A0A087YIM4_POEFO Loading...

Erythroid differentiation regulatory factor 1

AlphaFold DB , UniProt , Accession A0A087YIM4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,260 aa.

						>A0A087YIM4_POEFO|A0A087YIM4
MSLPPEDREPGVPMDNSKEDVGGPSCTGDYSKHDMTVCLGNGEVKSCAVVKYSAAPPPTTYALLQEKTDLKLPPANWLRENPQLGSAGTTVLGSSSKSKPFSSFGMAYDFIDCIGDDVDVVSDSENIKKLLKIPYSKSHVSMAVHRVGRTLLLDELDTQELLRRSSQTGDWTWLKEIYQRLIDQKWQRKKKSKEHWYQKAILSKFLYYSINGDGAAEPVTEDMIEEDEENGAEEYSSSWPATFTSAMSEAEEAHTPKQESVPVDRNFALGQVTSVPKEQNLPTLFNEGENSQGLRNDFVRNIMWTFEDIHMLVGSNMPIFGGGRYPAVSLRLRDSNKPINILTGIDYWLDNLMCNVPELVMCFHVNGIVQKYEMIKTEEIPHLENSTFSTRVVKDIAQNILSFLKSNCTKEGHTYWLFKASGSDIVKLYDLTTLCEEAEEEKCQNPFTLPVAVLLYRVASNLMLKASQNRKHYGKIRTLLLNCVKLLDPEKHPQIIASAYYMLSELFQLDELPDEDGGESLRAGGSEDSYSDEDREEEEGDDDDLTEDGEDMGSYGNRSRPQDDSKAVAVIRSVGELSVPEKYKSTHQIRPSCAFPVSQDKEERCRHVLSYVLKASSCIMSGHSLTVQKSQIRDINMAVINPQGLKAVDGSIKKESDLPAADPNTPIPLKYEDGGSNGASEKGISLLLERGQADQKHPTRSGMIPGSWQHRMKLQLFLKASKAYYVLSDAATNLLKYGRALRYIKLSLQCYDAYCSVSETLHPHLLQFHSQCLSLCGDIQLMLAQNASNRAAYLEEYSYQTKEDQEILHSMHRESSCQDFSMATDLAMDPEYQLFVSCRCYEAAHEMLTSEVLKDQSSDQLSQVLKRLGNIRNEMGVYYMNQAAAMQTEKQVKKSVSAAEQDLWKKSFSFFEKGMKDFEAIRDSTNTALLLCNTGRLMRICAQAHCPASADGSRGEFSPDEALYYNKAVDYYLQALRALGSRKSHPAVWDSVNWELSTTYFTLATLLQDYAPLSRKAQEQIEREVTDAMMKSLKYCDLQTESARQPLYQYRAATIHHRLASMYHSCFRNQVGDEHLRKQHRNLAELHYSKAVSLFLSLKDAPCELLRTLLERVAFTEFTMTGQSSSVAKLKSLIGAIEIMSETRHAFQLIQKELLEEQEEQTEPSAAESADSPDRVGVSTSGLDLQEVLKLIGVFEPSFSFLLLQVIKLMTTTKRKPSNKDEDMLKNYKAVYSKLLRSEKDAPLLSRVELYIELLQQLTP
					

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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	32.1	Very low	38.1	Very low	242 Å²	242	148.7 Å²	148.7	100%	1.192	82%	0.815	S	S	*	*				0	137.3	0	-64.2	170.1	172.2	0	0	107.7
2	S	31.2	Very low	37.3	Very low	117 Å²	117	147.6 Å²	147.6	82%	0.818	82%	0.815	S	S	*	*			cis	-161.7	145.4	-27.9	-74.1	0	0	0	0	107
3	L	28	Very low	37.4	Very low	169 Å²	169	146.2 Å²	146.2	89%	0.885	82%	0.817	S	S	*	*			trans	-80.9	-177	175.2	-71.8	158.5	0	0	0	112
4	P	62.4	Low	36.8	Very low	114 Å²	114	148.4 Å²	148.4	74%	0.74	82%	0.821	S	S	*	*			cis	-122.7	-133	-37.2	34.4	-12.2	0	0	0	108.9
5	P	59.9	Low	36.2	Very low	95 Å²	95	147.1 Å²	147.1	62%	0.617	81%	0.812	S	S	*	*			cis	-133	-179.5	-29.2	41.3	-23.4	0	0	0	116.3
6	E	34.9	Very low	35.8	Very low	178 Å²	178	146.1 Å²	146.1	83%	0.832	81%	0.805	S	S	*	*			trans	51.6	147.6	140.1	-73	161	-174.3	0	0	123.1
7	D	34.3	Very low	35.4	Very low	141 Å²	141	142.5 Å²	142.5	75%	0.754	79%	0.793	S	S	*	*			cis	-153.4	-171.8	6.1	-146.2	-21.3	0	0	0	113.8
8	R	32.7	Very low	35.1	Very low	219 Å²	219	143.9 Å²	143.9	83%	0.826	79%	0.789	S	S	*	*			trans	-71.3	164.8	-160.5	-74	170.9	170.6	179.7	-1.3	123.8
9	E	28.9	Very low	34.7	Very low	174 Å²	174	144.3 Å²	144.3	81%	0.813	79%	0.785	S	S	*	*			trans	105.8	163.2	140.3	-108.6	-165.6	-134.4	0	0	121
10	P	49.5	Very low	34.4	Very low	116 Å²	116	144.5 Å²	144.5	75%	0.753	79%	0.785	S	S	*	*				-131.7	174.8	-108.8	44.6	-28.3	0	0	0	118.5
11	G	25.6	Very low	34.2	Very low	71 Å²	71	144.4 Å²	144.4	73%	0.732	79%	0.789	S	S	*	*			trans	151.5	127.1	152.9	0	0	0	0	0	120.6
12	V	27.7	Very low	33.9	Very low	135 Å²	135	136.7 Å²	136.7	82%	0.818	77%	0.772	S	S	*	*			trans	41.2	143.2	140.1	-167	0	0	0	0	122.5
13	P	38.8	Very low	33.7	Very low	130 Å²	130	134.7 Å²	134.7	84%	0.844	77%	0.77	S	S	*	*			trans	-128.3	161.4	139.8	37.5	-27	0	0	0	115.3
14	M	29.5	Very low	34.2	Very low	177 Å²	177	133.1 Å²	133.1	87%	0.872	77%	0.769	S	S	*	*			trans	-110.5	133.5	-174.4	-96	-171.2	170.1	0	0	114.4
15	D	27.9	Very low	32.5	Very low	128 Å²	128	132.6 Å²	132.6	68%	0.684	77%	0.769	S	S	*	*				58.5	152.8	114.2	-152.1	23	0	0	0	124.9
16	N	29.8	Very low	30.9	Very low	131 Å²	131	134.8 Å²	134.8	70%	0.701	79%	0.785	S	S	*	*			trans	81.2	140.8	166.9	-65.6	-68.7	0	0	0	120.1
17	S	29	Very low	30.5	Very low	86 Å²	86	131.6 Å²	131.6	60%	0.601	78%	0.778	S	S	*	*			cis	-175.6	159.7	-8.9	55.8	0	0	0	0	113.5
18	K	29.1	Very low	30.2	Very low	167 Å²	167	128.7 Å²	128.7	73%	0.726	78%	0.781	S	S	*	*			trans	71.4	153	157.6	-70.5	167.9	168	-94.3	0	118.6
19	E	28.9	Very low	29.8	Very low	151 Å²	151	125.3 Å²	125.3	71%	0.706	78%	0.779	S	S	*	*			cis	-157.7	173.2	-3.8	-122.8	156.4	-167.7	0	0	112.7
20	D	27.9	Very low	29.5	Very low	148 Å²	148	127.8 Å²	127.8	79%	0.791	78%	0.783	S	S	*	*			trans	-44.1	155.3	-168.9	-67.2	-52.4	0	0	0	122.9
21	V	29.2	Very low	28.4	Very low	144 Å²	144	126.4 Å²	126.4	87%	0.873	78%	0.776	S	S	*	*				169.2	125.7	105.7	160.7	0	0	0	0	113.5
22	G	26.4	Very low	28.5	Very low	79 Å²	79	133.1 Å²	133.1	81%	0.814	79%	0.785	S	S	*	*			trans	103.6	125.4	135	0	0	0	0	0	122.5
23	G	26.3	Very low	28.4	Very low	76 Å²	76	134.4 Å²	134.4	78%	0.784	78%	0.781	S	S	*	*			trans	98.6	137.6	145.1	0	0	0	0	0	118.2
24	P	38.9	Very low	27.7	Very low	135 Å²	135	135.7 Å²	135.7	88%	0.877	78%	0.782	S	S	*	*			trans	-101.4	143.3	-167.8	37.5	-33.7	0	0	0	115.7
25	S	27.3	Very low	27.5	Very low	104 Å²	104	135.3 Å²	135.3	73%	0.727	78%	0.779	S	S	*	*			trans	-141.8	124.7	161.1	58.4	0	0	0	0	110.6	T27	S25-T27 PolarHBondContact O-N 3.02Å
26	C	27.3	Very low	27.5	Very low	141 Å²	141	135 Å²	135	95%	0.953	78%	0.783	S	S	*	*			trans	-76.2	103.4	-179.6	-69.3	0	0	0	0	112
27	T	26.5	Very low	27.4	Very low	111 Å²	111	134.1 Å²	134.1	68%	0.681	78%	0.781	S	S	*	*			trans	-112	116.7	159.2	46.7	0	0	0	0	108.8	S25 D29	S25-T27 PolarHBondContact O-N 3.02Å; T27-D29 VanDerWaalsContact C-N 3.35Å; T27-D29 PolarHBondContact O-N 2.62Å
28	G	26	Very low	27.3	Very low	80 Å²	80	134.9 Å²	134.9	83%	0.825	79%	0.786	S	S	*	*			trans	-77.1	82.3	178.6	0	0	0	0	0	111.3
29	D	24.4	Very low	27.5	Very low	147 Å²	147	135 Å²	135	79%	0.786	79%	0.793	S	S	*	*			trans	-69.7	134.3	175.2	-101.5	-37.1	0	0	0	111.7	T27 S31	T27-D29 VanDerWaalsContact C-N 3.35Å; T27-D29 PolarHBondContact O-N 2.62Å; D29-S31 PolarHBondContact O-N 3.34Å; D29-S31 VanDerWaalsContact O-N 3.12Å
30	Y	24.5	Very low	27.4	Very low	226 Å²	226	129.9 Å²	129.9	89%	0.886	78%	0.781	S	S	*	*			trans	-68.5	106.9	172.6	-81.7	-95.8	0	0	0	109.8	K32	Y30-K32 PolarHBondContact O-N 2.75Å
31	S	25.5	Very low	28	Very low	87 Å²	87	131.3 Å²	131.3	61%	0.608	79%	0.789	S	S	*	*			trans	-61.2	111.3	171.5	53.8	0	0	0	0	110.5	D29 H33	D29-S31 PolarHBondContact O-N 3.34Å; D29-S31 VanDerWaalsContact O-N 3.12Å; S31-H33 PolarHBondContact O-N 3.21Å
32	K	26.8	Very low	28.9	Very low	212 Å²	212	126.1 Å²	126.1	92%	0.922	77%	0.765	S	S	*	*			trans	-56.9	101.4	160.7	-86.9	179.7	173.1	174	0	108.4	Y30	Y30-K32 PolarHBondContact O-N 2.75Å
33	H	26.2	Very low	30.6	Very low	162 Å²	162	128.6 Å²	128.6	75%	0.75	76%	0.755	S	S	*	*			trans	-75.4	145.8	161.1	-79.6	-72.4	0	0	0	109.6	S31 M35	S31-H33 PolarHBondContact O-N 3.21Å; H33-M35 PolarHBondContact O-N 2.83Å
34	D	24.5	Very low	32.8	Very low	158 Å²	158	126 Å²	126	85%	0.845	72%	0.724	S	S	*	*			trans	-52	121.4	-174.2	-81.2	-54.4	0	0	0	113.1	T36	D34-T36 PolarHBondContact O-N 3.07Å
35	M	25.2	Very low	34.7	Very low	168 Å²	168	127.2 Å²	127.2	83%	0.828	72%	0.715	S	S	*	*			trans	-84.9	94	161	-77.2	-166.3	-69	0	0	108.8	H33 V37	H33-M35 PolarHBondContact O-N 2.83Å; M35-V37 VanDerWaalsContact C-N 3.32Å; M35-V37 HydrophobicContact CB-CG2 4.29Å; M35-V37 PolarHBondContact O-N 3.03Å
36	T	28.5	Very low	37.3	Very low	123 Å²	123	124.1 Å²	124.1	76%	0.755	69%	0.694	S	S	*	*			trans	-69	89.5	168.3	-50.7	0	0	0	0	109.5	D34 C38	D34-T36 PolarHBondContact O-N 3.07Å; T36-C38 PolarHBondContact O-N 2.67Å
37	V	28.2	Very low	39.9	Very low	111 Å²	111	120.8 Å²	120.8	67%	0.673	67%	0.671	S	S	*	*			trans	-82.4	94.8	176.7	-178.2	0	0	0	0	109.8	M35 L39	M35-V37 VanDerWaalsContact C-N 3.32Å; M35-V37 HydrophobicContact CB-CG2 4.29Å; M35-V37 PolarHBondContact O-N 3.03Å; V37-L39 PolarHBondContact O-N 3.35Å
38	C	26.7	Very low	42.5	Very low	102 Å²	102	116 Å²	116	69%	0.689	64%	0.643	S	S	*	*			trans	-77	114	167.2	-69.6	0	0	0	0	110.2	T36 G40	T36-C38 PolarHBondContact O-N 2.67Å; C38-G40 PolarHBondContact O-N 3.17Å
39	L	31.9	Very low	45	Very low	169 Å²	169	116 Å²	116	89%	0.885	63%	0.627	S	S	*	*			trans	-83.4	86.3	174.1	-86	159.8	0	0	0	110.7	V37	V37-L39 PolarHBondContact O-N 3.35Å
40	G	28.2	Very low	47.5	Very low	44 Å²	44	112.7 Å²	112.7	45%	0.454	61%	0.611	S	S	.	*			trans	-114.8	119.7	171.7	0	0	0	0	0	112.2	C38 G42	C38-G40 PolarHBondContact O-N 3.17Å; G40-G42 VanDerWaalsContact C-N 3.26Å; G40-G42 PolarHBondContact O-N 3.08Å
41	N	39.9	Very low	49.7	Very low	179 Å²	179	107.2 Å²	107.2	96%	0.957	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	70.4	179.5	-88	-13.3	0	0	0	112.3
42	G	47.1	Very low	51.6	Low	35 Å²	35	108.8 Å²	108.8	36%	0.361	59%	0.586	S	S	.	*	T	Hydrogen-bonded Turn	trans	-166.9	-47.7	-177.7	0	0	0	0	0	114.2	G40 R391	G40-G42 VanDerWaalsContact C-N 3.26Å; G40-G42 PolarHBondContact O-N 3.08Å; G42-R391 PolarHBondContact O-NE 2.86Å; G42-R391 PolarHBondContact O-NH2 3.03Å
43	E	62.8	Low	53.4	Low	131 Å²	131	101.1 Å²	101.1	61%	0.612	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-83.7	153.5	-159.8	-66.7	169.5	167.6	0	0	114.5
44	V	72	Confident	54.7	Low	20 Å²	20	94.7 Å²	94.7	12%	0.121	53%	0.534	C	S	.	.	P	Polyproline II helix	trans	-85.7	126.3	177.7	174.4	0	0	0	0	109.3	S46 F306 E307	V44-S46 PolarHBondContact O-N 2.81Å; V44-F306 HydrophobicContact CG1-CD2 4.11Å; V44-F306 HydrophobicContact CG1-CE2 3.43Å; V44-F306 VanDerWaalsContact CG1-CE2 3.43Å; V44-F306 HydrophobicContact CG1-CZ 3.82Å; V44-E307 VanDerWaalsContact CA-OE1 3.32Å; V44-E307 WeakPolarHBondContact CA-OE1 3.47Å; V44-E307 HydrophobicContact CG1-CG 3.69Å
45	K	78.8	Confident	56.2	Low	162 Å²	162	88 Å²	88	70%	0.704	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-71.6	118.6	179.6	-65.2	-177.1	-179.5	-179	0	110.6	E307	K45-E307 HydrophobicContact CB-CG 4.48Å; K45-E307 PolarHBondContact N-OE1 2.9Å; K45-E307 WeakPolarHBondContact O-CA 3.36Å; K45-E307 PolarHBondContact O-N 3.21Å
46	S	82.2	Confident	57.6	Low	39 Å²	39	82.8 Å²	82.8	27%	0.273	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	137.1	173.6	-174.4	0	0	0	0	110.1	V44 W304 L352	V44-S46 PolarHBondContact O-N 2.81Å; S46-W304 PolarHBondContact OG-NE1 3.21Å; S46-L352 WeakPolarHBondContact OG-CD2 3.31Å; S46-L352 WeakPolarHBondContact OG-CG 3.3Å; S46-L352 PolarHBondContact OG-O 2.68Å
47	C	81.7	Confident	59	Low	71 Å²	71	82.4 Å²	82.4	48%	0.48	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	123.6	170.6	-178.6	0	0	0	0	108.8	T305	C47-T305 PolarHBondContact N-O 2.84Å; C47-T305 PolarHBondContact O-N 3.22Å
48	A	82.5	Confident	60.4	Low	11 Å²	11	79.7 Å²	79.7	9%	0.091	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	120.3	179.4	0	0	0	0	0	110.2	I302 M353 N355	A48-I302 HydrophobicContact CB-CG2 3.88Å; A48-M353 VanDerWaalsContact CB-O 3.29Å; A48-M353 WeakPolarHBondContact CB-O 3.3Å; A48-N355 HydrophobicContact CB-CB 4.11Å
49	V	77.7	Confident	61.9	Low	80 Å²	80	77.8 Å²	77.8	49%	0.485	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	116.6	-177.7	-178.2	0	0	0	0	109.1	K51 M303	V49-K51 PolarHBondContact O-N 2.9Å; V49-M303 PolarHBondContact N-O 2.9Å; V49-M303 PolarHBondContact O-N 3.2Å
50	V	75.8	Confident	63.4	Low	76 Å²	76	74.8 Å²	74.8	46%	0.461	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	118.8	178.8	-177.4	0	0	0	0	109.5	Y52	V50-Y52 WeakPolarHBondContact CG1-O 3.38Å
51	K	70.8	Confident	65.5	Low	111 Å²	111	75.4 Å²	75.4	48%	0.483	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-34.1	176.2	-77.5	-76.6	-173	169.9	0	112.1	V49 F110 N301 M303	V49-K51 PolarHBondContact O-N 2.9Å; K51-F110 HydrophobicContact CB-CD1 4.31Å; K51-F110 HydrophobicContact CB-CE1 3.82Å; K51-F110 HydrophobicContact CB-CZ 4.29Å; K51-N301 PolarHBondContact N-O 2.92Å; K51-M303 HydrophobicContact CG-CB 4.02Å
52	Y	66.6	Low	67.1	Low	121 Å²	121	68.2 Å²	68.2	48%	0.475	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	142.9	174.7	172.2	-98.6	0	0	0	110.4	V50 A54 R300 N301	V50-Y52 WeakPolarHBondContact CG1-O 3.38Å; Y52-A54 HydrophobicContact CE1-CB 4.03Å; Y52-R300 WeakPolarHBondContact O-CA 3.33Å; Y52-N301 PolarHBondContact N-O 2.86Å; Y52-N301 PolarHBondContact O-N 3.45Å
53	S	64.8	Low	68.5	Low	50 Å²	50	71.1 Å²	71.1	35%	0.35	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	122.1	171.4	-168.3	0	0	0	0	109.3	A55 R300	S53-A55 WeakPolarHBondContact OG-CB 3.46Å; S53-A55 PolarHBondContact OG-N 3.49Å; S53-R300 WeakPolarHBondContact OG-CG 3.48Å
54	A	53.1	Low	69.2	Low	28 Å²	28	65.2 Å²	65.2	23%	0.231	37%	0.371	C	S	.	.			trans	-80.2	-7.3	164.4	0	0	0	0	0	111.8	Y52 V299	Y52-A54 HydrophobicContact CE1-CB 4.03Å; A54-V299 HydrophobicContact CB-CB 4.33Å; A54-V299 PolarHBondContact N-O 2.93Å
55	A	55.7	Low	69.4	Low	17 Å²	17	69.8 Å²	69.8	14%	0.14	39%	0.391	C	S	.	.	S	Bend	trans	-78.4	142	-173.6	0	0	0	0	0	111.9	S53 D297	S53-A55 WeakPolarHBondContact OG-CB 3.46Å; S53-A55 PolarHBondContact OG-N 3.49Å; A55-D297 WeakPolarHBondContact CA-O 3.32Å; A55-D297 WeakPolarHBondContact CB-O 3.33Å
56	P	54.3	Low	69.4	Low	59 Å²	59	68.7 Å²	68.7	38%	0.383	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-64	165.9	169.9	29.3	-33.3	0	0	0	110.9	D297	P56-D297 VanDerWaalsContact CD-O 3.23Å; P56-D297 WeakPolarHBondContact CD-O 3.49Å
57	P	57.5	Low	69.2	Low	114 Å²	114	71.9 Å²	71.9	74%	0.74	40%	0.398	S	S	*	.	S	Bend	trans	-49.9	135.2	170	-24.7	34.2	0	0	0	110	T59	P57-T59 PolarHBondContact O-N 2.85Å
58	P	59.1	Low	69.1	Low	54 Å²	54	69 Å²	69	35%	0.351	38%	0.378	S	S	.	.			trans	-61.2	114.2	-166.3	23.9	-35.3	0	0	0	111.6	G321	P58-G321 VanDerWaalsContact CB-O 3.22Å; P58-G321 WeakPolarHBondContact CB-O 3.2Å; P58-G321 WeakPolarHBondContact CG-O 3.27Å
59	T	57.8	Low	69.1	Low	63 Å²	63	69.9 Å²	69.9	39%	0.387	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-64.8	146.3	-174.4	-40.3	0	0	0	0	111.1	P57 Y61 F320 G321	P57-T59 PolarHBondContact O-N 2.85Å; T59-Y61 PolarHBondContact O-N 3.04Å; T59-F320 WeakPolarHBondContact O-CA 3.23Å; T59-G321 PolarHBondContact O-N 3.4Å
60	T	64.1	Low	69.3	Low	106 Å²	106	66 Å²	66	65%	0.65	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-60.8	130.3	163.8	40.4	0	0	0	0	110
61	Y	72.1	Confident	69.5	Low	57 Å²	57	66.6 Å²	66.6	22%	0.224	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-90.9	153	173.4	68.3	-79.6	0	0	0	110.8	T59 L63 S209 F320 V328 L330 V360	T59-Y61 PolarHBondContact O-N 3.04Å; Y61-L63 HydrophobicContact CE2-CD2 3.73Å; Y61-L63 HydrophobicContact CE2-CG 3.99Å; Y61-S209 CarbonylContact C-O 3.47Å; Y61-S209 VanDerWaalsContact CA-O 3.29Å; Y61-S209 WeakPolarHBondContact CA-O 3.37Å; Y61-F320 HydrophobicContact CD1-CB 3.76Å; Y61-F320 HydrophobicContact CG-CB 4.26Å; Y61-V328 HydrophobicContact CD1-CG2 3.89Å; Y61-V328 HydrophobicContact CE1-CG2 3.47Å; Y61-V328 VanDerWaalsContact CE1-CG2 3.47Å; Y61-L330 HydrophobicContact CD2-CD1 4.23Å; Y61-L330 HydrophobicContact CD2-CD2 3.85Å; Y61-L330 HydrophobicContact CE2-CD2 4.01Å; Y61-L330 HydrophobicContact CG-CD1 4.22Å; Y61-L330 HydrophobicContact CG-CD2 4.14Å; Y61-V360 HydrophobicContact CE2-CG1 4.37Å
62	A	73.6	Confident	69.8	Low	27 Å²	27	65.3 Å²	65.3	22%	0.223	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-91.6	135.2	169.1	0	0	0	0	0	110.5	S209	A62-S209 PolarHBondContact N-O 2.8Å
63	L	76.4	Confident	69.8	Low	97 Å²	97	63.5 Å²	63.5	51%	0.508	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-80	125.4	163.4	-70.4	168.1	0	0	0	107.7	Y61 Y372	Y61-L63 HydrophobicContact CE2-CD2 3.73Å; Y61-L63 HydrophobicContact CE2-CG 3.99Å; L63-Y372 HydrophobicContact CD2-CD1 3.4Å; L63-Y372 VanDerWaalsContact CD2-CD1 3.4Å; L63-Y372 HydrophobicContact CD2-CD2 3.93Å; L63-Y372 HydrophobicContact CD2-CE1 3.68Å; L63-Y372 HydrophobicContact CD2-CE2 4.2Å; L63-Y372 HydrophobicContact CD2-CG 3.52Å
64	L	77.7	Confident	69.9	Low	6 Å²	6	61.4 Å²	61.4	3%	0.031	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-76.5	144.1	176.6	-51.8	-179.4	0	0	0	109.6	L70 F205 V369 Y372	L64-L70 HydrophobicContact CD1-CD2 3.82Å; L64-F205 HydrophobicContact CD1-CD2 3.98Å; L64-F205 HydrophobicContact CD1-CE2 4.49Å; L64-V369 HydrophobicContact CB-CG2 4.42Å; L64-V369 HydrophobicContact CD1-CG2 4.22Å; L64-Y372 HydrophobicContact CB-CE2 4.45Å; L64-Y372 WeakPolarHBondContact CB-OH 3.43Å; L64-Y372 VanDerWaalsContact CG-OH 3.27Å; L64-Y372 WeakPolarHBondContact CG-OH 3.39Å; L64-Y372 PolarHBondContact N-OH 3.36Å; L64-Y372 VanDerWaalsContact N-OH 3.08Å; L64-Y372 WeakPolarHBondContact O-CE2 3.15Å
65	Q	75.4	Confident	70.3	Confident	117 Å²	117	63 Å²	63	55%	0.547	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-59.9	144.7	173.8	-79.8	168.2	64.4	0	0	111.7	T68 D213	Q65-T68 VanDerWaalsContact O-CB 3.31Å; Q65-T68 WeakPolarHBondContact O-CB 3.36Å; Q65-T68 PolarHBondContact O-N 2.88Å; Q65-T68 VanDerWaalsContact O-N 3.17Å; Q65-T68 PolarHBondContact O-OG1 2.8Å; Q65-D213 WeakPolarHBondContact CG-OD2 2.98Å; Q65-D213 PolarHBondContact NE2-OD2 3.14Å
66	E	78.3	Confident	70.5	Confident	139 Å²	139	67 Å²	67	65%	0.65	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	144.2	168.5	-56.1	-173.9	169.9	0	0	109.2	Q370	E66-Q370 WeakPolarHBondContact CG-O 3.29Å
67	K	77.7	Confident	70.7	Confident	106 Å²	106	65.7 Å²	65.7	46%	0.461	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.4	4	-169.8	-45.7	-179.3	-176.5	-176.4	0	117	D69 E221 V369	K67-D69 PolarHBondContact O-N 2.88Å; K67-E221 IonicContact NZ-OE1 2.66Å; K67-E221 PolarHBondContact NZ-OE1 2.75Å; K67-V369 PolarHBondContact N-O 2.89Å
68	T	80.8	Confident	70.7	Confident	10 Å²	10	67.5 Å²	67.5	6%	0.061	36%	0.362	C	S	.	.			trans	-62.8	125	173.1	-60.2	0	0	0	0	111.9	Q65 A216 I368 V369	Q65-T68 VanDerWaalsContact O-CB 3.31Å; Q65-T68 WeakPolarHBondContact O-CB 3.36Å; Q65-T68 PolarHBondContact O-N 2.88Å; Q65-T68 VanDerWaalsContact O-N 3.17Å; Q65-T68 PolarHBondContact O-OG1 2.8Å; T68-A216 HydrophobicContact CG2-CB 4.19Å; T68-I368 WeakPolarHBondContact O-CA 3.36Å; T68-V369 PolarHBondContact O-N 2.91Å
69	D	82.8	Confident	70.5	Confident	29 Å²	29	74 Å²	74	16%	0.155	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-90.1	105.2	178.3	-174.3	13.2	0	0	0	113.4	K67 K71 L72 I368	K67-D69 PolarHBondContact O-N 2.88Å; D69-K71 PolarHBondContact O-N 2.82Å; D69-K71 VanDerWaalsContact OD1-CB 3.27Å; D69-K71 WeakPolarHBondContact OD1-CB 3.43Å; D69-K71 VanDerWaalsContact OD1-CG 3.29Å; D69-K71 WeakPolarHBondContact OD1-CG 3.14Å; D69-K71 PolarHBondContact OD1-N 2.79Å; D69-L72 HydrophobicContact CB-CG 4.46Å; D69-L72 PolarHBondContact O-N 2.62Å; D69-I368 HydrophobicContact CB-CG1 4.4Å
70	L	80.9	Confident	70.1	Confident	0 Å²	0	77.3 Å²	77.3	0%	0	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-1.2	176.4	-56.6	169.1	0	0	0	113.8	L64 I201 K204 F205 Y208 L332 G367 V369	L64-L70 HydrophobicContact CD1-CD2 3.82Å; L70-I201 HydrophobicContact CB-CG2 3.65Å; L70-I201 HydrophobicContact CD1-CG2 3.91Å; L70-I201 HydrophobicContact CG-CG2 4.46Å; L70-K204 WeakPolarHBondContact O-CD 3.28Å; L70-F205 HydrophobicContact CD1-CB 4Å; L70-F205 HydrophobicContact CD1-CD2 4.43Å; L70-F205 HydrophobicContact CD2-CB 3.97Å; L70-Y208 HydrophobicContact CD2-CD2 3.82Å; L70-Y208 HydrophobicContact CD2-CE2 4.23Å; L70-L332 HydrophobicContact CD1-CD1 3.77Å; L70-L332 HydrophobicContact CD1-CD2 3.96Å; L70-G367 WeakPolarHBondContact CB-O 3.27Å; L70-G367 VanDerWaalsContact CG-O 3.23Å; L70-G367 WeakPolarHBondContact CG-O 3.35Å; L70-G367 PolarHBondContact N-O 3.36Å; L70-V369 HydrophobicContact CD1-CG2 3.94Å; L70-V369 HydrophobicContact CD2-CG2 4.32Å; L70-V369 HydrophobicContact CG-CG2 4.02Å
71	K	80.6	Confident	69.2	Low	88 Å²	88	73.4 Å²	73.4	38%	0.383	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-31.2	167.2	-65	167.8	177.8	134.1	0	111.4	D69 K204 N366	D69-K71 PolarHBondContact O-N 2.82Å; D69-K71 VanDerWaalsContact OD1-CB 3.27Å; D69-K71 WeakPolarHBondContact OD1-CB 3.43Å; D69-K71 VanDerWaalsContact OD1-CG 3.29Å; D69-K71 WeakPolarHBondContact OD1-CG 3.14Å; D69-K71 PolarHBondContact OD1-N 2.79Å; K71-K204 PolarHBondContact O-NZ 2.85Å; K71-N366 WeakPolarHBondContact CE-O 3.33Å; K71-N366 PolarHBondContact NZ-O 2.85Å
72	L	75.8	Confident	67.8	Low	84 Å²	84	76.8 Å²	76.8	44%	0.44	40%	0.395	S	S	.	.	S	Bend	trans	-69.4	135.4	177.7	-60.2	178	0	0	0	110	D69 Y208	D69-L72 HydrophobicContact CB-CG 4.46Å; D69-L72 PolarHBondContact O-N 2.62Å; L72-Y208 PolarHBondContact O-OH 3.18Å
73	P	67	Low	66.3	Low	83 Å²	83	81.9 Å²	81.9	54%	0.539	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-80.3	132.3	176.5	30.8	-31.4	0	0	0	110.8	W77	P73-W77 HydrophobicContact CB-CB 4.42Å; P73-W77 HydrophobicContact CB-CG 4.25Å
74	P	66.8	Low	64.9	Low	5 Å²	5	78 Å²	78	3%	0.032	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-56.3	153.7	172.4	-18	21.2	0	0	0	113.4	N76 W77 Y207 Y208	P74-N76 PolarHBondContact O-N 3.1Å; P74-W77 HydrophobicContact CB-CB 4.2Å; P74-W77 HydrophobicContact CG-CB 4.28Å; P74-W77 HydrophobicContact CG-CD2 4.36Å; P74-W77 HydrophobicContact CG-CE3 3.89Å; P74-W77 WeakPolarHBondContact O-CB 3.38Å; P74-W77 PolarHBondContact O-N 3.33Å; P74-W77 VanDerWaalsContact O-N 3.09Å; P74-Y207 HydrophobicContact CB-CD1 3.44Å; P74-Y207 VanDerWaalsContact CB-CD1 3.44Å; P74-Y207 HydrophobicContact CB-CE1 3.46Å; P74-Y207 VanDerWaalsContact CB-CE1 3.46Å; P74-Y207 HydrophobicContact CB-CG 4.38Å; P74-Y207 HydrophobicContact CG-CD1 3.52Å; P74-Y207 HydrophobicContact CG-CE1 4.08Å; P74-Y207 HydrophobicContact CG-CG 4.1Å; P74-Y208 HydrophobicContact CB-CD1 4.28Å; P74-Y208 HydrophobicContact CB-CE1 3.75Å; P74-Y208 HydrophobicContact CG-CD1 4.06Å; P74-Y208 HydrophobicContact CG-CD2 4.14Å; P74-Y208 HydrophobicContact CG-CE1 3.66Å; P74-Y208 HydrophobicContact CG-CE2 3.75Å; P74-Y208 HydrophobicContact CG-CG 4.28Å
75	A	61.4	Low	63.5	Low	61 Å²	61	78.8 Å²	78.8	50%	0.504	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	130.7	167.6	0	0	0	0	0	110.6	W77 Y207	A75-W77 VanDerWaalsContact C-N 3.25Å; A75-W77 PolarHBondContact O-N 3.45Å; A75-Y207 PolarHBondContact O-OH 3Å; A75-Y207 VanDerWaalsContact O-OH 3.1Å
76	N	60.1	Low	61.8	Low	101 Å²	101	74.6 Å²	74.6	54%	0.54	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.1	14.2	-174.5	-55.6	-64.6	0	0	0	116.8	P74 L78 R79	P74-N76 PolarHBondContact O-N 3.1Å; N76-L78 PolarHBondContact O-N 3.32Å; N76-R79 PolarHBondContact O-N 3.09Å
77	W	59.1	Low	60	Low	32 Å²	32	68.2 Å²	68.2	12%	0.121	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-44.8	-30.5	176.6	168.4	-115.6	0	0	0	117.1	P73 P74 A75 L92 S203 K204 Y207	P73-W77 HydrophobicContact CB-CB 4.42Å; P73-W77 HydrophobicContact CB-CG 4.25Å; P74-W77 HydrophobicContact CB-CB 4.2Å; P74-W77 HydrophobicContact CG-CB 4.28Å; P74-W77 HydrophobicContact CG-CD2 4.36Å; P74-W77 HydrophobicContact CG-CE3 3.89Å; P74-W77 WeakPolarHBondContact O-CB 3.38Å; P74-W77 PolarHBondContact O-N 3.33Å; P74-W77 VanDerWaalsContact O-N 3.09Å; A75-W77 VanDerWaalsContact C-N 3.25Å; A75-W77 PolarHBondContact O-N 3.45Å; W77-L92 HydrophobicContact CH2-CD1 4.07Å; W77-L92 HydrophobicContact CH2-CD2 3.62Å; W77-L92 HydrophobicContact CH2-CG 4.24Å; W77-L92 HydrophobicContact CZ2-CD1 4.13Å; W77-L92 HydrophobicContact CZ2-CD2 3.45Å; W77-L92 VanDerWaalsContact CZ2-CD2 3.45Å; W77-L92 HydrophobicContact CZ2-CG 4.37Å; W77-L92 HydrophobicContact CZ3-CD1 4.47Å; W77-S203 WeakPolarHBondContact CH2-O 3.31Å; W77-S203 VanDerWaalsContact CZ3-O 3.3Å; W77-S203 WeakPolarHBondContact CZ3-O 3.48Å; W77-K204 HydrophobicContact CD2-CG 4.1Å; W77-K204 HydrophobicContact CE3-CG 4.15Å; W77-K204 HydrophobicContact CH2-CB 4.11Å; W77-K204 HydrophobicContact CH2-CG 3.48Å; W77-K204 VanDerWaalsContact CH2-CG 3.48Å; W77-K204 HydrophobicContact CZ2-CB 4.47Å; W77-K204 HydrophobicContact CZ2-CD 4.41Å; W77-K204 HydrophobicContact CZ2-CG 3.4Å; W77-K204 VanDerWaalsContact CZ3-CA 3.49Å; W77-K204 HydrophobicContact CZ3-CB 4.28Å; W77-K204 HydrophobicContact CZ3-CG 3.87Å; W77-Y207 HydrophobicContact CE3-CD2 4.03Å; W77-Y207 AromaticContact CE3-CG 3.99Å; W77-Y207 HydrophobicContact CE3-CG 3.99Å; W77-Y207 HydrophobicContact CZ3-CD2 4.35Å; W77-Y207 HydrophobicContact CZ3-CG 4.22Å
78	L	56.7	Low	58.2	Low	153 Å²	153	63.8 Å²	63.8	80%	0.801	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	7	-178.5	-63	176	0	0	0	114.4	N76	N76-L78 PolarHBondContact O-N 3.32Å
79	R	55.3	Low	56.2	Low	190 Å²	190	66.1 Å²	66.1	72%	0.717	36%	0.356	S	S	*	.	S	Bend	trans	-105.4	148.3	176.2	-69.5	-173.8	175.1	-168.8	-0.2	110.5	N76 N81	N76-R79 PolarHBondContact O-N 3.09Å; R79-N81 PolarHBondContact O-N 3.42Å
80	E	48.9	Very low	54.3	Low	132 Å²	132	67 Å²	67	62%	0.617	36%	0.363	S	S	*	.			trans	-61.3	118.4	172.3	-66.5	-175.3	152.1	0	0	109.7
81	N	45.8	Very low	52.4	Low	24 Å²	24	69 Å²	69	13%	0.128	38%	0.375	C	S	.	.			trans	-92.3	125.1	178	174.8	-1.1	0	0	0	108.4	R79 Q83 L84 G85 N211	R79-N81 PolarHBondContact O-N 3.42Å; N81-Q83 PolarHBondContact O-N 3.47Å; N81-Q83 PolarHBondContact OD1-N 3.09Å; N81-Q83 VanDerWaalsContact OD1-N 3.1Å; N81-L84 HydrophobicContact CB-CB 4.02Å; N81-L84 PolarHBondContact O-N 3.48Å; N81-G85 PolarHBondContact O-N 2.94Å; N81-N211 PolarHBondContact ND2-ND2 3.18Å; N81-N211 PolarHBondContact ND2-OD1 3.3Å
82	P	42.3	Very low	50.5	Low	129 Å²	129	66.6 Å²	66.6	84%	0.838	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-10.8	-178.8	24.6	-34.9	0	0	0	115.3
83	Q	43.3	Very low	48.7	Very low	133 Å²	133	64 Å²	64	62%	0.621	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-8.4	170.7	-67.3	-176.9	-13.4	0	0	114.4	N81	N81-Q83 PolarHBondContact O-N 3.47Å; N81-Q83 PolarHBondContact OD1-N 3.09Å; N81-Q83 VanDerWaalsContact OD1-N 3.1Å
84	L	45.9	Very low	47	Very low	17 Å²	17	65.2 Å²	65.2	9%	0.089	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.9	-14.2	-170.9	-160.6	67.7	0	0	0	113.6	N81 A87 G88 Y207 I210 D297 F298	N81-L84 HydrophobicContact CB-CB 4.02Å; N81-L84 PolarHBondContact O-N 3.48Å; L84-A87 VanDerWaalsContact O-CB 3.27Å; L84-A87 WeakPolarHBondContact O-CB 3.11Å; L84-A87 PolarHBondContact O-N 3.23Å; L84-G88 PolarHBondContact O-N 3.36Å; L84-Y207 HydrophobicContact CD2-CD2 4.23Å; L84-I210 HydrophobicContact CD1-CD1 3.46Å; L84-I210 VanDerWaalsContact CD1-CD1 3.46Å; L84-D297 VanDerWaalsContact C-OD2 3.22Å; L84-F298 HydrophobicContact CD1-CE2 3.92Å; L84-F298 HydrophobicContact CD1-CZ 4.31Å
85	G	49	Very low	45.3	Very low	22 Å²	22	68.7 Å²	68.7	23%	0.227	40%	0.395	C	S	.	.	H	α-helix	trans	52	-145.2	176.4	0	0	0	0	0	113.4	N81 A87 D297	N81-G85 PolarHBondContact O-N 2.94Å; G85-A87 PolarHBondContact O-N 3.5Å; G85-D297 VanDerWaalsContact CA-OD2 3.27Å; G85-D297 WeakPolarHBondContact CA-OD2 3.43Å; G85-D297 PolarHBondContact N-OD2 2.9Å; G85-D297 VanDerWaalsContact N-OD2 3.11Å
86	S	39.7	Very low	44	Very low	29 Å²	29	71.4 Å²	71.4	20%	0.203	41%	0.41	C	S	.	.	H	α-helix	trans	-75.2	-4.9	172.6	-162.4	0	0	0	0	112.7	G88 T89 T90 R295 N296	S86-G88 PolarHBondContact O-N 2.94Å; S86-T89 WeakPolarHBondContact CA-OG1 3.37Å; S86-T89 PolarHBondContact O-N 3.45Å; S86-T89 PolarHBondContact O-OG1 3.12Å; S86-T89 VanDerWaalsContact O-OG1 3.11Å; S86-T90 WeakPolarHBondContact O-CG2 3.27Å; S86-T90 PolarHBondContact O-N 3.39Å; S86-T90 PolarHBondContact O-OG1 2.86Å; S86-T90 VanDerWaalsContact O-OG1 3.06Å; S86-R295 PolarHBondContact N-O 2.66Å; S86-R295 VanDerWaalsContact N-O 3.14Å; S86-N296 VanDerWaalsContact C-OD1 3.25Å; S86-N296 PolarHBondContact O-OD1 3.03Å
87	A	39.5	Very low	43.1	Very low	5 Å²	5	74.6 Å²	74.6	4%	0.041	42%	0.419	C	S	.	.	H	α-helix	trans	-70.3	-34.4	-177.4	0	0	0	0	0	112.1	L84 G85 T90 V91 N296 F298	L84-A87 VanDerWaalsContact O-CB 3.27Å; L84-A87 WeakPolarHBondContact O-CB 3.11Å; L84-A87 PolarHBondContact O-N 3.23Å; G85-A87 PolarHBondContact O-N 3.5Å; A87-T90 WeakPolarHBondContact CA-OG1 3.49Å; A87-T90 PolarHBondContact O-N 3.38Å; A87-T90 PolarHBondContact O-OG1 3.46Å; A87-V91 WeakPolarHBondContact O-CG2 3.29Å; A87-V91 PolarHBondContact O-N 3.11Å; A87-N296 PolarHBondContact N-OD1 2.89Å; A87-F298 HydrophobicContact CB-CD2 3.73Å; A87-F298 HydrophobicContact CB-CE2 4.16Å
88	G	41.3	Very low	42.3	Very low	13 Å²	13	78 Å²	78	13%	0.134	45%	0.448	C	S	.	.	H	α-helix	trans	-58.8	-47	170.6	0	0	0	0	0	111.8	L84 S86 L92	L84-G88 PolarHBondContact O-N 3.36Å; S86-G88 PolarHBondContact O-N 2.94Å; G88-L92 WeakPolarHBondContact O-CB 3.48Å; G88-L92 WeakPolarHBondContact O-CD1 3.03Å; G88-L92 WeakPolarHBondContact O-CG 3.04Å; G88-L92 PolarHBondContact O-N 3.11Å
89	T	38.6	Very low	42.4	Very low	58 Å²	58	76.1 Å²	76.1	36%	0.356	43%	0.433	S	S	.	.	H	α-helix	trans	-73.3	-26.6	-179.5	25.5	0	0	0	0	114.1	S86 L92 G93	S86-T89 WeakPolarHBondContact CA-OG1 3.37Å; S86-T89 PolarHBondContact O-N 3.45Å; S86-T89 PolarHBondContact O-OG1 3.12Å; S86-T89 VanDerWaalsContact O-OG1 3.11Å; T89-L92 CarbonylContact O-C 3.52Å; T89-L92 PolarHBondContact O-N 2.96Å; T89-G93 PolarHBondContact O-N 2.92Å; T89-G93 VanDerWaalsContact O-N 3.13Å
90	T	42.8	Very low	42.6	Very low	48 Å²	48	70.1 Å²	70.1	29%	0.294	42%	0.419	S	S	.	.	H	α-helix	trans	-80.2	-37.7	175.9	51.6	0	0	0	0	113	S86 A87 L92 G93 N296	S86-T90 WeakPolarHBondContact O-CG2 3.27Å; S86-T90 PolarHBondContact O-N 3.39Å; S86-T90 PolarHBondContact O-OG1 2.86Å; S86-T90 VanDerWaalsContact O-OG1 3.06Å; A87-T90 WeakPolarHBondContact CA-OG1 3.49Å; A87-T90 PolarHBondContact O-N 3.38Å; A87-T90 PolarHBondContact O-OG1 3.46Å; T90-L92 PolarHBondContact O-N 3.08Å; T90-G93 PolarHBondContact O-N 3.05Å; T90-G93 VanDerWaalsContact O-N 3.15Å; T90-N296 PolarHBondContact OG1-OD1 3.48Å
91	V	40.5	Very low	43.7	Very low	42 Å²	42	64.3 Å²	64.3	26%	0.255	39%	0.391	S	S	.	.	H	α-helix	trans	-59.1	-35.6	163.6	178	0	0	0	0	109.7	A87 G93 K199 L206	A87-V91 WeakPolarHBondContact O-CG2 3.29Å; A87-V91 PolarHBondContact O-N 3.11Å; V91-G93 VanDerWaalsContact C-N 3.34Å; V91-G93 PolarHBondContact O-N 3.48Å; V91-K199 WeakPolarHBondContact O-CE 3.3Å; V91-K199 PolarHBondContact O-NZ 2.69Å; V91-L206 HydrophobicContact CG1-CD1 4.04Å
92	L	40.8	Very low	45.5	Very low	38 Å²	38	65.7 Å²	65.7	20%	0.199	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-0.9	175.1	-74	167.6	0	0	0	117	W77 G88 T89 T90 S94 S203	W77-L92 HydrophobicContact CH2-CD1 4.07Å; W77-L92 HydrophobicContact CH2-CD2 3.62Å; W77-L92 HydrophobicContact CH2-CG 4.24Å; W77-L92 HydrophobicContact CZ2-CD1 4.13Å; W77-L92 HydrophobicContact CZ2-CD2 3.45Å; W77-L92 VanDerWaalsContact CZ2-CD2 3.45Å; W77-L92 HydrophobicContact CZ2-CG 4.37Å; W77-L92 HydrophobicContact CZ3-CD1 4.47Å; G88-L92 WeakPolarHBondContact O-CB 3.48Å; G88-L92 WeakPolarHBondContact O-CD1 3.03Å; G88-L92 WeakPolarHBondContact O-CG 3.04Å; G88-L92 PolarHBondContact O-N 3.11Å; T89-L92 CarbonylContact O-C 3.52Å; T89-L92 PolarHBondContact O-N 2.96Å; T90-L92 PolarHBondContact O-N 3.08Å; L92-S94 VanDerWaalsContact C-N 3.33Å; L92-S94 PolarHBondContact O-N 3.24Å; L92-S203 WeakPolarHBondContact CD2-OG 3.31Å; L92-S203 WeakPolarHBondContact CG-OG 3.44Å
93	G	37.7	Very low	47.6	Very low	30 Å²	30	59.5 Å²	59.5	31%	0.309	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.1	29.1	163.3	0	0	0	0	0	117.5	T89 T90 V91	T89-G93 PolarHBondContact O-N 2.92Å; T89-G93 VanDerWaalsContact O-N 3.13Å; T90-G93 PolarHBondContact O-N 3.05Å; T90-G93 VanDerWaalsContact O-N 3.15Å; V91-G93 VanDerWaalsContact C-N 3.34Å; V91-G93 PolarHBondContact O-N 3.48Å
94	S	31.8	Very low	49.5	Very low	108 Å²	108	54.9 Å²	54.9	76%	0.755	34%	0.341	S	S	*	.			trans	-105.8	0.7	-179.9	-70.9	0	0	0	0	115.4	L92	L92-S94 VanDerWaalsContact C-N 3.33Å; L92-S94 PolarHBondContact O-N 3.24Å
95	S	31.3	Very low	51.2	Low	77 Å²	77	55.7 Å²	55.7	54%	0.538	35%	0.353	S	S	.	.			trans	-105.5	123.5	170.1	-177.9	0	0	0	0	111.5	K97	S95-K97 PolarHBondContact OG-N 2.81Å; S95-K97 PolarHBondContact OG-O 2.99Å
96	S	34.4	Very low	52.9	Low	118 Å²	118	54.9 Å²	54.9	83%	0.825	34%	0.344	S	S	*	.			trans	-85.1	5.4	164.8	54.3	0	0	0	0	113
97	K	40	Very low	55.1	Low	169 Å²	169	53.5 Å²	53.5	74%	0.735	33%	0.334	S	S	*	.	S	Bend	trans	-102.8	129.7	175.8	-63.5	-176	176.5	-177.1	0	109.9	S95	S95-K97 PolarHBondContact OG-N 2.81Å; S95-K97 PolarHBondContact OG-O 2.99Å
98	S	43.4	Very low	57.1	Low	103 Å²	103	58.1 Å²	58.1	72%	0.72	35%	0.351	S	S	*	.			trans	55.8	113.6	-176.2	59.7	0	0	0	0	117.5
99	K	57.5	Low	59	Low	114 Å²	114	62.6 Å²	62.6	50%	0.496	37%	0.372	S	S	.	.			trans	-65	137.5	147.9	-65.7	-169.4	-175.4	-173	0	107	F101 E155	K99-F101 VanDerWaalsContact C-N 3.29Å; K99-F101 PolarHBondContact O-N 2.87Å; K99-E155 IonicContact NZ-OE2 3.18Å; K99-E155 PolarHBondContact NZ-OE2 3.07Å
100	P	60.9	Low	61.1	Low	64 Å²	64	61.5 Å²	61.5	42%	0.416	36%	0.362	S	S	.	.	S	Bend	trans	-71.8	-21.6	-173.7	27.5	-34.4	0	0	0	113.8	V299	P100-V299 HydrophobicContact CB-CG2 4.4Å
101	F	71.7	Confident	63	Low	9 Å²	9	60.5 Å²	60.5	4%	0.039	36%	0.355	C	S	.	.			trans	-125.2	138.3	177.7	-55.7	-73.4	0	0	0	110.1	K99 M106 D123 V299 G314 S315 N316	K99-F101 VanDerWaalsContact C-N 3.29Å; K99-F101 PolarHBondContact O-N 2.87Å; F101-M106 HydrophobicContact CB-SD 4.09Å; F101-M106 HydrophobicContact CD1-SD 4.11Å; F101-M106 HydrophobicContact CG-SD 4.48Å; F101-D123 HydrophobicContact CB-CB 4.08Å; F101-V299 HydrophobicContact CE1-CG1 3.77Å; F101-V299 HydrophobicContact CZ-CB 4.32Å; F101-V299 HydrophobicContact CZ-CG1 3.93Å; F101-V299 HydrophobicContact CZ-CG2 4.11Å; F101-G314 VanDerWaalsContact CD1-CA 3.47Å; F101-G314 VanDerWaalsContact CE1-CA 3.5Å; F101-S315 VanDerWaalsContact CZ-N 3.29Å; F101-S315 WeakPolarHBondContact CZ-O 3.31Å; F101-N316 HydrophobicContact CE2-CB 3.96Å; F101-N316 HydrophobicContact CZ-CB 4.36Å
102	S	83.3	Confident	64.7	Low	53 Å²	53	62.8 Å²	62.8	37%	0.371	37%	0.366	S	S	.	.			trans	-135.6	139	163.2	167.9	0	0	0	0	107.6	F104 G105 M106 D154	S102-F104 PolarHBondContact O-N 2.82Å; S102-G105 PolarHBondContact O-N 2.84Å; S102-G105 VanDerWaalsContact O-N 3.07Å; S102-M106 PolarHBondContact O-N 3.17Å; S102-D154 PolarHBondContact OG-OD2 2.73Å
103	S	85.3	Confident	66.6	Low	0 Å²	0	61.8 Å²	61.8	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-56.4	-37.3	-179.1	69	0	0	0	0	112.8	A107 V121 L152 D154	S103-A107 VanDerWaalsContact O-CB 3.22Å; S103-A107 WeakPolarHBondContact O-CB 3.42Å; S103-A107 PolarHBondContact O-N 2.94Å; S103-V121 WeakPolarHBondContact CB-O 3.44Å; S103-L152 WeakPolarHBondContact OG-CB 3.4Å; S103-D154 WeakPolarHBondContact CB-OD2 3.34Å; S103-D154 PolarHBondContact N-OD1 3.08Å; S103-D154 PolarHBondContact N-OD2 2.85Å; S103-D154 VanDerWaalsContact OG-CG 3.23Å; S103-D154 PolarHBondContact OG-OD2 3.44Å
104	F	84.1	Confident	68.7	Low	35 Å²	35	60.7 Å²	60.7	15%	0.154	35%	0.349	C	S	.	.	H	α-helix	trans	-67.1	-41.3	175.1	-71.3	-78.2	0	0	0	113.2	S102 A107 Y108 H145 L152 F447 P450 V451 L454	S102-F104 PolarHBondContact O-N 2.82Å; F104-A107 PolarHBondContact O-N 3.26Å; F104-Y108 WeakPolarHBondContact O-CB 3.32Å; F104-Y108 PolarHBondContact O-N 2.94Å; F104-H145 AromaticContact CE2-CD2 3.54Å; F104-H145 AromaticContact CE2-CE1 3.79Å; F104-H145 AromaticContact CE2-CG 3.88Å; F104-H145 AromaticContact CE2-NE2 3.51Å; F104-H145 HydrophobicContact CZ-CB 4.04Å; F104-H145 AromaticContact CZ-CD2 3.66Å; F104-H145 AromaticContact CZ-CE1 3.95Å; F104-H145 AromaticContact CZ-CG 3.52Å; F104-H145 AromaticContact CZ-ND1 3.7Å; F104-H145 AromaticContact CZ-NE2 3.96Å; F104-L152 HydrophobicContact CD1-CD2 3.74Å; F104-L152 HydrophobicContact CE1-CD2 3.97Å; F104-L152 HydrophobicContact CG-CD2 4.1Å; F104-F447 HydrophobicContact CE2-CD1 4.36Å; F104-P450 HydrophobicContact CD1-CB 4.08Å; F104-P450 HydrophobicContact CE1-CB 3.92Å; F104-P450 HydrophobicContact CE2-CB 4.48Å; F104-P450 HydrophobicContact CG-CB 4.43Å; F104-P450 HydrophobicContact CZ-CB 4.13Å; F104-V451 HydrophobicContact CE1-CB 4.48Å; F104-V451 HydrophobicContact CE1-CG2 3.67Å; F104-V451 HydrophobicContact CZ-CG2 3.59Å; F104-L454 HydrophobicContact CD1-CD2 4.01Å; F104-L454 HydrophobicContact CE1-CD2 4.36Å
105	G	81.7	Confident	70.4	Confident	34 Å²	34	56.2 Å²	56.2	35%	0.351	32%	0.319	S	S	.	.	H	α-helix	trans	-64.8	-46.7	178	0	0	0	0	0	111.5	S102 A107 Y108 D109	S102-G105 PolarHBondContact O-N 2.84Å; S102-G105 VanDerWaalsContact O-N 3.07Å; G105-A107 VanDerWaalsContact C-N 3.35Å; G105-A107 PolarHBondContact O-N 2.81Å; G105-Y108 WeakPolarHBondContact O-CB 3.42Å; G105-Y108 PolarHBondContact O-N 3.04Å; G105-Y108 VanDerWaalsContact O-N 3.12Å; G105-D109 PolarHBondContact O-N 3.16Å
106	M	84.9	Confident	72.1	Confident	5 Å²	5	55.2 Å²	55.2	3%	0.025	31%	0.308	C	S	.	.	H	α-helix	trans	-63.2	-39.1	175.2	-66.7	167.4	55.4	0	0	112.5	F101 S102 Y108 D109 F110 V121 S122 L312	F101-M106 HydrophobicContact CB-SD 4.09Å; F101-M106 HydrophobicContact CD1-SD 4.11Å; F101-M106 HydrophobicContact CG-SD 4.48Å; S102-M106 PolarHBondContact O-N 3.17Å; M106-Y108 VanDerWaalsContact C-N 3.26Å; M106-Y108 PolarHBondContact O-N 2.84Å; M106-D109 PolarHBondContact O-N 3.33Å; M106-F110 WeakPolarHBondContact O-CD2 3.47Å; M106-F110 PolarHBondContact O-N 3.05Å; M106-F110 VanDerWaalsContact O-N 3.08Å; M106-V121 HydrophobicContact CB-CG1 3.78Å; M106-V121 HydrophobicContact CE-CG1 4Å; M106-S122 WeakPolarHBondContact CE-O 3.25Å; M106-L312 HydrophobicContact CB-CD2 4.37Å; M106-L312 HydrophobicContact CE-CG 3.92Å; M106-L312 VanDerWaalsContact CE-O 3.29Å; M106-L312 WeakPolarHBondContact CE-O 3.25Å
107	A	85.7	Confident	74.2	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-68.7	-24.7	175.5	0	0	0	0	0	113.2	S103 F104 G105 I111 I114 L152 L454	S103-A107 VanDerWaalsContact O-CB 3.22Å; S103-A107 WeakPolarHBondContact O-CB 3.42Å; S103-A107 PolarHBondContact O-N 2.94Å; F104-A107 PolarHBondContact O-N 3.26Å; G105-A107 VanDerWaalsContact C-N 3.35Å; G105-A107 PolarHBondContact O-N 2.81Å; A107-I111 VanDerWaalsContact O-CA 3.25Å; A107-I111 WeakPolarHBondContact O-CA 3.42Å; A107-I111 PolarHBondContact O-N 3.21Å; A107-I114 HydrophobicContact CB-CD1 3.86Å; A107-I114 HydrophobicContact CB-CG1 4.06Å; A107-L152 HydrophobicContact CB-CD1 4.48Å; A107-L152 HydrophobicContact CB-CD2 3.93Å; A107-L152 HydrophobicContact CB-CG 4.38Å; A107-L454 HydrophobicContact CB-CD1 4.23Å; A107-L454 HydrophobicContact CB-CD2 3.93Å
108	Y	82.2	Confident	76.5	Confident	102 Å²	102	46.9 Å²	46.9	40%	0.4	26%	0.262	S	S	.	.	H	α-helix	trans	-74.2	-48.5	172.6	-172.9	-71.2	0	0	0	111	F104 G105 M106 F110 R457	F104-Y108 WeakPolarHBondContact O-CB 3.32Å; F104-Y108 PolarHBondContact O-N 2.94Å; G105-Y108 WeakPolarHBondContact O-CB 3.42Å; G105-Y108 PolarHBondContact O-N 3.04Å; G105-Y108 VanDerWaalsContact O-N 3.12Å; M106-Y108 VanDerWaalsContact C-N 3.26Å; M106-Y108 PolarHBondContact O-N 2.84Å; Y108-F110 VanDerWaalsContact C-N 3.31Å; Y108-F110 PolarHBondContact O-N 3.1Å; Y108-R457 PolarHBondContact OH-NH1 3.47Å; Y108-R457 VanDerWaalsContact OH-NH1 3.09Å; Y108-R457 PolarHBondContact OH-NH2 3.39Å
109	D	80.4	Confident	78.7	Confident	108 Å²	108	43.4 Å²	43.4	58%	0.578	24%	0.236	S	C	*	.	H	α-helix	trans	-64.9	-33.2	-178.6	-66.7	-16.6	0	0	0	112.6	G105 M106	G105-D109 PolarHBondContact O-N 3.16Å; M106-D109 PolarHBondContact O-N 3.33Å
110	F	82.9	Confident	80.3	Confident	34 Å²	34	38.1 Å²	38.1	15%	0.149	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118	40.7	-178.8	-57.7	-77.5	0	0	0	112.6	K51 M106 Y108 D112 C113 N301 L312	K51-F110 HydrophobicContact CB-CD1 4.31Å; K51-F110 HydrophobicContact CB-CE1 3.82Å; K51-F110 HydrophobicContact CB-CZ 4.29Å; M106-F110 WeakPolarHBondContact O-CD2 3.47Å; M106-F110 PolarHBondContact O-N 3.05Å; M106-F110 VanDerWaalsContact O-N 3.08Å; Y108-F110 VanDerWaalsContact C-N 3.31Å; Y108-F110 PolarHBondContact O-N 3.1Å; F110-D112 PolarHBondContact O-N 2.97Å; F110-C113 PolarHBondContact O-N 3.19Å; F110-N301 HydrophobicContact CE2-CB 3.63Å; F110-N301 HydrophobicContact CZ-CB 3.96Å; F110-L312 HydrophobicContact CB-CD2 3.8Å; F110-L312 HydrophobicContact CD2-CD1 4.29Å; F110-L312 HydrophobicContact CD2-CD2 3.91Å; F110-L312 HydrophobicContact CG-CD1 4.48Å; F110-L312 HydrophobicContact CG-CD2 4.13Å
111	I	82.6	Confident	81.8	Confident	27 Å²	27	35.1 Å²	35.1	14%	0.138	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-57.8	-26.3	-173.5	-158.1	162.5	0	0	0	114	A107 C113 I114 L454 R457 V458 N461	A107-I111 VanDerWaalsContact O-CA 3.25Å; A107-I111 WeakPolarHBondContact O-CA 3.42Å; A107-I111 PolarHBondContact O-N 3.21Å; I111-C113 PolarHBondContact O-N 2.95Å; I111-I114 PolarHBondContact O-N 3.03Å; I111-L454 HydrophobicContact CD1-CD1 4.34Å; I111-R457 HydrophobicContact CD1-CB 3.4Å; I111-R457 VanDerWaalsContact CD1-CB 3.4Å; I111-V458 HydrophobicContact CD1-CG2 4.06Å; I111-V458 HydrophobicContact CG1-CG2 3.76Å; I111-N461 HydrophobicContact CG2-CB 4.35Å
112	D	76.9	Confident	82.8	Confident	91 Å²	91	34.7 Å²	34.7	49%	0.487	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-59.8	-26.1	175.9	-72.6	-55.2	0	0	0	114.5	F110 N461 K465	F110-D112 PolarHBondContact O-N 2.97Å; D112-N461 PolarHBondContact OD1-ND2 3.07Å; D112-N461 PolarHBondContact OD1-OD1 2.88Å; D112-K465 WeakPolarHBondContact OD1-CE 3.37Å; D112-K465 IonicContact OD1-NZ 2.63Å; D112-K465 PolarHBondContact OD1-NZ 3.15Å
113	C	78.9	Confident	83.1	Confident	16 Å²	16	33.3 Å²	33.3	11%	0.108	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-95.1	-6.2	-177.9	-60.3	0	0	0	0	113.2	F110 I111 V118 M303	F110-C113 PolarHBondContact O-N 3.19Å; I111-C113 PolarHBondContact O-N 2.95Å; C113-V118 HydrophobicContact CB-CG2 3.75Å; C113-V118 WeakPolarHBondContact O-CB 3.44Å; C113-V118 WeakPolarHBondContact O-CG2 3.25Å; C113-V118 PolarHBondContact O-N 2.97Å; C113-M303 HydrophobicContact CB-CE 4.13Å
114	I	82.5	Confident	83.3	Confident	7 Å²	7	33.3 Å²	33.3	4%	0.036	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	134.7	-173.2	-55.9	-59.5	0	0	0	111	A107 I111 V121 V147 T150 V458	A107-I114 HydrophobicContact CB-CD1 3.86Å; A107-I114 HydrophobicContact CB-CG1 4.06Å; I111-I114 PolarHBondContact O-N 3.03Å; I114-V121 HydrophobicContact CD1-CG2 3.59Å; I114-V147 HydrophobicContact CG2-CG1 4.23Å; I114-T150 HydrophobicContact CD1-CG2 4.41Å; I114-V458 HydrophobicContact CB-CG2 4.17Å; I114-V458 HydrophobicContact CG2-CG2 3.87Å
115	G	67.1	Low	83.4	Confident	14 Å²	14	34.9 Å²	34.9	14%	0.144	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	98.9	-26.7	171.9	0	0	0	0	0	115.6	R149 T150	G115-R149 WeakPolarHBondContact O-CB 3.47Å; G115-T150 PolarHBondContact N-OG1 3.36Å
116	D	68.6	Low	83.8	Confident	56 Å²	56	33.5 Å²	33.5	30%	0.299	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-127.2	-43.5	178.9	-86.6	-34.6	0	0	0	114.7	R149 K475	D116-R149 IonicContact OD1-NH1 3.67Å; D116-K475 IonicContact OD1-NZ 2.8Å; D116-K475 PolarHBondContact OD1-NZ 3.35Å; D116-K475 IonicContact OD2-NZ 2.69Å; D116-K475 PolarHBondContact OD2-NZ 3.03Å
117	D	76.9	Confident	84.1	Confident	110 Å²	110	33.5 Å²	33.5	59%	0.588	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-21.3	-171.3	-62.3	-28	0	0	0	114.8
118	V	88.3	Confident	84.3	Confident	2 Å²	2	33.5 Å²	33.5	1%	0.012	17%	0.173	C	C	.	.			trans	-119.7	130	-174	177	0	0	0	0	111.3	C113 V120 V121 T150 M303 L312	C113-V118 HydrophobicContact CB-CG2 3.75Å; C113-V118 WeakPolarHBondContact O-CB 3.44Å; C113-V118 WeakPolarHBondContact O-CG2 3.25Å; C113-V118 PolarHBondContact O-N 2.97Å; V118-V120 WeakPolarHBondContact CG1-O 3.42Å; V118-V121 HydrophobicContact CG1-CG2 4.07Å; V118-T150 HydrophobicContact CG1-CG2 4.28Å; V118-T150 WeakPolarHBondContact O-CB 3.23Å; V118-T150 WeakPolarHBondContact O-CG2 3.27Å; V118-T150 PolarHBondContact O-OG1 3.18Å; V118-M303 HydrophobicContact CG2-CE 3.63Å; V118-M303 HydrophobicContact CG2-SD 3.73Å; V118-L312 HydrophobicContact CG1-CB 4.05Å
119	D	89.4	Confident	84.6	Confident	30 Å²	30	31.5 Å²	31.5	16%	0.16	17%	0.166	C	C	.	.	S	Bend	trans	-80.9	-39.7	176.6	-65.3	-62.6	0	0	0	112.9	T150 L151 I309 H310 L401 K405	D119-T150 CarbonylContact O-C 3.56Å; D119-T150 WeakPolarHBondContact O-CA 3.27Å; D119-L151 PolarHBondContact O-N 3.01Å; D119-I309 HydrophobicContact CB-CG2 4.37Å; D119-H310 WeakPolarHBondContact CB-O 3.28Å; D119-H310 PolarHBondContact N-O 3.42Å; D119-H310 PolarHBondContact OD2-N 3.12Å; D119-L401 HydrophobicContact CB-CD2 4.22Å; D119-K405 VanDerWaalsContact CG-NZ 3.32Å; D119-K405 IonicContact OD1-NZ 3.66Å; D119-K405 PolarHBondContact OD1-NZ 3.04Å; D119-K405 IonicContact OD2-NZ 2.78Å
120	V	92.2	Very high	85	Confident	4 Å²	4	26.8 Å²	26.8	2%	0.024	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	136.6	-169.9	-177.4	0	0	0	0	111.6	V118 I127 L151 L153 H310 M311 L312 L401	V118-V120 WeakPolarHBondContact CG1-O 3.42Å; V120-I127 HydrophobicContact CG1-CD1 3.87Å; V120-L151 CarbonylContact C-O 3.6Å; V120-L151 WeakPolarHBondContact CA-O 3.44Å; V120-L153 HydrophobicContact CG1-CD1 3.4Å; V120-L153 VanDerWaalsContact CG1-CD1 3.4Å; V120-L153 HydrophobicContact CG1-CG 4.04Å; V120-H310 PolarHBondContact N-O 3.12Å; V120-M311 HydrophobicContact CB-CB 4.49Å; V120-M311 HydrophobicContact CB-CG 4.14Å; V120-M311 CarbonylContact O-C 3.43Å; V120-M311 WeakPolarHBondContact O-CA 3.49Å; V120-L312 PolarHBondContact O-N 3.02Å; V120-L401 HydrophobicContact CG2-CD1 3.52Å; V120-L401 HydrophobicContact CG2-CD2 4.28Å
121	V	92.3	Very high	85.3	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	121.8	171	-174.5	0	0	0	0	109.5	S103 M106 I114 V118 T150 L151 L152 L153 L312	S103-V121 WeakPolarHBondContact CB-O 3.44Å; M106-V121 HydrophobicContact CB-CG1 3.78Å; M106-V121 HydrophobicContact CE-CG1 4Å; I114-V121 HydrophobicContact CD1-CG2 3.59Å; V118-V121 HydrophobicContact CG1-CG2 4.07Å; V121-T150 HydrophobicContact CG2-CG2 3.72Å; V121-L151 PolarHBondContact N-O 3.49Å; V121-L152 HydrophobicContact CB-CG 4.27Å; V121-L152 HydrophobicContact CG2-CD1 4.45Å; V121-L153 PolarHBondContact O-N 3.21Å; V121-L312 WeakPolarHBondContact CA-O 3.48Å; V121-L312 HydrophobicContact CG1-CB 4.4Å; V121-L312 HydrophobicContact CG1-CD2 4.11Å; V121-L312 HydrophobicContact CG1-CG 4.42Å; V121-L312 HydrophobicContact CG2-CB 4.2Å; V121-L312 HydrophobicContact CG2-CD2 4.38Å
122	S	92.6	Very high	85.6	Confident	1 Å²	1	25.6 Å²	25.6	1%	0.007	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	168.1	-179.4	-153.4	0	0	0	0	114.9	M106 N126 L153 L312 V313 G314	M106-S122 WeakPolarHBondContact CE-O 3.25Å; S122-N126 VanDerWaalsContact OG-CB 3.29Å; S122-N126 WeakPolarHBondContact OG-CB 3.3Å; S122-L153 WeakPolarHBondContact CB-O 3.36Å; S122-L153 WeakPolarHBondContact OG-CB 3.26Å; S122-L153 PolarHBondContact OG-O 3.07Å; S122-L312 PolarHBondContact N-O 3.07Å; S122-L312 VanDerWaalsContact N-O 3.09Å; S122-V313 WeakPolarHBondContact O-CA 3.37Å; S122-G314 PolarHBondContact O-N 2.91Å
123	D	89.4	Confident	86.1	Confident	23 Å²	23	22 Å²	22	12%	0.123	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	137.9	160.5	-177.8	-2.7	0	0	0	110.7	F101 E125 N126 I127	F101-D123 HydrophobicContact CB-CB 4.08Å; D123-E125 PolarHBondContact O-N 3.07Å; D123-E125 PolarHBondContact OD1-N 2.98Å; D123-E125 VanDerWaalsContact OD1-N 3.14Å; D123-N126 WeakPolarHBondContact O-CB 3.43Å; D123-N126 PolarHBondContact O-N 2.93Å; D123-I127 PolarHBondContact O-N 2.97Å
124	S	88.6	Confident	86.3	Confident	1 Å²	1	25.2 Å²	25.2	1%	0.007	14%	0.136	C	C	.	.	H	α-helix	trans	-44.7	-41.7	170.7	57.8	0	0	0	0	113.6	N126 I127 K128 G314	S124-N126 VanDerWaalsContact C-N 3.28Å; S124-N126 PolarHBondContact O-N 3.34Å; S124-I127 PolarHBondContact O-N 3.42Å; S124-K128 WeakPolarHBondContact O-CG 3.44Å; S124-K128 PolarHBondContact O-N 2.86Å; S124-G314 VanDerWaalsContact CB-O 3.28Å; S124-G314 WeakPolarHBondContact CB-O 3.48Å; S124-G314 PolarHBondContact N-O 2.68Å; S124-G314 PolarHBondContact OG-O 3.45Å; S124-G314 VanDerWaalsContact OG-O 3.09Å
125	E	87.6	Confident	86.4	Confident	68 Å²	68	28.3 Å²	28.3	32%	0.318	15%	0.148	S	C	.	.	H	α-helix	trans	-63.9	-31.7	178.3	-76.9	-60.9	151.2	0	0	113.1	D123 K128 K129	D123-E125 PolarHBondContact O-N 3.07Å; D123-E125 PolarHBondContact OD1-N 2.98Å; D123-E125 VanDerWaalsContact OD1-N 3.14Å; E125-K128 VanDerWaalsContact CD-CE 3.49Å; E125-K128 VanDerWaalsContact OE1-CE 3.22Å; E125-K128 WeakPolarHBondContact OE1-CE 3.47Å; E125-K128 IonicContact OE1-NZ 2.73Å; E125-K128 PolarHBondContact OE1-NZ 2.91Å; E125-K128 IonicContact OE2-NZ 3.84Å; E125-K129 WeakPolarHBondContact O-CB 3.48Å; E125-K129 WeakPolarHBondContact O-CD 3.22Å; E125-K129 WeakPolarHBondContact O-CG 3.09Å; E125-K129 PolarHBondContact O-N 3.15Å
126	N	89.6	Confident	87.2	Confident	4 Å²	4	28.6 Å²	28.6	2%	0.021	15%	0.147	C	C	.	.	H	α-helix	trans	-75.5	-40.7	178.3	-66.8	-19.9	0	0	0	111.3	S122 D123 S124 K129 L130 M142 E155	S122-N126 VanDerWaalsContact OG-CB 3.29Å; S122-N126 WeakPolarHBondContact OG-CB 3.3Å; D123-N126 WeakPolarHBondContact O-CB 3.43Å; D123-N126 PolarHBondContact O-N 2.93Å; S124-N126 VanDerWaalsContact C-N 3.28Å; S124-N126 PolarHBondContact O-N 3.34Å; N126-K129 PolarHBondContact O-N 2.63Å; N126-L130 WeakPolarHBondContact O-CG 3.44Å; N126-L130 PolarHBondContact O-N 3.31Å; N126-M142 HydrophobicContact CB-CE 3.77Å; N126-M142 HydrophobicContact CB-SD 4.48Å; N126-E155 PolarHBondContact ND2-N 2.95Å
127	I	90.3	Very high	87.8	Confident	6 Å²	6	33.5 Å²	33.5	3%	0.031	17%	0.166	C	C	.	.	H	α-helix	trans	-61.9	-46	173.2	-55.3	-58.4	0	0	0	110.4	V120 D123 S124 K129 L130 L131 L153 W304 M311	V120-I127 HydrophobicContact CG1-CD1 3.87Å; D123-I127 PolarHBondContact O-N 2.97Å; S124-I127 PolarHBondContact O-N 3.42Å; I127-K129 VanDerWaalsContact C-N 3.34Å; I127-K129 PolarHBondContact O-N 2.68Å; I127-L130 PolarHBondContact O-N 3.1Å; I127-L131 HydrophobicContact CG2-CD1 4.08Å; I127-L131 HydrophobicContact CG2-CG 4.36Å; I127-L131 WeakPolarHBondContact O-CG 3.45Å; I127-L131 PolarHBondContact O-N 3.02Å; I127-L153 HydrophobicContact CD1-CD1 4.09Å; I127-W304 HydrophobicContact CG2-CZ3 4.01Å; I127-M311 HydrophobicContact CD1-SD 4.16Å; I127-M311 HydrophobicContact CG1-SD 4.46Å; I127-M311 HydrophobicContact CG2-SD 4.11Å
128	K	89.9	Confident	88	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-59.3	-41.5	174	-70.4	-170.9	-55.8	170.5	0	112.4	S124 E125 K132 D346 L349 D350 M353	S124-K128 WeakPolarHBondContact O-CG 3.44Å; S124-K128 PolarHBondContact O-N 2.86Å; E125-K128 VanDerWaalsContact CD-CE 3.49Å; E125-K128 VanDerWaalsContact OE1-CE 3.22Å; E125-K128 WeakPolarHBondContact OE1-CE 3.47Å; E125-K128 IonicContact OE1-NZ 2.73Å; E125-K128 PolarHBondContact OE1-NZ 2.91Å; E125-K128 IonicContact OE2-NZ 3.84Å; K128-K132 VanDerWaalsContact O-CB 3.28Å; K128-K132 WeakPolarHBondContact O-CB 3.47Å; K128-K132 WeakPolarHBondContact O-CE 3.43Å; K128-K132 VanDerWaalsContact O-CG 3.28Å; K128-K132 WeakPolarHBondContact O-CG 3.46Å; K128-K132 PolarHBondContact O-N 3.43Å; K128-D346 VanDerWaalsContact CD-OD1 3.32Å; K128-D346 WeakPolarHBondContact CD-OD1 3.06Å; K128-D346 WeakPolarHBondContact CE-OD1 3.21Å; K128-D346 IonicContact NZ-OD1 3.87Å; K128-D346 PolarHBondContact NZ-OD1 2.71Å; K128-D346 IonicContact NZ-OD2 3.35Å; K128-L349 HydrophobicContact CD-CB 4.29Å; K128-L349 HydrophobicContact CG-CB 4.09Å; K128-L349 HydrophobicContact CG-CD1 4.08Å; K128-D350 WeakPolarHBondContact CD-OD1 3.49Å; K128-D350 WeakPolarHBondContact CE-OD1 3.16Å; K128-D350 IonicContact NZ-OD1 3.71Å; K128-D350 PolarHBondContact NZ-OD1 3.32Å; K128-D350 IonicContact NZ-OD2 2.99Å; K128-D350 PolarHBondContact NZ-OD2 2.95Å; K128-M353 HydrophobicContact CD-CE 3.89Å; K128-M353 HydrophobicContact CG-CE 3.71Å
129	K	88.7	Confident	87.8	Confident	59 Å²	59	35.6 Å²	35.6	26%	0.257	18%	0.178	S	C	.	.	H	α-helix	trans	-60.3	-43.4	175	-75.8	163.5	-160	164	0	111.9	E125 N126 I127 I133 E155	E125-K129 WeakPolarHBondContact O-CB 3.48Å; E125-K129 WeakPolarHBondContact O-CD 3.22Å; E125-K129 WeakPolarHBondContact O-CG 3.09Å; E125-K129 PolarHBondContact O-N 3.15Å; N126-K129 PolarHBondContact O-N 2.63Å; I127-K129 VanDerWaalsContact C-N 3.34Å; I127-K129 PolarHBondContact O-N 2.68Å; K129-I133 PolarHBondContact O-N 2.9Å; K129-E155 IonicContact NZ-OE1 2.96Å; K129-E155 PolarHBondContact NZ-OE1 3.32Å; K129-E155 IonicContact NZ-OE2 2.66Å
130	L	89.2	Confident	87.7	Confident	9 Å²	9	34.6 Å²	34.6	5%	0.047	17%	0.173	C	C	.	.	H	α-helix	trans	-62.6	-52.1	176.7	-72.1	176.2	0	0	0	112.1	N126 I127 K132 I133 M142 L153 I400 L417	N126-L130 WeakPolarHBondContact O-CG 3.44Å; N126-L130 PolarHBondContact O-N 3.31Å; I127-L130 PolarHBondContact O-N 3.1Å; L130-K132 PolarHBondContact O-N 3.36Å; L130-I133 HydrophobicContact CD2-CD1 3.83Å; L130-I133 VanDerWaalsContact O-CB 3.25Å; L130-I133 WeakPolarHBondContact O-CB 3.37Å; L130-I133 WeakPolarHBondContact O-CG1 3.42Å; L130-I133 PolarHBondContact O-N 3.03Å; L130-M142 HydrophobicContact CD1-CE 3.73Å; L130-M142 HydrophobicContact CD1-SD 4.32Å; L130-M142 HydrophobicContact CD2-CE 4.09Å; L130-M142 HydrophobicContact CD2-SD 3.66Å; L130-M142 HydrophobicContact CG-CE 3.79Å; L130-M142 HydrophobicContact CG-SD 3.7Å; L130-L153 HydrophobicContact CD1-CD1 3.7Å; L130-I400 HydrophobicContact CD2-CG2 4.4Å; L130-I400 VanDerWaalsContact O-CD1 3.31Å; L130-I400 WeakPolarHBondContact O-CD1 3.3Å; L130-L417 HydrophobicContact CD2-CD2 3.45Å; L130-L417 VanDerWaalsContact CD2-CD2 3.45Å
131	L	89.6	Confident	87.5	Confident	5 Å²	5	35.1 Å²	35.1	3%	0.026	18%	0.177	C	C	.	.	H	α-helix	trans	-65.9	-26.5	-178	-60.4	-176.8	0	0	0	112.7	I127 L349 V393 I396 A397	I127-L131 HydrophobicContact CG2-CD1 4.08Å; I127-L131 HydrophobicContact CG2-CG 4.36Å; I127-L131 WeakPolarHBondContact O-CG 3.45Å; I127-L131 PolarHBondContact O-N 3.02Å; L131-L349 HydrophobicContact CB-CD1 4.07Å; L131-L349 HydrophobicContact CD1-CD1 3.84Å; L131-L349 HydrophobicContact CD1-CD2 3.83Å; L131-V393 HydrophobicContact CB-CG1 4.29Å; L131-V393 HydrophobicContact CD1-CG1 4.29Å; L131-I396 HydrophobicContact CD2-CG2 4.42Å; L131-A397 VanDerWaalsContact CD2-CA 3.48Å; L131-A397 HydrophobicContact CD2-CB 3.44Å; L131-A397 VanDerWaalsContact CD2-CB 3.44Å
132	K	89.1	Confident	87.4	Confident	32 Å²	32	35.1 Å²	35.1	14%	0.139	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-2.2	173.8	-68.6	179.3	-63.8	-170.5	0	114.3	K128 L130 Y135 S136 L342 I345 D346	K128-K132 VanDerWaalsContact O-CB 3.28Å; K128-K132 WeakPolarHBondContact O-CB 3.47Å; K128-K132 WeakPolarHBondContact O-CE 3.43Å; K128-K132 VanDerWaalsContact O-CG 3.28Å; K128-K132 WeakPolarHBondContact O-CG 3.46Å; K128-K132 PolarHBondContact O-N 3.43Å; L130-K132 PolarHBondContact O-N 3.36Å; K132-Y135 PolarHBondContact O-N 3.45Å; K132-Y135 VanDerWaalsContact O-N 3.15Å; K132-S136 VanDerWaalsContact O-CB 3.25Å; K132-S136 WeakPolarHBondContact O-CB 3.49Å; K132-S136 PolarHBondContact O-N 3.33Å; K132-L342 HydrophobicContact CB-CD2 4.04Å; K132-L342 HydrophobicContact CD-CD2 4.22Å; K132-L342 HydrophobicContact CG-CD2 4.16Å; K132-I345 HydrophobicContact CD-CG2 4.32Å; K132-I345 HydrophobicContact CG-CG2 3.82Å; K132-D346 IonicContact NZ-OD1 2.71Å; K132-D346 PolarHBondContact NZ-OD1 3.04Å
133	I	87.1	Confident	87.3	Confident	16 Å²	16	35.1 Å²	35.1	8%	0.082	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-49.1	-179.7	-83.8	170.2	0	0	0	113.3	K129 L130 Y135 S136 V140 I400 K419 V426	K129-I133 PolarHBondContact O-N 2.9Å; L130-I133 HydrophobicContact CD2-CD1 3.83Å; L130-I133 VanDerWaalsContact O-CB 3.25Å; L130-I133 WeakPolarHBondContact O-CB 3.37Å; L130-I133 WeakPolarHBondContact O-CG1 3.42Å; L130-I133 PolarHBondContact O-N 3.03Å; I133-Y135 VanDerWaalsContact C-N 3.28Å; I133-Y135 PolarHBondContact O-N 3.19Å; I133-S136 PolarHBondContact O-N 3.41Å; I133-V140 HydrophobicContact CD1-CG1 4.41Å; I133-V140 HydrophobicContact CD1-CG2 4.48Å; I133-V140 HydrophobicContact CG1-CG2 3.92Å; I133-I400 HydrophobicContact CD1-CD1 4.5Å; I133-K419 HydrophobicContact CG2-CD 4.11Å; I133-V426 HydrophobicContact CG2-CG2 3.81Å
134	P	83.8	Confident	87.4	Confident	82 Å²	82	34 Å²	34	53%	0.532	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-23.8	-175.7	-23.1	38.2	0	0	0	113.4	I396	P134-I396 HydrophobicContact CB-CD1 4.26Å; P134-I396 HydrophobicContact CG-CD1 3.79Å; P134-I396 HydrophobicContact CG-CG1 3.99Å; P134-I396 HydrophobicContact CG-CG2 3.97Å
135	Y	84	Confident	87.5	Confident	72 Å²	72	34 Å²	34	28%	0.282	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-15.7	-179.2	-57.2	-75.2	0	0	0	112.8	K132 I133 I341 I345 V392 I396	K132-Y135 PolarHBondContact O-N 3.45Å; K132-Y135 VanDerWaalsContact O-N 3.15Å; I133-Y135 VanDerWaalsContact C-N 3.28Å; I133-Y135 PolarHBondContact O-N 3.19Å; Y135-I341 HydrophobicContact CD1-CG2 4.12Å; Y135-I341 HydrophobicContact CE1-CG2 4.39Å; Y135-I345 HydrophobicContact CD2-CD1 3.65Å; Y135-I345 HydrophobicContact CE2-CD1 3.67Å; Y135-I345 HydrophobicContact CG-CD1 4.11Å; Y135-V392 WeakPolarHBondContact OH-CG1 3.47Å; Y135-I396 HydrophobicContact CD2-CD1 4.48Å; Y135-I396 HydrophobicContact CE2-CD1 3.55Å
136	S	84.3	Confident	87.5	Confident	20 Å²	20	32.5 Å²	32.5	14%	0.14	16%	0.162	C	C	.	.			trans	-110.9	128.4	-171.5	-172	0	0	0	0	113.8	K132 I133 S138 K419	K132-S136 VanDerWaalsContact O-CB 3.25Å; K132-S136 WeakPolarHBondContact O-CB 3.49Å; K132-S136 PolarHBondContact O-N 3.33Å; I133-S136 PolarHBondContact O-N 3.41Å; S136-S138 PolarHBondContact O-N 3.16Å; S136-S138 VanDerWaalsContact OG-CB 3.25Å; S136-S138 WeakPolarHBondContact OG-CB 3.44Å; S136-S138 PolarHBondContact OG-N 3.05Å; S136-S138 PolarHBondContact OG-OG 3.29Å; S136-K419 PolarHBondContact O-NZ 2.92Å
137	K	81.1	Confident	87.3	Confident	159 Å²	159	32.3 Å²	32.3	69%	0.691	16%	0.161	S	C	*	.			trans	-80.9	3	167.2	-62.5	-168.9	178.5	-172.2	0	113.3	G422	K137-G422 PolarHBondContact O-N 3.23Å
138	S	81.2	Confident	86.7	Confident	53 Å²	53	33.1 Å²	33.1	37%	0.371	17%	0.171	S	C	.	.	S	Bend	trans	-64.1	155.5	173.7	68.3	0	0	0	0	111.7	S136	S136-S138 PolarHBondContact O-N 3.16Å; S136-S138 VanDerWaalsContact OG-CB 3.25Å; S136-S138 WeakPolarHBondContact OG-CB 3.44Å; S136-S138 PolarHBondContact OG-N 3.05Å; S136-S138 PolarHBondContact OG-OG 3.29Å
139	H	83.1	Confident	86.2	Confident	104 Å²	104	39.3 Å²	39.3	48%	0.481	19%	0.194	S	C	.	.			trans	-64.7	155.7	162	72.4	-21.4	0	0	0	111	K419	H139-K419 CarbonylContact C-O 3.6Å; H139-K419 WeakPolarHBondContact CA-O 3.33Å; H139-K419 WeakPolarHBondContact CB-O 3.31Å
140	V	87.1	Confident	86.2	Confident	9 Å²	9	36.5 Å²	36.5	6%	0.055	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	138	167.8	179	0	0	0	0	107.9	I133 M142 F418 K419	I133-V140 HydrophobicContact CD1-CG1 4.41Å; I133-V140 HydrophobicContact CD1-CG2 4.48Å; I133-V140 HydrophobicContact CG1-CG2 3.92Å; V140-M142 HydrophobicContact CG1-CG 4.14Å; V140-M142 HydrophobicContact CG1-SD 4.06Å; V140-F418 WeakPolarHBondContact O-CA 3.41Å; V140-F418 WeakPolarHBondContact O-CD2 3.41Å; V140-K419 HydrophobicContact CB-CB 4.04Å; V140-K419 HydrophobicContact CG2-CB 4.49Å; V140-K419 HydrophobicContact CG2-CD 4.49Å; V140-K419 PolarHBondContact N-O 3.3Å; V140-K419 PolarHBondContact O-N 3.07Å
141	S	88.4	Confident	86.4	Confident	14 Å²	14	36.1 Å²	36.1	10%	0.098	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	109.2	178.2	-178.6	0	0	0	0	108.9	L156 W416 L417	S141-L156 WeakPolarHBondContact CB-O 3.23Å; S141-L156 PolarHBondContact O-N 3.44Å; S141-L156 VanDerWaalsContact O-N 3.07Å; S141-L156 PolarHBondContact OG-O 3.32Å; S141-W416 PolarHBondContact OG-NE1 3.49Å; S141-L417 WeakPolarHBondContact CA-O 3.4Å
142	M	90.3	Very high	86.5	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	139.5	-174.7	-69.3	176.8	57.4	0	0	111.2	N126 L130 V140 L153 D154 W416 L417	N126-M142 HydrophobicContact CB-CE 3.77Å; N126-M142 HydrophobicContact CB-SD 4.48Å; L130-M142 HydrophobicContact CD1-CE 3.73Å; L130-M142 HydrophobicContact CD1-SD 4.32Å; L130-M142 HydrophobicContact CD2-CE 4.09Å; L130-M142 HydrophobicContact CD2-SD 3.66Å; L130-M142 HydrophobicContact CG-CE 3.79Å; L130-M142 HydrophobicContact CG-SD 3.7Å; V140-M142 HydrophobicContact CG1-CG 4.14Å; V140-M142 HydrophobicContact CG1-SD 4.06Å; M142-L153 HydrophobicContact CE-CB 3.95Å; M142-L153 HydrophobicContact CE-CD1 4.42Å; M142-D154 CarbonylContact C-O 3.14Å; M142-D154 VanDerWaalsContact CA-O 3.31Å; M142-D154 WeakPolarHBondContact CA-O 3.36Å; M142-W416 WeakPolarHBondContact O-CA 3.3Å; M142-L417 PolarHBondContact N-O 3.34Å; M142-L417 PolarHBondContact O-N 3.21Å
143	A	90.1	Very high	86.6	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.008	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	140.4	166.9	0	0	0	0	0	109.5	L153 D154 L156 T414 Y415	A143-L153 WeakPolarHBondContact O-CA 3.35Å; A143-D154 PolarHBondContact N-O 3.18Å; A143-D154 PolarHBondContact O-N 3.2Å; A143-D154 VanDerWaalsContact O-N 3.07Å; A143-L156 HydrophobicContact CB-CB 4.39Å; A143-L156 HydrophobicContact CB-CD1 4.29Å; A143-T414 HydrophobicContact CB-CG2 4.38Å; A143-Y415 CarbonylContact C-O 3.42Å; A143-Y415 WeakPolarHBondContact CA-O 3.22Å
144	V	92.1	Very high	86.7	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	107.6	-179.8	-176.2	0	0	0	0	107.6	L151 L152 L153 L404 Y415 L417	V144-L151 HydrophobicContact CG1-CD2 4.06Å; V144-L152 CarbonylContact C-O 3.59Å; V144-L152 WeakPolarHBondContact CA-O 3.22Å; V144-L153 HydrophobicContact CB-CD2 3.99Å; V144-L153 HydrophobicContact CG1-CD2 3.7Å; V144-L153 HydrophobicContact CG2-CD2 3.6Å; V144-L404 HydrophobicContact CG1-CD2 4.48Å; V144-L404 HydrophobicContact CG2-CD2 4.26Å; V144-Y415 PolarHBondContact N-O 3.43Å; V144-Y415 PolarHBondContact O-N 3.11Å; V144-L417 HydrophobicContact CG2-CB 4.26Å
145	H	90.6	Very high	86.8	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	133.9	-178.7	-41.7	-85.8	0	0	0	110.2	F104 L152 T414 F447 V451	F104-H145 AromaticContact CE2-CD2 3.54Å; F104-H145 AromaticContact CE2-CE1 3.79Å; F104-H145 AromaticContact CE2-CG 3.88Å; F104-H145 AromaticContact CE2-NE2 3.51Å; F104-H145 HydrophobicContact CZ-CB 4.04Å; F104-H145 AromaticContact CZ-CD2 3.66Å; F104-H145 AromaticContact CZ-CE1 3.95Å; F104-H145 AromaticContact CZ-CG 3.52Å; F104-H145 AromaticContact CZ-ND1 3.7Å; F104-H145 AromaticContact CZ-NE2 3.96Å; H145-L152 HydrophobicContact CB-CB 4.07Å; H145-L152 PolarHBondContact N-O 2.94Å; H145-L152 PolarHBondContact O-N 3.21Å; H145-T414 VanDerWaalsContact CE1-CG2 3.4Å; H145-T414 WeakPolarHBondContact CE1-CG2 3.3Å; H145-T414 VanDerWaalsContact ND1-CG2 3.32Å; H145-T414 WeakPolarHBondContact ND1-CG2 3.17Å; H145-T414 PolarHBondContact ND1-OG1 3.11Å; H145-F447 AromaticContact CE1-CD1 3.38Å; H145-F447 WeakPolarHBondContact CE1-CD1 3.47Å; H145-F447 AromaticContact CE1-CE1 3.83Å; H145-F447 AromaticContact CE1-CG 3.57Å; H145-V451 HydrophobicContact CB-CG2 4.09Å
146	R	87.8	Confident	86.8	Confident	36 Å²	36	31.5 Å²	31.5	14%	0.136	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	115.7	-176.4	-173.6	61.9	179.1	160.9	-5.2	112.3	G148 R149 T150 K410 G412 H413	R146-G148 PolarHBondContact NE-O 3.14Å; R146-G148 PolarHBondContact NH2-O 3.38Å; R146-R149 PolarHBondContact NH1-O 3.27Å; R146-T150 PolarHBondContact NH1-O 3.49Å; R146-T150 VanDerWaalsContact NH1-O 3.07Å; R146-K410 WeakPolarHBondContact CB-O 3.19Å; R146-G412 PolarHBondContact O-N 2.93Å; R146-H413 PolarHBondContact N-O 3.34Å; R146-H413 VanDerWaalsContact N-O 3.11Å
147	V	84.5	Confident	86.5	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	109.1	-179.9	-179.3	0	0	0	0	109.3	I114 R149 T150 L152 V451 L454 L455	I114-V147 HydrophobicContact CG2-CG1 4.23Å; V147-R149 PolarHBondContact O-N 3.06Å; V147-T150 PolarHBondContact N-O 3.35Å; V147-T150 PolarHBondContact O-N 3.06Å; V147-L152 HydrophobicContact CB-CD1 4.36Å; V147-L152 HydrophobicContact CG2-CD1 4.31Å; V147-V451 HydrophobicContact CG2-CG1 4.37Å; V147-L454 HydrophobicContact CG1-CD2 4.42Å; V147-L454 HydrophobicContact CG1-CG 4.34Å; V147-L454 HydrophobicContact CG2-CD2 4.08Å; V147-L455 HydrophobicContact CG1-CD2 4.04Å
148	G	78.3	Confident	85.9	Confident	23 Å²	23	26.8 Å²	26.8	24%	0.237	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	-124.4	-174.2	0	0	0	0	0	112	R146 E411	R146-G148 PolarHBondContact NE-O 3.14Å; R146-G148 PolarHBondContact NH2-O 3.38Å; G148-E411 WeakPolarHBondContact CA-OE1 3.46Å; G148-E411 PolarHBondContact N-OE1 3.34Å
149	R	80.1	Confident	85.2	Confident	131 Å²	131	28.8 Å²	28.8	49%	0.494	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-13.2	172.5	-67.2	176.7	166.7	176.2	-5.7	114.3	G115 D116 R146 V147	G115-R149 WeakPolarHBondContact O-CB 3.47Å; D116-R149 IonicContact OD1-NH1 3.67Å; R146-R149 PolarHBondContact NH1-O 3.27Å; V147-R149 PolarHBondContact O-N 3.06Å
150	T	89.3	Confident	84.5	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	151.2	-175.6	-48.6	0	0	0	0	111.4	I114 G115 V118 D119 V121 R146 V147 L152	I114-T150 HydrophobicContact CD1-CG2 4.41Å; G115-T150 PolarHBondContact N-OG1 3.36Å; V118-T150 HydrophobicContact CG1-CG2 4.28Å; V118-T150 WeakPolarHBondContact O-CB 3.23Å; V118-T150 WeakPolarHBondContact O-CG2 3.27Å; V118-T150 PolarHBondContact O-OG1 3.18Å; D119-T150 CarbonylContact O-C 3.56Å; D119-T150 WeakPolarHBondContact O-CA 3.27Å; V121-T150 HydrophobicContact CG2-CG2 3.72Å; R146-T150 PolarHBondContact NH1-O 3.49Å; R146-T150 VanDerWaalsContact NH1-O 3.07Å; V147-T150 PolarHBondContact N-O 3.35Å; V147-T150 PolarHBondContact O-N 3.06Å; T150-L152 HydrophobicContact CG2-CD1 4.16Å
151	L	91.8	Very high	83.6	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	122	171	-66.1	174.5	0	0	0	109.5	D119 V120 V121 V144 L401 L404 K405 C408	D119-L151 PolarHBondContact O-N 3.01Å; V120-L151 CarbonylContact C-O 3.6Å; V120-L151 WeakPolarHBondContact CA-O 3.44Å; V121-L151 PolarHBondContact N-O 3.49Å; V144-L151 HydrophobicContact CG1-CD2 4.06Å; L151-L401 HydrophobicContact CD1-CD1 3.87Å; L151-L404 HydrophobicContact CD1-CB 3.74Å; L151-K405 HydrophobicContact CD1-CG 4.04Å; L151-C408 HydrophobicContact CD2-CB 4.3Å
152	L	91.8	Very high	82.5	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	125.9	173.3	-86.5	71.1	0	0	0	108.3	S103 F104 A107 V121 V144 H145 V147 T150 L454	S103-L152 WeakPolarHBondContact OG-CB 3.4Å; F104-L152 HydrophobicContact CD1-CD2 3.74Å; F104-L152 HydrophobicContact CE1-CD2 3.97Å; F104-L152 HydrophobicContact CG-CD2 4.1Å; A107-L152 HydrophobicContact CB-CD1 4.48Å; A107-L152 HydrophobicContact CB-CD2 3.93Å; A107-L152 HydrophobicContact CB-CG 4.38Å; V121-L152 HydrophobicContact CB-CG 4.27Å; V121-L152 HydrophobicContact CG2-CD1 4.45Å; V144-L152 CarbonylContact C-O 3.59Å; V144-L152 WeakPolarHBondContact CA-O 3.22Å; H145-L152 HydrophobicContact CB-CB 4.07Å; H145-L152 PolarHBondContact N-O 2.94Å; H145-L152 PolarHBondContact O-N 3.21Å; V147-L152 HydrophobicContact CB-CD1 4.36Å; V147-L152 HydrophobicContact CG2-CD1 4.31Å; T150-L152 HydrophobicContact CG2-CD1 4.16Å; L152-L454 HydrophobicContact CD1-CD2 4.38Å; L152-L454 HydrophobicContact CD2-CD2 3.47Å; L152-L454 VanDerWaalsContact CD2-CD2 3.47Å
153	L	92.1	Very high	81.3	Confident	5 Å²	5	33 Å²	33	3%	0.026	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	119.1	-174.5	-58.1	174.9	0	0	0	110.6	V120 V121 S122 I127 L130 M142 A143 V144 L404	V120-L153 HydrophobicContact CG1-CD1 3.4Å; V120-L153 VanDerWaalsContact CG1-CD1 3.4Å; V120-L153 HydrophobicContact CG1-CG 4.04Å; V121-L153 PolarHBondContact O-N 3.21Å; S122-L153 WeakPolarHBondContact CB-O 3.36Å; S122-L153 WeakPolarHBondContact OG-CB 3.26Å; S122-L153 PolarHBondContact OG-O 3.07Å; I127-L153 HydrophobicContact CD1-CD1 4.09Å; L130-L153 HydrophobicContact CD1-CD1 3.7Å; M142-L153 HydrophobicContact CE-CB 3.95Å; M142-L153 HydrophobicContact CE-CD1 4.42Å; A143-L153 WeakPolarHBondContact O-CA 3.35Å; V144-L153 HydrophobicContact CB-CD2 3.99Å; V144-L153 HydrophobicContact CG1-CD2 3.7Å; V144-L153 HydrophobicContact CG2-CD2 3.6Å; L153-L404 HydrophobicContact CD2-CD1 4.32Å
154	D	89.6	Confident	80	Confident	25 Å²	25	38.8 Å²	38.8	13%	0.134	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	152.3	176	-87.3	-39.4	0	0	0	111.7	S102 S103 M142 A143 L156	S102-D154 PolarHBondContact OG-OD2 2.73Å; S103-D154 WeakPolarHBondContact CB-OD2 3.34Å; S103-D154 PolarHBondContact N-OD1 3.08Å; S103-D154 PolarHBondContact N-OD2 2.85Å; S103-D154 VanDerWaalsContact OG-CG 3.23Å; S103-D154 PolarHBondContact OG-OD2 3.44Å; M142-D154 CarbonylContact C-O 3.14Å; M142-D154 VanDerWaalsContact CA-O 3.31Å; M142-D154 WeakPolarHBondContact CA-O 3.36Å; A143-D154 PolarHBondContact N-O 3.18Å; A143-D154 PolarHBondContact O-N 3.2Å; A143-D154 VanDerWaalsContact O-N 3.07Å; D154-L156 PolarHBondContact O-N 3.13Å
155	E	86.3	Confident	78.5	Confident	74 Å²	74	39.1 Å²	39.1	35%	0.346	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	116	176.9	176.9	-177.7	-123.1	0	0	110.9	K99 N126 K129 D157	K99-E155 IonicContact NZ-OE2 3.18Å; K99-E155 PolarHBondContact NZ-OE2 3.07Å; N126-E155 PolarHBondContact ND2-N 2.95Å; K129-E155 IonicContact NZ-OE1 2.96Å; K129-E155 PolarHBondContact NZ-OE1 3.32Å; K129-E155 IonicContact NZ-OE2 2.66Å; E155-D157 PolarHBondContact O-N 3.15Å
156	L	84	Confident	77.1	Confident	6 Å²	6	43.1 Å²	43.1	3%	0.031	21%	0.206	C	C	.	.			trans	-89	84.4	177	-166	78	0	0	0	109.5	S141 A143 D154 T158 L161 W416 L431 F447	S141-L156 WeakPolarHBondContact CB-O 3.23Å; S141-L156 PolarHBondContact O-N 3.44Å; S141-L156 VanDerWaalsContact O-N 3.07Å; S141-L156 PolarHBondContact OG-O 3.32Å; A143-L156 HydrophobicContact CB-CB 4.39Å; A143-L156 HydrophobicContact CB-CD1 4.29Å; D154-L156 PolarHBondContact O-N 3.13Å; L156-T158 PolarHBondContact O-N 2.76Å; L156-L161 HydrophobicContact CD1-CD1 3.44Å; L156-L161 VanDerWaalsContact CD1-CD1 3.44Å; L156-L161 HydrophobicContact CG-CD1 3.75Å; L156-W416 HydrophobicContact CD2-CD2 4.28Å; L156-W416 HydrophobicContact CD2-CG 3.92Å; L156-L431 HydrophobicContact CD2-CD1 4.27Å; L156-F447 HydrophobicContact CD1-CE2 4.08Å; L156-F447 HydrophobicContact CD1-CZ 3.82Å
157	D	76.4	Confident	75.6	Confident	70 Å²	70	48 Å²	48	37%	0.374	23%	0.23	S	C	.	.			trans	-69.6	93.7	175.5	-175.5	-13.2	0	0	0	110.5	E155 Q159 E160 L161	E155-D157 PolarHBondContact O-N 3.15Å; D157-Q159 PolarHBondContact O-N 3.32Å; D157-Q159 WeakPolarHBondContact OD1-CA 3.22Å; D157-Q159 WeakPolarHBondContact OD1-CB 3.44Å; D157-Q159 PolarHBondContact OD1-N 3.32Å; D157-E160 HydrophobicContact CB-CB 4.17Å; D157-E160 PolarHBondContact O-N 3.25Å; D157-E160 PolarHBondContact OD1-N 3.41Å; D157-E160 VanDerWaalsContact OD1-N 3.12Å; D157-L161 VanDerWaalsContact O-CG 3.3Å; D157-L161 WeakPolarHBondContact O-CG 3.28Å; D157-L161 PolarHBondContact O-N 2.72Å
158	T	69.5	Low	74.2	Confident	11 Å²	11	52.2 Å²	52.2	7%	0.067	26%	0.256	C	S	.	.	H	α-helix	trans	-62.4	-27.3	179.4	59.2	0	0	0	0	112.5	L156 L162 Y178 W416	L156-T158 PolarHBondContact O-N 2.76Å; T158-L162 VanDerWaalsContact O-CB 3.23Å; T158-L162 WeakPolarHBondContact O-CB 3.35Å; T158-L162 VanDerWaalsContact O-CD1 3.27Å; T158-L162 WeakPolarHBondContact O-CD1 3.19Å; T158-L162 WeakPolarHBondContact O-CG 3.48Å; T158-L162 PolarHBondContact O-N 2.92Å; T158-Y178 HydrophobicContact CG2-CD2 4.03Å; T158-Y178 HydrophobicContact CG2-CE2 3.93Å; T158-W416 HydrophobicContact CG2-CZ2 3.97Å
159	Q	66.3	Low	73.2	Confident	95 Å²	95	52.6 Å²	52.6	44%	0.444	26%	0.26	S	S	.	.	H	α-helix	trans	-71.3	-41.8	179	-61.9	-174.2	9.5	0	0	111.5	D157 R163 W186	D157-Q159 PolarHBondContact O-N 3.32Å; D157-Q159 WeakPolarHBondContact OD1-CA 3.22Å; D157-Q159 WeakPolarHBondContact OD1-CB 3.44Å; D157-Q159 PolarHBondContact OD1-N 3.32Å; Q159-R163 WeakPolarHBondContact O-CB 3.36Å; Q159-R163 PolarHBondContact O-N 3.04Å; Q159-R163 VanDerWaalsContact O-N 3.1Å; Q159-W186 HydrophobicContact CG-CH2 3.84Å; Q159-W186 HydrophobicContact CG-CZ2 4.17Å
160	E	68.6	Low	72	Confident	45 Å²	45	51.3 Å²	51.3	21%	0.21	26%	0.263	C	S	.	.	H	α-helix	trans	-69.3	-41	175.4	174.8	60.1	-175.6	0	0	111.6	D157 R163 R164	D157-E160 HydrophobicContact CB-CB 4.17Å; D157-E160 PolarHBondContact O-N 3.25Å; D157-E160 PolarHBondContact OD1-N 3.41Å; D157-E160 VanDerWaalsContact OD1-N 3.12Å; E160-R163 WeakPolarHBondContact O-CB 3.48Å; E160-R163 PolarHBondContact O-N 3.31Å; E160-R163 IonicContact OE1-CZ 3.05Å; E160-R163 IonicContact OE1-NH2 2.92Å; E160-R163 PolarHBondContact OE1-NH2 2.93Å; E160-R163 IonicContact OE2-CZ 2.73Å; E160-R163 IonicContact OE2-NE 3.74Å; E160-R163 PolarHBondContact OE2-NE 3.12Å; E160-R163 IonicContact OE2-NH2 2.72Å; E160-R163 PolarHBondContact OE2-NH2 3.03Å; E160-R164 WeakPolarHBondContact O-CG 3.5Å; E160-R164 PolarHBondContact O-N 3.1Å; E160-R164 IonicContact OE1-CZ 3.04Å; E160-R164 IonicContact OE1-NE 3.73Å; E160-R164 PolarHBondContact OE1-NE 3.47Å; E160-R164 IonicContact OE1-NH2 2.76Å; E160-R164 PolarHBondContact OE1-NH2 3.46Å; E160-R164 VanDerWaalsContact OE1-NH2 3.09Å
161	L	67.6	Low	71	Confident	23 Å²	23	52.8 Å²	52.8	12%	0.12	27%	0.268	C	S	.	.	H	α-helix	trans	-65.1	-41.1	177.8	-66.5	172.4	0	0	0	112.1	L156 D157 R163 R164 S165 W171 L174	L156-L161 HydrophobicContact CD1-CD1 3.44Å; L156-L161 VanDerWaalsContact CD1-CD1 3.44Å; L156-L161 HydrophobicContact CG-CD1 3.75Å; D157-L161 VanDerWaalsContact O-CG 3.3Å; D157-L161 WeakPolarHBondContact O-CG 3.28Å; D157-L161 PolarHBondContact O-N 2.72Å; L161-R163 VanDerWaalsContact C-N 3.3Å; L161-R163 PolarHBondContact O-N 3.27Å; L161-R164 PolarHBondContact O-N 3.46Å; L161-S165 WeakPolarHBondContact O-CB 2.76Å; L161-S165 PolarHBondContact O-N 3.03Å; L161-W171 HydrophobicContact CD1-CE3 4.46Å; L161-W171 HydrophobicContact CD1-CH2 4.24Å; L161-W171 HydrophobicContact CD1-CZ3 4.04Å; L161-W171 HydrophobicContact CD2-CD2 4.08Å; L161-W171 HydrophobicContact CD2-CE3 4.24Å; L161-W171 HydrophobicContact CD2-CH2 3.66Å; L161-W171 HydrophobicContact CD2-CZ2 3.52Å; L161-W171 HydrophobicContact CD2-CZ3 4.05Å; L161-L174 HydrophobicContact CD1-CD2 4.22Å
162	L	66.3	Low	69.8	Low	27 Å²	27	55 Å²	55	14%	0.141	28%	0.282	C	S	.	.	H	α-helix	trans	-65.4	-30.9	172.6	-71.9	168.1	0	0	0	113	T158 S165 S166 K175 W186	T158-L162 VanDerWaalsContact O-CB 3.23Å; T158-L162 WeakPolarHBondContact O-CB 3.35Å; T158-L162 VanDerWaalsContact O-CD1 3.27Å; T158-L162 WeakPolarHBondContact O-CD1 3.19Å; T158-L162 WeakPolarHBondContact O-CG 3.48Å; T158-L162 PolarHBondContact O-N 2.92Å; L162-S165 PolarHBondContact O-OG 2.97Å; L162-S166 PolarHBondContact O-N 3.39Å; L162-S166 PolarHBondContact O-OG 3.42Å; L162-K175 HydrophobicContact CD2-CB 3.46Å; L162-K175 VanDerWaalsContact CD2-CB 3.46Å; L162-K175 HydrophobicContact CD2-CD 3.86Å; L162-K175 HydrophobicContact CD2-CG 3.43Å; L162-K175 VanDerWaalsContact CD2-CG 3.43Å; L162-W186 HydrophobicContact CD1-CE3 4.34Å; L162-W186 HydrophobicContact CD1-CH2 3.43Å; L162-W186 VanDerWaalsContact CD1-CH2 3.43Å; L162-W186 HydrophobicContact CD1-CZ2 3.7Å; L162-W186 HydrophobicContact CD1-CZ3 3.79Å
163	R	65.3	Low	69	Low	121 Å²	121	55.5 Å²	55.5	46%	0.457	28%	0.284	S	S	.	.	H	α-helix	trans	-68.2	-43.4	173	-171.6	177.9	72	101.2	4.5	110.9	Q159 E160 L161 S166	Q159-R163 WeakPolarHBondContact O-CB 3.36Å; Q159-R163 PolarHBondContact O-N 3.04Å; Q159-R163 VanDerWaalsContact O-N 3.1Å; E160-R163 WeakPolarHBondContact O-CB 3.48Å; E160-R163 PolarHBondContact O-N 3.31Å; E160-R163 IonicContact OE1-CZ 3.05Å; E160-R163 IonicContact OE1-NH2 2.92Å; E160-R163 PolarHBondContact OE1-NH2 2.93Å; E160-R163 IonicContact OE2-CZ 2.73Å; E160-R163 IonicContact OE2-NE 3.74Å; E160-R163 PolarHBondContact OE2-NE 3.12Å; E160-R163 IonicContact OE2-NH2 2.72Å; E160-R163 PolarHBondContact OE2-NH2 3.03Å; L161-R163 VanDerWaalsContact C-N 3.3Å; L161-R163 PolarHBondContact O-N 3.27Å; R163-S166 PolarHBondContact O-N 3.08Å
164	R	61.2	Low	68.1	Low	122 Å²	122	55.8 Å²	55.8	46%	0.46	29%	0.285	S	S	.	.	H	α-helix	trans	-68.6	-39.9	176.2	-69	179.3	-174.1	-156	0.7	112.7	E160 L161 S166 Q167 T168	E160-R164 WeakPolarHBondContact O-CG 3.5Å; E160-R164 PolarHBondContact O-N 3.1Å; E160-R164 IonicContact OE1-CZ 3.04Å; E160-R164 IonicContact OE1-NE 3.73Å; E160-R164 PolarHBondContact OE1-NE 3.47Å; E160-R164 IonicContact OE1-NH2 2.76Å; E160-R164 PolarHBondContact OE1-NH2 3.46Å; E160-R164 VanDerWaalsContact OE1-NH2 3.09Å; L161-R164 PolarHBondContact O-N 3.46Å; R164-S166 PolarHBondContact O-N 3.34Å; R164-S166 VanDerWaalsContact O-N 3.11Å; R164-Q167 WeakPolarHBondContact O-CA 3.47Å; R164-Q167 PolarHBondContact O-N 2.94Å; R164-T168 PolarHBondContact O-N 3.31Å; R164-T168 PolarHBondContact O-OG1 3.12Å
165	S	62	Low	67.2	Low	8 Å²	8	58 Å²	58	6%	0.056	29%	0.294	C	S	.	.	H	α-helix	trans	-54.5	-33.8	175.5	97.1	0	0	0	0	111.9	L161 L162 Q167 G169	L161-S165 WeakPolarHBondContact O-CB 2.76Å; L161-S165 PolarHBondContact O-N 3.03Å; L162-S165 PolarHBondContact O-OG 2.97Å; S165-Q167 VanDerWaalsContact C-N 3.25Å; S165-Q167 PolarHBondContact O-N 2.8Å; S165-G169 WeakPolarHBondContact O-CA 3.32Å; S165-G169 PolarHBondContact O-N 3.25Å
166	S	59.9	Low	66.6	Low	83 Å²	83	59.8 Å²	59.8	58%	0.58	30%	0.302	S	S	*	.	H	α-helix	trans	-81.1	-1.3	179.8	-51.2	0	0	0	0	113.5	L162 R163 R164	L162-S166 PolarHBondContact O-N 3.39Å; L162-S166 PolarHBondContact O-OG 3.42Å; R163-S166 PolarHBondContact O-N 3.08Å; R164-S166 PolarHBondContact O-N 3.34Å; R164-S166 VanDerWaalsContact O-N 3.11Å
167	Q	56.1	Low	66.2	Low	140 Å²	140	60.5 Å²	60.5	65%	0.654	31%	0.306	S	S	*	.	H	α-helix	trans	-121.4	-40	-177.5	-67	-177.1	-28.2	0	0	112.9	R164 S165	R164-Q167 WeakPolarHBondContact O-CA 3.47Å; R164-Q167 PolarHBondContact O-N 2.94Å; S165-Q167 VanDerWaalsContact C-N 3.25Å; S165-Q167 PolarHBondContact O-N 2.8Å
168	T	55.6	Low	66.1	Low	88 Å²	88	58.4 Å²	58.4	54%	0.54	29%	0.293	S	S	.	.	H	α-helix	trans	-112.3	-14.1	-179.8	65.1	0	0	0	0	114.7	R164 D170	R164-T168 PolarHBondContact O-N 3.31Å; R164-T168 PolarHBondContact O-OG1 3.12Å; T168-D170 WeakPolarHBondContact CB-OD2 3.42Å; T168-D170 PolarHBondContact O-N 2.89Å; T168-D170 PolarHBondContact OG1-OD2 3.43Å
169	G	58.2	Low	66.3	Low	31 Å²	31	62.1 Å²	62.1	32%	0.32	31%	0.309	S	S	.	.	S	Bend	trans	83.5	-23.9	-177.8	0	0	0	0	0	115.2	S165 W171 T172	S165-G169 WeakPolarHBondContact O-CA 3.32Å; S165-G169 PolarHBondContact O-N 3.25Å; G169-W171 PolarHBondContact O-N 3.06Å; G169-T172 WeakPolarHBondContact O-CG2 3.37Å; G169-T172 PolarHBondContact O-N 3.41Å; G169-T172 PolarHBondContact O-OG1 2.98Å
170	D	54.3	Low	66.6	Low	103 Å²	103	68 Å²	68	55%	0.551	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	8	-168.9	-50.5	-58.1	0	0	0	117.4	T168	T168-D170 WeakPolarHBondContact CB-OD2 3.42Å; T168-D170 PolarHBondContact O-N 2.89Å; T168-D170 PolarHBondContact OG1-OD2 3.43Å
171	W	67.6	Low	66.7	Low	31 Å²	31	69 Å²	69	12%	0.117	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-143	21.4	-175.9	-59.6	83.6	0	0	0	113	L161 G169 L174 K175 P446 F447	L161-W171 HydrophobicContact CD1-CE3 4.46Å; L161-W171 HydrophobicContact CD1-CH2 4.24Å; L161-W171 HydrophobicContact CD1-CZ3 4.04Å; L161-W171 HydrophobicContact CD2-CD2 4.08Å; L161-W171 HydrophobicContact CD2-CE3 4.24Å; L161-W171 HydrophobicContact CD2-CH2 3.66Å; L161-W171 HydrophobicContact CD2-CZ2 3.52Å; L161-W171 HydrophobicContact CD2-CZ3 4.05Å; G169-W171 PolarHBondContact O-N 3.06Å; W171-L174 HydrophobicContact CE3-CB 4.24Å; W171-L174 HydrophobicContact CE3-CD2 3.51Å; W171-L174 HydrophobicContact CZ3-CD2 3.73Å; W171-L174 PolarHBondContact O-N 2.96Å; W171-K175 PolarHBondContact O-N 3.3Å; W171-K175 VanDerWaalsContact O-N 3.13Å; W171-P446 HydrophobicContact CD2-CG 4.34Å; W171-P446 HydrophobicContact CE3-CG 4.17Å; W171-P446 HydrophobicContact CH2-CB 4.2Å; W171-P446 HydrophobicContact CH2-CG 3.18Å; W171-P446 HydrophobicContact CZ2-CB 3.95Å; W171-P446 HydrophobicContact CZ2-CG 3.31Å; W171-P446 HydrophobicContact CZ3-CG 3.62Å; W171-F447 AromaticContact CH2-CE2 3.83Å; W171-F447 HydrophobicContact CH2-CE2 3.83Å; W171-F447 AromaticContact CH2-CZ 3.94Å; W171-F447 HydrophobicContact CH2-CZ 3.94Å; W171-F447 HydrophobicContact CZ3-CE2 4.13Å
172	T	67.9	Low	66.8	Low	48 Å²	48	70.1 Å²	70.1	29%	0.294	34%	0.34	S	S	.	.	H	α-helix	trans	-56.5	-49.5	174.8	43.3	0	0	0	0	111.9	G169 L174 K175 E176	G169-T172 WeakPolarHBondContact O-CG2 3.37Å; G169-T172 PolarHBondContact O-N 3.41Å; G169-T172 PolarHBondContact O-OG1 2.98Å; T172-L174 VanDerWaalsContact C-N 3.33Å; T172-L174 PolarHBondContact O-N 3.01Å; T172-K175 WeakPolarHBondContact O-CA 3.34Å; T172-K175 VanDerWaalsContact O-CB 3.28Å; T172-K175 WeakPolarHBondContact O-CB 3.35Å; T172-K175 PolarHBondContact O-N 3.41Å; T172-E176 PolarHBondContact O-N 2.98Å
173	W	73.8	Confident	66.7	Low	9 Å²	9	71.8 Å²	71.8	3%	0.034	35%	0.349	C	S	.	.	H	α-helix	trans	-52.8	-46.7	176.2	69.7	-85.6	0	0	0	112.6	K175 E176 I177 L431 C435 A438 C443	W173-K175 VanDerWaalsContact C-N 3.31Å; W173-K175 PolarHBondContact O-N 3.07Å; W173-E176 PolarHBondContact O-N 3.38Å; W173-I177 HydrophobicContact CE3-CD1 3.55Å; W173-I177 HydrophobicContact CZ3-CD1 3.86Å; W173-I177 WeakPolarHBondContact O-CB 3.31Å; W173-I177 VanDerWaalsContact O-CG1 3.29Å; W173-I177 WeakPolarHBondContact O-CG1 3.39Å; W173-I177 PolarHBondContact O-N 2.92Å; W173-L431 HydrophobicContact CH2-CB 4.36Å; W173-L431 HydrophobicContact CZ3-CD2 4.47Å; W173-C435 HydrophobicContact CD2-CB 4.44Å; W173-C435 HydrophobicContact CE3-CB 4.02Å; W173-C435 HydrophobicContact CH2-CB 4.14Å; W173-C435 HydrophobicContact CZ3-CB 3.87Å; W173-A438 HydrophobicContact CB-CB 4.37Å; W173-C443 HydrophobicContact CB-CB 4.36Å; W173-C443 HydrophobicContact CG-CB 4.31Å
174	L	73.3	Confident	66.2	Low	11 Å²	11	74.9 Å²	74.9	6%	0.058	37%	0.368	C	S	.	.	H	α-helix	trans	-67.4	-33.7	179.7	-174.4	64.9	0	0	0	111.7	L161 W171 T172 Y178 L431	L161-L174 HydrophobicContact CD1-CD2 4.22Å; W171-L174 HydrophobicContact CE3-CB 4.24Å; W171-L174 HydrophobicContact CE3-CD2 3.51Å; W171-L174 HydrophobicContact CZ3-CD2 3.73Å; W171-L174 PolarHBondContact O-N 2.96Å; T172-L174 VanDerWaalsContact C-N 3.33Å; T172-L174 PolarHBondContact O-N 3.01Å; L174-Y178 VanDerWaalsContact O-CB 3.27Å; L174-Y178 WeakPolarHBondContact O-CB 3.49Å; L174-Y178 PolarHBondContact O-N 2.82Å; L174-L431 HydrophobicContact CD1-CD2 3.92Å
175	K	72.2	Confident	65.6	Low	72 Å²	72	77.4 Å²	77.4	31%	0.313	38%	0.382	S	S	.	.	H	α-helix	trans	-64.7	-44.2	174.2	175.3	172.3	174.9	-170.6	0	111.6	L162 W171 T172 W173 Y178 Q179	L162-K175 HydrophobicContact CD2-CB 3.46Å; L162-K175 VanDerWaalsContact CD2-CB 3.46Å; L162-K175 HydrophobicContact CD2-CD 3.86Å; L162-K175 HydrophobicContact CD2-CG 3.43Å; L162-K175 VanDerWaalsContact CD2-CG 3.43Å; W171-K175 PolarHBondContact O-N 3.3Å; W171-K175 VanDerWaalsContact O-N 3.13Å; T172-K175 WeakPolarHBondContact O-CA 3.34Å; T172-K175 VanDerWaalsContact O-CB 3.28Å; T172-K175 WeakPolarHBondContact O-CB 3.35Å; T172-K175 PolarHBondContact O-N 3.41Å; W173-K175 VanDerWaalsContact C-N 3.31Å; W173-K175 PolarHBondContact O-N 3.07Å; K175-Y178 PolarHBondContact O-N 3.34Å; K175-Q179 WeakPolarHBondContact O-CB 3.09Å; K175-Q179 VanDerWaalsContact O-CG 3.3Å; K175-Q179 WeakPolarHBondContact O-CG 3.2Å; K175-Q179 PolarHBondContact O-N 3.33Å
176	E	73.3	Confident	65.1	Low	111 Å²	111	81.9 Å²	81.9	52%	0.519	40%	0.398	S	S	.	.	H	α-helix	trans	-66.7	-43.7	177.9	-71.1	172.6	-170.7	0	0	111.5	T172 W173 Y178 Q179 R180	T172-E176 PolarHBondContact O-N 2.98Å; W173-E176 PolarHBondContact O-N 3.38Å; E176-Y178 PolarHBondContact O-N 2.84Å; E176-Q179 PolarHBondContact O-N 3.46Å; E176-R180 WeakPolarHBondContact O-CB 3.21Å; E176-R180 PolarHBondContact O-N 3.39Å
177	I	73.9	Confident	64.7	Low	21 Å²	21	85.6 Å²	85.6	11%	0.108	41%	0.407	C	S	.	.	H	α-helix	trans	-60	-44.4	172.9	-70.1	173.5	0	0	0	111.1	W173 Q179 R180 L181 L434	W173-I177 HydrophobicContact CE3-CD1 3.55Å; W173-I177 HydrophobicContact CZ3-CD1 3.86Å; W173-I177 WeakPolarHBondContact O-CB 3.31Å; W173-I177 VanDerWaalsContact O-CG1 3.29Å; W173-I177 WeakPolarHBondContact O-CG1 3.39Å; W173-I177 PolarHBondContact O-N 2.92Å; I177-Q179 VanDerWaalsContact C-N 3.35Å; I177-Q179 PolarHBondContact O-N 3.44Å; I177-R180 PolarHBondContact O-N 3.06Å; I177-L181 HydrophobicContact CG2-CD1 3.53Å; I177-L181 HydrophobicContact CG2-CG 4.15Å; I177-L181 VanDerWaalsContact O-CB 3.3Å; I177-L181 WeakPolarHBondContact O-CB 3.27Å; I177-L181 WeakPolarHBondContact O-CG 3.31Å; I177-L181 PolarHBondContact O-N 3.13Å; I177-L434 HydrophobicContact CD1-CB 3.96Å
178	Y	75.3	Confident	64.4	Low	26 Å²	26	88.9 Å²	88.9	10%	0.102	41%	0.413	C	S	.	.	H	α-helix	trans	-59.9	-45.1	176.4	-172	-75.6	0	0	0	111.3	T158 L174 K175 E176 I182 D183 W186 W416	T158-Y178 HydrophobicContact CG2-CD2 4.03Å; T158-Y178 HydrophobicContact CG2-CE2 3.93Å; L174-Y178 VanDerWaalsContact O-CB 3.27Å; L174-Y178 WeakPolarHBondContact O-CB 3.49Å; L174-Y178 PolarHBondContact O-N 2.82Å; K175-Y178 PolarHBondContact O-N 3.34Å; E176-Y178 PolarHBondContact O-N 2.84Å; Y178-I182 HydrophobicContact CD2-CD1 3.92Å; Y178-I182 HydrophobicContact CE1-CB 4.39Å; Y178-I182 HydrophobicContact CE1-CG2 4.24Å; Y178-I182 HydrophobicContact CE2-CD1 3.87Å; Y178-I182 HydrophobicContact CE2-CG2 4.49Å; Y178-I182 HydrophobicContact CG-CD1 4.46Å; Y178-I182 WeakPolarHBondContact O-CB 3.42Å; Y178-I182 PolarHBondContact O-N 3.15Å; Y178-D183 HydrophobicContact CE1-CB 4.39Å; Y178-D183 PolarHBondContact O-N 3.36Å; Y178-W186 HydrophobicContact CD1-CE3 4.48Å; Y178-W186 HydrophobicContact CD1-CZ3 4.44Å; Y178-W186 AromaticContact CE1-CE3 3.76Å; Y178-W186 HydrophobicContact CE1-CE3 3.76Å; Y178-W186 AromaticContact CE1-CZ3 3.62Å; Y178-W186 HydrophobicContact CE1-CZ3 3.62Å; Y178-W186 AromaticContact CZ-CZ3 3.78Å; Y178-W416 AromaticContact CD2-CH2 3.69Å; Y178-W416 HydrophobicContact CD2-CH2 3.69Å; Y178-W416 HydrophobicContact CD2-CZ2 4.03Å; Y178-W416 HydrophobicContact CE2-CH2 4.27Å; Y178-W416 HydrophobicContact CE2-CZ2 4.26Å
179	Q	73.8	Confident	64.3	Low	89 Å²	89	92.2 Å²	92.2	42%	0.416	42%	0.42	S	S	.	.	H	α-helix	trans	-67.8	-36	177.9	-71.9	177.6	-4.3	0	0	112.8	K175 E176 I177	K175-Q179 WeakPolarHBondContact O-CB 3.09Å; K175-Q179 VanDerWaalsContact O-CG 3.3Å; K175-Q179 WeakPolarHBondContact O-CG 3.2Å; K175-Q179 PolarHBondContact O-N 3.33Å; E176-Q179 PolarHBondContact O-N 3.46Å; I177-Q179 VanDerWaalsContact C-N 3.35Å; I177-Q179 PolarHBondContact O-N 3.44Å
180	R	72.6	Confident	63.9	Low	219 Å²	219	100.1 Å²	100.1	83%	0.826	45%	0.445	S	S	*	.	H	α-helix	trans	-73.6	-39	178.9	-176.9	175.7	177.6	175.3	-1.7	113	E176 I177	E176-R180 WeakPolarHBondContact O-CB 3.21Å; E176-R180 PolarHBondContact O-N 3.39Å; I177-R180 PolarHBondContact O-N 3.06Å
181	L	69.9	Low	64.1	Low	65 Å²	65	102.5 Å²	102.5	34%	0.34	45%	0.451	S	S	.	.	H	α-helix	trans	-98.9	-22.2	-170.8	-62.8	-177	0	0	0	115.1	I177 Y429	I177-L181 HydrophobicContact CG2-CD1 3.53Å; I177-L181 HydrophobicContact CG2-CG 4.15Å; I177-L181 VanDerWaalsContact O-CB 3.3Å; I177-L181 WeakPolarHBondContact O-CB 3.27Å; I177-L181 WeakPolarHBondContact O-CG 3.31Å; I177-L181 PolarHBondContact O-N 3.13Å; L181-Y429 HydrophobicContact CD1-CD1 3.95Å; L181-Y429 HydrophobicContact CD1-CE1 3.69Å
182	I	70.7	Confident	63.8	Low	48 Å²	48	104.6 Å²	104.6	25%	0.246	47%	0.47	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.6	-54.4	-167	-62.9	166.2	0	0	0	113.5	Y178 W416 F418	Y178-I182 HydrophobicContact CD2-CD1 3.92Å; Y178-I182 HydrophobicContact CE1-CB 4.39Å; Y178-I182 HydrophobicContact CE1-CG2 4.24Å; Y178-I182 HydrophobicContact CE2-CD1 3.87Å; Y178-I182 HydrophobicContact CE2-CG2 4.49Å; Y178-I182 HydrophobicContact CG-CD1 4.46Å; Y178-I182 WeakPolarHBondContact O-CB 3.42Å; Y178-I182 PolarHBondContact O-N 3.15Å; I182-W416 HydrophobicContact CD1-CH2 3.21Å; I182-W416 HydrophobicContact CD1-CZ2 3.75Å; I182-W416 HydrophobicContact CD1-CZ3 3.94Å; I182-F418 HydrophobicContact CB-CE1 4.43Å; I182-F418 HydrophobicContact CD1-CD1 3.73Å; I182-F418 HydrophobicContact CD1-CD2 4.19Å; I182-F418 HydrophobicContact CD1-CE1 3.58Å; I182-F418 HydrophobicContact CD1-CE2 4.06Å; I182-F418 HydrophobicContact CD1-CG 4.04Å; I182-F418 HydrophobicContact CD1-CZ 3.76Å; I182-F418 HydrophobicContact CG1-CD1 4.14Å; I182-F418 HydrophobicContact CG1-CE1 3.81Å; I182-F418 HydrophobicContact CG1-CZ 4.3Å; I182-F418 HydrophobicContact CG2-CE1 3.72Å; I182-F418 HydrophobicContact CG2-CZ 3.68Å
183	D	64.7	Low	63.6	Low	62 Å²	62	109.7 Å²	109.7	33%	0.332	49%	0.488	S	S	.	.			trans	-151.3	116.3	-171.9	-171.2	2.4	0	0	0	113.6	Y178 K185	Y178-D183 HydrophobicContact CE1-CB 4.39Å; Y178-D183 PolarHBondContact O-N 3.36Å; D183-K185 VanDerWaalsContact C-N 3.33Å; D183-K185 PolarHBondContact OD1-N 3.27Å
184	Q	54.4	Low	63.4	Low	186 Å²	186	113.2 Å²	113.2	87%	0.869	51%	0.505	S	S	*	.	S	Bend	trans	-78.4	-11.4	175.6	-66.7	-177.2	-5.9	0	0	113.7
185	K	48.7	Very low	63.3	Low	174 Å²	174	117.3 Å²	117.3	76%	0.757	52%	0.524	S	S	*	.	S	Bend	trans	-133	60.7	-175.6	-71.8	-173.3	177.6	178.3	0	112.3	D183 Q187	D183-K185 VanDerWaalsContact C-N 3.33Å; D183-K185 PolarHBondContact OD1-N 3.27Å; K185-Q187 PolarHBondContact O-N 2.92Å
186	W	50.6	Low	63.1	Low	102 Å²	102	120.2 Å²	120.2	39%	0.386	53%	0.533	S	S	.	.			trans	-43.7	121.8	175	179.1	-103.7	0	0	0	114	Q159 L162 Y178	Q159-W186 HydrophobicContact CG-CH2 3.84Å; Q159-W186 HydrophobicContact CG-CZ2 4.17Å; L162-W186 HydrophobicContact CD1-CE3 4.34Å; L162-W186 HydrophobicContact CD1-CH2 3.43Å; L162-W186 VanDerWaalsContact CD1-CH2 3.43Å; L162-W186 HydrophobicContact CD1-CZ2 3.7Å; L162-W186 HydrophobicContact CD1-CZ3 3.79Å; Y178-W186 HydrophobicContact CD1-CE3 4.48Å; Y178-W186 HydrophobicContact CD1-CZ3 4.44Å; Y178-W186 AromaticContact CE1-CE3 3.76Å; Y178-W186 HydrophobicContact CE1-CE3 3.76Å; Y178-W186 AromaticContact CE1-CZ3 3.62Å; Y178-W186 HydrophobicContact CE1-CZ3 3.62Å; Y178-W186 AromaticContact CZ-CZ3 3.78Å
187	Q	52	Low	63.3	Low	162 Å²	162	119.4 Å²	119.4	76%	0.757	53%	0.526	S	S	*	.			trans	-129.6	131.8	178.5	-79.4	-73.3	-17.3	0	0	111.7	K185 K189	K185-Q187 PolarHBondContact O-N 2.92Å; Q187-K189 PolarHBondContact O-N 3.21Å
188	R	49.1	Very low	63.2	Low	209 Å²	209	122.9 Å²	122.9	79%	0.789	54%	0.541	S	S	*	.			trans	-84.1	102.6	-172.8	-171.4	178.8	-171.8	169.4	2.6	111.8	K190	R188-K190 PolarHBondContact O-N 2.91Å
189	K	54.3	Low	63.1	Low	158 Å²	158	124.7 Å²	124.7	69%	0.687	55%	0.55	S	S	*	.			trans	-69.7	115	170.8	-71.4	-175.2	177.7	179.1	0	110.9	Q187	Q187-K189 PolarHBondContact O-N 3.21Å
190	K	50.5	Low	63	Low	196 Å²	196	122.3 Å²	122.3	85%	0.852	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-72.2	138.5	167.3	-73.5	-178.9	177	177	0	109.6	R188	R188-K190 PolarHBondContact O-N 2.91Å
191	K	57.3	Low	63.4	Low	154 Å²	154	112.2 Å²	112.2	67%	0.67	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-65.2	137.6	168.8	-65.6	-174.6	179.8	-177.9	0	109.2
192	S	60.7	Low	63.9	Low	74 Å²	74	112.3 Å²	112.3	52%	0.517	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-64.7	148.5	-178	-177.6	0	0	0	0	112.2	E194 H195	S192-E194 PolarHBondContact O-N 3.19Å; S192-E194 PolarHBondContact OG-N 3Å; S192-H195 PolarHBondContact O-N 3.17Å
193	K	65.4	Low	64.1	Low	156 Å²	156	110.3 Å²	110.3	68%	0.678	50%	0.499	S	S	*	.	H	α-helix	trans	-55.1	-38.5	170.1	-76.9	-173.8	174.3	-176.2	0	111.1	H195 W196 Y197 Y235	K193-H195 VanDerWaalsContact C-N 3.31Å; K193-H195 PolarHBondContact O-N 2.91Å; K193-W196 PolarHBondContact O-N 3.27Å; K193-W196 VanDerWaalsContact O-N 3.13Å; K193-Y197 PolarHBondContact O-N 2.76Å; K193-Y235 PolarHBondContact NZ-OH 2.89Å
194	E	69.8	Low	64.8	Low	82 Å²	82	108.7 Å²	108.7	38%	0.383	49%	0.489	S	S	.	.	H	α-helix	trans	-57.3	-39.1	178.5	178.7	61.3	-173	0	0	113.2	S192 W196 Y197 Q198 K337	S192-E194 PolarHBondContact O-N 3.19Å; S192-E194 PolarHBondContact OG-N 3Å; E194-W196 VanDerWaalsContact C-N 3.33Å; E194-W196 PolarHBondContact O-N 2.91Å; E194-Y197 PolarHBondContact O-N 3.09Å; E194-Q198 WeakPolarHBondContact O-CG 3.45Å; E194-Q198 PolarHBondContact O-N 3.05Å; E194-Q198 PolarHBondContact OE1-NE2 2.81Å; E194-K337 IonicContact OE1-NZ 3.85Å
195	H	69.7	Low	66.1	Low	97 Å²	97	99.9 Å²	99.9	45%	0.449	45%	0.447	S	S	.	.	H	α-helix	trans	-66.7	-35.8	179.2	177.1	-65	0	0	0	111.7	S192 K193 K199	S192-H195 PolarHBondContact O-N 3.17Å; K193-H195 VanDerWaalsContact C-N 3.31Å; K193-H195 PolarHBondContact O-N 2.91Å; H195-K199 VanDerWaalsContact O-CB 3.28Å; H195-K199 WeakPolarHBondContact O-CB 3.32Å; H195-K199 PolarHBondContact O-N 2.87Å; H195-K199 VanDerWaalsContact O-N 3.15Å
196	W	69.4	Low	67.4	Low	133 Å²	133	92.6 Å²	92.6	50%	0.504	42%	0.417	S	S	.	.	H	α-helix	trans	-72.6	-38.1	175.9	-74.5	105.2	0	0	0	111.8	K193 E194 K199 A200	K193-W196 PolarHBondContact O-N 3.27Å; K193-W196 VanDerWaalsContact O-N 3.13Å; E194-W196 VanDerWaalsContact C-N 3.33Å; E194-W196 PolarHBondContact O-N 2.91Å; W196-K199 PolarHBondContact O-N 2.87Å; W196-A200 WeakPolarHBondContact O-CB 3.35Å; W196-A200 PolarHBondContact O-N 2.63Å
197	Y	76.4	Confident	68.6	Low	94 Å²	94	88.6 Å²	88.6	37%	0.369	40%	0.402	S	S	.	.	H	α-helix	trans	-60.5	-53.2	174.2	178.1	-112.5	0	0	0	112	K193 E194 K199 A200 I201	K193-Y197 PolarHBondContact O-N 2.76Å; E194-Y197 PolarHBondContact O-N 3.09Å; Y197-K199 VanDerWaalsContact C-N 3.31Å; Y197-K199 PolarHBondContact O-N 2.73Å; Y197-A200 PolarHBondContact O-N 2.95Å; Y197-A200 VanDerWaalsContact O-N 3.15Å; Y197-I201 HydrophobicContact CD1-CD1 4.19Å; Y197-I201 HydrophobicContact CD2-CD1 4.18Å; Y197-I201 HydrophobicContact CE1-CD1 3.64Å; Y197-I201 HydrophobicContact CE2-CD1 3.64Å; Y197-I201 HydrophobicContact CE2-CG1 4.39Å; Y197-I201 HydrophobicContact CG-CD1 4.43Å; Y197-I201 PolarHBondContact O-N 2.77Å
198	Q	71.8	Confident	69.7	Low	94 Å²	94	81.1 Å²	81.1	44%	0.439	37%	0.366	S	S	.	.	H	α-helix	trans	-59.6	-40	177.2	-70.9	178.4	-4.4	0	0	112.4	E194 I201 L202	E194-Q198 WeakPolarHBondContact O-CG 3.45Å; E194-Q198 PolarHBondContact O-N 3.05Å; E194-Q198 PolarHBondContact OE1-NE2 2.81Å; Q198-I201 PolarHBondContact O-N 2.89Å; Q198-L202 WeakPolarHBondContact O-CB 3.19Å; Q198-L202 PolarHBondContact O-N 3.4Å
199	K	72.8	Confident	71	Confident	65 Å²	65	71.1 Å²	71.1	28%	0.283	33%	0.329	S	S	.	.	H	α-helix	trans	-64.4	-39.4	176.4	-177	166.1	-179.2	161	0	112.6	V91 H195 W196 Y197 S203	V91-K199 WeakPolarHBondContact O-CE 3.3Å; V91-K199 PolarHBondContact O-NZ 2.69Å; H195-K199 VanDerWaalsContact O-CB 3.28Å; H195-K199 WeakPolarHBondContact O-CB 3.32Å; H195-K199 PolarHBondContact O-N 2.87Å; H195-K199 VanDerWaalsContact O-N 3.15Å; W196-K199 PolarHBondContact O-N 2.87Å; Y197-K199 VanDerWaalsContact C-N 3.31Å; Y197-K199 PolarHBondContact O-N 2.73Å; K199-S203 WeakPolarHBondContact O-CB 3.22Å; K199-S203 PolarHBondContact O-N 3.22Å
200	A	72.6	Confident	71.9	Confident	38 Å²	38	65 Å²	65	31%	0.314	30%	0.303	S	S	.	.	H	α-helix	trans	-65.6	-44.4	177	0	0	0	0	0	111.9	W196 Y197 S203 K204	W196-A200 WeakPolarHBondContact O-CB 3.35Å; W196-A200 PolarHBondContact O-N 2.63Å; Y197-A200 PolarHBondContact O-N 2.95Å; Y197-A200 VanDerWaalsContact O-N 3.15Å; A200-S203 PolarHBondContact O-N 2.69Å; A200-K204 WeakPolarHBondContact O-CG 3.29Å; A200-K204 PolarHBondContact O-N 2.77Å; A200-K204 VanDerWaalsContact O-N 3.12Å
201	I	81.4	Confident	72.7	Confident	7 Å²	7	58.7 Å²	58.7	4%	0.036	28%	0.279	C	S	.	.	H	α-helix	trans	-67.1	-47.7	179.1	-64.6	-178.9	0	0	0	111.3	L70 Y197 Q198 S203 K204 F205 L332	L70-I201 HydrophobicContact CB-CG2 3.65Å; L70-I201 HydrophobicContact CD1-CG2 3.91Å; L70-I201 HydrophobicContact CG-CG2 4.46Å; Y197-I201 HydrophobicContact CD1-CD1 4.19Å; Y197-I201 HydrophobicContact CD2-CD1 4.18Å; Y197-I201 HydrophobicContact CE1-CD1 3.64Å; Y197-I201 HydrophobicContact CE2-CD1 3.64Å; Y197-I201 HydrophobicContact CE2-CG1 4.39Å; Y197-I201 HydrophobicContact CG-CD1 4.43Å; Y197-I201 PolarHBondContact O-N 2.77Å; Q198-I201 PolarHBondContact O-N 2.89Å; I201-S203 PolarHBondContact O-N 2.85Å; I201-K204 PolarHBondContact O-N 3.31Å; I201-K204 VanDerWaalsContact O-N 3.08Å; I201-F205 PolarHBondContact O-N 3.31Å; I201-L332 HydrophobicContact CG2-CD2 3.64Å
202	L	80.2	Confident	72.8	Confident	67 Å²	67	52.1 Å²	52.1	35%	0.351	25%	0.254	S	S	.	.	H	α-helix	trans	-54	-42.5	177.2	172.1	63.5	0	0	0	111.7	Q198 F205 L206 L332	Q198-L202 WeakPolarHBondContact O-CB 3.19Å; Q198-L202 PolarHBondContact O-N 3.4Å; L202-F205 HydrophobicContact CD1-CD1 4.38Å; L202-F205 WeakPolarHBondContact O-CB 3.11Å; L202-L206 HydrophobicContact CG-CD1 4.45Å; L202-L206 WeakPolarHBondContact O-CG 3.28Å; L202-L206 PolarHBondContact O-N 2.78Å; L202-L206 VanDerWaalsContact O-N 3.11Å; L202-L332 HydrophobicContact CB-CD2 4.48Å; L202-L332 HydrophobicContact CD1-CB 3.81Å
203	S	74.1	Confident	72.4	Confident	7 Å²	7	50.7 Å²	50.7	5%	0.049	24%	0.241	C	C	.	.	H	α-helix	trans	-73.6	-32	-179	-167.3	0	0	0	0	112.3	W77 L92 K199 A200 I201 L206 Y207	W77-S203 WeakPolarHBondContact CH2-O 3.31Å; W77-S203 VanDerWaalsContact CZ3-O 3.3Å; W77-S203 WeakPolarHBondContact CZ3-O 3.48Å; L92-S203 WeakPolarHBondContact CD2-OG 3.31Å; L92-S203 WeakPolarHBondContact CG-OG 3.44Å; K199-S203 WeakPolarHBondContact O-CB 3.22Å; K199-S203 PolarHBondContact O-N 3.22Å; A200-S203 PolarHBondContact O-N 2.69Å; I201-S203 PolarHBondContact O-N 2.85Å; S203-L206 PolarHBondContact O-N 3.28Å; S203-Y207 PolarHBondContact O-N 3Å; S203-Y207 VanDerWaalsContact O-N 3.11Å
204	K	79.6	Confident	71.7	Confident	28 Å²	28	47.6 Å²	47.6	12%	0.122	25%	0.254	C	S	.	.	H	α-helix	trans	-65.9	-44.4	174	-74.1	172.1	179.2	178.1	0	111	L70 K71 W77 A200 I201 L206 Y207 Y208	L70-K204 WeakPolarHBondContact O-CD 3.28Å; K71-K204 PolarHBondContact O-NZ 2.85Å; W77-K204 HydrophobicContact CD2-CG 4.1Å; W77-K204 HydrophobicContact CE3-CG 4.15Å; W77-K204 HydrophobicContact CH2-CB 4.11Å; W77-K204 HydrophobicContact CH2-CG 3.48Å; W77-K204 VanDerWaalsContact CH2-CG 3.48Å; W77-K204 HydrophobicContact CZ2-CB 4.47Å; W77-K204 HydrophobicContact CZ2-CD 4.41Å; W77-K204 HydrophobicContact CZ2-CG 3.4Å; W77-K204 VanDerWaalsContact CZ3-CA 3.49Å; W77-K204 HydrophobicContact CZ3-CB 4.28Å; W77-K204 HydrophobicContact CZ3-CG 3.87Å; A200-K204 WeakPolarHBondContact O-CG 3.29Å; A200-K204 PolarHBondContact O-N 2.77Å; A200-K204 VanDerWaalsContact O-N 3.12Å; I201-K204 PolarHBondContact O-N 3.31Å; I201-K204 VanDerWaalsContact O-N 3.08Å; K204-L206 VanDerWaalsContact C-N 3.31Å; K204-L206 PolarHBondContact O-N 2.98Å; K204-Y207 PolarHBondContact O-N 3.29Å; K204-Y207 VanDerWaalsContact O-N 3.12Å; K204-Y208 HydrophobicContact CB-CD2 4.5Å; K204-Y208 HydrophobicContact CB-CE2 4.39Å; K204-Y208 WeakPolarHBondContact O-CD2 3.32Å; K204-Y208 PolarHBondContact O-N 2.93Å
205	F	82	Confident	70.7	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-52.7	-47.2	171.5	164.3	-100.2	0	0	0	112.1	L64 L70 I201 L202 Y207 Y208 S209 L330 L332 C362 Y372	L64-F205 HydrophobicContact CD1-CD2 3.98Å; L64-F205 HydrophobicContact CD1-CE2 4.49Å; L70-F205 HydrophobicContact CD1-CB 4Å; L70-F205 HydrophobicContact CD1-CD2 4.43Å; L70-F205 HydrophobicContact CD2-CB 3.97Å; I201-F205 PolarHBondContact O-N 3.31Å; L202-F205 HydrophobicContact CD1-CD1 4.38Å; L202-F205 WeakPolarHBondContact O-CB 3.11Å; F205-Y207 PolarHBondContact O-N 2.85Å; F205-Y208 PolarHBondContact O-N 3.33Å; F205-S209 VanDerWaalsContact O-CB 3.31Å; F205-S209 WeakPolarHBondContact O-CB 3.33Å; F205-S209 PolarHBondContact O-N 3.25Å; F205-S209 PolarHBondContact O-OG 3.08Å; F205-L330 HydrophobicContact CE1-CB 4.04Å; F205-L330 HydrophobicContact CZ-CB 4.25Å; F205-L332 HydrophobicContact CB-CD1 4.42Å; F205-L332 HydrophobicContact CB-CD2 3.99Å; F205-L332 HydrophobicContact CD1-CB 3.89Å; F205-L332 HydrophobicContact CD2-CD1 3.95Å; F205-L332 HydrophobicContact CE1-CB 4.18Å; F205-L332 HydrophobicContact CE2-CD1 4.36Å; F205-L332 HydrophobicContact CG-CB 4.19Å; F205-L332 HydrophobicContact CG-CD1 4.05Å; F205-L332 HydrophobicContact CG-CD2 4.31Å; F205-L332 HydrophobicContact CG-CG 4.4Å; F205-C362 HydrophobicContact CD2-CB 4.28Å; F205-C362 HydrophobicContact CE2-CB 3.37Å; F205-C362 VanDerWaalsContact CE2-SG 3.56Å; F205-C362 HydrophobicContact CZ-CB 3.59Å; F205-Y372 HydrophobicContact CE2-CE1 4.16Å; F205-Y372 HydrophobicContact CZ-CE1 4.46Å
206	L	76.4	Confident	69.6	Low	22 Å²	22	41.8 Å²	41.8	12%	0.115	24%	0.236	C	C	.	.	H	α-helix	trans	-64.1	-36.9	177.4	-71.8	169.3	0	0	0	112.9	V91 L202 S203 K204 S209 I210 F320	V91-L206 HydrophobicContact CG1-CD1 4.04Å; L202-L206 HydrophobicContact CG-CD1 4.45Å; L202-L206 WeakPolarHBondContact O-CG 3.28Å; L202-L206 PolarHBondContact O-N 2.78Å; L202-L206 VanDerWaalsContact O-N 3.11Å; S203-L206 PolarHBondContact O-N 3.28Å; K204-L206 VanDerWaalsContact C-N 3.31Å; K204-L206 PolarHBondContact O-N 2.98Å; L206-S209 PolarHBondContact O-N 2.97Å; L206-I210 WeakPolarHBondContact O-CD1 3.36Å; L206-I210 VanDerWaalsContact O-CG1 3.3Å; L206-I210 WeakPolarHBondContact O-CG1 3.39Å; L206-I210 PolarHBondContact O-N 3.38Å; L206-F320 HydrophobicContact CD2-CE2 4.5Å; L206-F320 HydrophobicContact CD2-CZ 4.35Å
207	Y	74.1	Confident	68.5	Low	18 Å²	18	43.6 Å²	43.6	7%	0.071	25%	0.25	C	S	.	.	H	α-helix	trans	-66.8	-49.6	175.8	-173.8	-77.4	0	0	0	111.8	P74 A75 W77 L84 S203 K204 F205 S209 I210 N211	P74-Y207 HydrophobicContact CB-CD1 3.44Å; P74-Y207 VanDerWaalsContact CB-CD1 3.44Å; P74-Y207 HydrophobicContact CB-CE1 3.46Å; P74-Y207 VanDerWaalsContact CB-CE1 3.46Å; P74-Y207 HydrophobicContact CB-CG 4.38Å; P74-Y207 HydrophobicContact CG-CD1 3.52Å; P74-Y207 HydrophobicContact CG-CE1 4.08Å; P74-Y207 HydrophobicContact CG-CG 4.1Å; A75-Y207 PolarHBondContact O-OH 3Å; A75-Y207 VanDerWaalsContact O-OH 3.1Å; W77-Y207 HydrophobicContact CE3-CD2 4.03Å; W77-Y207 AromaticContact CE3-CG 3.99Å; W77-Y207 HydrophobicContact CE3-CG 3.99Å; W77-Y207 HydrophobicContact CZ3-CD2 4.35Å; W77-Y207 HydrophobicContact CZ3-CG 4.22Å; L84-Y207 HydrophobicContact CD2-CD2 4.23Å; S203-Y207 PolarHBondContact O-N 3Å; S203-Y207 VanDerWaalsContact O-N 3.11Å; K204-Y207 PolarHBondContact O-N 3.29Å; K204-Y207 VanDerWaalsContact O-N 3.12Å; F205-Y207 PolarHBondContact O-N 2.85Å; Y207-S209 VanDerWaalsContact C-N 3.28Å; Y207-S209 PolarHBondContact O-N 2.84Å; Y207-I210 PolarHBondContact O-N 2.85Å; Y207-I210 VanDerWaalsContact O-N 3.09Å; Y207-N211 HydrophobicContact CD1-CB 4.35Å; Y207-N211 HydrophobicContact CE1-CB 4.12Å; Y207-N211 WeakPolarHBondContact O-CB 3.09Å; Y207-N211 PolarHBondContact O-N 2.94Å; Y207-N211 PolarHBondContact O-OD1 3.39Å
208	Y	75.6	Confident	67	Low	4 Å²	4	43.6 Å²	43.6	2%	0.016	26%	0.262	C	S	.	.	H	α-helix	trans	-59.6	-39.5	175.2	-69.8	-61.2	0	0	0	111.8	L70 L72 P74 K204 F205 I210 N211 G212 A215 A216	L70-Y208 HydrophobicContact CD2-CD2 3.82Å; L70-Y208 HydrophobicContact CD2-CE2 4.23Å; L72-Y208 PolarHBondContact O-OH 3.18Å; P74-Y208 HydrophobicContact CB-CD1 4.28Å; P74-Y208 HydrophobicContact CB-CE1 3.75Å; P74-Y208 HydrophobicContact CG-CD1 4.06Å; P74-Y208 HydrophobicContact CG-CD2 4.14Å; P74-Y208 HydrophobicContact CG-CE1 3.66Å; P74-Y208 HydrophobicContact CG-CE2 3.75Å; P74-Y208 HydrophobicContact CG-CG 4.28Å; K204-Y208 HydrophobicContact CB-CD2 4.5Å; K204-Y208 HydrophobicContact CB-CE2 4.39Å; K204-Y208 WeakPolarHBondContact O-CD2 3.32Å; K204-Y208 PolarHBondContact O-N 2.93Å; F205-Y208 PolarHBondContact O-N 3.33Å; Y208-I210 PolarHBondContact O-N 3.14Å; Y208-N211 PolarHBondContact O-N 2.97Å; Y208-G212 WeakPolarHBondContact O-CA 3.19Å; Y208-G212 PolarHBondContact O-N 3.32Å; Y208-A215 HydrophobicContact CE1-CB 4.45Å; Y208-A216 HydrophobicContact CD1-CB 4.09Å; Y208-A216 HydrophobicContact CE1-CB 3.67Å
209	S	76.6	Confident	65.7	Low	0 Å²	0	42.5 Å²	42.5	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-64.9	-20.1	176.9	-56.2	0	0	0	0	113.9	Y61 A62 F205 L206 Y207	Y61-S209 CarbonylContact C-O 3.47Å; Y61-S209 VanDerWaalsContact CA-O 3.29Å; Y61-S209 WeakPolarHBondContact CA-O 3.37Å; A62-S209 PolarHBondContact N-O 2.8Å; F205-S209 VanDerWaalsContact O-CB 3.31Å; F205-S209 WeakPolarHBondContact O-CB 3.33Å; F205-S209 PolarHBondContact O-N 3.25Å; F205-S209 PolarHBondContact O-OG 3.08Å; L206-S209 PolarHBondContact O-N 2.97Å; Y207-S209 VanDerWaalsContact C-N 3.28Å; Y207-S209 PolarHBondContact O-N 2.84Å
210	I	72.8	Confident	64.1	Low	29 Å²	29	43.9 Å²	43.9	15%	0.149	28%	0.275	C	S	.	.	H	α-helix	trans	-95.7	-41.9	178.3	-72.1	167.7	0	0	0	111.4	L84 L206 Y207 Y208 F298 F320	L84-I210 HydrophobicContact CD1-CD1 3.46Å; L84-I210 VanDerWaalsContact CD1-CD1 3.46Å; L206-I210 WeakPolarHBondContact O-CD1 3.36Å; L206-I210 VanDerWaalsContact O-CG1 3.3Å; L206-I210 WeakPolarHBondContact O-CG1 3.39Å; L206-I210 PolarHBondContact O-N 3.38Å; Y207-I210 PolarHBondContact O-N 2.85Å; Y207-I210 VanDerWaalsContact O-N 3.09Å; Y208-I210 PolarHBondContact O-N 3.14Å; I210-F298 HydrophobicContact CD1-CZ 4.29Å; I210-F320 HydrophobicContact CD1-CE1 4.1Å; I210-F320 HydrophobicContact CD1-CZ 4.34Å; I210-F320 HydrophobicContact CG1-CE1 3.67Å; I210-F320 HydrophobicContact CG1-CZ 4.26Å
211	N	68.4	Low	62.5	Low	64 Å²	64	48.7 Å²	48.7	34%	0.342	29%	0.291	S	S	.	.	H	α-helix	trans	-91.7	-15.8	-172.6	-78.4	82.1	0	0	0	114.2	N81 Y207 Y208	N81-N211 PolarHBondContact ND2-ND2 3.18Å; N81-N211 PolarHBondContact ND2-OD1 3.3Å; Y207-N211 HydrophobicContact CD1-CB 4.35Å; Y207-N211 HydrophobicContact CE1-CB 4.12Å; Y207-N211 WeakPolarHBondContact O-CB 3.09Å; Y207-N211 PolarHBondContact O-N 2.94Å; Y207-N211 PolarHBondContact O-OD1 3.39Å; Y208-N211 PolarHBondContact O-N 2.97Å
212	G	59.8	Low	60.4	Low	15 Å²	15	55.9 Å²	55.9	16%	0.155	33%	0.33	C	S	.	.			trans	84.3	168	-179.9	0	0	0	0	0	115	Y208 G214	Y208-G212 WeakPolarHBondContact O-CA 3.19Å; Y208-G212 PolarHBondContact O-N 3.32Å; G212-G214 PolarHBondContact O-N 3.29Å
213	D	50.6	Low	58.7	Low	45 Å²	45	60.1 Å²	60.1	24%	0.241	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-60.6	-16.1	-175.4	-93.1	-0.5	0	0	0	114.8	Q65 A215 A216	Q65-D213 WeakPolarHBondContact CG-OD2 2.98Å; Q65-D213 PolarHBondContact NE2-OD2 3.14Å; D213-A215 PolarHBondContact O-N 3.25Å; D213-A216 PolarHBondContact O-N 3Å
214	G	51.6	Low	57.1	Low	91 Å²	91	65.9 Å²	65.9	94%	0.938	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-63.5	4.4	-180	0	0	0	0	0	115.8	G212	G212-G214 PolarHBondContact O-N 3.29Å
215	A	48.4	Very low	55	Low	36 Å²	36	73.8 Å²	73.8	30%	0.298	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-123.4	3.4	176.2	0	0	0	0	0	114.1	Y208 D213	Y208-A215 HydrophobicContact CE1-CB 4.45Å; D213-A215 PolarHBondContact O-N 3.25Å
216	A	47.8	Very low	52.8	Low	20 Å²	20	82.9 Å²	82.9	17%	0.165	46%	0.458	C	S	.	.			trans	-116.8	122.4	177.1	0	0	0	0	0	110.1	T68 Y208 D213	T68-A216 HydrophobicContact CG2-CB 4.19Å; Y208-A216 HydrophobicContact CD1-CB 4.09Å; Y208-A216 HydrophobicContact CE1-CB 3.67Å; D213-A216 PolarHBondContact O-N 3Å
217	E	45.9	Very low	50.7	Low	172 Å²	172	90 Å²	90	80%	0.804	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-78.8	126.5	169.5	-68.4	-172.7	162.6	0	0	109.3
218	P	43.9	Very low	49	Very low	94 Å²	94	98.3 Å²	98.3	61%	0.61	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-74.1	139.5	175.1	30.2	-33.5	0	0	0	110.5	T220	P218-T220 PolarHBondContact O-N 3.01Å
219	V	45.3	Very low	46.9	Very low	71 Å²	71	106.5 Å²	106.5	43%	0.43	57%	0.574	S	S	.	*	P	Polyproline II helix	trans	-72.6	118.9	176.2	-175.9	0	0	0	0	109.4
220	T	38.3	Very low	44.6	Very low	94 Å²	94	113.7 Å²	113.7	58%	0.577	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-69.6	146.3	171.7	45.9	0	0	0	0	111.1	P218 D222	P218-T220 PolarHBondContact O-N 3.01Å; T220-D222 PolarHBondContact O-N 3.05Å
221	E	40.2	Very low	42.5	Very low	139 Å²	139	116.2 Å²	116.2	65%	0.65	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-64.5	-11.3	-171.6	-83.7	170.7	159.5	0	0	115.4	K67 M223	K67-E221 IonicContact NZ-OE1 2.66Å; K67-E221 PolarHBondContact NZ-OE1 2.75Å; E221-M223 VanDerWaalsContact C-N 3.27Å; E221-M223 PolarHBondContact O-N 3.44Å
222	D	37.9	Very low	40.6	Very low	157 Å²	157	118.2 Å²	118.2	84%	0.84	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-76.2	4.5	-177.6	-59.4	-34.7	0	0	0	115.6	T220	T220-D222 PolarHBondContact O-N 3.05Å
223	M	42.9	Very low	39.3	Very low	157 Å²	157	126.9 Å²	126.9	77%	0.773	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-114.6	19.2	-176.6	-60.5	-163.6	107.4	0	0	115.1	E221	E221-M223 VanDerWaalsContact C-N 3.27Å; E221-M223 PolarHBondContact O-N 3.44Å
224	I	40.3	Very low	38.1	Very low	128 Å²	128	134.3 Å²	134.3	66%	0.656	74%	0.741	S	S	*	*	S	Bend	trans	-100.3	-11.8	-172.7	-65.2	177	0	0	0	113.8
225	E	36.6	Very low	36.8	Very low	193 Å²	193	139.1 Å²	139.1	90%	0.902	73%	0.732	S	S	*	*	S	Bend	trans	-101.1	3.3	-165.6	-66.2	-161.1	153.5	0	0	118.3
226	E	34.5	Very low	35.7	Very low	192 Å²	192	143 Å²	143	90%	0.897	76%	0.757	S	S	*	*	S	Bend	trans	-108.2	-0.5	-172.8	-71.3	-162.3	155.8	0	0	117.9
227	D	33.1	Very low	34.6	Very low	170 Å²	170	147 Å²	147	91%	0.909	78%	0.784	S	S	*	*			trans	-109.6	17.6	-173.2	-94.6	-21.8	0	0	0	115.9
228	E	37.9	Very low	33.6	Very low	194 Å²	194	144.1 Å²	144.1	91%	0.907	78%	0.783	S	S	*	*			trans	-103.8	64.7	168.1	-75.9	-156	162.6	0	0	113.3
229	E	32.9	Very low	32.7	Very low	176 Å²	176	151.6 Å²	151.6	82%	0.822	80%	0.799	S	S	*	*	S	Bend	trans	-164.6	144.2	145.2	-117.7	176.1	-157.8	0	0	115
230	N	28.6	Very low	32	Very low	150 Å²	150	154.3 Å²	154.3	80%	0.802	82%	0.818	S	S	*	*			trans	69.6	104.9	170.3	-59.6	-59	0	0	0	119.1
231	G	28.2	Very low	31.3	Very low	82 Å²	82	153.7 Å²	153.7	85%	0.845	82%	0.822	S	S	*	*			trans	-98.7	138.7	162.5	0	0	0	0	0	113.2
232	A	28.4	Very low	30.6	Very low	106 Å²	106	152.8 Å²	152.8	88%	0.876	83%	0.826	S	S	*	*			trans	-160.4	154.6	150.6	0	0	0	0	0	109.6
233	E	31.4	Very low	29.9	Very low	198 Å²	198	155.3 Å²	155.3	93%	0.925	83%	0.83	S	S	*	*			trans	-76.9	134.4	-170	-52.7	175	138.3	0	0	113.5
234	E	25.5	Very low	29	Very low	200 Å²	200	153.5 Å²	153.5	94%	0.935	83%	0.828	S	S	*	*			trans	-155.6	148.4	130.3	-133.4	177.1	-178.8	0	0	113.5
235	Y	25.6	Very low	28.2	Very low	192 Å²	192	153.4 Å²	153.4	75%	0.753	84%	0.839	S	S	*	*			trans	-94.5	116.1	-172.7	-144.9	-96.2	0	0	0	110.1	K193	K193-Y235 PolarHBondContact NZ-OH 2.89Å
236	S	23.5	Very low	27.6	Very low	117 Å²	117	148.6 Å²	148.6	82%	0.818	83%	0.832	S	S	*	*			trans	-134.3	124.1	168.7	-171	0	0	0	0	112.8
237	S	26.4	Very low	26.9	Very low	105 Å²	105	148.1 Å²	148.1	73%	0.734	83%	0.832	S	S	*	*			trans	-104.5	126.8	-176.8	55.7	0	0	0	0	110.6
238	S	24.8	Very low	26.5	Very low	111 Å²	111	144.5 Å²	144.5	78%	0.776	82%	0.82	S	S	*	*			trans	-155.8	103.8	160.5	38.3	0	0	0	0	113.6
239	W	24.4	Very low	25.8	Very low	252 Å²	252	144.2 Å²	144.2	96%	0.955	82%	0.819	S	S	*	*			trans	-105.6	133.9	141.6	-82.9	74.6	0	0	0	106.1
240	P	30.7	Very low	25.5	Very low	128 Å²	128	139.6 Å²	139.6	83%	0.831	81%	0.811	S	S	*	*			trans	-73.4	153.7	-173.1	29.8	-35	0	0	0	112.3
241	A	23.4	Very low	25.3	Very low	80 Å²	80	141.1 Å²	141.1	66%	0.661	81%	0.813	S	S	*	*			trans	-109.1	155.2	-174.4	0	0	0	0	0	112.7
242	T	25.1	Very low	25.1	Very low	120 Å²	120	145.5 Å²	145.5	74%	0.736	81%	0.812	S	S	*	*			trans	54.3	135.9	147.6	50.1	0	0	0	0	120.8
243	F	23	Very low	24.9	Very low	211 Å²	211	143.8 Å²	143.8	93%	0.925	80%	0.797	S	S	*	*				-134.6	141.4	127.7	-114.7	-82.4	0	0	0	111.6
244	T	25	Very low	24.5	Very low	119 Å²	119	143.4 Å²	143.4	73%	0.73	80%	0.795	S	S	*	*			trans	-100.9	161.2	-179.7	44.6	0	0	0	0	110.9
245	S	23.8	Very low	24.5	Very low	125 Å²	125	139.9 Å²	139.9	87%	0.874	79%	0.787	S	S	*	*			trans	-158.3	156.7	140.4	-157.7	0	0	0	0	111.7
246	A	23	Very low	24.7	Very low	92 Å²	92	136.5 Å²	136.5	76%	0.76	79%	0.789	S	S	*	*			trans	-126.7	-175.5	-177.3	0	0	0	0	0	111.5
247	M	21.3	Very low	24.7	Very low	183 Å²	183	140.1 Å²	140.1	90%	0.901	79%	0.79	S	S	*	*			trans	-63.3	170.6	-178.4	-50.2	175.2	177.6	0	0	112.7
248	S	24.2	Very low	24.5	Very low	93 Å²	93	143.1 Å²	143.1	65%	0.65	79%	0.792	S	S	*	*			cis	-162.3	178.1	27.2	-48.5	0	0	0	0	113.2
249	E	22.4	Very low	24.4	Very low	189 Å²	189	145.7 Å²	145.7	88%	0.883	79%	0.792	S	S	*	*			trans	72	145.4	156.3	-68.8	171.4	-168.8	0	0	119.3
250	A	26.1	Very low	24.3	Very low	79 Å²	79	139.5 Å²	139.5	65%	0.653	79%	0.787	S	S	*	*			cis	-166	155.6	-18.1	0	0	0	0	0	110.4
251	E	25.2	Very low	23.9	Very low	182 Å²	182	139.8 Å²	139.8	85%	0.85	79%	0.786	S	S	*	*			trans	48.3	152.7	152.8	-66.5	176.8	173.6	0	0	120.7
252	E	24.2	Very low	24.8	Very low	174 Å²	174	141.1 Å²	141.1	81%	0.813	79%	0.788	S	S	*	*			cis	-157.4	163.2	6	-140.9	-171.9	179.9	0	0	112
253	A	23.2	Very low	24.8	Very low	69 Å²	69	141 Å²	141	57%	0.57	79%	0.787	S	S	*	*			trans	84.8	125.2	140.8	0	0	0	0	0	125.5
254	H	23.8	Very low	24.9	Very low	191 Å²	191	137.7 Å²	137.7	88%	0.884	78%	0.779	S	S	*	*			trans	87.9	135.9	145.8	-60.8	-46.5	0	0	0	124.5
255	T	26.5	Very low	24.8	Very low	126 Å²	126	143.5 Å²	143.5	77%	0.773	79%	0.787	S	S	*	*			trans	-118.2	162.4	174.1	57.5	0	0	0	0	109.5
256	P	28.3	Very low	24.7	Very low	121 Å²	121	144 Å²	144	79%	0.786	78%	0.78	S	S	*	*				-141.9	150.7	89.5	22.2	0.8	0	0	0	113.6
257	K	23.2	Very low	24.7	Very low	193 Å²	193	148.7 Å²	148.7	84%	0.839	78%	0.784	S	S	*	*				63.8	110.9	72.5	-84.1	-164.2	177.8	-171.9	0	117.9
258	Q	24	Very low	24.7	Very low	167 Å²	167	144.7 Å²	144.7	78%	0.78	78%	0.78	S	S	*	*			trans	145.9	112.9	130.2	-82.1	-162.1	-70.7	0	0	111.3
259	E	21.4	Very low	24.6	Very low	166 Å²	166	148.3 Å²	148.3	78%	0.776	79%	0.791	S	S	*	*				84	111.2	76.8	-81.5	-175.6	145.7	0	0	115.1
260	S	23.2	Very low	24.6	Very low	121 Å²	121	142.4 Å²	142.4	85%	0.846	78%	0.781	S	S	*	*			trans	-160.7	134.8	143.8	59.3	0	0	0	0	111.2
261	V	21.6	Very low	24.4	Very low	135 Å²	135	147.9 Å²	147.9	82%	0.818	79%	0.793	S	S	*	*			trans	-159.3	164.4	-170.8	-176.9	0	0	0	0	106
262	P	43.4	Very low	24.3	Very low	108 Å²	108	145.6 Å²	145.6	70%	0.701	79%	0.791	S	S	*	*			cis	-119.5	-166.2	-32.3	29.5	-9.4	0	0	0	113
263	V	24.9	Very low	24.1	Very low	116 Å²	116	144.1 Å²	144.1	70%	0.703	79%	0.794	S	S	*	*				155.7	123.9	119.1	166.7	0	0	0	0	114.2
264	D	23.5	Very low	24.1	Very low	143 Å²	143	146.3 Å²	146.3	77%	0.765	81%	0.805	S	S	*	*			trans	31.6	141	147.8	-53.4	-11.1	0	0	0	124.4
265	R	23.7	Very low	24	Very low	241 Å²	241	143.4 Å²	143.4	91%	0.909	80%	0.8	S	S	*	*				-175.8	157.3	83.1	-131.8	167.3	-177.4	179.2	-1	116.3
266	N	22	Very low	23.8	Very low	136 Å²	136	143.3 Å²	143.3	73%	0.727	80%	0.802	S	S	*	*			trans	-84.3	159.7	-178.5	-63.4	-30.6	0	0	0	115
267	F	22.2	Very low	23.5	Very low	190 Å²	190	147.4 Å²	147.4	83%	0.833	81%	0.808	S	S	*	*				158.3	134.9	110.1	-98.5	-76.2	0	0	0	114.9
268	A	22	Very low	23.7	Very low	98 Å²	98	145.4 Å²	145.4	81%	0.81	80%	0.801	S	S	*	*			trans	-177.8	140.5	138.1	0	0	0	0	0	113.6
269	L	22.7	Very low	23.7	Very low	169 Å²	169	146 Å²	146	89%	0.885	80%	0.804	S	S	*	*			trans	-92.4	169.1	164.7	-83.4	69.2	0	0	0	109.5
270	G	21.3	Very low	23.8	Very low	65 Å²	65	145 Å²	145	67%	0.67	80%	0.804	S	S	*	*			cis	172.3	-165.6	2.8	0	0	0	0	0	112
271	Q	21.6	Very low	24	Very low	194 Å²	194	144.2 Å²	144.2	91%	0.907	79%	0.79	S	S	*	*			trans	72.6	119.4	-174.6	-63.1	-175.9	-50.7	0	0	115.6
272	V	22.7	Very low	24.2	Very low	134 Å²	134	141.3 Å²	141.3	81%	0.812	77%	0.774	S	S	*	*			cis	103.8	97.6	29.7	175.3	0	0	0	0	113.1
273	T	21.1	Very low	23.5	Very low	144 Å²	144	139.8 Å²	139.8	88%	0.883	76%	0.763	S	S	*	*			trans	-145.6	124.4	142.3	49.5	0	0	0	0	107.9
274	S	22.8	Very low	23.6	Very low	114 Å²	114	138.4 Å²	138.4	80%	0.797	75%	0.751	S	S	*	*			trans	-103.3	129.2	-169.2	51	0	0	0	0	113.3
275	V	20.9	Very low	23.9	Very low	130 Å²	130	136.7 Å²	136.7	79%	0.788	74%	0.737	S	S	*	*			trans	-127.4	130.8	157.9	-179.1	0	0	0	0	107	K277	V275-K277 PolarHBondContact O-N 2.85Å
276	P	22.6	Very low	24	Very low	125 Å²	125	129 Å²	129	81%	0.812	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-67.3	126.2	-179.2	-15.8	29.8	0	0	0	110.6
277	K	23.4	Very low	24.2	Very low	206 Å²	206	131.6 Å²	131.6	90%	0.896	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-79.6	129.3	169.9	-80.1	-176.1	173.6	-179.1	0	109.9	V275	V275-K277 PolarHBondContact O-N 2.85Å
278	E	25.6	Very low	24.5	Very low	151 Å²	151	124.5 Å²	124.5	71%	0.706	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-63.3	153.1	175.4	-66.6	-179.1	135.9	0	0	112.9	N280	E278-N280 PolarHBondContact O-N 2.97Å; E278-N280 PolarHBondContact O-ND2 2.95Å; E278-N280 VanDerWaalsContact O-ND2 3.09Å
279	Q	25.5	Very low	24.6	Very low	180 Å²	180	125.6 Å²	125.6	84%	0.841	69%	0.69	S	S	*	*			trans	-68	93.9	-179.8	-65.3	174.1	-9.4	0	0	110.9	L281	Q279-L281 PolarHBondContact O-N 2.82Å
280	N	23.9	Very low	24.7	Very low	145 Å²	145	125.4 Å²	125.4	78%	0.775	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-75.7	117.3	173.5	-79.6	-92.9	0	0	0	110.3	E278	E278-N280 PolarHBondContact O-N 2.97Å; E278-N280 PolarHBondContact O-ND2 2.95Å; E278-N280 VanDerWaalsContact O-ND2 3.09Å
281	L	26.7	Very low	25.1	Very low	104 Å²	104	127 Å²	127	55%	0.545	69%	0.691	S	S	.	*	P	Polyproline II helix	trans	-56.8	132.8	158.7	-95.8	72.3	0	0	0	108.1	Q279 T283	Q279-L281 PolarHBondContact O-N 2.82Å; L281-T283 PolarHBondContact O-N 3.03Å
282	P	26.3	Very low	25.4	Very low	74 Å²	74	126.5 Å²	126.5	48%	0.481	69%	0.688	S	S	.	*	P	Polyproline II helix	trans	-62.6	138.9	175.8	23.9	-30.9	0	0	0	110.6	L284	P282-L284 PolarHBondContact O-N 3.27Å
283	T	27.2	Very low	25.7	Very low	77 Å²	77	123.1 Å²	123.1	47%	0.472	68%	0.681	S	S	.	*			trans	-63.4	98	-176.3	30.6	0	0	0	0	111.8	L281 F285	L281-T283 PolarHBondContact O-N 3.03Å; T283-F285 PolarHBondContact O-N 3.38Å; T283-F285 VanDerWaalsContact O-N 3.07Å
284	L	28.4	Very low	26.1	Very low	86 Å²	86	123 Å²	123	45%	0.45	67%	0.674	S	S	.	*	S	Bend	trans	-69.4	-3.9	-172.3	-76.7	156.2	0	0	0	116.7	P282 Q494	P282-L284 PolarHBondContact O-N 3.27Å; L284-Q494 HydrophobicContact CD1-CG 4.29Å
285	F	30.3	Very low	26.7	Very low	107 Å²	107	126.5 Å²	126.5	47%	0.469	67%	0.67	S	S	.	*			trans	-134.3	77.3	175.8	-69.5	-79.2	0	0	0	108.8	T283 E287 I495	T283-F285 PolarHBondContact O-N 3.38Å; T283-F285 VanDerWaalsContact O-N 3.07Å; F285-E287 PolarHBondContact O-N 3.15Å; F285-I495 HydrophobicContact CE2-CD1 4.42Å
286	N	25.7	Very low	28	Very low	81 Å²	81	122 Å²	122	43%	0.433	64%	0.641	S	S	.	*			trans	-87.7	46.6	175.7	-151.9	5.1	0	0	0	113	E289	N286-E289 PolarHBondContact ND2-OE2 2.86Å; N286-E289 WeakPolarHBondContact OD1-CB 3.47Å; N286-E289 VanDerWaalsContact OD1-CD 3.32Å; N286-E289 WeakPolarHBondContact OD1-CG 3.36Å; N286-E289 PolarHBondContact OD1-N 3.43Å; N286-E289 VanDerWaalsContact OD1-N 3.11Å; N286-E289 PolarHBondContact OD1-OE2 2.97Å
287	E	25.2	Very low	29.5	Very low	190 Å²	190	117 Å²	117	89%	0.888	61%	0.607	S	S	*	*	S	Bend	trans	-86	2.3	164.4	-64.3	-164.4	141.5	0	0	111.7	F285	F285-E287 PolarHBondContact O-N 3.15Å
288	G	29.2	Very low	31.3	Very low	40 Å²	40	108.3 Å²	108.3	41%	0.412	57%	0.57	S	S	.	*	S	Bend	trans	-93.3	-42.4	176.4	0	0	0	0	0	115.1	N290 S291	G288-N290 VanDerWaalsContact C-N 3.28Å; G288-N290 PolarHBondContact O-N 2.98Å; G288-S291 WeakPolarHBondContact O-CB 3.32Å; G288-S291 PolarHBondContact O-N 3.02Å; G288-S291 PolarHBondContact O-OG 2.96Å
289	E	23.5	Very low	33.6	Very low	121 Å²	121	102.2 Å²	102.2	57%	0.565	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-3.7	-168.2	-63.7	172	175.3	0	0	115.2	N286 S291	N286-E289 PolarHBondContact ND2-OE2 2.86Å; N286-E289 WeakPolarHBondContact OD1-CB 3.47Å; N286-E289 VanDerWaalsContact OD1-CD 3.32Å; N286-E289 WeakPolarHBondContact OD1-CG 3.36Å; N286-E289 PolarHBondContact OD1-N 3.43Å; N286-E289 VanDerWaalsContact OD1-N 3.11Å; N286-E289 PolarHBondContact OD1-OE2 2.97Å; E289-S291 PolarHBondContact O-N 3Å
290	N	24.8	Very low	36.2	Very low	165 Å²	165	94.5 Å²	94.5	88%	0.882	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	3.3	163	-83.4	-11	0	0	0	113.1	G288 Q292	G288-N290 VanDerWaalsContact C-N 3.28Å; G288-N290 PolarHBondContact O-N 2.98Å; N290-Q292 PolarHBondContact O-N 2.91Å
291	S	30.6	Very low	39.2	Very low	99 Å²	99	88 Å²	88	69%	0.692	47%	0.471	S	S	*	.			trans	-86.1	47.1	164.7	65	0	0	0	0	112.8	G288 E289 G293	G288-S291 WeakPolarHBondContact O-CB 3.32Å; G288-S291 PolarHBondContact O-N 3.02Å; G288-S291 PolarHBondContact O-OG 2.96Å; E289-S291 PolarHBondContact O-N 3Å; S291-G293 PolarHBondContact O-N 3.32Å
292	Q	26.1	Very low	42.1	Very low	183 Å²	183	83.1 Å²	83.1	86%	0.855	45%	0.446	S	S	*	.			trans	-65.4	84.9	162.6	-79.8	-165.1	-11.6	0	0	110.6	N290	N290-Q292 PolarHBondContact O-N 2.91Å
293	G	29	Very low	45	Very low	63 Å²	63	81 Å²	81	65%	0.649	43%	0.43	S	S	*	.			trans	73.7	48.7	140	0	0	0	0	0	118.9	S291	S291-G293 PolarHBondContact O-N 3.32Å
294	L	29.7	Very low	48.1	Very low	142 Å²	142	77.3 Å²	77.3	74%	0.743	41%	0.407	S	S	*	.			trans	-96.5	99.7	149.1	-80.2	169	0	0	0	108.7
295	R	36.8	Very low	51	Low	188 Å²	188	74.9 Å²	74.9	71%	0.709	40%	0.396	S	S	*	.			trans	-67.4	136.6	-175.9	-64.6	-173.7	174.1	-153.9	-1.3	111.5	S86 D297	S86-R295 PolarHBondContact N-O 2.66Å; S86-R295 VanDerWaalsContact N-O 3.14Å; R295-D297 VanDerWaalsContact CB-OD1 3.23Å; R295-D297 WeakPolarHBondContact CB-OD1 3.38Å
296	N	47	Very low	53.7	Low	35 Å²	35	69.8 Å²	69.8	19%	0.187	37%	0.374	C	S	.	.			trans	-104.8	98.5	163.7	-98.3	-33	0	0	0	107.8	S86 A87 T90 F298 V299	S86-N296 VanDerWaalsContact C-OD1 3.25Å; S86-N296 PolarHBondContact O-OD1 3.03Å; A87-N296 PolarHBondContact N-OD1 2.89Å; T90-N296 PolarHBondContact OG1-OD1 3.48Å; N296-F298 PolarHBondContact O-N 2.74Å; N296-V299 HydrophobicContact CB-CG2 3.76Å; N296-V299 PolarHBondContact O-N 3.13Å
297	D	54.6	Low	56.5	Low	19 Å²	19	68.5 Å²	68.5	10%	0.102	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	15	-163.5	-57.1	-44.1	0	0	0	115.8	A55 P56 L84 G85 R295	A55-D297 WeakPolarHBondContact CA-O 3.32Å; A55-D297 WeakPolarHBondContact CB-O 3.33Å; P56-D297 VanDerWaalsContact CD-O 3.23Å; P56-D297 WeakPolarHBondContact CD-O 3.49Å; L84-D297 VanDerWaalsContact C-OD2 3.22Å; G85-D297 VanDerWaalsContact CA-OD2 3.27Å; G85-D297 WeakPolarHBondContact CA-OD2 3.43Å; G85-D297 PolarHBondContact N-OD2 2.9Å; G85-D297 VanDerWaalsContact N-OD2 3.11Å; R295-D297 VanDerWaalsContact CB-OD1 3.23Å; R295-D297 WeakPolarHBondContact CB-OD1 3.38Å
298	F	60.8	Low	59.3	Low	24 Å²	24	63.9 Å²	63.9	11%	0.105	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.6	4.2	173.2	-62.5	-62.1	0	0	0	114.4	L84 A87 I210 N296 R300 N316 P318	L84-F298 HydrophobicContact CD1-CE2 3.92Å; L84-F298 HydrophobicContact CD1-CZ 4.31Å; A87-F298 HydrophobicContact CB-CD2 3.73Å; A87-F298 HydrophobicContact CB-CE2 4.16Å; I210-F298 HydrophobicContact CD1-CZ 4.29Å; N296-F298 PolarHBondContact O-N 2.74Å; F298-R300 PolarHBondContact O-N 3.34Å; F298-N316 WeakPolarHBondContact O-CA 3.18Å; F298-P318 HydrophobicContact CD1-CB 4.4Å; F298-P318 HydrophobicContact CD2-CG 4.33Å; F298-P318 HydrophobicContact CE1-CB 4.4Å; F298-P318 HydrophobicContact CG-CG 4.5Å
299	V	75.1	Confident	62.1	Low	24 Å²	24	62.2 Å²	62.2	15%	0.145	33%	0.328	C	S	.	.			trans	-69.6	124.5	-178.6	164.4	0	0	0	0	111.3	A54 P100 F101 N296	A54-V299 HydrophobicContact CB-CB 4.33Å; A54-V299 PolarHBondContact N-O 2.93Å; P100-V299 HydrophobicContact CB-CG2 4.4Å; F101-V299 HydrophobicContact CE1-CG1 3.77Å; F101-V299 HydrophobicContact CZ-CB 4.32Å; F101-V299 HydrophobicContact CZ-CG1 3.93Å; F101-V299 HydrophobicContact CZ-CG2 4.11Å; N296-V299 HydrophobicContact CB-CG2 3.76Å; N296-V299 PolarHBondContact O-N 3.13Å
300	R	80.4	Confident	65.3	Low	18 Å²	18	60.2 Å²	60.2	7%	0.068	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	140.9	174.6	-50.9	-167.3	-173.1	81.1	-2.6	111	Y52 S53 F298 I302 S315 M317	Y52-R300 WeakPolarHBondContact O-CA 3.33Å; S53-R300 WeakPolarHBondContact OG-CG 3.48Å; F298-R300 PolarHBondContact O-N 3.34Å; R300-I302 HydrophobicContact CB-CD1 4.3Å; R300-I302 HydrophobicContact CB-CG1 4.09Å; R300-S315 PolarHBondContact N-O 3.28Å; R300-S315 PolarHBondContact O-N 3.02Å; R300-M317 PolarHBondContact NH1-O 3.21Å
301	N	85	Confident	68.5	Low	7 Å²	7	52.9 Å²	52.9	4%	0.037	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	122.8	168.4	-65.8	-44.8	0	0	0	108	K51 Y52 F110	K51-N301 PolarHBondContact N-O 2.92Å; Y52-N301 PolarHBondContact N-O 2.86Å; Y52-N301 PolarHBondContact O-N 3.45Å; F110-N301 HydrophobicContact CE2-CB 3.63Å; F110-N301 HydrophobicContact CZ-CB 3.96Å
302	I	88	Confident	71.4	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.01	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	129.2	-165.1	-49.2	178.2	0	0	0	109.1	A48 R300 W304 V313 C354	A48-I302 HydrophobicContact CB-CG2 3.88Å; R300-I302 HydrophobicContact CB-CD1 4.3Å; R300-I302 HydrophobicContact CB-CG1 4.09Å; I302-W304 PolarHBondContact O-N 2.65Å; I302-V313 PolarHBondContact N-O 2.69Å; I302-V313 PolarHBondContact O-N 3.25Å; I302-C354 HydrophobicContact CD1-CB 4.45Å
303	M	87.8	Confident	74.5	Confident	29 Å²	29	39.5 Å²	39.5	14%	0.143	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	100.5	167.7	-168.4	63	68.3	0	0	108.1	V49 K51 C113 V118 L312	V49-M303 PolarHBondContact N-O 2.9Å; V49-M303 PolarHBondContact O-N 3.2Å; K51-M303 HydrophobicContact CG-CB 4.02Å; C113-M303 HydrophobicContact CB-CE 4.13Å; V118-M303 HydrophobicContact CG2-CE 3.63Å; V118-M303 HydrophobicContact CG2-SD 3.73Å; M303-L312 HydrophobicContact CE-CD1 4.19Å
304	W	91.8	Very high	77.3	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	116.6	-178.2	179.1	43.7	0	0	0	110.2	S46 I127 I302 F306 M311 V313 L349 L352 M353	S46-W304 PolarHBondContact OG-NE1 3.21Å; I127-W304 HydrophobicContact CG2-CZ3 4.01Å; I302-W304 PolarHBondContact O-N 2.65Å; W304-F306 HydrophobicContact CD2-CB 4.23Å; W304-F306 HydrophobicContact CH2-CB 3.98Å; W304-F306 HydrophobicContact CH2-CD1 4.24Å; W304-F306 HydrophobicContact CH2-CD2 4.1Å; W304-F306 AromaticContact CH2-CG 3.87Å; W304-F306 HydrophobicContact CH2-CG 3.87Å; W304-F306 HydrophobicContact CZ2-CB 3.59Å; W304-F306 HydrophobicContact CZ2-CD1 4.29Å; W304-F306 AromaticContact CZ2-CD2 3.36Å; W304-F306 HydrophobicContact CZ2-CD2 3.36Å; W304-F306 HydrophobicContact CZ2-CE2 4.04Å; W304-F306 AromaticContact CZ2-CG 3.5Å; W304-F306 HydrophobicContact CZ2-CG 3.5Å; W304-F306 HydrophobicContact CZ3-CB 4.42Å; W304-M311 HydrophobicContact CE3-CB 4.33Å; W304-M311 HydrophobicContact CE3-CG 4.37Å; W304-M311 HydrophobicContact CE3-SD 3.75Å; W304-M311 HydrophobicContact CZ3-CE 4.31Å; W304-M311 HydrophobicContact CZ3-SD 3.69Å; W304-M311 PolarHBondContact N-O 3.04Å; W304-M311 PolarHBondContact O-N 2.8Å; W304-V313 HydrophobicContact CB-CG2 4.35Å; W304-V313 HydrophobicContact CE3-CG2 4.04Å; W304-L349 HydrophobicContact CH2-CD2 4.27Å; W304-L352 HydrophobicContact CZ2-CD2 3.41Å; W304-L352 VanDerWaalsContact CZ2-CD2 3.41Å; W304-M353 HydrophobicContact CD2-CB 4.46Å; W304-M353 HydrophobicContact CD2-CG 3.71Å; W304-M353 HydrophobicContact CE3-CG 3.61Å; W304-M353 HydrophobicContact CE3-SD 4.14Å; W304-M353 HydrophobicContact CG-CG 4.43Å; W304-M353 HydrophobicContact CH2-CG 3.84Å; W304-M353 HydrophobicContact CH2-SD 4.45Å; W304-M353 HydrophobicContact CZ2-CG 3.95Å; W304-M353 HydrophobicContact CZ3-CG 3.67Å; W304-M353 HydrophobicContact CZ3-SD 3.95Å
305	T	89.1	Confident	79.9	Confident	35 Å²	35	29.9 Å²	29.9	22%	0.215	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	111	168.1	-59.4	0	0	0	0	108.4	C47 I309 H310	C47-T305 PolarHBondContact N-O 2.84Å; C47-T305 PolarHBondContact O-N 3.22Å; T305-I309 WeakPolarHBondContact CA-O 3.43Å; T305-H310 WeakPolarHBondContact CG2-ND1 3.28Å; T305-H310 PolarHBondContact OG1-ND1 2.97Å
306	F	87.6	Confident	81.9	Confident	1 Å²	1	23.7 Å²	23.7	0%	0.004	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	101.2	172.8	-170.1	-126.8	0	0	0	107.9	V44 W304 D308 I309 W348 L352 K394 A397	V44-F306 HydrophobicContact CG1-CD2 4.11Å; V44-F306 HydrophobicContact CG1-CE2 3.43Å; V44-F306 VanDerWaalsContact CG1-CE2 3.43Å; V44-F306 HydrophobicContact CG1-CZ 3.82Å; W304-F306 HydrophobicContact CD2-CB 4.23Å; W304-F306 HydrophobicContact CH2-CB 3.98Å; W304-F306 HydrophobicContact CH2-CD1 4.24Å; W304-F306 HydrophobicContact CH2-CD2 4.1Å; W304-F306 AromaticContact CH2-CG 3.87Å; W304-F306 HydrophobicContact CH2-CG 3.87Å; W304-F306 HydrophobicContact CZ2-CB 3.59Å; W304-F306 HydrophobicContact CZ2-CD1 4.29Å; W304-F306 AromaticContact CZ2-CD2 3.36Å; W304-F306 HydrophobicContact CZ2-CD2 3.36Å; W304-F306 HydrophobicContact CZ2-CE2 4.04Å; W304-F306 AromaticContact CZ2-CG 3.5Å; W304-F306 HydrophobicContact CZ2-CG 3.5Å; W304-F306 HydrophobicContact CZ3-CB 4.42Å; F306-D308 PolarHBondContact O-N 3.08Å; F306-I309 PolarHBondContact N-O 3.02Å; F306-I309 PolarHBondContact O-N 3.39Å; F306-W348 HydrophobicContact CE2-CH2 4.07Å; F306-W348 AromaticContact CZ-CH2 4Å; F306-W348 HydrophobicContact CZ-CH2 4Å; F306-W348 HydrophobicContact CZ-CZ3 4.45Å; F306-L352 HydrophobicContact CD2-CD2 3.87Å; F306-L352 HydrophobicContact CE2-CD2 3.83Å; F306-K394 HydrophobicContact CE1-CB 4.25Å; F306-K394 HydrophobicContact CZ-CB 4.41Å; F306-A397 HydrophobicContact CD1-CB 4.21Å; F306-A397 HydrophobicContact CE1-CB 4.07Å
307	E	85.7	Confident	83.6	Confident	54 Å²	54	22.7 Å²	22.7	25%	0.252	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	-96.2	-171	-68.3	-94.9	167.4	0	0	113.3	V44 K45 K394	V44-E307 VanDerWaalsContact CA-OE1 3.32Å; V44-E307 WeakPolarHBondContact CA-OE1 3.47Å; V44-E307 HydrophobicContact CG1-CG 3.69Å; K45-E307 HydrophobicContact CB-CG 4.48Å; K45-E307 PolarHBondContact N-OE1 2.9Å; K45-E307 WeakPolarHBondContact O-CA 3.36Å; K45-E307 PolarHBondContact O-N 3.21Å; E307-K394 HydrophobicContact CB-CD 4.25Å; E307-K394 VanDerWaalsContact CD-NZ 3.28Å; E307-K394 HydrophobicContact CG-CD 3.67Å; E307-K394 HydrophobicContact CG-CG 4.11Å; E307-K394 IonicContact OE2-NZ 3.84Å; E307-K394 PolarHBondContact OE2-NZ 3.41Å
308	D	83.8	Confident	84.6	Confident	93 Å²	93	23 Å²	23	50%	0.497	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.8	7.9	-177.9	61.9	-40.8	0	0	0	112.9	F306 Q398	F306-D308 PolarHBondContact O-N 3.08Å; D308-Q398 VanDerWaalsContact CG-NE2 3.32Å; D308-Q398 PolarHBondContact OD1-NE2 3.43Å; D308-Q398 PolarHBondContact OD2-NE2 3.44Å; D308-Q398 VanDerWaalsContact OD2-NE2 3.15Å
309	I	88.1	Confident	85.4	Confident	5 Å²	5	22.7 Å²	22.7	3%	0.026	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	124.2	-179.5	-52.3	174.2	0	0	0	110.1	D119 T305 F306 M311 A397 Q398 L401	D119-I309 HydrophobicContact CB-CG2 4.37Å; T305-I309 WeakPolarHBondContact CA-O 3.43Å; F306-I309 PolarHBondContact N-O 3.02Å; F306-I309 PolarHBondContact O-N 3.39Å; I309-M311 HydrophobicContact CB-CE 4.23Å; I309-M311 HydrophobicContact CD1-CE 4.43Å; I309-M311 HydrophobicContact CG2-CE 3.49Å; I309-M311 VanDerWaalsContact CG2-CE 3.49Å; I309-M311 HydrophobicContact CG2-CG 3.93Å; I309-A397 HydrophobicContact CD1-CB 4.01Å; I309-Q398 HydrophobicContact CD1-CG 4Å; I309-L401 HydrophobicContact CB-CD2 4.35Å; I309-L401 HydrophobicContact CD1-CD2 4.07Å; I309-L401 HydrophobicContact CG1-CD2 4.08Å; I309-L401 HydrophobicContact CG2-CD2 3.4Å; I309-L401 VanDerWaalsContact CG2-CD2 3.4Å
310	H	90.3	Very high	85.6	Confident	78 Å²	78	21.6 Å²	21.6	36%	0.361	11%	0.111	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	116.3	178.1	-58.1	-60.2	0	0	0	111.4	D119 V120 T305	D119-H310 WeakPolarHBondContact CB-O 3.28Å; D119-H310 PolarHBondContact N-O 3.42Å; D119-H310 PolarHBondContact OD2-N 3.12Å; V120-H310 PolarHBondContact N-O 3.12Å; T305-H310 WeakPolarHBondContact CG2-ND1 3.28Å; T305-H310 PolarHBondContact OG1-ND1 2.97Å
311	M	91.6	Very high	85.2	Confident	11 Å²	11	21 Å²	21	5%	0.054	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	136.9	-177.2	-52	-166.8	-172.6	0	0	111.8	V120 I127 W304 I309 V313	V120-M311 HydrophobicContact CB-CB 4.49Å; V120-M311 HydrophobicContact CB-CG 4.14Å; V120-M311 CarbonylContact O-C 3.43Å; V120-M311 WeakPolarHBondContact O-CA 3.49Å; I127-M311 HydrophobicContact CD1-SD 4.16Å; I127-M311 HydrophobicContact CG1-SD 4.46Å; I127-M311 HydrophobicContact CG2-SD 4.11Å; W304-M311 HydrophobicContact CE3-CB 4.33Å; W304-M311 HydrophobicContact CE3-CG 4.37Å; W304-M311 HydrophobicContact CE3-SD 3.75Å; W304-M311 HydrophobicContact CZ3-CE 4.31Å; W304-M311 HydrophobicContact CZ3-SD 3.69Å; W304-M311 PolarHBondContact N-O 3.04Å; W304-M311 PolarHBondContact O-N 2.8Å; I309-M311 HydrophobicContact CB-CE 4.23Å; I309-M311 HydrophobicContact CD1-CE 4.43Å; I309-M311 HydrophobicContact CG2-CE 3.49Å; I309-M311 VanDerWaalsContact CG2-CE 3.49Å; I309-M311 HydrophobicContact CG2-CG 3.93Å; M311-V313 HydrophobicContact CB-CG2 3.73Å
312	L	91.7	Very high	84	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	109.5	164.3	179.9	64.5	0	0	0	108.4	M106 F110 V118 V120 V121 S122 M303	M106-L312 HydrophobicContact CB-CD2 4.37Å; M106-L312 HydrophobicContact CE-CG 3.92Å; M106-L312 VanDerWaalsContact CE-O 3.29Å; M106-L312 WeakPolarHBondContact CE-O 3.25Å; F110-L312 HydrophobicContact CB-CD2 3.8Å; F110-L312 HydrophobicContact CD2-CD1 4.29Å; F110-L312 HydrophobicContact CD2-CD2 3.91Å; F110-L312 HydrophobicContact CG-CD1 4.48Å; F110-L312 HydrophobicContact CG-CD2 4.13Å; V118-L312 HydrophobicContact CG1-CB 4.05Å; V120-L312 PolarHBondContact O-N 3.02Å; V121-L312 WeakPolarHBondContact CA-O 3.48Å; V121-L312 HydrophobicContact CG1-CB 4.4Å; V121-L312 HydrophobicContact CG1-CD2 4.11Å; V121-L312 HydrophobicContact CG1-CG 4.42Å; V121-L312 HydrophobicContact CG2-CB 4.2Å; V121-L312 HydrophobicContact CG2-CD2 4.38Å; S122-L312 PolarHBondContact N-O 3.07Å; S122-L312 VanDerWaalsContact N-O 3.09Å; M303-L312 HydrophobicContact CE-CD1 4.19Å
313	V	90.3	Very high	82.8	Confident	2 Å²	2	26.5 Å²	26.5	1%	0.012	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	128.1	-171.3	-174.9	0	0	0	0	111.4	S122 I302 W304 M311 M353	S122-V313 WeakPolarHBondContact O-CA 3.37Å; I302-V313 PolarHBondContact N-O 2.69Å; I302-V313 PolarHBondContact O-N 3.25Å; W304-V313 HydrophobicContact CB-CG2 4.35Å; W304-V313 HydrophobicContact CE3-CG2 4.04Å; M311-V313 HydrophobicContact CB-CG2 3.73Å; V313-M353 HydrophobicContact CG1-SD 3.93Å
314	G	87.8	Confident	81.1	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	127.6	170.4	0	0	0	0	0	110.1	F101 S122 S124	F101-G314 VanDerWaalsContact CD1-CA 3.47Å; F101-G314 VanDerWaalsContact CE1-CA 3.5Å; S122-G314 PolarHBondContact O-N 2.91Å; S124-G314 VanDerWaalsContact CB-O 3.28Å; S124-G314 WeakPolarHBondContact CB-O 3.48Å; S124-G314 PolarHBondContact N-O 2.68Å; S124-G314 PolarHBondContact OG-O 3.45Å; S124-G314 VanDerWaalsContact OG-O 3.09Å
315	S	85.6	Confident	79.7	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.014	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	138.5	175.1	-173.9	0	0	0	0	111.8	F101 R300 M317	F101-S315 VanDerWaalsContact CZ-N 3.29Å; F101-S315 WeakPolarHBondContact CZ-O 3.31Å; R300-S315 PolarHBondContact N-O 3.28Å; R300-S315 PolarHBondContact O-N 3.02Å; S315-M317 PolarHBondContact OG-N 3.33Å
316	N	78.4	Confident	78.7	Confident	59 Å²	59	45.9 Å²	45.9	32%	0.316	25%	0.246	S	C	.	.			trans	-107.4	18.7	172.2	66.4	-23.8	0	0	0	112.5	F101 F298 P318	F101-N316 HydrophobicContact CE2-CB 3.96Å; F101-N316 HydrophobicContact CZ-CB 4.36Å; F298-N316 WeakPolarHBondContact O-CA 3.18Å; N316-P318 WeakPolarHBondContact O-CD 3.43Å
317	M	81.4	Confident	78.5	Confident	13 Å²	13	47.2 Å²	47.2	6%	0.064	26%	0.258	C	S	.	.			trans	-60.9	126.6	-179.8	-174.4	173.1	76.4	0	0	110.9	R300 S315 I319 R331 D350 C354 V356	R300-M317 PolarHBondContact NH1-O 3.21Å; S315-M317 PolarHBondContact OG-N 3.33Å; M317-I319 HydrophobicContact CE-CG1 4.06Å; M317-I319 PolarHBondContact O-N 3.09Å; M317-R331 PolarHBondContact SD-NH2 2.98Å; M317-D350 WeakPolarHBondContact CE-O 3.25Å; M317-D350 HydrophobicContact SD-CB 3.73Å; M317-C354 HydrophobicContact CE-CB 3.85Å; M317-V356 HydrophobicContact CE-CG2 3.83Å
318	P	76.3	Confident	78.6	Confident	26 Å²	26	44.8 Å²	44.8	17%	0.169	25%	0.246	C	C	.	.			trans	-63.1	130.2	169	-22.4	35.3	0	0	0	110.7	F298 N316 F320	F298-P318 HydrophobicContact CD1-CB 4.4Å; F298-P318 HydrophobicContact CD2-CG 4.33Å; F298-P318 HydrophobicContact CE1-CB 4.4Å; F298-P318 HydrophobicContact CG-CG 4.5Å; N316-P318 WeakPolarHBondContact O-CD 3.43Å; P318-F320 HydrophobicContact CB-CE2 3.58Å; P318-F320 HydrophobicContact CB-CZ 3.73Å
319	I	78.1	Confident	78.8	Confident	17 Å²	17	40.4 Å²	40.4	9%	0.087	22%	0.223	C	C	.	.			trans	-125.2	131.4	176.7	-56.5	172.6	0	0	0	106.6	M317 A327 C354 V356	M317-I319 HydrophobicContact CE-CG1 4.06Å; M317-I319 PolarHBondContact O-N 3.09Å; I319-A327 HydrophobicContact CG2-CB 3.96Å; I319-C354 HydrophobicContact CD1-CB 3.86Å; I319-V356 HydrophobicContact CD1-CG2 3.84Å; I319-V356 HydrophobicContact CG1-CG2 3.99Å; I319-V356 HydrophobicContact CG2-CG2 4.09Å
320	F	79.7	Confident	78.7	Confident	2 Å²	2	40.7 Å²	40.7	1%	0.009	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-120.4	153	-174.5	-57	-89.4	0	0	0	110.3	T59 Y61 L206 I210 P318 A327 V328 L330	T59-F320 WeakPolarHBondContact O-CA 3.23Å; Y61-F320 HydrophobicContact CD1-CB 3.76Å; Y61-F320 HydrophobicContact CG-CB 4.26Å; L206-F320 HydrophobicContact CD2-CE2 4.5Å; L206-F320 HydrophobicContact CD2-CZ 4.35Å; I210-F320 HydrophobicContact CD1-CE1 4.1Å; I210-F320 HydrophobicContact CD1-CZ 4.34Å; I210-F320 HydrophobicContact CG1-CE1 3.67Å; I210-F320 HydrophobicContact CG1-CZ 4.26Å; P318-F320 HydrophobicContact CB-CE2 3.58Å; P318-F320 HydrophobicContact CB-CZ 3.73Å; F320-A327 CarbonylContact O-C 3.56Å; F320-A327 WeakPolarHBondContact O-CA 3.48Å; F320-V328 HydrophobicContact CB-CG2 4.07Å; F320-V328 PolarHBondContact N-O 2.93Å; F320-V328 PolarHBondContact O-N 2.62Å; F320-L330 HydrophobicContact CD2-CB 4.38Å; F320-L330 HydrophobicContact CD2-CD1 3.74Å; F320-L330 HydrophobicContact CD2-CG 3.54Å; F320-L330 HydrophobicContact CE1-CD1 4.42Å; F320-L330 HydrophobicContact CE2-CB 4.11Å; F320-L330 HydrophobicContact CE2-CD1 3.55Å; F320-L330 HydrophobicContact CE2-CG 3.63Å; F320-L330 HydrophobicContact CG-CD1 4.22Å; F320-L330 HydrophobicContact CG-CG 4.32Å; F320-L330 HydrophobicContact CZ-CD1 3.93Å; F320-L330 HydrophobicContact CZ-CG 4.48Å
321	G	71.5	Confident	78.5	Confident	5 Å²	5	38.8 Å²	38.8	5%	0.052	21%	0.214	C	C	.	.			trans	77.5	143.5	-179.8	0	0	0	0	0	114.7	P58 T59	P58-G321 VanDerWaalsContact CB-O 3.22Å; P58-G321 WeakPolarHBondContact CB-O 3.2Å; P58-G321 WeakPolarHBondContact CG-O 3.27Å; T59-G321 PolarHBondContact O-N 3.4Å
322	G	60.3	Low	78.3	Confident	35 Å²	35	39.1 Å²	39.1	36%	0.361	22%	0.216	S	C	.	.			trans	-179.9	172.7	176.4	0	0	0	0	0	112.3	R324 Y325	G322-R324 PolarHBondContact O-N 2.84Å; G322-R324 VanDerWaalsContact O-N 3.14Å; G322-Y325 WeakPolarHBondContact CA-O 3.25Å
323	G	62.9	Low	78	Confident	90 Å²	90	41.8 Å²	41.8	93%	0.928	23%	0.226	S	C	*	.	S	Bend	trans	75.9	-95.3	-175.3	0	0	0	0	0	111.9
324	R	50.3	Low	77.8	Confident	243 Å²	243	42.7 Å²	42.7	92%	0.917	23%	0.231	S	C	*	.	S	Bend	trans	-94.4	-2	-178.8	-75.2	-165.9	-76.1	-162	-3.9	114.9	G322	G322-R324 PolarHBondContact O-N 2.84Å; G322-R324 VanDerWaalsContact O-N 3.14Å
325	Y	62.5	Low	77.5	Confident	165 Å²	165	45.1 Å²	45.1	65%	0.647	25%	0.248	S	C	*	.	S	Bend	trans	-126.6	147.8	178.1	-62.1	-79.5	0	0	0	109.7	G322	G322-Y325 WeakPolarHBondContact CA-O 3.25Å
326	P	69.7	Low	77.2	Confident	62 Å²	62	50.4 Å²	50.4	40%	0.403	28%	0.276	S	S	.	.			trans	-61.4	152.1	176.1	26.5	-34.1	0	0	0	111.2	P357 E358	P326-P357 HydrophobicContact CB-CG 4.29Å; P326-E358 WeakPolarHBondContact CG-OE2 3.33Å
327	A	83.4	Confident	77.3	Confident	29 Å²	29	52.1 Å²	52.1	24%	0.24	28%	0.281	C	S	.	.			trans	-75.7	131.3	171.9	0	0	0	0	0	109.6	I319 F320 P357	I319-A327 HydrophobicContact CG2-CB 3.96Å; F320-A327 CarbonylContact O-C 3.56Å; F320-A327 WeakPolarHBondContact O-CA 3.48Å; A327-P357 VanDerWaalsContact O-CD 3.25Å; A327-P357 WeakPolarHBondContact O-CD 3.48Å; A327-P357 WeakPolarHBondContact O-CG 3.44Å
328	V	86.4	Confident	77.1	Confident	3 Å²	3	55.9 Å²	55.9	2%	0.018	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	152.1	-177.6	-51.5	0	0	0	0	112	Y61 F320 L330 E358 V360	Y61-V328 HydrophobicContact CD1-CG2 3.89Å; Y61-V328 HydrophobicContact CE1-CG2 3.47Å; Y61-V328 VanDerWaalsContact CE1-CG2 3.47Å; F320-V328 HydrophobicContact CB-CG2 4.07Å; F320-V328 PolarHBondContact N-O 2.93Å; F320-V328 PolarHBondContact O-N 2.62Å; V328-L330 HydrophobicContact CG2-CD2 4.34Å; V328-E358 VanDerWaalsContact CA-O 3.32Å; V328-E358 WeakPolarHBondContact CA-O 3.35Å; V328-E358 HydrophobicContact CG1-CB 3.99Å; V328-V360 HydrophobicContact CB-CG2 4.12Å; V328-V360 HydrophobicContact CG1-CG2 4.21Å; V328-V360 HydrophobicContact CG2-CG2 4.25Å
329	S	87.9	Confident	77.4	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.007	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	146.4	162.8	72.4	0	0	0	0	110.6	N351 E358 L359 V360	S329-N351 VanDerWaalsContact CB-OD1 3.3Å; S329-N351 WeakPolarHBondContact CB-OD1 3.16Å; S329-N351 PolarHBondContact OG-OD1 3.26Å; S329-E358 PolarHBondContact N-O 2.9Å; S329-E358 VanDerWaalsContact N-O 3.1Å; S329-L359 WeakPolarHBondContact OG-CD1 3.3Å; S329-V360 PolarHBondContact O-N 3.37Å
330	L	85.8	Confident	77.7	Confident	11 Å²	11	58.7 Å²	58.7	6%	0.058	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	132.9	177	-59.7	-176.4	0	0	0	110.5	Y61 F205 F320 V328 V360	Y61-L330 HydrophobicContact CD2-CD1 4.23Å; Y61-L330 HydrophobicContact CD2-CD2 3.85Å; Y61-L330 HydrophobicContact CE2-CD2 4.01Å; Y61-L330 HydrophobicContact CG-CD1 4.22Å; Y61-L330 HydrophobicContact CG-CD2 4.14Å; F205-L330 HydrophobicContact CE1-CB 4.04Å; F205-L330 HydrophobicContact CZ-CB 4.25Å; F320-L330 HydrophobicContact CD2-CB 4.38Å; F320-L330 HydrophobicContact CD2-CD1 3.74Å; F320-L330 HydrophobicContact CD2-CG 3.54Å; F320-L330 HydrophobicContact CE1-CD1 4.42Å; F320-L330 HydrophobicContact CE2-CB 4.11Å; F320-L330 HydrophobicContact CE2-CD1 3.55Å; F320-L330 HydrophobicContact CE2-CG 3.63Å; F320-L330 HydrophobicContact CG-CD1 4.22Å; F320-L330 HydrophobicContact CG-CG 4.32Å; F320-L330 HydrophobicContact CZ-CD1 3.93Å; F320-L330 HydrophobicContact CZ-CG 4.48Å; V328-L330 HydrophobicContact CG2-CD2 4.34Å; L330-V360 WeakPolarHBondContact CA-O 3.47Å; L330-V360 HydrophobicContact CD2-CB 3.79Å; L330-V360 HydrophobicContact CD2-CG1 3.95Å
331	R	87.6	Confident	78.1	Confident	39 Å²	39	61.7 Å²	61.7	15%	0.147	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	135.7	172.4	-60.9	-65.1	171.5	141.9	4.7	111.5	M317 Y347 D350 L359 V360 M361 C362	M317-R331 PolarHBondContact SD-NH2 2.98Å; R331-Y347 HydrophobicContact CB-CE1 4.41Å; R331-Y347 HydrophobicContact CB-CE2 4.1Å; R331-Y347 HydrophobicContact CG-CD1 4.14Å; R331-Y347 HydrophobicContact CG-CD2 4.35Å; R331-Y347 HydrophobicContact CG-CE1 3.8Å; R331-Y347 HydrophobicContact CG-CE2 4.03Å; R331-Y347 HydrophobicContact CG-CG 4.38Å; R331-D350 IonicContact CZ-OD2 2.73Å; R331-D350 IonicContact NH1-OD2 2.72Å; R331-D350 PolarHBondContact NH1-OD2 3.41Å; R331-D350 VanDerWaalsContact NH2-CG 3.3Å; R331-D350 IonicContact NH2-OD2 3.26Å; R331-D350 PolarHBondContact NH2-OD2 2.96Å; R331-L359 HydrophobicContact CB-CD1 3.96Å; R331-L359 HydrophobicContact CG-CD1 3.39Å; R331-V360 PolarHBondContact N-O 2.86Å; R331-M361 CarbonylContact O-C 3.57Å; R331-M361 WeakPolarHBondContact O-CA 3.45Å; R331-C362 PolarHBondContact O-N 2.94Å
332	L	85.9	Confident	78.8	Confident	18 Å²	18	64.2 Å²	64.2	9%	0.094	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	132.1	172.2	-174.8	69.3	0	0	0	110	L70 I201 L202 F205 C362 H364	L70-L332 HydrophobicContact CD1-CD1 3.77Å; L70-L332 HydrophobicContact CD1-CD2 3.96Å; I201-L332 HydrophobicContact CG2-CD2 3.64Å; L202-L332 HydrophobicContact CB-CD2 4.48Å; L202-L332 HydrophobicContact CD1-CB 3.81Å; F205-L332 HydrophobicContact CB-CD1 4.42Å; F205-L332 HydrophobicContact CB-CD2 3.99Å; F205-L332 HydrophobicContact CD1-CB 3.89Å; F205-L332 HydrophobicContact CD2-CD1 3.95Å; F205-L332 HydrophobicContact CE1-CB 4.18Å; F205-L332 HydrophobicContact CE2-CD1 4.36Å; F205-L332 HydrophobicContact CG-CB 4.19Å; F205-L332 HydrophobicContact CG-CD1 4.05Å; F205-L332 HydrophobicContact CG-CD2 4.31Å; F205-L332 HydrophobicContact CG-CG 4.4Å; L332-C362 CarbonylContact C-O 3.55Å; L332-C362 WeakPolarHBondContact CA-O 3.39Å; L332-C362 HydrophobicContact CD1-CB 4.06Å; L332-H364 HydrophobicContact CD1-CB 4.33Å
333	R	86.1	Confident	80	Confident	55 Å²	55	63.1 Å²	63.1	21%	0.208	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	144.3	179.6	-85.8	-72.2	147.4	154	2.8	113.1	T343 Y347 M361 C362 F363 H364	R333-T343 PolarHBondContact NH1-OG1 3.04Å; R333-T343 PolarHBondContact NH2-OG1 3.26Å; R333-Y347 PolarHBondContact NE-OH 3.18Å; R333-Y347 PolarHBondContact NH2-OH 3.31Å; R333-M361 HydrophobicContact CB-CG 4.21Å; R333-M361 HydrophobicContact CB-SD 4.12Å; R333-M361 HydrophobicContact CG-CG 4.21Å; R333-M361 HydrophobicContact CG-SD 3.76Å; R333-C362 PolarHBondContact N-O 3.31Å; R333-F363 HydrophobicContact CB-CD1 4.25Å; R333-F363 HydrophobicContact CB-CE1 4.35Å; R333-F363 CarbonylContact O-C 3.57Å; R333-F363 VanDerWaalsContact O-CA 3.31Å; R333-F363 WeakPolarHBondContact O-CA 3.25Å; R333-H364 PolarHBondContact O-CD2 2.83Å; R333-H364 PolarHBondContact O-N 2.68Å
334	D	85.3	Confident	81.2	Confident	21 Å²	21	58.9 Å²	58.9	11%	0.112	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	121.9	172.5	-177.4	-7.3	0	0	0	109.5	N336 K337 H364	D334-N336 PolarHBondContact O-N 2.75Å; D334-N336 VanDerWaalsContact O-N 3.16Å; D334-N336 WeakPolarHBondContact OD1-CB 3.37Å; D334-N336 PolarHBondContact OD1-N 3.42Å; D334-N336 VanDerWaalsContact OD1-N 3.08Å; D334-K337 HydrophobicContact CB-CB 4.27Å; D334-K337 HydrophobicContact CB-CD 4.04Å; D334-K337 HydrophobicContact CB-CG 4.2Å; D334-K337 PolarHBondContact O-N 2.94Å; D334-K337 WeakPolarHBondContact OD2-CD 3.39Å; D334-K337 VanDerWaalsContact OD2-CE 3.25Å; D334-K337 WeakPolarHBondContact OD2-CE 3.33Å; D334-K337 IonicContact OD2-NZ 3.69Å; D334-K337 PolarHBondContact OD2-NZ 2.85Å; D334-H364 WeakPolarHBondContact CA-O 3.38Å; D334-H364 PolarHBondContact N-NE2 2.83Å
335	S	83.3	Confident	83.1	Confident	51 Å²	51	47.3 Å²	47.3	36%	0.357	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-25.1	-178.3	-46.2	0	0	0	0	112.3	K337 H364	S335-K337 VanDerWaalsContact C-N 3.28Å; S335-K337 PolarHBondContact O-N 3Å; S335-H364 PolarHBondContact N-O 2.95Å; S335-H364 PolarHBondContact OG-O 3Å
336	N	79.4	Confident	84.4	Confident	114 Å²	114	40.8 Å²	40.8	61%	0.61	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.6	0.3	179.8	-61	-38.6	0	0	0	113.4	D334	D334-N336 PolarHBondContact O-N 2.75Å; D334-N336 VanDerWaalsContact O-N 3.16Å; D334-N336 WeakPolarHBondContact OD1-CB 3.37Å; D334-N336 PolarHBondContact OD1-N 3.42Å; D334-N336 VanDerWaalsContact OD1-N 3.08Å
337	K	79.9	Confident	85.3	Confident	94 Å²	94	38.4 Å²	38.4	41%	0.409	21%	0.205	S	C	.	.	S	Bend	trans	-124.7	108.2	-176.3	-66.3	178.9	-177.9	128.9	0	110.7	E194 D334 S335	E194-K337 IonicContact OE1-NZ 3.85Å; D334-K337 HydrophobicContact CB-CB 4.27Å; D334-K337 HydrophobicContact CB-CD 4.04Å; D334-K337 HydrophobicContact CB-CG 4.2Å; D334-K337 PolarHBondContact O-N 2.94Å; D334-K337 WeakPolarHBondContact OD2-CD 3.39Å; D334-K337 VanDerWaalsContact OD2-CE 3.25Å; D334-K337 WeakPolarHBondContact OD2-CE 3.33Å; D334-K337 IonicContact OD2-NZ 3.69Å; D334-K337 PolarHBondContact OD2-NZ 2.85Å; S335-K337 VanDerWaalsContact C-N 3.28Å; S335-K337 PolarHBondContact O-N 3Å
338	P	76.7	Confident	85.7	Confident	92 Å²	92	37.4 Å²	37.4	60%	0.597	20%	0.195	S	C	*	.	P	Polyproline II helix	trans	-61.9	149.3	178.6	26.1	-34.2	0	0	0	111.4	N340 N385	P338-N340 PolarHBondContact O-N 3.45Å; P338-N385 HydrophobicContact CB-CB 4.13Å
339	I	82.2	Confident	85.8	Confident	20 Å²	20	37.3 Å²	37.3	10%	0.103	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-66.4	116.9	174.2	-54.7	175.5	0	0	0	107.2	T343 M361 L383 N385 S386	I339-T343 HydrophobicContact CG2-CG2 3.72Å; I339-M361 HydrophobicContact CD1-CE 3.88Å; I339-M361 HydrophobicContact CD1-SD 3.74Å; I339-M361 HydrophobicContact CG1-SD 4.48Å; I339-L383 HydrophobicContact CD1-CD1 3.98Å; I339-N385 CarbonylContact O-C 3.57Å; I339-N385 VanDerWaalsContact O-O 3.1Å; I339-S386 WeakPolarHBondContact O-CB 3.38Å; I339-S386 PolarHBondContact O-N 2.89Å
340	N	85.7	Confident	85.9	Confident	82 Å²	82	37.7 Å²	37.7	44%	0.439	20%	0.197	S	C	.	.	P	Polyproline II helix	trans	-91.3	158.9	174.6	62.1	18.8	0	0	0	110.9	P338 L342 T343 G344 S386	P338-N340 PolarHBondContact O-N 3.45Å; N340-L342 PolarHBondContact O-N 2.83Å; N340-T343 WeakPolarHBondContact O-CA 3.49Å; N340-T343 VanDerWaalsContact O-CB 3.31Å; N340-T343 WeakPolarHBondContact O-CB 3.48Å; N340-T343 PolarHBondContact O-N 2.96Å; N340-T343 WeakPolarHBondContact OD1-CB 3.29Å; N340-T343 PolarHBondContact OD1-N 3.15Å; N340-T343 PolarHBondContact OD1-OG1 3.11Å; N340-G344 PolarHBondContact O-N 3.36Å; N340-S386 PolarHBondContact O-OG 3.27Å
341	I	86.5	Confident	86.1	Confident	65 Å²	65	37.1 Å²	37.1	33%	0.333	19%	0.194	S	C	.	.	H	α-helix	trans	-46.4	-42.6	179.2	-65	166.7	0	0	0	112.7	Y135 T343 G344 I345 F388	Y135-I341 HydrophobicContact CD1-CG2 4.12Å; Y135-I341 HydrophobicContact CE1-CG2 4.39Å; I341-T343 VanDerWaalsContact C-N 3.33Å; I341-T343 PolarHBondContact O-N 2.8Å; I341-G344 PolarHBondContact O-N 3.09Å; I341-I345 HydrophobicContact CG2-CD1 3.68Å; I341-I345 HydrophobicContact CG2-CG1 4.34Å; I341-I345 WeakPolarHBondContact O-CB 3.29Å; I341-I345 VanDerWaalsContact O-CG1 3.31Å; I341-I345 WeakPolarHBondContact O-CG1 3.41Å; I341-I345 PolarHBondContact O-N 2.81Å; I341-F388 HydrophobicContact CG2-CB 4.12Å
342	L	86.5	Confident	86.1	Confident	58 Å²	58	36.3 Å²	36.3	30%	0.304	19%	0.192	S	C	.	.	H	α-helix	trans	-63.9	-33.8	178.1	-77.1	172.7	0	0	0	113.6	K132 N340 D346	K132-L342 HydrophobicContact CB-CD2 4.04Å; K132-L342 HydrophobicContact CD-CD2 4.22Å; K132-L342 HydrophobicContact CG-CD2 4.16Å; N340-L342 PolarHBondContact O-N 2.83Å; L342-D346 WeakPolarHBondContact O-CB 3.44Å; L342-D346 PolarHBondContact O-N 3.46Å
343	T	86.6	Confident	86.2	Confident	13 Å²	13	35.6 Å²	35.6	8%	0.08	19%	0.188	C	C	.	.	H	α-helix	trans	-71.9	-47.4	172.2	-64.1	0	0	0	0	110.9	R333 I339 N340 I341 I345 D346 Y347	R333-T343 PolarHBondContact NH1-OG1 3.04Å; R333-T343 PolarHBondContact NH2-OG1 3.26Å; I339-T343 HydrophobicContact CG2-CG2 3.72Å; N340-T343 WeakPolarHBondContact O-CA 3.49Å; N340-T343 VanDerWaalsContact O-CB 3.31Å; N340-T343 WeakPolarHBondContact O-CB 3.48Å; N340-T343 PolarHBondContact O-N 2.96Å; N340-T343 WeakPolarHBondContact OD1-CB 3.29Å; N340-T343 PolarHBondContact OD1-N 3.15Å; N340-T343 PolarHBondContact OD1-OG1 3.11Å; I341-T343 VanDerWaalsContact C-N 3.33Å; I341-T343 PolarHBondContact O-N 2.8Å; T343-I345 VanDerWaalsContact C-N 3.33Å; T343-I345 PolarHBondContact O-N 3.37Å; T343-D346 WeakPolarHBondContact O-CB 3.34Å; T343-D346 PolarHBondContact O-N 2.75Å; T343-D346 VanDerWaalsContact O-N 3.08Å; T343-Y347 HydrophobicContact CG2-CD1 4.38Å; T343-Y347 HydrophobicContact CG2-CD2 3.75Å; T343-Y347 HydrophobicContact CG2-CE1 4.13Å; T343-Y347 HydrophobicContact CG2-CE2 3.44Å; T343-Y347 VanDerWaalsContact CG2-CE2 3.44Å; T343-Y347 HydrophobicContact CG2-CG 4.24Å; T343-Y347 PolarHBondContact O-N 3.09Å
344	G	88	Confident	86.2	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-59.3	-44.8	-179.1	0	0	0	0	0	112.1	N340 I341 D346 Y347 W348 I380 S386 F388	N340-G344 PolarHBondContact O-N 3.36Å; I341-G344 PolarHBondContact O-N 3.09Å; G344-D346 VanDerWaalsContact C-N 3.31Å; G344-D346 PolarHBondContact O-N 2.74Å; G344-Y347 PolarHBondContact O-N 3.04Å; G344-W348 WeakPolarHBondContact O-CB 3.5Å; G344-W348 PolarHBondContact O-N 3.12Å; G344-I380 WeakPolarHBondContact O-CG2 3.37Å; G344-S386 VanDerWaalsContact CA-OG 3.31Å; G344-S386 WeakPolarHBondContact CA-OG 3.38Å; G344-F388 VanDerWaalsContact C-CE1 3.46Å
345	I	89.7	Confident	86.3	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-60.8	-40.5	174.4	-68	169.8	0	0	0	111	K132 Y135 I341 T343 L349 F388 V393	K132-I345 HydrophobicContact CD-CG2 4.32Å; K132-I345 HydrophobicContact CG-CG2 3.82Å; Y135-I345 HydrophobicContact CD2-CD1 3.65Å; Y135-I345 HydrophobicContact CE2-CD1 3.67Å; Y135-I345 HydrophobicContact CG-CD1 4.11Å; I341-I345 HydrophobicContact CG2-CD1 3.68Å; I341-I345 HydrophobicContact CG2-CG1 4.34Å; I341-I345 WeakPolarHBondContact O-CB 3.29Å; I341-I345 VanDerWaalsContact O-CG1 3.31Å; I341-I345 WeakPolarHBondContact O-CG1 3.41Å; I341-I345 PolarHBondContact O-N 2.81Å; T343-I345 VanDerWaalsContact C-N 3.33Å; T343-I345 PolarHBondContact O-N 3.37Å; I345-L349 HydrophobicContact CG2-CD1 3.63Å; I345-L349 HydrophobicContact CG2-CG 4.2Å; I345-L349 VanDerWaalsContact O-CB 3.27Å; I345-L349 WeakPolarHBondContact O-CB 3.4Å; I345-L349 WeakPolarHBondContact O-CG 3.43Å; I345-L349 PolarHBondContact O-N 3.1Å; I345-F388 HydrophobicContact CD1-CD2 4.5Å; I345-F388 HydrophobicContact CD1-CG 4.3Å; I345-F388 HydrophobicContact CG1-CD1 3.69Å; I345-F388 HydrophobicContact CG1-CD2 3.86Å; I345-F388 HydrophobicContact CG1-CE1 3.76Å; I345-F388 HydrophobicContact CG1-CE2 3.9Å; I345-F388 HydrophobicContact CG1-CG 3.78Å; I345-F388 HydrophobicContact CG1-CZ 3.87Å; I345-V393 HydrophobicContact CD1-CG2 4.37Å; I345-V393 HydrophobicContact CG1-CG2 4.46Å
346	D	88.9	Confident	86.5	Confident	28 Å²	28	35.7 Å²	35.7	15%	0.15	19%	0.19	C	C	.	.	H	α-helix	trans	-63	-46.9	178.8	-164	63.5	0	0	0	112.1	K128 K132 L342 T343 G344 D350	K128-D346 VanDerWaalsContact CD-OD1 3.32Å; K128-D346 WeakPolarHBondContact CD-OD1 3.06Å; K128-D346 WeakPolarHBondContact CE-OD1 3.21Å; K128-D346 IonicContact NZ-OD1 3.87Å; K128-D346 PolarHBondContact NZ-OD1 2.71Å; K128-D346 IonicContact NZ-OD2 3.35Å; K132-D346 IonicContact NZ-OD1 2.71Å; K132-D346 PolarHBondContact NZ-OD1 3.04Å; L342-D346 WeakPolarHBondContact O-CB 3.44Å; L342-D346 PolarHBondContact O-N 3.46Å; T343-D346 WeakPolarHBondContact O-CB 3.34Å; T343-D346 PolarHBondContact O-N 2.75Å; T343-D346 VanDerWaalsContact O-N 3.08Å; G344-D346 VanDerWaalsContact C-N 3.31Å; G344-D346 PolarHBondContact O-N 2.74Å; D346-D350 VanDerWaalsContact O-CB 3.32Å; D346-D350 WeakPolarHBondContact O-CB 3.32Å; D346-D350 PolarHBondContact O-N 3.43Å
347	Y	89.9	Confident	86.8	Confident	12 Å²	12	33 Å²	33	5%	0.047	18%	0.179	C	C	.	.	H	α-helix	trans	-70	-41.8	-179.9	-67.5	-7.5	0	0	0	112.5	R331 R333 T343 G344 N351 L359 M361	R331-Y347 HydrophobicContact CB-CE1 4.41Å; R331-Y347 HydrophobicContact CB-CE2 4.1Å; R331-Y347 HydrophobicContact CG-CD1 4.14Å; R331-Y347 HydrophobicContact CG-CD2 4.35Å; R331-Y347 HydrophobicContact CG-CE1 3.8Å; R331-Y347 HydrophobicContact CG-CE2 4.03Å; R331-Y347 HydrophobicContact CG-CG 4.38Å; R333-Y347 PolarHBondContact NE-OH 3.18Å; R333-Y347 PolarHBondContact NH2-OH 3.31Å; T343-Y347 HydrophobicContact CG2-CD1 4.38Å; T343-Y347 HydrophobicContact CG2-CD2 3.75Å; T343-Y347 HydrophobicContact CG2-CE1 4.13Å; T343-Y347 HydrophobicContact CG2-CE2 3.44Å; T343-Y347 VanDerWaalsContact CG2-CE2 3.44Å; T343-Y347 HydrophobicContact CG2-CG 4.24Å; T343-Y347 PolarHBondContact O-N 3.09Å; G344-Y347 PolarHBondContact O-N 3.04Å; Y347-N351 PolarHBondContact O-N 3.2Å; Y347-N351 VanDerWaalsContact O-N 3.12Å; Y347-L359 HydrophobicContact CD2-CD2 3.93Å; Y347-L359 HydrophobicContact CG-CD2 4.37Å; Y347-M361 HydrophobicContact CD2-CE 3.82Å; Y347-M361 HydrophobicContact CE2-CE 3.6Å
348	W	90.6	Very high	87.2	Confident	9 Å²	9	30.4 Å²	30.4	3%	0.034	17%	0.168	C	C	.	.	H	α-helix	trans	-61.8	-49.2	176	178.8	67.9	0	0	0	111.6	F306 G344 N351 L352 I380 P381 F388 T390 V393	F306-W348 HydrophobicContact CE2-CH2 4.07Å; F306-W348 AromaticContact CZ-CH2 4Å; F306-W348 HydrophobicContact CZ-CH2 4Å; F306-W348 HydrophobicContact CZ-CZ3 4.45Å; G344-W348 WeakPolarHBondContact O-CB 3.5Å; G344-W348 PolarHBondContact O-N 3.12Å; W348-N351 PolarHBondContact O-N 2.61Å; W348-L352 HydrophobicContact CZ2-CD1 3.76Å; W348-L352 WeakPolarHBondContact O-CB 3.3Å; W348-L352 PolarHBondContact O-N 2.72Å; W348-I380 HydrophobicContact CB-CB 4.39Å; W348-I380 HydrophobicContact CB-CG2 4Å; W348-P381 HydrophobicContact CG-CG 4.23Å; W348-F388 HydrophobicContact CB-CZ 3.86Å; W348-F388 HydrophobicContact CD2-CE2 4.06Å; W348-F388 HydrophobicContact CD2-CZ 4.03Å; W348-F388 AromaticContact CE3-CE2 3.79Å; W348-F388 HydrophobicContact CE3-CE2 3.79Å; W348-F388 HydrophobicContact CE3-CZ 4.04Å; W348-F388 HydrophobicContact CG-CE2 4.46Å; W348-F388 AromaticContact CG-CZ 3.97Å; W348-F388 HydrophobicContact CG-CZ 3.97Å; W348-F388 HydrophobicContact CZ3-CE2 4.29Å; W348-T390 HydrophobicContact CD2-CG2 4.47Å; W348-T390 HydrophobicContact CH2-CG2 3.87Å; W348-T390 HydrophobicContact CZ2-CG2 3.43Å; W348-T390 VanDerWaalsContact CZ2-CG2 3.43Å; W348-V393 HydrophobicContact CZ3-CB 4.05Å; W348-V393 HydrophobicContact CZ3-CG1 3.97Å; W348-V393 HydrophobicContact CZ3-CG2 4.37Å
349	L	90.3	Very high	87.8	Confident	1 Å²	1	26 Å²	26	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-64.5	-42.4	178.6	-72.5	174.6	0	0	0	112.4	K128 L131 W304 I345 N351 L352 M353	K128-L349 HydrophobicContact CD-CB 4.29Å; K128-L349 HydrophobicContact CG-CB 4.09Å; K128-L349 HydrophobicContact CG-CD1 4.08Å; L131-L349 HydrophobicContact CB-CD1 4.07Å; L131-L349 HydrophobicContact CD1-CD1 3.84Å; L131-L349 HydrophobicContact CD1-CD2 3.83Å; W304-L349 HydrophobicContact CH2-CD2 4.27Å; I345-L349 HydrophobicContact CG2-CD1 3.63Å; I345-L349 HydrophobicContact CG2-CG 4.2Å; I345-L349 VanDerWaalsContact O-CB 3.27Å; I345-L349 WeakPolarHBondContact O-CB 3.4Å; I345-L349 WeakPolarHBondContact O-CG 3.43Å; I345-L349 PolarHBondContact O-N 3.1Å; L349-N351 PolarHBondContact O-N 3.23Å; L349-L352 PolarHBondContact O-N 3.27Å; L349-M353 HydrophobicContact CB-CE 4.17Å; L349-M353 WeakPolarHBondContact O-CB 3.13Å; L349-M353 WeakPolarHBondContact O-CE 3.2Å; L349-M353 VanDerWaalsContact O-CG 3.28Å; L349-M353 WeakPolarHBondContact O-CG 3.41Å; L349-M353 PolarHBondContact O-N 2.76Å
350	D	88.7	Confident	88.2	Confident	8 Å²	8	25.3 Å²	25.3	4%	0.043	14%	0.136	C	C	.	.	H	α-helix	trans	-59.6	-44.8	178	-88.3	-18.7	0	0	0	112.3	K128 M317 R331 D346 C354	K128-D350 WeakPolarHBondContact CD-OD1 3.49Å; K128-D350 WeakPolarHBondContact CE-OD1 3.16Å; K128-D350 IonicContact NZ-OD1 3.71Å; K128-D350 PolarHBondContact NZ-OD1 3.32Å; K128-D350 IonicContact NZ-OD2 2.99Å; K128-D350 PolarHBondContact NZ-OD2 2.95Å; M317-D350 WeakPolarHBondContact CE-O 3.25Å; M317-D350 HydrophobicContact SD-CB 3.73Å; R331-D350 IonicContact CZ-OD2 2.73Å; R331-D350 IonicContact NH1-OD2 2.72Å; R331-D350 PolarHBondContact NH1-OD2 3.41Å; R331-D350 VanDerWaalsContact NH2-CG 3.3Å; R331-D350 IonicContact NH2-OD2 3.26Å; R331-D350 PolarHBondContact NH2-OD2 2.96Å; D346-D350 VanDerWaalsContact O-CB 3.32Å; D346-D350 WeakPolarHBondContact O-CB 3.32Å; D346-D350 PolarHBondContact O-N 3.43Å; D350-C354 WeakPolarHBondContact O-CB 3.07Å; D350-C354 PolarHBondContact O-N 2.78Å; D350-C354 PolarHBondContact O-SG 3.05Å
351	N	89.7	Confident	88.2	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-66.7	-45	176	-82.3	16.9	0	0	0	111.8	S329 Y347 W348 L349 C354 N355 V356 T377	S329-N351 VanDerWaalsContact CB-OD1 3.3Å; S329-N351 WeakPolarHBondContact CB-OD1 3.16Å; S329-N351 PolarHBondContact OG-OD1 3.26Å; Y347-N351 PolarHBondContact O-N 3.2Å; Y347-N351 VanDerWaalsContact O-N 3.12Å; W348-N351 PolarHBondContact O-N 2.61Å; L349-N351 PolarHBondContact O-N 3.23Å; N351-C354 CarbonylContact O-C 3.55Å; N351-C354 PolarHBondContact O-N 3.32Å; N351-C354 VanDerWaalsContact O-N 3.1Å; N351-N355 PolarHBondContact O-N 3.22Å; N351-V356 HydrophobicContact CB-CB 4.07Å; N351-V356 HydrophobicContact CB-CG1 4.49Å; N351-V356 PolarHBondContact O-N 3.01Å; N351-T377 HydrophobicContact CB-CG2 3.8Å; N351-T377 WeakPolarHBondContact CB-OG1 3.36Å; N351-T377 PolarHBondContact ND2-OG1 2.97Å
352	L	88.6	Confident	88.3	Confident	22 Å²	22	18.3 Å²	18.3	12%	0.115	10%	0.099	C	C	.	.	H	α-helix	trans	-73.6	-30.9	-172.8	-174.3	135	0	0	0	113.2	S46 W304 F306 W348 L349 C354	S46-L352 WeakPolarHBondContact OG-CD2 3.31Å; S46-L352 WeakPolarHBondContact OG-CG 3.3Å; S46-L352 PolarHBondContact OG-O 2.68Å; W304-L352 HydrophobicContact CZ2-CD2 3.41Å; W304-L352 VanDerWaalsContact CZ2-CD2 3.41Å; F306-L352 HydrophobicContact CD2-CD2 3.87Å; F306-L352 HydrophobicContact CE2-CD2 3.83Å; W348-L352 HydrophobicContact CZ2-CD1 3.76Å; W348-L352 WeakPolarHBondContact O-CB 3.3Å; W348-L352 PolarHBondContact O-N 2.72Å; L349-L352 PolarHBondContact O-N 3.27Å; L352-C354 VanDerWaalsContact C-N 3.28Å
353	M	88.3	Confident	88.3	Confident	2 Å²	2	17 Å²	17	1%	0.01	9%	0.091	C	C	.	.	H	α-helix	trans	-67.7	-26.3	167.7	-74.8	-173.8	-71.7	0	0	112.8	A48 K128 W304 V313 L349	A48-M353 VanDerWaalsContact CB-O 3.29Å; A48-M353 WeakPolarHBondContact CB-O 3.3Å; K128-M353 HydrophobicContact CD-CE 3.89Å; K128-M353 HydrophobicContact CG-CE 3.71Å; W304-M353 HydrophobicContact CD2-CB 4.46Å; W304-M353 HydrophobicContact CD2-CG 3.71Å; W304-M353 HydrophobicContact CE3-CG 3.61Å; W304-M353 HydrophobicContact CE3-SD 4.14Å; W304-M353 HydrophobicContact CG-CG 4.43Å; W304-M353 HydrophobicContact CH2-CG 3.84Å; W304-M353 HydrophobicContact CH2-SD 4.45Å; W304-M353 HydrophobicContact CZ2-CG 3.95Å; W304-M353 HydrophobicContact CZ3-CG 3.67Å; W304-M353 HydrophobicContact CZ3-SD 3.95Å; V313-M353 HydrophobicContact CG1-SD 3.93Å; L349-M353 HydrophobicContact CB-CE 4.17Å; L349-M353 WeakPolarHBondContact O-CB 3.13Å; L349-M353 WeakPolarHBondContact O-CE 3.2Å; L349-M353 VanDerWaalsContact O-CG 3.28Å; L349-M353 WeakPolarHBondContact O-CG 3.41Å; L349-M353 PolarHBondContact O-N 2.76Å
354	C	85.9	Confident	88.4	Confident	12 Å²	12	17.5 Å²	17.5	8%	0.081	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	3.6	-176.3	-63.9	0	0	0	0	114.5	I302 M317 I319 D350 N351 L352 V356	I302-C354 HydrophobicContact CD1-CB 4.45Å; M317-C354 HydrophobicContact CE-CB 3.85Å; I319-C354 HydrophobicContact CD1-CB 3.86Å; D350-C354 WeakPolarHBondContact O-CB 3.07Å; D350-C354 PolarHBondContact O-N 2.78Å; D350-C354 PolarHBondContact O-SG 3.05Å; N351-C354 CarbonylContact O-C 3.55Å; N351-C354 PolarHBondContact O-N 3.32Å; N351-C354 VanDerWaalsContact O-N 3.1Å; L352-C354 VanDerWaalsContact C-N 3.28Å; C354-V356 VanDerWaalsContact C-N 3.31Å; C354-V356 HydrophobicContact CB-CG2 3.76Å; C354-V356 PolarHBondContact O-N 3.2Å
355	N	86.4	Confident	88.4	Confident	113 Å²	113	19.6 Å²	19.6	60%	0.604	11%	0.105	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.9	41.6	-171.4	-157.4	34.3	0	0	0	114.2	A48 N351 P357	A48-N355 HydrophobicContact CB-CB 4.11Å; N351-N355 PolarHBondContact O-N 3.22Å; N355-P357 WeakPolarHBondContact O-CD 3.47Å
356	V	87.4	Confident	88	Confident	5 Å²	5	24.3 Å²	24.3	3%	0.03	13%	0.13	C	C	.	.			trans	-94.2	115.3	-179.2	175.1	0	0	0	0	109.2	M317 I319 N351 C354 E358 T377	M317-V356 HydrophobicContact CE-CG2 3.83Å; I319-V356 HydrophobicContact CD1-CG2 3.84Å; I319-V356 HydrophobicContact CG1-CG2 3.99Å; I319-V356 HydrophobicContact CG2-CG2 4.09Å; N351-V356 HydrophobicContact CB-CB 4.07Å; N351-V356 HydrophobicContact CB-CG1 4.49Å; N351-V356 PolarHBondContact O-N 3.01Å; C354-V356 VanDerWaalsContact C-N 3.31Å; C354-V356 HydrophobicContact CB-CG2 3.76Å; C354-V356 PolarHBondContact O-N 3.2Å; V356-E358 VanDerWaalsContact CG1-O 3.26Å; V356-E358 WeakPolarHBondContact CG1-O 3.39Å; V356-T377 PolarHBondContact O-OG1 3.07Å
357	P	86	Confident	87.5	Confident	58 Å²	58	23 Å²	23	38%	0.377	12%	0.123	S	C	.	.			trans	-71.9	-27.3	-176.6	27.6	-36.7	0	0	0	114.2	P326 A327 N355 T377	P326-P357 HydrophobicContact CB-CG 4.29Å; A327-P357 VanDerWaalsContact O-CD 3.25Å; A327-P357 WeakPolarHBondContact O-CD 3.48Å; A327-P357 WeakPolarHBondContact O-CG 3.44Å; N355-P357 WeakPolarHBondContact O-CD 3.47Å; P357-T377 WeakPolarHBondContact O-CB 3.07Å; P357-T377 PolarHBondContact O-N 2.85Å; P357-T377 PolarHBondContact O-OG1 3.35Å
358	E	89.4	Confident	87.2	Confident	39 Å²	39	25.2 Å²	25.2	18%	0.182	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	145.6	-169.2	-74.2	171.5	-178.5	0	0	113	P326 V328 S329 V356	P326-E358 WeakPolarHBondContact CG-OE2 3.33Å; V328-E358 VanDerWaalsContact CA-O 3.32Å; V328-E358 WeakPolarHBondContact CA-O 3.35Å; V328-E358 HydrophobicContact CG1-CB 3.99Å; S329-E358 PolarHBondContact N-O 2.9Å; S329-E358 VanDerWaalsContact N-O 3.1Å; V356-E358 VanDerWaalsContact CG1-O 3.26Å; V356-E358 WeakPolarHBondContact CG1-O 3.39Å
359	L	89.3	Confident	87	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	126.7	174.6	166.5	60	0	0	0	108.9	S329 R331 Y347 M361 M374 I375 I380	S329-L359 WeakPolarHBondContact OG-CD1 3.3Å; R331-L359 HydrophobicContact CB-CD1 3.96Å; R331-L359 HydrophobicContact CG-CD1 3.39Å; Y347-L359 HydrophobicContact CD2-CD2 3.93Å; Y347-L359 HydrophobicContact CG-CD2 4.37Å; L359-M361 HydrophobicContact CD2-CE 3.69Å; L359-M361 HydrophobicContact CG-CE 4.36Å; L359-M374 WeakPolarHBondContact O-CA 3.31Å; L359-I375 PolarHBondContact N-O 3.07Å; L359-I375 PolarHBondContact O-N 2.81Å; L359-I380 HydrophobicContact CB-CD1 4.18Å; L359-I380 HydrophobicContact CD2-CD1 3.78Å; L359-I380 HydrophobicContact CD2-CG1 4.23Å
360	V	89	Confident	86.7	Confident	4 Å²	4	28.5 Å²	28.5	2%	0.024	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	114.8	171.3	173.4	0	0	0	0	108.9	Y61 V328 S329 L330 R331 Y372 E373 M374	Y61-V360 HydrophobicContact CE2-CG1 4.37Å; V328-V360 HydrophobicContact CB-CG2 4.12Å; V328-V360 HydrophobicContact CG1-CG2 4.21Å; V328-V360 HydrophobicContact CG2-CG2 4.25Å; S329-V360 PolarHBondContact O-N 3.37Å; L330-V360 WeakPolarHBondContact CA-O 3.47Å; L330-V360 HydrophobicContact CD2-CB 3.79Å; L330-V360 HydrophobicContact CD2-CG1 3.95Å; R331-V360 PolarHBondContact N-O 2.86Å; V360-Y372 HydrophobicContact CG1-CD1 3.75Å; V360-Y372 HydrophobicContact CG1-CE1 4.47Å; V360-E373 WeakPolarHBondContact CA-O 3.39Å; V360-M374 HydrophobicContact CG2-CE 3.85Å; V360-M374 HydrophobicContact CG2-CG 4.4Å
361	M	87.3	Confident	86.6	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	115.6	-177.6	-165.3	162.7	-56.6	0	0	110.9	R331 R333 I339 Y347 L359 F363 Y372 E373 I375	R331-M361 CarbonylContact O-C 3.57Å; R331-M361 WeakPolarHBondContact O-CA 3.45Å; R333-M361 HydrophobicContact CB-CG 4.21Å; R333-M361 HydrophobicContact CB-SD 4.12Å; R333-M361 HydrophobicContact CG-CG 4.21Å; R333-M361 HydrophobicContact CG-SD 3.76Å; I339-M361 HydrophobicContact CD1-CE 3.88Å; I339-M361 HydrophobicContact CD1-SD 3.74Å; I339-M361 HydrophobicContact CG1-SD 4.48Å; Y347-M361 HydrophobicContact CD2-CE 3.82Å; Y347-M361 HydrophobicContact CE2-CE 3.6Å; L359-M361 HydrophobicContact CD2-CE 3.69Å; L359-M361 HydrophobicContact CG-CE 4.36Å; M361-F363 HydrophobicContact CB-CE2 4.18Å; M361-F363 HydrophobicContact CG-CD2 4.37Å; M361-F363 HydrophobicContact CG-CE2 3.92Å; M361-F363 HydrophobicContact CG-CZ 4Å; M361-F363 HydrophobicContact SD-CE1 4.12Å; M361-F363 HydrophobicContact SD-CE2 4.18Å; M361-F363 HydrophobicContact SD-CZ 3.67Å; M361-Y372 CarbonylContact O-C 3.59Å; M361-Y372 WeakPolarHBondContact O-CA 3.49Å; M361-E373 PolarHBondContact N-O 2.9Å; M361-E373 PolarHBondContact O-N 2.96Å; M361-I375 HydrophobicContact CE-CD1 4.24Å
362	C	88	Confident	86.4	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	117.5	170.8	-178.4	0	0	0	0	109.3	F205 R331 L332 R333 Y372	F205-C362 HydrophobicContact CD2-CB 4.28Å; F205-C362 HydrophobicContact CE2-CB 3.37Å; F205-C362 VanDerWaalsContact CE2-SG 3.56Å; F205-C362 HydrophobicContact CZ-CB 3.59Å; R331-C362 PolarHBondContact O-N 2.94Å; L332-C362 CarbonylContact C-O 3.55Å; L332-C362 WeakPolarHBondContact CA-O 3.39Å; L332-C362 HydrophobicContact CD1-CB 4.06Å; R333-C362 PolarHBondContact N-O 3.31Å; C362-Y372 HydrophobicContact CB-CD1 3.95Å; C362-Y372 HydrophobicContact CB-CE1 3.59Å
363	F	87.2	Confident	86.4	Confident	30 Å²	30	37.1 Å²	37.1	13%	0.132	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	140.8	173.3	-70.6	-86.2	0	0	0	110.6	R333 M361 Q370 K371 E373	R333-F363 HydrophobicContact CB-CD1 4.25Å; R333-F363 HydrophobicContact CB-CE1 4.35Å; R333-F363 CarbonylContact O-C 3.57Å; R333-F363 VanDerWaalsContact O-CA 3.31Å; R333-F363 WeakPolarHBondContact O-CA 3.25Å; M361-F363 HydrophobicContact CB-CE2 4.18Å; M361-F363 HydrophobicContact CG-CD2 4.37Å; M361-F363 HydrophobicContact CG-CE2 3.92Å; M361-F363 HydrophobicContact CG-CZ 4Å; M361-F363 HydrophobicContact SD-CE1 4.12Å; M361-F363 HydrophobicContact SD-CE2 4.18Å; M361-F363 HydrophobicContact SD-CZ 3.67Å; F363-Q370 PolarHBondContact O-N 2.84Å; F363-K371 HydrophobicContact CB-CG 3.99Å; F363-K371 HydrophobicContact CD2-CD 4.27Å; F363-K371 HydrophobicContact CD2-CG 3.94Å; F363-K371 HydrophobicContact CG-CG 4.31Å; F363-K371 PolarHBondContact N-O 3.07Å; F363-E373 HydrophobicContact CD2-CB 4.46Å; F363-E373 HydrophobicContact CE2-CB 3.88Å
364	H	88.2	Confident	86.3	Confident	25 Å²	25	42.1 Å²	42.1	12%	0.116	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	159.6	175.7	74.8	77.4	0	0	0	111.9	L332 R333 D334 S335 G367 I368	L332-H364 HydrophobicContact CD1-CB 4.33Å; R333-H364 PolarHBondContact O-CD2 2.83Å; R333-H364 PolarHBondContact O-N 2.68Å; D334-H364 WeakPolarHBondContact CA-O 3.38Å; D334-H364 PolarHBondContact N-NE2 2.83Å; S335-H364 PolarHBondContact N-O 2.95Å; S335-H364 PolarHBondContact OG-O 3Å; H364-G367 PolarHBondContact ND1-N 2.88Å; H364-I368 CarbonylContact C-O 3.5Å; H364-I368 WeakPolarHBondContact CA-O 3.22Å; H364-I368 WeakPolarHBondContact CB-O 3.38Å
365	V	86.9	Confident	86.5	Confident	43 Å²	43	41.8 Å²	41.8	26%	0.261	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	122.5	164.3	172.8	0	0	0	0	107.2	G367 I368 Q370	V365-G367 PolarHBondContact O-N 2.65Å; V365-I368 PolarHBondContact N-O 2.9Å; V365-I368 WeakPolarHBondContact O-CB 3.34Å; V365-I368 PolarHBondContact O-N 3.41Å; V365-Q370 HydrophobicContact CB-CG 4.38Å; V365-Q370 HydrophobicContact CG2-CG 3.97Å
366	N	81.8	Confident	86.6	Confident	99 Å²	99	40.7 Å²	40.7	53%	0.529	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.4	34.3	-179.4	-67.9	-21.2	0	0	0	115.4	K71	K71-N366 WeakPolarHBondContact CE-O 3.33Å; K71-N366 PolarHBondContact NZ-O 2.85Å
367	G	79.1	Confident	86.7	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.3	-11.7	-176.9	0	0	0	0	0	115.1	L70 H364 V365	L70-G367 WeakPolarHBondContact CB-O 3.27Å; L70-G367 VanDerWaalsContact CG-O 3.23Å; L70-G367 WeakPolarHBondContact CG-O 3.35Å; L70-G367 PolarHBondContact N-O 3.36Å; H364-G367 PolarHBondContact ND1-N 2.88Å; V365-G367 PolarHBondContact O-N 2.65Å
368	I	83.9	Confident	86.8	Confident	60 Å²	60	42.7 Å²	42.7	31%	0.308	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	119.6	-179.3	-56.7	175.3	0	0	0	109.9	T68 D69 H364 V365 Q370	T68-I368 WeakPolarHBondContact O-CA 3.36Å; D69-I368 HydrophobicContact CB-CG1 4.4Å; H364-I368 CarbonylContact C-O 3.5Å; H364-I368 WeakPolarHBondContact CA-O 3.22Å; H364-I368 WeakPolarHBondContact CB-O 3.38Å; V365-I368 PolarHBondContact N-O 2.9Å; V365-I368 WeakPolarHBondContact O-CB 3.34Å; V365-I368 PolarHBondContact O-N 3.41Å; I368-Q370 PolarHBondContact O-N 3.36Å; I368-Q370 PolarHBondContact O-NE2 3.42Å
369	V	85.3	Confident	86.7	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	131.1	178.1	175.4	0	0	0	0	110.7	L64 K67 T68 L70 Y372	L64-V369 HydrophobicContact CB-CG2 4.42Å; L64-V369 HydrophobicContact CD1-CG2 4.22Å; K67-V369 PolarHBondContact N-O 2.89Å; T68-V369 PolarHBondContact O-N 2.91Å; L70-V369 HydrophobicContact CD1-CG2 3.94Å; L70-V369 HydrophobicContact CD2-CG2 4.32Å; L70-V369 HydrophobicContact CG-CG2 4.02Å; V369-Y372 HydrophobicContact CG1-CE2 3.87Å
370	Q	85.3	Confident	86.7	Confident	79 Å²	79	44.9 Å²	44.9	37%	0.369	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	-57.3	-177.7	-60.7	-58.3	-62.6	0	0	112.5	E66 F363 V365 I368	E66-Q370 WeakPolarHBondContact CG-O 3.29Å; F363-Q370 PolarHBondContact O-N 2.84Å; V365-Q370 HydrophobicContact CB-CG 4.38Å; V365-Q370 HydrophobicContact CG2-CG 3.97Å; I368-Q370 PolarHBondContact O-N 3.36Å; I368-Q370 PolarHBondContact O-NE2 3.42Å
371	K	85.2	Confident	86.6	Confident	90 Å²	90	44.8 Å²	44.8	39%	0.391	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	162.5	-177.7	63.3	159.9	-178	160.1	0	111.3	F363 E373	F363-K371 HydrophobicContact CB-CG 3.99Å; F363-K371 HydrophobicContact CD2-CD 4.27Å; F363-K371 HydrophobicContact CD2-CG 3.94Å; F363-K371 HydrophobicContact CG-CG 4.31Å; F363-K371 PolarHBondContact N-O 3.07Å; K371-E373 IonicContact NZ-OE2 2.62Å; K371-E373 PolarHBondContact NZ-OE2 3.19Å
372	Y	86.4	Confident	86.6	Confident	51 Å²	51	51.5 Å²	51.5	20%	0.2	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	142.8	167.7	-73.8	-99.6	0	0	0	110.8	L63 L64 F205 V360 M361 C362 V369	L63-Y372 HydrophobicContact CD2-CD1 3.4Å; L63-Y372 VanDerWaalsContact CD2-CD1 3.4Å; L63-Y372 HydrophobicContact CD2-CD2 3.93Å; L63-Y372 HydrophobicContact CD2-CE1 3.68Å; L63-Y372 HydrophobicContact CD2-CE2 4.2Å; L63-Y372 HydrophobicContact CD2-CG 3.52Å; L64-Y372 HydrophobicContact CB-CE2 4.45Å; L64-Y372 WeakPolarHBondContact CB-OH 3.43Å; L64-Y372 VanDerWaalsContact CG-OH 3.27Å; L64-Y372 WeakPolarHBondContact CG-OH 3.39Å; L64-Y372 PolarHBondContact N-OH 3.36Å; L64-Y372 VanDerWaalsContact N-OH 3.08Å; L64-Y372 WeakPolarHBondContact O-CE2 3.15Å; F205-Y372 HydrophobicContact CE2-CE1 4.16Å; F205-Y372 HydrophobicContact CZ-CE1 4.46Å; V360-Y372 HydrophobicContact CG1-CD1 3.75Å; V360-Y372 HydrophobicContact CG1-CE1 4.47Å; M361-Y372 CarbonylContact O-C 3.59Å; M361-Y372 WeakPolarHBondContact O-CA 3.49Å; C362-Y372 HydrophobicContact CB-CD1 3.95Å; C362-Y372 HydrophobicContact CB-CE1 3.59Å; V369-Y372 HydrophobicContact CG1-CE2 3.87Å
373	E	88.2	Confident	86.4	Confident	70 Å²	70	53.1 Å²	53.1	33%	0.327	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	127.9	178.2	-165.5	169.4	138.1	0	0	109.5	V360 M361 F363 K371 I375	V360-E373 WeakPolarHBondContact CA-O 3.39Å; M361-E373 PolarHBondContact N-O 2.9Å; M361-E373 PolarHBondContact O-N 2.96Å; F363-E373 HydrophobicContact CD2-CB 4.46Å; F363-E373 HydrophobicContact CE2-CB 3.88Å; K371-E373 IonicContact NZ-OE2 2.62Å; K371-E373 PolarHBondContact NZ-OE2 3.19Å; E373-I375 HydrophobicContact CG-CG1 4.18Å
374	M	86.1	Confident	85.7	Confident	106 Å²	106	59.6 Å²	59.6	52%	0.522	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	124.3	177.3	-177.8	176.3	-82.4	0	0	108.6	L359 V360	L359-M374 WeakPolarHBondContact O-CA 3.31Å; V360-M374 HydrophobicContact CG2-CE 3.85Å; V360-M374 HydrophobicContact CG2-CG 4.4Å
375	I	90	Very high	85.1	Confident	6 Å²	6	64 Å²	64	3%	0.031	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	130.1	-173.5	-56	170.9	0	0	0	107	L359 M361 E373 E379 I380 L383	L359-I375 PolarHBondContact N-O 3.07Å; L359-I375 PolarHBondContact O-N 2.81Å; M361-I375 HydrophobicContact CE-CD1 4.24Å; E373-I375 HydrophobicContact CG-CG1 4.18Å; I375-E379 HydrophobicContact CG2-CB 4.13Å; I375-I380 HydrophobicContact CG2-CG1 4.06Å; I375-L383 HydrophobicContact CD1-CD1 4.17Å; I375-L383 HydrophobicContact CD1-CD2 4.18Å; I375-L383 HydrophobicContact CG2-CD1 4.36Å; I375-L383 HydrophobicContact CG2-CD2 4.12Å
376	K	89.1	Confident	84.8	Confident	90 Å²	90	61.9 Å²	61.9	39%	0.391	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	151.3	176.6	-56	-172.9	-167.2	164.1	0	111.6	E378 E379 I380	K376-E378 HydrophobicContact CB-CG 4.23Å; K376-E378 WeakPolarHBondContact CD-OE1 3.42Å; K376-E378 IonicContact NZ-OE1 2.62Å; K376-E378 PolarHBondContact O-N 2.98Å; K376-E379 HydrophobicContact CB-CB 4.4Å; K376-E379 HydrophobicContact CB-CG 4.11Å; K376-E379 WeakPolarHBondContact CD-OE1 3.41Å; K376-E379 PolarHBondContact N-OE2 3.09Å; K376-E379 IonicContact NZ-OE1 3.93Å; K376-E379 WeakPolarHBondContact O-CB 3.39Å; K376-E379 PolarHBondContact O-N 3.44Å; K376-I380 PolarHBondContact O-N 2.82Å
377	T	89.6	Confident	84.9	Confident	13 Å²	13	61.3 Å²	61.3	8%	0.08	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-33.3	180	-67	0	0	0	0	112.2	N351 V356 P357 E379	N351-T377 HydrophobicContact CB-CG2 3.8Å; N351-T377 WeakPolarHBondContact CB-OG1 3.36Å; N351-T377 PolarHBondContact ND2-OG1 2.97Å; V356-T377 PolarHBondContact O-OG1 3.07Å; P357-T377 WeakPolarHBondContact O-CB 3.07Å; P357-T377 PolarHBondContact O-N 2.85Å; P357-T377 PolarHBondContact O-OG1 3.35Å; T377-E379 VanDerWaalsContact C-N 3.3Å; T377-E379 PolarHBondContact O-N 3.48Å
378	E	87.6	Confident	85.3	Confident	91 Å²	91	62.1 Å²	62.1	43%	0.425	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-21.8	172.5	64.5	-91.5	-155.4	0	0	114.5	K376 P381	K376-E378 HydrophobicContact CB-CG 4.23Å; K376-E378 WeakPolarHBondContact CD-OE1 3.42Å; K376-E378 IonicContact NZ-OE1 2.62Å; K376-E378 PolarHBondContact O-N 2.98Å; E378-P381 WeakPolarHBondContact O-CD 3.45Å
379	E	87.8	Confident	85.4	Confident	85 Å²	85	62 Å²	62	40%	0.397	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-22.7	-178.2	-69.1	162.7	-175.2	0	0	112.6	I375 K376 T377 P381 H382 L383	I375-E379 HydrophobicContact CG2-CB 4.13Å; K376-E379 HydrophobicContact CB-CB 4.4Å; K376-E379 HydrophobicContact CB-CG 4.11Å; K376-E379 WeakPolarHBondContact CD-OE1 3.41Å; K376-E379 PolarHBondContact N-OE2 3.09Å; K376-E379 IonicContact NZ-OE1 3.93Å; K376-E379 WeakPolarHBondContact O-CB 3.39Å; K376-E379 PolarHBondContact O-N 3.44Å; T377-E379 VanDerWaalsContact C-N 3.3Å; T377-E379 PolarHBondContact O-N 3.48Å; E379-P381 VanDerWaalsContact C-CD 3.45Å; E379-H382 PolarHBondContact O-N 2.85Å; E379-L383 PolarHBondContact O-N 3.11Å
380	I	88.5	Confident	85.4	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.005	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-51.1	-44.1	-179.5	-60.5	172.4	0	0	0	113.7	G344 W348 L359 I375 K376 H382 L383	G344-I380 WeakPolarHBondContact O-CG2 3.37Å; W348-I380 HydrophobicContact CB-CB 4.39Å; W348-I380 HydrophobicContact CB-CG2 4Å; L359-I380 HydrophobicContact CB-CD1 4.18Å; L359-I380 HydrophobicContact CD2-CD1 3.78Å; L359-I380 HydrophobicContact CD2-CG1 4.23Å; I375-I380 HydrophobicContact CG2-CG1 4.06Å; K376-I380 PolarHBondContact O-N 2.82Å; I380-H382 PolarHBondContact O-N 2.95Å; I380-H382 VanDerWaalsContact O-N 3.16Å; I380-L383 HydrophobicContact CB-CD1 4.48Å; I380-L383 HydrophobicContact CG2-CD1 4.3Å; I380-L383 WeakPolarHBondContact O-CG 3.5Å; I380-L383 PolarHBondContact O-N 3.42Å
381	P	87.4	Confident	85.4	Confident	2 Å²	2	66.1 Å²	66.1	1%	0.013	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-67.1	-10.8	178.8	-19.4	33.6	0	0	0	114.8	W348 E378 E379 T387 F388 T390	W348-P381 HydrophobicContact CG-CG 4.23Å; E378-P381 WeakPolarHBondContact O-CD 3.45Å; E379-P381 VanDerWaalsContact C-CD 3.45Å; P381-T387 VanDerWaalsContact O-CA 3.3Å; P381-T387 WeakPolarHBondContact O-CA 3.36Å; P381-F388 HydrophobicContact CB-CD1 4.46Å; P381-F388 HydrophobicContact CB-CD2 4.23Å; P381-F388 HydrophobicContact CB-CE1 4.08Å; P381-F388 HydrophobicContact CB-CE2 3.86Å; P381-F388 HydrophobicContact CB-CZ 3.76Å; P381-F388 HydrophobicContact CG-CE1 4.46Å; P381-F388 HydrophobicContact CG-CE2 4.03Å; P381-F388 HydrophobicContact CG-CZ 3.79Å; P381-F388 PolarHBondContact O-N 3.25Å; P381-T390 HydrophobicContact CB-CG2 3.87Å; P381-T390 HydrophobicContact CG-CG2 3.55Å
382	H	85.9	Confident	85.4	Confident	140 Å²	140	64.8 Å²	64.8	65%	0.648	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-107.9	-1.9	-176.7	-62.5	-62.5	0	0	0	113.7	E379 I380	E379-H382 PolarHBondContact O-N 2.85Å; I380-H382 PolarHBondContact O-N 2.95Å; I380-H382 VanDerWaalsContact O-N 3.16Å
383	L	84.8	Confident	85.4	Confident	34 Å²	34	62.3 Å²	62.3	18%	0.178	31%	0.309	C	S	.	.	S	Bend	trans	-59.8	145.4	177.8	-66.2	172.5	0	0	0	112.9	I339 I375 E379 I380 N385 S386 T387	I339-L383 HydrophobicContact CD1-CD1 3.98Å; I375-L383 HydrophobicContact CD1-CD1 4.17Å; I375-L383 HydrophobicContact CD1-CD2 4.18Å; I375-L383 HydrophobicContact CG2-CD1 4.36Å; I375-L383 HydrophobicContact CG2-CD2 4.12Å; E379-L383 PolarHBondContact O-N 3.11Å; I380-L383 HydrophobicContact CB-CD1 4.48Å; I380-L383 HydrophobicContact CG2-CD1 4.3Å; I380-L383 WeakPolarHBondContact O-CG 3.5Å; I380-L383 PolarHBondContact O-N 3.42Å; L383-N385 PolarHBondContact O-N 3.46Å; L383-S386 CarbonylContact O-C 3.54Å; L383-S386 PolarHBondContact O-N 3.17Å; L383-S386 VanDerWaalsContact O-N 3.07Å; L383-T387 PolarHBondContact O-N 2.92Å; L383-T387 PolarHBondContact O-OG1 2.9Å
384	E	72.9	Confident	85.3	Confident	166 Å²	166	61 Å²	61	78%	0.776	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	136.3	178	-63.3	-170.5	167.4	0	0	111.6	S386	E384-S386 PolarHBondContact O-N 3.41Å
385	N	74.8	Confident	85.3	Confident	117 Å²	117	59.5 Å²	59.5	63%	0.626	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	-4.3	-174.8	-49.8	-76.2	0	0	0	115.9	P338 I339 L383	P338-N385 HydrophobicContact CB-CB 4.13Å; I339-N385 CarbonylContact O-C 3.57Å; I339-N385 VanDerWaalsContact O-O 3.1Å; L383-N385 PolarHBondContact O-N 3.46Å
386	S	81.3	Confident	85.2	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.299	C	S	.	.			trans	-119	15.5	179.8	-167.8	0	0	0	0	113.6	I339 N340 G344 L383 E384 F388	I339-S386 WeakPolarHBondContact O-CB 3.38Å; I339-S386 PolarHBondContact O-N 2.89Å; N340-S386 PolarHBondContact O-OG 3.27Å; G344-S386 VanDerWaalsContact CA-OG 3.31Å; G344-S386 WeakPolarHBondContact CA-OG 3.38Å; L383-S386 CarbonylContact O-C 3.54Å; L383-S386 PolarHBondContact O-N 3.17Å; L383-S386 VanDerWaalsContact O-N 3.07Å; E384-S386 PolarHBondContact O-N 3.41Å; S386-F388 VanDerWaalsContact O-CD1 3.22Å; S386-F388 WeakPolarHBondContact O-CD1 3.46Å; S386-F388 PolarHBondContact O-N 2.96Å
387	T	83.6	Confident	85.1	Confident	87 Å²	87	56 Å²	56	53%	0.534	28%	0.283	S	S	.	.			trans	-65.4	122.6	-173.3	-38.9	0	0	0	0	112.4	P381 L383	P381-T387 VanDerWaalsContact O-CA 3.3Å; P381-T387 WeakPolarHBondContact O-CA 3.36Å; L383-T387 PolarHBondContact O-N 2.92Å; L383-T387 PolarHBondContact O-OG1 2.9Å
388	F	88	Confident	85	Confident	16 Å²	16	58.2 Å²	58.2	7%	0.07	29%	0.292	C	S	.	.			trans	-142.1	154.8	175.5	66.3	-94.3	0	0	0	112.7	I341 G344 I345 W348 P381 S386 T390 V393	I341-F388 HydrophobicContact CG2-CB 4.12Å; G344-F388 VanDerWaalsContact C-CE1 3.46Å; I345-F388 HydrophobicContact CD1-CD2 4.5Å; I345-F388 HydrophobicContact CD1-CG 4.3Å; I345-F388 HydrophobicContact CG1-CD1 3.69Å; I345-F388 HydrophobicContact CG1-CD2 3.86Å; I345-F388 HydrophobicContact CG1-CE1 3.76Å; I345-F388 HydrophobicContact CG1-CE2 3.9Å; I345-F388 HydrophobicContact CG1-CG 3.78Å; I345-F388 HydrophobicContact CG1-CZ 3.87Å; W348-F388 HydrophobicContact CB-CZ 3.86Å; W348-F388 HydrophobicContact CD2-CE2 4.06Å; W348-F388 HydrophobicContact CD2-CZ 4.03Å; W348-F388 AromaticContact CE3-CE2 3.79Å; W348-F388 HydrophobicContact CE3-CE2 3.79Å; W348-F388 HydrophobicContact CE3-CZ 4.04Å; W348-F388 HydrophobicContact CG-CE2 4.46Å; W348-F388 AromaticContact CG-CZ 3.97Å; W348-F388 HydrophobicContact CG-CZ 3.97Å; W348-F388 HydrophobicContact CZ3-CE2 4.29Å; P381-F388 HydrophobicContact CB-CD1 4.46Å; P381-F388 HydrophobicContact CB-CD2 4.23Å; P381-F388 HydrophobicContact CB-CE1 4.08Å; P381-F388 HydrophobicContact CB-CE2 3.86Å; P381-F388 HydrophobicContact CB-CZ 3.76Å; P381-F388 HydrophobicContact CG-CE1 4.46Å; P381-F388 HydrophobicContact CG-CE2 4.03Å; P381-F388 HydrophobicContact CG-CZ 3.79Å; P381-F388 PolarHBondContact O-N 3.25Å; S386-F388 VanDerWaalsContact O-CD1 3.22Å; S386-F388 WeakPolarHBondContact O-CD1 3.46Å; S386-F388 PolarHBondContact O-N 2.96Å; F388-T390 HydrophobicContact CE2-CG2 4.14Å; F388-V393 HydrophobicContact CD2-CG2 4.03Å; F388-V393 HydrophobicContact CE2-CG2 4.28Å
389	S	86.1	Confident	85.1	Confident	58 Å²	58	59.2 Å²	59.2	41%	0.406	30%	0.3	S	S	.	.			trans	-87	116.1	175.3	176.8	0	0	0	0	110.6	R391 V392 V393	S389-R391 PolarHBondContact O-N 3.02Å; S389-V392 PolarHBondContact O-N 3.37Å; S389-V392 VanDerWaalsContact O-N 3.08Å; S389-V393 PolarHBondContact O-N 3.49Å
390	T	85.8	Confident	85.2	Confident	26 Å²	26	56.8 Å²	56.8	16%	0.16	29%	0.29	C	S	.	.	H	α-helix	trans	-58.5	-33.9	174.9	53.3	0	0	0	0	112.2	W348 P381 F388 V393 K394	W348-T390 HydrophobicContact CD2-CG2 4.47Å; W348-T390 HydrophobicContact CH2-CG2 3.87Å; W348-T390 HydrophobicContact CZ2-CG2 3.43Å; W348-T390 VanDerWaalsContact CZ2-CG2 3.43Å; P381-T390 HydrophobicContact CB-CG2 3.87Å; P381-T390 HydrophobicContact CG-CG2 3.55Å; F388-T390 HydrophobicContact CE2-CG2 4.14Å; T390-V393 PolarHBondContact O-N 3.26Å; T390-K394 PolarHBondContact O-N 2.92Å
391	R	84.3	Confident	85.1	Confident	139 Å²	139	57.5 Å²	57.5	53%	0.525	29%	0.293	S	S	.	.	H	α-helix	trans	-62.7	-40.1	173.6	-62.9	-175.9	-176.1	-173.7	0.3	112.5	G42 S389 V393 K394 D395	G42-R391 PolarHBondContact O-NE 2.86Å; G42-R391 PolarHBondContact O-NH2 3.03Å; S389-R391 PolarHBondContact O-N 3.02Å; R391-V393 VanDerWaalsContact C-N 3.29Å; R391-V393 PolarHBondContact O-N 3.28Å; R391-K394 WeakPolarHBondContact O-CA 3.31Å; R391-K394 VanDerWaalsContact O-CB 3.32Å; R391-K394 WeakPolarHBondContact O-CB 3.32Å; R391-K394 PolarHBondContact O-N 3.4Å; R391-K394 VanDerWaalsContact O-N 3.13Å; R391-D395 PolarHBondContact O-N 2.69Å
392	V	86.1	Confident	85.1	Confident	62 Å²	62	60.6 Å²	60.6	38%	0.376	32%	0.315	S	S	.	.	H	α-helix	trans	-65.7	-35.3	176.7	178.3	0	0	0	0	110.7	Y135 S389 D395 I396	Y135-V392 WeakPolarHBondContact OH-CG1 3.47Å; S389-V392 PolarHBondContact O-N 3.37Å; S389-V392 VanDerWaalsContact O-N 3.08Å; V392-D395 PolarHBondContact O-N 2.88Å; V392-I396 HydrophobicContact CG1-CD1 3.92Å; V392-I396 HydrophobicContact CG1-CG1 4.45Å; V392-I396 WeakPolarHBondContact O-CB 3.49Å; V392-I396 WeakPolarHBondContact O-CD1 3.23Å; V392-I396 WeakPolarHBondContact O-CG1 3.05Å; V392-I396 PolarHBondContact O-N 2.79Å
393	V	86.6	Confident	85.4	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-66.5	-37	173.4	-172.4	0	0	0	0	111.7	L131 I345 W348 F388 S389 T390 R391 I396 A397	L131-V393 HydrophobicContact CB-CG1 4.29Å; L131-V393 HydrophobicContact CD1-CG1 4.29Å; I345-V393 HydrophobicContact CD1-CG2 4.37Å; I345-V393 HydrophobicContact CG1-CG2 4.46Å; W348-V393 HydrophobicContact CZ3-CB 4.05Å; W348-V393 HydrophobicContact CZ3-CG1 3.97Å; W348-V393 HydrophobicContact CZ3-CG2 4.37Å; F388-V393 HydrophobicContact CD2-CG2 4.03Å; F388-V393 HydrophobicContact CE2-CG2 4.28Å; S389-V393 PolarHBondContact O-N 3.49Å; T390-V393 PolarHBondContact O-N 3.26Å; R391-V393 VanDerWaalsContact C-N 3.29Å; R391-V393 PolarHBondContact O-N 3.28Å; V393-I396 PolarHBondContact O-N 3.37Å; V393-A397 PolarHBondContact O-N 3.42Å
394	K	84.9	Confident	85.7	Confident	41 Å²	41	56.3 Å²	56.3	18%	0.178	29%	0.293	C	S	.	.	H	α-helix	trans	-60.6	-50.7	169.4	-177.5	-161.6	175.8	170.7	0	111.7	F306 E307 T390 R391 I396 A397 Q398	F306-K394 HydrophobicContact CE1-CB 4.25Å; F306-K394 HydrophobicContact CZ-CB 4.41Å; E307-K394 HydrophobicContact CB-CD 4.25Å; E307-K394 VanDerWaalsContact CD-NZ 3.28Å; E307-K394 HydrophobicContact CG-CD 3.67Å; E307-K394 HydrophobicContact CG-CG 4.11Å; E307-K394 IonicContact OE2-NZ 3.84Å; E307-K394 PolarHBondContact OE2-NZ 3.41Å; T390-K394 PolarHBondContact O-N 2.92Å; R391-K394 WeakPolarHBondContact O-CA 3.31Å; R391-K394 VanDerWaalsContact O-CB 3.32Å; R391-K394 WeakPolarHBondContact O-CB 3.32Å; R391-K394 PolarHBondContact O-N 3.4Å; R391-K394 VanDerWaalsContact O-N 3.13Å; K394-I396 VanDerWaalsContact C-N 3.25Å; K394-I396 PolarHBondContact O-N 3.39Å; K394-A397 WeakPolarHBondContact O-CA 3.26Å; K394-A397 WeakPolarHBondContact O-CB 3.32Å; K394-A397 PolarHBondContact O-N 3.07Å; K394-Q398 PolarHBondContact O-N 3.44Å
395	D	86.7	Confident	86.4	Confident	75 Å²	75	52 Å²	52	40%	0.401	27%	0.272	S	S	.	.	H	α-helix	trans	-60.7	-37.9	-179.7	-60.7	-24.6	0	0	0	110.7	R391 V392 N399	R391-D395 PolarHBondContact O-N 2.69Å; V392-D395 PolarHBondContact O-N 2.88Å; D395-N399 WeakPolarHBondContact O-CB 3.47Å; D395-N399 PolarHBondContact O-N 2.96Å; D395-N399 PolarHBondContact O-ND2 2.88Å
396	I	88.4	Confident	87	Confident	19 Å²	19	49.7 Å²	49.7	10%	0.097	27%	0.265	C	S	.	.	H	α-helix	trans	-62.5	-45.2	172.6	-69.7	161.8	0	0	0	111	L131 P134 Y135 V392 V393 K394 N399 I400	L131-I396 HydrophobicContact CD2-CG2 4.42Å; P134-I396 HydrophobicContact CB-CD1 4.26Å; P134-I396 HydrophobicContact CG-CD1 3.79Å; P134-I396 HydrophobicContact CG-CG1 3.99Å; P134-I396 HydrophobicContact CG-CG2 3.97Å; Y135-I396 HydrophobicContact CD2-CD1 4.48Å; Y135-I396 HydrophobicContact CE2-CD1 3.55Å; V392-I396 HydrophobicContact CG1-CD1 3.92Å; V392-I396 HydrophobicContact CG1-CG1 4.45Å; V392-I396 WeakPolarHBondContact O-CB 3.49Å; V392-I396 WeakPolarHBondContact O-CD1 3.23Å; V392-I396 WeakPolarHBondContact O-CG1 3.05Å; V392-I396 PolarHBondContact O-N 2.79Å; V393-I396 PolarHBondContact O-N 3.37Å; K394-I396 VanDerWaalsContact C-N 3.25Å; K394-I396 PolarHBondContact O-N 3.39Å; I396-N399 PolarHBondContact O-N 2.75Å; I396-I400 HydrophobicContact CG2-CD1 3.65Å; I396-I400 HydrophobicContact CG2-CG1 4.37Å; I396-I400 WeakPolarHBondContact O-CB 3.44Å; I396-I400 VanDerWaalsContact O-CG1 3.3Å; I396-I400 WeakPolarHBondContact O-CG1 3.38Å; I396-I400 PolarHBondContact O-N 3.28Å
397	A	86.9	Confident	87.4	Confident	5 Å²	5	53.3 Å²	53.3	4%	0.041	29%	0.285	C	S	.	.	H	α-helix	trans	-59.3	-50.6	177.3	0	0	0	0	0	111.9	L131 F306 I309 V393 K394 L401	L131-A397 VanDerWaalsContact CD2-CA 3.48Å; L131-A397 HydrophobicContact CD2-CB 3.44Å; L131-A397 VanDerWaalsContact CD2-CB 3.44Å; F306-A397 HydrophobicContact CD1-CB 4.21Å; F306-A397 HydrophobicContact CE1-CB 4.07Å; I309-A397 HydrophobicContact CD1-CB 4.01Å; V393-A397 PolarHBondContact O-N 3.42Å; K394-A397 WeakPolarHBondContact O-CA 3.26Å; K394-A397 WeakPolarHBondContact O-CB 3.32Å; K394-A397 PolarHBondContact O-N 3.07Å; A397-L401 VanDerWaalsContact O-CB 3.3Å; A397-L401 WeakPolarHBondContact O-CB 3.46Å; A397-L401 PolarHBondContact O-N 2.82Å
398	Q	87.3	Confident	87.7	Confident	59 Å²	59	49.2 Å²	49.2	28%	0.276	26%	0.259	S	S	.	.	H	α-helix	trans	-62.8	-44.3	178.6	-72.1	-174.2	-24.4	0	0	111.8	D308 I309 K394 L401 S402	D308-Q398 VanDerWaalsContact CG-NE2 3.32Å; D308-Q398 PolarHBondContact OD1-NE2 3.43Å; D308-Q398 PolarHBondContact OD2-NE2 3.44Å; D308-Q398 VanDerWaalsContact OD2-NE2 3.15Å; I309-Q398 HydrophobicContact CD1-CG 4Å; K394-Q398 PolarHBondContact O-N 3.44Å; Q398-L401 PolarHBondContact O-N 3.15Å; Q398-S402 WeakPolarHBondContact O-CB 3.49Å; Q398-S402 PolarHBondContact O-N 3.31Å
399	N	89.6	Confident	87.4	Confident	112 Å²	112	53.4 Å²	53.4	60%	0.599	29%	0.286	S	S	*	.	H	α-helix	trans	-65.9	-43.7	179.6	-77.5	-48.7	0	0	0	112.5	D395 I396 F403	D395-N399 WeakPolarHBondContact O-CB 3.47Å; D395-N399 PolarHBondContact O-N 2.96Å; D395-N399 PolarHBondContact O-ND2 2.88Å; I396-N399 PolarHBondContact O-N 2.75Å; N399-F403 VanDerWaalsContact O-CB 3.26Å; N399-F403 WeakPolarHBondContact O-CB 3.47Å; N399-F403 PolarHBondContact O-N 3.07Å
400	I	88.7	Confident	87.3	Confident	34 Å²	34	55.1 Å²	55.1	17%	0.174	29%	0.286	C	S	.	.	H	α-helix	trans	-65	-44.8	176.4	-69.1	172.8	0	0	0	110.4	L130 I133 I396 F403 L404	L130-I400 HydrophobicContact CD2-CG2 4.4Å; L130-I400 VanDerWaalsContact O-CD1 3.31Å; L130-I400 WeakPolarHBondContact O-CD1 3.3Å; I133-I400 HydrophobicContact CD1-CD1 4.5Å; I396-I400 HydrophobicContact CG2-CD1 3.65Å; I396-I400 HydrophobicContact CG2-CG1 4.37Å; I396-I400 WeakPolarHBondContact O-CB 3.44Å; I396-I400 VanDerWaalsContact O-CG1 3.3Å; I396-I400 WeakPolarHBondContact O-CG1 3.38Å; I396-I400 PolarHBondContact O-N 3.28Å; I400-F403 PolarHBondContact O-N 3.11Å; I400-L404 HydrophobicContact CG2-CD1 4.13Å; I400-L404 HydrophobicContact CG2-CG 4.48Å; I400-L404 WeakPolarHBondContact O-CG 3.3Å; I400-L404 PolarHBondContact O-N 2.76Å
401	L	86.6	Confident	87.1	Confident	16 Å²	16	55.9 Å²	55.9	8%	0.084	29%	0.288	C	S	.	.	H	α-helix	trans	-67	-40	179.8	-175.7	58.7	0	0	0	112.1	D119 V120 L151 I309 A397 Q398 L404 K405	D119-L401 HydrophobicContact CB-CD2 4.22Å; V120-L401 HydrophobicContact CG2-CD1 3.52Å; V120-L401 HydrophobicContact CG2-CD2 4.28Å; L151-L401 HydrophobicContact CD1-CD1 3.87Å; I309-L401 HydrophobicContact CB-CD2 4.35Å; I309-L401 HydrophobicContact CD1-CD2 4.07Å; I309-L401 HydrophobicContact CG1-CD2 4.08Å; I309-L401 HydrophobicContact CG2-CD2 3.4Å; I309-L401 VanDerWaalsContact CG2-CD2 3.4Å; A397-L401 VanDerWaalsContact O-CB 3.3Å; A397-L401 WeakPolarHBondContact O-CB 3.46Å; A397-L401 PolarHBondContact O-N 2.82Å; Q398-L401 PolarHBondContact O-N 3.15Å; L401-L404 PolarHBondContact O-N 2.93Å; L401-K405 HydrophobicContact CD1-CD 4.22Å; L401-K405 HydrophobicContact CD1-CG 4.17Å; L401-K405 HydrophobicContact CG-CD 4.02Å; L401-K405 HydrophobicContact CG-CG 4.39Å; L401-K405 VanDerWaalsContact O-CB 3.31Å; L401-K405 WeakPolarHBondContact O-CB 3.27Å; L401-K405 VanDerWaalsContact O-CG 3.32Å; L401-K405 WeakPolarHBondContact O-CG 3.31Å; L401-K405 PolarHBondContact O-N 3.31Å
402	S	88.8	Confident	86.8	Confident	67 Å²	67	49.3 Å²	49.3	47%	0.469	26%	0.264	S	S	.	.	H	α-helix	trans	-63.2	-43.7	174	-175.6	0	0	0	0	111.5	Q398 K405 S406	Q398-S402 WeakPolarHBondContact O-CB 3.49Å; Q398-S402 PolarHBondContact O-N 3.31Å; S402-K405 PolarHBondContact O-N 2.64Å; S402-S406 VanDerWaalsContact O-CB 3.3Å; S402-S406 WeakPolarHBondContact O-CB 3.49Å; S402-S406 PolarHBondContact O-N 2.74Å; S402-S406 PolarHBondContact O-OG 3.25Å
403	F	91.1	Very high	86.8	Confident	82 Å²	82	47.4 Å²	47.4	36%	0.36	25%	0.251	S	S	.	.	H	α-helix	trans	-58.8	-49.1	173.1	175	-96.9	0	0	0	111.8	N399 I400 S406 N407 L417 L428	N399-F403 VanDerWaalsContact O-CB 3.26Å; N399-F403 WeakPolarHBondContact O-CB 3.47Å; N399-F403 PolarHBondContact O-N 3.07Å; I400-F403 PolarHBondContact O-N 3.11Å; F403-S406 PolarHBondContact O-N 3.23Å; F403-S406 PolarHBondContact O-OG 2.83Å; F403-S406 VanDerWaalsContact O-OG 3.07Å; F403-N407 WeakPolarHBondContact CD2-ND2 3.4Å; F403-N407 WeakPolarHBondContact O-CB 3.36Å; F403-N407 PolarHBondContact O-N 3.34Å; F403-N407 PolarHBondContact O-ND2 2.82Å; F403-L417 HydrophobicContact CE1-CD1 4.3Å; F403-L428 HydrophobicContact CE1-CB 4.24Å; F403-L428 HydrophobicContact CE1-CD2 4.22Å; F403-L428 HydrophobicContact CZ-CB 4.32Å
404	L	90.9	Very high	86.9	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.01	25%	0.251	C	S	.	.	H	α-helix	trans	-64.1	-46.6	177.9	-69	176.1	0	0	0	111.7	V144 L151 L153 I400 L401 S406 N407 C408 L417 L428	V144-L404 HydrophobicContact CG1-CD2 4.48Å; V144-L404 HydrophobicContact CG2-CD2 4.26Å; L151-L404 HydrophobicContact CD1-CB 3.74Å; L153-L404 HydrophobicContact CD2-CD1 4.32Å; I400-L404 HydrophobicContact CG2-CD1 4.13Å; I400-L404 HydrophobicContact CG2-CG 4.48Å; I400-L404 WeakPolarHBondContact O-CG 3.3Å; I400-L404 PolarHBondContact O-N 2.76Å; L401-L404 PolarHBondContact O-N 2.93Å; L404-S406 VanDerWaalsContact C-N 3.28Å; L404-S406 PolarHBondContact O-N 3.46Å; L404-N407 PolarHBondContact O-N 2.64Å; L404-C408 WeakPolarHBondContact O-CB 3.32Å; L404-C408 PolarHBondContact O-N 3.32Å; L404-L417 HydrophobicContact CD2-CD1 4.13Å; L404-L428 HydrophobicContact CD2-CD1 4.17Å
405	K	86.9	Confident	87.2	Confident	74 Å²	74	46 Å²	46	32%	0.322	24%	0.244	S	C	.	.	H	α-helix	trans	-62.7	-31.2	178.3	-76	177.2	173.8	177.2	0	113.4	D119 L151 L401 S402	D119-K405 VanDerWaalsContact CG-NZ 3.32Å; D119-K405 IonicContact OD1-NZ 3.66Å; D119-K405 PolarHBondContact OD1-NZ 3.04Å; D119-K405 IonicContact OD2-NZ 2.78Å; L151-K405 HydrophobicContact CD1-CG 4.04Å; L401-K405 HydrophobicContact CD1-CD 4.22Å; L401-K405 HydrophobicContact CD1-CG 4.17Å; L401-K405 HydrophobicContact CG-CD 4.02Å; L401-K405 HydrophobicContact CG-CG 4.39Å; L401-K405 VanDerWaalsContact O-CB 3.31Å; L401-K405 WeakPolarHBondContact O-CB 3.27Å; L401-K405 VanDerWaalsContact O-CG 3.32Å; L401-K405 WeakPolarHBondContact O-CG 3.31Å; L401-K405 PolarHBondContact O-N 3.31Å; S402-K405 PolarHBondContact O-N 2.64Å
406	S	88.4	Confident	87.4	Confident	69 Å²	69	42.4 Å²	42.4	48%	0.483	23%	0.225	S	C	.	.	H	α-helix	trans	-85.6	-22.5	179.5	53.6	0	0	0	0	114.3	S402 F403 L404 T409	S402-S406 VanDerWaalsContact O-CB 3.3Å; S402-S406 WeakPolarHBondContact O-CB 3.49Å; S402-S406 PolarHBondContact O-N 2.74Å; S402-S406 PolarHBondContact O-OG 3.25Å; F403-S406 PolarHBondContact O-N 3.23Å; F403-S406 PolarHBondContact O-OG 2.83Å; F403-S406 VanDerWaalsContact O-OG 3.07Å; L404-S406 VanDerWaalsContact C-N 3.28Å; L404-S406 PolarHBondContact O-N 3.46Å; S406-T409 WeakPolarHBondContact O-CG2 3.42Å
407	N	89.4	Confident	87.5	Confident	77 Å²	77	41.7 Å²	41.7	41%	0.412	22%	0.221	S	C	.	.	H	α-helix	trans	-106.9	-28.2	-178.2	-67.9	-94.3	0	0	0	113.4	F403 L404 T409 L428	F403-N407 WeakPolarHBondContact CD2-ND2 3.4Å; F403-N407 WeakPolarHBondContact O-CB 3.36Å; F403-N407 PolarHBondContact O-N 3.34Å; F403-N407 PolarHBondContact O-ND2 2.82Å; L404-N407 PolarHBondContact O-N 2.64Å; N407-T409 PolarHBondContact O-N 3.05Å; N407-L428 HydrophobicContact CB-CD2 3.67Å
408	C	89.3	Confident	87.6	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.222	C	C	.	.			trans	-82.1	59.9	172.4	-62.5	0	0	0	0	111.2	L151 L404 Y415	L151-C408 HydrophobicContact CD2-CB 4.3Å; L404-C408 WeakPolarHBondContact O-CB 3.32Å; L404-C408 PolarHBondContact O-N 3.32Å; C408-Y415 HydrophobicContact CB-CD2 3.7Å; C408-Y415 HydrophobicContact CB-CE2 3.59Å; C408-Y415 HydrophobicContact CB-CG 4.34Å; C408-Y415 WeakPolarHBondContact SG-CD2 3.47Å
409	T	82.3	Confident	87.6	Confident	105 Å²	105	39.4 Å²	39.4	64%	0.644	21%	0.21	S	C	*	.			trans	-80.1	-27.4	-168	54.7	0	0	0	0	114.9	S406 N407 Y415	S406-T409 WeakPolarHBondContact O-CG2 3.42Å; N407-T409 PolarHBondContact O-N 3.05Å; T409-Y415 PolarHBondContact N-OH 3.45Å
410	K	83.8	Confident	87.2	Confident	93 Å²	93	35.8 Å²	35.8	40%	0.404	20%	0.196	S	C	.	.	S	Bend	trans	-84.7	119.9	-179.2	-58.3	178.8	-176.2	171.8	0	109.5	R146 H413 Y415 D430 T433	R146-K410 WeakPolarHBondContact CB-O 3.19Å; K410-H413 HydrophobicContact CB-CB 4.05Å; K410-H413 WeakPolarHBondContact CB-CD2 3.39Å; K410-H413 WeakPolarHBondContact CD-CE1 3.15Å; K410-H413 WeakPolarHBondContact CD-NE2 3.4Å; K410-H413 PolarHBondContact O-N 3.45Å; K410-Y415 WeakPolarHBondContact CB-OH 3.16Å; K410-Y415 PolarHBondContact N-OH 2.92Å; K410-D430 IonicContact NZ-OD2 3.09Å; K410-D430 PolarHBondContact NZ-OD2 3.07Å; K410-T433 PolarHBondContact NZ-OG1 2.67Å
411	E	82.1	Confident	86.9	Confident	42 Å²	42	37.7 Å²	37.7	20%	0.196	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	143.5	172.1	-176.1	167.8	-137.8	0	0	110.6	G148 H413 L455 L479 N482	G148-E411 WeakPolarHBondContact CA-OE1 3.46Å; G148-E411 PolarHBondContact N-OE1 3.34Å; E411-H413 PolarHBondContact O-N 2.83Å; E411-L455 HydrophobicContact CG-CD2 4.13Å; E411-L479 WeakPolarHBondContact OE1-CD2 3.44Å; E411-N482 PolarHBondContact OE2-ND2 3.39Å
412	G	78.6	Confident	86.5	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.01	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.5	-16.4	-176.6	0	0	0	0	0	115	R146 V451	R146-G412 PolarHBondContact O-N 2.93Å; G412-V451 WeakPolarHBondContact O-CG1 3.3Å
413	H	86.1	Confident	86.3	Confident	23 Å²	23	38 Å²	38	11%	0.106	22%	0.223	C	C	.	.			trans	-77	149.2	-179.8	-79.2	-120.3	0	0	0	112.3	R146 K410 E411 Y415 D430 T432	R146-H413 PolarHBondContact N-O 3.34Å; R146-H413 VanDerWaalsContact N-O 3.11Å; K410-H413 HydrophobicContact CB-CB 4.05Å; K410-H413 WeakPolarHBondContact CB-CD2 3.39Å; K410-H413 WeakPolarHBondContact CD-CE1 3.15Å; K410-H413 WeakPolarHBondContact CD-NE2 3.4Å; K410-H413 PolarHBondContact O-N 3.45Å; E411-H413 PolarHBondContact O-N 2.83Å; H413-Y415 HydrophobicContact CB-CD2 4.3Å; H413-Y415 HydrophobicContact CB-CE2 3.6Å; H413-D430 IonicContact CE1-OD1 3.88Å; H413-D430 IonicContact CE1-OD2 2.69Å; H413-D430 IonicContact CG-OD1 3.4Å; H413-D430 VanDerWaalsContact ND1-CG 3.34Å; H413-D430 IonicContact ND1-OD1 3.99Å; H413-D430 PolarHBondContact ND1-OD1 2.97Å; H413-D430 IonicContact ND1-OD2 2.68Å; H413-D430 PolarHBondContact ND1-OD2 3.23Å; H413-T432 WeakPolarHBondContact ND1-CB 3.48Å
414	T	88.6	Confident	85.8	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	123.4	167.2	-61.5	0	0	0	0	109.7	A143 H145 L431 T432 F447	A143-T414 HydrophobicContact CB-CG2 4.38Å; H145-T414 VanDerWaalsContact CE1-CG2 3.4Å; H145-T414 WeakPolarHBondContact CE1-CG2 3.3Å; H145-T414 VanDerWaalsContact ND1-CG2 3.32Å; H145-T414 WeakPolarHBondContact ND1-CG2 3.17Å; H145-T414 PolarHBondContact ND1-OG1 3.11Å; T414-L431 HydrophobicContact CG2-CD1 4.36Å; T414-L431 WeakPolarHBondContact O-CB 3.47Å; T414-L431 PolarHBondContact O-N 3.2Å; T414-T432 PolarHBondContact N-OG1 3.23Å; T414-T432 PolarHBondContact O-N 2.97Å; T414-F447 HydrophobicContact CG2-CB 4.32Å; T414-F447 HydrophobicContact CG2-CD2 3.84Å; T414-F447 HydrophobicContact CG2-CE2 4.41Å; T414-F447 HydrophobicContact CG2-CG 4.17Å; T414-F447 WeakPolarHBondContact OG1-CB 3.3Å
415	Y	90.9	Very high	85.5	Confident	10 Å²	10	45.8 Å²	45.8	4%	0.039	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	155	176	-57.6	-96.2	0	0	0	110.7	A143 V144 C408 T409 K410 H413 L428 Y429 D430	A143-Y415 CarbonylContact C-O 3.42Å; A143-Y415 WeakPolarHBondContact CA-O 3.22Å; V144-Y415 PolarHBondContact N-O 3.43Å; V144-Y415 PolarHBondContact O-N 3.11Å; C408-Y415 HydrophobicContact CB-CD2 3.7Å; C408-Y415 HydrophobicContact CB-CE2 3.59Å; C408-Y415 HydrophobicContact CB-CG 4.34Å; C408-Y415 WeakPolarHBondContact SG-CD2 3.47Å; T409-Y415 PolarHBondContact N-OH 3.45Å; K410-Y415 WeakPolarHBondContact CB-OH 3.16Å; K410-Y415 PolarHBondContact N-OH 2.92Å; H413-Y415 HydrophobicContact CB-CD2 4.3Å; H413-Y415 HydrophobicContact CB-CE2 3.6Å; Y415-L428 HydrophobicContact CD1-CG 4.48Å; Y415-Y429 CarbonylContact C-O 3.59Å; Y415-Y429 WeakPolarHBondContact CA-O 3.42Å; Y415-D430 HydrophobicContact CD1-CB 3.88Å; Y415-D430 HydrophobicContact CE1-CB 3.81Å
416	W	90.4	Very high	85.5	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	113.1	176.8	174.5	35.9	0	0	0	110.4	S141 M142 L156 T158 Y178 I182 F418 L428 Y429 L431	S141-W416 PolarHBondContact OG-NE1 3.49Å; M142-W416 WeakPolarHBondContact O-CA 3.3Å; L156-W416 HydrophobicContact CD2-CD2 4.28Å; L156-W416 HydrophobicContact CD2-CG 3.92Å; T158-W416 HydrophobicContact CG2-CZ2 3.97Å; Y178-W416 AromaticContact CD2-CH2 3.69Å; Y178-W416 HydrophobicContact CD2-CH2 3.69Å; Y178-W416 HydrophobicContact CD2-CZ2 4.03Å; Y178-W416 HydrophobicContact CE2-CH2 4.27Å; Y178-W416 HydrophobicContact CE2-CZ2 4.26Å; I182-W416 HydrophobicContact CD1-CH2 3.21Å; I182-W416 HydrophobicContact CD1-CZ2 3.75Å; I182-W416 HydrophobicContact CD1-CZ3 3.94Å; W416-F418 HydrophobicContact CD2-CB 4.32Å; W416-F418 AromaticContact CE2-CD2 3.96Å; W416-F418 HydrophobicContact CZ2-CB 4.31Å; W416-F418 AromaticContact CZ2-CD2 3.71Å; W416-F418 HydrophobicContact CZ2-CD2 3.71Å; W416-F418 HydrophobicContact CZ2-CE2 4.33Å; W416-F418 HydrophobicContact CZ2-CG 4.11Å; W416-F418 AromaticContact NE1-CD2 3.98Å; W416-L428 WeakPolarHBondContact O-CA 3.12Å; W416-Y429 HydrophobicContact CD2-CD2 4.33Å; W416-Y429 AromaticContact CE3-CD2 3.8Å; W416-Y429 HydrophobicContact CE3-CD2 3.8Å; W416-Y429 HydrophobicContact CE3-CE2 4.48Å; W416-Y429 HydrophobicContact CE3-CG 4.3Å; W416-Y429 HydrophobicContact CZ3-CD2 4.36Å; W416-Y429 PolarHBondContact N-O 3.18Å; W416-Y429 PolarHBondContact O-N 3.49Å; W416-L431 HydrophobicContact CB-CD1 3.81Å; W416-L431 HydrophobicContact CB-CD2 3.9Å; W416-L431 HydrophobicContact CB-CG 3.65Å; W416-L431 HydrophobicContact CD2-CD2 4.44Å; W416-L431 HydrophobicContact CE3-CD2 3.91Å
417	L	91.1	Very high	85.5	Confident	4 Å²	4	45.9 Å²	45.9	2%	0.021	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	116.4	173.3	-169.8	75.9	0	0	0	108.8	L130 S141 M142 V144 F403 L404 V426 K427 L428	L130-L417 HydrophobicContact CD2-CD2 3.45Å; L130-L417 VanDerWaalsContact CD2-CD2 3.45Å; S141-L417 WeakPolarHBondContact CA-O 3.4Å; M142-L417 PolarHBondContact N-O 3.34Å; M142-L417 PolarHBondContact O-N 3.21Å; V144-L417 HydrophobicContact CG2-CB 4.26Å; F403-L417 HydrophobicContact CE1-CD1 4.3Å; L404-L417 HydrophobicContact CD2-CD1 4.13Å; L417-V426 HydrophobicContact CD1-CG1 3.46Å; L417-V426 VanDerWaalsContact CD1-CG1 3.46Å; L417-V426 HydrophobicContact CD2-CG1 4.46Å; L417-V426 HydrophobicContact CG-CG1 3.8Å; L417-K427 WeakPolarHBondContact CA-O 3.48Å; L417-L428 HydrophobicContact CB-CD1 4.15Å; L417-L428 HydrophobicContact CD1-CB 4.44Å; L417-L428 HydrophobicContact CD1-CD1 3.95Å
418	F	88.6	Confident	85.5	Confident	11 Å²	11	44.1 Å²	44.1	5%	0.048	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	133.6	-174.7	-176.6	-101	0	0	0	112.8	V140 I182 W416 A420 K427 Y429	V140-F418 WeakPolarHBondContact O-CA 3.41Å; V140-F418 WeakPolarHBondContact O-CD2 3.41Å; I182-F418 HydrophobicContact CB-CE1 4.43Å; I182-F418 HydrophobicContact CD1-CD1 3.73Å; I182-F418 HydrophobicContact CD1-CD2 4.19Å; I182-F418 HydrophobicContact CD1-CE1 3.58Å; I182-F418 HydrophobicContact CD1-CE2 4.06Å; I182-F418 HydrophobicContact CD1-CG 4.04Å; I182-F418 HydrophobicContact CD1-CZ 3.76Å; I182-F418 HydrophobicContact CG1-CD1 4.14Å; I182-F418 HydrophobicContact CG1-CE1 3.81Å; I182-F418 HydrophobicContact CG1-CZ 4.3Å; I182-F418 HydrophobicContact CG2-CE1 3.72Å; I182-F418 HydrophobicContact CG2-CZ 3.68Å; W416-F418 HydrophobicContact CD2-CB 4.32Å; W416-F418 AromaticContact CE2-CD2 3.96Å; W416-F418 HydrophobicContact CZ2-CB 4.31Å; W416-F418 AromaticContact CZ2-CD2 3.71Å; W416-F418 HydrophobicContact CZ2-CD2 3.71Å; W416-F418 HydrophobicContact CZ2-CE2 4.33Å; W416-F418 HydrophobicContact CZ2-CG 4.11Å; W416-F418 AromaticContact NE1-CD2 3.98Å; F418-A420 HydrophobicContact CE1-CB 3.93Å; F418-A420 HydrophobicContact CZ-CB 4.28Å; F418-K427 PolarHBondContact N-O 3.41Å; F418-K427 PolarHBondContact O-N 3.37Å; F418-Y429 HydrophobicContact CB-CE2 4.31Å
419	K	87.6	Confident	85.5	Confident	6 Å²	6	46 Å²	46	3%	0.026	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	123.4	170.6	-173.9	-177.3	-168.1	-77.3	0	108.1	I133 S136 H139 V140 S423 V426	I133-K419 HydrophobicContact CG2-CD 4.11Å; S136-K419 PolarHBondContact O-NZ 2.92Å; H139-K419 CarbonylContact C-O 3.6Å; H139-K419 WeakPolarHBondContact CA-O 3.33Å; H139-K419 WeakPolarHBondContact CB-O 3.31Å; V140-K419 HydrophobicContact CB-CB 4.04Å; V140-K419 HydrophobicContact CG2-CB 4.49Å; V140-K419 HydrophobicContact CG2-CD 4.49Å; V140-K419 PolarHBondContact N-O 3.3Å; V140-K419 PolarHBondContact O-N 3.07Å; K419-S423 VanDerWaalsContact CE-O 3.3Å; K419-S423 WeakPolarHBondContact CE-O 3.38Å; K419-S423 PolarHBondContact NZ-O 3.22Å; K419-V426 HydrophobicContact CB-CG2 4.32Å; K419-V426 HydrophobicContact CD-CG2 4.14Å; K419-V426 HydrophobicContact CG-CG2 4.29Å
420	A	81.8	Confident	85.8	Confident	36 Å²	36	42.3 Å²	42.3	30%	0.298	24%	0.237	S	C	.	.			trans	-72.9	151	176.7	0	0	0	0	0	111.5	F418 G422 S423	F418-A420 HydrophobicContact CE1-CB 3.93Å; F418-A420 HydrophobicContact CZ-CB 4.28Å; A420-G422 PolarHBondContact O-N 3Å; A420-S423 WeakPolarHBondContact O-CB 3.47Å; A420-S423 PolarHBondContact O-N 2.74Å
421	S	81.8	Confident	85.8	Confident	73 Å²	73	37.9 Å²	37.9	51%	0.51	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	124	175.9	-168.6	0	0	0	0	110.2	S423	S421-S423 VanDerWaalsContact C-N 3.25Å; S421-S423 PolarHBondContact O-N 3.31Å
422	G	78.9	Confident	85.8	Confident	50 Å²	50	36.1 Å²	36.1	52%	0.515	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.3	4	-177	0	0	0	0	0	115.6	K137 A420	K137-G422 PolarHBondContact O-N 3.23Å; A420-G422 PolarHBondContact O-N 3Å
423	S	82.8	Confident	86.1	Confident	40 Å²	40	37.5 Å²	37.5	28%	0.28	22%	0.218	S	C	.	.			trans	-94.5	142.8	171.2	-173	0	0	0	0	111	K419 A420 S421 I425	K419-S423 VanDerWaalsContact CE-O 3.3Å; K419-S423 WeakPolarHBondContact CE-O 3.38Å; K419-S423 PolarHBondContact NZ-O 3.22Å; A420-S423 WeakPolarHBondContact O-CB 3.47Å; A420-S423 PolarHBondContact O-N 2.74Å; S421-S423 VanDerWaalsContact C-N 3.25Å; S421-S423 PolarHBondContact O-N 3.31Å; S423-I425 PolarHBondContact OG-N 2.74Å
424	D	81.3	Confident	85.8	Confident	136 Å²	136	38.4 Å²	38.4	73%	0.727	22%	0.224	S	C	*	.			trans	-92.7	-2	176.3	-55.9	-41.9	0	0	0	112.7
425	I	84.1	Confident	85.2	Confident	111 Å²	111	38.7 Å²	38.7	57%	0.569	23%	0.226	S	C	*	.			trans	-99.2	127.5	-180	-58.6	174.6	0	0	0	110	S423 K427	S423-I425 PolarHBondContact OG-N 2.74Å; I425-K427 HydrophobicContact CG2-CG 4.16Å
426	V	86.6	Confident	84.3	Confident	49 Å²	49	45 Å²	45	30%	0.297	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	134.6	166.8	-172.2	0	0	0	0	108.6	I133 L417 K419	I133-V426 HydrophobicContact CG2-CG2 3.81Å; L417-V426 HydrophobicContact CD1-CG1 3.46Å; L417-V426 VanDerWaalsContact CD1-CG1 3.46Å; L417-V426 HydrophobicContact CD2-CG1 4.46Å; L417-V426 HydrophobicContact CG-CG1 3.8Å; K419-V426 HydrophobicContact CB-CG2 4.32Å; K419-V426 HydrophobicContact CD-CG2 4.14Å; K419-V426 HydrophobicContact CG-CG2 4.29Å
427	K	88.4	Confident	83.3	Confident	96 Å²	96	51.5 Å²	51.5	42%	0.417	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	148.5	176.9	-59.9	-176.2	-176.5	179.5	0	109.8	L417 F418 I425 Y429	L417-K427 WeakPolarHBondContact CA-O 3.48Å; F418-K427 PolarHBondContact N-O 3.41Å; F418-K427 PolarHBondContact O-N 3.37Å; I425-K427 HydrophobicContact CG2-CG 4.16Å; K427-Y429 HydrophobicContact CB-CD2 4.42Å; K427-Y429 HydrophobicContact CB-CE2 3.72Å; K427-Y429 HydrophobicContact CD-CE2 4.26Å; K427-Y429 WeakPolarHBondContact CD-OH 3.34Å
428	L	91.2	Very high	82	Confident	40 Å²	40	53 Å²	53	21%	0.209	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	127.1	174.8	-173.8	70.6	0	0	0	108.3	F403 L404 N407 Y415 W416 L417	F403-L428 HydrophobicContact CE1-CB 4.24Å; F403-L428 HydrophobicContact CE1-CD2 4.22Å; F403-L428 HydrophobicContact CZ-CB 4.32Å; L404-L428 HydrophobicContact CD2-CD1 4.17Å; N407-L428 HydrophobicContact CB-CD2 3.67Å; Y415-L428 HydrophobicContact CD1-CG 4.48Å; W416-L428 WeakPolarHBondContact O-CA 3.12Å; L417-L428 HydrophobicContact CB-CD1 4.15Å; L417-L428 HydrophobicContact CD1-CB 4.44Å; L417-L428 HydrophobicContact CD1-CD1 3.95Å
429	Y	88.5	Confident	80.3	Confident	39 Å²	39	62 Å²	62	15%	0.153	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	137.8	-179.5	-60.9	-80.7	0	0	0	109.9	L181 Y415 W416 F418 K427 L431 L434	L181-Y429 HydrophobicContact CD1-CD1 3.95Å; L181-Y429 HydrophobicContact CD1-CE1 3.69Å; Y415-Y429 CarbonylContact C-O 3.59Å; Y415-Y429 WeakPolarHBondContact CA-O 3.42Å; W416-Y429 HydrophobicContact CD2-CD2 4.33Å; W416-Y429 AromaticContact CE3-CD2 3.8Å; W416-Y429 HydrophobicContact CE3-CD2 3.8Å; W416-Y429 HydrophobicContact CE3-CE2 4.48Å; W416-Y429 HydrophobicContact CE3-CG 4.3Å; W416-Y429 HydrophobicContact CZ3-CD2 4.36Å; W416-Y429 PolarHBondContact N-O 3.18Å; W416-Y429 PolarHBondContact O-N 3.49Å; F418-Y429 HydrophobicContact CB-CE2 4.31Å; K427-Y429 HydrophobicContact CB-CD2 4.42Å; K427-Y429 HydrophobicContact CB-CE2 3.72Å; K427-Y429 HydrophobicContact CD-CE2 4.26Å; K427-Y429 WeakPolarHBondContact CD-OH 3.34Å; Y429-L431 PolarHBondContact O-N 3.38Å; Y429-L434 HydrophobicContact CD1-CD1 4.48Å
430	D	88.7	Confident	78.8	Confident	29 Å²	29	66.9 Å²	66.9	16%	0.155	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	98.6	172.2	-178.8	-11.2	0	0	0	109	K410 H413 Y415 T432 T433 L434	K410-D430 IonicContact NZ-OD2 3.09Å; K410-D430 PolarHBondContact NZ-OD2 3.07Å; H413-D430 IonicContact CE1-OD1 3.88Å; H413-D430 IonicContact CE1-OD2 2.69Å; H413-D430 IonicContact CG-OD1 3.4Å; H413-D430 VanDerWaalsContact ND1-CG 3.34Å; H413-D430 IonicContact ND1-OD1 3.99Å; H413-D430 PolarHBondContact ND1-OD1 2.97Å; H413-D430 IonicContact ND1-OD2 2.68Å; H413-D430 PolarHBondContact ND1-OD2 3.23Å; Y415-D430 HydrophobicContact CD1-CB 3.88Å; Y415-D430 HydrophobicContact CE1-CB 3.81Å; D430-T432 PolarHBondContact O-N 3.03Å; D430-T432 WeakPolarHBondContact OD1-CB 3.43Å; D430-T432 PolarHBondContact OD1-N 3.31Å; D430-T433 PolarHBondContact OD1-N 2.97Å; D430-T433 VanDerWaalsContact OD1-N 3.11Å; D430-T433 PolarHBondContact OD2-OG1 3.47Å; D430-L434 WeakPolarHBondContact O-CB 3.24Å; D430-L434 VanDerWaalsContact O-CG 3.25Å; D430-L434 WeakPolarHBondContact O-CG 3.28Å; D430-L434 PolarHBondContact O-N 2.99Å
431	L	83	Confident	77.3	Confident	0 Å²	0	75 Å²	75	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-67.5	-22	-178.4	-69.2	-174.9	0	0	0	112.8	L156 W173 L174 T414 W416 Y429 C435	L156-L431 HydrophobicContact CD2-CD1 4.27Å; W173-L431 HydrophobicContact CH2-CB 4.36Å; W173-L431 HydrophobicContact CZ3-CD2 4.47Å; L174-L431 HydrophobicContact CD1-CD2 3.92Å; T414-L431 HydrophobicContact CG2-CD1 4.36Å; T414-L431 WeakPolarHBondContact O-CB 3.47Å; T414-L431 PolarHBondContact O-N 3.2Å; W416-L431 HydrophobicContact CB-CD1 3.81Å; W416-L431 HydrophobicContact CB-CD2 3.9Å; W416-L431 HydrophobicContact CB-CG 3.65Å; W416-L431 HydrophobicContact CD2-CD2 4.44Å; W416-L431 HydrophobicContact CE3-CD2 3.91Å; Y429-L431 PolarHBondContact O-N 3.38Å; L431-C435 VanDerWaalsContact O-CB 3.24Å; L431-C435 WeakPolarHBondContact O-CB 3.47Å; L431-C435 PolarHBondContact O-N 3.13Å; L431-C435 VanDerWaalsContact O-N 3.1Å
432	T	83.3	Confident	76	Confident	5 Å²	5	80.8 Å²	80.8	3%	0.031	41%	0.411	C	S	.	.	H	α-helix	trans	-75	-51.7	-179.7	-50.5	0	0	0	0	109.2	H413 T414 D430 L434 C435 E436 N445	H413-T432 WeakPolarHBondContact ND1-CB 3.48Å; T414-T432 PolarHBondContact N-OG1 3.23Å; T414-T432 PolarHBondContact O-N 2.97Å; D430-T432 PolarHBondContact O-N 3.03Å; D430-T432 WeakPolarHBondContact OD1-CB 3.43Å; D430-T432 PolarHBondContact OD1-N 3.31Å; T432-L434 VanDerWaalsContact C-N 3.33Å; T432-L434 PolarHBondContact O-N 3.23Å; T432-C435 PolarHBondContact O-N 3.38Å; T432-C435 VanDerWaalsContact O-N 3.13Å; T432-E436 WeakPolarHBondContact O-CG 3.48Å; T432-E436 PolarHBondContact O-N 3.28Å; T432-N445 PolarHBondContact OG1-ND2 3.35Å
433	T	84.3	Confident	75	Confident	30 Å²	30	79.8 Å²	79.8	18%	0.184	40%	0.396	C	S	.	.	H	α-helix	trans	-60.3	-42.4	174.5	-53.6	0	0	0	0	111.4	K410 D430 C435 E436 E437	K410-T433 PolarHBondContact NZ-OG1 2.67Å; D430-T433 PolarHBondContact OD1-N 2.97Å; D430-T433 VanDerWaalsContact OD1-N 3.11Å; D430-T433 PolarHBondContact OD2-OG1 3.47Å; T433-C435 VanDerWaalsContact C-N 3.26Å; T433-C435 PolarHBondContact O-N 3.4Å; T433-E436 WeakPolarHBondContact O-CB 3.37Å; T433-E436 PolarHBondContact O-N 2.86Å; T433-E436 VanDerWaalsContact O-N 3.15Å; T433-E437 WeakPolarHBondContact O-CG 3.33Å; T433-E437 PolarHBondContact O-N 3.43Å; T433-E437 VanDerWaalsContact O-N 3.13Å
434	L	80.5	Confident	74.1	Confident	41 Å²	41	81.7 Å²	81.7	22%	0.215	40%	0.401	C	S	.	.	H	α-helix	trans	-67.4	-21.9	178	-73.1	171.4	0	0	0	114.5	I177 Y429 D430 T432	I177-L434 HydrophobicContact CD1-CB 3.96Å; Y429-L434 HydrophobicContact CD1-CD1 4.48Å; D430-L434 WeakPolarHBondContact O-CB 3.24Å; D430-L434 VanDerWaalsContact O-CG 3.25Å; D430-L434 WeakPolarHBondContact O-CG 3.28Å; D430-L434 PolarHBondContact O-N 2.99Å; T432-L434 VanDerWaalsContact C-N 3.33Å; T432-L434 PolarHBondContact O-N 3.23Å
435	C	75.1	Confident	73.6	Confident	7 Å²	7	75.6 Å²	75.6	5%	0.047	37%	0.368	C	S	.	.	H	α-helix	trans	-80.9	-29.7	173.6	-171.5	0	0	0	0	111.7	W173 L431 T432 T433 C443 N445	W173-C435 HydrophobicContact CD2-CB 4.44Å; W173-C435 HydrophobicContact CE3-CB 4.02Å; W173-C435 HydrophobicContact CH2-CB 4.14Å; W173-C435 HydrophobicContact CZ3-CB 3.87Å; L431-C435 VanDerWaalsContact O-CB 3.24Å; L431-C435 WeakPolarHBondContact O-CB 3.47Å; L431-C435 PolarHBondContact O-N 3.13Å; L431-C435 VanDerWaalsContact O-N 3.1Å; T432-C435 PolarHBondContact O-N 3.38Å; T432-C435 VanDerWaalsContact O-N 3.13Å; T433-C435 VanDerWaalsContact C-N 3.26Å; T433-C435 PolarHBondContact O-N 3.4Å; C435-C443 PolarHBondContact SG-O 3.4Å; C435-N445 HydrophobicContact CB-CB 4.16Å
436	E	73.3	Confident	73.2	Confident	142 Å²	142	72.6 Å²	72.6	66%	0.664	36%	0.356	S	S	*	.	H	α-helix	trans	-73.3	-28.6	174.7	-67.6	166.1	-175	0	0	112.2	T432 T433 A438	T432-E436 WeakPolarHBondContact O-CG 3.48Å; T432-E436 PolarHBondContact O-N 3.28Å; T433-E436 WeakPolarHBondContact O-CB 3.37Å; T433-E436 PolarHBondContact O-N 2.86Å; T433-E436 VanDerWaalsContact O-N 3.15Å; E436-A438 VanDerWaalsContact C-N 3.34Å
437	E	68.4	Low	72.9	Confident	137 Å²	137	72 Å²	72	64%	0.64	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-3.9	177.5	-71	176.5	-175.8	0	0	114.5	T433	T433-E437 WeakPolarHBondContact O-CG 3.33Å; T433-E437 PolarHBondContact O-N 3.43Å; T433-E437 VanDerWaalsContact O-N 3.13Å
438	A	63.3	Low	72.6	Confident	34 Å²	34	68.4 Å²	68.4	28%	0.281	34%	0.335	S	S	.	.			trans	-79.3	128.4	-179.3	0	0	0	0	0	111.5	W173 E436 E440 C443	W173-A438 HydrophobicContact CB-CB 4.37Å; E436-A438 VanDerWaalsContact C-N 3.34Å; A438-E440 PolarHBondContact O-N 3.47Å; A438-C443 HydrophobicContact CB-CB 4.38Å
439	E	53.2	Low	72.2	Confident	201 Å²	201	68.6 Å²	68.6	94%	0.939	34%	0.337	S	S	*	.	S	Bend	trans	-67.3	-5.1	-171.6	-62.4	179.5	168.1	0	0	115.2
440	E	56.3	Low	72	Confident	109 Å²	109	69.3 Å²	69.3	51%	0.509	35%	0.346	S	S	.	.			trans	-95.1	117.2	177.7	-65.9	-166.2	148.1	0	0	112.6	A438 K442 C443	A438-E440 PolarHBondContact O-N 3.47Å; E440-K442 PolarHBondContact O-N 2.92Å; E440-C443 PolarHBondContact O-N 3.17Å; E440-C443 VanDerWaalsContact O-N 3.16Å; E440-C443 PolarHBondContact O-SG 2.91Å
441	E	51.4	Low	71.8	Confident	206 Å²	206	67.9 Å²	67.9	96%	0.963	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-0.1	177.5	-66.3	-177.1	137.9	0	0	116.3
442	K	53.3	Low	72	Confident	194 Å²	194	67.9 Å²	67.9	84%	0.843	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	-2.2	-178.6	-68.7	-177.5	180	174.6	0	114.5	E440 Q444	E440-K442 PolarHBondContact O-N 2.92Å; K442-Q444 PolarHBondContact O-N 3.3Å; K442-Q444 VanDerWaalsContact O-N 3.13Å
443	C	57.6	Low	72.1	Confident	29 Å²	29	69 Å²	69	20%	0.196	35%	0.345	C	S	.	.			trans	-78.4	97.4	-176.6	-61	0	0	0	0	111.9	W173 C435 A438 E440	W173-C443 HydrophobicContact CB-CB 4.36Å; W173-C443 HydrophobicContact CG-CB 4.31Å; C435-C443 PolarHBondContact SG-O 3.4Å; A438-C443 HydrophobicContact CB-CB 4.38Å; E440-C443 PolarHBondContact O-N 3.17Å; E440-C443 VanDerWaalsContact O-N 3.16Å; E440-C443 PolarHBondContact O-SG 2.91Å
444	Q	63.6	Low	72.2	Confident	80 Å²	80	67.8 Å²	67.8	37%	0.374	34%	0.337	S	S	.	.			trans	-103.4	121.8	171	-173.2	164.7	-11.5	0	0	110.1	K442 P446	K442-Q444 PolarHBondContact O-N 3.3Å; K442-Q444 VanDerWaalsContact O-N 3.13Å; Q444-P446 VanDerWaalsContact O-CD 3.31Å; Q444-P446 WeakPolarHBondContact O-CD 3.37Å; Q444-P446 VanDerWaalsContact O-N 3.16Å
445	N	72.1	Confident	72.5	Confident	8 Å²	8	65.9 Å²	65.9	4%	0.043	33%	0.327	C	S	.	.			trans	-60.9	117.6	175.4	172.1	2.7	0	0	0	109.6	T432 C435 F447 T448	T432-N445 PolarHBondContact OG1-ND2 3.35Å; C435-N445 HydrophobicContact CB-CB 4.16Å; N445-F447 PolarHBondContact O-N 3.48Å; N445-F447 WeakPolarHBondContact OD1-CD2 3.21Å; N445-F447 PolarHBondContact OD1-N 3.01Å; N445-T448 WeakPolarHBondContact CB-OG1 3.31Å; N445-T448 WeakPolarHBondContact O-CB 3.35Å; N445-T448 PolarHBondContact O-N 3.42Å; N445-T448 VanDerWaalsContact O-N 3.1Å; N445-T448 PolarHBondContact O-OG1 2.93Å
446	P	75.5	Confident	73.2	Confident	49 Å²	49	67.4 Å²	67.4	32%	0.318	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-14.1	-172.4	26.1	-32.8	0	0	0	113.5	W171 Q444 P450	W171-P446 HydrophobicContact CD2-CG 4.34Å; W171-P446 HydrophobicContact CE3-CG 4.17Å; W171-P446 HydrophobicContact CH2-CB 4.2Å; W171-P446 HydrophobicContact CH2-CG 3.18Å; W171-P446 HydrophobicContact CZ2-CB 3.95Å; W171-P446 HydrophobicContact CZ2-CG 3.31Å; W171-P446 HydrophobicContact CZ3-CG 3.62Å; Q444-P446 VanDerWaalsContact O-CD 3.31Å; Q444-P446 WeakPolarHBondContact O-CD 3.37Å; Q444-P446 VanDerWaalsContact O-N 3.16Å; P446-P450 WeakPolarHBondContact O-CD 3.48Å
447	F	80.3	Confident	73.8	Confident	37 Å²	37	63.7 Å²	63.7	16%	0.162	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-15.3	174.8	-58.2	-71.6	0	0	0	113.3	F104 H145 L156 W171 T414 N445 L449 P450 V451	F104-F447 HydrophobicContact CE2-CD1 4.36Å; H145-F447 AromaticContact CE1-CD1 3.38Å; H145-F447 WeakPolarHBondContact CE1-CD1 3.47Å; H145-F447 AromaticContact CE1-CE1 3.83Å; H145-F447 AromaticContact CE1-CG 3.57Å; L156-F447 HydrophobicContact CD1-CE2 4.08Å; L156-F447 HydrophobicContact CD1-CZ 3.82Å; W171-F447 AromaticContact CH2-CE2 3.83Å; W171-F447 HydrophobicContact CH2-CE2 3.83Å; W171-F447 AromaticContact CH2-CZ 3.94Å; W171-F447 HydrophobicContact CH2-CZ 3.94Å; W171-F447 HydrophobicContact CZ3-CE2 4.13Å; T414-F447 HydrophobicContact CG2-CB 4.32Å; T414-F447 HydrophobicContact CG2-CD2 3.84Å; T414-F447 HydrophobicContact CG2-CE2 4.41Å; T414-F447 HydrophobicContact CG2-CG 4.17Å; T414-F447 WeakPolarHBondContact OG1-CB 3.3Å; N445-F447 PolarHBondContact O-N 3.48Å; N445-F447 WeakPolarHBondContact OD1-CD2 3.21Å; N445-F447 PolarHBondContact OD1-N 3.01Å; F447-L449 PolarHBondContact O-N 3.1Å; F447-P450 WeakPolarHBondContact O-CD 3.41Å; F447-V451 WeakPolarHBondContact O-CB 3.49Å; F447-V451 VanDerWaalsContact O-CG2 3.24Å; F447-V451 WeakPolarHBondContact O-CG2 3.29Å; F447-V451 PolarHBondContact O-N 3.03Å
448	T	81.1	Confident	74.6	Confident	19 Å²	19	57.3 Å²	57.3	12%	0.117	28%	0.283	C	S	.	.	H	α-helix	trans	-60.2	-45.7	-176.3	-61.2	0	0	0	0	112.6	N445 V451 A452 L486	N445-T448 WeakPolarHBondContact CB-OG1 3.31Å; N445-T448 WeakPolarHBondContact O-CB 3.35Å; N445-T448 PolarHBondContact O-N 3.42Å; N445-T448 VanDerWaalsContact O-N 3.1Å; N445-T448 PolarHBondContact O-OG1 2.93Å; T448-V451 PolarHBondContact O-N 3.18Å; T448-A452 WeakPolarHBondContact O-CB 3.16Å; T448-A452 PolarHBondContact O-N 3.27Å; T448-L486 HydrophobicContact CG2-CB 4Å; T448-L486 HydrophobicContact CG2-CD2 4.46Å; T448-L486 WeakPolarHBondContact CG2-O 3.37Å
449	L	82.5	Confident	75.8	Confident	45 Å²	45	55.7 Å²	55.7	24%	0.236	27%	0.269	C	S	.	.	H	α-helix	trans	-66.8	-49.9	179.1	175.9	66.5	0	0	0	112.5	F447 V451 A452 V453 L487 I495	F447-L449 PolarHBondContact O-N 3.1Å; L449-V451 VanDerWaalsContact C-N 3.32Å; L449-V451 PolarHBondContact O-N 3.23Å; L449-A452 PolarHBondContact O-N 3.38Å; L449-V453 HydrophobicContact CD1-CG2 3.92Å; L449-V453 HydrophobicContact CG-CG2 4.4Å; L449-V453 WeakPolarHBondContact O-CB 3.37Å; L449-V453 WeakPolarHBondContact O-CG2 3.48Å; L449-V453 PolarHBondContact O-N 2.89Å; L449-L487 HydrophobicContact CD1-CD2 3.94Å; L449-I495 HydrophobicContact CD1-CD1 3.95Å
450	P	84.2	Confident	77.3	Confident	53 Å²	53	48 Å²	48	34%	0.344	24%	0.238	S	C	.	.	H	α-helix	trans	-52.8	-43.9	172.1	-29.9	34.7	0	0	0	114.2	F104 P446 F447 L454	F104-P450 HydrophobicContact CD1-CB 4.08Å; F104-P450 HydrophobicContact CE1-CB 3.92Å; F104-P450 HydrophobicContact CE2-CB 4.48Å; F104-P450 HydrophobicContact CG-CB 4.43Å; F104-P450 HydrophobicContact CZ-CB 4.13Å; P446-P450 WeakPolarHBondContact O-CD 3.48Å; F447-P450 WeakPolarHBondContact O-CD 3.41Å; P450-L454 WeakPolarHBondContact O-CB 3.36Å; P450-L454 PolarHBondContact O-N 3.18Å
451	V	85.8	Confident	78.7	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-67	-45.8	179	175.9	0	0	0	0	111.4	F104 H145 V147 G412 F447 T448 L449 V453 L454 L455 L486	F104-V451 HydrophobicContact CE1-CB 4.48Å; F104-V451 HydrophobicContact CE1-CG2 3.67Å; F104-V451 HydrophobicContact CZ-CG2 3.59Å; H145-V451 HydrophobicContact CB-CG2 4.09Å; V147-V451 HydrophobicContact CG2-CG1 4.37Å; G412-V451 WeakPolarHBondContact O-CG1 3.3Å; F447-V451 WeakPolarHBondContact O-CB 3.49Å; F447-V451 VanDerWaalsContact O-CG2 3.24Å; F447-V451 WeakPolarHBondContact O-CG2 3.29Å; F447-V451 PolarHBondContact O-N 3.03Å; T448-V451 PolarHBondContact O-N 3.18Å; L449-V451 VanDerWaalsContact C-N 3.32Å; L449-V451 PolarHBondContact O-N 3.23Å; V451-V453 PolarHBondContact O-N 2.8Å; V451-L454 PolarHBondContact O-N 3.25Å; V451-L455 HydrophobicContact CG1-CD1 4.14Å; V451-L455 HydrophobicContact CG1-CG 4.44Å; V451-L455 WeakPolarHBondContact O-CG 3.37Å; V451-L455 PolarHBondContact O-N 2.92Å; V451-L486 HydrophobicContact CG1-CD1 4.41Å
452	A	86.2	Confident	80.2	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-63.7	-39.9	178	0	0	0	0	0	112.7	T448 L449 L454 L455 Y456 C483 L486 L487	T448-A452 WeakPolarHBondContact O-CB 3.16Å; T448-A452 PolarHBondContact O-N 3.27Å; L449-A452 PolarHBondContact O-N 3.38Å; A452-L454 VanDerWaalsContact C-N 3.34Å; A452-L455 PolarHBondContact O-N 2.97Å; A452-Y456 PolarHBondContact O-N 3.46Å; A452-C483 PolarHBondContact O-SG 3.39Å; A452-L486 HydrophobicContact CB-CB 4.2Å; A452-L486 HydrophobicContact CB-CD1 4.31Å; A452-L487 HydrophobicContact CB-CD1 3.81Å; A452-L487 HydrophobicContact CB-CD2 3.68Å; A452-L487 HydrophobicContact CB-CG 3.59Å
453	V	86.4	Confident	81.5	Confident	27 Å²	27	28.9 Å²	28.9	16%	0.164	15%	0.153	C	C	.	.	H	α-helix	trans	-63.3	-40.3	174.2	170	0	0	0	0	111.2	L449 V451 Y456 R457 I495	L449-V453 HydrophobicContact CD1-CG2 3.92Å; L449-V453 HydrophobicContact CG-CG2 4.4Å; L449-V453 WeakPolarHBondContact O-CB 3.37Å; L449-V453 WeakPolarHBondContact O-CG2 3.48Å; L449-V453 PolarHBondContact O-N 2.89Å; V451-V453 PolarHBondContact O-N 2.8Å; V453-Y456 PolarHBondContact O-N 3.49Å; V453-R457 HydrophobicContact CG1-CG 4.48Å; V453-R457 WeakPolarHBondContact O-CB 3.47Å; V453-R457 WeakPolarHBondContact O-CG 3.25Å; V453-R457 PolarHBondContact O-N 2.77Å; V453-I495 HydrophobicContact CG2-CD1 3.75Å
454	L	85.7	Confident	82.5	Confident	6 Å²	6	32.5 Å²	32.5	3%	0.031	17%	0.17	C	C	.	.	H	α-helix	trans	-67	-43.4	176.6	-176.2	57.5	0	0	0	111.6	F104 A107 I111 V147 L152 P450 V451 A452 Y456 R457 V458	F104-L454 HydrophobicContact CD1-CD2 4.01Å; F104-L454 HydrophobicContact CE1-CD2 4.36Å; A107-L454 HydrophobicContact CB-CD1 4.23Å; A107-L454 HydrophobicContact CB-CD2 3.93Å; I111-L454 HydrophobicContact CD1-CD1 4.34Å; V147-L454 HydrophobicContact CG1-CD2 4.42Å; V147-L454 HydrophobicContact CG1-CG 4.34Å; V147-L454 HydrophobicContact CG2-CD2 4.08Å; L152-L454 HydrophobicContact CD1-CD2 4.38Å; L152-L454 HydrophobicContact CD2-CD2 3.47Å; L152-L454 VanDerWaalsContact CD2-CD2 3.47Å; P450-L454 WeakPolarHBondContact O-CB 3.36Å; P450-L454 PolarHBondContact O-N 3.18Å; V451-L454 PolarHBondContact O-N 3.25Å; A452-L454 VanDerWaalsContact C-N 3.34Å; L454-Y456 PolarHBondContact O-N 3.29Å; L454-R457 PolarHBondContact O-N 2.98Å; L454-V458 HydrophobicContact CD1-CG2 4.03Å; L454-V458 HydrophobicContact CG-CG2 4.36Å; L454-V458 WeakPolarHBondContact O-CB 3.27Å; L454-V458 VanDerWaalsContact O-CG2 3.31Å; L454-V458 WeakPolarHBondContact O-CG2 3.19Å; L454-V458 PolarHBondContact O-N 3.05Å
455	L	87.4	Confident	82.9	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-56.3	-46.8	173.4	-71.5	168.4	0	0	0	111.8	V147 E411 V451 A452 A459 L479 N482 C483 L486	V147-L455 HydrophobicContact CG1-CD2 4.04Å; E411-L455 HydrophobicContact CG-CD2 4.13Å; V451-L455 HydrophobicContact CG1-CD1 4.14Å; V451-L455 HydrophobicContact CG1-CG 4.44Å; V451-L455 WeakPolarHBondContact O-CG 3.37Å; V451-L455 PolarHBondContact O-N 2.92Å; A452-L455 PolarHBondContact O-N 2.97Å; L455-A459 VanDerWaalsContact O-CB 3.31Å; L455-A459 WeakPolarHBondContact O-CB 3.33Å; L455-A459 PolarHBondContact O-N 3.1Å; L455-L479 HydrophobicContact CD2-CD2 3.5Å; L455-L479 VanDerWaalsContact CD2-CD2 3.5Å; L455-N482 HydrophobicContact CD1-CB 4.35Å; L455-C483 HydrophobicContact CB-CB 4.11Å; L455-L486 HydrophobicContact CD1-CD1 3.58Å
456	Y	88.8	Confident	82.5	Confident	39 Å²	39	32 Å²	32	15%	0.153	17%	0.167	C	C	.	.	H	α-helix	trans	-61.3	-44.1	176.1	174.4	-100.9	0	0	0	112.5	A452 V453 L454 A459 S460 L480 I495 S498 A499 M502	A452-Y456 PolarHBondContact O-N 3.46Å; V453-Y456 PolarHBondContact O-N 3.49Å; L454-Y456 PolarHBondContact O-N 3.29Å; Y456-A459 WeakPolarHBondContact O-CB 3.31Å; Y456-A459 PolarHBondContact O-N 3.45Å; Y456-S460 WeakPolarHBondContact O-CB 3.44Å; Y456-S460 PolarHBondContact O-N 2.88Å; Y456-L480 HydrophobicContact CD2-CD2 3.87Å; Y456-L480 HydrophobicContact CE2-CD2 4.43Å; Y456-I495 HydrophobicContact CG-CG2 4.4Å; Y456-S498 WeakPolarHBondContact OH-CB 3.24Å; Y456-A499 HydrophobicContact CD2-CB 4.1Å; Y456-A499 HydrophobicContact CE2-CB 4.39Å; Y456-M502 HydrophobicContact CE2-CE 3.69Å; Y456-M502 HydrophobicContact CE2-SD 4.36Å
457	R	86.9	Confident	81.8	Confident	65 Å²	65	34 Å²	34	25%	0.245	18%	0.182	C	C	.	.	H	α-helix	trans	-70.6	-38.4	-179	-73.1	174.8	166.4	-100.2	3.6	112.8	Y108 I111 V453 L454 S460 N461	Y108-R457 PolarHBondContact OH-NH1 3.47Å; Y108-R457 VanDerWaalsContact OH-NH1 3.09Å; Y108-R457 PolarHBondContact OH-NH2 3.39Å; I111-R457 HydrophobicContact CD1-CB 3.4Å; I111-R457 VanDerWaalsContact CD1-CB 3.4Å; V453-R457 HydrophobicContact CG1-CG 4.48Å; V453-R457 WeakPolarHBondContact O-CB 3.47Å; V453-R457 WeakPolarHBondContact O-CG 3.25Å; V453-R457 PolarHBondContact O-N 2.77Å; L454-R457 PolarHBondContact O-N 2.98Å; R457-S460 WeakPolarHBondContact O-CB 3.49Å; R457-S460 PolarHBondContact O-N 2.97Å; R457-N461 PolarHBondContact O-N 3.47Å
458	V	86.1	Confident	80.7	Confident	3 Å²	3	40.7 Å²	40.7	2%	0.018	21%	0.213	C	C	.	.	H	α-helix	trans	-63.5	-44.1	173.2	173.5	0	0	0	0	109.7	I111 I114 L454 S460 N461 L462 L479	I111-V458 HydrophobicContact CD1-CG2 4.06Å; I111-V458 HydrophobicContact CG1-CG2 3.76Å; I114-V458 HydrophobicContact CB-CG2 4.17Å; I114-V458 HydrophobicContact CG2-CG2 3.87Å; L454-V458 HydrophobicContact CD1-CG2 4.03Å; L454-V458 HydrophobicContact CG-CG2 4.36Å; L454-V458 WeakPolarHBondContact O-CB 3.27Å; L454-V458 VanDerWaalsContact O-CG2 3.31Å; L454-V458 WeakPolarHBondContact O-CG2 3.19Å; L454-V458 PolarHBondContact O-N 3.05Å; V458-S460 VanDerWaalsContact C-N 3.34Å; V458-S460 PolarHBondContact O-N 3.31Å; V458-N461 PolarHBondContact O-N 2.86Å; V458-L462 HydrophobicContact CG1-CD1 4.05Å; V458-L462 HydrophobicContact CG1-CG 4.45Å; V458-L462 WeakPolarHBondContact O-CB 3.48Å; V458-L462 VanDerWaalsContact O-CG 3.3Å; V458-L462 WeakPolarHBondContact O-CG 3.25Å; V458-L462 PolarHBondContact O-N 3.14Å; V458-L479 HydrophobicContact CG1-CD1 3.96Å
459	A	87.4	Confident	79.9	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-58.9	-42.8	172.8	0	0	0	0	0	112.7	L455 Y456 L462 M463 I476 L479 L480 M502	L455-A459 VanDerWaalsContact O-CB 3.31Å; L455-A459 WeakPolarHBondContact O-CB 3.33Å; L455-A459 PolarHBondContact O-N 3.1Å; Y456-A459 WeakPolarHBondContact O-CB 3.31Å; Y456-A459 PolarHBondContact O-N 3.45Å; A459-L462 PolarHBondContact O-N 3.11Å; A459-M463 PolarHBondContact O-N 3.35Å; A459-I476 HydrophobicContact CB-CG2 4.2Å; A459-L479 HydrophobicContact CB-CB 3.97Å; A459-L479 HydrophobicContact CB-CD1 4.31Å; A459-L480 HydrophobicContact CB-CD1 4.45Å; A459-L480 HydrophobicContact CB-CD2 3.63Å; A459-L480 HydrophobicContact CB-CG 3.72Å; A459-M502 HydrophobicContact CB-SD 4.44Å
460	S	85.9	Confident	79.2	Confident	40 Å²	40	47.2 Å²	47.2	28%	0.28	24%	0.238	S	C	.	.	H	α-helix	trans	-63.8	-44.1	177.5	-164.2	0	0	0	0	112.9	Y456 R457 V458 M463 L464 M502	Y456-S460 WeakPolarHBondContact O-CB 3.44Å; Y456-S460 PolarHBondContact O-N 2.88Å; R457-S460 WeakPolarHBondContact O-CB 3.49Å; R457-S460 PolarHBondContact O-N 2.97Å; V458-S460 VanDerWaalsContact C-N 3.34Å; V458-S460 PolarHBondContact O-N 3.31Å; S460-M463 PolarHBondContact O-N 2.94Å; S460-L464 PolarHBondContact O-N 3.34Å; S460-M502 WeakPolarHBondContact OG-CE 3.44Å
461	N	84.3	Confident	78.5	Confident	28 Å²	28	51.9 Å²	51.9	15%	0.15	25%	0.253	C	S	.	.	H	α-helix	trans	-65.2	-43.4	176	176.2	-77.7	0	0	0	111	I111 D112 R457 V458 M463 L464 K465	I111-N461 HydrophobicContact CG2-CB 4.35Å; D112-N461 PolarHBondContact OD1-ND2 3.07Å; D112-N461 PolarHBondContact OD1-OD1 2.88Å; R457-N461 PolarHBondContact O-N 3.47Å; V458-N461 PolarHBondContact O-N 2.86Å; N461-M463 VanDerWaalsContact C-N 3.27Å; N461-M463 PolarHBondContact O-N 3.31Å; N461-L464 PolarHBondContact O-N 3.46Å; N461-K465 PolarHBondContact O-N 3.48Å; N461-K465 WeakPolarHBondContact OD1-CE 3.35Å; N461-K465 PolarHBondContact OD1-NZ 3.02Å
462	L	83	Confident	77.9	Confident	17 Å²	17	53.7 Å²	53.7	9%	0.089	26%	0.261	C	S	.	.	H	α-helix	trans	-61.7	-33.7	174	-74.2	175.2	0	0	0	112.1	V458 A459 L464 K465 A466 I476 L479	V458-L462 HydrophobicContact CG1-CD1 4.05Å; V458-L462 HydrophobicContact CG1-CG 4.45Å; V458-L462 WeakPolarHBondContact O-CB 3.48Å; V458-L462 VanDerWaalsContact O-CG 3.3Å; V458-L462 WeakPolarHBondContact O-CG 3.25Å; V458-L462 PolarHBondContact O-N 3.14Å; A459-L462 PolarHBondContact O-N 3.11Å; L462-L464 PolarHBondContact O-N 2.74Å; L462-K465 CarbonylContact O-C 3.49Å; L462-K465 PolarHBondContact O-N 3.33Å; L462-A466 WeakPolarHBondContact O-CB 3.49Å; L462-A466 PolarHBondContact O-N 2.98Å; L462-I476 HydrophobicContact CB-CD1 3.97Å; L462-I476 HydrophobicContact CB-CG1 3.66Å; L462-I476 HydrophobicContact CD1-CG1 4.41Å; L462-L479 HydrophobicContact CD1-CD1 3.72Å
463	M	81.1	Confident	77.6	Confident	61 Å²	61	54.6 Å²	54.6	30%	0.3	27%	0.265	S	S	.	.	H	α-helix	trans	-65.1	-37.7	177.9	-164.1	171.3	81.7	0	0	112.5	A459 S460 N461 K465 A466 S467 I476 M502 E505	A459-M463 PolarHBondContact O-N 3.35Å; S460-M463 PolarHBondContact O-N 2.94Å; N461-M463 VanDerWaalsContact C-N 3.27Å; N461-M463 PolarHBondContact O-N 3.31Å; M463-K465 PolarHBondContact O-N 2.95Å; M463-A466 PolarHBondContact O-N 3.03Å; M463-S467 PolarHBondContact O-N 3.29Å; M463-I476 HydrophobicContact CB-CD1 4.36Å; M463-M502 HydrophobicContact CE-CG 3.93Å; M463-M502 HydrophobicContact SD-CG 3.4Å; M463-M502 WeakPolarHBondContact SD-CG 3.5Å; M463-M502 HydrophobicContact SD-SD 4.26Å; M463-E505 HydrophobicContact CE-CB 4.44Å; M463-E505 HydrophobicContact SD-CB 4.03Å
464	L	77.8	Confident	77.3	Confident	106 Å²	106	54.3 Å²	54.3	56%	0.555	27%	0.267	S	S	*	.	H	α-helix	trans	-59.5	-46.3	172.8	-63.1	171.6	0	0	0	111	S460 N461 L462 S467	S460-L464 PolarHBondContact O-N 3.34Å; N461-L464 PolarHBondContact O-N 3.46Å; L462-L464 PolarHBondContact O-N 2.74Å; L464-S467 PolarHBondContact O-OG 3.04Å
465	K	72	Confident	77	Confident	76 Å²	76	57.4 Å²	57.4	33%	0.33	28%	0.28	S	S	.	.	H	α-helix	trans	-69	-32.9	177	-67.1	168.6	179.2	159.6	0	113.1	D112 N461 L462 M463 S467 Q468	D112-K465 WeakPolarHBondContact OD1-CE 3.37Å; D112-K465 IonicContact OD1-NZ 2.63Å; D112-K465 PolarHBondContact OD1-NZ 3.15Å; N461-K465 PolarHBondContact O-N 3.48Å; N461-K465 WeakPolarHBondContact OD1-CE 3.35Å; N461-K465 PolarHBondContact OD1-NZ 3.02Å; L462-K465 CarbonylContact O-C 3.49Å; L462-K465 PolarHBondContact O-N 3.33Å; M463-K465 PolarHBondContact O-N 2.95Å; K465-S467 PolarHBondContact O-N 3.37Å; K465-Q468 PolarHBondContact O-N 3.09Å; K465-Q468 VanDerWaalsContact O-N 3.15Å
466	A	64.5	Low	76.8	Confident	2 Å²	2	57.4 Å²	57.4	2%	0.017	28%	0.28	C	S	.	.	H	α-helix	trans	-71.7	-17	-175	0	0	0	0	0	113.6	L462 M463 Q468 N469 H472 Y473 I476	L462-A466 WeakPolarHBondContact O-CB 3.49Å; L462-A466 PolarHBondContact O-N 2.98Å; M463-A466 PolarHBondContact O-N 3.03Å; A466-Q468 PolarHBondContact O-N 3.35Å; A466-Q468 VanDerWaalsContact O-N 3.14Å; A466-N469 CarbonylContact O-C 3.4Å; A466-N469 PolarHBondContact O-N 3.01Å; A466-H472 HydrophobicContact CB-CB 3.93Å; A466-Y473 HydrophobicContact CB-CD1 3.91Å; A466-Y473 HydrophobicContact CB-CE1 3.74Å; A466-I476 HydrophobicContact CB-CD1 3.64Å
467	S	60	Low	76.7	Confident	89 Å²	89	58.3 Å²	58.3	62%	0.622	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-28.2	166.6	64.4	0	0	0	0	112.9	M463 L464 K465	M463-S467 PolarHBondContact O-N 3.29Å; L464-S467 PolarHBondContact O-OG 3.04Å; K465-S467 PolarHBondContact O-N 3.37Å
468	Q	58.7	Low	76.7	Confident	178 Å²	178	58.4 Å²	58.4	83%	0.832	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	-11.4	179.7	-59.9	173.1	2.9	0	0	113.3	K465 A466	K465-Q468 PolarHBondContact O-N 3.09Å; K465-Q468 VanDerWaalsContact O-N 3.15Å; A466-Q468 PolarHBondContact O-N 3.35Å; A466-Q468 VanDerWaalsContact O-N 3.14Å
469	N	63.7	Low	76.7	Confident	63 Å²	63	58.8 Å²	58.8	34%	0.337	29%	0.293	S	S	.	.			trans	-158	104.2	-174	-175.3	-2	0	0	0	113.1	A466 K471 H472	A466-N469 CarbonylContact O-C 3.4Å; A466-N469 PolarHBondContact O-N 3.01Å; N469-K471 PolarHBondContact O-N 3.28Å; N469-K471 VanDerWaalsContact OD1-CB 3.27Å; N469-K471 WeakPolarHBondContact OD1-CB 3.39Å; N469-K471 WeakPolarHBondContact OD1-CD 3.4Å; N469-K471 VanDerWaalsContact OD1-CG 3.25Å; N469-K471 WeakPolarHBondContact OD1-CG 3.31Å; N469-K471 PolarHBondContact OD1-N 3.41Å; N469-K471 VanDerWaalsContact OD1-N 3.15Å; N469-H472 PolarHBondContact O-CD2 2.97Å; N469-H472 PolarHBondContact O-N 3.32Å
470	R	67.2	Low	76.7	Confident	138 Å²	138	58.8 Å²	58.8	52%	0.521	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-58.9	-16.7	-179.9	-70	-178.4	172.5	-166.4	-6.3	114.7	H472 Y473 E511	R470-H472 PolarHBondContact O-N 3.04Å; R470-H472 VanDerWaalsContact O-N 3.09Å; R470-Y473 WeakPolarHBondContact O-CB 3.45Å; R470-Y473 PolarHBondContact O-N 3.41Å; R470-Y473 VanDerWaalsContact O-N 3.11Å; R470-E511 IonicContact CZ-OE1 2.81Å; R470-E511 IonicContact NH1-OE1 3.18Å; R470-E511 PolarHBondContact NH1-OE1 3.41Å; R470-E511 IonicContact NH2-OE1 2.84Å; R470-E511 PolarHBondContact NH2-OE1 3.27Å
471	K	69.3	Low	76.9	Confident	152 Å²	152	60 Å²	60	66%	0.661	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-60.2	-20.2	178.5	-65.5	172.2	-176.1	169.5	0	114	N469	N469-K471 PolarHBondContact O-N 3.28Å; N469-K471 VanDerWaalsContact OD1-CB 3.27Å; N469-K471 WeakPolarHBondContact OD1-CB 3.39Å; N469-K471 WeakPolarHBondContact OD1-CD 3.4Å; N469-K471 VanDerWaalsContact OD1-CG 3.25Å; N469-K471 WeakPolarHBondContact OD1-CG 3.31Å; N469-K471 PolarHBondContact OD1-N 3.41Å; N469-K471 VanDerWaalsContact OD1-N 3.15Å
472	H	73.3	Confident	76.9	Confident	37 Å²	37	60.6 Å²	60.6	17%	0.171	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-83.4	-16	179	-63	-85.1	0	0	0	113.7	A466 N469 R470 G474 K475 I476	A466-H472 HydrophobicContact CB-CB 3.93Å; N469-H472 PolarHBondContact O-CD2 2.97Å; N469-H472 PolarHBondContact O-N 3.32Å; R470-H472 PolarHBondContact O-N 3.04Å; R470-H472 VanDerWaalsContact O-N 3.09Å; H472-G474 VanDerWaalsContact C-N 3.34Å; H472-G474 PolarHBondContact O-N 3.21Å; H472-K475 WeakPolarHBondContact O-CB 3.24Å; H472-K475 PolarHBondContact O-N 3.14Å; H472-I476 HydrophobicContact CB-CD1 4.15Å; H472-I476 WeakPolarHBondContact O-CG1 3.31Å; H472-I476 PolarHBondContact O-N 3Å
473	Y	79.8	Confident	77.2	Confident	20 Å²	20	59.8 Å²	59.8	8%	0.078	30%	0.295	C	S	.	.	H	α-helix	trans	-59.6	-41.6	-173	-81.3	39	0	0	0	112.4	A466 R470 K475 I476 R477 L506 Q508 F595	A466-Y473 HydrophobicContact CB-CD1 3.91Å; A466-Y473 HydrophobicContact CB-CE1 3.74Å; R470-Y473 WeakPolarHBondContact O-CB 3.45Å; R470-Y473 PolarHBondContact O-N 3.41Å; R470-Y473 VanDerWaalsContact O-N 3.11Å; Y473-K475 VanDerWaalsContact C-N 3.33Å; Y473-K475 PolarHBondContact O-N 3.4Å; Y473-I476 PolarHBondContact O-N 3.19Å; Y473-R477 WeakPolarHBondContact O-CB 3.45Å; Y473-R477 PolarHBondContact O-N 2.68Å; Y473-L506 HydrophobicContact CD2-CB 4.33Å; Y473-L506 HydrophobicContact CD2-CD2 4.06Å; Y473-L506 WeakPolarHBondContact CD2-O 3.09Å; Y473-L506 HydrophobicContact CE2-CD2 4.46Å; Y473-L506 VanDerWaalsContact CE2-O 3.32Å; Y473-L506 WeakPolarHBondContact CE2-O 3.39Å; Y473-L506 HydrophobicContact CG-CD2 4.08Å; Y473-Q508 PolarHBondContact OH-NE2 3.21Å; Y473-F595 HydrophobicContact CD2-CD1 4.13Å; Y473-F595 HydrophobicContact CD2-CE1 4.19Å; Y473-F595 HydrophobicContact CG-CD1 4.45Å
474	G	79.9	Confident	77.6	Confident	21 Å²	21	57.8 Å²	57.8	22%	0.216	29%	0.286	C	S	.	.	H	α-helix	trans	-61.3	-39.4	176.2	0	0	0	0	0	112.8	H472 T478	H472-G474 VanDerWaalsContact C-N 3.34Å; H472-G474 PolarHBondContact O-N 3.21Å; G474-T478 PolarHBondContact O-N 2.83Å; G474-T478 PolarHBondContact O-OG1 3.26Å
475	K	80.3	Confident	78	Confident	70 Å²	70	61.3 Å²	61.3	30%	0.304	30%	0.297	S	S	.	.	H	α-helix	trans	-68.3	-46.9	176.4	-57.1	-173.7	-168.9	179.5	0	111.1	D116 H472 Y473 R477 T478 L479	D116-K475 IonicContact OD1-NZ 2.8Å; D116-K475 PolarHBondContact OD1-NZ 3.35Å; D116-K475 IonicContact OD2-NZ 2.69Å; D116-K475 PolarHBondContact OD2-NZ 3.03Å; H472-K475 WeakPolarHBondContact O-CB 3.24Å; H472-K475 PolarHBondContact O-N 3.14Å; Y473-K475 VanDerWaalsContact C-N 3.33Å; Y473-K475 PolarHBondContact O-N 3.4Å; K475-R477 VanDerWaalsContact C-N 3.32Å; K475-R477 PolarHBondContact O-N 3.29Å; K475-T478 PolarHBondContact O-N 3.3Å; K475-L479 VanDerWaalsContact O-CG 3.31Å; K475-L479 WeakPolarHBondContact O-CG 3.22Å; K475-L479 PolarHBondContact O-N 3.13Å
476	I	84.3	Confident	78.5	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-57.9	-45.7	179	-63.8	161.6	0	0	0	110.3	A459 L462 M463 A466 H472 Y473 T478 L479 L480 L506	A459-I476 HydrophobicContact CB-CG2 4.2Å; L462-I476 HydrophobicContact CB-CD1 3.97Å; L462-I476 HydrophobicContact CB-CG1 3.66Å; L462-I476 HydrophobicContact CD1-CG1 4.41Å; M463-I476 HydrophobicContact CB-CD1 4.36Å; A466-I476 HydrophobicContact CB-CD1 3.64Å; H472-I476 HydrophobicContact CB-CD1 4.15Å; H472-I476 WeakPolarHBondContact O-CG1 3.31Å; H472-I476 PolarHBondContact O-N 3Å; Y473-I476 PolarHBondContact O-N 3.19Å; I476-T478 PolarHBondContact O-N 3.18Å; I476-L479 PolarHBondContact O-N 3.21Å; I476-L480 HydrophobicContact CG2-CD1 3.71Å; I476-L480 HydrophobicContact CG2-CG 4.32Å; I476-L480 WeakPolarHBondContact O-CB 3.45Å; I476-L480 VanDerWaalsContact O-CG 3.31Å; I476-L480 WeakPolarHBondContact O-CG 3.5Å; I476-L480 PolarHBondContact O-N 3.45Å; I476-L506 HydrophobicContact CB-CD2 4.16Å; I476-L506 HydrophobicContact CD1-CD2 4.45Å; I476-L506 HydrophobicContact CG2-CD1 4.25Å; I476-L506 HydrophobicContact CG2-CD2 3.86Å; I476-L506 HydrophobicContact CG2-CG 4.48Å
477	R	86.5	Confident	79.4	Confident	58 Å²	58	60 Å²	60	22%	0.219	29%	0.293	C	S	.	.	H	α-helix	trans	-56.4	-48.8	175.3	-177.6	175.2	175.2	90.6	-4	112.2	Y473 K475 L480 L481 L503 L506 F595 Y611	Y473-R477 WeakPolarHBondContact O-CB 3.45Å; Y473-R477 PolarHBondContact O-N 2.68Å; K475-R477 VanDerWaalsContact C-N 3.32Å; K475-R477 PolarHBondContact O-N 3.29Å; R477-L480 PolarHBondContact O-N 3.03Å; R477-L481 HydrophobicContact CG-CD1 3.82Å; R477-L481 HydrophobicContact CG-CG 4.38Å; R477-L481 WeakPolarHBondContact O-CB 3.47Å; R477-L481 VanDerWaalsContact O-CG 3.26Å; R477-L481 WeakPolarHBondContact O-CG 3.35Å; R477-L481 PolarHBondContact O-N 3.48Å; R477-L503 HydrophobicContact CB-CD2 4.45Å; R477-L503 HydrophobicContact CG-CD2 4.09Å; R477-L506 HydrophobicContact CB-CD1 3.79Å; R477-F595 VanDerWaalsContact CD-CE2 3.45Å; R477-Y611 PolarHBondContact NH1-OH 2.82Å; R477-Y611 PolarHBondContact NH2-OH 3.39Å
478	T	85.3	Confident	80.4	Confident	68 Å²	68	58.3 Å²	58.3	42%	0.417	28%	0.277	S	S	.	.	H	α-helix	trans	-62.7	-46.6	179.5	-60.3	0	0	0	0	111.9	G474 K475 I476 L480 L481 N482	G474-T478 PolarHBondContact O-N 2.83Å; G474-T478 PolarHBondContact O-OG1 3.26Å; K475-T478 PolarHBondContact O-N 3.3Å; I476-T478 PolarHBondContact O-N 3.18Å; T478-L480 PolarHBondContact O-N 3.04Å; T478-L481 PolarHBondContact O-N 3.46Å; T478-N482 WeakPolarHBondContact O-CB 3.42Å; T478-N482 PolarHBondContact O-N 2.97Å; T478-N482 PolarHBondContact O-ND2 3.07Å
479	L	86.3	Confident	81.2	Confident	11 Å²	11	53.1 Å²	53.1	6%	0.058	26%	0.259	C	S	.	.	H	α-helix	trans	-58.7	-44.4	177.8	-68.7	168	0	0	0	112	E411 L455 V458 A459 L462 K475 I476 C483	E411-L479 WeakPolarHBondContact OE1-CD2 3.44Å; L455-L479 HydrophobicContact CD2-CD2 3.5Å; L455-L479 VanDerWaalsContact CD2-CD2 3.5Å; V458-L479 HydrophobicContact CG1-CD1 3.96Å; A459-L479 HydrophobicContact CB-CB 3.97Å; A459-L479 HydrophobicContact CB-CD1 4.31Å; L462-L479 HydrophobicContact CD1-CD1 3.72Å; K475-L479 VanDerWaalsContact O-CG 3.31Å; K475-L479 WeakPolarHBondContact O-CG 3.22Å; K475-L479 PolarHBondContact O-N 3.13Å; I476-L479 PolarHBondContact O-N 3.21Å; L479-C483 WeakPolarHBondContact O-CB 3.46Å; L479-C483 PolarHBondContact O-N 3.16Å
480	L	88.8	Confident	81.7	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-71.1	-40.7	179.6	-68.3	172.2	0	0	0	112.8	Y456 A459 I476 R477 T478 N482 C483 V484 A499 M502 L503	Y456-L480 HydrophobicContact CD2-CD2 3.87Å; Y456-L480 HydrophobicContact CE2-CD2 4.43Å; A459-L480 HydrophobicContact CB-CD1 4.45Å; A459-L480 HydrophobicContact CB-CD2 3.63Å; A459-L480 HydrophobicContact CB-CG 3.72Å; I476-L480 HydrophobicContact CG2-CD1 3.71Å; I476-L480 HydrophobicContact CG2-CG 4.32Å; I476-L480 WeakPolarHBondContact O-CB 3.45Å; I476-L480 VanDerWaalsContact O-CG 3.31Å; I476-L480 WeakPolarHBondContact O-CG 3.5Å; I476-L480 PolarHBondContact O-N 3.45Å; R477-L480 PolarHBondContact O-N 3.03Å; T478-L480 PolarHBondContact O-N 3.04Å; L480-N482 VanDerWaalsContact C-N 3.33Å; L480-C483 WeakPolarHBondContact O-CB 3.5Å; L480-C483 PolarHBondContact O-N 3.22Å; L480-V484 WeakPolarHBondContact O-CG2 3.45Å; L480-V484 PolarHBondContact O-N 3.48Å; L480-A499 HydrophobicContact CD2-CB 4.06Å; L480-M502 HydrophobicContact CD1-CB 3.86Å; L480-M502 HydrophobicContact CD1-CG 3.72Å; L480-M502 HydrophobicContact CD1-SD 3.87Å; L480-M502 HydrophobicContact CD2-CB 4.47Å; L480-M502 HydrophobicContact CD2-SD 3.82Å; L480-M502 HydrophobicContact CG-SD 4.4Å; L480-L503 HydrophobicContact CB-CD1 4.13Å; L480-L503 HydrophobicContact CB-CD2 3.83Å; L480-L503 HydrophobicContact CB-CG 3.78Å; L480-L503 HydrophobicContact CD1-CD2 4.07Å; L480-L503 HydrophobicContact CD1-CG 3.91Å
481	L	88.3	Confident	82.2	Confident	65 Å²	65	55.3 Å²	55.3	34%	0.34	27%	0.271	S	S	.	.	H	α-helix	trans	-64	-39.7	175.1	-71.7	173.6	0	0	0	111.5	R477 T478 V484 K485 L503	R477-L481 HydrophobicContact CG-CD1 3.82Å; R477-L481 HydrophobicContact CG-CG 4.38Å; R477-L481 WeakPolarHBondContact O-CB 3.47Å; R477-L481 VanDerWaalsContact O-CG 3.26Å; R477-L481 WeakPolarHBondContact O-CG 3.35Å; R477-L481 PolarHBondContact O-N 3.48Å; T478-L481 PolarHBondContact O-N 3.46Å; L481-V484 PolarHBondContact O-N 3.19Å; L481-K485 WeakPolarHBondContact O-CB 3.48Å; L481-K485 PolarHBondContact O-N 2.98Å; L481-L503 HydrophobicContact CD2-CD1 3.92Å; L481-L503 HydrophobicContact CG-CD1 4.42Å; L481-L503 HydrophobicContact CG-CD2 4.32Å
482	N	86.2	Confident	82.8	Confident	41 Å²	41	49.7 Å²	49.7	22%	0.219	25%	0.247	C	C	.	.	H	α-helix	trans	-68.5	-40.5	175	-73	-22.4	0	0	0	111.6	E411 L455 T478 L480 V484 K485 L486	E411-N482 PolarHBondContact OE2-ND2 3.39Å; L455-N482 HydrophobicContact CD1-CB 4.35Å; T478-N482 WeakPolarHBondContact O-CB 3.42Å; T478-N482 PolarHBondContact O-N 2.97Å; T478-N482 PolarHBondContact O-ND2 3.07Å; L480-N482 VanDerWaalsContact C-N 3.33Å; N482-V484 PolarHBondContact O-N 3.39Å; N482-K485 PolarHBondContact O-N 3.42Å; N482-L486 WeakPolarHBondContact O-CD1 3.32Å; N482-L486 VanDerWaalsContact O-CG 3.22Å; N482-L486 WeakPolarHBondContact O-CG 3.36Å; N482-L486 PolarHBondContact O-N 3.49Å; N482-L486 VanDerWaalsContact O-N 3.13Å
483	C	89	Confident	83.3	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-55.4	-49	171.7	177	0	0	0	0	112.3	A452 L455 L479 L480 L486 L487	A452-C483 PolarHBondContact O-SG 3.39Å; L455-C483 HydrophobicContact CB-CB 4.11Å; L479-C483 WeakPolarHBondContact O-CB 3.46Å; L479-C483 PolarHBondContact O-N 3.16Å; L480-C483 WeakPolarHBondContact O-CB 3.5Å; L480-C483 PolarHBondContact O-N 3.22Å; C483-L486 PolarHBondContact O-N 3.39Å; C483-L487 WeakPolarHBondContact O-CG 3.26Å
484	V	88.6	Confident	83.5	Confident	18 Å²	18	49.7 Å²	49.7	11%	0.109	25%	0.249	C	C	.	.	H	α-helix	trans	-65.9	-40.3	179.2	170.6	0	0	0	0	111.6	L480 L481 N482 L486 L487 I496 A499 Y500	L480-V484 WeakPolarHBondContact O-CG2 3.45Å; L480-V484 PolarHBondContact O-N 3.48Å; L481-V484 PolarHBondContact O-N 3.19Å; N482-V484 PolarHBondContact O-N 3.39Å; V484-L486 VanDerWaalsContact C-N 3.28Å; V484-L486 PolarHBondContact O-N 2.94Å; V484-L487 PolarHBondContact O-N 3.34Å; V484-I496 HydrophobicContact CG1-CG2 4.15Å; V484-I496 HydrophobicContact CG2-CG2 4.39Å; V484-A499 HydrophobicContact CG2-CB 3.62Å; V484-Y500 HydrophobicContact CG1-CE1 4.01Å; V484-Y500 HydrophobicContact CG1-CE2 4.15Å; V484-Y500 WeakPolarHBondContact CG1-OH 3.46Å; V484-Y500 HydrophobicContact CG2-CE1 4.4Å
485	K	86.3	Confident	83.8	Confident	180 Å²	180	49.6 Å²	49.6	78%	0.783	24%	0.244	S	C	*	.	H	α-helix	trans	-63.6	-31.1	179.4	-174.8	-179.8	175.9	-171.8	0	113.3	L481 N482	L481-K485 WeakPolarHBondContact O-CB 3.48Å; L481-K485 PolarHBondContact O-N 2.98Å; N482-K485 PolarHBondContact O-N 3.42Å
486	L	81.9	Confident	84.2	Confident	38 Å²	38	46.5 Å²	46.5	20%	0.199	23%	0.23	C	C	.	.	H	α-helix	trans	-79.2	-17.7	179.7	-69.7	165.5	0	0	0	113.7	T448 V451 A452 L455 N482 C483 V484	T448-L486 HydrophobicContact CG2-CB 4Å; T448-L486 HydrophobicContact CG2-CD2 4.46Å; T448-L486 WeakPolarHBondContact CG2-O 3.37Å; V451-L486 HydrophobicContact CG1-CD1 4.41Å; A452-L486 HydrophobicContact CB-CB 4.2Å; A452-L486 HydrophobicContact CB-CD1 4.31Å; L455-L486 HydrophobicContact CD1-CD1 3.58Å; N482-L486 WeakPolarHBondContact O-CD1 3.32Å; N482-L486 VanDerWaalsContact O-CG 3.22Å; N482-L486 WeakPolarHBondContact O-CG 3.36Å; N482-L486 PolarHBondContact O-N 3.49Å; N482-L486 VanDerWaalsContact O-N 3.13Å; C483-L486 PolarHBondContact O-N 3.39Å; V484-L486 VanDerWaalsContact C-N 3.28Å; V484-L486 PolarHBondContact O-N 2.94Å
487	L	84.4	Confident	84.4	Confident	13 Å²	13	46.5 Å²	46.5	7%	0.068	23%	0.23	C	C	.	.	S	Bend	trans	-108.3	136.5	-170.3	-68.3	177.6	0	0	0	112.2	L449 A452 C483 V484 H492 I495 I496	L449-L487 HydrophobicContact CD1-CD2 3.94Å; A452-L487 HydrophobicContact CB-CD1 3.81Å; A452-L487 HydrophobicContact CB-CD2 3.68Å; A452-L487 HydrophobicContact CB-CG 3.59Å; C483-L487 WeakPolarHBondContact O-CG 3.26Å; V484-L487 PolarHBondContact O-N 3.34Å; L487-H492 HydrophobicContact CB-CB 4.32Å; L487-H492 HydrophobicContact CD1-CB 4.37Å; L487-H492 HydrophobicContact CD2-CB 4.26Å; L487-I495 HydrophobicContact CD1-CB 3.93Å; L487-I495 HydrophobicContact CD1-CD1 4.35Å; L487-I495 HydrophobicContact CD1-CG2 3.61Å; L487-I496 HydrophobicContact CB-CD1 3.7Å; L487-I496 HydrophobicContact CB-CG1 3.86Å; L487-I496 HydrophobicContact CD1-CG1 4.29Å
488	D	80.1	Confident	84.5	Confident	54 Å²	54	44.1 Å²	44.1	29%	0.289	22%	0.223	S	C	.	.			trans	-73.7	127.2	172.6	175.7	-43.9	0	0	0	110.4	E490 K491 H492 I496	D488-E490 VanDerWaalsContact C-N 3.31Å; D488-E490 PolarHBondContact O-N 3.42Å; D488-E490 WeakPolarHBondContact OD1-CA 3.4Å; D488-E490 WeakPolarHBondContact OD1-CB 3.43Å; D488-E490 PolarHBondContact OD1-N 3.45Å; D488-K491 HydrophobicContact CB-CB 4.06Å; D488-K491 HydrophobicContact CB-CD 4.01Å; D488-K491 HydrophobicContact CB-CG 4.17Å; D488-K491 PolarHBondContact O-N 3.37Å; D488-K491 PolarHBondContact OD1-N 3.45Å; D488-K491 WeakPolarHBondContact OD2-CD 3.31Å; D488-K491 WeakPolarHBondContact OD2-CE 3.37Å; D488-K491 IonicContact OD2-NZ 3.83Å; D488-H492 PolarHBondContact O-N 2.89Å; D488-I496 WeakPolarHBondContact O-CD1 3.41Å
489	P	76.2	Confident	84.7	Confident	68 Å²	68	40.9 Å²	40.9	44%	0.442	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-17.6	-175.9	30	-35.9	0	0	0	114.9	P493 I496 S621	P489-P493 WeakPolarHBondContact O-CB 3.43Å; P489-I496 HydrophobicContact CB-CD1 4.2Å; P489-S621 PolarHBondContact O-OG 3.26Å
490	E	74.2	Confident	84.9	Confident	131 Å²	131	42.5 Å²	42.5	61%	0.612	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87	-39.3	174.4	-58.6	-169.7	173.4	0	0	110.9	D488 P493 L625	D488-E490 VanDerWaalsContact C-N 3.31Å; D488-E490 PolarHBondContact O-N 3.42Å; D488-E490 WeakPolarHBondContact OD1-CA 3.4Å; D488-E490 WeakPolarHBondContact OD1-CB 3.43Å; D488-E490 PolarHBondContact OD1-N 3.45Å; E490-P493 WeakPolarHBondContact O-CD 3.14Å; E490-L625 HydrophobicContact CB-CD1 4.15Å; E490-L625 VanDerWaalsContact O-CD1 3.3Å; E490-L625 WeakPolarHBondContact O-CD1 3.41Å
491	K	77.2	Confident	85	Confident	116 Å²	116	45 Å²	45	50%	0.504	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-36.3	-179.6	-62.8	176.2	-174.3	169.7	0	113.5	D488	D488-K491 HydrophobicContact CB-CB 4.06Å; D488-K491 HydrophobicContact CB-CD 4.01Å; D488-K491 HydrophobicContact CB-CG 4.17Å; D488-K491 PolarHBondContact O-N 3.37Å; D488-K491 PolarHBondContact OD1-N 3.45Å; D488-K491 WeakPolarHBondContact OD2-CD 3.31Å; D488-K491 WeakPolarHBondContact OD2-CE 3.37Å; D488-K491 IonicContact OD2-NZ 3.83Å
492	H	82.6	Confident	85	Confident	35 Å²	35	42.3 Å²	42.3	16%	0.162	20%	0.204	C	C	.	.			trans	-128.5	43.2	-171.8	-55	-61.8	0	0	0	114.8	L487 D488 Q494 I495 I496	L487-H492 HydrophobicContact CB-CB 4.32Å; L487-H492 HydrophobicContact CD1-CB 4.37Å; L487-H492 HydrophobicContact CD2-CB 4.26Å; D488-H492 PolarHBondContact O-N 2.89Å; H492-Q494 PolarHBondContact O-N 3.32Å; H492-Q494 VanDerWaalsContact O-N 3.08Å; H492-I495 PolarHBondContact O-N 2.94Å; H492-I496 PolarHBondContact O-N 3.15Å
493	P	83.5	Confident	85.1	Confident	14 Å²	14	40.3 Å²	40.3	9%	0.091	19%	0.193	C	C	.	.	H	α-helix	trans	-58.2	-31.4	-171.7	22.9	-34.4	0	0	0	113.8	P489 E490 A497 C618 W708	P489-P493 WeakPolarHBondContact O-CB 3.43Å; E490-P493 WeakPolarHBondContact O-CD 3.14Å; P493-A497 VanDerWaalsContact O-CB 3.25Å; P493-A497 WeakPolarHBondContact O-CB 3.4Å; P493-A497 PolarHBondContact O-N 3.13Å; P493-C618 HydrophobicContact CB-CB 4.26Å; P493-C618 WeakPolarHBondContact CB-O 3.26Å; P493-W708 HydrophobicContact CB-CH2 4.17Å; P493-W708 HydrophobicContact CG-CH2 4.35Å; P493-W708 HydrophobicContact CG-CZ2 4.33Å
494	Q	84.5	Confident	85.1	Confident	42 Å²	42	40.3 Å²	40.3	20%	0.196	19%	0.193	C	C	.	.	H	α-helix	trans	-67.9	-44.9	-176.7	-177.9	170	18	0	0	113.8	L284 H492 S498 W708	L284-Q494 HydrophobicContact CD1-CG 4.29Å; H492-Q494 PolarHBondContact O-N 3.32Å; H492-Q494 VanDerWaalsContact O-N 3.08Å; Q494-S498 WeakPolarHBondContact O-CB 3.47Å; Q494-S498 PolarHBondContact O-N 3.13Å; Q494-S498 VanDerWaalsContact O-N 3.07Å; Q494-S498 PolarHBondContact O-OG 2.7Å; Q494-W708 HydrophobicContact CB-CD2 3.9Å; Q494-W708 HydrophobicContact CB-CE3 3.95Å; Q494-W708 HydrophobicContact CB-CH2 3.89Å; Q494-W708 HydrophobicContact CB-CZ2 3.82Å; Q494-W708 HydrophobicContact CB-CZ3 3.96Å; Q494-W708 VanDerWaalsContact CD-CG 3.42Å; Q494-W708 HydrophobicContact CG-CB 4.46Å; Q494-W708 HydrophobicContact CG-CD2 3.58Å; Q494-W708 HydrophobicContact CG-CE3 3.66Å; Q494-W708 HydrophobicContact CG-CG 3.98Å; Q494-W708 HydrophobicContact CG-CZ2 4.45Å; Q494-W708 HydrophobicContact CG-CZ3 4.15Å
495	I	86.5	Confident	85	Confident	20 Å²	20	42.1 Å²	42.1	10%	0.103	20%	0.201	C	C	.	.	H	α-helix	trans	-69	-41.9	179.7	-61.8	165.9	0	0	0	108.9	F285 L449 V453 Y456 L487 H492 S498 A499	F285-I495 HydrophobicContact CE2-CD1 4.42Å; L449-I495 HydrophobicContact CD1-CD1 3.95Å; V453-I495 HydrophobicContact CG2-CD1 3.75Å; Y456-I495 HydrophobicContact CG-CG2 4.4Å; L487-I495 HydrophobicContact CD1-CB 3.93Å; L487-I495 HydrophobicContact CD1-CD1 4.35Å; L487-I495 HydrophobicContact CD1-CG2 3.61Å; H492-I495 PolarHBondContact O-N 2.94Å; I495-S498 PolarHBondContact O-N 3.4Å; I495-A499 WeakPolarHBondContact O-CB 3.38Å; I495-A499 PolarHBondContact O-N 3.03Å
496	I	88.1	Confident	84.9	Confident	4 Å²	4	33.8 Å²	33.8	2%	0.021	16%	0.164	C	C	.	.	H	α-helix	trans	-64.1	-47.1	179.1	-66.7	162.1	0	0	0	111.4	V484 L487 D488 P489 H492 S498 A499 Y500 C618	V484-I496 HydrophobicContact CG1-CG2 4.15Å; V484-I496 HydrophobicContact CG2-CG2 4.39Å; L487-I496 HydrophobicContact CB-CD1 3.7Å; L487-I496 HydrophobicContact CB-CG1 3.86Å; L487-I496 HydrophobicContact CD1-CG1 4.29Å; D488-I496 WeakPolarHBondContact O-CD1 3.41Å; P489-I496 HydrophobicContact CB-CD1 4.2Å; H492-I496 PolarHBondContact O-N 3.15Å; I496-S498 VanDerWaalsContact C-N 3.31Å; I496-S498 PolarHBondContact O-N 3.18Å; I496-A499 PolarHBondContact O-N 3.22Å; I496-Y500 HydrophobicContact CG2-CD2 3.65Å; I496-Y500 HydrophobicContact CG2-CE2 3.39Å; I496-Y500 WeakPolarHBondContact O-CD2 3.38Å; I496-Y500 PolarHBondContact O-N 3.41Å; I496-C618 VanDerWaalsContact CG2-SG 3.58Å
497	A	87.6	Confident	84.9	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-59.9	-41.5	175.2	0	0	0	0	0	111.9	P493 Y500 Y501 A615 C618 W708 M712	P493-A497 VanDerWaalsContact O-CB 3.25Å; P493-A497 WeakPolarHBondContact O-CB 3.4Å; P493-A497 PolarHBondContact O-N 3.13Å; A497-Y500 PolarHBondContact O-N 3.29Å; A497-Y501 WeakPolarHBondContact O-CB 3.37Å; A497-Y501 PolarHBondContact O-N 3.11Å; A497-A615 HydrophobicContact CB-CB 4.4Å; A497-C618 HydrophobicContact CB-CB 4.2Å; A497-W708 HydrophobicContact CB-CZ3 4.4Å; A497-M712 HydrophobicContact CB-CG 4.24Å
498	S	88.6	Confident	84.3	Confident	9 Å²	9	35.4 Å²	35.4	6%	0.063	17%	0.17	C	C	.	.	H	α-helix	trans	-67	-35.9	177.1	-52.6	0	0	0	0	112.7	Y456 Q494 I495 I496 M502 M712	Y456-S498 WeakPolarHBondContact OH-CB 3.24Å; Q494-S498 WeakPolarHBondContact O-CB 3.47Å; Q494-S498 PolarHBondContact O-N 3.13Å; Q494-S498 VanDerWaalsContact O-N 3.07Å; Q494-S498 PolarHBondContact O-OG 2.7Å; I495-S498 PolarHBondContact O-N 3.4Å; I496-S498 VanDerWaalsContact C-N 3.31Å; I496-S498 PolarHBondContact O-N 3.18Å; S498-M502 WeakPolarHBondContact O-CB 3.17Å; S498-M502 PolarHBondContact O-N 3.13Å; S498-M712 WeakPolarHBondContact OG-CE 3.38Å
499	A	89.9	Confident	83.9	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-71	-39	175.5	0	0	0	0	0	112.1	Y456 L480 V484 I495 I496 M502 L503	Y456-A499 HydrophobicContact CD2-CB 4.1Å; Y456-A499 HydrophobicContact CE2-CB 4.39Å; L480-A499 HydrophobicContact CD2-CB 4.06Å; V484-A499 HydrophobicContact CG2-CB 3.62Å; I495-A499 WeakPolarHBondContact O-CB 3.38Å; I495-A499 PolarHBondContact O-N 3.03Å; I496-A499 PolarHBondContact O-N 3.22Å; A499-M502 PolarHBondContact O-N 2.95Å; A499-L503 WeakPolarHBondContact O-CB 3.47Å; A499-L503 WeakPolarHBondContact O-CG 3.41Å; A499-L503 PolarHBondContact O-N 2.94Å
500	Y	91.6	Very high	82.9	Confident	44 Å²	44	36.1 Å²	36.1	17%	0.173	17%	0.171	C	C	.	.	H	α-helix	trans	-67.2	-39.9	173	-76.7	-46.4	0	0	0	112.8	V484 I496 A497 L503 S504 Y611 K614	V484-Y500 HydrophobicContact CG1-CE1 4.01Å; V484-Y500 HydrophobicContact CG1-CE2 4.15Å; V484-Y500 WeakPolarHBondContact CG1-OH 3.46Å; V484-Y500 HydrophobicContact CG2-CE1 4.4Å; I496-Y500 HydrophobicContact CG2-CD2 3.65Å; I496-Y500 HydrophobicContact CG2-CE2 3.39Å; I496-Y500 WeakPolarHBondContact O-CD2 3.38Å; I496-Y500 PolarHBondContact O-N 3.41Å; A497-Y500 PolarHBondContact O-N 3.29Å; Y500-L503 HydrophobicContact CD1-CD1 4Å; Y500-L503 PolarHBondContact O-N 3.42Å; Y500-S504 PolarHBondContact O-N 2.96Å; Y500-S504 VanDerWaalsContact O-N 3.08Å; Y500-Y611 AromaticContact CD1-CD1 3.76Å; Y500-Y611 HydrophobicContact CD1-CD1 3.76Å; Y500-Y611 HydrophobicContact CD1-CE1 4.35Å; Y500-Y611 HydrophobicContact CE1-CD1 4.29Å; Y500-K614 HydrophobicContact CD1-CB 4.24Å; Y500-K614 HydrophobicContact CD2-CB 3.75Å; Y500-K614 HydrophobicContact CE1-CB 4.12Å; Y500-K614 HydrophobicContact CE1-CD 4.04Å; Y500-K614 HydrophobicContact CE2-CB 3.6Å; Y500-K614 HydrophobicContact CG-CB 4.06Å
501	Y	90.1	Very high	81.3	Confident	52 Å²	52	33.1 Å²	33.1	20%	0.204	16%	0.157	C	C	.	.	H	α-helix	trans	-59.1	-47.5	171.4	176.3	-114.6	0	0	0	111.1	A497 L503 S504 E505 M712 Q715 L716 K719	A497-Y501 WeakPolarHBondContact O-CB 3.37Å; A497-Y501 PolarHBondContact O-N 3.11Å; Y501-L503 VanDerWaalsContact C-N 3.34Å; Y501-L503 PolarHBondContact O-N 3.42Å; Y501-S504 WeakPolarHBondContact O-CA 3.46Å; Y501-S504 WeakPolarHBondContact O-CB 3.31Å; Y501-S504 PolarHBondContact O-N 3.19Å; Y501-S504 PolarHBondContact O-OG 2.78Å; Y501-E505 HydrophobicContact CE1-CG 4.31Å; Y501-E505 HydrophobicContact CE2-CG 4.45Å; Y501-E505 WeakPolarHBondContact CE2-OE1 3.44Å; Y501-E505 PolarHBondContact O-N 3.22Å; Y501-E505 VanDerWaalsContact O-N 3.15Å; Y501-E505 PolarHBondContact OH-OE1 2.97Å; Y501-M712 HydrophobicContact CD1-SD 4.45Å; Y501-M712 HydrophobicContact CG-SD 4.08Å; Y501-Q715 HydrophobicContact CD2-CB 4.36Å; Y501-Q715 HydrophobicContact CE1-CB 4.43Å; Y501-Q715 HydrophobicContact CE2-CB 3.92Å; Y501-L716 HydrophobicContact CD2-CD2 4.18Å; Y501-K719 HydrophobicContact CE2-CB 4.46Å
502	M	88.3	Confident	79.1	Confident	9 Å²	9	35.3 Å²	35.3	4%	0.044	17%	0.173	C	C	.	.	H	α-helix	trans	-63	-35.8	176.8	-163.4	179.6	-71.4	0	0	113.2	Y456 A459 S460 M463 L480 S498 A499 S504 E505 L506	Y456-M502 HydrophobicContact CE2-CE 3.69Å; Y456-M502 HydrophobicContact CE2-SD 4.36Å; A459-M502 HydrophobicContact CB-SD 4.44Å; S460-M502 WeakPolarHBondContact OG-CE 3.44Å; M463-M502 HydrophobicContact CE-CG 3.93Å; M463-M502 HydrophobicContact SD-CG 3.4Å; M463-M502 WeakPolarHBondContact SD-CG 3.5Å; M463-M502 HydrophobicContact SD-SD 4.26Å; L480-M502 HydrophobicContact CD1-CB 3.86Å; L480-M502 HydrophobicContact CD1-CG 3.72Å; L480-M502 HydrophobicContact CD1-SD 3.87Å; L480-M502 HydrophobicContact CD2-CB 4.47Å; L480-M502 HydrophobicContact CD2-SD 3.82Å; L480-M502 HydrophobicContact CG-SD 4.4Å; S498-M502 WeakPolarHBondContact O-CB 3.17Å; S498-M502 PolarHBondContact O-N 3.13Å; A499-M502 PolarHBondContact O-N 2.95Å; M502-S504 PolarHBondContact O-N 2.88Å; M502-E505 PolarHBondContact O-N 3.36Å; M502-L506 PolarHBondContact O-N 2.62Å
503	L	88.9	Confident	76.7	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63.1	-29.9	170.9	-79.5	166	0	0	0	112.7	R477 L480 L481 A499 Y500 Y501 L506 F507 Y611	R477-L503 HydrophobicContact CB-CD2 4.45Å; R477-L503 HydrophobicContact CG-CD2 4.09Å; L480-L503 HydrophobicContact CB-CD1 4.13Å; L480-L503 HydrophobicContact CB-CD2 3.83Å; L480-L503 HydrophobicContact CB-CG 3.78Å; L480-L503 HydrophobicContact CD1-CD2 4.07Å; L480-L503 HydrophobicContact CD1-CG 3.91Å; L481-L503 HydrophobicContact CD2-CD1 3.92Å; L481-L503 HydrophobicContact CG-CD1 4.42Å; L481-L503 HydrophobicContact CG-CD2 4.32Å; A499-L503 WeakPolarHBondContact O-CB 3.47Å; A499-L503 WeakPolarHBondContact O-CG 3.41Å; A499-L503 PolarHBondContact O-N 2.94Å; Y500-L503 HydrophobicContact CD1-CD1 4Å; Y500-L503 PolarHBondContact O-N 3.42Å; Y501-L503 VanDerWaalsContact C-N 3.34Å; Y501-L503 PolarHBondContact O-N 3.42Å; L503-L506 HydrophobicContact CD2-CD1 4.11Å; L503-F507 WeakPolarHBondContact O-CD2 3.44Å; L503-F507 WeakPolarHBondContact O-CE2 3.23Å; L503-Y611 HydrophobicContact CB-CD1 4.07Å; L503-Y611 HydrophobicContact CB-CD2 4.29Å; L503-Y611 HydrophobicContact CB-CE1 4.12Å; L503-Y611 HydrophobicContact CB-CE2 4.36Å; L503-Y611 HydrophobicContact CB-CG 4.17Å; L503-Y611 HydrophobicContact CD1-CD1 4.3Å; L503-Y611 HydrophobicContact CD1-CE1 3.96Å
504	S	89	Confident	74	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-77	-24.3	174.3	86.5	0	0	0	0	113.4	Y500 Y501 M502 L506 F507 K719	Y500-S504 PolarHBondContact O-N 2.96Å; Y500-S504 VanDerWaalsContact O-N 3.08Å; Y501-S504 WeakPolarHBondContact O-CA 3.46Å; Y501-S504 WeakPolarHBondContact O-CB 3.31Å; Y501-S504 PolarHBondContact O-N 3.19Å; Y501-S504 PolarHBondContact O-OG 2.78Å; M502-S504 PolarHBondContact O-N 2.88Å; S504-L506 VanDerWaalsContact C-N 3.32Å; S504-F507 PolarHBondContact O-N 3.43Å; S504-K719 VanDerWaalsContact O-CE 3.28Å; S504-K719 WeakPolarHBondContact O-CE 3.45Å; S504-K719 PolarHBondContact O-NZ 3.1Å
505	E	86.3	Confident	71.4	Confident	56 Å²	56	53.1 Å²	53.1	26%	0.262	27%	0.269	S	S	.	.	H	α-helix	trans	-72.9	-22.1	174	-67.6	-54.1	129.6	0	0	113.2	M463 Y501 M502 F507 K719	M463-E505 HydrophobicContact CE-CB 4.44Å; M463-E505 HydrophobicContact SD-CB 4.03Å; Y501-E505 HydrophobicContact CE1-CG 4.31Å; Y501-E505 HydrophobicContact CE2-CG 4.45Å; Y501-E505 WeakPolarHBondContact CE2-OE1 3.44Å; Y501-E505 PolarHBondContact O-N 3.22Å; Y501-E505 VanDerWaalsContact O-N 3.15Å; Y501-E505 PolarHBondContact OH-OE1 2.97Å; M502-E505 PolarHBondContact O-N 3.36Å; E505-F507 PolarHBondContact O-N 3.17Å; E505-F507 VanDerWaalsContact O-N 3.16Å; E505-K719 WeakPolarHBondContact OE1-CD 3.4Å; E505-K719 WeakPolarHBondContact OE1-CE 3.45Å; E505-K719 IonicContact OE1-NZ 2.68Å; E505-K719 PolarHBondContact OE1-NZ 3.42Å; E505-K719 IonicContact OE2-NZ 2.73Å; E505-K719 PolarHBondContact OE2-NZ 2.95Å
506	L	84	Confident	68.7	Low	4 Å²	4	60 Å²	60	2%	0.021	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-14.3	173	-63.1	179.3	0	0	0	113.9	Y473 I476 R477 M502 L503 S504	Y473-L506 HydrophobicContact CD2-CB 4.33Å; Y473-L506 HydrophobicContact CD2-CD2 4.06Å; Y473-L506 WeakPolarHBondContact CD2-O 3.09Å; Y473-L506 HydrophobicContact CE2-CD2 4.46Å; Y473-L506 VanDerWaalsContact CE2-O 3.32Å; Y473-L506 WeakPolarHBondContact CE2-O 3.39Å; Y473-L506 HydrophobicContact CG-CD2 4.08Å; I476-L506 HydrophobicContact CB-CD2 4.16Å; I476-L506 HydrophobicContact CD1-CD2 4.45Å; I476-L506 HydrophobicContact CG2-CD1 4.25Å; I476-L506 HydrophobicContact CG2-CD2 3.86Å; I476-L506 HydrophobicContact CG2-CG 4.48Å; R477-L506 HydrophobicContact CB-CD1 3.79Å; M502-L506 PolarHBondContact O-N 2.62Å; L503-L506 HydrophobicContact CD2-CD1 4.11Å; S504-L506 VanDerWaalsContact C-N 3.32Å
507	F	80.7	Confident	65.8	Low	8 Å²	8	63.2 Å²	63.2	4%	0.035	34%	0.34	C	S	.	.	S	Bend	trans	-104	96.4	174.8	-60.9	-93.3	0	0	0	108.1	L503 S504 E505 L509 F595 R604 H607 V608 Y611	L503-F507 WeakPolarHBondContact O-CD2 3.44Å; L503-F507 WeakPolarHBondContact O-CE2 3.23Å; S504-F507 PolarHBondContact O-N 3.43Å; E505-F507 PolarHBondContact O-N 3.17Å; E505-F507 VanDerWaalsContact O-N 3.16Å; F507-L509 PolarHBondContact O-N 2.95Å; F507-F595 HydrophobicContact CE1-CZ 4.16Å; F507-F595 AromaticContact CZ-CZ 3.97Å; F507-F595 HydrophobicContact CZ-CZ 3.97Å; F507-R604 HydrophobicContact CD1-CB 4.27Å; F507-R604 HydrophobicContact CD1-CG 4.29Å; F507-H607 HydrophobicContact CD1-CB 4.35Å; F507-H607 HydrophobicContact CE1-CB 3.96Å; F507-H607 HydrophobicContact CE2-CB 4.3Å; F507-H607 HydrophobicContact CZ-CB 3.93Å; F507-V608 HydrophobicContact CB-CG2 3.56Å; F507-V608 HydrophobicContact CD2-CG2 4.44Å; F507-V608 HydrophobicContact CG-CG2 4.18Å; F507-Y611 HydrophobicContact CE2-CD2 4.3Å; F507-Y611 AromaticContact CE2-CE2 3.72Å; F507-Y611 HydrophobicContact CE2-CE2 3.72Å; F507-Y611 HydrophobicContact CZ-CE2 4.35Å
508	Q	73.6	Confident	62.8	Low	77 Å²	77	66.8 Å²	66.8	36%	0.36	38%	0.377	S	S	.	.			trans	-66.7	125.2	173.6	-68.4	-177	-29.9	0	0	109.1	Y473	Y473-Q508 PolarHBondContact OH-NE2 3.21Å
509	L	71.8	Confident	59.9	Low	17 Å²	17	75.3 Å²	75.3	9%	0.089	42%	0.416	C	S	.	.	S	Bend	trans	-89.2	-26.6	178.5	-65.6	176.1	0	0	0	111.7	F507 E511 V608 K722 A723 V726	F507-L509 PolarHBondContact O-N 2.95Å; L509-E511 PolarHBondContact O-N 3.03Å; L509-V608 HydrophobicContact CD2-CG2 4.34Å; L509-K722 HydrophobicContact CD1-CB 3.79Å; L509-A723 HydrophobicContact CD1-CB 4.28Å; L509-V726 HydrophobicContact CB-CG2 4.21Å
510	D	55	Low	56.7	Low	120 Å²	120	81 Å²	81	64%	0.642	46%	0.455	S	S	*	.			trans	-100.1	47.8	-169.1	-55.5	-35.1	0	0	0	112.1	L512 K722	D510-L512 PolarHBondContact O-N 2.97Å; D510-K722 IonicContact OD2-NZ 2.74Å; D510-K722 PolarHBondContact OD2-NZ 2.66Å
511	E	39.3	Very low	53.7	Low	69 Å²	69	86.1 Å²	86.1	32%	0.322	49%	0.485	S	S	.	.			trans	-80.9	103.8	168.2	-82.2	-177	156.5	0	0	110.2	R470 L509 R604	R470-E511 IonicContact CZ-OE1 2.81Å; R470-E511 IonicContact NH1-OE1 3.18Å; R470-E511 PolarHBondContact NH1-OE1 3.41Å; R470-E511 IonicContact NH2-OE1 2.84Å; R470-E511 PolarHBondContact NH2-OE1 3.27Å; L509-E511 PolarHBondContact O-N 3.03Å; E511-R604 IonicContact OE2-CZ 2.64Å; E511-R604 IonicContact OE2-NH1 2.64Å; E511-R604 PolarHBondContact OE2-NH1 3.13Å; E511-R604 IonicContact OE2-NH2 2.65Å; E511-R604 PolarHBondContact OE2-NH2 3.49Å
512	L	32	Very low	50.8	Low	161 Å²	161	94.8 Å²	94.8	84%	0.843	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-58.1	137.3	156.5	-71.2	168.2	0	0	0	108.4	D510	D510-L512 PolarHBondContact O-N 2.97Å
513	P	31.4	Very low	47.8	Very low	103 Å²	103	98.7 Å²	98.7	67%	0.669	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-59.6	140.3	167.9	-17.2	30.7	0	0	0	109.6	E515	P513-E515 PolarHBondContact O-N 3.38Å
514	D	26.7	Very low	44.8	Very low	160 Å²	160	102.8 Å²	102.8	86%	0.856	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-60.2	123.6	169.1	-70.2	-56.2	0	0	0	109	D516	D514-D516 PolarHBondContact O-N 3.2Å
515	E	31.2	Very low	41.8	Very low	203 Å²	203	106.8 Å²	106.8	95%	0.949	63%	0.634	S	S	*	*	S	Bend	trans	-73.1	74.2	173	-73.1	-167.2	156.1	0	0	110.6	P513	P513-E515 PolarHBondContact O-N 3.38Å
516	D	28.4	Very low	38.9	Very low	165 Å²	165	109.8 Å²	109.8	88%	0.882	66%	0.661	S	S	*	*			trans	-138.5	63.3	159.6	-157.2	13.8	0	0	0	109.7	D514	D514-D516 PolarHBondContact O-N 3.2Å
517	G	27.2	Very low	36.2	Very low	70 Å²	70	118.4 Å²	118.4	72%	0.722	70%	0.702	S	S	*	*	S	Bend	trans	-164.8	111.3	179.4	0	0	0	0	0	108.7
518	G	25.5	Very low	33.5	Very low	76 Å²	76	124.7 Å²	124.7	78%	0.784	74%	0.736	S	S	*	*			trans	-57.4	154.6	-160	0	0	0	0	0	116.9	S520	G518-S520 PolarHBondContact O-N 3.4Å
519	E	26.5	Very low	31.3	Very low	188 Å²	188	126.6 Å²	126.6	88%	0.879	76%	0.757	S	S	*	*			trans	-32.5	99.6	-180	-61.5	177.4	136	0	0	115	L521	E519-L521 PolarHBondContact O-N 3.27Å
520	S	23.8	Very low	29.1	Very low	118 Å²	118	136.6 Å²	136.6	83%	0.825	80%	0.796	S	S	*	*			trans	-84.5	96.4	165.5	-168.6	0	0	0	0	109.7	G518 R522	G518-S520 PolarHBondContact O-N 3.4Å; S520-R522 PolarHBondContact O-N 3.43Å; S520-R522 VanDerWaalsContact O-N 3.15Å
521	L	28.3	Very low	27.7	Very low	153 Å²	153	136.5 Å²	136.5	80%	0.801	81%	0.805	S	S	*	*			trans	-63.4	110.1	176	-73.8	165.6	0	0	0	110.9	E519 A523	E519-L521 PolarHBondContact O-N 3.27Å; L521-A523 PolarHBondContact O-N 2.86Å
522	R	29.1	Very low	27.1	Very low	233 Å²	233	140 Å²	140	88%	0.879	83%	0.825	S	S	*	*			trans	-67.5	94.9	162.2	-77.4	-170.6	176.7	-162.7	-1	110	S520	S520-R522 PolarHBondContact O-N 3.43Å; S520-R522 VanDerWaalsContact O-N 3.15Å
523	A	26	Very low	26.9	Very low	92 Å²	92	141.1 Å²	141.1	76%	0.76	83%	0.826	S	S	*	*			trans	-126.2	118.7	158.7	0	0	0	0	0	108	L521	L521-A523 PolarHBondContact O-N 2.86Å
524	G	24.5	Very low	26.7	Very low	86 Å²	86	143.3 Å²	143.3	89%	0.887	83%	0.832	S	S	*	*			trans	-81.9	152.2	174.3	0	0	0	0	0	111.5
525	G	25.7	Very low	26.7	Very low	83 Å²	83	147.8 Å²	147.8	86%	0.856	84%	0.837	S	S	*	*			trans	116	71.1	164.3	0	0	0	0	0	116.3
526	S	25.5	Very low	26.6	Very low	119 Å²	119	147.4 Å²	147.4	83%	0.832	84%	0.835	S	S	*	*			trans	-156.1	114.4	143.3	59.9	0	0	0	0	109.7
527	E	27.8	Very low	26.6	Very low	185 Å²	185	148.6 Å²	148.6	86%	0.864	84%	0.836	S	S	*	*			trans	-76.1	138.3	163.2	-62.2	171.9	142.8	0	0	108.5
528	D	24.6	Very low	26.6	Very low	140 Å²	140	154.8 Å²	154.8	75%	0.749	85%	0.846	S	S	*	*			trans	163.5	155.7	133.8	-87.5	-24.5	0	0	0	112.2
529	S	26.9	Very low	26.7	Very low	117 Å²	117	160.8 Å²	160.8	82%	0.818	85%	0.853	S	S	*	*			trans	66.9	82	174.8	-69.8	0	0	0	0	118.3
530	Y	25.8	Very low	26.7	Very low	228 Å²	228	155.2 Å²	155.2	89%	0.894	85%	0.846	S	S	*	*			trans	-85.2	138.3	133.7	-109.7	-97.2	0	0	0	108.8
531	S	26.1	Very low	26.9	Very low	118 Å²	118	156.8 Å²	156.8	83%	0.825	85%	0.846	S	S	*	*			trans	-141.9	103.9	161.2	61	0	0	0	0	107.7
532	D	25.9	Very low	26.9	Very low	142 Å²	142	156.1 Å²	156.1	76%	0.759	84%	0.843	S	S	*	*			trans	-141	109.7	175.3	-153.2	11.7	0	0	0	105.8
533	E	27.6	Very low	26.8	Very low	185 Å²	185	152.1 Å²	152.1	86%	0.864	84%	0.839	S	S	*	*			trans	-137.9	106.3	169.1	-81.2	-165.6	177.3	0	0	108.3
534	D	28.3	Very low	26.9	Very low	149 Å²	149	154.1 Å²	154.1	80%	0.797	84%	0.837	S	S	*	*			trans	18.4	133	141.9	-56.3	-34.7	0	0	0	119.5
535	R	25.6	Very low	27.2	Very low	254 Å²	254	157 Å²	157	96%	0.958	83%	0.832	S	S	*	*			trans	-148.5	146.5	137.4	-114	166.2	-152.4	-138.3	2.4	113.1
536	E	28.9	Very low	27.5	Very low	194 Å²	194	160.3 Å²	160.3	91%	0.907	84%	0.835	S	S	*	*			trans	-85.6	178.5	-164.5	-59.9	174.9	131.8	0	0	113.7
537	E	28.8	Very low	27.7	Very low	191 Å²	191	162.6 Å²	162.6	89%	0.893	83%	0.832	S	S	*	*			trans	-65.1	147.7	180	-52.6	173	155.8	0	0	113.3
538	E	27.3	Very low	27.7	Very low	200 Å²	200	161.4 Å²	161.4	94%	0.935	83%	0.832	S	S	*	*			trans	-154.5	139.3	143.9	-121.3	174.1	-158.3	0	0	110.9
539	E	26.7	Very low	27.9	Very low	201 Å²	201	158.4 Å²	158.4	94%	0.939	83%	0.834	S	S	*	*			trans	-85.5	153.1	174.2	-61.5	-177.8	138.2	0	0	110.8
540	G	27.4	Very low	28	Very low	71 Å²	71	162.1 Å²	162.1	73%	0.732	84%	0.838	S	S	*	*			trans	159.7	92.8	164.8	0	0	0	0	0	117.3
541	D	27.7	Very low	28.2	Very low	152 Å²	152	157.7 Å²	157.7	81%	0.813	83%	0.83	S	S	*	*			trans	32.3	145.5	138	-64.6	-15.7	0	0	0	124.6
542	D	27.9	Very low	28.3	Very low	138 Å²	138	160 Å²	160	74%	0.738	83%	0.83	S	S	*	*			trans	78.6	110.7	143.9	-65.9	-8	0	0	0	123.3
543	D	28.1	Very low	28.2	Very low	149 Å²	149	156.8 Å²	156.8	80%	0.797	83%	0.83	S	S	*	*				83.6	142.9	122.3	-79.9	-13.1	0	0	0	125.5
544	D	28.8	Very low	28.2	Very low	135 Å²	135	153 Å²	153	72%	0.722	82%	0.824	S	S	*	*			trans	68.8	97.8	154.9	-104.6	-5.2	0	0	0	122.5
545	L	29.6	Very low	28.2	Very low	147 Å²	147	157 Å²	157	77%	0.77	83%	0.83	S	S	*	*				20.9	130.1	118.2	-58.1	173.9	0	0	0	118.6
546	T	32.4	Very low	28.2	Very low	151 Å²	151	148.3 Å²	148.3	93%	0.926	82%	0.819	S	S	*	*			trans	-143.5	143.4	133.2	11.8	0	0	0	0	111.3
547	E	29.1	Very low	28.1	Very low	167 Å²	167	146 Å²	146	78%	0.78	81%	0.814	S	S	*	*			trans	-90.7	171.1	-169.7	-61.7	169.7	122.9	0	0	113.8
548	D	28.5	Very low	27.9	Very low	161 Å²	161	147.9 Å²	147.9	86%	0.861	81%	0.812	S	S	*	*			trans	104.3	132.5	141.3	-72	-26.3	0	0	0	121.5
549	G	28.6	Very low	27.8	Very low	76 Å²	76	143.8 Å²	143.8	78%	0.784	81%	0.806	S	S	*	*			trans	142.7	67.4	157.7	0	0	0	0	0	118.9
550	E	28.9	Very low	27.7	Very low	195 Å²	195	146 Å²	146	91%	0.911	81%	0.806	S	S	*	*			trans	-17.8	154.5	148.2	-64.9	177.1	178.2	0	0	118
551	D	29.2	Very low	27.8	Very low	136 Å²	136	147.9 Å²	147.9	73%	0.727	81%	0.805	S	S	*	*			cis	-172.1	177.4	-6.8	178	28.1	0	0	0	108.8
552	M	28.4	Very low	28	Very low	167 Å²	167	149.4 Å²	149.4	82%	0.823	81%	0.807	S	S	*	*			trans	82	107.9	160.9	-75.6	-75.6	-178.6	0	0	121.9
553	G	25.3	Very low	28	Very low	73 Å²	73	150.4 Å²	150.4	75%	0.753	81%	0.813	S	S	*	*				140.7	104.7	118.6	0	0	0	0	0	121.4
554	S	27	Very low	28	Very low	107 Å²	107	149.9 Å²	149.9	75%	0.748	81%	0.81	S	S	*	*			trans	89.1	91	134.5	-161.1	0	0	0	0	122.5
555	Y	28	Very low	27.9	Very low	231 Å²	231	148.7 Å²	148.7	91%	0.906	81%	0.812	S	S	*	*			trans	55.1	115.4	143.3	-62.4	-80.4	0	0	0	123.5
556	G	25.9	Very low	27.9	Very low	72 Å²	72	151.1 Å²	151.1	74%	0.742	82%	0.816	S	S	*	*				129.5	91.7	102.8	0	0	0	0	0	121.3
557	N	26.6	Very low	27.8	Very low	147 Å²	147	149.1 Å²	149.1	79%	0.786	82%	0.815	S	S	*	*			trans	61.6	144.5	155.4	-86.2	-16.2	0	0	0	118.8
558	R	24.1	Very low	27.6	Very low	229 Å²	229	147.2 Å²	147.2	86%	0.864	81%	0.814	S	S	*	*			cis	-168.5	114.4	-14.8	-137.5	178.2	-161.5	-151.8	2.7	107.7
559	S	24.8	Very low	27.8	Very low	115 Å²	115	144.4 Å²	144.4	80%	0.804	81%	0.814	S	S	*	*			trans	-136.3	140	173.9	43.6	0	0	0	0	110.5
560	R	25.6	Very low	27.8	Very low	247 Å²	247	146.7 Å²	146.7	93%	0.932	81%	0.812	S	S	*	*			trans	-100.1	132.7	174.3	-85.5	177.3	162.8	178.1	-7.1	109.4
561	P	28.8	Very low	28	Very low	111 Å²	111	145.2 Å²	145.2	72%	0.721	81%	0.809	S	S	*	*				-100.6	145.7	123.9	-5.8	25.8	0	0	0	107.7
562	Q	33.3	Very low	28.2	Very low	183 Å²	183	148.5 Å²	148.5	86%	0.855	81%	0.811	S	S	*	*				63.8	103.2	54.7	-166.1	172.2	5.8	0	0	111.9
563	D	26.2	Very low	28.4	Very low	160 Å²	160	144.7 Å²	144.7	86%	0.856	80%	0.801	S	S	*	*			trans	-151.7	150.6	152.8	-153.7	-0.9	0	0	0	110.6
564	D	28.8	Very low	29	Very low	137 Å²	137	147 Å²	147	73%	0.733	80%	0.8	S	S	*	*			trans	-95.9	149.7	178.3	-89	-51.8	0	0	0	110.6
565	S	27.6	Very low	29.4	Very low	110 Å²	110	144.7 Å²	144.7	77%	0.769	79%	0.793	S	S	*	*				164.6	139.1	120.2	54.6	0	0	0	0	115.4
566	K	28.2	Very low	29.9	Very low	199 Å²	199	140 Å²	140	87%	0.865	78%	0.779	S	S	*	*			trans	37.5	99.1	141.2	-65.1	176	-178.7	170.6	0	119.3
567	A	30	Very low	30.2	Very low	108 Å²	108	143.9 Å²	143.9	89%	0.893	78%	0.782	S	S	*	*			trans	-7.2	120.1	145.6	0	0	0	0	0	118.4
568	V	26	Very low	30.5	Very low	127 Å²	127	141.5 Å²	141.5	77%	0.77	78%	0.777	S	S	*	*			trans	-111.8	130.4	153	175	0	0	0	0	108.3	V570	V568-V570 PolarHBondContact O-N 3.34Å
569	A	33.2	Very low	31	Very low	102 Å²	102	136.3 Å²	136.3	84%	0.843	77%	0.77	S	S	*	*			trans	-75.8	107.5	179	0	0	0	0	0	110.9
570	V	28.9	Very low	31.3	Very low	125 Å²	125	136.6 Å²	136.6	76%	0.758	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-102.3	118.9	173.4	-178.9	0	0	0	0	109.9	V568 R572	V568-V570 PolarHBondContact O-N 3.34Å; V570-R572 PolarHBondContact O-N 2.84Å
571	I	32.7	Very low	31.6	Very low	163 Å²	163	134 Å²	134	84%	0.836	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-67.3	125.7	175.1	-63.3	170.8	0	0	0	108.8
572	R	32.2	Very low	31.7	Very low	206 Å²	206	137.6 Å²	137.6	78%	0.777	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-65.3	141.8	177.7	-78.2	175.2	162.3	113.3	5.4	111.4	V570 E576	V570-R572 PolarHBondContact O-N 2.84Å; R572-E576 WeakPolarHBondContact CD-OE2 3.46Å; R572-E576 WeakPolarHBondContact CG-OE2 3.39Å; R572-E576 IonicContact NE-OE2 3.61Å; R572-E576 PolarHBondContact NE-OE2 2.93Å
573	S	33.5	Very low	31.8	Very low	87 Å²	87	139.5 Å²	139.5	61%	0.608	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-74.4	155	-176.5	75.8	0	0	0	0	112.3	G575 E576	S573-G575 PolarHBondContact O-N 2.82Å; S573-E576 PolarHBondContact O-N 3.47Å
574	V	36.8	Very low	31.9	Very low	122 Å²	122	141.4 Å²	141.4	74%	0.739	77%	0.774	S	S	*	*	G	3₁₀ helix	trans	-64.1	-8.8	-171.7	-175	0	0	0	0	113.6
575	G	37.2	Very low	31.8	Very low	57 Å²	57	139.7 Å²	139.7	59%	0.588	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-72.8	-24.4	174.9	0	0	0	0	0	115	S573 L577	S573-G575 PolarHBondContact O-N 2.82Å; G575-L577 VanDerWaalsContact C-N 3.3Å; G575-L577 PolarHBondContact O-N 3.31Å
576	E	37	Very low	31.9	Very low	133 Å²	133	140.5 Å²	140.5	62%	0.621	77%	0.773	S	S	*	*	G	3₁₀ helix	trans	-80.7	-7.2	-177.2	-64.2	-169.8	143.6	0	0	113.7	R572 S573	R572-E576 WeakPolarHBondContact CD-OE2 3.46Å; R572-E576 WeakPolarHBondContact CG-OE2 3.39Å; R572-E576 IonicContact NE-OE2 3.61Å; R572-E576 PolarHBondContact NE-OE2 2.93Å; S573-E576 PolarHBondContact O-N 3.47Å
577	L	32.3	Very low	31.9	Very low	154 Å²	154	138.7 Å²	138.7	81%	0.806	77%	0.767	S	S	*	*	G	3₁₀ helix	trans	-90.2	5.4	-178.4	-80.8	159.9	0	0	0	114.6	G575	G575-L577 VanDerWaalsContact C-N 3.3Å; G575-L577 PolarHBondContact O-N 3.31Å
578	S	33.9	Very low	31.9	Very low	96 Å²	96	142.5 Å²	142.5	67%	0.671	77%	0.767	S	S	*	*	S	Bend	trans	-110.9	14.3	-163.4	-59.8	0	0	0	0	116
579	V	33.4	Very low	32	Very low	121 Å²	121	143.7 Å²	143.7	73%	0.733	77%	0.767	S	S	*	*	S	Bend	trans	-137.9	125.7	176.2	-170	0	0	0	0	110.9	E581	V579-E581 PolarHBondContact O-N 2.96Å
580	P	32	Very low	31.6	Very low	120 Å²	120	150 Å²	150	78%	0.779	77%	0.769	S	S	*	*			trans	-64.2	120.1	179.6	-23.9	34.5	0	0	0	113.9	K582	P580-K582 PolarHBondContact O-N 3.03Å
581	E	31.9	Very low	31.7	Very low	193 Å²	193	147.8 Å²	147.8	90%	0.902	76%	0.757	S	S	*	*	S	Bend	trans	-71.6	82.3	177.5	-66	-172.2	121.3	0	0	112.8	V579	V579-E581 PolarHBondContact O-N 2.96Å
582	K	31	Very low	31.4	Very low	186 Å²	186	145.6 Å²	145.6	81%	0.809	76%	0.756	S	S	*	*	S	Bend	trans	-129.5	-1.5	165.8	-83.9	-164.3	173.4	-176.4	0	116.4	P580	P580-K582 PolarHBondContact O-N 3.03Å
583	Y	34.5	Very low	31.6	Very low	224 Å²	224	140 Å²	140	88%	0.878	75%	0.747	S	S	*	*			trans	-141.1	81.7	178	-73.2	-83.1	0	0	0	112.3
584	K	28.1	Very low	31.9	Very low	199 Å²	199	139.5 Å²	139.5	87%	0.865	75%	0.749	S	S	*	*			trans	-134.5	126.8	154.4	-76.9	-171.4	179	172	0	109.9	T586	K584-T586 PolarHBondContact O-N 3.3Å
585	S	27.6	Very low	32.6	Very low	101 Å²	101	135.5 Å²	135.5	71%	0.706	72%	0.722	S	S	*	*			trans	-59.5	126	179.8	172.7	0	0	0	0	111.4	H587	S585-H587 PolarHBondContact O-N 3.26Å; S585-H587 PolarHBondContact OG-CD2 2.89Å
586	T	28.6	Very low	33.3	Very low	127 Å²	127	138.1 Å²	138.1	78%	0.779	73%	0.729	S	S	*	*			trans	-83	20.3	-179.2	34.5	0	0	0	0	114.1	K584 Q588	K584-T586 PolarHBondContact O-N 3.3Å; T586-Q588 PolarHBondContact O-N 3.46Å
587	H	29.6	Very low	34.2	Very low	162 Å²	162	134.3 Å²	134.3	75%	0.75	71%	0.714	S	S	*	*			trans	-79.3	53.4	172.9	-74.8	-75.6	0	0	0	113.4	S585	S585-H587 PolarHBondContact O-N 3.26Å; S585-H587 PolarHBondContact OG-CD2 2.89Å
588	Q	29.8	Very low	35.4	Very low	188 Å²	188	128.6 Å²	128.6	88%	0.879	69%	0.687	S	S	*	*			trans	-166.4	59.2	162.6	-115.8	156.9	96.5	0	0	114.8	T586	T586-Q588 PolarHBondContact O-N 3.46Å
589	I	27.9	Very low	36.7	Very low	152 Å²	152	133.1 Å²	133.1	78%	0.779	70%	0.698	S	S	*	*			trans	-113.8	98.9	150.2	-57.7	178.5	0	0	0	106.9	P591	I589-P591 WeakPolarHBondContact O-CD 3.49Å
590	R	24.1	Very low	38.8	Very low	235 Å²	235	130.7 Å²	130.7	89%	0.887	68%	0.681	S	S	*	*			trans	-66	120.1	162.9	-87.5	-176.7	171.8	177.2	-2.2	106.9	S592	R590-S592 PolarHBondContact O-N 3.1Å
591	P	31.3	Very low	41.1	Very low	77 Å²	77	129.1 Å²	129.1	50%	0.5	66%	0.661	S	S	.	*			trans	-66.3	122.6	162.1	-4	20.4	0	0	0	106.6	I589 C593	I589-P591 WeakPolarHBondContact O-CD 3.49Å; P591-C593 PolarHBondContact O-N 3.37Å; P591-C593 PolarHBondContact O-SG 2.69Å; P591-C593 VanDerWaalsContact O-SG 3.41Å
592	S	27.3	Very low	43.6	Very low	117 Å²	117	121.5 Å²	121.5	82%	0.818	63%	0.626	S	S	*	*			trans	-64.6	103.1	165.1	-172	0	0	0	0	107.2	R590	R590-S592 PolarHBondContact O-N 3.1Å
593	C	36.1	Very low	46.1	Very low	88 Å²	88	116.2 Å²	116.2	60%	0.595	60%	0.604	S	S	*	*			trans	-103.9	28.1	-172.9	44	0	0	0	0	112.1	P591	P591-C593 PolarHBondContact O-N 3.37Å; P591-C593 PolarHBondContact O-SG 2.69Å; P591-C593 VanDerWaalsContact O-SG 3.41Å
594	A	40	Very low	48.6	Very low	78 Å²	78	106.3 Å²	106.3	65%	0.645	57%	0.565	S	S	*	*			trans	-85	116.7	164.5	0	0	0	0	0	108.5	P596	A594-P596 VanDerWaalsContact O-CD 3.26Å; A594-P596 WeakPolarHBondContact O-CD 3.49Å
595	F	51.7	Low	51.4	Low	37 Å²	37	96.9 Å²	96.9	16%	0.162	52%	0.524	C	S	.	.			trans	-75.3	113.1	162.8	173.5	-131.1	0	0	0	106.8	Y473 R477 F507 V597	Y473-F595 HydrophobicContact CD2-CD1 4.13Å; Y473-F595 HydrophobicContact CD2-CE1 4.19Å; Y473-F595 HydrophobicContact CG-CD1 4.45Å; R477-F595 VanDerWaalsContact CD-CE2 3.45Å; F507-F595 HydrophobicContact CE1-CZ 4.16Å; F507-F595 AromaticContact CZ-CZ 3.97Å; F507-F595 HydrophobicContact CZ-CZ 3.97Å; F595-V597 VanDerWaalsContact C-N 3.25Å; F595-V597 HydrophobicContact CD1-CG2 3.5Å; F595-V597 VanDerWaalsContact CD1-CG2 3.5Å; F595-V597 HydrophobicContact CE1-CG2 3.59Å; F595-V597 HydrophobicContact CG-CG2 4.44Å; F595-V597 PolarHBondContact O-N 3.06Å
596	P	50.5	Low	54.2	Low	113 Å²	113	98 Å²	98	73%	0.734	51%	0.513	S	S	*	.			trans	-73.5	90.1	172.2	31.1	-31.5	0	0	0	107.3	A594 S598	A594-P596 VanDerWaalsContact O-CD 3.26Å; A594-P596 WeakPolarHBondContact O-CD 3.49Å; P596-S598 PolarHBondContact O-N 3.37Å
597	V	57.2	Low	57	Low	53 Å²	53	94.8 Å²	94.8	32%	0.321	49%	0.489	S	S	.	.			trans	-62.8	120.5	156.4	-170	0	0	0	0	104.9	F595 Q599 R604	F595-V597 VanDerWaalsContact C-N 3.25Å; F595-V597 HydrophobicContact CD1-CG2 3.5Å; F595-V597 VanDerWaalsContact CD1-CG2 3.5Å; F595-V597 HydrophobicContact CE1-CG2 3.59Å; F595-V597 HydrophobicContact CG-CG2 4.44Å; F595-V597 PolarHBondContact O-N 3.06Å; V597-Q599 PolarHBondContact O-N 3.49Å; V597-R604 HydrophobicContact CG1-CG 4.2Å
598	S	56.1	Low	59.9	Low	33 Å²	33	87.1 Å²	87.1	23%	0.231	45%	0.453	C	S	.	.			trans	-56.5	134.4	171.6	-176	0	0	0	0	109	P596 D600 E603 R604	P596-S598 PolarHBondContact O-N 3.37Å; S598-D600 PolarHBondContact O-N 3.32Å; S598-D600 PolarHBondContact OG-N 2.84Å; S598-E603 WeakPolarHBondContact CB-OE2 3.42Å; S598-E603 PolarHBondContact OG-OE2 3.21Å; S598-R604 WeakPolarHBondContact O-CD 3.5Å; S598-R604 WeakPolarHBondContact O-CG 3.19Å
599	Q	61.7	Low	62.7	Low	192 Å²	192	78.6 Å²	78.6	90%	0.897	41%	0.414	S	S	*	.	S	Bend	trans	-67.2	-22.5	175.6	-71.8	-178.7	-23.3	0	0	111.4	V597 K601	V597-Q599 PolarHBondContact O-N 3.49Å; Q599-K601 PolarHBondContact O-N 2.92Å
600	D	78.5	Confident	65.6	Low	70 Å²	70	73.1 Å²	73.1	37%	0.374	39%	0.389	S	S	.	.			trans	-70	118.8	177.9	174.6	27.8	0	0	0	111.8	S598 E602 E603 R604	S598-D600 PolarHBondContact O-N 3.32Å; S598-D600 PolarHBondContact OG-N 2.84Å; D600-E602 PolarHBondContact O-N 3.34Å; D600-E602 WeakPolarHBondContact OD1-CB 3.29Å; D600-E602 PolarHBondContact OD1-N 3.49Å; D600-E602 WeakPolarHBondContact OD2-CB 3.42Å; D600-E603 HydrophobicContact CB-CB 4.08Å; D600-E603 PolarHBondContact O-N 3.2Å; D600-E603 WeakPolarHBondContact OD2-CB 3.23Å; D600-E603 PolarHBondContact OD2-N 3.34Å; D600-R604 WeakPolarHBondContact O-CG 3.34Å; D600-R604 PolarHBondContact O-N 3.09Å
601	K	80.7	Confident	68.8	Low	86 Å²	86	62.7 Å²	62.7	37%	0.374	35%	0.35	S	S	.	.	H	α-helix	trans	-57.1	-36.3	173.7	-66.3	-170.2	176.3	-175.3	0	111.7	Q599 C605	Q599-K601 PolarHBondContact O-N 2.92Å; K601-C605 PolarHBondContact O-N 3.44Å; K601-C605 PolarHBondContact O-SG 3.18Å
602	E	83.4	Confident	71.5	Confident	34 Å²	34	59.1 Å²	59.1	16%	0.159	33%	0.327	C	S	.	.	H	α-helix	trans	-69.3	-50.8	-177.3	-161.1	-171.2	131.5	0	0	111.2	D600 R604 C605 R606 L727 R739	D600-E602 PolarHBondContact O-N 3.34Å; D600-E602 WeakPolarHBondContact OD1-CB 3.29Å; D600-E602 PolarHBondContact OD1-N 3.49Å; D600-E602 WeakPolarHBondContact OD2-CB 3.42Å; E602-R604 VanDerWaalsContact C-N 3.3Å; E602-R604 PolarHBondContact O-N 3.17Å; E602-C605 PolarHBondContact O-N 3.15Å; E602-C605 VanDerWaalsContact O-N 3.08Å; E602-R606 WeakPolarHBondContact O-CG 3.25Å; E602-R606 PolarHBondContact O-N 3.41Å; E602-R606 IonicContact OE1-CZ 2.74Å; E602-R606 IonicContact OE1-NE 3.98Å; E602-R606 PolarHBondContact OE1-NE 3.49Å; E602-R606 IonicContact OE1-NH2 3.98Å; E602-R606 PolarHBondContact OE1-NH2 2.9Å; E602-L727 HydrophobicContact CB-CD2 4.25Å; E602-L727 HydrophobicContact CG-CD2 3.47Å; E602-L727 VanDerWaalsContact CG-CD2 3.47Å; E602-R739 IonicContact OE1-CZ 2.68Å; E602-R739 IonicContact OE1-NH1 2.61Å; E602-R739 IonicContact OE1-NH2 2.71Å; E602-R739 PolarHBondContact OE1-NH2 3.31Å; E602-R739 IonicContact OE2-CZ 2.7Å; E602-R739 VanDerWaalsContact OE2-CZ 3.26Å; E602-R739 IonicContact OE2-NH1 3.94Å; E602-R739 PolarHBondContact OE2-NH1 2.68Å; E602-R739 IonicContact OE2-NH2 2.81Å; E602-R739 PolarHBondContact OE2-NH2 3.05Å
603	E	83.6	Confident	74.4	Confident	74 Å²	74	54.5 Å²	54.5	35%	0.346	29%	0.292	S	S	.	.	H	α-helix	trans	-57.6	-39.3	177.1	-170.4	-178.3	-178.4	0	0	112.7	S598 D600 R606 H607	S598-E603 WeakPolarHBondContact CB-OE2 3.42Å; S598-E603 PolarHBondContact OG-OE2 3.21Å; D600-E603 HydrophobicContact CB-CB 4.08Å; D600-E603 PolarHBondContact O-N 3.2Å; D600-E603 WeakPolarHBondContact OD2-CB 3.23Å; D600-E603 PolarHBondContact OD2-N 3.34Å; E603-R606 PolarHBondContact O-N 3.47Å; E603-H607 PolarHBondContact O-N 2.93Å; E603-H607 PolarHBondContact O-ND1 2.98Å; E603-H607 IonicContact OE1-CE1 3.88Å; E603-H607 PolarHBondContact OE1-CE1 3.42Å
604	R	86.1	Confident	76.9	Confident	17 Å²	17	54.4 Å²	54.4	6%	0.064	28%	0.282	C	S	.	.	H	α-helix	trans	-60.5	-45.1	173.8	-66	-172	-53.5	-173.4	6.8	111.9	F507 E511 V597 S598 D600 E602 H607 V608	F507-R604 HydrophobicContact CD1-CB 4.27Å; F507-R604 HydrophobicContact CD1-CG 4.29Å; E511-R604 IonicContact OE2-CZ 2.64Å; E511-R604 IonicContact OE2-NH1 2.64Å; E511-R604 PolarHBondContact OE2-NH1 3.13Å; E511-R604 IonicContact OE2-NH2 2.65Å; E511-R604 PolarHBondContact OE2-NH2 3.49Å; V597-R604 HydrophobicContact CG1-CG 4.2Å; S598-R604 WeakPolarHBondContact O-CD 3.5Å; S598-R604 WeakPolarHBondContact O-CG 3.19Å; D600-R604 WeakPolarHBondContact O-CG 3.34Å; D600-R604 PolarHBondContact O-N 3.09Å; E602-R604 VanDerWaalsContact C-N 3.3Å; E602-R604 PolarHBondContact O-N 3.17Å; R604-H607 WeakPolarHBondContact O-CB 3.37Å; R604-H607 PolarHBondContact O-N 2.93Å; R604-V608 WeakPolarHBondContact O-CG2 3.49Å; R604-V608 PolarHBondContact O-N 3.05Å; R604-V608 VanDerWaalsContact O-N 3.07Å
605	C	88.1	Confident	79.1	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.007	25%	0.251	C	S	.	.	H	α-helix	trans	-66.5	-40.3	178.6	-63.8	0	0	0	0	111.9	K601 E602 H607 V608 L609 A723 L727	K601-C605 PolarHBondContact O-N 3.44Å; K601-C605 PolarHBondContact O-SG 3.18Å; E602-C605 PolarHBondContact O-N 3.15Å; E602-C605 VanDerWaalsContact O-N 3.08Å; C605-H607 VanDerWaalsContact C-N 3.32Å; C605-H607 PolarHBondContact O-N 3.08Å; C605-V608 PolarHBondContact O-N 3.43Å; C605-L609 WeakPolarHBondContact O-CG 3.5Å; C605-L609 PolarHBondContact O-N 3.13Å; C605-A723 HydrophobicContact CB-CB 4.48Å; C605-L727 HydrophobicContact CB-CD1 3.94Å; C605-L727 HydrophobicContact CB-CD2 3.66Å; C605-L727 HydrophobicContact CB-CG 3.55Å
606	R	86.7	Confident	80.6	Confident	124 Å²	124	49.6 Å²	49.6	47%	0.468	25%	0.248	S	C	.	.	H	α-helix	trans	-60.3	-39.9	174	-64.2	-165.8	-132.3	102.6	-6.8	112	E602 E603 L609 S610	E602-R606 WeakPolarHBondContact O-CG 3.25Å; E602-R606 PolarHBondContact O-N 3.41Å; E602-R606 IonicContact OE1-CZ 2.74Å; E602-R606 IonicContact OE1-NE 3.98Å; E602-R606 PolarHBondContact OE1-NE 3.49Å; E602-R606 IonicContact OE1-NH2 3.98Å; E602-R606 PolarHBondContact OE1-NH2 2.9Å; E603-R606 PolarHBondContact O-N 3.47Å; R606-L609 PolarHBondContact O-N 2.97Å; R606-S610 WeakPolarHBondContact O-CB 3.26Å; R606-S610 PolarHBondContact O-N 2.91Å
607	H	87	Confident	82.2	Confident	60 Å²	60	48.1 Å²	48.1	28%	0.278	24%	0.24	S	C	.	.	H	α-helix	trans	-61.7	-45.4	173.3	-81.3	92.7	0	0	0	112.5	F507 E603 R604 C605 S610 Y611	F507-H607 HydrophobicContact CD1-CB 4.35Å; F507-H607 HydrophobicContact CE1-CB 3.96Å; F507-H607 HydrophobicContact CE2-CB 4.3Å; F507-H607 HydrophobicContact CZ-CB 3.93Å; E603-H607 PolarHBondContact O-N 2.93Å; E603-H607 PolarHBondContact O-ND1 2.98Å; E603-H607 IonicContact OE1-CE1 3.88Å; E603-H607 PolarHBondContact OE1-CE1 3.42Å; R604-H607 WeakPolarHBondContact O-CB 3.37Å; R604-H607 PolarHBondContact O-N 2.93Å; C605-H607 VanDerWaalsContact C-N 3.32Å; C605-H607 PolarHBondContact O-N 3.08Å; H607-S610 PolarHBondContact O-N 2.9Å; H607-Y611 WeakPolarHBondContact O-CD2 3.38Å; H607-Y611 PolarHBondContact O-N 3.41Å; H607-Y611 VanDerWaalsContact O-N 3.1Å
608	V	89.3	Confident	83.3	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-57.9	-50.3	175.7	169.8	0	0	0	0	111.1	F507 L509 R604 C605 S610 Y611 V612 K719 A723	F507-V608 HydrophobicContact CB-CG2 3.56Å; F507-V608 HydrophobicContact CD2-CG2 4.44Å; F507-V608 HydrophobicContact CG-CG2 4.18Å; L509-V608 HydrophobicContact CD2-CG2 4.34Å; R604-V608 WeakPolarHBondContact O-CG2 3.49Å; R604-V608 PolarHBondContact O-N 3.05Å; R604-V608 VanDerWaalsContact O-N 3.07Å; C605-V608 PolarHBondContact O-N 3.43Å; V608-S610 VanDerWaalsContact C-N 3.33Å; V608-S610 PolarHBondContact O-N 2.92Å; V608-Y611 PolarHBondContact O-N 3.11Å; V608-Y611 VanDerWaalsContact O-N 3.17Å; V608-V612 HydrophobicContact CG1-CG2 4.4Å; V608-V612 WeakPolarHBondContact O-CG2 3.41Å; V608-V612 PolarHBondContact O-N 3.18Å; V608-K719 HydrophobicContact CG1-CD 4.36Å; V608-K719 HydrophobicContact CG1-CG 3.82Å; V608-A723 HydrophobicContact CB-CB 4.41Å; V608-A723 HydrophobicContact CG1-CB 3.94Å
609	L	89.4	Confident	84.3	Confident	9 Å²	9	44.6 Å²	44.6	5%	0.047	22%	0.218	C	C	.	.	H	α-helix	trans	-61.1	-39.8	179.3	-65.9	169.6	0	0	0	111.9	C605 R606 Y611 V612 L613 A720 A723 Y724 L727 I807	C605-L609 WeakPolarHBondContact O-CG 3.5Å; C605-L609 PolarHBondContact O-N 3.13Å; R606-L609 PolarHBondContact O-N 2.97Å; L609-Y611 PolarHBondContact O-N 3.4Å; L609-V612 PolarHBondContact O-N 3.16Å; L609-L613 PolarHBondContact O-N 2.69Å; L609-A720 HydrophobicContact CD2-CB 4.19Å; L609-A723 HydrophobicContact CD2-CB 3.95Å; L609-A723 HydrophobicContact CG-CB 4.07Å; L609-Y724 HydrophobicContact CD1-CD1 4.23Å; L609-Y724 HydrophobicContact CD1-CE1 3.74Å; L609-Y724 HydrophobicContact CD1-CE2 4.37Å; L609-Y724 HydrophobicContact CD2-CD2 4Å; L609-Y724 HydrophobicContact CD2-CE1 4.47Å; L609-Y724 HydrophobicContact CD2-CE2 3.62Å; L609-L727 HydrophobicContact CD1-CD1 3.75Å; L609-I807 HydrophobicContact CB-CD1 4.12Å; L609-I807 HydrophobicContact CD2-CD1 3.68Å; L609-I807 HydrophobicContact CG-CD1 4.43Å
610	S	89.8	Confident	84.5	Confident	37 Å²	37	38 Å²	38	26%	0.259	19%	0.188	S	C	.	.	H	α-helix	trans	-61.7	-39.2	174.8	-169.2	0	0	0	0	113.1	R606 H607 V608 K614	R606-S610 WeakPolarHBondContact O-CB 3.26Å; R606-S610 PolarHBondContact O-N 2.91Å; H607-S610 PolarHBondContact O-N 2.9Å; V608-S610 VanDerWaalsContact C-N 3.33Å; V608-S610 PolarHBondContact O-N 2.92Å; S610-K614 WeakPolarHBondContact O-CD 3.5Å; S610-K614 VanDerWaalsContact O-CG 3.32Å; S610-K614 WeakPolarHBondContact O-CG 3.19Å; S610-K614 PolarHBondContact O-N 3.22Å; S610-K614 PolarHBondContact OG-NZ 2.92Å
611	Y	90.2	Very high	83.7	Confident	16 Å²	16	36.5 Å²	36.5	6%	0.063	18%	0.183	C	C	.	.	H	α-helix	trans	-72.1	-37.2	174.9	-69.4	-57.4	0	0	0	112.2	R477 Y500 L503 F507 H607 V608 L609 L613 K614 A615	R477-Y611 PolarHBondContact NH1-OH 2.82Å; R477-Y611 PolarHBondContact NH2-OH 3.39Å; Y500-Y611 AromaticContact CD1-CD1 3.76Å; Y500-Y611 HydrophobicContact CD1-CD1 3.76Å; Y500-Y611 HydrophobicContact CD1-CE1 4.35Å; Y500-Y611 HydrophobicContact CE1-CD1 4.29Å; L503-Y611 HydrophobicContact CB-CD1 4.07Å; L503-Y611 HydrophobicContact CB-CD2 4.29Å; L503-Y611 HydrophobicContact CB-CE1 4.12Å; L503-Y611 HydrophobicContact CB-CE2 4.36Å; L503-Y611 HydrophobicContact CB-CG 4.17Å; L503-Y611 HydrophobicContact CD1-CD1 4.3Å; L503-Y611 HydrophobicContact CD1-CE1 3.96Å; F507-Y611 HydrophobicContact CE2-CD2 4.3Å; F507-Y611 AromaticContact CE2-CE2 3.72Å; F507-Y611 HydrophobicContact CE2-CE2 3.72Å; F507-Y611 HydrophobicContact CZ-CE2 4.35Å; H607-Y611 WeakPolarHBondContact O-CD2 3.38Å; H607-Y611 PolarHBondContact O-N 3.41Å; H607-Y611 VanDerWaalsContact O-N 3.1Å; V608-Y611 PolarHBondContact O-N 3.11Å; V608-Y611 VanDerWaalsContact O-N 3.17Å; L609-Y611 PolarHBondContact O-N 3.4Å; Y611-L613 VanDerWaalsContact C-N 3.34Å; Y611-L613 PolarHBondContact O-N 2.88Å; Y611-K614 PolarHBondContact O-N 3.41Å; Y611-A615 WeakPolarHBondContact O-CB 3.25Å; Y611-A615 PolarHBondContact O-N 3.32Å
612	V	88.9	Confident	82.5	Confident	3 Å²	3	32.6 Å²	32.6	2%	0.018	17%	0.166	C	C	.	.	H	α-helix	trans	-62.7	-40.3	175.1	168.1	0	0	0	0	111.8	V608 L609 A615 S616 L716 K719 A720	V608-V612 HydrophobicContact CG1-CG2 4.4Å; V608-V612 WeakPolarHBondContact O-CG2 3.41Å; V608-V612 PolarHBondContact O-N 3.18Å; L609-V612 PolarHBondContact O-N 3.16Å; V612-A615 PolarHBondContact O-N 2.75Å; V612-S616 WeakPolarHBondContact O-CB 3.33Å; V612-S616 PolarHBondContact O-N 3.15Å; V612-S616 PolarHBondContact O-OG 3.08Å; V612-L716 HydrophobicContact CB-CD2 4.31Å; V612-L716 HydrophobicContact CG1-CB 4.11Å; V612-L716 HydrophobicContact CG1-CD2 4.17Å; V612-L716 HydrophobicContact CG2-CD2 4.05Å; V612-K719 HydrophobicContact CG2-CB 4.26Å; V612-K719 HydrophobicContact CG2-CG 4.13Å; V612-A720 HydrophobicContact CG1-CB 4.23Å
613	L	87.6	Confident	81.1	Confident	19 Å²	19	32.5 Å²	32.5	10%	0.099	17%	0.166	C	C	.	.	H	α-helix	trans	-61	-50.1	173.3	-84.8	167.3	0	0	0	112.5	L609 Y611 A615 S616 S617 E803 E806 I807	L609-L613 PolarHBondContact O-N 2.69Å; Y611-L613 VanDerWaalsContact C-N 3.34Å; Y611-L613 PolarHBondContact O-N 2.88Å; L613-A615 VanDerWaalsContact C-N 3.33Å; L613-A615 PolarHBondContact O-N 2.77Å; L613-S616 WeakPolarHBondContact O-CB 3.46Å; L613-S616 PolarHBondContact O-N 2.97Å; L613-S616 VanDerWaalsContact O-N 3.12Å; L613-S617 PolarHBondContact O-N 3.4Å; L613-E803 HydrophobicContact CD1-CB 3.62Å; L613-E803 HydrophobicContact CD1-CG 3.8Å; L613-E806 HydrophobicContact CD2-CB 3.43Å; L613-E806 VanDerWaalsContact CD2-CB 3.43Å; L613-I807 HydrophobicContact CD1-CD1 4.27Å; L613-I807 HydrophobicContact CD1-CG1 4.06Å; L613-I807 HydrophobicContact CD2-CB 4.49Å; L613-I807 HydrophobicContact CD2-CD1 4.43Å; L613-I807 HydrophobicContact CD2-CG1 3.46Å; L613-I807 VanDerWaalsContact CD2-CG1 3.46Å; L613-I807 HydrophobicContact CG-CD1 4Å; L613-I807 HydrophobicContact CG-CG1 3.57Å
614	K	87.9	Confident	79.5	Confident	87 Å²	87	32.4 Å²	32.4	38%	0.378	17%	0.174	S	C	.	.	H	α-helix	trans	-60.1	-42.7	178.6	-71.5	163.6	-179	147.5	0	111.7	Y500 S610 Y611 S617 C618	Y500-K614 HydrophobicContact CD1-CB 4.24Å; Y500-K614 HydrophobicContact CD2-CB 3.75Å; Y500-K614 HydrophobicContact CE1-CB 4.12Å; Y500-K614 HydrophobicContact CE1-CD 4.04Å; Y500-K614 HydrophobicContact CE2-CB 3.6Å; Y500-K614 HydrophobicContact CG-CB 4.06Å; S610-K614 WeakPolarHBondContact O-CD 3.5Å; S610-K614 VanDerWaalsContact O-CG 3.32Å; S610-K614 WeakPolarHBondContact O-CG 3.19Å; S610-K614 PolarHBondContact O-N 3.22Å; S610-K614 PolarHBondContact OG-NZ 2.92Å; Y611-K614 PolarHBondContact O-N 3.41Å; K614-S617 PolarHBondContact O-N 3.5Å; K614-C618 PolarHBondContact O-N 3.3Å; K614-C618 PolarHBondContact O-SG 3.27Å
615	A	86.9	Confident	77.6	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-63	-42.4	173.5	0	0	0	0	0	112.6	A497 Y611 V612 L613 S617 C618 I619 L716	A497-A615 HydrophobicContact CB-CB 4.4Å; Y611-A615 WeakPolarHBondContact O-CB 3.25Å; Y611-A615 PolarHBondContact O-N 3.32Å; V612-A615 PolarHBondContact O-N 2.75Å; L613-A615 VanDerWaalsContact C-N 3.33Å; L613-A615 PolarHBondContact O-N 2.77Å; A615-S617 PolarHBondContact O-N 2.67Å; A615-C618 PolarHBondContact O-N 2.87Å; A615-I619 PolarHBondContact O-N 3.02Å; A615-L716 HydrophobicContact CB-CD1 3.68Å; A615-L716 HydrophobicContact CB-CD2 3.65Å; A615-L716 HydrophobicContact CB-CG 4.32Å
616	S	84	Confident	75.7	Confident	14 Å²	14	37.5 Å²	37.5	10%	0.098	20%	0.204	C	C	.	.	H	α-helix	trans	-63.6	-39.9	179	-61.3	0	0	0	0	112.4	V612 L613 C618 I619 M620	V612-S616 WeakPolarHBondContact O-CB 3.33Å; V612-S616 PolarHBondContact O-N 3.15Å; V612-S616 PolarHBondContact O-OG 3.08Å; L613-S616 WeakPolarHBondContact O-CB 3.46Å; L613-S616 PolarHBondContact O-N 2.97Å; L613-S616 VanDerWaalsContact O-N 3.12Å; S616-C618 PolarHBondContact O-N 3.39Å; S616-I619 PolarHBondContact O-N 3.35Å; S616-M620 PolarHBondContact O-N 3.41Å
617	S	82.9	Confident	73.9	Confident	81 Å²	81	34.3 Å²	34.3	57%	0.566	20%	0.199	S	C	*	.	H	α-helix	trans	-59.6	-44.5	175.1	-172.8	0	0	0	0	111.8	L613 K614 A615 I619 M620 S621	L613-S617 PolarHBondContact O-N 3.4Å; K614-S617 PolarHBondContact O-N 3.5Å; A615-S617 PolarHBondContact O-N 2.67Å; S617-I619 VanDerWaalsContact C-N 3.29Å; S617-I619 PolarHBondContact O-N 3.38Å; S617-M620 PolarHBondContact O-N 2.96Å; S617-M620 VanDerWaalsContact O-N 3.11Å; S617-S621 PolarHBondContact O-N 3.08Å
618	C	80.8	Confident	71.6	Confident	9 Å²	9	36.4 Å²	36.4	6%	0.061	21%	0.208	C	C	.	.	H	α-helix	trans	-63	-29.6	176	-62.7	0	0	0	0	113.8	P493 I496 A497 K614 A615 S616 S621 G622	P493-C618 HydrophobicContact CB-CB 4.26Å; P493-C618 WeakPolarHBondContact CB-O 3.26Å; I496-C618 VanDerWaalsContact CG2-SG 3.58Å; A497-C618 HydrophobicContact CB-CB 4.2Å; K614-C618 PolarHBondContact O-N 3.3Å; K614-C618 PolarHBondContact O-SG 3.27Å; A615-C618 PolarHBondContact O-N 2.87Å; S616-C618 PolarHBondContact O-N 3.39Å; C618-S621 PolarHBondContact O-OG 2.89Å; C618-S621 VanDerWaalsContact O-OG 3.08Å; C618-G622 PolarHBondContact O-N 3.35Å
619	I	76.3	Confident	69.5	Low	3 Å²	3	42.9 Å²	42.9	2%	0.015	24%	0.237	C	C	.	.	H	α-helix	trans	-68.5	-41	174.4	-64.8	169.9	0	0	0	110.4	A615 S616 S617 H623 M703 W708 Q709 M712 K713 L716	A615-I619 PolarHBondContact O-N 3.02Å; S616-I619 PolarHBondContact O-N 3.35Å; S617-I619 VanDerWaalsContact C-N 3.29Å; S617-I619 PolarHBondContact O-N 3.38Å; I619-H623 PolarHBondContact O-N 2.87Å; I619-H623 VanDerWaalsContact O-N 3.1Å; I619-M703 HydrophobicContact CG2-CE 4.47Å; I619-W708 HydrophobicContact CG1-CZ3 4.21Å; I619-Q709 HydrophobicContact CG2-CB 3.99Å; I619-Q709 HydrophobicContact CG2-CG 4.22Å; I619-Q709 PolarHBondContact O-NE2 3.33Å; I619-M712 HydrophobicContact CD1-CB 4.04Å; I619-M712 HydrophobicContact CD1-CG 3.8Å; I619-M712 HydrophobicContact CG1-CG 4.48Å; I619-K713 HydrophobicContact CD1-CB 4.31Å; I619-L716 HydrophobicContact CD1-CD1 3.6Å
620	M	67.4	Low	67.3	Low	55 Å²	55	45 Å²	45	27%	0.271	25%	0.252	S	S	.	.	H	α-helix	trans	-68.9	-42.1	180	-66.8	-58.7	-38.5	0	0	112.9	S616 S617 G622 H623 S624	S616-M620 PolarHBondContact O-N 3.41Å; S617-M620 PolarHBondContact O-N 2.96Å; S617-M620 VanDerWaalsContact O-N 3.11Å; M620-G622 VanDerWaalsContact C-N 3.35Å; M620-H623 PolarHBondContact O-N 2.9Å; M620-S624 PolarHBondContact O-N 3.48Å
621	S	61.7	Low	65.1	Low	38 Å²	38	48.4 Å²	48.4	27%	0.266	26%	0.264	S	S	.	.	H	α-helix	trans	-61.8	-43.5	175.3	61.4	0	0	0	0	111.4	P489 S617 C618 H623 S624 L625	P489-S621 PolarHBondContact O-OG 3.26Å; S617-S621 PolarHBondContact O-N 3.08Å; C618-S621 PolarHBondContact O-OG 2.89Å; C618-S621 VanDerWaalsContact O-OG 3.08Å; S621-H623 VanDerWaalsContact C-N 3.29Å; S621-H623 PolarHBondContact O-N 3.32Å; S621-S624 PolarHBondContact O-N 2.96Å; S621-L625 PolarHBondContact O-N 2.78Å
622	G	55.4	Low	63	Low	3 Å²	3	52 Å²	52	3%	0.031	28%	0.283	C	S	.	.	H	α-helix	trans	-60.7	-34.2	174.5	0	0	0	0	0	113.7	C618 M620 T626	C618-G622 PolarHBondContact O-N 3.35Å; M620-G622 VanDerWaalsContact C-N 3.35Å; G622-T626 WeakPolarHBondContact O-CB 3.28Å; G622-T626 PolarHBondContact O-N 3.13Å; G622-T626 PolarHBondContact O-OG1 3.42Å
623	H	54	Low	60.7	Low	32 Å²	32	61.1 Å²	61.1	15%	0.148	32%	0.317	C	S	.	.	H	α-helix	trans	-67.3	-45.1	179.4	-162.3	10.3	0	0	0	112.1	I619 M620 S621 L625 T626 V627 S701	I619-H623 PolarHBondContact O-N 2.87Å; I619-H623 VanDerWaalsContact O-N 3.1Å; M620-H623 PolarHBondContact O-N 2.9Å; S621-H623 VanDerWaalsContact C-N 3.29Å; S621-H623 PolarHBondContact O-N 3.32Å; H623-L625 VanDerWaalsContact C-N 3.33Å; H623-L625 PolarHBondContact O-N 3.49Å; H623-T626 PolarHBondContact O-N 3.43Å; H623-V627 WeakPolarHBondContact O-CG2 3.33Å; H623-V627 PolarHBondContact O-N 2.98Å; H623-S701 PolarHBondContact NE2-O 3.48Å
624	S	48.2	Very low	58.5	Low	73 Å²	73	65.3 Å²	65.3	51%	0.51	34%	0.34	S	S	.	.	H	α-helix	trans	-54.7	-46.9	176.3	-170.9	0	0	0	0	112.4	M620 S621 T626 Q628	M620-S624 PolarHBondContact O-N 3.48Å; S621-S624 PolarHBondContact O-N 2.96Å; S624-T626 VanDerWaalsContact C-N 3.33Å; S624-T626 PolarHBondContact O-N 2.9Å; S624-Q628 WeakPolarHBondContact O-CG 3.46Å; S624-Q628 PolarHBondContact O-N 2.97Å
625	L	46.4	Very low	56.6	Low	52 Å²	52	66.3 Å²	66.3	27%	0.272	35%	0.348	S	S	.	.	H	α-helix	trans	-66	-31.8	175.7	-81.5	157.2	0	0	0	113.5	E490 S621 H623 K629	E490-L625 HydrophobicContact CB-CD1 4.15Å; E490-L625 VanDerWaalsContact O-CD1 3.3Å; E490-L625 WeakPolarHBondContact O-CD1 3.41Å; S621-L625 PolarHBondContact O-N 2.78Å; H623-L625 VanDerWaalsContact C-N 3.33Å; H623-L625 PolarHBondContact O-N 3.49Å; L625-K629 VanDerWaalsContact O-CB 3.31Å; L625-K629 WeakPolarHBondContact O-CB 3.35Å; L625-K629 VanDerWaalsContact O-CG 3.23Å; L625-K629 WeakPolarHBondContact O-CG 3.47Å; L625-K629 PolarHBondContact O-N 3.03Å
626	T	48.3	Very low	54.5	Low	72 Å²	72	71 Å²	71	44%	0.442	37%	0.373	S	S	.	.	H	α-helix	trans	-76.4	-41.2	179.7	-52.6	0	0	0	0	110.9	G622 H623 S624 K629 S630	G622-T626 WeakPolarHBondContact O-CB 3.28Å; G622-T626 PolarHBondContact O-N 3.13Å; G622-T626 PolarHBondContact O-OG1 3.42Å; H623-T626 PolarHBondContact O-N 3.43Å; S624-T626 VanDerWaalsContact C-N 3.33Å; S624-T626 PolarHBondContact O-N 2.9Å; T626-K629 PolarHBondContact O-N 2.87Å; T626-S630 WeakPolarHBondContact O-CB 3.38Å; T626-S630 PolarHBondContact O-N 2.78Å; T626-S630 PolarHBondContact O-OG 3.04Å; T626-S630 VanDerWaalsContact O-OG 3.13Å
627	V	49.7	Very low	52.4	Low	57 Å²	57	77.2 Å²	77.2	35%	0.345	40%	0.402	S	S	.	.	H	α-helix	trans	-62.2	-48.2	172.7	175.1	0	0	0	0	110.5	H623 K629 S630 Q631	H623-V627 WeakPolarHBondContact O-CG2 3.33Å; H623-V627 PolarHBondContact O-N 2.98Å; V627-K629 PolarHBondContact O-N 3.27Å; V627-S630 WeakPolarHBondContact CA-OG 3.41Å; V627-S630 PolarHBondContact O-N 2.87Å; V627-S630 PolarHBondContact O-OG 3Å; V627-Q631 HydrophobicContact CG1-CG 4.47Å; V627-Q631 WeakPolarHBondContact O-CG 3.18Å; V627-Q631 PolarHBondContact O-N 3.43Å
628	Q	38.8	Very low	50.3	Low	104 Å²	104	76.5 Å²	76.5	49%	0.486	40%	0.401	S	S	.	.	H	α-helix	trans	-59.1	-44.8	174.9	-76.8	-176.3	-10.4	0	0	112.6	S624 S630 Q631 I632	S624-Q628 WeakPolarHBondContact O-CG 3.46Å; S624-Q628 PolarHBondContact O-N 2.97Å; Q628-S630 PolarHBondContact O-N 3.44Å; Q628-Q631 PolarHBondContact O-N 3.32Å; Q628-I632 WeakPolarHBondContact O-CB 3.35Å; Q628-I632 WeakPolarHBondContact O-CD1 3.43Å; Q628-I632 WeakPolarHBondContact O-CG1 3.34Å; Q628-I632 PolarHBondContact O-N 3.29Å
629	K	45.3	Very low	48.5	Very low	137 Å²	137	81.4 Å²	81.4	60%	0.596	43%	0.431	S	S	*	.	H	α-helix	trans	-67.7	-31.9	178.5	-75.9	172.9	-177.9	174.2	0	113.3	L625 T626 V627 R633	L625-K629 VanDerWaalsContact O-CB 3.31Å; L625-K629 WeakPolarHBondContact O-CB 3.35Å; L625-K629 VanDerWaalsContact O-CG 3.23Å; L625-K629 WeakPolarHBondContact O-CG 3.47Å; L625-K629 PolarHBondContact O-N 3.03Å; T626-K629 PolarHBondContact O-N 2.87Å; V627-K629 PolarHBondContact O-N 3.27Å; K629-R633 WeakPolarHBondContact O-CB 3.15Å; K629-R633 PolarHBondContact O-N 3.25Å
630	S	42.3	Very low	46.9	Very low	52 Å²	52	88 Å²	88	36%	0.364	47%	0.465	S	S	.	.	H	α-helix	trans	-69.8	-48.9	172.1	60	0	0	0	0	111.7	T626 V627 Q628 I632 R633 D634	T626-S630 WeakPolarHBondContact O-CB 3.38Å; T626-S630 PolarHBondContact O-N 2.78Å; T626-S630 PolarHBondContact O-OG 3.04Å; T626-S630 VanDerWaalsContact O-OG 3.13Å; V627-S630 WeakPolarHBondContact CA-OG 3.41Å; V627-S630 PolarHBondContact O-N 2.87Å; V627-S630 PolarHBondContact O-OG 3Å; Q628-S630 PolarHBondContact O-N 3.44Å; S630-I632 VanDerWaalsContact C-N 3.3Å; S630-I632 PolarHBondContact O-N 3Å; S630-R633 CarbonylContact O-C 3.52Å; S630-R633 WeakPolarHBondContact O-CA 3.37Å; S630-R633 WeakPolarHBondContact O-CB 3.33Å; S630-R633 PolarHBondContact O-N 3.3Å; S630-D634 PolarHBondContact O-N 3.39Å
631	Q	43	Very low	45.2	Very low	109 Å²	109	91.4 Å²	91.4	51%	0.509	48%	0.484	S	S	.	.	H	α-helix	trans	-57.2	-41.4	174	-72.9	177.3	-13.2	0	0	112.2	V627 Q628 R633 D634 I635	V627-Q631 HydrophobicContact CG1-CG 4.47Å; V627-Q631 WeakPolarHBondContact O-CG 3.18Å; V627-Q631 PolarHBondContact O-N 3.43Å; Q628-Q631 PolarHBondContact O-N 3.32Å; Q631-R633 VanDerWaalsContact C-N 3.34Å; Q631-R633 PolarHBondContact O-N 3Å; Q631-D634 PolarHBondContact O-N 2.8Å; Q631-I635 WeakPolarHBondContact O-CB 3.43Å; Q631-I635 WeakPolarHBondContact O-CD1 3.48Å; Q631-I635 WeakPolarHBondContact O-CG1 3.37Å; Q631-I635 PolarHBondContact O-N 2.9Å
632	I	47	Very low	44	Very low	91 Å²	91	94.9 Å²	94.9	47%	0.467	51%	0.506	S	S	.	.	H	α-helix	trans	-66.8	-34.1	175	-68.9	164.2	0	0	0	111.6	Q628 S630 N636	Q628-I632 WeakPolarHBondContact O-CB 3.35Å; Q628-I632 WeakPolarHBondContact O-CD1 3.43Å; Q628-I632 WeakPolarHBondContact O-CG1 3.34Å; Q628-I632 PolarHBondContact O-N 3.29Å; S630-I632 VanDerWaalsContact C-N 3.3Å; S630-I632 PolarHBondContact O-N 3Å; I632-N636 VanDerWaalsContact O-CB 3.24Å; I632-N636 WeakPolarHBondContact O-CB 3.4Å; I632-N636 PolarHBondContact O-N 3.46Å; I632-N636 PolarHBondContact O-ND2 3.41Å; I632-N636 VanDerWaalsContact O-ND2 3.1Å
633	R	40.4	Very low	42.9	Very low	195 Å²	195	103.3 Å²	103.3	74%	0.736	54%	0.544	S	S	*	.	H	α-helix	trans	-68.1	-41.6	172.2	-96.1	-177.1	169.9	170.6	-2.4	112.4	K629 S630 Q631 N636 M637	K629-R633 WeakPolarHBondContact O-CB 3.15Å; K629-R633 PolarHBondContact O-N 3.25Å; S630-R633 CarbonylContact O-C 3.52Å; S630-R633 WeakPolarHBondContact O-CA 3.37Å; S630-R633 WeakPolarHBondContact O-CB 3.33Å; S630-R633 PolarHBondContact O-N 3.3Å; Q631-R633 VanDerWaalsContact C-N 3.34Å; Q631-R633 PolarHBondContact O-N 3Å; R633-N636 PolarHBondContact O-N 2.92Å; R633-M637 WeakPolarHBondContact O-CB 3.44Å; R633-M637 PolarHBondContact O-N 3.09Å
634	D	41.7	Very low	42.1	Very low	108 Å²	108	105.7 Å²	105.7	58%	0.578	58%	0.577	S	S	*	*	H	α-helix	trans	-69.8	-38.7	179.5	-63	-29.3	0	0	0	111.1	S630 Q631 M637 A638	S630-D634 PolarHBondContact O-N 3.39Å; Q631-D634 PolarHBondContact O-N 2.8Å; D634-M637 PolarHBondContact O-N 3.17Å; D634-A638 WeakPolarHBondContact O-CB 3.43Å; D634-A638 PolarHBondContact O-N 3.35Å
635	I	48.7	Very low	41.2	Very low	107 Å²	107	110.2 Å²	110.2	55%	0.549	60%	0.595	S	S	.	*	H	α-helix	trans	-62.3	-46	170	-69.3	163.6	0	0	0	110.6	Q631 M637 A638 V639	Q631-I635 WeakPolarHBondContact O-CB 3.43Å; Q631-I635 WeakPolarHBondContact O-CD1 3.48Å; Q631-I635 WeakPolarHBondContact O-CG1 3.37Å; Q631-I635 PolarHBondContact O-N 2.9Å; I635-M637 PolarHBondContact O-N 3.34Å; I635-A638 PolarHBondContact O-N 3.22Å; I635-V639 WeakPolarHBondContact O-CG2 3.2Å; I635-V639 PolarHBondContact O-N 3.1Å
636	N	41.3	Very low	40.6	Very low	98 Å²	98	117.5 Å²	117.5	52%	0.524	62%	0.624	S	S	.	*	H	α-helix	trans	-69.4	-29.8	178.9	-75.4	-28.7	0	0	0	113.3	I632 R633	I632-N636 VanDerWaalsContact O-CB 3.24Å; I632-N636 WeakPolarHBondContact O-CB 3.4Å; I632-N636 PolarHBondContact O-N 3.46Å; I632-N636 PolarHBondContact O-ND2 3.41Å; I632-N636 VanDerWaalsContact O-ND2 3.1Å; R633-N636 PolarHBondContact O-N 2.92Å
637	M	39.8	Very low	40	Very low	145 Å²	145	118.7 Å²	118.7	71%	0.714	64%	0.642	S	S	*	*	H	α-helix	trans	-70.1	-34.3	170.3	-86.5	-66.5	-60.8	0	0	112.1	R633 D634 I635 V639	R633-M637 WeakPolarHBondContact O-CB 3.44Å; R633-M637 PolarHBondContact O-N 3.09Å; D634-M637 PolarHBondContact O-N 3.17Å; I635-M637 PolarHBondContact O-N 3.34Å; M637-V639 VanDerWaalsContact C-N 3.27Å; M637-V639 PolarHBondContact O-N 3.48Å
638	A	39.3	Very low	39	Very low	66 Å²	66	123.2 Å²	123.2	55%	0.545	67%	0.669	S	S	.	*	H	α-helix	trans	-70.4	-19.3	176.2	0	0	0	0	0	113.7	D634 I635 I640	D634-A638 WeakPolarHBondContact O-CB 3.43Å; D634-A638 PolarHBondContact O-N 3.35Å; I635-A638 PolarHBondContact O-N 3.22Å; A638-I640 VanDerWaalsContact C-N 3.29Å; A638-I640 PolarHBondContact O-N 2.74Å
639	V	44.1	Very low	38.4	Very low	112 Å²	112	125.9 Å²	125.9	68%	0.679	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	-10.4	-178.9	167.2	0	0	0	0	113.7	I635 M637	I635-V639 WeakPolarHBondContact O-CG2 3.2Å; I635-V639 PolarHBondContact O-N 3.1Å; M637-V639 VanDerWaalsContact C-N 3.27Å; M637-V639 PolarHBondContact O-N 3.48Å
640	I	42	Very low	37.7	Very low	142 Å²	142	122.2 Å²	122.2	73%	0.728	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.3	2.9	-175	-60	-179.7	0	0	0	113.4	A638	A638-I640 VanDerWaalsContact C-N 3.29Å; A638-I640 PolarHBondContact O-N 2.74Å
641	N	31.3	Very low	36.9	Very low	127 Å²	127	125 Å²	125	68%	0.679	71%	0.707	S	S	*	*			trans	-138.9	96.2	177.8	-157.8	2.5	0	0	0	114.3	Q643	N641-Q643 PolarHBondContact O-N 3.47Å
642	P	37.2	Very low	36.4	Very low	111 Å²	111	128.1 Å²	128.1	72%	0.721	73%	0.725	S	S	*	*			trans	-85.9	68.2	-175	35.7	-35.7	0	0	0	112.5
643	Q	32.8	Very low	35.5	Very low	180 Å²	180	132.6 Å²	132.6	84%	0.841	74%	0.741	S	S	*	*	S	Bend	trans	-161.5	112.1	165.1	-110	139.9	84	0	0	112.6	N641	N641-Q643 PolarHBondContact O-N 3.47Å
644	G	36.4	Very low	35	Very low	81 Å²	81	132.3 Å²	132.3	84%	0.835	75%	0.745	S	S	*	*			trans	111.1	61.4	160.9	0	0	0	0	0	117.3
645	L	29.2	Very low	34.5	Very low	169 Å²	169	137 Å²	137	89%	0.885	76%	0.764	S	S	*	*			trans	-137.7	111.5	160.1	-100.6	153.8	0	0	0	110.2
646	K	33.4	Very low	33.9	Very low	205 Å²	205	136 Å²	136	89%	0.891	77%	0.767	S	S	*	*			trans	-122.5	139.2	162.5	-89.4	-170	175	-177.1	0	108.1
647	A	36.8	Very low	33.5	Very low	97 Å²	97	139.3 Å²	139.3	80%	0.802	78%	0.784	S	S	*	*			trans	63	95.6	169.3	0	0	0	0	0	117.4
648	V	27.5	Very low	33.3	Very low	151 Å²	151	140.7 Å²	140.7	92%	0.915	79%	0.793	S	S	*	*				-132.8	127.5	115.6	-179.6	0	0	0	0	106.6
649	D	27.6	Very low	33.1	Very low	160 Å²	160	143.2 Å²	143.2	86%	0.856	80%	0.804	S	S	*	*			trans	-89.9	153.8	-175.7	-144.2	-19.4	0	0	0	111.6
650	G	28.9	Very low	32.9	Very low	60 Å²	60	142.6 Å²	142.6	62%	0.619	81%	0.811	S	S	*	*			trans	-82.9	142.6	-173.2	0	0	0	0	0	113.8
651	S	26.6	Very low	32.7	Very low	110 Å²	110	140.3 Å²	140.3	77%	0.769	81%	0.814	S	S	*	*			trans	-157.6	75.2	163.6	-83.8	0	0	0	0	112.3	K653	S651-K653 PolarHBondContact O-N 3.03Å
652	I	32.3	Very low	33.4	Very low	175 Å²	175	138.9 Å²	138.9	90%	0.897	81%	0.806	S	S	*	*			trans	-73.8	109.9	156.9	-62.9	173	0	0	0	106.6
653	K	28	Very low	33.7	Very low	186 Å²	186	139.6 Å²	139.6	81%	0.809	81%	0.811	S	S	*	*			trans	-101.5	135.9	166.7	-75.6	-169.7	176.2	-176.5	0	109.8	S651	S651-K653 PolarHBondContact O-N 3.03Å
654	K	30.7	Very low	34.4	Very low	188 Å²	188	137.8 Å²	137.8	82%	0.817	81%	0.807	S	S	*	*			trans	-69.5	146.9	175.3	-68.7	179.7	175.4	-179.4	0	110.4	S656	K654-S656 VanDerWaalsContact C-N 3.33Å; K654-S656 PolarHBondContact O-N 3.31Å
655	E	31	Very low	34.5	Very low	207 Å²	207	138.4 Å²	138.4	97%	0.967	79%	0.794	S	S	*	*	S	Bend	trans	-81	77.9	176.5	-167.9	167.7	-140.1	0	0	110.4
656	S	36.2	Very low	35	Very low	87 Å²	87	135.7 Å²	135.7	61%	0.608	79%	0.787	S	S	*	*			trans	-161.9	91.7	168.1	61.2	0	0	0	0	108.9	K654	K654-S656 VanDerWaalsContact C-N 3.33Å; K654-S656 PolarHBondContact O-N 3.31Å
657	D	32.5	Very low	35.2	Very low	166 Å²	166	132.6 Å²	132.6	89%	0.888	78%	0.779	S	S	*	*			trans	155.2	89.4	157.9	-81	-17.1	0	0	0	108.8
658	L	35.4	Very low	34.9	Very low	174 Å²	174	133.8 Å²	133.8	91%	0.911	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-78.8	129	164.7	-73.4	170.9	0	0	0	108.4	A660	L658-A660 PolarHBondContact O-N 3.12Å
659	P	36	Very low	35.1	Very low	119 Å²	119	132.5 Å²	132.5	77%	0.773	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-68.9	132.4	175.6	28.5	-33	0	0	0	110.1	A661	P659-A661 PolarHBondContact O-N 3.46Å
660	A	39.8	Very low	35.2	Very low	100 Å²	100	133.6 Å²	133.6	83%	0.826	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-61.8	135.6	168	0	0	0	0	0	109.8	L658	L658-A660 PolarHBondContact O-N 3.12Å
661	A	37.7	Very low	35.4	Very low	94 Å²	94	140.2 Å²	140.2	78%	0.777	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-67.5	141.9	-178.8	0	0	0	0	0	111.9	P659 P663	P659-A661 PolarHBondContact O-N 3.46Å; A661-P663 WeakPolarHBondContact O-CD 3.18Å
662	D	46.1	Very low	35.5	Very low	97 Å²	97	142.5 Å²	142.5	52%	0.519	77%	0.769	S	S	.	*	P	Polyproline II helix	trans	-66.6	119	174.5	175.3	-3.5	0	0	0	110.2	N664 T665	D662-N664 PolarHBondContact O-N 3.47Å; D662-N664 PolarHBondContact OD1-N 3.07Å; D662-T665 PolarHBondContact O-N 3.47Å; D662-T665 VanDerWaalsContact O-N 3.1Å; D662-T665 PolarHBondContact O-OG1 2.96Å
663	P	43.6	Very low	35.2	Very low	126 Å²	126	141.8 Å²	141.8	82%	0.818	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.5	-16.9	-179.1	-25.4	34.9	0	0	0	115.6	A661	A661-P663 WeakPolarHBondContact O-CD 3.18Å
664	N	45.7	Very low	35.2	Very low	142 Å²	142	136.8 Å²	136.8	76%	0.759	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	6.8	-178.8	-61.5	-67.5	0	0	0	113.9	D662 P666	D662-N664 PolarHBondContact O-N 3.47Å; D662-N664 PolarHBondContact OD1-N 3.07Å; N664-P666 VanDerWaalsContact O-CD 3.27Å; N664-P666 WeakPolarHBondContact O-CD 3.44Å
665	T	40.6	Very low	35	Very low	93 Å²	93	131.1 Å²	131.1	57%	0.571	76%	0.763	S	S	*	*	S	Bend	trans	-85.4	110.8	174.4	-42.6	0	0	0	0	109.7	D662 I667	D662-T665 PolarHBondContact O-N 3.47Å; D662-T665 VanDerWaalsContact O-N 3.1Å; D662-T665 PolarHBondContact O-OG1 2.96Å; T665-I667 PolarHBondContact O-N 3.38Å
666	P	39	Very low	35	Very low	112 Å²	112	126.4 Å²	126.4	73%	0.727	75%	0.753	S	S	*	*			trans	-66.8	123.5	179.6	26.7	-33.5	0	0	0	110.8	N664 P668	N664-P666 VanDerWaalsContact O-CD 3.27Å; N664-P666 WeakPolarHBondContact O-CD 3.44Å; P666-P668 WeakPolarHBondContact O-CD 3.5Å
667	I	36.9	Very low	34.6	Very low	141 Å²	141	129 Å²	129	72%	0.723	76%	0.76	S	S	*	*			trans	-65.1	125.9	175.5	-60.1	171.8	0	0	0	108.6	T665 L669	T665-I667 PolarHBondContact O-N 3.38Å; I667-L669 VanDerWaalsContact C-N 3.28Å; I667-L669 PolarHBondContact O-N 3.28Å
668	P	29.9	Very low	34.3	Very low	121 Å²	121	123.2 Å²	123.2	79%	0.786	74%	0.74	S	S	*	*			trans	-71.4	81.8	174.7	-16.2	31.4	0	0	0	111.2	P666 K670	P666-P668 WeakPolarHBondContact O-CD 3.5Å; P668-K670 VanDerWaalsContact C-N 3.34Å; P668-K670 PolarHBondContact O-N 2.95Å
669	L	31.8	Very low	34	Very low	125 Å²	125	118.7 Å²	118.7	65%	0.654	73%	0.727	S	S	*	*			trans	-69	94.4	165.1	-72.7	169.4	0	0	0	108.3	I667 Y671	I667-L669 VanDerWaalsContact C-N 3.28Å; I667-L669 PolarHBondContact O-N 3.28Å; L669-Y671 HydrophobicContact CB-CD2 4.1Å; L669-Y671 HydrophobicContact CB-CE2 3.96Å; L669-Y671 HydrophobicContact CD1-CE2 4.25Å; L669-Y671 PolarHBondContact O-N 2.99Å
670	K	31	Very low	34	Very low	182 Å²	182	114.6 Å²	114.6	79%	0.791	70%	0.702	S	S	*	*			trans	-67.4	84.9	164.6	-77.2	-170	173.8	-170.1	0	109.3	P668 E672	P668-K670 VanDerWaalsContact C-N 3.34Å; P668-K670 PolarHBondContact O-N 2.95Å; K670-E672 PolarHBondContact O-N 3Å
671	Y	32.7	Very low	33.7	Very low	199 Å²	199	116.5 Å²	116.5	78%	0.78	69%	0.694	S	S	*	*			trans	-72.1	102.7	148.2	-70.2	-83.4	0	0	0	106.4	L669 D673	L669-Y671 HydrophobicContact CB-CD2 4.1Å; L669-Y671 HydrophobicContact CB-CE2 3.96Å; L669-Y671 HydrophobicContact CD1-CE2 4.25Å; L669-Y671 PolarHBondContact O-N 2.99Å; Y671-D673 PolarHBondContact O-N 3.29Å
672	E	28.1	Very low	33.6	Very low	159 Å²	159	119.8 Å²	119.8	74%	0.743	69%	0.69	S	S	*	*			trans	-70.7	120.8	158.1	-68.6	-162.6	164.6	0	0	106.9	K670 G674	K670-E672 PolarHBondContact O-N 3Å; E672-G674 PolarHBondContact O-N 3.4Å
673	D	26.1	Very low	33.2	Very low	159 Å²	159	116 Å²	116	85%	0.85	67%	0.674	S	S	*	*			trans	-55.8	134.7	171.8	-80	-47.3	0	0	0	109.2	Y671 G675	Y671-D673 PolarHBondContact O-N 3.29Å; D673-G675 PolarHBondContact O-N 2.98Å
674	G	28.6	Very low	33.2	Very low	82 Å²	82	111.4 Å²	111.4	85%	0.845	64%	0.642	S	S	*	*			trans	-67.9	63.8	-171.2	0	0	0	0	0	115.4	E672 S676	E672-G674 PolarHBondContact O-N 3.4Å; G674-S676 VanDerWaalsContact C-N 3.33Å; G674-S676 PolarHBondContact O-N 3.11Å
675	G	26.5	Very low	32.8	Very low	69 Å²	69	106.9 Å²	106.9	71%	0.711	62%	0.622	S	S	*	*			trans	-90.5	61.7	166.6	0	0	0	0	0	111.1	D673 N677	D673-G675 PolarHBondContact O-N 2.98Å; G675-N677 PolarHBondContact O-N 3.27Å
676	S	31.3	Very low	33.1	Very low	107 Å²	107	106.7 Å²	106.7	75%	0.748	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	93.5	-175.9	58.1	0	0	0	0	112.2	G674	G674-S676 VanDerWaalsContact C-N 3.33Å; G674-S676 PolarHBondContact O-N 3.11Å
677	N	27.8	Very low	33.5	Very low	141 Å²	141	102.4 Å²	102.4	75%	0.754	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-162.9	-36.9	155.6	-94.8	-25.2	0	0	0	111.8	G675 A679	G675-N677 PolarHBondContact O-N 3.27Å; N677-A679 PolarHBondContact O-N 3.31Å
678	G	26.7	Very low	33.9	Very low	45 Å²	45	99 Å²	99	46%	0.464	57%	0.571	S	S	.	*	H	α-helix	trans	-76.3	-13.4	-170.7	0	0	0	0	0	117.3
679	A	27.9	Very low	34.4	Very low	79 Å²	79	99.6 Å²	99.6	65%	0.653	56%	0.563	S	S	*	*	H	α-helix	trans	-82.6	-34.1	178.2	0	0	0	0	0	112.6	N677 K682	N677-A679 PolarHBondContact O-N 3.31Å; A679-K682 PolarHBondContact O-N 3.25Å
680	S	36.7	Very low	35.1	Very low	34 Å²	34	99.5 Å²	99.5	24%	0.238	55%	0.554	C	S	.	*	H	α-helix	trans	-65.8	-43.1	179.8	-178.5	0	0	0	0	111.6	K682 G683 I684 M822	S680-K682 VanDerWaalsContact C-N 3.26Å; S680-K682 PolarHBondContact O-N 3.08Å; S680-G683 PolarHBondContact O-N 3.05Å; S680-I684 WeakPolarHBondContact O-CG1 3.48Å; S680-I684 PolarHBondContact O-N 3.19Å; S680-M822 VanDerWaalsContact O-CE 3.27Å; S680-M822 WeakPolarHBondContact O-CE 3.48Å
681	E	32.9	Very low	35.4	Very low	140 Å²	140	93.7 Å²	93.7	65%	0.654	55%	0.546	S	S	*	.	H	α-helix	trans	-61.4	-30.6	-179.1	-66.9	-174.8	140.9	0	0	113.7	I684 S685	E681-I684 PolarHBondContact O-N 3.25Å; E681-S685 PolarHBondContact O-N 3.5Å
682	K	35.3	Very low	35.4	Very low	162 Å²	162	93.3 Å²	93.3	70%	0.704	55%	0.552	S	S	*	*	H	α-helix	trans	-73.7	-32.5	179.6	-72.9	-177.3	178.5	176	0	113.8	A679 S680 I684	A679-K682 PolarHBondContact O-N 3.25Å; S680-K682 VanDerWaalsContact C-N 3.26Å; S680-K682 PolarHBondContact O-N 3.08Å; K682-I684 VanDerWaalsContact C-N 3.33Å
683	G	38.7	Very low	35.5	Very low	18 Å²	18	89.4 Å²	89.4	19%	0.186	55%	0.546	C	S	.	.	H	α-helix	trans	-71.2	-31.3	172.1	0	0	0	0	0	112.3	S680 S685 L686	S680-G683 PolarHBondContact O-N 3.05Å; G683-S685 PolarHBondContact O-N 3.09Å; G683-L686 PolarHBondContact O-N 3.12Å
684	I	42.7	Very low	35.9	Very low	29 Å²	29	89.6 Å²	89.6	15%	0.149	55%	0.547	C	S	.	.	H	α-helix	trans	-66.6	-36.7	179.7	-67.7	165	0	0	0	111.8	S680 E681 K682 L686 L687 M822 F835 R839	S680-I684 WeakPolarHBondContact O-CG1 3.48Å; S680-I684 PolarHBondContact O-N 3.19Å; E681-I684 PolarHBondContact O-N 3.25Å; K682-I684 VanDerWaalsContact C-N 3.33Å; I684-L686 VanDerWaalsContact C-N 3.33Å; I684-L686 PolarHBondContact O-N 3.39Å; I684-L687 PolarHBondContact O-N 3.49Å; I684-M822 HydrophobicContact CG1-CE 4.11Å; I684-M822 HydrophobicContact CG1-SD 4.2Å; I684-F835 HydrophobicContact CD1-CZ 4.3Å; I684-R839 HydrophobicContact CD1-CG 4.34Å
685	S	36.9	Very low	36.3	Very low	48 Å²	48	92.8 Å²	92.8	34%	0.336	54%	0.54	S	S	.	.	H	α-helix	trans	-63.5	-35.7	176.5	-140.4	0	0	0	0	113	E681 G683 L687 L688 E689	E681-S685 PolarHBondContact O-N 3.5Å; G683-S685 PolarHBondContact O-N 3.09Å; S685-L687 VanDerWaalsContact C-N 3.32Å; S685-L687 PolarHBondContact O-N 3.49Å; S685-L688 PolarHBondContact O-N 3.31Å; S685-L688 VanDerWaalsContact O-N 3.07Å; S685-E689 WeakPolarHBondContact CB-OE2 3.17Å; S685-E689 PolarHBondContact O-N 3.27Å; S685-E689 VanDerWaalsContact OG-CD 3.23Å; S685-E689 PolarHBondContact OG-OE2 3.42Å
686	L	47	Very low	36.9	Very low	88 Å²	88	99 Å²	99	46%	0.461	55%	0.547	S	S	.	.	H	α-helix	trans	-69.1	-26.6	-179	-79.8	162.3	0	0	0	113.6	G683 I684 L688 D819	G683-L686 PolarHBondContact O-N 3.12Å; I684-L686 VanDerWaalsContact C-N 3.33Å; I684-L686 PolarHBondContact O-N 3.39Å; L686-L688 PolarHBondContact O-N 3.35Å; L686-D819 HydrophobicContact CB-CB 4.27Å
687	L	47.3	Very low	37.4	Very low	22 Å²	22	100.2 Å²	100.2	12%	0.115	54%	0.541	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-15.6	172	-65.6	172.6	0	0	0	112.8	I684 S685 F820	I684-L687 PolarHBondContact O-N 3.49Å; S685-L687 VanDerWaalsContact C-N 3.32Å; S685-L687 PolarHBondContact O-N 3.49Å; L687-F820 HydrophobicContact CD2-CD1 3.39Å; L687-F820 HydrophobicContact CD2-CE1 3.4Å; L687-F820 HydrophobicContact CD2-CG 4.33Å; L687-F820 HydrophobicContact CD2-CZ 4.33Å
688	L	45.5	Very low	38.3	Very low	69 Å²	69	97.9 Å²	97.9	36%	0.361	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120	-37.5	-166.9	-60.5	172.2	0	0	0	113.9	S685 L686 R690 A843 E846	S685-L688 PolarHBondContact O-N 3.31Å; S685-L688 VanDerWaalsContact O-N 3.07Å; L686-L688 PolarHBondContact O-N 3.35Å; L688-R690 PolarHBondContact O-N 3.33Å; L688-A843 HydrophobicContact CD2-CB 4.24Å; L688-E846 WeakPolarHBondContact CD1-OE2 3.27Å; L688-E846 HydrophobicContact CD2-CB 4.44Å; L688-E846 WeakPolarHBondContact CD2-OE2 3.41Å
689	E	40.4	Very low	39.9	Very low	135 Å²	135	96.5 Å²	96.5	63%	0.631	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-84.3	-7.8	-162.1	-75.8	-174.3	116.2	0	0	117	S685 G691 Q692	S685-E689 WeakPolarHBondContact CB-OE2 3.17Å; S685-E689 PolarHBondContact O-N 3.27Å; S685-E689 VanDerWaalsContact OG-CD 3.23Å; S685-E689 PolarHBondContact OG-OE2 3.42Å; E689-G691 PolarHBondContact O-N 3.08Å; E689-Q692 PolarHBondContact O-N 3.29Å
690	R	46.8	Very low	41.5	Very low	122 Å²	122	100.7 Å²	100.7	46%	0.46	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-74.6	5.5	-171.5	-138.5	168	-179.4	-171.1	-8	115.5	L688 Q692 D752 S756	L688-R690 PolarHBondContact O-N 3.33Å; R690-Q692 VanDerWaalsContact C-N 3.3Å; R690-Q692 PolarHBondContact O-N 3.15Å; R690-D752 IonicContact NH1-OD1 3.98Å; R690-D752 PolarHBondContact NH1-OD1 2.94Å; R690-D752 IonicContact NH1-OD2 3.32Å; R690-S756 PolarHBondContact NH1-OG 3.36Å; R690-S756 VanDerWaalsContact NH1-OG 3.09Å; R690-S756 PolarHBondContact NH2-OG 3.45Å
691	G	36.6	Very low	42.7	Very low	61 Å²	61	100.1 Å²	100.1	63%	0.629	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-72.7	-13	172	0	0	0	0	0	115.3	E689	E689-G691 PolarHBondContact O-N 3.08Å
692	Q	33.4	Very low	44.1	Very low	191 Å²	191	95.7 Å²	95.7	89%	0.893	50%	0.503	S	S	*	.			trans	-139.4	67.9	-180	-66.7	-171.3	-2	0	0	112.8	E689 R690	E689-Q692 PolarHBondContact O-N 3.29Å; R690-Q692 VanDerWaalsContact C-N 3.3Å; R690-Q692 PolarHBondContact O-N 3.15Å
693	A	29.9	Very low	45.8	Very low	76 Å²	76	88.1 Å²	88.1	63%	0.628	47%	0.471	S	S	*	.			trans	-118.5	79	171.4	0	0	0	0	0	111.1	Q695	A693-Q695 PolarHBondContact O-N 3.25Å
694	D	35.3	Very low	47.4	Very low	163 Å²	163	93.5 Å²	93.5	87%	0.872	49%	0.493	S	S	*	.			trans	-74	85	176.4	-166.7	11.6	0	0	0	110.4
695	Q	37	Very low	48.9	Very low	149 Å²	149	94.9 Å²	94.9	70%	0.696	51%	0.505	S	S	*	.			trans	-151.3	109.7	176.3	-120.9	172.6	86.3	0	0	112.8	A693 H697	A693-Q695 PolarHBondContact O-N 3.25Å; Q695-H697 PolarHBondContact O-N 3.5Å; Q695-H697 PolarHBondContact OE1-NE2 3.44Å
696	K	39.4	Very low	50.5	Low	199 Å²	199	94.2 Å²	94.2	87%	0.865	51%	0.505	S	S	*	.			trans	-70.9	87.1	175.5	-66.8	175.9	179.7	174.5	0	111.5
697	H	40.7	Very low	52.1	Low	134 Å²	134	91.3 Å²	91.3	62%	0.62	49%	0.492	S	S	*	.			trans	-104.3	136.5	162.6	-66.4	-66.2	0	0	0	109.7	Q695	Q695-H697 PolarHBondContact O-N 3.5Å; Q695-H697 PolarHBondContact OE1-NE2 3.44Å
698	P	48.1	Very low	53.8	Low	91 Å²	91	93.3 Å²	93.3	59%	0.591	50%	0.498	S	S	*	.			trans	-60	154.2	164.6	28.6	-33.7	0	0	0	109.3
699	T	58.4	Low	55.6	Low	16 Å²	16	90.8 Å²	90.8	10%	0.098	48%	0.484	C	S	.	.			trans	-57.3	154.5	178.9	82.5	0	0	0	0	110.1	S701 G702 M703 V757 E814	T699-S701 PolarHBondContact O-N 2.98Å; T699-S701 VanDerWaalsContact O-N 3.14Å; T699-G702 WeakPolarHBondContact O-CA 3.4Å; T699-G702 PolarHBondContact O-N 3.42Å; T699-M703 HydrophobicContact CG2-CB 4.46Å; T699-M703 WeakPolarHBondContact OG1-CB 3.35Å; T699-M703 PolarHBondContact OG1-N 3.47Å; T699-V757 HydrophobicContact CG2-CG1 4.16Å; T699-V757 HydrophobicContact CG2-CG2 4.32Å; T699-E814 WeakPolarHBondContact CB-OE2 3.29Å; T699-E814 PolarHBondContact OG1-OE2 3.48Å
700	R	62.1	Low	57.5	Low	167 Å²	167	85 Å²	85	63%	0.63	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-26.2	-178.7	-70.9	-171.3	-178.5	172.9	2.4	112.5	G702 R813 E814 S816	R700-G702 PolarHBondContact O-N 2.91Å; R700-R813 WeakPolarHBondContact CB-O 3.3Å; R700-E814 VanDerWaalsContact CD-O 3.31Å; R700-E814 WeakPolarHBondContact CD-O 3.43Å; R700-E814 WeakPolarHBondContact CG-O 3.16Å; R700-E814 PolarHBondContact N-OE2 2.94Å; R700-S816 VanDerWaalsContact NH1-CB 3.27Å; R700-S816 VanDerWaalsContact NH1-N 3.19Å; R700-S816 PolarHBondContact NH1-OG 3.08Å; R700-S816 PolarHBondContact NH2-OG 3.44Å
701	S	62.1	Low	59.2	Low	23 Å²	23	85.1 Å²	85.1	16%	0.161	46%	0.458	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	1.6	170	-168.9	0	0	0	0	114.5	H623 T699 M703 E814	H623-S701 PolarHBondContact NE2-O 3.48Å; T699-S701 PolarHBondContact O-N 2.98Å; T699-S701 VanDerWaalsContact O-N 3.14Å; S701-M703 VanDerWaalsContact C-N 3.32Å; S701-M703 PolarHBondContact O-N 3.33Å; S701-E814 VanDerWaalsContact CB-CD 3.44Å; S701-E814 WeakPolarHBondContact CB-OE1 3.39Å; S701-E814 WeakPolarHBondContact CB-OE2 3.42Å; S701-E814 PolarHBondContact N-OE2 3.45Å
702	G	63	Low	61.6	Low	47 Å²	47	82.7 Å²	82.7	49%	0.485	43%	0.43	S	S	.	.			trans	69.3	24.1	-179.3	0	0	0	0	0	114.3	T699 R700	T699-G702 WeakPolarHBondContact O-CA 3.4Å; T699-G702 PolarHBondContact O-N 3.42Å; R700-G702 PolarHBondContact O-N 2.91Å
703	M	69.8	Low	64.1	Low	3 Å²	3	73.9 Å²	73.9	2%	0.015	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-82.8	136.1	-177.5	-65.9	173.2	45.9	0	0	111.1	I619 T699 S701 P705 Q709 H710 K713	I619-M703 HydrophobicContact CG2-CE 4.47Å; T699-M703 HydrophobicContact CG2-CB 4.46Å; T699-M703 WeakPolarHBondContact OG1-CB 3.35Å; T699-M703 PolarHBondContact OG1-N 3.47Å; S701-M703 VanDerWaalsContact C-N 3.32Å; S701-M703 PolarHBondContact O-N 3.33Å; M703-P705 WeakPolarHBondContact O-CD 3.02Å; M703-Q709 HydrophobicContact CE-CB 3.59Å; M703-Q709 WeakPolarHBondContact CE-O 3.43Å; M703-H710 HydrophobicContact CE-CB 4.34Å; M703-H710 VanDerWaalsContact CE-N 3.34Å; M703-K713 HydrophobicContact CE-CB 4.22Å; M703-K713 HydrophobicContact CE-CD 3.96Å; M703-K713 HydrophobicContact SD-CD 3.87Å
704	I	73	Confident	66.7	Low	130 Å²	130	71.3 Å²	71.3	67%	0.667	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-72.1	124.3	-180	-59.6	166.6	0	0	0	109.1	S707 H710	I704-S707 WeakPolarHBondContact O-CB 3.38Å; I704-S707 PolarHBondContact O-N 2.93Å; I704-S707 VanDerWaalsContact O-N 3.14Å; I704-S707 PolarHBondContact O-OG 3.39Å; I704-H710 WeakPolarHBondContact O-CB 3.37Å
705	P	73.3	Confident	69.2	Low	59 Å²	59	66.4 Å²	66.4	38%	0.383	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	139.1	175.1	-26.9	35.7	0	0	0	112.3	M703 S707 E759	M703-P705 WeakPolarHBondContact O-CD 3.02Å; P705-S707 PolarHBondContact O-N 2.91Å; P705-E759 WeakPolarHBondContact CB-OE1 3.48Å
706	G	71.3	Confident	71.7	Confident	33 Å²	33	59.3 Å²	59.3	34%	0.34	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.4	-2.5	-177.7	0	0	0	0	0	115.5	H710 R711	G706-H710 PolarHBondContact N-ND1 3.06Å; G706-R711 PolarHBondContact O-NE 3.4Å; G706-R711 PolarHBondContact O-NH1 2.87Å; G706-R711 PolarHBondContact O-NH2 3.09Å
707	S	80.9	Confident	74	Confident	28 Å²	28	50.1 Å²	50.1	20%	0.196	26%	0.263	C	S	.	.	S	Bend	trans	-61.8	160.8	167.3	66.4	0	0	0	0	111.6	I704 P705 Q709 H710 R711	I704-S707 WeakPolarHBondContact O-CB 3.38Å; I704-S707 PolarHBondContact O-N 2.93Å; I704-S707 VanDerWaalsContact O-N 3.14Å; I704-S707 PolarHBondContact O-OG 3.39Å; P705-S707 PolarHBondContact O-N 2.91Å; S707-Q709 PolarHBondContact O-N 3.12Å; S707-H710 PolarHBondContact O-N 2.76Å; S707-H710 VanDerWaalsContact OG-CB 3.29Å; S707-H710 WeakPolarHBondContact OG-CB 3.44Å; S707-H710 PolarHBondContact OG-N 3.49Å; S707-R711 PolarHBondContact O-N 3.5Å
708	W	82.9	Confident	76.3	Confident	64 Å²	64	45.5 Å²	45.5	24%	0.242	24%	0.243	C	C	.	.	H	α-helix	trans	-62.7	-34.8	176.6	73.3	-98.9	0	0	0	112.4	P493 Q494 A497 I619 M712	P493-W708 HydrophobicContact CB-CH2 4.17Å; P493-W708 HydrophobicContact CG-CH2 4.35Å; P493-W708 HydrophobicContact CG-CZ2 4.33Å; Q494-W708 HydrophobicContact CB-CD2 3.9Å; Q494-W708 HydrophobicContact CB-CE3 3.95Å; Q494-W708 HydrophobicContact CB-CH2 3.89Å; Q494-W708 HydrophobicContact CB-CZ2 3.82Å; Q494-W708 HydrophobicContact CB-CZ3 3.96Å; Q494-W708 VanDerWaalsContact CD-CG 3.42Å; Q494-W708 HydrophobicContact CG-CB 4.46Å; Q494-W708 HydrophobicContact CG-CD2 3.58Å; Q494-W708 HydrophobicContact CG-CE3 3.66Å; Q494-W708 HydrophobicContact CG-CG 3.98Å; Q494-W708 HydrophobicContact CG-CZ2 4.45Å; Q494-W708 HydrophobicContact CG-CZ3 4.15Å; A497-W708 HydrophobicContact CB-CZ3 4.4Å; I619-W708 HydrophobicContact CG1-CZ3 4.21Å; W708-M712 VanDerWaalsContact O-CB 3.25Å; W708-M712 WeakPolarHBondContact O-CB 3.47Å; W708-M712 PolarHBondContact O-N 2.9Å
709	Q	82.3	Confident	78.3	Confident	15 Å²	15	42.1 Å²	42.1	7%	0.07	22%	0.219	C	C	.	.	H	α-helix	trans	-64.4	-45.5	176.6	-63.8	173.7	-61.9	0	0	110.2	I619 M703 S707 M712 K713	I619-Q709 HydrophobicContact CG2-CB 3.99Å; I619-Q709 HydrophobicContact CG2-CG 4.22Å; I619-Q709 PolarHBondContact O-NE2 3.33Å; M703-Q709 HydrophobicContact CE-CB 3.59Å; M703-Q709 WeakPolarHBondContact CE-O 3.43Å; S707-Q709 PolarHBondContact O-N 3.12Å; Q709-M712 PolarHBondContact O-N 3.32Å; Q709-K713 VanDerWaalsContact O-CB 3.23Å; Q709-K713 WeakPolarHBondContact O-CB 3.42Å; Q709-K713 PolarHBondContact O-N 3.3Å
710	H	81.8	Confident	79.9	Confident	14 Å²	14	41.4 Å²	41.4	7%	0.065	22%	0.215	C	C	.	.	H	α-helix	trans	-59.3	-50.7	176.4	173.5	-99.9	0	0	0	111.9	M703 I704 G706 S707 M712 K713 L714 V757	M703-H710 HydrophobicContact CE-CB 4.34Å; M703-H710 VanDerWaalsContact CE-N 3.34Å; I704-H710 WeakPolarHBondContact O-CB 3.37Å; G706-H710 PolarHBondContact N-ND1 3.06Å; S707-H710 PolarHBondContact O-N 2.76Å; S707-H710 VanDerWaalsContact OG-CB 3.29Å; S707-H710 WeakPolarHBondContact OG-CB 3.44Å; S707-H710 PolarHBondContact OG-N 3.49Å; H710-M712 PolarHBondContact O-N 3.4Å; H710-K713 PolarHBondContact O-N 2.95Å; H710-L714 PolarHBondContact O-N 3.48Å; H710-L714 VanDerWaalsContact O-N 3.09Å; H710-V757 VanDerWaalsContact CD2-CG1 3.42Å; H710-V757 WeakPolarHBondContact CD2-CG1 3.45Å; H710-V757 WeakPolarHBondContact NE2-CG1 3.48Å; H710-V757 PolarHBondContact NE2-O 3.07Å
711	R	82.9	Confident	81.3	Confident	124 Å²	124	33.5 Å²	33.5	47%	0.468	19%	0.185	S	C	.	.	H	α-helix	trans	-62.7	-43.6	178.1	-66.9	-179.1	-173.6	138.6	2.9	113.2	G706 S707 L714 Q715	G706-R711 PolarHBondContact O-NE 3.4Å; G706-R711 PolarHBondContact O-NH1 2.87Å; G706-R711 PolarHBondContact O-NH2 3.09Å; S707-R711 PolarHBondContact O-N 3.5Å; R711-L714 PolarHBondContact O-N 3.29Å; R711-Q715 PolarHBondContact O-N 3.17Å
712	M	85.8	Confident	82.8	Confident	11 Å²	11	35.5 Å²	35.5	5%	0.054	19%	0.191	C	C	.	.	H	α-helix	trans	-65.3	-42.5	178.1	-172.6	59.6	55.9	0	0	110.8	A497 S498 Y501 I619 W708 Q709 H710 L714 Q715 L716	A497-M712 HydrophobicContact CB-CG 4.24Å; S498-M712 WeakPolarHBondContact OG-CE 3.38Å; Y501-M712 HydrophobicContact CD1-SD 4.45Å; Y501-M712 HydrophobicContact CG-SD 4.08Å; I619-M712 HydrophobicContact CD1-CB 4.04Å; I619-M712 HydrophobicContact CD1-CG 3.8Å; I619-M712 HydrophobicContact CG1-CG 4.48Å; W708-M712 VanDerWaalsContact O-CB 3.25Å; W708-M712 WeakPolarHBondContact O-CB 3.47Å; W708-M712 PolarHBondContact O-N 2.9Å; Q709-M712 PolarHBondContact O-N 3.32Å; H710-M712 PolarHBondContact O-N 3.4Å; M712-L714 VanDerWaalsContact C-N 3.34Å; M712-L714 PolarHBondContact O-N 3.08Å; M712-Q715 PolarHBondContact O-N 3.4Å; M712-Q715 VanDerWaalsContact O-N 3.15Å; M712-L716 HydrophobicContact CG-CD1 4Å; M712-L716 HydrophobicContact CG-CG 4.29Å; M712-L716 WeakPolarHBondContact O-CB 3.47Å; M712-L716 VanDerWaalsContact O-CG 3.26Å; M712-L716 WeakPolarHBondContact O-CG 3.45Å; M712-L716 PolarHBondContact O-N 2.94Å; M712-L716 HydrophobicContact SD-CG 4.39Å
713	K	85.9	Confident	84.2	Confident	5 Å²	5	33.2 Å²	33.2	2%	0.022	17%	0.168	C	C	.	.	H	α-helix	trans	-62.8	-38.8	179.3	-165.7	164.1	-172.7	173.4	0	112.5	I619 M703 Q709 H710 L716 F717 E814	I619-K713 HydrophobicContact CD1-CB 4.31Å; M703-K713 HydrophobicContact CE-CB 4.22Å; M703-K713 HydrophobicContact CE-CD 3.96Å; M703-K713 HydrophobicContact SD-CD 3.87Å; Q709-K713 VanDerWaalsContact O-CB 3.23Å; Q709-K713 WeakPolarHBondContact O-CB 3.42Å; Q709-K713 PolarHBondContact O-N 3.3Å; H710-K713 PolarHBondContact O-N 2.95Å; K713-L716 PolarHBondContact O-N 3.18Å; K713-F717 HydrophobicContact CD-CE2 4.24Å; K713-F717 HydrophobicContact CD-CZ 4.19Å; K713-F717 HydrophobicContact CG-CD2 4.18Å; K713-F717 HydrophobicContact CG-CE1 4.4Å; K713-F717 HydrophobicContact CG-CE2 3.78Å; K713-F717 HydrophobicContact CG-CZ 3.92Å; K713-F717 WeakPolarHBondContact O-CG 3.38Å; K713-F717 PolarHBondContact O-N 2.98Å; K713-E814 HydrophobicContact CD-CG 4.46Å; K713-E814 WeakPolarHBondContact CE-OE1 3.47Å; K713-E814 IonicContact NZ-OE1 3.76Å; K713-E814 PolarHBondContact NZ-OE1 3.32Å
714	L	85.1	Confident	85.3	Confident	23 Å²	23	33.1 Å²	33.1	12%	0.12	17%	0.167	C	C	.	.	H	α-helix	trans	-58.3	-49.2	170.2	-76	169.1	0	0	0	112.3	H710 R711 M712 L716 F717 L718 Y754 V757	H710-L714 PolarHBondContact O-N 3.48Å; H710-L714 VanDerWaalsContact O-N 3.09Å; R711-L714 PolarHBondContact O-N 3.29Å; M712-L714 VanDerWaalsContact C-N 3.34Å; M712-L714 PolarHBondContact O-N 3.08Å; L714-L716 VanDerWaalsContact C-N 3.33Å; L714-L716 PolarHBondContact O-N 3.49Å; L714-F717 PolarHBondContact O-N 3.39Å; L714-L718 PolarHBondContact O-N 3.03Å; L714-L718 VanDerWaalsContact O-N 3.13Å; L714-Y754 HydrophobicContact CB-CD2 4.27Å; L714-Y754 HydrophobicContact CB-CE2 4.03Å; L714-Y754 HydrophobicContact CD2-CD2 3.68Å; L714-Y754 HydrophobicContact CD2-CE2 3.69Å; L714-Y754 HydrophobicContact CD2-CG 4.27Å; L714-Y754 WeakPolarHBondContact CD2-O 3.41Å; L714-Y754 HydrophobicContact CG-CE2 4.45Å; L714-Y754 WeakPolarHBondContact O-CD2 3.43Å; L714-V757 HydrophobicContact CD1-CG1 4.42Å; L714-V757 HydrophobicContact CD2-CB 3.79Å; L714-V757 HydrophobicContact CD2-CG1 3.71Å; L714-V757 HydrophobicContact CG-CB 4.43Å; L714-V757 HydrophobicContact CG-CG1 3.79Å
715	Q	87.6	Confident	86.3	Confident	59 Å²	59	29.4 Å²	29.4	28%	0.276	15%	0.145	S	C	.	.	H	α-helix	trans	-61.4	-41.3	178.5	-72.2	176.5	-35.4	0	0	112	Y501 R711 M712 K719	Y501-Q715 HydrophobicContact CD2-CB 4.36Å; Y501-Q715 HydrophobicContact CE1-CB 4.43Å; Y501-Q715 HydrophobicContact CE2-CB 3.92Å; R711-Q715 PolarHBondContact O-N 3.17Å; M712-Q715 PolarHBondContact O-N 3.4Å; M712-Q715 VanDerWaalsContact O-N 3.15Å; Q715-K719 WeakPolarHBondContact O-CB 3.44Å; Q715-K719 PolarHBondContact O-N 2.93Å
716	L	88.8	Confident	87.3	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-66.9	-44.4	179.4	-69	175.9	0	0	0	112.9	Y501 V612 A615 I619 M712 K713 L714 K719 A720	Y501-L716 HydrophobicContact CD2-CD2 4.18Å; V612-L716 HydrophobicContact CB-CD2 4.31Å; V612-L716 HydrophobicContact CG1-CB 4.11Å; V612-L716 HydrophobicContact CG1-CD2 4.17Å; V612-L716 HydrophobicContact CG2-CD2 4.05Å; A615-L716 HydrophobicContact CB-CD1 3.68Å; A615-L716 HydrophobicContact CB-CD2 3.65Å; A615-L716 HydrophobicContact CB-CG 4.32Å; I619-L716 HydrophobicContact CD1-CD1 3.6Å; M712-L716 HydrophobicContact CG-CD1 4Å; M712-L716 HydrophobicContact CG-CG 4.29Å; M712-L716 WeakPolarHBondContact O-CB 3.47Å; M712-L716 VanDerWaalsContact O-CG 3.26Å; M712-L716 WeakPolarHBondContact O-CG 3.45Å; M712-L716 PolarHBondContact O-N 2.94Å; M712-L716 HydrophobicContact SD-CG 4.39Å; K713-L716 PolarHBondContact O-N 3.18Å; L714-L716 VanDerWaalsContact C-N 3.33Å; L714-L716 PolarHBondContact O-N 3.49Å; L716-K719 PolarHBondContact O-N 3.35Å; L716-A720 WeakPolarHBondContact O-CB 3.45Å; L716-A720 PolarHBondContact O-N 3.07Å
717	F	88.8	Confident	88.3	Confident	6 Å²	6	26 Å²	26	3%	0.026	12%	0.116	C	C	.	.	H	α-helix	trans	-63.1	-43.3	176.2	-72	-25.1	0	0	0	112.1	K713 L714 K719 A720 S721 A753 V757 M811 E814	K713-F717 HydrophobicContact CD-CE2 4.24Å; K713-F717 HydrophobicContact CD-CZ 4.19Å; K713-F717 HydrophobicContact CG-CD2 4.18Å; K713-F717 HydrophobicContact CG-CE1 4.4Å; K713-F717 HydrophobicContact CG-CE2 3.78Å; K713-F717 HydrophobicContact CG-CZ 3.92Å; K713-F717 WeakPolarHBondContact O-CG 3.38Å; K713-F717 PolarHBondContact O-N 2.98Å; L714-F717 PolarHBondContact O-N 3.39Å; F717-K719 PolarHBondContact O-N 3.44Å; F717-A720 PolarHBondContact O-N 3.19Å; F717-S721 WeakPolarHBondContact O-CB 3.38Å; F717-S721 PolarHBondContact O-N 3.17Å; F717-A753 HydrophobicContact CD1-CB 4.45Å; F717-A753 HydrophobicContact CD2-CB 3.78Å; F717-A753 HydrophobicContact CE1-CB 4.39Å; F717-A753 HydrophobicContact CE2-CB 3.68Å; F717-A753 HydrophobicContact CG-CB 4.16Å; F717-A753 HydrophobicContact CZ-CB 3.99Å; F717-V757 HydrophobicContact CE2-CG2 4.32Å; F717-M811 HydrophobicContact CD1-CG 4.08Å; F717-M811 HydrophobicContact CE1-CB 4.48Å; F717-M811 HydrophobicContact CE1-CG 3.63Å; F717-M811 HydrophobicContact CZ-CG 4.21Å; F717-E814 HydrophobicContact CE2-CG 4.19Å; F717-E814 HydrophobicContact CZ-CG 4.2Å
718	L	88.7	Confident	88.9	Confident	38 Å²	38	24.6 Å²	24.6	20%	0.199	11%	0.107	C	C	.	.	H	α-helix	trans	-63.8	-40.5	175.8	-177.6	60.6	0	0	0	112	L714 S721 K722 Y754 L765 F768	L714-L718 PolarHBondContact O-N 3.03Å; L714-L718 VanDerWaalsContact O-N 3.13Å; L718-S721 PolarHBondContact O-N 3.25Å; L718-K722 PolarHBondContact O-N 3.49Å; L718-Y754 HydrophobicContact CB-CD2 3.98Å; L718-Y754 HydrophobicContact CB-CE2 4.26Å; L718-L765 HydrophobicContact CD1-CD2 3.67Å; L718-L765 HydrophobicContact CD2-CD2 3.61Å; L718-L765 HydrophobicContact CG-CD2 4.31Å; L718-F768 HydrophobicContact CD1-CD1 4.38Å; L718-F768 HydrophobicContact CD1-CE1 4.48Å
719	K	90.4	Very high	89.4	Confident	20 Å²	20	24 Å²	24	9%	0.087	11%	0.108	C	C	.	.	H	α-helix	trans	-66.5	-41.1	177.8	-168.4	69.1	169.8	-166.1	0	112.2	Y501 S504 E505 V608 V612 Q715 L716 F717 A723	Y501-K719 HydrophobicContact CE2-CB 4.46Å; S504-K719 VanDerWaalsContact O-CE 3.28Å; S504-K719 WeakPolarHBondContact O-CE 3.45Å; S504-K719 PolarHBondContact O-NZ 3.1Å; E505-K719 WeakPolarHBondContact OE1-CD 3.4Å; E505-K719 WeakPolarHBondContact OE1-CE 3.45Å; E505-K719 IonicContact OE1-NZ 2.68Å; E505-K719 PolarHBondContact OE1-NZ 3.42Å; E505-K719 IonicContact OE2-NZ 2.73Å; E505-K719 PolarHBondContact OE2-NZ 2.95Å; V608-K719 HydrophobicContact CG1-CD 4.36Å; V608-K719 HydrophobicContact CG1-CG 3.82Å; V612-K719 HydrophobicContact CG2-CB 4.26Å; V612-K719 HydrophobicContact CG2-CG 4.13Å; Q715-K719 WeakPolarHBondContact O-CB 3.44Å; Q715-K719 PolarHBondContact O-N 2.93Å; L716-K719 PolarHBondContact O-N 3.35Å; F717-K719 PolarHBondContact O-N 3.44Å; K719-A723 PolarHBondContact O-N 3.03Å
720	A	91.7	Very high	89.8	Confident	1 Å²	1	24.3 Å²	24.3	1%	0.008	11%	0.113	C	C	.	.	H	α-helix	trans	-62.3	-45.7	172.8	0	0	0	0	0	111.7	L609 V612 L716 F717 K722 A723 Y724 C750	L609-A720 HydrophobicContact CD2-CB 4.19Å; V612-A720 HydrophobicContact CG1-CB 4.23Å; L716-A720 WeakPolarHBondContact O-CB 3.45Å; L716-A720 PolarHBondContact O-N 3.07Å; F717-A720 PolarHBondContact O-N 3.19Å; A720-K722 VanDerWaalsContact C-N 3.34Å; A720-K722 PolarHBondContact O-N 3.4Å; A720-A723 PolarHBondContact O-N 3.33Å; A720-A723 VanDerWaalsContact O-N 3.17Å; A720-Y724 VanDerWaalsContact O-CD2 3.28Å; A720-Y724 WeakPolarHBondContact O-CD2 3.47Å; A720-Y724 PolarHBondContact O-N 3.35Å; A720-C750 HydrophobicContact CB-CB 4.46Å
721	S	92.1	Very high	90.3	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-56.2	-47	177.8	-171.2	0	0	0	0	111.9	F717 L718 Y724 Y725 S747 C750 F768	F717-S721 WeakPolarHBondContact O-CB 3.38Å; F717-S721 PolarHBondContact O-N 3.17Å; L718-S721 PolarHBondContact O-N 3.25Å; S721-Y724 PolarHBondContact O-N 3.32Å; S721-Y725 PolarHBondContact O-N 3.44Å; S721-S747 WeakPolarHBondContact O-CB 3.5Å; S721-S747 PolarHBondContact O-OG 2.92Å; S721-S747 PolarHBondContact OG-O 3.09Å; S721-S747 PolarHBondContact OG-OG 2.91Å; S721-C750 VanDerWaalsContact CB-CB 3.47Å; S721-F768 WeakPolarHBondContact OG-CE1 3.32Å
722	K	92	Very high	90.8	Very high	65 Å²	65	18.8 Å²	18.8	28%	0.283	10%	0.095	S	C	.	.	H	α-helix	trans	-62.8	-43.2	174.8	-75.6	-169.4	163.5	-149.2	0	113.3	L509 D510 L718 A720 Y724 Y725 V726 F768	L509-K722 HydrophobicContact CD1-CB 3.79Å; D510-K722 IonicContact OD2-NZ 2.74Å; D510-K722 PolarHBondContact OD2-NZ 2.66Å; L718-K722 PolarHBondContact O-N 3.49Å; A720-K722 VanDerWaalsContact C-N 3.34Å; A720-K722 PolarHBondContact O-N 3.4Å; K722-Y724 PolarHBondContact O-N 2.91Å; K722-Y725 WeakPolarHBondContact O-CB 3.35Å; K722-Y725 PolarHBondContact O-N 3.33Å; K722-V726 PolarHBondContact O-N 3.47Å; K722-V726 VanDerWaalsContact O-N 3.08Å; K722-F768 HydrophobicContact CB-CZ 4.37Å; K722-F768 HydrophobicContact CG-CD2 4.46Å; K722-F768 HydrophobicContact CG-CE1 4.19Å; K722-F768 HydrophobicContact CG-CE2 3.88Å; K722-F768 HydrophobicContact CG-CZ 3.73Å
723	A	92.3	Very high	91	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-63.2	-41.6	178	0	0	0	0	0	111.8	L509 C605 V608 L609 K719 A720 V726 L727	L509-A723 HydrophobicContact CD1-CB 4.28Å; C605-A723 HydrophobicContact CB-CB 4.48Å; V608-A723 HydrophobicContact CB-CB 4.41Å; V608-A723 HydrophobicContact CG1-CB 3.94Å; L609-A723 HydrophobicContact CD2-CB 3.95Å; L609-A723 HydrophobicContact CG-CB 4.07Å; K719-A723 PolarHBondContact O-N 3.03Å; A720-A723 PolarHBondContact O-N 3.33Å; A720-A723 VanDerWaalsContact O-N 3.17Å; A723-V726 PolarHBondContact O-N 3.44Å; A723-L727 WeakPolarHBondContact O-CG 3.4Å; A723-L727 PolarHBondContact O-N 3.04Å
724	Y	93.8	Very high	91.3	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-68.6	-33.6	174.8	-78.7	-58	0	0	0	113.6	L609 A720 S721 K722 L727 S728 Y743 L746 D804 I807	L609-Y724 HydrophobicContact CD1-CD1 4.23Å; L609-Y724 HydrophobicContact CD1-CE1 3.74Å; L609-Y724 HydrophobicContact CD1-CE2 4.37Å; L609-Y724 HydrophobicContact CD2-CD2 4Å; L609-Y724 HydrophobicContact CD2-CE1 4.47Å; L609-Y724 HydrophobicContact CD2-CE2 3.62Å; A720-Y724 VanDerWaalsContact O-CD2 3.28Å; A720-Y724 WeakPolarHBondContact O-CD2 3.47Å; A720-Y724 PolarHBondContact O-N 3.35Å; S721-Y724 PolarHBondContact O-N 3.32Å; K722-Y724 PolarHBondContact O-N 2.91Å; Y724-L727 HydrophobicContact CD1-CD1 3.97Å; Y724-L727 HydrophobicContact CE1-CD1 4.33Å; Y724-L727 PolarHBondContact O-N 3.38Å; Y724-S728 WeakPolarHBondContact O-CB 3.48Å; Y724-S728 PolarHBondContact O-N 3.25Å; Y724-Y743 AromaticContact CD1-CD1 3.82Å; Y724-Y743 HydrophobicContact CD1-CD1 3.82Å; Y724-Y743 HydrophobicContact CD1-CE1 4.48Å; Y724-Y743 HydrophobicContact CE1-CD1 4.09Å; Y724-Y743 HydrophobicContact CE1-CE1 4.39Å; Y724-L746 HydrophobicContact CD1-CB 3.86Å; Y724-L746 HydrophobicContact CD1-CD1 3.99Å; Y724-L746 HydrophobicContact CD2-CB 3.81Å; Y724-L746 HydrophobicContact CE1-CB 4.02Å; Y724-L746 HydrophobicContact CE1-CD1 3.48Å; Y724-L746 VanDerWaalsContact CE1-CD1 3.48Å; Y724-L746 HydrophobicContact CE1-CG 4.36Å; Y724-L746 HydrophobicContact CE2-CB 3.96Å; Y724-L746 HydrophobicContact CE2-CD1 4.5Å; Y724-L746 HydrophobicContact CG-CB 3.76Å; Y724-D804 VanDerWaalsContact CE1-OD1 3.27Å; Y724-D804 WeakPolarHBondContact CE1-OD1 3.42Å; Y724-D804 PolarHBondContact OH-OD1 3.05Å; Y724-I807 HydrophobicContact CE2-CD1 4.19Å; Y724-I807 HydrophobicContact CE2-CG2 4.39Å
725	Y	94.6	Very high	91.6	Very high	52 Å²	52	32.3 Å²	32.3	20%	0.204	17%	0.166	C	C	.	.	H	α-helix	trans	-60.3	-48.9	171.7	174.8	-91.8	0	0	0	111.3	S721 K722 L727 S728 D729 I744 F768 Q771 C772 L775	S721-Y725 PolarHBondContact O-N 3.44Å; K722-Y725 WeakPolarHBondContact O-CB 3.35Å; K722-Y725 PolarHBondContact O-N 3.33Å; Y725-L727 VanDerWaalsContact C-N 3.34Å; Y725-L727 PolarHBondContact O-N 2.75Å; Y725-S728 WeakPolarHBondContact O-CB 3.39Å; Y725-S728 PolarHBondContact O-N 2.84Å; Y725-S728 VanDerWaalsContact O-N 3.1Å; Y725-D729 PolarHBondContact O-N 3Å; Y725-I744 HydrophobicContact CD2-CD1 4.02Å; Y725-F768 HydrophobicContact CD1-CE2 4.28Å; Y725-F768 HydrophobicContact CD2-CE2 4.34Å; Y725-F768 AromaticContact CG-CE2 3.95Å; Y725-F768 HydrophobicContact CG-CE2 3.95Å; Y725-F768 HydrophobicContact CG-CZ 4.43Å; Y725-Q771 HydrophobicContact CE2-CB 4.12Å; Y725-C772 HydrophobicContact CD2-CB 4.48Å; Y725-L775 HydrophobicContact CD2-CD2 3.77Å; Y725-L775 HydrophobicContact CE2-CB 3.92Å; Y725-L775 HydrophobicContact CE2-CD2 3.53Å; Y725-L775 HydrophobicContact CE2-CG 4.39Å; Y725-L775 HydrophobicContact CG-CD2 4.49Å
726	V	93.1	Very high	91.9	Very high	15 Å²	15	34 Å²	34	9%	0.091	17%	0.172	C	C	.	.	H	α-helix	trans	-64.9	-36.1	178.2	175.4	0	0	0	0	112.2	L509 K722 A723 S728 A730	L509-V726 HydrophobicContact CB-CG2 4.21Å; K722-V726 PolarHBondContact O-N 3.47Å; K722-V726 VanDerWaalsContact O-N 3.08Å; A723-V726 PolarHBondContact O-N 3.44Å; V726-S728 VanDerWaalsContact C-N 3.33Å; V726-A730 VanDerWaalsContact O-CB 3.3Å; V726-A730 WeakPolarHBondContact O-CB 3.49Å; V726-A730 PolarHBondContact O-N 3.02Å
727	L	92.5	Very high	92.1	Very high	5 Å²	5	34.4 Å²	34.4	3%	0.026	17%	0.174	C	C	.	.	H	α-helix	trans	-63.7	-37.1	171.8	-74.7	171.6	0	0	0	112.7	E602 C605 L609 A723 Y724 Y725 A731 Y743	E602-L727 HydrophobicContact CB-CD2 4.25Å; E602-L727 HydrophobicContact CG-CD2 3.47Å; E602-L727 VanDerWaalsContact CG-CD2 3.47Å; C605-L727 HydrophobicContact CB-CD1 3.94Å; C605-L727 HydrophobicContact CB-CD2 3.66Å; C605-L727 HydrophobicContact CB-CG 3.55Å; L609-L727 HydrophobicContact CD1-CD1 3.75Å; A723-L727 WeakPolarHBondContact O-CG 3.4Å; A723-L727 PolarHBondContact O-N 3.04Å; Y724-L727 HydrophobicContact CD1-CD1 3.97Å; Y724-L727 HydrophobicContact CE1-CD1 4.33Å; Y724-L727 PolarHBondContact O-N 3.38Å; Y725-L727 VanDerWaalsContact C-N 3.34Å; Y725-L727 PolarHBondContact O-N 2.75Å; L727-A731 VanDerWaalsContact O-CB 3.31Å; L727-A731 WeakPolarHBondContact O-CB 3.49Å; L727-A731 PolarHBondContact O-N 3.09Å; L727-Y743 HydrophobicContact CB-CD1 4.32Å; L727-Y743 HydrophobicContact CB-CD2 3.68Å; L727-Y743 HydrophobicContact CB-CE2 4.01Å; L727-Y743 HydrophobicContact CB-CG 3.86Å; L727-Y743 HydrophobicContact CD1-CD1 4.42Å; L727-Y743 HydrophobicContact CD1-CE1 4.28Å
728	S	94.5	Very high	92.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-70.4	-44.6	177.9	-172.6	0	0	0	0	112	Y724 Y725 V726 A731 T732 A740 I744 I779	Y724-S728 WeakPolarHBondContact O-CB 3.48Å; Y724-S728 PolarHBondContact O-N 3.25Å; Y725-S728 WeakPolarHBondContact O-CB 3.39Å; Y725-S728 PolarHBondContact O-N 2.84Å; Y725-S728 VanDerWaalsContact O-N 3.1Å; V726-S728 VanDerWaalsContact C-N 3.33Å; S728-A731 PolarHBondContact O-N 3.31Å; S728-T732 WeakPolarHBondContact O-CB 3.06Å; S728-T732 PolarHBondContact O-N 3.38Å; S728-T732 PolarHBondContact O-OG1 2.77Å; S728-A740 PolarHBondContact OG-O 3Å; S728-I744 WeakPolarHBondContact OG-CB 3.34Å; S728-I779 VanDerWaalsContact OG-CD1 3.25Å; S728-I779 WeakPolarHBondContact OG-CD1 3.21Å
729	D	93.2	Very high	92.4	Very high	52 Å²	52	34.2 Å²	34.2	28%	0.278	17%	0.171	S	C	.	.	H	α-helix	trans	-60.1	-48.2	173.8	176	65.5	0	0	0	110.9	Y725 A731 T732 N733 L775	Y725-D729 PolarHBondContact O-N 3Å; D729-A731 PolarHBondContact O-N 3.33Å; D729-T732 WeakPolarHBondContact O-CB 3.34Å; D729-T732 PolarHBondContact O-N 2.87Å; D729-N733 PolarHBondContact O-N 2.77Å; D729-N733 PolarHBondContact O-ND2 3.14Å; D729-N733 PolarHBondContact OD1-ND2 3.29Å; D729-N733 PolarHBondContact OD2-ND2 2.93Å; D729-L775 HydrophobicContact CB-CD2 4.1Å
730	A	91.4	Very high	92.6	Very high	20 Å²	20	33.3 Å²	33.3	17%	0.165	17%	0.167	C	C	.	.	H	α-helix	trans	-59.2	-42.4	175.8	0	0	0	0	0	112.7	V726 N733 L734	V726-A730 VanDerWaalsContact O-CB 3.3Å; V726-A730 WeakPolarHBondContact O-CB 3.49Å; V726-A730 PolarHBondContact O-N 3.02Å; A730-N733 PolarHBondContact O-N 3.4Å; A730-L734 WeakPolarHBondContact O-CG 3.48Å; A730-L734 PolarHBondContact O-N 2.97Å
731	A	92	Very high	92.7	Very high	2 Å²	2	33.2 Å²	33.2	2%	0.017	17%	0.166	C	C	.	.	H	α-helix	trans	-67.4	-34.9	176.5	0	0	0	0	0	112.9	L727 S728 D729 L734 L735 K736 R739 A740 Y743	L727-A731 VanDerWaalsContact O-CB 3.31Å; L727-A731 WeakPolarHBondContact O-CB 3.49Å; L727-A731 PolarHBondContact O-N 3.09Å; S728-A731 PolarHBondContact O-N 3.31Å; D729-A731 PolarHBondContact O-N 3.33Å; A731-L734 CarbonylContact O-C 3.52Å; A731-L734 PolarHBondContact O-N 3.45Å; A731-L735 PolarHBondContact O-N 2.9Å; A731-K736 PolarHBondContact O-N 3.41Å; A731-R739 HydrophobicContact CB-CB 4.36Å; A731-R739 HydrophobicContact CB-CG 4.21Å; A731-A740 HydrophobicContact CB-CB 3.84Å; A731-Y743 HydrophobicContact CB-CD2 4.33Å
732	T	92.9	Very high	92.7	Very high	21 Å²	21	33.9 Å²	33.9	13%	0.129	17%	0.168	C	C	.	.	H	α-helix	trans	-65	-44.4	175.7	-54.2	0	0	0	0	110.9	S728 D729 L734 L735 Y737 A740 I779	S728-T732 WeakPolarHBondContact O-CB 3.06Å; S728-T732 PolarHBondContact O-N 3.38Å; S728-T732 PolarHBondContact O-OG1 2.77Å; D729-T732 WeakPolarHBondContact O-CB 3.34Å; D729-T732 PolarHBondContact O-N 2.87Å; T732-L734 PolarHBondContact O-N 3.26Å; T732-L735 PolarHBondContact O-N 2.68Å; T732-Y737 HydrophobicContact CG2-CD1 4.37Å; T732-Y737 HydrophobicContact CG2-CE1 4.16Å; T732-A740 WeakPolarHBondContact OG1-CB 3.37Å; T732-I779 HydrophobicContact CG2-CG1 4.28Å; T732-I779 WeakPolarHBondContact OG1-CG1 3.41Å
733	N	90.7	Very high	92.8	Very high	101 Å²	101	31.3 Å²	31.3	54%	0.54	16%	0.157	S	C	.	.	H	α-helix	trans	-65.9	-17.7	175.3	-68.8	-61.5	0	0	0	113.4	D729 A730	D729-N733 PolarHBondContact O-N 2.77Å; D729-N733 PolarHBondContact O-ND2 3.14Å; D729-N733 PolarHBondContact OD1-ND2 3.29Å; D729-N733 PolarHBondContact OD2-ND2 2.93Å; A730-N733 PolarHBondContact O-N 3.4Å
734	L	90.7	Very high	92.9	Very high	108 Å²	108	31.3 Å²	31.3	57%	0.565	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96	10.4	173	-66.7	172.4	0	0	0	113.4	A730 A731 T732 K736	A730-L734 WeakPolarHBondContact O-CG 3.48Å; A730-L734 PolarHBondContact O-N 2.97Å; A731-L734 CarbonylContact O-C 3.52Å; A731-L734 PolarHBondContact O-N 3.45Å; T732-L734 PolarHBondContact O-N 3.26Å; L734-K736 HydrophobicContact CB-CG 4.38Å; L734-K736 PolarHBondContact O-N 3.05Å; L734-K736 VanDerWaalsContact O-N 3.15Å
735	L	92.9	Very high	92.7	Very high	114 Å²	114	33.3 Å²	33.3	60%	0.597	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	62	14.3	-178.4	-43.5	176.8	0	0	0	114.9	A731 T732 Y737	A731-L735 PolarHBondContact O-N 2.9Å; T732-L735 PolarHBondContact O-N 2.68Å; L735-Y737 HydrophobicContact CB-CE2 4.46Å; L735-Y737 WeakPolarHBondContact CD2-OH 3.35Å; L735-Y737 PolarHBondContact O-N 3.13Å
736	K	92.6	Very high	92.5	Very high	93 Å²	93	31 Å²	31	40%	0.404	16%	0.157	S	C	.	.			trans	-91	67.5	-178.3	-65.5	-166.9	177.9	-168.6	0	110.8	A731 L734 G738 R739 A740 E796	A731-K736 PolarHBondContact O-N 3.41Å; L734-K736 HydrophobicContact CB-CG 4.38Å; L734-K736 PolarHBondContact O-N 3.05Å; L734-K736 VanDerWaalsContact O-N 3.15Å; K736-G738 PolarHBondContact O-N 2.96Å; K736-R739 HydrophobicContact CB-CB 3.98Å; K736-R739 WeakPolarHBondContact O-CB 3.09Å; K736-R739 PolarHBondContact O-N 2.88Å; K736-A740 WeakPolarHBondContact O-CB 3.03Å; K736-A740 PolarHBondContact O-N 3.45Å; K736-E796 VanDerWaalsContact C-OE2 3.32Å; K736-E796 VanDerWaalsContact CB-OE1 3.27Å; K736-E796 WeakPolarHBondContact CB-OE1 3.49Å; K736-E796 WeakPolarHBondContact CD-OE1 3.44Å; K736-E796 VanDerWaalsContact CG-OE1 3.27Å; K736-E796 WeakPolarHBondContact CG-OE1 3.34Å
737	Y	93.6	Very high	92.5	Very high	9 Å²	9	30.3 Å²	30.3	4%	0.035	15%	0.153	C	C	.	.	H	α-helix	trans	-69.5	-31.5	-167.1	-54.2	-54.5	0	0	0	114.2	T732 L735 R739 A740 L741 M782 N786 Y793	T732-Y737 HydrophobicContact CG2-CD1 4.37Å; T732-Y737 HydrophobicContact CG2-CE1 4.16Å; L735-Y737 HydrophobicContact CB-CE2 4.46Å; L735-Y737 WeakPolarHBondContact CD2-OH 3.35Å; L735-Y737 PolarHBondContact O-N 3.13Å; Y737-R739 VanDerWaalsContact C-N 3.35Å; Y737-A740 PolarHBondContact O-N 3.01Å; Y737-L741 WeakPolarHBondContact O-CB 3.48Å; Y737-L741 PolarHBondContact O-N 3.31Å; Y737-M782 HydrophobicContact CD1-CB 3.83Å; Y737-M782 HydrophobicContact CD1-CG 4.43Å; Y737-M782 HydrophobicContact CD2-CB 4.07Å; Y737-M782 HydrophobicContact CE1-CB 3.58Å; Y737-M782 HydrophobicContact CE1-CG 3.82Å; Y737-M782 HydrophobicContact CE2-CB 3.84Å; Y737-M782 HydrophobicContact CG-CB 4.08Å; Y737-M782 VanDerWaalsContact OH-CE 3.26Å; Y737-M782 WeakPolarHBondContact OH-CE 3.44Å; Y737-N786 HydrophobicContact CE2-CB 4.46Å; Y737-Y793 HydrophobicContact CD2-CE1 4Å; Y737-Y793 HydrophobicContact CD2-CE2 4.26Å; Y737-Y793 AromaticContact CD2-CZ 3.65Å; Y737-Y793 WeakPolarHBondContact CD2-OH 3.31Å
738	G	91.9	Very high	92.3	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64	-43.7	172.8	0	0	0	0	0	111.3	K736 L741 R742 Y793 E796	K736-G738 PolarHBondContact O-N 2.96Å; G738-L741 PolarHBondContact O-N 2.95Å; G738-R742 PolarHBondContact O-N 3.31Å; G738-R742 VanDerWaalsContact O-N 3.14Å; G738-Y793 WeakPolarHBondContact CA-O 3.46Å; G738-E796 PolarHBondContact N-OE2 3.47Å
739	R	92.1	Very high	92	Very high	41 Å²	41	31.4 Å²	31.4	16%	0.155	16%	0.158	C	C	.	.	H	α-helix	trans	-62.4	-43.7	173.6	-171.2	179.7	-172.3	-159.8	2.2	111.9	E602 A731 K736 Y737 R742 Y743 E796	E602-R739 IonicContact OE1-CZ 2.68Å; E602-R739 IonicContact OE1-NH1 2.61Å; E602-R739 IonicContact OE1-NH2 2.71Å; E602-R739 PolarHBondContact OE1-NH2 3.31Å; E602-R739 IonicContact OE2-CZ 2.7Å; E602-R739 VanDerWaalsContact OE2-CZ 3.26Å; E602-R739 IonicContact OE2-NH1 3.94Å; E602-R739 PolarHBondContact OE2-NH1 2.68Å; E602-R739 IonicContact OE2-NH2 2.81Å; E602-R739 PolarHBondContact OE2-NH2 3.05Å; A731-R739 HydrophobicContact CB-CB 4.36Å; A731-R739 HydrophobicContact CB-CG 4.21Å; K736-R739 HydrophobicContact CB-CB 3.98Å; K736-R739 WeakPolarHBondContact O-CB 3.09Å; K736-R739 PolarHBondContact O-N 2.88Å; Y737-R739 VanDerWaalsContact C-N 3.35Å; R739-R742 PolarHBondContact O-N 2.85Å; R739-Y743 HydrophobicContact CG-CD2 4.06Å; R739-Y743 HydrophobicContact CG-CE2 3.59Å; R739-Y743 PolarHBondContact NE-OH 2.85Å; R739-Y743 PolarHBondContact NH2-OH 3.26Å; R739-Y743 WeakPolarHBondContact O-CD2 3.3Å; R739-Y743 PolarHBondContact O-N 3.32Å; R739-Y743 VanDerWaalsContact O-N 3.12Å; R739-E796 HydrophobicContact CB-CB 4.04Å; R739-E796 HydrophobicContact CB-CG 4.35Å; R739-E796 PolarHBondContact N-OE2 3.48Å
740	A	94.6	Very high	91.7	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-63.7	-43.4	178.7	0	0	0	0	0	112	S728 A731 T732 K736 Y737 R742 Y743 I744 I779	S728-A740 PolarHBondContact OG-O 3Å; A731-A740 HydrophobicContact CB-CB 3.84Å; T732-A740 WeakPolarHBondContact OG1-CB 3.37Å; K736-A740 WeakPolarHBondContact O-CB 3.03Å; K736-A740 PolarHBondContact O-N 3.45Å; Y737-A740 PolarHBondContact O-N 3.01Å; A740-R742 VanDerWaalsContact C-N 3.34Å; A740-R742 PolarHBondContact O-N 3.44Å; A740-Y743 PolarHBondContact O-N 2.88Å; A740-Y743 VanDerWaalsContact O-N 3.15Å; A740-I744 PolarHBondContact O-N 3.43Å; A740-I779 HydrophobicContact CB-CD1 3.77Å; A740-I779 HydrophobicContact CB-CG1 4.03Å; A740-I779 HydrophobicContact CB-CG2 4.41Å
741	L	93.7	Very high	91.5	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-61.9	-41	178	-172.6	65.8	0	0	0	111.5	Y737 G738 I744 K745 I779 Q780 L783 Y797 L826	Y737-L741 WeakPolarHBondContact O-CB 3.48Å; Y737-L741 PolarHBondContact O-N 3.31Å; G738-L741 PolarHBondContact O-N 2.95Å; L741-I744 HydrophobicContact CD1-CG2 4.23Å; L741-I744 WeakPolarHBondContact O-CG2 3.43Å; L741-I744 PolarHBondContact O-N 2.71Å; L741-K745 WeakPolarHBondContact O-CB 3.44Å; L741-K745 PolarHBondContact O-N 3.01Å; L741-I779 HydrophobicContact CB-CG2 3.89Å; L741-I779 HydrophobicContact CD1-CG2 4.1Å; L741-Q780 HydrophobicContact CD1-CG 4.34Å; L741-L783 HydrophobicContact CB-CD1 4.39Å; L741-L783 HydrophobicContact CD2-CD1 3.84Å; L741-Y797 HydrophobicContact CB-CD2 4.13Å; L741-Y797 HydrophobicContact CB-CE2 4.38Å; L741-Y797 HydrophobicContact CD2-CD2 3.99Å; L741-Y797 HydrophobicContact CD2-CE2 3.85Å; L741-Y797 HydrophobicContact CG-CD2 4.1Å; L741-Y797 HydrophobicContact CG-CE2 3.88Å; L741-L826 HydrophobicContact CD2-CB 3.92Å; L741-L826 HydrophobicContact CD2-CD1 4.04Å
742	R	91.8	Very high	91	Very high	13 Å²	13	28.6 Å²	28.6	5%	0.049	14%	0.139	C	C	.	.	H	α-helix	trans	-61.5	-43	173	176.2	178.2	60.7	115.3	9.6	112.2	G738 R739 A740 K745 L746 E796 Y797 Y799 D804	G738-R742 PolarHBondContact O-N 3.31Å; G738-R742 VanDerWaalsContact O-N 3.14Å; R739-R742 PolarHBondContact O-N 2.85Å; A740-R742 VanDerWaalsContact C-N 3.34Å; A740-R742 PolarHBondContact O-N 3.44Å; R742-K745 WeakPolarHBondContact O-CB 3.33Å; R742-K745 PolarHBondContact O-N 3.22Å; R742-L746 HydrophobicContact CG-CD1 4.44Å; R742-L746 WeakPolarHBondContact O-CG 3.43Å; R742-L746 PolarHBondContact O-N 2.94Å; R742-L746 VanDerWaalsContact O-N 3.1Å; R742-E796 PolarHBondContact NE-O 3.33Å; R742-E796 VanDerWaalsContact NE-O 3.17Å; R742-Y797 HydrophobicContact CB-CD2 4.01Å; R742-Y797 WeakPolarHBondContact CD-O 3.41Å; R742-Y799 WeakPolarHBondContact CD-O 3.46Å; R742-Y799 PolarHBondContact NE-O 3.41Å; R742-Y799 VanDerWaalsContact NE-O 3.14Å; R742-Y799 PolarHBondContact NH1-O 3.1Å; R742-D804 IonicContact NH1-OD2 3.97Å; R742-D804 PolarHBondContact NH1-OD2 3.25Å
743	Y	93.3	Very high	90.5	Very high	12 Å²	12	27.6 Å²	27.6	5%	0.047	13%	0.133	C	C	.	.	H	α-helix	trans	-70.3	-38.6	178.9	-69.4	-39.4	0	0	0	113.1	Y724 L727 A731 R739 A740 K745 L746 S747	Y724-Y743 AromaticContact CD1-CD1 3.82Å; Y724-Y743 HydrophobicContact CD1-CD1 3.82Å; Y724-Y743 HydrophobicContact CD1-CE1 4.48Å; Y724-Y743 HydrophobicContact CE1-CD1 4.09Å; Y724-Y743 HydrophobicContact CE1-CE1 4.39Å; L727-Y743 HydrophobicContact CB-CD1 4.32Å; L727-Y743 HydrophobicContact CB-CD2 3.68Å; L727-Y743 HydrophobicContact CB-CE2 4.01Å; L727-Y743 HydrophobicContact CB-CG 3.86Å; L727-Y743 HydrophobicContact CD1-CD1 4.42Å; L727-Y743 HydrophobicContact CD1-CE1 4.28Å; A731-Y743 HydrophobicContact CB-CD2 4.33Å; R739-Y743 HydrophobicContact CG-CD2 4.06Å; R739-Y743 HydrophobicContact CG-CE2 3.59Å; R739-Y743 PolarHBondContact NE-OH 2.85Å; R739-Y743 PolarHBondContact NH2-OH 3.26Å; R739-Y743 WeakPolarHBondContact O-CD2 3.3Å; R739-Y743 PolarHBondContact O-N 3.32Å; R739-Y743 VanDerWaalsContact O-N 3.12Å; A740-Y743 PolarHBondContact O-N 2.88Å; A740-Y743 VanDerWaalsContact O-N 3.15Å; Y743-K745 VanDerWaalsContact C-N 3.3Å; Y743-K745 PolarHBondContact O-N 3.44Å; Y743-L746 HydrophobicContact CD1-CD1 4.33Å; Y743-L746 PolarHBondContact O-N 3.13Å; Y743-S747 PolarHBondContact O-N 3.31Å
744	I	94.3	Very high	90.2	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-68.4	-32	174.9	-158.6	58.4	0	0	0	111.6	Y725 S728 A740 L741 S747 L748 C772 L775 C776 I779	Y725-I744 HydrophobicContact CD2-CD1 4.02Å; S728-I744 WeakPolarHBondContact OG-CB 3.34Å; A740-I744 PolarHBondContact O-N 3.43Å; L741-I744 HydrophobicContact CD1-CG2 4.23Å; L741-I744 WeakPolarHBondContact O-CG2 3.43Å; L741-I744 PolarHBondContact O-N 2.71Å; I744-S747 WeakPolarHBondContact O-CB 3.04Å; I744-S747 PolarHBondContact O-N 2.77Å; I744-L748 HydrophobicContact CG1-CD1 4.39Å; I744-L748 WeakPolarHBondContact O-CB 3.38Å; I744-L748 WeakPolarHBondContact O-CG 3.42Å; I744-L748 PolarHBondContact O-N 3.21Å; I744-C772 HydrophobicContact CD1-CB 4.06Å; I744-L775 HydrophobicContact CD1-CB 4.45Å; I744-L775 HydrophobicContact CD1-CD2 4.1Å; I744-L775 HydrophobicContact CD1-CG 4.41Å; I744-C776 HydrophobicContact CG1-CB 3.9Å; I744-C776 HydrophobicContact CG2-CB 4.19Å; I744-I779 HydrophobicContact CB-CD1 4.25Å; I744-I779 HydrophobicContact CG2-CD1 4.02Å
745	K	91.3	Very high	89.7	Confident	42 Å²	42	19.9 Å²	19.9	18%	0.183	9%	0.093	C	C	.	.	H	α-helix	trans	-57.2	-52.2	169.8	-170.6	163.8	-171.8	157.5	0	111.9	L741 R742 Y743 S747 L748 Q749 Y797 T824 D825	L741-K745 WeakPolarHBondContact O-CB 3.44Å; L741-K745 PolarHBondContact O-N 3.01Å; R742-K745 WeakPolarHBondContact O-CB 3.33Å; R742-K745 PolarHBondContact O-N 3.22Å; Y743-K745 VanDerWaalsContact C-N 3.3Å; Y743-K745 PolarHBondContact O-N 3.44Å; K745-S747 VanDerWaalsContact C-N 3.3Å; K745-S747 PolarHBondContact O-N 2.72Å; K745-L748 PolarHBondContact O-N 2.69Å; K745-Q749 WeakPolarHBondContact O-CB 3.37Å; K745-Q749 VanDerWaalsContact O-CG 3.29Å; K745-Q749 WeakPolarHBondContact O-CG 3.34Å; K745-Q749 PolarHBondContact O-N 3.15Å; K745-Y797 HydrophobicContact CD-CE2 4.34Å; K745-Y797 WeakPolarHBondContact CD-OH 3.46Å; K745-Y797 PolarHBondContact NZ-OH 2.89Å; K745-T824 HydrophobicContact CB-CG2 3.98Å; K745-T824 WeakPolarHBondContact CD-OG1 3.25Å; K745-T824 WeakPolarHBondContact CE-OG1 3.25Å; K745-T824 HydrophobicContact CG-CG2 4.14Å; K745-T824 WeakPolarHBondContact CG-OG1 3.39Å; K745-D825 IonicContact NZ-OD1 2.81Å; K745-D825 PolarHBondContact NZ-OD1 3.5Å
746	L	90.1	Very high	88.9	Confident	4 Å²	4	16 Å²	16	2%	0.021	8%	0.076	C	C	.	.	H	α-helix	trans	-61.7	-38.6	176.9	-66.9	171.2	0	0	0	111.8	Y724 R742 Y743 Q749 C750 D804 L808	Y724-L746 HydrophobicContact CD1-CB 3.86Å; Y724-L746 HydrophobicContact CD1-CD1 3.99Å; Y724-L746 HydrophobicContact CD2-CB 3.81Å; Y724-L746 HydrophobicContact CE1-CB 4.02Å; Y724-L746 HydrophobicContact CE1-CD1 3.48Å; Y724-L746 VanDerWaalsContact CE1-CD1 3.48Å; Y724-L746 HydrophobicContact CE1-CG 4.36Å; Y724-L746 HydrophobicContact CE2-CB 3.96Å; Y724-L746 HydrophobicContact CE2-CD1 4.5Å; Y724-L746 HydrophobicContact CG-CB 3.76Å; R742-L746 HydrophobicContact CG-CD1 4.44Å; R742-L746 WeakPolarHBondContact O-CG 3.43Å; R742-L746 PolarHBondContact O-N 2.94Å; R742-L746 VanDerWaalsContact O-N 3.1Å; Y743-L746 HydrophobicContact CD1-CD1 4.33Å; Y743-L746 PolarHBondContact O-N 3.13Å; L746-Q749 PolarHBondContact O-N 3.25Å; L746-C750 WeakPolarHBondContact O-CB 3.25Å; L746-C750 PolarHBondContact O-N 3.01Å; L746-C750 PolarHBondContact O-SG 3.4Å; L746-D804 HydrophobicContact CD1-CB 4.18Å; L746-L808 HydrophobicContact CD2-CD1 3.73Å; L746-L808 HydrophobicContact CD2-CD2 3.82Å; L746-L808 HydrophobicContact CD2-CG 3.66Å
747	S	92.1	Very high	88	Confident	0 Å²	0	12 Å²	12	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-61.5	-48.3	175.4	-176.6	0	0	0	0	112.6	S721 Y743 I744 K745 C750 Y751	S721-S747 WeakPolarHBondContact O-CB 3.5Å; S721-S747 PolarHBondContact O-OG 2.92Å; S721-S747 PolarHBondContact OG-O 3.09Å; S721-S747 PolarHBondContact OG-OG 2.91Å; Y743-S747 PolarHBondContact O-N 3.31Å; I744-S747 WeakPolarHBondContact O-CB 3.04Å; I744-S747 PolarHBondContact O-N 2.77Å; K745-S747 VanDerWaalsContact C-N 3.3Å; K745-S747 PolarHBondContact O-N 2.72Å; S747-C750 WeakPolarHBondContact O-CB 3.45Å; S747-C750 PolarHBondContact O-N 3.06Å; S747-Y751 PolarHBondContact O-N 2.68Å
748	L	88.6	Confident	87.2	Confident	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-66.9	-38.3	178.3	-72.4	168.6	0	0	0	112	I744 K745 Y751 D752 C772 L773 F820 T824	I744-L748 HydrophobicContact CG1-CD1 4.39Å; I744-L748 WeakPolarHBondContact O-CB 3.38Å; I744-L748 WeakPolarHBondContact O-CG 3.42Å; I744-L748 PolarHBondContact O-N 3.21Å; K745-L748 PolarHBondContact O-N 2.69Å; L748-Y751 WeakPolarHBondContact O-CB 3.33Å; L748-Y751 PolarHBondContact O-N 2.91Å; L748-Y751 VanDerWaalsContact O-N 3.13Å; L748-D752 PolarHBondContact O-N 2.92Å; L748-C772 HydrophobicContact CD2-CB 3.76Å; L748-C772 HydrophobicContact CG-CB 4.41Å; L748-L773 HydrophobicContact CD2-CD2 4.43Å; L748-F820 HydrophobicContact CB-CB 4.31Å; L748-F820 HydrophobicContact CB-CD1 4.36Å; L748-F820 HydrophobicContact CB-CG 4.12Å; L748-F820 HydrophobicContact CD1-CB 4.48Å; L748-F820 HydrophobicContact CD1-CD1 4.23Å; L748-F820 HydrophobicContact CD2-CD1 4.16Å; L748-F820 HydrophobicContact CD2-CE1 4.24Å; L748-F820 HydrophobicContact CG-CD1 4.49Å; L748-T824 HydrophobicContact CD1-CG2 3.75Å
749	Q	87.1	Confident	85.9	Confident	27 Å²	27	20.2 Å²	20.2	13%	0.126	10%	0.1	C	C	.	.	H	α-helix	trans	-64.5	-38.6	173.4	-70.8	176.4	-54.8	0	0	112.3	K745 L746 Y751 D752 A753 M811	K745-Q749 WeakPolarHBondContact O-CB 3.37Å; K745-Q749 VanDerWaalsContact O-CG 3.29Å; K745-Q749 WeakPolarHBondContact O-CG 3.34Å; K745-Q749 PolarHBondContact O-N 3.15Å; L746-Q749 PolarHBondContact O-N 3.25Å; Q749-Y751 VanDerWaalsContact C-N 3.3Å; Q749-Y751 PolarHBondContact O-N 3.27Å; Q749-D752 PolarHBondContact O-N 2.94Å; Q749-A753 WeakPolarHBondContact O-CB 3.35Å; Q749-A753 PolarHBondContact O-N 3.42Å; Q749-M811 HydrophobicContact CB-CE 4.02Å
750	C	87.9	Confident	84.5	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-62.2	-37.9	170.7	-67.1	0	0	0	0	112	A720 S721 L746 S747 Y754 M811	A720-C750 HydrophobicContact CB-CB 4.46Å; S721-C750 VanDerWaalsContact CB-CB 3.47Å; L746-C750 WeakPolarHBondContact O-CB 3.25Å; L746-C750 PolarHBondContact O-N 3.01Å; L746-C750 PolarHBondContact O-SG 3.4Å; S747-C750 WeakPolarHBondContact O-CB 3.45Å; S747-C750 PolarHBondContact O-N 3.06Å; C750-Y754 PolarHBondContact O-N 3.43Å; C750-M811 WeakPolarHBondContact CA-SD 3.21Å; C750-M811 HydrophobicContact CB-SD 3.9Å; C750-M811 PolarHBondContact N-SD 3.31Å; C750-M811 PolarHBondContact SG-SD 3.42Å
751	Y	86.3	Confident	83.2	Confident	9 Å²	9	26 Å²	26	4%	0.035	14%	0.138	C	C	.	.	H	α-helix	trans	-70.3	-39.5	178.1	-171.7	-84.5	0	0	0	112.5	S747 L748 Q749 Y754 C755 L765 F768 H769	S747-Y751 PolarHBondContact O-N 2.68Å; L748-Y751 WeakPolarHBondContact O-CB 3.33Å; L748-Y751 PolarHBondContact O-N 2.91Å; L748-Y751 VanDerWaalsContact O-N 3.13Å; Q749-Y751 VanDerWaalsContact C-N 3.3Å; Q749-Y751 PolarHBondContact O-N 3.27Å; Y751-Y754 WeakPolarHBondContact O-CB 3.49Å; Y751-Y754 PolarHBondContact O-N 2.92Å; Y751-C755 WeakPolarHBondContact CE1-SG 3.42Å; Y751-C755 PolarHBondContact O-N 3.46Å; Y751-C755 PolarHBondContact O-SG 3.21Å; Y751-L765 HydrophobicContact CE2-CB 4.47Å; Y751-L765 WeakPolarHBondContact CE2-O 3.47Å; Y751-L765 PolarHBondContact OH-O 3.31Å; Y751-F768 HydrophobicContact CD2-CD1 4.09Å; Y751-F768 HydrophobicContact CD2-CE1 4.28Å; Y751-F768 HydrophobicContact CE2-CD1 4.28Å; Y751-H769 AromaticContact CD1-CE1 3.69Å; Y751-H769 AromaticContact CD1-ND1 3.04Å; Y751-H769 WeakPolarHBondContact CD1-ND1 3.41Å; Y751-H769 HydrophobicContact CE1-CB 3.99Å; Y751-H769 AromaticContact CE1-CE1 3.85Å; Y751-H769 AromaticContact CE1-CG 3.7Å; Y751-H769 AromaticContact CE1-ND1 3.02Å; Y751-H769 WeakPolarHBondContact CE1-ND1 3.34Å; Y751-H769 HydrophobicContact CE2-CB 3.92Å; Y751-H769 AromaticContact CG-ND1 3.6Å; Y751-H769 AromaticContact CZ-CG 3.86Å; Y751-H769 AromaticContact CZ-ND1 3.57Å
752	D	82.3	Confident	82.1	Confident	6 Å²	6	31 Å²	31	3%	0.032	16%	0.16	C	C	.	.	H	α-helix	trans	-65.1	-41.8	173.1	-178.6	58.4	0	0	0	112.1	R690 L748 Q749 Y754 C755 S756 S815 C817 F820	R690-D752 IonicContact NH1-OD1 3.98Å; R690-D752 PolarHBondContact NH1-OD1 2.94Å; R690-D752 IonicContact NH1-OD2 3.32Å; L748-D752 PolarHBondContact O-N 2.92Å; Q749-D752 PolarHBondContact O-N 2.94Å; D752-Y754 VanDerWaalsContact C-N 3.25Å; D752-Y754 PolarHBondContact O-N 2.94Å; D752-C755 PolarHBondContact O-N 2.95Å; D752-S756 VanDerWaalsContact O-CB 3.3Å; D752-S756 WeakPolarHBondContact O-CB 3.45Å; D752-S756 PolarHBondContact O-N 3.41Å; D752-S756 PolarHBondContact O-OG 3.04Å; D752-S815 WeakPolarHBondContact OD2-CB 3.41Å; D752-S815 PolarHBondContact OD2-OG 3.27Å; D752-C817 HydrophobicContact CB-CB 4.42Å; D752-C817 WeakPolarHBondContact OD2-CB 3.35Å; D752-F820 HydrophobicContact CB-CD2 4.39Å; D752-F820 HydrophobicContact CB-CE2 4Å
753	A	82.5	Confident	81.2	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.008	17%	0.172	C	C	.	.	H	α-helix	trans	-62	-35.5	175	0	0	0	0	0	111.5	F717 Q749 V757 M811	F717-A753 HydrophobicContact CD1-CB 4.45Å; F717-A753 HydrophobicContact CD2-CB 3.78Å; F717-A753 HydrophobicContact CE1-CB 4.39Å; F717-A753 HydrophobicContact CE2-CB 3.68Å; F717-A753 HydrophobicContact CG-CB 4.16Å; F717-A753 HydrophobicContact CZ-CB 3.99Å; Q749-A753 WeakPolarHBondContact O-CB 3.35Å; Q749-A753 PolarHBondContact O-N 3.42Å; A753-V757 VanDerWaalsContact O-CG2 3.29Å; A753-V757 WeakPolarHBondContact O-CG2 3.28Å; A753-M811 HydrophobicContact CB-CB 4.06Å; A753-M811 HydrophobicContact CB-CG 4.02Å; A753-M811 HydrophobicContact CB-SD 4.36Å
754	Y	84.4	Confident	80.4	Confident	18 Å²	18	38.2 Å²	38.2	7%	0.071	20%	0.199	C	C	.	.	H	α-helix	trans	-63.7	-50.9	169.5	174.8	-85.5	0	0	0	111.9	L714 L718 C750 Y751 D752 S756 V757 S758 L765	L714-Y754 HydrophobicContact CB-CD2 4.27Å; L714-Y754 HydrophobicContact CB-CE2 4.03Å; L714-Y754 HydrophobicContact CD2-CD2 3.68Å; L714-Y754 HydrophobicContact CD2-CE2 3.69Å; L714-Y754 HydrophobicContact CD2-CG 4.27Å; L714-Y754 WeakPolarHBondContact CD2-O 3.41Å; L714-Y754 HydrophobicContact CG-CE2 4.45Å; L714-Y754 WeakPolarHBondContact O-CD2 3.43Å; L718-Y754 HydrophobicContact CB-CD2 3.98Å; L718-Y754 HydrophobicContact CB-CE2 4.26Å; C750-Y754 PolarHBondContact O-N 3.43Å; Y751-Y754 WeakPolarHBondContact O-CB 3.49Å; Y751-Y754 PolarHBondContact O-N 2.92Å; D752-Y754 VanDerWaalsContact C-N 3.25Å; D752-Y754 PolarHBondContact O-N 2.94Å; Y754-S756 VanDerWaalsContact C-N 3.31Å; Y754-S756 PolarHBondContact O-N 3.17Å; Y754-V757 PolarHBondContact O-N 2.93Å; Y754-V757 VanDerWaalsContact O-N 3.09Å; Y754-S758 WeakPolarHBondContact O-CB 3.48Å; Y754-S758 PolarHBondContact O-N 2.86Å; Y754-L765 HydrophobicContact CE1-CD1 3.62Å; Y754-L765 WeakPolarHBondContact OH-CD1 3.36Å
755	C	79.4	Confident	79.7	Confident	29 Å²	29	39.1 Å²	39.1	20%	0.196	20%	0.203	C	C	.	.	H	α-helix	trans	-65.2	-33.9	-178.1	-66.8	0	0	0	0	113	Y751 D752 V757	Y751-C755 WeakPolarHBondContact CE1-SG 3.42Å; Y751-C755 PolarHBondContact O-N 3.46Å; Y751-C755 PolarHBondContact O-SG 3.21Å; D752-C755 PolarHBondContact O-N 2.95Å; C755-V757 PolarHBondContact O-N 2.91Å
756	S	76.4	Confident	79.2	Confident	33 Å²	33	38.4 Å²	38.4	23%	0.231	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-14	175.7	-62.7	0	0	0	0	113.6	R690 D752 Y754	R690-S756 PolarHBondContact NH1-OG 3.36Å; R690-S756 VanDerWaalsContact NH1-OG 3.09Å; R690-S756 PolarHBondContact NH2-OG 3.45Å; D752-S756 VanDerWaalsContact O-CB 3.3Å; D752-S756 WeakPolarHBondContact O-CB 3.45Å; D752-S756 PolarHBondContact O-N 3.41Å; D752-S756 PolarHBondContact O-OG 3.04Å; Y754-S756 VanDerWaalsContact C-N 3.31Å; Y754-S756 PolarHBondContact O-N 3.17Å
757	V	74.4	Confident	78.8	Confident	8 Å²	8	40.8 Å²	40.8	5%	0.048	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.9	-20.4	179.3	178	0	0	0	0	111.9	T699 H710 L714 F717 A753 Y754 C755 E814	T699-V757 HydrophobicContact CG2-CG1 4.16Å; T699-V757 HydrophobicContact CG2-CG2 4.32Å; H710-V757 VanDerWaalsContact CD2-CG1 3.42Å; H710-V757 WeakPolarHBondContact CD2-CG1 3.45Å; H710-V757 WeakPolarHBondContact NE2-CG1 3.48Å; H710-V757 PolarHBondContact NE2-O 3.07Å; L714-V757 HydrophobicContact CD1-CG1 4.42Å; L714-V757 HydrophobicContact CD2-CB 3.79Å; L714-V757 HydrophobicContact CD2-CG1 3.71Å; L714-V757 HydrophobicContact CG-CB 4.43Å; L714-V757 HydrophobicContact CG-CG1 3.79Å; F717-V757 HydrophobicContact CE2-CG2 4.32Å; A753-V757 VanDerWaalsContact O-CG2 3.29Å; A753-V757 WeakPolarHBondContact O-CG2 3.28Å; Y754-V757 PolarHBondContact O-N 2.93Å; Y754-V757 VanDerWaalsContact O-N 3.09Å; C755-V757 PolarHBondContact O-N 2.91Å; V757-E814 HydrophobicContact CG2-CB 4.17Å; V757-E814 HydrophobicContact CG2-CG 4.21Å
758	S	75.8	Confident	78.6	Confident	25 Å²	25	41.5 Å²	41.5	18%	0.175	22%	0.216	C	C	.	.			trans	-89.8	133.7	-179	-166.8	0	0	0	0	112.2	Y754 T760	Y754-S758 WeakPolarHBondContact O-CB 3.48Å; Y754-S758 PolarHBondContact O-N 2.86Å; S758-T760 PolarHBondContact OG-N 3.14Å; S758-T760 PolarHBondContact OG-O 3.19Å
759	E	65.2	Low	78.5	Confident	156 Å²	156	41.8 Å²	41.8	73%	0.729	22%	0.217	S	C	*	.	S	Bend	trans	-84.5	-12.5	173.3	-63.4	176.9	-179.6	0	0	112.5	P705	P705-E759 WeakPolarHBondContact CB-OE1 3.48Å
760	T	63	Low	78.5	Confident	88 Å²	88	40.6 Å²	40.6	54%	0.54	21%	0.212	S	C	.	.			trans	-139.7	129	-174.9	56.9	0	0	0	0	112.4	S758	S758-T760 PolarHBondContact OG-N 3.14Å; S758-T760 PolarHBondContact OG-O 3.19Å
761	L	67.2	Low	78.6	Confident	76 Å²	76	43.7 Å²	43.7	40%	0.398	23%	0.226	S	C	.	.			trans	-92.3	119.3	173.2	-79.2	153.1	0	0	0	110.4	L766	L761-L766 HydrophobicContact CD2-CD2 4.21Å
762	H	70.9	Confident	78.9	Confident	104 Å²	104	43.3 Å²	43.3	48%	0.481	23%	0.225	S	C	.	.			trans	-87.8	148.3	174.9	-68.8	-63.5	0	0	0	111.8	H764 L765 L766	H762-H764 VanDerWaalsContact C-N 3.31Å; H762-H764 PolarHBondContact O-N 3.41Å; H762-L765 HydrophobicContact CB-CD1 3.94Å; H762-L765 HydrophobicContact CB-CG 4.17Å; H762-L765 WeakPolarHBondContact O-CB 3.39Å; H762-L765 PolarHBondContact O-N 2.97Å; H762-L766 PolarHBondContact O-N 3.04Å
763	P	73.5	Confident	79.3	Confident	45 Å²	45	43 Å²	43	29%	0.292	22%	0.223	S	C	.	.	H	α-helix	trans	-54.8	-41	-177.7	-25.9	32.9	0	0	0	114.3	L765 L766 Q767 V852 L853	P763-L765 PolarHBondContact O-N 3.42Å; P763-L766 PolarHBondContact O-N 3.43Å; P763-Q767 PolarHBondContact O-N 3.19Å; P763-V852 HydrophobicContact CB-CG1 4.27Å; P763-V852 HydrophobicContact CG-CG1 3.83Å; P763-L853 HydrophobicContact CB-CD2 3.75Å
764	H	75.5	Confident	79.8	Confident	132 Å²	132	43.3 Å²	43.3	61%	0.611	23%	0.225	S	C	*	.	H	α-helix	trans	-64.1	-23.1	178.4	-71.2	55.3	0	0	0	113.2	H762 F768	H762-H764 VanDerWaalsContact C-N 3.31Å; H762-H764 PolarHBondContact O-N 3.41Å; H764-F768 PolarHBondContact O-N 2.75Å; H764-F768 VanDerWaalsContact O-N 3.13Å
765	L	80.6	Confident	80.3	Confident	18 Å²	18	42.8 Å²	42.8	9%	0.094	22%	0.224	C	C	.	.	H	α-helix	trans	-83.9	-32.1	178.1	-58.2	172.1	0	0	0	111.8	L718 Y751 Y754 H762 P763 H769	L718-L765 HydrophobicContact CD1-CD2 3.67Å; L718-L765 HydrophobicContact CD2-CD2 3.61Å; L718-L765 HydrophobicContact CG-CD2 4.31Å; Y751-L765 HydrophobicContact CE2-CB 4.47Å; Y751-L765 WeakPolarHBondContact CE2-O 3.47Å; Y751-L765 PolarHBondContact OH-O 3.31Å; Y754-L765 HydrophobicContact CE1-CD1 3.62Å; Y754-L765 WeakPolarHBondContact OH-CD1 3.36Å; H762-L765 HydrophobicContact CB-CD1 3.94Å; H762-L765 HydrophobicContact CB-CG 4.17Å; H762-L765 WeakPolarHBondContact O-CB 3.39Å; H762-L765 PolarHBondContact O-N 2.97Å; P763-L765 PolarHBondContact O-N 3.42Å; L765-H769 PolarHBondContact O-N 3.42Å
766	L	79.4	Confident	81	Confident	27 Å²	27	41.4 Å²	41.4	14%	0.141	21%	0.214	C	C	.	.	H	α-helix	trans	-66.5	-41.1	170	-63.2	171.9	0	0	0	110.2	L761 H762 P763 H769 S770 M847 V852 L853	L761-L766 HydrophobicContact CD2-CD2 4.21Å; H762-L766 PolarHBondContact O-N 3.04Å; P763-L766 PolarHBondContact O-N 3.43Å; L766-H769 PolarHBondContact O-N 3.1Å; L766-S770 PolarHBondContact O-N 2.94Å; L766-M847 HydrophobicContact CB-CE 4.35Å; L766-M847 HydrophobicContact CD2-CE 3.56Å; L766-V852 HydrophobicContact CD1-CG1 4.48Å; L766-L853 HydrophobicContact CB-CD1 4Å
767	Q	82.8	Confident	81.8	Confident	54 Å²	54	39.9 Å²	39.9	25%	0.252	20%	0.203	S	C	.	.	H	α-helix	trans	-59.3	-48.4	173.2	-171.2	-178.6	27	0	0	112.1	P763 H769 S770 Q771 Q860	P763-Q767 PolarHBondContact O-N 3.19Å; Q767-H769 VanDerWaalsContact C-N 3.33Å; Q767-H769 PolarHBondContact O-N 3.08Å; Q767-S770 WeakPolarHBondContact O-CB 3.37Å; Q767-S770 PolarHBondContact O-N 3.02Å; Q767-Q771 WeakPolarHBondContact O-CG 3.43Å; Q767-Q771 PolarHBondContact O-N 3.4Å; Q767-Q771 VanDerWaalsContact O-N 3.08Å; Q767-Q860 VanDerWaalsContact CG-OE1 3.31Å
768	F	87.1	Confident	82.8	Confident	15 Å²	15	41.1 Å²	41.1	7%	0.066	21%	0.21	C	C	.	.	H	α-helix	trans	-62.2	-38.2	175.7	175.5	-112.4	0	0	0	112.4	L718 S721 K722 Y725 Y751 H764 S770 Q771 C772	L718-F768 HydrophobicContact CD1-CD1 4.38Å; L718-F768 HydrophobicContact CD1-CE1 4.48Å; S721-F768 WeakPolarHBondContact OG-CE1 3.32Å; K722-F768 HydrophobicContact CB-CZ 4.37Å; K722-F768 HydrophobicContact CG-CD2 4.46Å; K722-F768 HydrophobicContact CG-CE1 4.19Å; K722-F768 HydrophobicContact CG-CE2 3.88Å; K722-F768 HydrophobicContact CG-CZ 3.73Å; Y725-F768 HydrophobicContact CD1-CE2 4.28Å; Y725-F768 HydrophobicContact CD2-CE2 4.34Å; Y725-F768 AromaticContact CG-CE2 3.95Å; Y725-F768 HydrophobicContact CG-CE2 3.95Å; Y725-F768 HydrophobicContact CG-CZ 4.43Å; Y751-F768 HydrophobicContact CD2-CD1 4.09Å; Y751-F768 HydrophobicContact CD2-CE1 4.28Å; Y751-F768 HydrophobicContact CE2-CD1 4.28Å; H764-F768 PolarHBondContact O-N 2.75Å; H764-F768 VanDerWaalsContact O-N 3.13Å; F768-S770 PolarHBondContact O-N 2.97Å; F768-Q771 WeakPolarHBondContact O-CB 3.39Å; F768-Q771 PolarHBondContact O-N 2.92Å; F768-Q771 VanDerWaalsContact O-N 3.15Å; F768-C772 VanDerWaalsContact CZ-SG 3.51Å; F768-C772 PolarHBondContact O-N 3.23Å; F768-C772 PolarHBondContact O-SG 3.41Å
769	H	86.3	Confident	83.7	Confident	6 Å²	6	40 Å²	40	3%	0.028	20%	0.202	C	C	.	.	H	α-helix	trans	-63.1	-42.9	174.2	-165.3	85.2	0	0	0	112.5	Y751 L765 L766 Q767 Q771 C772 L773 F820 M847	Y751-H769 AromaticContact CD1-CE1 3.69Å; Y751-H769 AromaticContact CD1-ND1 3.04Å; Y751-H769 WeakPolarHBondContact CD1-ND1 3.41Å; Y751-H769 HydrophobicContact CE1-CB 3.99Å; Y751-H769 AromaticContact CE1-CE1 3.85Å; Y751-H769 AromaticContact CE1-CG 3.7Å; Y751-H769 AromaticContact CE1-ND1 3.02Å; Y751-H769 WeakPolarHBondContact CE1-ND1 3.34Å; Y751-H769 HydrophobicContact CE2-CB 3.92Å; Y751-H769 AromaticContact CG-ND1 3.6Å; Y751-H769 AromaticContact CZ-CG 3.86Å; Y751-H769 AromaticContact CZ-ND1 3.57Å; L765-H769 PolarHBondContact O-N 3.42Å; L766-H769 PolarHBondContact O-N 3.1Å; Q767-H769 VanDerWaalsContact C-N 3.33Å; Q767-H769 PolarHBondContact O-N 3.08Å; H769-Q771 PolarHBondContact O-N 2.94Å; H769-C772 WeakPolarHBondContact O-CB 3.35Å; H769-C772 PolarHBondContact O-N 3.07Å; H769-C772 VanDerWaalsContact O-N 3.13Å; H769-L773 VanDerWaalsContact CD2-CD1 3.43Å; H769-L773 WeakPolarHBondContact CD2-CD1 3.47Å; H769-L773 PolarHBondContact O-N 3.01Å; H769-F820 AromaticContact CE1-CE1 3.5Å; H769-F820 VanDerWaalsContact CE1-CE1 3.5Å; H769-F820 WeakPolarHBondContact CE1-CE1 3.28Å; H769-F820 AromaticContact CE1-CZ 3.55Å; H769-F820 AromaticContact NE2-CE1 3.65Å; H769-M847 HydrophobicContact CB-CE 3.94Å; H769-M847 HydrophobicContact CB-SD 4.5Å; H769-M847 PolarHBondContact CD2-SD 3.3Å
770	S	88.3	Confident	85.1	Confident	3 Å²	3	32.6 Å²	32.6	2%	0.021	17%	0.167	C	C	.	.	H	α-helix	trans	-59.4	-32.5	173.7	-178.8	0	0	0	0	112.4	L766 Q767 F768 S774 A844 L848	L766-S770 PolarHBondContact O-N 2.94Å; Q767-S770 WeakPolarHBondContact O-CB 3.37Å; Q767-S770 PolarHBondContact O-N 3.02Å; F768-S770 PolarHBondContact O-N 2.97Å; S770-S774 WeakPolarHBondContact O-CB 3.32Å; S770-S774 PolarHBondContact O-N 3.47Å; S770-S774 PolarHBondContact O-OG 3.32Å; S770-A844 PolarHBondContact OG-O 3.25Å; S770-L848 WeakPolarHBondContact OG-CD1 3.47Å; S770-L848 WeakPolarHBondContact OG-CG 3.36Å
771	Q	90.6	Very high	86.5	Confident	65 Å²	65	29.5 Å²	29.5	30%	0.304	15%	0.147	S	C	.	.	H	α-helix	trans	-69.8	-46	173.3	-68	169.2	-18	0	0	111.1	Y725 Q767 F768 H769 L773 S774 L775	Y725-Q771 HydrophobicContact CE2-CB 4.12Å; Q767-Q771 WeakPolarHBondContact O-CG 3.43Å; Q767-Q771 PolarHBondContact O-N 3.4Å; Q767-Q771 VanDerWaalsContact O-N 3.08Å; F768-Q771 WeakPolarHBondContact O-CB 3.39Å; F768-Q771 PolarHBondContact O-N 2.92Å; F768-Q771 VanDerWaalsContact O-N 3.15Å; H769-Q771 PolarHBondContact O-N 2.94Å; Q771-L773 PolarHBondContact O-N 2.84Å; Q771-S774 PolarHBondContact O-N 2.83Å; Q771-L775 PolarHBondContact O-N 3.3Å
772	C	91.8	Very high	87.7	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-58.4	-44.5	175.2	-68.1	0	0	0	0	112.6	Y725 I744 L748 F768 H769 C776	Y725-C772 HydrophobicContact CD2-CB 4.48Å; I744-C772 HydrophobicContact CD1-CB 4.06Å; L748-C772 HydrophobicContact CD2-CB 3.76Å; L748-C772 HydrophobicContact CG-CB 4.41Å; F768-C772 VanDerWaalsContact CZ-SG 3.51Å; F768-C772 PolarHBondContact O-N 3.23Å; F768-C772 PolarHBondContact O-SG 3.41Å; H769-C772 WeakPolarHBondContact O-CB 3.35Å; H769-C772 PolarHBondContact O-N 3.07Å; H769-C772 VanDerWaalsContact O-N 3.13Å; C772-C776 VanDerWaalsContact O-CB 3.28Å; C772-C776 WeakPolarHBondContact O-CB 3.3Å; C772-C776 PolarHBondContact O-N 3.18Å
773	L	91.4	Very high	88.7	Confident	1 Å²	1	23.8 Å²	23.8	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-64.5	-42.4	175.3	-69.5	177.6	0	0	0	111.8	L748 H769 Q771 C776 G777 C840 A843 A844 M847	L748-L773 HydrophobicContact CD2-CD2 4.43Å; H769-L773 VanDerWaalsContact CD2-CD1 3.43Å; H769-L773 WeakPolarHBondContact CD2-CD1 3.47Å; H769-L773 PolarHBondContact O-N 3.01Å; Q771-L773 PolarHBondContact O-N 2.84Å; L773-C776 WeakPolarHBondContact O-CB 3.34Å; L773-C776 PolarHBondContact O-N 2.92Å; L773-G777 PolarHBondContact O-N 3.47Å; L773-C840 WeakPolarHBondContact O-CB 3.36Å; L773-A843 HydrophobicContact CD1-CB 3.83Å; L773-A844 HydrophobicContact CB-CB 4.14Å; L773-M847 HydrophobicContact CD1-SD 4.08Å
774	S	92.8	Very high	89.6	Confident	6 Å²	6	22.2 Å²	22.2	4%	0.042	11%	0.11	C	C	.	.	H	α-helix	trans	-61.8	-45.6	177.4	-59.9	0	0	0	0	111.9	S770 Q771 C776 G777 D778 Y841	S770-S774 WeakPolarHBondContact O-CB 3.32Å; S770-S774 PolarHBondContact O-N 3.47Å; S770-S774 PolarHBondContact O-OG 3.32Å; Q771-S774 PolarHBondContact O-N 2.83Å; S774-C776 VanDerWaalsContact C-N 3.35Å; S774-C776 PolarHBondContact O-N 3.22Å; S774-G777 PolarHBondContact O-N 3.31Å; S774-D778 PolarHBondContact O-N 2.97Å; S774-Y841 WeakPolarHBondContact O-CE1 3.39Å
775	L	94.1	Very high	90.2	Very high	8 Å²	8	20.8 Å²	20.8	4%	0.042	10%	0.104	C	C	.	.	H	α-helix	trans	-65.1	-38.3	176.4	179.1	59	0	0	0	111.8	Y725 D729 I744 Q771 G777 D778 I779	Y725-L775 HydrophobicContact CD2-CD2 3.77Å; Y725-L775 HydrophobicContact CE2-CB 3.92Å; Y725-L775 HydrophobicContact CE2-CD2 3.53Å; Y725-L775 HydrophobicContact CE2-CG 4.39Å; Y725-L775 HydrophobicContact CG-CD2 4.49Å; D729-L775 HydrophobicContact CB-CD2 4.1Å; I744-L775 HydrophobicContact CD1-CB 4.45Å; I744-L775 HydrophobicContact CD1-CD2 4.1Å; I744-L775 HydrophobicContact CD1-CG 4.41Å; Q771-L775 PolarHBondContact O-N 3.3Å; L775-G777 VanDerWaalsContact C-N 3.31Å; L775-G777 PolarHBondContact O-N 3.15Å; L775-D778 PolarHBondContact O-N 3.28Å; L775-I779 HydrophobicContact CD1-CD1 4.11Å; L775-I779 HydrophobicContact CD1-CG1 4.32Å; L775-I779 HydrophobicContact CG-CD1 3.95Å; L775-I779 WeakPolarHBondContact O-CD1 3.48Å; L775-I779 VanDerWaalsContact O-CG1 3.25Å; L775-I779 WeakPolarHBondContact O-CG1 3.34Å; L775-I779 PolarHBondContact O-N 2.86Å
776	C	94.4	Very high	90.6	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-61.1	-40.7	173	-173.4	0	0	0	0	111.8	I744 C772 L773 S774 Q780 A823	I744-C776 HydrophobicContact CG1-CB 3.9Å; I744-C776 HydrophobicContact CG2-CB 4.19Å; C772-C776 VanDerWaalsContact O-CB 3.28Å; C772-C776 WeakPolarHBondContact O-CB 3.3Å; C772-C776 PolarHBondContact O-N 3.18Å; L773-C776 WeakPolarHBondContact O-CB 3.34Å; L773-C776 PolarHBondContact O-N 2.92Å; S774-C776 VanDerWaalsContact C-N 3.35Å; S774-C776 PolarHBondContact O-N 3.22Å; C776-Q780 WeakPolarHBondContact O-CG 3.26Å; C776-Q780 PolarHBondContact O-N 3.42Å; C776-A823 PolarHBondContact SG-O 2.86Å
777	G	93.8	Very high	90.7	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-63.7	-43.8	172.5	0	0	0	0	0	113.2	L773 S774 L775 I779 Q780 L781 S837 Y841	L773-G777 PolarHBondContact O-N 3.47Å; S774-G777 PolarHBondContact O-N 3.31Å; L775-G777 VanDerWaalsContact C-N 3.31Å; L775-G777 PolarHBondContact O-N 3.15Å; G777-I779 PolarHBondContact O-N 2.58Å; G777-Q780 PolarHBondContact O-N 3.07Å; G777-L781 PolarHBondContact O-N 3.38Å; G777-S837 WeakPolarHBondContact O-CB 3.49Å; G777-S837 PolarHBondContact O-OG 3.33Å; G777-Y841 PolarHBondContact O-OH 2.71Å
778	D	94.4	Very high	90.8	Very high	35 Å²	35	24.5 Å²	24.5	19%	0.187	14%	0.137	C	C	.	.	H	α-helix	trans	-60.1	-46.5	177.3	-68	-41.8	0	0	0	109.7	S774 L775 L781 M782 Y841 R867	S774-D778 PolarHBondContact O-N 2.97Å; L775-D778 PolarHBondContact O-N 3.28Å; D778-L781 PolarHBondContact O-N 3.49Å; D778-M782 WeakPolarHBondContact O-CG 3.41Å; D778-M782 PolarHBondContact O-N 3.37Å; D778-Y841 VanDerWaalsContact CA-OH 3.26Å; D778-Y841 WeakPolarHBondContact CA-OH 3.46Å; D778-Y841 PolarHBondContact N-OH 2.66Å; D778-Y841 PolarHBondContact OD1-OH 2.96Å; D778-R867 IonicContact OD1-CZ 3.03Å; D778-R867 IonicContact OD1-NE 2.97Å; D778-R867 PolarHBondContact OD1-NE 3.4Å; D778-R867 IonicContact OD1-NH2 3.6Å; D778-R867 IonicContact OD2-CZ 2.7Å; D778-R867 IonicContact OD2-NE 2.95Å; D778-R867 PolarHBondContact OD2-NE 2.91Å; D778-R867 IonicContact OD2-NH2 3.9Å; D778-R867 PolarHBondContact OD2-NH2 3.4Å
779	I	94.6	Very high	90.7	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.9	-45.6	179.2	-66.8	159.6	0	0	0	112.1	S728 T732 A740 L741 I744 L775 G777 L781 M782 L783	S728-I779 VanDerWaalsContact OG-CD1 3.25Å; S728-I779 WeakPolarHBondContact OG-CD1 3.21Å; T732-I779 HydrophobicContact CG2-CG1 4.28Å; T732-I779 WeakPolarHBondContact OG1-CG1 3.41Å; A740-I779 HydrophobicContact CB-CD1 3.77Å; A740-I779 HydrophobicContact CB-CG1 4.03Å; A740-I779 HydrophobicContact CB-CG2 4.41Å; L741-I779 HydrophobicContact CB-CG2 3.89Å; L741-I779 HydrophobicContact CD1-CG2 4.1Å; I744-I779 HydrophobicContact CB-CD1 4.25Å; I744-I779 HydrophobicContact CG2-CD1 4.02Å; L775-I779 HydrophobicContact CD1-CD1 4.11Å; L775-I779 HydrophobicContact CD1-CG1 4.32Å; L775-I779 HydrophobicContact CG-CD1 3.95Å; L775-I779 WeakPolarHBondContact O-CD1 3.48Å; L775-I779 VanDerWaalsContact O-CG1 3.25Å; L775-I779 WeakPolarHBondContact O-CG1 3.34Å; L775-I779 PolarHBondContact O-N 2.86Å; G777-I779 PolarHBondContact O-N 2.58Å; I779-L781 VanDerWaalsContact C-N 3.31Å; I779-L781 PolarHBondContact O-N 3.29Å; I779-M782 PolarHBondContact O-N 2.61Å; I779-L783 HydrophobicContact CG2-CD1 3.97Å; I779-L783 HydrophobicContact CG2-CG 4.46Å; I779-L783 WeakPolarHBondContact O-CG 3.41Å; I779-L783 PolarHBondContact O-N 3.34Å
780	Q	94.1	Very high	90.5	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-65.6	-33.8	179.6	-71.1	-76.6	17.1	0	0	112.3	L741 C776 G777 A784 A823 D825 V836	L741-Q780 HydrophobicContact CD1-CG 4.34Å; C776-Q780 WeakPolarHBondContact O-CG 3.26Å; C776-Q780 PolarHBondContact O-N 3.42Å; G777-Q780 PolarHBondContact O-N 3.07Å; Q780-A784 PolarHBondContact O-N 3.05Å; Q780-A784 VanDerWaalsContact O-N 3.14Å; Q780-A823 PolarHBondContact NE2-O 3.02Å; Q780-D825 PolarHBondContact NE2-O 3.41Å; Q780-V836 HydrophobicContact CG-CG1 4.05Å
781	L	93.6	Very high	90.4	Very high	24 Å²	24	35.6 Å²	35.6	13%	0.126	20%	0.202	C	C	.	.	H	α-helix	trans	-64.6	-47.9	171.3	169.8	58.3	0	0	0	111.4	G777 D778 I779 L783 A784 Q785 L834 I871 E874	G777-L781 PolarHBondContact O-N 3.38Å; D778-L781 PolarHBondContact O-N 3.49Å; I779-L781 VanDerWaalsContact C-N 3.31Å; I779-L781 PolarHBondContact O-N 3.29Å; L781-L783 VanDerWaalsContact C-N 3.3Å; L781-L783 PolarHBondContact O-N 2.9Å; L781-A784 PolarHBondContact O-N 2.62Å; L781-Q785 HydrophobicContact CD1-CG 4.17Å; L781-Q785 PolarHBondContact O-N 3.39Å; L781-L834 HydrophobicContact CD1-CD2 3.66Å; L781-I871 HydrophobicContact CD1-CD1 3.9Å; L781-E874 HydrophobicContact CD1-CG 4.35Å
782	M	93	Very high	90.3	Very high	55 Å²	55	34.9 Å²	34.9	27%	0.271	21%	0.207	S	C	.	.	H	α-helix	trans	-63.7	-35.6	179.2	-64.1	-47.4	-64.8	0	0	112.5	Y737 D778 I779 Q785 N786	Y737-M782 HydrophobicContact CD1-CB 3.83Å; Y737-M782 HydrophobicContact CD1-CG 4.43Å; Y737-M782 HydrophobicContact CD2-CB 4.07Å; Y737-M782 HydrophobicContact CE1-CB 3.58Å; Y737-M782 HydrophobicContact CE1-CG 3.82Å; Y737-M782 HydrophobicContact CE2-CB 3.84Å; Y737-M782 HydrophobicContact CG-CB 4.08Å; Y737-M782 VanDerWaalsContact OH-CE 3.26Å; Y737-M782 WeakPolarHBondContact OH-CE 3.44Å; D778-M782 WeakPolarHBondContact O-CG 3.41Å; D778-M782 PolarHBondContact O-N 3.37Å; I779-M782 PolarHBondContact O-N 2.61Å; M782-Q785 PolarHBondContact O-N 3.34Å; M782-N786 WeakPolarHBondContact O-CB 3.42Å; M782-N786 PolarHBondContact O-N 3.1Å; M782-N786 PolarHBondContact O-ND2 3.08Å
783	L	91.6	Very high	90.2	Very high	4 Å²	4	35.7 Å²	35.7	2%	0.021	21%	0.21	C	C	.	.	H	α-helix	trans	-64.1	-40.1	173.7	-75.2	166.9	0	0	0	112.6	L741 I779 L781 N786 Y793 L826	L741-L783 HydrophobicContact CB-CD1 4.39Å; L741-L783 HydrophobicContact CD2-CD1 3.84Å; I779-L783 HydrophobicContact CG2-CD1 3.97Å; I779-L783 HydrophobicContact CG2-CG 4.46Å; I779-L783 WeakPolarHBondContact O-CG 3.41Å; I779-L783 PolarHBondContact O-N 3.34Å; L781-L783 VanDerWaalsContact C-N 3.3Å; L781-L783 PolarHBondContact O-N 2.9Å; L783-N786 PolarHBondContact O-N 3.1Å; L783-Y793 HydrophobicContact CD2-CD2 3.54Å; L783-Y793 HydrophobicContact CD2-CE2 4.08Å; L783-Y793 HydrophobicContact CD2-CG 3.83Å; L783-L826 HydrophobicContact CD1-CD1 3.89Å; L783-L826 HydrophobicContact CD2-CD1 4.11Å
784	A	91	Very high	90.1	Very high	12 Å²	12	39 Å²	39	10%	0.099	23%	0.228	C	C	.	.	H	α-helix	trans	-67	-37.3	177	0	0	0	0	0	112.5	Q780 L781 P830 Q833 L834	Q780-A784 PolarHBondContact O-N 3.05Å; Q780-A784 VanDerWaalsContact O-N 3.14Å; L781-A784 PolarHBondContact O-N 2.62Å; A784-P830 HydrophobicContact CB-CB 4.49Å; A784-Q833 HydrophobicContact CB-CB 3.85Å; A784-L834 HydrophobicContact CB-CD2 3.64Å; A784-L834 HydrophobicContact CB-CG 3.7Å
785	Q	89.4	Confident	90	Very high	102 Å²	102	45.6 Å²	45.6	48%	0.477	26%	0.258	S	S	.	.	H	α-helix	trans	-71.3	-36.8	176.2	-70.9	-179.7	-23.5	0	0	112.4	L781 M782 A787	L781-Q785 HydrophobicContact CD1-CG 4.17Å; L781-Q785 PolarHBondContact O-N 3.39Å; M782-Q785 PolarHBondContact O-N 3.34Å; Q785-A787 PolarHBondContact O-N 2.56Å
786	N	87.6	Confident	89.8	Confident	50 Å²	50	47.2 Å²	47.2	27%	0.267	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	45.8	-175.9	-65.7	-89.2	0	0	0	112.5	Y737 M782 L783 S788 N789 Y793	Y737-N786 HydrophobicContact CE2-CB 4.46Å; M782-N786 WeakPolarHBondContact O-CB 3.42Å; M782-N786 PolarHBondContact O-N 3.1Å; M782-N786 PolarHBondContact O-ND2 3.08Å; L783-N786 PolarHBondContact O-N 3.1Å; N786-S788 PolarHBondContact O-N 2.83Å; N786-N789 PolarHBondContact O-N 3.44Å; N786-Y793 HydrophobicContact CB-CE2 4.16Å
787	A	83.4	Confident	89.6	Confident	27 Å²	27	49.4 Å²	49.4	22%	0.223	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-7.5	-174.2	0	0	0	0	0	115.5	Q785 R790	Q785-A787 PolarHBondContact O-N 2.56Å; A787-R790 WeakPolarHBondContact O-CD 3.28Å; A787-R790 VanDerWaalsContact O-CG 3.3Å; A787-R790 WeakPolarHBondContact O-CG 3.33Å; A787-R790 PolarHBondContact O-NE 3.19Å; A787-R790 PolarHBondContact O-NH1 3.4Å
788	S	83.8	Confident	89.3	Confident	100 Å²	100	53.6 Å²	53.6	70%	0.699	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-42.5	173.5	46.9	0	0	0	0	112.7	N786 R790	N786-S788 PolarHBondContact O-N 2.83Å; S788-R790 PolarHBondContact O-N 3.46Å; S788-R790 VanDerWaalsContact O-N 3.12Å
789	N	85.1	Confident	88.9	Confident	86 Å²	86	58.9 Å²	58.9	46%	0.46	32%	0.321	S	S	.	.			trans	-85.3	20.6	-170.7	-71	-25.9	0	0	0	114.7	N786 A791 A792 Y793	N786-N789 PolarHBondContact O-N 3.44Å; N789-A791 VanDerWaalsContact C-N 3.32Å; N789-A791 PolarHBondContact O-N 3.06Å; N789-A792 PolarHBondContact O-N 3.37Å; N789-Y793 HydrophobicContact CB-CD2 4.28Å; N789-Y793 HydrophobicContact CB-CE1 4.34Å; N789-Y793 HydrophobicContact CB-CE2 3.59Å; N789-Y793 WeakPolarHBondContact O-CD2 3.24Å; N789-Y793 PolarHBondContact O-N 3.19Å
790	R	82.5	Confident	88.3	Confident	91 Å²	91	62.4 Å²	62.4	34%	0.343	34%	0.338	S	S	.	.	H	α-helix	trans	-53	-40.2	-172.2	-78.1	166.9	170.2	139.1	-15.4	114.7	A787 S788 Y793 L794 M828	A787-R790 WeakPolarHBondContact O-CD 3.28Å; A787-R790 VanDerWaalsContact O-CG 3.3Å; A787-R790 WeakPolarHBondContact O-CG 3.33Å; A787-R790 PolarHBondContact O-NE 3.19Å; A787-R790 PolarHBondContact O-NH1 3.4Å; S788-R790 PolarHBondContact O-N 3.46Å; S788-R790 VanDerWaalsContact O-N 3.12Å; R790-Y793 PolarHBondContact O-N 3.36Å; R790-L794 WeakPolarHBondContact O-CG 3.39Å; R790-L794 PolarHBondContact O-N 3.35Å; R790-M828 HydrophobicContact CB-CE 4.42Å; R790-M828 HydrophobicContact CG-CE 4.49Å; R790-M828 PolarHBondContact NE-O 2.75Å; R790-M828 PolarHBondContact NH2-O 3.5Å
791	A	86.1	Confident	87.8	Confident	80 Å²	80	64.2 Å²	64.2	66%	0.661	35%	0.349	S	S	*	.	H	α-helix	trans	-63.7	-44.8	-177	0	0	0	0	0	112	N789 L794 E795	N789-A791 VanDerWaalsContact C-N 3.32Å; N789-A791 PolarHBondContact O-N 3.06Å; A791-L794 PolarHBondContact O-N 3.14Å; A791-E795 PolarHBondContact O-N 3.33Å; A791-E795 VanDerWaalsContact O-N 3.12Å
792	A	88	Confident	87.2	Confident	51 Å²	51	70.6 Å²	70.6	42%	0.421	38%	0.376	S	S	.	.	H	α-helix	trans	-62.7	-44	175.7	0	0	0	0	0	111.3	N789 L794 E795 E796	N789-A792 PolarHBondContact O-N 3.37Å; A792-L794 VanDerWaalsContact C-N 3.33Å; A792-L794 PolarHBondContact O-N 2.66Å; A792-E795 PolarHBondContact O-N 2.99Å; A792-E796 WeakPolarHBondContact O-CG 3.5Å; A792-E796 PolarHBondContact O-N 2.95Å
793	Y	90.3	Very high	86.5	Confident	16 Å²	16	72.5 Å²	72.5	6%	0.063	38%	0.384	C	S	.	.	H	α-helix	trans	-64.7	-34.6	178.2	-57.3	-35.3	0	0	0	113.1	Y737 G738 L783 N786 N789 R790 Y797	Y737-Y793 HydrophobicContact CD2-CE1 4Å; Y737-Y793 HydrophobicContact CD2-CE2 4.26Å; Y737-Y793 AromaticContact CD2-CZ 3.65Å; Y737-Y793 WeakPolarHBondContact CD2-OH 3.31Å; G738-Y793 WeakPolarHBondContact CA-O 3.46Å; L783-Y793 HydrophobicContact CD2-CD2 3.54Å; L783-Y793 HydrophobicContact CD2-CE2 4.08Å; L783-Y793 HydrophobicContact CD2-CG 3.83Å; N786-Y793 HydrophobicContact CB-CE2 4.16Å; N789-Y793 HydrophobicContact CB-CD2 4.28Å; N789-Y793 HydrophobicContact CB-CE1 4.34Å; N789-Y793 HydrophobicContact CB-CE2 3.59Å; N789-Y793 WeakPolarHBondContact O-CD2 3.24Å; N789-Y793 PolarHBondContact O-N 3.19Å; R790-Y793 PolarHBondContact O-N 3.36Å; Y793-Y797 WeakPolarHBondContact O-CB 3.29Å; Y793-Y797 PolarHBondContact O-N 3.29Å
794	L	88.9	Confident	86	Confident	71 Å²	71	72.5 Å²	72.5	37%	0.372	38%	0.384	S	S	.	.	H	α-helix	trans	-64	-44.8	173	-79.3	161.6	0	0	0	111.7	R790 A791 A792 Y797 S798 L826 M828	R790-L794 WeakPolarHBondContact O-CG 3.39Å; R790-L794 PolarHBondContact O-N 3.35Å; A791-L794 PolarHBondContact O-N 3.14Å; A792-L794 VanDerWaalsContact C-N 3.33Å; A792-L794 PolarHBondContact O-N 2.66Å; L794-Y797 PolarHBondContact O-N 3.46Å; L794-S798 VanDerWaalsContact O-CB 3.3Å; L794-S798 WeakPolarHBondContact O-CB 3.38Å; L794-S798 PolarHBondContact O-N 2.93Å; L794-S798 PolarHBondContact O-OG 2.73Å; L794-L826 HydrophobicContact CB-CD2 4.45Å; L794-L826 HydrophobicContact CD2-CD2 3.74Å; L794-L826 HydrophobicContact CD2-CG 4.27Å; L794-L826 HydrophobicContact CG-CD2 3.95Å; L794-M828 HydrophobicContact CD1-CE 4.19Å; L794-M828 HydrophobicContact CD1-SD 4.03Å; L794-M828 HydrophobicContact CD2-SD 4.46Å
795	E	89.4	Confident	85.7	Confident	145 Å²	145	76.8 Å²	76.8	68%	0.678	40%	0.402	S	S	*	.	H	α-helix	trans	-61.8	-52.3	176	-173.4	176.3	-175.7	0	0	111.1	A791 A792 Y797 S798 Y799	A791-E795 PolarHBondContact O-N 3.33Å; A791-E795 VanDerWaalsContact O-N 3.12Å; A792-E795 PolarHBondContact O-N 2.99Å; E795-Y797 VanDerWaalsContact C-N 3.26Å; E795-Y797 PolarHBondContact O-N 3.36Å; E795-S798 PolarHBondContact O-N 3.49Å; E795-S798 VanDerWaalsContact O-N 3.09Å; E795-S798 PolarHBondContact O-OG 3.13Å; E795-Y799 PolarHBondContact O-N 3Å
796	E	90.4	Very high	85.3	Confident	42 Å²	42	77.6 Å²	77.6	20%	0.196	41%	0.406	C	S	.	.	H	α-helix	trans	-57.9	-34.8	178.5	-73.2	-169.8	152.3	0	0	114.1	K736 G738 R739 R742 A792	K736-E796 VanDerWaalsContact C-OE2 3.32Å; K736-E796 VanDerWaalsContact CB-OE1 3.27Å; K736-E796 WeakPolarHBondContact CB-OE1 3.49Å; K736-E796 WeakPolarHBondContact CD-OE1 3.44Å; K736-E796 VanDerWaalsContact CG-OE1 3.27Å; K736-E796 WeakPolarHBondContact CG-OE1 3.34Å; G738-E796 PolarHBondContact N-OE2 3.47Å; R739-E796 HydrophobicContact CB-CB 4.04Å; R739-E796 HydrophobicContact CB-CG 4.35Å; R739-E796 PolarHBondContact N-OE2 3.48Å; R742-E796 PolarHBondContact NE-O 3.33Å; R742-E796 VanDerWaalsContact NE-O 3.17Å; A792-E796 WeakPolarHBondContact O-CG 3.5Å; A792-E796 PolarHBondContact O-N 2.95Å
797	Y	90.1	Very high	85.1	Confident	45 Å²	45	75.5 Å²	75.5	18%	0.176	40%	0.395	C	S	.	.	H	α-helix	trans	-76.8	-34.9	177.4	179.6	-98	0	0	0	112.3	L741 R742 K745 Y793 L794 E795 T824 L826	L741-Y797 HydrophobicContact CB-CD2 4.13Å; L741-Y797 HydrophobicContact CB-CE2 4.38Å; L741-Y797 HydrophobicContact CD2-CD2 3.99Å; L741-Y797 HydrophobicContact CD2-CE2 3.85Å; L741-Y797 HydrophobicContact CG-CD2 4.1Å; L741-Y797 HydrophobicContact CG-CE2 3.88Å; R742-Y797 HydrophobicContact CB-CD2 4.01Å; R742-Y797 WeakPolarHBondContact CD-O 3.41Å; K745-Y797 HydrophobicContact CD-CE2 4.34Å; K745-Y797 WeakPolarHBondContact CD-OH 3.46Å; K745-Y797 PolarHBondContact NZ-OH 2.89Å; Y793-Y797 WeakPolarHBondContact O-CB 3.29Å; Y793-Y797 PolarHBondContact O-N 3.29Å; L794-Y797 PolarHBondContact O-N 3.46Å; E795-Y797 VanDerWaalsContact C-N 3.26Å; E795-Y797 PolarHBondContact O-N 3.36Å; Y797-T824 WeakPolarHBondContact CE2-O 3.39Å; Y797-T824 PolarHBondContact OH-O 3.27Å; Y797-L826 HydrophobicContact CD1-CB 4.12Å; Y797-L826 HydrophobicContact CD1-CD2 4.26Å; Y797-L826 HydrophobicContact CD2-CB 4.46Å; Y797-L826 HydrophobicContact CE1-CB 4.2Å; Y797-L826 HydrophobicContact CG-CB 4.24Å; Y797-L826 HydrophobicContact CG-CD2 4.02Å
798	S	87.4	Confident	84.9	Confident	89 Å²	89	75.1 Å²	75.1	62%	0.622	39%	0.389	S	S	*	.	H	α-helix	trans	-76.2	-27.8	177.8	74.9	0	0	0	0	113.6	L794 E795	L794-S798 VanDerWaalsContact O-CB 3.3Å; L794-S798 WeakPolarHBondContact O-CB 3.38Å; L794-S798 PolarHBondContact O-N 2.93Å; L794-S798 PolarHBondContact O-OG 2.73Å; E795-S798 PolarHBondContact O-N 3.49Å; E795-S798 VanDerWaalsContact O-N 3.09Å; E795-S798 PolarHBondContact O-OG 3.13Å
799	Y	87.1	Confident	84.8	Confident	145 Å²	145	75.6 Å²	75.6	57%	0.569	38%	0.38	S	S	*	.			trans	-59.8	139.3	179.5	-176.1	-101.9	0	0	0	111.4	R742 E795 T801	R742-Y799 WeakPolarHBondContact CD-O 3.46Å; R742-Y799 PolarHBondContact NE-O 3.41Å; R742-Y799 VanDerWaalsContact NE-O 3.14Å; R742-Y799 PolarHBondContact NH1-O 3.1Å; E795-Y799 PolarHBondContact O-N 3Å; Y799-T801 HydrophobicContact CE1-CG2 4.04Å
800	Q	82.1	Confident	84.4	Confident	75 Å²	75	72.1 Å²	72.1	35%	0.35	36%	0.362	S	S	.	.			trans	-148.4	132.8	179.8	-163.4	169.4	61	0	0	111.6	D804 Q805	Q800-D804 HydrophobicContact CG-CB 3.64Å; Q800-Q805 HydrophobicContact CG-CG 3.94Å
801	T	83.4	Confident	84.1	Confident	38 Å²	38	68 Å²	68	23%	0.233	35%	0.347	C	S	.	.			trans	-81.3	162.7	176.3	67.9	0	0	0	0	110.8	Y799 E803 D804 Q805	Y799-T801 HydrophobicContact CE1-CG2 4.04Å; T801-E803 PolarHBondContact O-N 3.38Å; T801-D804 WeakPolarHBondContact CB-OD2 3.27Å; T801-D804 PolarHBondContact N-OD2 3.47Å; T801-D804 PolarHBondContact O-N 3.07Å; T801-D804 PolarHBondContact OG1-N 3.37Å; T801-D804 VanDerWaalsContact OG1-N 3.12Å; T801-D804 PolarHBondContact OG1-OD1 2.93Å; T801-D804 PolarHBondContact OG1-OD2 2.97Å; T801-Q805 PolarHBondContact O-N 3.32Å; T801-Q805 VanDerWaalsContact O-N 3.17Å
802	K	80.1	Confident	83.6	Confident	159 Å²	159	68.5 Å²	68.5	69%	0.691	34%	0.335	S	S	*	.	H	α-helix	trans	-63.8	-37.4	175.8	-67.3	-179.4	178.5	178.6	0	110.6	Q805 E806	K802-Q805 WeakPolarHBondContact O-CB 3.48Å; K802-Q805 PolarHBondContact O-N 2.91Å; K802-E806 PolarHBondContact O-N 3.49Å
803	E	77.9	Confident	82.8	Confident	94 Å²	94	70.9 Å²	70.9	44%	0.439	33%	0.333	S	S	.	.	H	α-helix	trans	-58.7	-47.6	174.4	-66.9	76.2	-174.9	0	0	111.3	L613 T801 Q805 E806 I807	L613-E803 HydrophobicContact CD1-CB 3.62Å; L613-E803 HydrophobicContact CD1-CG 3.8Å; T801-E803 PolarHBondContact O-N 3.38Å; E803-Q805 VanDerWaalsContact C-N 3.31Å; E803-Q805 PolarHBondContact O-N 3.04Å; E803-E806 PolarHBondContact O-N 3.24Å; E803-I807 WeakPolarHBondContact O-CG1 3.39Å; E803-I807 PolarHBondContact O-N 2.88Å
804	D	82.8	Confident	81.8	Confident	5 Å²	5	70.5 Å²	70.5	3%	0.027	33%	0.332	C	S	.	.	H	α-helix	trans	-59.5	-41.6	176.2	-59.7	-42	0	0	0	111.7	Y724 R742 L746 Q800 T801 L808	Y724-D804 VanDerWaalsContact CE1-OD1 3.27Å; Y724-D804 WeakPolarHBondContact CE1-OD1 3.42Å; Y724-D804 PolarHBondContact OH-OD1 3.05Å; R742-D804 IonicContact NH1-OD2 3.97Å; R742-D804 PolarHBondContact NH1-OD2 3.25Å; L746-D804 HydrophobicContact CD1-CB 4.18Å; Q800-D804 HydrophobicContact CG-CB 3.64Å; T801-D804 WeakPolarHBondContact CB-OD2 3.27Å; T801-D804 PolarHBondContact N-OD2 3.47Å; T801-D804 PolarHBondContact O-N 3.07Å; T801-D804 PolarHBondContact OG1-N 3.37Å; T801-D804 VanDerWaalsContact OG1-N 3.12Å; T801-D804 PolarHBondContact OG1-OD1 2.93Å; T801-D804 PolarHBondContact OG1-OD2 2.97Å; D804-L808 WeakPolarHBondContact O-CB 3.47Å; D804-L808 WeakPolarHBondContact O-CG 3.34Å; D804-L808 PolarHBondContact O-N 3.29Å
805	Q	84.1	Confident	80.8	Confident	101 Å²	101	67.6 Å²	67.6	47%	0.472	32%	0.318	S	S	.	.	H	α-helix	trans	-64.4	-43.1	178.3	-72.9	173.9	-4	0	0	112.5	Q800 T801 K802 E803 L808 H809	Q800-Q805 HydrophobicContact CG-CG 3.94Å; T801-Q805 PolarHBondContact O-N 3.32Å; T801-Q805 VanDerWaalsContact O-N 3.17Å; K802-Q805 WeakPolarHBondContact O-CB 3.48Å; K802-Q805 PolarHBondContact O-N 2.91Å; E803-Q805 VanDerWaalsContact C-N 3.31Å; E803-Q805 PolarHBondContact O-N 3.04Å; Q805-L808 PolarHBondContact O-N 3.19Å; Q805-H809 WeakPolarHBondContact O-CB 3.14Å; Q805-H809 PolarHBondContact O-N 2.9Å
806	E	81.1	Confident	79.4	Confident	119 Å²	119	64 Å²	64	56%	0.556	31%	0.309	S	S	*	.	H	α-helix	trans	-68	-39.2	178.4	-73.6	-178	-164.5	0	0	112.2	L613 K802 E803 H809 S810	L613-E806 HydrophobicContact CD2-CB 3.43Å; L613-E806 VanDerWaalsContact CD2-CB 3.43Å; K802-E806 PolarHBondContact O-N 3.49Å; E803-E806 PolarHBondContact O-N 3.24Å; E806-H809 PolarHBondContact O-N 3.4Å; E806-S810 PolarHBondContact O-N 3.28Å
807	I	82.7	Confident	77.8	Confident	7 Å²	7	62.5 Å²	62.5	4%	0.036	30%	0.303	C	S	.	.	H	α-helix	trans	-65	-48.2	174.5	-63.1	179.8	0	0	0	110	L609 L613 Y724 E803 H809 S810 M811	L609-I807 HydrophobicContact CB-CD1 4.12Å; L609-I807 HydrophobicContact CD2-CD1 3.68Å; L609-I807 HydrophobicContact CG-CD1 4.43Å; L613-I807 HydrophobicContact CD1-CD1 4.27Å; L613-I807 HydrophobicContact CD1-CG1 4.06Å; L613-I807 HydrophobicContact CD2-CB 4.49Å; L613-I807 HydrophobicContact CD2-CD1 4.43Å; L613-I807 HydrophobicContact CD2-CG1 3.46Å; L613-I807 VanDerWaalsContact CD2-CG1 3.46Å; L613-I807 HydrophobicContact CG-CD1 4Å; L613-I807 HydrophobicContact CG-CG1 3.57Å; Y724-I807 HydrophobicContact CE2-CD1 4.19Å; Y724-I807 HydrophobicContact CE2-CG2 4.39Å; E803-I807 WeakPolarHBondContact O-CG1 3.39Å; E803-I807 PolarHBondContact O-N 2.88Å; I807-H809 VanDerWaalsContact C-N 3.33Å; I807-H809 PolarHBondContact O-N 3.46Å; I807-S810 WeakPolarHBondContact O-CB 3.14Å; I807-S810 PolarHBondContact O-N 3.2Å; I807-S810 VanDerWaalsContact O-N 3.07Å; I807-M811 HydrophobicContact CG2-CE 4.12Å; I807-M811 HydrophobicContact CG2-CG 4.43Å; I807-M811 HydrophobicContact CG2-SD 4.2Å; I807-M811 WeakPolarHBondContact O-CG 3.45Å; I807-M811 PolarHBondContact O-N 2.93Å
808	L	80.6	Confident	76.4	Confident	18 Å²	18	67.9 Å²	67.9	9%	0.094	33%	0.33	C	S	.	.	H	α-helix	trans	-54.2	-46.8	174.8	-85	166.7	0	0	0	112.7	L746 D804 Q805 S810 M811 H812	L746-L808 HydrophobicContact CD2-CD1 3.73Å; L746-L808 HydrophobicContact CD2-CD2 3.82Å; L746-L808 HydrophobicContact CD2-CG 3.66Å; D804-L808 WeakPolarHBondContact O-CB 3.47Å; D804-L808 WeakPolarHBondContact O-CG 3.34Å; D804-L808 PolarHBondContact O-N 3.29Å; Q805-L808 PolarHBondContact O-N 3.19Å; L808-S810 VanDerWaalsContact C-N 3.28Å; L808-S810 PolarHBondContact O-N 3.32Å; L808-M811 HydrophobicContact CD2-CE 3.74Å; L808-M811 HydrophobicContact CG-CE 4.13Å; L808-M811 PolarHBondContact O-N 3.1Å; L808-M811 VanDerWaalsContact O-N 3.13Å; L808-H812 WeakPolarHBondContact O-CB 3.18Å; L808-H812 PolarHBondContact O-N 2.99Å
809	H	80.4	Confident	75.2	Confident	110 Å²	110	65.8 Å²	65.8	51%	0.509	31%	0.311	S	S	.	.	H	α-helix	trans	-64.5	-32.9	178.4	178.7	-135.9	0	0	0	112.5	Q805 E806 I807 R813	Q805-H809 WeakPolarHBondContact O-CB 3.14Å; Q805-H809 PolarHBondContact O-N 2.9Å; E806-H809 PolarHBondContact O-N 3.4Å; I807-H809 VanDerWaalsContact C-N 3.33Å; I807-H809 PolarHBondContact O-N 3.46Å; H809-R813 PolarHBondContact CE1-NH2 3.5Å; H809-R813 PolarHBondContact NE2-NE 2.96Å; H809-R813 PolarHBondContact NE2-NH2 3.03Å; H809-R813 WeakPolarHBondContact O-CD 3.33Å; H809-R813 WeakPolarHBondContact O-CG 3.34Å
810	S	76.9	Confident	74.4	Confident	13 Å²	13	59.7 Å²	59.7	9%	0.091	29%	0.288	C	S	.	.	H	α-helix	trans	-67.5	-36.3	172.2	-169.4	0	0	0	0	112.8	E806 I807 L808	E806-S810 PolarHBondContact O-N 3.28Å; I807-S810 WeakPolarHBondContact O-CB 3.14Å; I807-S810 PolarHBondContact O-N 3.2Å; I807-S810 VanDerWaalsContact O-N 3.07Å; L808-S810 VanDerWaalsContact C-N 3.28Å; L808-S810 PolarHBondContact O-N 3.32Å
811	M	76.4	Confident	73.9	Confident	4 Å²	4	58.4 Å²	58.4	2%	0.02	29%	0.287	C	S	.	.	H	α-helix	trans	-75.7	-45.4	178.1	-65.7	-173.4	-58.2	0	0	113	F717 Q749 C750 A753 I807 L808 R813 E814 S815	F717-M811 HydrophobicContact CD1-CG 4.08Å; F717-M811 HydrophobicContact CE1-CB 4.48Å; F717-M811 HydrophobicContact CE1-CG 3.63Å; F717-M811 HydrophobicContact CZ-CG 4.21Å; Q749-M811 HydrophobicContact CB-CE 4.02Å; C750-M811 WeakPolarHBondContact CA-SD 3.21Å; C750-M811 HydrophobicContact CB-SD 3.9Å; C750-M811 PolarHBondContact N-SD 3.31Å; C750-M811 PolarHBondContact SG-SD 3.42Å; A753-M811 HydrophobicContact CB-CB 4.06Å; A753-M811 HydrophobicContact CB-CG 4.02Å; A753-M811 HydrophobicContact CB-SD 4.36Å; I807-M811 HydrophobicContact CG2-CE 4.12Å; I807-M811 HydrophobicContact CG2-CG 4.43Å; I807-M811 HydrophobicContact CG2-SD 4.2Å; I807-M811 WeakPolarHBondContact O-CG 3.45Å; I807-M811 PolarHBondContact O-N 2.93Å; L808-M811 HydrophobicContact CD2-CE 3.74Å; L808-M811 HydrophobicContact CG-CE 4.13Å; L808-M811 PolarHBondContact O-N 3.1Å; L808-M811 VanDerWaalsContact O-N 3.13Å; M811-R813 PolarHBondContact O-N 3.45Å; M811-R813 VanDerWaalsContact O-N 3.08Å; M811-E814 PolarHBondContact O-N 2.98Å; M811-S815 PolarHBondContact O-N 2.91Å; M811-S815 VanDerWaalsContact O-N 3.1Å
812	H	75.8	Confident	73.7	Confident	91 Å²	91	57.9 Å²	57.9	42%	0.421	28%	0.282	S	S	.	.	H	α-helix	trans	-61.6	-19.4	-179	-72.2	167.5	0	0	0	113.6	L808 E814 S815	L808-H812 WeakPolarHBondContact O-CB 3.18Å; L808-H812 PolarHBondContact O-N 2.99Å; H812-E814 VanDerWaalsContact C-N 3.32Å; H812-S815 VanDerWaalsContact CA-O 3.26Å; H812-S815 WeakPolarHBondContact CA-O 3.39Å
813	R	71.3	Confident	73.7	Confident	101 Å²	101	50.6 Å²	50.6	38%	0.381	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-23.3	170.9	-73.9	167.9	175.5	-165.4	-8.2	114	R700 H809 M811	R700-R813 WeakPolarHBondContact CB-O 3.3Å; H809-R813 PolarHBondContact CE1-NH2 3.5Å; H809-R813 PolarHBondContact NE2-NE 2.96Å; H809-R813 PolarHBondContact NE2-NH2 3.03Å; H809-R813 WeakPolarHBondContact O-CD 3.33Å; H809-R813 WeakPolarHBondContact O-CG 3.34Å; M811-R813 PolarHBondContact O-N 3.45Å; M811-R813 VanDerWaalsContact O-N 3.08Å
814	E	69.7	Low	74	Confident	8 Å²	8	46.2 Å²	46.2	4%	0.037	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.2	-41.8	179.5	-59.5	-66.7	-172.5	0	0	112.8	T699 R700 S701 K713 F717 V757 M811 H812	T699-E814 WeakPolarHBondContact CB-OE2 3.29Å; T699-E814 PolarHBondContact OG1-OE2 3.48Å; R700-E814 VanDerWaalsContact CD-O 3.31Å; R700-E814 WeakPolarHBondContact CD-O 3.43Å; R700-E814 WeakPolarHBondContact CG-O 3.16Å; R700-E814 PolarHBondContact N-OE2 2.94Å; S701-E814 VanDerWaalsContact CB-CD 3.44Å; S701-E814 WeakPolarHBondContact CB-OE1 3.39Å; S701-E814 WeakPolarHBondContact CB-OE2 3.42Å; S701-E814 PolarHBondContact N-OE2 3.45Å; K713-E814 HydrophobicContact CD-CG 4.46Å; K713-E814 WeakPolarHBondContact CE-OE1 3.47Å; K713-E814 IonicContact NZ-OE1 3.76Å; K713-E814 PolarHBondContact NZ-OE1 3.32Å; F717-E814 HydrophobicContact CE2-CG 4.19Å; F717-E814 HydrophobicContact CZ-CG 4.2Å; V757-E814 HydrophobicContact CG2-CB 4.17Å; V757-E814 HydrophobicContact CG2-CG 4.21Å; M811-E814 PolarHBondContact O-N 2.98Å; H812-E814 VanDerWaalsContact C-N 3.32Å
815	S	67.9	Low	74.1	Confident	10 Å²	10	48.5 Å²	48.5	7%	0.07	24%	0.243	C	C	.	.			trans	-129.3	137.7	175.8	-179.2	0	0	0	0	110.6	D752 M811 H812 C817	D752-S815 WeakPolarHBondContact OD2-CB 3.41Å; D752-S815 PolarHBondContact OD2-OG 3.27Å; M811-S815 PolarHBondContact O-N 2.91Å; M811-S815 VanDerWaalsContact O-N 3.1Å; H812-S815 VanDerWaalsContact CA-O 3.26Å; H812-S815 WeakPolarHBondContact CA-O 3.39Å; S815-C817 PolarHBondContact O-N 3.06Å; S815-C817 PolarHBondContact OG-N 3.46Å
816	S	58.7	Low	74.1	Confident	70 Å²	70	45 Å²	45	49%	0.49	23%	0.228	S	C	.	.			trans	-76	-1.6	170.1	42.1	0	0	0	0	113.4	R700 Q818	R700-S816 VanDerWaalsContact NH1-CB 3.27Å; R700-S816 VanDerWaalsContact NH1-N 3.19Å; R700-S816 PolarHBondContact NH1-OG 3.08Å; R700-S816 PolarHBondContact NH2-OG 3.44Å; S816-Q818 PolarHBondContact O-N 3.03Å
817	C	57.5	Low	74.1	Confident	11 Å²	11	40.5 Å²	40.5	7%	0.074	21%	0.211	C	C	.	.			trans	12.4	89.4	174.2	-172.5	0	0	0	0	116.6	D752 S815	D752-C817 HydrophobicContact CB-CB 4.42Å; D752-C817 WeakPolarHBondContact OD2-CB 3.35Å; S815-C817 PolarHBondContact O-N 3.06Å; S815-C817 PolarHBondContact OG-N 3.46Å
818	Q	61	Low	73.9	Confident	158 Å²	158	45 Å²	45	74%	0.738	23%	0.233	S	C	*	.			trans	-114.9	-3.9	163.7	-69.3	-175.7	-18.1	0	0	112.6	S816 F820 S821	S816-Q818 PolarHBondContact O-N 3.03Å; Q818-F820 PolarHBondContact O-N 3.17Å; Q818-F820 VanDerWaalsContact O-N 3.1Å; Q818-S821 WeakPolarHBondContact O-CB 3.39Å; Q818-S821 PolarHBondContact O-N 3.04Å
819	D	61.8	Low	74.2	Confident	44 Å²	44	47.6 Å²	47.6	24%	0.235	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-27.2	-167.9	-54.6	-6.7	0	0	0	113.2	L686	L686-D819 HydrophobicContact CB-CB 4.27Å
820	F	70.4	Confident	74.5	Confident	18 Å²	18	43.7 Å²	43.7	8%	0.079	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	9.1	176.5	-60.3	-84.2	0	0	0	114.3	L687 L748 D752 H769 Q818 M822 A823 T824	L687-F820 HydrophobicContact CD2-CD1 3.39Å; L687-F820 HydrophobicContact CD2-CE1 3.4Å; L687-F820 HydrophobicContact CD2-CG 4.33Å; L687-F820 HydrophobicContact CD2-CZ 4.33Å; L748-F820 HydrophobicContact CB-CB 4.31Å; L748-F820 HydrophobicContact CB-CD1 4.36Å; L748-F820 HydrophobicContact CB-CG 4.12Å; L748-F820 HydrophobicContact CD1-CB 4.48Å; L748-F820 HydrophobicContact CD1-CD1 4.23Å; L748-F820 HydrophobicContact CD2-CD1 4.16Å; L748-F820 HydrophobicContact CD2-CE1 4.24Å; L748-F820 HydrophobicContact CG-CD1 4.49Å; D752-F820 HydrophobicContact CB-CD2 4.39Å; D752-F820 HydrophobicContact CB-CE2 4Å; H769-F820 AromaticContact CE1-CE1 3.5Å; H769-F820 VanDerWaalsContact CE1-CE1 3.5Å; H769-F820 WeakPolarHBondContact CE1-CE1 3.28Å; H769-F820 AromaticContact CE1-CZ 3.55Å; H769-F820 AromaticContact NE2-CE1 3.65Å; Q818-F820 PolarHBondContact O-N 3.17Å; Q818-F820 VanDerWaalsContact O-N 3.1Å; F820-M822 PolarHBondContact O-N 3.22Å; F820-A823 PolarHBondContact O-N 3.24Å; F820-T824 WeakPolarHBondContact O-CB 3.49Å; F820-T824 WeakPolarHBondContact O-CG2 3.33Å; F820-T824 PolarHBondContact O-N 3.36Å; F820-T824 PolarHBondContact O-OG1 3.41Å
821	S	72.4	Confident	75.2	Confident	48 Å²	48	45.6 Å²	45.6	34%	0.336	24%	0.239	S	C	.	.	H	α-helix	trans	-59.9	-49.4	-177.5	109	0	0	0	0	110.9	Q818 A823 T824 D825	Q818-S821 WeakPolarHBondContact O-CB 3.39Å; Q818-S821 PolarHBondContact O-N 3.04Å; S821-A823 PolarHBondContact O-N 2.99Å; S821-A823 VanDerWaalsContact O-N 3.08Å; S821-T824 CarbonylContact O-C 3.47Å; S821-T824 PolarHBondContact O-N 3.04Å; S821-T824 PolarHBondContact O-OG1 3.04Å; S821-D825 VanDerWaalsContact CB-OD2 3.24Å; S821-D825 WeakPolarHBondContact CB-OD2 3.42Å; S821-D825 WeakPolarHBondContact O-CB 3.46Å; S821-D825 PolarHBondContact O-N 3.42Å; S821-D825 PolarHBondContact OG-OD2 3.05Å
822	M	79.1	Confident	75.8	Confident	27 Å²	27	49.3 Å²	49.3	13%	0.133	25%	0.253	C	S	.	.	H	α-helix	trans	-50.7	-40.9	179.6	-170.7	-161.3	-52.2	0	0	113.3	S680 I684 F820 T824 Y832 V836	S680-M822 VanDerWaalsContact O-CE 3.27Å; S680-M822 WeakPolarHBondContact O-CE 3.48Å; I684-M822 HydrophobicContact CG1-CE 4.11Å; I684-M822 HydrophobicContact CG1-SD 4.2Å; F820-M822 PolarHBondContact O-N 3.22Å; M822-T824 VanDerWaalsContact C-N 3.34Å; M822-Y832 VanDerWaalsContact CG-OH 3.25Å; M822-Y832 WeakPolarHBondContact CG-OH 3.26Å; M822-V836 HydrophobicContact CG-CG2 4.3Å
823	A	79.8	Confident	76.6	Confident	5 Å²	5	45.3 Å²	45.3	4%	0.041	23%	0.234	C	C	.	.	H	α-helix	trans	-72	-28	179.2	0	0	0	0	0	113.2	C776 Q780 F820 S821	C776-A823 PolarHBondContact SG-O 2.86Å; Q780-A823 PolarHBondContact NE2-O 3.02Å; F820-A823 PolarHBondContact O-N 3.24Å; S821-A823 PolarHBondContact O-N 2.99Å; S821-A823 VanDerWaalsContact O-N 3.08Å
824	T	83.9	Confident	77.6	Confident	2 Å²	2	41 Å²	41	1%	0.012	22%	0.219	C	C	.	.	H	α-helix	trans	-118	0.3	-164.9	61.8	0	0	0	0	114.3	K745 L748 Y797 F820 S821 M822	K745-T824 HydrophobicContact CB-CG2 3.98Å; K745-T824 WeakPolarHBondContact CD-OG1 3.25Å; K745-T824 WeakPolarHBondContact CE-OG1 3.25Å; K745-T824 HydrophobicContact CG-CG2 4.14Å; K745-T824 WeakPolarHBondContact CG-OG1 3.39Å; L748-T824 HydrophobicContact CD1-CG2 3.75Å; Y797-T824 WeakPolarHBondContact CE2-O 3.39Å; Y797-T824 PolarHBondContact OH-O 3.27Å; F820-T824 WeakPolarHBondContact O-CB 3.49Å; F820-T824 WeakPolarHBondContact O-CG2 3.33Å; F820-T824 PolarHBondContact O-N 3.36Å; F820-T824 PolarHBondContact O-OG1 3.41Å; S821-T824 CarbonylContact O-C 3.47Å; S821-T824 PolarHBondContact O-N 3.04Å; S821-T824 PolarHBondContact O-OG1 3.04Å; M822-T824 VanDerWaalsContact C-N 3.34Å
825	D	85.1	Confident	78.6	Confident	53 Å²	53	43 Å²	43	28%	0.283	23%	0.228	S	C	.	.	S	Bend	trans	-82.3	134.2	175.9	-67.9	-26.4	0	0	0	110.1	K745 Q780 S821 A827	K745-D825 IonicContact NZ-OD1 2.81Å; K745-D825 PolarHBondContact NZ-OD1 3.5Å; Q780-D825 PolarHBondContact NE2-O 3.41Å; S821-D825 VanDerWaalsContact CB-OD2 3.24Å; S821-D825 WeakPolarHBondContact CB-OD2 3.42Å; S821-D825 WeakPolarHBondContact O-CB 3.46Å; S821-D825 PolarHBondContact O-N 3.42Å; S821-D825 PolarHBondContact OG-OD2 3.05Å; D825-A827 PolarHBondContact O-N 2.88Å; D825-A827 VanDerWaalsContact O-N 3.14Å
826	L	84.3	Confident	79.7	Confident	29 Å²	29	42.6 Å²	42.6	15%	0.152	23%	0.225	C	C	.	.			trans	-82.7	89.1	179.9	-177.3	56.4	0	0	0	109.5	L741 L783 L794 Y797	L741-L826 HydrophobicContact CD2-CB 3.92Å; L741-L826 HydrophobicContact CD2-CD1 4.04Å; L783-L826 HydrophobicContact CD1-CD1 3.89Å; L783-L826 HydrophobicContact CD2-CD1 4.11Å; L794-L826 HydrophobicContact CB-CD2 4.45Å; L794-L826 HydrophobicContact CD2-CD2 3.74Å; L794-L826 HydrophobicContact CD2-CG 4.27Å; L794-L826 HydrophobicContact CG-CD2 3.95Å; Y797-L826 HydrophobicContact CD1-CB 4.12Å; Y797-L826 HydrophobicContact CD1-CD2 4.26Å; Y797-L826 HydrophobicContact CD2-CB 4.46Å; Y797-L826 HydrophobicContact CE1-CB 4.2Å; Y797-L826 HydrophobicContact CG-CB 4.24Å; Y797-L826 HydrophobicContact CG-CD2 4.02Å
827	A	81.3	Confident	81.4	Confident	23 Å²	23	39.2 Å²	39.2	19%	0.19	20%	0.201	C	C	.	.			trans	-75.6	152.8	176.1	0	0	0	0	0	112.2	D825 Y832 Q833	D825-A827 PolarHBondContact O-N 2.88Å; D825-A827 VanDerWaalsContact O-N 3.14Å; A827-Y832 HydrophobicContact CB-CD1 3.32Å; A827-Y832 HydrophobicContact CB-CE1 3.82Å; A827-Y832 HydrophobicContact CB-CG 4.22Å; A827-Q833 HydrophobicContact CB-CG 4.16Å; A827-Q833 PolarHBondContact O-NE2 2.96Å; A827-Q833 VanDerWaalsContact O-NE2 3.13Å
828	M	77.4	Confident	83.1	Confident	103 Å²	103	38.9 Å²	38.9	51%	0.507	20%	0.199	S	C	.	.	S	Bend	trans	-88.1	-21	177.8	-60	-56	-67	0	0	113.3	R790 L794	R790-M828 HydrophobicContact CB-CE 4.42Å; R790-M828 HydrophobicContact CG-CE 4.49Å; R790-M828 PolarHBondContact NE-O 2.75Å; R790-M828 PolarHBondContact NH2-O 3.5Å; L794-M828 HydrophobicContact CD1-CE 4.19Å; L794-M828 HydrophobicContact CD1-SD 4.03Å; L794-M828 HydrophobicContact CD2-SD 4.46Å
829	D	87.2	Confident	84.4	Confident	72 Å²	72	34.9 Å²	34.9	39%	0.385	18%	0.177	S	C	.	.			trans	-91	120	-175.7	170.4	33.8	0	0	0	111.6	E831 Y832 Q833	D829-E831 VanDerWaalsContact C-N 3.28Å; D829-E831 PolarHBondContact O-N 2.62Å; D829-E831 PolarHBondContact OD1-N 3.47Å; D829-Y832 PolarHBondContact O-N 3.28Å; D829-Y832 WeakPolarHBondContact OD2-CB 3.43Å; D829-Y832 PolarHBondContact OD2-N 2.91Å; D829-Q833 WeakPolarHBondContact O-CG 3.49Å; D829-Q833 PolarHBondContact O-N 3.43Å; D829-Q833 VanDerWaalsContact O-N 3.11Å
830	P	87.8	Confident	85.9	Confident	28 Å²	28	32.9 Å²	32.9	18%	0.182	17%	0.167	C	C	.	.	H	α-helix	trans	-61.5	-30.6	176.5	-23.1	35	0	0	0	113.9	A784 Q833 L834 Y878	A784-P830 HydrophobicContact CB-CB 4.49Å; P830-Q833 PolarHBondContact O-N 3.37Å; P830-L834 VanDerWaalsContact O-CG 3.31Å; P830-L834 WeakPolarHBondContact O-CG 3.37Å; P830-L834 PolarHBondContact O-N 3.05Å; P830-Y878 HydrophobicContact CB-CE2 4.44Å
831	E	90.3	Very high	86.9	Confident	52 Å²	52	32.1 Å²	32.1	24%	0.243	16%	0.163	C	C	.	.	H	α-helix	trans	-63.1	-49.3	177.8	-171.9	175.8	154.3	0	0	110.2	D829 Q833 L834 F835 Y878 Y879 Q882	D829-E831 VanDerWaalsContact C-N 3.28Å; D829-E831 PolarHBondContact O-N 2.62Å; D829-E831 PolarHBondContact OD1-N 3.47Å; E831-Q833 PolarHBondContact O-N 3.01Å; E831-L834 PolarHBondContact O-N 2.75Å; E831-F835 WeakPolarHBondContact O-CB 3.41Å; E831-F835 PolarHBondContact O-N 3.17Å; E831-Y878 HydrophobicContact CB-CD1 4.5Å; E831-Y878 HydrophobicContact CB-CE1 3.58Å; E831-Y878 HydrophobicContact CG-CD1 4.34Å; E831-Y878 HydrophobicContact CG-CE1 3.7Å; E831-Y879 VanDerWaalsContact CD-CE1 3.48Å; E831-Y879 HydrophobicContact CG-CE1 4.17Å; E831-Y879 WeakPolarHBondContact OE1-CE1 3.43Å; E831-Y879 VanDerWaalsContact OE1-CZ 3.29Å; E831-Y879 PolarHBondContact OE1-OH 2.87Å; E831-Q882 PolarHBondContact OE2-NE2 3.12Å
832	Y	90	Very high	87.8	Confident	83 Å²	83	31 Å²	31	33%	0.325	15%	0.153	S	C	.	.	H	α-helix	trans	-60.5	-41.6	174.9	-175.1	-88.7	0	0	0	112.9	M822 A827 D829 F835 V836	M822-Y832 VanDerWaalsContact CG-OH 3.25Å; M822-Y832 WeakPolarHBondContact CG-OH 3.26Å; A827-Y832 HydrophobicContact CB-CD1 3.32Å; A827-Y832 HydrophobicContact CB-CE1 3.82Å; A827-Y832 HydrophobicContact CB-CG 4.22Å; D829-Y832 PolarHBondContact O-N 3.28Å; D829-Y832 WeakPolarHBondContact OD2-CB 3.43Å; D829-Y832 PolarHBondContact OD2-N 2.91Å; Y832-F835 PolarHBondContact O-N 2.89Å; Y832-V836 HydrophobicContact CD1-CG2 3.86Å; Y832-V836 HydrophobicContact CE1-CG2 3.46Å; Y832-V836 VanDerWaalsContact CE1-CG2 3.46Å; Y832-V836 HydrophobicContact CE2-CG2 4.38Å; Y832-V836 WeakPolarHBondContact O-CB 3.41Å; Y832-V836 WeakPolarHBondContact O-CG2 3.49Å; Y832-V836 PolarHBondContact O-N 2.81Å
833	Q	90.9	Very high	88.2	Confident	6 Å²	6	30 Å²	30	3%	0.028	15%	0.149	C	C	.	.	H	α-helix	trans	-63.8	-45.4	178.9	-70.4	176.3	-54	0	0	112.5	A784 A827 D829 P830 E831 V836 S837	A784-Q833 HydrophobicContact CB-CB 3.85Å; A827-Q833 HydrophobicContact CB-CG 4.16Å; A827-Q833 PolarHBondContact O-NE2 2.96Å; A827-Q833 VanDerWaalsContact O-NE2 3.13Å; D829-Q833 WeakPolarHBondContact O-CG 3.49Å; D829-Q833 PolarHBondContact O-N 3.43Å; D829-Q833 VanDerWaalsContact O-N 3.11Å; P830-Q833 PolarHBondContact O-N 3.37Å; E831-Q833 PolarHBondContact O-N 3.01Å; Q833-V836 PolarHBondContact O-N 3.38Å; Q833-S837 WeakPolarHBondContact O-CB 3.38Å; Q833-S837 PolarHBondContact O-N 2.92Å
834	L	92.7	Very high	88.6	Confident	12 Å²	12	29.8 Å²	29.8	6%	0.063	15%	0.147	C	C	.	.	H	α-helix	trans	-65.4	-38.3	175.5	-65.8	171	0	0	0	111.7	L781 A784 P830 E831 S837 C838 I871 E874 M875 Y878	L781-L834 HydrophobicContact CD1-CD2 3.66Å; A784-L834 HydrophobicContact CB-CD2 3.64Å; A784-L834 HydrophobicContact CB-CG 3.7Å; P830-L834 VanDerWaalsContact O-CG 3.31Å; P830-L834 WeakPolarHBondContact O-CG 3.37Å; P830-L834 PolarHBondContact O-N 3.05Å; E831-L834 PolarHBondContact O-N 2.75Å; L834-S837 PolarHBondContact O-N 2.98Å; L834-C838 PolarHBondContact O-N 3.32Å; L834-I871 HydrophobicContact CB-CD1 4.16Å; L834-I871 HydrophobicContact CD2-CD1 3.63Å; L834-E874 HydrophobicContact CD2-CB 4.47Å; L834-M875 HydrophobicContact CB-CG 4.19Å; L834-M875 HydrophobicContact CB-SD 3.29Å; L834-M875 WeakPolarHBondContact CB-SD 3.43Å; L834-M875 HydrophobicContact CD1-SD 4.32Å; L834-M875 HydrophobicContact CG-SD 4.43Å; L834-Y878 HydrophobicContact CD1-CD2 4.18Å; L834-Y878 HydrophobicContact CD1-CG 4.2Å
835	F	91.7	Very high	88.9	Confident	48 Å²	48	32 Å²	32	21%	0.211	16%	0.157	C	C	.	.	H	α-helix	trans	-61.1	-47.8	173.3	172.7	-94.8	0	0	0	111.9	I684 E831 Y832 C838 R839 M875	I684-F835 HydrophobicContact CD1-CZ 4.3Å; E831-F835 WeakPolarHBondContact O-CB 3.41Å; E831-F835 PolarHBondContact O-N 3.17Å; Y832-F835 PolarHBondContact O-N 2.89Å; F835-C838 WeakPolarHBondContact O-CB 3.27Å; F835-C838 PolarHBondContact O-N 2.99Å; F835-R839 HydrophobicContact CD1-CG 4.31Å; F835-R839 HydrophobicContact CE1-CG 3.91Å; F835-R839 HydrophobicContact CE2-CG 4.41Å; F835-R839 HydrophobicContact CZ-CG 3.99Å; F835-R839 VanDerWaalsContact CZ-NE 3.31Å; F835-R839 WeakPolarHBondContact O-CG 3.47Å; F835-R839 PolarHBondContact O-N 3.34Å; F835-M875 HydrophobicContact CB-CE 4.26Å
836	V	91.1	Very high	88.9	Confident	2 Å²	2	34.5 Å²	34.5	1%	0.012	17%	0.167	C	C	.	.	H	α-helix	trans	-61.3	-44.4	176.9	168.8	0	0	0	0	111	Q780 M822 Y832 Q833 C838 R839 C840	Q780-V836 HydrophobicContact CG-CG1 4.05Å; M822-V836 HydrophobicContact CG-CG2 4.3Å; Y832-V836 HydrophobicContact CD1-CG2 3.86Å; Y832-V836 HydrophobicContact CE1-CG2 3.46Å; Y832-V836 VanDerWaalsContact CE1-CG2 3.46Å; Y832-V836 HydrophobicContact CE2-CG2 4.38Å; Y832-V836 WeakPolarHBondContact O-CB 3.41Å; Y832-V836 WeakPolarHBondContact O-CG2 3.49Å; Y832-V836 PolarHBondContact O-N 2.81Å; Q833-V836 PolarHBondContact O-N 3.38Å; V836-C838 VanDerWaalsContact C-N 3.3Å; V836-C838 PolarHBondContact O-N 3.3Å; V836-R839 PolarHBondContact O-N 3.24Å; V836-R839 VanDerWaalsContact O-N 3.08Å; V836-C840 PolarHBondContact O-N 3.03Å; V836-C840 PolarHBondContact O-SG 2.99Å; V836-C840 VanDerWaalsContact O-SG 3.39Å
837	S	93.7	Very high	88.7	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-54.6	-46.2	173.8	-179.1	0	0	0	0	111.7	G777 Q833 L834 R839 C840 Y841	G777-S837 WeakPolarHBondContact O-CB 3.49Å; G777-S837 PolarHBondContact O-OG 3.33Å; Q833-S837 WeakPolarHBondContact O-CB 3.38Å; Q833-S837 PolarHBondContact O-N 2.92Å; L834-S837 PolarHBondContact O-N 2.98Å; S837-R839 PolarHBondContact O-N 3.24Å; S837-C840 PolarHBondContact O-N 2.99Å; S837-Y841 WeakPolarHBondContact O-CD2 3.46Å; S837-Y841 PolarHBondContact O-N 2.72Å; S837-Y841 WeakPolarHBondContact OG-CE2 3.31Å
838	C	92.4	Very high	88.7	Confident	4 Å²	4	33.8 Å²	33.8	3%	0.027	16%	0.159	C	C	.	.	H	α-helix	trans	-60.3	-42.2	175.4	-169.7	0	0	0	0	112.6	L834 F835 V836 Y841 E842 I871	L834-C838 PolarHBondContact O-N 3.32Å; F835-C838 WeakPolarHBondContact O-CB 3.27Å; F835-C838 PolarHBondContact O-N 2.99Å; V836-C838 VanDerWaalsContact C-N 3.3Å; V836-C838 PolarHBondContact O-N 3.3Å; C838-Y841 PolarHBondContact O-N 3.43Å; C838-E842 WeakPolarHBondContact O-CG 3.37Å; C838-E842 PolarHBondContact O-N 2.78Å; C838-I871 HydrophobicContact CB-CG1 3.96Å; C838-I871 HydrophobicContact CB-CG2 4.11Å
839	R	90.2	Very high	88.6	Confident	74 Å²	74	31.8 Å²	31.8	28%	0.279	15%	0.153	S	C	.	.	H	α-helix	trans	-66	-37.5	177.5	-64.9	-44.3	-166.5	156.4	14.4	113	I684 F835 V836 S837 Y841 E842 A843	I684-R839 HydrophobicContact CD1-CG 4.34Å; F835-R839 HydrophobicContact CD1-CG 4.31Å; F835-R839 HydrophobicContact CE1-CG 3.91Å; F835-R839 HydrophobicContact CE2-CG 4.41Å; F835-R839 HydrophobicContact CZ-CG 3.99Å; F835-R839 VanDerWaalsContact CZ-NE 3.31Å; F835-R839 WeakPolarHBondContact O-CG 3.47Å; F835-R839 PolarHBondContact O-N 3.34Å; V836-R839 PolarHBondContact O-N 3.24Å; V836-R839 VanDerWaalsContact O-N 3.08Å; S837-R839 PolarHBondContact O-N 3.24Å; R839-Y841 VanDerWaalsContact C-N 3.34Å; R839-Y841 PolarHBondContact O-N 3.21Å; R839-E842 VanDerWaalsContact CD-OE2 3.24Å; R839-E842 WeakPolarHBondContact CD-OE2 3.37Å; R839-E842 IonicContact CZ-OE2 2.66Å; R839-E842 IonicContact NE-OE2 2.75Å; R839-E842 IonicContact NH1-OE2 3.53Å; R839-E842 PolarHBondContact NH1-OE2 3.46Å; R839-E842 PolarHBondContact O-N 3.36Å; R839-A843 WeakPolarHBondContact O-CB 3.42Å; R839-A843 PolarHBondContact O-N 2.63Å
840	C	91.5	Very high	88	Confident	2 Å²	2	30.9 Å²	30.9	1%	0.014	15%	0.153	C	C	.	.	H	α-helix	trans	-60.4	-41.8	175	-70.3	0	0	0	0	112.1	L773 V836 S837 A844	L773-C840 WeakPolarHBondContact O-CB 3.36Å; V836-C840 PolarHBondContact O-N 3.03Å; V836-C840 PolarHBondContact O-SG 2.99Å; V836-C840 VanDerWaalsContact O-SG 3.39Å; S837-C840 PolarHBondContact O-N 2.99Å; C840-A844 WeakPolarHBondContact O-CB 3.48Å; C840-A844 PolarHBondContact O-N 3.46Å
841	Y	93.1	Very high	86.6	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.008	18%	0.18	C	C	.	.	H	α-helix	trans	-73.6	-35	175.5	-56.7	-50.8	0	0	0	113.7	S774 G777 D778 S837 C838 R839 A844 H845 R867 I871	S774-Y841 WeakPolarHBondContact O-CE1 3.39Å; G777-Y841 PolarHBondContact O-OH 2.71Å; D778-Y841 VanDerWaalsContact CA-OH 3.26Å; D778-Y841 WeakPolarHBondContact CA-OH 3.46Å; D778-Y841 PolarHBondContact N-OH 2.66Å; D778-Y841 PolarHBondContact OD1-OH 2.96Å; S837-Y841 WeakPolarHBondContact O-CD2 3.46Å; S837-Y841 PolarHBondContact O-N 2.72Å; S837-Y841 WeakPolarHBondContact OG-CE2 3.31Å; C838-Y841 PolarHBondContact O-N 3.43Å; R839-Y841 VanDerWaalsContact C-N 3.34Å; R839-Y841 PolarHBondContact O-N 3.21Å; Y841-A844 PolarHBondContact O-N 3.34Å; Y841-H845 WeakPolarHBondContact O-CB 3.33Å; Y841-H845 PolarHBondContact O-N 3.21Å; Y841-R867 HydrophobicContact CD1-CB 3.97Å; Y841-R867 HydrophobicContact CD2-CB 4.4Å; Y841-R867 HydrophobicContact CE1-CB 3.85Å; Y841-R867 HydrophobicContact CE1-CG 4.13Å; Y841-R867 HydrophobicContact CE2-CB 4.28Å; Y841-R867 HydrophobicContact CG-CB 4.24Å; Y841-I871 HydrophobicContact CD2-CB 4.25Å; Y841-I871 HydrophobicContact CD2-CG2 3.65Å; Y841-I871 HydrophobicContact CE2-CB 4.06Å; Y841-I871 HydrophobicContact CE2-CG2 3.98Å
842	E	90.6	Very high	85.2	Confident	25 Å²	25	39 Å²	39	12%	0.117	19%	0.194	C	C	.	.	H	α-helix	trans	-61.3	-47	173.8	-73.2	-179.9	158.8	0	0	110.8	C838 R839 H845 E846 L868 R872	C838-E842 WeakPolarHBondContact O-CG 3.37Å; C838-E842 PolarHBondContact O-N 2.78Å; R839-E842 VanDerWaalsContact CD-OE2 3.24Å; R839-E842 WeakPolarHBondContact CD-OE2 3.37Å; R839-E842 IonicContact CZ-OE2 2.66Å; R839-E842 IonicContact NE-OE2 2.75Å; R839-E842 IonicContact NH1-OE2 3.53Å; R839-E842 PolarHBondContact NH1-OE2 3.46Å; R839-E842 PolarHBondContact O-N 3.36Å; E842-H845 PolarHBondContact O-N 3.48Å; E842-E846 WeakPolarHBondContact O-CG 3.17Å; E842-E846 PolarHBondContact O-N 3.3Å; E842-L868 HydrophobicContact CG-CD1 3.7Å; E842-L868 HydrophobicContact CG-CD2 4.43Å; E842-R872 IonicContact OE1-CZ 2.78Å; E842-R872 IonicContact OE1-NE 3.5Å; E842-R872 IonicContact OE1-NH2 2.77Å; E842-R872 PolarHBondContact OE1-NH2 2.93Å
843	A	87.6	Confident	83.7	Confident	6 Å²	6	35.4 Å²	35.4	5%	0.05	18%	0.18	C	C	.	.	H	α-helix	trans	-62.8	-42.5	175.4	0	0	0	0	0	112.6	L688 L773 R839 H845 E846 M847	L688-A843 HydrophobicContact CD2-CB 4.24Å; L773-A843 HydrophobicContact CD1-CB 3.83Å; R839-A843 WeakPolarHBondContact O-CB 3.42Å; R839-A843 PolarHBondContact O-N 2.63Å; A843-H845 VanDerWaalsContact C-N 3.35Å; A843-H845 PolarHBondContact O-N 3.36Å; A843-E846 PolarHBondContact O-N 2.73Å; A843-M847 WeakPolarHBondContact O-CG 3.38Å; A843-M847 PolarHBondContact O-N 3.34Å; A843-M847 VanDerWaalsContact O-N 3.07Å
844	A	88.8	Confident	82.1	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-59.4	-43.8	174	0	0	0	0	0	112.2	S770 L773 C840 Y841 M847 L848 V864	S770-A844 PolarHBondContact OG-O 3.25Å; L773-A844 HydrophobicContact CB-CB 4.14Å; C840-A844 WeakPolarHBondContact O-CB 3.48Å; C840-A844 PolarHBondContact O-N 3.46Å; Y841-A844 PolarHBondContact O-N 3.34Å; A844-M847 PolarHBondContact O-N 2.87Å; A844-L848 WeakPolarHBondContact O-CG 3.42Å; A844-L848 PolarHBondContact O-N 3.43Å; A844-L848 VanDerWaalsContact O-N 3.12Å; A844-V864 HydrophobicContact CB-CG1 4.08Å
845	H	88.8	Confident	80.4	Confident	49 Å²	49	48.1 Å²	48.1	23%	0.227	24%	0.243	C	C	.	.	H	α-helix	trans	-63.4	-45.8	177.7	172.5	-89.1	0	0	0	112.3	Y841 E842 A843 M847 L848 T849 V864	Y841-H845 WeakPolarHBondContact O-CB 3.33Å; Y841-H845 PolarHBondContact O-N 3.21Å; E842-H845 PolarHBondContact O-N 3.48Å; A843-H845 VanDerWaalsContact C-N 3.35Å; A843-H845 PolarHBondContact O-N 3.36Å; H845-M847 VanDerWaalsContact C-N 3.34Å; H845-M847 PolarHBondContact O-N 3.48Å; H845-L848 PolarHBondContact O-N 2.98Å; H845-T849 PolarHBondContact CE1-OG1 3.43Å; H845-T849 WeakPolarHBondContact O-CB 3.27Å; H845-T849 PolarHBondContact O-N 3.27Å; H845-T849 PolarHBondContact O-OG1 2.98Å; H845-V864 HydrophobicContact CB-CG1 3.94Å
846	E	85.5	Confident	78.7	Confident	104 Å²	104	53 Å²	53	49%	0.486	27%	0.266	S	S	.	.	H	α-helix	trans	-61.6	-41.8	178.4	-73.8	180	-162.2	0	0	111.8	L688 E842 A843 T849 S850	L688-E846 WeakPolarHBondContact CD1-OE2 3.27Å; L688-E846 HydrophobicContact CD2-CB 4.44Å; L688-E846 WeakPolarHBondContact CD2-OE2 3.41Å; E842-E846 WeakPolarHBondContact O-CG 3.17Å; E842-E846 PolarHBondContact O-N 3.3Å; A843-E846 PolarHBondContact O-N 2.73Å; E846-T849 PolarHBondContact O-N 2.92Å; E846-S850 PolarHBondContact O-N 3.36Å
847	M	80.6	Confident	77.2	Confident	34 Å²	34	53.3 Å²	53.3	17%	0.167	27%	0.269	C	S	.	.	H	α-helix	trans	-63.4	-41.9	175.9	-70.2	-174.8	77.6	0	0	113.1	L766 H769 L773 A843 A844 H845 T849 S850	L766-M847 HydrophobicContact CB-CE 4.35Å; L766-M847 HydrophobicContact CD2-CE 3.56Å; H769-M847 HydrophobicContact CB-CE 3.94Å; H769-M847 HydrophobicContact CB-SD 4.5Å; H769-M847 PolarHBondContact CD2-SD 3.3Å; L773-M847 HydrophobicContact CD1-SD 4.08Å; A843-M847 WeakPolarHBondContact O-CG 3.38Å; A843-M847 PolarHBondContact O-N 3.34Å; A843-M847 VanDerWaalsContact O-N 3.07Å; A844-M847 PolarHBondContact O-N 2.87Å; H845-M847 VanDerWaalsContact C-N 3.34Å; H845-M847 PolarHBondContact O-N 3.48Å; M847-T849 VanDerWaalsContact C-N 3.31Å; M847-T849 PolarHBondContact O-N 3.08Å; M847-S850 WeakPolarHBondContact O-CB 3.46Å; M847-S850 PolarHBondContact O-N 3.39Å
848	L	80.1	Confident	76	Confident	3 Å²	3	57.7 Å²	57.7	2%	0.016	30%	0.299	C	S	.	.	H	α-helix	trans	-70.5	-24.5	177.3	-68.9	176.9	0	0	0	113.5	S770 A844 H845 L853 Q860 L861 V864	S770-L848 WeakPolarHBondContact OG-CD1 3.47Å; S770-L848 WeakPolarHBondContact OG-CG 3.36Å; A844-L848 WeakPolarHBondContact O-CG 3.42Å; A844-L848 PolarHBondContact O-N 3.43Å; A844-L848 VanDerWaalsContact O-N 3.12Å; H845-L848 PolarHBondContact O-N 2.98Å; L848-L853 HydrophobicContact CD2-CD1 4.4Å; L848-Q860 HydrophobicContact CD1-CB 4.41Å; L848-L861 HydrophobicContact CB-CD1 4.12Å; L848-V864 HydrophobicContact CD1-CB 4.42Å; L848-V864 HydrophobicContact CD1-CG2 3.83Å
849	T	76.8	Confident	75.2	Confident	62 Å²	62	63.3 Å²	63.3	38%	0.38	33%	0.329	S	S	.	.	H	α-helix	trans	-84.2	-13.2	-179.1	-54.7	0	0	0	0	113	H845 E846 M847 K854	H845-T849 PolarHBondContact CE1-OG1 3.43Å; H845-T849 WeakPolarHBondContact O-CB 3.27Å; H845-T849 PolarHBondContact O-N 3.27Å; H845-T849 PolarHBondContact O-OG1 2.98Å; E846-T849 PolarHBondContact O-N 2.92Å; M847-T849 VanDerWaalsContact C-N 3.31Å; M847-T849 PolarHBondContact O-N 3.08Å; T849-K854 WeakPolarHBondContact O-CE 3.41Å
850	S	74	Confident	74.7	Confident	53 Å²	53	62.1 Å²	62.1	37%	0.371	33%	0.326	S	S	.	.	S	Bend	trans	-55.6	146.1	176.8	-175.6	0	0	0	0	112.7	E846 M847 V852 L853	E846-S850 PolarHBondContact O-N 3.36Å; M847-S850 WeakPolarHBondContact O-CB 3.46Å; M847-S850 PolarHBondContact O-N 3.39Å; S850-V852 PolarHBondContact O-N 2.83Å; S850-L853 PolarHBondContact O-N 3.36Å
851	E	58.8	Low	74.4	Confident	160 Å²	160	64.2 Å²	64.2	75%	0.748	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-22.2	-173.4	-51.4	-152.5	119.3	0	0	114.3	L853 K854	E851-L853 VanDerWaalsContact C-N 3.29Å; E851-L853 PolarHBondContact O-N 2.87Å; E851-K854 IonicContact OE1-NZ 3.36Å; E851-K854 PolarHBondContact OE1-NZ 3.2Å
852	V	59.9	Low	74.1	Confident	89 Å²	89	66.3 Å²	66.3	54%	0.539	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-20	-179.7	-177.8	0	0	0	0	113.3	P763 L766 S850	P763-V852 HydrophobicContact CB-CG1 4.27Å; P763-V852 HydrophobicContact CG-CG1 3.83Å; L766-V852 HydrophobicContact CD1-CG1 4.48Å; S850-V852 PolarHBondContact O-N 2.83Å
853	L	60.1	Low	74.1	Confident	9 Å²	9	70.2 Å²	70.2	5%	0.047	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120	-4.1	-169.6	-74	172.2	0	0	0	115.8	P763 L766 L848 S850 E851 D855 Q856 S857	P763-L853 HydrophobicContact CB-CD2 3.75Å; L766-L853 HydrophobicContact CB-CD1 4Å; L848-L853 HydrophobicContact CD2-CD1 4.4Å; S850-L853 PolarHBondContact O-N 3.36Å; E851-L853 VanDerWaalsContact C-N 3.29Å; E851-L853 PolarHBondContact O-N 2.87Å; L853-D855 PolarHBondContact O-N 3.32Å; L853-Q856 PolarHBondContact O-N 3.27Å; L853-S857 PolarHBondContact O-OG 3.08Å
854	K	56.9	Low	74.2	Confident	122 Å²	122	70.1 Å²	70.1	53%	0.53	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-27.8	-167.2	-73.2	177.2	178	168.5	0	115.9	T849 E851	T849-K854 WeakPolarHBondContact O-CE 3.41Å; E851-K854 IonicContact OE1-NZ 3.36Å; E851-K854 PolarHBondContact OE1-NZ 3.2Å
855	D	55.3	Low	74.3	Confident	163 Å²	163	70.9 Å²	70.9	87%	0.872	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-4.9	-174.4	-67	-23.9	0	0	0	115	L853	L853-D855 PolarHBondContact O-N 3.32Å
856	Q	57.3	Low	74.5	Confident	151 Å²	151	73.2 Å²	73.2	71%	0.706	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.8	-7.3	-170.2	-66.7	-174.2	-7.9	0	0	115.8	L853	L853-Q856 PolarHBondContact O-N 3.27Å
857	S	59.8	Low	74.9	Confident	8 Å²	8	71.3 Å²	71.3	6%	0.056	37%	0.371	C	S	.	.			trans	-118.9	10	-164.6	61.8	0	0	0	0	116.4	L853 D859 Q860 L861	L853-S857 PolarHBondContact O-OG 3.08Å; S857-D859 VanDerWaalsContact C-N 3.35Å; S857-D859 PolarHBondContact O-N 3.46Å; S857-Q860 PolarHBondContact O-N 2.81Å; S857-Q860 VanDerWaalsContact O-N 3.11Å; S857-L861 PolarHBondContact O-N 3.33Å
858	S	67	Low	75.5	Confident	91 Å²	91	69.9 Å²	69.9	64%	0.636	36%	0.364	S	S	*	.	H	α-helix	trans	-48.9	-47.6	-171.8	-176.6	0	0	0	0	114.3	L861 S862	S858-L861 PolarHBondContact O-N 2.75Å; S858-S862 PolarHBondContact O-N 2.96Å
859	D	76.9	Confident	76.1	Confident	123 Å²	123	69.7 Å²	69.7	66%	0.658	36%	0.363	S	S	*	.	H	α-helix	trans	-70.4	-39.3	-176.7	-61.1	-24.6	0	0	0	112	S857 S862 Q863	S857-D859 VanDerWaalsContact C-N 3.35Å; S857-D859 PolarHBondContact O-N 3.46Å; D859-S862 PolarHBondContact O-N 3.3Å; D859-S862 PolarHBondContact O-OG 2.75Å; D859-Q863 WeakPolarHBondContact O-CG 3.48Å; D859-Q863 PolarHBondContact O-N 3.01Å; D859-Q863 VanDerWaalsContact O-N 3.08Å
860	Q	78.9	Confident	76.9	Confident	49 Å²	49	69.9 Å²	69.9	23%	0.229	36%	0.362	C	S	.	.	H	α-helix	trans	-67.7	-38.8	175.8	-73.3	-179.7	-11	0	0	111.8	Q767 L848 S857 S862 Q863 V864	Q767-Q860 VanDerWaalsContact CG-OE1 3.31Å; L848-Q860 HydrophobicContact CD1-CB 4.41Å; S857-Q860 PolarHBondContact O-N 2.81Å; S857-Q860 VanDerWaalsContact O-N 3.11Å; Q860-S862 VanDerWaalsContact C-N 3.28Å; Q860-S862 PolarHBondContact O-N 3.45Å; Q860-Q863 PolarHBondContact O-N 3.26Å; Q860-V864 WeakPolarHBondContact O-CG2 3.5Å; Q860-V864 PolarHBondContact O-N 2.98Å
861	L	85.3	Confident	77.9	Confident	45 Å²	45	67.4 Å²	67.4	24%	0.236	34%	0.344	C	S	.	.	H	α-helix	trans	-59.7	-41.6	173.1	-177.1	64.1	0	0	0	110.9	L848 S857 S858 Q863 V864 L865	L848-L861 HydrophobicContact CB-CD1 4.12Å; S857-L861 PolarHBondContact O-N 3.33Å; S858-L861 PolarHBondContact O-N 2.75Å; L861-Q863 VanDerWaalsContact C-N 3.34Å; L861-Q863 PolarHBondContact O-N 2.98Å; L861-V864 PolarHBondContact O-N 3.04Å; L861-L865 HydrophobicContact CG-CD1 4.29Å; L861-L865 WeakPolarHBondContact O-CB 3.25Å; L861-L865 WeakPolarHBondContact O-CG 3.48Å; L861-L865 PolarHBondContact O-N 3.06Å
862	S	86.7	Confident	79.7	Confident	46 Å²	46	60.9 Å²	60.9	32%	0.322	31%	0.313	S	S	.	.	H	α-helix	trans	-63.5	-37.9	176	83.8	0	0	0	0	112.9	S858 D859 Q860 K866	S858-S862 PolarHBondContact O-N 2.96Å; D859-S862 PolarHBondContact O-N 3.3Å; D859-S862 PolarHBondContact O-OG 2.75Å; Q860-S862 VanDerWaalsContact C-N 3.28Å; Q860-S862 PolarHBondContact O-N 3.45Å; S862-K866 WeakPolarHBondContact O-CB 3.36Å; S862-K866 PolarHBondContact O-N 2.85Å
863	Q	90	Very high	81.3	Confident	107 Å²	107	57.9 Å²	57.9	50%	0.5	29%	0.294	S	S	.	.	H	α-helix	trans	-68.5	-40.6	176.3	-69	174.6	7.2	0	0	112.3	D859 Q860 L861 K866 R867	D859-Q863 WeakPolarHBondContact O-CG 3.48Å; D859-Q863 PolarHBondContact O-N 3.01Å; D859-Q863 VanDerWaalsContact O-N 3.08Å; Q860-Q863 PolarHBondContact O-N 3.26Å; L861-Q863 VanDerWaalsContact C-N 3.34Å; L861-Q863 PolarHBondContact O-N 2.98Å; Q863-K866 PolarHBondContact O-N 2.7Å; Q863-R867 PolarHBondContact O-N 3.25Å
864	V	90.2	Very high	83	Confident	4 Å²	4	60.6 Å²	60.6	2%	0.024	31%	0.306	C	S	.	.	H	α-helix	trans	-67.9	-42.2	176.5	175.5	0	0	0	0	110.9	A844 H845 L848 Q860 L861 K866 R867 L868	A844-V864 HydrophobicContact CB-CG1 4.08Å; H845-V864 HydrophobicContact CB-CG1 3.94Å; L848-V864 HydrophobicContact CD1-CB 4.42Å; L848-V864 HydrophobicContact CD1-CG2 3.83Å; Q860-V864 WeakPolarHBondContact O-CG2 3.5Å; Q860-V864 PolarHBondContact O-N 2.98Å; L861-V864 PolarHBondContact O-N 3.04Å; V864-K866 VanDerWaalsContact C-N 3.32Å; V864-K866 PolarHBondContact O-N 2.69Å; V864-R867 PolarHBondContact O-N 3.42Å; V864-L868 WeakPolarHBondContact O-CB 3.42Å; V864-L868 PolarHBondContact O-N 2.92Å
865	L	91.1	Very high	84.7	Confident	16 Å²	16	54.8 Å²	54.8	8%	0.084	28%	0.281	C	S	.	.	H	α-helix	trans	-60.9	-39.5	173.1	-77.6	170.6	0	0	0	112.3	L861 L868 G869 D917 A920 I921	L861-L865 HydrophobicContact CG-CD1 4.29Å; L861-L865 WeakPolarHBondContact O-CB 3.25Å; L861-L865 WeakPolarHBondContact O-CG 3.48Å; L861-L865 PolarHBondContact O-N 3.06Å; L865-L868 PolarHBondContact O-N 2.87Å; L865-G869 PolarHBondContact O-N 3.3Å; L865-D917 HydrophobicContact CD2-CB 4.16Å; L865-A920 HydrophobicContact CD1-CB 4.28Å; L865-I921 HydrophobicContact CB-CG2 3.72Å; L865-I921 HydrophobicContact CD1-CG2 3.7Å; L865-I921 HydrophobicContact CG-CG2 4.37Å
866	K	93.2	Very high	86.6	Confident	98 Å²	98	47 Å²	47	43%	0.426	24%	0.239	S	C	.	.	H	α-helix	trans	-63.3	-43.9	174.9	-165.7	175.3	-173.8	172.3	0	112.2	S862 Q863 V864 N870 F918 I921	S862-K866 WeakPolarHBondContact O-CB 3.36Å; S862-K866 PolarHBondContact O-N 2.85Å; Q863-K866 PolarHBondContact O-N 2.7Å; V864-K866 VanDerWaalsContact C-N 3.32Å; V864-K866 PolarHBondContact O-N 2.69Å; K866-N870 VanDerWaalsContact O-CG 3.24Å; K866-N870 PolarHBondContact O-N 3.17Å; K866-F918 HydrophobicContact CG-CE1 4.11Å; K866-I921 HydrophobicContact CB-CD1 3.82Å; K866-I921 HydrophobicContact CG-CD1 4.23Å
867	R	93.5	Very high	88.3	Confident	65 Å²	65	41.1 Å²	41.1	25%	0.245	21%	0.213	C	C	.	.	H	α-helix	trans	-61.1	-44.1	172.9	-78.3	170.6	160.9	124.6	-9.7	111.9	D778 Y841 Q863 V864 N870 I871	D778-R867 IonicContact OD1-CZ 3.03Å; D778-R867 IonicContact OD1-NE 2.97Å; D778-R867 PolarHBondContact OD1-NE 3.4Å; D778-R867 IonicContact OD1-NH2 3.6Å; D778-R867 IonicContact OD2-CZ 2.7Å; D778-R867 IonicContact OD2-NE 2.95Å; D778-R867 PolarHBondContact OD2-NE 2.91Å; D778-R867 IonicContact OD2-NH2 3.9Å; D778-R867 PolarHBondContact OD2-NH2 3.4Å; Y841-R867 HydrophobicContact CD1-CB 3.97Å; Y841-R867 HydrophobicContact CD2-CB 4.4Å; Y841-R867 HydrophobicContact CE1-CB 3.85Å; Y841-R867 HydrophobicContact CE1-CG 4.13Å; Y841-R867 HydrophobicContact CE2-CB 4.28Å; Y841-R867 HydrophobicContact CG-CB 4.24Å; Q863-R867 PolarHBondContact O-N 3.25Å; V864-R867 PolarHBondContact O-N 3.42Å; R867-N870 WeakPolarHBondContact O-CB 3.46Å; R867-N870 PolarHBondContact O-N 3.4Å; R867-I871 PolarHBondContact O-N 3.03Å
868	L	93	Very high	90	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.016	22%	0.222	C	C	.	.	H	α-helix	trans	-63.3	-44.4	179.8	-174.6	59.5	0	0	0	111.8	E842 V864 L865 N870 I871 R872	E842-L868 HydrophobicContact CG-CD1 3.7Å; E842-L868 HydrophobicContact CG-CD2 4.43Å; V864-L868 WeakPolarHBondContact O-CB 3.42Å; V864-L868 PolarHBondContact O-N 2.92Å; L865-L868 PolarHBondContact O-N 2.87Å; L868-N870 VanDerWaalsContact C-N 3.35Å; L868-N870 PolarHBondContact O-N 3.4Å; L868-I871 HydrophobicContact CD1-CG2 4.33Å; L868-I871 WeakPolarHBondContact O-CG2 3.44Å; L868-R872 WeakPolarHBondContact O-CB 3.45Å; L868-R872 WeakPolarHBondContact O-CD 3.36Å; L868-R872 WeakPolarHBondContact O-CG 3.48Å; L868-R872 PolarHBondContact O-N 3.34Å
869	G	93.3	Very high	91.3	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.7	-40.2	173.2	0	0	0	0	0	112.8	L865 R872 N873 F918	L865-G869 PolarHBondContact O-N 3.3Å; G869-R872 PolarHBondContact O-N 2.88Å; G869-N873 PolarHBondContact O-N 3.46Å; G869-F918 VanDerWaalsContact CA-CE2 3.44Å
870	N	94.3	Very high	92.1	Very high	66 Å²	66	34 Å²	34	35%	0.353	16%	0.163	S	C	.	.	H	α-helix	trans	-62.8	-52.5	176	-73.3	-12.1	0	0	0	111.9	K866 R867 L868 R872 N873 E874 F918	K866-N870 VanDerWaalsContact O-CG 3.24Å; K866-N870 PolarHBondContact O-N 3.17Å; R867-N870 WeakPolarHBondContact O-CB 3.46Å; R867-N870 PolarHBondContact O-N 3.4Å; L868-N870 VanDerWaalsContact C-N 3.35Å; L868-N870 PolarHBondContact O-N 3.4Å; N870-R872 PolarHBondContact O-N 3.5Å; N870-N873 WeakPolarHBondContact O-CA 3.41Å; N870-N873 VanDerWaalsContact O-CB 3.3Å; N870-N873 WeakPolarHBondContact O-CB 3.49Å; N870-N873 PolarHBondContact O-N 3.5Å; N870-E874 PolarHBondContact O-N 2.84Å; N870-F918 WeakPolarHBondContact OD1-CZ 3.2Å
871	I	95.4	Very high	92.8	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-64.3	-31.5	179.7	-173	63.4	0	0	0	112.1	L781 L834 C838 Y841 R867 L868 N873 E874 M875	L781-I871 HydrophobicContact CD1-CD1 3.9Å; L834-I871 HydrophobicContact CB-CD1 4.16Å; L834-I871 HydrophobicContact CD2-CD1 3.63Å; C838-I871 HydrophobicContact CB-CG1 3.96Å; C838-I871 HydrophobicContact CB-CG2 4.11Å; Y841-I871 HydrophobicContact CD2-CB 4.25Å; Y841-I871 HydrophobicContact CD2-CG2 3.65Å; Y841-I871 HydrophobicContact CE2-CB 4.06Å; Y841-I871 HydrophobicContact CE2-CG2 3.98Å; R867-I871 PolarHBondContact O-N 3.03Å; L868-I871 HydrophobicContact CD1-CG2 4.33Å; L868-I871 WeakPolarHBondContact O-CG2 3.44Å; I871-N873 VanDerWaalsContact C-N 3.33Å; I871-E874 HydrophobicContact CD1-CB 4.46Å; I871-E874 PolarHBondContact O-N 3.2Å; I871-M875 HydrophobicContact CG1-CG 4.47Å; I871-M875 WeakPolarHBondContact O-CB 3.24Å; I871-M875 WeakPolarHBondContact O-CG 3.14Å; I871-M875 PolarHBondContact O-N 3.39Å
872	R	94.9	Very high	93	Very high	23 Å²	23	35.4 Å²	35.4	9%	0.087	17%	0.17	C	C	.	.	H	α-helix	trans	-69.6	-31.5	174.3	-73.5	170.9	170.8	178.1	4.4	111.6	E842 L868 G869 N870 G876 F910 D917	E842-R872 IonicContact OE1-CZ 2.78Å; E842-R872 IonicContact OE1-NE 3.5Å; E842-R872 IonicContact OE1-NH2 2.77Å; E842-R872 PolarHBondContact OE1-NH2 2.93Å; L868-R872 WeakPolarHBondContact O-CB 3.45Å; L868-R872 WeakPolarHBondContact O-CD 3.36Å; L868-R872 WeakPolarHBondContact O-CG 3.48Å; L868-R872 PolarHBondContact O-N 3.34Å; G869-R872 PolarHBondContact O-N 2.88Å; N870-R872 PolarHBondContact O-N 3.5Å; R872-G876 PolarHBondContact O-N 2.95Å; R872-F910 HydrophobicContact CB-CD1 4.5Å; R872-F910 HydrophobicContact CG-CD1 4.18Å; R872-F910 WeakPolarHBondContact O-CB 3.39Å; R872-D917 WeakPolarHBondContact CD-OD2 3.22Å; R872-D917 IonicContact CZ-OD1 3.35Å; R872-D917 IonicContact CZ-OD2 3.21Å; R872-D917 IonicContact NE-OD2 3.78Å; R872-D917 IonicContact NH1-OD1 3.45Å; R872-D917 PolarHBondContact NH1-OD1 3.13Å; R872-D917 IonicContact NH1-OD2 3.43Å; R872-D917 PolarHBondContact NH1-OD2 3.15Å
873	N	94.9	Very high	93.2	Very high	27 Å²	27	33.2 Å²	33.2	14%	0.144	16%	0.155	C	C	.	.	H	α-helix	trans	-63.5	-49.7	166.3	-179.4	75.4	0	0	0	111.3	G869 N870 I871 M875 G876 V877 L930 N933	G869-N873 PolarHBondContact O-N 3.46Å; N870-N873 WeakPolarHBondContact O-CA 3.41Å; N870-N873 VanDerWaalsContact O-CB 3.3Å; N870-N873 WeakPolarHBondContact O-CB 3.49Å; N870-N873 PolarHBondContact O-N 3.5Å; I871-N873 VanDerWaalsContact C-N 3.33Å; N873-M875 PolarHBondContact O-N 2.83Å; N873-G876 PolarHBondContact O-N 3.44Å; N873-G876 VanDerWaalsContact O-N 3.13Å; N873-V877 WeakPolarHBondContact O-CG2 3.38Å; N873-V877 PolarHBondContact O-N 3.49Å; N873-L930 HydrophobicContact CB-CD2 4.01Å; N873-L930 HydrophobicContact CB-CG 4.46Å; N873-N933 PolarHBondContact OD1-ND2 2.68Å
874	E	94.2	Very high	93.1	Very high	65 Å²	65	29.5 Å²	29.5	30%	0.304	14%	0.143	S	C	.	.	H	α-helix	trans	-61.3	-46.1	-179.3	-61.3	-47.4	105.8	0	0	112.4	L781 L834 N870 I871 G876 V877 Y878	L781-E874 HydrophobicContact CD1-CG 4.35Å; L834-E874 HydrophobicContact CD2-CB 4.47Å; N870-E874 PolarHBondContact O-N 2.84Å; I871-E874 HydrophobicContact CD1-CB 4.46Å; I871-E874 PolarHBondContact O-N 3.2Å; E874-G876 VanDerWaalsContact C-N 3.3Å; E874-G876 PolarHBondContact O-N 3.36Å; E874-V877 PolarHBondContact O-N 3.42Å; E874-Y878 WeakPolarHBondContact O-CB 3.46Å; E874-Y878 PolarHBondContact O-N 3.07Å
875	M	93.3	Very high	93	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-58	-41.9	172.6	-76.3	-66.1	-73.8	0	0	112.2	L834 F835 I871 N873 Y878 Y879 F910	L834-M875 HydrophobicContact CB-CG 4.19Å; L834-M875 HydrophobicContact CB-SD 3.29Å; L834-M875 WeakPolarHBondContact CB-SD 3.43Å; L834-M875 HydrophobicContact CD1-SD 4.32Å; L834-M875 HydrophobicContact CG-SD 4.43Å; F835-M875 HydrophobicContact CB-CE 4.26Å; I871-M875 HydrophobicContact CG1-CG 4.47Å; I871-M875 WeakPolarHBondContact O-CB 3.24Å; I871-M875 WeakPolarHBondContact O-CG 3.14Å; I871-M875 PolarHBondContact O-N 3.39Å; N873-M875 PolarHBondContact O-N 2.83Å; M875-Y878 PolarHBondContact O-N 3.01Å; M875-Y879 HydrophobicContact CE-CE2 3.74Å; M875-Y879 WeakPolarHBondContact O-CD2 3.34Å; M875-Y879 PolarHBondContact O-N 2.84Å; M875-F910 HydrophobicContact CB-CB 4.3Å; M875-F910 HydrophobicContact CB-CD1 3.68Å; M875-F910 HydrophobicContact CB-CD2 4.13Å; M875-F910 HydrophobicContact CB-CE1 4Å; M875-F910 HydrophobicContact CB-CE2 4.44Å; M875-F910 HydrophobicContact CB-CG 3.77Å; M875-F910 HydrophobicContact CB-CZ 4.37Å; M875-F910 HydrophobicContact CE-CE1 4.14Å; M875-F910 HydrophobicContact CE-CE2 3.91Å; M875-F910 HydrophobicContact CE-CZ 3.6Å; M875-F910 HydrophobicContact CG-CD1 4.28Å; M875-F910 HydrophobicContact CG-CE1 4.15Å
876	G	94.8	Very high	92.6	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-65.8	-40.9	177.3	0	0	0	0	0	112.7	R872 N873 E874 M880 S907 F911	R872-G876 PolarHBondContact O-N 2.95Å; N873-G876 PolarHBondContact O-N 3.44Å; N873-G876 VanDerWaalsContact O-N 3.13Å; E874-G876 VanDerWaalsContact C-N 3.3Å; E874-G876 PolarHBondContact O-N 3.36Å; G876-M880 VanDerWaalsContact O-CB 3.3Å; G876-M880 WeakPolarHBondContact O-CB 3.48Å; G876-M880 PolarHBondContact O-N 3.06Å; G876-S907 WeakPolarHBondContact O-CB 3.26Å; G876-S907 PolarHBondContact O-OG 3.16Å; G876-F911 VanDerWaalsContact C-CE1 3.42Å; G876-F911 VanDerWaalsContact CA-CE1 3.41Å; G876-F911 WeakPolarHBondContact O-CZ 3.41Å
877	V	94.6	Very high	91.7	Very high	27 Å²	27	31.1 Å²	31.1	16%	0.164	16%	0.159	C	C	.	.	H	α-helix	trans	-68.7	-40.1	176.1	171	0	0	0	0	111.4	N873 E874 M880 N881 F911	N873-V877 WeakPolarHBondContact O-CG2 3.38Å; N873-V877 PolarHBondContact O-N 3.49Å; E874-V877 PolarHBondContact O-N 3.42Å; V877-M880 HydrophobicContact CB-CE 4.47Å; V877-M880 HydrophobicContact CG1-CE 4.28Å; V877-M880 HydrophobicContact CG2-CE 4.19Å; V877-M880 WeakPolarHBondContact O-CB 3.39Å; V877-M880 PolarHBondContact O-N 3.44Å; V877-N881 WeakPolarHBondContact O-CB 3.36Å; V877-N881 VanDerWaalsContact O-CG 3.28Å; V877-N881 PolarHBondContact O-N 3.12Å; V877-F911 HydrophobicContact CG2-CE1 4.17Å; V877-F911 HydrophobicContact CG2-CZ 4.23Å
878	Y	93.6	Very high	90.7	Very high	61 Å²	61	33.5 Å²	33.5	24%	0.239	18%	0.181	C	C	.	.	H	α-helix	trans	-56.7	-53.8	176.7	-179.2	-97.2	0	0	0	111.6	P830 E831 L834 E874 M875 M880 N881 Q882	P830-Y878 HydrophobicContact CB-CE2 4.44Å; E831-Y878 HydrophobicContact CB-CD1 4.5Å; E831-Y878 HydrophobicContact CB-CE1 3.58Å; E831-Y878 HydrophobicContact CG-CD1 4.34Å; E831-Y878 HydrophobicContact CG-CE1 3.7Å; L834-Y878 HydrophobicContact CD1-CD2 4.18Å; L834-Y878 HydrophobicContact CD1-CG 4.2Å; E874-Y878 WeakPolarHBondContact O-CB 3.46Å; E874-Y878 PolarHBondContact O-N 3.07Å; M875-Y878 PolarHBondContact O-N 3.01Å; Y878-M880 VanDerWaalsContact C-N 3.34Å; Y878-M880 PolarHBondContact O-N 3.15Å; Y878-N881 PolarHBondContact O-N 2.95Å; Y878-Q882 HydrophobicContact CE1-CG 4.22Å; Y878-Q882 VanDerWaalsContact CZ-NE2 3.3Å; Y878-Q882 PolarHBondContact O-N 3.25Å; Y878-Q882 PolarHBondContact OH-NE2 3.49Å
879	Y	94.6	Very high	89.6	Confident	13 Å²	13	40.8 Å²	40.8	5%	0.051	22%	0.215	C	C	.	.	H	α-helix	trans	-67.4	-30.9	176.2	-67.8	-54	0	0	0	113.7	E831 M875 A883 L903 K906 F910	E831-Y879 VanDerWaalsContact CD-CE1 3.48Å; E831-Y879 HydrophobicContact CG-CE1 4.17Å; E831-Y879 WeakPolarHBondContact OE1-CE1 3.43Å; E831-Y879 VanDerWaalsContact OE1-CZ 3.29Å; E831-Y879 PolarHBondContact OE1-OH 2.87Å; M875-Y879 HydrophobicContact CE-CE2 3.74Å; M875-Y879 WeakPolarHBondContact O-CD2 3.34Å; M875-Y879 PolarHBondContact O-N 2.84Å; Y879-A883 WeakPolarHBondContact O-CB 3.35Å; Y879-A883 PolarHBondContact O-N 3.04Å; Y879-L903 HydrophobicContact CD1-CD2 3.72Å; Y879-L903 HydrophobicContact CE1-CD2 4.37Å; Y879-K906 HydrophobicContact CD1-CD 4.43Å; Y879-K906 HydrophobicContact CD2-CB 3.75Å; Y879-K906 HydrophobicContact CE1-CD 4.13Å; Y879-K906 HydrophobicContact CE2-CB 4Å; Y879-K906 HydrophobicContact CE2-CD 4.4Å; Y879-K906 HydrophobicContact CG-CB 4.06Å; Y879-F910 HydrophobicContact CD2-CD2 4.04Å; Y879-F910 HydrophobicContact CD2-CE2 4.19Å; Y879-F910 AromaticContact CE2-CD2 3.94Å; Y879-F910 HydrophobicContact CE2-CD2 3.94Å; Y879-F910 AromaticContact CE2-CE2 3.61Å; Y879-F910 HydrophobicContact CE2-CE2 3.61Å
880	M	94.1	Very high	88.2	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64.3	-41.8	172.9	179.8	-179.7	65.8	0	0	111.4	G876 V877 Y878 A883 A884 F911 R936 L937 I940	G876-M880 VanDerWaalsContact O-CB 3.3Å; G876-M880 WeakPolarHBondContact O-CB 3.48Å; G876-M880 PolarHBondContact O-N 3.06Å; V877-M880 HydrophobicContact CB-CE 4.47Å; V877-M880 HydrophobicContact CG1-CE 4.28Å; V877-M880 HydrophobicContact CG2-CE 4.19Å; V877-M880 WeakPolarHBondContact O-CB 3.39Å; V877-M880 PolarHBondContact O-N 3.44Å; Y878-M880 VanDerWaalsContact C-N 3.34Å; Y878-M880 PolarHBondContact O-N 3.15Å; M880-A883 PolarHBondContact O-N 3.43Å; M880-A884 PolarHBondContact O-N 3.35Å; M880-F911 HydrophobicContact SD-CZ 4.5Å; M880-R936 HydrophobicContact CE-CG 4.29Å; M880-R936 HydrophobicContact SD-CB 3.99Å; M880-R936 HydrophobicContact SD-CG 3.86Å; M880-L937 HydrophobicContact CB-CD1 4.23Å; M880-L937 HydrophobicContact CG-CB 4.29Å; M880-L937 HydrophobicContact CG-CD1 4.02Å; M880-L937 HydrophobicContact SD-CB 4.03Å; M880-I940 HydrophobicContact CG-CD1 3.43Å; M880-I940 VanDerWaalsContact CG-CD1 3.43Å; M880-I940 HydrophobicContact SD-CD1 4.03Å
881	N	93.2	Very high	86.1	Confident	71 Å²	71	49.5 Å²	49.5	38%	0.38	25%	0.253	S	S	.	.	H	α-helix	trans	-71.5	-40.8	178.6	-70.7	-13.6	0	0	0	111.6	V877 Y878 A883 A884 A885	V877-N881 WeakPolarHBondContact O-CB 3.36Å; V877-N881 VanDerWaalsContact O-CG 3.28Å; V877-N881 PolarHBondContact O-N 3.12Å; Y878-N881 PolarHBondContact O-N 2.95Å; N881-A883 VanDerWaalsContact C-N 3.3Å; N881-A883 PolarHBondContact O-N 2.81Å; N881-A884 PolarHBondContact O-N 3.14Å; N881-A884 VanDerWaalsContact O-N 3.16Å; N881-A885 PolarHBondContact O-N 2.66Å
882	Q	90.9	Very high	84	Confident	51 Å²	51	56 Å²	56	24%	0.238	29%	0.293	C	S	.	.	H	α-helix	trans	-56.1	-44.6	169.1	-74.9	-171.2	-9.3	0	0	111.4	E831 Y878 A884 A885 M886 L903	E831-Q882 PolarHBondContact OE2-NE2 3.12Å; Y878-Q882 HydrophobicContact CE1-CG 4.22Å; Y878-Q882 VanDerWaalsContact CZ-NE2 3.3Å; Y878-Q882 PolarHBondContact O-N 3.25Å; Y878-Q882 PolarHBondContact OH-NE2 3.49Å; Q882-A884 VanDerWaalsContact C-N 3.32Å; Q882-A884 PolarHBondContact O-N 3.17Å; Q882-A885 PolarHBondContact O-N 3.46Å; Q882-M886 WeakPolarHBondContact O-CG 3.48Å; Q882-M886 PolarHBondContact O-N 3.14Å; Q882-L903 HydrophobicContact CB-CD1 4.05Å
883	A	89.1	Confident	82	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-64.8	-34.1	177.6	0	0	0	0	0	112.8	Y879 M880 N881 Q887 L903 I940	Y879-A883 WeakPolarHBondContact O-CB 3.35Å; Y879-A883 PolarHBondContact O-N 3.04Å; M880-A883 PolarHBondContact O-N 3.43Å; N881-A883 VanDerWaalsContact C-N 3.3Å; N881-A883 PolarHBondContact O-N 2.81Å; A883-Q887 WeakPolarHBondContact O-CG 3.28Å; A883-L903 HydrophobicContact CB-CB 4.1Å; A883-L903 HydrophobicContact CB-CD1 4.29Å; A883-I940 HydrophobicContact CB-CG2 4.46Å
884	A	89.1	Confident	80.3	Confident	29 Å²	29	70.6 Å²	70.6	24%	0.24	36%	0.355	C	S	.	.	H	α-helix	trans	-70.4	-42	174	0	0	0	0	0	112.5	M880 N881 Q882 M886 Q887 T888 I940	M880-A884 PolarHBondContact O-N 3.35Å; N881-A884 PolarHBondContact O-N 3.14Å; N881-A884 VanDerWaalsContact O-N 3.16Å; Q882-A884 VanDerWaalsContact C-N 3.32Å; Q882-A884 PolarHBondContact O-N 3.17Å; A884-M886 VanDerWaalsContact C-N 3.31Å; A884-M886 PolarHBondContact O-N 2.91Å; A884-Q887 WeakPolarHBondContact O-CA 3.29Å; A884-Q887 WeakPolarHBondContact O-CB 3.38Å; A884-Q887 PolarHBondContact O-N 3.35Å; A884-T888 PolarHBondContact O-N 2.86Å; A884-I940 HydrophobicContact CB-CD1 4.15Å
885	A	87.8	Confident	78.9	Confident	43 Å²	43	72 Å²	72	36%	0.355	37%	0.372	S	S	.	.	H	α-helix	trans	-60.6	-41.1	174.7	0	0	0	0	0	111.7	N881 Q882 Q887 T888 E889	N881-A885 PolarHBondContact O-N 2.66Å; Q882-A885 PolarHBondContact O-N 3.46Å; A885-Q887 PolarHBondContact O-N 3.19Å; A885-T888 WeakPolarHBondContact CA-OG1 3.3Å; A885-T888 PolarHBondContact O-N 3.25Å; A885-T888 PolarHBondContact O-OG1 2.98Å; A885-E889 PolarHBondContact O-N 2.99Å; A885-E889 VanDerWaalsContact O-N 3.14Å
886	M	82.4	Confident	78.2	Confident	72 Å²	72	73.1 Å²	73.1	36%	0.355	38%	0.379	S	S	.	.	H	α-helix	trans	-62.8	-6.9	170.8	-73.1	-165.6	-174.4	0	0	114.3	Q882 A884 K890 L903	Q882-M886 WeakPolarHBondContact O-CG 3.48Å; Q882-M886 PolarHBondContact O-N 3.14Å; A884-M886 VanDerWaalsContact C-N 3.31Å; A884-M886 PolarHBondContact O-N 2.91Å; M886-K890 WeakPolarHBondContact O-CD 3.46Å; M886-K890 WeakPolarHBondContact O-CE 3.38Å; M886-K890 WeakPolarHBondContact O-CG 3.4Å; M886-K890 PolarHBondContact O-NZ 3.08Å; M886-L903 HydrophobicContact CE-CD1 3.71Å; M886-L903 HydrophobicContact SD-CD1 3.64Å
887	Q	74.7	Confident	77.6	Confident	37 Å²	37	75.4 Å²	75.4	17%	0.173	40%	0.395	C	S	.	.	H	α-helix	trans	-96.7	-40.3	171.6	-67.4	175.2	11.5	0	0	111.8	A883 A884 A885 E889 K890 E900 I940	A883-Q887 WeakPolarHBondContact O-CG 3.28Å; A884-Q887 WeakPolarHBondContact O-CA 3.29Å; A884-Q887 WeakPolarHBondContact O-CB 3.38Å; A884-Q887 PolarHBondContact O-N 3.35Å; A885-Q887 PolarHBondContact O-N 3.19Å; Q887-E889 VanDerWaalsContact C-N 3.3Å; Q887-E889 PolarHBondContact O-N 3.45Å; Q887-K890 PolarHBondContact O-N 3.31Å; Q887-E900 WeakPolarHBondContact CG-OE1 3.39Å; Q887-E900 PolarHBondContact NE2-OE1 3.25Å; Q887-E900 VanDerWaalsContact NE2-OE1 3.12Å; Q887-I940 VanDerWaalsContact NE2-CG2 3.26Å; Q887-I940 PolarHBondContact NE2-O 2.96Å; Q887-I940 PolarHBondContact OE1-O 3.37Å
888	T	73.6	Confident	77.1	Confident	116 Å²	116	78 Å²	78	71%	0.712	42%	0.419	S	S	*	.	H	α-helix	trans	-64.8	-33	176.6	43.1	0	0	0	0	112.8	A884 A885 K890	A884-T888 PolarHBondContact O-N 2.86Å; A885-T888 WeakPolarHBondContact CA-OG1 3.3Å; A885-T888 PolarHBondContact O-N 3.25Å; A885-T888 PolarHBondContact O-OG1 2.98Å; T888-K890 VanDerWaalsContact C-N 3.34Å; T888-K890 PolarHBondContact O-N 2.93Å
889	E	68.6	Low	76.7	Confident	156 Å²	156	77.7 Å²	77.7	73%	0.729	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-15.6	176.1	-67.2	178.6	178	0	0	114.1	A885 Q887 Q891	A885-E889 PolarHBondContact O-N 2.99Å; A885-E889 VanDerWaalsContact O-N 3.14Å; Q887-E889 VanDerWaalsContact C-N 3.3Å; Q887-E889 PolarHBondContact O-N 3.45Å; E889-Q891 PolarHBondContact O-N 3.49Å
890	K	63.4	Low	76.2	Confident	65 Å²	65	77 Å²	77	28%	0.283	43%	0.427	S	S	.	.			trans	-84.4	77.2	-176.2	-78.1	173.2	-167.9	136.4	0	112.7	M886 Q887 T888 V892 E900	M886-K890 WeakPolarHBondContact O-CD 3.46Å; M886-K890 WeakPolarHBondContact O-CE 3.38Å; M886-K890 WeakPolarHBondContact O-CG 3.4Å; M886-K890 PolarHBondContact O-NZ 3.08Å; Q887-K890 PolarHBondContact O-N 3.31Å; T888-K890 VanDerWaalsContact C-N 3.34Å; T888-K890 PolarHBondContact O-N 2.93Å; K890-V892 VanDerWaalsContact C-N 3.34Å; K890-E900 IonicContact NZ-OE1 2.68Å; K890-E900 PolarHBondContact NZ-OE1 2.85Å; K890-E900 IonicContact NZ-OE2 3.58Å; K890-E900 PolarHBondContact NZ-OE2 3.44Å
891	Q	51.2	Low	76	Confident	183 Å²	183	80.7 Å²	80.7	86%	0.855	44%	0.444	S	S	*	.	S	Bend	trans	-77.8	-13.6	165.8	-69.6	-167.8	-5.3	0	0	114.1	E889	E889-Q891 PolarHBondContact O-N 3.49Å
892	V	51.6	Low	75.9	Confident	138 Å²	138	80.8 Å²	80.8	84%	0.836	44%	0.444	S	S	*	.	S	Bend	trans	-145.9	39	-167.8	-149.5	0	0	0	0	116.8	K890	K890-V892 VanDerWaalsContact C-N 3.34Å
893	K	52.7	Low	76	Confident	166 Å²	166	78.8 Å²	78.8	72%	0.722	44%	0.435	S	S	*	.			trans	-128.6	131.8	172.1	-77	-176.6	-179.5	170.7	0	113.7	S895	K893-S895 PolarHBondContact O-N 3.24Å
894	K	58.2	Low	76.2	Confident	189 Å²	189	79.6 Å²	79.6	82%	0.822	44%	0.438	S	S	*	.	S	Bend	trans	-79.2	-5.1	-170.8	-76	-177.2	173.2	178.3	0	116.3
895	S	66.1	Low	76.4	Confident	94 Å²	94	84.7 Å²	84.7	66%	0.657	46%	0.455	S	S	*	.	S	Bend	trans	-158.4	154.4	-174.8	60.9	0	0	0	0	112.1	K893	K893-S895 PolarHBondContact O-N 3.24Å
896	V	77.4	Confident	76.7	Confident	25 Å²	25	86.1 Å²	86.1	15%	0.152	45%	0.453	C	S	.	.			trans	-50.6	135.9	170.3	-174	0	0	0	0	110.7	E900 Q901 W904 A944	V896-E900 HydrophobicContact CG1-CG 4.43Å; V896-Q901 HydrophobicContact CG1-CG 3.66Å; V896-W904 HydrophobicContact CB-CH2 4.49Å; V896-W904 HydrophobicContact CG1-CH2 3.43Å; V896-W904 VanDerWaalsContact CG1-CH2 3.43Å; V896-W904 HydrophobicContact CG1-CZ2 4.16Å; V896-W904 HydrophobicContact CG1-CZ3 3.83Å; V896-W904 HydrophobicContact CG2-CH2 4.18Å; V896-A944 HydrophobicContact CG2-CB 4.09Å; V896-A944 WeakPolarHBondContact CG2-O 3.42Å
897	S	82.6	Confident	77.4	Confident	47 Å²	47	82.7 Å²	82.7	33%	0.329	44%	0.436	S	S	.	.			trans	-86	148	178.9	-177	0	0	0	0	111.7	A899 E900 Q901	S897-A899 PolarHBondContact O-N 3.13Å; S897-A899 PolarHBondContact OG-N 3.18Å; S897-E900 PolarHBondContact N-OE2 3.38Å; S897-E900 PolarHBondContact O-N 2.96Å; S897-Q901 PolarHBondContact O-N 2.99Å; S897-Q901 VanDerWaalsContact O-N 3.09Å
898	A	84.3	Confident	78.4	Confident	81 Å²	81	83.8 Å²	83.8	67%	0.669	44%	0.441	S	S	*	.	H	α-helix	trans	-59.1	-35.4	171.5	0	0	0	0	0	112.3	Q901 D902	A898-Q901 PolarHBondContact O-N 3.43Å; A898-D902 PolarHBondContact O-N 2.92Å; A898-D902 VanDerWaalsContact O-N 3.08Å
899	A	84.8	Confident	79.5	Confident	55 Å²	55	80.6 Å²	80.6	46%	0.455	42%	0.423	S	S	.	.	H	α-helix	trans	-66.5	-36.9	176.5	0	0	0	0	0	112.6	S897 D902 L903	S897-A899 PolarHBondContact O-N 3.13Å; S897-A899 PolarHBondContact OG-N 3.18Å; A899-D902 WeakPolarHBondContact O-CB 3.34Å; A899-D902 PolarHBondContact O-N 3.02Å; A899-L903 PolarHBondContact O-N 3.06Å; A899-L903 VanDerWaalsContact O-N 3.11Å
900	E	85.7	Confident	80.8	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	40%	0.395	C	S	.	.	H	α-helix	trans	-70	-39.8	177	172.7	-179.5	-144.8	0	0	111.4	Q887 K890 V896 S897 D902 L903 W904 A944	Q887-E900 WeakPolarHBondContact CG-OE1 3.39Å; Q887-E900 PolarHBondContact NE2-OE1 3.25Å; Q887-E900 VanDerWaalsContact NE2-OE1 3.12Å; K890-E900 IonicContact NZ-OE1 2.68Å; K890-E900 PolarHBondContact NZ-OE1 2.85Å; K890-E900 IonicContact NZ-OE2 3.58Å; K890-E900 PolarHBondContact NZ-OE2 3.44Å; V896-E900 HydrophobicContact CG1-CG 4.43Å; S897-E900 PolarHBondContact N-OE2 3.38Å; S897-E900 PolarHBondContact O-N 2.96Å; E900-D902 PolarHBondContact O-N 3.14Å; E900-L903 PolarHBondContact O-N 3.15Å; E900-W904 VanDerWaalsContact CD-CZ2 3.5Å; E900-W904 HydrophobicContact CG-CD2 4.35Å; E900-W904 VanDerWaalsContact CG-CE2 3.49Å; E900-W904 HydrophobicContact CG-CH2 4.31Å; E900-W904 HydrophobicContact CG-CZ2 3.46Å; E900-W904 VanDerWaalsContact CG-CZ2 3.46Å; E900-W904 VanDerWaalsContact O-CG 3.26Å; E900-W904 PolarHBondContact O-N 3.01Å; E900-A944 WeakPolarHBondContact OE1-CB 3.49Å
901	Q	89.1	Confident	82.4	Confident	77 Å²	77	71.5 Å²	71.5	36%	0.36	38%	0.381	S	S	.	.	H	α-helix	trans	-63.9	-29.6	172.3	-66	-178.8	7.3	0	0	112.7	V896 S897 A898 W904 K905	V896-Q901 HydrophobicContact CG1-CG 3.66Å; S897-Q901 PolarHBondContact O-N 2.99Å; S897-Q901 VanDerWaalsContact O-N 3.09Å; A898-Q901 PolarHBondContact O-N 3.43Å; Q901-W904 HydrophobicContact CB-CE3 4.46Å; Q901-W904 HydrophobicContact CG-CE3 4.06Å; Q901-W904 HydrophobicContact CG-CZ3 3.99Å; Q901-K905 WeakPolarHBondContact O-CD 3.21Å; Q901-K905 VanDerWaalsContact O-CG 3.24Å; Q901-K905 WeakPolarHBondContact O-CG 3.42Å; Q901-K905 PolarHBondContact O-N 3.41Å; Q901-K905 VanDerWaalsContact O-N 3.11Å
902	D	91.7	Very high	84.5	Confident	72 Å²	72	66.6 Å²	66.6	39%	0.385	36%	0.358	S	S	.	.	H	α-helix	trans	-68.5	-45.2	173.6	-169.2	62.7	0	0	0	111.4	A898 A899 E900 W904 K905 K906	A898-D902 PolarHBondContact O-N 2.92Å; A898-D902 VanDerWaalsContact O-N 3.08Å; A899-D902 WeakPolarHBondContact O-CB 3.34Å; A899-D902 PolarHBondContact O-N 3.02Å; E900-D902 PolarHBondContact O-N 3.14Å; D902-W904 VanDerWaalsContact C-N 3.33Å; D902-W904 PolarHBondContact O-N 3.36Å; D902-K905 PolarHBondContact O-N 3.27Å; D902-K905 VanDerWaalsContact O-N 3.17Å; D902-K906 WeakPolarHBondContact O-CG 2.88Å; D902-K906 PolarHBondContact O-N 2.94Å; D902-K906 WeakPolarHBondContact OD2-CE 3.4Å; D902-K906 IonicContact OD2-NZ 2.68Å; D902-K906 PolarHBondContact OD2-NZ 3.35Å
903	L	92.4	Very high	86.5	Confident	10 Å²	10	63.9 Å²	63.9	5%	0.052	34%	0.335	C	S	.	.	H	α-helix	trans	-58.4	-42.5	173.2	-65.8	177.3	0	0	0	112.4	Y879 Q882 A883 M886 A899 E900 K905 K906 S907	Y879-L903 HydrophobicContact CD1-CD2 3.72Å; Y879-L903 HydrophobicContact CE1-CD2 4.37Å; Q882-L903 HydrophobicContact CB-CD1 4.05Å; A883-L903 HydrophobicContact CB-CB 4.1Å; A883-L903 HydrophobicContact CB-CD1 4.29Å; M886-L903 HydrophobicContact CE-CD1 3.71Å; M886-L903 HydrophobicContact SD-CD1 3.64Å; A899-L903 PolarHBondContact O-N 3.06Å; A899-L903 VanDerWaalsContact O-N 3.11Å; E900-L903 PolarHBondContact O-N 3.15Å; L903-K905 PolarHBondContact O-N 2.7Å; L903-K906 PolarHBondContact O-N 2.88Å; L903-S907 WeakPolarHBondContact O-CB 3.41Å; L903-S907 PolarHBondContact O-N 3.26Å
904	W	93.3	Very high	88.6	Confident	16 Å²	16	56 Å²	56	6%	0.061	30%	0.301	C	S	.	.	H	α-helix	trans	-62.1	-42.8	175.2	-58.6	-17.2	0	0	0	112.4	V896 E900 Q901 D902 F908 C941 A944	V896-W904 HydrophobicContact CB-CH2 4.49Å; V896-W904 HydrophobicContact CG1-CH2 3.43Å; V896-W904 VanDerWaalsContact CG1-CH2 3.43Å; V896-W904 HydrophobicContact CG1-CZ2 4.16Å; V896-W904 HydrophobicContact CG1-CZ3 3.83Å; V896-W904 HydrophobicContact CG2-CH2 4.18Å; E900-W904 VanDerWaalsContact CD-CZ2 3.5Å; E900-W904 HydrophobicContact CG-CD2 4.35Å; E900-W904 VanDerWaalsContact CG-CE2 3.49Å; E900-W904 HydrophobicContact CG-CH2 4.31Å; E900-W904 HydrophobicContact CG-CZ2 3.46Å; E900-W904 VanDerWaalsContact CG-CZ2 3.46Å; E900-W904 VanDerWaalsContact O-CG 3.26Å; E900-W904 PolarHBondContact O-N 3.01Å; Q901-W904 HydrophobicContact CB-CE3 4.46Å; Q901-W904 HydrophobicContact CG-CE3 4.06Å; Q901-W904 HydrophobicContact CG-CZ3 3.99Å; D902-W904 VanDerWaalsContact C-N 3.33Å; D902-W904 PolarHBondContact O-N 3.36Å; W904-F908 VanDerWaalsContact O-CB 3.23Å; W904-F908 WeakPolarHBondContact O-CB 3.46Å; W904-F908 PolarHBondContact O-N 3.36Å; W904-C941 HydrophobicContact CD2-CB 4.37Å; W904-C941 HydrophobicContact CE3-CB 4.3Å; W904-C941 HydrophobicContact CH2-CB 4.28Å; W904-C941 HydrophobicContact CZ2-CB 4.33Å; W904-C941 HydrophobicContact CZ3-CB 4.25Å; W904-A944 HydrophobicContact CH2-CB 3.65Å; W904-A944 HydrophobicContact CZ2-CB 3.45Å; W904-A944 VanDerWaalsContact CZ2-CB 3.45Å
905	K	94.1	Very high	90.3	Very high	136 Å²	136	48 Å²	48	59%	0.591	27%	0.266	S	S	*	.	H	α-helix	trans	-65.8	-41.2	177.7	-73.8	167.2	-173.2	171.3	0	111.9	Q901 D902 L903 S909	Q901-K905 WeakPolarHBondContact O-CD 3.21Å; Q901-K905 VanDerWaalsContact O-CG 3.24Å; Q901-K905 WeakPolarHBondContact O-CG 3.42Å; Q901-K905 PolarHBondContact O-N 3.41Å; Q901-K905 VanDerWaalsContact O-N 3.11Å; D902-K905 PolarHBondContact O-N 3.27Å; D902-K905 VanDerWaalsContact O-N 3.17Å; L903-K905 PolarHBondContact O-N 2.7Å; K905-S909 VanDerWaalsContact O-CB 3.27Å; K905-S909 WeakPolarHBondContact O-CB 3.38Å; K905-S909 PolarHBondContact O-N 3.07Å
906	K	93.8	Very high	91.7	Very high	73 Å²	73	48.8 Å²	48.8	32%	0.317	26%	0.258	S	S	.	.	H	α-helix	trans	-59.7	-57.7	173.4	-76.3	167.8	169.6	161.6	0	110.4	Y879 D902 L903 F908 S909 F910	Y879-K906 HydrophobicContact CD1-CD 4.43Å; Y879-K906 HydrophobicContact CD2-CB 3.75Å; Y879-K906 HydrophobicContact CE1-CD 4.13Å; Y879-K906 HydrophobicContact CE2-CB 4Å; Y879-K906 HydrophobicContact CE2-CD 4.4Å; Y879-K906 HydrophobicContact CG-CB 4.06Å; D902-K906 WeakPolarHBondContact O-CG 2.88Å; D902-K906 PolarHBondContact O-N 2.94Å; D902-K906 WeakPolarHBondContact OD2-CE 3.4Å; D902-K906 IonicContact OD2-NZ 2.68Å; D902-K906 PolarHBondContact OD2-NZ 3.35Å; L903-K906 PolarHBondContact O-N 2.88Å; K906-F908 VanDerWaalsContact C-N 3.34Å; K906-F908 PolarHBondContact O-N 2.72Å; K906-S909 PolarHBondContact O-N 2.91Å; K906-S909 VanDerWaalsContact O-N 3.07Å; K906-F910 VanDerWaalsContact O-CD2 3.22Å; K906-F910 WeakPolarHBondContact O-CD2 3.13Å; K906-F910 PolarHBondContact O-N 2.89Å
907	S	96.1	Very high	92.4	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-51.7	-50.4	178.4	-179.7	0	0	0	0	112	G876 L903 S909 F910 F911	G876-S907 WeakPolarHBondContact O-CB 3.26Å; G876-S907 PolarHBondContact O-OG 3.16Å; L903-S907 WeakPolarHBondContact O-CB 3.41Å; L903-S907 PolarHBondContact O-N 3.26Å; S907-S909 PolarHBondContact O-N 3.32Å; S907-F910 PolarHBondContact O-N 3.4Å; S907-F911 WeakPolarHBondContact O-CD2 3.47Å; S907-F911 WeakPolarHBondContact O-CG 3.34Å; S907-F911 PolarHBondContact O-N 2.88Å; S907-F911 VanDerWaalsContact OG-CE2 3.32Å; S907-F911 WeakPolarHBondContact OG-CE2 3.33Å
908	F	95.9	Very high	93	Very high	61 Å²	61	46.1 Å²	46.1	27%	0.268	24%	0.239	S	C	.	.	H	α-helix	trans	-61.8	-42.4	177	-173.4	-91.7	0	0	0	113.2	W904 K906 F910 F911 E912 T934 L937 M938 Y971	W904-F908 VanDerWaalsContact O-CB 3.23Å; W904-F908 WeakPolarHBondContact O-CB 3.46Å; W904-F908 PolarHBondContact O-N 3.36Å; K906-F908 VanDerWaalsContact C-N 3.34Å; K906-F908 PolarHBondContact O-N 2.72Å; F908-F910 VanDerWaalsContact C-N 3.31Å; F908-F910 PolarHBondContact O-N 2.89Å; F908-F911 PolarHBondContact O-N 3.46Å; F908-E912 HydrophobicContact CE1-CB 4.46Å; F908-E912 WeakPolarHBondContact O-CB 3.46Å; F908-E912 PolarHBondContact O-N 2.83Å; F908-T934 HydrophobicContact CD2-CG2 3.97Å; F908-T934 HydrophobicContact CE2-CG2 3.86Å; F908-L937 HydrophobicContact CB-CD2 4.07Å; F908-M938 HydrophobicContact CD2-CE 4.21Å; F908-Y971 WeakPolarHBondContact CE2-OH 3.44Å
909	S	96.2	Very high	93.4	Very high	49 Å²	49	48 Å²	48	34%	0.343	24%	0.235	S	C	.	.	H	α-helix	trans	-63.5	-36	177.7	179.2	0	0	0	0	112.4	K905 K906 S907 K913	K905-S909 VanDerWaalsContact O-CB 3.27Å; K905-S909 WeakPolarHBondContact O-CB 3.38Å; K905-S909 PolarHBondContact O-N 3.07Å; K906-S909 PolarHBondContact O-N 2.91Å; K906-S909 VanDerWaalsContact O-N 3.07Å; S907-S909 PolarHBondContact O-N 3.32Å; S909-K913 WeakPolarHBondContact O-CB 3.21Å; S909-K913 VanDerWaalsContact O-CG 3.28Å; S909-K913 WeakPolarHBondContact O-CG 3.38Å; S909-K913 PolarHBondContact O-N 3.23Å
910	F	96.3	Very high	93.7	Very high	30 Å²	30	48.8 Å²	48.8	13%	0.132	24%	0.241	C	C	.	.	H	α-helix	trans	-70.2	-43.4	175.3	-81.3	-72.9	0	0	0	111.1	R872 M875 Y879 K906 S907 F908 E912 K913 G914	R872-F910 HydrophobicContact CB-CD1 4.5Å; R872-F910 HydrophobicContact CG-CD1 4.18Å; R872-F910 WeakPolarHBondContact O-CB 3.39Å; M875-F910 HydrophobicContact CB-CB 4.3Å; M875-F910 HydrophobicContact CB-CD1 3.68Å; M875-F910 HydrophobicContact CB-CD2 4.13Å; M875-F910 HydrophobicContact CB-CE1 4Å; M875-F910 HydrophobicContact CB-CE2 4.44Å; M875-F910 HydrophobicContact CB-CG 3.77Å; M875-F910 HydrophobicContact CB-CZ 4.37Å; M875-F910 HydrophobicContact CE-CE1 4.14Å; M875-F910 HydrophobicContact CE-CE2 3.91Å; M875-F910 HydrophobicContact CE-CZ 3.6Å; M875-F910 HydrophobicContact CG-CD1 4.28Å; M875-F910 HydrophobicContact CG-CE1 4.15Å; Y879-F910 HydrophobicContact CD2-CD2 4.04Å; Y879-F910 HydrophobicContact CD2-CE2 4.19Å; Y879-F910 AromaticContact CE2-CD2 3.94Å; Y879-F910 HydrophobicContact CE2-CD2 3.94Å; Y879-F910 AromaticContact CE2-CE2 3.61Å; Y879-F910 HydrophobicContact CE2-CE2 3.61Å; K906-F910 VanDerWaalsContact O-CD2 3.22Å; K906-F910 WeakPolarHBondContact O-CD2 3.13Å; K906-F910 PolarHBondContact O-N 2.89Å; S907-F910 PolarHBondContact O-N 3.4Å; F908-F910 VanDerWaalsContact C-N 3.31Å; F908-F910 PolarHBondContact O-N 2.89Å; F910-E912 PolarHBondContact O-N 3.04Å; F910-K913 PolarHBondContact O-N 2.95Å; F910-G914 PolarHBondContact O-N 3.5Å
911	F	96.6	Very high	94	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.3	-43	175.2	-63.4	-31.5	0	0	0	113	G876 V877 M880 S907 F908 K913 G914 M915 L930 N933 T934 L937	G876-F911 VanDerWaalsContact C-CE1 3.42Å; G876-F911 VanDerWaalsContact CA-CE1 3.41Å; G876-F911 WeakPolarHBondContact O-CZ 3.41Å; V877-F911 HydrophobicContact CG2-CE1 4.17Å; V877-F911 HydrophobicContact CG2-CZ 4.23Å; M880-F911 HydrophobicContact SD-CZ 4.5Å; S907-F911 WeakPolarHBondContact O-CD2 3.47Å; S907-F911 WeakPolarHBondContact O-CG 3.34Å; S907-F911 PolarHBondContact O-N 2.88Å; S907-F911 VanDerWaalsContact OG-CE2 3.32Å; S907-F911 WeakPolarHBondContact OG-CE2 3.33Å; F908-F911 PolarHBondContact O-N 3.46Å; F911-K913 PolarHBondContact O-N 3.41Å; F911-G914 PolarHBondContact O-N 2.81Å; F911-M915 WeakPolarHBondContact O-CG 3.27Å; F911-M915 PolarHBondContact O-N 3.23Å; F911-L930 HydrophobicContact CB-CD2 4.07Å; F911-L930 HydrophobicContact CD1-CD2 3.54Å; F911-L930 HydrophobicContact CE1-CD2 4.39Å; F911-L930 HydrophobicContact CG-CD2 4.18Å; F911-N933 HydrophobicContact CE1-CB 3.95Å; F911-N933 HydrophobicContact CE2-CB 4.13Å; F911-N933 HydrophobicContact CZ-CB 3.67Å; F911-T934 WeakPolarHBondContact CB-OG1 3.21Å; F911-T934 WeakPolarHBondContact CD2-OG1 2.98Å; F911-L937 HydrophobicContact CD2-CD2 4.36Å; F911-L937 HydrophobicContact CE2-CB 4.28Å; F911-L937 HydrophobicContact CE2-CD2 4.27Å
912	E	95.7	Very high	94	Very high	80 Å²	80	58.1 Å²	58.1	37%	0.374	28%	0.276	S	S	.	.	H	α-helix	trans	-63.6	-39.6	178	-162.4	-153.9	-119.2	0	0	112.4	F908 F910 M915 K916	F908-E912 HydrophobicContact CE1-CB 4.46Å; F908-E912 WeakPolarHBondContact O-CB 3.46Å; F908-E912 PolarHBondContact O-N 2.83Å; F910-E912 PolarHBondContact O-N 3.04Å; E912-M915 HydrophobicContact CB-CE 4.49Å; E912-K916 VanDerWaalsContact CD-NZ 3.34Å; E912-K916 WeakPolarHBondContact O-CG 3.23Å; E912-K916 PolarHBondContact O-N 3.3Å; E912-K916 IonicContact OE2-NZ 3.36Å; E912-K916 PolarHBondContact OE2-NZ 3.05Å
913	K	94.5	Very high	94	Very high	80 Å²	80	56 Å²	56	35%	0.348	27%	0.265	S	S	.	.	H	α-helix	trans	-65.7	-46.3	174	-75.7	178.4	178.2	-172.8	0	111.8	S909 F910 F911 M915 K916 D917	S909-K913 WeakPolarHBondContact O-CB 3.21Å; S909-K913 VanDerWaalsContact O-CG 3.28Å; S909-K913 WeakPolarHBondContact O-CG 3.38Å; S909-K913 PolarHBondContact O-N 3.23Å; F910-K913 PolarHBondContact O-N 2.95Å; F911-K913 PolarHBondContact O-N 3.41Å; K913-M915 VanDerWaalsContact C-N 3.32Å; K913-M915 PolarHBondContact O-N 2.91Å; K913-K916 WeakPolarHBondContact O-CB 3.44Å; K913-K916 PolarHBondContact O-N 3.35Å; K913-K916 VanDerWaalsContact O-N 3.14Å; K913-D917 PolarHBondContact O-N 3.06Å
914	G	95	Very high	93.9	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60.5	-39.1	178.3	0	0	0	0	0	112.8	F910 F911 K916 D917 F918	F910-G914 PolarHBondContact O-N 3.5Å; F911-G914 PolarHBondContact O-N 2.81Å; G914-K916 VanDerWaalsContact C-N 3.33Å; G914-K916 PolarHBondContact O-N 2.69Å; G914-D917 PolarHBondContact O-N 3.39Å; G914-F918 WeakPolarHBondContact O-CD2 3.27Å; G914-F918 PolarHBondContact O-N 3.22Å; G914-F918 VanDerWaalsContact O-N 3.1Å
915	M	94.9	Very high	93.8	Very high	21 Å²	21	58.2 Å²	58.2	10%	0.103	28%	0.282	C	S	.	.	H	α-helix	trans	-60.8	-42.2	175	-72.8	-175.5	-67.6	0	0	111.6	F911 E912 K913 D917 F918 E919 T927 L930 L931	F911-M915 WeakPolarHBondContact O-CG 3.27Å; F911-M915 PolarHBondContact O-N 3.23Å; E912-M915 HydrophobicContact CB-CE 4.49Å; K913-M915 VanDerWaalsContact C-N 3.32Å; K913-M915 PolarHBondContact O-N 2.91Å; M915-D917 VanDerWaalsContact C-N 3.33Å; M915-D917 PolarHBondContact O-N 3Å; M915-F918 PolarHBondContact O-N 3.35Å; M915-E919 WeakPolarHBondContact O-CB 3.36Å; M915-E919 VanDerWaalsContact O-CG 3.25Å; M915-E919 WeakPolarHBondContact O-CG 3.34Å; M915-E919 PolarHBondContact O-N 3.5Å; M915-T927 HydrophobicContact CG-CG2 4.4Å; M915-L930 HydrophobicContact CG-CB 3.67Å; M915-L930 HydrophobicContact CG-CD1 4.04Å; M915-L930 HydrophobicContact CG-CG 4.43Å; M915-L930 HydrophobicContact SD-CB 4.39Å; M915-L931 HydrophobicContact SD-CD2 3.48Å; M915-L931 WeakPolarHBondContact SD-CD2 3.19Å; M915-L931 HydrophobicContact SD-CG 3.67Å
916	K	94.7	Very high	93.7	Very high	111 Å²	111	53.2 Å²	53.2	48%	0.483	26%	0.262	S	S	.	.	H	α-helix	trans	-62.4	-37.2	177.1	-69	162.9	179.7	169.5	0	112.6	E912 K913 G914 A920	E912-K916 VanDerWaalsContact CD-NZ 3.34Å; E912-K916 WeakPolarHBondContact O-CG 3.23Å; E912-K916 PolarHBondContact O-N 3.3Å; E912-K916 IonicContact OE2-NZ 3.36Å; E912-K916 PolarHBondContact OE2-NZ 3.05Å; K913-K916 WeakPolarHBondContact O-CB 3.44Å; K913-K916 PolarHBondContact O-N 3.35Å; K913-K916 VanDerWaalsContact O-N 3.14Å; G914-K916 VanDerWaalsContact C-N 3.33Å; G914-K916 PolarHBondContact O-N 2.69Å; K916-A920 WeakPolarHBondContact O-CB 3.4Å; K916-A920 PolarHBondContact O-N 2.95Å; K916-A920 VanDerWaalsContact O-N 3.09Å
917	D	93.1	Very high	93.8	Very high	15 Å²	15	50.3 Å²	50.3	8%	0.08	25%	0.25	C	S	.	.	H	α-helix	trans	-67.1	-45.3	176.7	-52	-45.7	0	0	0	111.7	L865 R872 K913 G914 M915 A920 I921	L865-D917 HydrophobicContact CD2-CB 4.16Å; R872-D917 WeakPolarHBondContact CD-OD2 3.22Å; R872-D917 IonicContact CZ-OD1 3.35Å; R872-D917 IonicContact CZ-OD2 3.21Å; R872-D917 IonicContact NE-OD2 3.78Å; R872-D917 IonicContact NH1-OD1 3.45Å; R872-D917 PolarHBondContact NH1-OD1 3.13Å; R872-D917 IonicContact NH1-OD2 3.43Å; R872-D917 PolarHBondContact NH1-OD2 3.15Å; K913-D917 PolarHBondContact O-N 3.06Å; G914-D917 PolarHBondContact O-N 3.39Å; M915-D917 VanDerWaalsContact C-N 3.33Å; M915-D917 PolarHBondContact O-N 3Å; D917-A920 WeakPolarHBondContact O-CB 3.5Å; D917-A920 PolarHBondContact O-N 3.47Å; D917-I921 PolarHBondContact O-N 3.47Å
918	F	94.7	Very high	93.7	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.009	25%	0.25	C	S	.	.	H	α-helix	trans	-70.5	-34.7	178.7	-70.2	-59.6	0	0	0	112.8	K866 G869 N870 G914 M915 A920 I921 R922 D923 N926 T927 L930	K866-F918 HydrophobicContact CG-CE1 4.11Å; G869-F918 VanDerWaalsContact CA-CE2 3.44Å; N870-F918 WeakPolarHBondContact OD1-CZ 3.2Å; G914-F918 WeakPolarHBondContact O-CD2 3.27Å; G914-F918 PolarHBondContact O-N 3.22Å; G914-F918 VanDerWaalsContact O-N 3.1Å; M915-F918 PolarHBondContact O-N 3.35Å; F918-A920 VanDerWaalsContact C-N 3.32Å; F918-A920 PolarHBondContact O-N 3Å; F918-I921 HydrophobicContact CD1-CD1 4.13Å; F918-I921 CarbonylContact O-C 3.53Å; F918-I921 WeakPolarHBondContact O-CG1 3.39Å; F918-I921 PolarHBondContact O-N 3.36Å; F918-R922 CarbonylContact O-C 3.47Å; F918-R922 WeakPolarHBondContact O-CA 3.48Å; F918-R922 PolarHBondContact O-N 3.11Å; F918-D923 HydrophobicContact CB-CB 4.2Å; F918-D923 HydrophobicContact CD1-CB 3.86Å; F918-D923 HydrophobicContact CG-CB 4.42Å; F918-D923 PolarHBondContact O-N 3.08Å; F918-N926 HydrophobicContact CD1-CB 3.6Å; F918-N926 HydrophobicContact CD2-CB 3.81Å; F918-N926 HydrophobicContact CE1-CB 3.46Å; F918-N926 VanDerWaalsContact CE1-CB 3.46Å; F918-N926 HydrophobicContact CE2-CB 3.66Å; F918-N926 HydrophobicContact CG-CB 3.77Å; F918-N926 HydrophobicContact CZ-CB 3.48Å; F918-N926 VanDerWaalsContact CZ-CB 3.48Å; F918-T927 WeakPolarHBondContact CB-OG1 3.45Å; F918-L930 HydrophobicContact CD2-CD1 3.31Å; F918-L930 HydrophobicContact CE2-CD1 3.46Å; F918-L930 VanDerWaalsContact CE2-CD1 3.46Å
919	E	93.1	Very high	93.5	Very high	121 Å²	121	50.4 Å²	50.4	57%	0.565	25%	0.253	S	S	*	.	H	α-helix	trans	-61.3	-39.7	171	-77.3	175.2	176.7	0	0	111.7	M915 I921 R922 T927	M915-E919 WeakPolarHBondContact O-CB 3.36Å; M915-E919 VanDerWaalsContact O-CG 3.25Å; M915-E919 WeakPolarHBondContact O-CG 3.34Å; M915-E919 PolarHBondContact O-N 3.5Å; E919-I921 VanDerWaalsContact C-N 3.31Å; E919-I921 PolarHBondContact O-N 3.48Å; E919-R922 PolarHBondContact O-N 3.35Å; E919-R922 VanDerWaalsContact O-N 3.12Å; E919-T927 HydrophobicContact CG-CG2 4.41Å
920	A	90.6	Very high	93.5	Very high	71 Å²	71	48.1 Å²	48.1	59%	0.587	24%	0.237	S	C	*	.	H	α-helix	trans	-61.8	-36.5	177.2	0	0	0	0	0	112.8	L865 K916 D917 F918	L865-A920 HydrophobicContact CD1-CB 4.28Å; K916-A920 WeakPolarHBondContact O-CB 3.4Å; K916-A920 PolarHBondContact O-N 2.95Å; K916-A920 VanDerWaalsContact O-N 3.09Å; D917-A920 WeakPolarHBondContact O-CB 3.5Å; D917-A920 PolarHBondContact O-N 3.47Å; F918-A920 VanDerWaalsContact C-N 3.32Å; F918-A920 PolarHBondContact O-N 3Å
921	I	92.1	Very high	93.4	Very high	47 Å²	47	47.3 Å²	47.3	24%	0.241	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	3.3	174.7	66.7	170.6	0	0	0	114.2	L865 K866 D917 F918 E919 D923	L865-I921 HydrophobicContact CB-CG2 3.72Å; L865-I921 HydrophobicContact CD1-CG2 3.7Å; L865-I921 HydrophobicContact CG-CG2 4.37Å; K866-I921 HydrophobicContact CB-CD1 3.82Å; K866-I921 HydrophobicContact CG-CD1 4.23Å; D917-I921 PolarHBondContact O-N 3.47Å; F918-I921 HydrophobicContact CD1-CD1 4.13Å; F918-I921 CarbonylContact O-C 3.53Å; F918-I921 WeakPolarHBondContact O-CG1 3.39Å; F918-I921 PolarHBondContact O-N 3.36Å; E919-I921 VanDerWaalsContact C-N 3.31Å; E919-I921 PolarHBondContact O-N 3.48Å; I921-D923 VanDerWaalsContact C-N 3.3Å; I921-D923 HydrophobicContact CD1-CB 4.1Å; I921-D923 HydrophobicContact CG1-CB 3.97Å; I921-D923 PolarHBondContact O-N 3.14Å
922	R	89.5	Confident	93.4	Very high	226 Å²	226	47.9 Å²	47.9	85%	0.853	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.9	29.8	-177.9	-51.6	179.7	-178.5	174.8	1.5	115.1	F918 E919 S924	F918-R922 CarbonylContact O-C 3.47Å; F918-R922 WeakPolarHBondContact O-CA 3.48Å; F918-R922 PolarHBondContact O-N 3.11Å; E919-R922 PolarHBondContact O-N 3.35Å; E919-R922 VanDerWaalsContact O-N 3.12Å; R922-S924 PolarHBondContact O-N 3.14Å; R922-S924 VanDerWaalsContact O-N 3.09Å
923	D	91.1	Very high	93.4	Very high	28 Å²	28	45.6 Å²	45.6	15%	0.15	23%	0.228	C	C	.	.			trans	-81.2	85.4	175.3	-169.4	-30.7	0	0	0	110.7	F918 I921 T925 N926 T927	F918-D923 HydrophobicContact CB-CB 4.2Å; F918-D923 HydrophobicContact CD1-CB 3.86Å; F918-D923 HydrophobicContact CG-CB 4.42Å; F918-D923 PolarHBondContact O-N 3.08Å; I921-D923 VanDerWaalsContact C-N 3.3Å; I921-D923 HydrophobicContact CD1-CB 4.1Å; I921-D923 HydrophobicContact CG1-CB 3.97Å; I921-D923 PolarHBondContact O-N 3.14Å; D923-T925 PolarHBondContact O-N 2.89Å; D923-T925 PolarHBondContact OD1-N 3.15Å; D923-N926 VanDerWaalsContact CG-ND2 3.35Å; D923-N926 PolarHBondContact OD1-N 3.23Å; D923-N926 PolarHBondContact OD1-ND2 2.97Å; D923-N926 PolarHBondContact OD2-ND2 3.18Å; D923-T927 WeakPolarHBondContact O-CB 3.46Å; D923-T927 PolarHBondContact O-N 3.19Å; D923-T927 VanDerWaalsContact O-N 3.15Å; D923-T927 PolarHBondContact O-OG1 2.98Å
924	S	90.6	Very high	93.4	Very high	53 Å²	53	41.8 Å²	41.8	37%	0.371	21%	0.212	S	C	.	.	H	α-helix	trans	-61.9	-25.3	179.2	54.7	0	0	0	0	113.8	R922 A928	R922-S924 PolarHBondContact O-N 3.14Å; R922-S924 VanDerWaalsContact O-N 3.09Å; S924-A928 WeakPolarHBondContact O-CB 3.32Å; S924-A928 PolarHBondContact O-N 3.46Å
925	T	91.3	Very high	93.5	Very high	18 Å²	18	41.8 Å²	41.8	11%	0.11	21%	0.212	C	C	.	.	H	α-helix	trans	-77.9	-49.5	-173.9	-55.2	0	0	0	0	110.7	D923 T927 A928 L929 H985 V988	D923-T925 PolarHBondContact O-N 2.89Å; D923-T925 PolarHBondContact OD1-N 3.15Å; T925-T927 VanDerWaalsContact C-N 3.34Å; T925-A928 WeakPolarHBondContact O-CB 3.3Å; T925-A928 PolarHBondContact O-N 3.24Å; T925-L929 PolarHBondContact O-N 3.09Å; T925-H985 HydrophobicContact CG2-CB 4.3Å; T925-H985 PolarHBondContact OG1-CE1 3.16Å; T925-H985 PolarHBondContact OG1-ND1 3.47Å; T925-H985 VanDerWaalsContact OG1-ND1 3.14Å; T925-H985 PolarHBondContact OG1-NE2 2.81Å; T925-H985 VanDerWaalsContact OG1-NE2 3.07Å; T925-V988 HydrophobicContact CG2-CG2 4.07Å
926	N	92.7	Very high	93.5	Very high	32 Å²	32	46.2 Å²	46.2	17%	0.171	23%	0.228	C	C	.	.	H	α-helix	trans	-70.1	-33.1	176.1	-71.5	-46	0	0	0	111.8	F918 D923 A928 L929 L930	F918-N926 HydrophobicContact CD1-CB 3.6Å; F918-N926 HydrophobicContact CD2-CB 3.81Å; F918-N926 HydrophobicContact CE1-CB 3.46Å; F918-N926 VanDerWaalsContact CE1-CB 3.46Å; F918-N926 HydrophobicContact CE2-CB 3.66Å; F918-N926 HydrophobicContact CG-CB 3.77Å; F918-N926 HydrophobicContact CZ-CB 3.48Å; F918-N926 VanDerWaalsContact CZ-CB 3.48Å; D923-N926 VanDerWaalsContact CG-ND2 3.35Å; D923-N926 PolarHBondContact OD1-N 3.23Å; D923-N926 PolarHBondContact OD1-ND2 2.97Å; D923-N926 PolarHBondContact OD2-ND2 3.18Å; N926-A928 VanDerWaalsContact C-N 3.31Å; N926-A928 PolarHBondContact O-N 2.94Å; N926-L929 PolarHBondContact O-N 3.07Å; N926-L930 PolarHBondContact O-N 3.38Å
927	T	94.5	Very high	93.5	Very high	11 Å²	11	41 Å²	41	7%	0.067	21%	0.205	C	C	.	.	H	α-helix	trans	-57.5	-43.2	167.9	-53.3	0	0	0	0	111.6	M915 F918 E919 D923 T925 L930 L931	M915-T927 HydrophobicContact CG-CG2 4.4Å; F918-T927 WeakPolarHBondContact CB-OG1 3.45Å; E919-T927 HydrophobicContact CG-CG2 4.41Å; D923-T927 WeakPolarHBondContact O-CB 3.46Å; D923-T927 PolarHBondContact O-N 3.19Å; D923-T927 VanDerWaalsContact O-N 3.15Å; D923-T927 PolarHBondContact O-OG1 2.98Å; T925-T927 VanDerWaalsContact C-N 3.34Å; T927-L930 PolarHBondContact O-N 3.14Å; T927-L931 HydrophobicContact CG2-CD1 4.21Å; T927-L931 WeakPolarHBondContact O-CG 3.44Å; T927-L931 PolarHBondContact O-N 3.47Å
928	A	93.8	Very high	93.6	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-67.7	-33.3	177.1	0	0	0	0	0	113.6	S924 T925 N926 L931 C932 A975 A978 L979	S924-A928 WeakPolarHBondContact O-CB 3.32Å; S924-A928 PolarHBondContact O-N 3.46Å; T925-A928 WeakPolarHBondContact O-CB 3.3Å; T925-A928 PolarHBondContact O-N 3.24Å; N926-A928 VanDerWaalsContact C-N 3.31Å; N926-A928 PolarHBondContact O-N 2.94Å; A928-L931 PolarHBondContact O-N 2.99Å; A928-C932 WeakPolarHBondContact O-CB 3.29Å; A928-C932 PolarHBondContact O-N 2.71Å; A928-A975 HydrophobicContact CB-CB 4.22Å; A928-A975 WeakPolarHBondContact O-CB 3.32Å; A928-A978 HydrophobicContact CB-CB 4.29Å; A928-L979 HydrophobicContact CB-CD1 4.17Å; A928-L979 HydrophobicContact CB-CD2 3.7Å; A928-L979 HydrophobicContact CB-CG 3.62Å
929	L	93.4	Very high	93.6	Very high	63 Å²	63	42.5 Å²	42.5	33%	0.33	21%	0.21	S	C	.	.	H	α-helix	trans	-65.3	-44.3	173.5	-73.3	170.8	0	0	0	111.8	T925 N926 L931 C932 N933 V988	T925-L929 PolarHBondContact O-N 3.09Å; N926-L929 PolarHBondContact O-N 3.07Å; L929-L931 PolarHBondContact O-N 3.03Å; L929-C932 VanDerWaalsContact O-CB 3.29Å; L929-C932 WeakPolarHBondContact O-CB 3.31Å; L929-C932 PolarHBondContact O-N 3.43Å; L929-C932 VanDerWaalsContact O-N 3.15Å; L929-N933 PolarHBondContact O-N 3.35Å; L929-V988 HydrophobicContact CD2-CG1 3.76Å; L929-V988 HydrophobicContact CD2-CG2 4.26Å; L929-V988 HydrophobicContact CG-CG1 4.07Å
930	L	94.8	Very high	93.5	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-62.5	-40.7	174.4	-81.1	155.2	0	0	0	113	N873 F911 M915 F918 N926 T927 C932 N933 T934	N873-L930 HydrophobicContact CB-CD2 4.01Å; N873-L930 HydrophobicContact CB-CG 4.46Å; F911-L930 HydrophobicContact CB-CD2 4.07Å; F911-L930 HydrophobicContact CD1-CD2 3.54Å; F911-L930 HydrophobicContact CE1-CD2 4.39Å; F911-L930 HydrophobicContact CG-CD2 4.18Å; M915-L930 HydrophobicContact CG-CB 3.67Å; M915-L930 HydrophobicContact CG-CD1 4.04Å; M915-L930 HydrophobicContact CG-CG 4.43Å; M915-L930 HydrophobicContact SD-CB 4.39Å; F918-L930 HydrophobicContact CD2-CD1 3.31Å; F918-L930 HydrophobicContact CE2-CD1 3.46Å; F918-L930 VanDerWaalsContact CE2-CD1 3.46Å; N926-L930 PolarHBondContact O-N 3.38Å; T927-L930 PolarHBondContact O-N 3.14Å; L930-C932 VanDerWaalsContact C-N 3.32Å; L930-C932 PolarHBondContact O-N 2.84Å; L930-N933 PolarHBondContact O-N 3.32Å; L930-T934 WeakPolarHBondContact O-CB 3.44Å; L930-T934 PolarHBondContact O-N 2.94Å; L930-T934 PolarHBondContact O-OG1 2.84Å
931	L	95.6	Very high	93.5	Very high	13 Å²	13	34 Å²	34	7%	0.068	16%	0.158	C	C	.	.	H	α-helix	trans	-62.8	-38.9	172.5	-72.4	165.6	0	0	0	111.5	M915 T927 A928 L929 T934 G935 Y971 Q974 A975 A978	M915-L931 HydrophobicContact SD-CD2 3.48Å; M915-L931 WeakPolarHBondContact SD-CD2 3.19Å; M915-L931 HydrophobicContact SD-CG 3.67Å; T927-L931 HydrophobicContact CG2-CD1 4.21Å; T927-L931 WeakPolarHBondContact O-CG 3.44Å; T927-L931 PolarHBondContact O-N 3.47Å; A928-L931 PolarHBondContact O-N 2.99Å; L929-L931 PolarHBondContact O-N 3.03Å; L931-T934 PolarHBondContact O-N 3.26Å; L931-G935 PolarHBondContact O-N 3.47Å; L931-Y971 HydrophobicContact CD2-CD1 3.8Å; L931-Y971 HydrophobicContact CD2-CE1 4.43Å; L931-Q974 HydrophobicContact CD1-CB 4.02Å; L931-Q974 HydrophobicContact CD2-CB 4.04Å; L931-A975 HydrophobicContact CB-CB 3.78Å; L931-A978 HydrophobicContact CD1-CB 4.47Å
932	C	94.9	Very high	93.5	Very high	13 Å²	13	31.7 Å²	31.7	9%	0.088	15%	0.147	C	C	.	.	H	α-helix	trans	-63.7	-46.3	174.8	-165.3	0	0	0	0	111.9	A928 L929 L930 G935 R936 Y972 V992	A928-C932 WeakPolarHBondContact O-CB 3.29Å; A928-C932 PolarHBondContact O-N 2.71Å; L929-C932 VanDerWaalsContact O-CB 3.29Å; L929-C932 WeakPolarHBondContact O-CB 3.31Å; L929-C932 PolarHBondContact O-N 3.43Å; L929-C932 VanDerWaalsContact O-N 3.15Å; L930-C932 VanDerWaalsContact C-N 3.32Å; L930-C932 PolarHBondContact O-N 2.84Å; C932-G935 WeakPolarHBondContact O-CA 3.37Å; C932-G935 PolarHBondContact O-N 3.3Å; C932-G935 VanDerWaalsContact O-N 3.16Å; C932-R936 PolarHBondContact O-N 3.1Å; C932-Y972 HydrophobicContact CB-CE1 4.47Å; C932-Y972 VanDerWaalsContact O-CE1 3.31Å; C932-Y972 WeakPolarHBondContact O-CE1 3.47Å; C932-V992 HydrophobicContact CB-CG2 4.09Å
933	N	95.7	Very high	93.4	Very high	31 Å²	31	25.2 Å²	25.2	17%	0.166	13%	0.126	C	C	.	.	H	α-helix	trans	-66.2	-37.1	176.9	-73.4	-20.3	0	0	0	112	N873 F911 L929 L930 G935 R936 L937	N873-N933 PolarHBondContact OD1-ND2 2.68Å; F911-N933 HydrophobicContact CE1-CB 3.95Å; F911-N933 HydrophobicContact CE2-CB 4.13Å; F911-N933 HydrophobicContact CZ-CB 3.67Å; L929-N933 PolarHBondContact O-N 3.35Å; L930-N933 PolarHBondContact O-N 3.32Å; N933-G935 VanDerWaalsContact C-N 3.33Å; N933-G935 PolarHBondContact O-N 2.92Å; N933-R936 WeakPolarHBondContact O-CB 3.49Å; N933-R936 PolarHBondContact O-N 3.34Å; N933-L937 PolarHBondContact O-N 2.96Å
934	T	95.9	Very high	93.2	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-62.9	-39.7	171.2	-55	0	0	0	0	111.3	F908 F911 L930 L931 L937 M938 Y971	F908-T934 HydrophobicContact CD2-CG2 3.97Å; F908-T934 HydrophobicContact CE2-CG2 3.86Å; F911-T934 WeakPolarHBondContact CB-OG1 3.21Å; F911-T934 WeakPolarHBondContact CD2-OG1 2.98Å; L930-T934 WeakPolarHBondContact O-CB 3.44Å; L930-T934 PolarHBondContact O-N 2.94Å; L930-T934 PolarHBondContact O-OG1 2.84Å; L931-T934 PolarHBondContact O-N 3.26Å; T934-L937 PolarHBondContact O-N 2.98Å; T934-M938 WeakPolarHBondContact O-CG 3.31Å; T934-M938 PolarHBondContact O-N 3.43Å; T934-Y971 HydrophobicContact CG2-CD1 3.93Å; T934-Y971 HydrophobicContact CG2-CD2 3.79Å; T934-Y971 HydrophobicContact CG2-CE1 3.86Å; T934-Y971 HydrophobicContact CG2-CE2 3.72Å; T934-Y971 HydrophobicContact CG2-CG 3.91Å
935	G	95.8	Very high	93	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-59.6	-43.5	171.4	0	0	0	0	0	112.7	L931 C932 N933 M938 R939 A968 Y972	L931-G935 PolarHBondContact O-N 3.47Å; C932-G935 WeakPolarHBondContact O-CA 3.37Å; C932-G935 PolarHBondContact O-N 3.3Å; C932-G935 VanDerWaalsContact O-N 3.16Å; N933-G935 VanDerWaalsContact C-N 3.33Å; N933-G935 PolarHBondContact O-N 2.92Å; G935-M938 PolarHBondContact O-N 3.5Å; G935-R939 PolarHBondContact O-N 3.5Å; G935-R939 VanDerWaalsContact O-N 3.14Å; G935-A968 WeakPolarHBondContact O-CB 3.42Å; G935-Y972 VanDerWaalsContact C-OH 3.32Å
936	R	95.1	Very high	92.6	Very high	115 Å²	115	25.5 Å²	25.5	43%	0.434	13%	0.127	S	C	.	.	H	α-helix	trans	-63.6	-42.9	175.5	-177.4	176.3	171.8	-179.9	-2.1	111.9	M880 C932 N933 M938 R939 I940 Y972	M880-R936 HydrophobicContact CE-CG 4.29Å; M880-R936 HydrophobicContact SD-CB 3.99Å; M880-R936 HydrophobicContact SD-CG 3.86Å; C932-R936 PolarHBondContact O-N 3.1Å; N933-R936 WeakPolarHBondContact O-CB 3.49Å; N933-R936 PolarHBondContact O-N 3.34Å; R936-M938 VanDerWaalsContact C-N 3.33Å; R936-M938 PolarHBondContact O-N 3.23Å; R936-R939 WeakPolarHBondContact O-CB 3.13Å; R936-R939 PolarHBondContact O-N 3Å; R936-R939 VanDerWaalsContact O-N 3.11Å; R936-I940 HydrophobicContact CG-CD1 4.27Å; R936-I940 PolarHBondContact O-N 2.82Å; R936-I940 VanDerWaalsContact O-N 3.09Å; R936-Y972 WeakPolarHBondContact CA-OH 3.47Å; R936-Y972 PolarHBondContact N-OH 3.25Å; R936-Y972 VanDerWaalsContact N-OH 3.15Å
937	L	95	Very high	91.7	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-57.5	-44.6	173.2	178.4	68	0	0	0	111.4	M880 F908 F911 N933 T934 R939 I940 C941	M880-L937 HydrophobicContact CB-CD1 4.23Å; M880-L937 HydrophobicContact CG-CB 4.29Å; M880-L937 HydrophobicContact CG-CD1 4.02Å; M880-L937 HydrophobicContact SD-CB 4.03Å; F908-L937 HydrophobicContact CB-CD2 4.07Å; F911-L937 HydrophobicContact CD2-CD2 4.36Å; F911-L937 HydrophobicContact CE2-CB 4.28Å; F911-L937 HydrophobicContact CE2-CD2 4.27Å; N933-L937 PolarHBondContact O-N 2.96Å; T934-L937 PolarHBondContact O-N 2.98Å; L937-R939 VanDerWaalsContact C-N 3.29Å; L937-R939 PolarHBondContact O-N 3.47Å; L937-I940 WeakPolarHBondContact O-CB 3.46Å; L937-I940 PolarHBondContact O-N 3.27Å; L937-I940 VanDerWaalsContact O-N 3.12Å; L937-C941 PolarHBondContact O-N 2.64Å; L937-C941 PolarHBondContact O-SG 3.06Å
938	M	95.7	Very high	90.7	Very high	13 Å²	13	28.9 Å²	28.9	6%	0.064	16%	0.157	C	C	.	.	H	α-helix	trans	-61.6	-35.1	176.5	-66.3	-57.7	103.6	0	0	112.4	F908 T934 G935 R936 C941 A942 Y964 K967 A968 Y971	F908-M938 HydrophobicContact CD2-CE 4.21Å; T934-M938 WeakPolarHBondContact O-CG 3.31Å; T934-M938 PolarHBondContact O-N 3.43Å; G935-M938 PolarHBondContact O-N 3.5Å; R936-M938 VanDerWaalsContact C-N 3.33Å; R936-M938 PolarHBondContact O-N 3.23Å; M938-C941 WeakPolarHBondContact O-CB 3.46Å; M938-C941 PolarHBondContact O-N 3.28Å; M938-A942 PolarHBondContact O-N 3.41Å; M938-Y964 WeakPolarHBondContact O-CB 3.28Å; M938-Y964 HydrophobicContact SD-CD1 3.93Å; M938-Y964 HydrophobicContact SD-CE1 4.31Å; M938-K967 HydrophobicContact CB-CB 4.45Å; M938-K967 HydrophobicContact CG-CB 3.99Å; M938-K967 HydrophobicContact SD-CB 4.13Å; M938-K967 HydrophobicContact SD-CD 4.1Å; M938-A968 HydrophobicContact CB-CB 3.77Å; M938-Y971 HydrophobicContact CG-CD2 3.87Å; M938-Y971 HydrophobicContact CG-CE2 3.98Å; M938-Y971 HydrophobicContact SD-CE2 4.38Å
939	R	94.1	Very high	89.3	Confident	36 Å²	36	31.2 Å²	31.2	14%	0.136	17%	0.173	C	C	.	.	H	α-helix	trans	-64.6	-40.5	173.2	-63.6	171	64.7	-163	-7.2	112	G935 R936 L937 A942 Q943 Y965 A968 Y972 E995 T999	G935-R939 PolarHBondContact O-N 3.5Å; G935-R939 VanDerWaalsContact O-N 3.14Å; R936-R939 WeakPolarHBondContact O-CB 3.13Å; R936-R939 PolarHBondContact O-N 3Å; R936-R939 VanDerWaalsContact O-N 3.11Å; L937-R939 VanDerWaalsContact C-N 3.29Å; L937-R939 PolarHBondContact O-N 3.47Å; R939-A942 WeakPolarHBondContact O-CB 3.39Å; R939-A942 PolarHBondContact O-N 3.2Å; R939-Q943 WeakPolarHBondContact O-CG 3.32Å; R939-Q943 PolarHBondContact O-N 3.23Å; R939-Q943 PolarHBondContact O-OE1 3.49Å; R939-Y965 HydrophobicContact CB-CE1 4.31Å; R939-Y965 HydrophobicContact CG-CD1 4.34Å; R939-Y965 HydrophobicContact CG-CE1 4.24Å; R939-A968 HydrophobicContact CG-CB 3.88Å; R939-Y972 WeakPolarHBondContact CD-OH 3.4Å; R939-E995 IonicContact CZ-OE2 3.35Å; R939-E995 IonicContact NH1-OE1 2.77Å; R939-E995 IonicContact NH1-OE2 3.19Å; R939-E995 PolarHBondContact NH1-OE2 2.86Å; R939-T999 WeakPolarHBondContact CD-OG1 3.18Å; R939-T999 HydrophobicContact CG-CG2 4.37Å
940	I	91.3	Very high	87.7	Confident	9 Å²	9	33.1 Å²	33.1	5%	0.046	20%	0.198	C	C	.	.	H	α-helix	trans	-64	-42.6	174.9	-68.1	160.9	0	0	0	110.1	M880 A883 A884 Q887 R936 L937 A942 Q943 A944	M880-I940 HydrophobicContact CG-CD1 3.43Å; M880-I940 VanDerWaalsContact CG-CD1 3.43Å; M880-I940 HydrophobicContact SD-CD1 4.03Å; A883-I940 HydrophobicContact CB-CG2 4.46Å; A884-I940 HydrophobicContact CB-CD1 4.15Å; Q887-I940 VanDerWaalsContact NE2-CG2 3.26Å; Q887-I940 PolarHBondContact NE2-O 2.96Å; Q887-I940 PolarHBondContact OE1-O 3.37Å; R936-I940 HydrophobicContact CG-CD1 4.27Å; R936-I940 PolarHBondContact O-N 2.82Å; R936-I940 VanDerWaalsContact O-N 3.09Å; L937-I940 WeakPolarHBondContact O-CB 3.46Å; L937-I940 PolarHBondContact O-N 3.27Å; L937-I940 VanDerWaalsContact O-N 3.12Å; I940-A942 VanDerWaalsContact C-N 3.33Å; I940-A942 PolarHBondContact O-N 3.1Å; I940-Q943 PolarHBondContact O-N 3.38Å; I940-A944 PolarHBondContact O-N 2.93Å
941	C	91.6	Very high	85.9	Confident	3 Å²	3	38.8 Å²	38.8	2%	0.02	23%	0.229	C	C	.	.	H	α-helix	trans	-58.2	-44.3	171.6	-60.1	0	0	0	0	111.7	W904 L937 M938 Q943 A944 H945 Y964	W904-C941 HydrophobicContact CD2-CB 4.37Å; W904-C941 HydrophobicContact CE3-CB 4.3Å; W904-C941 HydrophobicContact CH2-CB 4.28Å; W904-C941 HydrophobicContact CZ2-CB 4.33Å; W904-C941 HydrophobicContact CZ3-CB 4.25Å; L937-C941 PolarHBondContact O-N 2.64Å; L937-C941 PolarHBondContact O-SG 3.06Å; M938-C941 WeakPolarHBondContact O-CB 3.46Å; M938-C941 PolarHBondContact O-N 3.28Å; C941-Q943 PolarHBondContact O-N 2.9Å; C941-A944 PolarHBondContact O-N 3.15Å; C941-H945 PolarHBondContact O-CD2 2.92Å; C941-H945 PolarHBondContact O-N 2.88Å; C941-Y964 HydrophobicContact CB-CD1 3.53Å; C941-Y964 HydrophobicContact CB-CD2 4.21Å; C941-Y964 HydrophobicContact CB-CE1 3.72Å; C941-Y964 HydrophobicContact CB-CE2 4.37Å; C941-Y964 HydrophobicContact CB-CG 3.81Å
942	A	90.8	Very high	84.5	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-58.2	-47.8	176.3	0	0	0	0	0	111.5	M938 R939 I940 A944 H945 E961 Y965	M938-A942 PolarHBondContact O-N 3.41Å; R939-A942 WeakPolarHBondContact O-CB 3.39Å; R939-A942 PolarHBondContact O-N 3.2Å; I940-A942 VanDerWaalsContact C-N 3.33Å; I940-A942 PolarHBondContact O-N 3.1Å; A942-A944 VanDerWaalsContact C-N 3.3Å; A942-A944 PolarHBondContact O-N 3Å; A942-H945 PolarHBondContact O-N 2.89Å; A942-E961 WeakPolarHBondContact O-CG 3.28Å; A942-Y965 HydrophobicContact CB-CD1 4.22Å; A942-Y965 HydrophobicContact CB-CD2 3.74Å; A942-Y965 HydrophobicContact CB-CE1 4.1Å; A942-Y965 HydrophobicContact CB-CE2 3.59Å; A942-Y965 HydrophobicContact CB-CG 4.05Å
943	Q	88.5	Confident	83.4	Confident	90 Å²	90	43.6 Å²	43.6	42%	0.421	27%	0.274	S	S	.	.	H	α-helix	trans	-58.9	-36.6	-178.8	-72.6	168.2	-53.5	0	0	113.3	R939 I940 C941 H945 C946	R939-Q943 WeakPolarHBondContact O-CG 3.32Å; R939-Q943 PolarHBondContact O-N 3.23Å; R939-Q943 PolarHBondContact O-OE1 3.49Å; I940-Q943 PolarHBondContact O-N 3.38Å; C941-Q943 PolarHBondContact O-N 2.9Å; Q943-H945 VanDerWaalsContact C-N 3.28Å; Q943-H945 PolarHBondContact O-N 3.06Å; Q943-C946 WeakPolarHBondContact O-CB 3.4Å; Q943-C946 PolarHBondContact O-N 3.08Å
944	A	85.8	Confident	82.8	Confident	21 Å²	21	45.3 Å²	45.3	17%	0.174	28%	0.278	C	S	.	.	H	α-helix	trans	-67.9	-22.8	174.3	0	0	0	0	0	114.8	V896 E900 W904 I940 C941 A942 C946	V896-A944 HydrophobicContact CG2-CB 4.09Å; V896-A944 WeakPolarHBondContact CG2-O 3.42Å; E900-A944 WeakPolarHBondContact OE1-CB 3.49Å; W904-A944 HydrophobicContact CH2-CB 3.65Å; W904-A944 HydrophobicContact CZ2-CB 3.45Å; W904-A944 VanDerWaalsContact CZ2-CB 3.45Å; I940-A944 PolarHBondContact O-N 2.93Å; C941-A944 PolarHBondContact O-N 3.15Å; A942-A944 VanDerWaalsContact C-N 3.3Å; A942-A944 PolarHBondContact O-N 3Å; A944-C946 VanDerWaalsContact C-N 3.25Å
945	H	85.9	Confident	82.2	Confident	40 Å²	40	46.2 Å²	46.2	19%	0.185	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	7.6	174.9	-80.2	-94.7	0	0	0	113	C941 A942 Q943 P947 D960 E961 Y964	C941-H945 PolarHBondContact O-CD2 2.92Å; C941-H945 PolarHBondContact O-N 2.88Å; A942-H945 PolarHBondContact O-N 2.89Å; Q943-H945 VanDerWaalsContact C-N 3.28Å; Q943-H945 PolarHBondContact O-N 3.06Å; H945-P947 WeakPolarHBondContact O-CD 3.48Å; H945-D960 HydrophobicContact CB-CB 3.84Å; H945-D960 IonicContact CE1-OD2 3.2Å; H945-D960 VanDerWaalsContact ND1-CB 3.33Å; H945-D960 WeakPolarHBondContact ND1-CB 3.5Å; H945-D960 IonicContact ND1-OD2 3.53Å; H945-D960 PolarHBondContact ND1-OD2 2.94Å; H945-D960 VanDerWaalsContact ND1-OD2 3.13Å; H945-E961 HydrophobicContact CB-CG 4.11Å; H945-Y964 AromaticContact CD2-CD2 3.98Å; H945-Y964 AromaticContact CD2-CE2 3.6Å; H945-Y964 AromaticContact NE2-CE2 3.53Å
946	C	82.8	Confident	82	Confident	44 Å²	44	49.2 Å²	49.2	30%	0.297	30%	0.302	S	S	.	.			trans	-58	121	171.1	174.4	0	0	0	0	111.5	Q943 A944 R954	Q943-C946 WeakPolarHBondContact O-CB 3.4Å; Q943-C946 PolarHBondContact O-N 3.08Å; A944-C946 VanDerWaalsContact C-N 3.25Å; C946-R954 VanDerWaalsContact SG-CZ 3.54Å; C946-R954 PolarHBondContact SG-NH1 3.36Å
947	P	74.4	Confident	81.8	Confident	44 Å²	44	44.1 Å²	44.1	29%	0.286	28%	0.283	S	S	.	.			trans	-76.8	129.4	176.2	28.3	-29.2	0	0	0	111.5	H945 G955 E956 E961	H945-P947 WeakPolarHBondContact O-CD 3.48Å; P947-G955 PolarHBondContact O-N 2.58Å; P947-E956 WeakPolarHBondContact CG-O 3.41Å; P947-E961 WeakPolarHBondContact CD-OE2 3.43Å
948	A	73.2	Confident	81.5	Confident	69 Å²	69	44.8 Å²	44.8	57%	0.57	29%	0.287	S	S	*	.	B	Isolated β-bridge	trans	-106.6	131	170.6	0	0	0	0	0	110.5
949	S	64.1	Low	81.2	Confident	49 Å²	49	47.7 Å²	47.7	34%	0.343	31%	0.307	S	S	.	.			trans	-83.4	169.1	174.9	41.9	0	0	0	0	112.3	D951 G952 S953	S949-D951 WeakPolarHBondContact CB-OD1 3.4Å; S949-D951 PolarHBondContact O-N 3.28Å; S949-D951 VanDerWaalsContact O-N 3.15Å; S949-D951 PolarHBondContact OG-OD1 2.71Å; S949-G952 PolarHBondContact O-N 3.11Å; S949-G952 VanDerWaalsContact O-N 3.07Å; S949-S953 PolarHBondContact N-O 3.17Å; S949-S953 PolarHBondContact OG-O 3.4Å; S949-S953 PolarHBondContact OG-OG 3.02Å
950	A	60.1	Low	81	Confident	104 Å²	104	49.5 Å²	49.5	86%	0.86	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-12.7	-171.7	0	0	0	0	0	114.7
951	D	58.7	Low	81	Confident	120 Å²	120	49 Å²	49	64%	0.642	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-1.4	175.9	62.3	-17	0	0	0	113.3	S949 S953	S949-D951 WeakPolarHBondContact CB-OD1 3.4Å; S949-D951 PolarHBondContact O-N 3.28Å; S949-D951 VanDerWaalsContact O-N 3.15Å; S949-D951 PolarHBondContact OG-OD1 2.71Å; D951-S953 VanDerWaalsContact C-N 3.3Å; D951-S953 PolarHBondContact OD1-N 3.49Å; D951-S953 PolarHBondContact OD1-OG 3.26Å; D951-S953 PolarHBondContact OD2-OG 3.11Å
952	G	65.4	Low	81	Confident	69 Å²	69	50.1 Å²	50.1	71%	0.711	33%	0.327	S	S	*	.	S	Bend	trans	81.6	1.9	-175.1	0	0	0	0	0	114.6	S949	S949-G952 PolarHBondContact O-N 3.11Å; S949-G952 VanDerWaalsContact O-N 3.07Å
953	S	71.6	Confident	81.1	Confident	57 Å²	57	54.3 Å²	54.3	40%	0.399	35%	0.349	S	S	.	.			trans	-78.8	165.9	170.9	73.2	0	0	0	0	111.5	S949 D951	S949-S953 PolarHBondContact N-O 3.17Å; S949-S953 PolarHBondContact OG-O 3.4Å; S949-S953 PolarHBondContact OG-OG 3.02Å; D951-S953 VanDerWaalsContact C-N 3.3Å; D951-S953 PolarHBondContact OD1-N 3.49Å; D951-S953 PolarHBondContact OD1-OG 3.26Å; D951-S953 PolarHBondContact OD2-OG 3.11Å
954	R	84.1	Confident	81.4	Confident	67 Å²	67	52.3 Å²	52.3	25%	0.253	34%	0.337	S	S	.	.	B	Isolated β-bridge	trans	-90.9	130.1	-178.9	173	171.5	165.9	119	20.6	110.1	C946 E961 Y1010	C946-R954 VanDerWaalsContact SG-CZ 3.54Å; C946-R954 PolarHBondContact SG-NH1 3.36Å; R954-E961 IonicContact CZ-OE1 3.65Å; R954-E961 IonicContact NH1-OE1 2.81Å; R954-E961 VanDerWaalsContact NH2-CD 3.33Å; R954-E961 IonicContact NH2-OE1 3.81Å; R954-E961 PolarHBondContact NH2-OE1 3.36Å; R954-E961 IonicContact NH2-OE2 2.72Å; R954-E961 PolarHBondContact NH2-OE2 3.25Å; R954-Y1010 HydrophobicContact CB-CD1 4.14Å; R954-Y1010 HydrophobicContact CB-CE1 3.65Å; R954-Y1010 HydrophobicContact CG-CD1 3.75Å; R954-Y1010 HydrophobicContact CG-CE1 3.68Å; R954-Y1010 HydrophobicContact CG-CE2 4.44Å; R954-Y1010 HydrophobicContact CG-CG 4.19Å
955	G	83.3	Confident	81.9	Confident	19 Å²	19	51.5 Å²	51.5	20%	0.196	33%	0.33	C	S	.	.			trans	-79	178.6	179.3	0	0	0	0	0	114.3	P947	P947-G955 PolarHBondContact O-N 2.58Å
956	E	90.1	Very high	82.4	Confident	64 Å²	64	53.5 Å²	53.5	30%	0.299	34%	0.342	S	S	.	.	S	Bend	trans	-56.3	137.8	176	-69.8	-169.8	176.6	0	0	112.9	P947 S958 P1012 L1013 S1014	P947-E956 WeakPolarHBondContact CG-O 3.41Å; E956-S958 PolarHBondContact O-N 3.07Å; E956-P1012 HydrophobicContact CB-CB 4.41Å; E956-P1012 VanDerWaalsContact OE2-CA 3.27Å; E956-P1012 WeakPolarHBondContact OE2-CA 3.46Å; E956-L1013 PolarHBondContact OE1-N 3.37Å; E956-S1014 WeakPolarHBondContact OE1-CB 3.44Å; E956-S1014 PolarHBondContact OE1-N 3.46Å; E956-S1014 PolarHBondContact OE1-OG 3.27Å; E956-S1014 WeakPolarHBondContact OE2-CB 3.49Å; E956-S1014 PolarHBondContact OE2-N 2.99Å; E956-S1014 PolarHBondContact OE2-OG 2.96Å
957	F	90.8	Very high	83	Confident	7 Å²	7	55.1 Å²	55.1	3%	0.031	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-50.3	123.1	179.6	-178.7	-113.4	0	0	0	112.6	E961 A962 Y965 L1003 L1006 L1007 Y1010 R1015	F957-E961 HydrophobicContact CD2-CB 3.95Å; F957-E961 WeakPolarHBondContact CD2-OE2 3.25Å; F957-E961 HydrophobicContact CE2-CB 3.39Å; F957-E961 HydrophobicContact CE2-CG 4.3Å; F957-E961 HydrophobicContact CZ-CB 3.86Å; F957-A962 HydrophobicContact CE1-CB 3.67Å; F957-A962 HydrophobicContact CZ-CB 4.03Å; F957-Y965 HydrophobicContact CE2-CD2 4.05Å; F957-Y965 HydrophobicContact CE2-CE2 4.07Å; F957-Y965 HydrophobicContact CZ-CD2 4.02Å; F957-Y965 HydrophobicContact CZ-CE2 4.49Å; F957-L1003 HydrophobicContact CE1-CD1 3.78Å; F957-L1003 HydrophobicContact CE2-CD1 4.41Å; F957-L1003 HydrophobicContact CZ-CD1 3.42Å; F957-L1003 VanDerWaalsContact CZ-CD1 3.42Å; F957-L1006 HydrophobicContact CD2-CB 3.73Å; F957-L1006 HydrophobicContact CD2-CD1 4.17Å; F957-L1006 HydrophobicContact CE2-CB 3.92Å; F957-L1006 HydrophobicContact CE2-CD1 3.87Å; F957-L1006 HydrophobicContact CG-CB 4.44Å; F957-L1007 HydrophobicContact CD1-CD2 3.51Å; F957-L1007 HydrophobicContact CD1-CG 4.01Å; F957-L1007 HydrophobicContact CE1-CD2 3.79Å; F957-L1007 HydrophobicContact CE1-CG 4.02Å; F957-L1007 HydrophobicContact CG-CD2 4.48Å; F957-Y1010 WeakPolarHBondContact CB-O 3.37Å; F957-Y1010 PolarHBondContact N-O 3.36Å; F957-R1015 PolarHBondContact O-NH2 3.48Å
958	S	89.4	Confident	84.1	Confident	15 Å²	15	53 Å²	53	11%	0.105	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-83.1	150.2	-167.5	158.1	0	0	0	0	113.4	E956 D960 E961 A962	E956-S958 PolarHBondContact O-N 3.07Å; S958-D960 PolarHBondContact O-N 3.03Å; S958-D960 PolarHBondContact OG-N 3.47Å; S958-D960 VanDerWaalsContact OG-N 3.14Å; S958-E961 WeakPolarHBondContact CB-OE2 3.14Å; S958-E961 PolarHBondContact N-OE2 2.9Å; S958-E961 WeakPolarHBondContact O-CB 3.36Å; S958-E961 PolarHBondContact O-N 2.61Å; S958-A962 PolarHBondContact O-N 2.74Å
959	P	89.1	Confident	85.2	Confident	74 Å²	74	50 Å²	50	48%	0.481	31%	0.305	S	S	.	.	H	α-helix	trans	-64	-28.5	173.6	-17	32.4	0	0	0	112.4	A962 L963	P959-A962 PolarHBondContact O-N 2.76Å; P959-L963 WeakPolarHBondContact O-CB 3.35Å; P959-L963 PolarHBondContact O-N 3.43Å
960	D	89.1	Confident	86.8	Confident	74 Å²	74	51.9 Å²	51.9	40%	0.396	31%	0.311	S	S	.	.	H	α-helix	trans	-71.8	-41.7	176.3	-62.1	-28.2	0	0	0	110.7	H945 S958 A962 L963 Y964	H945-D960 HydrophobicContact CB-CB 3.84Å; H945-D960 IonicContact CE1-OD2 3.2Å; H945-D960 VanDerWaalsContact ND1-CB 3.33Å; H945-D960 WeakPolarHBondContact ND1-CB 3.5Å; H945-D960 IonicContact ND1-OD2 3.53Å; H945-D960 PolarHBondContact ND1-OD2 2.94Å; H945-D960 VanDerWaalsContact ND1-OD2 3.13Å; S958-D960 PolarHBondContact O-N 3.03Å; S958-D960 PolarHBondContact OG-N 3.47Å; S958-D960 VanDerWaalsContact OG-N 3.14Å; D960-A962 VanDerWaalsContact C-N 3.31Å; D960-A962 PolarHBondContact O-N 2.92Å; D960-L963 WeakPolarHBondContact O-CB 3.49Å; D960-L963 PolarHBondContact O-N 3.31Å; D960-Y964 WeakPolarHBondContact O-CD2 3.47Å; D960-Y964 PolarHBondContact O-N 3.41Å
961	E	91.5	Very high	88.6	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-57.4	-48.1	172	-64.2	-177.4	94.7	0	0	110.1	A942 H945 P947 R954 F957 S958 L963 Y964 Y965	A942-E961 WeakPolarHBondContact O-CG 3.28Å; H945-E961 HydrophobicContact CB-CG 4.11Å; P947-E961 WeakPolarHBondContact CD-OE2 3.43Å; R954-E961 IonicContact CZ-OE1 3.65Å; R954-E961 IonicContact NH1-OE1 2.81Å; R954-E961 VanDerWaalsContact NH2-CD 3.33Å; R954-E961 IonicContact NH2-OE1 3.81Å; R954-E961 PolarHBondContact NH2-OE1 3.36Å; R954-E961 IonicContact NH2-OE2 2.72Å; R954-E961 PolarHBondContact NH2-OE2 3.25Å; F957-E961 HydrophobicContact CD2-CB 3.95Å; F957-E961 WeakPolarHBondContact CD2-OE2 3.25Å; F957-E961 HydrophobicContact CE2-CB 3.39Å; F957-E961 HydrophobicContact CE2-CG 4.3Å; F957-E961 HydrophobicContact CZ-CB 3.86Å; S958-E961 WeakPolarHBondContact CB-OE2 3.14Å; S958-E961 PolarHBondContact N-OE2 2.9Å; S958-E961 WeakPolarHBondContact O-CB 3.36Å; S958-E961 PolarHBondContact O-N 2.61Å; E961-L963 VanDerWaalsContact C-N 3.34Å; E961-L963 PolarHBondContact O-N 2.88Å; E961-Y964 PolarHBondContact O-N 3.43Å; E961-Y965 HydrophobicContact CB-CD2 4.41Å; E961-Y965 HydrophobicContact CB-CE2 4.41Å; E961-Y965 WeakPolarHBondContact O-CD2 3.32Å; E961-Y965 PolarHBondContact O-N 3.26Å
962	A	91.6	Very high	90.4	Very high	26 Å²	26	43.4 Å²	43.4	22%	0.215	25%	0.248	C	C	.	.	H	α-helix	trans	-58.1	-43.5	176	0	0	0	0	0	112.3	F957 S958 P959 D960 N966	F957-A962 HydrophobicContact CE1-CB 3.67Å; F957-A962 HydrophobicContact CZ-CB 4.03Å; S958-A962 PolarHBondContact O-N 2.74Å; P959-A962 PolarHBondContact O-N 2.76Å; D960-A962 VanDerWaalsContact C-N 3.31Å; D960-A962 PolarHBondContact O-N 2.92Å; A962-N966 WeakPolarHBondContact O-CB 3.11Å; A962-N966 PolarHBondContact O-N 3.12Å; A962-N966 PolarHBondContact O-ND2 3.24Å
963	L	94.4	Very high	91.8	Very high	88 Å²	88	42.4 Å²	42.4	46%	0.461	23%	0.226	S	C	.	.	H	α-helix	trans	-59.7	-48.6	177.9	178.5	67.4	0	0	0	111.5	P959 D960 E961 N966 K967	P959-L963 WeakPolarHBondContact O-CB 3.35Å; P959-L963 PolarHBondContact O-N 3.43Å; D960-L963 WeakPolarHBondContact O-CB 3.49Å; D960-L963 PolarHBondContact O-N 3.31Å; E961-L963 VanDerWaalsContact C-N 3.34Å; E961-L963 PolarHBondContact O-N 2.88Å; L963-N966 PolarHBondContact O-N 3.35Å; L963-K967 WeakPolarHBondContact O-CG 3.45Å; L963-K967 PolarHBondContact O-N 3.06Å
964	Y	94.8	Very high	93	Very high	47 Å²	47	43 Å²	43	18%	0.184	22%	0.223	C	C	.	.	H	α-helix	trans	-71.5	-37.4	-178.3	-77.7	-68.3	0	0	0	112.9	M938 C941 H945 D960 E961 N966 K967 A968	M938-Y964 WeakPolarHBondContact O-CB 3.28Å; M938-Y964 HydrophobicContact SD-CD1 3.93Å; M938-Y964 HydrophobicContact SD-CE1 4.31Å; C941-Y964 HydrophobicContact CB-CD1 3.53Å; C941-Y964 HydrophobicContact CB-CD2 4.21Å; C941-Y964 HydrophobicContact CB-CE1 3.72Å; C941-Y964 HydrophobicContact CB-CE2 4.37Å; C941-Y964 HydrophobicContact CB-CG 3.81Å; H945-Y964 AromaticContact CD2-CD2 3.98Å; H945-Y964 AromaticContact CD2-CE2 3.6Å; H945-Y964 AromaticContact NE2-CE2 3.53Å; D960-Y964 WeakPolarHBondContact O-CD2 3.47Å; D960-Y964 PolarHBondContact O-N 3.41Å; E961-Y964 PolarHBondContact O-N 3.43Å; Y964-N966 PolarHBondContact O-N 3.42Å; Y964-K967 HydrophobicContact CD1-CD 4.26Å; Y964-K967 PolarHBondContact O-N 3.35Å; Y964-A968 PolarHBondContact O-N 3.47Å
965	Y	96.2	Very high	93.5	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.016	21%	0.211	C	C	.	.	H	α-helix	trans	-63.8	-37.6	172.2	-78.6	-59	0	0	0	112.8	R939 A942 F957 E961 A968 V969 T999 T1002 L1003 L1006	R939-Y965 HydrophobicContact CB-CE1 4.31Å; R939-Y965 HydrophobicContact CG-CD1 4.34Å; R939-Y965 HydrophobicContact CG-CE1 4.24Å; A942-Y965 HydrophobicContact CB-CD1 4.22Å; A942-Y965 HydrophobicContact CB-CD2 3.74Å; A942-Y965 HydrophobicContact CB-CE1 4.1Å; A942-Y965 HydrophobicContact CB-CE2 3.59Å; A942-Y965 HydrophobicContact CB-CG 4.05Å; F957-Y965 HydrophobicContact CE2-CD2 4.05Å; F957-Y965 HydrophobicContact CE2-CE2 4.07Å; F957-Y965 HydrophobicContact CZ-CD2 4.02Å; F957-Y965 HydrophobicContact CZ-CE2 4.49Å; E961-Y965 HydrophobicContact CB-CD2 4.41Å; E961-Y965 HydrophobicContact CB-CE2 4.41Å; E961-Y965 WeakPolarHBondContact O-CD2 3.32Å; E961-Y965 PolarHBondContact O-N 3.26Å; Y965-A968 WeakPolarHBondContact O-CB 3.24Å; Y965-A968 PolarHBondContact O-N 3.13Å; Y965-V969 WeakPolarHBondContact O-CG2 3.22Å; Y965-V969 PolarHBondContact O-N 3.1Å; Y965-V969 VanDerWaalsContact O-N 3.08Å; Y965-T999 HydrophobicContact CD1-CG2 4.1Å; Y965-T1002 HydrophobicContact CE1-CG2 4.2Å; Y965-L1003 HydrophobicContact CD2-CD1 4.27Å; Y965-L1003 HydrophobicContact CG-CD1 4.43Å; Y965-L1006 HydrophobicContact CE2-CD1 3.65Å
966	N	95.3	Very high	94	Very high	83 Å²	83	39.8 Å²	39.8	44%	0.444	21%	0.206	S	C	.	.	H	α-helix	trans	-67.1	-41.1	173.9	-77.5	-71	0	0	0	111.8	A962 L963 Y964 A968 V969 D970	A962-N966 WeakPolarHBondContact O-CB 3.11Å; A962-N966 PolarHBondContact O-N 3.12Å; A962-N966 PolarHBondContact O-ND2 3.24Å; L963-N966 PolarHBondContact O-N 3.35Å; Y964-N966 PolarHBondContact O-N 3.42Å; N966-A968 VanDerWaalsContact C-N 3.32Å; N966-A968 PolarHBondContact O-N 3.22Å; N966-V969 WeakPolarHBondContact O-CB 3.41Å; N966-V969 PolarHBondContact O-N 2.98Å; N966-D970 PolarHBondContact O-N 2.94Å
967	K	96.3	Very high	94.1	Very high	78 Å²	78	45.1 Å²	45.1	34%	0.339	22%	0.223	S	C	.	.	H	α-helix	trans	-59.2	-41.2	171.7	-72.5	176.7	179.2	179.7	0	112.4	M938 L963 Y964 V969 D970 Y971	M938-K967 HydrophobicContact CB-CB 4.45Å; M938-K967 HydrophobicContact CG-CB 3.99Å; M938-K967 HydrophobicContact SD-CB 4.13Å; M938-K967 HydrophobicContact SD-CD 4.1Å; L963-K967 WeakPolarHBondContact O-CG 3.45Å; L963-K967 PolarHBondContact O-N 3.06Å; Y964-K967 HydrophobicContact CD1-CD 4.26Å; Y964-K967 PolarHBondContact O-N 3.35Å; K967-V969 PolarHBondContact O-N 3.06Å; K967-D970 PolarHBondContact O-N 3.35Å; K967-Y971 WeakPolarHBondContact O-CD2 3.32Å; K967-Y971 PolarHBondContact O-N 3.13Å
968	A	96.9	Very high	94.2	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-57.9	-49.1	175.6	0	0	0	0	0	111.1	G935 M938 R939 Y964 Y965 N966 D970 Y971 Y972 T999	G935-A968 WeakPolarHBondContact O-CB 3.42Å; M938-A968 HydrophobicContact CB-CB 3.77Å; R939-A968 HydrophobicContact CG-CB 3.88Å; Y964-A968 PolarHBondContact O-N 3.47Å; Y965-A968 WeakPolarHBondContact O-CB 3.24Å; Y965-A968 PolarHBondContact O-N 3.13Å; N966-A968 VanDerWaalsContact C-N 3.32Å; N966-A968 PolarHBondContact O-N 3.22Å; A968-D970 VanDerWaalsContact C-N 3.33Å; A968-D970 PolarHBondContact O-N 3.11Å; A968-Y971 PolarHBondContact O-N 3.09Å; A968-Y972 HydrophobicContact CB-CE2 4.09Å; A968-Y972 WeakPolarHBondContact O-CD2 3.22Å; A968-Y972 PolarHBondContact O-N 2.84Å; A968-T999 HydrophobicContact CB-CG2 4.04Å
969	V	96.6	Very high	94.2	Very high	5 Å²	5	46.2 Å²	46.2	3%	0.03	23%	0.234	C	C	.	.	H	α-helix	trans	-54.8	-46.1	173.9	165.3	0	0	0	0	111.8	Y965 N966 K967 Y971 Y972 L973 L996 T999 Y1000	Y965-V969 WeakPolarHBondContact O-CG2 3.22Å; Y965-V969 PolarHBondContact O-N 3.1Å; Y965-V969 VanDerWaalsContact O-N 3.08Å; N966-V969 WeakPolarHBondContact O-CB 3.41Å; N966-V969 PolarHBondContact O-N 2.98Å; K967-V969 PolarHBondContact O-N 3.06Å; V969-Y971 VanDerWaalsContact C-N 3.32Å; V969-Y971 PolarHBondContact O-N 2.97Å; V969-Y972 PolarHBondContact O-N 3.49Å; V969-L973 HydrophobicContact CG1-CD1 3.74Å; V969-L973 HydrophobicContact CG1-CG 4.28Å; V969-L973 WeakPolarHBondContact O-CB 3.16Å; V969-L973 VanDerWaalsContact O-CG 3.28Å; V969-L973 WeakPolarHBondContact O-CG 3.47Å; V969-L973 PolarHBondContact O-N 2.81Å; V969-L996 HydrophobicContact CB-CD1 4.38Å; V969-L996 HydrophobicContact CG1-CD1 4.26Å; V969-L996 HydrophobicContact CG2-CD1 4.07Å; V969-T999 HydrophobicContact CG2-CG2 3.83Å; V969-Y1000 HydrophobicContact CG1-CE1 4.22Å; V969-Y1000 HydrophobicContact CG1-CE2 4.25Å; V969-Y1000 WeakPolarHBondContact CG1-OH 3.49Å; V969-Y1000 HydrophobicContact CG2-CD1 4.32Å; V969-Y1000 HydrophobicContact CG2-CE1 3.93Å; V969-Y1000 HydrophobicContact CG2-CE2 4.24Å
970	D	96.9	Very high	94.2	Very high	88 Å²	88	45.6 Å²	45.6	47%	0.471	24%	0.24	S	C	.	.	H	α-helix	trans	-61.6	-38	179.1	-72.9	-30.6	0	0	0	112.6	N966 K967 A968 Q974	N966-D970 PolarHBondContact O-N 2.94Å; K967-D970 PolarHBondContact O-N 3.35Å; A968-D970 VanDerWaalsContact C-N 3.33Å; A968-D970 PolarHBondContact O-N 3.11Å; D970-Q974 VanDerWaalsContact O-CG 3.27Å; D970-Q974 WeakPolarHBondContact O-CG 3.35Å; D970-Q974 PolarHBondContact O-N 3.45Å; D970-Q974 PolarHBondContact O-NE2 3.45Å
971	Y	97.6	Very high	94.1	Very high	47 Å²	47	44.7 Å²	44.7	18%	0.184	24%	0.24	C	C	.	.	H	α-helix	trans	-69.8	-43.9	175.5	-76.4	-63.8	0	0	0	112.8	F908 L931 T934 M938 K967 A968 V969 L973 Q974 A975	F908-Y971 WeakPolarHBondContact CE2-OH 3.44Å; L931-Y971 HydrophobicContact CD2-CD1 3.8Å; L931-Y971 HydrophobicContact CD2-CE1 4.43Å; T934-Y971 HydrophobicContact CG2-CD1 3.93Å; T934-Y971 HydrophobicContact CG2-CD2 3.79Å; T934-Y971 HydrophobicContact CG2-CE1 3.86Å; T934-Y971 HydrophobicContact CG2-CE2 3.72Å; T934-Y971 HydrophobicContact CG2-CG 3.91Å; M938-Y971 HydrophobicContact CG-CD2 3.87Å; M938-Y971 HydrophobicContact CG-CE2 3.98Å; M938-Y971 HydrophobicContact SD-CE2 4.38Å; K967-Y971 WeakPolarHBondContact O-CD2 3.32Å; K967-Y971 PolarHBondContact O-N 3.13Å; A968-Y971 PolarHBondContact O-N 3.09Å; V969-Y971 VanDerWaalsContact C-N 3.32Å; V969-Y971 PolarHBondContact O-N 2.97Å; Y971-L973 VanDerWaalsContact C-N 3.31Å; Y971-L973 PolarHBondContact O-N 2.88Å; Y971-Q974 WeakPolarHBondContact O-CA 3.49Å; Y971-Q974 WeakPolarHBondContact O-CB 3.43Å; Y971-Q974 PolarHBondContact O-N 2.87Å; Y971-A975 PolarHBondContact O-N 3.38Å
972	Y	97.3	Very high	93.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-63.4	-36.5	174.4	-63.8	-58.2	0	0	0	112.3	C932 G935 R936 R939 A968 V969 Q974 A975 L976 V992 E995 L996 T999	C932-Y972 HydrophobicContact CB-CE1 4.47Å; C932-Y972 VanDerWaalsContact O-CE1 3.31Å; C932-Y972 WeakPolarHBondContact O-CE1 3.47Å; G935-Y972 VanDerWaalsContact C-OH 3.32Å; R936-Y972 WeakPolarHBondContact CA-OH 3.47Å; R936-Y972 PolarHBondContact N-OH 3.25Å; R936-Y972 VanDerWaalsContact N-OH 3.15Å; R939-Y972 WeakPolarHBondContact CD-OH 3.4Å; A968-Y972 HydrophobicContact CB-CE2 4.09Å; A968-Y972 WeakPolarHBondContact O-CD2 3.22Å; A968-Y972 PolarHBondContact O-N 2.84Å; V969-Y972 PolarHBondContact O-N 3.49Å; Y972-Q974 VanDerWaalsContact C-N 3.29Å; Y972-Q974 PolarHBondContact O-N 3.18Å; Y972-A975 WeakPolarHBondContact O-CB 3.25Å; Y972-A975 PolarHBondContact O-N 3.49Å; Y972-L976 PolarHBondContact O-N 2.86Å; Y972-V992 HydrophobicContact CD1-CG1 4.36Å; Y972-E995 HydrophobicContact CD1-CB 4.13Å; Y972-E995 HydrophobicContact CE1-CB 3.5Å; Y972-E995 HydrophobicContact CE1-CG 4.27Å; Y972-E995 HydrophobicContact CE2-CB 4.47Å; Y972-E995 PolarHBondContact OH-OE2 3.3Å; Y972-L996 HydrophobicContact CD2-CD1 4.25Å; Y972-L996 HydrophobicContact CG-CB 4.37Å; Y972-T999 HydrophobicContact CE2-CG2 4.45Å; Y972-T999 WeakPolarHBondContact CE2-OG1 3.48Å
973	L	95.9	Very high	93.4	Very high	47 Å²	47	56.6 Å²	56.6	25%	0.246	29%	0.285	C	S	.	.	H	α-helix	trans	-70.4	-22.6	173.2	-70.3	175.6	0	0	0	113.2	V969 Y971 R977 L996	V969-L973 HydrophobicContact CG1-CD1 3.74Å; V969-L973 HydrophobicContact CG1-CG 4.28Å; V969-L973 WeakPolarHBondContact O-CB 3.16Å; V969-L973 VanDerWaalsContact O-CG 3.28Å; V969-L973 WeakPolarHBondContact O-CG 3.47Å; V969-L973 PolarHBondContact O-N 2.81Å; Y971-L973 VanDerWaalsContact C-N 3.31Å; Y971-L973 PolarHBondContact O-N 2.88Å; L973-R977 WeakPolarHBondContact O-CG 3.34Å; L973-R977 PolarHBondContact O-N 3.03Å; L973-R977 PolarHBondContact O-NE 2.88Å; L973-L996 HydrophobicContact CD2-CD2 3.87Å; L973-L996 HydrophobicContact CG-CD2 4.39Å
974	Q	95.6	Very high	92.8	Very high	71 Å²	71	55 Å²	55	33%	0.332	28%	0.281	S	S	.	.	H	α-helix	trans	-74.7	-43.4	167.5	-74.2	167.4	90.6	0	0	110.8	L931 D970 Y971 Y972 L976 R977 A978	L931-Q974 HydrophobicContact CD1-CB 4.02Å; L931-Q974 HydrophobicContact CD2-CB 4.04Å; D970-Q974 VanDerWaalsContact O-CG 3.27Å; D970-Q974 WeakPolarHBondContact O-CG 3.35Å; D970-Q974 PolarHBondContact O-N 3.45Å; D970-Q974 PolarHBondContact O-NE2 3.45Å; Y971-Q974 WeakPolarHBondContact O-CA 3.49Å; Y971-Q974 WeakPolarHBondContact O-CB 3.43Å; Y971-Q974 PolarHBondContact O-N 2.87Å; Y972-Q974 VanDerWaalsContact C-N 3.29Å; Y972-Q974 PolarHBondContact O-N 3.18Å; Q974-L976 PolarHBondContact O-N 3.41Å; Q974-R977 WeakPolarHBondContact O-CB 3.33Å; Q974-R977 PolarHBondContact O-N 2.85Å; Q974-R977 VanDerWaalsContact O-N 3.08Å; Q974-A978 PolarHBondContact O-N 3.5Å
975	A	94.8	Very high	92.3	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-58.1	-46.5	176.6	0	0	0	0	0	112.3	A928 L931 Y971 Y972 R977 A978 L979 V992	A928-A975 HydrophobicContact CB-CB 4.22Å; A928-A975 WeakPolarHBondContact O-CB 3.32Å; L931-A975 HydrophobicContact CB-CB 3.78Å; Y971-A975 PolarHBondContact O-N 3.38Å; Y972-A975 WeakPolarHBondContact O-CB 3.25Å; Y972-A975 PolarHBondContact O-N 3.49Å; A975-R977 VanDerWaalsContact C-N 3.29Å; A975-R977 PolarHBondContact O-N 2.97Å; A975-A978 PolarHBondContact O-N 3.3Å; A975-L979 WeakPolarHBondContact O-CG 3.34Å; A975-L979 PolarHBondContact O-N 2.99Å; A975-V992 HydrophobicContact CB-CG1 3.89Å; A975-V992 HydrophobicContact CB-CG2 4.04Å
976	L	93.6	Very high	91.9	Very high	17 Å²	17	59.1 Å²	59.1	9%	0.089	31%	0.307	C	S	.	.	H	α-helix	trans	-62.3	-34.7	175	-68.3	178.5	0	0	0	112.8	Y972 Q974 G980 W989 V992 L996 Y1035	Y972-L976 PolarHBondContact O-N 2.86Å; Q974-L976 PolarHBondContact O-N 3.41Å; L976-G980 PolarHBondContact O-N 2.96Å; L976-G980 VanDerWaalsContact O-N 3.17Å; L976-W989 HydrophobicContact CB-CZ3 4.45Å; L976-W989 HydrophobicContact CD2-CD2 4.01Å; L976-W989 HydrophobicContact CD2-CE3 3.88Å; L976-W989 HydrophobicContact CD2-CH2 4.22Å; L976-W989 HydrophobicContact CD2-CZ2 4.34Å; L976-W989 HydrophobicContact CD2-CZ3 4Å; L976-V992 HydrophobicContact CD1-CG1 4.49Å; L976-V992 HydrophobicContact CD2-CB 3.98Å; L976-V992 HydrophobicContact CD2-CG1 3.64Å; L976-V992 HydrophobicContact CG-CG1 3.64Å; L976-L996 HydrophobicContact CD1-CD2 3.83Å; L976-Y1035 HydrophobicContact CD1-CE1 4.02Å
977	R	93.4	Very high	91.5	Very high	176 Å²	176	58.9 Å²	58.9	66%	0.664	32%	0.316	S	S	*	.	H	α-helix	trans	-68.6	-38.9	174.8	-80.7	-178.7	-76.3	157.7	-14.1	112.2	L973 Q974 A975 G980	L973-R977 WeakPolarHBondContact O-CG 3.34Å; L973-R977 PolarHBondContact O-N 3.03Å; L973-R977 PolarHBondContact O-NE 2.88Å; Q974-R977 WeakPolarHBondContact O-CB 3.33Å; Q974-R977 PolarHBondContact O-N 2.85Å; Q974-R977 VanDerWaalsContact O-N 3.08Å; A975-R977 VanDerWaalsContact C-N 3.29Å; A975-R977 PolarHBondContact O-N 2.97Å; R977-G980 PolarHBondContact O-N 2.98Å
978	A	91.2	Very high	91.2	Very high	37 Å²	37	56.2 Å²	56.2	31%	0.306	31%	0.307	S	S	.	.	H	α-helix	trans	-65.6	-39.9	176.1	0	0	0	0	0	112.3	A928 L931 Q974 A975 G980	A928-A978 HydrophobicContact CB-CB 4.29Å; L931-A978 HydrophobicContact CD1-CB 4.47Å; Q974-A978 PolarHBondContact O-N 3.5Å; A975-A978 PolarHBondContact O-N 3.3Å; A978-G980 VanDerWaalsContact C-N 3.34Å
979	L	90.2	Very high	90.9	Very high	9 Å²	9	58.7 Å²	58.7	5%	0.047	32%	0.316	C	S	.	.	H	α-helix	trans	-71.1	-26.4	176.9	-66.5	171.4	0	0	0	113.8	A928 A975 S981 S984 H985 V988 W989 V992	A928-L979 HydrophobicContact CB-CD1 4.17Å; A928-L979 HydrophobicContact CB-CD2 3.7Å; A928-L979 HydrophobicContact CB-CG 3.62Å; A975-L979 WeakPolarHBondContact O-CG 3.34Å; A975-L979 PolarHBondContact O-N 2.99Å; L979-S981 PolarHBondContact O-N 3.1Å; L979-S984 PolarHBondContact O-OG 3.22Å; L979-H985 HydrophobicContact CD2-CB 4.39Å; L979-V988 HydrophobicContact CD1-CB 4.48Å; L979-V988 HydrophobicContact CD1-CG1 4.03Å; L979-V988 HydrophobicContact CD2-CB 4.47Å; L979-V988 HydrophobicContact CD2-CG1 4.16Å; L979-W989 HydrophobicContact CB-CE3 3.82Å; L979-W989 HydrophobicContact CB-CZ3 4.15Å; L979-W989 HydrophobicContact CD1-CB 4.29Å; L979-W989 HydrophobicContact CD1-CE3 4.09Å; L979-V992 HydrophobicContact CD1-CG2 4.36Å
980	G	89.1	Confident	90.6	Very high	60 Å²	60	59.5 Å²	59.5	62%	0.619	32%	0.32	S	S	*	.			trans	72.6	-49.6	177.5	0	0	0	0	0	115.3	L976 R977 A978	L976-G980 PolarHBondContact O-N 2.96Å; L976-G980 VanDerWaalsContact O-N 3.17Å; R977-G980 PolarHBondContact O-N 2.98Å; A978-G980 VanDerWaalsContact C-N 3.34Å
981	S	87.3	Confident	90.2	Very high	56 Å²	56	57 Å²	57	39%	0.392	31%	0.31	S	S	.	.	S	Bend	trans	-155.6	155.6	177.3	76.8	0	0	0	0	112.5	L979 K983 S984	L979-S981 PolarHBondContact O-N 3.1Å; S981-K983 PolarHBondContact O-N 2.85Å; S981-K983 VanDerWaalsContact O-N 3.07Å; S981-S984 PolarHBondContact O-N 3.35Å; S981-S984 PolarHBondContact O-OG 3.25Å
982	R	85.3	Confident	90	Very high	80 Å²	80	54.8 Å²	54.8	30%	0.302	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-29	175.4	-170.4	168.2	-177.2	-95.5	-7.1	114.2	S984 P986 W989 D990	R982-S984 VanDerWaalsContact C-N 3.25Å; R982-S984 PolarHBondContact O-N 3.03Å; R982-P986 WeakPolarHBondContact O-CA 3.38Å; R982-P986 WeakPolarHBondContact O-CG 3.39Å; R982-W989 HydrophobicContact CB-CD2 3.97Å; R982-W989 HydrophobicContact CB-CG 3.8Å; R982-W989 HydrophobicContact CG-CB 4.32Å; R982-W989 VanDerWaalsContact CG-CD1 3.42Å; R982-W989 HydrophobicContact CG-CG 3.87Å; R982-D990 IonicContact CZ-OD1 3.13Å; R982-D990 IonicContact CZ-OD2 2.79Å; R982-D990 IonicContact NE-OD1 3.7Å; R982-D990 PolarHBondContact NE-OD1 3.12Å; R982-D990 IonicContact NE-OD2 3.47Å; R982-D990 PolarHBondContact NE-OD2 2.97Å; R982-D990 IonicContact NH2-OD1 2.78Å; R982-D990 IonicContact NH2-OD2 3.54Å; R982-D990 PolarHBondContact NH2-OD2 3.14Å
983	K	83	Confident	89.8	Confident	196 Å²	196	55.6 Å²	55.6	85%	0.852	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-20.2	-177.1	-68.5	-171.3	177.3	-173.8	0	113.9	S981	S981-K983 PolarHBondContact O-N 2.85Å; S981-K983 VanDerWaalsContact O-N 3.07Å
984	S	81.6	Confident	89.6	Confident	54 Å²	54	55.7 Å²	55.7	38%	0.378	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-55.1	-179.9	64.4	0	0	0	0	110.8	L979 S981 R982	L979-S984 PolarHBondContact O-OG 3.22Å; S981-S984 PolarHBondContact O-N 3.35Å; S981-S984 PolarHBondContact O-OG 3.25Å; R982-S984 VanDerWaalsContact C-N 3.25Å; R982-S984 PolarHBondContact O-N 3.03Å
985	H	84.4	Confident	89.6	Confident	76 Å²	76	54.1 Å²	54.1	35%	0.352	30%	0.295	S	S	.	.			trans	-142.6	84.1	-176.8	-61.7	81.9	0	0	0	110.5	T925 L979 A987 V988 W989	T925-H985 HydrophobicContact CG2-CB 4.3Å; T925-H985 PolarHBondContact OG1-CE1 3.16Å; T925-H985 PolarHBondContact OG1-ND1 3.47Å; T925-H985 VanDerWaalsContact OG1-ND1 3.14Å; T925-H985 PolarHBondContact OG1-NE2 2.81Å; T925-H985 VanDerWaalsContact OG1-NE2 3.07Å; L979-H985 HydrophobicContact CD2-CB 4.39Å; H985-A987 PolarHBondContact O-N 3.35Å; H985-V988 HydrophobicContact CB-CB 4.22Å; H985-V988 HydrophobicContact CB-CG2 4.23Å; H985-V988 PolarHBondContact O-N 3.12Å; H985-W989 WeakPolarHBondContact O-CB 3.46Å; H985-W989 PolarHBondContact O-N 3.28Å
986	P	87.4	Confident	89.6	Confident	61 Å²	61	54.1 Å²	54.1	40%	0.396	30%	0.295	S	S	.	.	H	α-helix	trans	-56.5	-45.5	-172.9	-26.7	33.6	0	0	0	113.8	R982 V988 W989 D990	R982-P986 WeakPolarHBondContact O-CA 3.38Å; R982-P986 WeakPolarHBondContact O-CG 3.39Å; P986-V988 PolarHBondContact O-N 3.18Å; P986-W989 PolarHBondContact O-N 3.23Å; P986-D990 WeakPolarHBondContact O-CB 3.41Å; P986-D990 PolarHBondContact O-N 3.34Å
987	A	87.6	Confident	89.6	Confident	78 Å²	78	53.3 Å²	53.3	65%	0.645	29%	0.291	S	S	*	.	H	α-helix	trans	-61.2	-44.2	-178.4	0	0	0	0	0	112.9	H985 S991	H985-A987 PolarHBondContact O-N 3.35Å; A987-S991 WeakPolarHBondContact O-CB 3.3Å; A987-S991 PolarHBondContact O-N 3.03Å
988	V	88.7	Confident	89.7	Confident	23 Å²	23	45.7 Å²	45.7	14%	0.139	26%	0.264	C	S	.	.	H	α-helix	trans	-68.6	-44.9	177.9	-174	0	0	0	0	110.4	T925 L929 L979 H985 P986 D990 S991 V992	T925-V988 HydrophobicContact CG2-CG2 4.07Å; L929-V988 HydrophobicContact CD2-CG1 3.76Å; L929-V988 HydrophobicContact CD2-CG2 4.26Å; L929-V988 HydrophobicContact CG-CG1 4.07Å; L979-V988 HydrophobicContact CD1-CB 4.48Å; L979-V988 HydrophobicContact CD1-CG1 4.03Å; L979-V988 HydrophobicContact CD2-CB 4.47Å; L979-V988 HydrophobicContact CD2-CG1 4.16Å; H985-V988 HydrophobicContact CB-CB 4.22Å; H985-V988 HydrophobicContact CB-CG2 4.23Å; H985-V988 PolarHBondContact O-N 3.12Å; P986-V988 PolarHBondContact O-N 3.18Å; V988-D990 PolarHBondContact O-N 2.76Å; V988-S991 WeakPolarHBondContact O-CB 3.43Å; V988-S991 PolarHBondContact O-N 3.3Å; V988-S991 VanDerWaalsContact O-N 3.14Å; V988-V992 HydrophobicContact CG1-CG2 4.47Å; V988-V992 WeakPolarHBondContact O-CG2 3.43Å; V988-V992 PolarHBondContact O-N 2.88Å
989	W	91.3	Very high	89.9	Confident	52 Å²	52	44 Å²	44	20%	0.197	25%	0.25	C	C	.	.	H	α-helix	trans	-57.8	-46	176.5	-179.1	-86.2	0	0	0	112.2	L976 L979 R982 H985 P986 S991 V992 N993	L976-W989 HydrophobicContact CB-CZ3 4.45Å; L976-W989 HydrophobicContact CD2-CD2 4.01Å; L976-W989 HydrophobicContact CD2-CE3 3.88Å; L976-W989 HydrophobicContact CD2-CH2 4.22Å; L976-W989 HydrophobicContact CD2-CZ2 4.34Å; L976-W989 HydrophobicContact CD2-CZ3 4Å; L979-W989 HydrophobicContact CB-CE3 3.82Å; L979-W989 HydrophobicContact CB-CZ3 4.15Å; L979-W989 HydrophobicContact CD1-CB 4.29Å; L979-W989 HydrophobicContact CD1-CE3 4.09Å; R982-W989 HydrophobicContact CB-CD2 3.97Å; R982-W989 HydrophobicContact CB-CG 3.8Å; R982-W989 HydrophobicContact CG-CB 4.32Å; R982-W989 VanDerWaalsContact CG-CD1 3.42Å; R982-W989 HydrophobicContact CG-CG 3.87Å; H985-W989 WeakPolarHBondContact O-CB 3.46Å; H985-W989 PolarHBondContact O-N 3.28Å; P986-W989 PolarHBondContact O-N 3.23Å; W989-S991 VanDerWaalsContact C-N 3.27Å; W989-S991 PolarHBondContact O-N 3.23Å; W989-V992 PolarHBondContact O-N 3.12Å; W989-N993 PolarHBondContact NE1-ND2 3.4Å; W989-N993 PolarHBondContact O-N 3.38Å; W989-N993 PolarHBondContact O-ND2 3.47Å
990	D	89.6	Confident	90.3	Very high	21 Å²	21	44.5 Å²	44.5	11%	0.112	25%	0.251	C	S	.	.	H	α-helix	trans	-70.2	-25.6	179.4	-64.4	-13.7	0	0	0	111.8	R982 P986 V988 W994 R1044 Y1048	R982-D990 IonicContact CZ-OD1 3.13Å; R982-D990 IonicContact CZ-OD2 2.79Å; R982-D990 IonicContact NE-OD1 3.7Å; R982-D990 PolarHBondContact NE-OD1 3.12Å; R982-D990 IonicContact NE-OD2 3.47Å; R982-D990 PolarHBondContact NE-OD2 2.97Å; R982-D990 IonicContact NH2-OD1 2.78Å; R982-D990 IonicContact NH2-OD2 3.54Å; R982-D990 PolarHBondContact NH2-OD2 3.14Å; P986-D990 WeakPolarHBondContact O-CB 3.41Å; P986-D990 PolarHBondContact O-N 3.34Å; V988-D990 PolarHBondContact O-N 2.76Å; D990-W994 WeakPolarHBondContact O-CB 3.42Å; D990-W994 PolarHBondContact O-N 2.85Å; D990-W994 VanDerWaalsContact O-N 3.13Å; D990-R1044 PolarHBondContact O-NH1 3.06Å; D990-Y1048 PolarHBondContact O-OH 3.11Å
991	S	90.6	Very high	90.6	Very high	37 Å²	37	43.5 Å²	43.5	26%	0.259	23%	0.23	S	C	.	.	H	α-helix	trans	-72.6	-47.2	171.8	-133.1	0	0	0	0	111.9	A987 V988 W989 N993 W994 E995 R1044	A987-S991 WeakPolarHBondContact O-CB 3.3Å; A987-S991 PolarHBondContact O-N 3.03Å; V988-S991 WeakPolarHBondContact O-CB 3.43Å; V988-S991 PolarHBondContact O-N 3.3Å; V988-S991 VanDerWaalsContact O-N 3.14Å; W989-S991 VanDerWaalsContact C-N 3.27Å; W989-S991 PolarHBondContact O-N 3.23Å; S991-N993 VanDerWaalsContact C-N 3.33Å; S991-N993 PolarHBondContact O-N 3.04Å; S991-W994 WeakPolarHBondContact O-CB 3.43Å; S991-W994 PolarHBondContact O-N 3.29Å; S991-E995 WeakPolarHBondContact O-CG 3.27Å; S991-E995 PolarHBondContact O-N 3.34Å; S991-R1044 VanDerWaalsContact N-NH1 3.13Å; S991-R1044 PolarHBondContact OG-NH2 3.26Å
992	V	92.8	Very high	91	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-63.5	-39.4	177.9	178	0	0	0	0	111.1	C932 Y972 A975 L976 L979 V988 W989 L996	C932-V992 HydrophobicContact CB-CG2 4.09Å; Y972-V992 HydrophobicContact CD1-CG1 4.36Å; A975-V992 HydrophobicContact CB-CG1 3.89Å; A975-V992 HydrophobicContact CB-CG2 4.04Å; L976-V992 HydrophobicContact CD1-CG1 4.49Å; L976-V992 HydrophobicContact CD2-CB 3.98Å; L976-V992 HydrophobicContact CD2-CG1 3.64Å; L976-V992 HydrophobicContact CG-CG1 3.64Å; L979-V992 HydrophobicContact CD1-CG2 4.36Å; V988-V992 HydrophobicContact CG1-CG2 4.47Å; V988-V992 WeakPolarHBondContact O-CG2 3.43Å; V988-V992 PolarHBondContact O-N 2.88Å; W989-V992 PolarHBondContact O-N 3.12Å; V992-L996 WeakPolarHBondContact O-CB 3.3Å; V992-L996 PolarHBondContact O-N 2.89Å
993	N	92	Very high	91.4	Very high	17 Å²	17	39.1 Å²	39.1	9%	0.091	21%	0.209	C	C	.	.	H	α-helix	trans	-66.2	-39.5	173.9	-74.6	-52.4	0	0	0	112.7	W989 S991 L996 S997 Y1035	W989-N993 PolarHBondContact NE1-ND2 3.4Å; W989-N993 PolarHBondContact O-N 3.38Å; W989-N993 PolarHBondContact O-ND2 3.47Å; S991-N993 VanDerWaalsContact C-N 3.33Å; S991-N993 PolarHBondContact O-N 3.04Å; N993-L996 PolarHBondContact O-N 3.29Å; N993-S997 WeakPolarHBondContact O-CB 3.3Å; N993-S997 PolarHBondContact O-N 2.99Å; N993-Y1035 WeakPolarHBondContact OD1-CD1 3.38Å
994	W	93.1	Very high	92	Very high	49 Å²	49	29.8 Å²	29.8	19%	0.186	17%	0.168	C	C	.	.	H	α-helix	trans	-60.9	-48.2	176.4	173.1	-102	0	0	0	111	D990 S991 S997 T998 L1047 Y1048 R1051	D990-W994 WeakPolarHBondContact O-CB 3.42Å; D990-W994 PolarHBondContact O-N 2.85Å; D990-W994 VanDerWaalsContact O-N 3.13Å; S991-W994 WeakPolarHBondContact O-CB 3.43Å; S991-W994 PolarHBondContact O-N 3.29Å; W994-S997 PolarHBondContact O-N 3.3Å; W994-T998 WeakPolarHBondContact O-CB 3.24Å; W994-T998 PolarHBondContact O-N 3.41Å; W994-T998 PolarHBondContact O-OG1 3.08Å; W994-L1047 HydrophobicContact CH2-CB 3.55Å; W994-L1047 HydrophobicContact CH2-CD1 4.14Å; W994-L1047 HydrophobicContact CH2-CG 4.4Å; W994-L1047 HydrophobicContact CZ2-CD1 4.4Å; W994-L1047 HydrophobicContact CZ3-CB 3.53Å; W994-L1047 HydrophobicContact CZ3-CD1 4.49Å; W994-Y1048 WeakPolarHBondContact CA-OH 3.31Å; W994-Y1048 AromaticContact CE3-CD1 3.88Å; W994-Y1048 HydrophobicContact CE3-CD1 3.88Å; W994-Y1048 AromaticContact CE3-CE1 3.61Å; W994-Y1048 HydrophobicContact CE3-CE1 3.61Å; W994-Y1048 HydrophobicContact CZ3-CD1 4.09Å; W994-Y1048 HydrophobicContact CZ3-CE1 4.28Å; W994-Y1048 PolarHBondContact N-OH 3.18Å; W994-R1051 PolarHBondContact O-NH1 3.37Å
995	E	94.3	Very high	92.6	Very high	37 Å²	37	28.1 Å²	28.1	17%	0.173	16%	0.156	C	C	.	.	H	α-helix	trans	-65	-41.2	178.2	-72.8	-60	118.3	0	0	112.5	R939 Y972 S991 T998 T999	R939-E995 IonicContact CZ-OE2 3.35Å; R939-E995 IonicContact NH1-OE1 2.77Å; R939-E995 IonicContact NH1-OE2 3.19Å; R939-E995 PolarHBondContact NH1-OE2 2.86Å; Y972-E995 HydrophobicContact CD1-CB 4.13Å; Y972-E995 HydrophobicContact CE1-CB 3.5Å; Y972-E995 HydrophobicContact CE1-CG 4.27Å; Y972-E995 HydrophobicContact CE2-CB 4.47Å; Y972-E995 PolarHBondContact OH-OE2 3.3Å; S991-E995 WeakPolarHBondContact O-CG 3.27Å; S991-E995 PolarHBondContact O-N 3.34Å; E995-T998 WeakPolarHBondContact O-CB 3.3Å; E995-T998 PolarHBondContact O-N 3.1Å; E995-T999 WeakPolarHBondContact O-CB 3.22Å; E995-T999 PolarHBondContact O-N 2.89Å; E995-T999 PolarHBondContact O-OG1 3.46Å
996	L	94.9	Very high	93.1	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-66.6	-44.6	176.5	-177.2	52.8	0	0	0	112.2	V969 Y972 L973 L976 V992 N993 T998 T999 Y1000 Y1035	V969-L996 HydrophobicContact CB-CD1 4.38Å; V969-L996 HydrophobicContact CG1-CD1 4.26Å; V969-L996 HydrophobicContact CG2-CD1 4.07Å; Y972-L996 HydrophobicContact CD2-CD1 4.25Å; Y972-L996 HydrophobicContact CG-CB 4.37Å; L973-L996 HydrophobicContact CD2-CD2 3.87Å; L973-L996 HydrophobicContact CG-CD2 4.39Å; L976-L996 HydrophobicContact CD1-CD2 3.83Å; V992-L996 WeakPolarHBondContact O-CB 3.3Å; V992-L996 PolarHBondContact O-N 2.89Å; N993-L996 PolarHBondContact O-N 3.29Å; L996-T998 VanDerWaalsContact C-N 3.31Å; L996-T998 PolarHBondContact O-N 3.07Å; L996-T999 PolarHBondContact O-N 2.66Å; L996-Y1000 HydrophobicContact CD1-CD2 3.75Å; L996-Y1000 HydrophobicContact CD1-CE2 3.41Å; L996-Y1000 VanDerWaalsContact CD1-CE2 3.41Å; L996-Y1000 HydrophobicContact CG-CD2 4.04Å; L996-Y1000 HydrophobicContact CG-CE2 3.87Å; L996-Y1000 VanDerWaalsContact O-CD2 3.32Å; L996-Y1000 WeakPolarHBondContact O-CD2 3.19Å; L996-Y1000 PolarHBondContact O-N 3.36Å; L996-Y1035 HydrophobicContact CD2-CD1 3.95Å; L996-Y1035 HydrophobicContact CD2-CD2 3.93Å; L996-Y1035 HydrophobicContact CD2-CE1 3.72Å; L996-Y1035 HydrophobicContact CD2-CE2 3.76Å; L996-Y1035 HydrophobicContact CD2-CG 4.05Å; L996-Y1035 HydrophobicContact CG-CD2 3.93Å; L996-Y1035 HydrophobicContact CG-CE2 4.12Å; L996-Y1035 HydrophobicContact CG-CG 4.2Å
997	S	95	Very high	93.3	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-57.8	-45	172.5	171.4	0	0	0	0	110.9	N993 W994 F1001 S1032 C1036 R1051	N993-S997 WeakPolarHBondContact O-CB 3.3Å; N993-S997 PolarHBondContact O-N 2.99Å; W994-S997 PolarHBondContact O-N 3.3Å; S997-F1001 WeakPolarHBondContact O-CB 3.35Å; S997-F1001 PolarHBondContact O-N 3.41Å; S997-S1032 PolarHBondContact O-OG 3.47Å; S997-S1032 PolarHBondContact OG-O 3.43Å; S997-S1032 PolarHBondContact OG-OG 3.28Å; S997-C1036 PolarHBondContact OG-SG 3.23Å; S997-R1051 VanDerWaalsContact OG-CD 3.25Å; S997-R1051 WeakPolarHBondContact OG-CD 3.39Å; S997-R1051 PolarHBondContact OG-NH1 2.71Å
998	T	94.8	Very high	93.6	Very high	17 Å²	17	21.5 Å²	21.5	10%	0.104	11%	0.108	C	C	.	.	H	α-helix	trans	-61.7	-44.6	176.5	-52.7	0	0	0	0	110.9	W994 E995 L996 F1001 T1002 R1051	W994-T998 WeakPolarHBondContact O-CB 3.24Å; W994-T998 PolarHBondContact O-N 3.41Å; W994-T998 PolarHBondContact O-OG1 3.08Å; E995-T998 WeakPolarHBondContact O-CB 3.3Å; E995-T998 PolarHBondContact O-N 3.1Å; L996-T998 VanDerWaalsContact C-N 3.31Å; L996-T998 PolarHBondContact O-N 3.07Å; T998-F1001 PolarHBondContact O-N 3.32Å; T998-T1002 PolarHBondContact O-N 3.45Å; T998-T1002 PolarHBondContact O-OG1 3.29Å; T998-T1002 VanDerWaalsContact O-OG1 3.1Å; T998-R1051 VanDerWaalsContact OG1-CZ 3.28Å; T998-R1051 PolarHBondContact OG1-NH1 3.43Å; T998-R1051 PolarHBondContact OG1-NH2 2.89Å
999	T	96.1	Very high	93.7	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-62	-47.3	-179.2	-56.5	0	0	0	0	111.9	R939 Y965 A968 V969 Y972 E995 L996 F1001 L1003	R939-T999 WeakPolarHBondContact CD-OG1 3.18Å; R939-T999 HydrophobicContact CG-CG2 4.37Å; Y965-T999 HydrophobicContact CD1-CG2 4.1Å; A968-T999 HydrophobicContact CB-CG2 4.04Å; V969-T999 HydrophobicContact CG2-CG2 3.83Å; Y972-T999 HydrophobicContact CE2-CG2 4.45Å; Y972-T999 WeakPolarHBondContact CE2-OG1 3.48Å; E995-T999 WeakPolarHBondContact O-CB 3.22Å; E995-T999 PolarHBondContact O-N 2.89Å; E995-T999 PolarHBondContact O-OG1 3.46Å; L996-T999 PolarHBondContact O-N 2.66Å; T999-F1001 VanDerWaalsContact C-N 3.34Å; T999-L1003 WeakPolarHBondContact O-CB 3.33Å; T999-L1003 PolarHBondContact O-N 2.98Å
1000	Y	97.1	Very high	93.8	Very high	20 Å²	20	26.3 Å²	26.3	8%	0.078	13%	0.131	C	C	.	.	H	α-helix	trans	-64.7	-37.6	174.8	-80.2	-61.9	0	0	0	112.7	V969 L996 A1004 K1031 Y1035	V969-Y1000 HydrophobicContact CG1-CE1 4.22Å; V969-Y1000 HydrophobicContact CG1-CE2 4.25Å; V969-Y1000 WeakPolarHBondContact CG1-OH 3.49Å; V969-Y1000 HydrophobicContact CG2-CD1 4.32Å; V969-Y1000 HydrophobicContact CG2-CE1 3.93Å; V969-Y1000 HydrophobicContact CG2-CE2 4.24Å; L996-Y1000 HydrophobicContact CD1-CD2 3.75Å; L996-Y1000 HydrophobicContact CD1-CE2 3.41Å; L996-Y1000 VanDerWaalsContact CD1-CE2 3.41Å; L996-Y1000 HydrophobicContact CG-CD2 4.04Å; L996-Y1000 HydrophobicContact CG-CE2 3.87Å; L996-Y1000 VanDerWaalsContact O-CD2 3.32Å; L996-Y1000 WeakPolarHBondContact O-CD2 3.19Å; L996-Y1000 PolarHBondContact O-N 3.36Å; Y1000-A1004 VanDerWaalsContact O-CB 3.3Å; Y1000-A1004 WeakPolarHBondContact O-CB 3.44Å; Y1000-A1004 PolarHBondContact O-N 3.38Å; Y1000-K1031 HydrophobicContact CD1-CB 3.81Å; Y1000-K1031 HydrophobicContact CD1-CD 4.1Å; Y1000-K1031 HydrophobicContact CD2-CB 4Å; Y1000-K1031 HydrophobicContact CE1-CB 3.85Å; Y1000-K1031 HydrophobicContact CE1-CD 3.46Å; Y1000-K1031 VanDerWaalsContact CE1-CD 3.46Å; Y1000-K1031 HydrophobicContact CE1-CG 4.25Å; Y1000-K1031 HydrophobicContact CE2-CB 4.03Å; Y1000-K1031 HydrophobicContact CG-CB 3.88Å; Y1000-Y1035 HydrophobicContact CD2-CD2 4.09Å; Y1000-Y1035 HydrophobicContact CD2-CE2 4.29Å; Y1000-Y1035 HydrophobicContact CE2-CD2 4.03Å; Y1000-Y1035 AromaticContact CE2-CE2 3.75Å; Y1000-Y1035 HydrophobicContact CE2-CE2 3.75Å
1001	F	96.5	Very high	93.8	Very high	40 Å²	40	26.2 Å²	26.2	18%	0.175	13%	0.133	C	C	.	.	H	α-helix	trans	-63.5	-52.6	176.6	-177.6	-113.4	0	0	0	111.1	S997 T998 T999 L1003 A1004 T1005 M1029 R1051 T1054 I1055	S997-F1001 WeakPolarHBondContact O-CB 3.35Å; S997-F1001 PolarHBondContact O-N 3.41Å; T998-F1001 PolarHBondContact O-N 3.32Å; T999-F1001 VanDerWaalsContact C-N 3.34Å; F1001-L1003 VanDerWaalsContact C-N 3.34Å; F1001-L1003 PolarHBondContact O-N 3.38Å; F1001-A1004 PolarHBondContact O-N 3.09Å; F1001-A1004 VanDerWaalsContact O-N 3.11Å; F1001-T1005 HydrophobicContact CD1-CG2 4.35Å; F1001-T1005 HydrophobicContact CD2-CG2 4.22Å; F1001-T1005 HydrophobicContact CE1-CG2 3.99Å; F1001-T1005 HydrophobicContact CE2-CG2 3.86Å; F1001-T1005 HydrophobicContact CG-CG2 4.46Å; F1001-T1005 HydrophobicContact CZ-CG2 3.74Å; F1001-T1005 WeakPolarHBondContact O-CG2 3.4Å; F1001-T1005 PolarHBondContact O-N 2.9Å; F1001-T1005 PolarHBondContact O-OG1 3.44Å; F1001-M1029 HydrophobicContact CD2-SD 4.09Å; F1001-M1029 HydrophobicContact CE2-CE 4.42Å; F1001-M1029 HydrophobicContact CE2-SD 4.37Å; F1001-R1051 HydrophobicContact CD2-CG 4.31Å; F1001-R1051 HydrophobicContact CG-CG 4.33Å; F1001-T1054 HydrophobicContact CE2-CG2 4.36Å; F1001-T1054 HydrophobicContact CZ-CG2 3.94Å; F1001-I1055 HydrophobicContact CD2-CD1 3.97Å; F1001-I1055 HydrophobicContact CD2-CG1 3.5Å; F1001-I1055 VanDerWaalsContact CD2-CG1 3.5Å; F1001-I1055 HydrophobicContact CE2-CG1 3.64Å
1002	T	95.4	Very high	93.8	Very high	30 Å²	30	24.8 Å²	24.8	18%	0.184	12%	0.122	C	C	.	.	H	α-helix	trans	-58.8	-42.9	177.3	-56.7	0	0	0	0	111.9	Y965 T998 A1004 T1005 L1006	Y965-T1002 HydrophobicContact CE1-CG2 4.2Å; T998-T1002 PolarHBondContact O-N 3.45Å; T998-T1002 PolarHBondContact O-OG1 3.29Å; T998-T1002 VanDerWaalsContact O-OG1 3.1Å; T1002-A1004 VanDerWaalsContact C-N 3.32Å; T1002-A1004 PolarHBondContact O-N 3.17Å; T1002-T1005 PolarHBondContact O-N 3.13Å; T1002-T1005 PolarHBondContact O-OG1 3.45Å; T1002-T1005 VanDerWaalsContact O-OG1 3.09Å; T1002-L1006 HydrophobicContact CG2-CD1 3.96Å; T1002-L1006 HydrophobicContact CG2-CG 4.27Å; T1002-L1006 WeakPolarHBondContact O-CB 3.35Å; T1002-L1006 VanDerWaalsContact O-CG 3.23Å; T1002-L1006 WeakPolarHBondContact O-CG 3.49Å; T1002-L1006 PolarHBondContact O-N 3.01Å
1003	L	94.4	Very high	93.7	Very high	13 Å²	13	29.2 Å²	29.2	7%	0.068	15%	0.146	C	C	.	.	H	α-helix	trans	-59.9	-43.4	175.4	177.7	60.6	0	0	0	111.6	F957 Y965 T999 F1001 L1007	F957-L1003 HydrophobicContact CE1-CD1 3.78Å; F957-L1003 HydrophobicContact CE2-CD1 4.41Å; F957-L1003 HydrophobicContact CZ-CD1 3.42Å; F957-L1003 VanDerWaalsContact CZ-CD1 3.42Å; Y965-L1003 HydrophobicContact CD2-CD1 4.27Å; Y965-L1003 HydrophobicContact CG-CD1 4.43Å; T999-L1003 WeakPolarHBondContact O-CB 3.33Å; T999-L1003 PolarHBondContact O-N 2.98Å; F1001-L1003 VanDerWaalsContact C-N 3.34Å; F1001-L1003 PolarHBondContact O-N 3.38Å; L1003-L1007 HydrophobicContact CD1-CD1 4.07Å; L1003-L1007 HydrophobicContact CD1-CG 4.39Å; L1003-L1007 HydrophobicContact CG-CD1 4.08Å; L1003-L1007 WeakPolarHBondContact O-CB 3.49Å; L1003-L1007 VanDerWaalsContact O-CG 3.3Å; L1003-L1007 WeakPolarHBondContact O-CG 3.24Å; L1003-L1007 PolarHBondContact O-N 3.14Å
1004	A	95.1	Very high	93.5	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-69.4	-40.7	179.7	0	0	0	0	0	113	Y1000 F1001 T1002 Q1008 A1028 M1029	Y1000-A1004 VanDerWaalsContact O-CB 3.3Å; Y1000-A1004 WeakPolarHBondContact O-CB 3.44Å; Y1000-A1004 PolarHBondContact O-N 3.38Å; F1001-A1004 PolarHBondContact O-N 3.09Å; F1001-A1004 VanDerWaalsContact O-N 3.11Å; T1002-A1004 VanDerWaalsContact C-N 3.32Å; T1002-A1004 PolarHBondContact O-N 3.17Å; A1004-Q1008 WeakPolarHBondContact O-CB 3.5Å; A1004-Q1008 PolarHBondContact O-N 3.49Å; A1004-A1028 HydrophobicContact CB-CB 3.67Å; A1004-M1029 HydrophobicContact CB-CE 3.61Å; A1004-M1029 HydrophobicContact CB-CG 3.74Å; A1004-M1029 HydrophobicContact CB-SD 3.55Å; A1004-M1029 VanDerWaalsContact CB-SD 3.55Å
1005	T	94.8	Very high	93.3	Very high	19 Å²	19	36.7 Å²	36.7	12%	0.117	19%	0.186	C	C	.	.	H	α-helix	trans	-66.9	-42.3	176.3	58.7	0	0	0	0	111.2	F1001 T1002 L1007 Q1008 D1009 M1029	F1001-T1005 HydrophobicContact CD1-CG2 4.35Å; F1001-T1005 HydrophobicContact CD2-CG2 4.22Å; F1001-T1005 HydrophobicContact CE1-CG2 3.99Å; F1001-T1005 HydrophobicContact CE2-CG2 3.86Å; F1001-T1005 HydrophobicContact CG-CG2 4.46Å; F1001-T1005 HydrophobicContact CZ-CG2 3.74Å; F1001-T1005 WeakPolarHBondContact O-CG2 3.4Å; F1001-T1005 PolarHBondContact O-N 2.9Å; F1001-T1005 PolarHBondContact O-OG1 3.44Å; T1002-T1005 PolarHBondContact O-N 3.13Å; T1002-T1005 PolarHBondContact O-OG1 3.45Å; T1002-T1005 VanDerWaalsContact O-OG1 3.09Å; T1005-L1007 PolarHBondContact O-N 3.35Å; T1005-Q1008 PolarHBondContact O-N 3.34Å; T1005-Q1008 VanDerWaalsContact O-N 3.14Å; T1005-D1009 WeakPolarHBondContact O-CB 3.4Å; T1005-D1009 PolarHBondContact O-N 3.21Å; T1005-M1029 HydrophobicContact CG2-CE 4.07Å
1006	L	93.1	Very high	93.2	Very high	18 Å²	18	38.7 Å²	38.7	9%	0.094	19%	0.194	C	C	.	.	H	α-helix	trans	-63.9	-39.8	176.2	-69.4	179.6	0	0	0	112.8	F957 Y965 T1002 Q1008 Y1010	F957-L1006 HydrophobicContact CD2-CB 3.73Å; F957-L1006 HydrophobicContact CD2-CD1 4.17Å; F957-L1006 HydrophobicContact CE2-CB 3.92Å; F957-L1006 HydrophobicContact CE2-CD1 3.87Å; F957-L1006 HydrophobicContact CG-CB 4.44Å; Y965-L1006 HydrophobicContact CE2-CD1 3.65Å; T1002-L1006 HydrophobicContact CG2-CD1 3.96Å; T1002-L1006 HydrophobicContact CG2-CG 4.27Å; T1002-L1006 WeakPolarHBondContact O-CB 3.35Å; T1002-L1006 VanDerWaalsContact O-CG 3.23Å; T1002-L1006 WeakPolarHBondContact O-CG 3.49Å; T1002-L1006 PolarHBondContact O-N 3.01Å; L1006-Q1008 VanDerWaalsContact C-N 3.28Å; L1006-Q1008 PolarHBondContact O-N 3.2Å; L1006-Y1010 HydrophobicContact CD2-CD2 3.86Å; L1006-Y1010 HydrophobicContact CD2-CE2 4.14Å; L1006-Y1010 CarbonylContact O-C 3.59Å; L1006-Y1010 WeakPolarHBondContact O-CA 3.43Å; L1006-Y1010 WeakPolarHBondContact O-CB 3.38Å; L1006-Y1010 PolarHBondContact O-N 3.29Å
1007	L	92.1	Very high	93	Very high	11 Å²	11	42 Å²	42	6%	0.058	22%	0.221	C	C	.	.	H	α-helix	trans	-65.7	-29.3	173.4	-78.4	167.8	0	0	0	113.2	F957 L1003 T1005 A1011 I1021 E1024 V1025	F957-L1007 HydrophobicContact CD1-CD2 3.51Å; F957-L1007 HydrophobicContact CD1-CG 4.01Å; F957-L1007 HydrophobicContact CE1-CD2 3.79Å; F957-L1007 HydrophobicContact CE1-CG 4.02Å; F957-L1007 HydrophobicContact CG-CD2 4.48Å; L1003-L1007 HydrophobicContact CD1-CD1 4.07Å; L1003-L1007 HydrophobicContact CD1-CG 4.39Å; L1003-L1007 HydrophobicContact CG-CD1 4.08Å; L1003-L1007 WeakPolarHBondContact O-CB 3.49Å; L1003-L1007 VanDerWaalsContact O-CG 3.3Å; L1003-L1007 WeakPolarHBondContact O-CG 3.24Å; L1003-L1007 PolarHBondContact O-N 3.14Å; T1005-L1007 PolarHBondContact O-N 3.35Å; L1007-A1011 VanDerWaalsContact O-CA 3.3Å; L1007-A1011 WeakPolarHBondContact O-CA 3.43Å; L1007-I1021 VanDerWaalsContact O-CG2 3.28Å; L1007-I1021 WeakPolarHBondContact O-CG2 3.46Å; L1007-E1024 HydrophobicContact CD1-CB 4.37Å; L1007-V1025 HydrophobicContact CB-CG2 3.65Å
1008	Q	93.5	Very high	92.7	Very high	48 Å²	48	46.3 Å²	46.3	22%	0.224	24%	0.242	C	C	.	.	H	α-helix	trans	-84.5	-43.9	-179.7	-171.6	176.5	23.1	0	0	112.4	A1004 T1005 L1006 V1025 R1058	A1004-Q1008 WeakPolarHBondContact O-CB 3.5Å; A1004-Q1008 PolarHBondContact O-N 3.49Å; T1005-Q1008 PolarHBondContact O-N 3.34Å; T1005-Q1008 VanDerWaalsContact O-N 3.14Å; L1006-Q1008 VanDerWaalsContact C-N 3.28Å; L1006-Q1008 PolarHBondContact O-N 3.2Å; Q1008-V1025 HydrophobicContact CB-CG1 4.13Å; Q1008-V1025 HydrophobicContact CB-CG2 3.98Å; Q1008-V1025 HydrophobicContact CG-CG1 4.43Å; Q1008-R1058 PolarHBondContact NE2-O 3.26Å; Q1008-R1058 VanDerWaalsContact OE1-CZ 3.31Å
1009	D	92.3	Very high	92.3	Very high	89 Å²	89	50.8 Å²	50.8	48%	0.476	26%	0.261	S	S	.	.	H	α-helix	trans	-85.9	-30.5	-173.7	-61.8	-25.6	0	0	0	112.3	T1005 R1058	T1005-D1009 WeakPolarHBondContact O-CB 3.4Å; T1005-D1009 PolarHBondContact O-N 3.21Å; D1009-R1058 IonicContact OD1-CZ 2.73Å; D1009-R1058 IonicContact OD1-NH1 3.52Å; D1009-R1058 IonicContact OD1-NH2 2.57Å; D1009-R1058 PolarHBondContact OD1-NH2 2.96Å; D1009-R1058 IonicContact OD2-CZ 3.54Å; D1009-R1058 IonicContact OD2-NH1 3.43Å; D1009-R1058 PolarHBondContact OD2-NH1 3.28Å; D1009-R1058 IonicContact OD2-NH2 3.94Å; D1009-R1058 PolarHBondContact OD2-NH2 3.05Å
1010	Y	91.9	Very high	92.1	Very high	87 Å²	87	54.2 Å²	54.2	34%	0.341	28%	0.277	S	S	.	.	S	Bend	trans	-122.1	43	179.7	-55.1	-77.5	0	0	0	111.3	R954 F957 L1006	R954-Y1010 HydrophobicContact CB-CD1 4.14Å; R954-Y1010 HydrophobicContact CB-CE1 3.65Å; R954-Y1010 HydrophobicContact CG-CD1 3.75Å; R954-Y1010 HydrophobicContact CG-CE1 3.68Å; R954-Y1010 HydrophobicContact CG-CE2 4.44Å; R954-Y1010 HydrophobicContact CG-CG 4.19Å; F957-Y1010 WeakPolarHBondContact CB-O 3.37Å; F957-Y1010 PolarHBondContact N-O 3.36Å; L1006-Y1010 HydrophobicContact CD2-CD2 3.86Å; L1006-Y1010 HydrophobicContact CD2-CE2 4.14Å; L1006-Y1010 CarbonylContact O-C 3.59Å; L1006-Y1010 WeakPolarHBondContact O-CA 3.43Å; L1006-Y1010 WeakPolarHBondContact O-CB 3.38Å; L1006-Y1010 PolarHBondContact O-N 3.29Å
1011	A	90.8	Very high	91.9	Very high	19 Å²	19	53.4 Å²	53.4	16%	0.157	27%	0.274	C	S	.	.			trans	-47.5	124.5	-176.7	0	0	0	0	0	113.2	L1007 L1013 I1021	L1007-A1011 VanDerWaalsContact O-CA 3.3Å; L1007-A1011 WeakPolarHBondContact O-CA 3.43Å; A1011-L1013 HydrophobicContact CB-CD1 4.41Å; A1011-L1013 HydrophobicContact CB-CD2 4.35Å; A1011-L1013 HydrophobicContact CB-CG 4.02Å; A1011-L1013 PolarHBondContact O-N 3.22Å; A1011-I1021 HydrophobicContact CB-CD1 4.24Å; A1011-I1021 HydrophobicContact CB-CG2 4.14Å
1012	P	90.6	Very high	91.6	Very high	6 Å²	6	53 Å²	53	4%	0.039	27%	0.273	C	S	.	.			trans	-80.4	62.1	-175.9	33	-36.6	0	0	0	112.9	E956 S1014 R1015 K1016 I1021	E956-P1012 HydrophobicContact CB-CB 4.41Å; E956-P1012 VanDerWaalsContact OE2-CA 3.27Å; E956-P1012 WeakPolarHBondContact OE2-CA 3.46Å; P1012-S1014 PolarHBondContact O-N 3.28Å; P1012-R1015 PolarHBondContact O-N 3.21Å; P1012-K1016 HydrophobicContact CG-CD 4.49Å; P1012-K1016 PolarHBondContact O-N 3.43Å; P1012-I1021 HydrophobicContact CG-CD1 4.35Å; P1012-I1021 HydrophobicContact CG-CG1 4.46Å
1013	L	90.3	Very high	91.5	Very high	94 Å²	94	57.6 Å²	57.6	49%	0.492	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-22.4	-173.2	-63.8	171.7	0	0	0	113.4	E956 A1011 R1015 Q1018 I1021	E956-L1013 PolarHBondContact OE1-N 3.37Å; A1011-L1013 HydrophobicContact CB-CD1 4.41Å; A1011-L1013 HydrophobicContact CB-CD2 4.35Å; A1011-L1013 HydrophobicContact CB-CG 4.02Å; A1011-L1013 PolarHBondContact O-N 3.22Å; L1013-R1015 PolarHBondContact O-N 3.43Å; L1013-Q1018 HydrophobicContact CD2-CB 4.43Å; L1013-Q1018 VanDerWaalsContact CD2-OE1 3.26Å; L1013-I1021 HydrophobicContact CD2-CD1 3.58Å; L1013-I1021 HydrophobicContact CG-CD1 4.33Å
1014	S	88.4	Confident	91.5	Very high	87 Å²	87	59.2 Å²	59.2	61%	0.608	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-20.1	169.8	72.7	0	0	0	0	114	E956 P1012	E956-S1014 WeakPolarHBondContact OE1-CB 3.44Å; E956-S1014 PolarHBondContact OE1-N 3.46Å; E956-S1014 PolarHBondContact OE1-OG 3.27Å; E956-S1014 WeakPolarHBondContact OE2-CB 3.49Å; E956-S1014 PolarHBondContact OE2-N 2.99Å; E956-S1014 PolarHBondContact OE2-OG 2.96Å; P1012-S1014 PolarHBondContact O-N 3.28Å
1015	R	89.1	Confident	91.5	Very high	136 Å²	136	59.2 Å²	59.2	51%	0.513	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125	-25.6	-173.1	-68.2	177.4	-65.1	-140.7	-0.6	114.9	F957 P1012 L1013	F957-R1015 PolarHBondContact O-NH2 3.48Å; P1012-R1015 PolarHBondContact O-N 3.21Å; L1013-R1015 PolarHBondContact O-N 3.43Å
1016	K	90.8	Very high	91.5	Very high	78 Å²	78	59.4 Å²	59.4	34%	0.339	30%	0.295	S	S	.	.	S	Bend	trans	-128.7	143.3	-177.4	-65.1	-169.4	-178.4	-166.6	0	111.1	P1012 I1021 E1024	P1012-K1016 HydrophobicContact CG-CD 4.49Å; P1012-K1016 PolarHBondContact O-N 3.43Å; K1016-I1021 HydrophobicContact CB-CD1 3.84Å; K1016-I1021 HydrophobicContact CB-CG1 3.79Å; K1016-I1021 HydrophobicContact CD-CG1 4.31Å; K1016-E1024 IonicContact NZ-OE1 2.68Å; K1016-E1024 PolarHBondContact NZ-OE1 2.84Å; K1016-E1024 IonicContact NZ-OE2 3.73Å; K1016-E1024 PolarHBondContact NZ-OE2 3.48Å
1017	A	90.3	Very high	91.6	Very high	70 Å²	70	63.1 Å²	63.1	58%	0.579	32%	0.315	S	S	*	.			trans	-66.9	146	171.4	0	0	0	0	0	111.2	E1019 Q1020 I1021	A1017-E1019 VanDerWaalsContact C-N 3.34Å; A1017-E1019 PolarHBondContact O-N 2.82Å; A1017-Q1020 WeakPolarHBondContact O-CB 3.41Å; A1017-Q1020 PolarHBondContact O-N 3.12Å; A1017-I1021 PolarHBondContact O-N 2.78Å
1018	Q	88.6	Confident	91.7	Very high	91 Å²	91	62.9 Å²	62.9	43%	0.425	32%	0.315	S	S	.	.	H	α-helix	trans	-48.3	-50.7	179.3	179.7	64.9	24.4	0	0	112.6	L1013 Q1020 I1021 E1022	L1013-Q1018 HydrophobicContact CD2-CB 4.43Å; L1013-Q1018 VanDerWaalsContact CD2-OE1 3.26Å; Q1018-Q1020 PolarHBondContact O-N 3.43Å; Q1018-I1021 PolarHBondContact O-N 3.37Å; Q1018-I1021 VanDerWaalsContact O-N 3.07Å; Q1018-E1022 HydrophobicContact CG-CG 4.44Å; Q1018-E1022 WeakPolarHBondContact CG-OE1 3.33Å; Q1018-E1022 PolarHBondContact NE2-OE1 2.79Å; Q1018-E1022 WeakPolarHBondContact O-CG 3.41Å; Q1018-E1022 PolarHBondContact O-N 3.34Å
1019	E	87.5	Confident	91.9	Very high	110 Å²	110	60.6 Å²	60.6	51%	0.514	30%	0.304	S	S	.	.	H	α-helix	trans	-57.5	-33.7	179.1	-63.2	-179.1	-161.8	0	0	113.6	A1017 R1023	A1017-E1019 VanDerWaalsContact C-N 3.34Å; A1017-E1019 PolarHBondContact O-N 2.82Å; E1019-R1023 VanDerWaalsContact O-CG 3.25Å; E1019-R1023 WeakPolarHBondContact O-CG 3.36Å; E1019-R1023 PolarHBondContact O-N 2.98Å; E1019-R1023 VanDerWaalsContact O-N 3.16Å; E1019-R1023 PolarHBondContact O-NE 3.18Å; E1019-R1023 IonicContact OE2-CZ 3.9Å; E1019-R1023 IonicContact OE2-NH2 3.53Å; E1019-R1023 PolarHBondContact OE2-NH2 3.16Å
1020	Q	91.6	Very high	92	Very high	73 Å²	73	60.8 Å²	60.8	34%	0.341	30%	0.303	S	S	.	.	H	α-helix	trans	-74.1	-36.5	-179.9	-178.7	57.2	30.4	0	0	110.8	A1017 Q1018 R1023 E1024	A1017-Q1020 WeakPolarHBondContact O-CB 3.41Å; A1017-Q1020 PolarHBondContact O-N 3.12Å; Q1018-Q1020 PolarHBondContact O-N 3.43Å; Q1020-R1023 VanDerWaalsContact OE1-NH1 3.09Å; Q1020-E1024 PolarHBondContact NE2-OE1 3.41Å; Q1020-E1024 WeakPolarHBondContact O-CG 3.44Å; Q1020-E1024 PolarHBondContact O-N 3.03Å; Q1020-E1024 VanDerWaalsContact O-N 3.1Å
1021	I	92.3	Very high	92.2	Very high	3 Å²	3	61.2 Å²	61.2	2%	0.015	31%	0.307	C	S	.	.	H	α-helix	trans	-67.3	-44.4	173.8	-65.9	155.8	0	0	0	110.2	L1007 A1011 P1012 L1013 K1016 A1017 Q1018 R1023 E1024 V1025	L1007-I1021 VanDerWaalsContact O-CG2 3.28Å; L1007-I1021 WeakPolarHBondContact O-CG2 3.46Å; A1011-I1021 HydrophobicContact CB-CD1 4.24Å; A1011-I1021 HydrophobicContact CB-CG2 4.14Å; P1012-I1021 HydrophobicContact CG-CD1 4.35Å; P1012-I1021 HydrophobicContact CG-CG1 4.46Å; L1013-I1021 HydrophobicContact CD2-CD1 3.58Å; L1013-I1021 HydrophobicContact CG-CD1 4.33Å; K1016-I1021 HydrophobicContact CB-CD1 3.84Å; K1016-I1021 HydrophobicContact CB-CG1 3.79Å; K1016-I1021 HydrophobicContact CD-CG1 4.31Å; A1017-I1021 PolarHBondContact O-N 2.78Å; Q1018-I1021 PolarHBondContact O-N 3.37Å; Q1018-I1021 VanDerWaalsContact O-N 3.07Å; I1021-R1023 VanDerWaalsContact C-N 3.31Å; I1021-R1023 PolarHBondContact O-N 3.34Å; I1021-E1024 PolarHBondContact O-N 3.47Å; I1021-E1024 VanDerWaalsContact O-N 3.13Å; I1021-V1025 HydrophobicContact CG2-CG2 4.21Å; I1021-V1025 WeakPolarHBondContact O-CB 3.49Å; I1021-V1025 VanDerWaalsContact O-CG2 3.32Å; I1021-V1025 WeakPolarHBondContact O-CG2 3.42Å; I1021-V1025 PolarHBondContact O-N 3Å
1022	E	91.6	Very high	92.5	Very high	31 Å²	31	60.3 Å²	60.3	15%	0.145	30%	0.299	C	S	.	.	H	α-helix	trans	-60.1	-38.1	177.9	-71	174.5	179.3	0	0	112.9	Q1018 T1026 M1062 C1066	Q1018-E1022 HydrophobicContact CG-CG 4.44Å; Q1018-E1022 WeakPolarHBondContact CG-OE1 3.33Å; Q1018-E1022 PolarHBondContact NE2-OE1 2.79Å; Q1018-E1022 WeakPolarHBondContact O-CG 3.41Å; Q1018-E1022 PolarHBondContact O-N 3.34Å; E1022-T1026 WeakPolarHBondContact O-CB 3.32Å; E1022-T1026 PolarHBondContact O-N 2.99Å; E1022-T1026 PolarHBondContact O-OG1 2.92Å; E1022-M1062 HydrophobicContact CB-CE 4.34Å; E1022-M1062 HydrophobicContact CB-SD 4.2Å; E1022-M1062 HydrophobicContact CG-CG 4.44Å; E1022-M1062 HydrophobicContact CG-SD 4.06Å; E1022-C1066 PolarHBondContact OE1-SG 3.19Å; E1022-C1066 VanDerWaalsContact OE1-SG 3.42Å; E1022-C1066 PolarHBondContact OE2-SG 3.16Å
1023	R	92.2	Very high	92.6	Very high	127 Å²	127	61.3 Å²	61.3	48%	0.479	30%	0.304	S	S	.	.	H	α-helix	trans	-64.2	-48.7	171.3	-69.2	169.7	-149.8	152.2	2.5	111.8	E1019 Q1020 I1021 V1025 T1026 D1027	E1019-R1023 VanDerWaalsContact O-CG 3.25Å; E1019-R1023 WeakPolarHBondContact O-CG 3.36Å; E1019-R1023 PolarHBondContact O-N 2.98Å; E1019-R1023 VanDerWaalsContact O-N 3.16Å; E1019-R1023 PolarHBondContact O-NE 3.18Å; E1019-R1023 IonicContact OE2-CZ 3.9Å; E1019-R1023 IonicContact OE2-NH2 3.53Å; E1019-R1023 PolarHBondContact OE2-NH2 3.16Å; Q1020-R1023 VanDerWaalsContact OE1-NH1 3.09Å; I1021-R1023 VanDerWaalsContact C-N 3.31Å; I1021-R1023 PolarHBondContact O-N 3.34Å; R1023-V1025 VanDerWaalsContact C-N 3.34Å; R1023-V1025 PolarHBondContact O-N 2.93Å; R1023-T1026 PolarHBondContact O-N 2.82Å; R1023-D1027 PolarHBondContact O-N 3.07Å
1024	E	93.6	Very high	92.8	Very high	46 Å²	46	64.1 Å²	64.1	22%	0.215	31%	0.312	C	S	.	.	H	α-helix	trans	-63.3	-38.6	179.7	-73	173.3	-157	0	0	112.4	L1007 K1016 Q1020 I1021 D1027 A1028	L1007-E1024 HydrophobicContact CD1-CB 4.37Å; K1016-E1024 IonicContact NZ-OE1 2.68Å; K1016-E1024 PolarHBondContact NZ-OE1 2.84Å; K1016-E1024 IonicContact NZ-OE2 3.73Å; K1016-E1024 PolarHBondContact NZ-OE2 3.48Å; Q1020-E1024 PolarHBondContact NE2-OE1 3.41Å; Q1020-E1024 WeakPolarHBondContact O-CG 3.44Å; Q1020-E1024 PolarHBondContact O-N 3.03Å; Q1020-E1024 VanDerWaalsContact O-N 3.1Å; I1021-E1024 PolarHBondContact O-N 3.47Å; I1021-E1024 VanDerWaalsContact O-N 3.13Å; E1024-D1027 PolarHBondContact O-N 3.44Å; E1024-A1028 WeakPolarHBondContact O-CB 3.33Å; E1024-A1028 PolarHBondContact O-N 2.89Å
1025	V	95.6	Very high	92.9	Very high	1 Å²	1	61.7 Å²	61.7	1%	0.006	29%	0.29	C	S	.	.	H	α-helix	trans	-62.5	-46.7	171.7	170.9	0	0	0	0	110.5	L1007 Q1008 I1021 R1023 D1027 A1028 M1029 M1062	L1007-V1025 HydrophobicContact CB-CG2 3.65Å; Q1008-V1025 HydrophobicContact CB-CG1 4.13Å; Q1008-V1025 HydrophobicContact CB-CG2 3.98Å; Q1008-V1025 HydrophobicContact CG-CG1 4.43Å; I1021-V1025 HydrophobicContact CG2-CG2 4.21Å; I1021-V1025 WeakPolarHBondContact O-CB 3.49Å; I1021-V1025 VanDerWaalsContact O-CG2 3.32Å; I1021-V1025 WeakPolarHBondContact O-CG2 3.42Å; I1021-V1025 PolarHBondContact O-N 3Å; R1023-V1025 VanDerWaalsContact C-N 3.34Å; R1023-V1025 PolarHBondContact O-N 2.93Å; V1025-D1027 PolarHBondContact O-N 3.29Å; V1025-A1028 PolarHBondContact O-N 2.86Å; V1025-M1029 HydrophobicContact CG1-CG 4.15Å; V1025-M1029 VanDerWaalsContact O-CB 3.27Å; V1025-M1029 WeakPolarHBondContact O-CB 3.49Å; V1025-M1029 VanDerWaalsContact O-CG 3.22Å; V1025-M1029 WeakPolarHBondContact O-CG 3.43Å; V1025-M1029 PolarHBondContact O-N 3.37Å; V1025-M1062 HydrophobicContact CB-SD 4.36Å; V1025-M1062 HydrophobicContact CG1-SD 3.99Å
1026	T	94.8	Very high	93	Very high	23 Å²	23	55.8 Å²	55.8	14%	0.141	27%	0.27	C	S	.	.	H	α-helix	trans	-60.1	-47.5	177	-61.8	0	0	0	0	111.6	E1022 R1023 A1028 M1029 M1030 M1062 Y1063	E1022-T1026 WeakPolarHBondContact O-CB 3.32Å; E1022-T1026 PolarHBondContact O-N 2.99Å; E1022-T1026 PolarHBondContact O-OG1 2.92Å; R1023-T1026 PolarHBondContact O-N 2.82Å; T1026-A1028 PolarHBondContact O-N 3.45Å; T1026-M1029 PolarHBondContact O-N 3.39Å; T1026-M1030 HydrophobicContact CG2-CG 4.21Å; T1026-M1030 VanDerWaalsContact O-CB 3.3Å; T1026-M1030 WeakPolarHBondContact O-CB 3.49Å; T1026-M1030 VanDerWaalsContact O-CG 3.24Å; T1026-M1030 WeakPolarHBondContact O-CG 3.28Å; T1026-M1030 PolarHBondContact O-N 3.37Å; T1026-M1062 WeakPolarHBondContact OG1-CE 3.39Å; T1026-Y1063 VanDerWaalsContact CG2-OH 3.31Å; T1026-Y1063 WeakPolarHBondContact CG2-OH 3.3Å; T1026-Y1063 PolarHBondContact OG1-OH 2.86Å
1027	D	95.6	Very high	92.7	Very high	95 Å²	95	54.2 Å²	54.2	51%	0.508	27%	0.265	S	S	.	.	H	α-helix	trans	-62.1	-42.4	179.5	-79.2	-8.8	0	0	0	111.9	R1023 E1024 V1025 K1031	R1023-D1027 PolarHBondContact O-N 3.07Å; E1024-D1027 PolarHBondContact O-N 3.44Å; V1025-D1027 PolarHBondContact O-N 3.29Å; D1027-K1031 WeakPolarHBondContact O-CB 3.23Å; D1027-K1031 WeakPolarHBondContact O-CD 3.36Å; D1027-K1031 WeakPolarHBondContact O-CG 3.39Å; D1027-K1031 PolarHBondContact O-N 2.96Å
1028	A	95.1	Very high	92.5	Very high	6 Å²	6	53.3 Å²	53.3	5%	0.05	25%	0.25	C	S	.	.	H	α-helix	trans	-69.4	-43.5	177.7	0	0	0	0	0	112.2	A1004 E1024 V1025 T1026 M1030 K1031 S1032	A1004-A1028 HydrophobicContact CB-CB 3.67Å; E1024-A1028 WeakPolarHBondContact O-CB 3.33Å; E1024-A1028 PolarHBondContact O-N 2.89Å; V1025-A1028 PolarHBondContact O-N 2.86Å; T1026-A1028 PolarHBondContact O-N 3.45Å; A1028-M1030 PolarHBondContact O-N 3.06Å; A1028-K1031 PolarHBondContact O-N 3.11Å; A1028-S1032 PolarHBondContact O-N 3.43Å
1029	M	96.4	Very high	92.2	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-60.2	-45.2	174.2	-75.8	-56.3	-176.9	0	0	112.1	F1001 A1004 T1005 V1025 T1026 K1031 S1032 L1033 I1055 R1058 L1059	F1001-M1029 HydrophobicContact CD2-SD 4.09Å; F1001-M1029 HydrophobicContact CE2-CE 4.42Å; F1001-M1029 HydrophobicContact CE2-SD 4.37Å; A1004-M1029 HydrophobicContact CB-CE 3.61Å; A1004-M1029 HydrophobicContact CB-CG 3.74Å; A1004-M1029 HydrophobicContact CB-SD 3.55Å; A1004-M1029 VanDerWaalsContact CB-SD 3.55Å; T1005-M1029 HydrophobicContact CG2-CE 4.07Å; V1025-M1029 HydrophobicContact CG1-CG 4.15Å; V1025-M1029 VanDerWaalsContact O-CB 3.27Å; V1025-M1029 WeakPolarHBondContact O-CB 3.49Å; V1025-M1029 VanDerWaalsContact O-CG 3.22Å; V1025-M1029 WeakPolarHBondContact O-CG 3.43Å; V1025-M1029 PolarHBondContact O-N 3.37Å; T1026-M1029 PolarHBondContact O-N 3.39Å; M1029-K1031 PolarHBondContact O-N 3.22Å; M1029-S1032 WeakPolarHBondContact O-CB 3.18Å; M1029-S1032 PolarHBondContact O-N 3.08Å; M1029-L1033 PolarHBondContact O-N 2.97Å; M1029-I1055 HydrophobicContact CB-CG2 3.68Å; M1029-I1055 HydrophobicContact CG-CG2 4.06Å; M1029-I1055 HydrophobicContact SD-CB 4.22Å; M1029-I1055 HydrophobicContact SD-CG1 3.82Å; M1029-I1055 HydrophobicContact SD-CG2 3.76Å; M1029-R1058 HydrophobicContact CE-CB 4.32Å; M1029-L1059 HydrophobicContact CB-CD1 3.96Å; M1029-L1059 HydrophobicContact CB-CD2 3.98Å; M1029-L1059 HydrophobicContact CB-CG 4.09Å; M1029-L1059 HydrophobicContact CG-CD2 3.99Å; M1029-L1059 HydrophobicContact CG-CG 4.16Å
1030	M	95.9	Very high	91.9	Very high	93 Å²	93	54 Å²	54	46%	0.458	26%	0.257	S	S	.	.	H	α-helix	trans	-68	-33.6	178.1	-71.2	-62.7	-62.5	0	0	112.4	T1026 A1028 L1033 K1034	T1026-M1030 HydrophobicContact CG2-CG 4.21Å; T1026-M1030 VanDerWaalsContact O-CB 3.3Å; T1026-M1030 WeakPolarHBondContact O-CB 3.49Å; T1026-M1030 VanDerWaalsContact O-CG 3.24Å; T1026-M1030 WeakPolarHBondContact O-CG 3.28Å; T1026-M1030 PolarHBondContact O-N 3.37Å; A1028-M1030 PolarHBondContact O-N 3.06Å; M1030-L1033 HydrophobicContact SD-CD1 3.9Å; M1030-K1034 PolarHBondContact O-N 3.09Å; M1030-K1034 VanDerWaalsContact O-N 3.1Å
1031	K	95.6	Very high	91.3	Very high	96 Å²	96	58.9 Å²	58.9	42%	0.417	28%	0.279	S	S	.	.	H	α-helix	trans	-66.7	-41.4	169.8	-74.2	168.5	-171.1	174.1	0	111.8	Y1000 D1027 A1028 M1029 K1034 Y1035	Y1000-K1031 HydrophobicContact CD1-CB 3.81Å; Y1000-K1031 HydrophobicContact CD1-CD 4.1Å; Y1000-K1031 HydrophobicContact CD2-CB 4Å; Y1000-K1031 HydrophobicContact CE1-CB 3.85Å; Y1000-K1031 HydrophobicContact CE1-CD 3.46Å; Y1000-K1031 VanDerWaalsContact CE1-CD 3.46Å; Y1000-K1031 HydrophobicContact CE1-CG 4.25Å; Y1000-K1031 HydrophobicContact CE2-CB 4.03Å; Y1000-K1031 HydrophobicContact CG-CB 3.88Å; D1027-K1031 WeakPolarHBondContact O-CB 3.23Å; D1027-K1031 WeakPolarHBondContact O-CD 3.36Å; D1027-K1031 WeakPolarHBondContact O-CG 3.39Å; D1027-K1031 PolarHBondContact O-N 2.96Å; A1028-K1031 PolarHBondContact O-N 3.11Å; M1029-K1031 PolarHBondContact O-N 3.22Å; K1031-K1034 WeakPolarHBondContact O-CB 3.45Å; K1031-K1034 PolarHBondContact O-N 2.89Å; K1031-Y1035 WeakPolarHBondContact O-CD2 3.49Å; K1031-Y1035 PolarHBondContact O-N 2.97Å
1032	S	95.8	Very high	90.7	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-60.1	-47.2	175.1	-175.6	0	0	0	0	111.5	S997 A1028 M1029 K1034 Y1035 C1036 I1055	S997-S1032 PolarHBondContact O-OG 3.47Å; S997-S1032 PolarHBondContact OG-O 3.43Å; S997-S1032 PolarHBondContact OG-OG 3.28Å; A1028-S1032 PolarHBondContact O-N 3.43Å; M1029-S1032 WeakPolarHBondContact O-CB 3.18Å; M1029-S1032 PolarHBondContact O-N 3.08Å; S1032-K1034 VanDerWaalsContact C-N 3.3Å; S1032-K1034 PolarHBondContact O-N 3.13Å; S1032-Y1035 PolarHBondContact O-N 3.46Å; S1032-Y1035 VanDerWaalsContact O-N 3.08Å; S1032-C1036 PolarHBondContact O-N 2.93Å; S1032-C1036 PolarHBondContact O-SG 3.46Å; S1032-I1055 WeakPolarHBondContact OG-CD1 3.46Å
1033	L	94.4	Very high	90.1	Very high	27 Å²	27	63.9 Å²	63.9	14%	0.141	32%	0.324	C	S	.	.	H	α-helix	trans	-57.2	-38.7	174.7	-78.3	167.8	0	0	0	113.3	M1029 M1030 Y1035 C1036 A1052 I1055 H1056	M1029-L1033 PolarHBondContact O-N 2.97Å; M1030-L1033 HydrophobicContact SD-CD1 3.9Å; L1033-Y1035 PolarHBondContact O-N 3.31Å; L1033-C1036 PolarHBondContact O-N 3.25Å; L1033-C1036 VanDerWaalsContact O-N 3.1Å; L1033-A1052 HydrophobicContact CD2-CB 3.64Å; L1033-I1055 HydrophobicContact CD1-CB 4.48Å; L1033-I1055 HydrophobicContact CD1-CG2 3.63Å; L1033-I1055 HydrophobicContact CD2-CB 4.2Å; L1033-I1055 HydrophobicContact CD2-CD1 4.1Å; L1033-I1055 HydrophobicContact CD2-CG2 4.22Å; L1033-I1055 HydrophobicContact CG-CB 4.19Å; L1033-I1055 HydrophobicContact CG-CD1 3.95Å; L1033-I1055 HydrophobicContact CG-CG2 3.71Å; L1033-H1056 WeakPolarHBondContact CD1-CE1 3.33Å
1034	K	93.6	Very high	89.6	Confident	153 Å²	153	61.4 Å²	61.4	67%	0.665	32%	0.315	S	S	*	.	H	α-helix	trans	-59.3	-30.5	177.6	-175	-166.7	169.9	-164.6	0	112.5	M1030 K1031 S1032	M1030-K1034 PolarHBondContact O-N 3.09Å; M1030-K1034 VanDerWaalsContact O-N 3.1Å; K1031-K1034 WeakPolarHBondContact O-CB 3.45Å; K1031-K1034 PolarHBondContact O-N 2.89Å; S1032-K1034 VanDerWaalsContact C-N 3.3Å; S1032-K1034 PolarHBondContact O-N 3.13Å
1035	Y	91.1	Very high	89.2	Confident	37 Å²	37	60.8 Å²	60.8	15%	0.145	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	3.9	179.2	-63.3	-70.4	0	0	0	113.3	L976 N993 L996 Y1000 K1031 S1032 L1033 Y1048	L976-Y1035 HydrophobicContact CD1-CE1 4.02Å; N993-Y1035 WeakPolarHBondContact OD1-CD1 3.38Å; L996-Y1035 HydrophobicContact CD2-CD1 3.95Å; L996-Y1035 HydrophobicContact CD2-CD2 3.93Å; L996-Y1035 HydrophobicContact CD2-CE1 3.72Å; L996-Y1035 HydrophobicContact CD2-CE2 3.76Å; L996-Y1035 HydrophobicContact CD2-CG 4.05Å; L996-Y1035 HydrophobicContact CG-CD2 3.93Å; L996-Y1035 HydrophobicContact CG-CE2 4.12Å; L996-Y1035 HydrophobicContact CG-CG 4.2Å; Y1000-Y1035 HydrophobicContact CD2-CD2 4.09Å; Y1000-Y1035 HydrophobicContact CD2-CE2 4.29Å; Y1000-Y1035 HydrophobicContact CE2-CD2 4.03Å; Y1000-Y1035 AromaticContact CE2-CE2 3.75Å; Y1000-Y1035 HydrophobicContact CE2-CE2 3.75Å; K1031-Y1035 WeakPolarHBondContact O-CD2 3.49Å; K1031-Y1035 PolarHBondContact O-N 2.97Å; S1032-Y1035 PolarHBondContact O-N 3.46Å; S1032-Y1035 VanDerWaalsContact O-N 3.08Å; L1033-Y1035 PolarHBondContact O-N 3.31Å; Y1035-Y1048 WeakPolarHBondContact O-CE1 3.42Å
1036	C	90.7	Very high	88.8	Confident	12 Å²	12	63.8 Å²	63.8	8%	0.081	33%	0.331	C	S	.	.			trans	-84.3	109.7	167.3	-67.2	0	0	0	0	109.8	S997 S1032 L1033 L1038 Y1048	S997-C1036 PolarHBondContact OG-SG 3.23Å; S1032-C1036 PolarHBondContact O-N 2.93Å; S1032-C1036 PolarHBondContact O-SG 3.46Å; L1033-C1036 PolarHBondContact O-N 3.25Å; L1033-C1036 VanDerWaalsContact O-N 3.1Å; C1036-L1038 HydrophobicContact CB-CD2 4.45Å; C1036-L1038 PolarHBondContact O-N 3.49Å; C1036-Y1048 VanDerWaalsContact CA-CD1 3.49Å; C1036-Y1048 HydrophobicContact CB-CD1 3.88Å; C1036-Y1048 HydrophobicContact CB-CG 4.32Å
1037	D	85.4	Confident	88.5	Confident	44 Å²	44	66.8 Å²	66.8	24%	0.235	35%	0.346	C	S	.	.			trans	-79.8	107.1	171.8	-166	-14.6	0	0	0	110	Q1039 T1040 Y1048	D1037-Q1039 PolarHBondContact OD1-N 2.96Å; D1037-T1040 PolarHBondContact OD1-N 3.15Å; D1037-T1040 PolarHBondContact OD1-OG1 3.43Å; D1037-T1040 WeakPolarHBondContact OD2-CB 3.46Å; D1037-T1040 PolarHBondContact OD2-OG1 3.4Å; D1037-Y1048 HydrophobicContact CB-CD2 4.41Å; D1037-Y1048 HydrophobicContact CB-CE2 4.37Å; D1037-Y1048 WeakPolarHBondContact O-CD2 3.45Å
1038	L	85.2	Confident	88.3	Confident	52 Å²	52	62.4 Å²	62.4	27%	0.272	32%	0.323	S	S	.	.			trans	-97.1	-11.4	176.5	-56.8	179.8	0	0	0	112.5	C1036 Q1045 Q1049 A1052	C1036-L1038 HydrophobicContact CB-CD2 4.45Å; C1036-L1038 PolarHBondContact O-N 3.49Å; L1038-Q1045 PolarHBondContact O-NE2 3Å; L1038-Q1045 VanDerWaalsContact O-NE2 3.16Å; L1038-Q1049 HydrophobicContact CD2-CB 4.37Å; L1038-Q1049 HydrophobicContact CD2-CG 3.84Å; L1038-A1052 HydrophobicContact CD1-CB 4.09Å; L1038-A1052 HydrophobicContact CD2-CB 4Å
1039	Q	83.1	Confident	88.1	Confident	172 Å²	172	64 Å²	64	80%	0.804	33%	0.329	S	S	*	.	S	Bend	trans	-99	-33.9	-170.4	-59.7	-61.8	-59.2	0	0	112.3	D1037	D1037-Q1039 PolarHBondContact OD1-N 2.96Å
1040	T	81.4	Confident	87.9	Confident	44 Å²	44	68.3 Å²	68.3	27%	0.27	35%	0.346	S	S	.	.	S	Bend	trans	-86.8	122.8	179	-49	0	0	0	0	111.2	D1037 S1042	D1037-T1040 PolarHBondContact OD1-N 3.15Å; D1037-T1040 PolarHBondContact OD1-OG1 3.43Å; D1037-T1040 WeakPolarHBondContact OD2-CB 3.46Å; D1037-T1040 PolarHBondContact OD2-OG1 3.4Å; T1040-S1042 PolarHBondContact O-N 3.09Å
1041	E	77.6	Confident	87.8	Confident	174 Å²	174	65 Å²	65	81%	0.813	33%	0.328	S	S	*	.			trans	-61.4	120.6	167.3	-68.3	-179.3	176	0	0	110.3
1042	S	79.5	Confident	87.7	Confident	36 Å²	36	60.4 Å²	60.4	25%	0.252	31%	0.308	S	S	.	.			trans	-160.1	159.8	-179.7	66.3	0	0	0	0	110	T1040 R1044 Q1045	T1040-S1042 PolarHBondContact O-N 3.09Å; S1042-R1044 PolarHBondContact O-N 3.1Å; S1042-Q1045 VanDerWaalsContact O-CB 3.28Å; S1042-Q1045 WeakPolarHBondContact O-CB 3.33Å; S1042-Q1045 PolarHBondContact O-N 3.27Å; S1042-Q1045 PolarHBondContact OG-N 2.97Å
1043	A	79.3	Confident	87.6	Confident	104 Å²	104	60.4 Å²	60.4	86%	0.86	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-20.9	176.7	0	0	0	0	0	114
1044	R	82.5	Confident	87.6	Confident	74 Å²	74	60.1 Å²	60.1	28%	0.279	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-4.3	175.9	-63.9	-171.2	178.9	128.9	-10	114.2	D990 S991 S1042 L1047 Y1048	D990-R1044 PolarHBondContact O-NH1 3.06Å; S991-R1044 VanDerWaalsContact N-NH1 3.13Å; S991-R1044 PolarHBondContact OG-NH2 3.26Å; S1042-R1044 PolarHBondContact O-N 3.1Å; R1044-L1047 HydrophobicContact CG-CD1 4.47Å; R1044-L1047 WeakPolarHBondContact O-CB 3.15Å; R1044-L1047 PolarHBondContact O-N 3.5Å; R1044-L1047 VanDerWaalsContact O-N 3.15Å; R1044-Y1048 HydrophobicContact CB-CD2 4.12Å; R1044-Y1048 HydrophobicContact CB-CE2 3.91Å; R1044-Y1048 VanDerWaalsContact O-CD2 3.28Å; R1044-Y1048 WeakPolarHBondContact O-CD2 3.17Å; R1044-Y1048 PolarHBondContact O-N 2.88Å
1045	Q	85.4	Confident	87.7	Confident	34 Å²	34	52.9 Å²	52.9	16%	0.159	28%	0.276	C	S	.	.	H	α-helix	trans	-59	-43.3	-178.5	-168.8	-170.1	25.9	0	0	113	L1038 S1042 L1047 Y1048 Q1049	L1038-Q1045 PolarHBondContact O-NE2 3Å; L1038-Q1045 VanDerWaalsContact O-NE2 3.16Å; S1042-Q1045 VanDerWaalsContact O-CB 3.28Å; S1042-Q1045 WeakPolarHBondContact O-CB 3.33Å; S1042-Q1045 PolarHBondContact O-N 3.27Å; S1042-Q1045 PolarHBondContact OG-N 2.97Å; Q1045-L1047 VanDerWaalsContact C-N 3.3Å; Q1045-L1047 PolarHBondContact O-N 3.18Å; Q1045-Y1048 PolarHBondContact O-N 2.97Å; Q1045-Q1049 WeakPolarHBondContact O-CB 3.45Å; Q1045-Q1049 WeakPolarHBondContact O-CG 3.45Å; Q1045-Q1049 PolarHBondContact O-N 3.42Å
1046	P	86.9	Confident	88	Confident	63 Å²	63	52 Å²	52	41%	0.409	27%	0.273	S	S	.	.	H	α-helix	trans	-61.9	-38.2	175.3	-22.9	35.2	0	0	0	112.3	Q1049 Y1050	P1046-Q1049 PolarHBondContact O-N 2.93Å; P1046-Y1050 WeakPolarHBondContact O-CB 3.26Å; P1046-Y1050 PolarHBondContact O-N 3.42Å
1047	L	88.9	Confident	88.2	Confident	87 Å²	87	52.2 Å²	52.2	46%	0.455	27%	0.274	S	S	.	.	H	α-helix	trans	-66.9	-37.8	177.2	-55.7	176.8	0	0	0	112.2	W994 R1044 Q1045 R1051	W994-L1047 HydrophobicContact CH2-CB 3.55Å; W994-L1047 HydrophobicContact CH2-CD1 4.14Å; W994-L1047 HydrophobicContact CH2-CG 4.4Å; W994-L1047 HydrophobicContact CZ2-CD1 4.4Å; W994-L1047 HydrophobicContact CZ3-CB 3.53Å; W994-L1047 HydrophobicContact CZ3-CD1 4.49Å; R1044-L1047 HydrophobicContact CG-CD1 4.47Å; R1044-L1047 WeakPolarHBondContact O-CB 3.15Å; R1044-L1047 PolarHBondContact O-N 3.5Å; R1044-L1047 VanDerWaalsContact O-N 3.15Å; Q1045-L1047 VanDerWaalsContact C-N 3.3Å; Q1045-L1047 PolarHBondContact O-N 3.18Å; L1047-R1051 WeakPolarHBondContact O-CB 3.45Å; L1047-R1051 PolarHBondContact O-N 3.38Å
1048	Y	90.6	Very high	88.7	Confident	3 Å²	3	52.5 Å²	52.5	1%	0.012	27%	0.271	C	S	.	.	H	α-helix	trans	-67.9	-39.7	172.5	-74.7	-53.8	0	0	0	112.2	D990 W994 Y1035 C1036 D1037 R1044 Q1045 A1052	D990-Y1048 PolarHBondContact O-OH 3.11Å; W994-Y1048 WeakPolarHBondContact CA-OH 3.31Å; W994-Y1048 AromaticContact CE3-CD1 3.88Å; W994-Y1048 HydrophobicContact CE3-CD1 3.88Å; W994-Y1048 AromaticContact CE3-CE1 3.61Å; W994-Y1048 HydrophobicContact CE3-CE1 3.61Å; W994-Y1048 HydrophobicContact CZ3-CD1 4.09Å; W994-Y1048 HydrophobicContact CZ3-CE1 4.28Å; W994-Y1048 PolarHBondContact N-OH 3.18Å; Y1035-Y1048 WeakPolarHBondContact O-CE1 3.42Å; C1036-Y1048 VanDerWaalsContact CA-CD1 3.49Å; C1036-Y1048 HydrophobicContact CB-CD1 3.88Å; C1036-Y1048 HydrophobicContact CB-CG 4.32Å; D1037-Y1048 HydrophobicContact CB-CD2 4.41Å; D1037-Y1048 HydrophobicContact CB-CE2 4.37Å; D1037-Y1048 WeakPolarHBondContact O-CD2 3.45Å; R1044-Y1048 HydrophobicContact CB-CD2 4.12Å; R1044-Y1048 HydrophobicContact CB-CE2 3.91Å; R1044-Y1048 VanDerWaalsContact O-CD2 3.28Å; R1044-Y1048 WeakPolarHBondContact O-CD2 3.17Å; R1044-Y1048 PolarHBondContact O-N 2.88Å; Q1045-Y1048 PolarHBondContact O-N 2.97Å; Y1048-A1052 VanDerWaalsContact O-CB 3.24Å; Y1048-A1052 WeakPolarHBondContact O-CB 3.36Å; Y1048-A1052 PolarHBondContact O-N 2.97Å
1049	Q	90.4	Very high	89.2	Confident	39 Å²	39	50.1 Å²	50.1	18%	0.182	26%	0.259	C	S	.	.	H	α-helix	trans	-62.9	-48.1	175	-75.5	168.5	-16	0	0	111.3	L1038 Q1045 P1046 A1052 A1053 L1098	L1038-Q1049 HydrophobicContact CD2-CB 4.37Å; L1038-Q1049 HydrophobicContact CD2-CG 3.84Å; Q1045-Q1049 WeakPolarHBondContact O-CB 3.45Å; Q1045-Q1049 WeakPolarHBondContact O-CG 3.45Å; Q1045-Q1049 PolarHBondContact O-N 3.42Å; P1046-Q1049 PolarHBondContact O-N 2.93Å; Q1049-A1052 PolarHBondContact O-N 3.37Å; Q1049-A1053 WeakPolarHBondContact O-CB 3.37Å; Q1049-A1053 PolarHBondContact O-N 3.48Å; Q1049-L1098 HydrophobicContact CB-CD1 4.48Å; Q1049-L1098 HydrophobicContact CB-CD2 3.87Å; Q1049-L1098 HydrophobicContact CB-CG 4.4Å
1050	Y	92.3	Very high	89.8	Confident	91 Å²	91	41.9 Å²	41.9	36%	0.357	22%	0.22	S	C	.	.	H	α-helix	trans	-57.8	-52.6	175.3	-179	-89.4	0	0	0	110.8	P1046 A1052 A1053 T1054 F1095 L1098 A1101 E1104	P1046-Y1050 WeakPolarHBondContact O-CB 3.26Å; P1046-Y1050 PolarHBondContact O-N 3.42Å; Y1050-A1052 VanDerWaalsContact C-N 3.32Å; Y1050-A1052 PolarHBondContact O-N 3.45Å; Y1050-A1053 WeakPolarHBondContact O-CB 3.42Å; Y1050-A1053 PolarHBondContact O-N 2.88Å; Y1050-A1053 VanDerWaalsContact O-N 3.1Å; Y1050-T1054 PolarHBondContact O-N 2.8Å; Y1050-T1054 PolarHBondContact O-OG1 3.25Å; Y1050-F1095 HydrophobicContact CD2-CE1 4.26Å; Y1050-F1095 HydrophobicContact CE2-CE1 4.23Å; Y1050-L1098 VanDerWaalsContact CA-CD1 3.47Å; Y1050-L1098 HydrophobicContact CD2-CD1 4.23Å; Y1050-A1101 HydrophobicContact CD2-CB 3.98Å; Y1050-A1101 HydrophobicContact CE2-CB 3.83Å; Y1050-E1104 PolarHBondContact OH-OE1 2.9Å
1051	R	93.6	Very high	90.4	Very high	22 Å²	22	41.3 Å²	41.3	8%	0.083	22%	0.218	C	C	.	.	H	α-helix	trans	-57.6	-42.7	177.1	-178.5	177	-66.4	156.1	0.6	112.4	W994 S997 T998 F1001 L1047 A1053 T1054 I1055	W994-R1051 PolarHBondContact O-NH1 3.37Å; S997-R1051 VanDerWaalsContact OG-CD 3.25Å; S997-R1051 WeakPolarHBondContact OG-CD 3.39Å; S997-R1051 PolarHBondContact OG-NH1 2.71Å; T998-R1051 VanDerWaalsContact OG1-CZ 3.28Å; T998-R1051 PolarHBondContact OG1-NH1 3.43Å; T998-R1051 PolarHBondContact OG1-NH2 2.89Å; F1001-R1051 HydrophobicContact CD2-CG 4.31Å; F1001-R1051 HydrophobicContact CG-CG 4.33Å; L1047-R1051 WeakPolarHBondContact O-CB 3.45Å; L1047-R1051 PolarHBondContact O-N 3.38Å; R1051-A1053 VanDerWaalsContact C-N 3.34Å; R1051-T1054 PolarHBondContact O-N 2.85Å; R1051-I1055 HydrophobicContact CG-CD1 3.8Å; R1051-I1055 HydrophobicContact CG-CG1 4.35Å; R1051-I1055 WeakPolarHBondContact O-CB 3.43Å; R1051-I1055 WeakPolarHBondContact O-CG1 3.4Å; R1051-I1055 PolarHBondContact O-N 3.23Å
1052	A	94.4	Very high	91.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-65.1	-37.9	178.1	0	0	0	0	0	112.3	L1033 L1038 Y1048 Q1049 Y1050 H1056 L1094	L1033-A1052 HydrophobicContact CD2-CB 3.64Å; L1038-A1052 HydrophobicContact CD1-CB 4.09Å; L1038-A1052 HydrophobicContact CD2-CB 4Å; Y1048-A1052 VanDerWaalsContact O-CB 3.24Å; Y1048-A1052 WeakPolarHBondContact O-CB 3.36Å; Y1048-A1052 PolarHBondContact O-N 2.97Å; Q1049-A1052 PolarHBondContact O-N 3.37Å; Y1050-A1052 VanDerWaalsContact C-N 3.32Å; Y1050-A1052 PolarHBondContact O-N 3.45Å; A1052-H1056 WeakPolarHBondContact O-CB 3.36Å; A1052-H1056 PolarHBondContact O-N 2.98Å; A1052-L1094 HydrophobicContact CB-CD1 3.84Å
1053	A	93.9	Very high	91.9	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-63.1	-49	173.1	0	0	0	0	0	111.2	Q1049 Y1050 R1051 I1055 H1056 H1057 L1094 F1095	Q1049-A1053 WeakPolarHBondContact O-CB 3.37Å; Q1049-A1053 PolarHBondContact O-N 3.48Å; Y1050-A1053 WeakPolarHBondContact O-CB 3.42Å; Y1050-A1053 PolarHBondContact O-N 2.88Å; Y1050-A1053 VanDerWaalsContact O-N 3.1Å; R1051-A1053 VanDerWaalsContact C-N 3.34Å; A1053-I1055 PolarHBondContact O-N 2.9Å; A1053-H1056 PolarHBondContact O-N 2.95Å; A1053-H1057 WeakPolarHBondContact O-CB 3.47Å; A1053-H1057 PolarHBondContact O-N 2.88Å; A1053-L1094 HydrophobicContact CB-CB 3.64Å; A1053-L1094 HydrophobicContact CB-CD1 4.39Å; A1053-F1095 HydrophobicContact CB-CD1 3.67Å; A1053-F1095 HydrophobicContact CB-CD2 3.82Å; A1053-F1095 HydrophobicContact CB-CE1 3.53Å; A1053-F1095 HydrophobicContact CB-CE2 3.69Å; A1053-F1095 HydrophobicContact CB-CG 3.8Å; A1053-F1095 HydrophobicContact CB-CZ 3.54Å
1054	T	94.6	Very high	92.6	Very high	22 Å²	22	29.5 Å²	29.5	14%	0.135	14%	0.14	C	C	.	.	H	α-helix	trans	-59.9	-42.6	176.3	-44.4	0	0	0	0	112.2	F1001 Y1050 R1051 H1057 R1058	F1001-T1054 HydrophobicContact CE2-CG2 4.36Å; F1001-T1054 HydrophobicContact CZ-CG2 3.94Å; Y1050-T1054 PolarHBondContact O-N 2.8Å; Y1050-T1054 PolarHBondContact O-OG1 3.25Å; R1051-T1054 PolarHBondContact O-N 2.85Å; T1054-H1057 PolarHBondContact O-N 3.21Å; T1054-R1058 HydrophobicContact CG2-CG 4.44Å; T1054-R1058 WeakPolarHBondContact O-CB 3.27Å; T1054-R1058 WeakPolarHBondContact O-CG 3.29Å; T1054-R1058 PolarHBondContact O-N 2.81Å
1055	I	95.9	Very high	93.1	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61.8	-46.7	176.6	-69.1	164.6	0	0	0	110.7	F1001 M1029 S1032 L1033 R1051 A1053 R1058 L1059	F1001-I1055 HydrophobicContact CD2-CD1 3.97Å; F1001-I1055 HydrophobicContact CD2-CG1 3.5Å; F1001-I1055 VanDerWaalsContact CD2-CG1 3.5Å; F1001-I1055 HydrophobicContact CE2-CG1 3.64Å; M1029-I1055 HydrophobicContact CB-CG2 3.68Å; M1029-I1055 HydrophobicContact CG-CG2 4.06Å; M1029-I1055 HydrophobicContact SD-CB 4.22Å; M1029-I1055 HydrophobicContact SD-CG1 3.82Å; M1029-I1055 HydrophobicContact SD-CG2 3.76Å; S1032-I1055 WeakPolarHBondContact OG-CD1 3.46Å; L1033-I1055 HydrophobicContact CD1-CB 4.48Å; L1033-I1055 HydrophobicContact CD1-CG2 3.63Å; L1033-I1055 HydrophobicContact CD2-CB 4.2Å; L1033-I1055 HydrophobicContact CD2-CD1 4.1Å; L1033-I1055 HydrophobicContact CD2-CG2 4.22Å; L1033-I1055 HydrophobicContact CG-CB 4.19Å; L1033-I1055 HydrophobicContact CG-CD1 3.95Å; L1033-I1055 HydrophobicContact CG-CG2 3.71Å; R1051-I1055 HydrophobicContact CG-CD1 3.8Å; R1051-I1055 HydrophobicContact CG-CG1 4.35Å; R1051-I1055 WeakPolarHBondContact O-CB 3.43Å; R1051-I1055 WeakPolarHBondContact O-CG1 3.4Å; R1051-I1055 PolarHBondContact O-N 3.23Å; A1053-I1055 PolarHBondContact O-N 2.9Å; I1055-R1058 PolarHBondContact O-N 3.35Å; I1055-L1059 HydrophobicContact CG2-CD1 3.96Å; I1055-L1059 HydrophobicContact CG2-CG 4.4Å; I1055-L1059 WeakPolarHBondContact O-CB 3.28Å; I1055-L1059 WeakPolarHBondContact O-CG 3.37Å; I1055-L1059 PolarHBondContact O-N 3.19Å
1056	H	96	Very high	93.3	Very high	18 Å²	18	27.3 Å²	27.3	8%	0.083	14%	0.14	C	C	.	.	H	α-helix	trans	-64.7	-40.4	178	-77.9	-26.2	0	0	0	112.2	L1033 A1052 A1053 L1059 A1060 H1087 K1090 A1091	L1033-H1056 WeakPolarHBondContact CD1-CE1 3.33Å; A1052-H1056 WeakPolarHBondContact O-CB 3.36Å; A1052-H1056 PolarHBondContact O-N 2.98Å; A1053-H1056 PolarHBondContact O-N 2.95Å; H1056-L1059 PolarHBondContact O-N 2.88Å; H1056-A1060 WeakPolarHBondContact O-CB 3.23Å; H1056-A1060 PolarHBondContact O-N 2.89Å; H1056-H1087 AromaticContact CE1-CE1 3.97Å; H1056-H1087 AromaticContact CE1-ND1 3.7Å; H1056-H1087 AromaticContact CG-ND1 3.94Å; H1056-H1087 AromaticContact ND1-CE1 3.69Å; H1056-H1087 AromaticContact ND1-ND1 3.12Å; H1056-H1087 PolarHBondContact ND1-ND1 2.96Å; H1056-H1087 VanDerWaalsContact ND1-ND1 3.12Å; H1056-H1087 WeakPolarHBondContact O-CB 3.37Å; H1056-K1090 HydrophobicContact CB-CB 4.38Å; H1056-K1090 VanDerWaalsContact CD2-CB 3.46Å; H1056-K1090 WeakPolarHBondContact CD2-CB 3.37Å; H1056-K1090 WeakPolarHBondContact NE2-CD 3.48Å; H1056-A1091 HydrophobicContact CB-CB 3.89Å
1057	H	95.5	Very high	93.5	Very high	18 Å²	18	25 Å²	25	8%	0.083	12%	0.124	C	C	.	.	H	α-helix	trans	-59.1	-53	172.7	169.6	45.1	0	0	0	111.3	A1053 T1054 L1059 A1060 S1061 A1091 F1095 E1111	A1053-H1057 WeakPolarHBondContact O-CB 3.47Å; A1053-H1057 PolarHBondContact O-N 2.88Å; T1054-H1057 PolarHBondContact O-N 3.21Å; H1057-L1059 VanDerWaalsContact C-N 3.33Å; H1057-L1059 PolarHBondContact O-N 3.38Å; H1057-A1060 WeakPolarHBondContact O-CA 3.36Å; H1057-A1060 WeakPolarHBondContact O-CB 3.38Å; H1057-A1060 PolarHBondContact O-N 2.83Å; H1057-S1061 PolarHBondContact CE1-OG 3.26Å; H1057-S1061 PolarHBondContact ND1-OG 3.01Å; H1057-S1061 PolarHBondContact O-N 3.5Å; H1057-S1061 PolarHBondContact O-OG 2.95Å; H1057-A1091 HydrophobicContact CB-CB 4.05Å; H1057-F1095 HydrophobicContact CB-CE2 4.15Å; H1057-E1111 IonicContact CE1-OE1 3.71Å; H1057-E1111 PolarHBondContact CE1-OE1 3.45Å; H1057-E1111 IonicContact CE1-OE2 2.71Å; H1057-E1111 IonicContact ND1-OE2 2.66Å
1058	R	95.8	Very high	93.5	Very high	50 Å²	50	28 Å²	28	19%	0.189	13%	0.129	C	C	.	.	H	α-helix	trans	-62.5	-34.4	-178.8	-71.2	-175.2	63.9	124.7	4.5	113.7	Q1008 D1009 M1029 T1054 I1055 M1062	Q1008-R1058 PolarHBondContact NE2-O 3.26Å; Q1008-R1058 VanDerWaalsContact OE1-CZ 3.31Å; D1009-R1058 IonicContact OD1-CZ 2.73Å; D1009-R1058 IonicContact OD1-NH1 3.52Å; D1009-R1058 IonicContact OD1-NH2 2.57Å; D1009-R1058 PolarHBondContact OD1-NH2 2.96Å; D1009-R1058 IonicContact OD2-CZ 3.54Å; D1009-R1058 IonicContact OD2-NH1 3.43Å; D1009-R1058 PolarHBondContact OD2-NH1 3.28Å; D1009-R1058 IonicContact OD2-NH2 3.94Å; D1009-R1058 PolarHBondContact OD2-NH2 3.05Å; M1029-R1058 HydrophobicContact CE-CB 4.32Å; T1054-R1058 HydrophobicContact CG2-CG 4.44Å; T1054-R1058 WeakPolarHBondContact O-CB 3.27Å; T1054-R1058 WeakPolarHBondContact O-CG 3.29Å; T1054-R1058 PolarHBondContact O-N 2.81Å; I1055-R1058 PolarHBondContact O-N 3.35Å; R1058-M1062 WeakPolarHBondContact O-CB 3.28Å; R1058-M1062 PolarHBondContact O-N 2.8Å; R1058-M1062 VanDerWaalsContact O-N 3.15Å
1059	L	96	Very high	93.3	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-69.3	-39.2	171.2	-74.1	174.5	0	0	0	112.1	M1029 I1055 H1056 H1057 M1062 Y1063 H1087	M1029-L1059 HydrophobicContact CB-CD1 3.96Å; M1029-L1059 HydrophobicContact CB-CD2 3.98Å; M1029-L1059 HydrophobicContact CB-CG 4.09Å; M1029-L1059 HydrophobicContact CG-CD2 3.99Å; M1029-L1059 HydrophobicContact CG-CG 4.16Å; I1055-L1059 HydrophobicContact CG2-CD1 3.96Å; I1055-L1059 HydrophobicContact CG2-CG 4.4Å; I1055-L1059 WeakPolarHBondContact O-CB 3.28Å; I1055-L1059 WeakPolarHBondContact O-CG 3.37Å; I1055-L1059 PolarHBondContact O-N 3.19Å; H1056-L1059 PolarHBondContact O-N 2.88Å; H1057-L1059 VanDerWaalsContact C-N 3.33Å; H1057-L1059 PolarHBondContact O-N 3.38Å; L1059-M1062 HydrophobicContact CD2-CE 4.14Å; L1059-M1062 PolarHBondContact O-N 3.38Å; L1059-Y1063 WeakPolarHBondContact O-CD2 3.43Å; L1059-Y1063 PolarHBondContact O-N 3.23Å; L1059-H1087 HydrophobicContact CB-CB 4.47Å
1060	A	95.6	Very high	93.1	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-63.8	-49.2	177.8	0	0	0	0	0	111.7	H1056 H1057 M1062 Y1063 H1064 H1087 Y1088	H1056-A1060 WeakPolarHBondContact O-CB 3.23Å; H1056-A1060 PolarHBondContact O-N 2.89Å; H1057-A1060 WeakPolarHBondContact O-CA 3.36Å; H1057-A1060 WeakPolarHBondContact O-CB 3.38Å; H1057-A1060 PolarHBondContact O-N 2.83Å; A1060-M1062 VanDerWaalsContact C-N 3.31Å; A1060-M1062 PolarHBondContact O-N 3.41Å; A1060-Y1063 PolarHBondContact O-N 2.84Å; A1060-H1064 VanDerWaalsContact O-CB 3.24Å; A1060-H1064 WeakPolarHBondContact O-CB 3.46Å; A1060-H1064 PolarHBondContact O-N 3.34Å; A1060-H1087 HydrophobicContact CB-CB 3.68Å; A1060-Y1088 HydrophobicContact CB-CD1 3.56Å; A1060-Y1088 HydrophobicContact CB-CD2 3.68Å; A1060-Y1088 HydrophobicContact CB-CE1 3.71Å; A1060-Y1088 HydrophobicContact CB-CE2 3.82Å; A1060-Y1088 HydrophobicContact CB-CG 3.52Å
1061	S	94.6	Very high	92.3	Very high	31 Å²	31	34.5 Å²	34.5	22%	0.217	17%	0.174	C	C	.	.	H	α-helix	trans	-62.6	-37.2	177.8	-44.4	0	0	0	0	111.9	H1057 S1065 Y1088 E1111	H1057-S1061 PolarHBondContact CE1-OG 3.26Å; H1057-S1061 PolarHBondContact ND1-OG 3.01Å; H1057-S1061 PolarHBondContact O-N 3.5Å; H1057-S1061 PolarHBondContact O-OG 2.95Å; S1061-S1065 PolarHBondContact O-N 2.85Å; S1061-Y1088 WeakPolarHBondContact CA-OH 3.48Å; S1061-E1111 WeakPolarHBondContact CB-OE2 3.37Å; S1061-E1111 PolarHBondContact OG-OE2 2.93Å
1062	M	93.9	Very high	91.3	Very high	16 Å²	16	37.1 Å²	37.1	8%	0.079	21%	0.208	C	C	.	.	H	α-helix	trans	-61.3	-57.1	171.9	-170.4	-177.2	76.2	0	0	111.2	E1022 V1025 T1026 R1058 L1059 A1060 H1064 S1065 C1066	E1022-M1062 HydrophobicContact CB-CE 4.34Å; E1022-M1062 HydrophobicContact CB-SD 4.2Å; E1022-M1062 HydrophobicContact CG-CG 4.44Å; E1022-M1062 HydrophobicContact CG-SD 4.06Å; V1025-M1062 HydrophobicContact CB-SD 4.36Å; V1025-M1062 HydrophobicContact CG1-SD 3.99Å; T1026-M1062 WeakPolarHBondContact OG1-CE 3.39Å; R1058-M1062 WeakPolarHBondContact O-CB 3.28Å; R1058-M1062 PolarHBondContact O-N 2.8Å; R1058-M1062 VanDerWaalsContact O-N 3.15Å; L1059-M1062 HydrophobicContact CD2-CE 4.14Å; L1059-M1062 PolarHBondContact O-N 3.38Å; A1060-M1062 VanDerWaalsContact C-N 3.31Å; A1060-M1062 PolarHBondContact O-N 3.41Å; M1062-H1064 PolarHBondContact O-N 2.68Å; M1062-S1065 WeakPolarHBondContact O-CA 3.35Å; M1062-S1065 VanDerWaalsContact O-CB 3.3Å; M1062-S1065 WeakPolarHBondContact O-CB 3.41Å; M1062-S1065 PolarHBondContact O-N 2.83Å; M1062-C1066 PolarHBondContact O-N 3.2Å; M1062-C1066 PolarHBondContact O-SG 3.38Å
1063	Y	94.5	Very high	90.8	Very high	24 Å²	24	40.5 Å²	40.5	9%	0.094	23%	0.226	C	C	.	.	H	α-helix	trans	-65.1	-27.3	-179	-70.9	-49.2	0	0	0	113.6	T1026 L1059 A1060 F1067 H1080 L1083 H1087	T1026-Y1063 VanDerWaalsContact CG2-OH 3.31Å; T1026-Y1063 WeakPolarHBondContact CG2-OH 3.3Å; T1026-Y1063 PolarHBondContact OG1-OH 2.86Å; L1059-Y1063 WeakPolarHBondContact O-CD2 3.43Å; L1059-Y1063 PolarHBondContact O-N 3.23Å; A1060-Y1063 PolarHBondContact O-N 2.84Å; Y1063-F1067 VanDerWaalsContact O-CB 3.25Å; Y1063-F1067 WeakPolarHBondContact O-CB 3.49Å; Y1063-F1067 PolarHBondContact O-N 2.94Å; Y1063-H1080 AromaticContact CD1-ND1 3.45Å; Y1063-H1080 WeakPolarHBondContact CD1-ND1 3.43Å; Y1063-H1080 AromaticContact CE1-ND1 3.93Å; Y1063-L1083 HydrophobicContact CD1-CB 4.5Å; Y1063-L1083 HydrophobicContact CD1-CD1 4.37Å; Y1063-L1083 HydrophobicContact CD2-CB 3.58Å; Y1063-L1083 HydrophobicContact CD2-CD1 4.46Å; Y1063-L1083 HydrophobicContact CE1-CD1 4Å; Y1063-L1083 HydrophobicContact CE2-CB 3.84Å; Y1063-L1083 HydrophobicContact CE2-CD1 4.07Å; Y1063-L1083 HydrophobicContact CE2-CG 4.41Å; Y1063-L1083 HydrophobicContact CG-CB 3.92Å; Y1063-H1087 AromaticContact CD2-CD2 3.89Å; Y1063-H1087 AromaticContact CE2-CD2 3.84Å; Y1063-H1087 AromaticContact CE2-NE2 3.99Å
1064	H	93.6	Very high	90.4	Very high	27 Å²	27	46.3 Å²	46.3	13%	0.125	25%	0.253	C	S	.	.	H	α-helix	trans	-64.3	-45.3	169	-179	-173.8	0	0	0	110.8	A1060 M1062 F1067 R1068 A1084 Y1088 F1115	A1060-H1064 VanDerWaalsContact O-CB 3.24Å; A1060-H1064 WeakPolarHBondContact O-CB 3.46Å; A1060-H1064 PolarHBondContact O-N 3.34Å; M1062-H1064 PolarHBondContact O-N 2.68Å; H1064-F1067 PolarHBondContact O-N 3.03Å; H1064-R1068 WeakPolarHBondContact O-CB 2.96Å; H1064-R1068 PolarHBondContact O-N 3.29Å; H1064-A1084 HydrophobicContact CB-CB 4.39Å; H1064-Y1088 HydrophobicContact CB-CE2 4.12Å; H1064-Y1088 AromaticContact ND1-CE2 3.99Å; H1064-Y1088 PolarHBondContact ND1-OH 3.04Å; H1064-F1115 HydrophobicContact CB-CD2 4.38Å; H1064-F1115 AromaticContact CD2-CD2 3.73Å; H1064-F1115 VanDerWaalsContact CE1-CA 3.48Å; H1064-F1115 WeakPolarHBondContact CE1-CA 3.27Å; H1064-F1115 PolarHBondContact CE1-N 3.26Å; H1064-F1115 AromaticContact CG-CD2 3.92Å
1065	S	91.8	Very high	90	Very high	53 Å²	53	52 Å²	52	37%	0.371	28%	0.278	S	S	.	.	H	α-helix	trans	-60.5	-47.3	172.5	-167.9	0	0	0	0	111.9	S1061 M1062 F1067 R1068 N1069	S1061-S1065 PolarHBondContact O-N 2.85Å; M1062-S1065 WeakPolarHBondContact O-CA 3.35Å; M1062-S1065 VanDerWaalsContact O-CB 3.3Å; M1062-S1065 WeakPolarHBondContact O-CB 3.41Å; M1062-S1065 PolarHBondContact O-N 2.83Å; S1065-F1067 PolarHBondContact O-N 2.9Å; S1065-R1068 PolarHBondContact O-N 3.43Å; S1065-R1068 VanDerWaalsContact O-N 3.17Å; S1065-N1069 WeakPolarHBondContact O-CB 3.36Å; S1065-N1069 PolarHBondContact O-N 2.99Å; S1065-N1069 PolarHBondContact O-ND2 3.45Å; S1065-N1069 VanDerWaalsContact O-ND2 3.1Å; S1065-N1069 PolarHBondContact OG-ND2 2.92Å
1066	C	90.4	Very high	89.6	Confident	8 Å²	8	54 Å²	54	5%	0.054	29%	0.289	C	S	.	.	H	α-helix	trans	-55.9	-49.4	174.1	-51	0	0	0	0	110.8	E1022 M1062 R1068 N1069 Q1070 H1080	E1022-C1066 PolarHBondContact OE1-SG 3.19Å; E1022-C1066 VanDerWaalsContact OE1-SG 3.42Å; E1022-C1066 PolarHBondContact OE2-SG 3.16Å; M1062-C1066 PolarHBondContact O-N 3.2Å; M1062-C1066 PolarHBondContact O-SG 3.38Å; C1066-R1068 VanDerWaalsContact C-N 3.3Å; C1066-R1068 PolarHBondContact O-N 2.68Å; C1066-N1069 PolarHBondContact O-N 3.16Å; C1066-Q1070 VanDerWaalsContact O-CB 3.23Å; C1066-Q1070 WeakPolarHBondContact O-CB 3.21Å; C1066-Q1070 PolarHBondContact O-N 3.19Å; C1066-H1080 HydrophobicContact CB-CB 4.36Å
1067	F	90.5	Very high	89.1	Confident	16 Å²	16	56.7 Å²	56.7	7%	0.07	30%	0.298	C	S	.	.	H	α-helix	trans	-59.7	-36.1	177.8	171.2	-123.2	0	0	0	113.5	Y1063 H1064 S1065 R1077 H1080 R1081 F1115 F1118	Y1063-F1067 VanDerWaalsContact O-CB 3.25Å; Y1063-F1067 WeakPolarHBondContact O-CB 3.49Å; Y1063-F1067 PolarHBondContact O-N 2.94Å; H1064-F1067 PolarHBondContact O-N 3.03Å; S1065-F1067 PolarHBondContact O-N 2.9Å; F1067-R1077 HydrophobicContact CD2-CG 3.61Å; F1067-R1077 WeakPolarHBondContact CD2-O 3.45Å; F1067-R1077 HydrophobicContact CE2-CG 3.78Å; F1067-H1080 HydrophobicContact CB-CB 4.02Å; F1067-R1081 HydrophobicContact CD1-CB 4.48Å; F1067-R1081 HydrophobicContact CD2-CB 3.81Å; F1067-R1081 HydrophobicContact CE1-CB 4.49Å; F1067-R1081 HydrophobicContact CE1-CG 4.27Å; F1067-R1081 HydrophobicContact CE2-CB 3.85Å; F1067-R1081 HydrophobicContact CE2-CG 4.23Å; F1067-R1081 HydrophobicContact CG-CB 4.15Å; F1067-R1081 HydrophobicContact CZ-CB 4.21Å; F1067-R1081 HydrophobicContact CZ-CG 4.09Å; F1067-F1115 HydrophobicContact CD1-CD2 4.19Å; F1067-F1115 AromaticContact CD1-CE2 3.72Å; F1067-F1115 HydrophobicContact CD1-CE2 3.72Å; F1067-F1115 HydrophobicContact CE1-CD2 4.48Å; F1067-F1115 AromaticContact CE1-CE2 4Å; F1067-F1115 HydrophobicContact CE1-CE2 4Å; F1067-F1118 AromaticContact CD1-CD1 3.9Å; F1067-F1118 HydrophobicContact CD1-CD1 3.9Å; F1067-F1118 AromaticContact CD1-CE1 3.93Å; F1067-F1118 HydrophobicContact CD1-CE1 3.93Å; F1067-F1118 AromaticContact CE1-CD1 3.55Å; F1067-F1118 HydrophobicContact CE1-CD1 3.55Å; F1067-F1118 AromaticContact CE1-CE1 3.71Å; F1067-F1118 HydrophobicContact CE1-CE1 3.71Å; F1067-F1118 HydrophobicContact CZ-CD1 4.34Å; F1067-F1118 HydrophobicContact CZ-CE1 4.19Å
1068	R	88.9	Confident	88.8	Confident	149 Å²	149	62.3 Å²	62.3	56%	0.562	32%	0.322	S	S	*	.	H	α-helix	trans	-70.8	-38.8	177.5	-164.1	-172.5	74.3	-175.5	3.5	112.4	H1064 S1065 C1066 F1118	H1064-R1068 WeakPolarHBondContact O-CB 2.96Å; H1064-R1068 PolarHBondContact O-N 3.29Å; S1065-R1068 PolarHBondContact O-N 3.43Å; S1065-R1068 VanDerWaalsContact O-N 3.17Å; C1066-R1068 VanDerWaalsContact C-N 3.3Å; C1066-R1068 PolarHBondContact O-N 2.68Å; R1068-F1118 HydrophobicContact CB-CE1 4.1Å; R1068-F1118 HydrophobicContact CB-CZ 4.16Å; R1068-F1118 HydrophobicContact CG-CD2 4.36Å; R1068-F1118 HydrophobicContact CG-CE1 4.01Å; R1068-F1118 HydrophobicContact CG-CE2 3.82Å; R1068-F1118 HydrophobicContact CG-CZ 3.63Å
1069	N	86.8	Confident	88.6	Confident	91 Å²	91	64.3 Å²	64.3	49%	0.487	33%	0.333	S	S	.	.	H	α-helix	trans	-96.8	-12.1	-172.1	-52.5	-29.2	0	0	0	113.2	S1065 C1066 V1071	S1065-N1069 WeakPolarHBondContact O-CB 3.36Å; S1065-N1069 PolarHBondContact O-N 2.99Å; S1065-N1069 PolarHBondContact O-ND2 3.45Å; S1065-N1069 VanDerWaalsContact O-ND2 3.1Å; S1065-N1069 PolarHBondContact OG-ND2 2.92Å; C1066-N1069 PolarHBondContact O-N 3.16Å; N1069-V1071 PolarHBondContact O-N 3.25Å
1070	Q	85.8	Confident	88.3	Confident	46 Å²	46	65.1 Å²	65.1	22%	0.215	34%	0.337	C	S	.	.			trans	-67.7	122.9	179.3	-171.6	62.9	24.3	0	0	111.9	C1066 R1077	C1066-Q1070 VanDerWaalsContact O-CB 3.23Å; C1066-Q1070 WeakPolarHBondContact O-CB 3.21Å; C1066-Q1070 PolarHBondContact O-N 3.19Å; Q1070-R1077 HydrophobicContact CB-CB 4.29Å; Q1070-R1077 HydrophobicContact CB-CG 4.29Å; Q1070-R1077 HydrophobicContact CG-CB 3.94Å; Q1070-R1077 HydrophobicContact CG-CG 4.46Å
1071	V	76.2	Confident	88.1	Confident	133 Å²	133	70 Å²	70	81%	0.806	36%	0.356	S	S	*	.			trans	-121.8	136.8	177.5	-176.7	0	0	0	0	109.7	N1069 D1073	N1069-V1071 PolarHBondContact O-N 3.25Å; V1071-D1073 PolarHBondContact O-N 3.42Å
1072	G	73.3	Confident	88.1	Confident	77 Å²	77	73 Å²	73	79%	0.794	37%	0.369	S	S	*	.	S	Bend	trans	91.7	-42.6	170.2	0	0	0	0	0	116
1073	D	83.7	Confident	88.1	Confident	71 Å²	71	74.3 Å²	74.3	38%	0.38	38%	0.376	S	S	.	.			trans	-95.6	96.3	177.5	-171.3	-19.6	0	0	0	112	V1071 H1075 L1076 R1077	V1071-D1073 PolarHBondContact O-N 3.42Å; D1073-H1075 VanDerWaalsContact C-N 3.32Å; D1073-H1075 PolarHBondContact O-N 2.77Å; D1073-H1075 WeakPolarHBondContact OD1-CA 3.13Å; D1073-H1075 WeakPolarHBondContact OD1-CB 3.35Å; D1073-H1075 PolarHBondContact OD1-N 3.29Å; D1073-L1076 HydrophobicContact CB-CB 4.03Å; D1073-L1076 VanDerWaalsContact CG-CB 3.47Å; D1073-L1076 PolarHBondContact OD1-N 3.15Å; D1073-L1076 WeakPolarHBondContact OD2-CB 3.12Å; D1073-R1077 WeakPolarHBondContact O-CB 3.43Å; D1073-R1077 PolarHBondContact O-N 3.14Å
1074	E	84.3	Confident	88.1	Confident	122 Å²	122	73.1 Å²	73.1	57%	0.57	37%	0.372	S	S	*	.	H	α-helix	trans	-70.1	-21.9	177.2	-76.4	-67.4	130.7	0	0	113.9	R1077 K1078	E1074-R1077 WeakPolarHBondContact OE1-CD 3.3Å; E1074-R1077 IonicContact OE1-CZ 3.47Å; E1074-R1077 IonicContact OE1-NH1 2.71Å; E1074-R1077 PolarHBondContact OE1-NH1 3.42Å; E1074-K1078 VanDerWaalsContact O-CB 3.26Å; E1074-K1078 WeakPolarHBondContact O-CB 3.47Å; E1074-K1078 PolarHBondContact O-N 2.72Å; E1074-K1078 VanDerWaalsContact O-N 3.08Å
1075	H	87.8	Confident	88.1	Confident	140 Å²	140	74.7 Å²	74.7	65%	0.648	38%	0.379	S	S	*	.	H	α-helix	trans	-72.9	-51.9	175	178.7	-84.7	0	0	0	110.2	D1073 R1077 K1078 Q1079	D1073-H1075 VanDerWaalsContact C-N 3.32Å; D1073-H1075 PolarHBondContact O-N 2.77Å; D1073-H1075 WeakPolarHBondContact OD1-CA 3.13Å; D1073-H1075 WeakPolarHBondContact OD1-CB 3.35Å; D1073-H1075 PolarHBondContact OD1-N 3.29Å; H1075-R1077 VanDerWaalsContact C-N 3.33Å; H1075-R1077 PolarHBondContact O-N 2.89Å; H1075-K1078 PolarHBondContact O-N 2.82Å; H1075-Q1079 PolarHBondContact O-N 2.89Å
1076	L	85.9	Confident	88.3	Confident	44 Å²	44	76.1 Å²	76.1	23%	0.23	38%	0.382	C	S	.	.	H	α-helix	trans	-62.9	-40.2	177.1	-176.1	58.5	0	0	0	111.4	D1073 K1078 Q1079 H1080	D1073-L1076 HydrophobicContact CB-CB 4.03Å; D1073-L1076 VanDerWaalsContact CG-CB 3.47Å; D1073-L1076 PolarHBondContact OD1-N 3.15Å; D1073-L1076 WeakPolarHBondContact OD2-CB 3.12Å; L1076-K1078 PolarHBondContact O-N 3.14Å; L1076-Q1079 WeakPolarHBondContact O-CB 3.47Å; L1076-Q1079 PolarHBondContact O-N 3.32Å; L1076-Q1079 VanDerWaalsContact O-N 3.13Å; L1076-H1080 WeakPolarHBondContact CD1-NE2 3.35Å; L1076-H1080 WeakPolarHBondContact CG-NE2 3.17Å; L1076-H1080 PolarHBondContact O-CD2 3.32Å; L1076-H1080 VanDerWaalsContact O-CD2 3.25Å; L1076-H1080 PolarHBondContact O-N 3.42Å
1077	R	86.8	Confident	88.5	Confident	73 Å²	73	76.3 Å²	76.3	28%	0.275	38%	0.382	S	S	.	.	H	α-helix	trans	-59.8	-42.6	173.9	-170	179	-170.8	-161.9	4.8	112.6	F1067 Q1070 D1073 E1074 H1075 R1081	F1067-R1077 HydrophobicContact CD2-CG 3.61Å; F1067-R1077 WeakPolarHBondContact CD2-O 3.45Å; F1067-R1077 HydrophobicContact CE2-CG 3.78Å; Q1070-R1077 HydrophobicContact CB-CB 4.29Å; Q1070-R1077 HydrophobicContact CB-CG 4.29Å; Q1070-R1077 HydrophobicContact CG-CB 3.94Å; Q1070-R1077 HydrophobicContact CG-CG 4.46Å; D1073-R1077 WeakPolarHBondContact O-CB 3.43Å; D1073-R1077 PolarHBondContact O-N 3.14Å; E1074-R1077 WeakPolarHBondContact OE1-CD 3.3Å; E1074-R1077 IonicContact OE1-CZ 3.47Å; E1074-R1077 IonicContact OE1-NH1 2.71Å; E1074-R1077 PolarHBondContact OE1-NH1 3.42Å; H1075-R1077 VanDerWaalsContact C-N 3.33Å; H1075-R1077 PolarHBondContact O-N 2.89Å; R1077-R1081 PolarHBondContact O-N 3.22Å; R1077-R1081 VanDerWaalsContact O-N 3.1Å
1078	K	89.1	Confident	88.8	Confident	137 Å²	137	75.6 Å²	75.6	60%	0.596	38%	0.379	S	S	*	.	H	α-helix	trans	-66	-36.9	173.8	-175.5	-178.7	178.5	-174.3	0	112	E1074 H1075 L1076 N1082	E1074-K1078 VanDerWaalsContact O-CB 3.26Å; E1074-K1078 WeakPolarHBondContact O-CB 3.47Å; E1074-K1078 PolarHBondContact O-N 2.72Å; E1074-K1078 VanDerWaalsContact O-N 3.08Å; H1075-K1078 PolarHBondContact O-N 2.82Å; L1076-K1078 PolarHBondContact O-N 3.14Å; K1078-N1082 VanDerWaalsContact O-CG 3.26Å; K1078-N1082 PolarHBondContact O-N 3.01Å; K1078-N1082 VanDerWaalsContact O-N 3.09Å; K1078-N1082 PolarHBondContact O-OD1 2.81Å
1079	Q	90.7	Very high	89	Confident	91 Å²	91	70.6 Å²	70.6	43%	0.425	37%	0.367	S	S	.	.	H	α-helix	trans	-63.8	-49.4	175.3	-179.9	177.3	-14.9	0	0	111.6	H1075 L1076 R1081 N1082 L1083	H1075-Q1079 PolarHBondContact O-N 2.89Å; L1076-Q1079 WeakPolarHBondContact O-CB 3.47Å; L1076-Q1079 PolarHBondContact O-N 3.32Å; L1076-Q1079 VanDerWaalsContact O-N 3.13Å; Q1079-R1081 VanDerWaalsContact C-N 3.33Å; Q1079-R1081 PolarHBondContact O-N 2.9Å; Q1079-N1082 PolarHBondContact O-N 2.93Å; Q1079-N1082 VanDerWaalsContact O-N 3.15Å; Q1079-L1083 HydrophobicContact CG-CD1 3.99Å; Q1079-L1083 WeakPolarHBondContact O-CG 3.35Å; Q1079-L1083 PolarHBondContact O-N 2.84Å
1080	H	91	Very high	89.4	Confident	18 Å²	18	70.8 Å²	70.8	8%	0.083	36%	0.364	C	S	.	.	H	α-helix	trans	-59.2	-42	176.1	-69	-50.4	0	0	0	112.5	Y1063 C1066 F1067 L1076 N1082 L1083 A1084	Y1063-H1080 AromaticContact CD1-ND1 3.45Å; Y1063-H1080 WeakPolarHBondContact CD1-ND1 3.43Å; Y1063-H1080 AromaticContact CE1-ND1 3.93Å; C1066-H1080 HydrophobicContact CB-CB 4.36Å; F1067-H1080 HydrophobicContact CB-CB 4.02Å; L1076-H1080 WeakPolarHBondContact CD1-NE2 3.35Å; L1076-H1080 WeakPolarHBondContact CG-NE2 3.17Å; L1076-H1080 PolarHBondContact O-CD2 3.32Å; L1076-H1080 VanDerWaalsContact O-CD2 3.25Å; L1076-H1080 PolarHBondContact O-N 3.42Å; H1080-N1082 VanDerWaalsContact C-N 3.35Å; H1080-N1082 PolarHBondContact O-N 3.29Å; H1080-L1083 PolarHBondContact O-N 3.41Å; H1080-A1084 WeakPolarHBondContact O-CB 3.23Å; H1080-A1084 PolarHBondContact O-N 2.82Å
1081	R	91.8	Very high	89.8	Confident	103 Å²	103	68.6 Å²	68.6	39%	0.389	35%	0.353	S	S	.	.	H	α-helix	trans	-57.1	-46.1	173.6	-176	-174	162.2	169.6	-4	112.3	F1067 R1077 Q1079 E1085 F1115 T1119	F1067-R1081 HydrophobicContact CD1-CB 4.48Å; F1067-R1081 HydrophobicContact CD2-CB 3.81Å; F1067-R1081 HydrophobicContact CE1-CB 4.49Å; F1067-R1081 HydrophobicContact CE1-CG 4.27Å; F1067-R1081 HydrophobicContact CE2-CB 3.85Å; F1067-R1081 HydrophobicContact CE2-CG 4.23Å; F1067-R1081 HydrophobicContact CG-CB 4.15Å; F1067-R1081 HydrophobicContact CZ-CB 4.21Å; F1067-R1081 HydrophobicContact CZ-CG 4.09Å; R1077-R1081 PolarHBondContact O-N 3.22Å; R1077-R1081 VanDerWaalsContact O-N 3.1Å; Q1079-R1081 VanDerWaalsContact C-N 3.33Å; Q1079-R1081 PolarHBondContact O-N 2.9Å; R1081-E1085 PolarHBondContact O-N 2.98Å; R1081-F1115 HydrophobicContact CG-CE2 4.15Å; R1081-F1115 HydrophobicContact CG-CZ 3.69Å; R1081-F1115 WeakPolarHBondContact O-CZ 3.46Å; R1081-T1119 VanDerWaalsContact NH2-CG2 3.25Å
1082	N	93.7	Very high	90.6	Very high	94 Å²	94	62.5 Å²	62.5	50%	0.503	32%	0.316	S	S	.	.	H	α-helix	trans	-66.5	-37.9	179.6	-69.4	-12.2	0	0	0	112.1	K1078 Q1079 H1080 L1086	K1078-N1082 VanDerWaalsContact O-CG 3.26Å; K1078-N1082 PolarHBondContact O-N 3.01Å; K1078-N1082 VanDerWaalsContact O-N 3.09Å; K1078-N1082 PolarHBondContact O-OD1 2.81Å; Q1079-N1082 PolarHBondContact O-N 2.93Å; Q1079-N1082 VanDerWaalsContact O-N 3.15Å; H1080-N1082 VanDerWaalsContact C-N 3.35Å; H1080-N1082 PolarHBondContact O-N 3.29Å; N1082-L1086 WeakPolarHBondContact O-CB 3.38Å; N1082-L1086 PolarHBondContact O-N 3.27Å; N1082-L1086 VanDerWaalsContact O-N 3.11Å
1083	L	93.8	Very high	91.5	Very high	43 Å²	43	62.6 Å²	62.6	23%	0.225	31%	0.305	C	S	.	.	H	α-helix	trans	-69.7	-40.9	177.6	-68.8	168.6	0	0	0	111.8	Y1063 Q1079 H1080 L1086 H1087	Y1063-L1083 HydrophobicContact CD1-CB 4.5Å; Y1063-L1083 HydrophobicContact CD1-CD1 4.37Å; Y1063-L1083 HydrophobicContact CD2-CB 3.58Å; Y1063-L1083 HydrophobicContact CD2-CD1 4.46Å; Y1063-L1083 HydrophobicContact CE1-CD1 4Å; Y1063-L1083 HydrophobicContact CE2-CB 3.84Å; Y1063-L1083 HydrophobicContact CE2-CD1 4.07Å; Y1063-L1083 HydrophobicContact CE2-CG 4.41Å; Y1063-L1083 HydrophobicContact CG-CB 3.92Å; Q1079-L1083 HydrophobicContact CG-CD1 3.99Å; Q1079-L1083 WeakPolarHBondContact O-CG 3.35Å; Q1079-L1083 PolarHBondContact O-N 2.84Å; H1080-L1083 PolarHBondContact O-N 3.41Å; L1083-L1086 PolarHBondContact O-N 3.15Å; L1083-H1087 WeakPolarHBondContact O-CB 3.37Å; L1083-H1087 PolarHBondContact O-CD2 2.6Å; L1083-H1087 PolarHBondContact O-N 3.2Å
1084	A	94.4	Very high	91.9	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-59.1	-50.3	175	0	0	0	0	0	111.7	H1064 H1080 L1086 H1087 Y1088 F1115	H1064-A1084 HydrophobicContact CB-CB 4.39Å; H1080-A1084 WeakPolarHBondContact O-CB 3.23Å; H1080-A1084 PolarHBondContact O-N 2.82Å; A1084-L1086 PolarHBondContact O-N 3.49Å; A1084-H1087 PolarHBondContact O-N 3.03Å; A1084-Y1088 VanDerWaalsContact O-CD2 3.28Å; A1084-Y1088 WeakPolarHBondContact O-CD2 3.45Å; A1084-Y1088 PolarHBondContact O-N 2.84Å; A1084-F1115 HydrophobicContact CB-CD2 4.27Å; A1084-F1115 HydrophobicContact CB-CE2 3.74Å; A1084-F1115 HydrophobicContact CB-CZ 4.04Å
1085	E	93.3	Very high	92.3	Very high	59 Å²	59	55 Å²	55	28%	0.276	27%	0.268	S	S	.	.	H	α-helix	trans	-62.6	-41.7	178.4	-176	57.6	-147.1	0	0	112.4	R1081 H1087 S1089 R1112 F1115	R1081-E1085 PolarHBondContact O-N 2.98Å; E1085-H1087 VanDerWaalsContact C-N 3.34Å; E1085-H1087 PolarHBondContact O-N 3.43Å; E1085-S1089 VanDerWaalsContact O-CB 3.29Å; E1085-S1089 WeakPolarHBondContact O-CB 3.25Å; E1085-S1089 PolarHBondContact O-N 3.5Å; E1085-S1089 PolarHBondContact O-OG 3.19Å; E1085-S1089 PolarHBondContact OE1-OG 2.78Å; E1085-R1112 IonicContact OE1-CZ 3.36Å; E1085-R1112 IonicContact OE1-NE 2.89Å; E1085-R1112 PolarHBondContact OE1-NE 2.93Å; E1085-R1112 IonicContact OE1-NH2 2.89Å; E1085-R1112 PolarHBondContact OE1-NH2 2.58Å; E1085-F1115 HydrophobicContact CB-CE1 4Å; E1085-F1115 HydrophobicContact CB-CZ 4.34Å; E1085-F1115 VanDerWaalsContact OE2-CE1 3.27Å; E1085-F1115 WeakPolarHBondContact OE2-CE1 3.3Å
1086	L	95.4	Very high	92.3	Very high	84 Å²	84	52 Å²	52	44%	0.44	26%	0.257	S	S	.	.	H	α-helix	trans	-59.6	-45	176.6	176.4	64.8	0	0	0	111.6	N1082 L1083 A1084 K1090	N1082-L1086 WeakPolarHBondContact O-CB 3.38Å; N1082-L1086 PolarHBondContact O-N 3.27Å; N1082-L1086 VanDerWaalsContact O-N 3.11Å; L1083-L1086 PolarHBondContact O-N 3.15Å; A1084-L1086 PolarHBondContact O-N 3.49Å; L1086-K1090 WeakPolarHBondContact O-CG 3.42Å; L1086-K1090 PolarHBondContact O-N 3.44Å
1087	H	95.7	Very high	92.3	Very high	12 Å²	12	53.1 Å²	53.1	6%	0.056	27%	0.268	C	S	.	.	H	α-helix	trans	-77	-39.1	-177	-76.8	-61.1	0	0	0	112.6	H1056 L1059 A1060 Y1063 L1083 A1084 E1085 S1089 K1090 A1091	H1056-H1087 AromaticContact CE1-CE1 3.97Å; H1056-H1087 AromaticContact CE1-ND1 3.7Å; H1056-H1087 AromaticContact CG-ND1 3.94Å; H1056-H1087 AromaticContact ND1-CE1 3.69Å; H1056-H1087 AromaticContact ND1-ND1 3.12Å; H1056-H1087 PolarHBondContact ND1-ND1 2.96Å; H1056-H1087 VanDerWaalsContact ND1-ND1 3.12Å; H1056-H1087 WeakPolarHBondContact O-CB 3.37Å; L1059-H1087 HydrophobicContact CB-CB 4.47Å; A1060-H1087 HydrophobicContact CB-CB 3.68Å; Y1063-H1087 AromaticContact CD2-CD2 3.89Å; Y1063-H1087 AromaticContact CE2-CD2 3.84Å; Y1063-H1087 AromaticContact CE2-NE2 3.99Å; L1083-H1087 WeakPolarHBondContact O-CB 3.37Å; L1083-H1087 PolarHBondContact O-CD2 2.6Å; L1083-H1087 PolarHBondContact O-N 3.2Å; A1084-H1087 PolarHBondContact O-N 3.03Å; E1085-H1087 VanDerWaalsContact C-N 3.34Å; E1085-H1087 PolarHBondContact O-N 3.43Å; H1087-S1089 PolarHBondContact O-N 3.34Å; H1087-K1090 PolarHBondContact O-N 3.22Å; H1087-A1091 WeakPolarHBondContact O-CB 3.19Å; H1087-A1091 PolarHBondContact O-N 2.86Å
1088	Y	96.1	Very high	92.1	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59.7	-45.7	171.1	-81.9	-56.9	0	0	0	111.1	A1060 S1061 H1064 A1084 K1090 A1091 V1092 T1108 E1111 R1112 F1115	A1060-Y1088 HydrophobicContact CB-CD1 3.56Å; A1060-Y1088 HydrophobicContact CB-CD2 3.68Å; A1060-Y1088 HydrophobicContact CB-CE1 3.71Å; A1060-Y1088 HydrophobicContact CB-CE2 3.82Å; A1060-Y1088 HydrophobicContact CB-CG 3.52Å; S1061-Y1088 WeakPolarHBondContact CA-OH 3.48Å; H1064-Y1088 HydrophobicContact CB-CE2 4.12Å; H1064-Y1088 AromaticContact ND1-CE2 3.99Å; H1064-Y1088 PolarHBondContact ND1-OH 3.04Å; A1084-Y1088 VanDerWaalsContact O-CD2 3.28Å; A1084-Y1088 WeakPolarHBondContact O-CD2 3.45Å; A1084-Y1088 PolarHBondContact O-N 2.84Å; Y1088-K1090 VanDerWaalsContact C-N 3.33Å; Y1088-K1090 PolarHBondContact O-N 2.88Å; Y1088-A1091 PolarHBondContact O-N 3.36Å; Y1088-V1092 WeakPolarHBondContact O-CG2 3.46Å; Y1088-V1092 PolarHBondContact O-N 3.2Å; Y1088-T1108 HydrophobicContact CD1-CG2 3.97Å; Y1088-E1111 HydrophobicContact CE1-CB 3.73Å; Y1088-E1111 WeakPolarHBondContact OH-CB 3.24Å; Y1088-E1111 PolarHBondContact OH-OE2 2.68Å; Y1088-R1112 HydrophobicContact CD1-CB 4.17Å; Y1088-R1112 HydrophobicContact CD2-CB 4.49Å; Y1088-R1112 HydrophobicContact CD2-CG 4.45Å; Y1088-R1112 HydrophobicContact CG-CB 4.07Å; Y1088-R1112 HydrophobicContact CG-CG 4.13Å; Y1088-F1115 HydrophobicContact CE2-CB 4.16Å; Y1088-F1115 HydrophobicContact CE2-CG 4.37Å
1089	S	94.4	Very high	91.4	Very high	45 Å²	45	51.4 Å²	51.4	32%	0.315	26%	0.263	S	S	.	.	H	α-helix	trans	-59	-42.3	178.4	-62	0	0	0	0	112.5	E1085 H1087 S1093	E1085-S1089 VanDerWaalsContact O-CB 3.29Å; E1085-S1089 WeakPolarHBondContact O-CB 3.25Å; E1085-S1089 PolarHBondContact O-N 3.5Å; E1085-S1089 PolarHBondContact O-OG 3.19Å; E1085-S1089 PolarHBondContact OE1-OG 2.78Å; H1087-S1089 PolarHBondContact O-N 3.34Å; S1089-S1093 WeakPolarHBondContact O-CB 3.25Å; S1089-S1093 PolarHBondContact O-N 2.9Å
1090	K	94.6	Very high	90.7	Very high	94 Å²	94	53.3 Å²	53.3	41%	0.409	28%	0.276	S	S	.	.	H	α-helix	trans	-70.3	-39.5	176.8	-72.6	-177.8	175.8	-172.2	0	113	H1056 L1086 H1087 Y1088 S1093 L1094	H1056-K1090 HydrophobicContact CB-CB 4.38Å; H1056-K1090 VanDerWaalsContact CD2-CB 3.46Å; H1056-K1090 WeakPolarHBondContact CD2-CB 3.37Å; H1056-K1090 WeakPolarHBondContact NE2-CD 3.48Å; L1086-K1090 WeakPolarHBondContact O-CG 3.42Å; L1086-K1090 PolarHBondContact O-N 3.44Å; H1087-K1090 PolarHBondContact O-N 3.22Å; Y1088-K1090 VanDerWaalsContact C-N 3.33Å; Y1088-K1090 PolarHBondContact O-N 2.88Å; K1090-S1093 PolarHBondContact O-N 3.11Å; K1090-L1094 WeakPolarHBondContact O-CG 3.45Å; K1090-L1094 PolarHBondContact O-N 2.83Å; K1090-L1094 VanDerWaalsContact O-N 3.08Å
1091	A	94.8	Very high	90.5	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.8	-49.4	177.1	0	0	0	0	0	111	H1056 H1057 H1087 Y1088 S1093 L1094 F1095 T1108	H1056-A1091 HydrophobicContact CB-CB 3.89Å; H1057-A1091 HydrophobicContact CB-CB 4.05Å; H1087-A1091 WeakPolarHBondContact O-CB 3.19Å; H1087-A1091 PolarHBondContact O-N 2.86Å; Y1088-A1091 PolarHBondContact O-N 3.36Å; A1091-S1093 PolarHBondContact O-N 2.98Å; A1091-L1094 PolarHBondContact O-N 2.94Å; A1091-F1095 HydrophobicContact CB-CD2 4.43Å; A1091-F1095 HydrophobicContact CB-CE2 4.44Å; A1091-F1095 VanDerWaalsContact O-CD2 3.23Å; A1091-F1095 WeakPolarHBondContact O-CD2 3.34Å; A1091-F1095 PolarHBondContact O-N 3.42Å; A1091-T1108 HydrophobicContact CB-CG2 3.83Å
1092	V	93.1	Very high	90.3	Very high	5 Å²	5	47.9 Å²	47.9	3%	0.03	26%	0.256	C	S	.	.	H	α-helix	trans	-58.3	-46.6	175.5	172.7	0	0	0	0	111	Y1088 L1094 F1095 L1096 L1105 T1108 L1109	Y1088-V1092 WeakPolarHBondContact O-CG2 3.46Å; Y1088-V1092 PolarHBondContact O-N 3.2Å; V1092-L1094 VanDerWaalsContact C-N 3.27Å; V1092-L1094 PolarHBondContact O-N 3.19Å; V1092-F1095 PolarHBondContact O-N 3.46Å; V1092-L1096 HydrophobicContact CG1-CD1 3.73Å; V1092-L1096 HydrophobicContact CG1-CG 4.22Å; V1092-L1096 WeakPolarHBondContact O-CB 3.49Å; V1092-L1096 VanDerWaalsContact O-CG 3.28Å; V1092-L1096 WeakPolarHBondContact O-CG 3.38Å; V1092-L1096 PolarHBondContact O-N 2.99Å; V1092-L1105 HydrophobicContact CG1-CD1 4.35Å; V1092-T1108 HydrophobicContact CG2-CG2 3.78Å; V1092-L1109 HydrophobicContact CB-CD2 4.47Å; V1092-L1109 HydrophobicContact CG1-CD2 3.86Å; V1092-L1109 HydrophobicContact CG2-CD2 3.69Å; V1092-L1109 HydrophobicContact CG2-CG 4.15Å
1093	S	92.3	Very high	90.2	Very high	80 Å²	80	44 Å²	44	56%	0.559	24%	0.236	S	C	*	.	H	α-helix	trans	-61	-32.1	178.8	-175.7	0	0	0	0	114	S1089 K1090 A1091	S1089-S1093 WeakPolarHBondContact O-CB 3.25Å; S1089-S1093 PolarHBondContact O-N 2.9Å; K1090-S1093 PolarHBondContact O-N 3.11Å; A1091-S1093 PolarHBondContact O-N 2.98Å
1094	L	91.3	Very high	90	Very high	30 Å²	30	43.9 Å²	43.9	16%	0.157	23%	0.234	C	C	.	.	H	α-helix	trans	-82.5	-43.7	177.3	-70.5	169.6	0	0	0	111.4	A1052 A1053 K1090 A1091 V1092 L1096 S1097 L1098	A1052-L1094 HydrophobicContact CB-CD1 3.84Å; A1053-L1094 HydrophobicContact CB-CB 3.64Å; A1053-L1094 HydrophobicContact CB-CD1 4.39Å; K1090-L1094 WeakPolarHBondContact O-CG 3.45Å; K1090-L1094 PolarHBondContact O-N 2.83Å; K1090-L1094 VanDerWaalsContact O-N 3.08Å; A1091-L1094 PolarHBondContact O-N 2.94Å; V1092-L1094 VanDerWaalsContact C-N 3.27Å; V1092-L1094 PolarHBondContact O-N 3.19Å; L1094-L1096 VanDerWaalsContact C-N 3.28Å; L1094-L1096 PolarHBondContact O-N 3.48Å; L1094-S1097 PolarHBondContact O-N 3.04Å; L1094-S1097 PolarHBondContact O-OG 3.39Å; L1094-L1098 PolarHBondContact O-N 3.46Å
1095	F	91.6	Very high	89.9	Confident	2 Å²	2	44 Å²	44	1%	0.009	24%	0.235	C	C	.	.	H	α-helix	trans	-62.2	-33	175	-75.7	-56	0	0	0	112.6	Y1050 A1053 H1057 A1091 V1092 S1097 L1098 A1101 E1104 L1105	Y1050-F1095 HydrophobicContact CD2-CE1 4.26Å; Y1050-F1095 HydrophobicContact CE2-CE1 4.23Å; A1053-F1095 HydrophobicContact CB-CD1 3.67Å; A1053-F1095 HydrophobicContact CB-CD2 3.82Å; A1053-F1095 HydrophobicContact CB-CE1 3.53Å; A1053-F1095 HydrophobicContact CB-CE2 3.69Å; A1053-F1095 HydrophobicContact CB-CG 3.8Å; A1053-F1095 HydrophobicContact CB-CZ 3.54Å; H1057-F1095 HydrophobicContact CB-CE2 4.15Å; A1091-F1095 HydrophobicContact CB-CD2 4.43Å; A1091-F1095 HydrophobicContact CB-CE2 4.44Å; A1091-F1095 VanDerWaalsContact O-CD2 3.23Å; A1091-F1095 WeakPolarHBondContact O-CD2 3.34Å; A1091-F1095 PolarHBondContact O-N 3.42Å; V1092-F1095 PolarHBondContact O-N 3.46Å; F1095-S1097 PolarHBondContact O-N 3.38Å; F1095-L1098 HydrophobicContact CD1-CD1 4.17Å; F1095-L1098 PolarHBondContact O-N 3.15Å; F1095-A1101 HydrophobicContact CD1-CB 4.04Å; F1095-A1101 HydrophobicContact CE1-CB 4.32Å; F1095-E1104 HydrophobicContact CD1-CB 4.16Å; F1095-E1104 HydrophobicContact CE1-CB 3.64Å; F1095-E1104 HydrophobicContact CE1-CG 4.35Å; F1095-E1104 HydrophobicContact CE2-CB 4.21Å; F1095-E1104 HydrophobicContact CZ-CB 3.67Å; F1095-E1104 HydrophobicContact CZ-CG 4.38Å; F1095-L1105 HydrophobicContact CB-CB 4.03Å; F1095-L1105 HydrophobicContact CB-CD1 3.78Å; F1095-L1105 HydrophobicContact CB-CG 4.43Å
1096	L	88	Confident	89.9	Confident	79 Å²	79	41.1 Å²	41.1	41%	0.414	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-21	171.8	-75.6	170.9	0	0	0	114	V1092 L1094 L1105 H1145	V1092-L1096 HydrophobicContact CG1-CD1 3.73Å; V1092-L1096 HydrophobicContact CG1-CG 4.22Å; V1092-L1096 WeakPolarHBondContact O-CB 3.49Å; V1092-L1096 VanDerWaalsContact O-CG 3.28Å; V1092-L1096 WeakPolarHBondContact O-CG 3.38Å; V1092-L1096 PolarHBondContact O-N 2.99Å; L1094-L1096 VanDerWaalsContact C-N 3.28Å; L1094-L1096 PolarHBondContact O-N 3.48Å; L1096-L1105 HydrophobicContact CD2-CD1 4.15Å; L1096-L1105 HydrophobicContact CD2-CD2 3.78Å; L1096-L1105 HydrophobicContact CG-CD1 4.01Å; L1096-L1105 HydrophobicContact CG-CD2 4.42Å; L1096-H1145 HydrophobicContact CD2-CB 3.82Å
1097	S	85.7	Confident	89.9	Confident	66 Å²	66	40.6 Å²	40.6	46%	0.462	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-14.6	174.6	68.8	0	0	0	0	113.3	L1094 F1095	L1094-S1097 PolarHBondContact O-N 3.04Å; L1094-S1097 PolarHBondContact O-OG 3.39Å; F1095-S1097 PolarHBondContact O-N 3.38Å
1098	L	83.8	Confident	89.8	Confident	15 Å²	15	40 Å²	40	8%	0.079	21%	0.211	C	C	.	.			trans	-94.3	142	175	-63.5	165.8	0	0	0	109	Q1049 Y1050 L1094 F1095	Q1049-L1098 HydrophobicContact CB-CD1 4.48Å; Q1049-L1098 HydrophobicContact CB-CD2 3.87Å; Q1049-L1098 HydrophobicContact CB-CG 4.4Å; Y1050-L1098 VanDerWaalsContact CA-CD1 3.47Å; Y1050-L1098 HydrophobicContact CD2-CD1 4.23Å; L1094-L1098 PolarHBondContact O-N 3.46Å; F1095-L1098 HydrophobicContact CD1-CD1 4.17Å; F1095-L1098 PolarHBondContact O-N 3.15Å
1099	K	73.3	Confident	89.7	Confident	160 Å²	160	40 Å²	40	70%	0.696	21%	0.211	S	C	*	.	S	Bend	trans	-92.2	-26.4	177.1	-65.8	-178.9	-173.4	177.1	0	112.2
1100	D	76.9	Confident	89.7	Confident	130 Å²	130	38.6 Å²	38.6	70%	0.695	20%	0.2	S	C	*	.	S	Bend	trans	-107.7	29	-160	-28.8	-61.4	0	0	0	112.3
1101	A	85.7	Confident	89.6	Confident	2 Å²	2	36.7 Å²	36.7	2%	0.017	19%	0.192	C	C	.	.			trans	-142.7	49.9	-178	0	0	0	0	0	113.7	Y1050 F1095 C1103 L1105	Y1050-A1101 HydrophobicContact CD2-CB 3.98Å; Y1050-A1101 HydrophobicContact CE2-CB 3.83Å; F1095-A1101 HydrophobicContact CD1-CB 4.04Å; F1095-A1101 HydrophobicContact CE1-CB 4.32Å; A1101-C1103 PolarHBondContact O-N 3.07Å; A1101-L1105 PolarHBondContact O-N 2.63Å
1102	P	88.6	Confident	89.6	Confident	6 Å²	6	38.1 Å²	38.1	4%	0.039	20%	0.198	C	C	.	.	H	α-helix	trans	-67.8	-35.8	-172.9	27.8	-36.1	0	0	0	114	L1105 L1106 L1149 I1150 E1153 L1183	P1102-L1105 PolarHBondContact O-N 3.27Å; P1102-L1106 WeakPolarHBondContact O-CB 3.36Å; P1102-L1106 PolarHBondContact O-N 3.19Å; P1102-L1149 HydrophobicContact CB-CB 3.81Å; P1102-L1149 HydrophobicContact CB-CD1 4.49Å; P1102-I1150 HydrophobicContact CB-CG1 3.77Å; P1102-I1150 HydrophobicContact CG-CG1 4.21Å; P1102-E1153 WeakPolarHBondContact CG-OE1 3.34Å; P1102-L1183 HydrophobicContact CG-CD1 4.22Å
1103	C	90.5	Very high	89.6	Confident	12 Å²	12	38 Å²	38	8%	0.081	20%	0.197	C	C	.	.	H	α-helix	trans	-66.3	-42.1	-179.3	-72.7	0	0	0	0	111.8	A1101 L1106 R1107 V1188 L1191	A1101-C1103 PolarHBondContact O-N 3.07Å; C1103-L1106 PolarHBondContact O-N 3.4Å; C1103-R1107 VanDerWaalsContact O-CB 3.32Å; C1103-R1107 WeakPolarHBondContact O-CB 3.48Å; C1103-R1107 PolarHBondContact O-N 3.23Å; C1103-V1188 VanDerWaalsContact SG-CG2 3.55Å; C1103-L1191 HydrophobicContact CB-CD1 4.08Å; C1103-L1191 WeakPolarHBondContact O-CD1 3.41Å
1104	E	91.1	Very high	89.5	Confident	41 Å²	41	36.2 Å²	36.2	19%	0.192	19%	0.187	C	C	.	.	H	α-helix	trans	-68.2	-38.2	176.4	-66.7	91	146.5	0	0	111.9	Y1050 F1095 T1108	Y1050-E1104 PolarHBondContact OH-OE1 2.9Å; F1095-E1104 HydrophobicContact CD1-CB 4.16Å; F1095-E1104 HydrophobicContact CE1-CB 3.64Å; F1095-E1104 HydrophobicContact CE1-CG 4.35Å; F1095-E1104 HydrophobicContact CE2-CB 4.21Å; F1095-E1104 HydrophobicContact CZ-CB 3.67Å; F1095-E1104 HydrophobicContact CZ-CG 4.38Å; E1104-T1108 VanDerWaalsContact O-CB 3.25Å; E1104-T1108 WeakPolarHBondContact O-CB 3.45Å; E1104-T1108 PolarHBondContact O-N 3.06Å; E1104-T1108 PolarHBondContact O-OG1 3.2Å
1105	L	92.6	Very high	89.6	Confident	1 Å²	1	35 Å²	35	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-60.5	-50.3	171.7	179.5	59.6	0	0	0	111	V1092 F1095 L1096 A1101 P1102 T1108 L1109 H1145 A1146	V1092-L1105 HydrophobicContact CG1-CD1 4.35Å; F1095-L1105 HydrophobicContact CB-CB 4.03Å; F1095-L1105 HydrophobicContact CB-CD1 3.78Å; F1095-L1105 HydrophobicContact CB-CG 4.43Å; L1096-L1105 HydrophobicContact CD2-CD1 4.15Å; L1096-L1105 HydrophobicContact CD2-CD2 3.78Å; L1096-L1105 HydrophobicContact CG-CD1 4.01Å; L1096-L1105 HydrophobicContact CG-CD2 4.42Å; A1101-L1105 PolarHBondContact O-N 2.63Å; P1102-L1105 PolarHBondContact O-N 3.27Å; L1105-T1108 PolarHBondContact O-N 3.36Å; L1105-L1109 HydrophobicContact CD1-CD1 3.93Å; L1105-L1109 HydrophobicContact CD1-CG 4.29Å; L1105-L1109 HydrophobicContact CG-CD1 4.03Å; L1105-L1109 WeakPolarHBondContact O-CB 3.34Å; L1105-L1109 WeakPolarHBondContact O-CG 3.43Å; L1105-L1109 PolarHBondContact O-N 2.73Å; L1105-H1145 HydrophobicContact CD2-CB 4.5Å; L1105-A1146 HydrophobicContact CB-CB 4.26Å; L1105-A1146 HydrophobicContact CD2-CB 3.93Å; L1105-A1146 HydrophobicContact CG-CB 4.01Å
1106	L	92.9	Very high	89.4	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.2	-45.9	178.7	-178.6	58.6	0	0	0	111.6	P1102 C1103 T1108 L1109 L1110 T1143 A1146 F1147 I1150 L1191	P1102-L1106 WeakPolarHBondContact O-CB 3.36Å; P1102-L1106 PolarHBondContact O-N 3.19Å; C1103-L1106 PolarHBondContact O-N 3.4Å; L1106-T1108 PolarHBondContact O-N 3.17Å; L1106-L1109 PolarHBondContact O-N 3.21Å; L1106-L1110 HydrophobicContact CD1-CD1 4.12Å; L1106-L1110 HydrophobicContact CD1-CG 4.2Å; L1106-L1110 HydrophobicContact CG-CD1 4.03Å; L1106-L1110 WeakPolarHBondContact O-CB 3.26Å; L1106-L1110 VanDerWaalsContact O-CG 3.3Å; L1106-L1110 WeakPolarHBondContact O-CG 3.27Å; L1106-L1110 PolarHBondContact O-N 2.57Å; L1106-T1143 HydrophobicContact CD1-CG2 3.96Å; L1106-A1146 HydrophobicContact CB-CB 3.81Å; L1106-F1147 HydrophobicContact CD1-CE2 3.92Å; L1106-F1147 HydrophobicContact CD1-CZ 4.01Å; L1106-F1147 HydrophobicContact CD2-CE1 3.98Å; L1106-F1147 HydrophobicContact CD2-CZ 3.95Å; L1106-I1150 HydrophobicContact CD2-CD1 4.07Å; L1106-L1191 HydrophobicContact CB-CD1 4.33Å; L1106-L1191 HydrophobicContact CD2-CB 3.75Å; L1106-L1191 HydrophobicContact CD2-CD1 4.17Å; L1106-L1191 HydrophobicContact CG-CB 4.24Å; L1106-L1191 HydrophobicContact CG-CD1 4.35Å
1107	R	94.4	Very high	89.4	Confident	73 Å²	73	33.8 Å²	33.8	28%	0.275	17%	0.174	S	C	.	.	H	α-helix	trans	-58.8	-48.1	175.7	-170.7	-174.5	-63.2	125.7	-2.8	111.5	C1103 L1109 L1110 E1111 E1187 L1191	C1103-R1107 VanDerWaalsContact O-CB 3.32Å; C1103-R1107 WeakPolarHBondContact O-CB 3.48Å; C1103-R1107 PolarHBondContact O-N 3.23Å; R1107-L1109 VanDerWaalsContact C-N 3.33Å; R1107-L1109 PolarHBondContact O-N 3.06Å; R1107-L1110 PolarHBondContact O-N 2.96Å; R1107-E1111 PolarHBondContact O-N 3.26Å; R1107-E1187 IonicContact CZ-OE1 2.68Å; R1107-E1187 IonicContact NE-OE1 2.91Å; R1107-E1187 PolarHBondContact NE-OE1 3.14Å; R1107-E1187 IonicContact NH2-OE1 3.27Å; R1107-E1187 PolarHBondContact NH2-OE1 3.4Å; R1107-L1191 HydrophobicContact CB-CD1 4.46Å; R1107-L1191 HydrophobicContact CB-CD2 3.82Å; R1107-L1191 HydrophobicContact CG-CD2 4.08Å
1108	T	94.2	Very high	89.6	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61.5	-41.4	-179.8	-57.5	0	0	0	0	111.5	Y1088 A1091 V1092 E1104 L1105 L1106 R1112	Y1088-T1108 HydrophobicContact CD1-CG2 3.97Å; A1091-T1108 HydrophobicContact CB-CG2 3.83Å; V1092-T1108 HydrophobicContact CG2-CG2 3.78Å; E1104-T1108 VanDerWaalsContact O-CB 3.25Å; E1104-T1108 WeakPolarHBondContact O-CB 3.45Å; E1104-T1108 PolarHBondContact O-N 3.06Å; E1104-T1108 PolarHBondContact O-OG1 3.2Å; L1105-T1108 PolarHBondContact O-N 3.36Å; L1106-T1108 PolarHBondContact O-N 3.17Å; T1108-R1112 WeakPolarHBondContact O-CB 3.3Å; T1108-R1112 PolarHBondContact O-N 3.01Å
1109	L	93.4	Very high	89.7	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-68.2	-43.9	177.1	-73.7	169.2	0	0	0	112.4	V1092 L1105 L1106 R1107 E1111 R1112 V1113 I1139 E1142 T1143	V1092-L1109 HydrophobicContact CB-CD2 4.47Å; V1092-L1109 HydrophobicContact CG1-CD2 3.86Å; V1092-L1109 HydrophobicContact CG2-CD2 3.69Å; V1092-L1109 HydrophobicContact CG2-CG 4.15Å; L1105-L1109 HydrophobicContact CD1-CD1 3.93Å; L1105-L1109 HydrophobicContact CD1-CG 4.29Å; L1105-L1109 HydrophobicContact CG-CD1 4.03Å; L1105-L1109 WeakPolarHBondContact O-CB 3.34Å; L1105-L1109 WeakPolarHBondContact O-CG 3.43Å; L1105-L1109 PolarHBondContact O-N 2.73Å; L1106-L1109 PolarHBondContact O-N 3.21Å; R1107-L1109 VanDerWaalsContact C-N 3.33Å; R1107-L1109 PolarHBondContact O-N 3.06Å; L1109-E1111 VanDerWaalsContact C-N 3.35Å; L1109-E1111 PolarHBondContact O-N 3.1Å; L1109-R1112 PolarHBondContact O-N 2.55Å; L1109-V1113 WeakPolarHBondContact O-CG2 3.33Å; L1109-V1113 PolarHBondContact O-N 3.43Å; L1109-I1139 HydrophobicContact CD2-CG2 4.09Å; L1109-E1142 HydrophobicContact CD1-CB 4.22Å; L1109-E1142 HydrophobicContact CD2-CB 3.91Å; L1109-E1142 WeakPolarHBondContact CD2-OE2 3.26Å; L1109-T1143 HydrophobicContact CB-CG2 3.76Å; L1109-T1143 HydrophobicContact CD1-CG2 4.05Å
1110	L	94.2	Very high	90.3	Very high	14 Å²	14	26.5 Å²	26.5	7%	0.073	14%	0.135	C	C	.	.	H	α-helix	trans	-62	-40.3	176.3	-73.1	173.3	0	0	0	112.2	L1106 R1107 V1113 A1114 M1140 L1191 V1194 F1195	L1106-L1110 HydrophobicContact CD1-CD1 4.12Å; L1106-L1110 HydrophobicContact CD1-CG 4.2Å; L1106-L1110 HydrophobicContact CG-CD1 4.03Å; L1106-L1110 WeakPolarHBondContact O-CB 3.26Å; L1106-L1110 VanDerWaalsContact O-CG 3.3Å; L1106-L1110 WeakPolarHBondContact O-CG 3.27Å; L1106-L1110 PolarHBondContact O-N 2.57Å; R1107-L1110 PolarHBondContact O-N 2.96Å; L1110-V1113 WeakPolarHBondContact O-CB 3.23Å; L1110-V1113 PolarHBondContact O-N 2.78Å; L1110-A1114 PolarHBondContact O-N 3.41Å; L1110-M1140 HydrophobicContact CD2-CE 4.2Å; L1110-M1140 HydrophobicContact CD2-SD 4.19Å; L1110-L1191 HydrophobicContact CD1-CB 4.42Å; L1110-L1191 HydrophobicContact CD1-CD2 4.25Å; L1110-V1194 HydrophobicContact CD1-CB 4.34Å; L1110-V1194 HydrophobicContact CD1-CG1 4.26Å; L1110-F1195 HydrophobicContact CD1-CB 4.32Å; L1110-F1195 HydrophobicContact CD2-CB 4.05Å; L1110-F1195 HydrophobicContact CD2-CD2 4.11Å
1111	E	94.3	Very high	90.6	Very high	55 Å²	55	24.4 Å²	24.4	26%	0.257	13%	0.127	S	C	.	.	H	α-helix	trans	-66.5	-37.8	173.5	-76.6	-170.8	-159.3	0	0	113.2	H1057 S1061 Y1088 R1107 L1109 V1113 A1114 F1115	H1057-E1111 IonicContact CE1-OE1 3.71Å; H1057-E1111 PolarHBondContact CE1-OE1 3.45Å; H1057-E1111 IonicContact CE1-OE2 2.71Å; H1057-E1111 IonicContact ND1-OE2 2.66Å; S1061-E1111 WeakPolarHBondContact CB-OE2 3.37Å; S1061-E1111 PolarHBondContact OG-OE2 2.93Å; Y1088-E1111 HydrophobicContact CE1-CB 3.73Å; Y1088-E1111 WeakPolarHBondContact OH-CB 3.24Å; Y1088-E1111 PolarHBondContact OH-OE2 2.68Å; R1107-E1111 PolarHBondContact O-N 3.26Å; L1109-E1111 VanDerWaalsContact C-N 3.35Å; L1109-E1111 PolarHBondContact O-N 3.1Å; E1111-V1113 VanDerWaalsContact C-N 3.32Å; E1111-A1114 PolarHBondContact O-N 2.91Å; E1111-F1115 WeakPolarHBondContact O-CB 3.36Å; E1111-F1115 PolarHBondContact O-N 3.05Å
1112	R	93.7	Very high	90.2	Very high	29 Å²	29	27.7 Å²	27.7	11%	0.109	16%	0.161	C	C	.	.	H	α-helix	trans	-66.3	-34.5	175.2	-168.2	-172.3	178.5	-151.2	-0.4	111.8	E1085 Y1088 T1108 L1109 T1116 I1139 E1142	E1085-R1112 IonicContact OE1-CZ 3.36Å; E1085-R1112 IonicContact OE1-NE 2.89Å; E1085-R1112 PolarHBondContact OE1-NE 2.93Å; E1085-R1112 IonicContact OE1-NH2 2.89Å; E1085-R1112 PolarHBondContact OE1-NH2 2.58Å; Y1088-R1112 HydrophobicContact CD1-CB 4.17Å; Y1088-R1112 HydrophobicContact CD2-CB 4.49Å; Y1088-R1112 HydrophobicContact CD2-CG 4.45Å; Y1088-R1112 HydrophobicContact CG-CB 4.07Å; Y1088-R1112 HydrophobicContact CG-CG 4.13Å; T1108-R1112 WeakPolarHBondContact O-CB 3.3Å; T1108-R1112 PolarHBondContact O-N 3.01Å; L1109-R1112 PolarHBondContact O-N 2.55Å; R1112-T1116 PolarHBondContact O-N 3.21Å; R1112-T1116 VanDerWaalsContact O-N 3.09Å; R1112-T1116 PolarHBondContact O-OG1 3.1Å; R1112-I1139 HydrophobicContact CB-CG2 4.26Å; R1112-I1139 HydrophobicContact CG-CD1 4.22Å; R1112-I1139 HydrophobicContact CG-CG2 4.22Å; R1112-E1142 IonicContact NH1-OE1 3.35Å; R1112-E1142 IonicContact NH1-OE2 3.75Å; R1112-E1142 PolarHBondContact NH1-OE2 3.49Å
1113	V	92.8	Very high	90	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.012	17%	0.168	C	C	.	.	H	α-helix	trans	-60.8	-52.5	167.6	167.2	0	0	0	0	110.3	L1109 L1110 E1111 F1115 T1116 E1117 I1139 M1140 L1202	L1109-V1113 WeakPolarHBondContact O-CG2 3.33Å; L1109-V1113 PolarHBondContact O-N 3.43Å; L1110-V1113 WeakPolarHBondContact O-CB 3.23Å; L1110-V1113 PolarHBondContact O-N 2.78Å; E1111-V1113 VanDerWaalsContact C-N 3.32Å; V1113-F1115 VanDerWaalsContact C-N 3.28Å; V1113-F1115 PolarHBondContact O-N 3.49Å; V1113-T1116 CarbonylContact O-C 3.6Å; V1113-T1116 WeakPolarHBondContact O-CA 3.47Å; V1113-T1116 WeakPolarHBondContact O-CB 3.48Å; V1113-T1116 PolarHBondContact O-N 3.4Å; V1113-E1117 HydrophobicContact CG1-CG 4.36Å; V1113-E1117 PolarHBondContact O-N 3.21Å; V1113-I1139 HydrophobicContact CG2-CB 4.16Å; V1113-I1139 HydrophobicContact CG2-CG2 3.82Å; V1113-M1140 HydrophobicContact CB-CE 4.43Å; V1113-M1140 HydrophobicContact CG1-CE 3.92Å; V1113-M1140 HydrophobicContact CG2-CB 4.27Å; V1113-M1140 HydrophobicContact CG2-CE 4.09Å; V1113-M1140 HydrophobicContact CG2-SD 4.46Å; V1113-L1202 HydrophobicContact CG1-CD1 3.77Å
1114	A	91.5	Very high	89.4	Confident	43 Å²	43	34.7 Å²	34.7	36%	0.355	21%	0.206	S	C	.	.	H	α-helix	trans	-59.4	-37.1	179.8	0	0	0	0	0	112.8	L1110 E1111 T1116 E1117 F1118	L1110-A1114 PolarHBondContact O-N 3.41Å; E1111-A1114 PolarHBondContact O-N 2.91Å; A1114-T1116 VanDerWaalsContact C-N 3.34Å; A1114-T1116 PolarHBondContact O-N 2.82Å; A1114-E1117 PolarHBondContact O-N 2.86Å; A1114-F1118 WeakPolarHBondContact O-CB 3.37Å; A1114-F1118 PolarHBondContact O-N 2.98Å
1115	F	91.8	Very high	89.1	Confident	5 Å²	5	35.4 Å²	35.4	2%	0.022	22%	0.216	C	C	.	.	H	α-helix	trans	-61.1	-40.6	171.6	170.9	-105.1	0	0	0	112.5	H1064 F1067 R1081 A1084 E1085 Y1088 E1111 V1113 T1119	H1064-F1115 HydrophobicContact CB-CD2 4.38Å; H1064-F1115 AromaticContact CD2-CD2 3.73Å; H1064-F1115 VanDerWaalsContact CE1-CA 3.48Å; H1064-F1115 WeakPolarHBondContact CE1-CA 3.27Å; H1064-F1115 PolarHBondContact CE1-N 3.26Å; H1064-F1115 AromaticContact CG-CD2 3.92Å; F1067-F1115 HydrophobicContact CD1-CD2 4.19Å; F1067-F1115 AromaticContact CD1-CE2 3.72Å; F1067-F1115 HydrophobicContact CD1-CE2 3.72Å; F1067-F1115 HydrophobicContact CE1-CD2 4.48Å; F1067-F1115 AromaticContact CE1-CE2 4Å; F1067-F1115 HydrophobicContact CE1-CE2 4Å; R1081-F1115 HydrophobicContact CG-CE2 4.15Å; R1081-F1115 HydrophobicContact CG-CZ 3.69Å; R1081-F1115 WeakPolarHBondContact O-CZ 3.46Å; A1084-F1115 HydrophobicContact CB-CD2 4.27Å; A1084-F1115 HydrophobicContact CB-CE2 3.74Å; A1084-F1115 HydrophobicContact CB-CZ 4.04Å; E1085-F1115 HydrophobicContact CB-CE1 4Å; E1085-F1115 HydrophobicContact CB-CZ 4.34Å; E1085-F1115 VanDerWaalsContact OE2-CE1 3.27Å; E1085-F1115 WeakPolarHBondContact OE2-CE1 3.3Å; Y1088-F1115 HydrophobicContact CE2-CB 4.16Å; Y1088-F1115 HydrophobicContact CE2-CG 4.37Å; E1111-F1115 WeakPolarHBondContact O-CB 3.36Å; E1111-F1115 PolarHBondContact O-N 3.05Å; V1113-F1115 VanDerWaalsContact C-N 3.28Å; V1113-F1115 PolarHBondContact O-N 3.49Å; F1115-T1119 WeakPolarHBondContact O-CB 3.32Å; F1115-T1119 PolarHBondContact O-N 3.45Å; F1115-T1119 PolarHBondContact O-OG1 3.35Å
1116	T	89	Confident	88.5	Confident	17 Å²	17	38.5 Å²	38.5	10%	0.104	24%	0.237	C	C	.	.	H	α-helix	trans	-70.1	-40.1	177.4	-55.1	0	0	0	0	111.5	R1112 V1113 A1114 T1119 M1120 S1132 A1136	R1112-T1116 PolarHBondContact O-N 3.21Å; R1112-T1116 VanDerWaalsContact O-N 3.09Å; R1112-T1116 PolarHBondContact O-OG1 3.1Å; V1113-T1116 CarbonylContact O-C 3.6Å; V1113-T1116 WeakPolarHBondContact O-CA 3.47Å; V1113-T1116 WeakPolarHBondContact O-CB 3.48Å; V1113-T1116 PolarHBondContact O-N 3.4Å; A1114-T1116 VanDerWaalsContact C-N 3.34Å; A1114-T1116 PolarHBondContact O-N 2.82Å; T1116-T1119 WeakPolarHBondContact O-CB 3.47Å; T1116-T1119 PolarHBondContact O-N 3.26Å; T1116-M1120 WeakPolarHBondContact O-CB 3.48Å; T1116-M1120 PolarHBondContact O-N 3.38Å; T1116-S1132 WeakPolarHBondContact CG2-O 2.75Å; T1116-A1136 HydrophobicContact CG2-CB 3.87Å
1117	E	87.8	Confident	87.9	Confident	38 Å²	38	43.2 Å²	43.2	18%	0.178	27%	0.266	C	S	.	.	H	α-helix	trans	-61.7	-49.5	172.6	-69.9	-169	158.6	0	0	112	V1113 A1114 T1119 M1120 T1121 F1201 L1202	V1113-E1117 HydrophobicContact CG1-CG 4.36Å; V1113-E1117 PolarHBondContact O-N 3.21Å; A1114-E1117 PolarHBondContact O-N 2.86Å; E1117-T1119 VanDerWaalsContact C-N 3.31Å; E1117-T1119 PolarHBondContact O-N 3.17Å; E1117-M1120 CarbonylContact O-C 3.57Å; E1117-M1120 WeakPolarHBondContact O-CA 3.44Å; E1117-M1120 WeakPolarHBondContact O-CB 3.48Å; E1117-M1120 PolarHBondContact O-N 3.15Å; E1117-T1121 WeakPolarHBondContact O-CG2 3.33Å; E1117-T1121 PolarHBondContact O-N 3.25Å; E1117-F1201 WeakPolarHBondContact OE1-CD1 3.42Å; E1117-L1202 HydrophobicContact CG-CD2 3.92Å; E1117-L1202 WeakPolarHBondContact OE1-CD2 3.44Å; E1117-L1202 WeakPolarHBondContact OE1-CG 3.44Å
1118	F	88.4	Confident	87.4	Confident	58 Å²	58	41.5 Å²	41.5	25%	0.254	27%	0.267	S	S	.	.	H	α-helix	trans	-59.4	-44.6	177	-178.3	-108.1	0	0	0	110.9	F1067 R1068 A1114 M1120 T1121 G1122	F1067-F1118 AromaticContact CD1-CD1 3.9Å; F1067-F1118 HydrophobicContact CD1-CD1 3.9Å; F1067-F1118 AromaticContact CD1-CE1 3.93Å; F1067-F1118 HydrophobicContact CD1-CE1 3.93Å; F1067-F1118 AromaticContact CE1-CD1 3.55Å; F1067-F1118 HydrophobicContact CE1-CD1 3.55Å; F1067-F1118 AromaticContact CE1-CE1 3.71Å; F1067-F1118 HydrophobicContact CE1-CE1 3.71Å; F1067-F1118 HydrophobicContact CZ-CD1 4.34Å; F1067-F1118 HydrophobicContact CZ-CE1 4.19Å; R1068-F1118 HydrophobicContact CB-CE1 4.1Å; R1068-F1118 HydrophobicContact CB-CZ 4.16Å; R1068-F1118 HydrophobicContact CG-CD2 4.36Å; R1068-F1118 HydrophobicContact CG-CE1 4.01Å; R1068-F1118 HydrophobicContact CG-CE2 3.82Å; R1068-F1118 HydrophobicContact CG-CZ 3.63Å; A1114-F1118 WeakPolarHBondContact O-CB 3.37Å; A1114-F1118 PolarHBondContact O-N 2.98Å; F1118-M1120 PolarHBondContact O-N 2.93Å; F1118-T1121 PolarHBondContact O-N 2.98Å; F1118-T1121 VanDerWaalsContact O-N 3.15Å; F1118-T1121 PolarHBondContact O-OG1 3.17Å; F1118-G1122 PolarHBondContact O-N 2.91Å
1119	T	86	Confident	86.9	Confident	12 Å²	12	44.4 Å²	44.4	7%	0.074	28%	0.28	C	S	.	.	H	α-helix	trans	-57.7	-31.8	172.5	-70.3	0	0	0	0	113.4	R1081 F1115 T1116 E1117 Q1123	R1081-T1119 VanDerWaalsContact NH2-CG2 3.25Å; F1115-T1119 WeakPolarHBondContact O-CB 3.32Å; F1115-T1119 PolarHBondContact O-N 3.45Å; F1115-T1119 PolarHBondContact O-OG1 3.35Å; T1116-T1119 WeakPolarHBondContact O-CB 3.47Å; T1116-T1119 PolarHBondContact O-N 3.26Å; E1117-T1119 VanDerWaalsContact C-N 3.31Å; E1117-T1119 PolarHBondContact O-N 3.17Å; T1119-Q1123 WeakPolarHBondContact O-CG 3.37Å; T1119-Q1123 PolarHBondContact O-NE2 3.23Å
1120	M	85.4	Confident	86.5	Confident	18 Å²	18	46.1 Å²	46.1	9%	0.089	29%	0.288	C	S	.	.	H	α-helix	trans	-77.5	-36.3	176.5	176.7	-88.5	-56.5	0	0	112.5	T1116 E1117 F1118 G1122 Q1123 K1129 L1133	T1116-M1120 WeakPolarHBondContact O-CB 3.48Å; T1116-M1120 PolarHBondContact O-N 3.38Å; E1117-M1120 CarbonylContact O-C 3.57Å; E1117-M1120 WeakPolarHBondContact O-CA 3.44Å; E1117-M1120 WeakPolarHBondContact O-CB 3.48Å; E1117-M1120 PolarHBondContact O-N 3.15Å; F1118-M1120 PolarHBondContact O-N 2.93Å; M1120-G1122 VanDerWaalsContact C-N 3.28Å; M1120-G1122 PolarHBondContact O-N 3Å; M1120-Q1123 PolarHBondContact O-N 3.39Å; M1120-Q1123 VanDerWaalsContact O-N 3.17Å; M1120-K1129 HydrophobicContact CG-CB 4.04Å; M1120-K1129 HydrophobicContact CG-CG 4.08Å; M1120-K1129 HydrophobicContact SD-CB 4.26Å; M1120-K1129 HydrophobicContact SD-CD 4.21Å; M1120-K1129 HydrophobicContact SD-CG 4.15Å; M1120-L1133 HydrophobicContact CE-CD2 3.64Å; M1120-L1133 HydrophobicContact CE-CG 4.04Å; M1120-L1133 HydrophobicContact CG-CG 4.15Å; M1120-L1133 HydrophobicContact SD-CD1 4.49Å; M1120-L1133 HydrophobicContact SD-CD2 4.46Å; M1120-L1133 HydrophobicContact SD-CG 4.24Å
1121	T	83.6	Confident	86.1	Confident	87 Å²	87	53.3 Å²	53.3	53%	0.534	32%	0.319	S	S	.	.	H	α-helix	trans	-61.1	-36.8	176.6	67	0	0	0	0	112.6	E1117 F1118 Q1123	E1117-T1121 WeakPolarHBondContact O-CG2 3.33Å; E1117-T1121 PolarHBondContact O-N 3.25Å; F1118-T1121 PolarHBondContact O-N 2.98Å; F1118-T1121 VanDerWaalsContact O-N 3.15Å; F1118-T1121 PolarHBondContact O-OG1 3.17Å; T1121-Q1123 PolarHBondContact O-N 3.42Å
1122	G	78.3	Confident	85.7	Confident	70 Å²	70	51.7 Å²	51.7	72%	0.722	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-2.8	177.6	0	0	0	0	0	115.8	F1118 M1120	F1118-G1122 PolarHBondContact O-N 2.91Å; M1120-G1122 VanDerWaalsContact C-N 3.28Å; M1120-G1122 PolarHBondContact O-N 3Å
1123	Q	84.7	Confident	85.4	Confident	39 Å²	39	50.5 Å²	50.5	18%	0.182	31%	0.31	C	S	.	.			trans	-92.7	147.5	179.9	-63.3	169.9	29.3	0	0	111.5	T1119 M1120 T1121 A1128 K1129 S1132	T1119-Q1123 WeakPolarHBondContact O-CG 3.37Å; T1119-Q1123 PolarHBondContact O-NE2 3.23Å; M1120-Q1123 PolarHBondContact O-N 3.39Å; M1120-Q1123 VanDerWaalsContact O-N 3.17Å; T1121-Q1123 PolarHBondContact O-N 3.42Å; Q1123-A1128 PolarHBondContact OE1-O 2.89Å; Q1123-K1129 HydrophobicContact CB-CG 4.18Å; Q1123-K1129 WeakPolarHBondContact O-CE 3.35Å; Q1123-K1129 PolarHBondContact O-NZ 2.95Å; Q1123-S1132 PolarHBondContact NE2-OG 2.75Å; Q1123-S1132 PolarHBondContact OE1-OG 3.41Å; Q1123-S1132 VanDerWaalsContact OE1-OG 3.11Å
1124	S	77.4	Confident	85.1	Confident	127 Å²	127	52.3 Å²	52.3	89%	0.888	32%	0.319	S	S	*	.			trans	-96.8	-29.3	177.1	55.2	0	0	0	0	113.7
1125	S	85	Confident	84.9	Confident	56 Å²	56	51 Å²	51	39%	0.392	31%	0.31	S	S	.	.			trans	-83	129.1	-177.1	174.5	0	0	0	0	112.6	V1127 A1128 K1129	S1125-V1127 VanDerWaalsContact C-N 3.27Å; S1125-V1127 PolarHBondContact O-N 3.5Å; S1125-V1127 PolarHBondContact OG-N 3.29Å; S1125-A1128 PolarHBondContact O-N 2.95Å; S1125-K1129 WeakPolarHBondContact O-CG 3.42Å; S1125-K1129 PolarHBondContact O-N 3.09Å
1126	S	78.9	Confident	84.9	Confident	66 Å²	66	50.8 Å²	50.8	46%	0.462	31%	0.309	S	S	.	.	H	α-helix	trans	-60.3	-34.5	175	53.7	0	0	0	0	113.2	K1129 L1130 L1209	S1126-K1129 PolarHBondContact O-N 3.4Å; S1126-L1130 WeakPolarHBondContact O-CB 3.43Å; S1126-L1130 PolarHBondContact O-N 3.37Å; S1126-L1209 WeakPolarHBondContact O-CD2 3.46Å
1127	V	81.6	Confident	84.9	Confident	99 Å²	99	50.2 Å²	50.2	60%	0.6	31%	0.305	S	S	*	.	H	α-helix	trans	-69	-38.3	177.4	-179.4	0	0	0	0	111.1	S1125 K1131	S1125-V1127 VanDerWaalsContact C-N 3.27Å; S1125-V1127 PolarHBondContact O-N 3.5Å; S1125-V1127 PolarHBondContact OG-N 3.29Å; V1127-K1131 PolarHBondContact O-N 2.96Å
1128	A	82.5	Confident	85	Confident	36 Å²	36	54 Å²	54	30%	0.298	32%	0.323	S	S	.	.	H	α-helix	trans	-70.2	-40.6	176.2	0	0	0	0	0	111.2	Q1123 S1125 K1131 S1132	Q1123-A1128 PolarHBondContact OE1-O 2.89Å; S1125-A1128 PolarHBondContact O-N 2.95Å; A1128-K1131 PolarHBondContact O-N 3.46Å; A1128-S1132 WeakPolarHBondContact O-CB 3.46Å; A1128-S1132 PolarHBondContact O-N 2.86Å; A1128-S1132 PolarHBondContact O-OG 2.71Å
1129	K	84.2	Confident	85.1	Confident	62 Å²	62	51.9 Å²	51.9	27%	0.27	31%	0.314	S	S	.	.	H	α-helix	trans	-59.3	-46.8	172.4	-70.6	-169.9	-178.9	-168.3	0	112.2	M1120 Q1123 S1125 S1126 K1131 S1132 L1133 L1209	M1120-K1129 HydrophobicContact CG-CB 4.04Å; M1120-K1129 HydrophobicContact CG-CG 4.08Å; M1120-K1129 HydrophobicContact SD-CB 4.26Å; M1120-K1129 HydrophobicContact SD-CD 4.21Å; M1120-K1129 HydrophobicContact SD-CG 4.15Å; Q1123-K1129 HydrophobicContact CB-CG 4.18Å; Q1123-K1129 WeakPolarHBondContact O-CE 3.35Å; Q1123-K1129 PolarHBondContact O-NZ 2.95Å; S1125-K1129 WeakPolarHBondContact O-CG 3.42Å; S1125-K1129 PolarHBondContact O-N 3.09Å; S1126-K1129 PolarHBondContact O-N 3.4Å; K1129-K1131 PolarHBondContact O-N 3.33Å; K1129-S1132 PolarHBondContact O-N 3.22Å; K1129-L1133 WeakPolarHBondContact O-CB 3.3Å; K1129-L1133 WeakPolarHBondContact O-CG 3.45Å; K1129-L1133 PolarHBondContact O-N 3Å; K1129-L1209 HydrophobicContact CB-CD1 4.35Å
1130	L	84.4	Confident	85.4	Confident	35 Å²	35	51.3 Å²	51.3	18%	0.183	31%	0.311	C	S	.	.	H	α-helix	trans	-60	-45.9	176.6	-179.5	59.1	0	0	0	111.4	S1126 S1132 L1133 I1134 V1206 L1209 M1210	S1126-L1130 WeakPolarHBondContact O-CB 3.43Å; S1126-L1130 PolarHBondContact O-N 3.37Å; L1130-S1132 VanDerWaalsContact C-N 3.32Å; L1130-S1132 PolarHBondContact O-N 3.47Å; L1130-L1133 PolarHBondContact O-N 3.47Å; L1130-I1134 HydrophobicContact CD1-CD1 3.99Å; L1130-I1134 HydrophobicContact CD1-CG1 4.25Å; L1130-I1134 HydrophobicContact CG-CD1 3.94Å; L1130-I1134 VanDerWaalsContact O-CG1 3.31Å; L1130-I1134 WeakPolarHBondContact O-CG1 3.36Å; L1130-I1134 PolarHBondContact O-N 3.19Å; L1130-V1206 HydrophobicContact CD1-CG1 4.44Å; L1130-L1209 HydrophobicContact CB-CD2 4.34Å; L1130-L1209 HydrophobicContact CD1-CB 4.47Å; L1130-M1210 HydrophobicContact CD1-CG 3.69Å; L1130-M1210 HydrophobicContact CD2-CG 4.38Å
1131	K	86.1	Confident	85.7	Confident	165 Å²	165	51.4 Å²	51.4	72%	0.717	31%	0.313	S	S	*	.	H	α-helix	trans	-60.1	-41.7	176	-173.6	179.5	179.7	-177.2	0	112.3	V1127 A1128 K1129 I1134 G1135	V1127-K1131 PolarHBondContact O-N 2.96Å; A1128-K1131 PolarHBondContact O-N 3.46Å; K1129-K1131 PolarHBondContact O-N 3.33Å; K1131-I1134 PolarHBondContact O-N 3.42Å; K1131-G1135 PolarHBondContact O-N 3.34Å
1132	S	87.2	Confident	86	Confident	22 Å²	22	50.1 Å²	50.1	15%	0.154	30%	0.301	C	S	.	.	H	α-helix	trans	-70.5	-36.8	-179.5	-51.6	0	0	0	0	112.1	T1116 Q1123 A1128 K1129 L1130 G1135 A1136	T1116-S1132 WeakPolarHBondContact CG2-O 2.75Å; Q1123-S1132 PolarHBondContact NE2-OG 2.75Å; Q1123-S1132 PolarHBondContact OE1-OG 3.41Å; Q1123-S1132 VanDerWaalsContact OE1-OG 3.11Å; A1128-S1132 WeakPolarHBondContact O-CB 3.46Å; A1128-S1132 PolarHBondContact O-N 2.86Å; A1128-S1132 PolarHBondContact O-OG 2.71Å; K1129-S1132 PolarHBondContact O-N 3.22Å; L1130-S1132 VanDerWaalsContact C-N 3.32Å; L1130-S1132 PolarHBondContact O-N 3.47Å; S1132-G1135 PolarHBondContact O-N 2.96Å; S1132-A1136 PolarHBondContact O-N 2.86Å
1133	L	86.8	Confident	86.7	Confident	3 Å²	3	46.8 Å²	46.8	2%	0.016	27%	0.267	C	S	.	.	H	α-helix	trans	-68.4	-38.1	173.3	-78.3	166.6	0	0	0	112.7	M1120 K1129 L1130 A1136 I1137 L1202 Q1205 V1206 L1209	M1120-L1133 HydrophobicContact CE-CD2 3.64Å; M1120-L1133 HydrophobicContact CE-CG 4.04Å; M1120-L1133 HydrophobicContact CG-CG 4.15Å; M1120-L1133 HydrophobicContact SD-CD1 4.49Å; M1120-L1133 HydrophobicContact SD-CD2 4.46Å; M1120-L1133 HydrophobicContact SD-CG 4.24Å; K1129-L1133 WeakPolarHBondContact O-CB 3.3Å; K1129-L1133 WeakPolarHBondContact O-CG 3.45Å; K1129-L1133 PolarHBondContact O-N 3Å; L1130-L1133 PolarHBondContact O-N 3.47Å; L1133-A1136 PolarHBondContact O-N 2.86Å; L1133-I1137 PolarHBondContact O-N 2.97Å; L1133-L1202 HydrophobicContact CD2-CD2 3.77Å; L1133-Q1205 HydrophobicContact CD1-CB 4.08Å; L1133-Q1205 HydrophobicContact CD2-CB 4.09Å; L1133-V1206 HydrophobicContact CB-CG2 3.47Å; L1133-V1206 VanDerWaalsContact CB-CG2 3.47Å; L1133-V1206 HydrophobicContact CD1-CG2 4.16Å; L1133-V1206 HydrophobicContact CD2-CG2 4.44Å; L1133-V1206 HydrophobicContact CG-CG2 4.25Å; L1133-L1209 HydrophobicContact CD1-CD1 3.74Å
1134	I	86.8	Confident	87	Confident	40 Å²	40	47.2 Å²	47.2	21%	0.205	27%	0.267	C	S	.	.	H	α-helix	trans	-62.1	-46.3	173.3	-69.8	166.1	0	0	0	109.6	L1130 K1131 A1136 I1137 E1138	L1130-I1134 HydrophobicContact CD1-CD1 3.99Å; L1130-I1134 HydrophobicContact CD1-CG1 4.25Å; L1130-I1134 HydrophobicContact CG-CD1 3.94Å; L1130-I1134 VanDerWaalsContact O-CG1 3.31Å; L1130-I1134 WeakPolarHBondContact O-CG1 3.36Å; L1130-I1134 PolarHBondContact O-N 3.19Å; K1131-I1134 PolarHBondContact O-N 3.42Å; I1134-A1136 VanDerWaalsContact C-N 3.29Å; I1134-A1136 PolarHBondContact O-N 2.89Å; I1134-I1137 CarbonylContact O-C 3.58Å; I1134-I1137 WeakPolarHBondContact O-CA 3.31Å; I1134-I1137 WeakPolarHBondContact O-CB 3.41Å; I1134-I1137 PolarHBondContact O-N 3.41Å; I1134-E1138 WeakPolarHBondContact O-CG 3.43Å; I1134-E1138 PolarHBondContact O-N 3.49Å
1135	G	87.8	Confident	87.6	Confident	16 Å²	16	45.1 Å²	45.1	17%	0.165	24%	0.243	C	C	.	.	H	α-helix	trans	-60.2	-34.1	173.1	0	0	0	0	0	113.9	K1131 S1132 E1138 I1139	K1131-G1135 PolarHBondContact O-N 3.34Å; S1132-G1135 PolarHBondContact O-N 2.96Å; G1135-E1138 PolarHBondContact O-N 3.46Å; G1135-I1139 VanDerWaalsContact O-CG1 3.3Å; G1135-I1139 WeakPolarHBondContact O-CG1 3.44Å; G1135-I1139 PolarHBondContact O-N 3.01Å
1136	A	90.4	Very high	87.9	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.008	22%	0.224	C	C	.	.	H	α-helix	trans	-68.5	-34.3	172.7	0	0	0	0	0	112.7	T1116 S1132 L1133 I1134 M1140 L1202	T1116-A1136 HydrophobicContact CG2-CB 3.87Å; S1132-A1136 PolarHBondContact O-N 2.86Å; L1133-A1136 PolarHBondContact O-N 2.86Å; I1134-A1136 VanDerWaalsContact C-N 3.29Å; I1134-A1136 PolarHBondContact O-N 2.89Å; A1136-M1140 VanDerWaalsContact O-CB 3.27Å; A1136-M1140 WeakPolarHBondContact O-CB 3.44Å; A1136-M1140 PolarHBondContact O-N 2.93Å; A1136-L1202 HydrophobicContact CB-CD1 4.13Å; A1136-L1202 HydrophobicContact CB-CD2 3.68Å
1137	I	89.8	Confident	88.6	Confident	4 Å²	4	39.3 Å²	39.3	2%	0.021	20%	0.202	C	C	.	.	H	α-helix	trans	-69.8	-38.5	171.5	-70.5	-177.6	0	0	0	111.2	L1133 I1134 M1140 S1141 L1202 L1203 V1206 Y1228 L1258	L1133-I1137 PolarHBondContact O-N 2.97Å; I1134-I1137 CarbonylContact O-C 3.58Å; I1134-I1137 WeakPolarHBondContact O-CA 3.31Å; I1134-I1137 WeakPolarHBondContact O-CB 3.41Å; I1134-I1137 PolarHBondContact O-N 3.41Å; I1137-M1140 PolarHBondContact O-N 2.92Å; I1137-S1141 PolarHBondContact O-N 3.35Å; I1137-L1202 HydrophobicContact CG1-CB 4.2Å; I1137-L1203 HydrophobicContact CD1-CD2 4.16Å; I1137-V1206 HydrophobicContact CD1-CB 4.02Å; I1137-V1206 HydrophobicContact CD1-CG1 4.29Å; I1137-V1206 HydrophobicContact CD1-CG2 3.62Å; I1137-V1206 HydrophobicContact CG1-CG2 4.44Å; I1137-Y1228 HydrophobicContact CD1-CE1 4.41Å; I1137-Y1228 HydrophobicContact CG2-CE1 4.17Å; I1137-L1258 HydrophobicContact CG2-CD1 4.36Å
1138	E	90	Very high	89.1	Confident	117 Å²	117	37.9 Å²	37.9	55%	0.547	19%	0.189	S	C	.	.	H	α-helix	trans	-58.4	-51.9	173.5	-70.3	166.1	180	0	0	110.4	I1134 G1135 M1140 S1141 E1142	I1134-E1138 WeakPolarHBondContact O-CG 3.43Å; I1134-E1138 PolarHBondContact O-N 3.49Å; G1135-E1138 PolarHBondContact O-N 3.46Å; E1138-M1140 VanDerWaalsContact C-N 3.33Å; E1138-M1140 PolarHBondContact O-N 3.31Å; E1138-S1141 WeakPolarHBondContact O-CB 3.49Å; E1138-S1141 PolarHBondContact O-N 3.03Å; E1138-S1141 VanDerWaalsContact O-N 3.07Å; E1138-S1141 PolarHBondContact O-OG 2.91Å; E1138-E1142 PolarHBondContact O-N 2.87Å
1139	I	90.7	Very high	89.4	Confident	14 Å²	14	38.1 Å²	38.1	7%	0.072	19%	0.185	C	C	.	.	H	α-helix	trans	-63.3	-37.7	176.1	-60.8	162	0	0	0	111.4	L1109 R1112 V1113 G1135 S1141 E1142	L1109-I1139 HydrophobicContact CD2-CG2 4.09Å; R1112-I1139 HydrophobicContact CB-CG2 4.26Å; R1112-I1139 HydrophobicContact CG-CD1 4.22Å; R1112-I1139 HydrophobicContact CG-CG2 4.22Å; V1113-I1139 HydrophobicContact CG2-CB 4.16Å; V1113-I1139 HydrophobicContact CG2-CG2 3.82Å; G1135-I1139 VanDerWaalsContact O-CG1 3.3Å; G1135-I1139 WeakPolarHBondContact O-CG1 3.44Å; G1135-I1139 PolarHBondContact O-N 3.01Å; I1139-S1141 VanDerWaalsContact C-N 3.28Å; I1139-S1141 PolarHBondContact O-N 3.24Å; I1139-E1142 WeakPolarHBondContact O-CB 3.27Å; I1139-E1142 PolarHBondContact O-N 2.92Å; I1139-E1142 VanDerWaalsContact O-N 3.15Å
1140	M	92.2	Very high	89.7	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-62.5	-36	174.6	-170.9	64	82.1	0	0	111.4	L1110 V1113 A1136 I1137 E1138 E1142 T1143 F1195 F1199 L1202 L1255	L1110-M1140 HydrophobicContact CD2-CE 4.2Å; L1110-M1140 HydrophobicContact CD2-SD 4.19Å; V1113-M1140 HydrophobicContact CB-CE 4.43Å; V1113-M1140 HydrophobicContact CG1-CE 3.92Å; V1113-M1140 HydrophobicContact CG2-CB 4.27Å; V1113-M1140 HydrophobicContact CG2-CE 4.09Å; V1113-M1140 HydrophobicContact CG2-SD 4.46Å; A1136-M1140 VanDerWaalsContact O-CB 3.27Å; A1136-M1140 WeakPolarHBondContact O-CB 3.44Å; A1136-M1140 PolarHBondContact O-N 2.93Å; I1137-M1140 PolarHBondContact O-N 2.92Å; E1138-M1140 VanDerWaalsContact C-N 3.33Å; E1138-M1140 PolarHBondContact O-N 3.31Å; M1140-E1142 VanDerWaalsContact C-N 3.28Å; M1140-E1142 PolarHBondContact O-N 3.41Å; M1140-T1143 WeakPolarHBondContact O-CB 3.47Å; M1140-T1143 WeakPolarHBondContact O-CG2 3.39Å; M1140-T1143 PolarHBondContact O-N 2.9Å; M1140-T1143 PolarHBondContact O-OG1 2.87Å; M1140-T1143 HydrophobicContact SD-CG2 4.13Å; M1140-F1195 HydrophobicContact CG-CE2 4.17Å; M1140-F1195 HydrophobicContact SD-CD2 3.56Å; M1140-F1195 VanDerWaalsContact SD-CD2 3.56Å; M1140-F1195 HydrophobicContact SD-CE2 3.47Å; M1140-F1195 WeakPolarHBondContact SD-CE2 3.5Å; M1140-F1199 HydrophobicContact CE-CB 4.25Å; M1140-F1199 HydrophobicContact CG-CD2 3.68Å; M1140-F1199 HydrophobicContact CG-CE2 4.18Å; M1140-F1199 HydrophobicContact CG-CG 4.34Å; M1140-L1202 HydrophobicContact CB-CD1 4.31Å; M1140-L1202 HydrophobicContact CE-CD1 3.82Å; M1140-L1255 HydrophobicContact CG-CD2 4.35Å
1141	S	90.6	Very high	90	Very high	21 Å²	21	35.7 Å²	35.7	15%	0.147	17%	0.174	C	C	.	.	H	α-helix	trans	-65.3	-29.3	175.2	79.6	0	0	0	0	113.1	I1137 E1138 I1139 T1143 R1144	I1137-S1141 PolarHBondContact O-N 3.35Å; E1138-S1141 WeakPolarHBondContact O-CB 3.49Å; E1138-S1141 PolarHBondContact O-N 3.03Å; E1138-S1141 VanDerWaalsContact O-N 3.07Å; E1138-S1141 PolarHBondContact O-OG 2.91Å; I1139-S1141 VanDerWaalsContact C-N 3.28Å; I1139-S1141 PolarHBondContact O-N 3.24Å; S1141-T1143 PolarHBondContact O-N 3.33Å; S1141-R1144 VanDerWaalsContact O-CB 3.26Å; S1141-R1144 WeakPolarHBondContact O-CB 3.45Å; S1141-R1144 PolarHBondContact O-N 2.94Å
1142	E	90.3	Very high	90.1	Very high	60 Å²	60	33 Å²	33	28%	0.28	16%	0.162	S	C	.	.	H	α-helix	trans	-60.6	-28.2	174.4	-62	173.9	-176.3	0	0	112.1	L1109 R1112 E1138 I1139 M1140 R1144 H1145	L1109-E1142 HydrophobicContact CD1-CB 4.22Å; L1109-E1142 HydrophobicContact CD2-CB 3.91Å; L1109-E1142 WeakPolarHBondContact CD2-OE2 3.26Å; R1112-E1142 IonicContact NH1-OE1 3.35Å; R1112-E1142 IonicContact NH1-OE2 3.75Å; R1112-E1142 PolarHBondContact NH1-OE2 3.49Å; E1138-E1142 PolarHBondContact O-N 2.87Å; I1139-E1142 WeakPolarHBondContact O-CB 3.27Å; I1139-E1142 PolarHBondContact O-N 2.92Å; I1139-E1142 VanDerWaalsContact O-N 3.15Å; M1140-E1142 VanDerWaalsContact C-N 3.28Å; M1140-E1142 PolarHBondContact O-N 3.41Å; E1142-R1144 PolarHBondContact O-N 2.87Å; E1142-H1145 PolarHBondContact O-N 3.04Å; E1142-H1145 VanDerWaalsContact O-N 3.14Å; E1142-H1145 PolarHBondContact O-ND1 2.97Å
1143	T	92.9	Very high	90	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-18.8	178.6	67.2	0	0	0	0	113.7	L1106 L1109 M1140 S1141 H1145 A1146 F1147 L1255	L1106-T1143 HydrophobicContact CD1-CG2 3.96Å; L1109-T1143 HydrophobicContact CB-CG2 3.76Å; L1109-T1143 HydrophobicContact CD1-CG2 4.05Å; M1140-T1143 WeakPolarHBondContact O-CB 3.47Å; M1140-T1143 WeakPolarHBondContact O-CG2 3.39Å; M1140-T1143 PolarHBondContact O-N 2.9Å; M1140-T1143 PolarHBondContact O-OG1 2.87Å; M1140-T1143 HydrophobicContact SD-CG2 4.13Å; S1141-T1143 PolarHBondContact O-N 3.33Å; T1143-H1145 PolarHBondContact O-N 3.24Å; T1143-A1146 WeakPolarHBondContact O-CB 3.36Å; T1143-A1146 PolarHBondContact O-N 3.33Å; T1143-F1147 WeakPolarHBondContact O-CD2 3.49Å; T1143-F1147 PolarHBondContact O-N 2.84Å; T1143-L1255 WeakPolarHBondContact OG1-CD1 3.4Å
1144	R	92	Very high	90	Very high	47 Å²	47	34.4 Å²	34.4	18%	0.177	17%	0.166	C	C	.	.	H	α-helix	trans	-51.3	-39	172.7	-179.8	177.3	160.5	-78.3	3.7	111.9	S1141 E1142 F1147 Q1148 I1252 L1255	S1141-R1144 VanDerWaalsContact O-CB 3.26Å; S1141-R1144 WeakPolarHBondContact O-CB 3.45Å; S1141-R1144 PolarHBondContact O-N 2.94Å; E1142-R1144 PolarHBondContact O-N 2.87Å; R1144-F1147 PolarHBondContact O-N 3.34Å; R1144-Q1148 HydrophobicContact CG-CG 4.41Å; R1144-Q1148 VanDerWaalsContact O-CG 3.26Å; R1144-Q1148 WeakPolarHBondContact O-CG 3.33Å; R1144-Q1148 PolarHBondContact O-N 3.29Å; R1144-I1252 HydrophobicContact CG-CG2 4.3Å; R1144-L1255 HydrophobicContact CB-CB 4.01Å; R1144-L1255 HydrophobicContact CB-CD1 4.1Å; R1144-L1255 HydrophobicContact CG-CB 4.46Å
1145	H	89.6	Confident	90	Very high	83 Å²	83	35.9 Å²	35.9	38%	0.384	17%	0.174	S	C	.	.	H	α-helix	trans	-64.5	-41.5	179.5	-59.3	92.7	0	0	0	112	L1096 L1105 E1142 T1143 Q1148 L1149	L1096-H1145 HydrophobicContact CD2-CB 3.82Å; L1105-H1145 HydrophobicContact CD2-CB 4.5Å; E1142-H1145 PolarHBondContact O-N 3.04Å; E1142-H1145 VanDerWaalsContact O-N 3.14Å; E1142-H1145 PolarHBondContact O-ND1 2.97Å; T1143-H1145 PolarHBondContact O-N 3.24Å; H1145-Q1148 PolarHBondContact O-N 2.61Å; H1145-L1149 PolarHBondContact O-N 3.05Å
1146	A	91.1	Very high	89.8	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-64.9	-44.8	175.2	0	0	0	0	0	111.1	L1105 L1106 T1143 Q1148 L1149 I1150	L1105-A1146 HydrophobicContact CB-CB 4.26Å; L1105-A1146 HydrophobicContact CD2-CB 3.93Å; L1105-A1146 HydrophobicContact CG-CB 4.01Å; L1106-A1146 HydrophobicContact CB-CB 3.81Å; T1143-A1146 WeakPolarHBondContact O-CB 3.36Å; T1143-A1146 PolarHBondContact O-N 3.33Å; A1146-Q1148 VanDerWaalsContact C-N 3.3Å; A1146-Q1148 PolarHBondContact O-N 3.2Å; A1146-L1149 PolarHBondContact O-N 3.47Å; A1146-I1150 WeakPolarHBondContact O-CG1 3.47Å; A1146-I1150 PolarHBondContact O-N 2.97Å
1147	F	93.2	Very high	89.2	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-63	-33.3	176.1	-75.2	-61.4	0	0	0	113.4	L1106 T1143 R1144 I1150 Q1151 I1192 F1195 V1248 Y1251 I1252 L1255	L1106-F1147 HydrophobicContact CD1-CE2 3.92Å; L1106-F1147 HydrophobicContact CD1-CZ 4.01Å; L1106-F1147 HydrophobicContact CD2-CE1 3.98Å; L1106-F1147 HydrophobicContact CD2-CZ 3.95Å; T1143-F1147 WeakPolarHBondContact O-CD2 3.49Å; T1143-F1147 PolarHBondContact O-N 2.84Å; R1144-F1147 PolarHBondContact O-N 3.34Å; F1147-I1150 HydrophobicContact CD1-CD1 4.23Å; F1147-I1150 PolarHBondContact O-N 3.44Å; F1147-Q1151 WeakPolarHBondContact O-CB 3.44Å; F1147-Q1151 PolarHBondContact O-N 3Å; F1147-I1192 HydrophobicContact CE1-CD1 4.42Å; F1147-I1192 HydrophobicContact CE1-CG1 3.93Å; F1147-I1192 HydrophobicContact CZ-CG1 4.39Å; F1147-F1195 HydrophobicContact CE2-CD1 4.21Å; F1147-F1195 AromaticContact CE2-CD2 3.83Å; F1147-F1195 HydrophobicContact CE2-CD2 3.83Å; F1147-F1195 HydrophobicContact CE2-CE1 4.1Å; F1147-F1195 AromaticContact CE2-CE2 3.71Å; F1147-F1195 HydrophobicContact CE2-CE2 3.71Å; F1147-F1195 HydrophobicContact CE2-CG 4.09Å; F1147-F1195 AromaticContact CE2-CZ 3.86Å; F1147-F1195 HydrophobicContact CE2-CZ 3.86Å; F1147-F1195 HydrophobicContact CZ-CB 4.44Å; F1147-F1195 AromaticContact CZ-CD1 3.94Å; F1147-F1195 HydrophobicContact CZ-CD1 3.94Å; F1147-F1195 HydrophobicContact CZ-CD2 4.1Å; F1147-F1195 HydrophobicContact CZ-CE1 4.21Å; F1147-F1195 HydrophobicContact CZ-CE2 4.35Å; F1147-F1195 AromaticContact CZ-CG 3.9Å; F1147-F1195 HydrophobicContact CZ-CG 3.9Å; F1147-F1195 HydrophobicContact CZ-CZ 4.41Å; F1147-V1248 HydrophobicContact CB-CG1 4.17Å; F1147-V1248 HydrophobicContact CD1-CG1 4.15Å; F1147-V1248 HydrophobicContact CD1-CG2 4.27Å; F1147-V1248 WeakPolarHBondContact O-CG1 3.37Å; F1147-Y1251 HydrophobicContact CD1-CD2 4.33Å; F1147-Y1251 AromaticContact CE1-CD2 3.89Å; F1147-Y1251 HydrophobicContact CE1-CD2 3.89Å; F1147-Y1251 HydrophobicContact CZ-CD2 4.04Å; F1147-I1252 HydrophobicContact CB-CD1 4.21Å; F1147-I1252 HydrophobicContact CB-CG1 3.7Å; F1147-L1255 HydrophobicContact CD2-CD1 3.87Å; F1147-L1255 HydrophobicContact CE2-CD1 4.25Å
1148	Q	91.4	Very high	88.5	Confident	69 Å²	69	45.4 Å²	45.4	32%	0.322	21%	0.214	S	C	.	.	H	α-helix	trans	-67.3	-36.6	174.4	-74.6	178.6	-61.5	0	0	112.8	R1144 H1145 A1146 K1152 I1252	R1144-Q1148 HydrophobicContact CG-CG 4.41Å; R1144-Q1148 VanDerWaalsContact O-CG 3.26Å; R1144-Q1148 WeakPolarHBondContact O-CG 3.33Å; R1144-Q1148 PolarHBondContact O-N 3.29Å; H1145-Q1148 PolarHBondContact O-N 2.61Å; A1146-Q1148 VanDerWaalsContact C-N 3.3Å; A1146-Q1148 PolarHBondContact O-N 3.2Å; Q1148-K1152 PolarHBondContact O-N 2.94Å; Q1148-K1152 VanDerWaalsContact O-N 3.15Å; Q1148-I1252 HydrophobicContact CG-CD1 4Å; Q1148-I1252 HydrophobicContact CG-CG1 4.23Å; Q1148-I1252 HydrophobicContact CG-CG2 4.2Å
1149	L	89.5	Confident	87.6	Confident	42 Å²	42	46.9 Å²	46.9	22%	0.22	22%	0.221	C	C	.	.	H	α-helix	trans	-68.5	-46	172.8	-67.9	172	0	0	0	111	P1102 H1145 A1146 Q1151 K1152 E1153	P1102-L1149 HydrophobicContact CB-CB 3.81Å; P1102-L1149 HydrophobicContact CB-CD1 4.49Å; H1145-L1149 PolarHBondContact O-N 3.05Å; A1146-L1149 PolarHBondContact O-N 3.47Å; L1149-Q1151 VanDerWaalsContact C-N 3.3Å; L1149-Q1151 PolarHBondContact O-N 3.43Å; L1149-K1152 WeakPolarHBondContact O-CB 3.22Å; L1149-K1152 PolarHBondContact O-N 3.37Å; L1149-E1153 PolarHBondContact O-N 3.24Å
1150	I	90.3	Very high	86.5	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-55.7	-44.2	173	-67.3	171.4	0	0	0	111.2	P1102 L1106 A1146 F1147 K1152 E1153 L1154 L1183 V1188 V1248	P1102-I1150 HydrophobicContact CB-CG1 3.77Å; P1102-I1150 HydrophobicContact CG-CG1 4.21Å; L1106-I1150 HydrophobicContact CD2-CD1 4.07Å; A1146-I1150 WeakPolarHBondContact O-CG1 3.47Å; A1146-I1150 PolarHBondContact O-N 2.97Å; F1147-I1150 HydrophobicContact CD1-CD1 4.23Å; F1147-I1150 PolarHBondContact O-N 3.44Å; I1150-K1152 VanDerWaalsContact C-N 3.3Å; I1150-K1152 PolarHBondContact O-N 3.48Å; I1150-E1153 PolarHBondContact O-N 3.22Å; I1150-L1154 HydrophobicContact CG2-CD1 3.72Å; I1150-L1154 HydrophobicContact CG2-CG 4.25Å; I1150-L1154 WeakPolarHBondContact O-CB 3.32Å; I1150-L1154 WeakPolarHBondContact O-CG 3.44Å; I1150-L1154 PolarHBondContact O-N 2.89Å; I1150-L1183 HydrophobicContact CG1-CD1 4.44Å; I1150-L1183 HydrophobicContact CG2-CD2 4.04Å; I1150-V1188 HydrophobicContact CD1-CG1 4.42Å; I1150-V1188 HydrophobicContact CD1-CG2 4.31Å; I1150-V1188 HydrophobicContact CG2-CG1 4.19Å; I1150-V1248 HydrophobicContact CG2-CG1 4.35Å; I1150-V1248 HydrophobicContact CG2-CG2 4.03Å
1151	Q	90.8	Very high	84.8	Confident	46 Å²	46	61.3 Å²	61.3	22%	0.215	29%	0.288	C	S	.	.	H	α-helix	trans	-61.1	-40.8	177.8	-169.9	-170	8.2	0	0	111.4	F1147 L1149 L1155 L1245 V1248 E1249 I1252	F1147-Q1151 WeakPolarHBondContact O-CB 3.44Å; F1147-Q1151 PolarHBondContact O-N 3Å; L1149-Q1151 VanDerWaalsContact C-N 3.3Å; L1149-Q1151 PolarHBondContact O-N 3.43Å; Q1151-L1155 HydrophobicContact CG-CD1 4.23Å; Q1151-L1155 WeakPolarHBondContact O-CD1 3.15Å; Q1151-L1155 VanDerWaalsContact O-CG 3.27Å; Q1151-L1155 WeakPolarHBondContact O-CG 3.34Å; Q1151-L1155 PolarHBondContact O-N 3.07Å; Q1151-L1245 HydrophobicContact CG-CD1 3.81Å; Q1151-V1248 HydrophobicContact CB-CG1 3.92Å; Q1151-E1249 VanDerWaalsContact NE2-CG 3.32Å; Q1151-E1249 PolarHBondContact NE2-OE1 2.93Å; Q1151-I1252 HydrophobicContact CB-CD1 4.01Å; Q1151-I1252 HydrophobicContact CG-CD1 4.43Å
1152	K	87.9	Confident	83.1	Confident	109 Å²	109	65.8 Å²	65.8	47%	0.474	32%	0.315	S	S	.	.	H	α-helix	trans	-65.5	-49.7	179.5	-176.1	-178.1	169.1	-74.8	0	111.2	Q1148 L1149 I1150 L1154 L1155 E1156	Q1148-K1152 PolarHBondContact O-N 2.94Å; Q1148-K1152 VanDerWaalsContact O-N 3.15Å; L1149-K1152 WeakPolarHBondContact O-CB 3.22Å; L1149-K1152 PolarHBondContact O-N 3.37Å; I1150-K1152 VanDerWaalsContact C-N 3.3Å; I1150-K1152 PolarHBondContact O-N 3.48Å; K1152-L1154 VanDerWaalsContact C-N 3.35Å; K1152-L1154 PolarHBondContact O-N 3.15Å; K1152-L1155 PolarHBondContact O-N 3.49Å; K1152-L1155 VanDerWaalsContact O-N 3.11Å; K1152-E1156 VanDerWaalsContact CE-OE1 3.23Å; K1152-E1156 WeakPolarHBondContact CE-OE1 3.37Å; K1152-E1156 IonicContact NZ-OE1 3.79Å; K1152-E1156 PolarHBondContact NZ-OE1 2.85Å; K1152-E1156 IonicContact NZ-OE2 2.66Å; K1152-E1156 PolarHBondContact NZ-OE2 3.4Å; K1152-E1156 WeakPolarHBondContact O-CG 3.35Å; K1152-E1156 PolarHBondContact O-N 3.28Å
1153	E	86.6	Confident	80.9	Confident	42 Å²	42	70.4 Å²	70.4	20%	0.196	34%	0.337	C	S	.	.	H	α-helix	trans	-60.9	-42.1	177.8	-70	170.2	-154.8	0	0	111.5	P1102 L1149 I1150 L1155 E1156 E1157 L1183	P1102-E1153 WeakPolarHBondContact CG-OE1 3.34Å; L1149-E1153 PolarHBondContact O-N 3.24Å; I1150-E1153 PolarHBondContact O-N 3.22Å; E1153-L1155 PolarHBondContact O-N 3.13Å; E1153-E1156 PolarHBondContact O-N 3.21Å; E1153-E1157 WeakPolarHBondContact O-CG 3.27Å; E1153-E1157 PolarHBondContact O-N 3.37Å; E1153-L1183 HydrophobicContact CB-CB 4.49Å; E1153-L1183 HydrophobicContact CB-CD2 4.46Å; E1153-L1183 WeakPolarHBondContact OE2-CD1 3.18Å
1154	L	86.8	Confident	78.6	Confident	11 Å²	11	76 Å²	76	6%	0.058	37%	0.372	C	S	.	.	H	α-helix	trans	-64.9	-20.1	175.4	-74.8	173.9	0	0	0	115	I1150 K1152 Q1158 L1183 L1185 L1244 L1245 V1248	I1150-L1154 HydrophobicContact CG2-CD1 3.72Å; I1150-L1154 HydrophobicContact CG2-CG 4.25Å; I1150-L1154 WeakPolarHBondContact O-CB 3.32Å; I1150-L1154 WeakPolarHBondContact O-CG 3.44Å; I1150-L1154 PolarHBondContact O-N 2.89Å; K1152-L1154 VanDerWaalsContact C-N 3.35Å; K1152-L1154 PolarHBondContact O-N 3.15Å; L1154-Q1158 WeakPolarHBondContact O-CG 3.46Å; L1154-Q1158 PolarHBondContact O-NE2 3.31Å; L1154-Q1158 VanDerWaalsContact O-NE2 3.15Å; L1154-L1183 HydrophobicContact CD1-CD2 4.45Å; L1154-L1183 HydrophobicContact CD2-CD2 3.69Å; L1154-L1183 HydrophobicContact CG-CD2 3.66Å; L1154-L1185 HydrophobicContact CD2-CD2 3.55Å; L1154-L1244 HydrophobicContact CD1-CD2 4.16Å; L1154-L1244 HydrophobicContact CD1-CG 4.01Å; L1154-L1244 HydrophobicContact CD2-CD2 4.09Å; L1154-L1245 HydrophobicContact CB-CD1 4.11Å; L1154-L1245 HydrophobicContact CD1-CD1 4.49Å; L1154-V1248 HydrophobicContact CD1-CG2 4.31Å
1155	L	86.4	Confident	76.2	Confident	71 Å²	71	79.5 Å²	79.5	37%	0.372	41%	0.405	S	S	.	.	H	α-helix	trans	-87.1	-42.3	174.6	-74.2	167.8	0	0	0	110.6	Q1151 K1152 E1153 E1157 Q1158 E1159 L1245	Q1151-L1155 HydrophobicContact CG-CD1 4.23Å; Q1151-L1155 WeakPolarHBondContact O-CD1 3.15Å; Q1151-L1155 VanDerWaalsContact O-CG 3.27Å; Q1151-L1155 WeakPolarHBondContact O-CG 3.34Å; Q1151-L1155 PolarHBondContact O-N 3.07Å; K1152-L1155 PolarHBondContact O-N 3.49Å; K1152-L1155 VanDerWaalsContact O-N 3.11Å; E1153-L1155 PolarHBondContact O-N 3.13Å; L1155-E1157 PolarHBondContact O-N 3.04Å; L1155-Q1158 WeakPolarHBondContact O-CB 3.37Å; L1155-Q1158 PolarHBondContact O-N 3.29Å; L1155-E1159 PolarHBondContact O-N 3.01Å; L1155-L1245 HydrophobicContact CD2-CD1 4.35Å; L1155-L1245 HydrophobicContact CD2-CD2 3.77Å; L1155-L1245 HydrophobicContact CG-CD1 4.23Å; L1155-L1245 HydrophobicContact CG-CD2 4.49Å
1156	E	83.1	Confident	73.7	Confident	84 Å²	84	80.1 Å²	80.1	39%	0.393	42%	0.424	S	S	.	.	H	α-helix	trans	-60.5	-43.9	175	-69.1	173	150.3	0	0	110.8	K1152 E1153 Q1158 E1159 E1160	K1152-E1156 VanDerWaalsContact CE-OE1 3.23Å; K1152-E1156 WeakPolarHBondContact CE-OE1 3.37Å; K1152-E1156 IonicContact NZ-OE1 3.79Å; K1152-E1156 PolarHBondContact NZ-OE1 2.85Å; K1152-E1156 IonicContact NZ-OE2 2.66Å; K1152-E1156 PolarHBondContact NZ-OE2 3.4Å; K1152-E1156 WeakPolarHBondContact O-CG 3.35Å; K1152-E1156 PolarHBondContact O-N 3.28Å; E1153-E1156 PolarHBondContact O-N 3.21Å; E1156-Q1158 PolarHBondContact O-N 3.11Å; E1156-E1159 PolarHBondContact O-N 3.18Å; E1156-E1160 PolarHBondContact O-N 3.05Å; E1156-E1160 VanDerWaalsContact O-N 3.13Å
1157	E	77.4	Confident	71.2	Confident	46 Å²	46	85 Å²	85	22%	0.215	46%	0.464	C	S	.	.	H	α-helix	trans	-62.2	-22.5	173	-74.3	-178.6	177.5	0	0	114	E1153 L1155 Q1161 L1183	E1153-E1157 WeakPolarHBondContact O-CG 3.27Å; E1153-E1157 PolarHBondContact O-N 3.37Å; L1155-E1157 PolarHBondContact O-N 3.04Å; E1157-Q1161 VanDerWaalsContact O-CG 3.29Å; E1157-Q1161 WeakPolarHBondContact O-CG 3.5Å; E1157-Q1161 PolarHBondContact O-NE2 3.28Å; E1157-L1183 WeakPolarHBondContact OE1-CB 3.49Å; E1157-L1183 PolarHBondContact OE1-N 2.79Å
1158	Q	74.9	Confident	68.8	Low	92 Å²	92	94.6 Å²	94.6	43%	0.43	51%	0.509	S	S	.	.	H	α-helix	trans	-85.9	-33.7	175.7	-76.7	175.5	39.9	0	0	112.5	L1154 L1155 E1156 Q1161 T1162	L1154-Q1158 WeakPolarHBondContact O-CG 3.46Å; L1154-Q1158 PolarHBondContact O-NE2 3.31Å; L1154-Q1158 VanDerWaalsContact O-NE2 3.15Å; L1155-Q1158 WeakPolarHBondContact O-CB 3.37Å; L1155-Q1158 PolarHBondContact O-N 3.29Å; E1156-Q1158 PolarHBondContact O-N 3.11Å; Q1158-Q1161 PolarHBondContact O-N 2.93Å; Q1158-T1162 PolarHBondContact O-N 3.45Å; Q1158-T1162 PolarHBondContact O-OG1 2.88Å
1159	E	71.9	Confident	66	Low	147 Å²	147	97.2 Å²	97.2	69%	0.687	54%	0.535	S	S	*	.	H	α-helix	trans	-65.8	-44.2	174.5	-70.5	-178	171.4	0	0	110.5	L1155 E1156 Q1161 T1162	L1155-E1159 PolarHBondContact O-N 3.01Å; E1156-E1159 PolarHBondContact O-N 3.18Å; E1159-Q1161 PolarHBondContact O-N 3.03Å; E1159-T1162 PolarHBondContact O-N 3.46Å
1160	E	66.6	Low	63.6	Low	162 Å²	162	99.7 Å²	99.7	76%	0.757	56%	0.562	S	S	*	*	H	α-helix	trans	-60.4	-28.9	175	-70.4	-173.3	167.5	0	0	113.8	E1156 T1162	E1156-E1160 PolarHBondContact O-N 3.05Å; E1156-E1160 VanDerWaalsContact O-N 3.13Å; E1160-T1162 VanDerWaalsContact C-N 3.33Å
1161	Q	58.3	Low	60.9	Low	155 Å²	155	107.2 Å²	107.2	72%	0.724	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	-5.6	177.6	-72.6	173.3	44.8	0	0	114.1	E1157 Q1158 E1159	E1157-Q1161 VanDerWaalsContact O-CG 3.29Å; E1157-Q1161 WeakPolarHBondContact O-CG 3.5Å; E1157-Q1161 PolarHBondContact O-NE2 3.28Å; Q1158-Q1161 PolarHBondContact O-N 2.93Å; E1159-Q1161 PolarHBondContact O-N 3.03Å
1162	T	53.6	Low	57.9	Low	115 Å²	115	110.5 Å²	110.5	71%	0.706	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.8	-14.1	-173.9	-51.9	0	0	0	0	113.2	Q1158 E1159 E1160	Q1158-T1162 PolarHBondContact O-N 3.45Å; Q1158-T1162 PolarHBondContact O-OG1 2.88Å; E1159-T1162 PolarHBondContact O-N 3.46Å; E1160-T1162 VanDerWaalsContact C-N 3.33Å
1163	E	43.8	Very low	55.6	Low	158 Å²	158	111 Å²	111	74%	0.738	64%	0.644	S	S	*	*	S	Bend	trans	-77	124	170.7	-80.9	-76.6	144.8	0	0	111.2	S1165	E1163-S1165 PolarHBondContact O-N 3.42Å; E1163-S1165 VanDerWaalsContact O-N 3.17Å
1164	P	44.9	Very low	52.9	Low	116 Å²	116	116.3 Å²	116.3	75%	0.753	67%	0.674	S	S	*	*			trans	-77.3	103.9	179.7	30.1	-32.9	0	0	0	111.7	A1166	P1164-A1166 PolarHBondContact O-N 3.15Å
1165	S	41.8	Very low	50.1	Low	122 Å²	122	126.7 Å²	126.7	85%	0.853	71%	0.713	S	S	*	*			trans	-54.8	127.3	178.4	60.1	0	0	0	0	113.7	E1163	E1163-S1165 PolarHBondContact O-N 3.42Å; E1163-S1165 VanDerWaalsContact O-N 3.17Å
1166	A	37.2	Very low	47.7	Very low	95 Å²	95	130.9 Å²	130.9	79%	0.785	74%	0.741	S	S	*	*			trans	-102.6	127.5	167.6	0	0	0	0	0	111.3	P1164	P1164-A1166 PolarHBondContact O-N 3.15Å
1167	A	39.5	Very low	45	Very low	103 Å²	103	129.6 Å²	129.6	85%	0.851	75%	0.75	S	S	*	*			trans	68.9	120.5	168	0	0	0	0	0	119
1168	E	42.3	Very low	42.9	Very low	201 Å²	201	133.1 Å²	133.1	94%	0.939	78%	0.775	S	S	*	*			trans	-72.1	138.7	162.1	-57.6	168.4	129.6	0	0	110.4
1169	S	31.7	Very low	40.7	Very low	125 Å²	125	134.1 Å²	134.1	87%	0.874	79%	0.792	S	S	*	*			trans	-143.5	131.8	150.3	65.2	0	0	0	0	109.9
1170	A	40.7	Very low	39.1	Very low	94 Å²	94	132.8 Å²	132.8	78%	0.777	79%	0.794	S	S	*	*			trans	-114.7	111.8	-178.2	0	0	0	0	0	109.5
1171	D	32.2	Very low	38	Very low	157 Å²	157	130.6 Å²	130.6	84%	0.84	80%	0.797	S	S	*	*			trans	173.1	113.3	132	-99.7	-23.1	0	0	0	111.1
1172	S	28.2	Very low	38	Very low	115 Å²	115	125.8 Å²	125.8	80%	0.804	79%	0.789	S	S	*	*			trans	-166.4	110.1	150.3	47	0	0	0	0	110.8
1173	P	39	Very low	39	Very low	120 Å²	120	121.1 Å²	121.1	78%	0.779	76%	0.759	S	S	*	*			trans	-100.3	73.2	177.6	37	-31.1	0	0	0	111.3
1174	D	30.8	Very low	40.7	Very low	154 Å²	154	117.5 Å²	117.5	82%	0.824	75%	0.745	S	S	*	*			trans	-165.4	74.5	161.4	-104	-28.9	0	0	0	113.7
1175	R	27.7	Very low	42.6	Very low	229 Å²	229	115.5 Å²	115.5	86%	0.864	73%	0.727	S	S	*	*			trans	-140.4	72.1	159.7	-82.6	-164.4	171.3	-172.4	-3.5	111.5	G1177	R1175-G1177 PolarHBondContact O-N 2.97Å
1176	V	37	Very low	44.6	Very low	158 Å²	158	116.1 Å²	116.1	96%	0.958	72%	0.717	S	S	*	*			trans	-79.4	69.7	162.6	-173.2	0	0	0	0	108.9
1177	G	26.1	Very low	47	Very low	58 Å²	58	113 Å²	113	60%	0.598	69%	0.686	S	S	*	*	S	Bend	trans	-140	70	-171.8	0	0	0	0	0	112.3	R1175 S1179	R1175-G1177 PolarHBondContact O-N 2.97Å; G1177-S1179 PolarHBondContact O-N 2.97Å
1178	V	32.3	Very low	49.3	Very low	120 Å²	120	108.1 Å²	108.1	73%	0.727	65%	0.646	S	S	*	*			trans	42.6	69.7	157.7	-165.7	0	0	0	0	114.8	T1180	V1178-T1180 HydrophobicContact CG1-CG2 3.45Å; V1178-T1180 VanDerWaalsContact CG1-CG2 3.45Å; V1178-T1180 PolarHBondContact O-N 2.93Å
1179	S	29.6	Very low	51.5	Low	113 Å²	113	102.7 Å²	102.7	79%	0.79	62%	0.623	S	S	*	*			trans	-70.3	103.6	152	174.5	0	0	0	0	107.9	G1177	G1177-S1179 PolarHBondContact O-N 2.97Å
1180	T	36.9	Very low	54.4	Low	118 Å²	118	101.4 Å²	101.4	72%	0.724	60%	0.601	S	S	*	*			trans	-132.4	27.8	173.5	56.4	0	0	0	0	112	V1178	V1178-T1180 HydrophobicContact CG1-CG2 3.45Å; V1178-T1180 VanDerWaalsContact CG1-CG2 3.45Å; V1178-T1180 PolarHBondContact O-N 2.93Å
1181	S	45.1	Very low	56.8	Low	117 Å²	117	97.4 Å²	97.4	82%	0.818	57%	0.567	S	S	*	*			trans	-110.6	59.2	172.5	58.2	0	0	0	0	109.7
1182	G	57.7	Low	59.6	Low	54 Å²	54	90 Å²	90	56%	0.557	53%	0.527	S	S	*	.	S	Bend	trans	-151.2	126.6	172.5	0	0	0	0	0	107.9	D1184	G1182-D1184 PolarHBondContact O-N 2.93Å
1183	L	73.8	Confident	62.5	Low	16 Å²	16	86.6 Å²	86.6	8%	0.084	51%	0.51	C	S	.	.			trans	-71.2	128.4	-174.1	175.8	67.5	0	0	0	109.4	P1102 I1150 E1153 L1154 E1157 L1185 V1188	P1102-L1183 HydrophobicContact CG-CD1 4.22Å; I1150-L1183 HydrophobicContact CG1-CD1 4.44Å; I1150-L1183 HydrophobicContact CG2-CD2 4.04Å; E1153-L1183 HydrophobicContact CB-CB 4.49Å; E1153-L1183 HydrophobicContact CB-CD2 4.46Å; E1153-L1183 WeakPolarHBondContact OE2-CD1 3.18Å; L1154-L1183 HydrophobicContact CD1-CD2 4.45Å; L1154-L1183 HydrophobicContact CD2-CD2 3.69Å; L1154-L1183 HydrophobicContact CG-CD2 3.66Å; E1157-L1183 WeakPolarHBondContact OE1-CB 3.49Å; E1157-L1183 PolarHBondContact OE1-N 2.79Å; L1183-L1185 VanDerWaalsContact C-N 3.26Å; L1183-L1185 HydrophobicContact CD2-CD2 4.02Å; L1183-L1185 HydrophobicContact CG-CD2 4.34Å; L1183-L1185 PolarHBondContact O-N 2.94Å; L1183-V1188 HydrophobicContact CD1-CG2 3.61Å; L1183-V1188 HydrophobicContact CD2-CG2 4.09Å; L1183-V1188 HydrophobicContact CG-CG2 3.84Å
1184	D	80.9	Confident	65	Low	83 Å²	83	84.6 Å²	84.6	44%	0.444	50%	0.495	S	S	.	.			trans	-71.3	84.8	173.7	-176.3	-13.2	0	0	0	110.1	G1182 Q1186 E1187 V1188	G1182-D1184 PolarHBondContact O-N 2.93Å; D1184-Q1186 PolarHBondContact O-N 3.05Å; D1184-Q1186 WeakPolarHBondContact OD1-CA 3.47Å; D1184-Q1186 WeakPolarHBondContact OD1-CB 3.34Å; D1184-Q1186 PolarHBondContact OD1-N 2.61Å; D1184-E1187 HydrophobicContact CB-CB 3.96Å; D1184-E1187 VanDerWaalsContact CG-CB 3.43Å; D1184-E1187 PolarHBondContact O-N 3.07Å; D1184-E1187 PolarHBondContact OD1-N 3.15Å; D1184-E1187 WeakPolarHBondContact OD2-CB 3.46Å; D1184-V1188 WeakPolarHBondContact O-CG2 3.44Å; D1184-V1188 PolarHBondContact O-N 2.92Å
1185	L	83.3	Confident	68	Low	74 Å²	74	77.2 Å²	77.2	39%	0.387	46%	0.456	S	S	.	.	H	α-helix	trans	-54.4	-32.6	178.1	-61.9	176.3	0	0	0	112.3	L1154 L1183 L1189 L1244	L1154-L1185 HydrophobicContact CD2-CD2 3.55Å; L1183-L1185 VanDerWaalsContact C-N 3.26Å; L1183-L1185 HydrophobicContact CD2-CD2 4.02Å; L1183-L1185 HydrophobicContact CG-CD2 4.34Å; L1183-L1185 PolarHBondContact O-N 2.94Å; L1185-L1189 WeakPolarHBondContact O-CB 3.31Å; L1185-L1189 VanDerWaalsContact O-CG 3.23Å; L1185-L1189 WeakPolarHBondContact O-CG 3.48Å; L1185-L1189 PolarHBondContact O-N 2.83Å; L1185-L1244 HydrophobicContact CD2-CD2 3.91Å
1186	Q	85.2	Confident	71	Confident	134 Å²	134	67.7 Å²	67.7	63%	0.626	42%	0.422	S	S	*	.	H	α-helix	trans	-71	-40.8	178.8	-161	-167.4	12.7	0	0	110.7	D1184 K1190	D1184-Q1186 PolarHBondContact O-N 3.05Å; D1184-Q1186 WeakPolarHBondContact OD1-CA 3.47Å; D1184-Q1186 WeakPolarHBondContact OD1-CB 3.34Å; D1184-Q1186 PolarHBondContact OD1-N 2.61Å; Q1186-K1190 WeakPolarHBondContact O-CE 3.36Å; Q1186-K1190 WeakPolarHBondContact O-CG 3.37Å; Q1186-K1190 PolarHBondContact O-N 3.15Å; Q1186-K1190 VanDerWaalsContact O-N 3.09Å
1187	E	87.6	Confident	73.5	Confident	31 Å²	31	63.9 Å²	63.9	15%	0.145	40%	0.4	C	S	.	.	H	α-helix	trans	-71.7	-39	175.2	-169.7	62.3	-168.9	0	0	112.4	R1107 D1184 L1189 K1190 L1191	R1107-E1187 IonicContact CZ-OE1 2.68Å; R1107-E1187 IonicContact NE-OE1 2.91Å; R1107-E1187 PolarHBondContact NE-OE1 3.14Å; R1107-E1187 IonicContact NH2-OE1 3.27Å; R1107-E1187 PolarHBondContact NH2-OE1 3.4Å; D1184-E1187 HydrophobicContact CB-CB 3.96Å; D1184-E1187 VanDerWaalsContact CG-CB 3.43Å; D1184-E1187 PolarHBondContact O-N 3.07Å; D1184-E1187 PolarHBondContact OD1-N 3.15Å; D1184-E1187 WeakPolarHBondContact OD2-CB 3.46Å; E1187-L1189 VanDerWaalsContact C-N 3.31Å; E1187-L1189 PolarHBondContact O-N 2.71Å; E1187-K1190 WeakPolarHBondContact O-CB 3.45Å; E1187-K1190 PolarHBondContact O-N 3.3Å; E1187-K1190 VanDerWaalsContact O-N 3.15Å; E1187-K1190 WeakPolarHBondContact OE2-CD 3.21Å; E1187-K1190 WeakPolarHBondContact OE2-CE 3.44Å; E1187-K1190 IonicContact OE2-NZ 3.47Å; E1187-K1190 PolarHBondContact OE2-NZ 3.01Å; E1187-L1191 HydrophobicContact CG-CD1 4.09Å; E1187-L1191 HydrophobicContact CG-CG 4.31Å; E1187-L1191 WeakPolarHBondContact O-CB 3.3Å; E1187-L1191 VanDerWaalsContact O-CG 3.31Å; E1187-L1191 WeakPolarHBondContact O-CG 3.46Å; E1187-L1191 PolarHBondContact O-N 3.17Å
1188	V	88.1	Confident	76.6	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-55.4	-47	171.1	172.8	0	0	0	0	110.7	C1103 I1150 L1183 D1184 K1190 L1191 I1192 L1244	C1103-V1188 VanDerWaalsContact SG-CG2 3.55Å; I1150-V1188 HydrophobicContact CD1-CG1 4.42Å; I1150-V1188 HydrophobicContact CD1-CG2 4.31Å; I1150-V1188 HydrophobicContact CG2-CG1 4.19Å; L1183-V1188 HydrophobicContact CD1-CG2 3.61Å; L1183-V1188 HydrophobicContact CD2-CG2 4.09Å; L1183-V1188 HydrophobicContact CG-CG2 3.84Å; D1184-V1188 WeakPolarHBondContact O-CG2 3.44Å; D1184-V1188 PolarHBondContact O-N 2.92Å; V1188-K1190 PolarHBondContact O-N 3.39Å; V1188-L1191 PolarHBondContact O-N 2.86Å; V1188-I1192 HydrophobicContact CG1-CD1 3.72Å; V1188-I1192 HydrophobicContact CG1-CG1 4.43Å; V1188-I1192 WeakPolarHBondContact O-CB 3.37Å; V1188-I1192 VanDerWaalsContact O-CG1 3.31Å; V1188-I1192 WeakPolarHBondContact O-CG1 3.44Å; V1188-I1192 PolarHBondContact O-N 2.82Å; V1188-L1244 HydrophobicContact CG1-CD1 4.12Å; V1188-L1244 HydrophobicContact CG1-CD2 4.26Å
1189	L	88.5	Confident	79.5	Confident	87 Å²	87	57 Å²	57	46%	0.455	35%	0.348	S	S	.	.	H	α-helix	trans	-63.5	-38.7	177.2	-74	169.9	0	0	0	112.7	L1185 E1187 G1193 L1244	L1185-L1189 WeakPolarHBondContact O-CB 3.31Å; L1185-L1189 VanDerWaalsContact O-CG 3.23Å; L1185-L1189 WeakPolarHBondContact O-CG 3.48Å; L1185-L1189 PolarHBondContact O-N 2.83Å; E1187-L1189 VanDerWaalsContact C-N 3.31Å; E1187-L1189 PolarHBondContact O-N 2.71Å; L1189-G1193 PolarHBondContact O-N 3.45Å; L1189-L1244 HydrophobicContact CD2-CD1 4.05Å
1190	K	91.3	Very high	82.4	Confident	98 Å²	98	52.9 Å²	52.9	43%	0.426	32%	0.319	S	S	.	.	H	α-helix	trans	-63.2	-46.9	173.1	-74.4	174.8	-121.6	148	0	111.5	Q1186 E1187 V1188 G1193 V1194	Q1186-K1190 WeakPolarHBondContact O-CE 3.36Å; Q1186-K1190 WeakPolarHBondContact O-CG 3.37Å; Q1186-K1190 PolarHBondContact O-N 3.15Å; Q1186-K1190 VanDerWaalsContact O-N 3.09Å; E1187-K1190 WeakPolarHBondContact O-CB 3.45Å; E1187-K1190 PolarHBondContact O-N 3.3Å; E1187-K1190 VanDerWaalsContact O-N 3.15Å; E1187-K1190 WeakPolarHBondContact OE2-CD 3.21Å; E1187-K1190 WeakPolarHBondContact OE2-CE 3.44Å; E1187-K1190 IonicContact OE2-NZ 3.47Å; E1187-K1190 PolarHBondContact OE2-NZ 3.01Å; V1188-K1190 PolarHBondContact O-N 3.39Å; K1190-G1193 CarbonylContact O-C 3.56Å; K1190-G1193 WeakPolarHBondContact O-CA 3.46Å; K1190-G1193 PolarHBondContact O-N 2.88Å; K1190-G1193 VanDerWaalsContact O-N 3.13Å; K1190-V1194 PolarHBondContact O-N 3.04Å; K1190-V1194 VanDerWaalsContact O-N 3.1Å
1191	L	92.1	Very high	85	Confident	10 Å²	10	51.3 Å²	51.3	5%	0.052	30%	0.303	C	S	.	.	H	α-helix	trans	-66	-39.4	-179.7	-68.2	172.5	0	0	0	111.7	C1103 L1106 R1107 L1110 E1187 V1188 G1193 V1194 F1195	C1103-L1191 HydrophobicContact CB-CD1 4.08Å; C1103-L1191 WeakPolarHBondContact O-CD1 3.41Å; L1106-L1191 HydrophobicContact CB-CD1 4.33Å; L1106-L1191 HydrophobicContact CD2-CB 3.75Å; L1106-L1191 HydrophobicContact CD2-CD1 4.17Å; L1106-L1191 HydrophobicContact CG-CB 4.24Å; L1106-L1191 HydrophobicContact CG-CD1 4.35Å; R1107-L1191 HydrophobicContact CB-CD1 4.46Å; R1107-L1191 HydrophobicContact CB-CD2 3.82Å; R1107-L1191 HydrophobicContact CG-CD2 4.08Å; L1110-L1191 HydrophobicContact CD1-CB 4.42Å; L1110-L1191 HydrophobicContact CD1-CD2 4.25Å; E1187-L1191 HydrophobicContact CG-CD1 4.09Å; E1187-L1191 HydrophobicContact CG-CG 4.31Å; E1187-L1191 WeakPolarHBondContact O-CB 3.3Å; E1187-L1191 VanDerWaalsContact O-CG 3.31Å; E1187-L1191 WeakPolarHBondContact O-CG 3.46Å; E1187-L1191 PolarHBondContact O-N 3.17Å; V1188-L1191 PolarHBondContact O-N 2.86Å; L1191-G1193 VanDerWaalsContact C-N 3.32Å; L1191-G1193 PolarHBondContact O-N 2.67Å; L1191-V1194 PolarHBondContact O-N 3.12Å; L1191-V1194 VanDerWaalsContact O-N 3.13Å; L1191-F1195 WeakPolarHBondContact O-CB 3.4Å; L1191-F1195 PolarHBondContact O-N 3.13Å
1192	I	89.9	Confident	87.1	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-61.3	-41.6	170.3	-70.8	168.2	0	0	0	110.8	F1147 V1188 V1194 F1195 E1196 L1244 V1248 Y1251	F1147-I1192 HydrophobicContact CE1-CD1 4.42Å; F1147-I1192 HydrophobicContact CE1-CG1 3.93Å; F1147-I1192 HydrophobicContact CZ-CG1 4.39Å; V1188-I1192 HydrophobicContact CG1-CD1 3.72Å; V1188-I1192 HydrophobicContact CG1-CG1 4.43Å; V1188-I1192 WeakPolarHBondContact O-CB 3.37Å; V1188-I1192 VanDerWaalsContact O-CG1 3.31Å; V1188-I1192 WeakPolarHBondContact O-CG1 3.44Å; V1188-I1192 PolarHBondContact O-N 2.82Å; I1192-V1194 PolarHBondContact O-N 2.86Å; I1192-F1195 PolarHBondContact O-N 2.77Å; I1192-F1195 VanDerWaalsContact O-N 3.12Å; I1192-E1196 HydrophobicContact CG2-CG 4.13Å; I1192-E1196 PolarHBondContact O-N 3.42Å; I1192-L1244 HydrophobicContact CD1-CD1 3.46Å; I1192-L1244 VanDerWaalsContact CD1-CD1 3.46Å; I1192-V1248 HydrophobicContact CD1-CG2 4.29Å; I1192-Y1251 HydrophobicContact CD1-CE2 4.17Å; I1192-Y1251 HydrophobicContact CG1-CE2 4.15Å; I1192-Y1251 HydrophobicContact CG2-CE2 3.83Å; I1192-Y1251 WeakPolarHBondContact CG2-OH 3.41Å
1193	G	89.1	Confident	88.6	Confident	44 Å²	44	43.2 Å²	43.2	45%	0.454	24%	0.237	S	C	.	.	H	α-helix	trans	-60.4	-23.3	174	0	0	0	0	0	114.6	L1189 K1190 L1191 P1197	L1189-G1193 PolarHBondContact O-N 3.45Å; K1190-G1193 CarbonylContact O-C 3.56Å; K1190-G1193 WeakPolarHBondContact O-CA 3.46Å; K1190-G1193 PolarHBondContact O-N 2.88Å; K1190-G1193 VanDerWaalsContact O-N 3.13Å; L1191-G1193 VanDerWaalsContact C-N 3.32Å; L1191-G1193 PolarHBondContact O-N 2.67Å; G1193-P1197 WeakPolarHBondContact O-CD 3.4Å; G1193-P1197 VanDerWaalsContact O-CG 3.29Å; G1193-P1197 WeakPolarHBondContact O-CG 3.32Å
1194	V	91.6	Very high	89.4	Confident	77 Å²	77	44.7 Å²	44.7	47%	0.467	25%	0.245	S	C	.	.	H	α-helix	trans	-90.5	-35.7	171.1	177	0	0	0	0	111.7	L1110 K1190 L1191 I1192 P1197 S1198	L1110-V1194 HydrophobicContact CD1-CB 4.34Å; L1110-V1194 HydrophobicContact CD1-CG1 4.26Å; K1190-V1194 PolarHBondContact O-N 3.04Å; K1190-V1194 VanDerWaalsContact O-N 3.1Å; L1191-V1194 PolarHBondContact O-N 3.12Å; L1191-V1194 VanDerWaalsContact O-N 3.13Å; I1192-V1194 PolarHBondContact O-N 2.86Å; V1194-P1197 WeakPolarHBondContact O-CD 3.19Å; V1194-S1198 WeakPolarHBondContact O-CB 3.49Å; V1194-S1198 PolarHBondContact O-N 3.48Å; V1194-S1198 PolarHBondContact O-OG 3.24Å
1195	F	93.7	Very high	89.7	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.9	-54.3	179.4	171.1	-96.8	0	0	0	112.5	L1110 M1140 F1147 L1191 I1192 S1198 F1199 Y1251 L1255	L1110-F1195 HydrophobicContact CD1-CB 4.32Å; L1110-F1195 HydrophobicContact CD2-CB 4.05Å; L1110-F1195 HydrophobicContact CD2-CD2 4.11Å; M1140-F1195 HydrophobicContact CG-CE2 4.17Å; M1140-F1195 HydrophobicContact SD-CD2 3.56Å; M1140-F1195 VanDerWaalsContact SD-CD2 3.56Å; M1140-F1195 HydrophobicContact SD-CE2 3.47Å; M1140-F1195 WeakPolarHBondContact SD-CE2 3.5Å; F1147-F1195 HydrophobicContact CE2-CD1 4.21Å; F1147-F1195 AromaticContact CE2-CD2 3.83Å; F1147-F1195 HydrophobicContact CE2-CD2 3.83Å; F1147-F1195 HydrophobicContact CE2-CE1 4.1Å; F1147-F1195 AromaticContact CE2-CE2 3.71Å; F1147-F1195 HydrophobicContact CE2-CE2 3.71Å; F1147-F1195 HydrophobicContact CE2-CG 4.09Å; F1147-F1195 AromaticContact CE2-CZ 3.86Å; F1147-F1195 HydrophobicContact CE2-CZ 3.86Å; F1147-F1195 HydrophobicContact CZ-CB 4.44Å; F1147-F1195 AromaticContact CZ-CD1 3.94Å; F1147-F1195 HydrophobicContact CZ-CD1 3.94Å; F1147-F1195 HydrophobicContact CZ-CD2 4.1Å; F1147-F1195 HydrophobicContact CZ-CE1 4.21Å; F1147-F1195 HydrophobicContact CZ-CE2 4.35Å; F1147-F1195 AromaticContact CZ-CG 3.9Å; F1147-F1195 HydrophobicContact CZ-CG 3.9Å; F1147-F1195 HydrophobicContact CZ-CZ 4.41Å; L1191-F1195 WeakPolarHBondContact O-CB 3.4Å; L1191-F1195 PolarHBondContact O-N 3.13Å; I1192-F1195 PolarHBondContact O-N 2.77Å; I1192-F1195 VanDerWaalsContact O-N 3.12Å; F1195-S1198 PolarHBondContact O-N 3.16Å; F1195-F1199 HydrophobicContact CE1-CB 4.45Å; F1195-F1199 AromaticContact CE1-CD1 3.85Å; F1195-F1199 HydrophobicContact CE1-CD1 3.85Å; F1195-F1199 HydrophobicContact CE1-CG 4.44Å; F1195-F1199 HydrophobicContact CE2-CB 4.34Å; F1195-F1199 HydrophobicContact CE2-CD1 4.38Å; F1195-F1199 HydrophobicContact CE2-CG 4.35Å; F1195-F1199 HydrophobicContact CZ-CB 4.25Å; F1195-F1199 AromaticContact CZ-CD1 3.6Å; F1195-F1199 HydrophobicContact CZ-CD1 3.6Å; F1195-F1199 HydrophobicContact CZ-CE1 4.07Å; F1195-F1199 AromaticContact CZ-CG 4Å; F1195-F1199 HydrophobicContact CZ-CG 4Å; F1195-F1199 VanDerWaalsContact O-CB 3.24Å; F1195-F1199 WeakPolarHBondContact O-CB 3.31Å; F1195-F1199 PolarHBondContact O-N 2.91Å; F1195-Y1251 HydrophobicContact CD1-CD1 4.46Å; F1195-Y1251 HydrophobicContact CD1-CD2 4.49Å; F1195-Y1251 HydrophobicContact CD1-CG 4.4Å; F1195-Y1251 AromaticContact CE1-CD1 3.75Å; F1195-Y1251 HydrophobicContact CE1-CD1 3.75Å; F1195-Y1251 HydrophobicContact CE1-CD2 4.22Å; F1195-Y1251 HydrophobicContact CE1-CE1 4.31Å; F1195-Y1251 AromaticContact CE1-CG 3.72Å; F1195-Y1251 HydrophobicContact CE1-CG 3.72Å; F1195-Y1251 HydrophobicContact CZ-CG 4.49Å; F1195-L1255 HydrophobicContact CE2-CD1 4.26Å; F1195-L1255 HydrophobicContact CE2-CD2 4.25Å; F1195-L1255 HydrophobicContact CZ-CD1 4.01Å; F1195-L1255 HydrophobicContact CZ-CD2 4.11Å; F1195-L1255 HydrophobicContact CZ-CG 4.3Å
1196	E	90.6	Very high	89.9	Confident	29 Å²	29	39.8 Å²	39.8	14%	0.136	22%	0.217	C	C	.	.	H	α-helix	trans	-56.8	-48.1	-174.1	-62.5	-179	161.7	0	0	113.3	I1192 S1200 R1247 Y1251	I1192-E1196 HydrophobicContact CG2-CG 4.13Å; I1192-E1196 PolarHBondContact O-N 3.42Å; E1196-S1200 VanDerWaalsContact O-CB 3.23Å; E1196-S1200 WeakPolarHBondContact O-CB 3.48Å; E1196-S1200 PolarHBondContact O-N 2.83Å; E1196-R1247 IonicContact OE1-CZ 2.77Å; E1196-R1247 IonicContact OE1-NE 3.5Å; E1196-R1247 IonicContact OE1-NH2 2.62Å; E1196-R1247 PolarHBondContact OE1-NH2 2.92Å; E1196-R1247 IonicContact OE2-NH2 3.89Å; E1196-Y1251 HydrophobicContact CG-CE1 4.21Å; E1196-Y1251 PolarHBondContact OE1-OH 2.93Å
1197	P	90.6	Very high	90.1	Very high	78 Å²	78	34.3 Å²	34.3	51%	0.506	19%	0.192	S	C	.	.	H	α-helix	trans	-68.2	-39.2	-178.8	-19	34.8	0	0	0	111.7	G1193 V1194 F1201	G1193-P1197 WeakPolarHBondContact O-CD 3.4Å; G1193-P1197 VanDerWaalsContact O-CG 3.29Å; G1193-P1197 WeakPolarHBondContact O-CG 3.32Å; V1194-P1197 WeakPolarHBondContact O-CD 3.19Å; P1197-F1201 WeakPolarHBondContact O-CB 3.41Å; P1197-F1201 PolarHBondContact O-N 3.46Å
1198	S	91	Very high	90.1	Very high	32 Å²	32	37.6 Å²	37.6	22%	0.224	21%	0.206	C	C	.	.	H	α-helix	trans	-66.1	-45.4	179	-53.7	0	0	0	0	111.2	V1194 F1195 F1201 L1202	V1194-S1198 WeakPolarHBondContact O-CB 3.49Å; V1194-S1198 PolarHBondContact O-N 3.48Å; V1194-S1198 PolarHBondContact O-OG 3.24Å; F1195-S1198 PolarHBondContact O-N 3.16Å; S1198-F1201 PolarHBondContact O-N 3.42Å; S1198-L1202 WeakPolarHBondContact O-CG 3.4Å; S1198-L1202 PolarHBondContact O-N 3.29Å
1199	F	92.5	Very high	89.9	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.5	-44.8	179	-175	-145.8	0	0	0	112	M1140 F1195 L1203 V1231 L1235 L1254 L1255 L1258	M1140-F1199 HydrophobicContact CE-CB 4.25Å; M1140-F1199 HydrophobicContact CG-CD2 3.68Å; M1140-F1199 HydrophobicContact CG-CE2 4.18Å; M1140-F1199 HydrophobicContact CG-CG 4.34Å; F1195-F1199 HydrophobicContact CE1-CB 4.45Å; F1195-F1199 AromaticContact CE1-CD1 3.85Å; F1195-F1199 HydrophobicContact CE1-CD1 3.85Å; F1195-F1199 HydrophobicContact CE1-CG 4.44Å; F1195-F1199 HydrophobicContact CE2-CB 4.34Å; F1195-F1199 HydrophobicContact CE2-CD1 4.38Å; F1195-F1199 HydrophobicContact CE2-CG 4.35Å; F1195-F1199 HydrophobicContact CZ-CB 4.25Å; F1195-F1199 AromaticContact CZ-CD1 3.6Å; F1195-F1199 HydrophobicContact CZ-CD1 3.6Å; F1195-F1199 HydrophobicContact CZ-CE1 4.07Å; F1195-F1199 AromaticContact CZ-CG 4Å; F1195-F1199 HydrophobicContact CZ-CG 4Å; F1195-F1199 VanDerWaalsContact O-CB 3.24Å; F1195-F1199 WeakPolarHBondContact O-CB 3.31Å; F1195-F1199 PolarHBondContact O-N 2.91Å; F1199-L1203 HydrophobicContact CD2-CD1 3.99Å; F1199-L1203 HydrophobicContact CD2-CG 4.3Å; F1199-L1203 HydrophobicContact CE1-CD1 4.39Å; F1199-L1203 HydrophobicContact CE2-CD1 3.75Å; F1199-L1203 HydrophobicContact CE2-CG 4.16Å; F1199-L1203 HydrophobicContact CG-CD1 4.43Å; F1199-L1203 HydrophobicContact CZ-CD1 3.96Å; F1199-L1203 WeakPolarHBondContact O-CG 3.46Å; F1199-L1203 PolarHBondContact O-N 3.23Å; F1199-L1203 VanDerWaalsContact O-N 3.16Å; F1199-V1231 HydrophobicContact CE1-CG1 4.44Å; F1199-V1231 HydrophobicContact CZ-CG1 3.9Å; F1199-L1235 HydrophobicContact CB-CD2 4.43Å; F1199-L1235 HydrophobicContact CD1-CD1 4.06Å; F1199-L1235 HydrophobicContact CD1-CD2 3.54Å; F1199-L1235 HydrophobicContact CD1-CG 4.43Å; F1199-L1235 HydrophobicContact CE1-CD1 4.36Å; F1199-L1235 HydrophobicContact CE1-CD2 4.06Å; F1199-L1235 HydrophobicContact CG-CD2 4.1Å; F1199-L1254 HydrophobicContact CE1-CB 4.27Å; F1199-L1255 HydrophobicContact CE1-CD2 4.3Å; F1199-L1255 HydrophobicContact CE2-CD2 4.01Å; F1199-L1255 HydrophobicContact CZ-CD2 3.79Å; F1199-L1258 HydrophobicContact CE2-CD1 3.34Å; F1199-L1258 HydrophobicContact CZ-CD1 3.48Å; F1199-L1258 VanDerWaalsContact CZ-CD1 3.48Å
1200	S	90.8	Very high	89.6	Confident	28 Å²	28	36.2 Å²	36.2	20%	0.196	20%	0.198	C	C	.	.	H	α-helix	trans	-61.2	-43.2	173.4	-175.1	0	0	0	0	112.1	E1196 L1204 Y1232	E1196-S1200 VanDerWaalsContact O-CB 3.23Å; E1196-S1200 WeakPolarHBondContact O-CB 3.48Å; E1196-S1200 PolarHBondContact O-N 2.83Å; S1200-L1204 VanDerWaalsContact O-CB 3.31Å; S1200-L1204 WeakPolarHBondContact O-CB 3.24Å; S1200-L1204 PolarHBondContact O-N 3.17Å; S1200-Y1232 WeakPolarHBondContact O-CE2 3.46Å
1201	F	90.9	Very high	89.2	Confident	85 Å²	85	35.2 Å²	35.2	37%	0.373	20%	0.201	S	C	.	.	H	α-helix	trans	-62.4	-50.9	177.4	177.3	-98.3	0	0	0	112.2	E1117 P1197 S1198 L1203 L1204 Q1205	E1117-F1201 WeakPolarHBondContact OE1-CD1 3.42Å; P1197-F1201 WeakPolarHBondContact O-CB 3.41Å; P1197-F1201 PolarHBondContact O-N 3.46Å; S1198-F1201 PolarHBondContact O-N 3.42Å; F1201-L1203 PolarHBondContact O-N 3.37Å; F1201-L1204 PolarHBondContact O-N 3.41Å; F1201-Q1205 HydrophobicContact CD1-CG 4.15Å; F1201-Q1205 HydrophobicContact CD2-CG 4.21Å; F1201-Q1205 HydrophobicContact CE1-CG 3.83Å; F1201-Q1205 HydrophobicContact CE2-CG 3.91Å; F1201-Q1205 HydrophobicContact CG-CG 4.33Å; F1201-Q1205 HydrophobicContact CZ-CG 3.7Å; F1201-Q1205 WeakPolarHBondContact O-CG 3.12Å; F1201-Q1205 PolarHBondContact O-N 2.68Å
1202	L	90.3	Very high	88.5	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-56	-51.4	179	-76.3	176.3	0	0	0	112.2	V1113 E1117 L1133 A1136 I1137 M1140 S1198 L1204 Q1205 V1206	V1113-L1202 HydrophobicContact CG1-CD1 3.77Å; E1117-L1202 HydrophobicContact CG-CD2 3.92Å; E1117-L1202 WeakPolarHBondContact OE1-CD2 3.44Å; E1117-L1202 WeakPolarHBondContact OE1-CG 3.44Å; L1133-L1202 HydrophobicContact CD2-CD2 3.77Å; A1136-L1202 HydrophobicContact CB-CD1 4.13Å; A1136-L1202 HydrophobicContact CB-CD2 3.68Å; I1137-L1202 HydrophobicContact CG1-CB 4.2Å; M1140-L1202 HydrophobicContact CB-CD1 4.31Å; M1140-L1202 HydrophobicContact CE-CD1 3.82Å; S1198-L1202 WeakPolarHBondContact O-CG 3.4Å; S1198-L1202 PolarHBondContact O-N 3.29Å; L1202-L1204 VanDerWaalsContact C-N 3.34Å; L1202-L1204 PolarHBondContact O-N 3.05Å; L1202-Q1205 PolarHBondContact O-N 2.96Å; L1202-V1206 WeakPolarHBondContact O-CG2 3.39Å; L1202-V1206 PolarHBondContact O-N 3.34Å
1203	L	89.5	Confident	87.5	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-57.8	-46.9	177.9	-73.5	169.1	0	0	0	111	I1137 F1199 F1201 Q1205 V1206 I1207 Y1228 V1231 Y1232 L1235 L1258	I1137-L1203 HydrophobicContact CD1-CD2 4.16Å; F1199-L1203 HydrophobicContact CD2-CD1 3.99Å; F1199-L1203 HydrophobicContact CD2-CG 4.3Å; F1199-L1203 HydrophobicContact CE1-CD1 4.39Å; F1199-L1203 HydrophobicContact CE2-CD1 3.75Å; F1199-L1203 HydrophobicContact CE2-CG 4.16Å; F1199-L1203 HydrophobicContact CG-CD1 4.43Å; F1199-L1203 HydrophobicContact CZ-CD1 3.96Å; F1199-L1203 WeakPolarHBondContact O-CG 3.46Å; F1199-L1203 PolarHBondContact O-N 3.23Å; F1199-L1203 VanDerWaalsContact O-N 3.16Å; F1201-L1203 PolarHBondContact O-N 3.37Å; L1203-Q1205 PolarHBondContact O-N 3.18Å; L1203-V1206 PolarHBondContact O-N 3.2Å; L1203-I1207 WeakPolarHBondContact O-CB 3.29Å; L1203-I1207 WeakPolarHBondContact O-CD1 3.43Å; L1203-I1207 WeakPolarHBondContact O-CG1 3.4Å; L1203-I1207 PolarHBondContact O-N 3.26Å; L1203-Y1228 HydrophobicContact CD2-CD1 4.2Å; L1203-Y1228 HydrophobicContact CD2-CG 4.37Å; L1203-V1231 HydrophobicContact CD1-CG1 3.94Å; L1203-Y1232 HydrophobicContact CB-CD2 3.74Å; L1203-Y1232 HydrophobicContact CB-CG 4.28Å; L1203-Y1232 HydrophobicContact CD1-CD2 4.39Å; L1203-L1235 HydrophobicContact CD1-CD2 4.3Å; L1203-L1258 HydrophobicContact CD2-CD1 4.46Å; L1203-L1258 HydrophobicContact CD2-CD2 4.23Å
1204	L	90.4	Very high	86	Confident	47 Å²	47	50.6 Å²	50.6	25%	0.246	27%	0.268	C	S	.	.	H	α-helix	trans	-62.2	-41.2	178.3	-177.4	59.2	0	0	0	112.6	S1200 F1201 L1202 K1208 Y1232	S1200-L1204 VanDerWaalsContact O-CB 3.31Å; S1200-L1204 WeakPolarHBondContact O-CB 3.24Å; S1200-L1204 PolarHBondContact O-N 3.17Å; F1201-L1204 PolarHBondContact O-N 3.41Å; L1202-L1204 VanDerWaalsContact C-N 3.34Å; L1202-L1204 PolarHBondContact O-N 3.05Å; L1204-K1208 HydrophobicContact CD1-CD 4.29Å; L1204-K1208 HydrophobicContact CD1-CG 4.44Å; L1204-K1208 HydrophobicContact CG-CD 4.15Å; L1204-K1208 WeakPolarHBondContact O-CB 3.38Å; L1204-K1208 VanDerWaalsContact O-CG 3.23Å; L1204-K1208 WeakPolarHBondContact O-CG 3.3Å; L1204-K1208 PolarHBondContact O-N 3.36Å; L1204-Y1232 HydrophobicContact CB-CE2 3.83Å; L1204-Y1232 HydrophobicContact CD1-CE1 4.15Å
1205	Q	87.7	Confident	84.7	Confident	54 Å²	54	56.7 Å²	56.7	25%	0.252	28%	0.283	S	S	.	.	H	α-helix	trans	-68.9	-42.4	178.7	-65.9	-57.8	-14.6	0	0	112	L1133 F1201 L1202 L1203 K1208 L1209	L1133-Q1205 HydrophobicContact CD1-CB 4.08Å; L1133-Q1205 HydrophobicContact CD2-CB 4.09Å; F1201-Q1205 HydrophobicContact CD1-CG 4.15Å; F1201-Q1205 HydrophobicContact CD2-CG 4.21Å; F1201-Q1205 HydrophobicContact CE1-CG 3.83Å; F1201-Q1205 HydrophobicContact CE2-CG 3.91Å; F1201-Q1205 HydrophobicContact CG-CG 4.33Å; F1201-Q1205 HydrophobicContact CZ-CG 3.7Å; F1201-Q1205 WeakPolarHBondContact O-CG 3.12Å; F1201-Q1205 PolarHBondContact O-N 2.68Å; L1202-Q1205 PolarHBondContact O-N 2.96Å; L1203-Q1205 PolarHBondContact O-N 3.18Å; Q1205-K1208 PolarHBondContact O-N 2.85Å; Q1205-L1209 WeakPolarHBondContact O-CB 3.24Å; Q1205-L1209 PolarHBondContact O-N 3.44Å
1206	V	87.5	Confident	83.1	Confident	0 Å²	0	66 Å²	66	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-62.5	-47.8	175.4	171.3	0	0	0	0	111	L1130 L1133 I1137 L1202 L1203 K1208 L1209 M1210 Y1228	L1130-V1206 HydrophobicContact CD1-CG1 4.44Å; L1133-V1206 HydrophobicContact CB-CG2 3.47Å; L1133-V1206 VanDerWaalsContact CB-CG2 3.47Å; L1133-V1206 HydrophobicContact CD1-CG2 4.16Å; L1133-V1206 HydrophobicContact CD2-CG2 4.44Å; L1133-V1206 HydrophobicContact CG-CG2 4.25Å; I1137-V1206 HydrophobicContact CD1-CB 4.02Å; I1137-V1206 HydrophobicContact CD1-CG1 4.29Å; I1137-V1206 HydrophobicContact CD1-CG2 3.62Å; I1137-V1206 HydrophobicContact CG1-CG2 4.44Å; L1202-V1206 WeakPolarHBondContact O-CG2 3.39Å; L1202-V1206 PolarHBondContact O-N 3.34Å; L1203-V1206 PolarHBondContact O-N 3.2Å; V1206-K1208 VanDerWaalsContact C-N 3.3Å; V1206-K1208 PolarHBondContact O-N 2.87Å; V1206-L1209 PolarHBondContact O-N 3.47Å; V1206-M1210 HydrophobicContact CG1-CG 4.09Å; V1206-M1210 HydrophobicContact CG1-SD 3.53Å; V1206-M1210 VanDerWaalsContact CG1-SD 3.53Å; V1206-M1210 WeakPolarHBondContact O-CB 3.47Å; V1206-M1210 WeakPolarHBondContact O-CG 3.22Å; V1206-M1210 PolarHBondContact O-N 2.97Å; V1206-Y1228 HydrophobicContact CG1-CD2 3.59Å; V1206-Y1228 HydrophobicContact CG1-CE2 3.62Å
1207	I	88.8	Confident	81.8	Confident	20 Å²	20	67.4 Å²	67.4	10%	0.103	34%	0.335	C	S	.	.	H	α-helix	trans	-58.1	-43.6	177	-67.6	162.5	0	0	0	110.7	L1203 T1211 L1225 K1229 Y1232	L1203-I1207 WeakPolarHBondContact O-CB 3.29Å; L1203-I1207 WeakPolarHBondContact O-CD1 3.43Å; L1203-I1207 WeakPolarHBondContact O-CG1 3.4Å; L1203-I1207 PolarHBondContact O-N 3.26Å; I1207-T1211 HydrophobicContact CG2-CG2 4.48Å; I1207-T1211 WeakPolarHBondContact O-CB 3.41Å; I1207-T1211 VanDerWaalsContact O-CG2 3.28Å; I1207-T1211 WeakPolarHBondContact O-CG2 3.33Å; I1207-T1211 PolarHBondContact O-N 3.26Å; I1207-T1211 PolarHBondContact O-OG1 3.16Å; I1207-L1225 HydrophobicContact CB-CD1 4.36Å; I1207-L1225 HydrophobicContact CG1-CD1 4.2Å; I1207-L1225 HydrophobicContact CG2-CD1 4.25Å; I1207-K1229 HydrophobicContact CD1-CG 3.95Å; I1207-K1229 HydrophobicContact CG1-CG 4.1Å; I1207-K1229 HydrophobicContact CG2-CG 4.03Å; I1207-Y1232 HydrophobicContact CD1-CD1 4.19Å; I1207-Y1232 HydrophobicContact CD1-CG 4.06Å
1208	K	87.6	Confident	80.9	Confident	99 Å²	99	66.7 Å²	66.7	43%	0.43	33%	0.331	S	S	.	.	H	α-helix	trans	-62.9	-45.4	175.9	-77.8	170.1	178.3	171	0	112.6	L1204 Q1205 V1206 T1211 T1212	L1204-K1208 HydrophobicContact CD1-CD 4.29Å; L1204-K1208 HydrophobicContact CD1-CG 4.44Å; L1204-K1208 HydrophobicContact CG-CD 4.15Å; L1204-K1208 WeakPolarHBondContact O-CB 3.38Å; L1204-K1208 VanDerWaalsContact O-CG 3.23Å; L1204-K1208 WeakPolarHBondContact O-CG 3.3Å; L1204-K1208 PolarHBondContact O-N 3.36Å; Q1205-K1208 PolarHBondContact O-N 2.85Å; V1206-K1208 VanDerWaalsContact C-N 3.3Å; V1206-K1208 PolarHBondContact O-N 2.87Å; K1208-T1211 PolarHBondContact O-OG1 3Å; K1208-T1212 WeakPolarHBondContact O-CB 3.27Å; K1208-T1212 WeakPolarHBondContact O-CG2 3.41Å; K1208-T1212 PolarHBondContact O-N 3.43Å; K1208-T1212 VanDerWaalsContact O-N 3.08Å; K1208-T1212 PolarHBondContact O-OG1 3.42Å
1209	L	83.8	Confident	79.9	Confident	29 Å²	29	71.1 Å²	71.1	15%	0.152	35%	0.352	C	S	.	.	H	α-helix	trans	-70.4	-40.9	-178.6	-113.2	138.4	0	0	0	112.2	S1126 K1129 L1130 L1133 Q1205 V1206 T1212 T1213	S1126-L1209 WeakPolarHBondContact O-CD2 3.46Å; K1129-L1209 HydrophobicContact CB-CD1 4.35Å; L1130-L1209 HydrophobicContact CB-CD2 4.34Å; L1130-L1209 HydrophobicContact CD1-CB 4.47Å; L1133-L1209 HydrophobicContact CD1-CD1 3.74Å; Q1205-L1209 WeakPolarHBondContact O-CB 3.24Å; Q1205-L1209 PolarHBondContact O-N 3.44Å; V1206-L1209 PolarHBondContact O-N 3.47Å; L1209-T1212 PolarHBondContact O-OG1 3.41Å; L1209-T1213 WeakPolarHBondContact O-CB 3.47Å; L1209-T1213 PolarHBondContact O-N 2.9Å; L1209-T1213 PolarHBondContact O-OG1 3.15Å
1210	M	82.1	Confident	79	Confident	29 Å²	29	78.7 Å²	78.7	14%	0.143	39%	0.386	C	S	.	.	H	α-helix	trans	-65.9	-39.7	175.8	-68.2	-179.5	83.8	0	0	112	L1130 V1206 D1221 L1225 Y1228	L1130-M1210 HydrophobicContact CD1-CG 3.69Å; L1130-M1210 HydrophobicContact CD2-CG 4.38Å; V1206-M1210 HydrophobicContact CG1-CG 4.09Å; V1206-M1210 HydrophobicContact CG1-SD 3.53Å; V1206-M1210 VanDerWaalsContact CG1-SD 3.53Å; V1206-M1210 WeakPolarHBondContact O-CB 3.47Å; V1206-M1210 WeakPolarHBondContact O-CG 3.22Å; V1206-M1210 PolarHBondContact O-N 2.97Å; M1210-D1221 HydrophobicContact CE-CB 4.16Å; M1210-D1221 VanDerWaalsContact CE-O 3.27Å; M1210-D1221 WeakPolarHBondContact CE-O 3.38Å; M1210-L1225 HydrophobicContact CB-CD1 3.95Å; M1210-L1225 HydrophobicContact CB-CD2 4.28Å; M1210-L1225 HydrophobicContact CE-CB 4.06Å; M1210-L1225 HydrophobicContact SD-CB 4.41Å; M1210-L1225 HydrophobicContact SD-CD1 4.22Å; M1210-Y1228 HydrophobicContact SD-CD2 4.04Å; M1210-Y1228 HydrophobicContact SD-CE2 4.07Å
1211	T	82.8	Confident	78.2	Confident	77 Å²	77	80.4 Å²	80.4	47%	0.472	39%	0.392	S	S	.	.	H	α-helix	trans	-75.5	-24.1	179	51.7	0	0	0	0	114.6	I1207 K1208 L1225	I1207-T1211 HydrophobicContact CG2-CG2 4.48Å; I1207-T1211 WeakPolarHBondContact O-CB 3.41Å; I1207-T1211 VanDerWaalsContact O-CG2 3.28Å; I1207-T1211 WeakPolarHBondContact O-CG2 3.33Å; I1207-T1211 PolarHBondContact O-N 3.26Å; I1207-T1211 PolarHBondContact O-OG1 3.16Å; K1208-T1211 PolarHBondContact O-OG1 3Å; T1211-L1225 HydrophobicContact CG2-CD1 4.33Å; T1211-L1225 HydrophobicContact CG2-CD2 3.95Å
1212	T	76.9	Confident	77.7	Confident	103 Å²	103	80.8 Å²	80.8	63%	0.632	40%	0.395	S	S	*	.	H	α-helix	trans	-94.1	-9.2	178.7	53.9	0	0	0	0	114	K1208 L1209 K1214	K1208-T1212 WeakPolarHBondContact O-CB 3.27Å; K1208-T1212 WeakPolarHBondContact O-CG2 3.41Å; K1208-T1212 PolarHBondContact O-N 3.43Å; K1208-T1212 VanDerWaalsContact O-N 3.08Å; K1208-T1212 PolarHBondContact O-OG1 3.42Å; L1209-T1212 PolarHBondContact O-OG1 3.41Å; T1212-K1214 PolarHBondContact O-N 3.31Å
1213	T	69.3	Low	77.2	Confident	53 Å²	53	84.4 Å²	84.4	33%	0.325	42%	0.415	S	S	.	.			trans	-74.8	117	-179.7	-68.7	0	0	0	0	111.1	L1209 R1215	L1209-T1213 WeakPolarHBondContact O-CB 3.47Å; L1209-T1213 PolarHBondContact O-N 2.9Å; L1209-T1213 PolarHBondContact O-OG1 3.15Å; T1213-R1215 HydrophobicContact CG2-CB 3.95Å; T1213-R1215 PolarHBondContact O-N 3.15Å
1214	K	57.8	Low	76.8	Confident	223 Å²	223	87.7 Å²	87.7	97%	0.97	43%	0.431	S	S	*	.			trans	-70.1	17.4	-176.9	-60.2	-175	178.6	-178.5	0	115.6	T1212	T1212-K1214 PolarHBondContact O-N 3.31Å
1215	R	64.5	Low	76.5	Confident	205 Å²	205	86.7 Å²	86.7	77%	0.774	43%	0.425	S	S	*	.	S	Bend	trans	-98.9	140.4	-178.8	-166	179	-172.6	-176.1	1.7	108.8	T1213 P1217	T1213-R1215 HydrophobicContact CG2-CB 3.95Å; T1213-R1215 PolarHBondContact O-N 3.15Å; R1215-P1217 VanDerWaalsContact O-CD 3.3Å; R1215-P1217 WeakPolarHBondContact O-CD 3.44Å; R1215-P1217 VanDerWaalsContact O-N 3.17Å
1216	K	60.7	Low	76.5	Confident	195 Å²	195	89.4 Å²	89.4	85%	0.848	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-61.3	116	171.8	-166.1	175.7	-175.9	-178.7	0	108.3
1217	P	62.9	Low	76.5	Confident	59 Å²	59	93.6 Å²	93.6	38%	0.383	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-68	154.1	-178	28.7	-35.1	0	0	0	110.8	R1215 D1221 E1222	R1215-P1217 VanDerWaalsContact O-CD 3.3Å; R1215-P1217 WeakPolarHBondContact O-CD 3.44Å; R1215-P1217 VanDerWaalsContact O-N 3.17Å; P1217-D1221 HydrophobicContact CB-CB 3.96Å; P1217-E1222 HydrophobicContact CB-CG 3.88Å; P1217-E1222 HydrophobicContact CG-CG 3.55Å; P1217-E1222 WeakPolarHBondContact CG-OE1 3.42Å
1218	S	71.1	Confident	76.5	Confident	62 Å²	62	93.3 Å²	93.3	43%	0.434	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-70.1	154.4	163.3	-175	0	0	0	0	109.7	K1220 D1221 E1222	S1218-K1220 PolarHBondContact O-N 3.05Å; S1218-K1220 VanDerWaalsContact O-N 3.15Å; S1218-D1221 WeakPolarHBondContact CB-OD2 3.31Å; S1218-D1221 PolarHBondContact N-OD2 3.22Å; S1218-D1221 WeakPolarHBondContact O-CA 3.42Å; S1218-D1221 WeakPolarHBondContact O-CB 3.2Å; S1218-D1221 PolarHBondContact O-N 3.47Å; S1218-E1222 PolarHBondContact O-N 2.98Å
1219	N	70.8	Confident	76.5	Confident	125 Å²	125	93.2 Å²	93.2	67%	0.668	46%	0.456	S	S	*	.	H	α-helix	trans	-52.4	-38.5	171.4	-70.6	16.4	0	0	0	111.1	D1221 E1222 D1223	N1219-D1221 VanDerWaalsContact C-N 3.33Å; N1219-D1221 PolarHBondContact O-N 2.89Å; N1219-E1222 PolarHBondContact O-N 3.37Å; N1219-D1223 PolarHBondContact O-N 2.79Å
1220	K	73.3	Confident	76.8	Confident	160 Å²	160	94.4 Å²	94.4	70%	0.696	47%	0.47	S	S	*	.	H	α-helix	trans	-61.8	-37.2	174.6	-65.9	-167.1	173.7	-165	0	113.3	S1218 M1224	S1218-K1220 PolarHBondContact O-N 3.05Å; S1218-K1220 VanDerWaalsContact O-N 3.15Å; K1220-M1224 WeakPolarHBondContact O-CB 3.47Å; K1220-M1224 WeakPolarHBondContact O-CG 3.39Å; K1220-M1224 PolarHBondContact O-N 3.37Å
1221	D	74.3	Confident	77.1	Confident	63 Å²	63	93 Å²	93	34%	0.337	46%	0.464	S	S	.	.	H	α-helix	trans	-72.7	-35.4	178.7	-52.3	-34.3	0	0	0	110.9	M1210 P1217 S1218 N1219 L1225	M1210-D1221 HydrophobicContact CE-CB 4.16Å; M1210-D1221 VanDerWaalsContact CE-O 3.27Å; M1210-D1221 WeakPolarHBondContact CE-O 3.38Å; P1217-D1221 HydrophobicContact CB-CB 3.96Å; S1218-D1221 WeakPolarHBondContact CB-OD2 3.31Å; S1218-D1221 PolarHBondContact N-OD2 3.22Å; S1218-D1221 WeakPolarHBondContact O-CA 3.42Å; S1218-D1221 WeakPolarHBondContact O-CB 3.2Å; S1218-D1221 PolarHBondContact O-N 3.47Å; N1219-D1221 VanDerWaalsContact C-N 3.33Å; N1219-D1221 PolarHBondContact O-N 2.89Å; D1221-L1225 WeakPolarHBondContact O-CB 3.38Å; D1221-L1225 PolarHBondContact O-N 3.31Å
1222	E	78.9	Confident	77.5	Confident	93 Å²	93	91.4 Å²	91.4	44%	0.435	45%	0.449	S	S	.	.	H	α-helix	trans	-67.3	-40.4	173.7	-67.2	-162.9	167.1	0	0	112.2	P1217 S1218 N1219 L1225 K1226	P1217-E1222 HydrophobicContact CB-CG 3.88Å; P1217-E1222 HydrophobicContact CG-CG 3.55Å; P1217-E1222 WeakPolarHBondContact CG-OE1 3.42Å; S1218-E1222 PolarHBondContact O-N 2.98Å; N1219-E1222 PolarHBondContact O-N 3.37Å; E1222-L1225 PolarHBondContact O-N 2.92Å; E1222-K1226 VanDerWaalsContact O-CG 3.31Å; E1222-K1226 WeakPolarHBondContact O-CG 3.29Å; E1222-K1226 PolarHBondContact O-N 2.95Å
1223	D	80.7	Confident	78.1	Confident	76 Å²	76	88.6 Å²	88.6	41%	0.406	43%	0.433	S	S	.	.	H	α-helix	trans	-70.9	-42.6	178.4	-67	-29.5	0	0	0	111.7	N1219 L1225 K1226 N1227	N1219-D1223 PolarHBondContact O-N 2.79Å; D1223-L1225 VanDerWaalsContact C-N 3.29Å; D1223-L1225 PolarHBondContact O-N 3.25Å; D1223-K1226 WeakPolarHBondContact O-CB 3.16Å; D1223-K1226 PolarHBondContact O-N 3.41Å; D1223-K1226 VanDerWaalsContact O-N 3.15Å; D1223-K1226 IonicContact OD1-NZ 2.62Å; D1223-K1226 PolarHBondContact OD1-NZ 2.99Å; D1223-N1227 PolarHBondContact O-N 3.38Å; D1223-N1227 PolarHBondContact O-OD1 2.97Å
1224	M	81.7	Confident	79	Confident	69 Å²	69	89.7 Å²	89.7	34%	0.34	43%	0.434	S	S	.	.	H	α-helix	trans	-58	-41.4	169.3	-73.5	-170.7	-62.3	0	0	111.9	K1220 K1226 N1227 Y1228	K1220-M1224 WeakPolarHBondContact O-CB 3.47Å; K1220-M1224 WeakPolarHBondContact O-CG 3.39Å; K1220-M1224 PolarHBondContact O-N 3.37Å; M1224-K1226 VanDerWaalsContact C-N 3.34Å; M1224-K1226 PolarHBondContact O-N 2.87Å; M1224-N1227 PolarHBondContact O-N 3.07Å; M1224-Y1228 HydrophobicContact CB-CE2 4.24Å; M1224-Y1228 WeakPolarHBondContact O-CD2 3.38Å; M1224-Y1228 PolarHBondContact O-N 2.84Å
1225	L	84.3	Confident	80.4	Confident	26 Å²	26	79.6 Å²	79.6	14%	0.136	39%	0.39	C	S	.	.	H	α-helix	trans	-66.7	-31.9	177.2	-178.4	59.6	0	0	0	113.1	I1207 M1210 T1211 D1221 E1222 D1223 K1229	I1207-L1225 HydrophobicContact CB-CD1 4.36Å; I1207-L1225 HydrophobicContact CG1-CD1 4.2Å; I1207-L1225 HydrophobicContact CG2-CD1 4.25Å; M1210-L1225 HydrophobicContact CB-CD1 3.95Å; M1210-L1225 HydrophobicContact CB-CD2 4.28Å; M1210-L1225 HydrophobicContact CE-CB 4.06Å; M1210-L1225 HydrophobicContact SD-CB 4.41Å; M1210-L1225 HydrophobicContact SD-CD1 4.22Å; T1211-L1225 HydrophobicContact CG2-CD1 4.33Å; T1211-L1225 HydrophobicContact CG2-CD2 3.95Å; D1221-L1225 WeakPolarHBondContact O-CB 3.38Å; D1221-L1225 PolarHBondContact O-N 3.31Å; E1222-L1225 PolarHBondContact O-N 2.92Å; D1223-L1225 VanDerWaalsContact C-N 3.29Å; D1223-L1225 PolarHBondContact O-N 3.25Å; L1225-K1229 WeakPolarHBondContact O-CB 3.42Å; L1225-K1229 VanDerWaalsContact O-CG 3.24Å; L1225-K1229 WeakPolarHBondContact O-CG 3.19Å; L1225-K1229 PolarHBondContact O-N 3.44Å
1226	K	85.8	Confident	81.4	Confident	112 Å²	112	74.9 Å²	74.9	49%	0.487	38%	0.38	S	S	.	.	H	α-helix	trans	-66.3	-47.5	170.9	-69.5	163.7	-157.1	160	0	110.2	E1222 D1223 M1224 K1229 A1230	E1222-K1226 VanDerWaalsContact O-CG 3.31Å; E1222-K1226 WeakPolarHBondContact O-CG 3.29Å; E1222-K1226 PolarHBondContact O-N 2.95Å; D1223-K1226 WeakPolarHBondContact O-CB 3.16Å; D1223-K1226 PolarHBondContact O-N 3.41Å; D1223-K1226 VanDerWaalsContact O-N 3.15Å; D1223-K1226 IonicContact OD1-NZ 2.62Å; D1223-K1226 PolarHBondContact OD1-NZ 2.99Å; M1224-K1226 VanDerWaalsContact C-N 3.34Å; M1224-K1226 PolarHBondContact O-N 2.87Å; K1226-K1229 PolarHBondContact O-N 2.66Å; K1226-A1230 PolarHBondContact O-N 3.1Å
1227	N	87.4	Confident	82.6	Confident	87 Å²	87	75 Å²	75	47%	0.465	38%	0.375	S	S	.	.	H	α-helix	trans	-62.1	-48.2	-179.5	-66.9	2.1	0	0	0	111.4	D1223 M1224 K1229 A1230 V1231	D1223-N1227 PolarHBondContact O-N 3.38Å; D1223-N1227 PolarHBondContact O-OD1 2.97Å; M1224-N1227 PolarHBondContact O-N 3.07Å; N1227-K1229 VanDerWaalsContact C-N 3.31Å; N1227-K1229 PolarHBondContact O-N 2.96Å; N1227-A1230 WeakPolarHBondContact O-CB 3.23Å; N1227-A1230 PolarHBondContact O-N 3.15Å; N1227-V1231 WeakPolarHBondContact O-CG2 3.42Å; N1227-V1231 PolarHBondContact O-N 3.36Å
1228	Y	89.3	Confident	83.6	Confident	15 Å²	15	73.5 Å²	73.5	6%	0.059	37%	0.366	C	S	.	.	H	α-helix	trans	-58.4	-40	175.8	-62.8	-23.1	0	0	0	112.5	I1137 L1203 V1206 M1210 M1224 Y1232 L1258	I1137-Y1228 HydrophobicContact CD1-CE1 4.41Å; I1137-Y1228 HydrophobicContact CG2-CE1 4.17Å; L1203-Y1228 HydrophobicContact CD2-CD1 4.2Å; L1203-Y1228 HydrophobicContact CD2-CG 4.37Å; V1206-Y1228 HydrophobicContact CG1-CD2 3.59Å; V1206-Y1228 HydrophobicContact CG1-CE2 3.62Å; M1210-Y1228 HydrophobicContact SD-CD2 4.04Å; M1210-Y1228 HydrophobicContact SD-CE2 4.07Å; M1224-Y1228 HydrophobicContact CB-CE2 4.24Å; M1224-Y1228 WeakPolarHBondContact O-CD2 3.38Å; M1224-Y1228 PolarHBondContact O-N 2.84Å; Y1228-Y1232 WeakPolarHBondContact O-CB 3.32Å; Y1228-Y1232 PolarHBondContact O-N 2.66Å; Y1228-L1258 HydrophobicContact CD1-CD2 3.47Å; Y1228-L1258 VanDerWaalsContact CD1-CD2 3.47Å; Y1228-L1258 HydrophobicContact CE1-CD2 3.75Å
1229	K	88.4	Confident	83.9	Confident	96 Å²	96	78 Å²	78	42%	0.417	38%	0.38	S	S	.	.	H	α-helix	trans	-66.8	-37	174.6	-74.8	174.3	-176.6	176.7	0	112.8	I1207 L1225 K1226 N1227 S1233	I1207-K1229 HydrophobicContact CD1-CG 3.95Å; I1207-K1229 HydrophobicContact CG1-CG 4.1Å; I1207-K1229 HydrophobicContact CG2-CG 4.03Å; L1225-K1229 WeakPolarHBondContact O-CB 3.42Å; L1225-K1229 VanDerWaalsContact O-CG 3.24Å; L1225-K1229 WeakPolarHBondContact O-CG 3.19Å; L1225-K1229 PolarHBondContact O-N 3.44Å; K1226-K1229 PolarHBondContact O-N 2.66Å; N1227-K1229 VanDerWaalsContact C-N 3.31Å; N1227-K1229 PolarHBondContact O-N 2.96Å; K1229-S1233 WeakPolarHBondContact O-CB 3.23Å; K1229-S1233 PolarHBondContact O-N 3.13Å
1230	A	88.9	Confident	84	Confident	54 Å²	54	78.7 Å²	78.7	45%	0.446	38%	0.377	S	S	.	.	H	α-helix	trans	-66.1	-51.5	177.3	0	0	0	0	0	111.1	K1226 N1227 Y1232 S1233 K1234	K1226-A1230 PolarHBondContact O-N 3.1Å; N1227-A1230 WeakPolarHBondContact O-CB 3.23Å; N1227-A1230 PolarHBondContact O-N 3.15Å; A1230-Y1232 PolarHBondContact O-N 2.88Å; A1230-S1233 PolarHBondContact O-N 3.22Å; A1230-K1234 PolarHBondContact O-N 3.09Å
1231	V	89.6	Confident	84.1	Confident	1 Å²	1	79 Å²	79	1%	0.006	39%	0.387	C	S	.	.	H	α-helix	trans	-59.2	-47.2	177	175.3	0	0	0	0	110.9	F1199 L1203 N1227 S1233 K1234 L1235 L1254 Q1257 L1258	F1199-V1231 HydrophobicContact CE1-CG1 4.44Å; F1199-V1231 HydrophobicContact CZ-CG1 3.9Å; L1203-V1231 HydrophobicContact CD1-CG1 3.94Å; N1227-V1231 WeakPolarHBondContact O-CG2 3.42Å; N1227-V1231 PolarHBondContact O-N 3.36Å; V1231-S1233 PolarHBondContact O-N 2.98Å; V1231-K1234 PolarHBondContact O-N 3.47Å; V1231-L1235 WeakPolarHBondContact O-CB 3.35Å; V1231-L1235 PolarHBondContact O-N 3.25Å; V1231-L1254 HydrophobicContact CG1-CB 4.14Å; V1231-L1254 HydrophobicContact CG1-CD2 4.02Å; V1231-Q1257 HydrophobicContact CG2-CB 3.69Å; V1231-L1258 HydrophobicContact CB-CD2 4.14Å; V1231-L1258 HydrophobicContact CG1-CD1 4.18Å; V1231-L1258 HydrophobicContact CG1-CD2 4.16Å; V1231-L1258 HydrophobicContact CG1-CG 4.2Å; V1231-L1258 HydrophobicContact CG2-CD2 3.85Å; V1231-L1258 HydrophobicContact CG2-CG 4.21Å
1232	Y	90.8	Very high	84.6	Confident	43 Å²	43	77.3 Å²	77.3	17%	0.169	38%	0.381	C	S	.	.	H	α-helix	trans	-60.8	-41.4	176.3	-177.2	-108.1	0	0	0	112.9	S1200 L1203 L1204 I1207 Y1228 A1230 K1234 L1236	S1200-Y1232 WeakPolarHBondContact O-CE2 3.46Å; L1203-Y1232 HydrophobicContact CB-CD2 3.74Å; L1203-Y1232 HydrophobicContact CB-CG 4.28Å; L1203-Y1232 HydrophobicContact CD1-CD2 4.39Å; L1204-Y1232 HydrophobicContact CB-CE2 3.83Å; L1204-Y1232 HydrophobicContact CD1-CE1 4.15Å; I1207-Y1232 HydrophobicContact CD1-CD1 4.19Å; I1207-Y1232 HydrophobicContact CD1-CG 4.06Å; Y1228-Y1232 WeakPolarHBondContact O-CB 3.32Å; Y1228-Y1232 PolarHBondContact O-N 2.66Å; A1230-Y1232 PolarHBondContact O-N 2.88Å; Y1232-K1234 VanDerWaalsContact C-N 3.34Å; Y1232-K1234 PolarHBondContact O-N 2.95Å; Y1232-L1236 HydrophobicContact CD1-CD1 3.98Å; Y1232-L1236 HydrophobicContact CE1-CD1 3.39Å; Y1232-L1236 HydrophobicContact CE1-CG 4.19Å; Y1232-L1236 HydrophobicContact CE2-CD1 4.33Å; Y1232-L1236 HydrophobicContact CE2-CG 4.31Å; Y1232-L1236 WeakPolarHBondContact O-CB 3.23Å; Y1232-L1236 WeakPolarHBondContact O-CG 3.44Å; Y1232-L1236 PolarHBondContact O-N 3.33Å
1233	S	89.6	Confident	84.9	Confident	43 Å²	43	77.1 Å²	77.1	30%	0.301	39%	0.388	S	S	.	.	H	α-helix	trans	-67.5	-32.2	176.9	-177.5	0	0	0	0	112.7	K1229 A1230 V1231 R1237	K1229-S1233 WeakPolarHBondContact O-CB 3.23Å; K1229-S1233 PolarHBondContact O-N 3.13Å; A1230-S1233 PolarHBondContact O-N 3.22Å; V1231-S1233 PolarHBondContact O-N 2.98Å; S1233-R1237 WeakPolarHBondContact O-CD 3.33Å; S1233-R1237 VanDerWaalsContact O-CG 3.25Å; S1233-R1237 WeakPolarHBondContact O-CG 3.31Å
1234	K	87.5	Confident	85.1	Confident	76 Å²	76	75.1 Å²	75.1	33%	0.33	38%	0.377	S	S	.	.	H	α-helix	trans	-76.9	-41.3	176	-173.7	169.8	164.4	164.8	0	111.4	A1230 V1231 Y1232 L1236 R1237 S1238 L1250 E1253 L1254	A1230-K1234 PolarHBondContact O-N 3.09Å; V1231-K1234 PolarHBondContact O-N 3.47Å; Y1232-K1234 VanDerWaalsContact C-N 3.34Å; Y1232-K1234 PolarHBondContact O-N 2.95Å; K1234-L1236 VanDerWaalsContact C-N 3.34Å; K1234-L1236 PolarHBondContact O-N 2.9Å; K1234-R1237 PolarHBondContact O-N 3.45Å; K1234-R1237 VanDerWaalsContact O-N 3.08Å; K1234-S1238 PolarHBondContact O-N 3.01Å; K1234-L1250 HydrophobicContact CD-CD1 4.48Å; K1234-L1250 HydrophobicContact CG-CD1 4.49Å; K1234-E1253 IonicContact NZ-OE1 3.68Å; K1234-E1253 PolarHBondContact NZ-OE1 3.2Å; K1234-E1253 IonicContact NZ-OE2 3.69Å; K1234-E1253 PolarHBondContact NZ-OE2 3.03Å; K1234-L1254 HydrophobicContact CB-CD2 3.77Å; K1234-L1254 HydrophobicContact CD-CD2 3.79Å; K1234-L1254 HydrophobicContact CG-CD2 3.78Å
1235	L	87.9	Confident	85.4	Confident	12 Å²	12	73 Å²	73	6%	0.063	37%	0.367	C	S	.	.	H	α-helix	trans	-59.9	-39.1	172.5	-174.7	67.9	0	0	0	112.5	F1199 L1203 V1231 R1237 S1238 L1254	F1199-L1235 HydrophobicContact CB-CD2 4.43Å; F1199-L1235 HydrophobicContact CD1-CD1 4.06Å; F1199-L1235 HydrophobicContact CD1-CD2 3.54Å; F1199-L1235 HydrophobicContact CD1-CG 4.43Å; F1199-L1235 HydrophobicContact CE1-CD1 4.36Å; F1199-L1235 HydrophobicContact CE1-CD2 4.06Å; F1199-L1235 HydrophobicContact CG-CD2 4.1Å; L1203-L1235 HydrophobicContact CD1-CD2 4.3Å; V1231-L1235 WeakPolarHBondContact O-CB 3.35Å; V1231-L1235 PolarHBondContact O-N 3.25Å; L1235-R1237 PolarHBondContact O-N 2.88Å; L1235-S1238 PolarHBondContact O-N 3.23Å; L1235-S1238 PolarHBondContact O-OG 3.02Å; L1235-L1254 HydrophobicContact CB-CD1 4.13Å; L1235-L1254 HydrophobicContact CD1-CD1 3.92Å
1236	L	85.9	Confident	85.5	Confident	105 Å²	105	74.5 Å²	74.5	55%	0.55	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-13.5	175.9	-77	-178.7	0	0	0	114.6	Y1232 K1234	Y1232-L1236 HydrophobicContact CD1-CD1 3.98Å; Y1232-L1236 HydrophobicContact CE1-CD1 3.39Å; Y1232-L1236 HydrophobicContact CE1-CG 4.19Å; Y1232-L1236 HydrophobicContact CE2-CD1 4.33Å; Y1232-L1236 HydrophobicContact CE2-CG 4.31Å; Y1232-L1236 WeakPolarHBondContact O-CB 3.23Å; Y1232-L1236 WeakPolarHBondContact O-CG 3.44Å; Y1232-L1236 PolarHBondContact O-N 3.33Å; K1234-L1236 VanDerWaalsContact C-N 3.34Å; K1234-L1236 PolarHBondContact O-N 2.9Å
1237	R	85.1	Confident	85.7	Confident	198 Å²	198	71 Å²	71	75%	0.747	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	2.2	-177.9	-68.4	173.5	-172.1	-173.4	1.3	113.1	S1233 K1234 L1235	S1233-R1237 WeakPolarHBondContact O-CD 3.33Å; S1233-R1237 VanDerWaalsContact O-CG 3.25Å; S1233-R1237 WeakPolarHBondContact O-CG 3.31Å; K1234-R1237 PolarHBondContact O-N 3.45Å; K1234-R1237 VanDerWaalsContact O-N 3.08Å; L1235-R1237 PolarHBondContact O-N 2.88Å
1238	S	83.3	Confident	85.9	Confident	28 Å²	28	66.9 Å²	66.9	20%	0.196	34%	0.341	C	S	.	.			trans	-69.4	134.9	177.6	62.8	0	0	0	0	111.4	K1234 L1235 K1240 L1250	K1234-S1238 PolarHBondContact O-N 3.01Å; L1235-S1238 PolarHBondContact O-N 3.23Å; L1235-S1238 PolarHBondContact O-OG 3.02Å; S1238-K1240 PolarHBondContact O-N 3.03Å; S1238-L1250 VanDerWaalsContact CB-CD2 3.48Å
1239	E	78.4	Confident	85.9	Confident	155 Å²	155	70.1 Å²	70.1	72%	0.724	36%	0.357	S	S	*	.			trans	-70.4	125.6	171.7	-66.2	-178.6	173.6	0	0	110	D1241 A1242	E1239-D1241 VanDerWaalsContact C-N 3.34Å; E1239-A1242 HydrophobicContact CB-CB 4.3Å; E1239-A1242 WeakPolarHBondContact O-CB 3.47Å
1240	K	73	Confident	86.1	Confident	141 Å²	141	67.3 Å²	67.3	61%	0.613	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-23.9	-175.9	-67.1	-167.9	170.8	-161.1	0	113.5	S1238 A1242 R1247	S1238-K1240 PolarHBondContact O-N 3.03Å; K1240-A1242 VanDerWaalsContact C-N 3.33Å; K1240-R1247 PolarHBondContact O-NH1 3.04Å
1241	D	75.9	Confident	86.2	Confident	167 Å²	167	64.8 Å²	64.8	89%	0.893	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	6.6	-178.8	-50.4	-51.1	0	0	0	112.3	E1239	E1239-D1241 VanDerWaalsContact C-N 3.34Å
1242	A	83.1	Confident	86.4	Confident	26 Å²	26	65.7 Å²	65.7	22%	0.215	33%	0.329	C	S	.	.	S	Bend	trans	-66.4	151.7	177.2	0	0	0	0	0	112.1	E1239 K1240 R1247	E1239-A1242 HydrophobicContact CB-CB 4.3Å; E1239-A1242 WeakPolarHBondContact O-CB 3.47Å; K1240-A1242 VanDerWaalsContact C-N 3.33Å; A1242-R1247 HydrophobicContact CB-CG 3.95Å; A1242-R1247 WeakPolarHBondContact O-CD 3.28Å
1243	P	85.9	Confident	86.4	Confident	89 Å²	89	67.6 Å²	67.6	58%	0.578	34%	0.34	S	S	*	.			trans	-53.6	146.1	176.6	-26.5	35.3	0	0	0	113	L1245 S1246 R1247	P1243-L1245 VanDerWaalsContact C-N 3.33Å; P1243-L1245 PolarHBondContact O-N 2.57Å; P1243-S1246 PolarHBondContact O-N 2.95Å; P1243-S1246 VanDerWaalsContact O-N 3.16Å; P1243-R1247 PolarHBondContact O-N 3.08Å
1244	L	85.9	Confident	86.5	Confident	35 Å²	35	65.6 Å²	65.6	18%	0.183	33%	0.326	C	S	.	.	H	α-helix	trans	-55.3	-45.7	-175	178.7	59.2	0	0	0	112.4	L1154 L1185 V1188 L1189 I1192 S1246 R1247 V1248	L1154-L1244 HydrophobicContact CD1-CD2 4.16Å; L1154-L1244 HydrophobicContact CD1-CG 4.01Å; L1154-L1244 HydrophobicContact CD2-CD2 4.09Å; L1185-L1244 HydrophobicContact CD2-CD2 3.91Å; V1188-L1244 HydrophobicContact CG1-CD1 4.12Å; V1188-L1244 HydrophobicContact CG1-CD2 4.26Å; L1189-L1244 HydrophobicContact CD2-CD1 4.05Å; I1192-L1244 HydrophobicContact CD1-CD1 3.46Å; I1192-L1244 VanDerWaalsContact CD1-CD1 3.46Å; L1244-S1246 PolarHBondContact O-N 3.3Å; L1244-R1247 WeakPolarHBondContact O-CB 3.32Å; L1244-R1247 PolarHBondContact O-N 2.77Å; L1244-V1248 HydrophobicContact CD1-CG2 4.25Å; L1244-V1248 WeakPolarHBondContact O-CG2 3.35Å; L1244-V1248 PolarHBondContact O-N 3.2Å
1245	L	87.1	Confident	86.7	Confident	25 Å²	25	62 Å²	62	13%	0.131	31%	0.31	C	S	.	.	H	α-helix	trans	-57.6	-49.7	177.9	-178.3	62.7	0	0	0	111.8	Q1151 L1154 L1155 P1243 R1247 V1248 E1249	Q1151-L1245 HydrophobicContact CG-CD1 3.81Å; L1154-L1245 HydrophobicContact CB-CD1 4.11Å; L1154-L1245 HydrophobicContact CD1-CD1 4.49Å; L1155-L1245 HydrophobicContact CD2-CD1 4.35Å; L1155-L1245 HydrophobicContact CD2-CD2 3.77Å; L1155-L1245 HydrophobicContact CG-CD1 4.23Å; L1155-L1245 HydrophobicContact CG-CD2 4.49Å; P1243-L1245 VanDerWaalsContact C-N 3.33Å; P1243-L1245 PolarHBondContact O-N 2.57Å; L1245-R1247 VanDerWaalsContact C-N 3.27Å; L1245-R1247 PolarHBondContact O-N 3.48Å; L1245-V1248 PolarHBondContact O-N 2.67Å; L1245-V1248 VanDerWaalsContact O-N 3.15Å; L1245-E1249 WeakPolarHBondContact O-CG 3.4Å; L1245-E1249 PolarHBondContact O-N 2.92Å
1246	S	87.1	Confident	86.7	Confident	56 Å²	56	65.9 Å²	65.9	39%	0.392	33%	0.328	S	S	.	.	H	α-helix	trans	-64.6	-29.1	178.7	-50	0	0	0	0	113.3	P1243 L1244 L1250	P1243-S1246 PolarHBondContact O-N 2.95Å; P1243-S1246 VanDerWaalsContact O-N 3.16Å; L1244-S1246 PolarHBondContact O-N 3.3Å; S1246-L1250 WeakPolarHBondContact O-CB 3.15Å; S1246-L1250 PolarHBondContact O-N 2.69Å; S1246-L1250 VanDerWaalsContact O-N 3.15Å
1247	R	89.9	Confident	86.7	Confident	39 Å²	39	64.3 Å²	64.3	15%	0.147	32%	0.318	C	S	.	.	H	α-helix	trans	-70.8	-45	172.3	-71.2	175.8	63.2	-176.2	5.5	111.5	E1196 K1240 A1242 P1243 L1244 L1245 L1250 Y1251	E1196-R1247 IonicContact OE1-CZ 2.77Å; E1196-R1247 IonicContact OE1-NE 3.5Å; E1196-R1247 IonicContact OE1-NH2 2.62Å; E1196-R1247 PolarHBondContact OE1-NH2 2.92Å; E1196-R1247 IonicContact OE2-NH2 3.89Å; K1240-R1247 PolarHBondContact O-NH1 3.04Å; A1242-R1247 HydrophobicContact CB-CG 3.95Å; A1242-R1247 WeakPolarHBondContact O-CD 3.28Å; P1243-R1247 PolarHBondContact O-N 3.08Å; L1244-R1247 WeakPolarHBondContact O-CB 3.32Å; L1244-R1247 PolarHBondContact O-N 2.77Å; L1245-R1247 VanDerWaalsContact C-N 3.27Å; L1245-R1247 PolarHBondContact O-N 3.48Å; R1247-L1250 PolarHBondContact O-N 3.19Å; R1247-Y1251 HydrophobicContact CB-CE2 3.99Å; R1247-Y1251 PolarHBondContact NE-OH 2.96Å; R1247-Y1251 PolarHBondContact NH2-OH 3.25Å; R1247-Y1251 WeakPolarHBondContact O-CD2 3.15Å; R1247-Y1251 WeakPolarHBondContact O-CE2 3.32Å; R1247-Y1251 PolarHBondContact O-N 3.26Å
1248	V	90.3	Very high	86.5	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60.1	-46	175.7	170.6	0	0	0	0	111	F1147 I1150 Q1151 L1154 I1192 L1244 L1245 L1250 Y1251 I1252	F1147-V1248 HydrophobicContact CB-CG1 4.17Å; F1147-V1248 HydrophobicContact CD1-CG1 4.15Å; F1147-V1248 HydrophobicContact CD1-CG2 4.27Å; F1147-V1248 WeakPolarHBondContact O-CG1 3.37Å; I1150-V1248 HydrophobicContact CG2-CG1 4.35Å; I1150-V1248 HydrophobicContact CG2-CG2 4.03Å; Q1151-V1248 HydrophobicContact CB-CG1 3.92Å; L1154-V1248 HydrophobicContact CD1-CG2 4.31Å; I1192-V1248 HydrophobicContact CD1-CG2 4.29Å; L1244-V1248 HydrophobicContact CD1-CG2 4.25Å; L1244-V1248 WeakPolarHBondContact O-CG2 3.35Å; L1244-V1248 PolarHBondContact O-N 3.2Å; L1245-V1248 PolarHBondContact O-N 2.67Å; L1245-V1248 VanDerWaalsContact O-N 3.15Å; V1248-L1250 PolarHBondContact O-N 3.02Å; V1248-Y1251 PolarHBondContact O-N 3.03Å; V1248-Y1251 VanDerWaalsContact O-N 3.16Å; V1248-I1252 HydrophobicContact CG1-CD1 3.98Å; V1248-I1252 WeakPolarHBondContact O-CG1 3.44Å; V1248-I1252 PolarHBondContact O-N 2.94Å
1249	E	90.9	Very high	85.9	Confident	84 Å²	84	57.3 Å²	57.3	39%	0.393	30%	0.295	S	S	.	.	H	α-helix	trans	-54.7	-47.6	173.1	-76.9	175	164.9	0	0	112.7	Q1151 L1245 Y1251 I1252 E1253	Q1151-E1249 VanDerWaalsContact NE2-CG 3.32Å; Q1151-E1249 PolarHBondContact NE2-OE1 2.93Å; L1245-E1249 WeakPolarHBondContact O-CG 3.4Å; L1245-E1249 PolarHBondContact O-N 2.92Å; E1249-Y1251 VanDerWaalsContact C-N 3.34Å; E1249-Y1251 PolarHBondContact O-N 3.15Å; E1249-I1252 PolarHBondContact O-N 3.42Å; E1249-E1253 PolarHBondContact O-N 3.22Å
1250	L	91.1	Very high	84.7	Confident	36 Å²	36	59.3 Å²	59.3	19%	0.188	32%	0.322	C	S	.	.	H	α-helix	trans	-61.4	-40.7	177.3	178.9	62.2	0	0	0	111.9	K1234 S1238 S1246 R1247 V1248 E1253 L1254	K1234-L1250 HydrophobicContact CD-CD1 4.48Å; K1234-L1250 HydrophobicContact CG-CD1 4.49Å; S1238-L1250 VanDerWaalsContact CB-CD2 3.48Å; S1246-L1250 WeakPolarHBondContact O-CB 3.15Å; S1246-L1250 PolarHBondContact O-N 2.69Å; S1246-L1250 VanDerWaalsContact O-N 3.15Å; R1247-L1250 PolarHBondContact O-N 3.19Å; V1248-L1250 PolarHBondContact O-N 3.02Å; L1250-E1253 PolarHBondContact O-N 3.48Å; L1250-L1254 HydrophobicContact CD1-CD1 4.12Å; L1250-L1254 HydrophobicContact CD1-CG 4.16Å; L1250-L1254 HydrophobicContact CG-CD1 3.96Å; L1250-L1254 HydrophobicContact CG-CG 4.41Å; L1250-L1254 WeakPolarHBondContact O-CB 3.16Å; L1250-L1254 WeakPolarHBondContact O-CG 3.38Å; L1250-L1254 PolarHBondContact O-N 2.87Å
1251	Y	92.6	Very high	85.3	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.008	31%	0.307	C	S	.	.	H	α-helix	trans	-66.1	-41.8	176.3	-51.7	-39.5	0	0	0	111.6	F1147 I1192 F1195 E1196 R1247 V1248 E1249 E1253 L1254 L1255	F1147-Y1251 HydrophobicContact CD1-CD2 4.33Å; F1147-Y1251 AromaticContact CE1-CD2 3.89Å; F1147-Y1251 HydrophobicContact CE1-CD2 3.89Å; F1147-Y1251 HydrophobicContact CZ-CD2 4.04Å; I1192-Y1251 HydrophobicContact CD1-CE2 4.17Å; I1192-Y1251 HydrophobicContact CG1-CE2 4.15Å; I1192-Y1251 HydrophobicContact CG2-CE2 3.83Å; I1192-Y1251 WeakPolarHBondContact CG2-OH 3.41Å; F1195-Y1251 HydrophobicContact CD1-CD1 4.46Å; F1195-Y1251 HydrophobicContact CD1-CD2 4.49Å; F1195-Y1251 HydrophobicContact CD1-CG 4.4Å; F1195-Y1251 AromaticContact CE1-CD1 3.75Å; F1195-Y1251 HydrophobicContact CE1-CD1 3.75Å; F1195-Y1251 HydrophobicContact CE1-CD2 4.22Å; F1195-Y1251 HydrophobicContact CE1-CE1 4.31Å; F1195-Y1251 AromaticContact CE1-CG 3.72Å; F1195-Y1251 HydrophobicContact CE1-CG 3.72Å; F1195-Y1251 HydrophobicContact CZ-CG 4.49Å; E1196-Y1251 HydrophobicContact CG-CE1 4.21Å; E1196-Y1251 PolarHBondContact OE1-OH 2.93Å; R1247-Y1251 HydrophobicContact CB-CE2 3.99Å; R1247-Y1251 PolarHBondContact NE-OH 2.96Å; R1247-Y1251 PolarHBondContact NH2-OH 3.25Å; R1247-Y1251 WeakPolarHBondContact O-CD2 3.15Å; R1247-Y1251 WeakPolarHBondContact O-CE2 3.32Å; R1247-Y1251 PolarHBondContact O-N 3.26Å; V1248-Y1251 PolarHBondContact O-N 3.03Å; V1248-Y1251 VanDerWaalsContact O-N 3.16Å; E1249-Y1251 VanDerWaalsContact C-N 3.34Å; E1249-Y1251 PolarHBondContact O-N 3.15Å; Y1251-E1253 VanDerWaalsContact C-N 3.32Å; Y1251-E1253 PolarHBondContact O-N 3.16Å; Y1251-L1254 PolarHBondContact O-N 3.29Å; Y1251-L1255 WeakPolarHBondContact O-CB 3.39Å; Y1251-L1255 WeakPolarHBondContact O-CD1 3.47Å; Y1251-L1255 WeakPolarHBondContact O-CG 3.49Å; Y1251-L1255 PolarHBondContact O-N 2.95Å
1252	I	92.4	Very high	85.8	Confident	19 Å²	19	49.4 Å²	49.4	10%	0.097	28%	0.276	C	S	.	.	H	α-helix	trans	-57.9	-45.6	175.3	-66.1	164.9	0	0	0	110.4	R1144 F1147 Q1148 Q1151 V1248 E1249 L1255 Q1256	R1144-I1252 HydrophobicContact CG-CG2 4.3Å; F1147-I1252 HydrophobicContact CB-CD1 4.21Å; F1147-I1252 HydrophobicContact CB-CG1 3.7Å; Q1148-I1252 HydrophobicContact CG-CD1 4Å; Q1148-I1252 HydrophobicContact CG-CG1 4.23Å; Q1148-I1252 HydrophobicContact CG-CG2 4.2Å; Q1151-I1252 HydrophobicContact CB-CD1 4.01Å; Q1151-I1252 HydrophobicContact CG-CD1 4.43Å; V1248-I1252 HydrophobicContact CG1-CD1 3.98Å; V1248-I1252 WeakPolarHBondContact O-CG1 3.44Å; V1248-I1252 PolarHBondContact O-N 2.94Å; E1249-I1252 PolarHBondContact O-N 3.42Å; I1252-L1255 PolarHBondContact O-N 2.62Å; I1252-Q1256 VanDerWaalsContact O-CB 3.3Å; I1252-Q1256 WeakPolarHBondContact O-CB 3.34Å; I1252-Q1256 PolarHBondContact O-N 3.37Å
1253	E	91.9	Very high	86	Confident	84 Å²	84	50.7 Å²	50.7	39%	0.393	28%	0.28	S	S	.	.	H	α-helix	trans	-64.2	-42.5	177.7	-161.7	-145.2	134.6	0	0	112.4	K1234 E1249 L1250 Y1251 Q1256 Q1257	K1234-E1253 IonicContact NZ-OE1 3.68Å; K1234-E1253 PolarHBondContact NZ-OE1 3.2Å; K1234-E1253 IonicContact NZ-OE2 3.69Å; K1234-E1253 PolarHBondContact NZ-OE2 3.03Å; E1249-E1253 PolarHBondContact O-N 3.22Å; L1250-E1253 PolarHBondContact O-N 3.48Å; Y1251-E1253 VanDerWaalsContact C-N 3.32Å; Y1251-E1253 PolarHBondContact O-N 3.16Å; E1253-Q1256 WeakPolarHBondContact O-CB 3.25Å; E1253-Q1256 PolarHBondContact O-N 2.99Å; E1253-Q1257 WeakPolarHBondContact O-CG 3.19Å; E1253-Q1257 PolarHBondContact O-N 3.43Å; E1253-Q1257 PolarHBondContact OE1-NE2 3.49Å
1254	L	91.3	Very high	86	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-67.7	-38.3	178.8	-71.4	173.6	0	0	0	112.4	F1199 V1231 K1234 L1235 L1250 Y1251 Q1257	F1199-L1254 HydrophobicContact CE1-CB 4.27Å; V1231-L1254 HydrophobicContact CG1-CB 4.14Å; V1231-L1254 HydrophobicContact CG1-CD2 4.02Å; K1234-L1254 HydrophobicContact CB-CD2 3.77Å; K1234-L1254 HydrophobicContact CD-CD2 3.79Å; K1234-L1254 HydrophobicContact CG-CD2 3.78Å; L1235-L1254 HydrophobicContact CB-CD1 4.13Å; L1235-L1254 HydrophobicContact CD1-CD1 3.92Å; L1250-L1254 HydrophobicContact CD1-CD1 4.12Å; L1250-L1254 HydrophobicContact CD1-CG 4.16Å; L1250-L1254 HydrophobicContact CG-CD1 3.96Å; L1250-L1254 HydrophobicContact CG-CG 4.41Å; L1250-L1254 WeakPolarHBondContact O-CB 3.16Å; L1250-L1254 WeakPolarHBondContact O-CG 3.38Å; L1250-L1254 PolarHBondContact O-N 2.87Å; Y1251-L1254 PolarHBondContact O-N 3.29Å; L1254-Q1257 PolarHBondContact O-N 3.49Å
1255	L	91.7	Very high	86	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-72	-36.2	176.9	-65.2	166.5	0	0	0	111.2	M1140 T1143 R1144 F1147 F1195 F1199 Y1251 I1252 Q1257 L1258 T1259	M1140-L1255 HydrophobicContact CG-CD2 4.35Å; T1143-L1255 WeakPolarHBondContact OG1-CD1 3.4Å; R1144-L1255 HydrophobicContact CB-CB 4.01Å; R1144-L1255 HydrophobicContact CB-CD1 4.1Å; R1144-L1255 HydrophobicContact CG-CB 4.46Å; F1147-L1255 HydrophobicContact CD2-CD1 3.87Å; F1147-L1255 HydrophobicContact CE2-CD1 4.25Å; F1195-L1255 HydrophobicContact CE2-CD1 4.26Å; F1195-L1255 HydrophobicContact CE2-CD2 4.25Å; F1195-L1255 HydrophobicContact CZ-CD1 4.01Å; F1195-L1255 HydrophobicContact CZ-CD2 4.11Å; F1195-L1255 HydrophobicContact CZ-CG 4.3Å; F1199-L1255 HydrophobicContact CE1-CD2 4.3Å; F1199-L1255 HydrophobicContact CE2-CD2 4.01Å; F1199-L1255 HydrophobicContact CZ-CD2 3.79Å; Y1251-L1255 WeakPolarHBondContact O-CB 3.39Å; Y1251-L1255 WeakPolarHBondContact O-CD1 3.47Å; Y1251-L1255 WeakPolarHBondContact O-CG 3.49Å; Y1251-L1255 PolarHBondContact O-N 2.95Å; I1252-L1255 PolarHBondContact O-N 2.62Å; L1255-Q1257 PolarHBondContact O-N 2.99Å; L1255-L1258 PolarHBondContact O-N 3.37Å; L1255-T1259 PolarHBondContact O-N 3.08Å
1256	Q	87.8	Confident	85.9	Confident	94 Å²	94	50.9 Å²	50.9	44%	0.439	28%	0.276	S	S	.	.	H	α-helix	trans	-56.5	-36.3	172.8	-173.3	77.1	63.9	0	0	112.4	I1252 E1253 L1258 T1259	I1252-Q1256 VanDerWaalsContact O-CB 3.3Å; I1252-Q1256 WeakPolarHBondContact O-CB 3.34Å; I1252-Q1256 PolarHBondContact O-N 3.37Å; E1253-Q1256 WeakPolarHBondContact O-CB 3.25Å; E1253-Q1256 PolarHBondContact O-N 2.99Å; Q1256-L1258 PolarHBondContact O-N 3.28Å; Q1256-T1259 PolarHBondContact O-OG1 3.46Å
1257	Q	85.9	Confident	85.8	Confident	72 Å²	72	50.5 Å²	50.5	34%	0.336	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-8.3	178.4	-68.7	173.2	31	0	0	114.2	V1231 E1253 L1254 L1255	V1231-Q1257 HydrophobicContact CG2-CB 3.69Å; E1253-Q1257 WeakPolarHBondContact O-CG 3.19Å; E1253-Q1257 PolarHBondContact O-N 3.43Å; E1253-Q1257 PolarHBondContact OE1-NE2 3.49Å; L1254-Q1257 PolarHBondContact O-N 3.49Å; L1255-Q1257 PolarHBondContact O-N 2.99Å
1258	L	81.9	Confident	85.5	Confident	20 Å²	20	51.4 Å²	51.4	11%	0.105	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-22.4	177.6	-62.7	177.6	0	0	0	113.2	I1137 F1199 L1203 Y1228 V1231 L1255 Q1256	I1137-L1258 HydrophobicContact CG2-CD1 4.36Å; F1199-L1258 HydrophobicContact CE2-CD1 3.34Å; F1199-L1258 HydrophobicContact CZ-CD1 3.48Å; F1199-L1258 VanDerWaalsContact CZ-CD1 3.48Å; L1203-L1258 HydrophobicContact CD2-CD1 4.46Å; L1203-L1258 HydrophobicContact CD2-CD2 4.23Å; Y1228-L1258 HydrophobicContact CD1-CD2 3.47Å; Y1228-L1258 VanDerWaalsContact CD1-CD2 3.47Å; Y1228-L1258 HydrophobicContact CE1-CD2 3.75Å; V1231-L1258 HydrophobicContact CB-CD2 4.14Å; V1231-L1258 HydrophobicContact CG1-CD1 4.18Å; V1231-L1258 HydrophobicContact CG1-CD2 4.16Å; V1231-L1258 HydrophobicContact CG1-CG 4.2Å; V1231-L1258 HydrophobicContact CG2-CD2 3.85Å; V1231-L1258 HydrophobicContact CG2-CG 4.21Å; L1255-L1258 PolarHBondContact O-N 3.37Å; Q1256-L1258 PolarHBondContact O-N 3.28Å
1259	T	70.1	Confident	85.1	Confident	60 Å²	60	55.7 Å²	55.7	37%	0.368	30%	0.301	S	S	.	.			trans	-66.9	132.6	166	23.2	0	0	0	0	110.9	L1255 Q1256	L1255-T1259 PolarHBondContact O-N 3.08Å; Q1256-T1259 PolarHBondContact O-OG1 3.46Å
1260	P	53.4	Low	84.6	Confident	197 Å²	197	53.1 Å²	53.1	100%	1.279	29%	0.292	S	S	*	.			trans	-78	0	-176.2	33.1	-37.3	0	0	0	114.9

Retrieved 1,260 of 1,260 residues in 1236.4 ms (Link to these results)

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