContact CD2-SD 3.71Å; L948-M953 HydrophobicContact CG-CE 3.79Å; L948-F977 HydrophobicContact CD1-CE1 3.87Å; L948-F977 HydrophobicContact CD1-CZ 4.49Å; L948-C981 HydrophobicContact CD1-CB 3.79Å; L948-C981 HydrophobicContact CD2-CB 4.17Å
949	K	81.6	Confident	84.3	Confident	171 Å²	171	41.7 Å²	41.7	74%	0.743	21%	0.209	S	C	*	.	H	α-helix	trans	-66	-32.5	175.9	-76.8	174.6	-178.9	-179	0	112.5	S945 V946 Q947	S945-K949 WeakPolarHBondContact O-CD 3.24Å; S945-K949 VanDerWaalsContact O-CG 3.25Å; S945-K949 WeakPolarHBondContact O-CG 3.26Å; S945-K949 PolarHBondContact O-N 3.32Å; V946-K949 PolarHBondContact O-N 2.67Å; Q947-K949 VanDerWaalsContact C-N 3.33Å; Q947-K949 PolarHBondContact O-N 3.21Å
950	N	76.3	Confident	83.9	Confident	69 Å²	69	41.6 Å²	41.6	37%	0.369	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	3.2	-179.6	-63.7	-31	0	0	0	113.7	V946 Q947 L948 L952	V946-N950 PolarHBondContact O-N 3.43Å; V946-N950 PolarHBondContact O-ND2 3.32Å; Q947-N950 CarbonylContact O-C 3.58Å; Q947-N950 PolarHBondContact O-N 3.22Å; L948-N950 VanDerWaalsContact C-N 3.29Å; L948-N950 PolarHBondContact O-N 3.43Å; N950-L952 HydrophobicContact CB-CD1 3.88Å; N950-L952 HydrophobicContact CB-CG 3.94Å; N950-L952 PolarHBondContact O-N 2.99Å
951	S	73.6	Confident	83.4	Confident	79 Å²	79	41.8 Å²	41.8	55%	0.552	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.3	26.7	-177.4	-51.3	0	0	0	0	114.8	Q947 L948 M953	Q947-S951 PolarHBondContact O-N 3.05Å; Q947-S951 VanDerWaalsContact O-N 3.1Å; L948-S951 PolarHBondContact O-N 2.86Å; S951-M953 VanDerWaalsContact C-N 3.35Å; S951-M953 PolarHBondContact O-N 3.4Å
952	L	76.4	Confident	82.8	Confident	51 Å²	51	39 Å²	39	27%	0.267	20%	0.202	S	C	.	.			trans	-92.1	56.1	-177	-64.8	174.9	0	0	0	112.2	Q947 N950 V954 Q955 L956	Q947-L952 PolarHBondContact O-N 3.4Å; Q947-L952 VanDerWaalsContact O-N 3.14Å; Q947-L952 VanDerWaalsContact OE1-CD1 3.24Å; N950-L952 HydrophobicContact CB-CD1 3.88Å; N950-L952 HydrophobicContact CB-CG 3.94Å; N950-L952 PolarHBondContact O-N 2.99Å; L952-V954 PolarHBondContact O-N 3.38Å; L952-Q955 HydrophobicContact CB-CB 4.47Å; L952-L956 WeakPolarHBondContact O-CB 3.23Å; L952-L956 PolarHBondContact O-N 3.25Å; L952-L956 VanDerWaalsContact O-N 3.11Å
953	M	80.6	Confident	82.2	Confident	11 Å²	11	41.6 Å²	41.6	5%	0.054	22%	0.218	C	C	.	.	H	α-helix	trans	-65.1	-38.5	-175.4	-72.7	-59.6	93.7	0	0	114.1	L948 S951 Q955 L956 R957 Y982	L948-M953 HydrophobicContact CB-CE 4.31Å; L948-M953 HydrophobicContact CD2-CE 3.35Å; L948-M953 HydrophobicContact CD2-SD 3.71Å; L948-M953 HydrophobicContact CG-CE 3.79Å; S951-M953 VanDerWaalsContact C-N 3.35Å; S951-M953 PolarHBondContact O-N 3.4Å; M953-Q955 PolarHBondContact O-N 3.44Å; M953-L956 HydrophobicContact CE-CB 4.4Å; M953-L956 HydrophobicContact CE-CD2 3.49Å; M953-L956 VanDerWaalsContact CE-CD2 3.49Å; M953-L956 PolarHBondContact O-N 3.22Å; M953-L956 HydrophobicContact SD-CD2 4.1Å; M953-R957 WeakPolarHBondContact O-CG 3.48Å; M953-R957 PolarHBondContact O-N 2.95Å; M953-Y982 HydrophobicContact CG-CD2 3.74Å; M953-Y982 HydrophobicContact CG-CE2 3.91Å; M953-Y982 HydrophobicContact CG-CG 4.1Å; M953-Y982 HydrophobicContact SD-CD2 4.11Å; M953-Y982 HydrophobicContact SD-CG 4.15Å
954	V	77.1	Confident	81.3	Confident	30 Å²	30	46.5 Å²	46.5	18%	0.182	24%	0.241	C	C	.	.	H	α-helix	trans	-62.9	-45.8	179.8	178.8	0	0	0	0	110.8	D113 L952 L956 R957 R958	D113-V954 HydrophobicContact CB-CG1 3.83Å; L952-V954 PolarHBondContact O-N 3.38Å; V954-L956 PolarHBondContact O-N 3.48Å; V954-R957 PolarHBondContact O-N 3.3Å; V954-R958 WeakPolarHBondContact O-CG 3.3Å; V954-R958 PolarHBondContact O-N 2.95Å
955	Q	75.6	Confident	80.1	Confident	101 Å²	101	48.2 Å²	48.2	47%	0.472	25%	0.253	S	S	.	.	H	α-helix	trans	-64.1	-41.9	177.6	-171.7	176.2	-2.1	0	0	111.6	L952 M953 R958 S959	L952-Q955 HydrophobicContact CB-CB 4.47Å; M953-Q955 PolarHBondContact O-N 3.44Å; Q955-R958 PolarHBondContact O-N 3.34Å; Q955-S959 WeakPolarHBondContact O-CB 3.43Å; Q955-S959 PolarHBondContact O-N 3.38Å; Q955-S959 PolarHBondContact O-OG 3.1Å; Q955-S959 VanDerWaalsContact O-OG 3.08Å
956	L	82.6	Confident	79.4	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-57.6	-51	176.2	179.1	56.3	0	0	0	111.4	F943 Q947 L952 M953 V954 R958 S959 L960 A978	F943-L956 HydrophobicContact CD1-CD1 3.61Å; F943-L956 HydrophobicContact CE1-CD1 3.46Å; F943-L956 VanDerWaalsContact CE1-CD1 3.46Å; Q947-L956 HydrophobicContact CB-CB 4.13Å; Q947-L956 HydrophobicContact CB-CD1 4.29Å; Q947-L956 HydrophobicContact CB-CD2 4.13Å; Q947-L956 HydrophobicContact CB-CG 4.43Å; Q947-L956 HydrophobicContact CG-CB 4.4Å; Q947-L956 HydrophobicContact CG-CD1 4.27Å; L952-L956 WeakPolarHBondContact O-CB 3.23Å; L952-L956 PolarHBondContact O-N 3.25Å; L952-L956 VanDerWaalsContact O-N 3.11Å; M953-L956 HydrophobicContact CE-CB 4.4Å; M953-L956 HydrophobicContact CE-CD2 3.49Å; M953-L956 VanDerWaalsContact CE-CD2 3.49Å; M953-L956 PolarHBondContact O-N 3.22Å; M953-L956 HydrophobicContact SD-CD2 4.1Å; V954-L956 PolarHBondContact O-N 3.48Å; L956-R958 PolarHBondContact O-N 2.61Å; L956-S959 WeakPolarHBondContact CA-OG 3.11Å; L956-S959 PolarHBondContact O-N 3.21Å; L956-S959 PolarHBondContact O-OG 2.79Å; L956-L960 HydrophobicContact CD1-CD1 3.89Å; L956-L960 HydrophobicContact CD1-CG 4.09Å; L956-L960 HydrophobicContact CG-CD1 4.16Å; L956-L960 WeakPolarHBondContact O-CG 3.38Å; L956-L960 PolarHBondContact O-N 3.47Å; L956-L960 VanDerWaalsContact O-N 3.1Å; L956-A978 HydrophobicContact CD2-CB 3.51Å; L956-A978 HydrophobicContact CG-CB 4.34Å
957	R	83.1	Confident	79.4	Confident	34 Å²	34	52.7 Å²	52.7	13%	0.128	27%	0.267	C	S	.	.	H	α-helix	trans	-55.8	-48.6	178.9	-71.9	171.4	-174.1	143.2	10.1	112.4	Y123 M953 V954 S959 L960 E979	Y123-R957 PolarHBondContact OH-NH1 3.37Å; M953-R957 WeakPolarHBondContact O-CG 3.48Å; M953-R957 PolarHBondContact O-N 2.95Å; V954-R957 PolarHBondContact O-N 3.3Å; R957-S959 PolarHBondContact O-N 3.47Å; R957-L960 PolarHBondContact O-N 3.32Å; R957-E979 IonicContact CZ-OE1 2.87Å; R957-E979 IonicContact CZ-OE2 3.63Å; R957-E979 IonicContact NE-OE1 2.87Å; R957-E979 PolarHBondContact NE-OE1 3.3Å; R957-E979 IonicContact NE-OE2 3.86Å; R957-E979 IonicContact NH2-OE1 3.95Å; R957-E979 PolarHBondContact NH2-OE1 3.1Å; R957-E979 VanDerWaalsContact NH2-OE1 3.16Å; R957-E979 IonicContact NH2-OE2 3.92Å; R957-E979 PolarHBondContact NH2-OE2 3.22Å
958	R	79.4	Confident	79.6	Confident	103 Å²	103	53.2 Å²	53.2	39%	0.389	27%	0.271	S	S	.	.	H	α-helix	trans	-60.7	-45.3	178.2	-71.3	173.5	174.3	-170.7	-9.6	112.4	Y112 D113 V954 Q955 L956 L960 G961	Y112-R958 PolarHBondContact O-NH2 3.17Å; D113-R958 IonicContact OD1-CZ 3.07Å; D113-R958 IonicContact OD1-NE 3.29Å; D113-R958 PolarHBondContact OD1-NE 2.97Å; D113-R958 IonicContact OD1-NH2 2.65Å; D113-R958 PolarHBondContact OD1-NH2 3.15Å; V954-R958 WeakPolarHBondContact O-CG 3.3Å; V954-R958 PolarHBondContact O-N 2.95Å; Q955-R958 PolarHBondContact O-N 3.34Å; L956-R958 PolarHBondContact O-N 2.61Å; R958-L960 VanDerWaalsContact C-N 3.33Å; R958-L960 PolarHBondContact O-N 2.93Å; R958-G961 PolarHBondContact O-N 2.75Å
959	S	82.4	Confident	79.9	Confident	51 Å²	51	52 Å²	52	36%	0.357	27%	0.265	S	S	.	.	H	α-helix	trans	-69.6	-27.6	-175.5	63.1	0	0	0	0	114.1	F943 Q955 L956 R957 G961	F943-S959 WeakPolarHBondContact CE1-OG 3.16Å; F943-S959 VanDerWaalsContact CZ-OG 3.25Å; F943-S959 WeakPolarHBondContact CZ-OG 3.5Å; Q955-S959 WeakPolarHBondContact O-CB 3.43Å; Q955-S959 PolarHBondContact O-N 3.38Å; Q955-S959 PolarHBondContact O-OG 3.1Å; Q955-S959 VanDerWaalsContact O-OG 3.08Å; L956-S959 WeakPolarHBondContact CA-OG 3.11Å; L956-S959 PolarHBondContact O-N 3.21Å; L956-S959 PolarHBondContact O-OG 2.79Å; R957-S959 PolarHBondContact O-N 3.47Å; S959-G961 VanDerWaalsContact C-N 3.32Å
960	L	85.7	Confident	80.3	Confident	5 Å²	5	44 Å²	44	3%	0.026	23%	0.23	C	C	.	.	H	α-helix	trans	-75	-23.1	176.6	-68.9	174.1	0	0	0	112.5	L940 L956 R957 R958 V962 A974 A975	L940-L960 HydrophobicContact CD2-CD2 3.93Å; L956-L960 HydrophobicContact CD1-CD1 3.89Å; L956-L960 HydrophobicContact CD1-CG 4.09Å; L956-L960 HydrophobicContact CG-CD1 4.16Å; L956-L960 WeakPolarHBondContact O-CG 3.38Å; L956-L960 PolarHBondContact O-N 3.47Å; L956-L960 VanDerWaalsContact O-N 3.1Å; R957-L960 PolarHBondContact O-N 3.32Å; R958-L960 VanDerWaalsContact C-N 3.33Å; R958-L960 PolarHBondContact O-N 2.93Å; L960-V962 VanDerWaalsContact C-N 3.28Å; L960-V962 HydrophobicContact CB-CG1 4.2Å; L960-V962 PolarHBondContact O-N 3.17Å; L960-A974 HydrophobicContact CD2-CB 4.15Å; L960-A975 HydrophobicContact CD1-CB 3.79Å
961	G	83	Confident	81.1	Confident	7 Å²	7	43 Å²	43	7%	0.072	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.4	30.7	172.2	0	0	0	0	0	114.5	R958 S959 T963 Q964	R958-G961 PolarHBondContact O-N 2.75Å; S959-G961 VanDerWaalsContact C-N 3.32Å; G961-T963 PolarHBondContact O-N 2.78Å; G961-T963 VanDerWaalsContact O-N 3.12Å; G961-Q964 VanDerWaalsContact O-CB 3.26Å; G961-Q964 WeakPolarHBondContact O-CB 3.2Å; G961-Q964 VanDerWaalsContact O-CG 3.25Å; G961-Q964 WeakPolarHBondContact O-CG 2.89Å; G961-Q964 PolarHBondContact O-N 3.33Å
962	V	83	Confident	82	Confident	7 Å²	7	39.2 Å²	39.2	4%	0.042	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-13.9	-175	-66.6	0	0	0	0	114.8	F122 L960 Q964 F972 A975 L1005	F122-V962 HydrophobicContact CE2-CG2 4.07Å; L960-V962 VanDerWaalsContact C-N 3.28Å; L960-V962 HydrophobicContact CB-CG1 4.2Å; L960-V962 PolarHBondContact O-N 3.17Å; V962-Q964 VanDerWaalsContact C-N 3.27Å; V962-F972 HydrophobicContact CB-CD1 4.13Å; V962-F972 HydrophobicContact CB-CE1 3.78Å; V962-F972 HydrophobicContact CG1-CD1 3.99Å; V962-F972 HydrophobicContact CG1-CE1 4.14Å; V962-A975 HydrophobicContact CG1-CB 3.67Å; V962-L1005 HydrophobicContact CG2-CD1 4.34Å
963	T	77.5	Confident	82.8	Confident	66 Å²	66	36.8 Å²	36.8	41%	0.405	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-10.2	173.6	50.6	0	0	0	0	112.8	G961 L1005	G961-T963 PolarHBondContact O-N 2.78Å; G961-T963 VanDerWaalsContact O-N 3.12Å; T963-L1005 HydrophobicContact CG2-CD1 4.28Å
964	Q	75	Confident	83.4	Confident	109 Å²	109	36.2 Å²	36.2	51%	0.509	18%	0.18	S	C	.	.	S	Bend	trans	-74.3	135.4	177.1	-62.3	172.9	3.8	0	0	110.8	G961 V962 K966 C967	G961-Q964 VanDerWaalsContact O-CB 3.26Å; G961-Q964 WeakPolarHBondContact O-CB 3.2Å; G961-Q964 VanDerWaalsContact O-CG 3.25Å; G961-Q964 WeakPolarHBondContact O-CG 2.89Å; G961-Q964 PolarHBondContact O-N 3.33Å; V962-Q964 VanDerWaalsContact C-N 3.27Å; Q964-K966 PolarHBondContact O-N 3.26Å; Q964-K966 VanDerWaalsContact O-N 3.1Å; Q964-C967 WeakPolarHBondContact O-CB 2.94Å; Q964-C967 PolarHBondContact O-N 2.79Å
965	S	66.8	Low	84.2	Confident	36 Å²	36	35.1 Å²	35.1	25%	0.252	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-23.8	-177.1	55.6	0	0	0	0	114.5	P27	P27-S965 WeakPolarHBondContact O-CB 3.12Å; P27-S965 PolarHBondContact O-OG 3.43Å
966	K	73.3	Confident	85	Confident	146 Å²	146	30.3 Å²	30.3	64%	0.635	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.6	22.7	177.4	-65.6	-173.9	173.8	178.3	0	113.9	Q964 S968	Q964-K966 PolarHBondContact O-N 3.26Å; Q964-K966 VanDerWaalsContact O-N 3.1Å; K966-S968 PolarHBondContact O-N 3.33Å
967	C	85.7	Confident	85.5	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.155	C	C	.	.			trans	-60.9	132.2	176.4	-178.1	0	0	0	0	110.7	Q964 R971 F972 Q1010	Q964-C967 WeakPolarHBondContact O-CB 2.94Å; Q964-C967 PolarHBondContact O-N 2.79Å; C967-R971 VanDerWaalsContact SG-CB 3.53Å; C967-F972 HydrophobicContact CB-CD2 4.29Å; C967-F972 HydrophobicContact CB-CE2 3.56Å; C967-F972 HydrophobicContact CB-CZ 3.75Å; C967-F972 WeakPolarHBondContact O-CE2 3.32Å; C967-Q1010 PolarHBondContact O-NE2 3.02Å
968	S	88	Confident	85.9	Confident	11 Å²	11	29.6 Å²	29.6	8%	0.077	15%	0.149	C	C	.	.			trans	-78	158.7	-178	65.3	0	0	0	0	112.5	N935 K966 A970 R971 F972	N935-S968 WeakPolarHBondContact OD1-CB 3.06Å; N935-S968 PolarHBondContact OD1-OG 3.21Å; K966-S968 PolarHBondContact O-N 3.33Å; S968-A970 VanDerWaalsContact C-N 3.26Å; S968-A970 PolarHBondContact O-N 3.38Å; S968-R971 PolarHBondContact O-N 3.26Å; S968-F972 WeakPolarHBondContact O-CD2 3.33Å; S968-F972 PolarHBondContact O-N 2.93Å; S968-F972 VanDerWaalsContact O-N 3.17Å
969	V	90.2	Very high	86.4	Confident	4 Å²	4	25.1 Å²	25.1	2%	0.024	13%	0.132	C	C	.	.	H	α-helix	trans	-54.4	-43.5	175.3	178	0	0	0	0	111.2	Y613 R971 F972 V973 Q1010 V1015 L1016	Y613-V969 HydrophobicContact CE2-CG1 4.23Å; V969-R971 VanDerWaalsContact C-N 3.34Å; V969-R971 PolarHBondContact O-N 3.36Å; V969-F972 PolarHBondContact O-N 3.44Å; V969-V973 HydrophobicContact CG1-CG2 4.2Å; V969-V973 WeakPolarHBondContact O-CG2 3.29Å; V969-V973 PolarHBondContact O-N 3.49Å; V969-Q1010 HydrophobicContact CG2-CB 4.47Å; V969-Q1010 HydrophobicContact CG2-CG 4.23Å; V969-V1015 HydrophobicContact CG1-CB 4.42Å; V969-V1015 HydrophobicContact CG1-CG1 4.48Å; V969-L1016 HydrophobicContact CG1-CD1 4.33Å; V969-L1016 HydrophobicContact CG1-CD2 4.35Å; V969-L1016 HydrophobicContact CG1-CG 4.15Å; V969-L1016 HydrophobicContact CG2-CD1 4.4Å
970	A	90.8	Very high	86.8	Confident	2 Å²	2	24 Å²	24	2%	0.017	12%	0.121	C	C	.	.	H	α-helix	trans	-57.6	-43	-179.9	0	0	0	0	0	113.1	Y613 N935 V937 L940 S968 V973 A974	Y613-A970 HydrophobicContact CE1-CB 3.8Å; N935-A970 HydrophobicContact CB-CB 4.44Å; V937-A970 HydrophobicContact CG2-CB 4.42Å; L940-A970 HydrophobicContact CD1-CB 3.8Å; S968-A970 VanDerWaalsContact C-N 3.26Å; S968-A970 PolarHBondContact O-N 3.38Å; A970-V973 PolarHBondContact O-N 3.28Å; A970-A974 WeakPolarHBondContact O-CB 3.42Å; A970-A974 PolarHBondContact O-N 3.42Å
971	R	92.1	Very high	87	Confident	47 Å²	47	25.2 Å²	25.2	18%	0.177	13%	0.13	C	C	.	.	H	α-helix	trans	-69.1	-38.5	177.4	-74.9	178.5	173.5	178.1	-6.5	112.4	P934 L940 C967 S968 V969 A974 A975	P934-R971 VanDerWaalsContact CB-CZ 3.46Å; L940-R971 HydrophobicContact CD1-CG 4.43Å; L940-R971 HydrophobicContact CD2-CG 4.26Å; C967-R971 VanDerWaalsContact SG-CB 3.53Å; S968-R971 PolarHBondContact O-N 3.26Å; V969-R971 VanDerWaalsContact C-N 3.34Å; V969-R971 PolarHBondContact O-N 3.36Å; R971-A974 PolarHBondContact O-N 2.64Å; R971-A975 WeakPolarHBondContact O-CB 3.46Å; R971-A975 PolarHBondContact O-N 3.45Å
972	F	93.3	Very high	87.1	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.4	-45.4	172.5	-79.9	-63.1	0	0	0	111.6	V962 C967 S968 V969 A974 A975 I976 V1002 L1005 A1006 A1009 Q1010 L1016	V962-F972 HydrophobicContact CB-CD1 4.13Å; V962-F972 HydrophobicContact CB-CE1 3.78Å; V962-F972 HydrophobicContact CG1-CD1 3.99Å; V962-F972 HydrophobicContact CG1-CE1 4.14Å; C967-F972 HydrophobicContact CB-CD2 4.29Å; C967-F972 HydrophobicContact CB-CE2 3.56Å; C967-F972 HydrophobicContact CB-CZ 3.75Å; C967-F972 WeakPolarHBondContact O-CE2 3.32Å; S968-F972 WeakPolarHBondContact O-CD2 3.33Å; S968-F972 PolarHBondContact O-N 2.93Å; S968-F972 VanDerWaalsContact O-N 3.17Å; V969-F972 PolarHBondContact O-N 3.44Å; F972-A974 VanDerWaalsContact C-N 3.3Å; F972-A974 PolarHBondContact O-N 3.12Å; F972-A975 PolarHBondContact O-N 2.99Å; F972-I976 WeakPolarHBondContact O-CB 3.34Å; F972-I976 WeakPolarHBondContact O-CD1 3.48Å; F972-I976 VanDerWaalsContact O-CG1 3.22Å; F972-I976 WeakPolarHBondContact O-CG1 3.39Å; F972-I976 PolarHBondContact O-N 3.49Å; F972-V1002 HydrophobicContact CD1-CG1 4.42Å; F972-L1005 HydrophobicContact CE1-CB 4.08Å; F972-A1006 HydrophobicContact CB-CB 4.37Å; F972-A1006 HydrophobicContact CD1-CB 3.69Å; F972-A1006 HydrophobicContact CD2-CB 4.41Å; F972-A1006 HydrophobicContact CE1-CB 4.01Å; F972-A1006 HydrophobicContact CG-CB 3.92Å; F972-A1009 HydrophobicContact CE2-CB 3.76Å; F972-A1009 HydrophobicContact CZ-CB 3.69Å; F972-Q1010 HydrophobicContact CD2-CG 3.91Å; F972-Q1010 HydrophobicContact CE2-CG 3.8Å; F972-L1016 HydrophobicContact CB-CD1 4.17Å; F972-L1016 HydrophobicContact CB-CD2 3.78Å; F972-L1016 HydrophobicContact CD2-CD1 4.33Å; F972-L1016 HydrophobicContact CG-CD1 4.46Å
973	V	93.5	Very high	87.2	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-60.4	-41.8	176.5	175.9	0	0	0	0	111.1	Y613 F617 L620 V969 A970 I976 F977 V1015 L1016 L1019	Y613-V973 HydrophobicContact CD1-CB 4.26Å; Y613-V973 HydrophobicContact CD1-CG1 4.15Å; Y613-V973 HydrophobicContact CD1-CG2 4.3Å; Y613-V973 HydrophobicContact CD2-CG2 4.47Å; Y613-V973 HydrophobicContact CG-CG1 4.16Å; Y613-V973 HydrophobicContact CG-CG2 4.25Å; F617-V973 HydrophobicContact CD2-CG1 3.77Å; F617-V973 HydrophobicContact CE2-CG1 3.91Å; L620-V973 HydrophobicContact CD1-CG1 3.83Å; V969-V973 HydrophobicContact CG1-CG2 4.2Å; V969-V973 WeakPolarHBondContact O-CG2 3.29Å; V969-V973 PolarHBondContact O-N 3.49Å; A970-V973 PolarHBondContact O-N 3.28Å; V973-I976 PolarHBondContact O-N 2.88Å; V973-F977 WeakPolarHBondContact O-CB 3.2Å; V973-F977 PolarHBondContact O-N 2.83Å; V973-V1015 HydrophobicContact CG2-CG1 4.14Å; V973-L1016 HydrophobicContact CG2-CD2 3.86Å; V973-L1019 HydrophobicContact CG1-CD1 4.33Å; V973-L1019 HydrophobicContact CG2-CD1 4.04Å
974	A	93.6	Very high	87.5	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-62.2	-41.9	175.3	0	0	0	0	0	112.6	F617 L940 L960 A970 R971 F972 F977 A978	F617-A974 HydrophobicContact CE1-CB 4.39Å; F617-A974 HydrophobicContact CZ-CB 3.84Å; L940-A974 HydrophobicContact CB-CB 3.94Å; L940-A974 HydrophobicContact CD1-CB 4.26Å; L940-A974 HydrophobicContact CD2-CB 4.21Å; L940-A974 HydrophobicContact CG-CB 4.38Å; L960-A974 HydrophobicContact CD2-CB 4.15Å; A970-A974 WeakPolarHBondContact O-CB 3.42Å; A970-A974 PolarHBondContact O-N 3.42Å; R971-A974 PolarHBondContact O-N 2.64Å; F972-A974 VanDerWaalsContact C-N 3.3Å; F972-A974 PolarHBondContact O-N 3.12Å; A974-F977 PolarHBondContact O-N 3.32Å; A974-A978 WeakPolarHBondContact O-CB 3.4Å; A974-A978 PolarHBondContact O-N 3Å
975	A	93.4	Very high	87.8	Confident	6 Å²	6	27.9 Å²	27.9	5%	0.05	13%	0.133	C	C	.	.	H	α-helix	trans	-64.9	-43.5	175.6	0	0	0	0	0	112	L960 V962 R971 F972 F977 A978 E979 V1002	L960-A975 HydrophobicContact CD1-CB 3.79Å; V962-A975 HydrophobicContact CG1-CB 3.67Å; R971-A975 WeakPolarHBondContact O-CB 3.46Å; R971-A975 PolarHBondContact O-N 3.45Å; F972-A975 PolarHBondContact O-N 2.99Å; A975-F977 PolarHBondContact O-N 2.99Å; A975-A978 PolarHBondContact O-N 3.45Å; A975-E979 WeakPolarHBondContact O-CG 3.47Å; A975-E979 PolarHBondContact O-N 3.31Å; A975-V1002 HydrophobicContact CB-CG1 3.92Å
976	I	93.4	Very high	88.4	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-59.5	-47.2	175.2	-70.8	158.6	0	0	0	110.2	L620 F972 V973 A978 F980 L999 V1002 F1003 L1016 F1023	L620-I976 HydrophobicContact CD2-CG2 4.06Å; F972-I976 WeakPolarHBondContact O-CB 3.34Å; F972-I976 WeakPolarHBondContact O-CD1 3.48Å; F972-I976 VanDerWaalsContact O-CG1 3.22Å; F972-I976 WeakPolarHBondContact O-CG1 3.39Å; F972-I976 PolarHBondContact O-N 3.49Å; V973-I976 PolarHBondContact O-N 2.88Å; I976-A978 VanDerWaalsContact C-N 3.34Å; I976-A978 PolarHBondContact O-N 2.99Å; I976-F980 WeakPolarHBondContact O-CB 3.29Å; I976-F980 PolarHBondContact O-N 3.49Å; I976-L999 HydrophobicContact CG2-CD1 4.17Å; I976-V1002 HydrophobicContact CG1-CG1 3.73Å; I976-F1003 HydrophobicContact CB-CZ 4.44Å; I976-F1003 HydrophobicContact CD1-CD1 4Å; I976-F1003 HydrophobicContact CD1-CE1 3.49Å; I976-F1003 VanDerWaalsContact CD1-CE1 3.49Å; I976-F1003 HydrophobicContact CD1-CZ 3.9Å; I976-F1003 HydrophobicContact CG1-CD1 4.41Å; I976-F1003 HydrophobicContact CG1-CE1 3.97Å; I976-F1003 HydrophobicContact CG1-CE2 4.4Å; I976-F1003 HydrophobicContact CG1-CZ 3.91Å; I976-F1003 HydrophobicContact CG2-CE1 4.33Å; I976-F1003 HydrophobicContact CG2-CE2 4.18Å; I976-F1003 HydrophobicContact CG2-CZ 3.61Å; I976-L1016 HydrophobicContact CD1-CD2 3.74Å; I976-F1023 HydrophobicContact CG2-CD2 4.33Å; I976-F1023 HydrophobicContact CG2-CE2 3.41Å; I976-F1023 VanDerWaalsContact CG2-CE2 3.41Å; I976-F1023 HydrophobicContact CG2-CZ 3.88Å
977	F	93.2	Very high	88.6	Confident	20 Å²	20	28.4 Å²	28.4	9%	0.088	13%	0.129	C	C	.	.	H	α-helix	trans	-58	-46.3	175.1	164.3	-94.4	0	0	0	111.9	F617 S619 L620 C944 L948 V973 A974 A975 F980 C981	F617-F977 HydrophobicContact CB-CB 4.49Å; F617-F977 HydrophobicContact CB-CD2 3.81Å; F617-F977 HydrophobicContact CB-CE2 4.33Å; F617-F977 HydrophobicContact CB-CG 4.31Å; F617-F977 HydrophobicContact CD1-CB 3.77Å; F617-F977 AromaticContact CD1-CD1 3.63Å; F617-F977 HydrophobicContact CD1-CD1 3.63Å; F617-F977 AromaticContact CD1-CD2 3.54Å; F617-F977 HydrophobicContact CD1-CD2 3.54Å; F617-F977 HydrophobicContact CD1-CE1 4.07Å; F617-F977 AromaticContact CD1-CE2 3.92Å; F617-F977 HydrophobicContact CD1-CE2 3.92Å; F617-F977 AromaticContact CD1-CG 3.35Å; F617-F977 HydrophobicContact CD1-CG 3.35Å; F617-F977 HydrophobicContact CD1-CZ 4.2Å; F617-F977 HydrophobicContact CE1-CB 4.17Å; F617-F977 AromaticContact CE1-CD1 3.8Å; F617-F977 HydrophobicContact CE1-CD1 3.8Å; F617-F977 HydrophobicContact CE1-CD2 4.49Å; F617-F977 HydrophobicContact CE1-CE1 4.31Å; F617-F977 AromaticContact CE1-CG 3.91Å; F617-F977 HydrophobicContact CE1-CG 3.91Å; F617-F977 HydrophobicContact CG-CB 4.23Å; F617-F977 HydrophobicContact CG-CD2 4.09Å; F617-F977 HydrophobicContact CG-CG 4.13Å; S619-F977 VanDerWaalsContact OG-CD2 3.25Å; S619-F977 WeakPolarHBondContact OG-CD2 3.42Å; S619-F977 WeakPolarHBondContact OG-CE2 3.42Å; L620-F977 HydrophobicContact CD1-CB 4.35Å; L620-F977 HydrophobicContact CD2-CB 4.03Å; L620-F977 HydrophobicContact CG-CB 4.22Å; L620-F977 HydrophobicContact CG-CD2 4.29Å; C944-F977 HydrophobicContact CB-CD1 3.82Å; C944-F977 HydrophobicContact CB-CE1 3.69Å; L948-F977 HydrophobicContact CD1-CE1 3.87Å; L948-F977 HydrophobicContact CD1-CZ 4.49Å; V973-F977 WeakPolarHBondContact O-CB 3.2Å; V973-F977 PolarHBondContact O-N 2.83Å; A974-F977 PolarHBondContact O-N 3.32Å; A975-F977 PolarHBondContact O-N 2.99Å; F977-F980 PolarHBondContact O-N 3.38Å; F977-C981 WeakPolarHBondContact O-CB 2.92Å; F977-C981 PolarHBondContact O-N 3.39Å; F977-C981 PolarHBondContact O-SG 3.14Å
978	A	91.6	Very high	88.3	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.008	16%	0.155	C	C	.	.	H	α-helix	trans	-62.5	-52.2	-179.1	0	0	0	0	0	112.3	L956 A974 A975 I976 F980 C981 Y982	L956-A978 HydrophobicContact CD2-CB 3.51Å; L956-A978 HydrophobicContact CG-CB 4.34Å; A974-A978 WeakPolarHBondContact O-CB 3.4Å; A974-A978 PolarHBondContact O-N 3Å; A975-A978 PolarHBondContact O-N 3.45Å; I976-A978 VanDerWaalsContact C-N 3.34Å; I976-A978 PolarHBondContact O-N 2.99Å; A978-F980 VanDerWaalsContact C-N 3.29Å; A978-F980 PolarHBondContact O-N 3.17Å; A978-C981 PolarHBondContact O-N 3.41Å; A978-Y982 WeakPolarHBondContact O-CB 3.38Å; A978-Y982 PolarHBondContact O-N 3.24Å
979	E	89.8	Confident	87.7	Confident	9 Å²	9	36.1 Å²	36.1	4%	0.042	17%	0.172	C	C	.	.	H	α-helix	trans	-63.9	-36.5	178.3	-67.6	-54.6	151.2	0	0	111.5	R957 A975 Y982 F983 L999 V1002	R957-E979 IonicContact CZ-OE1 2.87Å; R957-E979 IonicContact CZ-OE2 3.63Å; R957-E979 IonicContact NE-OE1 2.87Å; R957-E979 PolarHBondContact NE-OE1 3.3Å; R957-E979 IonicContact NE-OE2 3.86Å; R957-E979 IonicContact NH2-OE1 3.95Å; R957-E979 PolarHBondContact NH2-OE1 3.1Å; R957-E979 VanDerWaalsContact NH2-OE1 3.16Å; R957-E979 IonicContact NH2-OE2 3.92Å; R957-E979 PolarHBondContact NH2-OE2 3.22Å; A975-E979 WeakPolarHBondContact O-CG 3.47Å; A975-E979 PolarHBondContact O-N 3.31Å; E979-Y982 PolarHBondContact O-N 3.19Å; E979-F983 VanDerWaalsContact O-CB 3.29Å; E979-F983 WeakPolarHBondContact O-CB 3.44Å; E979-F983 PolarHBondContact O-N 3.09Å; E979-L999 HydrophobicContact CB-CB 4.42Å; E979-L999 HydrophobicContact CB-CD1 4.01Å; E979-V1002 HydrophobicContact CG-CG2 4.02Å
980	F	90.1	Very high	86.4	Confident	29 Å²	29	44.4 Å²	44.4	13%	0.127	21%	0.211	C	C	.	.	H	α-helix	trans	-66	-46.9	176.5	-180	-116.8	0	0	0	112.5	S619 I976 F977 A978 Y982 F983 V984 L999 F1023 L1026	S619-F980 VanDerWaalsContact O-CE1 3.27Å; S619-F980 WeakPolarHBondContact O-CE1 3.49Å; I976-F980 WeakPolarHBondContact O-CB 3.29Å; I976-F980 PolarHBondContact O-N 3.49Å; F977-F980 PolarHBondContact O-N 3.38Å; A978-F980 VanDerWaalsContact C-N 3.29Å; A978-F980 PolarHBondContact O-N 3.17Å; F980-Y982 PolarHBondContact O-N 3.16Å; F980-F983 HydrophobicContact CD2-CD1 4.33Å; F980-F983 HydrophobicContact CE2-CD1 4.4Å; F980-F983 WeakPolarHBondContact O-CB 3.35Å; F980-F983 PolarHBondContact O-N 3.1Å; F980-V984 HydrophobicContact CD1-CG2 4.38Å; F980-V984 HydrophobicContact CD2-CG2 4.12Å; F980-V984 HydrophobicContact CE1-CG2 3.92Å; F980-V984 HydrophobicContact CE2-CG2 3.67Å; F980-V984 HydrophobicContact CG-CG2 4.49Å; F980-V984 HydrophobicContact CZ-CG2 3.57Å; F980-V984 WeakPolarHBondContact O-CG2 3.47Å; F980-V984 PolarHBondContact O-N 2.63Å; F980-L999 HydrophobicContact CD2-CD2 4.45Å; F980-F1023 HydrophobicContact CB-CE1 3.95Å; F980-F1023 HydrophobicContact CB-CZ 3.98Å; F980-F1023 AromaticContact CD1-CE1 3.94Å; F980-F1023 HydrophobicContact CD1-CE1 3.94Å; F980-F1023 HydrophobicContact CD1-CZ 4.23Å; F980-F1023 AromaticContact CD2-CD1 3.91Å; F980-F1023 HydrophobicContact CD2-CD1 3.91Å; F980-F1023 AromaticContact CD2-CE1 3.19Å; F980-F1023 HydrophobicContact CD2-CE1 3.19Å; F980-F1023 HydrophobicContact CD2-CZ 4.07Å; F980-F1023 HydrophobicContact CE1-CE1 4.21Å; F980-F1023 HydrophobicContact CE2-CD1 4.03Å; F980-F1023 AromaticContact CE2-CE1 3.5Å; F980-F1023 HydrophobicContact CE2-CE1 3.5Å; F980-F1023 VanDerWaalsContact CE2-CE1 3.5Å; F980-F1023 HydrophobicContact CG-CD1 4.49Å; F980-F1023 AromaticContact CG-CE1 3.4Å; F980-F1023 HydrophobicContact CG-CE1 3.4Å; F980-F1023 AromaticContact CG-CZ 3.81Å; F980-F1023 HydrophobicContact CG-CZ 3.81Å; F980-F1023 AromaticContact CZ-CE1 3.99Å; F980-F1023 HydrophobicContact CZ-CE1 3.99Å; F980-L1026 HydrophobicContact CZ-CD1 4.45Å
981	C	89	Confident	84.6	Confident	30 Å²	30	52 Å²	52	20%	0.203	25%	0.248	C	C	.	.	H	α-helix	trans	-59.9	-39.5	176.3	-68.9	0	0	0	0	111.4	S619 L948 F977 A978 K985	S619-C981 PolarHBondContact OG-SG 3.2Å; L948-C981 HydrophobicContact CD1-CB 3.79Å; L948-C981 HydrophobicContact CD2-CB 4.17Å; F977-C981 WeakPolarHBondContact O-CB 2.92Å; F977-C981 PolarHBondContact O-N 3.39Å; F977-C981 PolarHBondContact O-SG 3.14Å; A978-C981 PolarHBondContact O-N 3.41Å; C981-K985 WeakPolarHBondContact O-CB 3.46Å; C981-K985 PolarHBondContact O-N 3.23Å
982	Y	85.8	Confident	82.8	Confident	77 Å²	77	54.4 Å²	54.4	30%	0.302	27%	0.271	S	S	.	.	H	α-helix	trans	-65.9	-44.6	176.3	-174.6	-111.1	0	0	0	112	M953 A978 E979 F980 K985 L986	M953-Y982 HydrophobicContact CG-CD2 3.74Å; M953-Y982 HydrophobicContact CG-CE2 3.91Å; M953-Y982 HydrophobicContact CG-CG 4.1Å; M953-Y982 HydrophobicContact SD-CD2 4.11Å; M953-Y982 HydrophobicContact SD-CG 4.15Å; A978-Y982 WeakPolarHBondContact O-CB 3.38Å; A978-Y982 PolarHBondContact O-N 3.24Å; E979-Y982 PolarHBondContact O-N 3.19Å; F980-Y982 PolarHBondContact O-N 3.16Å; Y982-K985 PolarHBondContact O-N 3.1Å; Y982-L986 HydrophobicContact CD1-CD1 3.9Å; Y982-L986 HydrophobicContact CD1-CG 4.49Å; Y982-L986 HydrophobicContact CE1-CD1 3.39Å; Y982-L986 HydrophobicContact CE1-CG 4.12Å; Y982-L986 HydrophobicContact CE2-CG 4.42Å; Y982-L986 WeakPolarHBondContact O-CG 3.16Å; Y982-L986 PolarHBondContact O-N 3.45Å
983	F	84.3	Confident	81.2	Confident	25 Å²	25	63.8 Å²	63.8	11%	0.11	31%	0.314	C	S	.	.	H	α-helix	trans	-57.8	-48.2	174.6	170.2	-97.5	0	0	0	112.2	E979 F980 K985 L986 R987 A994 P996 L1027	E979-F983 VanDerWaalsContact O-CB 3.29Å; E979-F983 WeakPolarHBondContact O-CB 3.44Å; E979-F983 PolarHBondContact O-N 3.09Å; F980-F983 HydrophobicContact CD2-CD1 4.33Å; F980-F983 HydrophobicContact CE2-CD1 4.4Å; F980-F983 WeakPolarHBondContact O-CB 3.35Å; F980-F983 PolarHBondContact O-N 3.1Å; F983-K985 VanDerWaalsContact C-N 3.35Å; F983-K985 PolarHBondContact O-N 3.08Å; F983-L986 PolarHBondContact O-N 2.87Å; F983-R987 WeakPolarHBondContact O-CB 3.36Å; F983-R987 PolarHBondContact O-N 3.11Å; F983-A994 HydrophobicContact CD2-CB 3.84Å; F983-A994 HydrophobicContact CE2-CB 3.71Å; F983-A994 WeakPolarHBondContact CE2-O 3.38Å; F983-P996 HydrophobicContact CD2-CB 4.4Å; F983-P996 HydrophobicContact CE2-CB 4.06Å; F983-L1027 HydrophobicContact CE1-CD2 3.91Å; F983-L1027 HydrophobicContact CZ-CD2 3.68Å
984	V	84.3	Confident	80	Confident	34 Å²	34	64.9 Å²	64.9	21%	0.206	32%	0.324	C	S	.	.	H	α-helix	trans	-60.1	-46.5	177.4	172.1	0	0	0	0	110.6	F980 L986 R987 D988	F980-V984 HydrophobicContact CD1-CG2 4.38Å; F980-V984 HydrophobicContact CD2-CG2 4.12Å; F980-V984 HydrophobicContact CE1-CG2 3.92Å; F980-V984 HydrophobicContact CE2-CG2 3.67Å; F980-V984 HydrophobicContact CG-CG2 4.49Å; F980-V984 HydrophobicContact CZ-CG2 3.57Å; F980-V984 WeakPolarHBondContact O-CG2 3.47Å; F980-V984 PolarHBondContact O-N 2.63Å; V984-L986 VanDerWaalsContact C-N 3.34Å; V984-L986 PolarHBondContact O-N 3.23Å; V984-R987 PolarHBondContact O-N 2.97Å; V984-D988 VanDerWaalsContact O-CG 3.24Å; V984-D988 PolarHBondContact O-N 3.34Å
985	K	82.1	Confident	79.1	Confident	109 Å²	109	70 Å²	70	47%	0.474	35%	0.351	S	S	.	.	H	α-helix	trans	-58.3	-44.1	177.4	-174.8	-179.9	178.5	-174.3	0	112	C981 Y982 F983 T989	C981-K985 WeakPolarHBondContact O-CB 3.46Å; C981-K985 PolarHBondContact O-N 3.23Å; Y982-K985 PolarHBondContact O-N 3.1Å; F983-K985 VanDerWaalsContact C-N 3.35Å; F983-K985 PolarHBondContact O-N 3.08Å; K985-T989 WeakPolarHBondContact O-CG2 3.43Å; K985-T989 PolarHBondContact O-N 2.91Å; K985-T989 PolarHBondContact O-OG1 3.32Å
986	L	79.9	Confident	78.5	Confident	57 Å²	57	70.8 Å²	70.8	30%	0.298	36%	0.355	S	S	.	.	H	α-helix	trans	-65.7	-43.1	178	-75	177.7	0	0	0	112.3	Y982 F983 V984 D988 T989 A994	Y982-L986 HydrophobicContact CD1-CD1 3.9Å; Y982-L986 HydrophobicContact CD1-CG 4.49Å; Y982-L986 HydrophobicContact CE1-CD1 3.39Å; Y982-L986 HydrophobicContact CE1-CG 4.12Å; Y982-L986 HydrophobicContact CE2-CG 4.42Å; Y982-L986 WeakPolarHBondContact O-CG 3.16Å; Y982-L986 PolarHBondContact O-N 3.45Å; F983-L986 PolarHBondContact O-N 2.87Å; V984-L986 VanDerWaalsContact C-N 3.34Å; V984-L986 PolarHBondContact O-N 3.23Å; L986-D988 VanDerWaalsContact C-N 3.32Å; L986-D988 PolarHBondContact O-N 3.45Å; L986-T989 WeakPolarHBondContact CA-OG1 3.35Å; L986-T989 PolarHBondContact O-N 2.96Å; L986-T989 PolarHBondContact O-OG1 3.12Å; L986-A994 HydrophobicContact CB-CB 4.04Å
987	R	76.7	Confident	78	Confident	135 Å²	135	72 Å²	72	51%	0.509	36%	0.364	S	S	.	.	H	α-helix	trans	-60.1	-44.7	177.9	-174.3	-164.3	66.6	-166.1	-3.5	111.3	F983 V984 T989 E990 A994	F983-R987 WeakPolarHBondContact O-CB 3.36Å; F983-R987 PolarHBondContact O-N 3.11Å; V984-R987 PolarHBondContact O-N 2.97Å; R987-T989 PolarHBondContact O-N 3.43Å; R987-E990 PolarHBondContact O-N 3.3Å; R987-A994 HydrophobicContact CB-CB 4.17Å
988	D	78.7	Confident	77.4	Confident	101 Å²	101	72.3 Å²	72.3	54%	0.54	37%	0.366	S	S	.	.	H	α-helix	trans	-71.8	-18.1	-177.7	-63.3	-6.8	0	0	0	112.4	V984 L986 E990	V984-D988 VanDerWaalsContact O-CG 3.24Å; V984-D988 PolarHBondContact O-N 3.34Å; L986-D988 VanDerWaalsContact C-N 3.32Å; L986-D988 PolarHBondContact O-N 3.45Å; D988-E990 VanDerWaalsContact C-N 3.3Å; D988-E990 PolarHBondContact O-N 2.92Å
989	T	76.5	Confident	77.2	Confident	72 Å²	72	72.4 Å²	72.4	44%	0.442	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-1.6	176.4	51.2	0	0	0	0	115.2	K985 L986 R987 M991	K985-T989 WeakPolarHBondContact O-CG2 3.43Å; K985-T989 PolarHBondContact O-N 2.91Å; K985-T989 PolarHBondContact O-OG1 3.32Å; L986-T989 WeakPolarHBondContact CA-OG1 3.35Å; L986-T989 PolarHBondContact O-N 2.96Å; L986-T989 PolarHBondContact O-OG1 3.12Å; R987-T989 PolarHBondContact O-N 3.43Å; T989-M991 WeakPolarHBondContact O-CG 3.49Å; T989-M991 PolarHBondContact O-N 3.45Å
990	E	61.4	Low	77.2	Confident	179 Å²	179	73.4 Å²	73.4	84%	0.836	37%	0.37	S	S	*	.			trans	52.9	-5.9	179.1	-65.8	-171.8	171.6	0	0	117.1	R987 D988	R987-E990 PolarHBondContact O-N 3.3Å; D988-E990 VanDerWaalsContact C-N 3.3Å; D988-E990 PolarHBondContact O-N 2.92Å
991	M	54.4	Low	77	Confident	162 Å²	162	73.2 Å²	73.2	80%	0.798	37%	0.37	S	S	*	.	S	Bend	trans	-79.5	-20.6	-171	-72.4	-73.7	100.7	0	0	114	T989	T989-M991 WeakPolarHBondContact O-CG 3.49Å; T989-M991 PolarHBondContact O-N 3.45Å
992	C	53.3	Low	77.1	Confident	97 Å²	97	71.8 Å²	71.8	66%	0.655	36%	0.361	S	S	*	.	S	Bend	trans	-149.7	149.4	-178.3	-80.6	0	0	0	0	111.6	A994	C992-A994 PolarHBondContact O-N 3.49Å
993	H	60.4	Low	77.4	Confident	196 Å²	196	68.5 Å²	68.5	91%	0.907	35%	0.348	S	S	*	.			trans	-61.2	105.9	161.2	-72.7	-71.2	0	0	0	108.2	D995	H993-D995 PolarHBondContact O-N 3.02Å; H993-D995 VanDerWaalsContact O-N 3.14Å
994	A	67.3	Low	77.6	Confident	24 Å²	24	69.7 Å²	69.7	20%	0.198	36%	0.356	C	S	.	.			trans	-65.8	111.8	175.4	0	0	0	0	0	108.9	F983 L986 R987 C992 P996	F983-A994 HydrophobicContact CD2-CB 3.84Å; F983-A994 HydrophobicContact CE2-CB 3.71Å; F983-A994 WeakPolarHBondContact CE2-O 3.38Å; L986-A994 HydrophobicContact CB-CB 4.04Å; R987-A994 HydrophobicContact CB-CB 4.17Å; C992-A994 PolarHBondContact O-N 3.49Å; A994-P996 WeakPolarHBondContact O-CD 3.46Å
995	D	75.2	Confident	77.9	Confident	106 Å²	106	70.7 Å²	70.7	57%	0.567	36%	0.359	S	S	*	.			trans	-82.5	120.9	176.6	-174.4	-2	0	0	0	109.8	H993 S997	H993-D995 PolarHBondContact O-N 3.02Å; H993-D995 VanDerWaalsContact O-N 3.14Å; D995-S997 VanDerWaalsContact CG-OG 3.29Å; D995-S997 PolarHBondContact O-N 3.23Å; D995-S997 VanDerWaalsContact OD1-CB 3.32Å; D995-S997 WeakPolarHBondContact OD1-CB 3.46Å; D995-S997 PolarHBondContact OD1-N 3.48Å; D995-S997 WeakPolarHBondContact OD2-CB 3.38Å; D995-S997 PolarHBondContact OD2-OG 2.9Å
996	P	81.3	Confident	78.3	Confident	23 Å²	23	65.5 Å²	65.5	15%	0.149	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	4.8	175.7	31.9	-36.3	0	0	0	114.2	F983 A994 L998 L999 Y1000 L1027	F983-P996 HydrophobicContact CD2-CB 4.4Å; F983-P996 HydrophobicContact CE2-CB 4.06Å; A994-P996 WeakPolarHBondContact O-CD 3.46Å; P996-L998 VanDerWaalsContact C-N 3.31Å; P996-L998 PolarHBondContact O-N 3.11Å; P996-L999 WeakPolarHBondContact O-CB 3.32Å; P996-L999 PolarHBondContact O-N 2.95Å; P996-L999 VanDerWaalsContact O-N 3.13Å; P996-Y1000 HydrophobicContact CB-CD2 4.29Å; P996-Y1000 HydrophobicContact CB-CE2 4.03Å; P996-Y1000 HydrophobicContact CG-CD2 4.25Å; P996-Y1000 HydrophobicContact CG-CE2 3.71Å; P996-Y1000 WeakPolarHBondContact O-CD2 3.24Å; P996-Y1000 PolarHBondContact O-N 3.33Å; P996-L1027 HydrophobicContact CB-CD1 3.83Å; P996-L1027 HydrophobicContact CB-CD2 4.42Å; P996-L1027 HydrophobicContact CG-CD1 4.34Å
997	S	81.8	Confident	78.7	Confident	25 Å²	25	63.4 Å²	63.4	18%	0.175	33%	0.328	C	S	.	.	H	α-helix	trans	-48.8	-43.8	-178.2	60.6	0	0	0	0	114.8	D995 Y1000 N1001	D995-S997 VanDerWaalsContact CG-OG 3.29Å; D995-S997 PolarHBondContact O-N 3.23Å; D995-S997 VanDerWaalsContact OD1-CB 3.32Å; D995-S997 WeakPolarHBondContact OD1-CB 3.46Å; D995-S997 PolarHBondContact OD1-N 3.48Å; D995-S997 WeakPolarHBondContact OD2-CB 3.38Å; D995-S997 PolarHBondContact OD2-OG 2.9Å; S997-Y1000 WeakPolarHBondContact O-CB 3.43Å; S997-Y1000 PolarHBondContact O-N 2.95Å; S997-N1001 VanDerWaalsContact O-CG 3.31Å; S997-N1001 PolarHBondContact O-N 3.39Å
998	L	81.7	Confident	79.1	Confident	27 Å²	27	59.2 Å²	59.2	14%	0.141	32%	0.315	C	S	.	.	H	α-helix	trans	-64.7	-44.3	179.8	-65.9	173.1	0	0	0	111.9	F122 Y123 P996 Y1000 N1001 V1002	F122-L998 HydrophobicContact CD1-CD2 3.52Å; F122-L998 HydrophobicContact CE1-CB 4.21Å; F122-L998 HydrophobicContact CE1-CD2 3.98Å; Y123-L998 HydrophobicContact CD1-CD2 4.39Å; Y123-L998 HydrophobicContact CE1-CD2 4.06Å; P996-L998 VanDerWaalsContact C-N 3.31Å; P996-L998 PolarHBondContact O-N 3.11Å; L998-Y1000 VanDerWaalsContact C-N 3.27Å; L998-Y1000 PolarHBondContact O-N 3.21Å; L998-N1001 PolarHBondContact O-N 3.14Å; L998-V1002 PolarHBondContact O-N 3.18Å; L998-V1002 VanDerWaalsContact O-N 3.09Å
999	L	86.6	Confident	79.4	Confident	4 Å²	4	55.7 Å²	55.7	2%	0.021	30%	0.3	C	S	.	.	H	α-helix	trans	-61.2	-41.5	175	-176.9	63.7	0	0	0	110.3	I976 E979 F980 P996 N1001 V1002 F1003 F1023	I976-L999 HydrophobicContact CG2-CD1 4.17Å; E979-L999 HydrophobicContact CB-CB 4.42Å; E979-L999 HydrophobicContact CB-CD1 4.01Å; F980-L999 HydrophobicContact CD2-CD2 4.45Å; P996-L999 WeakPolarHBondContact O-CB 3.32Å; P996-L999 PolarHBondContact O-N 2.95Å; P996-L999 VanDerWaalsContact O-N 3.13Å; L999-N1001 PolarHBondContact O-N 3.22Å; L999-V1002 PolarHBondContact O-N 3.48Å; L999-F1003 HydrophobicContact CD1-CD2 4.25Å; L999-F1003 HydrophobicContact CD1-CE2 3.78Å; L999-F1003 HydrophobicContact CD2-CE2 4.36Å; L999-F1003 HydrophobicContact CG-CD2 4.06Å; L999-F1003 HydrophobicContact CG-CE2 3.79Å; L999-F1003 WeakPolarHBondContact O-CD2 3.46Å; L999-F1003 PolarHBondContact O-N 3.27Å; L999-F1003 VanDerWaalsContact O-N 3.17Å; L999-F1023 HydrophobicContact CD2-CD1 4.05Å; L999-F1023 HydrophobicContact CD2-CE1 4.37Å; L999-F1023 HydrophobicContact CD2-CG 4.35Å
1000	Y	89.3	Confident	79.9	Confident	30 Å²	30	54 Å²	54	12%	0.118	29%	0.288	C	S	.	.	H	α-helix	trans	-62.5	-39.7	175.2	-69.5	-36.6	0	0	0	113.3	P996 S997 L998 F1003 D1004 R1020 E1024 L1027	P996-Y1000 HydrophobicContact CB-CD2 4.29Å; P996-Y1000 HydrophobicContact CB-CE2 4.03Å; P996-Y1000 HydrophobicContact CG-CD2 4.25Å; P996-Y1000 HydrophobicContact CG-CE2 3.71Å; P996-Y1000 WeakPolarHBondContact O-CD2 3.24Å; P996-Y1000 PolarHBondContact O-N 3.33Å; S997-Y1000 WeakPolarHBondContact O-CB 3.43Å; S997-Y1000 PolarHBondContact O-N 2.95Å; L998-Y1000 VanDerWaalsContact C-N 3.27Å; L998-Y1000 PolarHBondContact O-N 3.21Å; Y1000-F1003 PolarHBondContact O-N 2.83Å; Y1000-D1004 PolarHBondContact O-N 3.1Å; Y1000-R1020 VanDerWaalsContact CD1-NH1 3.3Å; Y1000-R1020 VanDerWaalsContact CE1-NH2 3.33Å; Y1000-E1024 VanDerWaalsContact CE1-OE1 3.31Å; Y1000-E1024 WeakPolarHBondContact CE1-OE1 3.29Å; Y1000-E1024 PolarHBondContact OH-OE2 3.02Å; Y1000-L1027 HydrophobicContact CE1-CD1 3.99Å
1001	N	86.7	Confident	81	Confident	24 Å²	24	48.7 Å²	48.7	13%	0.128	26%	0.263	C	S	.	.	H	α-helix	trans	-64	-41	176.3	-69.1	-21.8	0	0	0	111.8	F122 S997 L998 L999 F1003 D1004 L1005	F122-N1001 HydrophobicContact CD1-CB 4.25Å; F122-N1001 HydrophobicContact CE1-CB 4.33Å; F122-N1001 PolarHBondContact O-ND2 2.82Å; S997-N1001 VanDerWaalsContact O-CG 3.31Å; S997-N1001 PolarHBondContact O-N 3.39Å; L998-N1001 PolarHBondContact O-N 3.14Å; L999-N1001 PolarHBondContact O-N 3.22Å; N1001-F1003 VanDerWaalsContact C-N 3.32Å; N1001-F1003 PolarHBondContact O-N 2.91Å; N1001-D1004 PolarHBondContact O-N 3.02Å; N1001-L1005 WeakPolarHBondContact O-CG 3.36Å; N1001-L1005 PolarHBondContact O-N 3.33Å
1002	V	90.3	Very high	82.6	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-59.8	-44.6	175.3	177.9	0	0	0	0	111.2	F122 F972 A975 I976 E979 L998 L999 L1005 A1006	F122-V1002 HydrophobicContact CE1-CG2 3.86Å; F122-V1002 HydrophobicContact CE2-CG2 4.38Å; F122-V1002 HydrophobicContact CZ-CG2 3.36Å; F972-V1002 HydrophobicContact CD1-CG1 4.42Å; A975-V1002 HydrophobicContact CB-CG1 3.92Å; I976-V1002 HydrophobicContact CG1-CG1 3.73Å; E979-V1002 HydrophobicContact CG-CG2 4.02Å; L998-V1002 PolarHBondContact O-N 3.18Å; L998-V1002 VanDerWaalsContact O-N 3.09Å; L999-V1002 PolarHBondContact O-N 3.48Å; V1002-L1005 PolarHBondContact O-N 3.18Å; V1002-A1006 VanDerWaalsContact O-CB 3.32Å; V1002-A1006 WeakPolarHBondContact O-CB 3.34Å; V1002-A1006 PolarHBondContact O-N 3.21Å
1003	F	92.1	Very high	84.4	Confident	9 Å²	9	39.2 Å²	39.2	4%	0.039	21%	0.207	C	C	.	.	H	α-helix	trans	-66.1	-37.3	177.1	-84.2	-62.1	0	0	0	113.4	I976 L999 Y1000 N1001 A1006 A1007 L1019 R1020 F1023	I976-F1003 HydrophobicContact CB-CZ 4.44Å; I976-F1003 HydrophobicContact CD1-CD1 4Å; I976-F1003 HydrophobicContact CD1-CE1 3.49Å; I976-F1003 VanDerWaalsContact CD1-CE1 3.49Å; I976-F1003 HydrophobicContact CD1-CZ 3.9Å; I976-F1003 HydrophobicContact CG1-CD1 4.41Å; I976-F1003 HydrophobicContact CG1-CE1 3.97Å; I976-F1003 HydrophobicContact CG1-CE2 4.4Å; I976-F1003 HydrophobicContact CG1-CZ 3.91Å; I976-F1003 HydrophobicContact CG2-CE1 4.33Å; I976-F1003 HydrophobicContact CG2-CE2 4.18Å; I976-F1003 HydrophobicContact CG2-CZ 3.61Å; L999-F1003 HydrophobicContact CD1-CD2 4.25Å; L999-F1003 HydrophobicContact CD1-CE2 3.78Å; L999-F1003 HydrophobicContact CD2-CE2 4.36Å; L999-F1003 HydrophobicContact CG-CD2 4.06Å; L999-F1003 HydrophobicContact CG-CE2 3.79Å; L999-F1003 WeakPolarHBondContact O-CD2 3.46Å; L999-F1003 PolarHBondContact O-N 3.27Å; L999-F1003 VanDerWaalsContact O-N 3.17Å; Y1000-F1003 PolarHBondContact O-N 2.83Å; N1001-F1003 VanDerWaalsContact C-N 3.32Å; N1001-F1003 PolarHBondContact O-N 2.91Å; F1003-A1006 PolarHBondContact O-N 2.87Å; F1003-A1007 VanDerWaalsContact O-CB 3.27Å; F1003-A1007 WeakPolarHBondContact O-CB 3.37Å; F1003-A1007 PolarHBondContact O-N 3.36Å; F1003-L1019 HydrophobicContact CE1-CB 4.26Å; F1003-L1019 HydrophobicContact CZ-CB 4.42Å; F1003-R1020 HydrophobicContact CD1-CB 3.64Å; F1003-R1020 HydrophobicContact CD1-CG 4.13Å; F1003-R1020 HydrophobicContact CE1-CB 3.65Å; F1003-R1020 HydrophobicContact CE1-CG 4.49Å; F1003-R1020 HydrophobicContact CG-CB 4.26Å; F1003-R1020 HydrophobicContact CG-CG 4.28Å; F1003-R1020 HydrophobicContact CZ-CB 4.28Å; F1003-F1023 HydrophobicContact CE1-CD2 4.44Å; F1003-F1023 HydrophobicContact CE2-CB 4.34Å; F1003-F1023 AromaticContact CE2-CD2 3.59Å; F1003-F1023 HydrophobicContact CE2-CD2 3.59Å; F1003-F1023 HydrophobicContact CE2-CE2 4.15Å; F1003-F1023 HydrophobicContact CE2-CG 4.11Å; F1003-F1023 AromaticContact CZ-CD2 3.27Å; F1003-F1023 HydrophobicContact CZ-CD2 3.27Å; F1003-F1023 AromaticContact CZ-CE2 3.68Å; F1003-F1023 HydrophobicContact CZ-CE2 3.68Å; F1003-F1023 HydrophobicContact CZ-CG 4.21Å
1004	D	89.9	Confident	85.9	Confident	50 Å²	50	30.3 Å²	30.3	27%	0.267	17%	0.166	S	C	.	.	H	α-helix	trans	-67	-38.8	175.8	-73.7	-22.5	0	0	0	110.8	Y1000 N1001 A1007 N1008	Y1000-D1004 PolarHBondContact O-N 3.1Å; N1001-D1004 PolarHBondContact O-N 3.02Å; D1004-A1007 PolarHBondContact O-N 3.4Å; D1004-N1008 VanDerWaalsContact O-CG 3.22Å; D1004-N1008 PolarHBondContact O-N 3.31Å; D1004-N1008 PolarHBondContact O-ND2 2.9Å; D1004-N1008 VanDerWaalsContact O-ND2 3.08Å
1005	L	89.3	Confident	87.1	Confident	54 Å²	54	29.2 Å²	29.2	28%	0.283	16%	0.157	S	C	.	.	H	α-helix	trans	-62.9	-46.6	171.6	-70.9	172.9	0	0	0	111.5	V962 T963 F972 N1001 V1002 A1007 N1008 A1009	V962-L1005 HydrophobicContact CG2-CD1 4.34Å; T963-L1005 HydrophobicContact CG2-CD1 4.28Å; F972-L1005 HydrophobicContact CE1-CB 4.08Å; N1001-L1005 WeakPolarHBondContact O-CG 3.36Å; N1001-L1005 PolarHBondContact O-N 3.33Å; V1002-L1005 PolarHBondContact O-N 3.18Å; L1005-A1007 VanDerWaalsContact C-N 3.34Å; L1005-A1007 PolarHBondContact O-N 3.47Å; L1005-N1008 PolarHBondContact O-N 2.71Å; L1005-N1008 VanDerWaalsContact O-N 3.1Å; L1005-A1009 PolarHBondContact O-N 3.47Å
1006	A	91.4	Very high	88	Confident	1 Å²	1	24.5 Å²	24.5	1%	0.008	13%	0.132	C	C	.	.	H	α-helix	trans	-58.2	-44.9	175.9	0	0	0	0	0	111.8	F972 V1002 F1003 N1008 A1009 Q1010 L1016	F972-A1006 HydrophobicContact CB-CB 4.37Å; F972-A1006 HydrophobicContact CD1-CB 3.69Å; F972-A1006 HydrophobicContact CD2-CB 4.41Å; F972-A1006 HydrophobicContact CE1-CB 4.01Å; F972-A1006 HydrophobicContact CG-CB 3.92Å; V1002-A1006 VanDerWaalsContact O-CB 3.32Å; V1002-A1006 WeakPolarHBondContact O-CB 3.34Å; V1002-A1006 PolarHBondContact O-N 3.21Å; F1003-A1006 PolarHBondContact O-N 2.87Å; A1006-N1008 PolarHBondContact O-N 3.32Å; A1006-A1009 PolarHBondContact O-N 3.32Å; A1006-Q1010 CarbonylContact O-C 3.54Å; A1006-Q1010 WeakPolarHBondContact O-CA 3.33Å; A1006-Q1010 PolarHBondContact O-N 3.31Å; A1006-L1016 HydrophobicContact CB-CD1 3.99Å
1007	A	88.5	Confident	88.6	Confident	12 Å²	12	24 Å²	24	10%	0.099	13%	0.127	C	C	.	.	H	α-helix	trans	-66.5	-19.6	177.8	0	0	0	0	0	113.3	F1003 D1004 L1005 Q1011 W1017	F1003-A1007 VanDerWaalsContact O-CB 3.27Å; F1003-A1007 WeakPolarHBondContact O-CB 3.37Å; F1003-A1007 PolarHBondContact O-N 3.36Å; D1004-A1007 PolarHBondContact O-N 3.4Å; L1005-A1007 VanDerWaalsContact C-N 3.34Å; L1005-A1007 PolarHBondContact O-N 3.47Å; A1007-Q1011 WeakPolarHBondContact O-CA 3.07Å; A1007-Q1011 WeakPolarHBondContact O-CB 3.4Å; A1007-Q1011 WeakPolarHBondContact O-CG 3.43Å; A1007-Q1011 PolarHBondContact O-NE2 2.91Å; A1007-Q1011 VanDerWaalsContact O-NE2 3.15Å; A1007-W1017 HydrophobicContact CB-CH2 3.61Å; A1007-W1017 HydrophobicContact CB-CZ2 3.78Å; A1007-W1017 HydrophobicContact CB-CZ3 4.4Å
1008	N	84.3	Confident	89.2	Confident	47 Å²	47	23.2 Å²	23.2	25%	0.251	12%	0.12	S	C	.	.	H	α-helix	trans	-90.2	-42.4	174.5	-66.8	-29.2	0	0	0	112.1	D1004 L1005 A1006 Q1011	D1004-N1008 VanDerWaalsContact O-CG 3.22Å; D1004-N1008 PolarHBondContact O-N 3.31Å; D1004-N1008 PolarHBondContact O-ND2 2.9Å; D1004-N1008 VanDerWaalsContact O-ND2 3.08Å; L1005-N1008 PolarHBondContact O-N 2.71Å; L1005-N1008 VanDerWaalsContact O-N 3.1Å; A1006-N1008 PolarHBondContact O-N 3.32Å; N1008-Q1011 WeakPolarHBondContact O-CG 3.47Å
1009	A	85.1	Confident	89.7	Confident	27 Å²	27	22 Å²	22	22%	0.223	11%	0.114	C	C	.	.	H	α-helix	trans	-81.8	-35.1	-176.9	0	0	0	0	0	113.1	F972 L1005 A1006	F972-A1009 HydrophobicContact CE2-CB 3.76Å; F972-A1009 HydrophobicContact CZ-CB 3.69Å; L1005-A1009 PolarHBondContact O-N 3.47Å; A1006-A1009 PolarHBondContact O-N 3.32Å
1010	Q	86.8	Confident	90.1	Very high	37 Å²	37	22.4 Å²	22.4	17%	0.173	12%	0.115	C	C	.	.	S	Bend	trans	-130.9	50.6	-172.7	-64.9	-63.1	-19.3	0	0	110.6	C967 V969 F972 A1006 H1012 S1013 L1016	C967-Q1010 PolarHBondContact O-NE2 3.02Å; V969-Q1010 HydrophobicContact CG2-CB 4.47Å; V969-Q1010 HydrophobicContact CG2-CG 4.23Å; F972-Q1010 HydrophobicContact CD2-CG 3.91Å; F972-Q1010 HydrophobicContact CE2-CG 3.8Å; A1006-Q1010 CarbonylContact O-C 3.54Å; A1006-Q1010 WeakPolarHBondContact O-CA 3.33Å; A1006-Q1010 PolarHBondContact O-N 3.31Å; Q1010-H1012 PolarHBondContact O-N 2.94Å; Q1010-S1013 WeakPolarHBondContact O-CB 3.39Å; Q1010-S1013 PolarHBondContact O-N 3.38Å; Q1010-L1016 HydrophobicContact CB-CD1 3.63Å; Q1010-L1016 HydrophobicContact CG-CD1 4.33Å
1011	Q	86	Confident	90.3	Very high	68 Å²	68	21.2 Å²	21.2	32%	0.318	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-26.4	-171.9	-29.8	-158.6	-67.9	0	0	113.2	A1007 N1008 W1017 S1045	A1007-Q1011 WeakPolarHBondContact O-CA 3.07Å; A1007-Q1011 WeakPolarHBondContact O-CB 3.4Å; A1007-Q1011 WeakPolarHBondContact O-CG 3.43Å; A1007-Q1011 PolarHBondContact O-NE2 2.91Å; A1007-Q1011 VanDerWaalsContact O-NE2 3.15Å; N1008-Q1011 WeakPolarHBondContact O-CG 3.47Å; Q1011-W1017 PolarHBondContact O-NE1 3.34Å; Q1011-S1045 WeakPolarHBondContact O-CB 3.23Å
1012	H	87.9	Confident	90.5	Very high	58 Å²	58	21.3 Å²	21.3	27%	0.269	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	9	-175.9	-59.3	-57.9	0	0	0	113.6	L369 Q1010 V1014 S1045 C1046 W1048	L369-H1012 WeakPolarHBondContact CD2-CD2 3.43Å; L369-H1012 WeakPolarHBondContact CD2-CE1 3.47Å; L369-H1012 WeakPolarHBondContact CD2-NE2 3.37Å; Q1010-H1012 PolarHBondContact O-N 2.94Å; H1012-V1014 PolarHBondContact O-N 3.42Å; H1012-S1045 PolarHBondContact ND1-O 3.48Å; H1012-C1046 VanDerWaalsContact C-SG 3.53Å; H1012-C1046 PolarHBondContact O-SG 3.41Å; H1012-C1046 VanDerWaalsContact O-SG 3.38Å; H1012-W1048 HydrophobicContact CB-CH2 3.9Å; H1012-W1048 HydrophobicContact CB-CZ2 4.47Å
1013	S	90.7	Very high	90.4	Very high	2 Å²	2	21.4 Å²	21.4	1%	0.014	12%	0.115	C	C	.	.			trans	-78.7	103.8	176.1	-175.6	0	0	0	0	110.6	Q1010 V1015 L1016 W1017	Q1010-S1013 WeakPolarHBondContact O-CB 3.39Å; Q1010-S1013 PolarHBondContact O-N 3.38Å; S1013-V1015 PolarHBondContact O-N 3.21Å; S1013-L1016 PolarHBondContact O-N 3.29Å; S1013-L1016 WeakPolarHBondContact OG-CG 3.36Å; S1013-L1016 PolarHBondContact OG-N 3.49Å; S1013-W1017 PolarHBondContact O-N 3.32Å
1014	V	92.3	Very high	90.2	Very high	8 Å²	8	21.1 Å²	21.1	5%	0.048	11%	0.114	C	C	.	.	H	α-helix	trans	-53	-44.1	172.1	177	0	0	0	0	110.2	H1012 L1016 W1017 R1018 C1046 W1048 S1049	H1012-V1014 PolarHBondContact O-N 3.42Å; V1014-L1016 PolarHBondContact O-N 2.96Å; V1014-W1017 PolarHBondContact O-N 3.38Å; V1014-R1018 HydrophobicContact CG1-CG 3.94Å; V1014-R1018 WeakPolarHBondContact O-CB 3.49Å; V1014-R1018 VanDerWaalsContact O-CG 3.24Å; V1014-R1018 WeakPolarHBondContact O-CG 3.26Å; V1014-R1018 PolarHBondContact O-N 2.75Å; V1014-C1046 HydrophobicContact CG2-CB 4.06Å; V1014-W1048 HydrophobicContact CG2-CZ2 4.31Å; V1014-S1049 VanDerWaalsContact CG1-OG 3.31Å; V1014-S1049 WeakPolarHBondContact CG1-OG 3.47Å
1015	V	91.9	Very high	90	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.006	12%	0.119	C	C	.	.	H	α-helix	trans	-54	-49.1	-179.8	175.7	0	0	0	0	112.1	I610 Y613 V969 V973 S1013 R1018 L1019	I610-V1015 HydrophobicContact CB-CG1 4.33Å; I610-V1015 HydrophobicContact CB-CG2 4.05Å; I610-V1015 HydrophobicContact CD1-CG1 4.36Å; I610-V1015 HydrophobicContact CG1-CG1 4.03Å; Y613-V1015 HydrophobicContact CD2-CG1 3.89Å; Y613-V1015 HydrophobicContact CE2-CG1 4.2Å; Y613-V1015 HydrophobicContact CE2-CG2 4.41Å; V969-V1015 HydrophobicContact CG1-CB 4.42Å; V969-V1015 HydrophobicContact CG1-CG1 4.48Å; V973-V1015 HydrophobicContact CG2-CG1 4.14Å; S1013-V1015 PolarHBondContact O-N 3.21Å; V1015-R1018 PolarHBondContact O-N 3.02Å; V1015-L1019 HydrophobicContact CG1-CD1 4.19Å; V1015-L1019 WeakPolarHBondContact O-CB 3.24Å; V1015-L1019 WeakPolarHBondContact O-CG 3.4Å; V1015-L1019 PolarHBondContact O-N 2.88Å
1016	L	93.4	Very high	89.7	Confident	7 Å²	7	22.4 Å²	22.4	4%	0.037	13%	0.129	C	C	.	.	H	α-helix	trans	-68.7	-37.6	-176.5	-63.2	171.9	0	0	0	111.9	V969 F972 V973 I976 A1006 Q1010 S1013 V1014 R1020	V969-L1016 HydrophobicContact CG1-CD1 4.33Å; V969-L1016 HydrophobicContact CG1-CD2 4.35Å; V969-L1016 HydrophobicContact CG1-CG 4.15Å; V969-L1016 HydrophobicContact CG2-CD1 4.4Å; F972-L1016 HydrophobicContact CB-CD1 4.17Å; F972-L1016 HydrophobicContact CB-CD2 3.78Å; F972-L1016 HydrophobicContact CD2-CD1 4.33Å; F972-L1016 HydrophobicContact CG-CD1 4.46Å; V973-L1016 HydrophobicContact CG2-CD2 3.86Å; I976-L1016 HydrophobicContact CD1-CD2 3.74Å; A1006-L1016 HydrophobicContact CB-CD1 3.99Å; Q1010-L1016 HydrophobicContact CB-CD1 3.63Å; Q1010-L1016 HydrophobicContact CG-CD1 4.33Å; S1013-L1016 PolarHBondContact O-N 3.29Å; S1013-L1016 WeakPolarHBondContact OG-CG 3.36Å; S1013-L1016 PolarHBondContact OG-N 3.49Å; V1014-L1016 PolarHBondContact O-N 2.96Å; L1016-R1020 WeakPolarHBondContact O-CB 3.44Å; L1016-R1020 PolarHBondContact O-N 2.93Å
1017	W	94.5	Very high	89.1	Confident	14 Å²	14	23.3 Å²	23.3	5%	0.053	13%	0.134	C	C	.	.	H	α-helix	trans	-68.1	-43.8	175.7	-73.9	117.2	0	0	0	113	A1007 Q1011 S1013 V1014 R1020 L1021 V1038 R1041 A1042 L1052	A1007-W1017 HydrophobicContact CB-CH2 3.61Å; A1007-W1017 HydrophobicContact CB-CZ2 3.78Å; A1007-W1017 HydrophobicContact CB-CZ3 4.4Å; Q1011-W1017 PolarHBondContact O-NE1 3.34Å; S1013-W1017 PolarHBondContact O-N 3.32Å; V1014-W1017 PolarHBondContact O-N 3.38Å; W1017-R1020 WeakPolarHBondContact O-CB 3.13Å; W1017-R1020 PolarHBondContact O-N 3.09Å; W1017-R1020 VanDerWaalsContact O-N 3.16Å; W1017-L1021 WeakPolarHBondContact O-CG 3.44Å; W1017-L1021 PolarHBondContact O-N 2.83Å; W1017-V1038 HydrophobicContact CZ3-CG1 4.43Å; W1017-R1041 HydrophobicContact CH2-CB 3.96Å; W1017-R1041 HydrophobicContact CZ3-CB 4.2Å; W1017-A1042 HydrophobicContact CB-CB 3.91Å; W1017-A1042 HydrophobicContact CD2-CB 3.75Å; W1017-A1042 HydrophobicContact CE3-CB 3.68Å; W1017-A1042 HydrophobicContact CG-CB 3.86Å; W1017-A1042 HydrophobicContact CZ3-CB 4.45Å; W1017-L1052 HydrophobicContact CB-CD1 3.91Å; W1017-L1052 HydrophobicContact CB-CD2 4.35Å
1018	R	94.3	Very high	88.3	Confident	8 Å²	8	24.4 Å²	24.4	3%	0.03	14%	0.141	C	C	.	.	H	α-helix	trans	-62.4	-43.2	177.1	-66.3	-170.1	75	-166.4	-0.5	111.5	I610 P623 H624 V1014 V1015 R1020 L1021 A1022 S1051 L1052 D1055	I610-R1018 HydrophobicContact CD1-CB 3.97Å; P623-R1018 HydrophobicContact CG-CB 4.17Å; H624-R1018 PolarHBondContact O-NH1 3.17Å; H624-R1018 PolarHBondContact O-NH2 3.1Å; V1014-R1018 HydrophobicContact CG1-CG 3.94Å; V1014-R1018 WeakPolarHBondContact O-CB 3.49Å; V1014-R1018 VanDerWaalsContact O-CG 3.24Å; V1014-R1018 WeakPolarHBondContact O-CG 3.26Å; V1014-R1018 PolarHBondContact O-N 2.75Å; V1015-R1018 PolarHBondContact O-N 3.02Å; R1018-R1020 PolarHBondContact O-N 3.48Å; R1018-L1021 PolarHBondContact O-N 2.99Å; R1018-A1022 WeakPolarHBondContact O-CB 3.29Å; R1018-A1022 PolarHBondContact O-N 3.45Å; R1018-S1051 PolarHBondContact NH1-OG 2.92Å; R1018-L1052 HydrophobicContact CG-CB 4.47Å; R1018-L1052 HydrophobicContact CG-CD1 3.69Å; R1018-D1055 WeakPolarHBondContact CB-OD2 3.33Å; R1018-D1055 WeakPolarHBondContact CG-OD2 3.45Å; R1018-D1055 IonicContact CZ-OD1 3.49Å; R1018-D1055 IonicContact CZ-OD2 3.92Å; R1018-D1055 IonicContact NE-OD1 2.83Å; R1018-D1055 IonicContact NE-OD2 2.62Å; R1018-D1055 PolarHBondContact NE-OD2 3.08Å; R1018-D1055 VanDerWaalsContact NH2-CG 3.31Å; R1018-D1055 IonicContact NH2-OD1 2.86Å; R1018-D1055 PolarHBondContact NH2-OD1 3.46Å; R1018-D1055 IonicContact NH2-OD2 3.48Å; R1018-D1055 PolarHBondContact NH2-OD2 2.9Å
1019	L	93.3	Very high	87.2	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-58.3	-48.5	171.1	-73.8	174.7	0	0	0	110.9	I610 L614 L620 V973 F1003 V1015 L1021 A1022 F1023	I610-L1019 HydrophobicContact CD1-CD2 4.41Å; I610-L1019 HydrophobicContact CD1-CG 4.26Å; L614-L1019 HydrophobicContact CD2-CD2 4.16Å; L620-L1019 HydrophobicContact CD1-CD1 4.47Å; L620-L1019 HydrophobicContact CD1-CD2 4.32Å; V973-L1019 HydrophobicContact CG1-CD1 4.33Å; V973-L1019 HydrophobicContact CG2-CD1 4.04Å; F1003-L1019 HydrophobicContact CE1-CB 4.26Å; F1003-L1019 HydrophobicContact CZ-CB 4.42Å; V1015-L1019 HydrophobicContact CG1-CD1 4.19Å; V1015-L1019 WeakPolarHBondContact O-CB 3.24Å; V1015-L1019 WeakPolarHBondContact O-CG 3.4Å; V1015-L1019 PolarHBondContact O-N 2.88Å; L1019-L1021 VanDerWaalsContact C-N 3.34Å; L1019-L1021 PolarHBondContact O-N 3.27Å; L1019-A1022 PolarHBondContact O-N 3.11Å; L1019-F1023 HydrophobicContact CB-CE2 4.42Å; L1019-F1023 WeakPolarHBondContact O-CD2 3.34Å; L1019-F1023 PolarHBondContact O-N 3.37Å
1020	R	93.7	Very high	86	Confident	12 Å²	12	34.2 Å²	34.2	5%	0.045	19%	0.19	C	C	.	.	H	α-helix	trans	-57.2	-45.9	179	178.9	56.4	-178.2	-125.6	1.8	112	Y1000 F1003 L1016 W1017 R1018 F1023 E1024 V1038	Y1000-R1020 VanDerWaalsContact CD1-NH1 3.3Å; Y1000-R1020 VanDerWaalsContact CE1-NH2 3.33Å; F1003-R1020 HydrophobicContact CD1-CB 3.64Å; F1003-R1020 HydrophobicContact CD1-CG 4.13Å; F1003-R1020 HydrophobicContact CE1-CB 3.65Å; F1003-R1020 HydrophobicContact CE1-CG 4.49Å; F1003-R1020 HydrophobicContact CG-CB 4.26Å; F1003-R1020 HydrophobicContact CG-CG 4.28Å; F1003-R1020 HydrophobicContact CZ-CB 4.28Å; L1016-R1020 WeakPolarHBondContact O-CB 3.44Å; L1016-R1020 PolarHBondContact O-N 2.93Å; W1017-R1020 WeakPolarHBondContact O-CB 3.13Å; W1017-R1020 PolarHBondContact O-N 3.09Å; W1017-R1020 VanDerWaalsContact O-N 3.16Å; R1018-R1020 PolarHBondContact O-N 3.48Å; R1020-F1023 PolarHBondContact O-N 2.91Å; R1020-E1024 HydrophobicContact CG-CG 4.5Å; R1020-E1024 IonicContact CZ-OE1 2.63Å; R1020-E1024 IonicContact NE-OE1 3.86Å; R1020-E1024 PolarHBondContact NE-OE1 2.98Å; R1020-E1024 IonicContact NH2-OE1 3.98Å; R1020-E1024 PolarHBondContact NH2-OE1 3.4Å; R1020-E1024 WeakPolarHBondContact O-CG 3.44Å; R1020-E1024 PolarHBondContact O-N 2.96Å; R1020-V1038 HydrophobicContact CB-CG1 4.49Å; R1020-V1038 HydrophobicContact CG-CG1 3.55Å
1021	L	93.1	Very high	84.7	Confident	6 Å²	6	35.8 Å²	35.8	3%	0.031	22%	0.216	C	C	.	.	H	α-helix	trans	-62.5	-43.5	177.8	-69.1	177.9	0	0	0	111.8	W1017 R1018 L1019 F1023 E1024 G1025 V1038 A1039 L1052 D1055	W1017-L1021 WeakPolarHBondContact O-CG 3.44Å; W1017-L1021 PolarHBondContact O-N 2.83Å; R1018-L1021 PolarHBondContact O-N 2.99Å; L1019-L1021 VanDerWaalsContact C-N 3.34Å; L1019-L1021 PolarHBondContact O-N 3.27Å; L1021-F1023 VanDerWaalsContact C-N 3.31Å; L1021-F1023 PolarHBondContact O-N 2.99Å; L1021-E1024 PolarHBondContact O-N 3.21Å; L1021-G1025 PolarHBondContact O-N 3.03Å; L1021-V1038 HydrophobicContact CD2-CB 4.14Å; L1021-V1038 HydrophobicContact CD2-CG1 3.59Å; L1021-V1038 HydrophobicContact CG-CG1 4.4Å; L1021-A1039 HydrophobicContact CD2-CB 4.02Å; L1021-L1052 HydrophobicContact CD1-CD1 3.72Å; L1021-D1055 HydrophobicContact CD1-CB 3.97Å
1022	A	91	Very high	83.8	Confident	25 Å²	25	37.1 Å²	37.1	21%	0.207	23%	0.228	C	C	.	.	H	α-helix	trans	-60	-40.5	175.9	0	0	0	0	0	112.1	P621 P623 R1018 L1019 G1025 L1026	P621-A1022 HydrophobicContact CB-CB 4.05Å; P621-A1022 HydrophobicContact CG-CB 4.05Å; P623-A1022 HydrophobicContact CG-CB 4.15Å; R1018-A1022 WeakPolarHBondContact O-CB 3.29Å; R1018-A1022 PolarHBondContact O-N 3.45Å; L1019-A1022 PolarHBondContact O-N 3.11Å; A1022-G1025 PolarHBondContact O-N 2.97Å; A1022-L1026 PolarHBondContact O-N 2.98Å
1023	F	88.9	Confident	83.2	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.009	23%	0.233	C	C	.	.	H	α-helix	trans	-66.3	-42.4	174.5	-79.6	-65.7	0	0	0	113.5	L620 P621 I976 F980 L999 F1003 L1019 R1020 L1021 G1025 L1026 L1027	L620-F1023 HydrophobicContact CD2-CE2 4.17Å; L620-F1023 HydrophobicContact CD2-CZ 3.68Å; P621-F1023 HydrophobicContact CG-CD1 3.99Å; P621-F1023 HydrophobicContact CG-CD2 4.16Å; P621-F1023 HydrophobicContact CG-CE1 3.65Å; P621-F1023 HydrophobicContact CG-CE2 3.9Å; P621-F1023 HydrophobicContact CG-CG 4.23Å; P621-F1023 HydrophobicContact CG-CZ 3.66Å; I976-F1023 HydrophobicContact CG2-CD2 4.33Å; I976-F1023 HydrophobicContact CG2-CE2 3.41Å; I976-F1023 VanDerWaalsContact CG2-CE2 3.41Å; I976-F1023 HydrophobicContact CG2-CZ 3.88Å; F980-F1023 HydrophobicContact CB-CE1 3.95Å; F980-F1023 HydrophobicContact CB-CZ 3.98Å; F980-F1023 AromaticContact CD1-CE1 3.94Å; F980-F1023 HydrophobicContact CD1-CE1 3.94Å; F980-F1023 HydrophobicContact CD1-CZ 4.23Å; F980-F1023 AromaticContact CD2-CD1 3.91Å; F980-F1023 HydrophobicContact CD2-CD1 3.91Å; F980-F1023 AromaticContact CD2-CE1 3.19Å; F980-F1023 HydrophobicContact CD2-CE1 3.19Å; F980-F1023 HydrophobicContact CD2-CZ 4.07Å; F980-F1023 HydrophobicContact CE1-CE1 4.21Å; F980-F1023 HydrophobicContact CE2-CD1 4.03Å; F980-F1023 AromaticContact CE2-CE1 3.5Å; F980-F1023 HydrophobicContact CE2-CE1 3.5Å; F980-F1023 VanDerWaalsContact CE2-CE1 3.5Å; F980-F1023 HydrophobicContact CG-CD1 4.49Å; F980-F1023 AromaticContact CG-CE1 3.4Å; F980-F1023 HydrophobicContact CG-CE1 3.4Å; F980-F1023 AromaticContact CG-CZ 3.81Å; F980-F1023 HydrophobicContact CG-CZ 3.81Å; F980-F1023 AromaticContact CZ-CE1 3.99Å; F980-F1023 HydrophobicContact CZ-CE1 3.99Å; L999-F1023 HydrophobicContact CD2-CD1 4.05Å; L999-F1023 HydrophobicContact CD2-CE1 4.37Å; L999-F1023 HydrophobicContact CD2-CG 4.35Å; F1003-F1023 HydrophobicContact CE1-CD2 4.44Å; F1003-F1023 HydrophobicContact CE2-CB 4.34Å; F1003-F1023 AromaticContact CE2-CD2 3.59Å; F1003-F1023 HydrophobicContact CE2-CD2 3.59Å; F1003-F1023 HydrophobicContact CE2-CE2 4.15Å; F1003-F1023 HydrophobicContact CE2-CG 4.11Å; F1003-F1023 AromaticContact CZ-CD2 3.27Å; F1003-F1023 HydrophobicContact CZ-CD2 3.27Å; F1003-F1023 AromaticContact CZ-CE2 3.68Å; F1003-F1023 HydrophobicContact CZ-CE2 3.68Å; F1003-F1023 HydrophobicContact CZ-CG 4.21Å; L1019-F1023 HydrophobicContact CB-CE2 4.42Å; L1019-F1023 WeakPolarHBondContact O-CD2 3.34Å; L1019-F1023 PolarHBondContact O-N 3.37Å; R1020-F1023 PolarHBondContact O-N 2.91Å; L1021-F1023 VanDerWaalsContact C-N 3.31Å; L1021-F1023 PolarHBondContact O-N 2.99Å; F1023-G1025 PolarHBondContact O-N 3.14Å; F1023-L1026 HydrophobicContact CD1-CD1 4.5Å; F1023-L1026 PolarHBondContact O-N 3.3Å; F1023-L1026 VanDerWaalsContact O-N 3.09Å; F1023-L1027 WeakPolarHBondContact O-CG 3.42Å; F1023-L1027 PolarHBondContact O-N 2.67Å
1024	E	88.6	Confident	82.9	Confident	3 Å²	3	41.6 Å²	41.6	1%	0.014	25%	0.25	C	C	.	.	H	α-helix	trans	-64.8	-32.1	176.3	-64	-73.8	-163.8	0	0	111.4	Y1000 R1020 L1021 L1026 L1027 C1028 R1035 V1038	Y1000-E1024 VanDerWaalsContact CE1-OE1 3.31Å; Y1000-E1024 WeakPolarHBondContact CE1-OE1 3.29Å; Y1000-E1024 PolarHBondContact OH-OE2 3.02Å; R1020-E1024 HydrophobicContact CG-CG 4.5Å; R1020-E1024 IonicContact CZ-OE1 2.63Å; R1020-E1024 IonicContact NE-OE1 3.86Å; R1020-E1024 PolarHBondContact NE-OE1 2.98Å; R1020-E1024 IonicContact NH2-OE1 3.98Å; R1020-E1024 PolarHBondContact NH2-OE1 3.4Å; R1020-E1024 WeakPolarHBondContact O-CG 3.44Å; R1020-E1024 PolarHBondContact O-N 2.96Å; L1021-E1024 PolarHBondContact O-N 3.21Å; E1024-L1026 VanDerWaalsContact C-N 3.34Å; E1024-L1026 PolarHBondContact O-N 2.82Å; E1024-L1027 PolarHBondContact O-N 2.65Å; E1024-C1028 WeakPolarHBondContact O-CB 3.46Å; E1024-C1028 PolarHBondContact O-N 3.28Å; E1024-R1035 HydrophobicContact CB-CG 3.58Å; E1024-V1038 HydrophobicContact CG-CG2 4.24Å
1025	G	84.9	Confident	82.6	Confident	37 Å²	37	44.2 Å²	44.2	38%	0.381	26%	0.259	S	S	.	.	H	α-helix	trans	-56	-45.9	168.6	0	0	0	0	0	112.7	L1021 A1022 F1023	L1021-G1025 PolarHBondContact O-N 3.03Å; A1022-G1025 PolarHBondContact O-N 2.97Å; F1023-G1025 PolarHBondContact O-N 3.14Å
1026	L	82.8	Confident	82.6	Confident	94 Å²	94	46.4 Å²	46.4	49%	0.492	27%	0.269	S	S	.	.	H	α-helix	trans	-70.8	-36.6	178.3	-67.1	175.7	0	0	0	113.3	P621 F980 A1022 F1023 E1024	P621-L1026 HydrophobicContact CB-CD1 3.88Å; P621-L1026 HydrophobicContact CG-CD1 4.14Å; F980-L1026 HydrophobicContact CZ-CD1 4.45Å; A1022-L1026 PolarHBondContact O-N 2.98Å; F1023-L1026 HydrophobicContact CD1-CD1 4.5Å; F1023-L1026 PolarHBondContact O-N 3.3Å; F1023-L1026 VanDerWaalsContact O-N 3.09Å; E1024-L1026 VanDerWaalsContact C-N 3.34Å; E1024-L1026 PolarHBondContact O-N 2.82Å
1027	L	78.9	Confident	82.4	Confident	21 Å²	21	51.3 Å²	51.3	11%	0.11	30%	0.295	C	S	.	.	H	α-helix	trans	-87.6	-12.2	-173.6	-66.7	175.9	0	0	0	114.5	F983 P996 Y1000 F1023 E1024 Q1029 S1030	F983-L1027 HydrophobicContact CE1-CD2 3.91Å; F983-L1027 HydrophobicContact CZ-CD2 3.68Å; P996-L1027 HydrophobicContact CB-CD1 3.83Å; P996-L1027 HydrophobicContact CB-CD2 4.42Å; P996-L1027 HydrophobicContact CG-CD1 4.34Å; Y1000-L1027 HydrophobicContact CE1-CD1 3.99Å; F1023-L1027 WeakPolarHBondContact O-CG 3.42Å; F1023-L1027 PolarHBondContact O-N 2.67Å; E1024-L1027 PolarHBondContact O-N 2.65Å; L1027-Q1029 PolarHBondContact O-N 2.8Å; L1027-S1030 WeakPolarHBondContact O-CB 3.37Å; L1027-S1030 PolarHBondContact O-N 2.92Å; L1027-S1030 PolarHBondContact O-OG 3.42Å
1028	C	71.1	Confident	82.3	Confident	35 Å²	35	50.7 Å²	50.7	24%	0.236	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-54	-24.9	-177.5	-170.9	0	0	0	0	113.8	E1024 S1030 G1031 D1033	E1024-C1028 WeakPolarHBondContact O-CB 3.46Å; E1024-C1028 PolarHBondContact O-N 3.28Å; C1028-S1030 PolarHBondContact O-N 2.9Å; C1028-G1031 PolarHBondContact O-N 3.33Å; C1028-D1033 VanDerWaalsContact SG-CG 3.55Å
1029	Q	62.5	Low	82.3	Confident	193 Å²	193	50.3 Å²	50.3	90%	0.902	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-58	-15.6	174.2	-60.4	-179.1	5.5	0	0	113.9	L1027	L1027-Q1029 PolarHBondContact O-N 2.8Å
1030	S	59.9	Low	82.3	Confident	87 Å²	87	54.6 Å²	54.6	61%	0.608	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-85.4	-0.8	-177.9	65	0	0	0	0	116	L1027 C1028	L1027-S1030 WeakPolarHBondContact O-CB 3.37Å; L1027-S1030 PolarHBondContact O-N 2.92Å; L1027-S1030 PolarHBondContact O-OG 3.42Å; C1028-S1030 PolarHBondContact O-N 2.9Å
1031	G	59.2	Low	82.3	Confident	69 Å²	69	57.7 Å²	57.7	71%	0.711	32%	0.32	S	S	*	.	S	Bend	trans	103	-7.2	163.5	0	0	0	0	0	117.8	C1028	C1028-G1031 PolarHBondContact O-N 3.33Å
1032	V	66.4	Low	82.4	Confident	96 Å²	96	57.4 Å²	57.4	58%	0.582	32%	0.319	S	S	*	.			trans	-120.5	103.4	169.6	-174.5	0	0	0	0	109.3	K1034	V1032-K1034 HydrophobicContact CG1-CG 3.98Å; V1032-K1034 PolarHBondContact O-N 3.39Å; V1032-K1034 VanDerWaalsContact O-N 3.08Å
1033	D	77	Confident	82.6	Confident	68 Å²	68	56.4 Å²	56.4	36%	0.364	31%	0.31	S	S	.	.			trans	-77.7	93.8	178.4	-167.4	-5.1	0	0	0	110.8	C1028 R1035	C1028-D1033 VanDerWaalsContact SG-CG 3.55Å; D1033-R1035 VanDerWaalsContact C-N 3.33Å; D1033-R1035 WeakPolarHBondContact OD1-CB 3.34Å; D1033-R1035 VanDerWaalsContact OD1-CG 3.22Å; D1033-R1035 WeakPolarHBondContact OD1-CG 3.25Å; D1033-R1035 IonicContact OD1-CZ 3.06Å; D1033-R1035 PolarHBondContact OD1-N 3.4Å; D1033-R1035 VanDerWaalsContact OD1-N 3.1Å; D1033-R1035 IonicContact OD1-NE 3.14Å; D1033-R1035 PolarHBondContact OD1-NE 3.06Å; D1033-R1035 IonicContact OD1-NH2 2.84Å; D1033-R1035 IonicContact OD2-CZ 3.87Å; D1033-R1035 IonicContact OD2-NE 3.72Å; D1033-R1035 PolarHBondContact OD2-NE 2.91Å; D1033-R1035 IonicContact OD2-NH2 2.78Å; D1033-R1035 PolarHBondContact OD2-NH2 3.23Å
1034	K	82.5	Confident	82.8	Confident	86 Å²	86	61.2 Å²	61.2	37%	0.374	33%	0.332	S	S	.	.			trans	-88.1	1.4	175.7	-64.3	-179	-177	169.4	0	113.2	V1032 Q1036 D1037 V1038	V1032-K1034 HydrophobicContact CG1-CG 3.98Å; V1032-K1034 PolarHBondContact O-N 3.39Å; V1032-K1034 VanDerWaalsContact O-N 3.08Å; K1034-Q1036 VanDerWaalsContact C-N 3.29Å; K1034-Q1036 PolarHBondContact O-N 2.83Å; K1034-D1037 PolarHBondContact O-N 3.28Å; K1034-V1038 WeakPolarHBondContact O-CG2 3.45Å; K1034-V1038 PolarHBondContact O-N 2.84Å; K1034-V1038 VanDerWaalsContact O-N 3.12Å
1035	R	87.3	Confident	82.9	Confident	63 Å²	63	62 Å²	62	24%	0.238	34%	0.338	C	S	.	.	H	α-helix	trans	-59.5	-39.6	-170.7	-69.9	179.7	-65.2	167.1	-1.6	112.4	E1024 D1033 V1038 A1039 C1059	E1024-R1035 HydrophobicContact CB-CG 3.58Å; D1033-R1035 VanDerWaalsContact C-N 3.33Å; D1033-R1035 WeakPolarHBondContact OD1-CB 3.34Å; D1033-R1035 VanDerWaalsContact OD1-CG 3.22Å; D1033-R1035 WeakPolarHBondContact OD1-CG 3.25Å; D1033-R1035 IonicContact OD1-CZ 3.06Å; D1033-R1035 PolarHBondContact OD1-N 3.4Å; D1033-R1035 VanDerWaalsContact OD1-N 3.1Å; D1033-R1035 IonicContact OD1-NE 3.14Å; D1033-R1035 PolarHBondContact OD1-NE 3.06Å; D1033-R1035 IonicContact OD1-NH2 2.84Å; D1033-R1035 IonicContact OD2-CZ 3.87Å; D1033-R1035 IonicContact OD2-NE 3.72Å; D1033-R1035 PolarHBondContact OD2-NE 2.91Å; D1033-R1035 IonicContact OD2-NH2 2.78Å; D1033-R1035 PolarHBondContact OD2-NH2 3.23Å; R1035-V1038 PolarHBondContact O-N 3.41Å; R1035-A1039 WeakPolarHBondContact O-CB 3.46Å; R1035-A1039 PolarHBondContact O-N 3.01Å; R1035-C1059 HydrophobicContact CB-CB 3.78Å
1036	Q	90.5	Very high	83.3	Confident	48 Å²	48	60.3 Å²	60.3	22%	0.224	32%	0.32	C	S	.	.	H	α-helix	trans	-63.3	-46.6	179.3	-63.2	-175.4	38.8	0	0	112.5	K1034 V1038 A1039 Y1040 C1059 F1060 P1061	K1034-Q1036 VanDerWaalsContact C-N 3.29Å; K1034-Q1036 PolarHBondContact O-N 2.83Å; Q1036-V1038 VanDerWaalsContact C-N 3.32Å; Q1036-V1038 PolarHBondContact O-N 3.19Å; Q1036-A1039 PolarHBondContact O-N 3.17Å; Q1036-Y1040 WeakPolarHBondContact O-CD2 3.47Å; Q1036-Y1040 PolarHBondContact O-N 2.95Å; Q1036-C1059 WeakPolarHBondContact CG-O 3.46Å; Q1036-F1060 HydrophobicContact CB-CD1 4.13Å; Q1036-F1060 HydrophobicContact CB-CE1 3.98Å; Q1036-F1060 HydrophobicContact CG-CD1 3.85Å; Q1036-F1060 HydrophobicContact CG-CE1 4.24Å; Q1036-P1061 VanDerWaalsContact NE2-CD 3.29Å
1037	D	90.2	Very high	83.9	Confident	109 Å²	109	55.8 Å²	55.8	58%	0.583	30%	0.297	S	S	*	.	H	α-helix	trans	-65.8	-38.8	-178.7	-66.1	-18.2	0	0	0	111.3	K1034 R1041	K1034-D1037 PolarHBondContact O-N 3.28Å; D1037-R1041 WeakPolarHBondContact O-CG 3.02Å; D1037-R1041 PolarHBondContact O-N 2.53Å
1038	V	92.3	Very high	84.6	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.006	29%	0.293	C	S	.	.	H	α-helix	trans	-66.4	-44.5	174.1	175.7	0	0	0	0	110.5	W1017 R1020 L1021 E1024 K1034 R1035 Q1036 R1041 A1042	W1017-V1038 HydrophobicContact CZ3-CG1 4.43Å; R1020-V1038 HydrophobicContact CB-CG1 4.49Å; R1020-V1038 HydrophobicContact CG-CG1 3.55Å; L1021-V1038 HydrophobicContact CD2-CB 4.14Å; L1021-V1038 HydrophobicContact CD2-CG1 3.59Å; L1021-V1038 HydrophobicContact CG-CG1 4.4Å; E1024-V1038 HydrophobicContact CG-CG2 4.24Å; K1034-V1038 WeakPolarHBondContact O-CG2 3.45Å; K1034-V1038 PolarHBondContact O-N 2.84Å; K1034-V1038 VanDerWaalsContact O-N 3.12Å; R1035-V1038 PolarHBondContact O-N 3.41Å; Q1036-V1038 VanDerWaalsContact C-N 3.32Å; Q1036-V1038 PolarHBondContact O-N 3.19Å; V1038-R1041 PolarHBondContact O-N 3.5Å; V1038-A1042 WeakPolarHBondContact O-CB 3.46Å; V1038-A1042 PolarHBondContact O-N 2.68Å
1039	A	94.1	Very high	85.7	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-59.8	-47.3	178	0	0	0	0	0	111.4	L1021 R1035 Q1036 R1041 A1042 L1043 A1056 C1059 F1060	L1021-A1039 HydrophobicContact CD2-CB 4.02Å; R1035-A1039 WeakPolarHBondContact O-CB 3.46Å; R1035-A1039 PolarHBondContact O-N 3.01Å; Q1036-A1039 PolarHBondContact O-N 3.17Å; A1039-R1041 VanDerWaalsContact C-N 3.33Å; A1039-R1041 PolarHBondContact O-N 3.41Å; A1039-A1042 WeakPolarHBondContact O-CB 3.38Å; A1039-A1042 PolarHBondContact O-N 3.49Å; A1039-A1042 VanDerWaalsContact O-N 3.17Å; A1039-L1043 VanDerWaalsContact O-CG 3.29Å; A1039-L1043 WeakPolarHBondContact O-CG 3.37Å; A1039-L1043 PolarHBondContact O-N 3.21Å; A1039-A1056 HydrophobicContact CB-CB 4.03Å; A1039-C1059 HydrophobicContact CB-CB 4.01Å; A1039-F1060 HydrophobicContact CB-CE1 4.26Å; A1039-F1060 HydrophobicContact CB-CE2 3.84Å; A1039-F1060 HydrophobicContact CB-CZ 3.61Å
1040	Y	94	Very high	87.3	Confident	91 Å²	91	44.4 Å²	44.4	36%	0.357	24%	0.239	S	C	.	.	H	α-helix	trans	-58.6	-42.6	175.8	-76.5	-57.5	0	0	0	112.8	Q1036 L1043 Q1044 F1060 K1064	Q1036-Y1040 WeakPolarHBondContact O-CD2 3.47Å; Q1036-Y1040 PolarHBondContact O-N 2.95Å; Y1040-L1043 PolarHBondContact O-N 2.72Å; Y1040-Q1044 WeakPolarHBondContact O-CB 3.4Å; Y1040-Q1044 VanDerWaalsContact O-CG 3.28Å; Y1040-Q1044 WeakPolarHBondContact O-CG 3.48Å; Y1040-Q1044 PolarHBondContact O-N 2.66Å; Y1040-F1060 HydrophobicContact CD1-CE1 4.21Å; Y1040-F1060 AromaticContact CD1-CZ 3.83Å; Y1040-F1060 HydrophobicContact CD1-CZ 3.83Å; Y1040-F1060 AromaticContact CD2-CE1 3.83Å; Y1040-F1060 HydrophobicContact CD2-CE1 3.83Å; Y1040-F1060 HydrophobicContact CD2-CZ 4.14Å; Y1040-F1060 AromaticContact CE1-CE1 3.84Å; Y1040-F1060 HydrophobicContact CE1-CE1 3.84Å; Y1040-F1060 AromaticContact CE1-CZ 3.71Å; Y1040-F1060 HydrophobicContact CE1-CZ 3.71Å; Y1040-F1060 HydrophobicContact CE2-CD1 4.42Å; Y1040-F1060 AromaticContact CE2-CE1 3.44Å; Y1040-F1060 HydrophobicContact CE2-CE1 3.44Å; Y1040-F1060 VanDerWaalsContact CE2-CE1 3.44Å; Y1040-F1060 HydrophobicContact CE2-CZ 4.06Å; Y1040-F1060 HydrophobicContact CG-CE1 4.2Å; Y1040-F1060 HydrophobicContact CG-CZ 4.03Å; Y1040-F1060 AromaticContact CZ-CE1 3.43Å; Y1040-F1060 VanDerWaalsContact CZ-CE1 3.43Å; Y1040-F1060 AromaticContact CZ-CZ 3.83Å; Y1040-K1064 PolarHBondContact OH-NZ 3.28Å
1041	R	93.8	Very high	88.9	Confident	77 Å²	77	40.9 Å²	40.9	29%	0.291	22%	0.215	S	C	.	.	H	α-helix	trans	-64.3	-40.9	176.1	-73.3	-170.4	-68.7	160.9	-1.5	112.3	W1017 D1037 V1038 A1039 Q1044 S1045	W1017-R1041 HydrophobicContact CH2-CB 3.96Å; W1017-R1041 HydrophobicContact CZ3-CB 4.2Å; D1037-R1041 WeakPolarHBondContact O-CG 3.02Å; D1037-R1041 PolarHBondContact O-N 2.53Å; V1038-R1041 PolarHBondContact O-N 3.5Å; A1039-R1041 VanDerWaalsContact C-N 3.33Å; A1039-R1041 PolarHBondContact O-N 3.41Å; R1041-Q1044 PolarHBondContact O-N 2.85Å; R1041-S1045 WeakPolarHBondContact O-CB 3.28Å; R1041-S1045 PolarHBondContact O-N 2.93Å; R1041-S1045 PolarHBondContact O-OG 2.97Å
1042	A	94.5	Very high	90.5	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.3	-48.4	177.6	0	0	0	0	0	111.2	W1017 V1038 A1039 Q1044 S1045 C1046 L1052	W1017-A1042 HydrophobicContact CB-CB 3.91Å; W1017-A1042 HydrophobicContact CD2-CB 3.75Å; W1017-A1042 HydrophobicContact CE3-CB 3.68Å; W1017-A1042 HydrophobicContact CG-CB 3.86Å; W1017-A1042 HydrophobicContact CZ3-CB 4.45Å; V1038-A1042 WeakPolarHBondContact O-CB 3.46Å; V1038-A1042 PolarHBondContact O-N 2.68Å; A1039-A1042 WeakPolarHBondContact O-CB 3.38Å; A1039-A1042 PolarHBondContact O-N 3.49Å; A1039-A1042 VanDerWaalsContact O-N 3.17Å; A1042-Q1044 VanDerWaalsContact C-N 3.33Å; A1042-Q1044 PolarHBondContact O-N 3.48Å; A1042-S1045 PolarHBondContact O-N 3.15Å; A1042-S1045 VanDerWaalsContact O-N 3.12Å; A1042-C1046 PolarHBondContact O-N 3.38Å; A1042-L1052 HydrophobicContact CB-CD1 4.11Å; A1042-L1052 HydrophobicContact CB-CD2 4.05Å; A1042-L1052 HydrophobicContact CB-CG 4.36Å
1043	L	94.5	Very high	91.9	Very high	4 Å²	4	33 Å²	33	2%	0.021	15%	0.153	C	C	.	.	H	α-helix	trans	-63.1	-38	177.7	-63.2	-177.3	0	0	0	112.4	F371 A1039 Y1040 S1045 P1047 L1052 F1053 A1056 F1060	F371-L1043 WeakPolarHBondContact CD2-O 3.44Å; F371-L1043 VanDerWaalsContact CE2-O 3.29Å; F371-L1043 WeakPolarHBondContact CE2-O 3.49Å; A1039-L1043 VanDerWaalsContact O-CG 3.29Å; A1039-L1043 WeakPolarHBondContact O-CG 3.37Å; A1039-L1043 PolarHBondContact O-N 3.21Å; Y1040-L1043 PolarHBondContact O-N 2.72Å; L1043-S1045 VanDerWaalsContact C-N 3.28Å; L1043-S1045 PolarHBondContact O-N 2.94Å; L1043-P1047 WeakPolarHBondContact O-CA 3.39Å; L1043-L1052 HydrophobicContact CD2-CG 4.36Å; L1043-F1053 HydrophobicContact CB-CZ 4.45Å; L1043-F1053 HydrophobicContact CD1-CD1 4.23Å; L1043-F1053 HydrophobicContact CD1-CE1 4.09Å; L1043-F1053 HydrophobicContact CD2-CB 4.35Å; L1043-F1053 HydrophobicContact CD2-CD1 3.79Å; L1043-F1053 HydrophobicContact CD2-CD2 3.53Å; L1043-F1053 HydrophobicContact CD2-CE1 3.93Å; L1043-F1053 HydrophobicContact CD2-CE2 3.66Å; L1043-F1053 HydrophobicContact CD2-CG 3.61Å; L1043-F1053 HydrophobicContact CD2-CZ 3.87Å; L1043-F1053 HydrophobicContact CG-CE1 4.48Å; L1043-A1056 HydrophobicContact CD1-CB 4.06Å; L1043-A1056 HydrophobicContact CD2-CB 3.89Å; L1043-A1056 HydrophobicContact CG-CB 4.1Å; L1043-F1060 HydrophobicContact CD1-CE2 4.13Å
1044	Q	93	Very high	92.7	Very high	104 Å²	104	29.9 Å²	29.9	49%	0.486	14%	0.136	S	C	.	.	H	α-helix	trans	-62.9	-35.9	174.2	-77.4	177.2	-0.5	0	0	112.8	F371 Y1040 R1041 A1042	F371-Q1044 HydrophobicContact CD1-CG 4.36Å; F371-Q1044 VanDerWaalsContact CD2-CA 3.45Å; F371-Q1044 HydrophobicContact CD2-CB 4.42Å; F371-Q1044 HydrophobicContact CD2-CG 4.39Å; F371-Q1044 HydrophobicContact CG-CG 4.3Å; Y1040-Q1044 WeakPolarHBondContact O-CB 3.4Å; Y1040-Q1044 VanDerWaalsContact O-CG 3.28Å; Y1040-Q1044 WeakPolarHBondContact O-CG 3.48Å; Y1040-Q1044 PolarHBondContact O-N 2.66Å; R1041-Q1044 PolarHBondContact O-N 2.85Å; A1042-Q1044 VanDerWaalsContact C-N 3.33Å; A1042-Q1044 PolarHBondContact O-N 3.48Å
1045	S	92	Very high	93.2	Very high	20 Å²	20	26.4 Å²	26.4	14%	0.14	12%	0.122	C	C	.	.	H	α-helix	trans	-86.2	-28.5	-175.7	-48.4	0	0	0	0	112.9	Q1011 H1012 R1041 A1042 L1043 P1047 W1048	Q1011-S1045 WeakPolarHBondContact O-CB 3.23Å; H1012-S1045 PolarHBondContact ND1-O 3.48Å; R1041-S1045 WeakPolarHBondContact O-CB 3.28Å; R1041-S1045 PolarHBondContact O-N 2.93Å; R1041-S1045 PolarHBondContact O-OG 2.97Å; A1042-S1045 PolarHBondContact O-N 3.15Å; A1042-S1045 VanDerWaalsContact O-N 3.12Å; L1043-S1045 VanDerWaalsContact C-N 3.28Å; L1043-S1045 PolarHBondContact O-N 2.94Å; S1045-P1047 VanDerWaalsContact C-CD 3.49Å; S1045-W1048 WeakPolarHBondContact O-CH2 3.37Å; S1045-W1048 WeakPolarHBondContact O-CZ3 3.37Å
1046	C	93.3	Very high	93.4	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.111	C	C	.	.			trans	-132.1	58.8	-177.1	-64.4	0	0	0	0	112.9	H1012 V1014 A1042 W1048 S1049 L1052	H1012-C1046 VanDerWaalsContact C-SG 3.53Å; H1012-C1046 PolarHBondContact O-SG 3.41Å; H1012-C1046 VanDerWaalsContact O-SG 3.38Å; V1014-C1046 HydrophobicContact CG2-CB 4.06Å; A1042-C1046 PolarHBondContact O-N 3.38Å; C1046-W1048 HydrophobicContact CB-CH2 4.15Å; C1046-W1048 HydrophobicContact CB-CZ2 4.09Å; C1046-W1048 PolarHBondContact O-N 3.28Å; C1046-S1049 PolarHBondContact O-N 3.36Å; C1046-L1052 HydrophobicContact CB-CD2 3.49Å; C1046-L1052 VanDerWaalsContact CB-CD2 3.49Å
1047	P	94.2	Very high	93.5	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-10.9	-174.6	24.5	-35.2	0	0	0	115.6	F371 F374 L1043 S1045	F371-P1047 HydrophobicContact CD2-CB 3.68Å; F371-P1047 HydrophobicContact CD2-CG 4.07Å; F371-P1047 HydrophobicContact CE2-CB 3.99Å; F374-P1047 HydrophobicContact CB-CG 4.44Å; F374-P1047 HydrophobicContact CD1-CB 3.63Å; F374-P1047 HydrophobicContact CD1-CG 3.74Å; F374-P1047 HydrophobicContact CE1-CB 3.97Å; F374-P1047 HydrophobicContact CE1-CG 4.2Å; F374-P1047 HydrophobicContact CG-CB 4.4Å; F374-P1047 HydrophobicContact CG-CG 4.04Å; L1043-P1047 WeakPolarHBondContact O-CA 3.39Å; S1045-P1047 VanDerWaalsContact C-CD 3.49Å
1048	W	94.4	Very high	93.4	Very high	7 Å²	7	20.4 Å²	20.4	3%	0.027	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-13.2	-179.3	62.3	84.7	0	0	0	114.2	L368 F374 F421 E424 S425 H1012 V1014 S1045 C1046 K1050 L1077	L368-W1048 HydrophobicContact CB-CE3 3.85Å; L368-W1048 HydrophobicContact CB-CH2 4.33Å; L368-W1048 HydrophobicContact CB-CZ3 3.6Å; L368-W1048 HydrophobicContact CD1-CE3 4.5Å; L368-W1048 HydrophobicContact CD2-CB 4.31Å; L368-W1048 HydrophobicContact CD2-CD2 3.89Å; L368-W1048 HydrophobicContact CD2-CE3 3.57Å; L368-W1048 HydrophobicContact CD2-CG 4.21Å; L368-W1048 HydrophobicContact CD2-CZ3 4.22Å; L368-W1048 HydrophobicContact CG-CE3 4.16Å; L368-W1048 HydrophobicContact CG-CZ3 4.31Å; F374-W1048 HydrophobicContact CE1-CB 4.11Å; F374-W1048 HydrophobicContact CE2-CB 4.29Å; F374-W1048 HydrophobicContact CZ-CB 3.53Å; F421-W1048 HydrophobicContact CD2-CB 4.44Å; F421-W1048 HydrophobicContact CE2-CB 3.58Å; F421-W1048 HydrophobicContact CE2-CG 4.18Å; F421-W1048 HydrophobicContact CZ-CB 4.27Å; E424-W1048 CarbonylContact C-O 3.58Å; S425-W1048 WeakPolarHBondContact CA-O 3.43Å; H1012-W1048 HydrophobicContact CB-CH2 3.9Å; H1012-W1048 HydrophobicContact CB-CZ2 4.47Å; V1014-W1048 HydrophobicContact CG2-CZ2 4.31Å; S1045-W1048 WeakPolarHBondContact O-CH2 3.37Å; S1045-W1048 WeakPolarHBondContact O-CZ3 3.37Å; C1046-W1048 HydrophobicContact CB-CH2 4.15Å; C1046-W1048 HydrophobicContact CB-CZ2 4.09Å; C1046-W1048 PolarHBondContact O-N 3.28Å; W1048-K1050 PolarHBondContact O-N 3.07Å; W1048-L1077 VanDerWaalsContact O-CD2 3.32Å; W1048-L1077 WeakPolarHBondContact O-CD2 3.27Å
1049	S	94.3	Very high	93.2	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.096	C	C	.	.			trans	-92.1	104.9	-171.1	-175.5	0	0	0	0	111.1	E424 V1014 C1046 S1051 L1052 F1053	E424-S1049 WeakPolarHBondContact O-CA 3.47Å; V1014-S1049 VanDerWaalsContact CG1-OG 3.31Å; V1014-S1049 WeakPolarHBondContact CG1-OG 3.47Å; C1046-S1049 PolarHBondContact O-N 3.36Å; S1049-S1051 VanDerWaalsContact C-N 3.33Å; S1049-S1051 PolarHBondContact O-N 3.44Å; S1049-S1051 PolarHBondContact OG-OG 2.92Å; S1049-L1052 WeakPolarHBondContact O-CB 3.29Å; S1049-L1052 PolarHBondContact O-N 3.18Å; S1049-L1052 VanDerWaalsContact O-N 3.16Å; S1049-F1053 WeakPolarHBondContact O-CD2 3.38Å; S1049-F1053 PolarHBondContact O-N 3.39Å
1050	K	95.3	Very high	93	Very high	2 Å²	2	21 Å²	21	1%	0.009	10%	0.096	C	C	.	.	H	α-helix	trans	-54.8	-48.9	175.3	178	-177	173	175.1	0	111.7	E424 E533 E537 W1048 L1052 F1053 D1054 M1072 R1078	E424-K1050 PolarHBondContact O-N 2.95Å; E533-K1050 WeakPolarHBondContact OE1-CE 3.24Å; E533-K1050 IonicContact OE1-NZ 3.23Å; E533-K1050 PolarHBondContact OE1-NZ 2.87Å; E537-K1050 WeakPolarHBondContact OE1-CD 3.08Å; E537-K1050 WeakPolarHBondContact OE1-CE 3.21Å; E537-K1050 IonicContact OE1-NZ 2.87Å; E537-K1050 PolarHBondContact OE1-NZ 2.97Å; W1048-K1050 PolarHBondContact O-N 3.07Å; K1050-L1052 PolarHBondContact O-N 3.27Å; K1050-F1053 WeakPolarHBondContact O-CA 3.45Å; K1050-F1053 WeakPolarHBondContact O-CB 3.23Å; K1050-F1053 PolarHBondContact O-N 3.21Å; K1050-D1054 PolarHBondContact O-N 2.76Å; K1050-M1072 HydrophobicContact CG-CE 4.16Å; K1050-R1078 WeakPolarHBondContact CD-O 3.18Å; K1050-R1078 WeakPolarHBondContact CE-O 3.08Å; K1050-R1078 PolarHBondContact NZ-O 3.48Å
1051	S	93.4	Very high	92.6	Very high	14 Å²	14	19.1 Å²	19.1	10%	0.098	10%	0.096	C	C	.	.	H	α-helix	trans	-59	-26.2	-178.5	69.3	0	0	0	0	114.2	R1018 S1049 D1055	R1018-S1051 PolarHBondContact NH1-OG 2.92Å; S1049-S1051 VanDerWaalsContact C-N 3.33Å; S1049-S1051 PolarHBondContact O-N 3.44Å; S1049-S1051 PolarHBondContact OG-OG 2.92Å; S1051-D1055 VanDerWaalsContact O-CG 3.31Å; S1051-D1055 PolarHBondContact O-N 3.13Å
1052	L	94.1	Very high	92.3	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-77.1	-33.6	174.2	-175.9	64.6	0	0	0	112.1	W1017 R1018 L1021 A1042 L1043 C1046 S1049 K1050 A1056	W1017-L1052 HydrophobicContact CB-CD1 3.91Å; W1017-L1052 HydrophobicContact CB-CD2 4.35Å; R1018-L1052 HydrophobicContact CG-CB 4.47Å; R1018-L1052 HydrophobicContact CG-CD1 3.69Å; L1021-L1052 HydrophobicContact CD1-CD1 3.72Å; A1042-L1052 HydrophobicContact CB-CD1 4.11Å; A1042-L1052 HydrophobicContact CB-CD2 4.05Å; A1042-L1052 HydrophobicContact CB-CG 4.36Å; L1043-L1052 HydrophobicContact CD2-CG 4.36Å; C1046-L1052 HydrophobicContact CB-CD2 3.49Å; C1046-L1052 VanDerWaalsContact CB-CD2 3.49Å; S1049-L1052 WeakPolarHBondContact O-CB 3.29Å; S1049-L1052 PolarHBondContact O-N 3.18Å; S1049-L1052 VanDerWaalsContact O-N 3.16Å; K1050-L1052 PolarHBondContact O-N 3.27Å; L1052-A1056 VanDerWaalsContact O-CB 3.23Å; L1052-A1056 WeakPolarHBondContact O-CB 3.49Å; L1052-A1056 PolarHBondContact O-N 2.91Å
1053	F	95	Very high	91.9	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-64.8	-41.4	170.9	-82.8	-102.9	0	0	0	111.1	L1043 S1049 K1050 D1055 A1056 V1057 V1068 L1071 M1072 L1077	L1043-F1053 HydrophobicContact CB-CZ 4.45Å; L1043-F1053 HydrophobicContact CD1-CD1 4.23Å; L1043-F1053 HydrophobicContact CD1-CE1 4.09Å; L1043-F1053 HydrophobicContact CD2-CB 4.35Å; L1043-F1053 HydrophobicContact CD2-CD1 3.79Å; L1043-F1053 HydrophobicContact CD2-CD2 3.53Å; L1043-F1053 HydrophobicContact CD2-CE1 3.93Å; L1043-F1053 HydrophobicContact CD2-CE2 3.66Å; L1043-F1053 HydrophobicContact CD2-CG 3.61Å; L1043-F1053 HydrophobicContact CD2-CZ 3.87Å; L1043-F1053 HydrophobicContact CG-CE1 4.48Å; S1049-F1053 WeakPolarHBondContact O-CD2 3.38Å; S1049-F1053 PolarHBondContact O-N 3.39Å; K1050-F1053 WeakPolarHBondContact O-CA 3.45Å; K1050-F1053 WeakPolarHBondContact O-CB 3.23Å; K1050-F1053 PolarHBondContact O-N 3.21Å; F1053-D1055 PolarHBondContact O-N 3.48Å; F1053-A1056 CarbonylContact O-C 3.59Å; F1053-A1056 WeakPolarHBondContact O-CA 3.45Å; F1053-A1056 WeakPolarHBondContact O-CB 3.42Å; F1053-A1056 PolarHBondContact O-N 3.06Å; F1053-A1056 VanDerWaalsContact O-N 3.09Å; F1053-V1057 WeakPolarHBondContact O-CG2 3.3Å; F1053-V1057 PolarHBondContact O-N 2.91Å; F1053-V1068 HydrophobicContact CD1-CG1 3.84Å; F1053-L1071 HydrophobicContact CE1-CB 4.4Å; F1053-L1071 HydrophobicContact CE1-CD2 3.78Å; F1053-L1071 HydrophobicContact CE1-CG 3.95Å; F1053-L1071 HydrophobicContact CZ-CD2 4.23Å; F1053-L1071 HydrophobicContact CZ-CG 4.37Å; F1053-M1072 HydrophobicContact CB-CE 4.11Å; F1053-M1072 HydrophobicContact CB-CG 3.95Å; F1053-M1072 HydrophobicContact CB-SD 3.8Å; F1053-M1072 HydrophobicContact CD1-CG 3.26Å; F1053-M1072 HydrophobicContact CD1-SD 4.09Å; F1053-M1072 HydrophobicContact CE1-CG 3.84Å; F1053-M1072 HydrophobicContact CG-CG 3.73Å; F1053-M1072 HydrophobicContact CG-SD 4.27Å; F1053-L1077 HydrophobicContact CD1-CD1 4.33Å; F1053-L1077 HydrophobicContact CD2-CD1 3.37Å; F1053-L1077 HydrophobicContact CE1-CD1 4.33Å; F1053-L1077 HydrophobicContact CE2-CD1 3.39Å; F1053-L1077 HydrophobicContact CG-CD1 3.87Å; F1053-L1077 HydrophobicContact CZ-CD1 3.9Å
1054	D	93.4	Very high	91.7	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-62	-43.5	176.8	-57.8	-35.2	0	0	0	111.9	Q530 K1050 A1056 V1057	Q530-D1054 PolarHBondContact NE2-O 2.69Å; K1050-D1054 PolarHBondContact O-N 2.76Å; D1054-A1056 VanDerWaalsContact C-N 3.32Å; D1054-A1056 PolarHBondContact O-N 3.44Å; D1054-V1057 PolarHBondContact O-N 3.28Å
1055	D	92.7	Very high	91.6	Very high	14 Å²	14	24.6 Å²	24.6	8%	0.075	13%	0.132	C	C	.	.	H	α-helix	trans	-62.9	-39	172.4	-69.7	-9.6	0	0	0	111.6	R1018 L1021 S1051 F1053 Q1058 C1059	R1018-D1055 WeakPolarHBondContact CB-OD2 3.33Å; R1018-D1055 WeakPolarHBondContact CG-OD2 3.45Å; R1018-D1055 IonicContact CZ-OD1 3.49Å; R1018-D1055 IonicContact CZ-OD2 3.92Å; R1018-D1055 IonicContact NE-OD1 2.83Å; R1018-D1055 IonicContact NE-OD2 2.62Å; R1018-D1055 PolarHBondContact NE-OD2 3.08Å; R1018-D1055 VanDerWaalsContact NH2-CG 3.31Å; R1018-D1055 IonicContact NH2-OD1 2.86Å; R1018-D1055 PolarHBondContact NH2-OD1 3.46Å; R1018-D1055 IonicContact NH2-OD2 3.48Å; R1018-D1055 PolarHBondContact NH2-OD2 2.9Å; L1021-D1055 HydrophobicContact CD1-CB 3.97Å; S1051-D1055 VanDerWaalsContact O-CG 3.31Å; S1051-D1055 PolarHBondContact O-N 3.13Å; F1053-D1055 PolarHBondContact O-N 3.48Å; D1055-Q1058 PolarHBondContact O-N 3.47Å; D1055-C1059 PolarHBondContact O-SG 3.02Å; D1055-C1059 VanDerWaalsContact O-SG 3.42Å
1056	A	92.6	Very high	91.6	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-68.8	-36.7	-179.5	0	0	0	0	0	112.2	A1039 L1043 L1052 F1053 D1054 Q1058 C1059 F1060	A1039-A1056 HydrophobicContact CB-CB 4.03Å; L1043-A1056 HydrophobicContact CD1-CB 4.06Å; L1043-A1056 HydrophobicContact CD2-CB 3.89Å; L1043-A1056 HydrophobicContact CG-CB 4.1Å; L1052-A1056 VanDerWaalsContact O-CB 3.23Å; L1052-A1056 WeakPolarHBondContact O-CB 3.49Å; L1052-A1056 PolarHBondContact O-N 2.91Å; F1053-A1056 CarbonylContact O-C 3.59Å; F1053-A1056 WeakPolarHBondContact O-CA 3.45Å; F1053-A1056 WeakPolarHBondContact O-CB 3.42Å; F1053-A1056 PolarHBondContact O-N 3.06Å; F1053-A1056 VanDerWaalsContact O-N 3.09Å; D1054-A1056 VanDerWaalsContact C-N 3.32Å; D1054-A1056 PolarHBondContact O-N 3.44Å; A1056-Q1058 PolarHBondContact O-N 3.32Å; A1056-C1059 WeakPolarHBondContact O-CA 3.32Å; A1056-C1059 VanDerWaalsContact O-CB 3.25Å; A1056-C1059 WeakPolarHBondContact O-CB 3.41Å; A1056-C1059 PolarHBondContact O-N 3.21Å; A1056-F1060 HydrophobicContact CB-CE2 4.04Å; A1056-F1060 WeakPolarHBondContact O-CD2 3.36Å; A1056-F1060 PolarHBondContact O-N 3.47Å
1057	V	92	Very high	91.6	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-55.1	-41.6	174.8	166.9	0	0	0	0	110.4	K526 W529 F1053 D1054 C1059 F1060 T1065 V1068	K526-V1057 WeakPolarHBondContact CE-O 3.43Å; K526-V1057 HydrophobicContact CG-CG1 4.06Å; K526-V1057 PolarHBondContact NZ-O 3.26Å; W529-V1057 HydrophobicContact CE3-CG1 4.12Å; W529-V1057 HydrophobicContact CH2-CG2 4.28Å; W529-V1057 HydrophobicContact CZ3-CB 4.21Å; W529-V1057 HydrophobicContact CZ3-CG1 3.95Å; W529-V1057 HydrophobicContact CZ3-CG2 3.84Å; F1053-V1057 WeakPolarHBondContact O-CG2 3.3Å; F1053-V1057 PolarHBondContact O-N 2.91Å; D1054-V1057 PolarHBondContact O-N 3.28Å; V1057-C1059 PolarHBondContact O-N 3.22Å; V1057-F1060 PolarHBondContact O-N 3.49Å; V1057-T1065 HydrophobicContact CG1-CG2 3.89Å; V1057-V1068 HydrophobicContact CG2-CB 4.19Å; V1057-V1068 HydrophobicContact CG2-CG1 3.69Å
1058	Q	88	Confident	91.5	Very high	94 Å²	94	32 Å²	32	44%	0.439	17%	0.17	S	C	.	.	H	α-helix	trans	-61.7	-28.5	176	-67.2	-170.9	-1.2	0	0	113.5	K526 Q530 D1055 A1056	K526-Q1058 VanDerWaalsContact NZ-C 3.29Å; K526-Q1058 PolarHBondContact NZ-O 3.01Å; Q530-Q1058 VanDerWaalsContact CD-NE2 3.27Å; D1055-Q1058 PolarHBondContact O-N 3.47Å; A1056-Q1058 PolarHBondContact O-N 3.32Å
1059	C	89	Confident	91.5	Very high	9 Å²	9	31.8 Å²	31.8	6%	0.061	17%	0.169	C	C	.	.	H	α-helix	trans	-82	-20.8	-179.3	-65.5	0	0	0	0	113.8	R1035 Q1036 A1039 D1055 A1056 V1057	R1035-C1059 HydrophobicContact CB-CB 3.78Å; Q1036-C1059 WeakPolarHBondContact CG-O 3.46Å; A1039-C1059 HydrophobicContact CB-CB 4.01Å; D1055-C1059 PolarHBondContact O-SG 3.02Å; D1055-C1059 VanDerWaalsContact O-SG 3.42Å; A1056-C1059 WeakPolarHBondContact O-CA 3.32Å; A1056-C1059 VanDerWaalsContact O-CB 3.25Å; A1056-C1059 WeakPolarHBondContact O-CB 3.41Å; A1056-C1059 PolarHBondContact O-N 3.21Å; V1057-C1059 PolarHBondContact O-N 3.22Å
1060	F	88.8	Confident	91.5	Very high	4 Å²	4	35.4 Å²	35.4	2%	0.018	19%	0.189	C	C	.	.	S	Bend	trans	-90.4	151.7	179.9	-69.2	-62.8	0	0	0	113.1	K526 Q1036 A1039 Y1040 L1043 A1056 V1057 K1064 V1068	K526-F1060 PolarHBondContact NZ-O 2.62Å; Q1036-F1060 HydrophobicContact CB-CD1 4.13Å; Q1036-F1060 HydrophobicContact CB-CE1 3.98Å; Q1036-F1060 HydrophobicContact CG-CD1 3.85Å; Q1036-F1060 HydrophobicContact CG-CE1 4.24Å; A1039-F1060 HydrophobicContact CB-CE1 4.26Å; A1039-F1060 HydrophobicContact CB-CE2 3.84Å; A1039-F1060 HydrophobicContact CB-CZ 3.61Å; Y1040-F1060 HydrophobicContact CD1-CE1 4.21Å; Y1040-F1060 AromaticContact CD1-CZ 3.83Å; Y1040-F1060 HydrophobicContact CD1-CZ 3.83Å; Y1040-F1060 AromaticContact CD2-CE1 3.83Å; Y1040-F1060 HydrophobicContact CD2-CE1 3.83Å; Y1040-F1060 HydrophobicContact CD2-CZ 4.14Å; Y1040-F1060 AromaticContact CE1-CE1 3.84Å; Y1040-F1060 HydrophobicContact CE1-CE1 3.84Å; Y1040-F1060 AromaticContact CE1-CZ 3.71Å; Y1040-F1060 HydrophobicContact CE1-CZ 3.71Å; Y1040-F1060 HydrophobicContact CE2-CD1 4.42Å; Y1040-F1060 AromaticContact CE2-CE1 3.44Å; Y1040-F1060 HydrophobicContact CE2-CE1 3.44Å; Y1040-F1060 VanDerWaalsContact CE2-CE1 3.44Å; Y1040-F1060 HydrophobicContact CE2-CZ 4.06Å; Y1040-F1060 HydrophobicContact CG-CE1 4.2Å; Y1040-F1060 HydrophobicContact CG-CZ 4.03Å; Y1040-F1060 AromaticContact CZ-CE1 3.43Å; Y1040-F1060 VanDerWaalsContact CZ-CE1 3.43Å; Y1040-F1060 AromaticContact CZ-CZ 3.83Å; L1043-F1060 HydrophobicContact CD1-CE2 4.13Å; A1056-F1060 HydrophobicContact CB-CE2 4.04Å; A1056-F1060 WeakPolarHBondContact O-CD2 3.36Å; A1056-F1060 PolarHBondContact O-N 3.47Å; V1057-F1060 PolarHBondContact O-N 3.49Å; F1060-K1064 HydrophobicContact CB-CB 4.21Å; F1060-K1064 HydrophobicContact CD1-CD 4.24Å; F1060-V1068 HydrophobicContact CD2-CG2 3.5Å; F1060-V1068 HydrophobicContact CE2-CG2 3.75Å; F1060-V1068 HydrophobicContact CG-CG2 4.26Å
1061	P	87.3	Confident	91.5	Very high	52 Å²	52	36.9 Å²	36.9	34%	0.338	20%	0.197	S	C	.	.			trans	-60.4	150.1	167.2	-18.2	32.3	0	0	0	110.4	Q1036 E1063 K1064	Q1036-P1061 VanDerWaalsContact NE2-CD 3.29Å; P1061-E1063 PolarHBondContact O-N 3.21Å; P1061-E1063 VanDerWaalsContact O-N 3.11Å; P1061-K1064 PolarHBondContact O-N 3.45Å
1062	A	86.4	Confident	91.6	Very high	49 Å²	49	36.2 Å²	36.2	41%	0.405	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-55.3	-33.6	-176.8	0	0	0	0	0	113.6	K526 K1064 T1065	K526-A1062 HydrophobicContact CB-CB 4.04Å; K526-A1062 HydrophobicContact CD-CB 4.43Å; A1062-K1064 PolarHBondContact O-N 2.92Å; A1062-T1065 WeakPolarHBondContact O-CB 3.24Å; A1062-T1065 PolarHBondContact O-N 2.8Å; A1062-T1065 VanDerWaalsContact O-N 3.16Å; A1062-T1065 PolarHBondContact O-OG1 2.92Å
1063	E	87.3	Confident	91.6	Very high	185 Å²	185	40.5 Å²	40.5	86%	0.864	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-62.4	-23	177.6	-61.4	170.6	-163.5	0	0	113.8	P1061	P1061-E1063 PolarHBondContact O-N 3.21Å; P1061-E1063 VanDerWaalsContact O-N 3.11Å
1064	K	89.6	Confident	91.7	Very high	66 Å²	66	46 Å²	46	29%	0.287	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-96.3	-5.9	179.7	-68.3	-170.4	-178.2	177.4	0	113.2	Y1040 F1060 P1061 A1062 Q1066 V1067 V1068	Y1040-K1064 PolarHBondContact OH-NZ 3.28Å; F1060-K1064 HydrophobicContact CB-CB 4.21Å; F1060-K1064 HydrophobicContact CD1-CD 4.24Å; P1061-K1064 PolarHBondContact O-N 3.45Å; A1062-K1064 PolarHBondContact O-N 2.92Å; K1064-Q1066 VanDerWaalsContact C-N 3.3Å; K1064-Q1066 PolarHBondContact O-N 3.32Å; K1064-V1067 WeakPolarHBondContact O-CB 3.25Å; K1064-V1067 PolarHBondContact O-N 3.21Å; K1064-V1067 VanDerWaalsContact O-N 3.09Å; K1064-V1068 PolarHBondContact O-N 3.02Å
1065	T	89.8	Confident	91.8	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-57.2	-45.6	-177.4	-59.4	0	0	0	0	111.1	K526 W529 V1057 A1062 V1067 V1068 V1069 W1083	K526-T1065 HydrophobicContact CB-CG2 4.46Å; K526-T1065 WeakPolarHBondContact CB-OG1 3.49Å; K526-T1065 HydrophobicContact CG-CG2 4.43Å; K526-T1065 WeakPolarHBondContact CG-OG1 3.07Å; W529-T1065 HydrophobicContact CE3-CG2 4.45Å; V1057-T1065 HydrophobicContact CG1-CG2 3.89Å; A1062-T1065 WeakPolarHBondContact O-CB 3.24Å; A1062-T1065 PolarHBondContact O-N 2.8Å; A1062-T1065 VanDerWaalsContact O-N 3.16Å; A1062-T1065 PolarHBondContact O-OG1 2.92Å; T1065-V1067 VanDerWaalsContact C-N 3.31Å; T1065-V1067 PolarHBondContact O-N 3.42Å; T1065-V1068 WeakPolarHBondContact O-CB 3.2Å; T1065-V1068 PolarHBondContact O-N 2.92Å; T1065-V1069 HydrophobicContact CG2-CG2 4.38Å; T1065-V1069 WeakPolarHBondContact O-CG2 3.31Å; T1065-V1069 PolarHBondContact O-N 3.26Å; T1065-W1083 HydrophobicContact CG2-CH2 3.9Å; T1065-W1083 HydrophobicContact CG2-CZ3 3.56Å
1066	Q	92.9	Very high	92	Very high	81 Å²	81	46.8 Å²	46.8	38%	0.379	26%	0.255	S	S	.	.	H	α-helix	trans	-56	-44.1	176.4	-174.2	173.8	2.3	0	0	112.2	K1064 V1068 V1069 D1070 W1083	K1064-Q1066 VanDerWaalsContact C-N 3.3Å; K1064-Q1066 PolarHBondContact O-N 3.32Å; Q1066-V1068 PolarHBondContact O-N 3.39Å; Q1066-V1069 CarbonylContact O-C 3.6Å; Q1066-V1069 PolarHBondContact O-N 3.08Å; Q1066-V1069 VanDerWaalsContact O-N 3.11Å; Q1066-D1070 WeakPolarHBondContact O-CB 3.19Å; Q1066-D1070 PolarHBondContact O-N 3.45Å; Q1066-W1083 HydrophobicContact CB-CD2 4.01Å; Q1066-W1083 HydrophobicContact CB-CG 4.33Å; Q1066-W1083 HydrophobicContact CB-CZ2 4Å; Q1066-W1083 VanDerWaalsContact CD-NE1 3.31Å; Q1066-W1083 HydrophobicContact CG-CD2 4.08Å; Q1066-W1083 HydrophobicContact CG-CG 3.85Å
1067	V	92.8	Very high	92.2	Very high	88 Å²	88	47.1 Å²	47.1	53%	0.533	26%	0.257	S	S	.	.	H	α-helix	trans	-60.8	-35.4	179.1	-179.6	0	0	0	0	111.8	K1064 T1065 L1071	K1064-V1067 WeakPolarHBondContact O-CB 3.25Å; K1064-V1067 PolarHBondContact O-N 3.21Å; K1064-V1067 VanDerWaalsContact O-N 3.09Å; T1065-V1067 VanDerWaalsContact C-N 3.31Å; T1065-V1067 PolarHBondContact O-N 3.42Å; V1067-L1071 WeakPolarHBondContact O-CB 3.35Å; V1067-L1071 PolarHBondContact O-N 3.42Å; V1067-L1071 VanDerWaalsContact O-N 3.08Å
1068	V	92.9	Very high	92.4	Very high	7 Å²	7	47.2 Å²	47.2	4%	0.042	26%	0.257	C	S	.	.	H	α-helix	trans	-72.3	-41.6	177	-179	0	0	0	0	110.6	F1053 V1057 F1060 K1064 T1065 Q1066 L1071 M1072	F1053-V1068 HydrophobicContact CD1-CG1 3.84Å; V1057-V1068 HydrophobicContact CG2-CB 4.19Å; V1057-V1068 HydrophobicContact CG2-CG1 3.69Å; F1060-V1068 HydrophobicContact CD2-CG2 3.5Å; F1060-V1068 HydrophobicContact CE2-CG2 3.75Å; F1060-V1068 HydrophobicContact CG-CG2 4.26Å; K1064-V1068 PolarHBondContact O-N 3.02Å; T1065-V1068 WeakPolarHBondContact O-CB 3.2Å; T1065-V1068 PolarHBondContact O-N 2.92Å; Q1066-V1068 PolarHBondContact O-N 3.39Å; V1068-L1071 WeakPolarHBondContact O-CB 3.39Å; V1068-L1071 PolarHBondContact O-N 3.45Å; V1068-M1072 WeakPolarHBondContact O-CG 3.22Å; V1068-M1072 PolarHBondContact O-N 3.27Å
1069	V	93.5	Very high	92.7	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.006	24%	0.241	C	C	.	.	H	α-helix	trans	-62.2	-45.7	175.1	174.7	0	0	0	0	110.8	W529 T1065 Q1066 L1071 M1072 V1073 L1079 W1083	W529-V1069 HydrophobicContact CD2-CG2 4.27Å; W529-V1069 HydrophobicContact CH2-CG2 4.27Å; W529-V1069 HydrophobicContact CZ2-CG2 3.7Å; T1065-V1069 HydrophobicContact CG2-CG2 4.38Å; T1065-V1069 WeakPolarHBondContact O-CG2 3.31Å; T1065-V1069 PolarHBondContact O-N 3.26Å; Q1066-V1069 CarbonylContact O-C 3.6Å; Q1066-V1069 PolarHBondContact O-N 3.08Å; Q1066-V1069 VanDerWaalsContact O-N 3.11Å; V1069-L1071 VanDerWaalsContact C-N 3.25Å; V1069-L1071 PolarHBondContact O-N 3.35Å; V1069-M1072 WeakPolarHBondContact O-CA 3.49Å; V1069-M1072 WeakPolarHBondContact O-CB 3.33Å; V1069-M1072 PolarHBondContact O-N 3.27Å; V1069-V1073 WeakPolarHBondContact O-CG2 3.38Å; V1069-V1073 PolarHBondContact O-N 2.93Å; V1069-L1079 HydrophobicContact CG1-CD1 3.94Å; V1069-L1079 HydrophobicContact CG1-CD2 3.57Å; V1069-L1079 HydrophobicContact CG1-CG 4.44Å; V1069-W1083 HydrophobicContact CG1-CB 4.41Å; V1069-W1083 HydrophobicContact CG2-CE3 4.25Å
1070	D	94.9	Very high	92.9	Very high	76 Å²	76	43.4 Å²	43.4	41%	0.406	24%	0.239	S	C	.	.	H	α-helix	trans	-58.9	-39.1	175.2	-64.5	-18.9	0	0	0	111.3	Q1066 V1073 E1074	Q1066-D1070 WeakPolarHBondContact O-CB 3.19Å; Q1066-D1070 PolarHBondContact O-N 3.45Å; D1070-V1073 PolarHBondContact O-N 3.46Å; D1070-E1074 PolarHBondContact O-N 3.04Å
1071	L	94.6	Very high	93.2	Very high	34 Å²	34	43.2 Å²	43.2	18%	0.178	24%	0.238	C	C	.	.	H	α-helix	trans	-66.8	-37.6	175.1	-177	66.3	0	0	0	111.8	F371 F1053 V1067 V1068 V1069 V1073 E1074 K1075	F371-L1071 HydrophobicContact CZ-CD1 4.08Å; F371-L1071 HydrophobicContact CZ-CD2 4.02Å; F1053-L1071 HydrophobicContact CE1-CB 4.4Å; F1053-L1071 HydrophobicContact CE1-CD2 3.78Å; F1053-L1071 HydrophobicContact CE1-CG 3.95Å; F1053-L1071 HydrophobicContact CZ-CD2 4.23Å; F1053-L1071 HydrophobicContact CZ-CG 4.37Å; V1067-L1071 WeakPolarHBondContact O-CB 3.35Å; V1067-L1071 PolarHBondContact O-N 3.42Å; V1067-L1071 VanDerWaalsContact O-N 3.08Å; V1068-L1071 WeakPolarHBondContact O-CB 3.39Å; V1068-L1071 PolarHBondContact O-N 3.45Å; V1069-L1071 VanDerWaalsContact C-N 3.25Å; V1069-L1071 PolarHBondContact O-N 3.35Å; L1071-V1073 VanDerWaalsContact C-N 3.33Å; L1071-E1074 PolarHBondContact O-N 2.86Å; L1071-K1075 HydrophobicContact CD1-CG 4.45Å; L1071-K1075 WeakPolarHBondContact O-CG 3.23Å; L1071-K1075 PolarHBondContact O-N 3.49Å
1072	M	95.9	Very high	93.4	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-60.8	-44.7	173.6	-67.8	171.1	71.8	0	0	110.9	W529 K1050 F1053 V1068 V1069 K1075 G1076 L1077	W529-M1072 HydrophobicContact CH2-SD 4.29Å; K1050-M1072 HydrophobicContact CG-CE 4.16Å; F1053-M1072 HydrophobicContact CB-CE 4.11Å; F1053-M1072 HydrophobicContact CB-CG 3.95Å; F1053-M1072 HydrophobicContact CB-SD 3.8Å; F1053-M1072 HydrophobicContact CD1-CG 3.26Å; F1053-M1072 HydrophobicContact CD1-SD 4.09Å; F1053-M1072 HydrophobicContact CE1-CG 3.84Å; F1053-M1072 HydrophobicContact CG-CG 3.73Å; F1053-M1072 HydrophobicContact CG-SD 4.27Å; V1068-M1072 WeakPolarHBondContact O-CG 3.22Å; V1068-M1072 PolarHBondContact O-N 3.27Å; V1069-M1072 WeakPolarHBondContact O-CA 3.49Å; V1069-M1072 WeakPolarHBondContact O-CB 3.33Å; V1069-M1072 PolarHBondContact O-N 3.27Å; M1072-K1075 PolarHBondContact O-N 3.22Å; M1072-G1076 PolarHBondContact O-N 3.15Å; M1072-L1077 HydrophobicContact CB-CB 4.14Å; M1072-L1077 HydrophobicContact CB-CD1 4.31Å; M1072-L1077 HydrophobicContact CG-CD1 4.07Å; M1072-L1077 PolarHBondContact O-N 3.21Å
1073	V	95.2	Very high	93.6	Very high	89 Å²	89	41.6 Å²	41.6	54%	0.539	22%	0.221	S	C	.	.	H	α-helix	trans	-60.8	-47.8	175	176.1	0	0	0	0	110.7	V1069 D1070 L1071 K1075 G1076 L1079	V1069-V1073 WeakPolarHBondContact O-CG2 3.38Å; V1069-V1073 PolarHBondContact O-N 2.93Å; D1070-V1073 PolarHBondContact O-N 3.46Å; L1071-V1073 VanDerWaalsContact C-N 3.33Å; V1073-K1075 VanDerWaalsContact C-N 3.26Å; V1073-K1075 PolarHBondContact O-N 2.97Å; V1073-G1076 PolarHBondContact O-N 3.4Å; V1073-L1079 HydrophobicContact CG2-CD2 3.78Å
1074	E	95.7	Very high	93.8	Very high	116 Å²	116	38.6 Å²	38.6	54%	0.542	21%	0.207	S	C	.	.	H	α-helix	trans	-56.3	-40.6	177	-170.5	-157.6	126.9	0	0	111.9	D1070 L1071 G1076	D1070-E1074 PolarHBondContact O-N 3.04Å; L1071-E1074 PolarHBondContact O-N 2.86Å; E1074-G1076 VanDerWaalsContact C-N 3.31Å
1075	K	96.1	Very high	94	Very high	1 Å²	1	38.1 Å²	38.1	0%	0.004	21%	0.206	C	C	.	.	H	α-helix	trans	-79.2	-12.5	179	-61.5	-40.2	179.2	-165.4	0	113.4	F371 R372 F374 T375 V376 L1071 M1072 V1073 L1077	F371-K1075 VanDerWaalsContact O-CE 3.31Å; F371-K1075 WeakPolarHBondContact O-CE 3.28Å; F371-K1075 PolarHBondContact O-NZ 3.01Å; R372-K1075 PolarHBondContact O-NZ 3.14Å; F374-K1075 HydrophobicContact CD1-CD 4.28Å; F374-K1075 HydrophobicContact CE1-CB 4.43Å; F374-K1075 WeakPolarHBondContact O-CD 3.39Å; T375-K1075 CarbonylContact C-O 3.59Å; T375-K1075 WeakPolarHBondContact CA-O 3.4Å; V376-K1075 WeakPolarHBondContact CG2-O 3.44Å; V376-K1075 PolarHBondContact N-O 3.44Å; L1071-K1075 HydrophobicContact CD1-CG 4.45Å; L1071-K1075 WeakPolarHBondContact O-CG 3.23Å; L1071-K1075 PolarHBondContact O-N 3.49Å; M1072-K1075 PolarHBondContact O-N 3.22Å; V1073-K1075 VanDerWaalsContact C-N 3.26Å; V1073-K1075 PolarHBondContact O-N 2.97Å; K1075-L1077 HydrophobicContact CB-CG 4.25Å
1076	G	96.7	Very high	94	Very high	30 Å²	30	38.1 Å²	38.1	31%	0.309	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.4	26	-176.6	0	0	0	0	0	113.6	V376 H427 M1072 V1073 E1074	V376-G1076 WeakPolarHBondContact CB-O 3.14Å; V376-G1076 WeakPolarHBondContact CG2-O 3.41Å; H427-G1076 PolarHBondContact NE2-O 3.49Å; M1072-G1076 PolarHBondContact O-N 3.15Å; V1073-G1076 PolarHBondContact O-N 3.4Å; E1074-G1076 VanDerWaalsContact C-N 3.31Å
1077	L	97	Very high	94	Very high	7 Å²	7	37.2 Å²	37.2	4%	0.037	20%	0.203	C	C	.	.			trans	-72	146.7	170.8	-62.1	178	0	0	0	109.5	V376 W1048 F1053 M1072 K1075 L1079	V376-L1077 HydrophobicContact CG2-CD2 4.03Å; W1048-L1077 VanDerWaalsContact O-CD2 3.32Å; W1048-L1077 WeakPolarHBondContact O-CD2 3.27Å; F1053-L1077 HydrophobicContact CD1-CD1 4.33Å; F1053-L1077 HydrophobicContact CD2-CD1 3.37Å; F1053-L1077 HydrophobicContact CE1-CD1 4.33Å; F1053-L1077 HydrophobicContact CE2-CD1 3.39Å; F1053-L1077 HydrophobicContact CG-CD1 3.87Å; F1053-L1077 HydrophobicContact CZ-CD1 3.9Å; M1072-L1077 HydrophobicContact CB-CB 4.14Å; M1072-L1077 HydrophobicContact CB-CD1 4.31Å; M1072-L1077 HydrophobicContact CG-CD1 4.07Å; M1072-L1077 PolarHBondContact O-N 3.21Å; K1075-L1077 HydrophobicContact CB-CG 4.25Å; L1077-L1079 PolarHBondContact O-N 3.41Å; L1077-L1079 VanDerWaalsContact O-N 3.14Å
1078	R	95.9	Very high	93.8	Very high	3 Å²	3	38.6 Å²	38.6	1%	0.011	21%	0.207	C	C	.	.			trans	-71.4	110.2	-176	-175.9	58.3	172.5	110.4	13.4	111.3	S425 G426 E429 D554 E556 K1050	S425-R1078 PolarHBondContact O-N 2.96Å; G426-R1078 WeakPolarHBondContact O-CB 3.49Å; G426-R1078 VanDerWaalsContact O-CG 3.29Å; G426-R1078 WeakPolarHBondContact O-CG 3.31Å; E429-R1078 WeakPolarHBondContact OE1-CD 3.35Å; E429-R1078 IonicContact OE1-CZ 2.76Å; E429-R1078 IonicContact OE1-NE 3.77Å; E429-R1078 PolarHBondContact OE1-NE 3.28Å; E429-R1078 IonicContact OE1-NH2 3.33Å; D554-R1078 IonicContact OD1-CZ 3.42Å; D554-R1078 IonicContact OD1-NH1 2.69Å; D554-R1078 PolarHBondContact OD1-NH1 2.71Å; D554-R1078 IonicContact OD1-NH2 2.76Å; D554-R1078 PolarHBondContact OD1-NH2 3.4Å; D554-R1078 VanDerWaalsContact OD1-NH2 3.16Å; D554-R1078 IonicContact OD2-CZ 3.59Å; D554-R1078 IonicContact OD2-NH1 3.18Å; D554-R1078 IonicContact OD2-NH2 3.03Å; D554-R1078 PolarHBondContact OD2-NH2 3.3Å; E556-R1078 WeakPolarHBondContact OE2-CD 3.3Å; E556-R1078 IonicContact OE2-CZ 2.63Å; E556-R1078 IonicContact OE2-NE 2.66Å; E556-R1078 PolarHBondContact OE2-NE 3.35Å; E556-R1078 IonicContact OE2-NH1 2.91Å; E556-R1078 PolarHBondContact OE2-NH1 3.09Å; K1050-R1078 WeakPolarHBondContact CD-O 3.18Å; K1050-R1078 WeakPolarHBondContact CE-O 3.08Å; K1050-R1078 PolarHBondContact NZ-O 3.48Å
1079	L	94.4	Very high	93.6	Very high	19 Å²	19	40.3 Å²	40.3	10%	0.099	22%	0.215	C	C	.	.			trans	-105.6	120.2	176.1	-176.1	71.9	0	0	0	109.4	W529 V1069 V1073 L1077	W529-L1079 HydrophobicContact CZ2-CD1 3.56Å; V1069-L1079 HydrophobicContact CG1-CD1 3.94Å; V1069-L1079 HydrophobicContact CG1-CD2 3.57Å; V1069-L1079 HydrophobicContact CG1-CG 4.44Å; V1073-L1079 HydrophobicContact CG2-CD2 3.78Å; L1077-L1079 PolarHBondContact O-N 3.41Å; L1077-L1079 VanDerWaalsContact O-N 3.14Å
1080	R	94.2	Very high	93.3	Very high	3 Å²	3	41.5 Å²	41.5	1%	0.011	22%	0.224	C	C	.	.	S	Bend	trans	-93.2	-19.6	178.7	-67.9	171.9	169.2	66.4	4.4	112.9	G426 E429 E533 R536 E537 H540	G426-R1080 PolarHBondContact O-NH1 3.33Å; G426-R1080 VanDerWaalsContact O-NH1 3.16Å; G426-R1080 PolarHBondContact O-NH2 3.19Å; E429-R1080 IonicContact OE2-CZ 3.92Å; E429-R1080 IonicContact OE2-NH2 2.68Å; E429-R1080 PolarHBondContact OE2-NH2 2.79Å; E533-R1080 PolarHBondContact OE1-N 3.11Å; E533-R1080 WeakPolarHBondContact OE2-CA 3.49Å; E533-R1080 WeakPolarHBondContact OE2-CB 3.25Å; E533-R1080 PolarHBondContact OE2-N 2.99Å; R536-R1080 VanDerWaalsContact C-CD 3.43Å; R536-R1080 HydrophobicContact CB-CB 3.73Å; R536-R1080 HydrophobicContact CB-CG 4.31Å; R536-R1080 WeakPolarHBondContact CD-O 3.42Å; R536-R1080 PolarHBondContact NH1-O 2.8Å; E537-R1080 IonicContact OE1-NH1 2.78Å; H540-R1080 PolarHBondContact O-NE 2.95Å; H540-R1080 PolarHBondContact O-NH2 3.39Å
1081	V	93.4	Very high	92.8	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.231	C	C	.	.	S	Bend	trans	-123.9	91.8	176.3	-172.3	0	0	0	0	109.6	W529 L532 E533 L1086	W529-V1081 PolarHBondContact NE1-O 3.17Å; L532-V1081 HydrophobicContact CB-CG2 3.79Å; L532-V1081 HydrophobicContact CD1-CG1 4.46Å; E533-V1081 HydrophobicContact CB-CG2 4.38Å; E533-V1081 PolarHBondContact OE2-N 3.12Å; V1081-L1086 HydrophobicContact CG1-CB 4.23Å; V1081-L1086 HydrophobicContact CG1-CD1 4.37Å
1082	P	92.5	Very high	92.1	Very high	49 Å²	49	44.5 Å²	44.5	32%	0.318	24%	0.241	S	C	.	.			trans	-52.3	146.2	166.4	-26.3	35.9	0	0	0	112.1	E1084 E1085 L1086	P1082-E1084 VanDerWaalsContact C-N 3.27Å; P1082-E1084 PolarHBondContact O-N 3.48Å; P1082-E1085 HydrophobicContact CB-CB 4.37Å; P1082-E1085 WeakPolarHBondContact CD-OE2 3.28Å; P1082-E1085 WeakPolarHBondContact O-CB 3.32Å; P1082-E1085 PolarHBondContact O-N 3.32Å; P1082-L1086 PolarHBondContact O-N 3.22Å
1083	W	91.6	Very high	91.1	Very high	18 Å²	18	44.9 Å²	44.9	7%	0.068	24%	0.243	C	C	.	.	H	α-helix	trans	-65.4	-34.2	-176.2	-168.5	-104.1	0	0	0	112.2	L525 W529 T1065 Q1066 V1069 E1085 L1086 L1087	L525-W1083 HydrophobicContact CB-CH2 4.34Å; W529-W1083 HydrophobicContact CB-CZ3 4.24Å; W529-W1083 HydrophobicContact CG-CE3 4.48Å; W529-W1083 HydrophobicContact CG-CZ3 4.2Å; T1065-W1083 HydrophobicContact CG2-CH2 3.9Å; T1065-W1083 HydrophobicContact CG2-CZ3 3.56Å; Q1066-W1083 HydrophobicContact CB-CD2 4.01Å; Q1066-W1083 HydrophobicContact CB-CG 4.33Å; Q1066-W1083 HydrophobicContact CB-CZ2 4Å; Q1066-W1083 VanDerWaalsContact CD-NE1 3.31Å; Q1066-W1083 HydrophobicContact CG-CD2 4.08Å; Q1066-W1083 HydrophobicContact CG-CG 3.85Å; V1069-W1083 HydrophobicContact CG1-CB 4.41Å; V1069-W1083 HydrophobicContact CG2-CE3 4.25Å; W1083-E1085 VanDerWaalsContact C-N 3.33Å; W1083-E1085 PolarHBondContact O-N 2.55Å; W1083-L1086 HydrophobicContact CD2-CD2 4.21Å; W1083-L1086 HydrophobicContact CE3-CD2 3.68Å; W1083-L1086 HydrophobicContact CH2-CD2 3.89Å; W1083-L1086 HydrophobicContact CZ2-CD2 4.4Å; W1083-L1086 HydrophobicContact CZ3-CD2 3.5Å; W1083-L1086 VanDerWaalsContact CZ3-CD2 3.5Å; W1083-L1086 WeakPolarHBondContact O-CB 3.48Å; W1083-L1086 PolarHBondContact O-N 3.23Å; W1083-L1087 WeakPolarHBondContact O-CG 3.38Å; W1083-L1087 PolarHBondContact O-N 3.12Å
1084	E	91.4	Very high	90	Very high	123 Å²	123	43.1 Å²	43.1	58%	0.575	24%	0.238	S	C	*	.	H	α-helix	trans	-62.9	-40.9	176.5	-63.7	72.6	-158.8	0	0	111.7	P1082 L1087 L1088	P1082-E1084 VanDerWaalsContact C-N 3.27Å; P1082-E1084 PolarHBondContact O-N 3.48Å; E1084-L1087 PolarHBondContact O-N 2.94Å; E1084-L1088 WeakPolarHBondContact O-CG 3.48Å; E1084-L1088 PolarHBondContact O-N 3.3Å
1085	E	91.8	Very high	88.7	Confident	56 Å²	56	43.6 Å²	43.6	26%	0.262	24%	0.24	S	C	.	.	H	α-helix	trans	-65.3	-45	178.1	-170.1	-169	164	0	0	111	R536 P1082 W1083 L1087 L1088 L1089	R536-E1085 IonicContact CZ-OE1 3.76Å; R536-E1085 VanDerWaalsContact CZ-OE1 3.23Å; R536-E1085 IonicContact CZ-OE2 2.85Å; R536-E1085 IonicContact NH1-OE1 2.9Å; R536-E1085 PolarHBondContact NH1-OE1 2.93Å; R536-E1085 IonicContact NH1-OE2 3.78Å; R536-E1085 PolarHBondContact NH1-OE2 3.32Å; R536-E1085 IonicContact NH2-OE1 2.65Å; R536-E1085 PolarHBondContact NH2-OE1 3.16Å; P1082-E1085 HydrophobicContact CB-CB 4.37Å; P1082-E1085 WeakPolarHBondContact CD-OE2 3.28Å; P1082-E1085 WeakPolarHBondContact O-CB 3.32Å; P1082-E1085 PolarHBondContact O-N 3.32Å; W1083-E1085 VanDerWaalsContact C-N 3.33Å; W1083-E1085 PolarHBondContact O-N 2.55Å; E1085-L1087 VanDerWaalsContact C-N 3.25Å; E1085-L1087 PolarHBondContact O-N 2.99Å; E1085-L1088 WeakPolarHBondContact O-CA 3.42Å; E1085-L1088 WeakPolarHBondContact O-CB 3.38Å; E1085-L1088 PolarHBondContact O-N 3.28Å; E1085-L1089 HydrophobicContact CG-CD1 4.22Å; E1085-L1089 HydrophobicContact CG-CG 4.45Å; E1085-L1089 PolarHBondContact O-N 3.15Å
1086	L	91.8	Very high	87.2	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-54.3	-42.9	175.5	-177	78.4	0	0	0	112.2	L525 F528 W529 L532 V1081 P1082 W1083 L1088 L1089 S1090	L525-L1086 HydrophobicContact CB-CD2 4.47Å; L525-L1086 HydrophobicContact CD2-CD2 4.43Å; F528-L1086 HydrophobicContact CD1-CD1 3.44Å; F528-L1086 VanDerWaalsContact CD1-CD1 3.44Å; F528-L1086 HydrophobicContact CD1-CG 4.28Å; F528-L1086 HydrophobicContact CE1-CD1 3.83Å; F528-L1086 HydrophobicContact CG-CD1 4.09Å; W529-L1086 HydrophobicContact CB-CD1 3.89Å; W529-L1086 HydrophobicContact CB-CD2 3.68Å; W529-L1086 HydrophobicContact CB-CG 4.4Å; W529-L1086 HydrophobicContact CG-CD2 4.24Å; L532-L1086 HydrophobicContact CD1-CD1 3.93Å; V1081-L1086 HydrophobicContact CG1-CB 4.23Å; V1081-L1086 HydrophobicContact CG1-CD1 4.37Å; P1082-L1086 PolarHBondContact O-N 3.22Å; W1083-L1086 HydrophobicContact CD2-CD2 4.21Å; W1083-L1086 HydrophobicContact CE3-CD2 3.68Å; W1083-L1086 HydrophobicContact CH2-CD2 3.89Å; W1083-L1086 HydrophobicContact CZ2-CD2 4.4Å; W1083-L1086 HydrophobicContact CZ3-CD2 3.5Å; W1083-L1086 VanDerWaalsContact CZ3-CD2 3.5Å; W1083-L1086 WeakPolarHBondContact O-CB 3.48Å; W1083-L1086 PolarHBondContact O-N 3.23Å; L1086-L1088 VanDerWaalsContact C-N 3.25Å; L1086-L1088 PolarHBondContact O-N 3.43Å; L1086-L1089 PolarHBondContact O-N 3.05Å; L1086-S1090 WeakPolarHBondContact O-CB 3.38Å; L1086-S1090 PolarHBondContact O-N 3.37Å; L1086-S1090 PolarHBondContact O-OG 3.36Å; L1086-S1090 VanDerWaalsContact O-OG 3.1Å
1087	L	90.9	Very high	85.4	Confident	61 Å²	61	55.3 Å²	55.3	32%	0.319	29%	0.287	S	S	.	.	H	α-helix	trans	-66.5	-27.8	178.4	-67.8	176.3	0	0	0	112.5	L525 W1083 E1084 E1085 S1090 K1091	L525-L1087 HydrophobicContact CD1-CD2 4.07Å; W1083-L1087 WeakPolarHBondContact O-CG 3.38Å; W1083-L1087 PolarHBondContact O-N 3.12Å; E1084-L1087 PolarHBondContact O-N 2.94Å; E1085-L1087 VanDerWaalsContact C-N 3.25Å; E1085-L1087 PolarHBondContact O-N 2.99Å; L1087-S1090 WeakPolarHBondContact CA-OG 3.13Å; L1087-S1090 PolarHBondContact O-OG 2.99Å; L1087-S1090 VanDerWaalsContact O-OG 3.12Å; L1087-K1091 WeakPolarHBondContact O-CD 3.23Å; L1087-K1091 VanDerWaalsContact O-CG 3.26Å; L1087-K1091 WeakPolarHBondContact O-CG 3.45Å
1088	L	90.3	Very high	83.5	Confident	118 Å²	118	59.2 Å²	59.2	62%	0.618	32%	0.315	S	S	*	.	H	α-helix	trans	-75.4	-48.7	173.7	-66.8	174.9	0	0	0	111	E1084 E1085 L1086 S1090 K1091 A1092	E1084-L1088 WeakPolarHBondContact O-CG 3.48Å; E1084-L1088 PolarHBondContact O-N 3.3Å; E1085-L1088 WeakPolarHBondContact O-CA 3.42Å; E1085-L1088 WeakPolarHBondContact O-CB 3.38Å; E1085-L1088 PolarHBondContact O-N 3.28Å; L1086-L1088 VanDerWaalsContact C-N 3.25Å; L1086-L1088 PolarHBondContact O-N 3.43Å; L1088-S1090 VanDerWaalsContact C-N 3.31Å; L1088-S1090 PolarHBondContact O-N 3.32Å; L1088-K1091 PolarHBondContact O-N 3.42Å; L1088-K1091 VanDerWaalsContact O-N 3.09Å; L1088-A1092 PolarHBondContact O-N 3.18Å
1089	L	88.3	Confident	81.4	Confident	42 Å²	42	68.1 Å²	68.1	22%	0.22	36%	0.363	C	S	.	.	H	α-helix	trans	-59.9	-40.5	179.3	-67.3	174	0	0	0	112.2	F528 L532 E1085 L1086 K1091 A1092 S1093	F528-L1089 HydrophobicContact CE1-CB 4.15Å; F528-L1089 HydrophobicContact CZ-CB 4.21Å; L532-L1089 HydrophobicContact CD1-CD1 3.94Å; E1085-L1089 HydrophobicContact CG-CD1 4.22Å; E1085-L1089 HydrophobicContact CG-CG 4.45Å; E1085-L1089 PolarHBondContact O-N 3.15Å; L1086-L1089 PolarHBondContact O-N 3.05Å; L1089-K1091 VanDerWaalsContact C-N 3.31Å; L1089-K1091 PolarHBondContact O-N 2.9Å; L1089-A1092 PolarHBondContact O-N 3.23Å; L1089-S1093 PolarHBondContact O-N 3.02Å; L1089-S1093 PolarHBondContact O-OG 3.34Å
1090	S	85.9	Confident	80.8	Confident	26 Å²	26	70.6 Å²	70.6	18%	0.182	38%	0.376	C	S	.	.	H	α-helix	trans	-67.3	-27.3	176.4	64.1	0	0	0	0	114	L1086 L1087 L1088 S1093 A1094	L1086-S1090 WeakPolarHBondContact O-CB 3.38Å; L1086-S1090 PolarHBondContact O-N 3.37Å; L1086-S1090 PolarHBondContact O-OG 3.36Å; L1086-S1090 VanDerWaalsContact O-OG 3.1Å; L1087-S1090 WeakPolarHBondContact CA-OG 3.13Å; L1087-S1090 PolarHBondContact O-OG 2.99Å; L1087-S1090 VanDerWaalsContact O-OG 3.12Å; L1088-S1090 VanDerWaalsContact C-N 3.31Å; L1088-S1090 PolarHBondContact O-N 3.32Å; S1090-S1093 VanDerWaalsContact C-OG 3.31Å; S1090-S1093 WeakPolarHBondContact CA-OG 3.13Å; S1090-S1093 PolarHBondContact O-OG 2.92Å; S1090-A1094 PolarHBondContact O-N 3.41Å
1091	K	85.2	Confident	80.1	Confident	128 Å²	128	74.2 Å²	74.2	56%	0.557	40%	0.395	S	S	*	.	H	α-helix	trans	-82.4	-39.6	176.4	-73.2	173.1	-172.3	173.9	0	111.9	L1087 L1088 L1089 S1093 A1094 Q1095	L1087-K1091 WeakPolarHBondContact O-CD 3.23Å; L1087-K1091 VanDerWaalsContact O-CG 3.26Å; L1087-K1091 WeakPolarHBondContact O-CG 3.45Å; L1088-K1091 PolarHBondContact O-N 3.42Å; L1088-K1091 VanDerWaalsContact O-N 3.09Å; L1089-K1091 VanDerWaalsContact C-N 3.31Å; L1089-K1091 PolarHBondContact O-N 2.9Å; K1091-S1093 VanDerWaalsContact C-N 3.34Å; K1091-A1094 PolarHBondContact O-N 2.99Å; K1091-Q1095 WeakPolarHBondContact O-CG 3.39Å; K1091-Q1095 PolarHBondContact O-N 2.86Å
1092	A	80.9	Confident	79.3	Confident	46 Å²	46	78.3 Å²	78.3	38%	0.38	42%	0.417	S	S	.	.	H	α-helix	trans	-61.2	-44.1	178.7	0	0	0	0	0	111.3	L1088 L1089 Q1095 Q1096	L1088-A1092 PolarHBondContact O-N 3.18Å; L1089-A1092 PolarHBondContact O-N 3.23Å; A1092-Q1095 PolarHBondContact O-N 3.37Å; A1092-Q1096 WeakPolarHBondContact O-CG 3.36Å; A1092-Q1096 PolarHBondContact O-N 3.41Å
1093	S	74.1	Confident	78.6	Confident	8 Å²	8	80 Å²	80	6%	0.056	42%	0.423	C	S	.	.	H	α-helix	trans	-62	-43.7	174.2	45.1	0	0	0	0	112.8	C517 S520 L1089 S1090 K1091 Q1095 Q1096 E1097	C517-S1093 WeakPolarHBondContact O-CB 3.36Å; S520-S1093 WeakPolarHBondContact OG-CB 3.48Å; S520-S1093 PolarHBondContact OG-OG 2.91Å; L1089-S1093 PolarHBondContact O-N 3.02Å; L1089-S1093 PolarHBondContact O-OG 3.34Å; S1090-S1093 VanDerWaalsContact C-OG 3.31Å; S1090-S1093 WeakPolarHBondContact CA-OG 3.13Å; S1090-S1093 PolarHBondContact O-OG 2.92Å; K1091-S1093 VanDerWaalsContact C-N 3.34Å; S1093-Q1095 VanDerWaalsContact C-N 3.27Å; S1093-Q1095 PolarHBondContact O-N 3.12Å; S1093-Q1096 PolarHBondContact O-N 3.11Å; S1093-E1097 PolarHBondContact O-N 3.32Å
1094	A	72.2	Confident	77.8	Confident	52 Å²	52	83.9 Å²	83.9	43%	0.43	45%	0.445	S	S	.	.	H	α-helix	trans	-64.4	-30.5	176.4	0	0	0	0	0	113.4	S1090 K1091 S1098	S1090-A1094 PolarHBondContact O-N 3.41Å; K1091-A1094 PolarHBondContact O-N 2.99Å; A1094-S1098 PolarHBondContact O-N 2.98Å
1095	Q	67.9	Low	76.8	Confident	125 Å²	125	81.3 Å²	81.3	58%	0.584	44%	0.436	S	S	*	.	H	α-helix	trans	-73.2	-41.5	174.7	-75.1	176.2	-16.9	0	0	111.8	K1091 A1092 S1093 E1097 S1098 D1099	K1091-Q1095 WeakPolarHBondContact O-CG 3.39Å; K1091-Q1095 PolarHBondContact O-N 2.86Å; A1092-Q1095 PolarHBondContact O-N 3.37Å; S1093-Q1095 VanDerWaalsContact C-N 3.27Å; S1093-Q1095 PolarHBondContact O-N 3.12Å; Q1095-E1097 VanDerWaalsContact C-N 3.27Å; Q1095-E1097 PolarHBondContact O-N 2.84Å; Q1095-S1098 WeakPolarHBondContact CA-OG 3.09Å; Q1095-S1098 PolarHBondContact O-N 3.42Å; Q1095-S1098 PolarHBondContact O-OG 3.25Å; Q1095-D1099 PolarHBondContact O-N 2.98Å
1096	Q	64.7	Low	75.8	Confident	149 Å²	149	83.1 Å²	83.1	70%	0.696	45%	0.449	S	S	*	.	H	α-helix	trans	-63.3	-27.1	177.5	-75.8	178.5	-15.2	0	0	114.1	A1092 S1093	A1092-Q1096 WeakPolarHBondContact O-CG 3.36Å; A1092-Q1096 PolarHBondContact O-N 3.41Å; S1093-Q1096 PolarHBondContact O-N 3.11Å
1097	E	59.5	Low	74.5	Confident	128 Å²	128	89.5 Å²	89.5	60%	0.598	48%	0.483	S	S	*	.	H	α-helix	trans	-79.9	-23.2	170.5	-88.8	-167.2	170.7	0	0	113.4	V521 S1093 Q1095	V521-E1097 WeakPolarHBondContact CG1-OE2 3.34Å; S1093-E1097 PolarHBondContact O-N 3.32Å; Q1095-E1097 VanDerWaalsContact C-N 3.27Å; Q1095-E1097 PolarHBondContact O-N 2.84Å
1098	S	55.9	Low	73.2	Confident	90 Å²	90	91.8 Å²	91.8	63%	0.629	50%	0.497	S	S	*	.	H	α-helix	trans	-82.4	-28.2	179.5	73.8	0	0	0	0	113.3	A1094 Q1095	A1094-S1098 PolarHBondContact O-N 2.98Å; Q1095-S1098 WeakPolarHBondContact CA-OG 3.09Å; Q1095-S1098 PolarHBondContact O-N 3.42Å; Q1095-S1098 PolarHBondContact O-OG 3.25Å
1099	D	53.5	Low	71.6	Confident	190 Å²	190	89.5 Å²	89.5	100%	1.016	49%	0.486	S	S	*	.			trans	-82.3	0	172.6	-70.3	-20.3	0	0	0	110.9	Q1095	Q1095-D1099 PolarHBondContact O-N 2.98Å

Retrieved 1,099 of 1,099 residues in 1140.5 ms (Link to these results)

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