A0A087XQ06_POEFO Loading...

SNF2 related chromatin remodeling ATPase 5

AlphaFold DB (A0A3B3TNB6), UniProt , Accession A0A087XQ06, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,035 aa.

						>A0A087XQ06_POEFO|A0A087XQ06
MSESENCVEQREEPTELEEAGGAEEKSDSSDAGKESSSEGGADAQDASSSSSSKTKDSTPGYEEKVQTDRTNRFEYLLKQTELFAHFIQPAAQKTPTSPLKMKPGRPRIKKDEKQNLLSAGDNRHRRTEQEEDEELLNESTKTTNVCTRFDESPSYVKTGKMRDYQIRGLNWLISLYENGINGILADEMGLGKTLQTIALLGYMKHYRNIPGPHMVLVPKSTLYNWMNEFKRWVPSLRAVCLIGDRDQRTALIRDVLLPGEWDVCVTSYEMLIIEKAVFKKFNWRYLVIDEAHRIKNEKSKLSEIVREFKTTNRLLLTGTPLQNNLHELWALLNFLLPDVFNSSEDFDSWFDTNNCLGDQKLVERLHTVLRPFLLRRIKADVEKTLLPKKEIKIYVGLSKMQREWYTKILMKDIDILNSAGKMDKMRLLNVLMQLRKCCNHPYLFDGAEPGPPYTTDLHLVVNGGKMVVLDKLLPKMKEQGSRVLIFSQMTRMLDILEDYCMWKNYEYCRLDGQTPHEERQVSINAYNEPNSTKFIFMLSTRAGGLGINLATADVVILYDSDWNPQVDLQAMDRAHRIGQQKQVRVYRFITENTVEERIVERAEMKLRLDSIVIQQGRLVDPSANKLGKDEMLSIIRHGATHVFASKESEITDDDIDAILERGERKTMEMKEKLSSLGESSLRNFTMDTENTSVYTFEGEDYREKKKVITNWIEPPKRERKANYAVDAYFREALRVSEPKAPKAPRPPKQPNVQDFQFFPPRLFELLEKEILFYRKTIGYKVPRNPDIPNSAQVQKEEQAKIDEAEALTEEELEEKENLLQQGFTIWSKRDFNQFIKANEKWGRDDIENIAREVEGKTPEEVMEYSAVFWERCNELQDIEKIMAQIERGEARIQRRISIKKALDSKIGRYKAPFHQLRISYGTNKGKNYTEEEDRFLICMLHKLGFDKESVYDELRQCIRNSPQFRFDWFLKSRTAMELQRRCNTLITLIERENMELEEREKAEKKKRGPKSGSAQKRKAEGTPDGRGRRKKLKL
					

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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	33.5	Very low	29.1	Very low	226 Å²	226	145.5 Å²	145.5	100%	1.113	76%	0.758	S	S	*	*				0	90	0	-53.2	-170.3	-66.6	0	0	104.9
2	S	28.8	Very low	28.8	Very low	104 Å²	104	146.2 Å²	146.2	73%	0.727	75%	0.754	S	S	*	*				64.1	129.4	65	77.6	0	0	0	0	109.9
3	E	31	Very low	28.4	Very low	174 Å²	174	148.8 Å²	148.8	81%	0.813	76%	0.761	S	S	*	*			cis	-132.9	133.4	26.3	-80.4	155.1	-172.4	0	0	109.8
4	S	30.6	Very low	30	Very low	96 Å²	96	146.1 Å²	146.1	67%	0.671	76%	0.758	S	S	*	*				83	131.1	57.4	76.6	0	0	0	0	113.3
5	E	34.5	Very low	29.6	Very low	169 Å²	169	146.5 Å²	146.5	79%	0.79	77%	0.769	S	S	*	*			cis	-167.5	-174.4	-8.1	-139.3	159.4	-149.5	0	0	112.2
6	N	28.5	Very low	29.4	Very low	139 Å²	139	148.3 Å²	148.3	74%	0.743	77%	0.772	S	S	*	*			trans	76.8	124.2	174.1	-58.2	-49.2	0	0	0	117.3
7	C	27.7	Very low	29.3	Very low	110 Å²	110	148.1 Å²	148.1	74%	0.743	77%	0.772	S	S	*	*			cis	89.3	139	36.1	-63.3	0	0	0	0	113
8	V	27.3	Very low	29.1	Very low	126 Å²	126	149.4 Å²	149.4	76%	0.764	77%	0.773	S	S	*	*			cis	-151.8	167.2	0.5	105.2	0	0	0	0	113.3
9	E	27.7	Very low	29	Very low	146 Å²	146	151.3 Å²	151.3	68%	0.682	78%	0.778	S	S	*	*			trans	-47.2	-179.9	162.9	-62.7	-174.5	114.7	0	0	115.2
10	Q	25.3	Very low	28.9	Very low	125 Å²	125	149 Å²	149	58%	0.584	78%	0.783	S	S	*	*			cis	-171.8	162.4	-28.9	-100.7	-169.9	66.8	0	0	106
11	R	25.5	Very low	28.7	Very low	186 Å²	186	146 Å²	146	70%	0.702	79%	0.788	S	S	*	*			trans	75.6	135.3	144.5	-80.4	165.2	-174.9	-104.7	2.6	123.6
12	E	25.2	Very low	28.2	Very low	153 Å²	153	138.6 Å²	138.6	72%	0.715	77%	0.77	S	S	*	*			trans	88.5	154.9	133.4	-75.3	158.6	-140.6	0	0	121.3
13	E	23.4	Very low	28.1	Very low	181 Å²	181	138.1 Å²	138.1	85%	0.846	77%	0.772	S	S	*	*			trans	-110.4	-159.1	-160.2	-47.5	173.9	137.8	0	0	110.1
14	P	50.8	Low	27.8	Very low	111 Å²	111	138.1 Å²	138.1	72%	0.721	77%	0.772	S	S	*	*				-118.1	-178	-60.4	26.2	-7.7	0	0	0	111.1
15	T	24.5	Very low	27.6	Very low	151 Å²	151	139.2 Å²	139.2	93%	0.926	77%	0.767	S	S	*	*			trans	-154.7	157.5	160	-2.2	0	0	0	0	111.9
16	E	26.5	Very low	27.2	Very low	175 Å²	175	139.1 Å²	139.1	82%	0.818	76%	0.764	S	S	*	*			trans	-112.5	168.7	-173.3	-59.1	-178.7	114.8	0	0	113.3
17	L	26.9	Very low	27	Very low	145 Å²	145	137 Å²	137	76%	0.759	76%	0.759	S	S	*	*			trans	84	144.8	145.8	-79.5	160.1	0	0	0	123.3
18	E	26.6	Very low	26.9	Very low	172 Å²	172	139.3 Å²	139.3	80%	0.804	76%	0.764	S	S	*	*			trans	93.4	157	146.2	-88.2	174.5	-154.3	0	0	123.9
19	E	26.6	Very low	26.8	Very low	185 Å²	185	138.4 Å²	138.4	86%	0.864	76%	0.764	S	S	*	*			trans	63.1	128.3	-174	-53.9	-164.7	142.4	0	0	117.3
20	A	26.6	Very low	26.8	Very low	106 Å²	106	136.2 Å²	136.2	88%	0.876	77%	0.765	S	S	*	*			cis	104.4	129.2	21.2	0	0	0	0	0	114.3
21	G	26.1	Very low	26.9	Very low	85 Å²	85	138.2 Å²	138.2	88%	0.876	78%	0.78	S	S	*	*			trans	157.2	148.3	176.7	0	0	0	0	0	113.9
22	G	23.1	Very low	26.9	Very low	72 Å²	72	133.3 Å²	133.3	74%	0.742	78%	0.779	S	S	*	*			trans	-172.6	172	178	0	0	0	0	0	113
23	A	25.5	Very low	27	Very low	94 Å²	94	129.8 Å²	129.8	78%	0.777	78%	0.783	S	S	*	*			trans	67.1	151.9	-172.7	0	0	0	0	0	114.2
24	E	25.8	Very low	27.1	Very low	174 Å²	174	130.2 Å²	130.2	81%	0.813	78%	0.782	S	S	*	*			cis	-162	-174.2	-12.4	-117.3	175.7	140.6	0	0	107.6
25	E	25.7	Very low	25.9	Very low	119 Å²	119	132.4 Å²	132.4	56%	0.556	78%	0.783	S	S	*	*			cis	-161.7	168.2	11.4	-141.5	-166.3	156.4	0	0	110.8
26	K	26.3	Very low	26	Very low	167 Å²	167	131 Å²	131	73%	0.726	78%	0.78	S	S	*	*			trans	64.4	153.6	151.8	-81.3	165.4	-176.5	138.4	0	120.3
27	S	23.3	Very low	26	Very low	93 Å²	93	128 Å²	128	65%	0.65	78%	0.778	S	S	*	*			cis	-156.2	151.2	1.8	47.7	0	0	0	0	112.4
28	D	25.5	Very low	25.9	Very low	159 Å²	159	126.9 Å²	126.9	85%	0.85	78%	0.782	S	S	*	*			trans	56.7	145.1	149.5	-62	-8.8	0	0	0	120.5
29	S	26.7	Very low	26	Very low	107 Å²	107	128.2 Å²	128.2	75%	0.748	79%	0.788	S	S	*	*			cis	-166.9	-178.5	-15.1	82.6	0	0	0	0	107.2
30	S	26.9	Very low	26	Very low	101 Å²	101	123 Å²	123	71%	0.706	78%	0.783	S	S	*	*			cis	-172.8	147.9	-12	36.5	0	0	0	0	109.6
31	D	27.3	Very low	25.9	Very low	167 Å²	167	121.6 Å²	121.6	89%	0.893	78%	0.78	S	S	*	*			trans	66.4	152.9	161.2	-113.3	-0.6	0	0	0	118.9
32	A	26.6	Very low	25.9	Very low	83 Å²	83	122.4 Å²	122.4	69%	0.686	78%	0.778	S	S	*	*			cis	-154.2	137.9	-2.1	0	0	0	0	0	113.2
33	G	25.8	Very low	26	Very low	79 Å²	79	127.1 Å²	127.1	81%	0.814	79%	0.787	S	S	*	*			trans	70.9	157.3	156.4	0	0	0	0	0	119.4
34	K	26.3	Very low	26.1	Very low	189 Å²	189	126.5 Å²	126.5	82%	0.822	78%	0.781	S	S	*	*			cis	-157.1	170.2	-8.4	-140.8	-175.2	178.4	-175.5	0	111.9
35	E	25.8	Very low	26.1	Very low	158 Å²	158	127.8 Å²	127.8	74%	0.738	79%	0.787	S	S	*	*			trans	-49	158.6	176.2	-62.3	137.4	139.1	0	0	113.7
36	S	26.8	Very low	26.2	Very low	122 Å²	122	129.9 Å²	129.9	85%	0.853	80%	0.802	S	S	*	*			cis	-155.5	166	43.9	59.4	0	0	0	0	117.5
37	S	25.1	Very low	26.2	Very low	112 Å²	112	126.7 Å²	126.7	78%	0.783	81%	0.807	S	S	*	*			trans	-101.1	154	174.7	53.9	0	0	0	0	112.7
38	S	26.2	Very low	26.2	Very low	120 Å²	120	128.2 Å²	128.2	84%	0.839	82%	0.817	S	S	*	*			trans	-148.4	113.8	153.8	61.6	0	0	0	0	110.9
39	E	28.3	Very low	26.3	Very low	201 Å²	201	126.1 Å²	126.1	94%	0.939	82%	0.815	S	S	*	*			trans	-78.6	166	170.3	-61.3	178.8	115.7	0	0	111.6
40	G	25.4	Very low	26.3	Very low	74 Å²	74	127.1 Å²	127.1	76%	0.763	82%	0.822	S	S	*	*			trans	-168.3	106.6	170.6	0	0	0	0	0	112.1
41	G	24.8	Very low	26.2	Very low	78 Å²	78	127.9 Å²	127.9	80%	0.804	83%	0.828	S	S	*	*			trans	-62.3	141.6	168.5	0	0	0	0	0	111.1
42	A	26.5	Very low	26.2	Very low	101 Å²	101	125 Å²	125	84%	0.835	82%	0.82	S	S	*	*				78.4	106.2	67.6	0	0	0	0	0	112.6
43	D	25.9	Very low	26	Very low	172 Å²	172	126.8 Å²	126.8	92%	0.92	83%	0.828	S	S	*	*			trans	-156.9	164.7	145.2	-136.7	-26.7	0	0	0	110.3
44	A	26.6	Very low	26.1	Very low	80 Å²	80	132 Å²	132	66%	0.661	83%	0.828	S	S	*	*			trans	-128.9	151	-168.1	0	0	0	0	0	114.6
45	Q	27.2	Very low	26.1	Very low	201 Å²	201	129.4 Å²	129.4	94%	0.939	83%	0.829	S	S	*	*			trans	-164.2	150	154.5	-116.1	155.8	67	0	0	113.8
46	D	26.5	Very low	26.3	Very low	164 Å²	164	132 Å²	132	88%	0.877	84%	0.837	S	S	*	*			trans	-78.9	149.1	-175.5	-78.8	-67.2	0	0	0	114.9
47	A	25.7	Very low	26.7	Very low	99 Å²	99	133.4 Å²	133.4	82%	0.818	84%	0.835	S	S	*	*			trans	-154.9	84.1	158.9	0	0	0	0	0	111.8	S49	A47-S49 PolarHBondContact O-N 3.12Å
48	S	25.1	Very low	26.9	Very low	125 Å²	125	131.9 Å²	131.9	87%	0.874	83%	0.825	S	S	*	*			trans	-72.6	121.4	175.7	61.6	0	0	0	0	112
49	S	26.1	Very low	27.7	Very low	115 Å²	115	130 Å²	130	80%	0.804	81%	0.808	S	S	*	*			trans	-145.5	133.4	160.9	63.4	0	0	0	0	112.1	A47	A47-S49 PolarHBondContact O-N 3.12Å
50	S	27.1	Very low	28.3	Very low	128 Å²	128	125.6 Å²	125.6	90%	0.895	80%	0.797	S	S	*	*			trans	-77.5	127.8	-177.8	54.9	0	0	0	0	111.6
51	S	26.1	Very low	29.8	Very low	118 Å²	118	124.2 Å²	124.2	83%	0.825	78%	0.783	S	S	*	*			trans	-130.9	141.2	164.6	62.5	0	0	0	0	110.9
52	S	25.2	Very low	31.8	Very low	105 Å²	105	121.9 Å²	121.9	73%	0.734	75%	0.75	S	S	*	*			trans	-76.7	138.8	-173.3	46.5	0	0	0	0	112.1	K54	S52-K54 VanDerWaalsContact C-N 3.29Å; S52-K54 PolarHBondContact O-N 2.82Å
53	S	23.9	Very low	33.9	Very low	121 Å²	121	122.7 Å²	122.7	85%	0.846	74%	0.736	S	S	*	*			trans	-71.2	76.3	-176.6	57.8	0	0	0	0	112.5	T55	S53-T55 PolarHBondContact O-N 3.42Å
54	K	27.7	Very low	36.1	Very low	188 Å²	188	121.3 Å²	121.3	82%	0.817	72%	0.724	S	S	*	*			trans	-64.2	122.4	162.2	-77.4	-176.7	175.3	178.1	0	108.9	S52 K56	S52-K54 VanDerWaalsContact C-N 3.29Å; S52-K54 PolarHBondContact O-N 2.82Å; K54-K56 PolarHBondContact O-N 2.82Å
55	T	25.9	Very low	38.3	Very low	136 Å²	136	120.4 Å²	120.4	83%	0.834	71%	0.705	S	S	*	*			trans	-61.6	103.5	174.6	46.7	0	0	0	0	110.7	S53 D57	S53-T55 PolarHBondContact O-N 3.42Å; T55-D57 PolarHBondContact O-N 3Å
56	K	31	Very low	40.5	Very low	211 Å²	211	113.6 Å²	113.6	92%	0.917	68%	0.677	S	S	*	*			trans	-71.7	105.2	160.7	-78.8	-176.1	174.8	180	0	107.8	K54	K54-K56 PolarHBondContact O-N 2.82Å
57	D	33.5	Very low	42.7	Very low	152 Å²	152	111.1 Å²	111.1	81%	0.813	66%	0.661	S	S	*	*			trans	-146.8	60.3	172.2	-151.5	-0.4	0	0	0	112.4	T55	T55-D57 PolarHBondContact O-N 3Å
58	S	30.1	Very low	45.2	Very low	81 Å²	81	109.7 Å²	109.7	57%	0.566	64%	0.642	S	S	*	*			trans	-131.2	121.2	155.8	57	0	0	0	0	108.7	P60	S58-P60 WeakPolarHBondContact O-CD 3.46Å
59	T	42.7	Very low	47.7	Very low	79 Å²	79	104.4 Å²	104.4	49%	0.485	60%	0.604	S	S	.	*			trans	-75.8	114.9	175.1	47	0	0	0	0	109.1	G61 Y62	T59-G61 VanDerWaalsContact C-N 3.34Å; T59-G61 PolarHBondContact O-N 3.06Å; T59-Y62 WeakPolarHBondContact O-CB 3.45Å; T59-Y62 PolarHBondContact O-N 2.91Å
60	P	41.2	Very low	50.1	Low	110 Å²	110	103.7 Å²	103.7	71%	0.714	58%	0.583	S	S	*	*	H	α-helix	trans	-58.8	-40.5	-167.1	18.6	-31	0	0	0	113.5	S58 Y62 E63	S58-P60 WeakPolarHBondContact O-CD 3.46Å; P60-Y62 PolarHBondContact O-N 3.34Å; P60-E63 PolarHBondContact O-N 2.93Å
61	G	57.6	Low	52.4	Low	44 Å²	44	101.3 Å²	101.3	45%	0.454	56%	0.564	S	S	.	*	H	α-helix	trans	-67.8	0.9	177.2	0	0	0	0	0	116.1	T59	T59-G61 VanDerWaalsContact C-N 3.34Å; T59-G61 PolarHBondContact O-N 3.06Å
62	Y	66.7	Low	54.9	Low	29 Å²	29	98.1 Å²	98.1	11%	0.114	54%	0.538	C	S	.	.	H	α-helix	trans	-79.1	-45.4	167.5	-179.5	-87.1	0	0	0	111.3	T59 P60 V66 N283	T59-Y62 WeakPolarHBondContact O-CB 3.45Å; T59-Y62 PolarHBondContact O-N 2.91Å; P60-Y62 PolarHBondContact O-N 3.34Å; Y62-V66 HydrophobicContact CD1-CG2 4.23Å; Y62-V66 HydrophobicContact CE1-CG2 3.75Å; Y62-V66 WeakPolarHBondContact O-CG2 3.25Å; Y62-V66 PolarHBondContact O-N 3.3Å; Y62-V66 VanDerWaalsContact O-N 3.11Å; Y62-N283 HydrophobicContact CD2-CB 4.12Å; Y62-N283 HydrophobicContact CE2-CB 3.85Å
63	E	70.3	Confident	57.5	Low	119 Å²	119	94 Å²	94	56%	0.556	51%	0.506	S	S	*	.	H	α-helix	trans	-75.5	-40.7	-172.3	-64.8	178	175.9	0	0	111.1	P60 V66 Q67	P60-E63 PolarHBondContact O-N 2.93Å; E63-V66 PolarHBondContact O-N 2.99Å; E63-Q67 PolarHBondContact O-N 3.06Å; E63-Q67 VanDerWaalsContact O-N 3.11Å
64	E	72.5	Confident	60	Low	143 Å²	143	90.4 Å²	90.4	67%	0.668	48%	0.475	S	S	*	.	H	α-helix	trans	-55.6	-52.2	171.5	-177.7	175.9	-155.2	0	0	111.7	V66 Q67 T68	E64-V66 PolarHBondContact O-N 3.04Å; E64-Q67 WeakPolarHBondContact O-CB 3.48Å; E64-Q67 PolarHBondContact O-N 2.74Å; E64-Q67 VanDerWaalsContact O-N 3.08Å; E64-T68 PolarHBondContact O-N 3.37Å; E64-T68 PolarHBondContact O-OG1 3.45Å
65	K	71.4	Confident	62.3	Low	60 Å²	60	86.1 Å²	86.1	26%	0.261	46%	0.458	S	S	.	.	H	α-helix	trans	-61.8	-40.1	178.7	176.2	163.3	-179.8	162.6	0	112.6	Q67 T68 D69 Y177	K65-Q67 PolarHBondContact O-N 2.92Å; K65-T68 PolarHBondContact O-N 3.26Å; K65-T68 VanDerWaalsContact O-N 3.17Å; K65-D69 VanDerWaalsContact CE-OD1 3.24Å; K65-D69 WeakPolarHBondContact CE-OD1 3.26Å; K65-D69 WeakPolarHBondContact CE-OD2 3.31Å; K65-D69 WeakPolarHBondContact O-CB 3.38Å; K65-D69 VanDerWaalsContact O-CG 3.3Å; K65-D69 PolarHBondContact O-N 3.23Å; K65-Y177 PolarHBondContact NZ-OH 3.39Å
66	V	73.9	Confident	64.8	Low	58 Å²	58	81.8 Å²	81.8	35%	0.352	43%	0.427	S	S	.	.	H	α-helix	trans	-61.2	-34.3	176.5	166.4	0	0	0	0	111.4	Y62 E63 E64 R70	Y62-V66 HydrophobicContact CD1-CG2 4.23Å; Y62-V66 HydrophobicContact CE1-CG2 3.75Å; Y62-V66 WeakPolarHBondContact O-CG2 3.25Å; Y62-V66 PolarHBondContact O-N 3.3Å; Y62-V66 VanDerWaalsContact O-N 3.11Å; E63-V66 PolarHBondContact O-N 2.99Å; E64-V66 PolarHBondContact O-N 3.04Å; V66-R70 VanDerWaalsContact O-CB 3.26Å; V66-R70 WeakPolarHBondContact O-CB 3.47Å; V66-R70 PolarHBondContact O-N 3.02Å; V66-R70 VanDerWaalsContact O-N 3.1Å
67	Q	73.4	Confident	66.9	Low	112 Å²	112	71.8 Å²	71.8	52%	0.523	38%	0.383	S	S	.	.	H	α-helix	trans	-71.3	-39.4	174.2	-170.4	68.2	-1.2	0	0	112.1	E63 E64 K65 R70 T71	E63-Q67 PolarHBondContact O-N 3.06Å; E63-Q67 VanDerWaalsContact O-N 3.11Å; E64-Q67 WeakPolarHBondContact O-CB 3.48Å; E64-Q67 PolarHBondContact O-N 2.74Å; E64-Q67 VanDerWaalsContact O-N 3.08Å; K65-Q67 PolarHBondContact O-N 2.92Å; Q67-R70 PolarHBondContact O-N 3.33Å; Q67-T71 PolarHBondContact O-N 2.77Å; Q67-T71 VanDerWaalsContact O-N 3.15Å; Q67-T71 PolarHBondContact O-OG1 2.87Å
68	T	78.1	Confident	68.8	Low	69 Å²	69	68.1 Å²	68.1	42%	0.423	36%	0.363	S	S	.	.	H	α-helix	trans	-64.1	-50.2	173.4	-42	0	0	0	0	112.1	E64 K65 R70 T71 N72	E64-T68 PolarHBondContact O-N 3.37Å; E64-T68 PolarHBondContact O-OG1 3.45Å; K65-T68 PolarHBondContact O-N 3.26Å; K65-T68 VanDerWaalsContact O-N 3.17Å; T68-R70 PolarHBondContact O-N 2.64Å; T68-T71 PolarHBondContact O-N 2.92Å; T68-N72 PolarHBondContact O-N 3.04Å; T68-N72 PolarHBondContact O-OD1 3.34Å
69	D	76.3	Confident	70.8	Confident	15 Å²	15	71.4 Å²	71.4	8%	0.08	37%	0.367	C	S	.	.	H	α-helix	trans	-58.7	-33.4	178.9	-70.2	-12.7	0	0	0	110.8	K65 R73 T312	K65-D69 VanDerWaalsContact CE-OD1 3.24Å; K65-D69 WeakPolarHBondContact CE-OD1 3.26Å; K65-D69 WeakPolarHBondContact CE-OD2 3.31Å; K65-D69 WeakPolarHBondContact O-CB 3.38Å; K65-D69 VanDerWaalsContact O-CG 3.3Å; K65-D69 PolarHBondContact O-N 3.23Å; D69-R73 WeakPolarHBondContact O-CB 3.39Å; D69-R73 PolarHBondContact O-N 3.02Å; D69-R73 VanDerWaalsContact O-N 3.15Å; D69-T312 WeakPolarHBondContact OD2-CG2 3.36Å
70	R	76.6	Confident	72.1	Confident	99 Å²	99	72.1 Å²	72.1	37%	0.374	37%	0.365	S	S	.	.	H	α-helix	trans	-68.6	-42.4	174.4	-178.8	178	-175.9	-174	2.8	112.9	V66 Q67 T68 F74	V66-R70 VanDerWaalsContact O-CB 3.26Å; V66-R70 WeakPolarHBondContact O-CB 3.47Å; V66-R70 PolarHBondContact O-N 3.02Å; V66-R70 VanDerWaalsContact O-N 3.1Å; Q67-R70 PolarHBondContact O-N 3.33Å; T68-R70 PolarHBondContact O-N 2.64Å; R70-F74 HydrophobicContact CG-CD2 4.07Å; R70-F74 HydrophobicContact CG-CE2 3.53Å; R70-F74 HydrophobicContact CG-CZ 4.1Å; R70-F74 WeakPolarHBondContact O-CD2 3.2Å; R70-F74 WeakPolarHBondContact O-CG 3.42Å; R70-F74 PolarHBondContact O-N 3.28Å; R70-F74 VanDerWaalsContact O-N 3.14Å
71	T	77	Confident	73.3	Confident	78 Å²	78	68 Å²	68	48%	0.479	34%	0.338	S	S	.	.	H	α-helix	trans	-66.7	-49.4	177.8	-57.8	0	0	0	0	111.3	Q67 T68 R73 F74 E75	Q67-T71 PolarHBondContact O-N 2.77Å; Q67-T71 VanDerWaalsContact O-N 3.15Å; Q67-T71 PolarHBondContact O-OG1 2.87Å; T68-T71 PolarHBondContact O-N 2.92Å; T71-R73 VanDerWaalsContact C-N 3.28Å; T71-R73 PolarHBondContact O-N 3.22Å; T71-F74 PolarHBondContact O-N 2.91Å; T71-F74 VanDerWaalsContact O-N 3.1Å; T71-E75 PolarHBondContact O-N 3.44Å
72	N	78.4	Confident	73.7	Confident	52 Å²	52	74.2 Å²	74.2	28%	0.278	36%	0.355	S	S	.	.	H	α-helix	trans	-57.5	-42.5	178.7	-63.8	2.8	0	0	0	111.5	T68 E75 Y76	T68-N72 PolarHBondContact O-N 3.04Å; T68-N72 PolarHBondContact O-OD1 3.34Å; N72-E75 PolarHBondContact O-N 2.61Å; N72-Y76 PolarHBondContact O-N 2.8Å
73	R	79.2	Confident	73.6	Confident	18 Å²	18	75.2 Å²	75.2	7%	0.068	36%	0.362	C	S	.	.	H	α-helix	trans	-57.1	-50.2	173.9	171.4	-167	-59.2	157.4	12.1	112.1	D69 T71 E75 Y76 L77 N179 G180 I181 L337 D339	D69-R73 WeakPolarHBondContact O-CB 3.39Å; D69-R73 PolarHBondContact O-N 3.02Å; D69-R73 VanDerWaalsContact O-N 3.15Å; T71-R73 VanDerWaalsContact C-N 3.28Å; T71-R73 PolarHBondContact O-N 3.22Å; R73-E75 VanDerWaalsContact C-N 3.34Å; R73-E75 PolarHBondContact O-N 3.47Å; R73-Y76 PolarHBondContact O-N 3.13Å; R73-L77 HydrophobicContact CG-CD1 4.06Å; R73-L77 VanDerWaalsContact O-CG 3.24Å; R73-L77 WeakPolarHBondContact O-CG 3.37Å; R73-L77 PolarHBondContact O-N 2.99Å; R73-N179 WeakPolarHBondContact CA-O 3.35Å; R73-N179 PolarHBondContact N-O 3.3Å; R73-G180 PolarHBondContact NE-O 3.23Å; R73-G180 PolarHBondContact NH2-O 3.48Å; R73-I181 HydrophobicContact CB-CG1 4.31Å; R73-I181 HydrophobicContact CG-CG1 4.07Å; R73-L337 HydrophobicContact CG-CD2 4.48Å; R73-D339 IonicContact NH1-OD2 3.74Å; R73-D339 PolarHBondContact NH1-OD2 2.78Å
74	F	75.7	Confident	73.6	Confident	45 Å²	45	69.6 Å²	69.6	20%	0.197	34%	0.336	C	S	.	.	H	α-helix	trans	-61.4	-43.6	179.5	-71.6	-45.8	0	0	0	111.7	R70 T71 Y76 L77 L78 I88 V340	R70-F74 HydrophobicContact CG-CD2 4.07Å; R70-F74 HydrophobicContact CG-CE2 3.53Å; R70-F74 HydrophobicContact CG-CZ 4.1Å; R70-F74 WeakPolarHBondContact O-CD2 3.2Å; R70-F74 WeakPolarHBondContact O-CG 3.42Å; R70-F74 PolarHBondContact O-N 3.28Å; R70-F74 VanDerWaalsContact O-N 3.14Å; T71-F74 PolarHBondContact O-N 2.91Å; T71-F74 VanDerWaalsContact O-N 3.1Å; F74-Y76 PolarHBondContact O-N 3.36Å; F74-L77 PolarHBondContact O-N 3.32Å; F74-L78 VanDerWaalsContact O-CG 3.28Å; F74-L78 WeakPolarHBondContact O-CG 3.26Å; F74-L78 PolarHBondContact O-N 3.12Å; F74-I88 HydrophobicContact CD1-CD1 3.76Å; F74-I88 HydrophobicContact CD1-CG1 4.2Å; F74-I88 HydrophobicContact CE1-CD1 4.21Å; F74-I88 HydrophobicContact CE1-CG1 4.13Å; F74-V340 HydrophobicContact CE1-CG2 4.16Å
75	E	76.2	Confident	73.4	Confident	98 Å²	98	64.4 Å²	64.4	46%	0.458	32%	0.318	S	S	.	.	H	α-helix	trans	-60.5	-46.1	178.3	-166.7	-169.6	154.9	0	0	112	T71 N72 R73 K79	T71-E75 PolarHBondContact O-N 3.44Å; N72-E75 PolarHBondContact O-N 2.61Å; R73-E75 VanDerWaalsContact C-N 3.34Å; R73-E75 PolarHBondContact O-N 3.47Å; E75-K79 HydrophobicContact CG-CD 4.49Å; E75-K79 WeakPolarHBondContact O-CG 3.43Å; E75-K79 PolarHBondContact O-N 3.26Å; E75-K79 VanDerWaalsContact O-N 3.09Å; E75-K79 VanDerWaalsContact OE1-CE 3.27Å; E75-K79 WeakPolarHBondContact OE1-CE 3Å; E75-K79 IonicContact OE1-NZ 3.41Å; E75-K79 PolarHBondContact OE1-NZ 3.37Å
76	Y	78	Confident	73.1	Confident	46 Å²	46	67.3 Å²	67.3	18%	0.18	33%	0.332	C	S	.	.	H	α-helix	trans	-63.2	-43	176.8	-177.9	-81.9	0	0	0	112.3	N72 R73 F74 K79 Q80 N179 I181 P372	N72-Y76 PolarHBondContact O-N 2.8Å; R73-Y76 PolarHBondContact O-N 3.13Å; F74-Y76 PolarHBondContact O-N 3.36Å; Y76-K79 PolarHBondContact O-N 2.8Å; Y76-Q80 HydrophobicContact CD1-CG 3.92Å; Y76-Q80 HydrophobicContact CE1-CG 3.59Å; Y76-Q80 WeakPolarHBondContact O-CG 3.12Å; Y76-Q80 PolarHBondContact O-N 2.81Å; Y76-Q80 VanDerWaalsContact O-N 3.13Å; Y76-N179 HydrophobicContact CD2-CB 3.88Å; Y76-N179 WeakPolarHBondContact CD2-OD1 3.44Å; Y76-N179 HydrophobicContact CE2-CB 4.36Å; Y76-N179 HydrophobicContact CG-CB 4.12Å; Y76-I181 HydrophobicContact CD1-CD1 3.13Å; Y76-I181 HydrophobicContact CE1-CD1 3.65Å; Y76-I181 HydrophobicContact CG-CD1 3.62Å; Y76-P372 HydrophobicContact CE1-CB 4.25Å
77	L	76.7	Confident	72.7	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-63.6	-44.7	179.6	-69.2	178.2	0	0	0	111.8	R73 F74 K79 Q80 T81 F84 I181 L337 V340 F373	R73-L77 HydrophobicContact CG-CD1 4.06Å; R73-L77 VanDerWaalsContact O-CG 3.24Å; R73-L77 WeakPolarHBondContact O-CG 3.37Å; R73-L77 PolarHBondContact O-N 2.99Å; F74-L77 PolarHBondContact O-N 3.32Å; L77-K79 VanDerWaalsContact C-N 3.29Å; L77-K79 PolarHBondContact O-N 2.86Å; L77-Q80 PolarHBondContact O-N 2.98Å; L77-Q80 VanDerWaalsContact O-N 3.09Å; L77-T81 PolarHBondContact O-N 3.35Å; L77-F84 HydrophobicContact CB-CB 4.08Å; L77-F84 HydrophobicContact CB-CD1 4.46Å; L77-F84 HydrophobicContact CB-CD2 3.96Å; L77-F84 HydrophobicContact CB-CG 3.92Å; L77-F84 HydrophobicContact CD1-CD1 4.41Å; L77-F84 HydrophobicContact CD2-CD1 4.3Å; L77-F84 HydrophobicContact CD2-CD2 4.21Å; L77-F84 HydrophobicContact CD2-CE1 4.07Å; L77-F84 HydrophobicContact CD2-CE2 3.99Å; L77-F84 HydrophobicContact CD2-CG 4.38Å; L77-F84 HydrophobicContact CD2-CZ 3.91Å; L77-F84 VanDerWaalsContact O-CD2 3.26Å; L77-F84 WeakPolarHBondContact O-CD2 3.48Å; L77-I181 HydrophobicContact CD2-CD1 4.48Å; L77-L337 HydrophobicContact CD1-CD1 4.1Å; L77-V340 HydrophobicContact CD1-CG2 4.41Å; L77-F373 HydrophobicContact CD2-CE1 3.73Å; L77-F373 HydrophobicContact CD2-CZ 3.44Å; L77-F373 VanDerWaalsContact CD2-CZ 3.44Å
78	L	73.4	Confident	72.3	Confident	76 Å²	76	63.7 Å²	63.7	40%	0.398	31%	0.312	S	S	.	.	H	α-helix	trans	-61.5	-37.3	176.1	-68.4	170.1	0	0	0	112	F74 Q80 A85 I88	F74-L78 VanDerWaalsContact O-CG 3.28Å; F74-L78 WeakPolarHBondContact O-CG 3.26Å; F74-L78 PolarHBondContact O-N 3.12Å; L78-Q80 VanDerWaalsContact C-N 3.31Å; L78-Q80 PolarHBondContact O-N 2.86Å; L78-A85 HydrophobicContact CD2-CB 3.67Å; L78-I88 HydrophobicContact CD2-CD1 4.41Å
79	K	72.3	Confident	71.3	Confident	150 Å²	150	67.5 Å²	67.5	65%	0.652	33%	0.325	S	S	*	.	H	α-helix	trans	-68.2	-22.9	173.8	-73.4	175	-176.7	175.5	0	114.3	E75 Y76 L77	E75-K79 HydrophobicContact CG-CD 4.49Å; E75-K79 WeakPolarHBondContact O-CG 3.43Å; E75-K79 PolarHBondContact O-N 3.26Å; E75-K79 VanDerWaalsContact O-N 3.09Å; E75-K79 VanDerWaalsContact OE1-CE 3.27Å; E75-K79 WeakPolarHBondContact OE1-CE 3Å; E75-K79 IonicContact OE1-NZ 3.41Å; E75-K79 PolarHBondContact OE1-NZ 3.37Å; Y76-K79 PolarHBondContact O-N 2.8Å; L77-K79 VanDerWaalsContact C-N 3.29Å; L77-K79 PolarHBondContact O-N 2.86Å
80	Q	68.1	Low	69.8	Low	94 Å²	94	72.1 Å²	72.1	44%	0.439	36%	0.355	S	S	.	.	H	α-helix	trans	-84.7	-49	179.2	-71	-65.7	-50.3	0	0	112.5	Y76 L77 L78 F84 P372	Y76-Q80 HydrophobicContact CD1-CG 3.92Å; Y76-Q80 HydrophobicContact CE1-CG 3.59Å; Y76-Q80 WeakPolarHBondContact O-CG 3.12Å; Y76-Q80 PolarHBondContact O-N 2.81Å; Y76-Q80 VanDerWaalsContact O-N 3.13Å; L77-Q80 PolarHBondContact O-N 2.98Å; L77-Q80 VanDerWaalsContact O-N 3.09Å; L78-Q80 VanDerWaalsContact C-N 3.31Å; L78-Q80 PolarHBondContact O-N 2.86Å; Q80-F84 HydrophobicContact CB-CE2 4.49Å; Q80-P372 HydrophobicContact CB-CG 4.28Å; Q80-P372 HydrophobicContact CG-CB 4.49Å; Q80-P372 HydrophobicContact CG-CG 4.06Å
81	T	67.4	Low	67.9	Low	23 Å²	23	71.7 Å²	71.7	14%	0.141	37%	0.373	C	S	.	.			trans	-154.3	138.9	175	63	0	0	0	0	112.3	L77 L83 F84 T368	L77-T81 PolarHBondContact O-N 3.35Å; T81-L83 PolarHBondContact O-N 3.21Å; T81-F84 PolarHBondContact O-N 3.33Å; T81-F84 VanDerWaalsContact O-N 3.15Å; T81-F84 WeakPolarHBondContact OG1-CD2 3.18Å; T81-F84 VanDerWaalsContact OG1-CE2 3.27Å; T81-F84 WeakPolarHBondContact OG1-CE2 3.45Å; T81-T368 HydrophobicContact CG2-CG2 3.81Å
82	E	65.6	Low	65.9	Low	175 Å²	175	72.1 Å²	72.1	82%	0.818	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-25.6	168.1	-63.1	175.2	-176.7	0	0	113.3	F84 A85	E82-F84 PolarHBondContact O-N 3.5Å; E82-A85 VanDerWaalsContact O-CB 3.22Å; E82-A85 WeakPolarHBondContact O-CB 3.45Å; E82-A85 PolarHBondContact O-N 2.68Å
83	L	66	Low	63.9	Low	49 Å²	49	78.5 Å²	78.5	26%	0.257	41%	0.413	S	S	.	.	H	α-helix	trans	-56.8	-30.9	178.7	-56.5	-176.9	0	0	0	113.2	T81 A85 H86 F87 W350 R365 V369	T81-L83 PolarHBondContact O-N 3.21Å; L83-A85 VanDerWaalsContact C-N 3.32Å; L83-H86 WeakPolarHBondContact O-CB 3.43Å; L83-H86 PolarHBondContact O-N 3.3Å; L83-F87 WeakPolarHBondContact O-CD2 3.22Å; L83-W350 HydrophobicContact CD1-CH2 4.4Å; L83-W350 HydrophobicContact CD1-CZ2 4.49Å; L83-W350 HydrophobicContact CD2-CZ2 4.25Å; L83-R365 HydrophobicContact CD1-CB 4.4Å; L83-V369 HydrophobicContact CB-CG2 4.29Å; L83-V369 HydrophobicContact CD1-CG2 3.75Å
84	F	69	Low	61.7	Low	1 Å²	1	87.3 Å²	87.3	0%	0.004	45%	0.452	C	S	.	.	H	α-helix	trans	-69.7	-29.6	175.3	-67.5	-70.5	0	0	0	112.4	L77 Q80 T81 E82 H86 F87 I88 F341 V369 F373	L77-F84 HydrophobicContact CB-CB 4.08Å; L77-F84 HydrophobicContact CB-CD1 4.46Å; L77-F84 HydrophobicContact CB-CD2 3.96Å; L77-F84 HydrophobicContact CB-CG 3.92Å; L77-F84 HydrophobicContact CD1-CD1 4.41Å; L77-F84 HydrophobicContact CD2-CD1 4.3Å; L77-F84 HydrophobicContact CD2-CD2 4.21Å; L77-F84 HydrophobicContact CD2-CE1 4.07Å; L77-F84 HydrophobicContact CD2-CE2 3.99Å; L77-F84 HydrophobicContact CD2-CG 4.38Å; L77-F84 HydrophobicContact CD2-CZ 3.91Å; L77-F84 VanDerWaalsContact O-CD2 3.26Å; L77-F84 WeakPolarHBondContact O-CD2 3.48Å; Q80-F84 HydrophobicContact CB-CE2 4.49Å; T81-F84 PolarHBondContact O-N 3.33Å; T81-F84 VanDerWaalsContact O-N 3.15Å; T81-F84 WeakPolarHBondContact OG1-CD2 3.18Å; T81-F84 VanDerWaalsContact OG1-CE2 3.27Å; T81-F84 WeakPolarHBondContact OG1-CE2 3.45Å; E82-F84 PolarHBondContact O-N 3.5Å; F84-H86 PolarHBondContact O-N 3.09Å; F84-F87 PolarHBondContact O-N 3.1Å; F84-F87 VanDerWaalsContact O-N 3.17Å; F84-I88 HydrophobicContact CB-CD1 4.21Å; F84-I88 WeakPolarHBondContact O-CD1 3.44Å; F84-I88 VanDerWaalsContact O-CG1 3.22Å; F84-I88 WeakPolarHBondContact O-CG1 3.36Å; F84-I88 PolarHBondContact O-N 3.25Å; F84-I88 VanDerWaalsContact O-N 3.16Å; F84-F341 HydrophobicContact CD1-CZ 4.45Å; F84-F341 HydrophobicContact CE1-CZ 4.09Å; F84-V369 HydrophobicContact CE1-CG1 3.93Å; F84-V369 HydrophobicContact CZ-CG1 3.87Å; F84-F373 AromaticContact CE1-CE2 3.83Å; F84-F373 HydrophobicContact CE1-CE2 3.83Å; F84-F373 AromaticContact CE1-CZ 3.84Å; F84-F373 HydrophobicContact CE1-CZ 3.84Å; F84-F373 AromaticContact CZ-CE2 3.64Å; F84-F373 HydrophobicContact CZ-CE2 3.64Å; F84-F373 AromaticContact CZ-CZ 3.77Å; F84-F373 HydrophobicContact CZ-CZ 3.77Å
85	A	68	Low	59.3	Low	35 Å²	35	91.9 Å²	91.9	29%	0.289	48%	0.483	S	S	.	.	H	α-helix	trans	-60.7	-34	177.8	0	0	0	0	0	111.8	L78 E82 L83 I88 Q89	L78-A85 HydrophobicContact CD2-CB 3.67Å; E82-A85 VanDerWaalsContact O-CB 3.22Å; E82-A85 WeakPolarHBondContact O-CB 3.45Å; E82-A85 PolarHBondContact O-N 2.68Å; L83-A85 VanDerWaalsContact C-N 3.32Å; A85-I88 PolarHBondContact O-N 2.66Å; A85-Q89 PolarHBondContact O-N 3.43Å
86	H	66.6	Low	57.5	Low	121 Å²	121	92.9 Å²	92.9	56%	0.56	50%	0.498	S	S	*	.	H	α-helix	trans	-61.3	-43.7	176	-172.4	-86.3	0	0	0	112.4	L83 F84 I88 W350	L83-H86 WeakPolarHBondContact O-CB 3.43Å; L83-H86 PolarHBondContact O-N 3.3Å; F84-H86 PolarHBondContact O-N 3.09Å; H86-I88 VanDerWaalsContact C-N 3.31Å; H86-I88 PolarHBondContact O-N 3.5Å; H86-W350 AromaticContact CE1-CD1 3.87Å; H86-W350 AromaticContact ND1-CD1 3.94Å
87	F	65.2	Low	55.1	Low	39 Å²	39	97.8 Å²	97.8	17%	0.171	53%	0.533	C	S	.	.	H	α-helix	trans	-78	-11.9	178.3	-64.9	-76.5	0	0	0	113.8	L83 F84 V340 F341 W350	L83-F87 WeakPolarHBondContact O-CD2 3.22Å; F84-F87 PolarHBondContact O-N 3.1Å; F84-F87 VanDerWaalsContact O-N 3.17Å; F87-V340 HydrophobicContact CB-CG1 3.93Å; F87-F341 HydrophobicContact CD1-CD1 4.45Å; F87-F341 HydrophobicContact CD1-CE1 4.45Å; F87-F341 HydrophobicContact CD2-CE1 4.21Å; F87-F341 HydrophobicContact CE2-CE1 4.39Å; F87-F341 HydrophobicContact CG-CE1 4.25Å; F87-W350 HydrophobicContact CZ-CB 4.32Å; F87-W350 AromaticContact CZ-CD2 3.99Å; F87-W350 HydrophobicContact CZ-CD2 3.99Å; F87-W350 AromaticContact CZ-CG 3.88Å; F87-W350 HydrophobicContact CZ-CG 3.88Å
88	I	64.8	Low	52.7	Low	55 Å²	55	103.3 Å²	103.3	28%	0.282	57%	0.572	S	S	.	*	H	α-helix	trans	-94.2	-15.5	-178.3	-69.7	165.6	0	0	0	112.3	F74 L78 F84 A85 H86	F74-I88 HydrophobicContact CD1-CD1 3.76Å; F74-I88 HydrophobicContact CD1-CG1 4.2Å; F74-I88 HydrophobicContact CE1-CD1 4.21Å; F74-I88 HydrophobicContact CE1-CG1 4.13Å; L78-I88 HydrophobicContact CD2-CD1 4.41Å; F84-I88 HydrophobicContact CB-CD1 4.21Å; F84-I88 WeakPolarHBondContact O-CD1 3.44Å; F84-I88 VanDerWaalsContact O-CG1 3.22Å; F84-I88 WeakPolarHBondContact O-CG1 3.36Å; F84-I88 PolarHBondContact O-N 3.25Å; F84-I88 VanDerWaalsContact O-N 3.16Å; A85-I88 PolarHBondContact O-N 2.66Å; H86-I88 VanDerWaalsContact C-N 3.31Å; H86-I88 PolarHBondContact O-N 3.5Å
89	Q	56.3	Low	51	Low	149 Å²	149	105.5 Å²	105.5	70%	0.696	59%	0.59	S	S	*	*	S	Bend	trans	-65.7	138.1	178.3	-70.5	-171.5	17.9	0	0	111.9	A85 A91	A85-Q89 PolarHBondContact O-N 3.43Å; Q89-A91 PolarHBondContact O-N 2.72Å
90	P	44.7	Very low	48.9	Very low	111 Å²	111	106.4 Å²	106.4	72%	0.721	60%	0.601	S	S	*	*			trans	-74.2	118	-162.8	-18.9	33.4	0	0	0	113.9	A92	P90-A92 HydrophobicContact CB-CB 4.21Å; P90-A92 PolarHBondContact O-N 2.69Å
91	A	37.1	Very low	47.1	Very low	91 Å²	91	111 Å²	111	75%	0.752	62%	0.62	S	S	*	*			trans	-67.7	27.8	169.7	0	0	0	0	0	114.4	Q89	Q89-A91 PolarHBondContact O-N 2.72Å
92	A	35.5	Very low	45.1	Very low	86 Å²	86	119 Å²	119	71%	0.711	66%	0.658	S	S	*	*			trans	-94.4	10.7	-168.8	0	0	0	0	0	114.6	P90	P90-A92 HydrophobicContact CB-CB 4.21Å; P90-A92 PolarHBondContact O-N 2.69Å
93	Q	35.5	Very low	43.2	Very low	186 Å²	186	120.1 Å²	120.1	87%	0.869	66%	0.661	S	S	*	*			trans	-120.9	67.7	-178	-68.8	-167.7	-10.8	0	0	112.5
94	K	33	Very low	41.5	Very low	204 Å²	204	124.1 Å²	124.1	89%	0.887	69%	0.689	S	S	*	*			trans	-158.9	62.9	172	-112	162.5	-168.5	176.6	0	114.4
95	T	27.2	Very low	39.7	Very low	140 Å²	140	127.5 Å²	127.5	86%	0.859	72%	0.724	S	S	*	*			trans	-138.3	122.2	162.4	50.6	0	0	0	0	110.2
96	P	36.8	Very low	37.6	Very low	120 Å²	120	137.6 Å²	137.6	78%	0.779	76%	0.755	S	S	*	*			trans	-99.3	136.7	-174.5	35.6	-32.3	0	0	0	113.8
97	T	28	Very low	36	Very low	149 Å²	149	137 Å²	137	91%	0.914	76%	0.761	S	S	*	*			trans	-163.2	161.1	149.7	-4.1	0	0	0	0	111.9
98	S	26.2	Very low	34.4	Very low	115 Å²	115	147.1 Å²	147.1	80%	0.804	80%	0.799	S	S	*	*			trans	-77.2	161.2	-165	-59.8	0	0	0	0	115.4
99	P	38.8	Very low	32.8	Very low	122 Å²	122	151.5 Å²	151.5	79%	0.792	82%	0.821	S	S	*	*			trans	-92.7	136	-169.5	34.6	-33.7	0	0	0	114.3
100	L	27.9	Very low	31.6	Very low	169 Å²	169	152.4 Å²	152.4	89%	0.885	82%	0.823	S	S	*	*			trans	-156.6	149	157.7	-111	162.7	0	0	0	113.1
101	K	30.3	Very low	31	Very low	190 Å²	190	155.7 Å²	155.7	83%	0.826	83%	0.826	S	S	*	*			trans	-63.3	141	-162.2	-59.3	153.4	178.1	170.1	0	116.1
102	M	24.8	Very low	30.9	Very low	193 Å²	193	155.3 Å²	155.3	95%	0.951	81%	0.811	S	S	*	*			trans	-137.8	162.6	140.3	-86.3	-163.2	73	0	0	111.4
103	K	26	Very low	31	Very low	198 Å²	198	158.4 Å²	158.4	86%	0.861	81%	0.811	S	S	*	*			trans	-84.7	157	-169.8	-85.1	-179.2	175.6	178.5	0	113.5
104	P	30.7	Very low	30.8	Very low	133 Å²	133	157.7 Å²	157.7	86%	0.864	81%	0.805	S	S	*	*			trans	-81.4	146.1	-171.1	32.6	-36.5	0	0	0	114.2
105	G	31	Very low	30.9	Very low	71 Å²	71	154.7 Å²	154.7	73%	0.732	79%	0.794	S	S	*	*			trans	-171.9	124.9	168.8	0	0	0	0	0	113.6
106	R	24.2	Very low	31.4	Very low	247 Å²	247	154 Å²	154	93%	0.932	79%	0.785	S	S	*	*	S	Bend	trans	68.1	160.5	174.7	-124.3	175.2	-170.4	-179.6	2.9	115.7
107	P	32.1	Very low	31.6	Very low	108 Å²	108	155.5 Å²	155.5	70%	0.701	79%	0.785	S	S	*	*				-102.5	169.1	-69.9	36	-30.7	0	0	0	112.6	I109	P107-I109 PolarHBondContact O-N 3.15Å
108	R	32	Very low	32	Very low	253 Å²	253	155.2 Å²	155.2	96%	0.955	78%	0.778	S	S	*	*			trans	-68.5	109.1	171.2	-87.7	177.8	163.8	166.4	-6.8	110.8
109	I	31.8	Very low	32.6	Very low	146 Å²	146	153.1 Å²	153.1	75%	0.749	76%	0.763	S	S	*	*			trans	-72.8	140.2	151.8	-63.1	175.5	0	0	0	107.2	P107	P107-I109 PolarHBondContact O-N 3.15Å
110	K	31.3	Very low	32.8	Very low	168 Å²	168	151 Å²	151	73%	0.73	76%	0.755	S	S	*	*			trans	-62.9	152.2	179.1	-85.2	-178.8	158.5	-156.4	0	111.1	D112	K110-D112 VanDerWaalsContact C-N 3.26Å; K110-D112 WeakPolarHBondContact CD-OD2 3.3Å; K110-D112 IonicContact NZ-OD2 3.22Å; K110-D112 PolarHBondContact O-N 3.1Å
111	K	31.6	Very low	33.2	Very low	181 Å²	181	146.6 Å²	146.6	79%	0.787	75%	0.752	S	S	*	*	S	Bend	trans	-84.7	-7.5	-176.2	-148.6	179	-179.5	-169.8	0	112.6
112	D	35.2	Very low	33.4	Very low	83 Å²	83	143 Å²	143	44%	0.444	74%	0.741	S	S	.	*	S	Bend	trans	-87.4	-37.4	-150.7	-39.1	-26.3	0	0	0	111.7	K110 K114 Q115 N116	K110-D112 VanDerWaalsContact C-N 3.26Å; K110-D112 WeakPolarHBondContact CD-OD2 3.3Å; K110-D112 IonicContact NZ-OD2 3.22Å; K110-D112 PolarHBondContact O-N 3.1Å; D112-K114 PolarHBondContact O-N 2.88Å; D112-K114 VanDerWaalsContact O-N 3.16Å; D112-Q115 PolarHBondContact O-N 2.94Å; D112-N116 PolarHBondContact O-N 3.12Å
113	E	36.1	Very low	34.2	Very low	151 Å²	151	141.1 Å²	141.1	71%	0.706	74%	0.735	S	S	*	*	H	α-helix	trans	-58.1	-31.6	177.9	-65.4	-175.6	137.5	0	0	113.2	Q115	E113-Q115 PolarHBondContact O-N 3.01Å
114	K	33	Very low	35	Very low	170 Å²	170	142.4 Å²	142.4	74%	0.739	73%	0.734	S	S	*	*	H	α-helix	trans	-73.6	-13.9	179.8	-160.3	173.7	-177.4	-178.9	0	112.9	D112	D112-K114 PolarHBondContact O-N 2.88Å; D112-K114 VanDerWaalsContact O-N 3.16Å
115	Q	34.8	Very low	35.5	Very low	141 Å²	141	144.5 Å²	144.5	66%	0.659	73%	0.733	S	S	*	*	H	α-helix	trans	-94.2	-38.2	-178.2	-155.9	157.5	-18.2	0	0	111.5	D112 E113 L117 L118 S119	D112-Q115 PolarHBondContact O-N 2.94Å; E113-Q115 PolarHBondContact O-N 3.01Å; Q115-L117 VanDerWaalsContact C-N 3.32Å; Q115-L117 PolarHBondContact O-N 2.74Å; Q115-L118 PolarHBondContact O-N 3.27Å; Q115-S119 PolarHBondContact O-N 2.69Å
116	N	38.1	Very low	36.1	Very low	125 Å²	125	152.3 Å²	152.3	67%	0.668	74%	0.74	S	S	*	*	H	α-helix	trans	-66.4	-27.8	177.5	-73.8	9	0	0	0	114	D112 L118 S119	D112-N116 PolarHBondContact O-N 3.12Å; N116-L118 PolarHBondContact O-N 2.98Å; N116-S119 PolarHBondContact O-OG 2.88Å
117	L	40.6	Very low	37.6	Very low	152 Å²	152	146.8 Å²	146.8	80%	0.796	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-6.1	176.2	-78.1	166.5	0	0	0	114.2	Q115	Q115-L117 VanDerWaalsContact C-N 3.32Å; Q115-L117 PolarHBondContact O-N 2.74Å
118	L	35.6	Very low	38.9	Very low	144 Å²	144	145.4 Å²	145.4	75%	0.754	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115	-11.3	-177.8	-70.4	170.5	0	0	0	113.8	Q115 N116	Q115-L118 PolarHBondContact O-N 3.27Å; N116-L118 PolarHBondContact O-N 2.98Å
119	S	38.3	Very low	40.2	Very low	70 Å²	70	141.1 Å²	141.1	49%	0.49	70%	0.7	S	S	.	*			trans	-84.7	-14.4	-179	54.2	0	0	0	0	114.6	Q115 N116 G121 D122	Q115-S119 PolarHBondContact O-N 2.69Å; N116-S119 PolarHBondContact O-OG 2.88Å; S119-G121 PolarHBondContact O-N 3.38Å; S119-D122 PolarHBondContact O-N 3.38Å; S119-D122 VanDerWaalsContact O-N 3.14Å
120	A	42.9	Very low	41.5	Very low	77 Å²	77	141.6 Å²	141.6	64%	0.636	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	-0.5	-175	0	0	0	0	0	115.8
121	G	36.3	Very low	42.9	Very low	78 Å²	78	138.8 Å²	138.8	80%	0.804	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.9	-7.4	175.9	0	0	0	0	0	115.8	S119	S119-G121 PolarHBondContact O-N 3.38Å
122	D	36.2	Very low	44.2	Very low	113 Å²	113	134.9 Å²	134.9	60%	0.604	67%	0.673	S	S	*	*			trans	-127.6	78.3	-173.6	-164.4	7	0	0	0	113.3	S119 R124	S119-D122 PolarHBondContact O-N 3.38Å; S119-D122 VanDerWaalsContact O-N 3.14Å; D122-R124 PolarHBondContact O-N 2.93Å; D122-R124 WeakPolarHBondContact OD1-CB 3.3Å
123	N	39.9	Very low	45.4	Very low	154 Å²	154	135.3 Å²	135.3	82%	0.824	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	44.4	177.9	-66.8	-32.7	0	0	0	113
124	R	43.1	Very low	46.8	Very low	225 Å²	225	134.4 Å²	134.4	85%	0.849	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.2	-4.2	-178.4	-71.7	-173	164.1	-169.1	-3.2	115.7	D122	D122-R124 PolarHBondContact O-N 2.93Å; D122-R124 WeakPolarHBondContact OD1-CB 3.3Å
125	H	42.4	Very low	48.3	Very low	178 Å²	178	130.2 Å²	130.2	82%	0.824	65%	0.654	S	S	*	*	S	Bend	trans	-80.5	124	165.8	-125.3	-77.8	0	0	0	110.2	R127	H125-R127 PolarHBondContact O-N 3.05Å
126	R	43.4	Very low	49.3	Very low	235 Å²	235	128.2 Å²	128.2	89%	0.887	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-67.8	123.6	171	-168.3	176.4	-173.3	175.5	1.1	107.9
127	R	54.2	Low	50.3	Low	131 Å²	131	127.6 Å²	127.6	49%	0.494	64%	0.643	S	S	.	*	P	Polyproline II helix	trans	-64.5	159.5	177.5	-70.2	178.6	173.8	179.2	-9.5	110.8	H125 E132 E135	H125-R127 PolarHBondContact O-N 3.05Å; R127-E132 HydrophobicContact CB-CG 3.85Å; R127-E135 IonicContact CZ-OE1 2.73Å; R127-E135 IonicContact CZ-OE2 2.76Å; R127-E135 IonicContact NH1-OE1 2.86Å; R127-E135 PolarHBondContact NH1-OE1 2.79Å; R127-E135 IonicContact NH1-OE2 3.88Å; R127-E135 PolarHBondContact NH1-OE2 3.24Å; R127-E135 IonicContact NH2-OE1 2.81Å
128	T	60.7	Low	51	Low	79 Å²	79	124.2 Å²	124.2	49%	0.485	63%	0.626	S	S	.	*	P	Polyproline II helix	trans	-87	153.2	172.4	58.6	0	0	0	0	111.3	Q130 E131 E132	T128-Q130 PolarHBondContact O-N 3.43Å; T128-E131 PolarHBondContact N-OE2 3.05Å; T128-E131 WeakPolarHBondContact O-CB 3.42Å; T128-E131 PolarHBondContact O-N 2.78Å; T128-E131 VanDerWaalsContact OG1-CD 3.27Å; T128-E131 VanDerWaalsContact OG1-CG 3.27Å; T128-E131 WeakPolarHBondContact OG1-CG 3.44Å; T128-E131 PolarHBondContact OG1-OE2 3.02Å; T128-E132 PolarHBondContact O-N 3.37Å
129	E	59.8	Low	51.6	Low	163 Å²	163	123.4 Å²	123.4	76%	0.762	62%	0.618	S	S	*	*	H	α-helix	trans	-53.8	-39.4	179.8	-171.6	171.5	-162.9	0	0	112	E132 D133	E129-E132 PolarHBondContact O-N 3.24Å; E129-D133 WeakPolarHBondContact O-CB 3.5Å; E129-D133 PolarHBondContact O-N 3.31Å
130	Q	58.5	Low	51.7	Low	156 Å²	156	124.4 Å²	124.4	73%	0.729	63%	0.625	S	S	*	*	H	α-helix	trans	-69.8	-31.6	174.9	-68.2	-170.5	-71.8	0	0	114.1	T128 E134	T128-Q130 PolarHBondContact O-N 3.43Å; Q130-E134 WeakPolarHBondContact O-CB 3.32Å; Q130-E134 WeakPolarHBondContact O-CG 3.49Å; Q130-E134 PolarHBondContact O-N 3.1Å
131	E	61.3	Low	51.5	Low	108 Å²	108	125.9 Å²	125.9	51%	0.505	63%	0.626	S	S	.	*	H	α-helix	trans	-72.4	-38.5	175	-73.9	167.6	130.9	0	0	111.4	T128 E135	T128-E131 PolarHBondContact N-OE2 3.05Å; T128-E131 WeakPolarHBondContact O-CB 3.42Å; T128-E131 PolarHBondContact O-N 2.78Å; T128-E131 VanDerWaalsContact OG1-CD 3.27Å; T128-E131 VanDerWaalsContact OG1-CG 3.27Å; T128-E131 WeakPolarHBondContact OG1-CG 3.44Å; T128-E131 PolarHBondContact OG1-OE2 3.02Å; E131-E135 VanDerWaalsContact O-CB 3.27Å; E131-E135 WeakPolarHBondContact O-CB 3.23Å; E131-E135 PolarHBondContact O-N 3.29Å
132	E	57.8	Low	51.8	Low	100 Å²	100	128.7 Å²	128.7	47%	0.467	62%	0.616	S	S	.	*	H	α-helix	trans	-68.2	-42.9	174.1	-66.8	-173.2	139.3	0	0	111	R127 T128 E129 E135 L136	R127-E132 HydrophobicContact CB-CG 3.85Å; T128-E132 PolarHBondContact O-N 3.37Å; E129-E132 PolarHBondContact O-N 3.24Å; E132-E135 PolarHBondContact O-N 3.22Å; E132-L136 WeakPolarHBondContact O-CB 3.37Å; E132-L136 WeakPolarHBondContact O-CD1 3.31Å; E132-L136 WeakPolarHBondContact O-CG 3.5Å; E132-L136 PolarHBondContact O-N 2.86Å
133	D	60.4	Low	51.8	Low	92 Å²	92	129.7 Å²	129.7	49%	0.492	63%	0.627	S	S	.	*	H	α-helix	trans	-64.3	-42.7	175.1	-87.2	-9.1	0	0	0	112.8	E129 E135 L136 L137	E129-D133 WeakPolarHBondContact O-CB 3.5Å; E129-D133 PolarHBondContact O-N 3.31Å; D133-E135 VanDerWaalsContact C-N 3.34Å; D133-L136 PolarHBondContact O-N 3.46Å; D133-L137 WeakPolarHBondContact O-CB 3.43Å; D133-L137 VanDerWaalsContact O-CG 3.3Å; D133-L137 WeakPolarHBondContact O-CG 3.43Å; D133-L137 PolarHBondContact O-N 3.23Å
134	E	65.6	Low	51.7	Low	131 Å²	131	127.8 Å²	127.8	61%	0.612	62%	0.621	S	S	*	*	H	α-helix	trans	-65.4	-36.3	174.4	-79.2	-168.9	-179.9	0	0	111.9	Q130 N138	Q130-E134 WeakPolarHBondContact O-CB 3.32Å; Q130-E134 WeakPolarHBondContact O-CG 3.49Å; Q130-E134 PolarHBondContact O-N 3.1Å; E134-N138 WeakPolarHBondContact O-CB 3.34Å; E134-N138 PolarHBondContact O-N 2.9Å; E134-N138 PolarHBondContact O-ND2 3.46Å
135	E	63.7	Low	51.8	Low	82 Å²	82	123.5 Å²	123.5	38%	0.383	62%	0.615	S	S	.	*	H	α-helix	trans	-67.4	-44	175.3	-166	176.2	-138.9	0	0	111.4	R127 E131 E132 D133 N138 E139	R127-E135 IonicContact CZ-OE1 2.73Å; R127-E135 IonicContact CZ-OE2 2.76Å; R127-E135 IonicContact NH1-OE1 2.86Å; R127-E135 PolarHBondContact NH1-OE1 2.79Å; R127-E135 IonicContact NH1-OE2 3.88Å; R127-E135 PolarHBondContact NH1-OE2 3.24Å; R127-E135 IonicContact NH2-OE1 2.81Å; E131-E135 VanDerWaalsContact O-CB 3.27Å; E131-E135 WeakPolarHBondContact O-CB 3.23Å; E131-E135 PolarHBondContact O-N 3.29Å; E132-E135 PolarHBondContact O-N 3.22Å; D133-E135 VanDerWaalsContact C-N 3.34Å; E135-N138 CarbonylContact O-C 3.6Å; E135-N138 WeakPolarHBondContact O-CA 3.42Å; E135-N138 WeakPolarHBondContact O-CB 3.42Å; E135-N138 PolarHBondContact O-N 3.32Å; E135-N138 VanDerWaalsContact O-N 3.11Å; E135-E139 PolarHBondContact O-N 2.86Å
136	L	57.4	Low	52.1	Low	100 Å²	100	119.8 Å²	119.8	52%	0.524	61%	0.605	S	S	.	*	H	α-helix	trans	-65.8	-36	175.8	-70.8	166.9	0	0	0	112.7	E132 D133 N138 E139 S140	E132-L136 WeakPolarHBondContact O-CB 3.37Å; E132-L136 WeakPolarHBondContact O-CD1 3.31Å; E132-L136 WeakPolarHBondContact O-CG 3.5Å; E132-L136 PolarHBondContact O-N 2.86Å; D133-L136 PolarHBondContact O-N 3.46Å; L136-N138 VanDerWaalsContact C-N 3.33Å; L136-E139 PolarHBondContact O-N 3.33Å; L136-S140 WeakPolarHBondContact O-CB 3.25Å; L136-S140 PolarHBondContact O-N 3.46Å; L136-S140 PolarHBondContact O-OG 3.01Å
137	L	58.5	Low	52.7	Low	112 Å²	112	112.2 Å²	112.2	59%	0.586	59%	0.587	S	S	*	*	H	α-helix	trans	-66.1	-35.9	170.2	-77.6	165.3	0	0	0	111.7	D133 S140 T141	D133-L137 WeakPolarHBondContact O-CB 3.43Å; D133-L137 VanDerWaalsContact O-CG 3.3Å; D133-L137 WeakPolarHBondContact O-CG 3.43Å; D133-L137 PolarHBondContact O-N 3.23Å; L137-S140 WeakPolarHBondContact CA-OG 3.46Å; L137-S140 PolarHBondContact O-OG 2.89Å; L137-T141 WeakPolarHBondContact O-CB 3.24Å; L137-T141 WeakPolarHBondContact O-CG2 3.47Å; L137-T141 PolarHBondContact O-N 3.4Å; L137-T141 VanDerWaalsContact O-N 3.17Å; L137-T141 PolarHBondContact O-OG1 3.24Å
138	N	55	Low	53.4	Low	80 Å²	80	107.3 Å²	107.3	43%	0.428	57%	0.571	S	S	.	*	H	α-helix	trans	-73.1	-33.2	173.2	-84.4	-79	0	0	0	113	E134 E135 L136 T141 K142	E134-N138 WeakPolarHBondContact O-CB 3.34Å; E134-N138 PolarHBondContact O-N 2.9Å; E134-N138 PolarHBondContact O-ND2 3.46Å; E135-N138 CarbonylContact O-C 3.6Å; E135-N138 WeakPolarHBondContact O-CA 3.42Å; E135-N138 WeakPolarHBondContact O-CB 3.42Å; E135-N138 PolarHBondContact O-N 3.32Å; E135-N138 VanDerWaalsContact O-N 3.11Å; L136-N138 VanDerWaalsContact C-N 3.33Å; N138-T141 PolarHBondContact O-OG1 3.21Å; N138-K142 VanDerWaalsContact O-CB 3.28Å; N138-K142 WeakPolarHBondContact O-CB 3.45Å; N138-K142 WeakPolarHBondContact O-CD 3.47Å; N138-K142 WeakPolarHBondContact O-CG 3.47Å; N138-K142 PolarHBondContact O-N 3.21Å
139	E	47.4	Very low	54.4	Low	128 Å²	128	111.7 Å²	111.7	60%	0.598	58%	0.579	S	S	*	*	H	α-helix	trans	-74.3	-32.7	174.4	-72.5	-153.4	133.1	0	0	112.8	E135 L136	E135-E139 PolarHBondContact O-N 2.86Å; L136-E139 PolarHBondContact O-N 3.33Å
140	S	41.4	Very low	55.7	Low	91 Å²	91	104.8 Å²	104.8	64%	0.636	55%	0.547	S	S	*	.	H	α-helix	trans	-77	-24.4	175.5	54.8	0	0	0	0	113.8	L136 L137	L136-S140 WeakPolarHBondContact O-CB 3.25Å; L136-S140 PolarHBondContact O-N 3.46Å; L136-S140 PolarHBondContact O-OG 3.01Å; L137-S140 WeakPolarHBondContact CA-OG 3.46Å; L137-S140 PolarHBondContact O-OG 2.89Å
141	T	38.4	Very low	57	Low	108 Å²	108	102.8 Å²	102.8	66%	0.663	54%	0.541	S	S	*	.	H	α-helix	trans	-91.7	-28.8	174.6	50	0	0	0	0	113.8	L137 N138 T143	L137-T141 WeakPolarHBondContact O-CB 3.24Å; L137-T141 WeakPolarHBondContact O-CG2 3.47Å; L137-T141 PolarHBondContact O-N 3.4Å; L137-T141 VanDerWaalsContact O-N 3.17Å; L137-T141 PolarHBondContact O-OG1 3.24Å; N138-T141 PolarHBondContact O-OG1 3.21Å; T141-T143 PolarHBondContact O-N 2.95Å
142	K	41.7	Very low	58.2	Low	136 Å²	136	103.7 Å²	103.7	59%	0.591	55%	0.545	S	S	*	.	S	Bend	trans	-69.7	109.2	164.2	-73.2	166.5	-169.8	165	0	108.6	N138 T144	N138-K142 VanDerWaalsContact O-CB 3.28Å; N138-K142 WeakPolarHBondContact O-CB 3.45Å; N138-K142 WeakPolarHBondContact O-CD 3.47Å; N138-K142 WeakPolarHBondContact O-CG 3.47Å; N138-K142 PolarHBondContact O-N 3.21Å; K142-T144 PolarHBondContact O-N 3.34Å
143	T	38.1	Very low	59.7	Low	135 Å²	135	100 Å²	100	83%	0.828	53%	0.53	S	S	*	.			trans	-47.9	119.5	164.3	51.7	0	0	0	0	108.6	T141 N145	T141-T143 PolarHBondContact O-N 2.95Å; T143-N145 PolarHBondContact O-N 3.49Å
144	T	37.3	Very low	61.2	Low	114 Å²	114	95.9 Å²	95.9	70%	0.699	51%	0.508	S	S	*	.			trans	-51.1	132.6	-173	44.5	0	0	0	0	109.9	K142 V146	K142-T144 PolarHBondContact O-N 3.34Å; T144-V146 WeakPolarHBondContact O-CG2 3.27Å; T144-V146 PolarHBondContact O-N 2.93Å
145	N	45.1	Very low	62.3	Low	135 Å²	135	93.5 Å²	93.5	72%	0.722	51%	0.506	S	S	*	.			trans	-71.4	84.8	178.3	-112	-36.3	0	0	0	108	T143 C147	T143-N145 PolarHBondContact O-N 3.49Å; N145-C147 VanDerWaalsContact C-N 3.29Å; N145-C147 PolarHBondContact O-N 2.84Å
146	V	48.1	Very low	63.6	Low	100 Å²	100	90 Å²	90	61%	0.606	49%	0.49	S	S	*	.			trans	-65	92	-179.7	-177.2	0	0	0	0	108.3	T144 T148	T144-V146 WeakPolarHBondContact O-CG2 3.27Å; T144-V146 PolarHBondContact O-N 2.93Å; V146-T148 PolarHBondContact O-N 2.99Å; V146-T148 PolarHBondContact O-OG1 3.33Å
147	C	56.1	Low	65.2	Low	75 Å²	75	85.8 Å²	85.8	51%	0.507	47%	0.468	S	S	.	.			trans	-52.7	105.7	173.9	178.8	0	0	0	0	107.8	N145 R149 E178	N145-C147 VanDerWaalsContact C-N 3.29Å; N145-C147 PolarHBondContact O-N 2.84Å; C147-R149 VanDerWaalsContact C-N 3.27Å; C147-R149 PolarHBondContact O-N 2.99Å; C147-E178 WeakPolarHBondContact CA-OE2 3.35Å; C147-E178 PolarHBondContact SG-OE2 2.66Å
148	T	69.7	Low	66.5	Low	28 Å²	28	87.3 Å²	87.3	17%	0.172	47%	0.47	C	S	.	.			trans	-84.4	78.4	-159.5	-41.7	0	0	0	0	110.4	V146 F150 E178 Y203 Y207	V146-T148 PolarHBondContact O-N 2.99Å; V146-T148 PolarHBondContact O-OG1 3.33Å; T148-F150 HydrophobicContact CG2-CE2 4.47Å; T148-F150 HydrophobicContact CG2-CZ 4.48Å; T148-E178 PolarHBondContact N-OE1 3.35Å; T148-Y203 WeakPolarHBondContact CB-OH 3.24Å; T148-Y203 HydrophobicContact CG2-CE2 3.75Å; T148-Y203 PolarHBondContact OG1-OH 3.48Å; T148-Y207 HydrophobicContact CG2-CD1 3.78Å; T148-Y207 HydrophobicContact CG2-CE1 4.15Å
149	R	81.6	Confident	67.7	Low	171 Å²	171	87.3 Å²	87.3	65%	0.645	47%	0.473	S	S	*	.			trans	-81.7	131.5	-178	179.3	177.1	164.3	154.5	-5.2	111.3	C147 D151	C147-R149 VanDerWaalsContact C-N 3.27Å; C147-R149 PolarHBondContact O-N 2.99Å; R149-D151 IonicContact CZ-OD1 2.61Å; R149-D151 VanDerWaalsContact CZ-OD1 3.27Å; R149-D151 IonicContact NE-OD1 3.98Å; R149-D151 PolarHBondContact NE-OD1 3.49Å; R149-D151 IonicContact NE-OD2 2.8Å; R149-D151 IonicContact NH2-OD1 2.67Å; R149-D151 PolarHBondContact NH2-OD1 3Å
150	F	86.8	Confident	69.4	Low	19 Å²	19	83 Å²	83	8%	0.083	46%	0.463	C	S	.	.			trans	-100.1	121.6	170.5	-65.6	-85.6	0	0	0	109.7	T148 P154 Y156 I167 L170 N171 I174 Y203 Y207	T148-F150 HydrophobicContact CG2-CE2 4.47Å; T148-F150 HydrophobicContact CG2-CZ 4.48Å; F150-P154 HydrophobicContact CD1-CB 3.94Å; F150-P154 HydrophobicContact CD1-CG 3.75Å; F150-P154 HydrophobicContact CD2-CG 4.29Å; F150-P154 HydrophobicContact CE1-CB 3.77Å; F150-P154 HydrophobicContact CE1-CG 3.97Å; F150-P154 HydrophobicContact CE2-CG 4.5Å; F150-P154 HydrophobicContact CG-CG 3.93Å; F150-P154 HydrophobicContact CZ-CB 4.3Å; F150-P154 HydrophobicContact CZ-CG 4.35Å; F150-Y156 HydrophobicContact CZ-CE1 4.26Å; F150-I167 HydrophobicContact CB-CG2 4.29Å; F150-I167 WeakPolarHBondContact O-CG2 3.16Å; F150-L170 HydrophobicContact CD2-CD2 4.18Å; F150-N171 PolarHBondContact N-OD1 3.26Å; F150-N171 PolarHBondContact O-ND2 3.25Å; F150-N171 PolarHBondContact O-OD1 3.28Å; F150-I174 HydrophobicContact CD2-CD1 3.74Å; F150-I174 HydrophobicContact CE2-CD1 3.61Å; F150-Y203 AromaticContact CE2-CD2 3.68Å; F150-Y203 HydrophobicContact CE2-CD2 3.68Å; F150-Y203 HydrophobicContact CE2-CE2 4.16Å; F150-Y203 AromaticContact CZ-CD2 3.98Å; F150-Y203 HydrophobicContact CZ-CD2 3.98Å; F150-Y207 HydrophobicContact CE1-CE1 4.28Å; F150-Y207 AromaticContact CE1-CE2 3.9Å; F150-Y207 HydrophobicContact CE1-CE2 3.9Å; F150-Y207 AromaticContact CE1-CZ 3.68Å; F150-Y207 HydrophobicContact CZ-CD1 4.39Å; F150-Y207 AromaticContact CZ-CD2 3.97Å; F150-Y207 HydrophobicContact CZ-CD2 3.97Å; F150-Y207 HydrophobicContact CZ-CE1 4.08Å; F150-Y207 AromaticContact CZ-CE2 3.64Å; F150-Y207 HydrophobicContact CZ-CE2 3.64Å; F150-Y207 HydrophobicContact CZ-CG 4.34Å; F150-Y207 AromaticContact CZ-CZ 3.7Å
151	D	84.7	Confident	71.6	Confident	114 Å²	114	86 Å²	86	61%	0.61	46%	0.464	S	S	*	.	S	Bend	trans	-94.2	-15.8	168.7	-64.9	-58.7	0	0	0	112.2	R149	R149-D151 IonicContact CZ-OD1 2.61Å; R149-D151 VanDerWaalsContact CZ-OD1 3.27Å; R149-D151 IonicContact NE-OD1 3.98Å; R149-D151 PolarHBondContact NE-OD1 3.49Å; R149-D151 IonicContact NE-OD2 2.8Å; R149-D151 IonicContact NH2-OD1 2.67Å; R149-D151 PolarHBondContact NH2-OD1 3Å
152	E	87.9	Confident	74.1	Confident	127 Å²	127	81.2 Å²	81.2	59%	0.593	43%	0.434	S	S	*	.	S	Bend	trans	-118.3	171.7	169.6	-84.4	-149.4	-131.7	0	0	112.7	K161	E152-K161 IonicContact OE2-NZ 3.47Å; E152-K161 PolarHBondContact OE2-NZ 3.02Å
153	S	89.8	Confident	76.3	Confident	23 Å²	23	79.3 Å²	79.3	16%	0.161	42%	0.424	C	S	.	.			trans	-62	127.5	175.6	-173.3	0	0	0	0	111.3	K161 M162	S153-K161 WeakPolarHBondContact OG-CA 3.44Å; S153-M162 PolarHBondContact OG-N 3.47Å
154	P	90.6	Very high	78.7	Confident	4 Å²	4	78.4 Å²	78.4	3%	0.026	41%	0.414	C	S	.	.			trans	-61.2	143.1	-176.1	-21.3	29.5	0	0	0	114.1	F150 Y156 V157 M162 L170	F150-P154 HydrophobicContact CD1-CB 3.94Å; F150-P154 HydrophobicContact CD1-CG 3.75Å; F150-P154 HydrophobicContact CD2-CG 4.29Å; F150-P154 HydrophobicContact CE1-CB 3.77Å; F150-P154 HydrophobicContact CE1-CG 3.97Å; F150-P154 HydrophobicContact CE2-CG 4.5Å; F150-P154 HydrophobicContact CG-CG 3.93Å; F150-P154 HydrophobicContact CZ-CB 4.3Å; F150-P154 HydrophobicContact CZ-CG 4.35Å; P154-Y156 HydrophobicContact CB-CD1 3.94Å; P154-Y156 HydrophobicContact CB-CD2 4.33Å; P154-Y156 HydrophobicContact CB-CE1 3.39Å; P154-Y156 HydrophobicContact CB-CE2 3.83Å; P154-Y156 HydrophobicContact CB-CG 4.37Å; P154-Y156 WeakPolarHBondContact CB-OH 3.35Å; P154-Y156 HydrophobicContact CG-CE1 4.27Å; P154-Y156 HydrophobicContact CG-CE2 4.31Å; P154-Y156 WeakPolarHBondContact CG-OH 3.38Å; P154-Y156 PolarHBondContact O-N 3.45Å; P154-Y156 VanDerWaalsContact O-N 3.13Å; P154-V157 HydrophobicContact CB-CG2 4.38Å; P154-V157 WeakPolarHBondContact O-CB 3.23Å; P154-V157 PolarHBondContact O-N 2.96Å; P154-M162 HydrophobicContact CG-SD 4.47Å; P154-L170 HydrophobicContact CG-CD2 3.55Å
155	S	89.1	Confident	81.2	Confident	82 Å²	82	73.3 Å²	73.3	57%	0.573	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-16.4	-173.7	62.4	0	0	0	0	115.4	K158	S155-K158 WeakPolarHBondContact O-CE 3.45Å; S155-K158 PolarHBondContact O-NZ 3.11Å
156	Y	91.1	Very high	83.5	Confident	8 Å²	8	67.4 Å²	67.4	3%	0.031	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-13.1	173	55.4	-103.5	0	0	0	113.5	F150 P154 K158 A199 H206 Y207 V234	F150-Y156 HydrophobicContact CZ-CE1 4.26Å; P154-Y156 HydrophobicContact CB-CD1 3.94Å; P154-Y156 HydrophobicContact CB-CD2 4.33Å; P154-Y156 HydrophobicContact CB-CE1 3.39Å; P154-Y156 HydrophobicContact CB-CE2 3.83Å; P154-Y156 HydrophobicContact CB-CG 4.37Å; P154-Y156 WeakPolarHBondContact CB-OH 3.35Å; P154-Y156 HydrophobicContact CG-CE1 4.27Å; P154-Y156 HydrophobicContact CG-CE2 4.31Å; P154-Y156 WeakPolarHBondContact CG-OH 3.38Å; P154-Y156 PolarHBondContact O-N 3.45Å; P154-Y156 VanDerWaalsContact O-N 3.13Å; Y156-K158 PolarHBondContact O-N 3.27Å; Y156-A199 HydrophobicContact CE2-CB 4.47Å; Y156-A199 PolarHBondContact OH-O 3.39Å; Y156-A199 VanDerWaalsContact OH-O 3.12Å; Y156-H206 WeakPolarHBondContact CB-CD2 3.48Å; Y156-H206 HydrophobicContact CD1-CB 3.96Å; Y156-H206 AromaticContact CD1-CD2 3.92Å; Y156-H206 AromaticContact CG-CD2 3.61Å; Y156-Y207 HydrophobicContact CD1-CD2 4.24Å; Y156-Y207 AromaticContact CD1-CE2 3.91Å; Y156-Y207 HydrophobicContact CD1-CE2 3.91Å; Y156-Y207 AromaticContact CE1-CD2 3.85Å; Y156-Y207 HydrophobicContact CE1-CD2 3.85Å; Y156-Y207 AromaticContact CE1-CE2 3.68Å; Y156-Y207 HydrophobicContact CE1-CE2 3.68Å; Y156-V234 HydrophobicContact CD2-CG1 4.38Å; Y156-V234 HydrophobicContact CD2-CG2 4.06Å
157	V	91.8	Very high	85.5	Confident	12 Å²	12	63.2 Å²	63.2	7%	0.073	32%	0.324	C	S	.	.			trans	-83.9	107.5	172.3	-174.5	0	0	0	0	108.1	P154 M162 L195 A199 W233 V234	P154-V157 HydrophobicContact CB-CG2 4.38Å; P154-V157 WeakPolarHBondContact O-CB 3.23Å; P154-V157 PolarHBondContact O-N 2.96Å; V157-M162 HydrophobicContact CG1-CG 4.47Å; V157-M162 HydrophobicContact CG2-SD 4.18Å; V157-L195 HydrophobicContact CG1-CD1 4.41Å; V157-A199 HydrophobicContact CG2-CB 4.49Å; V157-W233 WeakPolarHBondContact CA-O 3.25Å; V157-W233 HydrophobicContact CG1-CB 4.48Å; V157-W233 HydrophobicContact CG1-CE3 3.76Å; V157-W233 HydrophobicContact CG1-CZ3 4.47Å; V157-V234 HydrophobicContact CG2-CG2 4.4Å
158	K	85.6	Confident	87.1	Confident	144 Å²	144	67.1 Å²	67.1	63%	0.626	33%	0.328	S	S	*	.			trans	-92.9	-46.5	-167.2	-62.7	-53.7	-170.5	-173.2	0	114.8	S155 Y156 G160 W233	S155-K158 WeakPolarHBondContact O-CE 3.45Å; S155-K158 PolarHBondContact O-NZ 3.11Å; Y156-K158 PolarHBondContact O-N 3.27Å; K158-G160 PolarHBondContact O-N 2.91Å; K158-W233 PolarHBondContact N-O 2.9Å
159	T	78.8	Confident	88.2	Confident	80 Å²	80	65.8 Å²	65.8	49%	0.491	32%	0.32	S	S	.	.	S	Bend	trans	-88.4	38.5	-166.5	-47.8	0	0	0	0	113.5	R232 W233	T159-R232 WeakPolarHBondContact CB-O 3.22Å; T159-R232 HydrophobicContact CG2-CG 3.95Å; T159-R232 PolarHBondContact OG1-O 3.38Å; T159-W233 VanDerWaalsContact O-CZ3 3.26Å; T159-W233 WeakPolarHBondContact O-CZ3 3.25Å
160	G	83.3	Confident	88.8	Confident	37 Å²	37	57.7 Å²	57.7	38%	0.381	29%	0.289	S	S	.	.	S	Bend	trans	134	166.8	178.3	0	0	0	0	0	113.6	K158	K158-G160 PolarHBondContact O-N 2.91Å
161	K	87.4	Confident	89	Confident	153 Å²	153	58 Å²	58	67%	0.665	29%	0.292	S	S	*	.	P	Polyproline II helix	trans	-87.8	142.9	176.5	-68.5	-162.7	174.4	-161.8	0	112.1	E152 S153	E152-K161 IonicContact OE2-NZ 3.47Å; E152-K161 PolarHBondContact OE2-NZ 3.02Å; S153-K161 WeakPolarHBondContact OG-CA 3.44Å
162	M	90.9	Very high	89.3	Confident	8 Å²	8	54.7 Å²	54.7	4%	0.039	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-68.3	147.3	165.1	-64.3	-179.8	69.4	0	0	110.9	S153 P154 V157 Q166 I167 L170 L195 A199	S153-M162 PolarHBondContact OG-N 3.47Å; P154-M162 HydrophobicContact CG-SD 4.47Å; V157-M162 HydrophobicContact CG1-CG 4.47Å; V157-M162 HydrophobicContact CG2-SD 4.18Å; M162-Q166 HydrophobicContact CB-CB 4.29Å; M162-Q166 HydrophobicContact CE-CB 3.87Å; M162-I167 HydrophobicContact CB-CD1 4.4Å; M162-I167 HydrophobicContact CB-CG1 3.79Å; M162-L170 HydrophobicContact CE-CB 4.16Å; M162-L170 HydrophobicContact CE-CD2 4.26Å; M162-L170 HydrophobicContact SD-CD2 4.17Å; M162-L195 HydrophobicContact CE-CG 4.45Å; M162-L195 HydrophobicContact CG-CD1 4.41Å; M162-L195 HydrophobicContact CG-CD2 4.14Å; M162-L195 HydrophobicContact CG-CG 4.25Å; M162-A199 HydrophobicContact CE-CB 3.85Å; M162-A199 HydrophobicContact SD-CB 3.68Å
163	R	89.4	Confident	89.6	Confident	97 Å²	97	48.9 Å²	48.9	37%	0.366	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-79.2	155.7	174.7	-62.9	-175.8	177.6	-123.1	-5.7	111.6	Y165 Q166 I167 E383 T385	R163-Y165 HydrophobicContact CB-CD1 4.07Å; R163-Y165 HydrophobicContact CB-CE1 3.88Å; R163-Y165 PolarHBondContact O-N 3.29Å; R163-Q166 HydrophobicContact CB-CG 4.23Å; R163-Q166 CarbonylContact O-C 3.55Å; R163-Q166 WeakPolarHBondContact O-CA 3.28Å; R163-Q166 VanDerWaalsContact O-CB 3.29Å; R163-Q166 WeakPolarHBondContact O-CB 3.47Å; R163-Q166 PolarHBondContact O-N 2.91Å; R163-I167 PolarHBondContact O-N 3.16Å; R163-E383 WeakPolarHBondContact CD-OE2 3.44Å; R163-E383 IonicContact CZ-OE2 2.76Å; R163-E383 VanDerWaalsContact CZ-OE2 3.3Å; R163-E383 IonicContact NE-OE2 3.52Å; R163-E383 PolarHBondContact NE-OE2 3.25Å; R163-E383 IonicContact NH1-OE1 2.68Å; R163-E383 PolarHBondContact NH1-OE1 3.17Å; R163-E383 IonicContact NH1-OE2 2.72Å; R163-E383 PolarHBondContact NH1-OE2 3.44Å; R163-T385 PolarHBondContact NH1-OG1 2.99Å; R163-T385 VanDerWaalsContact NH1-OG1 3.17Å
164	D	87.9	Confident	89.6	Confident	116 Å²	116	47.8 Å²	47.8	62%	0.62	24%	0.236	S	C	*	.	H	α-helix	trans	-53.4	-35.3	-174.6	-44.8	1.5	0	0	0	114.2	R168	D164-R168 WeakPolarHBondContact O-CB 3.32Å; D164-R168 WeakPolarHBondContact O-CG 3.48Å; D164-R168 PolarHBondContact O-N 3.13Å; D164-R168 PolarHBondContact O-NE 2.98Å
165	Y	90.1	Very high	89.5	Confident	7 Å²	7	49.4 Å²	49.4	3%	0.027	25%	0.247	C	C	.	.	H	α-helix	trans	-76.7	-31.9	176.6	79.5	-96.9	0	0	0	111.2	R163 R168 G169 L191 R377 V382 I578	R163-Y165 HydrophobicContact CB-CD1 4.07Å; R163-Y165 HydrophobicContact CB-CE1 3.88Å; R163-Y165 PolarHBondContact O-N 3.29Å; Y165-R168 PolarHBondContact O-N 3.35Å; Y165-G169 PolarHBondContact O-N 3.47Å; Y165-L191 HydrophobicContact CE2-CB 4.04Å; Y165-L191 HydrophobicContact CE2-CD2 4.26Å; Y165-L191 WeakPolarHBondContact CE2-O 3.47Å; Y165-L191 PolarHBondContact OH-O 3.12Å; Y165-R377 PolarHBondContact O-NH1 3.24Å; Y165-V382 HydrophobicContact CD1-CB 3.92Å; Y165-V382 HydrophobicContact CD1-CG2 4.04Å; Y165-V382 HydrophobicContact CD2-CB 4.43Å; Y165-V382 HydrophobicContact CD2-CG2 4.26Å; Y165-V382 HydrophobicContact CE1-CG2 4.24Å; Y165-V382 HydrophobicContact CE2-CG2 4.47Å; Y165-V382 HydrophobicContact CG-CB 3.86Å; Y165-V382 HydrophobicContact CG-CG1 4.36Å; Y165-V382 HydrophobicContact CG-CG2 4.09Å; Y165-I578 HydrophobicContact CE1-CD1 4.46Å; Y165-I578 WeakPolarHBondContact OH-CD1 3.36Å
166	Q	92.4	Very high	89.5	Confident	11 Å²	11	45.7 Å²	45.7	5%	0.051	22%	0.221	C	C	.	.	H	α-helix	trans	-70.1	-38.2	174	-58.3	175.7	-33.8	0	0	110.9	M162 R163 G169 L170 L191 Q196	M162-Q166 HydrophobicContact CB-CB 4.29Å; M162-Q166 HydrophobicContact CE-CB 3.87Å; R163-Q166 HydrophobicContact CB-CG 4.23Å; R163-Q166 CarbonylContact O-C 3.55Å; R163-Q166 WeakPolarHBondContact O-CA 3.28Å; R163-Q166 VanDerWaalsContact O-CB 3.29Å; R163-Q166 WeakPolarHBondContact O-CB 3.47Å; R163-Q166 PolarHBondContact O-N 2.91Å; Q166-G169 PolarHBondContact O-N 3.42Å; Q166-L170 WeakPolarHBondContact O-CB 3.33Å; Q166-L170 PolarHBondContact O-N 3.01Å; Q166-L191 PolarHBondContact NE2-O 3.12Å; Q166-Q196 HydrophobicContact CB-CG 3.94Å; Q166-Q196 HydrophobicContact CG-CG 4.27Å
167	I	91.3	Very high	89.3	Confident	12 Å²	12	46 Å²	46	6%	0.062	22%	0.223	C	C	.	.	H	α-helix	trans	-62.8	-48.5	172.2	-64.2	165.9	0	0	0	109.9	F150 M162 R163 G169 L170 N171	F150-I167 HydrophobicContact CB-CG2 4.29Å; F150-I167 WeakPolarHBondContact O-CG2 3.16Å; M162-I167 HydrophobicContact CB-CD1 4.4Å; M162-I167 HydrophobicContact CB-CG1 3.79Å; R163-I167 PolarHBondContact O-N 3.16Å; I167-G169 VanDerWaalsContact C-N 3.25Å; I167-G169 PolarHBondContact O-N 3.43Å; I167-L170 WeakPolarHBondContact O-CB 3.12Å; I167-L170 PolarHBondContact O-N 3.22Å; I167-L170 VanDerWaalsContact O-N 3.17Å; I167-N171 PolarHBondContact O-N 3.49Å; I167-N171 PolarHBondContact O-ND2 2.87Å
168	R	89.6	Confident	89	Confident	157 Å²	157	47.3 Å²	47.3	59%	0.592	23%	0.228	S	C	*	.	H	α-helix	trans	-58.7	-34.1	172.6	-79	176.2	-82.1	176.8	-11.6	113.5	D164 Y165 W172	D164-R168 WeakPolarHBondContact O-CB 3.32Å; D164-R168 WeakPolarHBondContact O-CG 3.48Å; D164-R168 PolarHBondContact O-N 3.13Å; D164-R168 PolarHBondContact O-NE 2.98Å; Y165-R168 PolarHBondContact O-N 3.35Å; R168-W172 PolarHBondContact O-N 2.89Å; R168-W172 VanDerWaalsContact O-N 3.1Å
169	G	92.1	Very high	88.9	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-73.8	-37.2	175.2	0	0	0	0	0	113.5	Y165 Q166 I167 W172 L173	Y165-G169 PolarHBondContact O-N 3.47Å; Q166-G169 PolarHBondContact O-N 3.42Å; I167-G169 VanDerWaalsContact C-N 3.25Å; I167-G169 PolarHBondContact O-N 3.43Å; G169-W172 PolarHBondContact O-N 3.39Å; G169-L173 WeakPolarHBondContact O-CG 3.3Å; G169-L173 PolarHBondContact O-N 2.59Å
170	L	93.7	Very high	89.1	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.1	-47.3	170.3	175.4	62.4	0	0	0	111	F150 P154 M162 Q166 I167 W172 L173 I174 A199 L200	F150-L170 HydrophobicContact CD2-CD2 4.18Å; P154-L170 HydrophobicContact CG-CD2 3.55Å; M162-L170 HydrophobicContact CE-CB 4.16Å; M162-L170 HydrophobicContact CE-CD2 4.26Å; M162-L170 HydrophobicContact SD-CD2 4.17Å; Q166-L170 WeakPolarHBondContact O-CB 3.33Å; Q166-L170 PolarHBondContact O-N 3.01Å; I167-L170 WeakPolarHBondContact O-CB 3.12Å; I167-L170 PolarHBondContact O-N 3.22Å; I167-L170 VanDerWaalsContact O-N 3.17Å; L170-W172 VanDerWaalsContact C-N 3.28Å; L170-W172 PolarHBondContact O-N 3.4Å; L170-L173 WeakPolarHBondContact O-CB 3.3Å; L170-L173 PolarHBondContact O-N 3.07Å; L170-L173 VanDerWaalsContact O-N 3.12Å; L170-I174 HydrophobicContact CD1-CD1 4.02Å; L170-I174 HydrophobicContact CD1-CG1 4.24Å; L170-I174 HydrophobicContact CG-CD1 3.86Å; L170-I174 HydrophobicContact CG-CG1 4.48Å; L170-I174 WeakPolarHBondContact O-CG1 3.49Å; L170-I174 PolarHBondContact O-N 3.48Å; L170-A199 HydrophobicContact CD1-CB 3.94Å; L170-A199 HydrophobicContact CD2-CB 3.99Å; L170-L200 HydrophobicContact CD1-CB 4.17Å
171	N	91	Very high	89.2	Confident	25 Å²	25	37.1 Å²	37.1	13%	0.134	17%	0.168	C	C	.	.	H	α-helix	trans	-60.4	-37.4	176.4	-67	-23.4	0	0	0	112.3	F150 I167 I174 S175	F150-N171 PolarHBondContact N-OD1 3.26Å; F150-N171 PolarHBondContact O-ND2 3.25Å; F150-N171 PolarHBondContact O-OD1 3.28Å; I167-N171 PolarHBondContact O-N 3.49Å; I167-N171 PolarHBondContact O-ND2 2.87Å; N171-I174 PolarHBondContact O-N 2.8Å; N171-S175 WeakPolarHBondContact O-CB 3.31Å; N171-S175 PolarHBondContact O-N 3.05Å
172	W	92.4	Very high	89.4	Confident	46 Å²	46	30.2 Å²	30.2	17%	0.174	14%	0.138	C	C	.	.	H	α-helix	trans	-64.7	-45.2	172.8	175.9	76.6	0	0	0	111.8	R168 G169 L170 I174 S175 L176 I184 L185 P372 F373 L375	R168-W172 PolarHBondContact O-N 2.89Å; R168-W172 VanDerWaalsContact O-N 3.1Å; G169-W172 PolarHBondContact O-N 3.39Å; L170-W172 VanDerWaalsContact C-N 3.28Å; L170-W172 PolarHBondContact O-N 3.4Å; W172-I174 VanDerWaalsContact C-N 3.33Å; W172-I174 PolarHBondContact O-N 2.65Å; W172-S175 PolarHBondContact O-N 3.46Å; W172-L176 HydrophobicContact CD2-CD1 4.31Å; W172-L176 HydrophobicContact CD2-CG 4.47Å; W172-L176 HydrophobicContact CE3-CD1 4.34Å; W172-L176 HydrophobicContact CH2-CD1 3.67Å; W172-L176 HydrophobicContact CZ2-CD1 3.61Å; W172-L176 HydrophobicContact CZ2-CG 4.31Å; W172-L176 HydrophobicContact CZ3-CD1 4.04Å; W172-L176 WeakPolarHBondContact O-CG 3.4Å; W172-L176 PolarHBondContact O-N 2.95Å; W172-I184 WeakPolarHBondContact CH2-O 3.47Å; W172-L185 HydrophobicContact CZ3-CD1 4.31Å; W172-P372 PolarHBondContact NE1-O 3.33Å; W172-F373 WeakPolarHBondContact CH2-O 3.37Å; W172-F373 WeakPolarHBondContact CZ2-O 3.1Å; W172-L375 HydrophobicContact CB-CD2 4.17Å; W172-L375 HydrophobicContact CD2-CB 3.73Å; W172-L375 HydrophobicContact CD2-CD2 3.81Å; W172-L375 HydrophobicContact CD2-CG 4.35Å; W172-L375 HydrophobicContact CE3-CB 3.57Å; W172-L375 HydrophobicContact CE3-CD2 3.55Å; W172-L375 HydrophobicContact CE3-CG 4.22Å; W172-L375 HydrophobicContact CG-CD2 4.09Å; W172-L375 HydrophobicContact CH2-CB 3.58Å; W172-L375 HydrophobicContact CZ2-CB 3.72Å; W172-L375 HydrophobicContact CZ3-CB 3.51Å; W172-L375 HydrophobicContact CZ3-CD2 4.22Å
173	L	93.6	Very high	89.4	Confident	4 Å²	4	29.9 Å²	29.9	2%	0.021	14%	0.138	C	C	.	.	H	α-helix	trans	-62.1	-37.4	175.2	-69.3	170.9	0	0	0	112.9	G169 L170 L176 Y177 Q196 L200 L315	G169-L173 WeakPolarHBondContact O-CG 3.3Å; G169-L173 PolarHBondContact O-N 2.59Å; L170-L173 WeakPolarHBondContact O-CB 3.3Å; L170-L173 PolarHBondContact O-N 3.07Å; L170-L173 VanDerWaalsContact O-N 3.12Å; L173-L176 PolarHBondContact O-N 3.21Å; L173-Y177 PolarHBondContact O-N 2.93Å; L173-Y177 VanDerWaalsContact O-N 3.1Å; L173-Q196 HydrophobicContact CD1-CB 4.34Å; L173-L200 HydrophobicContact CB-CD1 3.95Å; L173-L200 HydrophobicContact CB-CD2 4.05Å; L173-L200 HydrophobicContact CB-CG 4.41Å; L173-L200 HydrophobicContact CD1-CB 4.37Å; L173-L200 HydrophobicContact CD1-CD2 4.38Å; L173-L315 HydrophobicContact CD2-CD1 3.63Å; L173-L315 HydrophobicContact CD2-CD2 4.06Å
174	I	90.4	Very high	89.4	Confident	1 Å²	1	25.5 Å²	25.5	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-66	-44.8	173.6	-68.8	168.5	0	0	0	110.4	F150 L170 N171 W172 L176 Y177 E178 L200 Y203	F150-I174 HydrophobicContact CD2-CD1 3.74Å; F150-I174 HydrophobicContact CE2-CD1 3.61Å; L170-I174 HydrophobicContact CD1-CD1 4.02Å; L170-I174 HydrophobicContact CD1-CG1 4.24Å; L170-I174 HydrophobicContact CG-CD1 3.86Å; L170-I174 HydrophobicContact CG-CG1 4.48Å; L170-I174 WeakPolarHBondContact O-CG1 3.49Å; L170-I174 PolarHBondContact O-N 3.48Å; N171-I174 PolarHBondContact O-N 2.8Å; W172-I174 VanDerWaalsContact C-N 3.33Å; W172-I174 PolarHBondContact O-N 2.65Å; I174-L176 VanDerWaalsContact C-N 3.3Å; I174-L176 PolarHBondContact O-N 2.7Å; I174-Y177 WeakPolarHBondContact O-CB 3.36Å; I174-Y177 PolarHBondContact O-N 3.36Å; I174-Y177 VanDerWaalsContact O-N 3.1Å; I174-E178 HydrophobicContact CG2-CG 4.2Å; I174-E178 WeakPolarHBondContact O-CG 3.47Å; I174-E178 PolarHBondContact O-N 2.88Å; I174-L200 HydrophobicContact CG1-CD1 4.12Å; I174-Y203 HydrophobicContact CB-CE1 4.41Å; I174-Y203 HydrophobicContact CD1-CD1 4.11Å; I174-Y203 HydrophobicContact CD1-CD2 3.88Å; I174-Y203 HydrophobicContact CD1-CE1 4.34Å; I174-Y203 HydrophobicContact CD1-CE2 4.12Å; I174-Y203 HydrophobicContact CD1-CG 3.86Å; I174-Y203 HydrophobicContact CG1-CD1 3.74Å; I174-Y203 HydrophobicContact CG1-CD2 4.41Å; I174-Y203 HydrophobicContact CG1-CE1 3.89Å; I174-Y203 HydrophobicContact CG1-CG 4.01Å; I174-Y203 HydrophobicContact CG2-CE1 3.85Å; I174-Y203 HydrophobicContact CG2-CE2 4.45Å
175	S	87.4	Confident	89.6	Confident	37 Å²	37	20 Å²	20	26%	0.259	9%	0.092	S	C	.	.	H	α-helix	trans	-61.2	-37.7	176.8	-170.9	0	0	0	0	112.1	N171 W172 N179	N171-S175 WeakPolarHBondContact O-CB 3.31Å; N171-S175 PolarHBondContact O-N 3.05Å; W172-S175 PolarHBondContact O-N 3.46Å; S175-N179 PolarHBondContact O-N 3.11Å; S175-N179 PolarHBondContact O-ND2 3.29Å
176	L	88.7	Confident	89.5	Confident	5 Å²	5	19.9 Å²	19.9	3%	0.026	9%	0.093	C	C	.	.	H	α-helix	trans	-62.8	-45.6	171.7	-67.3	-171	0	0	0	112	W172 L173 I174 E178 N179 G180 I181	W172-L176 HydrophobicContact CD2-CD1 4.31Å; W172-L176 HydrophobicContact CD2-CG 4.47Å; W172-L176 HydrophobicContact CE3-CD1 4.34Å; W172-L176 HydrophobicContact CH2-CD1 3.67Å; W172-L176 HydrophobicContact CZ2-CD1 3.61Å; W172-L176 HydrophobicContact CZ2-CG 4.31Å; W172-L176 HydrophobicContact CZ3-CD1 4.04Å; W172-L176 WeakPolarHBondContact O-CG 3.4Å; W172-L176 PolarHBondContact O-N 2.95Å; L173-L176 PolarHBondContact O-N 3.21Å; I174-L176 VanDerWaalsContact C-N 3.3Å; I174-L176 PolarHBondContact O-N 2.7Å; L176-E178 PolarHBondContact O-N 3.43Å; L176-N179 PolarHBondContact O-N 2.81Å; L176-G180 PolarHBondContact O-N 3.41Å; L176-I181 CarbonylContact C-O 3.3Å; L176-I181 HydrophobicContact CD2-CB 4.35Å; L176-I181 HydrophobicContact CD2-CG2 3.88Å; L176-I181 PolarHBondContact O-N 3.3Å
177	Y	88.4	Confident	89.3	Confident	15 Å²	15	19.4 Å²	19.4	6%	0.059	9%	0.09	C	C	.	.	H	α-helix	trans	-58.6	-47.3	177.1	173.8	-107.8	0	0	0	112.5	K65 L173 I174 N179 G180 Y203 M204 R208 I210 Y286 N313	K65-Y177 PolarHBondContact NZ-OH 3.39Å; L173-Y177 PolarHBondContact O-N 2.93Å; L173-Y177 VanDerWaalsContact O-N 3.1Å; I174-Y177 WeakPolarHBondContact O-CB 3.36Å; I174-Y177 PolarHBondContact O-N 3.36Å; I174-Y177 VanDerWaalsContact O-N 3.1Å; Y177-N179 PolarHBondContact O-N 2.92Å; Y177-G180 PolarHBondContact O-N 3.39Å; Y177-Y203 HydrophobicContact CD1-CE1 4.28Å; Y177-M204 HydrophobicContact CD1-SD 4.07Å; Y177-M204 HydrophobicContact CD2-CE 4.26Å; Y177-M204 HydrophobicContact CD2-SD 3.92Å; Y177-M204 HydrophobicContact CE1-CE 4.45Å; Y177-M204 HydrophobicContact CE1-SD 3.82Å; Y177-M204 HydrophobicContact CE2-CE 3.55Å; Y177-M204 HydrophobicContact CE2-SD 3.67Å; Y177-M204 HydrophobicContact CG-SD 4.12Å; Y177-R208 HydrophobicContact CE1-CG 4.04Å; Y177-I210 WeakPolarHBondContact OH-CD1 3.33Å; Y177-Y286 WeakPolarHBondContact CB-OH 3.45Å; Y177-Y286 AromaticContact CD2-CE2 3.92Å; Y177-Y286 HydrophobicContact CD2-CE2 3.92Å; Y177-Y286 WeakPolarHBondContact CD2-OH 3.46Å; Y177-Y286 HydrophobicContact CE2-CE2 4.44Å; Y177-N313 WeakPolarHBondContact CD2-ND2 3.41Å
178	E	84.9	Confident	88.9	Confident	39 Å²	39	21.2 Å²	21.2	18%	0.182	10%	0.098	C	C	.	.	H	α-helix	trans	-66.4	-26.8	-176.9	-69.6	174.7	157.4	0	0	112.6	C147 T148 I174 L176 Y203 R208	C147-E178 WeakPolarHBondContact CA-OE2 3.35Å; C147-E178 PolarHBondContact SG-OE2 2.66Å; T148-E178 PolarHBondContact N-OE1 3.35Å; I174-E178 HydrophobicContact CG2-CG 4.2Å; I174-E178 WeakPolarHBondContact O-CG 3.47Å; I174-E178 PolarHBondContact O-N 2.88Å; L176-E178 PolarHBondContact O-N 3.43Å; E178-Y203 PolarHBondContact OE1-OH 3.16Å; E178-Y203 VanDerWaalsContact OE1-OH 3.12Å; E178-R208 IonicContact OE1-CZ 3.6Å; E178-R208 IonicContact OE1-NH2 3.56Å; E178-R208 PolarHBondContact OE1-NH2 3.21Å
179	N	82.3	Confident	88.5	Confident	45 Å²	45	14.8 Å²	14.8	24%	0.241	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	4.2	173.2	-68.8	-74.8	0	0	0	113.9	R73 Y76 S175 L176 Y177 I181	R73-N179 WeakPolarHBondContact CA-O 3.35Å; R73-N179 PolarHBondContact N-O 3.3Å; Y76-N179 HydrophobicContact CD2-CB 3.88Å; Y76-N179 WeakPolarHBondContact CD2-OD1 3.44Å; Y76-N179 HydrophobicContact CE2-CB 4.36Å; Y76-N179 HydrophobicContact CG-CB 4.12Å; S175-N179 PolarHBondContact O-N 3.11Å; S175-N179 PolarHBondContact O-ND2 3.29Å; L176-N179 PolarHBondContact O-N 2.81Å; Y177-N179 PolarHBondContact O-N 2.92Å; N179-I181 HydrophobicContact CB-CD1 3.94Å; N179-I181 HydrophobicContact CB-CG1 4.36Å; N179-I181 PolarHBondContact O-N 2.69Å
180	G	83.8	Confident	87.8	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	70	26.6	179.9	0	0	0	0	0	114.5	R73 L176 Y177	R73-G180 PolarHBondContact NE-O 3.23Å; R73-G180 PolarHBondContact NH2-O 3.48Å; L176-G180 PolarHBondContact O-N 3.41Å; Y177-G180 PolarHBondContact O-N 3.39Å
181	I	85.8	Confident	87.5	Confident	2 Å²	2	15.9 Å²	15.9	1%	0.01	9%	0.087	C	C	.	.			trans	-111.6	145.7	-170.2	-69.5	168.2	0	0	0	112.3	R73 Y76 L77 L176 N179 F373	R73-I181 HydrophobicContact CB-CG1 4.31Å; R73-I181 HydrophobicContact CG-CG1 4.07Å; Y76-I181 HydrophobicContact CD1-CD1 3.13Å; Y76-I181 HydrophobicContact CE1-CD1 3.65Å; Y76-I181 HydrophobicContact CG-CD1 3.62Å; L77-I181 HydrophobicContact CD2-CD1 4.48Å; L176-I181 CarbonylContact C-O 3.3Å; L176-I181 HydrophobicContact CD2-CB 4.35Å; L176-I181 HydrophobicContact CD2-CG2 3.88Å; L176-I181 PolarHBondContact O-N 3.3Å; N179-I181 HydrophobicContact CB-CD1 3.94Å; N179-I181 HydrophobicContact CB-CG1 4.36Å; N179-I181 PolarHBondContact O-N 2.69Å; I181-F373 HydrophobicContact CG2-CD1 3.65Å; I181-F373 HydrophobicContact CG2-CE1 3.74Å
182	N	91.3	Very high	87.3	Confident	7 Å²	7	15.8 Å²	15.8	4%	0.037	9%	0.092	C	C	.	.			trans	-97.9	145.8	179	-65.3	-33.8	0	0	0	111.1	N313 R314 L336	N182-N313 WeakPolarHBondContact OD1-CA 3.45Å; N182-N313 PolarHBondContact OD1-OD1 3.13Å; N182-R314 WeakPolarHBondContact CA-O 3.36Å; N182-R314 HydrophobicContact CB-CB 4.12Å; N182-R314 VanDerWaalsContact CB-O 3.31Å; N182-R314 WeakPolarHBondContact CB-O 3.44Å; N182-R314 PolarHBondContact OD1-N 3.05Å; N182-R314 PolarHBondContact OD1-O 2.98Å; N182-L336 HydrophobicContact CB-CB 4.02Å; N182-L336 HydrophobicContact CB-CD2 3.74Å; N182-L336 HydrophobicContact CB-CG 4.49Å; N182-L336 PolarHBondContact ND2-O 3.05Å
183	G	89.9	Confident	87.4	Confident	2 Å²	2	14.4 Å²	14.4	2%	0.021	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	163.4	-167	0	0	0	0	0	116.6	R314 L316 F373	G183-R314 PolarHBondContact N-O 3.03Å; G183-L316 PolarHBondContact O-N 2.96Å; G183-F373 CarbonylContact C-O 3.56Å; G183-F373 WeakPolarHBondContact CA-O 3.29Å
184	I	90.9	Very high	87.4	Confident	4 Å²	4	15.3 Å²	15.3	2%	0.021	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	111.4	171.7	-46.2	-177.2	0	0	0	109.5	W172 A186 L316 T318 L322 L336 F373 L374 L375	W172-I184 WeakPolarHBondContact CH2-O 3.47Å; I184-A186 HydrophobicContact CG2-CB 4.19Å; I184-A186 PolarHBondContact O-N 3.01Å; I184-L316 CarbonylContact C-O 3.47Å; I184-L316 WeakPolarHBondContact CA-O 3.42Å; I184-L316 HydrophobicContact CG1-CB 4.36Å; I184-L316 HydrophobicContact CG1-CD1 4.42Å; I184-L316 HydrophobicContact CG2-CB 4.3Å; I184-T318 HydrophobicContact CG2-CG2 4.06Å; I184-L322 HydrophobicContact CD1-CD1 3.7Å; I184-L336 HydrophobicContact CD1-CD1 3.81Å; I184-L336 HydrophobicContact CG1-CD1 3.57Å; I184-F373 PolarHBondContact N-O 3.42Å; I184-L374 HydrophobicContact CB-CG 4.42Å; I184-L374 WeakPolarHBondContact O-CA 3.41Å; I184-L375 PolarHBondContact O-N 3.01Å; I184-L375 VanDerWaalsContact O-N 3.08Å
185	L	91.9	Very high	87.6	Confident	0 Å²	0	15.8 Å²	15.8	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	97.2	169.2	-171.1	61.4	0	0	0	109.2	W172 K193 Q196 L315 L316 L317 T318 L375	W172-L185 HydrophobicContact CZ3-CD1 4.31Å; L185-K193 HydrophobicContact CB-CD 4.38Å; L185-K193 HydrophobicContact CD2-CB 3.87Å; L185-K193 HydrophobicContact CD2-CD 4.18Å; L185-K193 HydrophobicContact CD2-CG 3.78Å; L185-K193 HydrophobicContact CG-CB 4.49Å; L185-K193 HydrophobicContact CG-CD 3.87Å; L185-K193 HydrophobicContact CG-CG 3.9Å; L185-K193 WeakPolarHBondContact O-CD 3.46Å; L185-Q196 HydrophobicContact CD2-CB 4.08Å; L185-L315 HydrophobicContact CB-CD1 4.44Å; L185-L316 PolarHBondContact N-O 3.44Å; L185-L317 HydrophobicContact CB-CD2 3.79Å; L185-L317 HydrophobicContact CD2-CD2 4.17Å; L185-T318 PolarHBondContact O-N 2.97Å; L185-T318 VanDerWaalsContact O-N 3.12Å; L185-L375 HydrophobicContact CD1-CB 4.15Å; L185-L375 HydrophobicContact CD1-CD2 3.9Å; L185-L375 HydrophobicContact CD1-CG 4.13Å
186	A	88.1	Confident	87.9	Confident	6 Å²	6	14 Å²	14	5%	0.05	8%	0.083	C	C	.	.			trans	-107.1	22	-174.7	0	0	0	0	0	113.5	I184 T318 L374 L375 R376	I184-A186 HydrophobicContact CG2-CB 4.19Å; I184-A186 PolarHBondContact O-N 3.01Å; A186-T318 HydrophobicContact CB-CG2 3.57Å; A186-L374 HydrophobicContact CB-CD2 4.13Å; A186-L374 HydrophobicContact CB-CG 4.21Å; A186-L375 CarbonylContact C-O 3.5Å; A186-L375 WeakPolarHBondContact CA-O 3.5Å; A186-L375 PolarHBondContact N-O 3.09Å; A186-R376 HydrophobicContact CB-CB 4.06Å; A186-R376 VanDerWaalsContact O-CG 3.31Å; A186-R376 WeakPolarHBondContact O-CG 3.45Å
187	D	87.9	Confident	88.3	Confident	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.081	C	C	.	.	P	Polyproline II helix	trans	-48.3	147.9	167.1	-81.1	-18.4	0	0	0	112.4	L191 K193 Q196 L375 R377	D187-L191 HydrophobicContact CB-CB 4.25Å; D187-L191 HydrophobicContact CB-CD1 4.13Å; D187-K193 HydrophobicContact CB-CD 4.12Å; D187-K193 HydrophobicContact CB-CG 3.91Å; D187-K193 PolarHBondContact O-NZ 2.99Å; D187-Q196 PolarHBondContact OD2-NE2 3.08Å; D187-L375 PolarHBondContact N-O 2.9Å; D187-R377 IonicContact OD1-CZ 3.66Å; D187-R377 PolarHBondContact OD1-N 3.3Å; D187-R377 IonicContact OD1-NE 3.84Å; D187-R377 PolarHBondContact OD1-NE 3.26Å; D187-R377 IonicContact OD1-NH2 2.69Å; D187-R377 PolarHBondContact OD1-NH2 3.03Å; D187-R377 IonicContact OD2-CZ 2.71Å; D187-R377 IonicContact OD2-NE 2.66Å; D187-R377 IonicContact OD2-NH2 2.64Å; D187-R377 PolarHBondContact OD2-NH2 2.89Å
188	E	82.3	Confident	88.6	Confident	50 Å²	50	13 Å²	13	23%	0.234	8%	0.078	C	C	.	.	P	Polyproline II helix	trans	-53.7	153.3	173.9	-160.1	-177.2	146.1	0	0	113	G190 L191 R377 I378 K379	E188-G190 PolarHBondContact O-N 3.24Å; E188-L191 HydrophobicContact CB-CD1 3.97Å; E188-L191 HydrophobicContact CB-CG 4.36Å; E188-L191 PolarHBondContact O-N 2.88Å; E188-R377 PolarHBondContact N-O 3.02Å; E188-R377 VanDerWaalsContact N-O 3.09Å; E188-I378 VanDerWaalsContact OE2-CG2 3.27Å; E188-I378 WeakPolarHBondContact OE2-CG2 3.38Å; E188-K379 HydrophobicContact CB-CG 4.4Å; E188-K379 HydrophobicContact CG-CG 4.35Å; E188-K379 WeakPolarHBondContact OE1-CD 3.34Å; E188-K379 WeakPolarHBondContact OE1-CE 3.43Å; E188-K379 IonicContact OE1-NZ 2.69Å; E188-K379 PolarHBondContact OE1-NZ 3.24Å; E188-K379 WeakPolarHBondContact OE2-CG 3.33Å; E188-K379 PolarHBondContact OE2-N 2.92Å
189	M	82.1	Confident	89.1	Confident	22 Å²	22	11.2 Å²	11.2	11%	0.108	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	136.3	176.8	-57.7	-153.9	86.1	0	0	111.2	E291 K379 Q570 D573	M189-E291 WeakPolarHBondContact CE-OE1 3.44Å; M189-K379 WeakPolarHBondContact O-CE 3.27Å; M189-K379 PolarHBondContact O-NZ 3.45Å; M189-Q570 HydrophobicContact CE-CG 4.32Å; M189-Q570 HydrophobicContact SD-CB 4.24Å; M189-Q570 HydrophobicContact SD-CG 3.8Å; M189-D573 HydrophobicContact CB-CB 4.42Å
190	G	77.7	Confident	89.7	Confident	23 Å²	23	9.1 Å²	9.1	24%	0.237	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.4	-9.8	179.3	0	0	0	0	0	115.9	E188 G192	E188-G190 PolarHBondContact O-N 3.24Å; G190-G192 PolarHBondContact O-N 3.42Å; G190-G192 VanDerWaalsContact O-N 3.13Å
191	L	85.7	Confident	90.3	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	6%	0.059	C	C	.	.	S	Bend	trans	-73	6.1	175.8	-70.4	-178.2	0	0	0	115.1	Y165 Q166 D187 E188 K379 V382 E383 I578	Y165-L191 HydrophobicContact CE2-CB 4.04Å; Y165-L191 HydrophobicContact CE2-CD2 4.26Å; Y165-L191 WeakPolarHBondContact CE2-O 3.47Å; Y165-L191 PolarHBondContact OH-O 3.12Å; Q166-L191 PolarHBondContact NE2-O 3.12Å; D187-L191 HydrophobicContact CB-CB 4.25Å; D187-L191 HydrophobicContact CB-CD1 4.13Å; E188-L191 HydrophobicContact CB-CD1 3.97Å; E188-L191 HydrophobicContact CB-CG 4.36Å; E188-L191 PolarHBondContact O-N 2.88Å; L191-K379 HydrophobicContact CD2-CG 3.92Å; L191-K379 HydrophobicContact CG-CG 4.19Å; L191-V382 HydrophobicContact CD1-CG2 3.94Å; L191-V382 HydrophobicContact CD2-CG2 3.61Å; L191-V382 HydrophobicContact CG-CG2 4.46Å; L191-E383 HydrophobicContact CD2-CB 4.43Å; L191-I578 HydrophobicContact CD2-CD1 4.19Å
192	G	88.8	Confident	90.6	Very high	23 Å²	23	9.1 Å²	9.1	24%	0.237	6%	0.059	C	C	.	.			trans	79.2	37.3	174.1	0	0	0	0	0	115.1	G190 T194 L195 Q196	G190-G192 PolarHBondContact O-N 3.42Å; G190-G192 VanDerWaalsContact O-N 3.13Å; G192-T194 PolarHBondContact O-N 3.14Å; G192-L195 PolarHBondContact O-N 2.87Å; G192-L195 VanDerWaalsContact O-N 3.08Å; G192-Q196 PolarHBondContact O-N 2.89Å; G192-Q196 VanDerWaalsContact O-N 3.12Å
193	K	92.8	Very high	90.7	Very high	18 Å²	18	8.8 Å²	8.8	8%	0.078	6%	0.057	C	C	.	.	H	α-helix	trans	-51.3	-38.7	172.9	-69.2	-164.3	-73.3	-93.7	0	113.3	L185 D187 Q196 T197 L317 T318	L185-K193 HydrophobicContact CB-CD 4.38Å; L185-K193 HydrophobicContact CD2-CB 3.87Å; L185-K193 HydrophobicContact CD2-CD 4.18Å; L185-K193 HydrophobicContact CD2-CG 3.78Å; L185-K193 HydrophobicContact CG-CB 4.49Å; L185-K193 HydrophobicContact CG-CD 3.87Å; L185-K193 HydrophobicContact CG-CG 3.9Å; L185-K193 WeakPolarHBondContact O-CD 3.46Å; D187-K193 HydrophobicContact CB-CD 4.12Å; D187-K193 HydrophobicContact CB-CG 3.91Å; D187-K193 PolarHBondContact O-NZ 2.99Å; K193-Q196 PolarHBondContact O-N 3.46Å; K193-T197 WeakPolarHBondContact O-CB 3.45Å; K193-T197 PolarHBondContact O-N 3.4Å; K193-T197 PolarHBondContact O-OG1 3.15Å; K193-L317 HydrophobicContact CD-CB 4.46Å; K193-T318 VanDerWaalsContact CE-O 3.26Å; K193-T318 WeakPolarHBondContact CE-O 3.36Å; K193-T318 PolarHBondContact NZ-O 2.87Å
194	T	93.9	Very high	90.8	Very high	22 Å²	22	8.8 Å²	8.8	14%	0.135	6%	0.057	C	C	.	.	H	α-helix	trans	-57	-48.5	174.8	-52.3	0	0	0	0	111.8	G192 T197 I198 W226 E229	G192-T194 PolarHBondContact O-N 3.14Å; T194-T197 PolarHBondContact O-N 3.03Å; T194-I198 HydrophobicContact CG2-CD1 3.74Å; T194-I198 VanDerWaalsContact O-CG1 3.26Å; T194-I198 WeakPolarHBondContact O-CG1 3.41Å; T194-I198 PolarHBondContact O-N 2.98Å; T194-W226 HydrophobicContact CG2-CD2 3.79Å; T194-W226 HydrophobicContact CG2-CE3 3.77Å; T194-W226 HydrophobicContact CG2-CG 4.44Å; T194-W226 HydrophobicContact CG2-CH2 4.08Å; T194-W226 HydrophobicContact CG2-CZ2 4.09Å; T194-W226 HydrophobicContact CG2-CZ3 3.92Å; T194-E229 HydrophobicContact CG2-CB 4.02Å; T194-E229 HydrophobicContact CG2-CG 4.15Å
195	L	94.3	Very high	90.9	Very high	11 Å²	11	11 Å²	11	6%	0.058	7%	0.066	C	C	.	.	H	α-helix	trans	-64.5	-44.2	176.9	175.6	55.9	0	0	0	112.1	V157 M162 G192 T197 I198 A199 W233	V157-L195 HydrophobicContact CG1-CD1 4.41Å; M162-L195 HydrophobicContact CE-CG 4.45Å; M162-L195 HydrophobicContact CG-CD1 4.41Å; M162-L195 HydrophobicContact CG-CD2 4.14Å; M162-L195 HydrophobicContact CG-CG 4.25Å; G192-L195 PolarHBondContact O-N 2.87Å; G192-L195 VanDerWaalsContact O-N 3.08Å; L195-T197 PolarHBondContact O-N 2.96Å; L195-I198 PolarHBondContact O-N 3.49Å; L195-A199 VanDerWaalsContact O-CB 3.29Å; L195-A199 WeakPolarHBondContact O-CB 3.48Å; L195-A199 PolarHBondContact O-N 3.26Å; L195-W233 HydrophobicContact CD1-CB 3.97Å; L195-W233 HydrophobicContact CD1-CD2 3.65Å; L195-W233 HydrophobicContact CD1-CE3 4.05Å; L195-W233 HydrophobicContact CD1-CG 3.58Å; L195-W233 HydrophobicContact CD2-CD2 4.44Å; L195-W233 HydrophobicContact CD2-CH2 4.43Å; L195-W233 HydrophobicContact CD2-CZ2 4.31Å
196	Q	94.8	Very high	90.9	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-57.3	-38.5	175.3	-67.2	177.2	84.5	0	0	111.6	Q166 L173 L185 D187 G192 K193 L200	Q166-Q196 HydrophobicContact CB-CG 3.94Å; Q166-Q196 HydrophobicContact CG-CG 4.27Å; L173-Q196 HydrophobicContact CD1-CB 4.34Å; L185-Q196 HydrophobicContact CD2-CB 4.08Å; D187-Q196 PolarHBondContact OD2-NE2 3.08Å; G192-Q196 PolarHBondContact O-N 2.89Å; G192-Q196 VanDerWaalsContact O-N 3.12Å; K193-Q196 PolarHBondContact O-N 3.46Å; Q196-L200 PolarHBondContact O-N 3.22Å; Q196-L200 VanDerWaalsContact O-N 3.17Å
197	T	96.1	Very high	90.9	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-74.5	-43.3	178.6	-52.5	0	0	0	0	113	K193 T194 L195 A199 L200 L201 W226 V288 L315	K193-T197 WeakPolarHBondContact O-CB 3.45Å; K193-T197 PolarHBondContact O-N 3.4Å; K193-T197 PolarHBondContact O-OG1 3.15Å; T194-T197 PolarHBondContact O-N 3.03Å; L195-T197 PolarHBondContact O-N 2.96Å; T197-A199 VanDerWaalsContact C-N 3.28Å; T197-A199 PolarHBondContact O-N 3.42Å; T197-L200 WeakPolarHBondContact O-CB 3.16Å; T197-L200 PolarHBondContact O-N 2.8Å; T197-L201 PolarHBondContact O-N 3.16Å; T197-L201 VanDerWaalsContact O-N 3.13Å; T197-W226 HydrophobicContact CG2-CH2 3.96Å; T197-W226 HydrophobicContact CG2-CZ3 4.15Å; T197-V288 HydrophobicContact CG2-CB 4.49Å; T197-V288 HydrophobicContact CG2-CG1 3.84Å; T197-V288 HydrophobicContact CG2-CG2 3.82Å; T197-L315 HydrophobicContact CG2-CD2 3.9Å
198	I	96.1	Very high	90.8	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-64.2	-37.3	176.7	-67.4	168.4	0	0	0	110.2	T194 L195 L201 G202 W226 E229 F230 W233 V234	T194-I198 HydrophobicContact CG2-CD1 3.74Å; T194-I198 VanDerWaalsContact O-CG1 3.26Å; T194-I198 WeakPolarHBondContact O-CG1 3.41Å; T194-I198 PolarHBondContact O-N 2.98Å; L195-I198 PolarHBondContact O-N 3.49Å; I198-L201 PolarHBondContact O-N 3.17Å; I198-G202 PolarHBondContact O-N 3.08Å; I198-W226 HydrophobicContact CD1-CE3 4.37Å; I198-W226 HydrophobicContact CG1-CE3 4.34Å; I198-W226 HydrophobicContact CG1-CZ3 4.09Å; I198-E229 HydrophobicContact CD1-CB 3.63Å; I198-F230 HydrophobicContact CB-CD1 4.46Å; I198-F230 HydrophobicContact CB-CE1 4.3Å; I198-F230 HydrophobicContact CD1-CD1 4.28Å; I198-F230 HydrophobicContact CD1-CD2 4.48Å; I198-F230 HydrophobicContact CD1-CE1 4.49Å; I198-F230 HydrophobicContact CD1-CG 4.25Å; I198-F230 HydrophobicContact CG1-CD1 3.91Å; I198-F230 HydrophobicContact CG1-CE1 3.71Å; I198-F230 HydrophobicContact CG1-CE2 4.39Å; I198-F230 HydrophobicContact CG1-CG 4.33Å; I198-F230 HydrophobicContact CG1-CZ 3.94Å; I198-F230 HydrophobicContact CG2-CD1 3.87Å; I198-F230 HydrophobicContact CG2-CE1 4.09Å; I198-W233 HydrophobicContact CG2-CB 4.38Å; I198-V234 HydrophobicContact CG2-CB 4.03Å; I198-V234 HydrophobicContact CG2-CG2 3.78Å
199	A	94.9	Very high	91.1	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-64.6	-39.3	173.8	0	0	0	0	0	112.4	Y156 V157 M162 L170 L195 T197 L201 G202 Y203	Y156-A199 HydrophobicContact CE2-CB 4.47Å; Y156-A199 PolarHBondContact OH-O 3.39Å; Y156-A199 VanDerWaalsContact OH-O 3.12Å; V157-A199 HydrophobicContact CG2-CB 4.49Å; M162-A199 HydrophobicContact CE-CB 3.85Å; M162-A199 HydrophobicContact SD-CB 3.68Å; L170-A199 HydrophobicContact CD1-CB 3.94Å; L170-A199 HydrophobicContact CD2-CB 3.99Å; L195-A199 VanDerWaalsContact O-CB 3.29Å; L195-A199 WeakPolarHBondContact O-CB 3.48Å; L195-A199 PolarHBondContact O-N 3.26Å; T197-A199 VanDerWaalsContact C-N 3.28Å; T197-A199 PolarHBondContact O-N 3.42Å; A199-L201 PolarHBondContact O-N 3.11Å; A199-G202 CarbonylContact O-C 3.53Å; A199-G202 WeakPolarHBondContact O-CA 3.46Å; A199-G202 PolarHBondContact O-N 3.27Å; A199-G202 VanDerWaalsContact O-N 3.15Å; A199-Y203 PolarHBondContact O-N 2.93Å
200	L	95.2	Very high	91.5	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.01	15%	0.146	C	C	.	.	H	α-helix	trans	-59.5	-44.1	172.6	178.7	68.6	0	0	0	111.9	L170 L173 I174 Q196 T197 G202 Y203 M204 Y286 L315	L170-L200 HydrophobicContact CD1-CB 4.17Å; L173-L200 HydrophobicContact CB-CD1 3.95Å; L173-L200 HydrophobicContact CB-CD2 4.05Å; L173-L200 HydrophobicContact CB-CG 4.41Å; L173-L200 HydrophobicContact CD1-CB 4.37Å; L173-L200 HydrophobicContact CD1-CD2 4.38Å; I174-L200 HydrophobicContact CG1-CD1 4.12Å; Q196-L200 PolarHBondContact O-N 3.22Å; Q196-L200 VanDerWaalsContact O-N 3.17Å; T197-L200 WeakPolarHBondContact O-CB 3.16Å; T197-L200 PolarHBondContact O-N 2.8Å; L200-G202 VanDerWaalsContact C-N 3.31Å; L200-G202 PolarHBondContact O-N 3.32Å; L200-Y203 WeakPolarHBondContact O-CB 3.39Å; L200-Y203 PolarHBondContact O-N 3.07Å; L200-M204 WeakPolarHBondContact O-CG 3.32Å; L200-M204 PolarHBondContact O-N 2.92Å; L200-Y286 HydrophobicContact CD2-CE1 4.01Å; L200-L315 HydrophobicContact CD2-CD2 4.18Å
201	L	95.3	Very high	91.9	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-68.2	-31.6	175.9	-60.5	-179.3	0	0	0	112	T197 I198 A199 M204 K205 H214 V216 F230 L237 V264 Y286	T197-L201 PolarHBondContact O-N 3.16Å; T197-L201 VanDerWaalsContact O-N 3.13Å; I198-L201 PolarHBondContact O-N 3.17Å; A199-L201 PolarHBondContact O-N 3.11Å; L201-M204 PolarHBondContact O-N 3.37Å; L201-K205 PolarHBondContact O-N 2.79Å; L201-K205 VanDerWaalsContact O-N 3.15Å; L201-H214 HydrophobicContact CD1-CB 4.45Å; L201-H214 HydrophobicContact CD2-CB 4.21Å; L201-V216 HydrophobicContact CD1-CG2 4.45Å; L201-F230 HydrophobicContact CD1-CE1 4.02Å; L201-F230 HydrophobicContact CD1-CZ 3.92Å; L201-L237 HydrophobicContact CB-CD1 3.94Å; L201-V264 HydrophobicContact CD1-CG1 4.36Å; L201-V264 HydrophobicContact CD1-CG2 4.17Å; L201-Y286 HydrophobicContact CD2-CD2 4.39Å; L201-Y286 HydrophobicContact CD2-CG 4.38Å
202	G	93.4	Very high	92.1	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-63.3	-44	169.8	0	0	0	0	0	112.6	I198 A199 L200 K205 H206	I198-G202 PolarHBondContact O-N 3.08Å; A199-G202 CarbonylContact O-C 3.53Å; A199-G202 WeakPolarHBondContact O-CA 3.46Å; A199-G202 PolarHBondContact O-N 3.27Å; A199-G202 VanDerWaalsContact O-N 3.15Å; L200-G202 VanDerWaalsContact C-N 3.31Å; L200-G202 PolarHBondContact O-N 3.32Å; G202-K205 PolarHBondContact O-N 3.03Å; G202-H206 WeakPolarHBondContact O-CB 3.13Å; G202-H206 PolarHBondContact O-CD2 2.7Å; G202-H206 VanDerWaalsContact O-CD2 3.24Å; G202-H206 PolarHBondContact O-N 3.19Å
203	Y	93.5	Very high	92.3	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-59.2	-45.9	172.8	170.3	-102.7	0	0	0	112	T148 F150 I174 Y177 E178 A199 L200 K205 H206 Y207 R208	T148-Y203 WeakPolarHBondContact CB-OH 3.24Å; T148-Y203 HydrophobicContact CG2-CE2 3.75Å; T148-Y203 PolarHBondContact OG1-OH 3.48Å; F150-Y203 AromaticContact CE2-CD2 3.68Å; F150-Y203 HydrophobicContact CE2-CD2 3.68Å; F150-Y203 HydrophobicContact CE2-CE2 4.16Å; F150-Y203 AromaticContact CZ-CD2 3.98Å; F150-Y203 HydrophobicContact CZ-CD2 3.98Å; I174-Y203 HydrophobicContact CB-CE1 4.41Å; I174-Y203 HydrophobicContact CD1-CD1 4.11Å; I174-Y203 HydrophobicContact CD1-CD2 3.88Å; I174-Y203 HydrophobicContact CD1-CE1 4.34Å; I174-Y203 HydrophobicContact CD1-CE2 4.12Å; I174-Y203 HydrophobicContact CD1-CG 3.86Å; I174-Y203 HydrophobicContact CG1-CD1 3.74Å; I174-Y203 HydrophobicContact CG1-CD2 4.41Å; I174-Y203 HydrophobicContact CG1-CE1 3.89Å; I174-Y203 HydrophobicContact CG1-CG 4.01Å; I174-Y203 HydrophobicContact CG2-CE1 3.85Å; I174-Y203 HydrophobicContact CG2-CE2 4.45Å; Y177-Y203 HydrophobicContact CD1-CE1 4.28Å; E178-Y203 PolarHBondContact OE1-OH 3.16Å; E178-Y203 VanDerWaalsContact OE1-OH 3.12Å; A199-Y203 PolarHBondContact O-N 2.93Å; L200-Y203 WeakPolarHBondContact O-CB 3.39Å; L200-Y203 PolarHBondContact O-N 3.07Å; Y203-K205 VanDerWaalsContact C-N 3.31Å; Y203-K205 PolarHBondContact O-N 3.11Å; Y203-H206 PolarHBondContact O-N 3.13Å; Y203-Y207 HydrophobicContact CD2-CD2 4.09Å; Y203-Y207 AromaticContact CD2-CG 3.84Å; Y203-Y207 HydrophobicContact CD2-CG 3.84Å; Y203-Y207 VanDerWaalsContact CE2-CB 3.45Å; Y203-Y207 HydrophobicContact CE2-CD1 4.43Å; Y203-Y207 AromaticContact CE2-CG 3.96Å; Y203-Y207 HydrophobicContact CE2-CG 3.96Å; Y203-Y207 WeakPolarHBondContact O-CB 3.21Å; Y203-Y207 PolarHBondContact O-N 2.59Å; Y203-R208 HydrophobicContact CD1-CG 4.42Å; Y203-R208 HydrophobicContact CE1-CG 3.7Å; Y203-R208 PolarHBondContact O-N 2.87Å; Y203-R208 PolarHBondContact OH-NE 2.93Å; Y203-R208 PolarHBondContact OH-NH2 3.19Å
204	M	92.3	Very high	92.4	Very high	3 Å²	3	30.6 Å²	30.6	2%	0.015	15%	0.154	C	C	.	.	H	α-helix	trans	-55	-46.7	176.6	-71	-64.2	-70.6	0	0	111.7	Y177 L200 L201 R208 N209 I210 Y286	Y177-M204 HydrophobicContact CD1-SD 4.07Å; Y177-M204 HydrophobicContact CD2-CE 4.26Å; Y177-M204 HydrophobicContact CD2-SD 3.92Å; Y177-M204 HydrophobicContact CE1-CE 4.45Å; Y177-M204 HydrophobicContact CE1-SD 3.82Å; Y177-M204 HydrophobicContact CE2-CE 3.55Å; Y177-M204 HydrophobicContact CE2-SD 3.67Å; Y177-M204 HydrophobicContact CG-SD 4.12Å; L200-M204 WeakPolarHBondContact O-CG 3.32Å; L200-M204 PolarHBondContact O-N 2.92Å; L201-M204 PolarHBondContact O-N 3.37Å; M204-R208 CarbonylContact O-C 3.59Å; M204-R208 PolarHBondContact O-N 3.43Å; M204-N209 PolarHBondContact O-N 3.48Å; M204-I210 CarbonylContact C-O 3.57Å; M204-I210 HydrophobicContact CE-CB 3.98Å; M204-I210 HydrophobicContact CE-CD1 3.87Å; M204-I210 HydrophobicContact CE-CG2 3.81Å; M204-I210 PolarHBondContact O-N 3.15Å; M204-Y286 HydrophobicContact CE-CD2 4.34Å; M204-Y286 HydrophobicContact CE-CE2 4.12Å; M204-Y286 HydrophobicContact CG-CD2 4.46Å; M204-Y286 HydrophobicContact CG-CE2 4.22Å; M204-Y286 HydrophobicContact SD-CE2 4.07Å
205	K	92.5	Very high	92.5	Very high	50 Å²	50	29.6 Å²	29.6	22%	0.217	15%	0.148	C	C	.	.	H	α-helix	trans	-69.5	-50.8	178.1	-174	161.3	-174	173.6	0	113.2	L201 G202 Y203 N209 I210 P211 S236 L237 D263	L201-K205 PolarHBondContact O-N 2.79Å; L201-K205 VanDerWaalsContact O-N 3.15Å; G202-K205 PolarHBondContact O-N 3.03Å; Y203-K205 VanDerWaalsContact C-N 3.31Å; Y203-K205 PolarHBondContact O-N 3.11Å; K205-N209 WeakPolarHBondContact O-CA 3.12Å; K205-I210 PolarHBondContact N-O 3.22Å; K205-P211 HydrophobicContact CD-CB 3.92Å; K205-P211 HydrophobicContact CG-CB 4.02Å; K205-S236 PolarHBondContact NZ-O 2.97Å; K205-L237 HydrophobicContact CB-CD2 4.15Å; K205-L237 HydrophobicContact CD-CD2 3.78Å; K205-D263 IonicContact NZ-OD1 3.61Å; K205-D263 PolarHBondContact NZ-OD1 2.99Å; K205-D263 IonicContact NZ-OD2 3.37Å; K205-D263 PolarHBondContact NZ-OD2 2.76Å
206	H	90.6	Very high	92.6	Very high	90 Å²	90	29 Å²	29	42%	0.417	15%	0.145	S	C	.	.	H	α-helix	trans	-86.9	-28.6	-167.9	-70.7	-70.5	0	0	0	115.3	Y156 G202 Y203 S236	Y156-H206 WeakPolarHBondContact CB-CD2 3.48Å; Y156-H206 HydrophobicContact CD1-CB 3.96Å; Y156-H206 AromaticContact CD1-CD2 3.92Å; Y156-H206 AromaticContact CG-CD2 3.61Å; G202-H206 WeakPolarHBondContact O-CB 3.13Å; G202-H206 PolarHBondContact O-CD2 2.7Å; G202-H206 VanDerWaalsContact O-CD2 3.24Å; G202-H206 PolarHBondContact O-N 3.19Å; Y203-H206 PolarHBondContact O-N 3.13Å; H206-S236 PolarHBondContact NE2-OG 3.24Å
207	Y	88.8	Confident	92.5	Very high	111 Å²	111	29 Å²	29	44%	0.435	15%	0.145	S	C	.	.	H	α-helix	trans	-111.8	-27.2	-176.3	-79.3	-100.6	0	0	0	113.5	T148 F150 Y156 Y203	T148-Y207 HydrophobicContact CG2-CD1 3.78Å; T148-Y207 HydrophobicContact CG2-CE1 4.15Å; F150-Y207 HydrophobicContact CE1-CE1 4.28Å; F150-Y207 AromaticContact CE1-CE2 3.9Å; F150-Y207 HydrophobicContact CE1-CE2 3.9Å; F150-Y207 AromaticContact CE1-CZ 3.68Å; F150-Y207 HydrophobicContact CZ-CD1 4.39Å; F150-Y207 AromaticContact CZ-CD2 3.97Å; F150-Y207 HydrophobicContact CZ-CD2 3.97Å; F150-Y207 HydrophobicContact CZ-CE1 4.08Å; F150-Y207 AromaticContact CZ-CE2 3.64Å; F150-Y207 HydrophobicContact CZ-CE2 3.64Å; F150-Y207 HydrophobicContact CZ-CG 4.34Å; F150-Y207 AromaticContact CZ-CZ 3.7Å; Y156-Y207 HydrophobicContact CD1-CD2 4.24Å; Y156-Y207 AromaticContact CD1-CE2 3.91Å; Y156-Y207 HydrophobicContact CD1-CE2 3.91Å; Y156-Y207 AromaticContact CE1-CD2 3.85Å; Y156-Y207 HydrophobicContact CE1-CD2 3.85Å; Y156-Y207 AromaticContact CE1-CE2 3.68Å; Y156-Y207 HydrophobicContact CE1-CE2 3.68Å; Y203-Y207 HydrophobicContact CD2-CD2 4.09Å; Y203-Y207 AromaticContact CD2-CG 3.84Å; Y203-Y207 HydrophobicContact CD2-CG 3.84Å; Y203-Y207 VanDerWaalsContact CE2-CB 3.45Å; Y203-Y207 HydrophobicContact CE2-CD1 4.43Å; Y203-Y207 AromaticContact CE2-CG 3.96Å; Y203-Y207 HydrophobicContact CE2-CG 3.96Å; Y203-Y207 WeakPolarHBondContact O-CB 3.21Å; Y203-Y207 PolarHBondContact O-N 2.59Å
208	R	86.9	Confident	92.4	Very high	76 Å²	76	29 Å²	29	29%	0.287	15%	0.145	S	C	.	.	S	Bend	trans	-108.7	1.7	178.3	-63.4	-65	-170.6	166.8	-5	113.7	Y177 E178 Y203 M204 I210	Y177-R208 HydrophobicContact CE1-CG 4.04Å; E178-R208 IonicContact OE1-CZ 3.6Å; E178-R208 IonicContact OE1-NH2 3.56Å; E178-R208 PolarHBondContact OE1-NH2 3.21Å; Y203-R208 HydrophobicContact CD1-CG 4.42Å; Y203-R208 HydrophobicContact CE1-CG 3.7Å; Y203-R208 PolarHBondContact O-N 2.87Å; Y203-R208 PolarHBondContact OH-NE 2.93Å; Y203-R208 PolarHBondContact OH-NH2 3.19Å; M204-R208 CarbonylContact O-C 3.59Å; M204-R208 PolarHBondContact O-N 3.43Å; R208-I210 HydrophobicContact CB-CD1 4.32Å; R208-I210 WeakPolarHBondContact O-CG1 3.38Å; R208-I210 PolarHBondContact O-N 3.44Å
209	N	88.5	Confident	91.9	Very high	142 Å²	142	30 Å²	30	76%	0.759	15%	0.151	S	C	*	.			trans	50.9	35.6	-178.9	-160.4	21.7	0	0	0	114.3	M204 K205 P211	M204-N209 PolarHBondContact O-N 3.48Å; K205-N209 WeakPolarHBondContact O-CA 3.12Å; N209-P211 WeakPolarHBondContact O-CD 3.41Å
210	I	89.2	Confident	91.4	Very high	33 Å²	33	34.7 Å²	34.7	17%	0.169	17%	0.171	C	C	.	.			trans	-117.3	92.7	177	-64.9	160	0	0	0	107.3	Y177 M204 K205 R208 R285	Y177-I210 WeakPolarHBondContact OH-CD1 3.33Å; M204-I210 CarbonylContact C-O 3.57Å; M204-I210 HydrophobicContact CE-CB 3.98Å; M204-I210 HydrophobicContact CE-CD1 3.87Å; M204-I210 HydrophobicContact CE-CG2 3.81Å; M204-I210 PolarHBondContact O-N 3.15Å; K205-I210 PolarHBondContact N-O 3.22Å; R208-I210 HydrophobicContact CB-CD1 4.32Å; R208-I210 WeakPolarHBondContact O-CG1 3.38Å; R208-I210 PolarHBondContact O-N 3.44Å; I210-R285 HydrophobicContact CG2-CB 4.26Å; I210-R285 HydrophobicContact CG2-CG 3.9Å
211	P	86.6	Confident	90.6	Very high	52 Å²	52	35.3 Å²	35.3	34%	0.338	18%	0.176	S	C	.	.			trans	-77	-23.2	-177.8	29.5	-35.1	0	0	0	113.8	K205 N209 H214 D263	K205-P211 HydrophobicContact CD-CB 3.92Å; K205-P211 HydrophobicContact CG-CB 4.02Å; N209-P211 WeakPolarHBondContact O-CD 3.41Å; P211-H214 PolarHBondContact O-CD2 2.82Å; P211-H214 VanDerWaalsContact O-CD2 3.29Å; P211-H214 PolarHBondContact O-NE2 3.04Å; P211-D263 VanDerWaalsContact O-CB 3.27Å; P211-D263 WeakPolarHBondContact O-CB 3.21Å
212	G	88.8	Confident	90.1	Very high	17 Å²	17	35.7 Å²	35.7	18%	0.175	18%	0.178	C	C	.	.			trans	170.7	-166.8	-174.7	0	0	0	0	0	114.5	R285	G212-R285 VanDerWaalsContact O-CG 3.32Å; G212-R285 WeakPolarHBondContact O-CG 3.29Å
213	P	94	Very high	89.9	Confident	32 Å²	32	35.8 Å²	35.8	21%	0.208	18%	0.178	C	C	.	.			cis	-77.6	138.8	-7.5	31.1	-33.5	0	0	0	111.7	W262 N283 W284 R285	P213-W262 HydrophobicContact CB-CH2 3.53Å; P213-W262 HydrophobicContact CB-CZ2 4.42Å; P213-W262 HydrophobicContact CB-CZ3 3.67Å; P213-N283 WeakPolarHBondContact CG-O 2.96Å; P213-W284 HydrophobicContact CB-CE3 4.01Å; P213-W284 HydrophobicContact CB-CZ3 4Å; P213-W284 HydrophobicContact CG-CE3 4.41Å; P213-R285 PolarHBondContact O-N 3.5Å
214	H	95.8	Very high	89.5	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	139.7	175.1	-57.1	-70.9	0	0	0	111.2	L201 P211 D263 V264 C265 Y286	L201-H214 HydrophobicContact CD1-CB 4.45Å; L201-H214 HydrophobicContact CD2-CB 4.21Å; P211-H214 PolarHBondContact O-CD2 2.82Å; P211-H214 VanDerWaalsContact O-CD2 3.29Å; P211-H214 PolarHBondContact O-NE2 3.04Å; H214-D263 PolarHBondContact N-O 3.41Å; H214-V264 HydrophobicContact CB-CG1 4.31Å; H214-V264 HydrophobicContact CB-CG2 4.27Å; H214-V264 CarbonylContact O-C 3.6Å; H214-V264 WeakPolarHBondContact O-CA 3.39Å; H214-C265 PolarHBondContact O-N 2.71Å; H214-Y286 PolarHBondContact ND1-N 2.84Å
215	M	95.2	Very high	89.2	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	133.6	176.2	-177.2	152.2	64.5	0	0	110.8	L217 C265 T267 L272 F279 W284 Y286 L287 V288 F309	M215-L217 HydrophobicContact CE-CD2 4.38Å; M215-L217 HydrophobicContact CG-CD2 3.61Å; M215-L217 HydrophobicContact CG-CG 4.23Å; M215-L217 HydrophobicContact SD-CD2 3.77Å; M215-C265 WeakPolarHBondContact CA-O 3.49Å; M215-T267 HydrophobicContact CG-CG2 4.49Å; M215-T267 HydrophobicContact SD-CG2 4.38Å; M215-L272 HydrophobicContact CE-CD1 4.25Å; M215-L272 HydrophobicContact SD-CD1 4.28Å; M215-F279 HydrophobicContact SD-CD1 3.82Å; M215-F279 HydrophobicContact SD-CE1 4.16Å; M215-F279 HydrophobicContact SD-CG 4.45Å; M215-W284 HydrophobicContact CB-CD2 3.85Å; M215-W284 HydrophobicContact CB-CE3 3.5Å; M215-W284 HydrophobicContact CB-CH2 4.24Å; M215-W284 HydrophobicContact CB-CZ3 3.68Å; M215-W284 HydrophobicContact CE-CD2 4.44Å; M215-W284 HydrophobicContact SD-CH2 4.37Å; M215-W284 HydrophobicContact SD-CZ2 4.15Å; M215-Y286 PolarHBondContact N-O 3.13Å; M215-L287 HydrophobicContact CB-CD1 4.19Å; M215-L287 HydrophobicContact CE-CD1 3.79Å; M215-L287 HydrophobicContact CG-CD1 4.09Å; M215-V288 PolarHBondContact O-N 3.22Å; M215-F309 HydrophobicContact CE-CD2 3.9Å; M215-F309 HydrophobicContact CE-CE2 4.22Å; M215-F309 HydrophobicContact CE-CG 4.31Å
216	V	96.1	Very high	89.3	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	108.4	176.1	-170.3	0	0	0	0	108.9	L201 V218 W226 F230 V264 C265 V266 T267 V288	L201-V216 HydrophobicContact CD1-CG2 4.45Å; V216-V218 HydrophobicContact CG1-CG1 3.69Å; V216-W226 HydrophobicContact CG1-CD2 4.13Å; V216-W226 HydrophobicContact CG1-CE3 3.91Å; V216-W226 HydrophobicContact CG1-CH2 4.23Å; V216-W226 HydrophobicContact CG1-CZ2 4.45Å; V216-W226 HydrophobicContact CG1-CZ3 3.96Å; V216-F230 HydrophobicContact CG2-CE2 4.46Å; V216-F230 HydrophobicContact CG2-CZ 4.25Å; V216-V264 HydrophobicContact CG2-CG1 3.57Å; V216-C265 PolarHBondContact N-O 3.25Å; V216-V266 HydrophobicContact CB-CG1 4.41Å; V216-V266 HydrophobicContact CB-CG2 4.39Å; V216-V266 WeakPolarHBondContact O-CA 3.34Å; V216-T267 PolarHBondContact O-N 3.21Å; V216-V288 HydrophobicContact CB-CB 4.38Å; V216-V288 HydrophobicContact CG1-CB 4.08Å; V216-V288 HydrophobicContact CG1-CG1 4.06Å; V216-V288 HydrophobicContact CG2-CB 4.19Å; V216-V288 HydrophobicContact CG2-CG2 4.37Å
217	L	93.8	Very high	89.4	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	122.4	179	-55	-172.6	0	0	0	109.9	M215 T267 Y269 L272 L287 V288 I289 D290 V306	M215-L217 HydrophobicContact CE-CD2 4.38Å; M215-L217 HydrophobicContact CG-CD2 3.61Å; M215-L217 HydrophobicContact CG-CG 4.23Å; M215-L217 HydrophobicContact SD-CD2 3.77Å; L217-T267 HydrophobicContact CD2-CG2 3.46Å; L217-T267 VanDerWaalsContact CD2-CG2 3.46Å; L217-Y269 HydrophobicContact CB-CD1 4.49Å; L217-Y269 HydrophobicContact CB-CE1 4.11Å; L217-L272 HydrophobicContact CD1-CD1 3.54Å; L217-L272 HydrophobicContact CD2-CD1 3.38Å; L217-L272 HydrophobicContact CG-CD1 4.11Å; L217-L287 HydrophobicContact CD1-CD1 3.82Å; L217-L287 HydrophobicContact CG-CD1 3.79Å; L217-V288 PolarHBondContact N-O 2.73Å; L217-I289 HydrophobicContact CB-CG1 4.39Å; L217-I289 HydrophobicContact CD1-CD1 4.23Å; L217-I289 HydrophobicContact CD1-CG1 4.14Å; L217-I289 HydrophobicContact CG-CG1 4.47Å; L217-D290 PolarHBondContact O-N 3.18Å; L217-V306 HydrophobicContact CD1-CG1 4.16Å; L217-V306 HydrophobicContact CD1-CG2 3.91Å
218	V	92.1	Very high	89.4	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	156.7	-173.3	-49.1	0	0	0	0	112.3	V216 L223 W226 V266 T267 S268 D290	V216-V218 HydrophobicContact CG1-CG1 3.69Å; V218-L223 HydrophobicContact CG2-CB 4.39Å; V218-L223 HydrophobicContact CG2-CD2 3.38Å; V218-L223 HydrophobicContact CG2-CG 3.79Å; V218-W226 HydrophobicContact CG1-CD2 4.25Å; V218-W226 HydrophobicContact CG1-CG 4.02Å; V218-V266 HydrophobicContact CG1-CG1 4.32Å; V218-V266 HydrophobicContact CG2-CG1 4.06Å; V218-T267 PolarHBondContact N-O 2.87Å; V218-S268 WeakPolarHBondContact O-CA 3.41Å; V218-D290 HydrophobicContact CB-CB 4.22Å; V218-D290 HydrophobicContact CG1-CB 3.86Å
219	P	87.5	Confident	89.7	Confident	19 Å²	19	32 Å²	32	12%	0.123	17%	0.17	C	C	.	.			trans	-52.9	139.4	164	-26.8	35.3	0	0	0	111.8	S221 T222 L223 Y269 E291	P219-S221 PolarHBondContact O-N 3.01Å; P219-T222 WeakPolarHBondContact CD-OG1 3.46Å; P219-T222 PolarHBondContact O-N 3.07Å; P219-T222 PolarHBondContact O-OG1 3.48Å; P219-L223 PolarHBondContact O-N 2.66Å; P219-Y269 HydrophobicContact CG-CE2 4.3Å; P219-E291 HydrophobicContact CG-CB 4.01Å; P219-E291 HydrophobicContact CG-CG 4.16Å
220	K	82.9	Confident	90	Very high	100 Å²	100	25.2 Å²	25.2	44%	0.435	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-30.6	-179.4	-171.5	175.1	-170	165.1	0	113.5	L223 E270 H517	K220-L223 HydrophobicContact CG-CD1 4.18Å; K220-L223 WeakPolarHBondContact O-CD1 3.29Å; K220-E270 IonicContact NZ-OE2 3.33Å; K220-E270 PolarHBondContact NZ-OE2 2.63Å; K220-H517 PolarHBondContact O-NE2 2.83Å; K220-H517 VanDerWaalsContact O-NE2 3.15Å
221	S	78.5	Confident	90.2	Very high	15 Å²	15	30.6 Å²	30.6	11%	0.105	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-33	174.8	54	0	0	0	0	115.1	P219 L546	P219-S221 PolarHBondContact O-N 3.01Å; S221-L546 VanDerWaalsContact CB-O 3.24Å; S221-L546 WeakPolarHBondContact CB-O 3.34Å; S221-L546 VanDerWaalsContact OG-CB 3.3Å; S221-L546 WeakPolarHBondContact OG-CB 3.42Å; S221-L546 PolarHBondContact OG-O 3.17Å
222	T	85.6	Confident	90.4	Very high	9 Å²	9	33.8 Å²	33.8	6%	0.055	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-6	-173.9	60	0	0	0	0	113.2	P219 Y224 N225 W226 L546	P219-T222 WeakPolarHBondContact CD-OG1 3.46Å; P219-T222 PolarHBondContact O-N 3.07Å; P219-T222 PolarHBondContact O-OG1 3.48Å; T222-Y224 PolarHBondContact O-N 3.03Å; T222-N225 WeakPolarHBondContact O-CA 3.41Å; T222-N225 WeakPolarHBondContact O-CB 3.46Å; T222-N225 PolarHBondContact O-N 3.36Å; T222-W226 PolarHBondContact O-N 3.12Å; T222-L546 WeakPolarHBondContact CG2-O 3.07Å
223	L	88.6	Confident	90.6	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-43.4	-57.2	174.3	-73.4	170.1	0	0	0	112.5	V218 P219 K220 N225 W226 M227 I243 V266	V218-L223 HydrophobicContact CG2-CB 4.39Å; V218-L223 HydrophobicContact CG2-CD2 3.38Å; V218-L223 HydrophobicContact CG2-CG 3.79Å; P219-L223 PolarHBondContact O-N 2.66Å; K220-L223 HydrophobicContact CG-CD1 4.18Å; K220-L223 WeakPolarHBondContact O-CD1 3.29Å; L223-N225 VanDerWaalsContact C-N 3.35Å; L223-N225 PolarHBondContact O-N 2.89Å; L223-W226 PolarHBondContact O-N 3.28Å; L223-M227 WeakPolarHBondContact O-CG 3.31Å; L223-M227 PolarHBondContact O-N 3.15Å; L223-I243 HydrophobicContact CD1-CD1 3.79Å; L223-V266 HydrophobicContact CD2-CG1 4.08Å
224	Y	84.6	Confident	90.6	Very high	83 Å²	83	32.7 Å²	32.7	33%	0.325	15%	0.148	S	C	.	.	H	α-helix	trans	-69.5	-31.2	-178	-75	-101.6	0	0	0	112.6	T222 N228 H517	T222-Y224 PolarHBondContact O-N 3.03Å; Y224-N228 VanDerWaalsContact O-CB 3.27Å; Y224-N228 WeakPolarHBondContact O-CB 3.43Å; Y224-N228 PolarHBondContact O-N 2.99Å; Y224-N228 PolarHBondContact O-ND2 3.32Å; Y224-H517 AromaticContact CD2-CE1 3.32Å; Y224-H517 WeakPolarHBondContact CD2-CE1 3.22Å; Y224-H517 AromaticContact CD2-NE2 3.57Å; Y224-H517 AromaticContact CE2-CD2 3.96Å; Y224-H517 AromaticContact CE2-CE1 3.52Å; Y224-H517 AromaticContact CE2-NE2 3.44Å; Y224-H517 WeakPolarHBondContact CE2-NE2 3.32Å
225	N	87.8	Confident	90.4	Very high	38 Å²	38	36.5 Å²	36.5	20%	0.203	17%	0.172	C	C	.	.	H	α-helix	trans	-62.9	-48.9	171.3	-172.2	101	0	0	0	110.4	T222 L223 M227 N228 E229	T222-N225 WeakPolarHBondContact O-CA 3.41Å; T222-N225 WeakPolarHBondContact O-CB 3.46Å; T222-N225 PolarHBondContact O-N 3.36Å; L223-N225 VanDerWaalsContact C-N 3.35Å; L223-N225 PolarHBondContact O-N 2.89Å; N225-M227 PolarHBondContact O-N 3.38Å; N225-N228 PolarHBondContact O-N 2.83Å; N225-E229 WeakPolarHBondContact O-CB 3.19Å; N225-E229 WeakPolarHBondContact O-CG 3.18Å; N225-E229 PolarHBondContact O-N 3.12Å
226	W	93.5	Very high	90.2	Very high	1 Å²	1	38.6 Å²	38.6	0%	0.004	19%	0.187	C	C	.	.	H	α-helix	trans	-59.5	-46.8	176.4	-84.8	90.7	0	0	0	112.1	T194 T197 I198 V216 V218 T222 L223 N228 E229 F230 V266 V288 D290 L317	T194-W226 HydrophobicContact CG2-CD2 3.79Å; T194-W226 HydrophobicContact CG2-CE3 3.77Å; T194-W226 HydrophobicContact CG2-CG 4.44Å; T194-W226 HydrophobicContact CG2-CH2 4.08Å; T194-W226 HydrophobicContact CG2-CZ2 4.09Å; T194-W226 HydrophobicContact CG2-CZ3 3.92Å; T197-W226 HydrophobicContact CG2-CH2 3.96Å; T197-W226 HydrophobicContact CG2-CZ3 4.15Å; I198-W226 HydrophobicContact CD1-CE3 4.37Å; I198-W226 HydrophobicContact CG1-CE3 4.34Å; I198-W226 HydrophobicContact CG1-CZ3 4.09Å; V216-W226 HydrophobicContact CG1-CD2 4.13Å; V216-W226 HydrophobicContact CG1-CE3 3.91Å; V216-W226 HydrophobicContact CG1-CH2 4.23Å; V216-W226 HydrophobicContact CG1-CZ2 4.45Å; V216-W226 HydrophobicContact CG1-CZ3 3.96Å; V218-W226 HydrophobicContact CG1-CD2 4.25Å; V218-W226 HydrophobicContact CG1-CG 4.02Å; T222-W226 PolarHBondContact O-N 3.12Å; L223-W226 PolarHBondContact O-N 3.28Å; W226-N228 VanDerWaalsContact C-N 3.34Å; W226-N228 PolarHBondContact O-N 3.45Å; W226-E229 PolarHBondContact O-N 3.31Å; W226-F230 AromaticContact CE3-CE2 3.83Å; W226-F230 HydrophobicContact CE3-CE2 3.83Å; W226-F230 HydrophobicContact CE3-CZ 4.31Å; W226-F230 HydrophobicContact CZ3-CE2 4.47Å; W226-F230 WeakPolarHBondContact O-CD2 3.38Å; W226-F230 PolarHBondContact O-N 2.83Å; W226-V266 HydrophobicContact CB-CG1 4.14Å; W226-V288 HydrophobicContact CH2-CG1 4.33Å; W226-D290 HydrophobicContact CZ2-CB 4.09Å; W226-D290 PolarHBondContact NE1-OD2 3.38Å; W226-L317 HydrophobicContact CH2-CD1 3.68Å; W226-L317 HydrophobicContact CZ2-CD1 3.59Å
227	M	92.6	Very high	90	Very high	24 Å²	24	39 Å²	39	12%	0.118	19%	0.189	C	C	.	.	H	α-helix	trans	-61	-39.3	177.3	-68.3	-64.8	-69.9	0	0	113	L223 N225 K231 A239 C241 V266	L223-M227 WeakPolarHBondContact O-CG 3.31Å; L223-M227 PolarHBondContact O-N 3.15Å; N225-M227 PolarHBondContact O-N 3.38Å; M227-K231 WeakPolarHBondContact O-CG 3.45Å; M227-K231 PolarHBondContact O-N 3.06Å; M227-A239 HydrophobicContact CE-CB 4.28Å; M227-A239 WeakPolarHBondContact CE-O 3.31Å; M227-A239 HydrophobicContact SD-CB 4.03Å; M227-C241 HydrophobicContact CE-CB 3.87Å; M227-C241 HydrophobicContact CG-CB 4.02Å; M227-C241 HydrophobicContact SD-CB 3.83Å; M227-V266 HydrophobicContact SD-CB 4.01Å; M227-V266 HydrophobicContact SD-CG2 3.7Å
228	N	89.9	Confident	90	Very high	75 Å²	75	44.6 Å²	44.6	40%	0.401	21%	0.21	S	C	.	.	H	α-helix	trans	-70.9	-40.1	176.6	-70.4	-12.1	0	0	0	111.8	Y224 N225 W226 K231 R232	Y224-N228 VanDerWaalsContact O-CB 3.27Å; Y224-N228 WeakPolarHBondContact O-CB 3.43Å; Y224-N228 PolarHBondContact O-N 2.99Å; Y224-N228 PolarHBondContact O-ND2 3.32Å; N225-N228 PolarHBondContact O-N 2.83Å; W226-N228 VanDerWaalsContact C-N 3.34Å; W226-N228 PolarHBondContact O-N 3.45Å; N228-K231 PolarHBondContact O-N 2.74Å; N228-R232 WeakPolarHBondContact O-CB 3.46Å; N228-R232 PolarHBondContact O-N 2.69Å
229	E	92.8	Very high	90.1	Very high	30 Å²	30	45.7 Å²	45.7	14%	0.14	22%	0.219	C	C	.	.	H	α-helix	trans	-68.2	-35.8	176.9	-62.4	-88.2	-126.7	0	0	111.1	T194 I198 N225 W226 R232 W233	T194-E229 HydrophobicContact CG2-CB 4.02Å; T194-E229 HydrophobicContact CG2-CG 4.15Å; I198-E229 HydrophobicContact CD1-CB 3.63Å; N225-E229 WeakPolarHBondContact O-CB 3.19Å; N225-E229 WeakPolarHBondContact O-CG 3.18Å; N225-E229 PolarHBondContact O-N 3.12Å; W226-E229 PolarHBondContact O-N 3.31Å; E229-R232 PolarHBondContact O-N 3.07Å; E229-R232 IonicContact OE2-NH1 3.45Å; E229-W233 WeakPolarHBondContact O-CB 3.14Å; E229-W233 PolarHBondContact O-N 3.23Å; E229-W233 PolarHBondContact OE2-NE1 3.13Å
230	F	94.7	Very high	90.4	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-58.7	-55.7	170.7	-87.2	-66.2	0	0	0	111.2	I198 L201 V216 W226 R232 W233 V234 L237 A239 V264 V266	I198-F230 HydrophobicContact CB-CD1 4.46Å; I198-F230 HydrophobicContact CB-CE1 4.3Å; I198-F230 HydrophobicContact CD1-CD1 4.28Å; I198-F230 HydrophobicContact CD1-CD2 4.48Å; I198-F230 HydrophobicContact CD1-CE1 4.49Å; I198-F230 HydrophobicContact CD1-CG 4.25Å; I198-F230 HydrophobicContact CG1-CD1 3.91Å; I198-F230 HydrophobicContact CG1-CE1 3.71Å; I198-F230 HydrophobicContact CG1-CE2 4.39Å; I198-F230 HydrophobicContact CG1-CG 4.33Å; I198-F230 HydrophobicContact CG1-CZ 3.94Å; I198-F230 HydrophobicContact CG2-CD1 3.87Å; I198-F230 HydrophobicContact CG2-CE1 4.09Å; L201-F230 HydrophobicContact CD1-CE1 4.02Å; L201-F230 HydrophobicContact CD1-CZ 3.92Å; V216-F230 HydrophobicContact CG2-CE2 4.46Å; V216-F230 HydrophobicContact CG2-CZ 4.25Å; W226-F230 AromaticContact CE3-CE2 3.83Å; W226-F230 HydrophobicContact CE3-CE2 3.83Å; W226-F230 HydrophobicContact CE3-CZ 4.31Å; W226-F230 HydrophobicContact CZ3-CE2 4.47Å; W226-F230 WeakPolarHBondContact O-CD2 3.38Å; W226-F230 PolarHBondContact O-N 2.83Å; F230-R232 PolarHBondContact O-N 2.97Å; F230-W233 PolarHBondContact O-N 3.29Å; F230-V234 CarbonylContact O-C 3.58Å; F230-V234 VanDerWaalsContact O-C 3.25Å; F230-V234 PolarHBondContact O-N 3.33Å; F230-V234 VanDerWaalsContact O-N 3.11Å; F230-L237 HydrophobicContact CD1-CB 4.45Å; F230-L237 HydrophobicContact CD1-CD1 4.18Å; F230-L237 HydrophobicContact CE1-CD1 4.1Å; F230-A239 HydrophobicContact CB-CB 3.96Å; F230-A239 HydrophobicContact CD1-CB 4.47Å; F230-A239 HydrophobicContact CD2-CB 4Å; F230-A239 HydrophobicContact CG-CB 3.91Å; F230-V264 HydrophobicContact CE1-CG1 4.35Å; F230-V264 HydrophobicContact CE1-CG2 4.11Å; F230-V264 HydrophobicContact CE2-CG1 4.12Å; F230-V264 HydrophobicContact CZ-CB 4.38Å; F230-V264 HydrophobicContact CZ-CG1 3.74Å; F230-V264 HydrophobicContact CZ-CG2 4.32Å; F230-V266 HydrophobicContact CD2-CG2 4.16Å; F230-V266 HydrophobicContact CE2-CG2 3.81Å
231	K	93.1	Very high	90.8	Very high	146 Å²	146	42.1 Å²	42.1	64%	0.635	21%	0.206	S	C	*	.	H	α-helix	trans	-57.1	-36.9	177.5	-72.8	177.1	176.5	-176	0	112.7	M227 N228 P235	M227-K231 WeakPolarHBondContact O-CG 3.45Å; M227-K231 PolarHBondContact O-N 3.06Å; N228-K231 PolarHBondContact O-N 2.74Å; K231-P235 WeakPolarHBondContact O-CB 3.35Å
232	R	91	Very high	91.3	Very high	118 Å²	118	41.4 Å²	41.4	45%	0.445	20%	0.201	S	C	.	.	H	α-helix	trans	-72.4	-54.4	-179.5	179.6	-177.4	-178.1	179.3	7.1	112.5	T159 N228 E229 F230	T159-R232 WeakPolarHBondContact CB-O 3.22Å; T159-R232 HydrophobicContact CG2-CG 3.95Å; T159-R232 PolarHBondContact OG1-O 3.38Å; N228-R232 WeakPolarHBondContact O-CB 3.46Å; N228-R232 PolarHBondContact O-N 2.69Å; E229-R232 PolarHBondContact O-N 3.07Å; E229-R232 IonicContact OE2-NH1 3.45Å; F230-R232 PolarHBondContact O-N 2.97Å
233	W	93.1	Very high	91.3	Very high	27 Å²	27	43 Å²	43	10%	0.102	21%	0.209	C	C	.	.	H	α-helix	trans	-86.8	-44.4	-166.5	-64.5	111.7	0	0	0	112.5	V157 K158 T159 L195 I198 E229 F230	V157-W233 WeakPolarHBondContact CA-O 3.25Å; V157-W233 HydrophobicContact CG1-CB 4.48Å; V157-W233 HydrophobicContact CG1-CE3 3.76Å; V157-W233 HydrophobicContact CG1-CZ3 4.47Å; K158-W233 PolarHBondContact N-O 2.9Å; T159-W233 VanDerWaalsContact O-CZ3 3.26Å; T159-W233 WeakPolarHBondContact O-CZ3 3.25Å; L195-W233 HydrophobicContact CD1-CB 3.97Å; L195-W233 HydrophobicContact CD1-CD2 3.65Å; L195-W233 HydrophobicContact CD1-CE3 4.05Å; L195-W233 HydrophobicContact CD1-CG 3.58Å; L195-W233 HydrophobicContact CD2-CD2 4.44Å; L195-W233 HydrophobicContact CD2-CH2 4.43Å; L195-W233 HydrophobicContact CD2-CZ2 4.31Å; I198-W233 HydrophobicContact CG2-CB 4.38Å; E229-W233 WeakPolarHBondContact O-CB 3.14Å; E229-W233 PolarHBondContact O-N 3.23Å; E229-W233 PolarHBondContact OE2-NE1 3.13Å; F230-W233 PolarHBondContact O-N 3.29Å
234	V	93.1	Very high	91.1	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.222	C	C	.	.			trans	-135	69.5	-174.6	-172.4	0	0	0	0	109.1	Y156 V157 I198 F230 S236 L237	Y156-V234 HydrophobicContact CD2-CG1 4.38Å; Y156-V234 HydrophobicContact CD2-CG2 4.06Å; V157-V234 HydrophobicContact CG2-CG2 4.4Å; I198-V234 HydrophobicContact CG2-CB 4.03Å; I198-V234 HydrophobicContact CG2-CG2 3.78Å; F230-V234 CarbonylContact O-C 3.58Å; F230-V234 VanDerWaalsContact O-C 3.25Å; F230-V234 PolarHBondContact O-N 3.33Å; F230-V234 VanDerWaalsContact O-N 3.11Å; V234-S236 WeakPolarHBondContact CG1-OG 3.38Å; V234-S236 PolarHBondContact O-N 3.48Å; V234-L237 HydrophobicContact CB-CD1 4.15Å; V234-L237 HydrophobicContact CG1-CD1 3.78Å; V234-L237 HydrophobicContact CG1-CG 3.88Å; V234-L237 PolarHBondContact O-N 3.1Å
235	P	91.6	Very high	91.1	Very high	80 Å²	80	44 Å²	44	52%	0.519	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-13.5	-177.7	23.3	-34.1	0	0	0	114.4	K231 L237	K231-P235 WeakPolarHBondContact O-CB 3.35Å; P235-L237 PolarHBondContact O-N 3.06Å
236	S	91.5	Very high	91	Very high	45 Å²	45	51.2 Å²	51.2	32%	0.315	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-11.1	171.8	59.1	0	0	0	0	114.4	K205 H206 V234	K205-S236 PolarHBondContact NZ-O 2.97Å; H206-S236 PolarHBondContact NE2-OG 3.24Å; V234-S236 WeakPolarHBondContact CG1-OG 3.38Å; V234-S236 PolarHBondContact O-N 3.48Å
237	L	92.4	Very high	90.8	Very high	8 Å²	8	56.6 Å²	56.6	4%	0.042	28%	0.28	C	S	.	.	S	Bend	trans	-91.4	115.9	174.5	-75.6	169.4	0	0	0	110.4	L201 K205 F230 V234 P235 A239 D263 V264	L201-L237 HydrophobicContact CB-CD1 3.94Å; K205-L237 HydrophobicContact CB-CD2 4.15Å; K205-L237 HydrophobicContact CD-CD2 3.78Å; F230-L237 HydrophobicContact CD1-CB 4.45Å; F230-L237 HydrophobicContact CD1-CD1 4.18Å; F230-L237 HydrophobicContact CE1-CD1 4.1Å; V234-L237 HydrophobicContact CB-CD1 4.15Å; V234-L237 HydrophobicContact CG1-CD1 3.78Å; V234-L237 HydrophobicContact CG1-CG 3.88Å; V234-L237 PolarHBondContact O-N 3.1Å; P235-L237 PolarHBondContact O-N 3.06Å; L237-A239 VanDerWaalsContact C-N 3.33Å; L237-A239 PolarHBondContact O-N 2.84Å; L237-D263 VanDerWaalsContact CA-OD2 3.28Å; L237-D263 WeakPolarHBondContact CA-OD2 3.27Å; L237-D263 HydrophobicContact CD2-CB 3.98Å; L237-V264 HydrophobicContact CD2-CG2 4.35Å
238	R	93.3	Very high	90.6	Very high	118 Å²	118	60.8 Å²	60.8	45%	0.445	30%	0.299	S	S	.	.			trans	-72.4	84.4	173.6	-64.9	-161.2	-69.8	-178.7	-0.4	110.2	E261 D263 V264	R238-E261 IonicContact CZ-OE2 3.3Å; R238-E261 PolarHBondContact NE-O 2.76Å; R238-E261 PolarHBondContact NH1-O 3.31Å; R238-E261 IonicContact NH1-OE2 3.61Å; R238-E261 PolarHBondContact NH1-OE2 3.46Å; R238-E261 VanDerWaalsContact NH2-C 3.33Å; R238-E261 PolarHBondContact NH2-O 3.37Å; R238-E261 IonicContact NH2-OE2 3.44Å; R238-E261 PolarHBondContact NH2-OE2 3.09Å; R238-D263 HydrophobicContact CB-CB 4.35Å; R238-D263 PolarHBondContact N-OD2 2.78Å; R238-D263 PolarHBondContact O-N 3.27Å; R238-V264 PolarHBondContact O-N 2.84Å
239	A	94	Very high	90.6	Very high	22 Å²	22	58.3 Å²	58.3	18%	0.182	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	130.6	174.1	0	0	0	0	0	111.5	M227 F230 L237 V264	M227-A239 HydrophobicContact CE-CB 4.28Å; M227-A239 WeakPolarHBondContact CE-O 3.31Å; M227-A239 HydrophobicContact SD-CB 4.03Å; F230-A239 HydrophobicContact CB-CB 3.96Å; F230-A239 HydrophobicContact CD1-CB 4.47Å; F230-A239 HydrophobicContact CD2-CB 4Å; F230-A239 HydrophobicContact CG-CB 3.91Å; L237-A239 VanDerWaalsContact C-N 3.33Å; L237-A239 PolarHBondContact O-N 2.84Å; A239-V264 CarbonylContact C-O 3.59Å; A239-V264 WeakPolarHBondContact CA-O 3.45Å; A239-V264 HydrophobicContact CB-CB 4.43Å
240	V	93.1	Very high	90.5	Very high	24 Å²	24	60.8 Å²	60.8	15%	0.145	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	148.9	174.7	-62.2	0	0	0	0	110.4	V256 W262 V264 C265 V266	V240-V256 HydrophobicContact CB-CG1 4.49Å; V240-V256 HydrophobicContact CG1-CG1 3.8Å; V240-W262 HydrophobicContact CB-CB 4.49Å; V240-W262 HydrophobicContact CG1-CB 3.67Å; V240-W262 HydrophobicContact CG1-CG 4.28Å; V240-W262 HydrophobicContact CG2-CB 3.97Å; V240-W262 HydrophobicContact CG2-CD2 3.96Å; V240-W262 HydrophobicContact CG2-CE3 4.14Å; V240-W262 HydrophobicContact CG2-CG 3.87Å; V240-V264 PolarHBondContact N-O 3.16Å; V240-C265 HydrophobicContact CG2-CB 4.22Å; V240-V266 PolarHBondContact O-N 3.45Å
241	C	91.8	Very high	90.2	Very high	21 Å²	21	62.6 Å²	62.6	14%	0.142	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	119.3	-178.5	-171.6	0	0	0	0	111.3	M227 I243 V266	M227-C241 HydrophobicContact CE-CB 3.87Å; M227-C241 HydrophobicContact CG-CB 4.02Å; M227-C241 HydrophobicContact SD-CB 3.83Å; C241-I243 PolarHBondContact O-N 3.1Å; C241-V266 WeakPolarHBondContact CA-O 3.47Å
242	L	88.5	Confident	90	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	92.2	173.5	-172.6	65.2	0	0	0	110.3	R249 L252 I253 L257 V266 M271 E275 F279	L242-R249 HydrophobicContact CD1-CB 4.22Å; L242-R249 HydrophobicContact CD1-CG 4.16Å; L242-L252 HydrophobicContact CD1-CD2 3.61Å; L242-I253 HydrophobicContact CD1-CD1 4.27Å; L242-I253 HydrophobicContact CD1-CG1 3.96Å; L242-I253 HydrophobicContact CD2-CD1 4.45Å; L242-L257 HydrophobicContact CD1-CD1 4.33Å; L242-V266 PolarHBondContact N-O 3.44Å; L242-V266 VanDerWaalsContact N-O 3.15Å; L242-M271 HydrophobicContact CB-CG 4.48Å; L242-M271 HydrophobicContact CD2-CG 3.78Å; L242-M271 HydrophobicContact CG-CG 3.87Å; L242-E275 HydrophobicContact CD2-CB 4.31Å; L242-E275 HydrophobicContact CD2-CG 4.27Å; L242-F279 HydrophobicContact CD2-CE1 4.5Å; L242-F279 HydrophobicContact CD2-CE2 3.88Å; L242-F279 HydrophobicContact CD2-CZ 3.51Å
243	I	86.2	Confident	90	Very high	41 Å²	41	53.2 Å²	53.2	21%	0.21	28%	0.281	C	S	.	.			trans	-138.3	154.6	168.8	-166	167.1	0	0	0	109.8	L223 C241	L223-I243 HydrophobicContact CD1-CD1 3.79Å; C241-I243 PolarHBondContact O-N 3.1Å
244	G	83.7	Confident	89.8	Confident	27 Å²	27	59.6 Å²	59.6	28%	0.278	31%	0.305	S	S	.	.	S	Bend	trans	147.4	-176	175.4	0	0	0	0	0	112.7	R249	G244-R249 WeakPolarHBondContact O-CD 3.42Å
245	D	85.1	Confident	89.5	Confident	79 Å²	79	63.6 Å²	63.6	42%	0.422	33%	0.327	S	S	.	.	S	Bend	trans	-75.3	-169.3	166.3	62.6	43.8	0	0	0	112.1	D247 Q248 R249	D245-D247 VanDerWaalsContact C-N 3.31Å; D245-D247 PolarHBondContact O-N 2.7Å; D245-D247 PolarHBondContact OD1-N 2.88Å; D245-Q248 VanDerWaalsContact N-OE1 3.13Å; D245-Q248 WeakPolarHBondContact OD1-CB 3.38Å; D245-Q248 WeakPolarHBondContact OD1-CG 3.44Å; D245-Q248 PolarHBondContact OD1-N 3.36Å; D245-Q248 WeakPolarHBondContact OD2-CG 3.47Å; D245-Q248 PolarHBondContact OD2-NE2 2.9Å; D245-R249 WeakPolarHBondContact O-CB 3.5Å; D245-R249 VanDerWaalsContact O-CD 3.32Å; D245-R249 WeakPolarHBondContact O-CD 3.46Å; D245-R249 WeakPolarHBondContact O-CG 3.28Å; D245-R249 PolarHBondContact O-N 2.88Å; D245-R249 PolarHBondContact O-NE 2.93Å
246	R	87.1	Confident	89.3	Confident	190 Å²	190	62.1 Å²	62.1	72%	0.717	32%	0.316	S	S	*	.	H	α-helix	trans	-60.9	-40.6	-179.5	-175.6	179.4	179.4	-180	-2	112.4	T250	R246-T250 WeakPolarHBondContact O-CB 3.08Å; R246-T250 PolarHBondContact O-N 3.03Å; R246-T250 PolarHBondContact O-OG1 2.82Å
247	D	89.1	Confident	89.1	Confident	114 Å²	114	60 Å²	60	61%	0.61	30%	0.301	S	S	*	.	H	α-helix	trans	-91.4	-40.5	-163.1	-55.5	-30.5	0	0	0	110	D245 R249 T250 A251	D245-D247 VanDerWaalsContact C-N 3.31Å; D245-D247 PolarHBondContact O-N 2.7Å; D245-D247 PolarHBondContact OD1-N 2.88Å; D247-R249 VanDerWaalsContact C-N 3.29Å; D247-R249 PolarHBondContact O-N 2.75Å; D247-T250 PolarHBondContact O-N 2.76Å; D247-T250 VanDerWaalsContact O-N 3.15Å; D247-A251 PolarHBondContact O-N 2.99Å
248	Q	87.9	Confident	88.8	Confident	112 Å²	112	63.6 Å²	63.6	52%	0.523	32%	0.32	S	S	.	.	H	α-helix	trans	-52.7	-46.5	166.7	-68.7	173.4	-2.9	0	0	111.7	D245 L252	D245-Q248 VanDerWaalsContact N-OE1 3.13Å; D245-Q248 WeakPolarHBondContact OD1-CB 3.38Å; D245-Q248 WeakPolarHBondContact OD1-CG 3.44Å; D245-Q248 PolarHBondContact OD1-N 3.36Å; D245-Q248 WeakPolarHBondContact OD2-CG 3.47Å; D245-Q248 PolarHBondContact OD2-NE2 2.9Å; Q248-L252 VanDerWaalsContact O-CB 3.31Å; Q248-L252 WeakPolarHBondContact O-CB 3.12Å; Q248-L252 PolarHBondContact O-N 3.37Å
249	R	90.3	Very high	88.5	Confident	23 Å²	23	61.7 Å²	61.7	9%	0.087	32%	0.323	C	S	.	.	H	α-helix	trans	-69.4	-38.2	178	-66.4	177	-49.7	125.4	36.7	112	L242 G244 D245 D247 L252 I253 M271 E275	L242-R249 HydrophobicContact CD1-CB 4.22Å; L242-R249 HydrophobicContact CD1-CG 4.16Å; G244-R249 WeakPolarHBondContact O-CD 3.42Å; D245-R249 WeakPolarHBondContact O-CB 3.5Å; D245-R249 VanDerWaalsContact O-CD 3.32Å; D245-R249 WeakPolarHBondContact O-CD 3.46Å; D245-R249 WeakPolarHBondContact O-CG 3.28Å; D245-R249 PolarHBondContact O-N 2.88Å; D245-R249 PolarHBondContact O-NE 2.93Å; D247-R249 VanDerWaalsContact C-N 3.29Å; D247-R249 PolarHBondContact O-N 2.75Å; R249-L252 PolarHBondContact O-N 3.4Å; R249-I253 HydrophobicContact CB-CD1 4.49Å; R249-I253 VanDerWaalsContact O-CB 3.27Å; R249-I253 WeakPolarHBondContact O-CB 3.45Å; R249-I253 VanDerWaalsContact O-CD1 3.32Å; R249-I253 WeakPolarHBondContact O-CD1 3.32Å; R249-I253 WeakPolarHBondContact O-CG1 3.21Å; R249-I253 PolarHBondContact O-N 3.04Å; R249-M271 WeakPolarHBondContact CD-SD 3.32Å; R249-M271 HydrophobicContact CG-SD 4.47Å; R249-M271 PolarHBondContact NH1-SD 2.84Å; R249-E275 IonicContact CZ-OE1 2.66Å; R249-E275 IonicContact NH1-OE1 3.77Å; R249-E275 PolarHBondContact NH1-OE1 2.92Å; R249-E275 IonicContact NH2-OE1 2.69Å; R249-E275 PolarHBondContact NH2-OE1 3.32Å
250	T	89.3	Confident	87.9	Confident	82 Å²	82	62.7 Å²	62.7	50%	0.503	34%	0.336	S	S	.	.	H	α-helix	trans	-62.8	-43.9	177.8	-58.6	0	0	0	0	110.9	R246 D247 R254	R246-T250 WeakPolarHBondContact O-CB 3.08Å; R246-T250 PolarHBondContact O-N 3.03Å; R246-T250 PolarHBondContact O-OG1 2.82Å; D247-T250 PolarHBondContact O-N 2.76Å; D247-T250 VanDerWaalsContact O-N 3.15Å; T250-R254 WeakPolarHBondContact O-CB 3.49Å; T250-R254 PolarHBondContact O-N 2.72Å; T250-R254 VanDerWaalsContact O-N 3.11Å
251	A	89.8	Confident	87.6	Confident	38 Å²	38	67.4 Å²	67.4	31%	0.314	36%	0.356	S	S	.	.	H	α-helix	trans	-61.6	-54.2	172.3	0	0	0	0	0	111.4	D247 I253 R254 D255	D247-A251 PolarHBondContact O-N 2.99Å; A251-I253 VanDerWaalsContact C-N 3.27Å; A251-I253 PolarHBondContact O-N 3.01Å; A251-R254 PolarHBondContact O-N 3.42Å; A251-D255 WeakPolarHBondContact O-CB 3.48Å; A251-D255 PolarHBondContact O-N 2.79Å
252	L	88.6	Confident	87.6	Confident	51 Å²	51	67 Å²	67	27%	0.267	35%	0.351	S	S	.	.	H	α-helix	trans	-63.6	-29.2	-177.3	-170.3	141.4	0	0	0	113.2	L242 Q248 R249 V256 L257	L242-L252 HydrophobicContact CD1-CD2 3.61Å; Q248-L252 VanDerWaalsContact O-CB 3.31Å; Q248-L252 WeakPolarHBondContact O-CB 3.12Å; Q248-L252 PolarHBondContact O-N 3.37Å; R249-L252 PolarHBondContact O-N 3.4Å; L252-V256 HydrophobicContact CG-CB 4.33Å; L252-V256 HydrophobicContact CG-CG2 4.26Å; L252-V256 WeakPolarHBondContact O-CA 3.33Å; L252-V256 WeakPolarHBondContact O-CB 3.48Å; L252-V256 PolarHBondContact O-N 2.87Å; L252-V256 VanDerWaalsContact O-N 3.11Å; L252-L257 HydrophobicContact CD2-CD1 3.4Å; L252-L257 VanDerWaalsContact CD2-CD1 3.4Å; L252-L257 PolarHBondContact O-N 3.43Å
253	I	90	Very high	87.9	Confident	16 Å²	16	67.4 Å²	67.4	8%	0.082	35%	0.354	C	S	.	.	I	π-helix	trans	-68.7	-46.9	171.1	-73	161.1	0	0	0	111.2	L242 R249 A251 L257 L258 E275 V278	L242-I253 HydrophobicContact CD1-CD1 4.27Å; L242-I253 HydrophobicContact CD1-CG1 3.96Å; L242-I253 HydrophobicContact CD2-CD1 4.45Å; R249-I253 HydrophobicContact CB-CD1 4.49Å; R249-I253 VanDerWaalsContact O-CB 3.27Å; R249-I253 WeakPolarHBondContact O-CB 3.45Å; R249-I253 VanDerWaalsContact O-CD1 3.32Å; R249-I253 WeakPolarHBondContact O-CD1 3.32Å; R249-I253 WeakPolarHBondContact O-CG1 3.21Å; R249-I253 PolarHBondContact O-N 3.04Å; A251-I253 VanDerWaalsContact C-N 3.27Å; A251-I253 PolarHBondContact O-N 3.01Å; I253-L257 HydrophobicContact CG1-CD1 4.45Å; I253-L257 PolarHBondContact O-N 2.88Å; I253-L258 HydrophobicContact CG2-CD1 4.11Å; I253-L258 HydrophobicContact CG2-CG 4.27Å; I253-L258 WeakPolarHBondContact O-CG 3.16Å; I253-L258 PolarHBondContact O-N 3.26Å; I253-E275 HydrophobicContact CD1-CG 4.24Å; I253-V278 HydrophobicContact CD1-CG2 4.28Å; I253-V278 HydrophobicContact CG2-CG1 3.94Å; I253-V278 HydrophobicContact CG2-CG2 4.01Å
254	R	88.8	Confident	88.3	Confident	160 Å²	160	65.4 Å²	65.4	60%	0.604	34%	0.344	S	S	*	.	I	π-helix	trans	-68	-44.9	-179	-173.5	-169.2	66.9	-166.8	-7.2	112.4	T250 A251 P259	T250-R254 WeakPolarHBondContact O-CB 3.49Å; T250-R254 PolarHBondContact O-N 2.72Å; T250-R254 VanDerWaalsContact O-N 3.11Å; A251-R254 PolarHBondContact O-N 3.42Å; R254-P259 WeakPolarHBondContact O-CD 3.37Å
255	D	87.5	Confident	88.9	Confident	84 Å²	84	64.1 Å²	64.1	45%	0.449	33%	0.331	S	S	.	.	I	π-helix	trans	-97	-17.6	-165.8	-57.1	-29.3	0	0	0	113.1	A251	A251-D255 WeakPolarHBondContact O-CB 3.48Å; A251-D255 PolarHBondContact O-N 2.79Å
256	V	86.9	Confident	89.4	Confident	50 Å²	50	60.4 Å²	60.4	30%	0.303	31%	0.31	S	S	.	.	I	π-helix	trans	-127.1	-50.4	-177.6	-169.2	0	0	0	0	113	V240 L252 W262	V240-V256 HydrophobicContact CB-CG1 4.49Å; V240-V256 HydrophobicContact CG1-CG1 3.8Å; L252-V256 HydrophobicContact CG-CB 4.33Å; L252-V256 HydrophobicContact CG-CG2 4.26Å; L252-V256 WeakPolarHBondContact O-CA 3.33Å; L252-V256 WeakPolarHBondContact O-CB 3.48Å; L252-V256 PolarHBondContact O-N 2.87Å; L252-V256 VanDerWaalsContact O-N 3.11Å; V256-W262 PolarHBondContact O-NE1 2.75Å
257	L	87.4	Confident	89.7	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.276	C	S	.	.	I	π-helix	trans	-70.6	-51.6	-177.4	-84.2	92.2	0	0	0	113	L242 L252 I253 G260 W262 F282	L242-L257 HydrophobicContact CD1-CD1 4.33Å; L252-L257 HydrophobicContact CD2-CD1 3.4Å; L252-L257 VanDerWaalsContact CD2-CD1 3.4Å; L252-L257 PolarHBondContact O-N 3.43Å; I253-L257 HydrophobicContact CG1-CD1 4.45Å; I253-L257 PolarHBondContact O-N 2.88Å; L257-G260 PolarHBondContact O-N 3.41Å; L257-G260 VanDerWaalsContact O-N 3.16Å; L257-W262 PolarHBondContact O-NE1 3.34Å; L257-F282 HydrophobicContact CB-CZ 4.45Å
258	L	86.6	Confident	89.8	Confident	83 Å²	83	46.1 Å²	46.1	44%	0.435	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-32.9	-173.2	-69.7	172.5	0	0	0	114.8	I253 G260 K281 F282	I253-L258 HydrophobicContact CG2-CD1 4.11Å; I253-L258 HydrophobicContact CG2-CG 4.27Å; I253-L258 WeakPolarHBondContact O-CG 3.16Å; I253-L258 PolarHBondContact O-N 3.26Å; L258-G260 PolarHBondContact O-N 2.81Å; L258-K281 HydrophobicContact CD2-CD 4.34Å; L258-F282 HydrophobicContact CD2-CZ 4.42Å
259	P	86.3	Confident	89.9	Confident	78 Å²	78	42 Å²	42	51%	0.506	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-14.2	171.2	-26.1	37	0	0	0	115.1	R254 E261	R254-P259 WeakPolarHBondContact O-CD 3.37Å; P259-E261 VanDerWaalsContact C-N 3.27Å; P259-E261 HydrophobicContact CB-CG 4.44Å; P259-E261 PolarHBondContact O-N 3.39Å
260	G	81.3	Confident	89.8	Confident	44 Å²	44	46 Å²	46	45%	0.454	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.8	10.4	176.5	0	0	0	0	0	115.6	L257 L258 W262	L257-G260 PolarHBondContact O-N 3.41Å; L257-G260 VanDerWaalsContact O-N 3.16Å; L258-G260 PolarHBondContact O-N 2.81Å; G260-W262 PolarHBondContact O-N 3.4Å
261	E	86.9	Confident	89.8	Confident	123 Å²	123	42.9 Å²	42.9	58%	0.575	23%	0.228	S	C	*	.			trans	-76	40.7	-176.5	-76.4	-119.3	-137.5	0	0	114.3	R238 P259	R238-E261 IonicContact CZ-OE2 3.3Å; R238-E261 PolarHBondContact NE-O 2.76Å; R238-E261 PolarHBondContact NH1-O 3.31Å; R238-E261 IonicContact NH1-OE2 3.61Å; R238-E261 PolarHBondContact NH1-OE2 3.46Å; R238-E261 VanDerWaalsContact NH2-C 3.33Å; R238-E261 PolarHBondContact NH2-O 3.37Å; R238-E261 IonicContact NH2-OE2 3.44Å; R238-E261 PolarHBondContact NH2-OE2 3.09Å; P259-E261 VanDerWaalsContact C-N 3.27Å; P259-E261 HydrophobicContact CB-CG 4.44Å; P259-E261 PolarHBondContact O-N 3.39Å
262	W	92.6	Very high	89.8	Confident	11 Å²	11	41 Å²	41	4%	0.042	21%	0.213	C	C	.	.			trans	-153.8	154.7	-174.4	54.8	-85.7	0	0	0	111.9	P213 V240 V256 L257 G260 C265 F282 W284	P213-W262 HydrophobicContact CB-CH2 3.53Å; P213-W262 HydrophobicContact CB-CZ2 4.42Å; P213-W262 HydrophobicContact CB-CZ3 3.67Å; V240-W262 HydrophobicContact CB-CB 4.49Å; V240-W262 HydrophobicContact CG1-CB 3.67Å; V240-W262 HydrophobicContact CG1-CG 4.28Å; V240-W262 HydrophobicContact CG2-CB 3.97Å; V240-W262 HydrophobicContact CG2-CD2 3.96Å; V240-W262 HydrophobicContact CG2-CE3 4.14Å; V240-W262 HydrophobicContact CG2-CG 3.87Å; V256-W262 PolarHBondContact O-NE1 2.75Å; L257-W262 PolarHBondContact O-NE1 3.34Å; G260-W262 PolarHBondContact O-N 3.4Å; W262-C265 HydrophobicContact CE3-CB 4.04Å; W262-C265 HydrophobicContact CH2-CB 4.03Å; W262-C265 HydrophobicContact CZ3-CB 3.59Å; W262-F282 HydrophobicContact CZ2-CD1 4.18Å; W262-F282 AromaticContact CZ2-CE1 3.83Å; W262-F282 HydrophobicContact CZ2-CE1 3.83Å; W262-F282 HydrophobicContact CZ2-CZ 4.06Å; W262-W284 AromaticContact CH2-CH2 3.5Å; W262-W284 HydrophobicContact CH2-CH2 3.5Å; W262-W284 AromaticContact CH2-CZ3 3.5Å; W262-W284 HydrophobicContact CH2-CZ3 3.5Å; W262-W284 VanDerWaalsContact CH2-CZ3 3.5Å; W262-W284 HydrophobicContact CZ2-CH2 4.48Å; W262-W284 HydrophobicContact CZ3-CH2 4.13Å; W262-W284 AromaticContact CZ3-CZ3 3.74Å; W262-W284 HydrophobicContact CZ3-CZ3 3.74Å
263	D	94	Very high	89.9	Confident	9 Å²	9	42 Å²	42	5%	0.048	22%	0.218	C	C	.	.	S	Bend	trans	-99.2	-42.5	-175.9	-62.3	-22.7	0	0	0	111	K205 P211 H214 L237 R238	K205-D263 IonicContact NZ-OD1 3.61Å; K205-D263 PolarHBondContact NZ-OD1 2.99Å; K205-D263 IonicContact NZ-OD2 3.37Å; K205-D263 PolarHBondContact NZ-OD2 2.76Å; P211-D263 VanDerWaalsContact O-CB 3.27Å; P211-D263 WeakPolarHBondContact O-CB 3.21Å; H214-D263 PolarHBondContact N-O 3.41Å; L237-D263 VanDerWaalsContact CA-OD2 3.28Å; L237-D263 WeakPolarHBondContact CA-OD2 3.27Å; L237-D263 HydrophobicContact CD2-CB 3.98Å; R238-D263 HydrophobicContact CB-CB 4.35Å; R238-D263 PolarHBondContact N-OD2 2.78Å; R238-D263 PolarHBondContact O-N 3.27Å
264	V	95.8	Very high	89.9	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	126.2	-172.9	-169.8	0	0	0	0	111.3	L201 H214 V216 F230 L237 R238 A239 V240 V266	L201-V264 HydrophobicContact CD1-CG1 4.36Å; L201-V264 HydrophobicContact CD1-CG2 4.17Å; H214-V264 HydrophobicContact CB-CG1 4.31Å; H214-V264 HydrophobicContact CB-CG2 4.27Å; H214-V264 CarbonylContact O-C 3.6Å; H214-V264 WeakPolarHBondContact O-CA 3.39Å; V216-V264 HydrophobicContact CG2-CG1 3.57Å; F230-V264 HydrophobicContact CE1-CG1 4.35Å; F230-V264 HydrophobicContact CE1-CG2 4.11Å; F230-V264 HydrophobicContact CE2-CG1 4.12Å; F230-V264 HydrophobicContact CZ-CB 4.38Å; F230-V264 HydrophobicContact CZ-CG1 3.74Å; F230-V264 HydrophobicContact CZ-CG2 4.32Å; L237-V264 HydrophobicContact CD2-CG2 4.35Å; R238-V264 PolarHBondContact O-N 2.84Å; A239-V264 CarbonylContact C-O 3.59Å; A239-V264 WeakPolarHBondContact CA-O 3.45Å; A239-V264 HydrophobicContact CB-CB 4.43Å; V240-V264 PolarHBondContact N-O 3.16Å; V264-V266 HydrophobicContact CG1-CG2 4.32Å
265	C	95.1	Very high	90	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	115.6	169.9	178.4	0	0	0	0	110.5	H214 M215 V216 V240 W262 W284	H214-C265 PolarHBondContact O-N 2.71Å; M215-C265 WeakPolarHBondContact CA-O 3.49Å; V216-C265 PolarHBondContact N-O 3.25Å; V240-C265 HydrophobicContact CG2-CB 4.22Å; W262-C265 HydrophobicContact CE3-CB 4.04Å; W262-C265 HydrophobicContact CH2-CB 4.03Å; W262-C265 HydrophobicContact CZ3-CB 3.59Å; C265-W284 HydrophobicContact CB-CH2 4.08Å; C265-W284 HydrophobicContact CB-CZ3 4.16Å
266	V	95.3	Very high	90.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	125.6	174.3	-166.5	0	0	0	0	108.9	V216 V218 L223 W226 M227 F230 V240 C241 L242 V264	V216-V266 HydrophobicContact CB-CG1 4.41Å; V216-V266 HydrophobicContact CB-CG2 4.39Å; V216-V266 WeakPolarHBondContact O-CA 3.34Å; V218-V266 HydrophobicContact CG1-CG1 4.32Å; V218-V266 HydrophobicContact CG2-CG1 4.06Å; L223-V266 HydrophobicContact CD2-CG1 4.08Å; W226-V266 HydrophobicContact CB-CG1 4.14Å; M227-V266 HydrophobicContact SD-CB 4.01Å; M227-V266 HydrophobicContact SD-CG2 3.7Å; F230-V266 HydrophobicContact CD2-CG2 4.16Å; F230-V266 HydrophobicContact CE2-CG2 3.81Å; V240-V266 PolarHBondContact O-N 3.45Å; C241-V266 WeakPolarHBondContact CA-O 3.47Å; L242-V266 PolarHBondContact N-O 3.44Å; L242-V266 VanDerWaalsContact N-O 3.15Å; V264-V266 HydrophobicContact CG1-CG2 4.32Å
267	T	93.9	Very high	90.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	162.3	-173.4	-170.2	0	0	0	0	112.6	M215 V216 L217 V218 M271 F279	M215-T267 HydrophobicContact CG-CG2 4.49Å; M215-T267 HydrophobicContact SD-CG2 4.38Å; V216-T267 PolarHBondContact O-N 3.21Å; L217-T267 HydrophobicContact CD2-CG2 3.46Å; L217-T267 VanDerWaalsContact CD2-CG2 3.46Å; V218-T267 PolarHBondContact N-O 2.87Å; T267-M271 WeakPolarHBondContact OG1-CB 3.28Å; T267-F279 HydrophobicContact CG2-CE1 4.13Å; T267-F279 HydrophobicContact CG2-CZ 3.86Å
268	S	92.2	Very high	90.5	Very high	4 Å²	4	42.2 Å²	42.2	3%	0.028	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	154.8	-178.9	88.3	0	0	0	0	112.9	V218 E270 M271 L272	V218-S268 WeakPolarHBondContact O-CA 3.41Å; S268-E270 PolarHBondContact O-N 3.45Å; S268-E270 PolarHBondContact OG-N 3.4Å; S268-M271 PolarHBondContact O-N 3Å; S268-M271 PolarHBondContact OG-N 3.23Å; S268-M271 VanDerWaalsContact OG-N 3.14Å; S268-L272 PolarHBondContact O-N 3.05Å
269	Y	89	Confident	90.7	Very high	26 Å²	26	38.2 Å²	38.2	10%	0.102	21%	0.213	C	C	.	.	H	α-helix	trans	-53.5	-35.5	171.9	-66.3	-61.6	0	0	0	114	L217 P219 I273 I289 D290 R294 L302	L217-Y269 HydrophobicContact CB-CD1 4.49Å; L217-Y269 HydrophobicContact CB-CE1 4.11Å; P219-Y269 HydrophobicContact CG-CE2 4.3Å; Y269-I273 WeakPolarHBondContact O-CD1 3.32Å; Y269-I273 WeakPolarHBondContact O-CG1 3.43Å; Y269-I289 HydrophobicContact CE1-CG2 4.02Å; Y269-I289 WeakPolarHBondContact OH-CG2 3.09Å; Y269-D290 PolarHBondContact OH-O 2.92Å; Y269-R294 HydrophobicContact CD2-CG 4.45Å; Y269-R294 HydrophobicContact CE1-CB 4.41Å; Y269-R294 HydrophobicContact CE2-CB 4.22Å; Y269-R294 HydrophobicContact CE2-CG 3.95Å; Y269-L302 HydrophobicContact CD1-CD1 3.74Å; Y269-L302 HydrophobicContact CD1-CD2 3.44Å; Y269-L302 VanDerWaalsContact CD1-CD2 3.44Å; Y269-L302 HydrophobicContact CD1-CG 4.19Å; Y269-L302 HydrophobicContact CE1-CD2 3.84Å; Y269-L302 HydrophobicContact CG-CD2 4.08Å
270	E	88.4	Confident	90.9	Very high	108 Å²	108	38.8 Å²	38.8	51%	0.505	21%	0.208	S	C	.	.	H	α-helix	trans	-68.6	-45.8	175.9	-63.2	165.3	179.4	0	0	110.4	K220 S268 L272 I273 I274	K220-E270 IonicContact NZ-OE2 3.33Å; K220-E270 PolarHBondContact NZ-OE2 2.63Å; S268-E270 PolarHBondContact O-N 3.45Å; S268-E270 PolarHBondContact OG-N 3.4Å; E270-L272 PolarHBondContact O-N 3.4Å; E270-I273 PolarHBondContact O-N 2.91Å; E270-I274 WeakPolarHBondContact O-CG1 3.48Å; E270-I274 PolarHBondContact O-N 2.98Å
271	M	89.8	Confident	91.3	Very high	15 Å²	15	43.6 Å²	43.6	7%	0.074	22%	0.216	C	C	.	.	H	α-helix	trans	-66.1	-38.9	-174.1	-161.8	61.7	64.6	0	0	112.8	L242 R249 T267 S268 I273 I274 E275	L242-M271 HydrophobicContact CB-CG 4.48Å; L242-M271 HydrophobicContact CD2-CG 3.78Å; L242-M271 HydrophobicContact CG-CG 3.87Å; R249-M271 WeakPolarHBondContact CD-SD 3.32Å; R249-M271 HydrophobicContact CG-SD 4.47Å; R249-M271 PolarHBondContact NH1-SD 2.84Å; T267-M271 WeakPolarHBondContact OG1-CB 3.28Å; S268-M271 PolarHBondContact O-N 3Å; S268-M271 PolarHBondContact OG-N 3.23Å; S268-M271 VanDerWaalsContact OG-N 3.14Å; M271-I273 VanDerWaalsContact C-N 3.27Å; M271-I273 PolarHBondContact O-N 3.32Å; M271-I274 PolarHBondContact O-N 2.93Å; M271-E275 PolarHBondContact O-N 2.86Å; M271-E275 HydrophobicContact SD-CG 4.31Å
272	L	90.2	Very high	91.5	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-63	-31.3	176.8	176.9	146.2	0	0	0	112.9	M215 L217 S268 E270 K276 L302 I305 V306 F309	M215-L272 HydrophobicContact CE-CD1 4.25Å; M215-L272 HydrophobicContact SD-CD1 4.28Å; L217-L272 HydrophobicContact CD1-CD1 3.54Å; L217-L272 HydrophobicContact CD2-CD1 3.38Å; L217-L272 HydrophobicContact CG-CD1 4.11Å; S268-L272 PolarHBondContact O-N 3.05Å; E270-L272 PolarHBondContact O-N 3.4Å; L272-K276 WeakPolarHBondContact O-CB 3.49Å; L272-K276 PolarHBondContact O-N 3.18Å; L272-L302 HydrophobicContact CD2-CD1 3.94Å; L272-I305 HydrophobicContact CD2-CB 4.32Å; L272-I305 HydrophobicContact CD2-CG2 3.74Å; L272-V306 HydrophobicContact CD1-CG2 4.02Å; L272-V306 HydrophobicContact CD2-CG2 3.62Å; L272-V306 HydrophobicContact CG-CG2 4.5Å; L272-F309 HydrophobicContact CD1-CE2 3.7Å; L272-F309 HydrophobicContact CD1-CZ 4.25Å; L272-F309 HydrophobicContact CD2-CE2 4.03Å; L272-F309 HydrophobicContact CD2-CZ 4.39Å; L272-F309 HydrophobicContact CG-CE2 3.9Å; L272-F309 HydrophobicContact CG-CZ 4.08Å
273	I	89.8	Confident	91.5	Very high	71 Å²	71	41.2 Å²	41.2	36%	0.364	21%	0.206	S	C	.	.	H	α-helix	trans	-71.5	-37.5	176.1	-65.4	167.9	0	0	0	110.7	Y269 E270 M271 I305	Y269-I273 WeakPolarHBondContact O-CD1 3.32Å; Y269-I273 WeakPolarHBondContact O-CG1 3.43Å; E270-I273 PolarHBondContact O-N 2.91Å; M271-I273 VanDerWaalsContact C-N 3.27Å; M271-I273 PolarHBondContact O-N 3.32Å; I273-I305 HydrophobicContact CB-CD1 4.37Å; I273-I305 HydrophobicContact CG1-CD1 4.2Å; I273-I305 HydrophobicContact CG2-CD1 4.14Å
274	I	90.4	Very high	91.5	Very high	106 Å²	106	40.8 Å²	40.8	54%	0.544	20%	0.204	S	C	.	.	H	α-helix	trans	-75.8	-54.9	-178.5	-53.6	164.5	0	0	0	110.3	E270 M271 K276	E270-I274 WeakPolarHBondContact O-CG1 3.48Å; E270-I274 PolarHBondContact O-N 2.98Å; M271-I274 PolarHBondContact O-N 2.93Å; I274-K276 VanDerWaalsContact C-N 3.33Å; I274-K276 PolarHBondContact O-N 3.23Å
275	E	91.2	Very high	91.3	Very high	36 Å²	36	44 Å²	44	17%	0.168	22%	0.216	C	C	.	.	S	Bend	trans	-93.5	22.8	-170.8	-56.7	-53.7	146.1	0	0	113.8	L242 R249 I253 M271 A277 V278 F279	L242-E275 HydrophobicContact CD2-CB 4.31Å; L242-E275 HydrophobicContact CD2-CG 4.27Å; R249-E275 IonicContact CZ-OE1 2.66Å; R249-E275 IonicContact NH1-OE1 3.77Å; R249-E275 PolarHBondContact NH1-OE1 2.92Å; R249-E275 IonicContact NH2-OE1 2.69Å; R249-E275 PolarHBondContact NH2-OE1 3.32Å; I253-E275 HydrophobicContact CD1-CG 4.24Å; M271-E275 PolarHBondContact O-N 2.86Å; M271-E275 HydrophobicContact SD-CG 4.31Å; E275-A277 PolarHBondContact O-N 3.03Å; E275-V278 PolarHBondContact O-N 3.31Å; E275-F279 HydrophobicContact CB-CD2 4.27Å; E275-F279 HydrophobicContact CB-CE2 3.98Å; E275-F279 WeakPolarHBondContact O-CD2 3.36Å; E275-F279 PolarHBondContact O-N 3.03Å
276	K	90.8	Very high	91.3	Very high	81 Å²	81	44.3 Å²	44.3	35%	0.352	22%	0.218	S	C	.	.	H	α-helix	trans	-53.4	-30.6	-175.5	69.5	177.5	-170.7	164.6	0	114.4	L272 I274 V278 F279 K280 I305	L272-K276 WeakPolarHBondContact O-CB 3.49Å; L272-K276 PolarHBondContact O-N 3.18Å; I274-K276 VanDerWaalsContact C-N 3.33Å; I274-K276 PolarHBondContact O-N 3.23Å; K276-V278 VanDerWaalsContact C-N 3.26Å; K276-V278 PolarHBondContact O-N 2.95Å; K276-F279 PolarHBondContact O-N 2.87Å; K276-K280 WeakPolarHBondContact O-CB 3.31Å; K276-K280 WeakPolarHBondContact O-CG 3.45Å; K276-K280 PolarHBondContact O-N 3.34Å; K276-I305 HydrophobicContact CB-CG2 3.81Å; K276-I305 HydrophobicContact CD-CD1 3.89Å; K276-I305 HydrophobicContact CD-CG1 4.01Å; K276-I305 HydrophobicContact CD-CG2 4.07Å
277	A	90.4	Very high	91.2	Very high	74 Å²	74	44.3 Å²	44.3	61%	0.612	22%	0.218	S	C	*	.	H	α-helix	trans	-67.1	-24.6	178.6	0	0	0	0	0	113.4	E275	E275-A277 PolarHBondContact O-N 3.03Å
278	V	90	Very high	91.3	Very high	17 Å²	17	44.4 Å²	44.4	10%	0.103	22%	0.218	C	C	.	.	H	α-helix	trans	-83.1	-49.2	173.8	179.3	0	0	0	0	109.8	I253 E275 K276 K280 K281 F282	I253-V278 HydrophobicContact CD1-CG2 4.28Å; I253-V278 HydrophobicContact CG2-CG1 3.94Å; I253-V278 HydrophobicContact CG2-CG2 4.01Å; E275-V278 PolarHBondContact O-N 3.31Å; K276-V278 VanDerWaalsContact C-N 3.26Å; K276-V278 PolarHBondContact O-N 2.95Å; V278-K280 PolarHBondContact O-N 2.68Å; V278-K281 WeakPolarHBondContact O-CB 3.32Å; V278-K281 PolarHBondContact O-N 3.4Å; V278-F282 HydrophobicContact CG1-CE2 4.19Å; V278-F282 WeakPolarHBondContact O-CD2 3.16Å
279	F	91.3	Very high	91.4	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.2	-28.1	-179.8	-68.7	-66.4	0	0	0	113.8	M215 L242 T267 E275 K276 K281 W284 F309	M215-F279 HydrophobicContact SD-CD1 3.82Å; M215-F279 HydrophobicContact SD-CE1 4.16Å; M215-F279 HydrophobicContact SD-CG 4.45Å; L242-F279 HydrophobicContact CD2-CE1 4.5Å; L242-F279 HydrophobicContact CD2-CE2 3.88Å; L242-F279 HydrophobicContact CD2-CZ 3.51Å; T267-F279 HydrophobicContact CG2-CE1 4.13Å; T267-F279 HydrophobicContact CG2-CZ 3.86Å; E275-F279 HydrophobicContact CB-CD2 4.27Å; E275-F279 HydrophobicContact CB-CE2 3.98Å; E275-F279 WeakPolarHBondContact O-CD2 3.36Å; E275-F279 PolarHBondContact O-N 3.03Å; K276-F279 PolarHBondContact O-N 2.87Å; F279-K281 VanDerWaalsContact C-N 3.28Å; F279-K281 PolarHBondContact O-N 2.78Å; F279-W284 HydrophobicContact CD1-CH2 4.25Å; F279-W284 AromaticContact CD1-CZ2 3.81Å; F279-W284 HydrophobicContact CD1-CZ2 3.81Å; F279-W284 PolarHBondContact O-NE1 3.39Å; F279-F309 HydrophobicContact CB-CD1 4.21Å; F279-F309 HydrophobicContact CB-CE1 3.41Å; F279-F309 VanDerWaalsContact CB-CE1 3.41Å; F279-F309 HydrophobicContact CB-CZ 3.73Å
280	K	91.1	Very high	91.5	Very high	90 Å²	90	43.8 Å²	43.8	39%	0.391	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-14.8	174.2	-80.4	-169.5	-178.7	-167.3	0	115.2	K276 V278 F282 E308 F309	K276-K280 WeakPolarHBondContact O-CB 3.31Å; K276-K280 WeakPolarHBondContact O-CG 3.45Å; K276-K280 PolarHBondContact O-N 3.34Å; V278-K280 PolarHBondContact O-N 2.68Å; K280-F282 VanDerWaalsContact C-N 3.35Å; K280-E308 VanDerWaalsContact CE-CD 3.45Å; K280-E308 WeakPolarHBondContact CE-OE2 3.27Å; K280-E308 IonicContact NZ-OE1 3.07Å; K280-E308 PolarHBondContact NZ-OE1 2.84Å; K280-E308 IonicContact NZ-OE2 2.69Å; K280-E308 PolarHBondContact NZ-OE2 3.07Å; K280-F309 HydrophobicContact CB-CE1 4.46Å; K280-F309 HydrophobicContact CG-CD1 3.87Å; K280-F309 HydrophobicContact CG-CE1 3.69Å
281	K	90.3	Very high	91.3	Very high	145 Å²	145	39.5 Å²	39.5	63%	0.63	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-20.9	179.4	-62.3	-175.1	178.1	-173.6	0	113.3	L258 V278 F279	L258-K281 HydrophobicContact CD2-CD 4.34Å; V278-K281 WeakPolarHBondContact O-CB 3.32Å; V278-K281 PolarHBondContact O-N 3.4Å; F279-K281 VanDerWaalsContact C-N 3.28Å; F279-K281 PolarHBondContact O-N 2.78Å
282	F	90.4	Very high	91	Very high	32 Å²	32	39.1 Å²	39.1	14%	0.14	20%	0.195	C	C	.	.	S	Bend	trans	-99.5	139.9	-174.2	-59.3	-84.6	0	0	0	111.8	L257 L258 W262 V278 K280 W284	L257-F282 HydrophobicContact CB-CZ 4.45Å; L258-F282 HydrophobicContact CD2-CZ 4.42Å; W262-F282 HydrophobicContact CZ2-CD1 4.18Å; W262-F282 AromaticContact CZ2-CE1 3.83Å; W262-F282 HydrophobicContact CZ2-CE1 3.83Å; W262-F282 HydrophobicContact CZ2-CZ 4.06Å; V278-F282 HydrophobicContact CG1-CE2 4.19Å; V278-F282 WeakPolarHBondContact O-CD2 3.16Å; K280-F282 VanDerWaalsContact C-N 3.35Å; F282-W284 HydrophobicContact CB-CD2 4.25Å; F282-W284 HydrophobicContact CB-CH2 4.36Å; F282-W284 HydrophobicContact CB-CZ2 3.67Å; F282-W284 HydrophobicContact CD2-CH2 4.42Å; F282-W284 AromaticContact CD2-CZ2 3.87Å; F282-W284 HydrophobicContact CD2-CZ2 3.87Å; F282-W284 HydrophobicContact CG-CH2 4.46Å; F282-W284 HydrophobicContact CG-CZ2 4.01Å; F282-W284 VanDerWaalsContact O-CD1 3.24Å; F282-W284 PolarHBondContact O-NE1 3.18Å
283	N	91.9	Very high	90.3	Very high	51 Å²	51	42.3 Å²	42.3	27%	0.273	21%	0.21	S	C	.	.			trans	-90.5	101.1	169.6	-68.5	-32.5	0	0	0	108.9	Y62 P213 K310	Y62-N283 HydrophobicContact CD2-CB 4.12Å; Y62-N283 HydrophobicContact CE2-CB 3.85Å; P213-N283 WeakPolarHBondContact CG-O 2.96Å; N283-K310 WeakPolarHBondContact OD1-CD 3.47Å
284	W	93.6	Very high	89.6	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	129.9	-169.8	-60.6	94.3	0	0	0	112.4	P213 M215 W262 C265 F279 F282 K310 T311 T312	P213-W284 HydrophobicContact CB-CE3 4.01Å; P213-W284 HydrophobicContact CB-CZ3 4Å; P213-W284 HydrophobicContact CG-CE3 4.41Å; M215-W284 HydrophobicContact CB-CD2 3.85Å; M215-W284 HydrophobicContact CB-CE3 3.5Å; M215-W284 HydrophobicContact CB-CH2 4.24Å; M215-W284 HydrophobicContact CB-CZ3 3.68Å; M215-W284 HydrophobicContact CE-CD2 4.44Å; M215-W284 HydrophobicContact SD-CH2 4.37Å; M215-W284 HydrophobicContact SD-CZ2 4.15Å; W262-W284 AromaticContact CH2-CH2 3.5Å; W262-W284 HydrophobicContact CH2-CH2 3.5Å; W262-W284 AromaticContact CH2-CZ3 3.5Å; W262-W284 HydrophobicContact CH2-CZ3 3.5Å; W262-W284 VanDerWaalsContact CH2-CZ3 3.5Å; W262-W284 HydrophobicContact CZ2-CH2 4.48Å; W262-W284 HydrophobicContact CZ3-CH2 4.13Å; W262-W284 AromaticContact CZ3-CZ3 3.74Å; W262-W284 HydrophobicContact CZ3-CZ3 3.74Å; C265-W284 HydrophobicContact CB-CH2 4.08Å; C265-W284 HydrophobicContact CB-CZ3 4.16Å; F279-W284 HydrophobicContact CD1-CH2 4.25Å; F279-W284 AromaticContact CD1-CZ2 3.81Å; F279-W284 HydrophobicContact CD1-CZ2 3.81Å; F279-W284 PolarHBondContact O-NE1 3.39Å; F282-W284 HydrophobicContact CB-CD2 4.25Å; F282-W284 HydrophobicContact CB-CH2 4.36Å; F282-W284 HydrophobicContact CB-CZ2 3.67Å; F282-W284 HydrophobicContact CD2-CH2 4.42Å; F282-W284 AromaticContact CD2-CZ2 3.87Å; F282-W284 HydrophobicContact CD2-CZ2 3.87Å; F282-W284 HydrophobicContact CG-CH2 4.46Å; F282-W284 HydrophobicContact CG-CZ2 4.01Å; F282-W284 VanDerWaalsContact O-CD1 3.24Å; F282-W284 PolarHBondContact O-NE1 3.18Å; W284-K310 PolarHBondContact N-O 3Å; W284-T311 HydrophobicContact CB-CG2 4.22Å; W284-T311 CarbonylContact O-C 3.48Å; W284-T311 VanDerWaalsContact O-CA 3.29Å; W284-T311 WeakPolarHBondContact O-CA 3.5Å; W284-T312 PolarHBondContact O-N 3.12Å
285	R	92.6	Very high	89	Confident	68 Å²	68	40.6 Å²	40.6	26%	0.257	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	-41	178.4	-62.3	-55.6	-169	174.8	3.3	112.6	I210 G212 P213 N313	I210-R285 HydrophobicContact CG2-CB 4.26Å; I210-R285 HydrophobicContact CG2-CG 3.9Å; G212-R285 VanDerWaalsContact O-CG 3.32Å; G212-R285 WeakPolarHBondContact O-CG 3.29Å; P213-R285 PolarHBondContact O-N 3.5Å; R285-N313 PolarHBondContact O-N 3.49Å; R285-N313 VanDerWaalsContact O-N 3.12Å
286	Y	94.2	Very high	88.2	Confident	7 Å²	7	43 Å²	43	3%	0.027	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	142.9	166.4	-96.1	-88.7	0	0	0	110.7	Y177 L200 L201 M204 H214 M215 N313 L315	Y177-Y286 WeakPolarHBondContact CB-OH 3.45Å; Y177-Y286 AromaticContact CD2-CE2 3.92Å; Y177-Y286 HydrophobicContact CD2-CE2 3.92Å; Y177-Y286 WeakPolarHBondContact CD2-OH 3.46Å; Y177-Y286 HydrophobicContact CE2-CE2 4.44Å; L200-Y286 HydrophobicContact CD2-CE1 4.01Å; L201-Y286 HydrophobicContact CD2-CD2 4.39Å; L201-Y286 HydrophobicContact CD2-CG 4.38Å; M204-Y286 HydrophobicContact CE-CD2 4.34Å; M204-Y286 HydrophobicContact CE-CE2 4.12Å; M204-Y286 HydrophobicContact CG-CD2 4.46Å; M204-Y286 HydrophobicContact CG-CE2 4.22Å; M204-Y286 HydrophobicContact SD-CE2 4.07Å; H214-Y286 PolarHBondContact ND1-N 2.84Å; M215-Y286 PolarHBondContact N-O 3.13Å; Y286-N313 CarbonylContact C-O 3.59Å; Y286-N313 WeakPolarHBondContact CA-O 3.41Å; Y286-N313 HydrophobicContact CD1-CB 3.82Å; Y286-N313 HydrophobicContact CD2-CB 4.27Å; Y286-N313 HydrophobicContact CE1-CB 3.49Å; Y286-N313 VanDerWaalsContact CE1-CB 3.49Å; Y286-N313 HydrophobicContact CE2-CB 3.98Å; Y286-N313 HydrophobicContact CG-CB 4.19Å; Y286-L315 HydrophobicContact CD1-CB 4.45Å
287	L	94.8	Very high	87.5	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	109.8	162.6	170.5	56	0	0	0	109.2	M215 L217 I289 V306 T311 N313 R314 L315 F335	M215-L287 HydrophobicContact CB-CD1 4.19Å; M215-L287 HydrophobicContact CE-CD1 3.79Å; M215-L287 HydrophobicContact CG-CD1 4.09Å; L217-L287 HydrophobicContact CD1-CD1 3.82Å; L217-L287 HydrophobicContact CG-CD1 3.79Å; L287-I289 HydrophobicContact CD1-CG1 4.14Å; L287-I289 HydrophobicContact CD2-CD1 4.42Å; L287-I289 HydrophobicContact CG-CD1 4.35Å; L287-I289 HydrophobicContact CG-CG1 4.18Å; L287-V306 HydrophobicContact CD2-CG1 3.6Å; L287-T311 HydrophobicContact CB-CG2 3.79Å; L287-T311 HydrophobicContact CD2-CG2 3.84Å; L287-T311 HydrophobicContact CG-CG2 4.48Å; L287-N313 PolarHBondContact N-O 3.03Å; L287-R314 HydrophobicContact CB-CG 4.45Å; L287-R314 CarbonylContact O-C 3.58Å; L287-R314 WeakPolarHBondContact O-CA 3.25Å; L287-L315 PolarHBondContact O-N 2.87Å; L287-F335 HydrophobicContact CD2-CZ 3.91Å
288	V	95.3	Very high	86.8	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.006	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	137.5	173.7	-179.5	0	0	0	0	109.2	T197 M215 V216 L217 W226 L315 L317	T197-V288 HydrophobicContact CG2-CB 4.49Å; T197-V288 HydrophobicContact CG2-CG1 3.84Å; T197-V288 HydrophobicContact CG2-CG2 3.82Å; M215-V288 PolarHBondContact O-N 3.22Å; V216-V288 HydrophobicContact CB-CB 4.38Å; V216-V288 HydrophobicContact CG1-CB 4.08Å; V216-V288 HydrophobicContact CG1-CG1 4.06Å; V216-V288 HydrophobicContact CG2-CB 4.19Å; V216-V288 HydrophobicContact CG2-CG2 4.37Å; L217-V288 PolarHBondContact N-O 2.73Å; W226-V288 HydrophobicContact CH2-CG1 4.33Å; V288-L315 CarbonylContact C-O 3.56Å; V288-L315 WeakPolarHBondContact CA-O 3.16Å; V288-L315 HydrophobicContact CG2-CB 4.43Å; V288-L315 HydrophobicContact CG2-CD2 4.46Å; V288-L317 HydrophobicContact CG1-CD1 3.79Å; V288-L317 HydrophobicContact CG1-CG 4.13Å
289	I	93.1	Very high	86.2	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	112	176.9	-54.6	-171.7	0	0	0	109.9	L217 Y269 L287 A292 I295 V306 L315 L316 L317 F335	L217-I289 HydrophobicContact CB-CG1 4.39Å; L217-I289 HydrophobicContact CD1-CD1 4.23Å; L217-I289 HydrophobicContact CD1-CG1 4.14Å; L217-I289 HydrophobicContact CG-CG1 4.47Å; Y269-I289 HydrophobicContact CE1-CG2 4.02Å; Y269-I289 WeakPolarHBondContact OH-CG2 3.09Å; L287-I289 HydrophobicContact CD1-CG1 4.14Å; L287-I289 HydrophobicContact CD2-CD1 4.42Å; L287-I289 HydrophobicContact CG-CD1 4.35Å; L287-I289 HydrophobicContact CG-CG1 4.18Å; I289-A292 HydrophobicContact CG2-CB 4.31Å; I289-I295 HydrophobicContact CD1-CD1 4.16Å; I289-V306 HydrophobicContact CD1-CG1 4Å; I289-L315 PolarHBondContact N-O 2.67Å; I289-L316 HydrophobicContact CB-CD2 3.8Å; I289-L316 HydrophobicContact CD1-CD2 3.93Å; I289-L316 HydrophobicContact CG1-CD2 4.09Å; I289-L316 HydrophobicContact CG2-CD2 4.45Å; I289-L317 PolarHBondContact O-N 2.74Å; I289-F335 HydrophobicContact CD1-CE1 3.7Å; I289-F335 HydrophobicContact CD1-CE2 4.48Å; I289-F335 HydrophobicContact CD1-CZ 3.55Å
290	D	91.8	Very high	85.8	Confident	17 Å²	17	49.2 Å²	49.2	9%	0.091	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	134.8	179.3	-168.6	29.5	0	0	0	111.7	L217 V218 W226 Y269 L317	L217-D290 PolarHBondContact O-N 3.18Å; V218-D290 HydrophobicContact CB-CB 4.22Å; V218-D290 HydrophobicContact CG1-CB 3.86Å; W226-D290 HydrophobicContact CZ2-CB 4.09Å; W226-D290 PolarHBondContact NE1-OD2 3.38Å; Y269-D290 PolarHBondContact OH-O 2.92Å; D290-L317 HydrophobicContact CB-CD1 4.31Å
291	E	85.2	Confident	85.4	Confident	19 Å²	19	52.1 Å²	52.1	9%	0.089	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	55.6	-165.9	-69.7	-62	166.5	0	0	113.2	M189 P219 H293 R294 L317	M189-E291 WeakPolarHBondContact CE-OE1 3.44Å; P219-E291 HydrophobicContact CG-CB 4.01Å; P219-E291 HydrophobicContact CG-CG 4.16Å; E291-H293 PolarHBondContact O-N 3.02Å; E291-H293 IonicContact OE2-CE1 2.74Å; E291-H293 PolarHBondContact OE2-CE1 2.84Å; E291-H293 VanDerWaalsContact OE2-CE1 3.28Å; E291-H293 IonicContact OE2-ND1 3.45Å; E291-H293 PolarHBondContact OE2-ND1 3.48Å; E291-R294 WeakPolarHBondContact O-CG 3.3Å; E291-R294 PolarHBondContact O-N 2.97Å; E291-R294 VanDerWaalsContact O-N 3.11Å; E291-L317 PolarHBondContact N-O 3.12Å
292	A	82.5	Confident	85.1	Confident	6 Å²	6	46.1 Å²	46.1	5%	0.05	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-57.5	-8.9	-178.1	0	0	0	0	0	115.5	I289 R294 I295 L316 L317	I289-A292 HydrophobicContact CG2-CB 4.31Å; A292-R294 PolarHBondContact O-N 3.28Å; A292-I295 WeakPolarHBondContact O-CG1 3.34Å; A292-I295 PolarHBondContact O-N 3.37Å; A292-L316 HydrophobicContact CB-CB 3.95Å; A292-L316 HydrophobicContact CB-CD2 4.1Å; A292-L316 HydrophobicContact CB-CG 4.45Å; A292-L317 WeakPolarHBondContact CB-O 3.46Å; A292-L317 PolarHBondContact N-O 3.49Å
293	H	75.9	Confident	84.8	Confident	67 Å²	67	44.7 Å²	44.7	31%	0.31	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-53.6	-20.4	167.1	73.9	-109.4	0	0	0	112.6	E291 I295 K296	E291-H293 PolarHBondContact O-N 3.02Å; E291-H293 IonicContact OE2-CE1 2.74Å; E291-H293 PolarHBondContact OE2-CE1 2.84Å; E291-H293 VanDerWaalsContact OE2-CE1 3.28Å; E291-H293 IonicContact OE2-ND1 3.45Å; E291-H293 PolarHBondContact OE2-ND1 3.48Å; H293-I295 VanDerWaalsContact C-N 3.35Å; H293-I295 PolarHBondContact O-N 3.23Å; H293-K296 WeakPolarHBondContact O-CD 3.46Å; H293-K296 WeakPolarHBondContact O-CG 3.32Å
294	R	75.8	Confident	84.6	Confident	139 Å²	139	46.9 Å²	46.9	53%	0.525	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-69	-22.7	176	-67.2	-65.2	177.1	141.3	1.8	115.3	Y269 E291 A292 L302	Y269-R294 HydrophobicContact CD2-CG 4.45Å; Y269-R294 HydrophobicContact CE1-CB 4.41Å; Y269-R294 HydrophobicContact CE2-CB 4.22Å; Y269-R294 HydrophobicContact CE2-CG 3.95Å; E291-R294 WeakPolarHBondContact O-CG 3.3Å; E291-R294 PolarHBondContact O-N 2.97Å; E291-R294 VanDerWaalsContact O-N 3.11Å; A292-R294 PolarHBondContact O-N 3.28Å; R294-L302 HydrophobicContact CB-CD2 4.29Å
295	I	76.6	Confident	84.4	Confident	3 Å²	3	47.4 Å²	47.4	2%	0.015	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-101.3	7.4	-178.9	60.3	159.1	0	0	0	114	I289 A292 H293 N297 L302 L316 L332 F335	I289-I295 HydrophobicContact CD1-CD1 4.16Å; A292-I295 WeakPolarHBondContact O-CG1 3.34Å; A292-I295 PolarHBondContact O-N 3.37Å; H293-I295 VanDerWaalsContact C-N 3.35Å; H293-I295 PolarHBondContact O-N 3.23Å; I295-N297 PolarHBondContact O-N 3.46Å; I295-L302 HydrophobicContact CG2-CD2 3.89Å; I295-L302 HydrophobicContact CG2-CG 4.12Å; I295-L316 HydrophobicContact CD1-CD1 4.33Å; I295-L316 HydrophobicContact CD1-CD2 3.76Å; I295-L332 HydrophobicContact CD1-CD2 3.89Å; I295-L332 HydrophobicContact CG1-CD2 3.83Å; I295-F335 HydrophobicContact CD1-CD1 3.9Å; I295-F335 HydrophobicContact CD1-CD2 4.34Å; I295-F335 HydrophobicContact CD1-CE1 4.21Å; I295-F335 HydrophobicContact CD1-CG 3.97Å
296	K	75.6	Confident	84.1	Confident	87 Å²	87	44.2 Å²	44.2	38%	0.378	20%	0.203	S	C	.	.			trans	-61.5	-16.3	-173.9	79.9	-165.7	-161.4	102.4	0	115.8	H293 E328	H293-K296 WeakPolarHBondContact O-CD 3.46Å; H293-K296 WeakPolarHBondContact O-CG 3.32Å; K296-E328 HydrophobicContact CB-CB 4.37Å; K296-E328 HydrophobicContact CB-CG 4.2Å; K296-E328 VanDerWaalsContact CD-OE2 3.28Å; K296-E328 WeakPolarHBondContact CD-OE2 3.08Å; K296-E328 HydrophobicContact CG-CG 4.29Å; K296-E328 IonicContact NZ-OE1 3.41Å; K296-E328 PolarHBondContact NZ-OE1 2.96Å; K296-E328 IonicContact NZ-OE2 3.07Å; K296-E328 PolarHBondContact NZ-OE2 2.9Å
297	N	75.3	Confident	83.8	Confident	87 Å²	87	47.6 Å²	47.6	47%	0.465	22%	0.216	S	C	.	.			trans	-106	113.4	174.8	179	2.8	0	0	0	109.8	I295 K299 S300 S303	I295-N297 PolarHBondContact O-N 3.46Å; N297-K299 PolarHBondContact O-N 3.36Å; N297-K299 PolarHBondContact OD1-N 3.42Å; N297-S300 WeakPolarHBondContact O-CB 3.39Å; N297-S300 PolarHBondContact O-N 3.25Å; N297-S300 VanDerWaalsContact O-N 3.13Å; N297-S300 PolarHBondContact O-OG 2.92Å; N297-S303 WeakPolarHBondContact O-CB 3.43Å
298	E	75.3	Confident	83.5	Confident	37 Å²	37	52 Å²	52	17%	0.173	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-40.3	176.4	75.8	-172.9	147.4	0	0	112.1	S300 S303 H327 W330 A331	E298-S300 PolarHBondContact O-N 3.28Å; E298-S303 WeakPolarHBondContact CA-OG 3.45Å; E298-S303 VanDerWaalsContact O-CB 3.3Å; E298-S303 WeakPolarHBondContact O-CB 3.41Å; E298-S303 PolarHBondContact O-OG 3.38Å; E298-H327 VanDerWaalsContact CD-NE2 3.29Å; E298-H327 IonicContact OE1-CD2 3.84Å; E298-H327 IonicContact OE1-CE1 3.34Å; E298-H327 IonicContact OE1-NE2 2.68Å; E298-H327 PolarHBondContact OE1-NE2 3.26Å; E298-H327 IonicContact OE2-CE1 2.71Å; E298-H327 IonicContact OE2-NE2 3.95Å; E298-W330 HydrophobicContact CB-CZ3 4.41Å; E298-W330 WeakPolarHBondContact OE2-CZ3 3.33Å; E298-A331 HydrophobicContact CB-CB 4.46Å
299	K	78.6	Confident	83.2	Confident	149 Å²	149	52.2 Å²	52.2	65%	0.648	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.8	15.8	-173.2	-50.3	-169.9	167	82.4	0	112	N297	N297-K299 PolarHBondContact O-N 3.36Å; N297-K299 PolarHBondContact OD1-N 3.42Å
300	S	81.8	Confident	83.1	Confident	29 Å²	29	58.4 Å²	58.4	20%	0.203	26%	0.264	C	S	.	.	S	Bend	trans	-87	134.2	170.6	66.6	0	0	0	0	109.2	N297 E298 L302 S303 E304	N297-S300 WeakPolarHBondContact O-CB 3.39Å; N297-S300 PolarHBondContact O-N 3.25Å; N297-S300 VanDerWaalsContact O-N 3.13Å; N297-S300 PolarHBondContact O-OG 2.92Å; E298-S300 PolarHBondContact O-N 3.28Å; S300-L302 CarbonylContact O-C 3.51Å; S300-L302 PolarHBondContact O-N 3.48Å; S300-S303 WeakPolarHBondContact O-CA 3.42Å; S300-S303 WeakPolarHBondContact O-CB 3.4Å; S300-S303 PolarHBondContact O-N 2.73Å; S300-S303 VanDerWaalsContact OG-CB 3.27Å; S300-S303 WeakPolarHBondContact OG-CB 3.21Å; S300-S303 PolarHBondContact OG-N 3.36Å; S300-E304 PolarHBondContact O-N 2.88Å
301	K	83.6	Confident	83	Confident	151 Å²	151	58.6 Å²	58.6	66%	0.657	27%	0.266	S	S	*	.	H	α-helix	trans	-51.8	-28.3	175.2	-65.2	-176.9	178.2	-178.5	0	113.2	E304 I305	K301-E304 WeakPolarHBondContact CA-OE2 2.93Å; K301-I305 WeakPolarHBondContact O-CB 3.38Å; K301-I305 WeakPolarHBondContact O-CD1 3.31Å; K301-I305 WeakPolarHBondContact O-CG1 3.22Å; K301-I305 PolarHBondContact O-N 3.02Å
302	L	84.3	Confident	83.3	Confident	19 Å²	19	58.3 Å²	58.3	10%	0.099	27%	0.265	C	S	.	.	H	α-helix	trans	-67.1	-53.8	173	177.7	64.5	0	0	0	111.6	Y269 L272 R294 I295 S300 E304 I305 V306	Y269-L302 HydrophobicContact CD1-CD1 3.74Å; Y269-L302 HydrophobicContact CD1-CD2 3.44Å; Y269-L302 VanDerWaalsContact CD1-CD2 3.44Å; Y269-L302 HydrophobicContact CD1-CG 4.19Å; Y269-L302 HydrophobicContact CE1-CD2 3.84Å; Y269-L302 HydrophobicContact CG-CD2 4.08Å; L272-L302 HydrophobicContact CD2-CD1 3.94Å; R294-L302 HydrophobicContact CB-CD2 4.29Å; I295-L302 HydrophobicContact CG2-CD2 3.89Å; I295-L302 HydrophobicContact CG2-CG 4.12Å; S300-L302 CarbonylContact O-C 3.51Å; S300-L302 PolarHBondContact O-N 3.48Å; L302-E304 VanDerWaalsContact C-N 3.32Å; L302-E304 PolarHBondContact O-N 2.65Å; L302-I305 PolarHBondContact O-N 2.68Å; L302-V306 HydrophobicContact CD1-CG2 3.7Å; L302-V306 HydrophobicContact CG-CG2 4.29Å; L302-V306 WeakPolarHBondContact O-CB 3.33Å; L302-V306 WeakPolarHBondContact O-CG2 3.25Å; L302-V306 PolarHBondContact O-N 3.49Å
303	S	84	Confident	83.7	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.014	26%	0.263	C	S	.	.	H	α-helix	trans	-53.8	-50.7	174.6	162.8	0	0	0	0	110.8	N297 E298 S300 V306 R307	N297-S303 WeakPolarHBondContact O-CB 3.43Å; E298-S303 WeakPolarHBondContact CA-OG 3.45Å; E298-S303 VanDerWaalsContact O-CB 3.3Å; E298-S303 WeakPolarHBondContact O-CB 3.41Å; E298-S303 PolarHBondContact O-OG 3.38Å; S300-S303 WeakPolarHBondContact O-CA 3.42Å; S300-S303 WeakPolarHBondContact O-CB 3.4Å; S300-S303 PolarHBondContact O-N 2.73Å; S300-S303 VanDerWaalsContact OG-CB 3.27Å; S300-S303 WeakPolarHBondContact OG-CB 3.21Å; S300-S303 PolarHBondContact OG-N 3.36Å; S303-V306 PolarHBondContact O-N 3.1Å; S303-R307 WeakPolarHBondContact O-CB 3.48Å; S303-R307 WeakPolarHBondContact O-CD 3.28Å; S303-R307 WeakPolarHBondContact O-CG 3.46Å; S303-R307 PolarHBondContact O-N 3.48Å; S303-R307 PolarHBondContact OG-NE 3.21Å
304	E	86.6	Confident	84.5	Confident	96 Å²	96	56 Å²	56	45%	0.449	25%	0.253	S	S	.	.	H	α-helix	trans	-51.8	-60.2	177.2	-67.1	168.2	177	0	0	111.7	S300 K301 L302 V306 R307 E308	S300-E304 PolarHBondContact O-N 2.88Å; K301-E304 WeakPolarHBondContact CA-OE2 2.93Å; L302-E304 VanDerWaalsContact C-N 3.32Å; L302-E304 PolarHBondContact O-N 2.65Å; E304-V306 PolarHBondContact O-N 3.1Å; E304-R307 WeakPolarHBondContact O-CB 3.43Å; E304-R307 PolarHBondContact O-N 3.19Å; E304-E308 WeakPolarHBondContact O-CG 3.41Å; E304-E308 PolarHBondContact O-N 2.69Å
305	I	88.9	Confident	85.3	Confident	12 Å²	12	49.5 Å²	49.5	6%	0.062	23%	0.229	C	C	.	.	H	α-helix	trans	-63.4	-39.6	-176.3	-66.5	164.5	0	0	0	111.6	L272 I273 K276 K301 L302 R307 E308 F309	L272-I305 HydrophobicContact CD2-CB 4.32Å; L272-I305 HydrophobicContact CD2-CG2 3.74Å; I273-I305 HydrophobicContact CB-CD1 4.37Å; I273-I305 HydrophobicContact CG1-CD1 4.2Å; I273-I305 HydrophobicContact CG2-CD1 4.14Å; K276-I305 HydrophobicContact CB-CG2 3.81Å; K276-I305 HydrophobicContact CD-CD1 3.89Å; K276-I305 HydrophobicContact CD-CG1 4.01Å; K276-I305 HydrophobicContact CD-CG2 4.07Å; K301-I305 WeakPolarHBondContact O-CB 3.38Å; K301-I305 WeakPolarHBondContact O-CD1 3.31Å; K301-I305 WeakPolarHBondContact O-CG1 3.22Å; K301-I305 PolarHBondContact O-N 3.02Å; L302-I305 PolarHBondContact O-N 2.68Å; I305-R307 VanDerWaalsContact C-N 3.26Å; I305-R307 PolarHBondContact O-N 3Å; I305-E308 WeakPolarHBondContact O-CB 3.4Å; I305-E308 PolarHBondContact O-N 3.47Å; I305-E308 VanDerWaalsContact O-N 3.07Å; I305-F309 HydrophobicContact CG2-CE2 3.98Å; I305-F309 HydrophobicContact CG2-CZ 3.79Å; I305-F309 WeakPolarHBondContact O-CD2 3.3Å; I305-F309 WeakPolarHBondContact O-CE2 3.49Å
306	V	87.9	Confident	86.1	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-68	-29.1	-178.9	-179.3	0	0	0	0	111.7	L217 L272 L287 I289 L302 S303 E304 E308 F335	L217-V306 HydrophobicContact CD1-CG1 4.16Å; L217-V306 HydrophobicContact CD1-CG2 3.91Å; L272-V306 HydrophobicContact CD1-CG2 4.02Å; L272-V306 HydrophobicContact CD2-CG2 3.62Å; L272-V306 HydrophobicContact CG-CG2 4.5Å; L287-V306 HydrophobicContact CD2-CG1 3.6Å; I289-V306 HydrophobicContact CD1-CG1 4Å; L302-V306 HydrophobicContact CD1-CG2 3.7Å; L302-V306 HydrophobicContact CG-CG2 4.29Å; L302-V306 WeakPolarHBondContact O-CB 3.33Å; L302-V306 WeakPolarHBondContact O-CG2 3.25Å; L302-V306 PolarHBondContact O-N 3.49Å; S303-V306 PolarHBondContact O-N 3.1Å; E304-V306 PolarHBondContact O-N 3.1Å; V306-E308 VanDerWaalsContact C-N 3.32Å; V306-F335 HydrophobicContact CB-CE2 4.35Å; V306-F335 HydrophobicContact CG1-CE2 3.68Å; V306-F335 HydrophobicContact CG1-CZ 3.69Å
307	R	86.4	Confident	86.8	Confident	78 Å²	78	45.3 Å²	45.3	29%	0.294	21%	0.21	S	C	.	.	H	α-helix	trans	-71.5	-22.7	172.2	-68	157.4	175.5	-108.5	-13.3	113.2	S303 E304 I305 F309 A331 N334 F335	S303-R307 WeakPolarHBondContact O-CB 3.48Å; S303-R307 WeakPolarHBondContact O-CD 3.28Å; S303-R307 WeakPolarHBondContact O-CG 3.46Å; S303-R307 PolarHBondContact O-N 3.48Å; S303-R307 PolarHBondContact OG-NE 3.21Å; E304-R307 WeakPolarHBondContact O-CB 3.43Å; E304-R307 PolarHBondContact O-N 3.19Å; I305-R307 VanDerWaalsContact C-N 3.26Å; I305-R307 PolarHBondContact O-N 3Å; R307-F309 VanDerWaalsContact C-N 3.27Å; R307-F309 PolarHBondContact O-N 3.24Å; R307-A331 PolarHBondContact NH2-O 3.04Å; R307-N334 PolarHBondContact NH1-OD1 2.78Å; R307-N334 PolarHBondContact NH2-OD1 3.25Å; R307-F335 HydrophobicContact CG-CD2 4.04Å; R307-F335 HydrophobicContact CG-CE2 4.28Å
308	E	88.3	Confident	87.3	Confident	93 Å²	93	41.2 Å²	41.2	44%	0.435	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-10.7	177.6	-53.8	-174.6	101.5	0	0	114	K280 E304 I305 V306	K280-E308 VanDerWaalsContact CE-CD 3.45Å; K280-E308 WeakPolarHBondContact CE-OE2 3.27Å; K280-E308 IonicContact NZ-OE1 3.07Å; K280-E308 PolarHBondContact NZ-OE1 2.84Å; K280-E308 IonicContact NZ-OE2 2.69Å; K280-E308 PolarHBondContact NZ-OE2 3.07Å; E304-E308 WeakPolarHBondContact O-CG 3.41Å; E304-E308 PolarHBondContact O-N 2.69Å; I305-E308 WeakPolarHBondContact O-CB 3.4Å; I305-E308 PolarHBondContact O-N 3.47Å; I305-E308 VanDerWaalsContact O-N 3.07Å; V306-E308 VanDerWaalsContact C-N 3.32Å
309	F	89.9	Confident	87.2	Confident	6 Å²	6	40.3 Å²	40.3	3%	0.026	19%	0.189	C	C	.	.	S	Bend	trans	-85.5	137.7	-177.6	-60.3	-58.7	0	0	0	113.1	M215 L272 F279 K280 I305 R307 T311	M215-F309 HydrophobicContact CE-CD2 3.9Å; M215-F309 HydrophobicContact CE-CE2 4.22Å; M215-F309 HydrophobicContact CE-CG 4.31Å; L272-F309 HydrophobicContact CD1-CE2 3.7Å; L272-F309 HydrophobicContact CD1-CZ 4.25Å; L272-F309 HydrophobicContact CD2-CE2 4.03Å; L272-F309 HydrophobicContact CD2-CZ 4.39Å; L272-F309 HydrophobicContact CG-CE2 3.9Å; L272-F309 HydrophobicContact CG-CZ 4.08Å; F279-F309 HydrophobicContact CB-CD1 4.21Å; F279-F309 HydrophobicContact CB-CE1 3.41Å; F279-F309 VanDerWaalsContact CB-CE1 3.41Å; F279-F309 HydrophobicContact CB-CZ 3.73Å; K280-F309 HydrophobicContact CB-CE1 4.46Å; K280-F309 HydrophobicContact CG-CD1 3.87Å; K280-F309 HydrophobicContact CG-CE1 3.69Å; I305-F309 HydrophobicContact CG2-CE2 3.98Å; I305-F309 HydrophobicContact CG2-CZ 3.79Å; I305-F309 WeakPolarHBondContact O-CD2 3.3Å; I305-F309 WeakPolarHBondContact O-CE2 3.49Å; R307-F309 VanDerWaalsContact C-N 3.27Å; R307-F309 PolarHBondContact O-N 3.24Å; F309-T311 HydrophobicContact CB-CG2 4.28Å; F309-T311 PolarHBondContact O-N 2.9Å
310	K	90.2	Very high	86.5	Confident	129 Å²	129	35 Å²	35	56%	0.561	17%	0.169	S	C	*	.			trans	-70.1	113.7	169.2	-67.6	-179.3	175.9	-174.8	0	109.3	N283 W284	N283-K310 WeakPolarHBondContact OD1-CD 3.47Å; W284-K310 PolarHBondContact N-O 3Å
311	T	91.1	Very high	85.4	Confident	21 Å²	21	35 Å²	35	13%	0.129	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	130.2	-176.8	57.3	0	0	0	0	110.2	W284 L287 F309 R314	W284-T311 HydrophobicContact CB-CG2 4.22Å; W284-T311 CarbonylContact O-C 3.48Å; W284-T311 VanDerWaalsContact O-CA 3.29Å; W284-T311 WeakPolarHBondContact O-CA 3.5Å; L287-T311 HydrophobicContact CB-CG2 3.79Å; L287-T311 HydrophobicContact CD2-CG2 3.84Å; L287-T311 HydrophobicContact CG-CG2 4.48Å; F309-T311 HydrophobicContact CB-CG2 4.28Å; F309-T311 PolarHBondContact O-N 2.9Å; T311-R314 PolarHBondContact OG1-NE 3.5Å; T311-R314 PolarHBondContact OG1-NH2 2.85Å; T311-R314 VanDerWaalsContact OG1-NH2 3.08Å
312	T	89.8	Confident	84.2	Confident	13 Å²	13	30.1 Å²	30.1	8%	0.08	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	-59.3	170.2	-46.5	0	0	0	0	110.4	D69 W284	D69-T312 WeakPolarHBondContact OD2-CG2 3.36Å; W284-T312 PolarHBondContact O-N 3.12Å
313	N	90.9	Very high	82.8	Confident	2 Å²	2	31.2 Å²	31.2	1%	0.011	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	156.4	179.1	-66.9	-64.6	0	0	0	113.4	Y177 N182 R285 Y286 L287	Y177-N313 WeakPolarHBondContact CD2-ND2 3.41Å; N182-N313 WeakPolarHBondContact OD1-CA 3.45Å; N182-N313 PolarHBondContact OD1-OD1 3.13Å; R285-N313 PolarHBondContact O-N 3.49Å; R285-N313 VanDerWaalsContact O-N 3.12Å; Y286-N313 CarbonylContact C-O 3.59Å; Y286-N313 WeakPolarHBondContact CA-O 3.41Å; Y286-N313 HydrophobicContact CD1-CB 3.82Å; Y286-N313 HydrophobicContact CD2-CB 4.27Å; Y286-N313 HydrophobicContact CE1-CB 3.49Å; Y286-N313 VanDerWaalsContact CE1-CB 3.49Å; Y286-N313 HydrophobicContact CE2-CB 3.98Å; Y286-N313 HydrophobicContact CG-CB 4.19Å; L287-N313 PolarHBondContact N-O 3.03Å
314	R	92.9	Very high	81.5	Confident	24 Å²	24	32.7 Å²	32.7	9%	0.091	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	134.2	-175.6	-62.6	178.3	177.7	177.8	-0.3	110.2	N182 G183 L287 T311 F335	N182-R314 WeakPolarHBondContact CA-O 3.36Å; N182-R314 HydrophobicContact CB-CB 4.12Å; N182-R314 VanDerWaalsContact CB-O 3.31Å; N182-R314 WeakPolarHBondContact CB-O 3.44Å; N182-R314 PolarHBondContact OD1-N 3.05Å; N182-R314 PolarHBondContact OD1-O 2.98Å; G183-R314 PolarHBondContact N-O 3.03Å; L287-R314 HydrophobicContact CB-CG 4.45Å; L287-R314 CarbonylContact O-C 3.58Å; L287-R314 WeakPolarHBondContact O-CA 3.25Å; T311-R314 PolarHBondContact OG1-NE 3.5Å; T311-R314 PolarHBondContact OG1-NH2 2.85Å; T311-R314 VanDerWaalsContact OG1-NH2 3.08Å; R314-F335 HydrophobicContact CB-CE1 4.37Å; R314-F335 WeakPolarHBondContact CD-O 3.41Å; R314-F335 HydrophobicContact CG-CE1 4.43Å; R314-F335 PolarHBondContact NH1-O 2.95Å
315	L	93.8	Very high	80.2	Confident	2 Å²	2	31.1 Å²	31.1	1%	0.01	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	120.3	178.8	175.5	59.4	0	0	0	110.2	L173 L185 T197 L200 Y286 L287 V288 I289 L317	L173-L315 HydrophobicContact CD2-CD1 3.63Å; L173-L315 HydrophobicContact CD2-CD2 4.06Å; L185-L315 HydrophobicContact CB-CD1 4.44Å; T197-L315 HydrophobicContact CG2-CD2 3.9Å; L200-L315 HydrophobicContact CD2-CD2 4.18Å; Y286-L315 HydrophobicContact CD1-CB 4.45Å; L287-L315 PolarHBondContact O-N 2.87Å; V288-L315 CarbonylContact C-O 3.56Å; V288-L315 WeakPolarHBondContact CA-O 3.16Å; V288-L315 HydrophobicContact CG2-CB 4.43Å; V288-L315 HydrophobicContact CG2-CD2 4.46Å; I289-L315 PolarHBondContact N-O 2.67Å; L315-L317 HydrophobicContact CD1-CD2 4.2Å; L315-L317 HydrophobicContact CD2-CD2 4.07Å; L315-L317 HydrophobicContact CG-CD2 3.85Å
316	L	92.4	Very high	79.2	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.005	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	131.5	176.8	-60.2	-177.5	0	0	0	110.2	G183 I184 L185 I289 A292 I295 L332 F335 L336	G183-L316 PolarHBondContact O-N 2.96Å; I184-L316 CarbonylContact C-O 3.47Å; I184-L316 WeakPolarHBondContact CA-O 3.42Å; I184-L316 HydrophobicContact CG1-CB 4.36Å; I184-L316 HydrophobicContact CG1-CD1 4.42Å; I184-L316 HydrophobicContact CG2-CB 4.3Å; L185-L316 PolarHBondContact N-O 3.44Å; I289-L316 HydrophobicContact CB-CD2 3.8Å; I289-L316 HydrophobicContact CD1-CD2 3.93Å; I289-L316 HydrophobicContact CG1-CD2 4.09Å; I289-L316 HydrophobicContact CG2-CD2 4.45Å; A292-L316 HydrophobicContact CB-CB 3.95Å; A292-L316 HydrophobicContact CB-CD2 4.1Å; A292-L316 HydrophobicContact CB-CG 4.45Å; I295-L316 HydrophobicContact CD1-CD1 4.33Å; I295-L316 HydrophobicContact CD1-CD2 3.76Å; L316-L332 HydrophobicContact CD1-CB 4.41Å; L316-L332 HydrophobicContact CD1-CD2 3.93Å; L316-F335 HydrophobicContact CD1-CD1 4.18Å; L316-F335 HydrophobicContact CD2-CD1 3.87Å; L316-F335 HydrophobicContact CD2-CE1 3.75Å; L316-F335 HydrophobicContact CG-CD1 4.35Å; L316-L336 HydrophobicContact CD1-CD1 4.4Å; L316-L336 HydrophobicContact CD1-CD2 4.01Å; L316-L336 HydrophobicContact CD1-CG 4.1Å; L316-L336 HydrophobicContact CG-CD2 3.97Å
317	L	91.5	Very high	78.6	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	128.7	174.6	-42.7	176.3	0	0	0	108.8	L185 K193 W226 V288 I289 D290 E291 A292 L315	L185-L317 HydrophobicContact CB-CD2 3.79Å; L185-L317 HydrophobicContact CD2-CD2 4.17Å; K193-L317 HydrophobicContact CD-CB 4.46Å; W226-L317 HydrophobicContact CH2-CD1 3.68Å; W226-L317 HydrophobicContact CZ2-CD1 3.59Å; V288-L317 HydrophobicContact CG1-CD1 3.79Å; V288-L317 HydrophobicContact CG1-CG 4.13Å; I289-L317 PolarHBondContact O-N 2.74Å; D290-L317 HydrophobicContact CB-CD1 4.31Å; E291-L317 PolarHBondContact N-O 3.12Å; A292-L317 WeakPolarHBondContact CB-O 3.46Å; A292-L317 PolarHBondContact N-O 3.49Å; L315-L317 HydrophobicContact CD1-CD2 4.2Å; L315-L317 HydrophobicContact CD2-CD2 4.07Å; L315-L317 HydrophobicContact CG-CD2 3.85Å
318	T	85.8	Confident	78.1	Confident	2 Å²	2	32.4 Å²	32.4	1%	0.012	17%	0.166	C	C	.	.			trans	-135.8	139.8	176.8	-179.3	0	0	0	0	111.5	I184 L185 A186 K193 T320 L322	I184-T318 HydrophobicContact CG2-CG2 4.06Å; L185-T318 PolarHBondContact O-N 2.97Å; L185-T318 VanDerWaalsContact O-N 3.12Å; A186-T318 HydrophobicContact CB-CG2 3.57Å; K193-T318 VanDerWaalsContact CE-O 3.26Å; K193-T318 WeakPolarHBondContact CE-O 3.36Å; K193-T318 PolarHBondContact NZ-O 2.87Å; T318-T320 PolarHBondContact OG1-N 3.23Å; T318-T320 VanDerWaalsContact OG1-N 3.15Å; T318-T320 PolarHBondContact OG1-O 3.06Å; T318-T320 PolarHBondContact OG1-OG1 3.18Å; T318-L322 HydrophobicContact CG2-CD2 4.21Å
319	G	72.3	Confident	77.5	Confident	17 Å²	17	28.8 Å²	28.8	18%	0.175	15%	0.149	C	C	.	.	S	Bend	trans	-87.7	-23.9	167.3	0	0	0	0	0	113.7
320	T	65.1	Low	77	Confident	38 Å²	38	29 Å²	29	23%	0.233	15%	0.15	C	C	.	.	S	Bend	trans	-98.1	150.4	-174.8	51.2	0	0	0	0	112.1	T318	T318-T320 PolarHBondContact OG1-N 3.23Å; T318-T320 VanDerWaalsContact OG1-N 3.15Å; T318-T320 PolarHBondContact OG1-O 3.06Å; T318-T320 PolarHBondContact OG1-OG1 3.18Å
321	P	58.7	Low	76.6	Confident	28 Å²	28	22.9 Å²	22.9	18%	0.182	12%	0.123	C	C	.	.			trans	-56	145.2	168.6	26.1	-35.7	0	0	0	111.6	Q323 I614	P321-Q323 HydrophobicContact CB-CG 4.4Å; P321-Q323 PolarHBondContact O-N 2.96Å; P321-Q323 VanDerWaalsContact O-N 3.13Å; P321-I614 HydrophobicContact CB-CD1 3.98Å; P321-I614 HydrophobicContact CB-CG1 4.22Å; P321-I614 HydrophobicContact CG-CD1 4.03Å
322	L	58.1	Low	76.2	Confident	49 Å²	49	22.4 Å²	22.4	26%	0.257	12%	0.12	S	C	.	.	S	Bend	trans	-80.2	84.5	171.8	-59.9	-174.7	0	0	0	109.5	I184 T318 L329 L332 L374	I184-L322 HydrophobicContact CD1-CD1 3.7Å; T318-L322 HydrophobicContact CG2-CD2 4.21Å; L322-L329 HydrophobicContact CB-CD1 4.34Å; L322-L329 HydrophobicContact CD1-CD1 4Å; L322-L332 HydrophobicContact CD1-CD1 4.46Å; L322-L332 HydrophobicContact CD2-CD1 3.73Å; L322-L374 HydrophobicContact CD1-CD1 3.57Å; L322-L374 HydrophobicContact CG-CD1 4.36Å
323	Q	55.1	Low	75.7	Confident	42 Å²	42	22 Å²	22	20%	0.196	12%	0.117	C	C	.	.			trans	-145.1	158.1	-174.8	-78.4	-169.8	-28.6	0	0	115.1	P321 V613	P321-Q323 HydrophobicContact CB-CG 4.4Å; P321-Q323 PolarHBondContact O-N 2.96Å; P321-Q323 VanDerWaalsContact O-N 3.13Å; Q323-V613 PolarHBondContact NE2-O 3.25Å
324	N	56	Low	75.5	Confident	34 Å²	34	22.3 Å²	22.3	18%	0.182	12%	0.119	C	C	.	.	S	Bend	trans	99.7	-0.5	175.7	-58.5	-70	0	0	0	118	N625	N324-N625 PolarHBondContact OD1-ND2 2.96Å
325	N	60.1	Low	75.1	Confident	63 Å²	63	21.3 Å²	21.3	34%	0.337	12%	0.115	S	C	.	.			trans	-162.4	137.8	167	-166.6	-8.6	0	0	0	112	H327 E328 L329	N325-H327 VanDerWaalsContact C-N 3.31Å; N325-H327 PolarHBondContact OD1-N 2.96Å; N325-E328 HydrophobicContact CB-CB 4.05Å; N325-E328 HydrophobicContact CB-CG 3.83Å; N325-E328 PolarHBondContact O-N 3.15Å; N325-L329 PolarHBondContact O-N 3.47Å
326	L	67.5	Low	74.7	Confident	26 Å²	26	21.2 Å²	21.2	14%	0.136	12%	0.115	C	C	.	.	H	α-helix	trans	-60.6	-40.9	168.5	-81.6	171.4	0	0	0	111.4	E328 L329 W330 F347 F351 L366 L619	L326-E328 VanDerWaalsContact C-N 3.27Å; L326-E328 PolarHBondContact O-N 3.08Å; L326-L329 CarbonylContact O-C 3.4Å; L326-L329 WeakPolarHBondContact O-CA 3.34Å; L326-L329 WeakPolarHBondContact O-CB 3.4Å; L326-L329 PolarHBondContact O-N 3.37Å; L326-W330 PolarHBondContact O-N 3.07Å; L326-F347 HydrophobicContact CD2-CE1 4.45Å; L326-F351 HydrophobicContact CD1-CB 3.62Å; L326-F351 HydrophobicContact CD1-CD1 4.23Å; L326-F351 HydrophobicContact CD1-CD2 4.3Å; L326-F351 HydrophobicContact CD1-CG 3.8Å; L326-F351 HydrophobicContact CD2-CD1 4.09Å; L326-F351 HydrophobicContact CD2-CD2 4.26Å; L326-F351 HydrophobicContact CD2-CE1 4.21Å; L326-F351 HydrophobicContact CD2-CE2 4.41Å; L326-F351 HydrophobicContact CD2-CG 4.14Å; L326-F351 HydrophobicContact CD2-CZ 4.38Å; L326-L366 HydrophobicContact CD2-CD1 3.64Å; L326-L619 HydrophobicContact CD1-CD1 3.76Å; L326-L619 HydrophobicContact CD2-CD1 3.95Å; L326-L619 HydrophobicContact CD2-CD2 4.17Å; L326-L619 HydrophobicContact CG-CD1 3.67Å; L326-L619 HydrophobicContact CG-CD2 4.08Å
327	H	74.8	Confident	74.2	Confident	43 Å²	43	21.3 Å²	21.3	20%	0.199	12%	0.115	C	C	.	.	H	α-helix	trans	-65.7	-29	-179.6	-163.4	50.6	0	0	0	113.1	E298 N325 W330 A331	E298-H327 VanDerWaalsContact CD-NE2 3.29Å; E298-H327 IonicContact OE1-CD2 3.84Å; E298-H327 IonicContact OE1-CE1 3.34Å; E298-H327 IonicContact OE1-NE2 2.68Å; E298-H327 PolarHBondContact OE1-NE2 3.26Å; E298-H327 IonicContact OE2-CE1 2.71Å; E298-H327 IonicContact OE2-NE2 3.95Å; N325-H327 VanDerWaalsContact C-N 3.31Å; N325-H327 PolarHBondContact OD1-N 2.96Å; H327-W330 AromaticContact CE1-CE3 3.46Å; H327-W330 VanDerWaalsContact CE1-CE3 3.46Å; H327-W330 AromaticContact CE1-CZ3 3.65Å; H327-W330 AromaticContact ND1-CE3 3.6Å; H327-A331 VanDerWaalsContact O-CB 3.24Å; H327-A331 WeakPolarHBondContact O-CB 3.39Å; H327-A331 PolarHBondContact O-N 3.4Å
328	E	75.3	Confident	73.6	Confident	48 Å²	48	23.7 Å²	23.7	22%	0.224	13%	0.131	C	C	.	.	H	α-helix	trans	-73.4	-31.5	172.8	-69.8	-174.1	-171.2	0	0	111.7	K296 N325 L326 L332	K296-E328 HydrophobicContact CB-CB 4.37Å; K296-E328 HydrophobicContact CB-CG 4.2Å; K296-E328 VanDerWaalsContact CD-OE2 3.28Å; K296-E328 WeakPolarHBondContact CD-OE2 3.08Å; K296-E328 HydrophobicContact CG-CG 4.29Å; K296-E328 IonicContact NZ-OE1 3.41Å; K296-E328 PolarHBondContact NZ-OE1 2.96Å; K296-E328 IonicContact NZ-OE2 3.07Å; K296-E328 PolarHBondContact NZ-OE2 2.9Å; N325-E328 HydrophobicContact CB-CB 4.05Å; N325-E328 HydrophobicContact CB-CG 3.83Å; N325-E328 PolarHBondContact O-N 3.15Å; L326-E328 VanDerWaalsContact C-N 3.27Å; L326-E328 PolarHBondContact O-N 3.08Å; E328-L332 WeakPolarHBondContact O-CD1 3.16Å; E328-L332 VanDerWaalsContact O-CG 3.27Å; E328-L332 WeakPolarHBondContact O-CG 3.45Å; E328-L332 PolarHBondContact O-N 2.71Å
329	L	75.5	Confident	73.2	Confident	16 Å²	16	27.4 Å²	27.4	8%	0.084	15%	0.151	C	C	.	.	H	α-helix	trans	-71.4	-45.4	172.1	-173.6	71.6	0	0	0	111.2	L322 N325 L326 A331 L332 L333 L366 L370	L322-L329 HydrophobicContact CB-CD1 4.34Å; L322-L329 HydrophobicContact CD1-CD1 4Å; N325-L329 PolarHBondContact O-N 3.47Å; L326-L329 CarbonylContact O-C 3.4Å; L326-L329 WeakPolarHBondContact O-CA 3.34Å; L326-L329 WeakPolarHBondContact O-CB 3.4Å; L326-L329 PolarHBondContact O-N 3.37Å; L329-A331 PolarHBondContact O-N 3Å; L329-L332 PolarHBondContact O-N 3.34Å; L329-L333 HydrophobicContact CG-CD1 4.27Å; L329-L333 PolarHBondContact O-N 2.94Å; L329-L366 HydrophobicContact CD2-CD1 3.73Å; L329-L366 HydrophobicContact CD2-CD2 3.84Å; L329-L366 HydrophobicContact CD2-CG 3.91Å; L329-L370 HydrophobicContact CD1-CD1 3.83Å; L329-L370 HydrophobicContact CD1-CD2 3.94Å; L329-L370 HydrophobicContact CD2-CD1 3.98Å; L329-L370 HydrophobicContact CD2-CD2 4.23Å; L329-L370 HydrophobicContact CD2-CG 4.43Å; L329-L370 HydrophobicContact CG-CD2 4.33Å
330	W	80.9	Confident	73.5	Confident	10 Å²	10	26.8 Å²	26.8	4%	0.038	14%	0.144	C	C	.	.	H	α-helix	trans	-56.6	-48.3	173.8	174.9	81.7	0	0	0	111.2	E298 L326 H327 L332 L333 N334 F341 S343 S344 F347	E298-W330 HydrophobicContact CB-CZ3 4.41Å; E298-W330 WeakPolarHBondContact OE2-CZ3 3.33Å; L326-W330 PolarHBondContact O-N 3.07Å; H327-W330 AromaticContact CE1-CE3 3.46Å; H327-W330 VanDerWaalsContact CE1-CE3 3.46Å; H327-W330 AromaticContact CE1-CZ3 3.65Å; H327-W330 AromaticContact ND1-CE3 3.6Å; W330-L332 PolarHBondContact O-N 3.05Å; W330-L332 VanDerWaalsContact O-N 3.1Å; W330-L333 PolarHBondContact O-N 3.02Å; W330-N334 HydrophobicContact CD2-CB 4.21Å; W330-N334 HydrophobicContact CH2-CB 4.32Å; W330-N334 HydrophobicContact CZ2-CB 3.85Å; W330-N334 VanDerWaalsContact O-CB 3.23Å; W330-N334 WeakPolarHBondContact O-CB 3.39Å; W330-N334 PolarHBondContact O-N 3.4Å; W330-F341 PolarHBondContact NE1-O 2.64Å; W330-S343 PolarHBondContact NE1-O 3.41Å; W330-S344 VanDerWaalsContact CZ2-N 3.35Å; W330-F347 HydrophobicContact CB-CD1 3.72Å; W330-F347 HydrophobicContact CB-CE1 3.69Å; W330-F347 HydrophobicContact CB-CG 4.2Å; W330-F347 HydrophobicContact CB-CZ 4.13Å; W330-F347 VanDerWaalsContact CD1-CB 3.43Å; W330-F347 AromaticContact CD1-CD1 3.81Å; W330-F347 AromaticContact CD1-CD2 3.68Å; W330-F347 AromaticContact CD1-CG 3.39Å; W330-F347 HydrophobicContact CG-CB 4.29Å; W330-F347 HydrophobicContact CG-CD1 4.04Å; W330-F347 HydrophobicContact CG-CE1 4.44Å; W330-F347 HydrophobicContact CG-CG 4.08Å
331	A	82.1	Confident	74.1	Confident	1 Å²	1	25.2 Å²	25.2	1%	0.008	13%	0.133	C	C	.	.	H	α-helix	trans	-58.5	-28.9	-179.3	0	0	0	0	0	113	E298 R307 H327 L329 F335	E298-A331 HydrophobicContact CB-CB 4.46Å; R307-A331 PolarHBondContact NH2-O 3.04Å; H327-A331 VanDerWaalsContact O-CB 3.24Å; H327-A331 WeakPolarHBondContact O-CB 3.39Å; H327-A331 PolarHBondContact O-N 3.4Å; L329-A331 PolarHBondContact O-N 3Å; A331-F335 VanDerWaalsContact O-CB 3.28Å; A331-F335 WeakPolarHBondContact O-CB 3.28Å; A331-F335 PolarHBondContact O-N 3.39Å
332	L	81.1	Confident	75.1	Confident	11 Å²	11	29 Å²	29	6%	0.058	15%	0.152	C	C	.	.	H	α-helix	trans	-82.3	-41.4	173.6	-62.7	169	0	0	0	112.3	I295 L316 L322 E328 L329 W330 F335 L336	I295-L332 HydrophobicContact CD1-CD2 3.89Å; I295-L332 HydrophobicContact CG1-CD2 3.83Å; L316-L332 HydrophobicContact CD1-CB 4.41Å; L316-L332 HydrophobicContact CD1-CD2 3.93Å; L322-L332 HydrophobicContact CD1-CD1 4.46Å; L322-L332 HydrophobicContact CD2-CD1 3.73Å; E328-L332 WeakPolarHBondContact O-CD1 3.16Å; E328-L332 VanDerWaalsContact O-CG 3.27Å; E328-L332 WeakPolarHBondContact O-CG 3.45Å; E328-L332 PolarHBondContact O-N 2.71Å; L329-L332 PolarHBondContact O-N 3.34Å; W330-L332 PolarHBondContact O-N 3.05Å; W330-L332 VanDerWaalsContact O-N 3.1Å; L332-F335 WeakPolarHBondContact O-CB 3.22Å; L332-F335 PolarHBondContact O-N 3.13Å; L332-L336 WeakPolarHBondContact O-CG 3.44Å; L332-L336 PolarHBondContact O-N 3.34Å
333	L	80.9	Confident	76.1	Confident	5 Å²	5	28 Å²	28	3%	0.026	15%	0.149	C	C	.	.	H	α-helix	trans	-63.5	-46.8	175.3	-79	174.5	0	0	0	112.3	L329 W330 F335 L336 L337 F341 F347 L370 F373	L329-L333 HydrophobicContact CG-CD1 4.27Å; L329-L333 PolarHBondContact O-N 2.94Å; W330-L333 PolarHBondContact O-N 3.02Å; L333-F335 VanDerWaalsContact C-N 3.26Å; L333-F335 PolarHBondContact O-N 2.88Å; L333-L336 PolarHBondContact O-N 3.08Å; L333-L336 VanDerWaalsContact O-N 3.16Å; L333-L337 PolarHBondContact O-N 3.28Å; L333-F341 HydrophobicContact CB-CD2 3.93Å; L333-F341 HydrophobicContact CB-CE2 4.24Å; L333-F341 HydrophobicContact CB-CG 4.26Å; L333-F341 HydrophobicContact CD1-CZ 4.45Å; L333-F341 HydrophobicContact CD2-CE2 4.27Å; L333-F347 HydrophobicContact CD1-CE2 3.95Å; L333-F347 HydrophobicContact CD1-CZ 4.16Å; L333-L370 HydrophobicContact CD1-CD2 4Å; L333-L370 HydrophobicContact CD2-CD2 3.86Å; L333-L370 HydrophobicContact CG-CD2 4.17Å; L333-F373 HydrophobicContact CD2-CD2 4.21Å; L333-F373 HydrophobicContact CD2-CE2 4.44Å
334	N	85.1	Confident	77.3	Confident	9 Å²	9	27.4 Å²	27.4	5%	0.048	15%	0.15	C	C	.	.	H	α-helix	trans	-63.2	-29.4	171.4	168.8	-95	0	0	0	112.3	R307 W330 P338 F341	R307-N334 PolarHBondContact NH1-OD1 2.78Å; R307-N334 PolarHBondContact NH2-OD1 3.25Å; W330-N334 HydrophobicContact CD2-CB 4.21Å; W330-N334 HydrophobicContact CH2-CB 4.32Å; W330-N334 HydrophobicContact CZ2-CB 3.85Å; W330-N334 VanDerWaalsContact O-CB 3.23Å; W330-N334 WeakPolarHBondContact O-CB 3.39Å; W330-N334 PolarHBondContact O-N 3.4Å; N334-P338 VanDerWaalsContact O-CA 3.26Å; N334-P338 WeakPolarHBondContact O-CA 3.37Å; N334-P338 WeakPolarHBondContact O-CB 3.27Å; N334-P338 WeakPolarHBondContact O-CD 3.48Å; N334-P338 VanDerWaalsContact O-N 3.16Å; N334-F341 HydrophobicContact CB-CB 4.12Å; N334-F341 WeakPolarHBondContact CB-O 3.15Å; N334-F341 PolarHBondContact ND2-O 3.43Å
335	F	85.1	Confident	78.4	Confident	2 Å²	2	33.1 Å²	33.1	1%	0.009	18%	0.175	C	C	.	.	H	α-helix	trans	-70	-37.6	171.3	-177.5	-93.6	0	0	0	112.6	L287 I289 I295 V306 R307 R314 L316 A331 L332 L333	L287-F335 HydrophobicContact CD2-CZ 3.91Å; I289-F335 HydrophobicContact CD1-CE1 3.7Å; I289-F335 HydrophobicContact CD1-CE2 4.48Å; I289-F335 HydrophobicContact CD1-CZ 3.55Å; I295-F335 HydrophobicContact CD1-CD1 3.9Å; I295-F335 HydrophobicContact CD1-CD2 4.34Å; I295-F335 HydrophobicContact CD1-CE1 4.21Å; I295-F335 HydrophobicContact CD1-CG 3.97Å; V306-F335 HydrophobicContact CB-CE2 4.35Å; V306-F335 HydrophobicContact CG1-CE2 3.68Å; V306-F335 HydrophobicContact CG1-CZ 3.69Å; R307-F335 HydrophobicContact CG-CD2 4.04Å; R307-F335 HydrophobicContact CG-CE2 4.28Å; R314-F335 HydrophobicContact CB-CE1 4.37Å; R314-F335 WeakPolarHBondContact CD-O 3.41Å; R314-F335 HydrophobicContact CG-CE1 4.43Å; R314-F335 PolarHBondContact NH1-O 2.95Å; L316-F335 HydrophobicContact CD1-CD1 4.18Å; L316-F335 HydrophobicContact CD2-CD1 3.87Å; L316-F335 HydrophobicContact CD2-CE1 3.75Å; L316-F335 HydrophobicContact CG-CD1 4.35Å; A331-F335 VanDerWaalsContact O-CB 3.28Å; A331-F335 WeakPolarHBondContact O-CB 3.28Å; A331-F335 PolarHBondContact O-N 3.39Å; L332-F335 WeakPolarHBondContact O-CB 3.22Å; L332-F335 PolarHBondContact O-N 3.13Å; L333-F335 VanDerWaalsContact C-N 3.26Å; L333-F335 PolarHBondContact O-N 2.88Å
336	L	84.6	Confident	79.2	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-73.8	-48	176.6	-66.7	164.8	0	0	0	111.8	N182 I184 L316 L332 L333	N182-L336 HydrophobicContact CB-CB 4.02Å; N182-L336 HydrophobicContact CB-CD2 3.74Å; N182-L336 HydrophobicContact CB-CG 4.49Å; N182-L336 PolarHBondContact ND2-O 3.05Å; I184-L336 HydrophobicContact CD1-CD1 3.81Å; I184-L336 HydrophobicContact CG1-CD1 3.57Å; L316-L336 HydrophobicContact CD1-CD1 4.4Å; L316-L336 HydrophobicContact CD1-CD2 4.01Å; L316-L336 HydrophobicContact CD1-CG 4.1Å; L316-L336 HydrophobicContact CG-CD2 3.97Å; L332-L336 WeakPolarHBondContact O-CG 3.44Å; L332-L336 PolarHBondContact O-N 3.34Å; L333-L336 PolarHBondContact O-N 3.08Å; L333-L336 VanDerWaalsContact O-N 3.16Å
337	L	82.1	Confident	79.6	Confident	2 Å²	2	33.9 Å²	33.9	1%	0.01	18%	0.179	C	C	.	.			trans	-131.1	71.6	-172.8	-65.6	-176.2	0	0	0	111	R73 L77 L333 D339 V340 F341 F373	R73-L337 HydrophobicContact CG-CD2 4.48Å; L77-L337 HydrophobicContact CD1-CD1 4.1Å; L333-L337 PolarHBondContact O-N 3.28Å; L337-D339 PolarHBondContact O-N 2.76Å; L337-V340 HydrophobicContact CB-CB 4.34Å; L337-V340 HydrophobicContact CB-CG2 4.43Å; L337-V340 PolarHBondContact O-N 3.41Å; L337-F341 HydrophobicContact CB-CD2 4.21Å; L337-F341 PolarHBondContact O-N 3.39Å; L337-F341 VanDerWaalsContact O-N 3.1Å; L337-F373 HydrophobicContact CD1-CE1 3.59Å; L337-F373 HydrophobicContact CD1-CZ 3.61Å
338	P	79.6	Confident	79.5	Confident	50 Å²	50	34.1 Å²	34.1	33%	0.325	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-25.6	179.5	26.7	-35.3	0	0	0	112.7	N334 V340	N334-P338 VanDerWaalsContact O-CA 3.26Å; N334-P338 WeakPolarHBondContact O-CA 3.37Å; N334-P338 WeakPolarHBondContact O-CB 3.27Å; N334-P338 WeakPolarHBondContact O-CD 3.48Å; N334-P338 VanDerWaalsContact O-N 3.16Å; P338-V340 PolarHBondContact O-N 2.77Å
339	D	77.3	Confident	79.4	Confident	81 Å²	81	35.1 Å²	35.1	43%	0.433	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-19.1	178.5	-48.5	-46.7	0	0	0	113.7	R73 L337	R73-D339 IonicContact NH1-OD2 3.74Å; R73-D339 PolarHBondContact NH1-OD2 2.78Å; L337-D339 PolarHBondContact O-N 2.76Å
340	V	77.8	Confident	79	Confident	4 Å²	4	37 Å²	37	2%	0.024	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112	-44.3	-174.6	-179.2	0	0	0	0	111.1	F74 L77 F87 L337 P338	F74-V340 HydrophobicContact CE1-CG2 4.16Å; L77-V340 HydrophobicContact CD1-CG2 4.41Å; F87-V340 HydrophobicContact CB-CG1 3.93Å; L337-V340 HydrophobicContact CB-CB 4.34Å; L337-V340 HydrophobicContact CB-CG2 4.43Å; L337-V340 PolarHBondContact O-N 3.41Å; P338-V340 PolarHBondContact O-N 2.77Å
341	F	78.5	Confident	78.3	Confident	4 Å²	4	37.2 Å²	37.2	2%	0.018	20%	0.201	C	C	.	.	S	Bend	trans	-103.7	45.3	-176.7	-62.5	-72	0	0	0	111.7	F84 F87 W330 L333 N334 L337 S343 F347	F84-F341 HydrophobicContact CD1-CZ 4.45Å; F84-F341 HydrophobicContact CE1-CZ 4.09Å; F87-F341 HydrophobicContact CD1-CD1 4.45Å; F87-F341 HydrophobicContact CD1-CE1 4.45Å; F87-F341 HydrophobicContact CD2-CE1 4.21Å; F87-F341 HydrophobicContact CE2-CE1 4.39Å; F87-F341 HydrophobicContact CG-CE1 4.25Å; W330-F341 PolarHBondContact NE1-O 2.64Å; L333-F341 HydrophobicContact CB-CD2 3.93Å; L333-F341 HydrophobicContact CB-CE2 4.24Å; L333-F341 HydrophobicContact CB-CG 4.26Å; L333-F341 HydrophobicContact CD1-CZ 4.45Å; L333-F341 HydrophobicContact CD2-CE2 4.27Å; N334-F341 HydrophobicContact CB-CB 4.12Å; N334-F341 WeakPolarHBondContact CB-O 3.15Å; N334-F341 PolarHBondContact ND2-O 3.43Å; L337-F341 HydrophobicContact CB-CD2 4.21Å; L337-F341 PolarHBondContact O-N 3.39Å; L337-F341 VanDerWaalsContact O-N 3.1Å; F341-S343 VanDerWaalsContact C-N 3.28Å; F341-S343 PolarHBondContact O-N 2.83Å; F341-F347 AromaticContact CD1-CD2 3.98Å; F341-F347 HydrophobicContact CD1-CD2 3.98Å; F341-F347 HydrophobicContact CD1-CE2 4.27Å; F341-F347 HydrophobicContact CE1-CD2 4.28Å; F341-F347 HydrophobicContact CE1-CE2 4.28Å
342	N	79.4	Confident	77.1	Confident	108 Å²	108	43.3 Å²	43.3	58%	0.578	23%	0.234	S	C	*	.			trans	-63.5	-27.5	-169.5	65.5	-5.9	0	0	0	114.8
343	S	80.2	Confident	75.4	Confident	28 Å²	28	47 Å²	47	20%	0.196	26%	0.257	C	S	.	.			trans	-117.4	135.2	-173	175.6	0	0	0	0	110.9	W330 F341 E345 D346	W330-S343 PolarHBondContact NE1-O 3.41Å; F341-S343 VanDerWaalsContact C-N 3.28Å; F341-S343 PolarHBondContact O-N 2.83Å; S343-E345 PolarHBondContact OG-N 3.46Å; S343-D346 WeakPolarHBondContact CB-OD2 3.49Å; S343-D346 PolarHBondContact OG-N 3.17Å; S343-D346 PolarHBondContact OG-OD2 3.29Å
344	S	78.8	Confident	73.8	Confident	29 Å²	29	54.8 Å²	54.8	20%	0.203	30%	0.299	C	S	.	.	S	Bend	trans	-80.1	-35.1	170	61.1	0	0	0	0	111.2	W330 D346 F347 D348	W330-S344 VanDerWaalsContact CZ2-N 3.35Å; S344-D346 PolarHBondContact O-N 2.87Å; S344-F347 PolarHBondContact O-N 3.25Å; S344-D348 VanDerWaalsContact O-CB 3.29Å; S344-D348 WeakPolarHBondContact O-CB 3.25Å; S344-D348 VanDerWaalsContact O-CG 3.32Å; S344-D348 PolarHBondContact O-N 2.93Å
345	E	78.9	Confident	72	Confident	154 Å²	154	61.8 Å²	61.8	72%	0.72	34%	0.336	S	S	*	.	H	α-helix	trans	-67.1	-36.8	-177.8	-63.5	179.5	-174.5	0	0	111.9	S343 S349	S343-E345 PolarHBondContact OG-N 3.46Å; E345-S349 VanDerWaalsContact O-CB 3.23Å; E345-S349 WeakPolarHBondContact O-CB 3.39Å; E345-S349 PolarHBondContact O-N 3.11Å; E345-S349 PolarHBondContact O-OG 3.32Å
346	D	77.1	Confident	70.2	Confident	99 Å²	99	64.1 Å²	64.1	53%	0.529	35%	0.352	S	S	.	.	H	α-helix	trans	-76.1	-23.5	175	-60.5	-73.2	0	0	0	112.9	S343 S344	S343-D346 WeakPolarHBondContact CB-OD2 3.49Å; S343-D346 PolarHBondContact OG-N 3.17Å; S343-D346 PolarHBondContact OG-OD2 3.29Å; S344-D346 PolarHBondContact O-N 2.87Å
347	F	75.7	Confident	68	Low	7 Å²	7	73 Å²	73	3%	0.031	40%	0.398	C	S	.	.	H	α-helix	trans	-78.5	-54.9	171.3	-175.9	-89.9	0	0	0	110.2	L326 W330 L333 F341 S344 S349 W350 F351	L326-F347 HydrophobicContact CD2-CE1 4.45Å; W330-F347 HydrophobicContact CB-CD1 3.72Å; W330-F347 HydrophobicContact CB-CE1 3.69Å; W330-F347 HydrophobicContact CB-CG 4.2Å; W330-F347 HydrophobicContact CB-CZ 4.13Å; W330-F347 VanDerWaalsContact CD1-CB 3.43Å; W330-F347 AromaticContact CD1-CD1 3.81Å; W330-F347 AromaticContact CD1-CD2 3.68Å; W330-F347 AromaticContact CD1-CG 3.39Å; W330-F347 HydrophobicContact CG-CB 4.29Å; W330-F347 HydrophobicContact CG-CD1 4.04Å; W330-F347 HydrophobicContact CG-CE1 4.44Å; W330-F347 HydrophobicContact CG-CG 4.08Å; L333-F347 HydrophobicContact CD1-CE2 3.95Å; L333-F347 HydrophobicContact CD1-CZ 4.16Å; F341-F347 AromaticContact CD1-CD2 3.98Å; F341-F347 HydrophobicContact CD1-CD2 3.98Å; F341-F347 HydrophobicContact CD1-CE2 4.27Å; F341-F347 HydrophobicContact CE1-CD2 4.28Å; F341-F347 HydrophobicContact CE1-CE2 4.28Å; S344-F347 PolarHBondContact O-N 3.25Å; F347-S349 VanDerWaalsContact C-N 3.34Å; F347-S349 PolarHBondContact O-N 2.84Å; F347-W350 WeakPolarHBondContact O-CA 3.32Å; F347-W350 VanDerWaalsContact O-CB 3.27Å; F347-W350 WeakPolarHBondContact O-CB 3.35Å; F347-W350 PolarHBondContact O-N 2.98Å; F347-F351 AromaticContact CD1-CD2 3.82Å; F347-F351 HydrophobicContact CD1-CD2 3.82Å; F347-F351 AromaticContact CD1-CE2 3.71Å; F347-F351 HydrophobicContact CD1-CE2 3.71Å; F347-F351 HydrophobicContact CD2-CE2 4.03Å; F347-F351 AromaticContact CE1-CD2 3.74Å; F347-F351 HydrophobicContact CE1-CD2 3.74Å; F347-F351 AromaticContact CE1-CE2 3.34Å; F347-F351 HydrophobicContact CE1-CE2 3.34Å; F347-F351 HydrophobicContact CE1-CZ 4.28Å; F347-F351 AromaticContact CE2-CE2 3.71Å; F347-F351 HydrophobicContact CE2-CE2 3.71Å; F347-F351 HydrophobicContact CE2-CZ 4.38Å; F347-F351 HydrophobicContact CG-CD2 4.37Å; F347-F351 HydrophobicContact CG-CE2 4.05Å; F347-F351 HydrophobicContact CZ-CD2 4.24Å; F347-F351 AromaticContact CZ-CE2 3.37Å; F347-F351 HydrophobicContact CZ-CE2 3.37Å; F347-F351 AromaticContact CZ-CZ 3.99Å; F347-F351 HydrophobicContact CZ-CZ 3.99Å; F347-F351 WeakPolarHBondContact O-CD2 3.43Å; F347-F351 PolarHBondContact O-N 3.15Å
348	D	74.1	Confident	66.6	Low	47 Å²	47	75.3 Å²	75.3	25%	0.251	42%	0.423	S	S	.	.	H	α-helix	trans	-56.1	-46.8	179.4	-71.8	-23.7	0	0	0	110.3	S344 W350 F351 D352	S344-D348 VanDerWaalsContact O-CB 3.29Å; S344-D348 WeakPolarHBondContact O-CB 3.25Å; S344-D348 VanDerWaalsContact O-CG 3.32Å; S344-D348 PolarHBondContact O-N 2.93Å; D348-W350 VanDerWaalsContact C-N 3.25Å; D348-W350 PolarHBondContact O-N 3.11Å; D348-F351 CarbonylContact O-C 3.56Å; D348-F351 WeakPolarHBondContact O-CA 3.06Å; D348-F351 PolarHBondContact O-N 2.93Å; D348-D352 WeakPolarHBondContact O-CB 3.46Å; D348-D352 PolarHBondContact O-N 3.21Å
349	S	72.8	Confident	65.3	Low	70 Å²	70	76.6 Å²	76.6	49%	0.49	43%	0.427	S	S	.	.	H	α-helix	trans	-67.1	-17.4	176.4	60.7	0	0	0	0	115.4	E345 F347 F351	E345-S349 VanDerWaalsContact O-CB 3.23Å; E345-S349 WeakPolarHBondContact O-CB 3.39Å; E345-S349 PolarHBondContact O-N 3.11Å; E345-S349 PolarHBondContact O-OG 3.32Å; F347-S349 VanDerWaalsContact C-N 3.34Å; F347-S349 PolarHBondContact O-N 2.84Å; S349-F351 VanDerWaalsContact C-N 3.3Å
350	W	67.3	Low	64.3	Low	55 Å²	55	77 Å²	77	21%	0.208	43%	0.427	C	S	.	.	H	α-helix	trans	-75.4	-20.3	169.2	-168.3	92.6	0	0	0	112.2	L83 H86 F87 F347 D348 L362 R365	L83-W350 HydrophobicContact CD1-CH2 4.4Å; L83-W350 HydrophobicContact CD1-CZ2 4.49Å; L83-W350 HydrophobicContact CD2-CZ2 4.25Å; H86-W350 AromaticContact CE1-CD1 3.87Å; H86-W350 AromaticContact ND1-CD1 3.94Å; F87-W350 HydrophobicContact CZ-CB 4.32Å; F87-W350 AromaticContact CZ-CD2 3.99Å; F87-W350 HydrophobicContact CZ-CD2 3.99Å; F87-W350 AromaticContact CZ-CG 3.88Å; F87-W350 HydrophobicContact CZ-CG 3.88Å; F347-W350 WeakPolarHBondContact O-CA 3.32Å; F347-W350 VanDerWaalsContact O-CB 3.27Å; F347-W350 WeakPolarHBondContact O-CB 3.35Å; F347-W350 PolarHBondContact O-N 2.98Å; D348-W350 VanDerWaalsContact C-N 3.25Å; D348-W350 PolarHBondContact O-N 3.11Å; W350-L362 HydrophobicContact CZ3-CD1 4.17Å; W350-R365 HydrophobicContact CH2-CB 4.47Å
351	F	65	Low	63.5	Low	14 Å²	14	83 Å²	83	6%	0.061	45%	0.452	C	S	.	.	H	α-helix	trans	-100.9	-36.2	172.6	-67.4	-80.2	0	0	0	113.2	L326 F347 D348 S349 T353 L362 L366	L326-F351 HydrophobicContact CD1-CB 3.62Å; L326-F351 HydrophobicContact CD1-CD1 4.23Å; L326-F351 HydrophobicContact CD1-CD2 4.3Å; L326-F351 HydrophobicContact CD1-CG 3.8Å; L326-F351 HydrophobicContact CD2-CD1 4.09Å; L326-F351 HydrophobicContact CD2-CD2 4.26Å; L326-F351 HydrophobicContact CD2-CE1 4.21Å; L326-F351 HydrophobicContact CD2-CE2 4.41Å; L326-F351 HydrophobicContact CD2-CG 4.14Å; L326-F351 HydrophobicContact CD2-CZ 4.38Å; F347-F351 AromaticContact CD1-CD2 3.82Å; F347-F351 HydrophobicContact CD1-CD2 3.82Å; F347-F351 AromaticContact CD1-CE2 3.71Å; F347-F351 HydrophobicContact CD1-CE2 3.71Å; F347-F351 HydrophobicContact CD2-CE2 4.03Å; F347-F351 AromaticContact CE1-CD2 3.74Å; F347-F351 HydrophobicContact CE1-CD2 3.74Å; F347-F351 AromaticContact CE1-CE2 3.34Å; F347-F351 HydrophobicContact CE1-CE2 3.34Å; F347-F351 HydrophobicContact CE1-CZ 4.28Å; F347-F351 AromaticContact CE2-CE2 3.71Å; F347-F351 HydrophobicContact CE2-CE2 3.71Å; F347-F351 HydrophobicContact CE2-CZ 4.38Å; F347-F351 HydrophobicContact CG-CD2 4.37Å; F347-F351 HydrophobicContact CG-CE2 4.05Å; F347-F351 HydrophobicContact CZ-CD2 4.24Å; F347-F351 AromaticContact CZ-CE2 3.37Å; F347-F351 HydrophobicContact CZ-CE2 3.37Å; F347-F351 AromaticContact CZ-CZ 3.99Å; F347-F351 HydrophobicContact CZ-CZ 3.99Å; F347-F351 WeakPolarHBondContact O-CD2 3.43Å; F347-F351 PolarHBondContact O-N 3.15Å; D348-F351 CarbonylContact O-C 3.56Å; D348-F351 WeakPolarHBondContact O-CA 3.06Å; D348-F351 PolarHBondContact O-N 2.93Å; S349-F351 VanDerWaalsContact C-N 3.3Å; F351-T353 VanDerWaalsContact C-N 3.35Å; F351-T353 PolarHBondContact O-N 3.41Å; F351-L362 HydrophobicContact CD1-CD1 3.79Å; F351-L362 HydrophobicContact CD1-CD2 4.05Å; F351-L362 HydrophobicContact CD1-CG 3.93Å; F351-L362 HydrophobicContact CE1-CD1 4.03Å; F351-L362 HydrophobicContact CE1-CG 4.32Å; F351-L366 HydrophobicContact CE1-CB 4.19Å; F351-L366 HydrophobicContact CE1-CD1 3.75Å; F351-L366 HydrophobicContact CE1-CG 4.44Å; F351-L366 HydrophobicContact CZ-CB 4.5Å; F351-L366 HydrophobicContact CZ-CD1 3.94Å; F351-L366 HydrophobicContact CZ-CG 4.48Å
352	D	56.9	Low	62.6	Low	129 Å²	129	84.1 Å²	84.1	69%	0.69	46%	0.459	S	S	*	.			trans	-82.5	74.4	179.7	-91.9	-6.1	0	0	0	111	D348	D348-D352 WeakPolarHBondContact O-CB 3.46Å; D348-D352 PolarHBondContact O-N 3.21Å
353	T	46.6	Very low	61.8	Low	88 Å²	88	79.9 Å²	79.9	54%	0.54	44%	0.436	S	S	.	.			trans	-106.1	133.3	154.1	-45.4	0	0	0	0	108.8	F351 N355 C356	F351-T353 VanDerWaalsContact C-N 3.35Å; F351-T353 PolarHBondContact O-N 3.41Å; T353-N355 PolarHBondContact O-N 2.67Å; T353-C356 PolarHBondContact O-N 3.01Å; T353-C356 VanDerWaalsContact O-N 3.09Å
354	N	46.3	Very low	61.2	Low	169 Å²	169	84.1 Å²	84.1	90%	0.904	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	25.9	-170.6	-73.6	-71.6	0	0	0	116.2
355	N	48.1	Very low	60.7	Low	157 Å²	157	89.3 Å²	89.3	84%	0.84	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.8	-2.8	171.8	-86.7	-28.4	0	0	0	113.2	T353 L357	T353-N355 PolarHBondContact O-N 2.67Å; N355-L357 PolarHBondContact O-N 3.34Å
356	C	46.5	Very low	60.2	Low	51 Å²	51	82.9 Å²	82.9	35%	0.345	44%	0.439	S	S	.	.			trans	-89.8	10.5	-164.3	-66.7	0	0	0	0	116.3	T353 G358 L362	T353-C356 PolarHBondContact O-N 3.01Å; T353-C356 VanDerWaalsContact O-N 3.09Å; C356-G358 VanDerWaalsContact C-N 3.3Å; C356-G358 PolarHBondContact O-N 3.05Å; C356-L362 HydrophobicContact CB-CD2 4Å
357	L	39.8	Very low	59.7	Low	186 Å²	186	82.4 Å²	82.4	97%	0.974	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	77.4	175.8	-84.2	166.2	0	0	0	112.4	N355	N355-L357 PolarHBondContact O-N 3.34Å
358	G	51.7	Low	59.6	Low	51 Å²	51	85.4 Å²	85.4	53%	0.526	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	142.4	-12	168	0	0	0	0	0	116.2	C356 Q360	C356-G358 VanDerWaalsContact C-N 3.3Å; C356-G358 PolarHBondContact O-N 3.05Å; G358-Q360 PolarHBondContact O-N 2.72Å
359	D	52.8	Low	59.5	Low	78 Å²	78	83.9 Å²	83.9	42%	0.417	44%	0.444	S	S	.	.			trans	-75.7	109.7	-170.6	-165.9	-0.8	0	0	0	112.8	K361 L362	D359-K361 PolarHBondContact O-N 3.44Å; D359-K361 WeakPolarHBondContact OD1-CB 3.22Å; D359-K361 WeakPolarHBondContact OD1-CD 3.09Å; D359-K361 WeakPolarHBondContact OD1-CG 3.37Å; D359-K361 PolarHBondContact OD1-N 3.34Å; D359-L362 PolarHBondContact O-N 3.36Å
360	Q	55.3	Low	59.6	Low	89 Å²	89	81 Å²	81	42%	0.416	42%	0.424	S	S	.	.	H	α-helix	trans	-60.4	-23.1	176.3	-72	172.6	-69.1	0	0	112.4	G358 L362 V363 E364	G358-Q360 PolarHBondContact O-N 2.72Å; Q360-L362 VanDerWaalsContact C-N 3.34Å; Q360-L362 PolarHBondContact O-N 3.16Å; Q360-V363 WeakPolarHBondContact O-CB 3.38Å; Q360-V363 PolarHBondContact O-N 3.02Å; Q360-E364 WeakPolarHBondContact O-CG 3.25Å; Q360-E364 PolarHBondContact O-N 2.91Å
361	K	61.8	Low	60	Low	130 Å²	130	88.1 Å²	88.1	57%	0.565	45%	0.451	S	S	*	.	H	α-helix	trans	-67.6	-31.8	-179.4	-62	167.1	-174.1	168	0	113.1	D359 V363 E364 R365	D359-K361 PolarHBondContact O-N 3.44Å; D359-K361 WeakPolarHBondContact OD1-CB 3.22Å; D359-K361 WeakPolarHBondContact OD1-CD 3.09Å; D359-K361 WeakPolarHBondContact OD1-CG 3.37Å; D359-K361 PolarHBondContact OD1-N 3.34Å; K361-V363 VanDerWaalsContact C-N 3.35Å; K361-E364 PolarHBondContact O-N 2.91Å; K361-R365 VanDerWaalsContact O-CG 3.27Å; K361-R365 WeakPolarHBondContact O-CG 3.17Å; K361-R365 PolarHBondContact O-N 3.46Å
362	L	60.8	Low	60.6	Low	28 Å²	28	88 Å²	88	15%	0.147	45%	0.451	C	S	.	.	H	α-helix	trans	-69.1	-39.1	176.7	-177.1	58.7	0	0	0	110.9	W350 F351 C356 D359 Q360 R365 L366	W350-L362 HydrophobicContact CZ3-CD1 4.17Å; F351-L362 HydrophobicContact CD1-CD1 3.79Å; F351-L362 HydrophobicContact CD1-CD2 4.05Å; F351-L362 HydrophobicContact CD1-CG 3.93Å; F351-L362 HydrophobicContact CE1-CD1 4.03Å; F351-L362 HydrophobicContact CE1-CG 4.32Å; C356-L362 HydrophobicContact CB-CD2 4Å; D359-L362 PolarHBondContact O-N 3.36Å; Q360-L362 VanDerWaalsContact C-N 3.34Å; Q360-L362 PolarHBondContact O-N 3.16Å; L362-R365 PolarHBondContact O-N 2.98Å; L362-L366 PolarHBondContact O-N 2.69Å
363	V	62.6	Low	61.7	Low	18 Å²	18	81.9 Å²	81.9	11%	0.109	42%	0.418	C	S	.	.	H	α-helix	trans	-64.3	-44.7	173.2	161	0	0	0	0	111.7	Q360 K361 R365 L366 H367 Q616 G617	Q360-V363 WeakPolarHBondContact O-CB 3.38Å; Q360-V363 PolarHBondContact O-N 3.02Å; K361-V363 VanDerWaalsContact C-N 3.35Å; V363-R365 VanDerWaalsContact C-N 3.35Å; V363-R365 PolarHBondContact O-N 3.38Å; V363-L366 PolarHBondContact O-N 3.19Å; V363-H367 PolarHBondContact O-CD2 3.17Å; V363-H367 VanDerWaalsContact O-CD2 3.3Å; V363-H367 PolarHBondContact O-N 3.07Å; V363-Q616 WeakPolarHBondContact CG1-O 3.49Å; V363-G617 VanDerWaalsContact CG1-CA 3.4Å; V363-G617 WeakPolarHBondContact CG1-O 3.36Å; V363-G617 WeakPolarHBondContact CG2-O 3.22Å
364	E	65.6	Low	63.6	Low	118 Å²	118	79.5 Å²	79.5	55%	0.551	40%	0.402	S	S	*	.	H	α-helix	trans	-62.4	-40	176.3	-72.8	169.3	166.4	0	0	112	Q360 K361 H367 T368	Q360-E364 WeakPolarHBondContact O-CG 3.25Å; Q360-E364 PolarHBondContact O-N 2.91Å; K361-E364 PolarHBondContact O-N 2.91Å; E364-H367 PolarHBondContact O-N 3.12Å; E364-T368 WeakPolarHBondContact O-CB 3.46Å; E364-T368 PolarHBondContact O-N 3.47Å; E364-T368 PolarHBondContact O-OG1 3.49Å
365	R	68.4	Low	65.5	Low	137 Å²	137	73 Å²	73	52%	0.517	37%	0.367	S	S	.	.	H	α-helix	trans	-61.3	-47.7	172.2	-71.9	169.1	-175.5	-173.6	1.1	111.8	L83 W350 K361 L362 V363 H367 T368 V369	L83-R365 HydrophobicContact CD1-CB 4.4Å; W350-R365 HydrophobicContact CH2-CB 4.47Å; K361-R365 VanDerWaalsContact O-CG 3.27Å; K361-R365 WeakPolarHBondContact O-CG 3.17Å; K361-R365 PolarHBondContact O-N 3.46Å; L362-R365 PolarHBondContact O-N 2.98Å; V363-R365 VanDerWaalsContact C-N 3.35Å; V363-R365 PolarHBondContact O-N 3.38Å; R365-H367 PolarHBondContact O-N 3.17Å; R365-T368 WeakPolarHBondContact O-CB 3.48Å; R365-T368 PolarHBondContact O-N 2.93Å; R365-T368 VanDerWaalsContact O-N 3.11Å; R365-V369 WeakPolarHBondContact O-CG2 3.43Å; R365-V369 PolarHBondContact O-N 2.96Å
366	L	68.6	Low	67.3	Low	20 Å²	20	70.4 Å²	70.4	11%	0.105	35%	0.346	C	S	.	.	H	α-helix	trans	-58.5	-46.2	176.1	178.1	156.9	0	0	0	111.3	L326 L329 F351 L362 V363 T368 V369 L370	L326-L366 HydrophobicContact CD2-CD1 3.64Å; L329-L366 HydrophobicContact CD2-CD1 3.73Å; L329-L366 HydrophobicContact CD2-CD2 3.84Å; L329-L366 HydrophobicContact CD2-CG 3.91Å; F351-L366 HydrophobicContact CE1-CB 4.19Å; F351-L366 HydrophobicContact CE1-CD1 3.75Å; F351-L366 HydrophobicContact CE1-CG 4.44Å; F351-L366 HydrophobicContact CZ-CB 4.5Å; F351-L366 HydrophobicContact CZ-CD1 3.94Å; F351-L366 HydrophobicContact CZ-CG 4.48Å; L362-L366 PolarHBondContact O-N 2.69Å; V363-L366 PolarHBondContact O-N 3.19Å; L366-T368 VanDerWaalsContact C-N 3.29Å; L366-T368 PolarHBondContact O-N 3.14Å; L366-V369 PolarHBondContact O-N 3.15Å; L366-L370 HydrophobicContact CD2-CD1 3.65Å; L366-L370 HydrophobicContact CD2-CG 4.17Å; L366-L370 WeakPolarHBondContact O-CG 3.35Å; L366-L370 PolarHBondContact O-N 3.17Å
367	H	68.1	Low	69.2	Low	88 Å²	88	69.6 Å²	69.6	41%	0.407	34%	0.335	S	S	.	.	H	α-helix	trans	-62.6	-35.1	175	-83.5	-64.6	0	0	0	112.8	V363 E364 R365 L370 R371 G617	V363-H367 PolarHBondContact O-CD2 3.17Å; V363-H367 VanDerWaalsContact O-CD2 3.3Å; V363-H367 PolarHBondContact O-N 3.07Å; E364-H367 PolarHBondContact O-N 3.12Å; R365-H367 PolarHBondContact O-N 3.17Å; H367-L370 PolarHBondContact O-N 3.32Å; H367-R371 WeakPolarHBondContact O-CB 3.38Å; H367-R371 PolarHBondContact O-N 3.49Å; H367-G617 VanDerWaalsContact NE2-CA 3.3Å; H367-G617 WeakPolarHBondContact NE2-CA 3.37Å
368	T	71.9	Confident	71.2	Confident	71 Å²	71	64.9 Å²	64.9	44%	0.436	31%	0.31	S	S	.	.	H	α-helix	trans	-65.7	-42.9	175	-54.6	0	0	0	0	111.3	T81 E364 R365 L366 R371 P372	T81-T368 HydrophobicContact CG2-CG2 3.81Å; E364-T368 WeakPolarHBondContact O-CB 3.46Å; E364-T368 PolarHBondContact O-N 3.47Å; E364-T368 PolarHBondContact O-OG1 3.49Å; R365-T368 WeakPolarHBondContact O-CB 3.48Å; R365-T368 PolarHBondContact O-N 2.93Å; R365-T368 VanDerWaalsContact O-N 3.11Å; L366-T368 VanDerWaalsContact C-N 3.29Å; L366-T368 PolarHBondContact O-N 3.14Å; T368-R371 PolarHBondContact O-N 3.33Å; T368-P372 WeakPolarHBondContact O-CD 3.41Å
369	V	73.1	Confident	72.6	Confident	14 Å²	14	63 Å²	63	9%	0.085	29%	0.288	C	S	.	.	H	α-helix	trans	-64.8	-36.1	174.4	171.3	0	0	0	0	112.3	L83 F84 R365 L366 F373	L83-V369 HydrophobicContact CB-CG2 4.29Å; L83-V369 HydrophobicContact CD1-CG2 3.75Å; F84-V369 HydrophobicContact CE1-CG1 3.93Å; F84-V369 HydrophobicContact CZ-CG1 3.87Å; R365-V369 WeakPolarHBondContact O-CG2 3.43Å; R365-V369 PolarHBondContact O-N 2.96Å; L366-V369 PolarHBondContact O-N 3.15Å; V369-F373 VanDerWaalsContact O-CD2 3.31Å; V369-F373 WeakPolarHBondContact O-CD2 3.37Å; V369-F373 VanDerWaalsContact O-CE2 3.29Å; V369-F373 WeakPolarHBondContact O-CE2 3.28Å
370	L	74.9	Confident	73.7	Confident	11 Å²	11	63.1 Å²	63.1	6%	0.058	30%	0.299	C	S	.	.	H	α-helix	trans	-76.1	-29.4	177.6	-69	-175.3	0	0	0	114.2	L329 L333 L366 H367 P372 F373 L374	L329-L370 HydrophobicContact CD1-CD1 3.83Å; L329-L370 HydrophobicContact CD1-CD2 3.94Å; L329-L370 HydrophobicContact CD2-CD1 3.98Å; L329-L370 HydrophobicContact CD2-CD2 4.23Å; L329-L370 HydrophobicContact CD2-CG 4.43Å; L329-L370 HydrophobicContact CG-CD2 4.33Å; L333-L370 HydrophobicContact CD1-CD2 4Å; L333-L370 HydrophobicContact CD2-CD2 3.86Å; L333-L370 HydrophobicContact CG-CD2 4.17Å; L366-L370 HydrophobicContact CD2-CD1 3.65Å; L366-L370 HydrophobicContact CD2-CG 4.17Å; L366-L370 WeakPolarHBondContact O-CG 3.35Å; L366-L370 PolarHBondContact O-N 3.17Å; H367-L370 PolarHBondContact O-N 3.32Å; L370-P372 VanDerWaalsContact C-CD 3.48Å; L370-F373 PolarHBondContact O-N 3.41Å; L370-L374 WeakPolarHBondContact O-CB 3.4Å; L370-L374 PolarHBondContact O-N 3.04Å
371	R	75.4	Confident	74.8	Confident	204 Å²	204	63.8 Å²	63.8	77%	0.77	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-36.5	-168.5	-173.9	173.6	-177.3	166.3	-0.1	115.2	H367 T368	H367-R371 WeakPolarHBondContact O-CB 3.38Å; H367-R371 PolarHBondContact O-N 3.49Å; T368-R371 PolarHBondContact O-N 3.33Å
372	P	77.4	Confident	75.6	Confident	10 Å²	10	59.5 Å²	59.5	7%	0.065	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-38.4	174.2	-22	34.4	0	0	0	112.7	Y76 Q80 W172 T368 L370	Y76-P372 HydrophobicContact CE1-CB 4.25Å; Q80-P372 HydrophobicContact CB-CG 4.28Å; Q80-P372 HydrophobicContact CG-CB 4.49Å; Q80-P372 HydrophobicContact CG-CG 4.06Å; W172-P372 PolarHBondContact NE1-O 3.33Å; T368-P372 WeakPolarHBondContact O-CD 3.41Å; L370-P372 VanDerWaalsContact C-CD 3.48Å
373	F	81.3	Confident	76.1	Confident	1 Å²	1	58.6 Å²	58.6	0%	0.004	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-18.4	-174.5	-48.8	-64.1	0	0	0	114.5	L77 F84 W172 I181 G183 I184 L333 L337 V369 L370	L77-F373 HydrophobicContact CD2-CE1 3.73Å; L77-F373 HydrophobicContact CD2-CZ 3.44Å; L77-F373 VanDerWaalsContact CD2-CZ 3.44Å; F84-F373 AromaticContact CE1-CE2 3.83Å; F84-F373 HydrophobicContact CE1-CE2 3.83Å; F84-F373 AromaticContact CE1-CZ 3.84Å; F84-F373 HydrophobicContact CE1-CZ 3.84Å; F84-F373 AromaticContact CZ-CE2 3.64Å; F84-F373 HydrophobicContact CZ-CE2 3.64Å; F84-F373 AromaticContact CZ-CZ 3.77Å; F84-F373 HydrophobicContact CZ-CZ 3.77Å; W172-F373 WeakPolarHBondContact CH2-O 3.37Å; W172-F373 WeakPolarHBondContact CZ2-O 3.1Å; I181-F373 HydrophobicContact CG2-CD1 3.65Å; I181-F373 HydrophobicContact CG2-CE1 3.74Å; G183-F373 CarbonylContact C-O 3.56Å; G183-F373 WeakPolarHBondContact CA-O 3.29Å; I184-F373 PolarHBondContact N-O 3.42Å; L333-F373 HydrophobicContact CD2-CD2 4.21Å; L333-F373 HydrophobicContact CD2-CE2 4.44Å; L337-F373 HydrophobicContact CD1-CE1 3.59Å; L337-F373 HydrophobicContact CD1-CZ 3.61Å; V369-F373 VanDerWaalsContact O-CD2 3.31Å; V369-F373 WeakPolarHBondContact O-CD2 3.37Å; V369-F373 VanDerWaalsContact O-CE2 3.29Å; V369-F373 WeakPolarHBondContact O-CE2 3.28Å; L370-F373 PolarHBondContact O-N 3.41Å
374	L	85.4	Confident	76.6	Confident	39 Å²	39	67 Å²	67	20%	0.204	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	111.6	-167.4	-169.8	157.2	0	0	0	112.4	I184 A186 L322 L370 R376	I184-L374 HydrophobicContact CB-CG 4.42Å; I184-L374 WeakPolarHBondContact O-CA 3.41Å; A186-L374 HydrophobicContact CB-CD2 4.13Å; A186-L374 HydrophobicContact CB-CG 4.21Å; L322-L374 HydrophobicContact CD1-CD1 3.57Å; L322-L374 HydrophobicContact CG-CD1 4.36Å; L370-L374 WeakPolarHBondContact O-CB 3.4Å; L370-L374 PolarHBondContact O-N 3.04Å; L374-R376 HydrophobicContact CD2-CB 3.59Å
375	L	87.2	Confident	77.2	Confident	32 Å²	32	66.1 Å²	66.1	17%	0.168	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	116.7	169.4	-179.4	58.6	0	0	0	110.2	W172 I184 L185 A186 D187 R377	W172-L375 HydrophobicContact CB-CD2 4.17Å; W172-L375 HydrophobicContact CD2-CB 3.73Å; W172-L375 HydrophobicContact CD2-CD2 3.81Å; W172-L375 HydrophobicContact CD2-CG 4.35Å; W172-L375 HydrophobicContact CE3-CB 3.57Å; W172-L375 HydrophobicContact CE3-CD2 3.55Å; W172-L375 HydrophobicContact CE3-CG 4.22Å; W172-L375 HydrophobicContact CG-CD2 4.09Å; W172-L375 HydrophobicContact CH2-CB 3.58Å; W172-L375 HydrophobicContact CZ2-CB 3.72Å; W172-L375 HydrophobicContact CZ3-CB 3.51Å; W172-L375 HydrophobicContact CZ3-CD2 4.22Å; I184-L375 PolarHBondContact O-N 3.01Å; I184-L375 VanDerWaalsContact O-N 3.08Å; L185-L375 HydrophobicContact CD1-CB 4.15Å; L185-L375 HydrophobicContact CD1-CD2 3.9Å; L185-L375 HydrophobicContact CD1-CG 4.13Å; A186-L375 CarbonylContact C-O 3.5Å; A186-L375 WeakPolarHBondContact CA-O 3.5Å; A186-L375 PolarHBondContact N-O 3.09Å; D187-L375 PolarHBondContact N-O 2.9Å; L375-R377 HydrophobicContact CD1-CG 4.31Å
376	R	85.1	Confident	77.7	Confident	103 Å²	103	60.8 Å²	60.8	39%	0.389	31%	0.305	S	S	.	.			trans	-135.9	129.7	177.4	174.7	165.5	-173.2	-152.8	-0.4	110.8	A186 L374	A186-R376 HydrophobicContact CB-CB 4.06Å; A186-R376 VanDerWaalsContact O-CG 3.31Å; A186-R376 WeakPolarHBondContact O-CG 3.45Å; L374-R376 HydrophobicContact CD2-CB 3.59Å
377	R	86.2	Confident	78.4	Confident	33 Å²	33	63.7 Å²	63.7	13%	0.125	32%	0.32	C	S	.	.			trans	-139.5	146.9	179.9	-62.7	167.6	-67.8	-168.7	5.9	110.1	Y165 D187 E188 L375 V382	Y165-R377 PolarHBondContact O-NH1 3.24Å; D187-R377 IonicContact OD1-CZ 3.66Å; D187-R377 PolarHBondContact OD1-N 3.3Å; D187-R377 IonicContact OD1-NE 3.84Å; D187-R377 PolarHBondContact OD1-NE 3.26Å; D187-R377 IonicContact OD1-NH2 2.69Å; D187-R377 PolarHBondContact OD1-NH2 3.03Å; D187-R377 IonicContact OD2-CZ 2.71Å; D187-R377 IonicContact OD2-NE 2.66Å; D187-R377 IonicContact OD2-NH2 2.64Å; D187-R377 PolarHBondContact OD2-NH2 2.89Å; E188-R377 PolarHBondContact N-O 3.02Å; E188-R377 VanDerWaalsContact N-O 3.09Å; L375-R377 HydrophobicContact CD1-CG 4.31Å; R377-V382 HydrophobicContact CB-CG1 3.9Å; R377-V382 HydrophobicContact CG-CG1 4.33Å
378	I	81.9	Confident	79.2	Confident	88 Å²	88	64.3 Å²	64.3	45%	0.451	33%	0.332	S	S	.	.			trans	-97.9	146.4	179.9	-50	175.8	0	0	0	108.6	E188 A380 D381 V382	E188-I378 VanDerWaalsContact OE2-CG2 3.27Å; E188-I378 WeakPolarHBondContact OE2-CG2 3.38Å; I378-A380 HydrophobicContact CG2-CB 4.44Å; I378-A380 PolarHBondContact O-N 2.8Å; I378-D381 VanDerWaalsContact CB-OD2 3.3Å; I378-D381 WeakPolarHBondContact CB-OD2 3.4Å; I378-D381 PolarHBondContact N-OD2 3.44Å; I378-D381 PolarHBondContact O-N 2.73Å; I378-D381 VanDerWaalsContact O-N 3.09Å; I378-V382 PolarHBondContact O-N 3.24Å
379	K	80.8	Confident	80.1	Confident	12 Å²	12	63.5 Å²	63.5	5%	0.052	32%	0.322	C	S	.	.	H	α-helix	trans	-52	-42.3	178.2	-73.8	172.6	-164.3	136.6	0	112.6	E188 M189 L191 D381 V382 E383 L386 D573 H576	E188-K379 HydrophobicContact CB-CG 4.4Å; E188-K379 HydrophobicContact CG-CG 4.35Å; E188-K379 WeakPolarHBondContact OE1-CD 3.34Å; E188-K379 WeakPolarHBondContact OE1-CE 3.43Å; E188-K379 IonicContact OE1-NZ 2.69Å; E188-K379 PolarHBondContact OE1-NZ 3.24Å; E188-K379 WeakPolarHBondContact OE2-CG 3.33Å; E188-K379 PolarHBondContact OE2-N 2.92Å; M189-K379 WeakPolarHBondContact O-CE 3.27Å; M189-K379 PolarHBondContact O-NZ 3.45Å; L191-K379 HydrophobicContact CD2-CG 3.92Å; L191-K379 HydrophobicContact CG-CG 4.19Å; K379-D381 PolarHBondContact O-N 2.66Å; K379-V382 PolarHBondContact O-N 3.11Å; K379-E383 WeakPolarHBondContact O-CA 3.46Å; K379-E383 WeakPolarHBondContact O-CB 3.44Å; K379-E383 PolarHBondContact O-N 3.44Å; K379-L386 HydrophobicContact CD-CD2 4.07Å; K379-D573 IonicContact NZ-OD1 2.98Å; K379-D573 PolarHBondContact NZ-OD1 2.87Å; K379-D573 VanDerWaalsContact NZ-OD1 3.09Å; K379-D573 IonicContact NZ-OD2 3.81Å; K379-D573 PolarHBondContact NZ-OD2 3.01Å; K379-H576 PolarHBondContact NZ-O 3.15Å
380	A	76.4	Confident	80.9	Confident	80 Å²	80	67.8 Å²	67.8	66%	0.661	34%	0.34	S	S	*	.	H	α-helix	trans	-60.3	-32.6	-178.7	0	0	0	0	0	113.2	I378	I378-A380 HydrophobicContact CG2-CB 4.44Å; I378-A380 PolarHBondContact O-N 2.8Å
381	D	77.6	Confident	81.7	Confident	103 Å²	103	70.6 Å²	70.6	55%	0.551	35%	0.352	S	S	*	.	H	α-helix	trans	-77.6	-36.1	-177.4	-46.3	-31.2	0	0	0	111.8	I378 K379	I378-D381 VanDerWaalsContact CB-OD2 3.3Å; I378-D381 WeakPolarHBondContact CB-OD2 3.4Å; I378-D381 PolarHBondContact N-OD2 3.44Å; I378-D381 PolarHBondContact O-N 2.73Å; I378-D381 VanDerWaalsContact O-N 3.09Å; K379-D381 PolarHBondContact O-N 2.66Å
382	V	79.1	Confident	82.5	Confident	39 Å²	39	61.2 Å²	61.2	24%	0.236	32%	0.318	C	S	.	.	H	α-helix	trans	-109.6	-22.9	-167.6	-56	0	0	0	0	114.9	Y165 L191 R377 I378 K379	Y165-V382 HydrophobicContact CD1-CB 3.92Å; Y165-V382 HydrophobicContact CD1-CG2 4.04Å; Y165-V382 HydrophobicContact CD2-CB 4.43Å; Y165-V382 HydrophobicContact CD2-CG2 4.26Å; Y165-V382 HydrophobicContact CE1-CG2 4.24Å; Y165-V382 HydrophobicContact CE2-CG2 4.47Å; Y165-V382 HydrophobicContact CG-CB 3.86Å; Y165-V382 HydrophobicContact CG-CG1 4.36Å; Y165-V382 HydrophobicContact CG-CG2 4.09Å; L191-V382 HydrophobicContact CD1-CG2 3.94Å; L191-V382 HydrophobicContact CD2-CG2 3.61Å; L191-V382 HydrophobicContact CG-CG2 4.46Å; R377-V382 HydrophobicContact CB-CG1 3.9Å; R377-V382 HydrophobicContact CG-CG1 4.33Å; I378-V382 PolarHBondContact O-N 3.24Å; K379-V382 PolarHBondContact O-N 3.11Å
383	E	70.9	Confident	83.2	Confident	9 Å²	9	61 Å²	61	4%	0.042	32%	0.316	C	S	.	.			trans	-127.8	65.9	-165.9	-168.2	47.2	-93.3	0	0	112.7	R163 L191 K379 T385 L386 I578	R163-E383 WeakPolarHBondContact CD-OE2 3.44Å; R163-E383 IonicContact CZ-OE2 2.76Å; R163-E383 VanDerWaalsContact CZ-OE2 3.3Å; R163-E383 IonicContact NE-OE2 3.52Å; R163-E383 PolarHBondContact NE-OE2 3.25Å; R163-E383 IonicContact NH1-OE1 2.68Å; R163-E383 PolarHBondContact NH1-OE1 3.17Å; R163-E383 IonicContact NH1-OE2 2.72Å; R163-E383 PolarHBondContact NH1-OE2 3.44Å; L191-E383 HydrophobicContact CD2-CB 4.43Å; K379-E383 WeakPolarHBondContact O-CA 3.46Å; K379-E383 WeakPolarHBondContact O-CB 3.44Å; K379-E383 PolarHBondContact O-N 3.44Å; E383-T385 PolarHBondContact O-N 3.37Å; E383-T385 VanDerWaalsContact O-N 3.08Å; E383-T385 PolarHBondContact OE1-N 2.93Å; E383-T385 PolarHBondContact OE1-OG1 2.89Å; E383-L386 HydrophobicContact CG-CB 3.81Å; E383-L386 PolarHBondContact O-N 3.42Å; E383-L386 VanDerWaalsContact O-N 3.16Å; E383-I578 HydrophobicContact CG-CD1 4.27Å; E383-I578 HydrophobicContact CG-CG1 4.23Å
384	K	74.5	Confident	83.6	Confident	194 Å²	194	61 Å²	61	84%	0.843	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-11.6	-179.6	-62	-176.9	-179.8	-179	0	114.3
385	T	76.4	Confident	83.8	Confident	101 Å²	101	60.5 Å²	60.5	62%	0.62	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-15.9	177	71	0	0	0	0	113.5	R163 E383	R163-T385 PolarHBondContact NH1-OG1 2.99Å; R163-T385 VanDerWaalsContact NH1-OG1 3.17Å; E383-T385 PolarHBondContact O-N 3.37Å; E383-T385 VanDerWaalsContact O-N 3.08Å; E383-T385 PolarHBondContact OE1-N 2.93Å; E383-T385 PolarHBondContact OE1-OG1 2.89Å
386	L	79.2	Confident	83.9	Confident	24 Å²	24	59.3 Å²	59.3	13%	0.126	31%	0.305	C	S	.	.	S	Bend	trans	-91.5	112.5	178	179.3	63.5	0	0	0	110.1	K379 E383 Q580	K379-L386 HydrophobicContact CD-CD2 4.07Å; E383-L386 HydrophobicContact CG-CB 3.81Å; E383-L386 PolarHBondContact O-N 3.42Å; E383-L386 VanDerWaalsContact O-N 3.16Å; L386-Q580 HydrophobicContact CD1-CB 4.18Å
387	L	83.9	Confident	84.1	Confident	81 Å²	81	54.8 Å²	54.8	42%	0.424	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-59.2	141	178.2	-66.2	101.2	0	0	0	111.6	K389 H576	L387-K389 PolarHBondContact O-N 3.34Å; L387-H576 PolarHBondContact O-NE2 3.34Å
388	P	85.6	Confident	84.2	Confident	101 Å²	101	53.2 Å²	53.2	66%	0.656	28%	0.284	S	S	*	.	P	Polyproline II helix	trans	-68.7	129.4	-179.5	28.3	-34.3	0	0	0	110.7	K390 Q583	P388-K390 PolarHBondContact O-N 3.15Å; P388-Q583 PolarHBondContact O-NE2 3.1Å; P388-Q583 PolarHBondContact O-OE1 3.44Å
389	K	90.4	Very high	84.6	Confident	54 Å²	54	49.1 Å²	49.1	24%	0.235	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-58.6	135.2	178	51.1	170.5	170.3	-84.6	0	111.6	L387 M572 D573 H576 V584 V586	L387-K389 PolarHBondContact O-N 3.34Å; K389-M572 HydrophobicContact CD-CB 4.31Å; K389-M572 HydrophobicContact CD-SD 4.1Å; K389-D573 IonicContact NZ-OD1 3.54Å; K389-D573 PolarHBondContact NZ-OD1 3.25Å; K389-H576 HydrophobicContact CB-CB 4.4Å; K389-H576 HydrophobicContact CD-CB 4.1Å; K389-H576 HydrophobicContact CG-CB 4.5Å; K389-H576 PolarHBondContact N-NE2 3.36Å; K389-H576 PolarHBondContact NZ-ND1 3.21Å; K389-H576 VanDerWaalsContact NZ-ND1 3.12Å; K389-V584 HydrophobicContact CB-CB 4.19Å; K389-V584 HydrophobicContact CB-CG1 4.34Å; K389-V586 HydrophobicContact CD-CG2 4.39Å
390	K	90.3	Very high	85	Confident	105 Å²	105	55.5 Å²	55.5	46%	0.457	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	123.5	168.9	-74.7	-168.7	166.7	-157	0	109	P388 V584 V586 E664	P388-K390 PolarHBondContact O-N 3.15Å; K390-V584 PolarHBondContact N-O 2.91Å; K390-V586 PolarHBondContact O-N 2.96Å; K390-E664 IonicContact NZ-OE1 3.66Å
391	E	91.2	Very high	85.7	Confident	69 Å²	69	53 Å²	53	32%	0.322	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	130.2	170.3	-175.5	171.6	-171.2	0	0	109.7	M572 V586 R588	E391-M572 WeakPolarHBondContact OE1-CE 3.36Å; E391-V586 CarbonylContact C-O 3.18Å; E391-V586 WeakPolarHBondContact CA-O 3.35Å; E391-V586 HydrophobicContact CB-CB 4.28Å; E391-V586 HydrophobicContact CG-CB 4.28Å; E391-V586 HydrophobicContact CG-CG1 4.31Å; E391-R588 IonicContact OE1-CZ 2.85Å; E391-R588 IonicContact OE1-NE 2.71Å; E391-R588 PolarHBondContact OE1-NE 2.89Å; E391-R588 IonicContact OE1-NH2 2.81Å; E391-R588 PolarHBondContact OE1-NH2 2.96Å
392	I	91.7	Very high	86.3	Confident	8 Å²	8	48.1 Å²	48.1	4%	0.041	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	119.7	-174.9	-54.3	173.6	0	0	0	107.2	V586 Y587 R588 L660 E664	I392-V586 PolarHBondContact N-O 3.08Å; I392-Y587 HydrophobicContact CB-CD1 4.1Å; I392-Y587 HydrophobicContact CB-CE1 4.37Å; I392-Y587 HydrophobicContact CD1-CD1 4.34Å; I392-Y587 HydrophobicContact CD1-CE1 3.77Å; I392-Y587 WeakPolarHBondContact O-CA 3.47Å; I392-R588 PolarHBondContact O-N 3.24Å; I392-L660 HydrophobicContact CG2-CD2 4.23Å; I392-E664 HydrophobicContact CD1-CG 3.93Å; I392-E664 WeakPolarHBondContact CD1-OE1 3.48Å; I392-E664 HydrophobicContact CG1-CG 3.9Å; I392-E664 HydrophobicContact CG2-CG 3.89Å
393	K	91.4	Very high	86.7	Confident	6 Å²	6	47.1 Å²	47.1	3%	0.026	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	114.9	175.9	-57.8	173.2	-162.4	180	0	108.6	Y395 I590 E604 G663 T667 M670	K393-Y395 HydrophobicContact CB-CD2 4.17Å; K393-Y395 HydrophobicContact CB-CE2 3.6Å; K393-Y395 HydrophobicContact CD-CE2 4.38Å; K393-Y395 WeakPolarHBondContact O-CD2 3.33Å; K393-I590 HydrophobicContact CB-CD1 3.88Å; K393-I590 HydrophobicContact CD-CD1 4.07Å; K393-I590 HydrophobicContact CG-CD1 4.06Å; K393-E604 WeakPolarHBondContact CE-OE1 3.39Å; K393-E604 IonicContact NZ-OE1 2.83Å; K393-E604 PolarHBondContact NZ-OE1 3.43Å; K393-E604 IonicContact NZ-OE2 2.75Å; K393-E604 PolarHBondContact NZ-OE2 3.3Å; K393-G663 WeakPolarHBondContact O-CA 3.01Å; K393-T667 WeakPolarHBondContact CB-OG1 3.47Å; K393-T667 HydrophobicContact CD-CG2 4.44Å; K393-T667 HydrophobicContact CG-CG2 4.4Å; K393-T667 WeakPolarHBondContact CG-OG1 3.25Å; K393-T667 PolarHBondContact N-OG1 3.17Å; K393-T667 VanDerWaalsContact N-OG1 3.16Å; K393-M670 PolarHBondContact NZ-SD 2.89Å
394	I	91.3	Very high	87.5	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	112.6	173.3	-61.5	170.7	0	0	0	107.4	V396 V469 L473 Y587 R588 F589 I590 I659 L660	I394-V396 HydrophobicContact CG2-CG2 4.02Å; I394-V469 HydrophobicContact CG2-CG1 3.78Å; I394-L473 HydrophobicContact CD1-CD2 4.34Å; I394-Y587 HydrophobicContact CD1-CD1 3.69Å; I394-Y587 HydrophobicContact CD1-CG 4.11Å; I394-Y587 HydrophobicContact CG1-CD1 4.41Å; I394-R588 PolarHBondContact N-O 3.12Å; I394-F589 HydrophobicContact CB-CD1 4.15Å; I394-F589 HydrophobicContact CD1-CD1 4.34Å; I394-F589 HydrophobicContact CD1-CE1 3.98Å; I394-I590 PolarHBondContact O-N 3.12Å; I394-I659 HydrophobicContact CG2-CG2 3.6Å; I394-L660 HydrophobicContact CD1-CD2 3.68Å; I394-L660 HydrophobicContact CG1-CD2 4Å
395	Y	89.3	Confident	88.3	Confident	29 Å²	29	44 Å²	44	11%	0.114	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	133.6	178.6	-70.7	-93.8	0	0	0	109.3	K393 I590 E592 K666	K393-Y395 HydrophobicContact CB-CD2 4.17Å; K393-Y395 HydrophobicContact CB-CE2 3.6Å; K393-Y395 HydrophobicContact CD-CE2 4.38Å; K393-Y395 WeakPolarHBondContact O-CD2 3.33Å; Y395-I590 CarbonylContact C-O 3.57Å; Y395-I590 WeakPolarHBondContact CA-O 3.44Å; Y395-I590 HydrophobicContact CD1-CB 4.37Å; Y395-I590 HydrophobicContact CD1-CG2 4.43Å; Y395-I590 HydrophobicContact CE1-CD1 4.23Å; Y395-I590 HydrophobicContact CE1-CG2 4.47Å; Y395-E592 VanDerWaalsContact CB-OE1 3.28Å; Y395-E592 WeakPolarHBondContact CB-OE1 3.32Å; Y395-E592 HydrophobicContact CD1-CG 4.02Å; Y395-E592 HydrophobicContact CG-CG 4.33Å; Y395-K666 HydrophobicContact CD1-CD 4.39Å; Y395-K666 HydrophobicContact CD2-CB 4.23Å; Y395-K666 HydrophobicContact CD2-CD 3.56Å; Y395-K666 HydrophobicContact CE1-CD 4.44Å; Y395-K666 HydrophobicContact CE2-CB 3.69Å; Y395-K666 HydrophobicContact CE2-CD 3.63Å; Y395-K666 HydrophobicContact CE2-CG 4.32Å; Y395-K666 HydrophobicContact CG-CD 3.97Å
396	V	89.8	Confident	88.9	Confident	7 Å²	7	39.2 Å²	39.2	4%	0.042	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	129.7	-166.5	-168.1	0	0	0	0	111.4	I394 G465 V469 I590 T591 E592	I394-V396 HydrophobicContact CG2-CG2 4.02Å; V396-G465 WeakPolarHBondContact CG1-O 3.4Å; V396-V469 HydrophobicContact CG1-CG2 3.84Å; V396-V469 HydrophobicContact CG2-CG2 3.99Å; V396-I590 PolarHBondContact N-O 2.87Å; V396-T591 CarbonylContact O-C 3.51Å; V396-T591 VanDerWaalsContact O-CA 3.29Å; V396-T591 WeakPolarHBondContact O-CA 3.23Å; V396-E592 PolarHBondContact O-N 2.64Å
397	G	88.6	Confident	89.3	Confident	7 Å²	7	39.3 Å²	39.3	7%	0.072	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-74.2	158	175.6	0	0	0	0	0	114.2
398	L	88.7	Confident	89.4	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-73.3	135.4	173.4	-72.1	167.5	0	0	0	111.5	Q402 T591 T594 V643 E650	L398-Q402 HydrophobicContact CB-CB 4.37Å; L398-Q402 HydrophobicContact CD2-CB 3.75Å; L398-T591 HydrophobicContact CD2-CG2 3.67Å; L398-T591 HydrophobicContact CG-CG2 3.97Å; L398-T594 HydrophobicContact CD1-CG2 3.95Å; L398-T594 HydrophobicContact CD2-CG2 4.09Å; L398-T594 HydrophobicContact CG-CG2 4.1Å; L398-V643 HydrophobicContact CD1-CG1 4.48Å; L398-V643 HydrophobicContact CD1-CG2 3.91Å; L398-E650 PolarHBondContact O-N 2.95Å
399	S	90.4	Very high	89.4	Confident	3 Å²	3	36.5 Å²	36.5	2%	0.021	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-65.4	158.5	165.6	88.5	0	0	0	0	110.9	M401 Q402 R403 N463	S399-M401 PolarHBondContact O-N 2.72Å; S399-M401 PolarHBondContact OG-N 3.22Å; S399-Q402 PolarHBondContact O-N 2.84Å; S399-Q402 VanDerWaalsContact O-N 3.12Å; S399-Q402 WeakPolarHBondContact OG-CG 3.33Å; S399-Q402 PolarHBondContact OG-N 3.19Å; S399-R403 PolarHBondContact O-N 3.16Å; S399-N463 WeakPolarHBondContact CB-O 3.37Å; S399-N463 PolarHBondContact OG-O 3.05Å
400	K	89.3	Confident	89.1	Confident	145 Å²	145	34 Å²	34	63%	0.63	16%	0.155	S	C	*	.	H	α-helix	trans	-51.3	-45.3	173	-179.4	-179.4	176.1	-179.4	0	111.9	R403 E404	K400-R403 PolarHBondContact O-N 2.99Å; K400-E404 PolarHBondContact O-N 2.99Å
401	M	89.8	Confident	88.6	Confident	28 Å²	28	32.3 Å²	32.3	14%	0.138	15%	0.149	C	C	.	.	H	α-helix	trans	-67.8	-40.1	180	-170.8	-172.4	179.3	0	0	112	S399 E404 W405 P442 Y443 A448 N463	S399-M401 PolarHBondContact O-N 2.72Å; S399-M401 PolarHBondContact OG-N 3.22Å; M401-E404 PolarHBondContact O-N 3.42Å; M401-W405 PolarHBondContact O-N 2.94Å; M401-W405 VanDerWaalsContact O-N 3.13Å; M401-P442 HydrophobicContact CB-CG 4.34Å; M401-P442 HydrophobicContact CE-CB 3.57Å; M401-P442 HydrophobicContact CE-CG 4.44Å; M401-P442 HydrophobicContact CG-CB 4.04Å; M401-P442 HydrophobicContact CG-CG 4.02Å; M401-P442 HydrophobicContact SD-CB 3.62Å; M401-P442 HydrophobicContact SD-CG 3.86Å; M401-Y443 HydrophobicContact CE-CD1 4.2Å; M401-Y443 HydrophobicContact CE-CE1 3.9Å; M401-Y443 HydrophobicContact SD-CE1 3.92Å; M401-A448 HydrophobicContact CE-CB 3.65Å; M401-A448 WeakPolarHBondContact CE-O 3.33Å; M401-N463 HydrophobicContact CB-CB 4.43Å; M401-N463 WeakPolarHBondContact CB-OD1 3.43Å; M401-N463 HydrophobicContact SD-CB 3.71Å; M401-N463 PolarHBondContact SD-OD1 3.45Å; M401-N463 VanDerWaalsContact SD-OD1 3.36Å
402	Q	90.9	Very high	88.1	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-62.6	-44.3	173.9	-70.5	175.4	-74	0	0	111.1	L398 S399 E404 W405 Y406 C438 C439 P442	L398-Q402 HydrophobicContact CB-CB 4.37Å; L398-Q402 HydrophobicContact CD2-CB 3.75Å; S399-Q402 PolarHBondContact O-N 2.84Å; S399-Q402 VanDerWaalsContact O-N 3.12Å; S399-Q402 WeakPolarHBondContact OG-CG 3.33Å; S399-Q402 PolarHBondContact OG-N 3.19Å; Q402-E404 PolarHBondContact O-N 2.91Å; Q402-W405 PolarHBondContact O-N 2.82Å; Q402-Y406 VanDerWaalsContact O-CB 3.27Å; Q402-Y406 WeakPolarHBondContact O-CB 3.45Å; Q402-Y406 PolarHBondContact O-N 3.38Å; Q402-C438 WeakPolarHBondContact CG-O 3.19Å; Q402-C438 PolarHBondContact NE2-O 2.86Å; Q402-C438 PolarHBondContact O-SG 3.17Å; Q402-C439 PolarHBondContact NE2-O 3.12Å; Q402-C439 VanDerWaalsContact NE2-O 3.09Å; Q402-P442 HydrophobicContact CG-CG 3.56Å
403	R	87.6	Confident	87.1	Confident	18 Å²	18	38.7 Å²	38.7	7%	0.068	18%	0.178	C	C	.	.	H	α-helix	trans	-58.3	-49.1	176.4	-175.8	171.3	-53.6	101.1	-3.3	111.3	S399 K400 W405 Y406 T407 V643 S646 E648 E650	S399-R403 PolarHBondContact O-N 3.16Å; K400-R403 PolarHBondContact O-N 2.99Å; R403-W405 VanDerWaalsContact C-N 3.33Å; R403-W405 PolarHBondContact O-N 3.2Å; R403-Y406 PolarHBondContact O-N 2.89Å; R403-T407 WeakPolarHBondContact O-CB 3.48Å; R403-T407 PolarHBondContact O-N 2.86Å; R403-T407 PolarHBondContact O-OG1 3.17Å; R403-T407 VanDerWaalsContact O-OG1 3.07Å; R403-V643 HydrophobicContact CG-CG1 3.91Å; R403-S646 WeakPolarHBondContact CD-O 3.41Å; R403-S646 PolarHBondContact NE-O 3.01Å; R403-S646 PolarHBondContact NE-OG 3.33Å; R403-S646 VanDerWaalsContact NE-OG 3.15Å; R403-S646 PolarHBondContact NH2-OG 3.1Å; R403-E648 PolarHBondContact NH1-O 3.08Å; R403-E648 PolarHBondContact NH2-O 3.38Å; R403-E650 IonicContact CZ-OE1 3.73Å; R403-E650 IonicContact NE-OE1 2.7Å; R403-E650 VanDerWaalsContact NH2-CD 3.35Å; R403-E650 IonicContact NH2-OE1 2.58Å; R403-E650 PolarHBondContact NH2-OE1 2.82Å
404	E	88.3	Confident	86	Confident	85 Å²	85	39.1 Å²	39.1	40%	0.397	18%	0.18	S	C	.	.	H	α-helix	trans	-54.6	-46.8	177.8	-79.4	-171	-140.5	0	0	112.8	K400 M401 Q402 K408	K400-E404 PolarHBondContact O-N 2.99Å; M401-E404 PolarHBondContact O-N 3.42Å; Q402-E404 PolarHBondContact O-N 2.91Å; E404-K408 WeakPolarHBondContact O-CB 3.24Å; E404-K408 WeakPolarHBondContact O-CD 3.47Å; E404-K408 WeakPolarHBondContact O-CG 3.09Å; E404-K408 PolarHBondContact O-N 3.26Å; E404-K408 IonicContact OE2-NZ 3.69Å; E404-K408 PolarHBondContact OE2-NZ 3.38Å
405	W	89.6	Confident	84.7	Confident	53 Å²	53	42.3 Å²	42.3	20%	0.201	20%	0.197	C	C	.	.	H	α-helix	trans	-68.2	-40	178.4	-84.9	94.3	0	0	0	112.6	M401 Q402 R403 K408 I409 C438 F445 A448	M401-W405 PolarHBondContact O-N 2.94Å; M401-W405 VanDerWaalsContact O-N 3.13Å; Q402-W405 PolarHBondContact O-N 2.82Å; R403-W405 VanDerWaalsContact C-N 3.33Å; R403-W405 PolarHBondContact O-N 3.2Å; W405-K408 PolarHBondContact O-N 2.89Å; W405-I409 WeakPolarHBondContact O-CD1 3.35Å; W405-I409 VanDerWaalsContact O-CG1 3.22Å; W405-I409 WeakPolarHBondContact O-CG1 3.35Å; W405-I409 PolarHBondContact O-N 3.38Å; W405-C438 VanDerWaalsContact CB-SG 3.56Å; W405-F445 HydrophobicContact CB-CE2 4.44Å; W405-F445 HydrophobicContact CD2-CB 4.48Å; W405-F445 AromaticContact CD2-CD2 3.96Å; W405-F445 HydrophobicContact CD2-CD2 3.96Å; W405-F445 HydrophobicContact CD2-CG 4.39Å; W405-F445 HydrophobicContact CE3-CB 4.07Å; W405-F445 HydrophobicContact CE3-CD1 4.47Å; W405-F445 AromaticContact CE3-CD2 3.73Å; W405-F445 HydrophobicContact CE3-CD2 3.73Å; W405-F445 HydrophobicContact CE3-CE2 4.31Å; W405-F445 AromaticContact CE3-CG 3.83Å; W405-F445 HydrophobicContact CE3-CG 3.83Å; W405-F445 HydrophobicContact CG-CD2 4.31Å; W405-F445 HydrophobicContact CH2-CB 3.88Å; W405-F445 HydrophobicContact CZ2-CB 4.31Å; W405-F445 HydrophobicContact CZ3-CB 3.75Å; W405-F445 HydrophobicContact CZ3-CD1 4.42Å; W405-F445 HydrophobicContact CZ3-CD2 4.28Å; W405-F445 AromaticContact CZ3-CG 3.9Å; W405-F445 HydrophobicContact CZ3-CG 3.9Å; W405-A448 HydrophobicContact CH2-CB 4.5Å; W405-A448 HydrophobicContact CZ2-CB 3.62Å
406	Y	89.4	Confident	83.4	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62.4	-46.2	177.5	-160.6	-80.7	0	0	0	111.1	Q402 R403 I409 L410 L435 C438 T594 V595 G639 V643	Q402-Y406 VanDerWaalsContact O-CB 3.27Å; Q402-Y406 WeakPolarHBondContact O-CB 3.45Å; Q402-Y406 PolarHBondContact O-N 3.38Å; R403-Y406 PolarHBondContact O-N 2.89Å; Y406-I409 PolarHBondContact O-N 3.24Å; Y406-L410 HydrophobicContact CD1-CD1 3.78Å; Y406-L410 HydrophobicContact CD1-CG 4.25Å; Y406-L410 HydrophobicContact CE1-CD1 3.75Å; Y406-L410 HydrophobicContact CE1-CG 4.33Å; Y406-L410 WeakPolarHBondContact O-CG 3.35Å; Y406-L410 PolarHBondContact O-N 3.29Å; Y406-L435 HydrophobicContact CD1-CD2 3.96Å; Y406-L435 HydrophobicContact CD2-CD2 3.86Å; Y406-L435 HydrophobicContact CE1-CD2 3.95Å; Y406-L435 HydrophobicContact CE2-CB 4.03Å; Y406-L435 HydrophobicContact CE2-CD2 3.83Å; Y406-L435 HydrophobicContact CE2-CG 4.43Å; Y406-L435 HydrophobicContact CG-CD2 3.94Å; Y406-C438 HydrophobicContact CD2-CB 4.15Å; Y406-C438 PolarHBondContact N-SG 3.15Å; Y406-C438 VanDerWaalsContact N-SG 3.4Å; Y406-T594 HydrophobicContact CE2-CG2 4.06Å; Y406-T594 WeakPolarHBondContact OH-CA 3.35Å; Y406-V595 PolarHBondContact OH-N 3.47Å; Y406-G639 VanDerWaalsContact CE1-O 3.26Å; Y406-G639 WeakPolarHBondContact CE1-O 3.29Å; Y406-V643 HydrophobicContact CD1-CB 4.17Å; Y406-V643 HydrophobicContact CD1-CG1 3.75Å; Y406-V643 HydrophobicContact CD1-CG2 4.1Å; Y406-V643 HydrophobicContact CE1-CB 4.24Å; Y406-V643 HydrophobicContact CE1-CG1 4.32Å; Y406-V643 HydrophobicContact CE1-CG2 3.9Å; Y406-V643 HydrophobicContact CG-CG1 4.44Å
407	T	87.1	Confident	82	Confident	26 Å²	26	42.4 Å²	42.4	16%	0.16	20%	0.199	C	C	.	.	H	α-helix	trans	-62	-44	173.6	-60.4	0	0	0	0	111.8	R403 I409 L410 M411 F644	R403-T407 WeakPolarHBondContact O-CB 3.48Å; R403-T407 PolarHBondContact O-N 2.86Å; R403-T407 PolarHBondContact O-OG1 3.17Å; R403-T407 VanDerWaalsContact O-OG1 3.07Å; T407-I409 VanDerWaalsContact C-N 3.31Å; T407-I409 PolarHBondContact O-N 3.07Å; T407-L410 PolarHBondContact O-N 3.4Å; T407-M411 HydrophobicContact CG2-CE 3.81Å; T407-M411 HydrophobicContact CG2-CG 4.3Å; T407-M411 HydrophobicContact CG2-SD 4.09Å; T407-M411 WeakPolarHBondContact O-CB 3.26Å; T407-M411 WeakPolarHBondContact O-CG 3.4Å; T407-M411 PolarHBondContact O-N 3.14Å; T407-F644 HydrophobicContact CG2-CD1 4.36Å; T407-F644 HydrophobicContact CG2-CE1 3.84Å
408	K	86.2	Confident	80.6	Confident	107 Å²	107	44.1 Å²	44.1	47%	0.465	21%	0.206	S	C	.	.	H	α-helix	trans	-60	-38.2	175.4	-73.7	158.7	-173.4	164.3	0	112	E404 W405 K412	E404-K408 WeakPolarHBondContact O-CB 3.24Å; E404-K408 WeakPolarHBondContact O-CD 3.47Å; E404-K408 WeakPolarHBondContact O-CG 3.09Å; E404-K408 PolarHBondContact O-N 3.26Å; E404-K408 IonicContact OE2-NZ 3.69Å; E404-K408 PolarHBondContact OE2-NZ 3.38Å; W405-K408 PolarHBondContact O-N 2.89Å; K408-K412 WeakPolarHBondContact O-CB 3.42Å; K408-K412 PolarHBondContact O-N 3.07Å
409	I	87	Confident	79.2	Confident	16 Å²	16	47.4 Å²	47.4	8%	0.082	23%	0.23	C	C	.	.	H	α-helix	trans	-67	-48.5	175.6	-67.1	157.2	0	0	0	111	W405 Y406 T407 K412 V431 Q434 L435 C438 F445	W405-I409 WeakPolarHBondContact O-CD1 3.35Å; W405-I409 VanDerWaalsContact O-CG1 3.22Å; W405-I409 WeakPolarHBondContact O-CG1 3.35Å; W405-I409 PolarHBondContact O-N 3.38Å; Y406-I409 PolarHBondContact O-N 3.24Å; T407-I409 VanDerWaalsContact C-N 3.31Å; T407-I409 PolarHBondContact O-N 3.07Å; I409-K412 PolarHBondContact O-N 3.45Å; I409-V431 HydrophobicContact CG2-CG1 4.46Å; I409-Q434 HydrophobicContact CD1-CB 3.97Å; I409-Q434 HydrophobicContact CG1-CB 4.34Å; I409-Q434 HydrophobicContact CG2-CB 4.12Å; I409-L435 HydrophobicContact CB-CD2 4.02Å; I409-L435 HydrophobicContact CG2-CD2 3.61Å; I409-L435 HydrophobicContact CG2-CG 4.05Å; I409-C438 HydrophobicContact CD1-CB 4.17Å; I409-F445 HydrophobicContact CD1-CE1 4.17Å; I409-F445 HydrophobicContact CD1-CE2 4.09Å; I409-F445 HydrophobicContact CD1-CZ 3.53Å
410	L	83.9	Confident	77.2	Confident	2 Å²	2	52.6 Å²	52.6	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-63.1	-42.8	178.8	-70.2	176.1	0	0	0	112.6	Y406 T407 K412 D413 I414 L417 L435 I636 A640 F644	Y406-L410 HydrophobicContact CD1-CD1 3.78Å; Y406-L410 HydrophobicContact CD1-CG 4.25Å; Y406-L410 HydrophobicContact CE1-CD1 3.75Å; Y406-L410 HydrophobicContact CE1-CG 4.33Å; Y406-L410 WeakPolarHBondContact O-CG 3.35Å; Y406-L410 PolarHBondContact O-N 3.29Å; T407-L410 PolarHBondContact O-N 3.4Å; L410-K412 VanDerWaalsContact C-N 3.34Å; L410-K412 PolarHBondContact O-N 3.22Å; L410-D413 PolarHBondContact O-N 3.37Å; L410-I414 WeakPolarHBondContact O-CA 3.49Å; L410-I414 PolarHBondContact O-N 3.49Å; L410-I414 VanDerWaalsContact O-N 3.07Å; L410-L417 HydrophobicContact CD2-CD1 3.96Å; L410-L435 HydrophobicContact CD2-CD1 4.03Å; L410-L435 HydrophobicContact CD2-CD2 4.17Å; L410-L435 HydrophobicContact CG-CD2 4.18Å; L410-I636 HydrophobicContact CD2-CG2 3.99Å; L410-A640 HydrophobicContact CD1-CB 3.75Å; L410-A640 HydrophobicContact CD2-CB 4.3Å; L410-F644 HydrophobicContact CB-CE2 4.38Å; L410-F644 HydrophobicContact CB-CZ 4.04Å; L410-F644 HydrophobicContact CD1-CE2 4.04Å; L410-F644 HydrophobicContact CD1-CZ 4.3Å
411	M	80.1	Confident	75.6	Confident	69 Å²	69	48.3 Å²	48.3	34%	0.34	27%	0.269	S	S	.	.	H	α-helix	trans	-64.9	-35.1	178.6	-75.4	-173.9	172	0	0	112.8	T407 D413 I414 F644 Y702	T407-M411 HydrophobicContact CG2-CE 3.81Å; T407-M411 HydrophobicContact CG2-CG 4.3Å; T407-M411 HydrophobicContact CG2-SD 4.09Å; T407-M411 WeakPolarHBondContact O-CB 3.26Å; T407-M411 WeakPolarHBondContact O-CG 3.4Å; T407-M411 PolarHBondContact O-N 3.14Å; M411-D413 PolarHBondContact O-N 3.07Å; M411-I414 VanDerWaalsContact O-CG2 3.29Å; M411-I414 WeakPolarHBondContact O-CG2 3.46Å; M411-F644 HydrophobicContact CE-CE1 3.97Å; M411-F644 HydrophobicContact CG-CE1 4.26Å; M411-F644 HydrophobicContact CG-CZ 4.4Å; M411-Y702 HydrophobicContact CE-CD1 4.11Å; M411-Y702 HydrophobicContact CE-CE1 4.37Å
412	K	79.8	Confident	73.8	Confident	170 Å²	170	57.1 Å²	57.1	74%	0.739	31%	0.307	S	S	*	.	H	α-helix	trans	-62.4	-42.7	179.5	-178.8	178.8	178.8	176.2	0	112.4	K408 I409 L410	K408-K412 WeakPolarHBondContact O-CB 3.42Å; K408-K412 PolarHBondContact O-N 3.07Å; I409-K412 PolarHBondContact O-N 3.45Å; L410-K412 VanDerWaalsContact C-N 3.34Å; L410-K412 PolarHBondContact O-N 3.22Å
413	D	69.8	Low	72.3	Confident	41 Å²	41	58.4 Å²	58.4	22%	0.219	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107	18.8	-174.9	-68.2	-66.5	0	0	0	112.5	L410 M411 D415 I416 L417 V431	L410-D413 PolarHBondContact O-N 3.37Å; M411-D413 PolarHBondContact O-N 3.07Å; D413-D415 VanDerWaalsContact C-N 3.26Å; D413-D415 PolarHBondContact O-N 3.39Å; D413-I416 HydrophobicContact CB-CD1 4.14Å; D413-I416 HydrophobicContact CB-CG1 4.42Å; D413-I416 WeakPolarHBondContact O-CA 3.42Å; D413-I416 VanDerWaalsContact O-CB 3.25Å; D413-I416 WeakPolarHBondContact O-CB 3.37Å; D413-I416 PolarHBondContact O-N 3.36Å; D413-I416 WeakPolarHBondContact OD1-CD1 3.36Å; D413-L417 PolarHBondContact O-N 2.84Å; D413-V431 HydrophobicContact CB-CG2 3.81Å
414	I	68.6	Low	71.3	Confident	15 Å²	15	61.6 Å²	61.6	8%	0.077	33%	0.331	C	S	.	.	H	α-helix	trans	-58.8	-34	-176.8	-165.2	169.3	0	0	0	113.3	L410 M411 I416 L417 N418 Y695	L410-I414 WeakPolarHBondContact O-CA 3.49Å; L410-I414 PolarHBondContact O-N 3.49Å; L410-I414 VanDerWaalsContact O-N 3.07Å; M411-I414 VanDerWaalsContact O-CG2 3.29Å; M411-I414 WeakPolarHBondContact O-CG2 3.46Å; I414-I416 PolarHBondContact O-N 2.87Å; I414-L417 PolarHBondContact O-N 3.23Å; I414-N418 PolarHBondContact O-N 2.85Å; I414-N418 PolarHBondContact O-ND2 2.84Å; I414-Y695 HydrophobicContact CD1-CD1 3.92Å; I414-Y695 HydrophobicContact CD1-CE1 3.91Å; I414-Y695 HydrophobicContact CG1-CD1 4.32Å; I414-Y695 HydrophobicContact CG1-CE1 3.89Å; I414-Y695 HydrophobicContact CG2-CE1 4.11Å
415	D	64.1	Low	70.5	Confident	66 Å²	66	61.7 Å²	61.7	35%	0.353	33%	0.331	S	S	.	.	H	α-helix	trans	-59.8	-37	174.3	-60	-10.7	0	0	0	111.1	D413 S419 Y695 K706	D413-D415 VanDerWaalsContact C-N 3.26Å; D413-D415 PolarHBondContact O-N 3.39Å; D415-S419 VanDerWaalsContact O-CB 3.24Å; D415-S419 WeakPolarHBondContact O-CB 3.18Å; D415-S419 PolarHBondContact O-N 2.84Å; D415-S419 VanDerWaalsContact O-N 3.15Å; D415-S419 PolarHBondContact O-OG 2.81Å; D415-Y695 WeakPolarHBondContact CA-OH 3.34Å; D415-Y695 PolarHBondContact OD1-OH 2.69Å; D415-K706 IonicContact OD1-NZ 3.6Å; D415-K706 PolarHBondContact OD1-NZ 3.15Å; D415-K706 IonicContact OD2-NZ 2.6Å; D415-K706 PolarHBondContact OD2-NZ 3.17Å
416	I	62.3	Low	69.5	Low	35 Å²	35	64.8 Å²	64.8	18%	0.179	35%	0.349	C	S	.	.	H	α-helix	trans	-71.8	-43.4	179.9	-52.4	-175.1	0	0	0	109.9	D413 I414 N418 S419 M423 L428	D413-I416 HydrophobicContact CB-CD1 4.14Å; D413-I416 HydrophobicContact CB-CG1 4.42Å; D413-I416 WeakPolarHBondContact O-CA 3.42Å; D413-I416 VanDerWaalsContact O-CB 3.25Å; D413-I416 WeakPolarHBondContact O-CB 3.37Å; D413-I416 PolarHBondContact O-N 3.36Å; D413-I416 WeakPolarHBondContact OD1-CD1 3.36Å; I414-I416 PolarHBondContact O-N 2.87Å; I416-N418 PolarHBondContact O-N 3.17Å; I416-N418 VanDerWaalsContact O-N 3.17Å; I416-S419 PolarHBondContact O-N 3.43Å; I416-M423 HydrophobicContact CG2-CE 3.44Å; I416-M423 VanDerWaalsContact CG2-CE 3.44Å; I416-M423 WeakPolarHBondContact O-CE 3.39Å; I416-L428 HydrophobicContact CG2-CD2 4.45Å
417	L	60.7	Low	68.8	Low	4 Å²	4	71.7 Å²	71.7	2%	0.021	38%	0.375	C	S	.	.	H	α-helix	trans	-63.2	-22.8	-178.2	-58.4	179.5	0	0	0	114.3	L410 D413 I414 I636 R637	L410-L417 HydrophobicContact CD2-CD1 3.96Å; D413-L417 PolarHBondContact O-N 2.84Å; I414-L417 PolarHBondContact O-N 3.23Å; L417-I636 HydrophobicContact CD1-CG2 4.19Å; L417-I636 HydrophobicContact CD2-CB 4.43Å; L417-I636 HydrophobicContact CD2-CG2 3.62Å; L417-R637 PolarHBondContact O-NH2 3.26Å
418	N	60.3	Low	68.3	Low	42 Å²	42	70.4 Å²	70.4	23%	0.225	37%	0.367	C	S	.	.	H	α-helix	trans	-107.6	-10.9	-178.9	-63.4	-80.5	0	0	0	113.9	I414 I416 A420 V694 Y695	I414-N418 PolarHBondContact O-N 2.85Å; I414-N418 PolarHBondContact O-ND2 2.84Å; I416-N418 PolarHBondContact O-N 3.17Å; I416-N418 VanDerWaalsContact O-N 3.17Å; N418-A420 PolarHBondContact O-N 3.37Å; N418-V694 PolarHBondContact OD1-N 3.01Å; N418-Y695 HydrophobicContact CB-CD2 4.21Å; N418-Y695 HydrophobicContact CB-CE2 3.54Å; N418-Y695 VanDerWaalsContact CG-CE2 3.49Å; N418-Y695 WeakPolarHBondContact ND2-CE2 3.32Å
419	S	58.4	Low	67.9	Low	70 Å²	70	69 Å²	69	49%	0.49	36%	0.364	S	S	.	.			trans	-83	96.8	-178.3	-71.9	0	0	0	0	112.5	D415 I416 G421	D415-S419 VanDerWaalsContact O-CB 3.24Å; D415-S419 WeakPolarHBondContact O-CB 3.18Å; D415-S419 PolarHBondContact O-N 2.84Å; D415-S419 VanDerWaalsContact O-N 3.15Å; D415-S419 PolarHBondContact O-OG 2.81Å; I416-S419 PolarHBondContact O-N 3.43Å; S419-G421 PolarHBondContact O-N 3.1Å
420	A	48.2	Very low	67.7	Low	111 Å²	111	72.5 Å²	72.5	92%	0.917	38%	0.383	S	S	*	.			trans	-69.5	22.5	177.9	0	0	0	0	0	115.3	N418	N418-A420 PolarHBondContact O-N 3.37Å
421	G	56.3	Low	67.7	Low	55 Å²	55	72.7 Å²	72.7	57%	0.567	38%	0.384	S	S	*	.	S	Bend	trans	-88.8	-162.8	-179.9	0	0	0	0	0	113.9	S419 M423	S419-G421 PolarHBondContact O-N 3.1Å; G421-M423 VanDerWaalsContact C-N 3.3Å; G421-M423 WeakPolarHBondContact O-CG 3.44Å; G421-M423 PolarHBondContact O-N 2.92Å
422	K	52.2	Low	67.9	Low	214 Å²	214	69.5 Å²	69.5	93%	0.93	37%	0.369	S	S	*	.	S	Bend	trans	-67.1	80.9	176	-74.1	-176.8	175.9	179.3	0	111.7
423	M	59.1	Low	68.1	Low	28 Å²	28	65.3 Å²	65.3	14%	0.138	35%	0.352	C	S	.	.			trans	-72.3	130.6	-176.9	-58.4	-167.3	77.4	0	0	113.5	I416 G421 K425 L428 K629 L633	I416-M423 HydrophobicContact CG2-CE 3.44Å; I416-M423 VanDerWaalsContact CG2-CE 3.44Å; I416-M423 WeakPolarHBondContact O-CE 3.39Å; G421-M423 VanDerWaalsContact C-N 3.3Å; G421-M423 WeakPolarHBondContact O-CG 3.44Å; G421-M423 PolarHBondContact O-N 2.92Å; M423-K425 PolarHBondContact O-N 3.5Å; M423-L428 HydrophobicContact CE-CD1 3.97Å; M423-L428 HydrophobicContact CE-CD2 3.81Å; M423-L428 HydrophobicContact CE-CG 4.03Å; M423-L428 HydrophobicContact SD-CD1 4.22Å; M423-K629 PolarHBondContact O-NZ 3.07Å; M423-L633 HydrophobicContact CE-CD2 4.02Å; M423-L633 HydrophobicContact SD-CD1 3.82Å; M423-L633 HydrophobicContact SD-CD2 4.02Å; M423-L633 HydrophobicContact SD-CG 4.44Å
424	D	66.3	Low	69	Low	84 Å²	84	66.3 Å²	66.3	45%	0.449	36%	0.356	S	S	.	.			trans	-64.7	112.5	167.6	-78.9	-29.6	0	0	0	110.7	M426 R427 L428	D424-M426 PolarHBondContact O-N 3.02Å; D424-M426 VanDerWaalsContact O-N 3.13Å; D424-R427 HydrophobicContact CB-CB 4.14Å; D424-R427 HydrophobicContact CB-CG 3.73Å; D424-R427 PolarHBondContact O-N 2.77Å; D424-R427 IonicContact OD2-CZ 3.72Å; D424-R427 IonicContact OD2-NE 2.66Å; D424-R427 PolarHBondContact OD2-NE 2.62Å; D424-R427 IonicContact OD2-NH2 2.73Å; D424-R427 PolarHBondContact OD2-NH2 2.98Å; D424-R427 VanDerWaalsContact OD2-NH2 3.1Å; D424-L428 PolarHBondContact O-N 3.46Å
425	K	71.2	Confident	70	Confident	88 Å²	88	65.6 Å²	65.6	38%	0.383	35%	0.352	S	S	.	.	H	α-helix	trans	-56.1	-33	176.1	-166.4	175.9	-173.8	171.3	0	111.8	M423 L429 L627 M632	M423-K425 PolarHBondContact O-N 3.5Å; K425-L429 HydrophobicContact CG-CD1 4.25Å; K425-L429 WeakPolarHBondContact O-CG 3.26Å; K425-L429 PolarHBondContact O-N 2.97Å; K425-L429 VanDerWaalsContact O-N 3.14Å; K425-L627 WeakPolarHBondContact CE-O 3.35Å; K425-L627 PolarHBondContact NZ-O 3.4Å; K425-M632 HydrophobicContact CD-CE 4.28Å; K425-M632 HydrophobicContact CG-CE 3.74Å
426	M	69.3	Low	71.3	Confident	117 Å²	117	63.1 Å²	63.1	58%	0.576	34%	0.338	S	S	*	.	H	α-helix	trans	-69.5	-30.1	-179.6	-159	161.7	76.9	0	0	113.3	D424 N430 L734	D424-M426 PolarHBondContact O-N 3.02Å; D424-M426 VanDerWaalsContact O-N 3.13Å; M426-N430 VanDerWaalsContact O-CG 3.28Å; M426-N430 PolarHBondContact O-N 2.87Å; M426-N430 VanDerWaalsContact O-N 3.12Å; M426-L734 HydrophobicContact SD-CD1 4.12Å
427	R	74.1	Confident	72.7	Confident	145 Å²	145	64.1 Å²	64.1	55%	0.547	34%	0.341	S	S	.	.	H	α-helix	trans	-71.6	-44.8	175.3	-66	-173.8	-157.3	-140	4.2	111.7	D424 L429 N430 V431	D424-R427 HydrophobicContact CB-CB 4.14Å; D424-R427 HydrophobicContact CB-CG 3.73Å; D424-R427 PolarHBondContact O-N 2.77Å; D424-R427 IonicContact OD2-CZ 3.72Å; D424-R427 IonicContact OD2-NE 2.66Å; D424-R427 PolarHBondContact OD2-NE 2.62Å; D424-R427 IonicContact OD2-NH2 2.73Å; D424-R427 PolarHBondContact OD2-NH2 2.98Å; D424-R427 VanDerWaalsContact OD2-NH2 3.1Å; R427-L429 VanDerWaalsContact C-N 3.33Å; R427-L429 PolarHBondContact O-N 3.13Å; R427-N430 WeakPolarHBondContact O-CB 3.46Å; R427-N430 PolarHBondContact O-N 3.28Å; R427-N430 VanDerWaalsContact O-N 3.09Å; R427-V431 PolarHBondContact O-N 3.5Å
428	L	77.4	Confident	74.2	Confident	0 Å²	0	64 Å²	64	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-60.1	-42.7	175.6	-72.2	174.2	0	0	0	112	I416 M423 D424 N430 V431 L432 L633 I636	I416-L428 HydrophobicContact CG2-CD2 4.45Å; M423-L428 HydrophobicContact CE-CD1 3.97Å; M423-L428 HydrophobicContact CE-CD2 3.81Å; M423-L428 HydrophobicContact CE-CG 4.03Å; M423-L428 HydrophobicContact SD-CD1 4.22Å; D424-L428 PolarHBondContact O-N 3.46Å; L428-N430 VanDerWaalsContact C-N 3.29Å; L428-N430 PolarHBondContact O-N 3.39Å; L428-V431 PolarHBondContact O-N 2.9Å; L428-L432 WeakPolarHBondContact O-CB 3.42Å; L428-L432 PolarHBondContact O-N 3.32Å; L428-L633 HydrophobicContact CD1-CD2 4.01Å; L428-L633 HydrophobicContact CD1-CG 4.05Å; L428-L633 HydrophobicContact CD2-CD2 3.67Å; L428-I636 HydrophobicContact CD2-CD1 4.17Å
429	L	77.1	Confident	75.7	Confident	77 Å²	77	62 Å²	62	40%	0.403	33%	0.329	S	S	.	.	H	α-helix	trans	-60.3	-37.6	173.6	-74.6	167	0	0	0	112.5	K425 R427 M433 M632	K425-L429 HydrophobicContact CG-CD1 4.25Å; K425-L429 WeakPolarHBondContact O-CG 3.26Å; K425-L429 PolarHBondContact O-N 2.97Å; K425-L429 VanDerWaalsContact O-N 3.14Å; R427-L429 VanDerWaalsContact C-N 3.33Å; R427-L429 PolarHBondContact O-N 3.13Å; L429-M433 VanDerWaalsContact O-CB 3.3Å; L429-M433 WeakPolarHBondContact O-CB 3.47Å; L429-M433 PolarHBondContact O-N 2.89Å; L429-M632 HydrophobicContact CD2-CE 4.43Å; L429-M632 HydrophobicContact CD2-SD 3.55Å; L429-M632 VanDerWaalsContact CD2-SD 3.55Å; L429-M632 HydrophobicContact CG-CE 4.37Å; L429-M632 HydrophobicContact CG-SD 3.97Å
430	N	82.3	Confident	77.3	Confident	90 Å²	90	58.6 Å²	58.6	48%	0.481	31%	0.306	S	S	.	.	H	α-helix	trans	-68.3	-46.3	176.1	-75.4	-13.3	0	0	0	112.4	M426 R427 L428 L432 M433 Q434	M426-N430 VanDerWaalsContact O-CG 3.28Å; M426-N430 PolarHBondContact O-N 2.87Å; M426-N430 VanDerWaalsContact O-N 3.12Å; R427-N430 WeakPolarHBondContact O-CB 3.46Å; R427-N430 PolarHBondContact O-N 3.28Å; R427-N430 VanDerWaalsContact O-N 3.09Å; L428-N430 VanDerWaalsContact C-N 3.29Å; L428-N430 PolarHBondContact O-N 3.39Å; N430-L432 PolarHBondContact O-N 3.11Å; N430-M433 WeakPolarHBondContact O-CB 3.43Å; N430-M433 PolarHBondContact O-N 2.98Å; N430-Q434 WeakPolarHBondContact O-CG 3.2Å; N430-Q434 PolarHBondContact O-N 2.84Å
431	V	84	Confident	79.5	Confident	5 Å²	5	53.3 Å²	53.3	3%	0.03	26%	0.262	C	S	.	.	H	α-helix	trans	-56.5	-52.2	175.3	173.9	0	0	0	0	110.1	I409 D413 R427 L428 M433 Q434 L435 I636	I409-V431 HydrophobicContact CG2-CG1 4.46Å; D413-V431 HydrophobicContact CB-CG2 3.81Å; R427-V431 PolarHBondContact O-N 3.5Å; L428-V431 PolarHBondContact O-N 2.9Å; V431-M433 VanDerWaalsContact C-N 3.26Å; V431-M433 PolarHBondContact O-N 3.43Å; V431-Q434 PolarHBondContact O-N 3.28Å; V431-L435 HydrophobicContact CG1-CD1 4.06Å; V431-L435 HydrophobicContact CG1-CG 4.39Å; V431-L435 WeakPolarHBondContact O-CG 3.38Å; V431-L435 PolarHBondContact O-N 3.15Å; V431-I636 HydrophobicContact CG1-CD1 4.47Å
432	L	84.8	Confident	81.3	Confident	3 Å²	3	50.7 Å²	50.7	2%	0.016	24%	0.235	C	C	.	.	H	α-helix	trans	-56.9	-37.4	178	-175.9	57.2	0	0	0	112.6	L428 N430 R436 W563 V595 M632 I635 I636	L428-L432 WeakPolarHBondContact O-CB 3.42Å; L428-L432 PolarHBondContact O-N 3.32Å; N430-L432 PolarHBondContact O-N 3.11Å; L432-R436 WeakPolarHBondContact O-CG 3.48Å; L432-R436 PolarHBondContact O-N 3.12Å; L432-R436 VanDerWaalsContact O-N 3.11Å; L432-W563 HydrophobicContact CD1-CH2 4.29Å; L432-W563 HydrophobicContact CD1-CZ2 4.33Å; L432-W563 HydrophobicContact CD2-CH2 3.7Å; L432-W563 HydrophobicContact CD2-CZ2 3.66Å; L432-W563 HydrophobicContact CG-CH2 4.27Å; L432-W563 HydrophobicContact CG-CZ2 3.98Å; L432-V595 HydrophobicContact CD1-CB 4.03Å; L432-V595 HydrophobicContact CD1-CG1 4.02Å; L432-V595 HydrophobicContact CD1-CG2 4.38Å; L432-M632 HydrophobicContact CD2-CB 4.49Å; L432-M632 HydrophobicContact CD2-CG 4.04Å; L432-M632 HydrophobicContact CD2-SD 3.96Å; L432-I635 HydrophobicContact CD1-CG2 4.07Å; L432-I636 HydrophobicContact CB-CD1 4.32Å; L432-I636 HydrophobicContact CD1-CG1 4.22Å
433	M	85.1	Confident	83.2	Confident	81 Å²	81	41.1 Å²	41.1	40%	0.399	19%	0.194	S	C	.	.	H	α-helix	trans	-68.2	-39.6	174.4	-174.3	61.2	67.7	0	0	112.8	L429 N430 V431 K437 M490	L429-M433 VanDerWaalsContact O-CB 3.3Å; L429-M433 WeakPolarHBondContact O-CB 3.47Å; L429-M433 PolarHBondContact O-N 2.89Å; N430-M433 WeakPolarHBondContact O-CB 3.43Å; N430-M433 PolarHBondContact O-N 2.98Å; V431-M433 VanDerWaalsContact C-N 3.26Å; V431-M433 PolarHBondContact O-N 3.43Å; M433-K437 PolarHBondContact O-N 3.41Å; M433-K437 VanDerWaalsContact O-N 3.17Å; M433-M490 HydrophobicContact SD-CE 4.36Å
434	Q	87.9	Confident	84.7	Confident	63 Å²	63	40.1 Å²	40.1	29%	0.294	19%	0.188	S	C	.	.	H	α-helix	trans	-68.5	-42.3	174.8	-49.8	-50.9	-11.5	0	0	111	I409 N430 V431 R436 K437 C438 F445	I409-Q434 HydrophobicContact CD1-CB 3.97Å; I409-Q434 HydrophobicContact CG1-CB 4.34Å; I409-Q434 HydrophobicContact CG2-CB 4.12Å; N430-Q434 WeakPolarHBondContact O-CG 3.2Å; N430-Q434 PolarHBondContact O-N 2.84Å; V431-Q434 PolarHBondContact O-N 3.28Å; Q434-R436 VanDerWaalsContact C-N 3.3Å; Q434-R436 PolarHBondContact O-N 3.46Å; Q434-K437 WeakPolarHBondContact O-CB 3.39Å; Q434-K437 PolarHBondContact O-N 2.71Å; Q434-K437 VanDerWaalsContact O-N 3.08Å; Q434-C438 PolarHBondContact O-N 2.94Å; Q434-F445 HydrophobicContact CB-CE1 4.08Å; Q434-F445 HydrophobicContact CB-CZ 4.29Å; Q434-F445 WeakPolarHBondContact O-CZ 3.28Å
435	L	90	Very high	85.7	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-57.3	-43.4	176.7	-64.8	175.2	0	0	0	111.3	Y406 I409 L410 V431 K437 C438 C439 V595 I636	Y406-L435 HydrophobicContact CD1-CD2 3.96Å; Y406-L435 HydrophobicContact CD2-CD2 3.86Å; Y406-L435 HydrophobicContact CE1-CD2 3.95Å; Y406-L435 HydrophobicContact CE2-CB 4.03Å; Y406-L435 HydrophobicContact CE2-CD2 3.83Å; Y406-L435 HydrophobicContact CE2-CG 4.43Å; Y406-L435 HydrophobicContact CG-CD2 3.94Å; I409-L435 HydrophobicContact CB-CD2 4.02Å; I409-L435 HydrophobicContact CG2-CD2 3.61Å; I409-L435 HydrophobicContact CG2-CG 4.05Å; L410-L435 HydrophobicContact CD2-CD1 4.03Å; L410-L435 HydrophobicContact CD2-CD2 4.17Å; L410-L435 HydrophobicContact CG-CD2 4.18Å; V431-L435 HydrophobicContact CG1-CD1 4.06Å; V431-L435 HydrophobicContact CG1-CG 4.39Å; V431-L435 WeakPolarHBondContact O-CG 3.38Å; V431-L435 PolarHBondContact O-N 3.15Å; L435-K437 PolarHBondContact O-N 2.85Å; L435-C438 VanDerWaalsContact O-CB 3.31Å; L435-C438 WeakPolarHBondContact O-CB 3.39Å; L435-C438 PolarHBondContact O-N 3.29Å; L435-C438 VanDerWaalsContact O-N 3.11Å; L435-C439 PolarHBondContact O-N 2.84Å; L435-C439 PolarHBondContact O-SG 3.48Å; L435-C439 VanDerWaalsContact O-SG 3.32Å; L435-V595 HydrophobicContact CB-CG1 4.37Å; L435-V595 HydrophobicContact CB-CG2 3.83Å; L435-V595 HydrophobicContact CD1-CG1 3.83Å; L435-I636 HydrophobicContact CD1-CG1 4.42Å; L435-I636 HydrophobicContact CD1-CG2 4Å
436	R	91.1	Very high	86.3	Confident	13 Å²	13	38.9 Å²	38.9	5%	0.049	19%	0.185	C	C	.	.	H	α-helix	trans	-60.9	-40.4	173.3	-74	-170.4	68.7	-171.5	3	114	L432 Q434 C438 C439 N440 M490 D560 S561 V595 I599	L432-R436 WeakPolarHBondContact O-CG 3.48Å; L432-R436 PolarHBondContact O-N 3.12Å; L432-R436 VanDerWaalsContact O-N 3.11Å; Q434-R436 VanDerWaalsContact C-N 3.3Å; Q434-R436 PolarHBondContact O-N 3.46Å; R436-C438 VanDerWaalsContact C-N 3.26Å; R436-C438 PolarHBondContact O-N 2.76Å; R436-C439 PolarHBondContact O-N 2.91Å; R436-N440 PolarHBondContact O-N 3.4Å; R436-N440 VanDerWaalsContact O-N 3.11Å; R436-M490 HydrophobicContact CB-CE 3.97Å; R436-D560 IonicContact NH2-OD2 3.42Å; R436-D560 PolarHBondContact NH2-OD2 3.35Å; R436-S561 PolarHBondContact NH2-O 3.26Å; R436-V595 HydrophobicContact CG-CG2 4.22Å; R436-I599 HydrophobicContact CG-CD1 4.17Å
437	K	90.8	Very high	86.8	Confident	57 Å²	57	36.1 Å²	36.1	25%	0.248	19%	0.187	C	C	.	.	H	α-helix	trans	-59.6	-41.5	172.7	-70.4	176.9	-171.9	172.1	0	111	M433 Q434 L435 C439 N440 H441 L444 F445 M490	M433-K437 PolarHBondContact O-N 3.41Å; M433-K437 VanDerWaalsContact O-N 3.17Å; Q434-K437 WeakPolarHBondContact O-CB 3.39Å; Q434-K437 PolarHBondContact O-N 2.71Å; Q434-K437 VanDerWaalsContact O-N 3.08Å; L435-K437 PolarHBondContact O-N 2.85Å; K437-C439 PolarHBondContact O-N 2.96Å; K437-N440 PolarHBondContact O-N 3.12Å; K437-N440 VanDerWaalsContact O-N 3.08Å; K437-H441 PolarHBondContact O-N 3.44Å; K437-L444 HydrophobicContact CB-CB 4.06Å; K437-L444 HydrophobicContact CB-CD1 4.04Å; K437-L444 HydrophobicContact CD-CB 4.34Å; K437-L444 HydrophobicContact CG-CB 4.33Å; K437-L444 HydrophobicContact CG-CD1 4.3Å; K437-F445 HydrophobicContact CB-CE1 4.26Å; K437-F445 HydrophobicContact CB-CE2 4.38Å; K437-F445 HydrophobicContact CB-CZ 3.83Å; K437-F445 HydrophobicContact CD-CE1 4.05Å; K437-F445 HydrophobicContact CD-CZ 4.44Å; K437-M490 HydrophobicContact CG-CE 4Å; K437-M490 HydrophobicContact CG-SD 3.78Å
438	C	91.9	Very high	87.4	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.8	-40	180	-158.8	0	0	0	0	112.2	Q402 W405 Y406 I409 Q434 L435 R436 N440 F445	Q402-C438 WeakPolarHBondContact CG-O 3.19Å; Q402-C438 PolarHBondContact NE2-O 2.86Å; Q402-C438 PolarHBondContact O-SG 3.17Å; W405-C438 VanDerWaalsContact CB-SG 3.56Å; Y406-C438 HydrophobicContact CD2-CB 4.15Å; Y406-C438 PolarHBondContact N-SG 3.15Å; Y406-C438 VanDerWaalsContact N-SG 3.4Å; I409-C438 HydrophobicContact CD1-CB 4.17Å; Q434-C438 PolarHBondContact O-N 2.94Å; L435-C438 VanDerWaalsContact O-CB 3.31Å; L435-C438 WeakPolarHBondContact O-CB 3.39Å; L435-C438 PolarHBondContact O-N 3.29Å; L435-C438 VanDerWaalsContact O-N 3.11Å; R436-C438 VanDerWaalsContact C-N 3.26Å; R436-C438 PolarHBondContact O-N 2.76Å; C438-N440 VanDerWaalsContact C-N 3.28Å; C438-N440 PolarHBondContact O-N 3.02Å; C438-F445 HydrophobicContact CB-CE2 3.85Å; C438-F445 HydrophobicContact CB-CZ 4.13Å
439	C	92.3	Very high	87.8	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.4	-33.3	171.3	-60.7	0	0	0	0	112.9	Q402 L435 R436 K437 K466 T591 T594 E596	Q402-C439 PolarHBondContact NE2-O 3.12Å; Q402-C439 VanDerWaalsContact NE2-O 3.09Å; L435-C439 PolarHBondContact O-N 2.84Å; L435-C439 PolarHBondContact O-SG 3.48Å; L435-C439 VanDerWaalsContact O-SG 3.32Å; R436-C439 PolarHBondContact O-N 2.91Å; K437-C439 PolarHBondContact O-N 2.96Å; C439-K466 WeakPolarHBondContact O-CE 3.42Å; C439-T591 HydrophobicContact CB-CG2 4.48Å; C439-T591 WeakPolarHBondContact CB-OG1 3.17Å; C439-T594 PolarHBondContact SG-OG1 2.95Å; C439-E596 VanDerWaalsContact CB-CD 3.46Å; C439-E596 HydrophobicContact CB-CG 3.81Å; C439-E596 WeakPolarHBondContact CB-OE2 3.4Å
440	N	93.1	Very high	88	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-75.9	-62	178.1	-78.7	-10.5	0	0	0	113.7	R436 K437 C438 L444 K466 M490 M493 Y559 D560	R436-N440 PolarHBondContact O-N 3.4Å; R436-N440 VanDerWaalsContact O-N 3.11Å; K437-N440 PolarHBondContact O-N 3.12Å; K437-N440 VanDerWaalsContact O-N 3.08Å; C438-N440 VanDerWaalsContact C-N 3.28Å; C438-N440 PolarHBondContact O-N 3.02Å; N440-L444 HydrophobicContact CB-CD1 3.79Å; N440-K466 PolarHBondContact OD1-NZ 3.45Å; N440-M490 PolarHBondContact ND2-SD 2.78Å; N440-M493 HydrophobicContact CB-SD 4.1Å; N440-Y559 HydrophobicContact CB-CE1 3.99Å; N440-Y559 PolarHBondContact O-OH 3.33Å; N440-D560 VanDerWaalsContact ND2-CG 3.32Å; N440-D560 PolarHBondContact ND2-OD2 2.87Å; N440-D560 WeakPolarHBondContact OD1-CB 3.48Å
441	H	94	Very high	87.5	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.181	C	C	.	.			trans	-165.1	138.5	175.1	-158.5	-110.9	0	0	0	112.6	K437 Y443 L444 L460 M493 I496	K437-H441 PolarHBondContact O-N 3.44Å; H441-Y443 VanDerWaalsContact C-N 3.29Å; H441-Y443 AromaticContact CE1-CD2 3.45Å; H441-Y443 VanDerWaalsContact CE1-CD2 3.45Å; H441-Y443 WeakPolarHBondContact CE1-CD2 3.47Å; H441-Y443 AromaticContact CE1-CE2 3.76Å; H441-Y443 AromaticContact CE1-CG 3.56Å; H441-Y443 AromaticContact ND1-CD2 3.82Å; H441-Y443 AromaticContact ND1-CG 3.61Å; H441-Y443 PolarHBondContact ND1-N 3.35Å; H441-Y443 PolarHBondContact O-N 2.82Å; H441-L444 HydrophobicContact CB-CG 4.38Å; H441-L444 WeakPolarHBondContact O-CB 3.47Å; H441-L444 WeakPolarHBondContact O-CG 3.32Å; H441-L444 PolarHBondContact O-N 3.33Å; H441-L460 PolarHBondContact NE2-O 3.3Å; H441-M493 HydrophobicContact CB-CE 4.11Å; H441-M493 HydrophobicContact CB-SD 3.71Å; H441-I496 HydrophobicContact CB-CD1 4.12Å
442	P	92.6	Very high	86.9	Confident	0 Å²	0	35 Å²	35	0%	0	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-58.6	-33.3	177.8	-27.4	36.5	0	0	0	114.8	M401 Q402 L444 F445 A448 N463	M401-P442 HydrophobicContact CB-CG 4.34Å; M401-P442 HydrophobicContact CE-CB 3.57Å; M401-P442 HydrophobicContact CE-CG 4.44Å; M401-P442 HydrophobicContact CG-CB 4.04Å; M401-P442 HydrophobicContact CG-CG 4.02Å; M401-P442 HydrophobicContact SD-CB 3.62Å; M401-P442 HydrophobicContact SD-CG 3.86Å; Q402-P442 HydrophobicContact CG-CG 3.56Å; P442-L444 PolarHBondContact O-N 3.02Å; P442-F445 WeakPolarHBondContact O-CD2 3.41Å; P442-F445 PolarHBondContact O-N 3.46Å; P442-A448 HydrophobicContact CB-CB 4.45Å; P442-A448 WeakPolarHBondContact O-CB 3.41Å; P442-N463 WeakPolarHBondContact CD-O 3.16Å; P442-N463 VanDerWaalsContact CG-O 3.31Å; P442-N463 WeakPolarHBondContact CG-O 3.35Å
443	Y	92.4	Very high	86.6	Confident	13 Å²	13	39.9 Å²	39.9	5%	0.051	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-72.9	2.1	-177.1	-52.1	-12.2	0	0	0	113.6	M401 H441 F445 A448 E449 H459 L460 N463 R492	M401-Y443 HydrophobicContact CE-CD1 4.2Å; M401-Y443 HydrophobicContact CE-CE1 3.9Å; M401-Y443 HydrophobicContact SD-CE1 3.92Å; H441-Y443 VanDerWaalsContact C-N 3.29Å; H441-Y443 AromaticContact CE1-CD2 3.45Å; H441-Y443 VanDerWaalsContact CE1-CD2 3.45Å; H441-Y443 WeakPolarHBondContact CE1-CD2 3.47Å; H441-Y443 AromaticContact CE1-CE2 3.76Å; H441-Y443 AromaticContact CE1-CG 3.56Å; H441-Y443 AromaticContact ND1-CD2 3.82Å; H441-Y443 AromaticContact ND1-CG 3.61Å; H441-Y443 PolarHBondContact ND1-N 3.35Å; H441-Y443 PolarHBondContact O-N 2.82Å; Y443-F445 PolarHBondContact O-N 3.28Å; Y443-A448 HydrophobicContact CD1-CB 4.36Å; Y443-E449 HydrophobicContact CD1-CB 3.84Å; Y443-E449 HydrophobicContact CD1-CG 4.25Å; Y443-E449 HydrophobicContact CD2-CB 4.13Å; Y443-E449 HydrophobicContact CD2-CG 3.74Å; Y443-E449 HydrophobicContact CE1-CB 4.19Å; Y443-E449 HydrophobicContact CE1-CG 4.32Å; Y443-E449 HydrophobicContact CE2-CB 4.45Å; Y443-E449 HydrophobicContact CE2-CG 3.81Å; Y443-E449 HydrophobicContact CG-CB 3.85Å; Y443-E449 HydrophobicContact CG-CG 4.01Å; Y443-H459 AromaticContact CE2-ND1 3.81Å; Y443-H459 AromaticContact CZ-ND1 3.75Å; Y443-H459 PolarHBondContact OH-ND1 2.76Å; Y443-H459 PolarHBondContact OH-O 2.91Å; Y443-L460 HydrophobicContact CD2-CD1 3.79Å; Y443-L460 HydrophobicContact CE2-CD1 3.77Å; Y443-N463 HydrophobicContact CE1-CB 4.39Å; Y443-N463 PolarHBondContact OH-ND2 3.4Å; Y443-R492 PolarHBondContact O-NH2 3.38Å
444	L	90.6	Very high	86.3	Confident	6 Å²	6	40 Å²	40	3%	0.031	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-72.1	-8.4	162.2	-61.8	176.4	0	0	0	112.8	K437 N440 H441 P442 M490 R492 M493 I496	K437-L444 HydrophobicContact CB-CB 4.06Å; K437-L444 HydrophobicContact CB-CD1 4.04Å; K437-L444 HydrophobicContact CD-CB 4.34Å; K437-L444 HydrophobicContact CG-CB 4.33Å; K437-L444 HydrophobicContact CG-CD1 4.3Å; N440-L444 HydrophobicContact CB-CD1 3.79Å; H441-L444 HydrophobicContact CB-CG 4.38Å; H441-L444 WeakPolarHBondContact O-CB 3.47Å; H441-L444 WeakPolarHBondContact O-CG 3.32Å; H441-L444 PolarHBondContact O-N 3.33Å; P442-L444 PolarHBondContact O-N 3.02Å; L444-M490 HydrophobicContact CD1-SD 3.91Å; L444-R492 HydrophobicContact CD2-CB 3.54Å; L444-R492 WeakPolarHBondContact CD2-O 3.15Å; L444-M493 HydrophobicContact CD1-SD 4.34Å; L444-I496 HydrophobicContact CD2-CD1 3.7Å; L444-I496 HydrophobicContact CG-CD1 4.02Å
445	F	88.6	Confident	86.1	Confident	22 Å²	22	39.7 Å²	39.7	10%	0.096	24%	0.243	C	C	.	.	S	Bend	trans	-103.9	131.8	167.9	-55.9	-67.6	0	0	0	111	W405 I409 Q434 K437 C438 P442 Y443 G447 A448	W405-F445 HydrophobicContact CB-CE2 4.44Å; W405-F445 HydrophobicContact CD2-CB 4.48Å; W405-F445 AromaticContact CD2-CD2 3.96Å; W405-F445 HydrophobicContact CD2-CD2 3.96Å; W405-F445 HydrophobicContact CD2-CG 4.39Å; W405-F445 HydrophobicContact CE3-CB 4.07Å; W405-F445 HydrophobicContact CE3-CD1 4.47Å; W405-F445 AromaticContact CE3-CD2 3.73Å; W405-F445 HydrophobicContact CE3-CD2 3.73Å; W405-F445 HydrophobicContact CE3-CE2 4.31Å; W405-F445 AromaticContact CE3-CG 3.83Å; W405-F445 HydrophobicContact CE3-CG 3.83Å; W405-F445 HydrophobicContact CG-CD2 4.31Å; W405-F445 HydrophobicContact CH2-CB 3.88Å; W405-F445 HydrophobicContact CZ2-CB 4.31Å; W405-F445 HydrophobicContact CZ3-CB 3.75Å; W405-F445 HydrophobicContact CZ3-CD1 4.42Å; W405-F445 HydrophobicContact CZ3-CD2 4.28Å; W405-F445 AromaticContact CZ3-CG 3.9Å; W405-F445 HydrophobicContact CZ3-CG 3.9Å; I409-F445 HydrophobicContact CD1-CE1 4.17Å; I409-F445 HydrophobicContact CD1-CE2 4.09Å; I409-F445 HydrophobicContact CD1-CZ 3.53Å; Q434-F445 HydrophobicContact CB-CE1 4.08Å; Q434-F445 HydrophobicContact CB-CZ 4.29Å; Q434-F445 WeakPolarHBondContact O-CZ 3.28Å; K437-F445 HydrophobicContact CB-CE1 4.26Å; K437-F445 HydrophobicContact CB-CE2 4.38Å; K437-F445 HydrophobicContact CB-CZ 3.83Å; K437-F445 HydrophobicContact CD-CE1 4.05Å; K437-F445 HydrophobicContact CD-CZ 4.44Å; C438-F445 HydrophobicContact CB-CE2 3.85Å; C438-F445 HydrophobicContact CB-CZ 4.13Å; P442-F445 WeakPolarHBondContact O-CD2 3.41Å; P442-F445 PolarHBondContact O-N 3.46Å; Y443-F445 PolarHBondContact O-N 3.28Å; F445-G447 PolarHBondContact O-N 3.03Å; F445-A448 HydrophobicContact CB-CB 4.14Å; F445-A448 VanDerWaalsContact O-CB 3.24Å; F445-A448 WeakPolarHBondContact O-CB 3.3Å; F445-A448 PolarHBondContact O-N 2.92Å
446	D	82.1	Confident	85.7	Confident	124 Å²	124	42.6 Å²	42.6	66%	0.663	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	129	-178.1	-46.4	-39.8	0	0	0	109.2	R492	D446-R492 IonicContact OD1-CZ 3.63Å; D446-R492 IonicContact OD1-NH1 2.64Å; D446-R492 PolarHBondContact OD1-NH1 2.97Å; D446-R492 IonicContact OD1-NH2 2.78Å; D446-R492 PolarHBondContact OD1-NH2 2.94Å; D446-R492 IonicContact OD2-NH1 3.59Å
447	G	81.4	Confident	85.3	Confident	59 Å²	59	45.7 Å²	45.7	61%	0.608	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.7	5.2	-171.3	0	0	0	0	0	115.2	F445	F445-G447 PolarHBondContact O-N 3.03Å
448	A	85.5	Confident	85.2	Confident	12 Å²	12	47.9 Å²	47.9	10%	0.099	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-39.7	168.7	0	0	0	0	0	112.4	M401 W405 P442 Y443 F445	M401-A448 HydrophobicContact CE-CB 3.65Å; M401-A448 WeakPolarHBondContact CE-O 3.33Å; W405-A448 HydrophobicContact CH2-CB 4.5Å; W405-A448 HydrophobicContact CZ2-CB 3.62Å; P442-A448 HydrophobicContact CB-CB 4.45Å; P442-A448 WeakPolarHBondContact O-CB 3.41Å; Y443-A448 HydrophobicContact CD1-CB 4.36Å; F445-A448 HydrophobicContact CB-CB 4.14Å; F445-A448 VanDerWaalsContact O-CB 3.24Å; F445-A448 WeakPolarHBondContact O-CB 3.3Å; F445-A448 PolarHBondContact O-N 2.92Å
449	E	86.7	Confident	85	Confident	62 Å²	62	49.9 Å²	49.9	29%	0.29	30%	0.301	S	S	.	.	S	Bend	trans	-69.2	131.9	-178.8	-167.7	-177.8	-175.3	0	0	111.7	Y443 Y454	Y443-E449 HydrophobicContact CD1-CB 3.84Å; Y443-E449 HydrophobicContact CD1-CG 4.25Å; Y443-E449 HydrophobicContact CD2-CB 4.13Å; Y443-E449 HydrophobicContact CD2-CG 3.74Å; Y443-E449 HydrophobicContact CE1-CB 4.19Å; Y443-E449 HydrophobicContact CE1-CG 4.32Å; Y443-E449 HydrophobicContact CE2-CB 4.45Å; Y443-E449 HydrophobicContact CE2-CG 3.81Å; Y443-E449 HydrophobicContact CG-CB 3.85Å; Y443-E449 HydrophobicContact CG-CG 4.01Å; E449-Y454 HydrophobicContact CB-CD1 4.13Å; E449-Y454 HydrophobicContact CB-CE1 4.25Å; E449-Y454 HydrophobicContact CG-CD1 3.75Å; E449-Y454 HydrophobicContact CG-CE1 4.36Å
450	P	80.1	Confident	84.9	Confident	70 Å²	70	50.1 Å²	50.1	46%	0.455	30%	0.302	S	S	.	.			trans	-67.5	135	177.2	29	-34.4	0	0	0	111	Y454	P450-Y454 WeakPolarHBondContact O-CD1 3.4Å
451	G	73.4	Confident	84.7	Confident	45 Å²	45	50.4 Å²	50.4	46%	0.464	30%	0.304	S	S	.	.			trans	147.5	-174.3	179.7	0	0	0	0	0	112.9	P453	G451-P453 WeakPolarHBondContact CA-O 3.27Å
452	P	71.6	Confident	84.5	Confident	106 Å²	106	54.2 Å²	54.2	69%	0.688	33%	0.327	S	S	*	.	S	Bend	cis	-75.7	158.7	1.3	-15.3	31.4	0	0	0	113.8	Y454	P452-Y454 HydrophobicContact CB-CE2 4.23Å; P452-Y454 HydrophobicContact CG-CE2 3.99Å
453	P	76.7	Confident	84.4	Confident	105 Å²	105	55.9 Å²	55.9	68%	0.682	34%	0.336	S	S	*	.	S	Bend	cis	-66.7	156.1	-6.8	31.3	-36	0	0	0	111.4	G451	G451-P453 WeakPolarHBondContact CA-O 3.27Å
454	Y	80.1	Confident	84.3	Confident	84 Å²	84	55.3 Å²	55.3	33%	0.329	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-96.9	129.2	170.6	-57.6	-75.3	0	0	0	106.9	E449 P450 P452 R718	E449-Y454 HydrophobicContact CB-CD1 4.13Å; E449-Y454 HydrophobicContact CB-CE1 4.25Å; E449-Y454 HydrophobicContact CG-CD1 3.75Å; E449-Y454 HydrophobicContact CG-CE1 4.36Å; P450-Y454 WeakPolarHBondContact O-CD1 3.4Å; P452-Y454 HydrophobicContact CB-CE2 4.23Å; P452-Y454 HydrophobicContact CG-CE2 3.99Å; Y454-R718 VanDerWaalsContact CD2-NH1 3.27Å
455	T	82.7	Confident	84.3	Confident	56 Å²	56	55 Å²	55	34%	0.344	33%	0.333	S	S	.	.			trans	-127.9	153.9	-174.3	51.6	0	0	0	0	111.1	D457 H459	T455-D457 WeakPolarHBondContact CB-OD2 3.19Å; T455-D457 PolarHBondContact O-N 3.28Å; T455-D457 PolarHBondContact OG1-OD2 3.32Å; T455-H459 PolarHBondContact O-CE1 2.89Å; T455-H459 PolarHBondContact O-NE2 3.41Å; T455-H459 PolarHBondContact OG1-NE2 3.49Å
456	T	82	Confident	84.6	Confident	60 Å²	60	54 Å²	54	37%	0.368	33%	0.328	S	S	.	.			trans	-98.8	58.4	-177.2	57.4	0	0	0	0	110.1	D499 W503	T456-D499 HydrophobicContact CG2-CB 4.01Å; T456-W503 PolarHBondContact O-NE1 2.95Å
457	D	83.4	Confident	85.2	Confident	78 Å²	78	48.1 Å²	48.1	42%	0.417	30%	0.297	S	S	.	.	S	Bend	trans	-100.4	-175.4	-175.7	-54.3	-49	0	0	0	112.4	T455 H459 L460	T455-D457 WeakPolarHBondContact CB-OD2 3.19Å; T455-D457 PolarHBondContact O-N 3.28Å; T455-D457 PolarHBondContact OG1-OD2 3.32Å; D457-H459 PolarHBondContact O-N 2.89Å; D457-H459 IonicContact OD2-NE2 2.8Å; D457-L460 WeakPolarHBondContact O-CB 3.43Å; D457-L460 PolarHBondContact O-N 3.11Å
458	L	87.5	Confident	85.7	Confident	104 Å²	104	46.7 Å²	46.7	55%	0.545	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-25.5	177.9	-178.1	61.5	0	0	0	114.4	L460 V461 V462 W503	L458-L460 PolarHBondContact O-N 2.98Å; L458-V461 PolarHBondContact O-N 3.26Å; L458-V462 HydrophobicContact CD1-CG2 4.09Å; L458-V462 HydrophobicContact CG-CG2 3.89Å; L458-V462 PolarHBondContact O-N 2.88Å; L458-W503 HydrophobicContact CB-CH2 4.34Å; L458-W503 HydrophobicContact CD1-CH2 4.29Å
459	H	88.5	Confident	86	Confident	41 Å²	41	46.7 Å²	46.7	19%	0.19	28%	0.275	C	S	.	.	H	α-helix	trans	-63.1	-23.3	175.2	67.6	72.7	0	0	0	113.3	Y443 T455 D457 V461 N463	Y443-H459 AromaticContact CE2-ND1 3.81Å; Y443-H459 AromaticContact CZ-ND1 3.75Å; Y443-H459 PolarHBondContact OH-ND1 2.76Å; Y443-H459 PolarHBondContact OH-O 2.91Å; T455-H459 PolarHBondContact O-CE1 2.89Å; T455-H459 PolarHBondContact O-NE2 3.41Å; T455-H459 PolarHBondContact OG1-NE2 3.49Å; D457-H459 PolarHBondContact O-N 2.89Å; D457-H459 IonicContact OD2-NE2 2.8Å; H459-V461 PolarHBondContact O-N 3Å; H459-N463 WeakPolarHBondContact O-CB 3.11Å; H459-N463 PolarHBondContact O-N 3.13Å; H459-N463 PolarHBondContact O-ND2 2.92Å
460	L	89.1	Confident	86.4	Confident	6 Å²	6	43.7 Å²	43.7	3%	0.031	26%	0.261	C	S	.	.	H	α-helix	trans	-66.2	-26.5	173.3	-168.7	65.8	0	0	0	112.4	H441 Y443 D457 L458 I496 D499	H441-L460 PolarHBondContact NE2-O 3.3Å; Y443-L460 HydrophobicContact CD2-CD1 3.79Å; Y443-L460 HydrophobicContact CE2-CD1 3.77Å; D457-L460 WeakPolarHBondContact O-CB 3.43Å; D457-L460 PolarHBondContact O-N 3.11Å; L458-L460 PolarHBondContact O-N 2.98Å; L460-I496 HydrophobicContact CD1-CG2 4.06Å; L460-D499 HydrophobicContact CD2-CB 4.46Å
461	V	90.6	Very high	87	Confident	5 Å²	5	41.6 Å²	41.6	3%	0.03	25%	0.246	C	C	.	.	H	α-helix	trans	-91.8	-53.1	176.1	173	0	0	0	0	110.6	L458 H459 N463 G464 V468 D471 Y500 W503	L458-V461 PolarHBondContact O-N 3.26Å; H459-V461 PolarHBondContact O-N 3Å; V461-N463 PolarHBondContact O-N 2.94Å; V461-G464 PolarHBondContact O-N 3.21Å; V461-G464 VanDerWaalsContact O-N 3.12Å; V461-G464 VanDerWaalsContact O-O 3.09Å; V461-V468 HydrophobicContact CG1-CB 4.46Å; V461-V468 HydrophobicContact CG1-CG2 4.1Å; V461-V468 WeakPolarHBondContact O-CG2 3.26Å; V461-D471 HydrophobicContact CG1-CB 3.91Å; V461-D471 HydrophobicContact CG2-CB 4.33Å; V461-Y500 HydrophobicContact CG2-CD2 3.86Å; V461-Y500 HydrophobicContact CG2-CE2 3.76Å; V461-W503 HydrophobicContact CG2-CH2 4.48Å; V461-W503 HydrophobicContact CG2-CZ3 3.75Å
462	V	89.8	Confident	87.9	Confident	81 Å²	81	42.3 Å²	42.3	49%	0.491	24%	0.236	S	C	.	.	H	α-helix	trans	-62	-28.9	-172.8	174.7	0	0	0	0	113.2	L458 G464	L458-V462 HydrophobicContact CD1-CG2 4.09Å; L458-V462 HydrophobicContact CG-CG2 3.89Å; L458-V462 PolarHBondContact O-N 2.88Å; V462-G464 VanDerWaalsContact C-N 3.33Å; V462-G464 PolarHBondContact O-N 2.93Å
463	N	89.8	Confident	88.9	Confident	35 Å²	35	37.2 Å²	37.2	19%	0.187	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-7.3	179.8	-73.5	-58.8	0	0	0	114.7	S399 M401 P442 Y443 H459 V461	S399-N463 WeakPolarHBondContact CB-O 3.37Å; S399-N463 PolarHBondContact OG-O 3.05Å; M401-N463 HydrophobicContact CB-CB 4.43Å; M401-N463 WeakPolarHBondContact CB-OD1 3.43Å; M401-N463 HydrophobicContact SD-CB 3.71Å; M401-N463 PolarHBondContact SD-OD1 3.45Å; M401-N463 VanDerWaalsContact SD-OD1 3.36Å; P442-N463 WeakPolarHBondContact CD-O 3.16Å; P442-N463 VanDerWaalsContact CG-O 3.31Å; P442-N463 WeakPolarHBondContact CG-O 3.35Å; Y443-N463 HydrophobicContact CE1-CB 4.39Å; Y443-N463 PolarHBondContact OH-ND2 3.4Å; H459-N463 WeakPolarHBondContact O-CB 3.11Å; H459-N463 PolarHBondContact O-N 3.13Å; H459-N463 PolarHBondContact O-ND2 2.92Å; V461-N463 PolarHBondContact O-N 2.94Å
464	G	90.4	Very high	89.8	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.171	C	C	.	.			trans	-129.9	116.8	175.2	0	0	0	0	0	112.7	V461 V462 K466 M467 V468	V461-G464 PolarHBondContact O-N 3.21Å; V461-G464 VanDerWaalsContact O-N 3.12Å; V461-G464 VanDerWaalsContact O-O 3.09Å; V462-G464 VanDerWaalsContact C-N 3.33Å; V462-G464 PolarHBondContact O-N 2.93Å; G464-K466 VanDerWaalsContact C-N 3.26Å; G464-K466 PolarHBondContact O-N 3.41Å; G464-M467 WeakPolarHBondContact O-CA 3.4Å; G464-M467 WeakPolarHBondContact O-CB 3.5Å; G464-M467 PolarHBondContact O-N 3.03Å; G464-V468 PolarHBondContact O-N 3.41Å; G464-V468 VanDerWaalsContact O-N 3.08Å
465	G	90.8	Very high	90.4	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.01	17%	0.169	C	C	.	.	H	α-helix	trans	-54.4	-41	-179.5	0	0	0	0	0	113.3	V396 M467 V468 V469	V396-G465 WeakPolarHBondContact CG1-O 3.4Å; G465-M467 VanDerWaalsContact C-N 3.29Å; G465-M467 PolarHBondContact O-N 3.33Å; G465-V468 PolarHBondContact O-N 3.15Å; G465-V469 PolarHBondContact O-N 3.17Å; G465-V469 VanDerWaalsContact O-N 3.11Å
466	K	94.3	Very high	90.9	Very high	1 Å²	1	30.6 Å²	30.6	0%	0.004	17%	0.165	C	C	.	.	H	α-helix	trans	-61.6	-33.2	174.3	-67.3	-173.4	-172.7	-174.4	0	113.1	C439 N440 G464 L470 Y559 F589 T591 E596	C439-K466 WeakPolarHBondContact O-CE 3.42Å; N440-K466 PolarHBondContact OD1-NZ 3.45Å; G464-K466 VanDerWaalsContact C-N 3.26Å; G464-K466 PolarHBondContact O-N 3.41Å; K466-L470 VanDerWaalsContact O-CB 3.31Å; K466-L470 WeakPolarHBondContact O-CB 3.44Å; K466-L470 PolarHBondContact O-N 2.88Å; K466-Y559 HydrophobicContact CB-CE1 4.23Å; K466-Y559 HydrophobicContact CB-CE2 3.75Å; K466-Y559 WeakPolarHBondContact CB-OH 3.49Å; K466-Y559 HydrophobicContact CD-CD1 4.01Å; K466-Y559 HydrophobicContact CD-CE1 3.64Å; K466-Y559 HydrophobicContact CD-CE2 4.41Å; K466-Y559 PolarHBondContact NZ-O 3.49Å; K466-F589 HydrophobicContact CB-CD2 3.99Å; K466-F589 HydrophobicContact CB-CE2 4.49Å; K466-F589 HydrophobicContact CD-CB 4.2Å; K466-F589 HydrophobicContact CD-CD2 4.36Å; K466-F589 HydrophobicContact CG-CB 4.34Å; K466-F589 HydrophobicContact CG-CD2 4.2Å; K466-F589 WeakPolarHBondContact O-CE2 3.46Å; K466-T591 WeakPolarHBondContact CE-OG1 3.35Å; K466-E596 WeakPolarHBondContact CE-OE2 3.32Å; K466-E596 IonicContact NZ-OE1 2.66Å; K466-E596 PolarHBondContact NZ-OE1 3.3Å; K466-E596 IonicContact NZ-OE2 2.92Å; K466-E596 PolarHBondContact NZ-OE2 3.42Å
467	M	94.5	Very high	91.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-73.5	-37.9	175.8	-67	-61.4	-69.1	0	0	111.7	G464 G465 V469 L470 D471 M493 L497 Y500 Y559	G464-M467 WeakPolarHBondContact O-CA 3.4Å; G464-M467 WeakPolarHBondContact O-CB 3.5Å; G464-M467 PolarHBondContact O-N 3.03Å; G465-M467 VanDerWaalsContact C-N 3.29Å; G465-M467 PolarHBondContact O-N 3.33Å; M467-V469 VanDerWaalsContact C-N 3.35Å; M467-V469 PolarHBondContact O-N 3.32Å; M467-L470 HydrophobicContact CE-CD2 4.49Å; M467-L470 PolarHBondContact O-N 2.99Å; M467-L470 HydrophobicContact SD-CD2 4.12Å; M467-D471 WeakPolarHBondContact O-CB 3.37Å; M467-D471 PolarHBondContact O-N 2.84Å; M467-M493 HydrophobicContact SD-CE 3.89Å; M467-L497 HydrophobicContact CE-CD2 4.07Å; M467-L497 HydrophobicContact SD-CD2 3.69Å; M467-Y500 HydrophobicContact CE-CD1 4.06Å; M467-Y500 HydrophobicContact CE-CD2 3.7Å; M467-Y500 HydrophobicContact CE-CE2 4.32Å; M467-Y500 HydrophobicContact CE-CG 3.56Å; M467-Y559 HydrophobicContact SD-CE2 3.99Å
468	V	92.3	Very high	91.9	Very high	28 Å²	28	29.2 Å²	29.2	17%	0.17	15%	0.15	C	C	.	.	H	α-helix	trans	-58.3	-47.6	172.8	-179.6	0	0	0	0	110.7	V461 G464 G465 L470 D471 K472 I651	V461-V468 HydrophobicContact CG1-CB 4.46Å; V461-V468 HydrophobicContact CG1-CG2 4.1Å; V461-V468 WeakPolarHBondContact O-CG2 3.26Å; G464-V468 PolarHBondContact O-N 3.41Å; G464-V468 VanDerWaalsContact O-N 3.08Å; G465-V468 PolarHBondContact O-N 3.15Å; V468-L470 PolarHBondContact O-N 3.04Å; V468-D471 PolarHBondContact O-N 2.84Å; V468-K472 PolarHBondContact O-N 2.92Å; V468-I651 HydrophobicContact CG1-CG2 4.33Å; V468-I651 HydrophobicContact CG2-CD1 4.35Å
469	V	92.3	Very high	92.2	Very high	12 Å²	12	31.9 Å²	31.9	7%	0.073	16%	0.16	C	C	.	.	H	α-helix	trans	-63.6	-40.4	176.1	172	0	0	0	0	111.6	I394 V396 G465 M467 K472 L473 F589 I656	I394-V469 HydrophobicContact CG2-CG1 3.78Å; V396-V469 HydrophobicContact CG1-CG2 3.84Å; V396-V469 HydrophobicContact CG2-CG2 3.99Å; G465-V469 PolarHBondContact O-N 3.17Å; G465-V469 VanDerWaalsContact O-N 3.11Å; M467-V469 VanDerWaalsContact C-N 3.35Å; M467-V469 PolarHBondContact O-N 3.32Å; V469-K472 PolarHBondContact O-N 2.87Å; V469-L473 WeakPolarHBondContact O-CB 3.41Å; V469-L473 PolarHBondContact O-N 3.41Å; V469-F589 HydrophobicContact CG1-CE1 3.86Å; V469-F589 HydrophobicContact CG1-CZ 3.9Å; V469-I656 HydrophobicContact CG1-CD1 4.29Å
470	L	94.4	Very high	92.3	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-64.4	-39.4	177.4	-170.8	65.4	0	0	0	112.5	K466 M467 V468 L473 L474 I486 L497 Y500 I557 F589	K466-L470 VanDerWaalsContact O-CB 3.31Å; K466-L470 WeakPolarHBondContact O-CB 3.44Å; K466-L470 PolarHBondContact O-N 2.88Å; M467-L470 HydrophobicContact CE-CD2 4.49Å; M467-L470 PolarHBondContact O-N 2.99Å; M467-L470 HydrophobicContact SD-CD2 4.12Å; V468-L470 PolarHBondContact O-N 3.04Å; L470-L473 PolarHBondContact O-N 2.88Å; L470-L474 HydrophobicContact CD1-CD1 3.87Å; L470-L474 HydrophobicContact CD1-CD2 4.29Å; L470-L474 HydrophobicContact CD1-CG 3.83Å; L470-L474 HydrophobicContact CD2-CD1 4.25Å; L470-L474 HydrophobicContact CG-CD1 3.69Å; L470-L474 HydrophobicContact CG-CG 4.06Å; L470-L474 WeakPolarHBondContact O-CB 3.49Å; L470-L474 WeakPolarHBondContact O-CG 3.47Å; L470-L474 PolarHBondContact O-N 3.07Å; L470-I486 HydrophobicContact CD1-CD1 4.32Å; L470-I486 HydrophobicContact CD2-CD1 4.5Å; L470-L497 HydrophobicContact CD2-CD2 3.41Å; L470-L497 VanDerWaalsContact CD2-CD2 3.41Å; L470-Y500 HydrophobicContact CD2-CE1 4.46Å; L470-I557 HydrophobicContact CD1-CD1 3.59Å; L470-F589 HydrophobicContact CB-CE2 4.09Å; L470-F589 HydrophobicContact CB-CZ 4.28Å; L470-F589 HydrophobicContact CD1-CE2 4.2Å; L470-F589 HydrophobicContact CD1-CZ 4.09Å
471	D	93.8	Very high	92.4	Very high	26 Å²	26	36 Å²	36	14%	0.139	19%	0.193	C	C	.	.	H	α-helix	trans	-73.2	-30.7	178.8	-162.4	23.3	0	0	0	112.5	V461 M467 V468 P475 Y500 K504	V461-D471 HydrophobicContact CG1-CB 3.91Å; V461-D471 HydrophobicContact CG2-CB 4.33Å; M467-D471 WeakPolarHBondContact O-CB 3.37Å; M467-D471 PolarHBondContact O-N 2.84Å; V468-D471 PolarHBondContact O-N 2.84Å; D471-P475 WeakPolarHBondContact O-CD 3.37Å; D471-P475 VanDerWaalsContact O-CG 3.26Å; D471-P475 WeakPolarHBondContact O-CG 3.35Å; D471-Y500 WeakPolarHBondContact CA-OH 3.26Å; D471-Y500 HydrophobicContact CB-CE2 4.27Å; D471-Y500 PolarHBondContact OD1-OH 2.85Å; D471-Y500 VanDerWaalsContact OD1-OH 3.06Å; D471-K504 VanDerWaalsContact OD1-CE 3.3Å; D471-K504 WeakPolarHBondContact OD1-CE 3.47Å; D471-K504 IonicContact OD1-NZ 3.26Å; D471-K504 PolarHBondContact OD1-NZ 2.89Å; D471-K504 IonicContact OD2-NZ 3.9Å; D471-K504 PolarHBondContact OD2-NZ 3.23Å
472	K	91.8	Very high	92.6	Very high	59 Å²	59	36 Å²	36	26%	0.257	19%	0.194	S	C	.	.	H	α-helix	trans	-71.7	-34.1	166.8	-67	-164.2	-177.5	-167	0	112.6	V468 V469 D653 D654 I656	V468-K472 PolarHBondContact O-N 2.92Å; V469-K472 PolarHBondContact O-N 2.87Å; K472-D653 WeakPolarHBondContact CE-OD1 3.47Å; K472-D653 PolarHBondContact NZ-O 3.37Å; K472-D653 VanDerWaalsContact NZ-O 3.12Å; K472-D653 IonicContact NZ-OD1 3.89Å; K472-D653 PolarHBondContact NZ-OD1 2.68Å; K472-D654 PolarHBondContact NZ-O 2.75Å; K472-I656 HydrophobicContact CB-CB 4.16Å; K472-I656 HydrophobicContact CB-CD1 4.38Å; K472-I656 HydrophobicContact CB-CG1 4.45Å
473	L	92.8	Very high	92.8	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-82	-42.9	-173.6	-175.7	63.1	0	0	0	114	I394 V469 L470 K476 M477 I557 Y587 F589 I656	I394-L473 HydrophobicContact CD1-CD2 4.34Å; V469-L473 WeakPolarHBondContact O-CB 3.41Å; V469-L473 PolarHBondContact O-N 3.41Å; L470-L473 PolarHBondContact O-N 2.88Å; L473-K476 PolarHBondContact O-N 3.01Å; L473-M477 HydrophobicContact CD1-CE 4.01Å; L473-M477 HydrophobicContact CD1-CG 4.38Å; L473-M477 HydrophobicContact CG-CG 4.33Å; L473-M477 WeakPolarHBondContact O-CG 3.21Å; L473-M477 PolarHBondContact O-N 2.86Å; L473-M477 VanDerWaalsContact O-N 3.15Å; L473-I557 HydrophobicContact CD2-CD1 3.99Å; L473-Y587 HydrophobicContact CD1-CE2 4.39Å; L473-Y587 HydrophobicContact CD2-CD2 3.99Å; L473-Y587 HydrophobicContact CD2-CE2 4.4Å; L473-Y587 HydrophobicContact CD2-CG 4.17Å; L473-F589 HydrophobicContact CD2-CE1 4.25Å; L473-F589 HydrophobicContact CD2-CZ 4.37Å; L473-I656 HydrophobicContact CB-CD1 4.21Å; L473-I656 HydrophobicContact CB-CG1 4.38Å; L473-I656 HydrophobicContact CD1-CD1 4.38Å; L473-I656 HydrophobicContact CD1-CG1 4.1Å
474	L	94.9	Very high	93.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-62.8	-43.4	-173.6	-75.6	174.8	0	0	0	114.6	L470 K476 M477 K478 V484 Y500 Y506 F535 I536 I557	L470-L474 HydrophobicContact CD1-CD1 3.87Å; L470-L474 HydrophobicContact CD1-CD2 4.29Å; L470-L474 HydrophobicContact CD1-CG 3.83Å; L470-L474 HydrophobicContact CD2-CD1 4.25Å; L470-L474 HydrophobicContact CG-CD1 3.69Å; L470-L474 HydrophobicContact CG-CG 4.06Å; L470-L474 WeakPolarHBondContact O-CB 3.49Å; L470-L474 WeakPolarHBondContact O-CG 3.47Å; L470-L474 PolarHBondContact O-N 3.07Å; L474-K476 VanDerWaalsContact C-N 3.33Å; L474-K476 PolarHBondContact O-N 3.19Å; L474-M477 PolarHBondContact O-N 3.15Å; L474-K478 PolarHBondContact O-N 3.22Å; L474-V484 HydrophobicContact CD2-CB 4.36Å; L474-V484 HydrophobicContact CD2-CG1 4.05Å; L474-V484 HydrophobicContact CD2-CG2 4.08Å; L474-Y500 HydrophobicContact CD1-CE1 3.78Å; L474-Y506 HydrophobicContact CB-CE2 4.37Å; L474-Y506 HydrophobicContact CD1-CE2 4.2Å; L474-F535 HydrophobicContact CB-CE1 4.37Å; L474-F535 HydrophobicContact CD2-CE1 4.1Å; L474-F535 HydrophobicContact CD2-CZ 4.11Å; L474-F535 WeakPolarHBondContact O-CZ 3.24Å; L474-I536 HydrophobicContact CD1-CD1 3.99Å; L474-I536 HydrophobicContact CD2-CD1 4.25Å; L474-I557 HydrophobicContact CD2-CD1 4.33Å
475	P	93.5	Very high	93.4	Very high	45 Å²	45	33.2 Å²	33.2	29%	0.292	17%	0.172	S	C	.	.	H	α-helix	trans	-56.4	-47.1	175.6	-24.5	34.2	0	0	0	111.7	D471 M477 K478 E479	D471-P475 WeakPolarHBondContact O-CD 3.37Å; D471-P475 VanDerWaalsContact O-CG 3.26Å; D471-P475 WeakPolarHBondContact O-CG 3.35Å; P475-M477 VanDerWaalsContact C-N 3.28Å; P475-M477 PolarHBondContact O-N 3.44Å; P475-K478 WeakPolarHBondContact O-CA 3.15Å; P475-K478 WeakPolarHBondContact O-CB 3.19Å; P475-K478 PolarHBondContact O-N 3.15Å; P475-E479 WeakPolarHBondContact O-CG 3.48Å; P475-E479 PolarHBondContact O-N 2.92Å
476	K	92.4	Very high	93.7	Very high	60 Å²	60	33.2 Å²	33.2	26%	0.261	17%	0.172	S	C	.	.	H	α-helix	trans	-64	-29.1	179.5	-173.1	165	-166.9	-179.2	0	113.4	L473 L474 Q480 I656 D657	L473-K476 PolarHBondContact O-N 3.01Å; L474-K476 VanDerWaalsContact C-N 3.33Å; L474-K476 PolarHBondContact O-N 3.19Å; K476-Q480 WeakPolarHBondContact O-CG 3.12Å; K476-Q480 PolarHBondContact O-N 3.49Å; K476-Q480 PolarHBondContact O-NE2 3.08Å; K476-I656 HydrophobicContact CD-CG2 4.1Å; K476-D657 IonicContact NZ-OD1 3.3Å; K476-D657 PolarHBondContact NZ-OD1 2.91Å; K476-D657 IonicContact NZ-OD2 3.38Å; K476-D657 PolarHBondContact NZ-OD2 3.08Å
477	M	93.7	Very high	93.7	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.01	17%	0.172	C	C	.	.	H	α-helix	trans	-75.8	-35.1	171.4	-63	-58.9	99	0	0	112.1	L473 L474 P475 Q480 G481 S482 V484 F535 V555 Y587	L473-M477 HydrophobicContact CD1-CE 4.01Å; L473-M477 HydrophobicContact CD1-CG 4.38Å; L473-M477 HydrophobicContact CG-CG 4.33Å; L473-M477 WeakPolarHBondContact O-CG 3.21Å; L473-M477 PolarHBondContact O-N 2.86Å; L473-M477 VanDerWaalsContact O-N 3.15Å; L474-M477 PolarHBondContact O-N 3.15Å; P475-M477 VanDerWaalsContact C-N 3.28Å; P475-M477 PolarHBondContact O-N 3.44Å; M477-Q480 PolarHBondContact O-N 2.98Å; M477-G481 PolarHBondContact O-N 3.16Å; M477-S482 WeakPolarHBondContact O-CB 3.33Å; M477-S482 PolarHBondContact O-N 3.39Å; M477-V484 HydrophobicContact CB-CG2 4.06Å; M477-V484 HydrophobicContact CG-CG2 4.48Å; M477-F535 HydrophobicContact CB-CE2 4.47Å; M477-F535 HydrophobicContact CB-CZ 4.33Å; M477-V555 HydrophobicContact CG-CG1 4.44Å; M477-V555 HydrophobicContact CG-CG2 4.48Å; M477-V555 HydrophobicContact SD-CG1 4.27Å; M477-V555 HydrophobicContact SD-CG2 3.73Å; M477-Y587 HydrophobicContact SD-CE2 4.04Å
478	K	92.6	Very high	93.7	Very high	108 Å²	108	33.1 Å²	33.1	47%	0.47	17%	0.172	S	C	.	.	H	α-helix	trans	-67.5	-42.2	176.6	-166.9	173.1	177.2	-174.9	0	111.6	L474 P475 Q480 G481 Y506 F535	L474-K478 PolarHBondContact O-N 3.22Å; P475-K478 WeakPolarHBondContact O-CA 3.15Å; P475-K478 WeakPolarHBondContact O-CB 3.19Å; P475-K478 PolarHBondContact O-N 3.15Å; K478-Q480 VanDerWaalsContact C-N 3.31Å; K478-Q480 PolarHBondContact O-N 2.79Å; K478-G481 PolarHBondContact O-N 3.38Å; K478-Y506 HydrophobicContact CD-CD1 4.12Å; K478-Y506 HydrophobicContact CD-CE1 3.76Å; K478-F535 HydrophobicContact CB-CD2 4.46Å; K478-F535 HydrophobicContact CB-CE1 4.11Å; K478-F535 HydrophobicContact CB-CE2 3.83Å; K478-F535 HydrophobicContact CB-CZ 3.65Å; K478-F535 HydrophobicContact CD-CD1 4.36Å; K478-F535 HydrophobicContact CD-CE1 4.35Å; K478-F535 HydrophobicContact CG-CD2 4.42Å; K478-F535 HydrophobicContact CG-CE1 4.47Å; K478-F535 HydrophobicContact CG-CE2 4.27Å; K478-F535 HydrophobicContact CG-CZ 4.32Å
479	E	93.1	Very high	93.6	Very high	159 Å²	159	33.8 Å²	33.8	74%	0.743	17%	0.173	S	C	*	.	H	α-helix	trans	-61	-36.4	173.6	-71.8	168.3	-178.3	0	0	112.7	P475 G481	P475-E479 WeakPolarHBondContact O-CG 3.48Å; P475-E479 PolarHBondContact O-N 2.92Å; E479-G481 PolarHBondContact O-N 2.93Å
480	Q	91.2	Very high	93.3	Very high	79 Å²	79	34.5 Å²	34.5	37%	0.369	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	0.2	174.3	-75.4	172.2	61	0	0	113.8	K476 M477 K478 S482	K476-Q480 WeakPolarHBondContact O-CG 3.12Å; K476-Q480 PolarHBondContact O-N 3.49Å; K476-Q480 PolarHBondContact O-NE2 3.08Å; M477-Q480 PolarHBondContact O-N 2.98Å; K478-Q480 VanDerWaalsContact C-N 3.31Å; K478-Q480 PolarHBondContact O-N 2.79Å; Q480-S482 PolarHBondContact O-N 3.04Å
481	G	91.8	Very high	92.9	Very high	54 Å²	54	37.2 Å²	37.2	56%	0.557	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.8	29.2	-174.8	0	0	0	0	0	112.8	M477 K478 E479 K582	M477-G481 PolarHBondContact O-N 3.16Å; K478-G481 PolarHBondContact O-N 3.38Å; E479-G481 PolarHBondContact O-N 2.93Å; G481-K582 PolarHBondContact O-NZ 3.45Å
482	S	94	Very high	92.7	Very high	7 Å²	7	41.1 Å²	41.1	5%	0.049	21%	0.205	C	C	.	.			trans	-85.1	154.7	174.8	-72.4	0	0	0	0	111.2	M477 Q480 F535 D554	M477-S482 WeakPolarHBondContact O-CB 3.33Å; M477-S482 PolarHBondContact O-N 3.39Å; Q480-S482 PolarHBondContact O-N 3.04Å; S482-F535 WeakPolarHBondContact O-CD2 3.27Å; S482-F535 VanDerWaalsContact O-CE2 3.26Å; S482-F535 WeakPolarHBondContact O-CE2 3.3Å; S482-D554 VanDerWaalsContact CA-OD1 3.26Å; S482-D554 WeakPolarHBondContact CA-OD1 3.26Å; S482-D554 WeakPolarHBondContact CB-OD1 3.27Å; S482-D554 VanDerWaalsContact CB-OD2 3.24Å; S482-D554 WeakPolarHBondContact CB-OD2 3.32Å; S482-D554 PolarHBondContact OG-OD2 3.15Å
483	R	94.8	Very high	92.7	Very high	56 Å²	56	38.3 Å²	38.3	21%	0.211	19%	0.193	C	C	.	.			trans	-114.2	135	174	-90	-166.9	-63.5	-154.7	-11	110	Y527 K534 T552 A553 D554 V555	R483-Y527 PolarHBondContact NH1-O 3.24Å; R483-K534 WeakPolarHBondContact CD-O 3.41Å; R483-T552 PolarHBondContact NE-O 3.43Å; R483-T552 PolarHBondContact NH2-O 3.43Å; R483-T552 VanDerWaalsContact NH2-O 3.11Å; R483-A553 HydrophobicContact CB-CB 4.27Å; R483-D554 PolarHBondContact N-OD1 3.2Å; R483-D554 PolarHBondContact O-N 2.9Å; R483-V555 PolarHBondContact O-N 3.23Å
484	V	96.4	Very high	92.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	123.6	-164	-174.6	0	0	0	0	111.2	L474 M477 I486 Y527 F535 I536 F537 V555 I557	L474-V484 HydrophobicContact CD2-CB 4.36Å; L474-V484 HydrophobicContact CD2-CG1 4.05Å; L474-V484 HydrophobicContact CD2-CG2 4.08Å; M477-V484 HydrophobicContact CB-CG2 4.06Å; M477-V484 HydrophobicContact CG-CG2 4.48Å; V484-I486 HydrophobicContact CG1-CG1 3.91Å; V484-Y527 PolarHBondContact N-OH 3.47Å; V484-Y527 PolarHBondContact O-OH 2.79Å; V484-F535 HydrophobicContact CG2-CE2 3.76Å; V484-F535 HydrophobicContact CG2-CZ 3.88Å; V484-F535 PolarHBondContact N-O 3.27Å; V484-I536 CarbonylContact O-C 3.6Å; V484-I536 WeakPolarHBondContact O-CA 3.46Å; V484-F537 PolarHBondContact O-N 3.34Å; V484-V555 WeakPolarHBondContact CA-O 3.3Å; V484-V555 HydrophobicContact CG1-CG1 4.22Å; V484-V555 HydrophobicContact CG2-CB 4.15Å; V484-V555 HydrophobicContact CG2-CG1 4.25Å; V484-I557 HydrophobicContact CG1-CD1 3.67Å; V484-I557 HydrophobicContact CG1-CG1 3.92Å
485	L	96.5	Very high	92.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	131.5	162.5	-51.2	-171.9	0	0	0	108.9	F487 Y527 F537 L539 L550 A553 V555 V556 I557 R574 A575	L485-F487 HydrophobicContact CB-CD2 4.33Å; L485-F487 HydrophobicContact CB-CE2 3.78Å; L485-F487 HydrophobicContact CB-CZ 4.46Å; L485-F487 HydrophobicContact CD1-CE2 4.01Å; L485-F487 HydrophobicContact CD1-CZ 4.14Å; L485-Y527 HydrophobicContact CD2-CE1 4.05Å; L485-F537 WeakPolarHBondContact CA-O 3.39Å; L485-F537 HydrophobicContact CD2-CB 3.65Å; L485-L539 HydrophobicContact CB-CD1 4.38Å; L485-L539 HydrophobicContact CD1-CD1 4.43Å; L485-L539 HydrophobicContact CD2-CD1 4.37Å; L485-L550 HydrophobicContact CD1-CB 3.98Å; L485-L550 HydrophobicContact CD1-CD1 3.98Å; L485-L550 HydrophobicContact CD2-CB 4.24Å; L485-L550 HydrophobicContact CD2-CD1 3.89Å; L485-A553 HydrophobicContact CD1-CB 4.19Å; L485-A553 HydrophobicContact CD2-CB 3.51Å; L485-A553 HydrophobicContact CG-CB 3.55Å; L485-V555 PolarHBondContact N-O 3.45Å; L485-V556 HydrophobicContact CB-CG2 4.42Å; L485-V556 HydrophobicContact CD1-CG2 4.3Å; L485-I557 PolarHBondContact O-N 3.48Å; L485-R574 HydrophobicContact CD1-CB 4.35Å; L485-A575 HydrophobicContact CD1-CB 4.04Å
486	I	96.6	Very high	92.5	Very high	1 Å²	1	40 Å²	40	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	116	172.5	-53	179.5	0	0	0	108.4	L470 V484 L497 I536 F537 L539 I557	L470-I486 HydrophobicContact CD1-CD1 4.32Å; L470-I486 HydrophobicContact CD2-CD1 4.5Å; V484-I486 HydrophobicContact CG1-CG1 3.91Å; I486-L497 HydrophobicContact CG2-CD1 3.98Å; I486-I536 HydrophobicContact CD1-CG2 3.79Å; I486-I536 HydrophobicContact CG1-CG2 4.11Å; I486-F537 PolarHBondContact N-O 3.5Å; I486-L539 PolarHBondContact O-N 3.21Å; I486-I557 HydrophobicContact CG1-CB 4.41Å; I486-I557 HydrophobicContact CG1-CD1 4.48Å
487	F	95.2	Very high	92.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	135.9	175.5	-65.9	-88.6	0	0	0	111.3	L485 L539 V556 I557 L558 Y559 A571 R574	L485-F487 HydrophobicContact CB-CD2 4.33Å; L485-F487 HydrophobicContact CB-CE2 3.78Å; L485-F487 HydrophobicContact CB-CZ 4.46Å; L485-F487 HydrophobicContact CD1-CE2 4.01Å; L485-F487 HydrophobicContact CD1-CZ 4.14Å; F487-L539 VanDerWaalsContact CA-O 3.31Å; F487-L539 WeakPolarHBondContact CA-O 3.21Å; F487-L539 HydrophobicContact CD1-CB 3.53Å; F487-L539 HydrophobicContact CD1-CD1 4.26Å; F487-L539 HydrophobicContact CE1-CB 3.62Å; F487-L539 HydrophobicContact CE1-CD1 3.59Å; F487-L539 HydrophobicContact CE1-CG 4.15Å; F487-L539 HydrophobicContact CE2-CD1 4.29Å; F487-L539 HydrophobicContact CG-CB 4.31Å; F487-L539 HydrophobicContact CZ-CB 4.44Å; F487-L539 HydrophobicContact CZ-CD1 3.61Å; F487-V556 HydrophobicContact CD2-CG1 3.75Å; F487-V556 HydrophobicContact CE2-CG1 3.71Å; F487-I557 PolarHBondContact N-O 3.25Å; F487-L558 HydrophobicContact CB-CD2 3.87Å; F487-L558 HydrophobicContact CD2-CD2 3.92Å; F487-L558 HydrophobicContact CG-CD2 4.18Å; F487-Y559 WeakPolarHBondContact O-CB 3.44Å; F487-Y559 PolarHBondContact O-N 2.81Å; F487-A571 HydrophobicContact CD1-CB 3.9Å; F487-A571 HydrophobicContact CD2-CB 4.3Å; F487-A571 HydrophobicContact CE1-CB 3.72Å; F487-A571 HydrophobicContact CE2-CB 4.15Å; F487-A571 HydrophobicContact CG-CB 4.17Å; F487-A571 HydrophobicContact CZ-CB 3.86Å; F487-A571 WeakPolarHBondContact CZ-O 3.18Å; F487-R574 HydrophobicContact CZ-CB 4.37Å; F487-R574 HydrophobicContact CZ-CG 4.15Å
488	S	93.5	Very high	92.6	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	150.6	166.4	-178.9	0	0	0	0	112.2	M490 L539 S540 T541 D560	S488-M490 VanDerWaalsContact C-N 3.32Å; S488-M490 PolarHBondContact OG-N 2.98Å; S488-L539 PolarHBondContact N-O 3.48Å; S488-L539 VanDerWaalsContact N-O 3.14Å; S488-S540 CarbonylContact O-C 3.51Å; S488-S540 VanDerWaalsContact O-CA 3.27Å; S488-S540 WeakPolarHBondContact O-CA 3.47Å; S488-T541 PolarHBondContact O-N 2.95Å; S488-T541 PolarHBondContact O-OG1 3.33Å; S488-D560 WeakPolarHBondContact CA-OD1 3.29Å; S488-D560 WeakPolarHBondContact CB-OD1 3.48Å; S488-D560 PolarHBondContact OG-OD1 3.19Å
489	Q	89.6	Confident	92.6	Very high	42 Å²	42	37.4 Å²	37.4	20%	0.196	19%	0.192	C	C	.	.	S	Bend	trans	-74.7	-22.3	174	-65.9	-71.1	-14.5	0	0	112.9	T541 D560 D562	Q489-T541 PolarHBondContact N-OG1 3.37Å; Q489-D560 PolarHBondContact N-OD1 2.96Å; Q489-D562 VanDerWaalsContact NE2-CG 3.34Å; Q489-D562 PolarHBondContact NE2-OD2 2.88Å; Q489-D562 PolarHBondContact OE1-OD2 2.94Å
490	M	86	Confident	92.6	Very high	26 Å²	26	29.9 Å²	29.9	13%	0.128	16%	0.157	C	C	.	.			trans	-107.8	114.8	-172.1	-57.5	-167.9	-171.4	0	0	111.2	M433 R436 K437 N440 L444 S488 R492 M493 L494	M433-M490 HydrophobicContact SD-CE 4.36Å; R436-M490 HydrophobicContact CB-CE 3.97Å; K437-M490 HydrophobicContact CG-CE 4Å; K437-M490 HydrophobicContact CG-SD 3.78Å; N440-M490 PolarHBondContact ND2-SD 2.78Å; L444-M490 HydrophobicContact CD1-SD 3.91Å; S488-M490 VanDerWaalsContact C-N 3.32Å; S488-M490 PolarHBondContact OG-N 2.98Å; M490-R492 VanDerWaalsContact C-N 3.28Å; M490-R492 PolarHBondContact O-N 3.08Å; M490-M493 HydrophobicContact CB-CB 4Å; M490-M493 WeakPolarHBondContact O-CA 3.5Å; M490-M493 VanDerWaalsContact O-CB 3.29Å; M490-M493 WeakPolarHBondContact O-CB 3.47Å; M490-M493 PolarHBondContact O-N 3.49Å; M490-L494 PolarHBondContact O-N 2.95Å
491	T	87.6	Confident	92.8	Very high	57 Å²	57	26.1 Å²	26.1	35%	0.35	14%	0.14	S	C	.	.	H	α-helix	trans	-62.2	-34.5	177.3	56.7	0	0	0	0	112.7	M493 L494 D495 D512	T491-M493 PolarHBondContact O-N 3.02Å; T491-L494 WeakPolarHBondContact O-CA 3.42Å; T491-L494 WeakPolarHBondContact O-CB 3.35Å; T491-L494 PolarHBondContact O-N 2.96Å; T491-D495 PolarHBondContact O-N 2.87Å; T491-D512 HydrophobicContact CG2-CB 4.13Å
492	R	87.9	Confident	92.8	Very high	109 Å²	109	28.3 Å²	28.3	41%	0.411	14%	0.136	S	C	.	.	H	α-helix	trans	-61.8	-18.8	170.5	-83.2	-173.1	68	166.6	-1.4	114.2	Y443 L444 D446 M490 D495 I496	Y443-R492 PolarHBondContact O-NH2 3.38Å; L444-R492 HydrophobicContact CD2-CB 3.54Å; L444-R492 WeakPolarHBondContact CD2-O 3.15Å; D446-R492 IonicContact OD1-CZ 3.63Å; D446-R492 IonicContact OD1-NH1 2.64Å; D446-R492 PolarHBondContact OD1-NH1 2.97Å; D446-R492 IonicContact OD1-NH2 2.78Å; D446-R492 PolarHBondContact OD1-NH2 2.94Å; D446-R492 IonicContact OD2-NH1 3.59Å; M490-R492 VanDerWaalsContact C-N 3.28Å; M490-R492 PolarHBondContact O-N 3.08Å; R492-D495 WeakPolarHBondContact CA-OD2 3.19Å; R492-I496 WeakPolarHBondContact O-CG1 3.49Å
493	M	92.9	Very high	92.7	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-82	-32.5	171.4	-169.5	65.8	-130.9	0	0	111.2	N440 H441 L444 M467 M490 T491 D495 I496 L497 Y559	N440-M493 HydrophobicContact CB-SD 4.1Å; H441-M493 HydrophobicContact CB-CE 4.11Å; H441-M493 HydrophobicContact CB-SD 3.71Å; L444-M493 HydrophobicContact CD1-SD 4.34Å; M467-M493 HydrophobicContact SD-CE 3.89Å; M490-M493 HydrophobicContact CB-CB 4Å; M490-M493 WeakPolarHBondContact O-CA 3.5Å; M490-M493 VanDerWaalsContact O-CB 3.29Å; M490-M493 WeakPolarHBondContact O-CB 3.47Å; M490-M493 PolarHBondContact O-N 3.49Å; T491-M493 PolarHBondContact O-N 3.02Å; M493-D495 VanDerWaalsContact C-N 3.31Å; M493-I496 HydrophobicContact CE-CB 3.95Å; M493-I496 HydrophobicContact CE-CG2 3.59Å; M493-I496 PolarHBondContact O-N 3.37Å; M493-I496 HydrophobicContact SD-CD1 4.42Å; M493-L497 HydrophobicContact CE-CD2 4.28Å; M493-L497 HydrophobicContact CE-CG 3.94Å; M493-L497 HydrophobicContact CG-CD1 4.35Å; M493-L497 VanDerWaalsContact O-CG 3.29Å; M493-L497 WeakPolarHBondContact O-CG 3.45Å; M493-L497 PolarHBondContact O-N 2.97Å; M493-Y559 HydrophobicContact CE-CE1 3.86Å; M493-Y559 HydrophobicContact CE-CE2 4.21Å; M493-Y559 WeakPolarHBondContact CE-OH 3.38Å; M493-Y559 HydrophobicContact CG-CD1 3.91Å; M493-Y559 HydrophobicContact CG-CE1 3.71Å; M493-Y559 HydrophobicContact SD-CD1 4.45Å; M493-Y559 HydrophobicContact SD-CE1 3.65Å
494	L	92.7	Very high	92.6	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-65.3	-36.7	171.3	-52.8	-177.4	0	0	0	111.2	M490 T491 I496 L497 E498 D512 M538	M490-L494 PolarHBondContact O-N 2.95Å; T491-L494 WeakPolarHBondContact O-CA 3.42Å; T491-L494 WeakPolarHBondContact O-CB 3.35Å; T491-L494 PolarHBondContact O-N 2.96Å; L494-I496 PolarHBondContact O-N 2.81Å; L494-L497 HydrophobicContact CD2-CD1 4.25Å; L494-L497 PolarHBondContact O-N 3.25Å; L494-E498 VanDerWaalsContact O-CB 3.24Å; L494-E498 WeakPolarHBondContact O-CB 3.35Å; L494-E498 PolarHBondContact O-N 3.21Å; L494-D512 HydrophobicContact CD1-CB 4.38Å; L494-M538 HydrophobicContact CD2-CB 4.35Å
495	D	91.2	Very high	92.5	Very high	65 Å²	65	38.7 Å²	38.7	35%	0.348	19%	0.186	S	C	.	.	H	α-helix	trans	-56.8	-47.6	172.1	-54.1	-20.2	0	0	0	111.1	T491 R492 M493 E498 D499 R510	T491-D495 PolarHBondContact O-N 2.87Å; R492-D495 WeakPolarHBondContact CA-OD2 3.19Å; M493-D495 VanDerWaalsContact C-N 3.31Å; D495-E498 WeakPolarHBondContact O-CB 3.45Å; D495-E498 PolarHBondContact O-N 2.61Å; D495-D499 PolarHBondContact O-N 2.87Å; D495-D499 VanDerWaalsContact O-N 3.12Å; D495-R510 IonicContact OD1-CZ 2.65Å; D495-R510 VanDerWaalsContact OD1-CZ 3.22Å; D495-R510 IonicContact OD1-NH1 2.71Å; D495-R510 PolarHBondContact OD1-NH1 2.85Å; D495-R510 IonicContact OD1-NH2 3.6Å; D495-R510 PolarHBondContact OD1-NH2 2.66Å
496	I	92.6	Very high	92.4	Very high	16 Å²	16	39.6 Å²	39.6	8%	0.082	19%	0.19	C	C	.	.	H	α-helix	trans	-65.3	-39.4	178.1	-69.3	168.1	0	0	0	112.1	H441 L444 L460 R492 M493 L494 E498 Y500	H441-I496 HydrophobicContact CB-CD1 4.12Å; L444-I496 HydrophobicContact CD2-CD1 3.7Å; L444-I496 HydrophobicContact CG-CD1 4.02Å; L460-I496 HydrophobicContact CD1-CG2 4.06Å; R492-I496 WeakPolarHBondContact O-CG1 3.49Å; M493-I496 HydrophobicContact CE-CB 3.95Å; M493-I496 HydrophobicContact CE-CG2 3.59Å; M493-I496 PolarHBondContact O-N 3.37Å; M493-I496 HydrophobicContact SD-CD1 4.42Å; L494-I496 PolarHBondContact O-N 2.81Å; I496-E498 VanDerWaalsContact C-N 3.3Å; I496-Y500 WeakPolarHBondContact O-CB 3.45Å; I496-Y500 PolarHBondContact O-N 3.02Å; I496-Y500 VanDerWaalsContact O-N 3.15Å
497	L	94.7	Very high	92.4	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-68.6	-30	175.8	-71.7	166.2	0	0	0	112	M467 L470 I486 M493 L494 C501 M538 Y559	M467-L497 HydrophobicContact CE-CD2 4.07Å; M467-L497 HydrophobicContact SD-CD2 3.69Å; L470-L497 HydrophobicContact CD2-CD2 3.41Å; L470-L497 VanDerWaalsContact CD2-CD2 3.41Å; I486-L497 HydrophobicContact CG2-CD1 3.98Å; M493-L497 HydrophobicContact CE-CD2 4.28Å; M493-L497 HydrophobicContact CE-CG 3.94Å; M493-L497 HydrophobicContact CG-CD1 4.35Å; M493-L497 VanDerWaalsContact O-CG 3.29Å; M493-L497 WeakPolarHBondContact O-CG 3.45Å; M493-L497 PolarHBondContact O-N 2.97Å; L494-L497 HydrophobicContact CD2-CD1 4.25Å; L494-L497 PolarHBondContact O-N 3.25Å; L497-C501 WeakPolarHBondContact O-CB 3.44Å; L497-C501 PolarHBondContact O-N 2.89Å; L497-C501 PolarHBondContact O-SG 3.34Å; L497-M538 HydrophobicContact CB-SD 3.5Å; L497-M538 VanDerWaalsContact CB-SD 3.5Å; L497-Y559 HydrophobicContact CD2-CE2 4.37Å
498	E	93.9	Very high	92.4	Very high	40 Å²	40	46.2 Å²	46.2	19%	0.187	22%	0.219	C	C	.	.	H	α-helix	trans	-70.6	-46.5	177.5	-174.6	161.1	-159.2	0	0	111.7	L494 D495 I496 Y500 C501 M502 Y508 R510 M538	L494-E498 VanDerWaalsContact O-CB 3.24Å; L494-E498 WeakPolarHBondContact O-CB 3.35Å; L494-E498 PolarHBondContact O-N 3.21Å; D495-E498 WeakPolarHBondContact O-CB 3.45Å; D495-E498 PolarHBondContact O-N 2.61Å; I496-E498 VanDerWaalsContact C-N 3.3Å; E498-Y500 VanDerWaalsContact C-N 3.31Å; E498-Y500 PolarHBondContact O-N 2.76Å; E498-C501 PolarHBondContact O-N 3.45Å; E498-C501 VanDerWaalsContact O-N 3.16Å; E498-M502 HydrophobicContact CG-CE 3.91Å; E498-M502 PolarHBondContact O-N 3.29Å; E498-Y508 HydrophobicContact CG-CE1 4.37Å; E498-Y508 HydrophobicContact CG-CE2 3.8Å; E498-Y508 VanDerWaalsContact CG-OH 3.23Å; E498-Y508 WeakPolarHBondContact CG-OH 3.32Å; E498-Y508 WeakPolarHBondContact OE1-CE2 3.29Å; E498-Y508 VanDerWaalsContact OE1-CZ 3.27Å; E498-Y508 PolarHBondContact OE1-OH 3.21Å; E498-R510 WeakPolarHBondContact OE2-CD 3.48Å; E498-R510 IonicContact OE2-CZ 2.72Å; E498-R510 IonicContact OE2-NE 2.8Å; E498-R510 IonicContact OE2-NH1 2.76Å; E498-R510 PolarHBondContact OE2-NH1 3.1Å; E498-M538 HydrophobicContact CB-CE 3.88Å; E498-M538 HydrophobicContact CB-SD 4.47Å; E498-M538 HydrophobicContact CG-CE 4.25Å
499	D	92	Very high	92.4	Very high	73 Å²	73	46.7 Å²	46.7	39%	0.39	22%	0.222	S	C	.	.	H	α-helix	trans	-58.7	-41.5	171.5	-71	-30.6	0	0	0	111.7	T456 L460 D495 M502 W503	T456-D499 HydrophobicContact CG2-CB 4.01Å; L460-D499 HydrophobicContact CD2-CB 4.46Å; D495-D499 PolarHBondContact O-N 2.87Å; D495-D499 VanDerWaalsContact O-N 3.12Å; D499-M502 PolarHBondContact O-N 3.03Å; D499-W503 PolarHBondContact O-N 2.91Å
500	Y	94.5	Very high	92.5	Very high	1 Å²	1	47.1 Å²	47.1	0%	0.004	22%	0.222	C	C	.	.	H	α-helix	trans	-64	-41.1	173.6	163.9	-92.2	0	0	0	113	V461 M467 L470 D471 L474 I496 E498 W503 K504 Y506	V461-Y500 HydrophobicContact CG2-CD2 3.86Å; V461-Y500 HydrophobicContact CG2-CE2 3.76Å; M467-Y500 HydrophobicContact CE-CD1 4.06Å; M467-Y500 HydrophobicContact CE-CD2 3.7Å; M467-Y500 HydrophobicContact CE-CE2 4.32Å; M467-Y500 HydrophobicContact CE-CG 3.56Å; L470-Y500 HydrophobicContact CD2-CE1 4.46Å; D471-Y500 WeakPolarHBondContact CA-OH 3.26Å; D471-Y500 HydrophobicContact CB-CE2 4.27Å; D471-Y500 PolarHBondContact OD1-OH 2.85Å; D471-Y500 VanDerWaalsContact OD1-OH 3.06Å; L474-Y500 HydrophobicContact CD1-CE1 3.78Å; I496-Y500 WeakPolarHBondContact O-CB 3.45Å; I496-Y500 PolarHBondContact O-N 3.02Å; I496-Y500 VanDerWaalsContact O-N 3.15Å; E498-Y500 VanDerWaalsContact C-N 3.31Å; E498-Y500 PolarHBondContact O-N 2.76Å; Y500-W503 HydrophobicContact CD2-CE3 4.06Å; Y500-W503 HydrophobicContact CD2-CZ3 4.27Å; Y500-W503 HydrophobicContact CE2-CE3 4.45Å; Y500-W503 HydrophobicContact CE2-CZ3 4.38Å; Y500-W503 PolarHBondContact O-N 2.8Å; Y500-K504 HydrophobicContact CD2-CG 4.18Å; Y500-K504 HydrophobicContact CE2-CD 4.44Å; Y500-K504 HydrophobicContact CE2-CG 3.72Å; Y500-K504 WeakPolarHBondContact O-CB 3.41Å; Y500-K504 PolarHBondContact O-N 3.46Å; Y500-Y506 HydrophobicContact CE1-CD2 4.31Å; Y500-Y506 HydrophobicContact CE1-CE2 4.19Å
501	C	94.4	Very high	92.6	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.007	22%	0.216	C	C	.	.	H	α-helix	trans	-65.9	-38.2	177.2	-71.5	0	0	0	0	111.8	L497 E498 N505 Y506 Y508	L497-C501 WeakPolarHBondContact O-CB 3.44Å; L497-C501 PolarHBondContact O-N 2.89Å; L497-C501 PolarHBondContact O-SG 3.34Å; E498-C501 PolarHBondContact O-N 3.45Å; E498-C501 VanDerWaalsContact O-N 3.16Å; C501-N505 PolarHBondContact O-N 2.81Å; C501-N505 VanDerWaalsContact O-N 3.08Å; C501-Y506 PolarHBondContact O-N 3.25Å; C501-Y508 HydrophobicContact CB-CD1 3.71Å; C501-Y508 HydrophobicContact CB-CE1 4.21Å; C501-Y508 HydrophobicContact CB-CG 4.37Å
502	M	91.8	Very high	92.5	Very high	100 Å²	100	43.5 Å²	43.5	49%	0.493	20%	0.201	S	C	.	.	H	α-helix	trans	-61.9	-50.3	172	-74.8	-169.7	-102.9	0	0	111.4	E498 D499 K504 N505 Y508	E498-M502 HydrophobicContact CG-CE 3.91Å; E498-M502 PolarHBondContact O-N 3.29Å; D499-M502 PolarHBondContact O-N 3.03Å; M502-K504 VanDerWaalsContact C-N 3.33Å; M502-K504 PolarHBondContact O-N 3.08Å; M502-N505 PolarHBondContact O-N 3.08Å; M502-N505 VanDerWaalsContact O-N 3.08Å; M502-Y508 HydrophobicContact CG-CE1 4.36Å
503	W	92.6	Very high	91.8	Very high	79 Å²	79	41.4 Å²	41.4	30%	0.299	21%	0.214	S	C	.	.	H	α-helix	trans	-57.4	-42.5	178.6	174	55.3	0	0	0	113.2	T456 L458 V461 D499 Y500 N505	T456-W503 PolarHBondContact O-NE1 2.95Å; L458-W503 HydrophobicContact CB-CH2 4.34Å; L458-W503 HydrophobicContact CD1-CH2 4.29Å; V461-W503 HydrophobicContact CG2-CH2 4.48Å; V461-W503 HydrophobicContact CG2-CZ3 3.75Å; D499-W503 PolarHBondContact O-N 2.91Å; Y500-W503 HydrophobicContact CD2-CE3 4.06Å; Y500-W503 HydrophobicContact CD2-CZ3 4.27Å; Y500-W503 HydrophobicContact CE2-CE3 4.45Å; Y500-W503 HydrophobicContact CE2-CZ3 4.38Å; Y500-W503 PolarHBondContact O-N 2.8Å; W503-N505 VanDerWaalsContact C-N 3.3Å; W503-N505 PolarHBondContact O-N 2.87Å; W503-N505 PolarHBondContact O-ND2 2.87Å
504	K	91.9	Very high	90.9	Very high	64 Å²	64	48.6 Å²	48.6	28%	0.278	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	1.3	178.7	-68.4	-79.6	175.3	148.2	0	114.3	D471 Y500 M502 Y506	D471-K504 VanDerWaalsContact OD1-CE 3.3Å; D471-K504 WeakPolarHBondContact OD1-CE 3.47Å; D471-K504 IonicContact OD1-NZ 3.26Å; D471-K504 PolarHBondContact OD1-NZ 2.89Å; D471-K504 IonicContact OD2-NZ 3.9Å; D471-K504 PolarHBondContact OD2-NZ 3.23Å; Y500-K504 HydrophobicContact CD2-CG 4.18Å; Y500-K504 HydrophobicContact CE2-CD 4.44Å; Y500-K504 HydrophobicContact CE2-CG 3.72Å; Y500-K504 WeakPolarHBondContact O-CB 3.41Å; Y500-K504 PolarHBondContact O-N 3.46Å; M502-K504 VanDerWaalsContact C-N 3.33Å; M502-K504 PolarHBondContact O-N 3.08Å; K504-Y506 VanDerWaalsContact C-N 3.28Å; K504-Y506 HydrophobicContact CB-CD2 3.51Å; K504-Y506 HydrophobicContact CB-CE2 3.44Å; K504-Y506 VanDerWaalsContact CB-CE2 3.44Å; K504-Y506 HydrophobicContact CB-CG 4.32Å; K504-Y506 HydrophobicContact CG-CD2 4.45Å; K504-Y506 HydrophobicContact CG-CE2 4.04Å; K504-Y506 PolarHBondContact O-N 3.21Å
505	N	93.6	Very high	90.1	Very high	137 Å²	137	49.7 Å²	49.7	73%	0.733	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	44.5	-175.5	-62.9	-86.4	0	0	0	113	C501 M502 W503	C501-N505 PolarHBondContact O-N 2.81Å; C501-N505 VanDerWaalsContact O-N 3.08Å; M502-N505 PolarHBondContact O-N 3.08Å; M502-N505 VanDerWaalsContact O-N 3.08Å; W503-N505 VanDerWaalsContact C-N 3.3Å; W503-N505 PolarHBondContact O-N 2.87Å; W503-N505 PolarHBondContact O-ND2 2.87Å
506	Y	95.6	Very high	89.3	Confident	19 Å²	19	49.6 Å²	49.6	8%	0.075	26%	0.257	C	S	.	.			trans	-90	124.4	169.5	-67.6	-52.5	0	0	0	110.1	L474 K478 Y500 C501 K504 Y508 F535 I536	L474-Y506 HydrophobicContact CB-CE2 4.37Å; L474-Y506 HydrophobicContact CD1-CE2 4.2Å; K478-Y506 HydrophobicContact CD-CD1 4.12Å; K478-Y506 HydrophobicContact CD-CE1 3.76Å; Y500-Y506 HydrophobicContact CE1-CD2 4.31Å; Y500-Y506 HydrophobicContact CE1-CE2 4.19Å; C501-Y506 PolarHBondContact O-N 3.25Å; K504-Y506 VanDerWaalsContact C-N 3.28Å; K504-Y506 HydrophobicContact CB-CD2 3.51Å; K504-Y506 HydrophobicContact CB-CE2 3.44Å; K504-Y506 VanDerWaalsContact CB-CE2 3.44Å; K504-Y506 HydrophobicContact CB-CG 4.32Å; K504-Y506 HydrophobicContact CG-CD2 4.45Å; K504-Y506 HydrophobicContact CG-CE2 4.04Å; K504-Y506 PolarHBondContact O-N 3.21Å; Y506-Y508 WeakPolarHBondContact O-CD1 3.22Å; Y506-Y508 PolarHBondContact O-N 3.17Å; Y506-F535 AromaticContact CD1-CD1 3.6Å; Y506-F535 HydrophobicContact CD1-CD1 3.6Å; Y506-F535 AromaticContact CD1-CE1 3.81Å; Y506-F535 HydrophobicContact CD1-CE1 3.81Å; Y506-F535 HydrophobicContact CE1-CD1 4.12Å; Y506-F535 AromaticContact CE1-CE1 3.86Å; Y506-F535 HydrophobicContact CE1-CE1 3.86Å; Y506-F535 HydrophobicContact CG-CD1 4.12Å; Y506-F535 HydrophobicContact CG-CE1 4.38Å; Y506-I536 HydrophobicContact CD2-CD1 4.09Å; Y506-I536 HydrophobicContact CG-CD1 4.07Å
507	E	95.5	Very high	88.1	Confident	84 Å²	84	50.7 Å²	50.7	39%	0.393	26%	0.261	S	S	.	.			trans	-71.7	125.8	170.2	-74.7	-158.5	-117.2	0	0	111.3	T533 K534 F535 I536	E507-T533 WeakPolarHBondContact OE1-CB 3.37Å; E507-T533 PolarHBondContact OE1-OG1 2.79Å; E507-T533 PolarHBondContact OE2-OG1 2.8Å; E507-K534 HydrophobicContact CB-CD 4Å; E507-K534 IonicContact OE2-NZ 2.79Å; E507-K534 PolarHBondContact OE2-NZ 2.98Å; E507-F535 PolarHBondContact O-N 3.36Å; E507-I536 PolarHBondContact O-N 2.96Å
508	Y	95.6	Very high	87.2	Confident	57 Å²	57	58 Å²	58	22%	0.224	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	164.6	-175.8	68.2	-87.6	0	0	0	113.5	E498 C501 M502 Y506 R510 I536 M538	E498-Y508 HydrophobicContact CG-CE1 4.37Å; E498-Y508 HydrophobicContact CG-CE2 3.8Å; E498-Y508 VanDerWaalsContact CG-OH 3.23Å; E498-Y508 WeakPolarHBondContact CG-OH 3.32Å; E498-Y508 WeakPolarHBondContact OE1-CE2 3.29Å; E498-Y508 VanDerWaalsContact OE1-CZ 3.27Å; E498-Y508 PolarHBondContact OE1-OH 3.21Å; C501-Y508 HydrophobicContact CB-CD1 3.71Å; C501-Y508 HydrophobicContact CB-CE1 4.21Å; C501-Y508 HydrophobicContact CB-CG 4.37Å; M502-Y508 HydrophobicContact CG-CE1 4.36Å; Y506-Y508 WeakPolarHBondContact O-CD1 3.22Å; Y506-Y508 PolarHBondContact O-N 3.17Å; Y508-R510 HydrophobicContact CE2-CB 4.47Å; Y508-I536 CarbonylContact C-O 3.47Å; Y508-I536 WeakPolarHBondContact CA-O 3.35Å; Y508-M538 HydrophobicContact CD1-CE 4.43Å; Y508-M538 HydrophobicContact CD2-CE 3.26Å; Y508-M538 HydrophobicContact CE2-CE 3.73Å; Y508-M538 HydrophobicContact CG-CE 3.68Å
509	C	94.3	Very high	86.4	Confident	10 Å²	10	61.4 Å²	61.4	7%	0.068	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	150.8	158.9	-71	0	0	0	0	109.8	I536 F537 M538	C509-I536 PolarHBondContact N-O 2.89Å; C509-F537 HydrophobicContact CB-CD1 3.87Å; C509-F537 HydrophobicContact CB-CD2 3.85Å; C509-F537 HydrophobicContact CB-CE1 3.75Å; C509-F537 HydrophobicContact CB-CE2 3.73Å; C509-F537 HydrophobicContact CB-CG 3.91Å; C509-F537 HydrophobicContact CB-CZ 3.68Å; C509-F537 WeakPolarHBondContact O-CA 3.31Å; C509-F537 WeakPolarHBondContact O-CD2 3.32Å; C509-M538 PolarHBondContact O-N 3.42Å
510	R	92.1	Very high	85.8	Confident	50 Å²	50	59.6 Å²	59.6	19%	0.189	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	137.7	176.7	177.2	176.2	170	151.6	2.2	110.4	D495 E498 Y508 D512 M538	D495-R510 IonicContact OD1-CZ 2.65Å; D495-R510 VanDerWaalsContact OD1-CZ 3.22Å; D495-R510 IonicContact OD1-NH1 2.71Å; D495-R510 PolarHBondContact OD1-NH1 2.85Å; D495-R510 IonicContact OD1-NH2 3.6Å; D495-R510 PolarHBondContact OD1-NH2 2.66Å; E498-R510 WeakPolarHBondContact OE2-CD 3.48Å; E498-R510 IonicContact OE2-CZ 2.72Å; E498-R510 IonicContact OE2-NE 2.8Å; E498-R510 IonicContact OE2-NH1 2.76Å; E498-R510 PolarHBondContact OE2-NH1 3.1Å; Y508-R510 HydrophobicContact CE2-CB 4.47Å; R510-D512 IonicContact CZ-OD2 2.74Å; R510-D512 IonicContact NE-OD2 3.71Å; R510-D512 PolarHBondContact NE-OD2 3.47Å; R510-D512 IonicContact NH2-OD2 2.65Å; R510-D512 PolarHBondContact NH2-OD2 2.9Å; R510-M538 WeakPolarHBondContact CA-O 3.49Å
511	L	87.4	Confident	85	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	116.6	174.4	-177.7	178.5	0	0	0	109.8	R520 I524 F537 M538 L539 S540 A543 I548	L511-R520 HydrophobicContact CD1-CG 3.69Å; L511-R520 HydrophobicContact CG-CG 3.98Å; L511-I524 HydrophobicContact CD1-CD1 3.98Å; L511-I524 HydrophobicContact CD1-CG1 4.17Å; L511-F537 HydrophobicContact CB-CE2 3.6Å; L511-F537 HydrophobicContact CB-CZ 4.19Å; L511-F537 HydrophobicContact CD1-CE2 4.45Å; L511-F537 HydrophobicContact CD1-CZ 4.39Å; L511-M538 PolarHBondContact N-O 3.18Å; L511-L539 HydrophobicContact CB-CD2 3.9Å; L511-L539 HydrophobicContact CD1-CD2 3.99Å; L511-L539 HydrophobicContact CD2-CD2 4.27Å; L511-L539 HydrophobicContact CG-CD2 4.28Å; L511-L539 WeakPolarHBondContact O-CA 3.2Å; L511-S540 PolarHBondContact O-N 3.24Å; L511-S540 VanDerWaalsContact O-N 3.14Å; L511-A543 HydrophobicContact CD2-CB 3.53Å; L511-I548 HydrophobicContact CD1-CD1 4.12Å
512	D	85	Confident	84.6	Confident	8 Å²	8	66 Å²	66	4%	0.043	34%	0.335	C	S	.	.			trans	-131.5	-162.3	174.1	66.9	44.4	0	0	0	112	T491 L494 R510 Q514 T515 R520	T491-D512 HydrophobicContact CG2-CB 4.13Å; L494-D512 HydrophobicContact CD1-CB 4.38Å; R510-D512 IonicContact CZ-OD2 2.74Å; R510-D512 IonicContact NE-OD2 3.71Å; R510-D512 PolarHBondContact NE-OD2 3.47Å; R510-D512 IonicContact NH2-OD2 2.65Å; R510-D512 PolarHBondContact NH2-OD2 2.9Å; D512-Q514 VanDerWaalsContact C-N 3.34Å; D512-Q514 WeakPolarHBondContact OD1-CA 3.37Å; D512-Q514 WeakPolarHBondContact OD1-CB 3.49Å; D512-Q514 PolarHBondContact OD1-N 3.49Å; D512-T515 PolarHBondContact N-OG1 2.6Å; D512-T515 PolarHBondContact OD1-N 3.36Å; D512-R520 PolarHBondContact O-NH2 3.49Å
513	G	72.6	Confident	84.5	Confident	65 Å²	65	62.5 Å²	62.5	67%	0.67	32%	0.321	S	S	*	.	S	Bend	trans	-78.5	-13.4	-178	0	0	0	0	0	114.8
514	Q	75.3	Confident	84.2	Confident	151 Å²	151	59.5 Å²	59.5	71%	0.706	31%	0.31	S	S	*	.	S	Bend	trans	-99.2	-22.7	179.8	-57.7	-173.2	12.1	0	0	112.3	D512 P516	D512-Q514 VanDerWaalsContact C-N 3.34Å; D512-Q514 WeakPolarHBondContact OD1-CA 3.37Å; D512-Q514 WeakPolarHBondContact OD1-CB 3.49Å; D512-Q514 PolarHBondContact OD1-N 3.49Å; Q514-P516 WeakPolarHBondContact O-CD 3.41Å
515	T	75.2	Confident	84	Confident	23 Å²	23	60.7 Å²	60.7	14%	0.141	32%	0.32	C	S	.	.	S	Bend	trans	-51.6	122.4	177.1	-43.6	0	0	0	0	112	D512 E519 R520	D512-T515 PolarHBondContact N-OG1 2.6Å; D512-T515 PolarHBondContact OD1-N 3.36Å; T515-E519 HydrophobicContact CG2-CB 4.16Å; T515-R520 HydrophobicContact CG2-CB 4.33Å; T515-R520 PolarHBondContact O-NH2 3.1Å
516	P	74	Confident	83.9	Confident	63 Å²	63	55.5 Å²	55.5	41%	0.409	30%	0.296	S	S	.	.			trans	-52.3	155.5	172.6	-30.2	37.5	0	0	0	113.9	Q514 E518 E519 R520	Q514-P516 WeakPolarHBondContact O-CD 3.41Å; P516-E518 PolarHBondContact O-N 2.91Å; P516-E519 HydrophobicContact CB-CB 4.36Å; P516-E519 HydrophobicContact CB-CG 4.23Å; P516-E519 WeakPolarHBondContact CD-OE2 3.49Å; P516-E519 HydrophobicContact CG-CG 4.46Å; P516-R520 WeakPolarHBondContact O-CB 3.4Å; P516-R520 PolarHBondContact O-N 3.23Å
517	H	68.8	Low	83.8	Confident	38 Å²	38	54.6 Å²	54.6	18%	0.176	29%	0.292	C	S	.	.	H	α-helix	trans	-67.7	-36	-171.6	-161.4	-15	0	0	0	113.1	K220 Y224 Q521	K220-H517 PolarHBondContact O-NE2 2.83Å; K220-H517 VanDerWaalsContact O-NE2 3.15Å; Y224-H517 AromaticContact CD2-CE1 3.32Å; Y224-H517 WeakPolarHBondContact CD2-CE1 3.22Å; Y224-H517 AromaticContact CD2-NE2 3.57Å; Y224-H517 AromaticContact CE2-CD2 3.96Å; Y224-H517 AromaticContact CE2-CE1 3.52Å; Y224-H517 AromaticContact CE2-NE2 3.44Å; Y224-H517 WeakPolarHBondContact CE2-NE2 3.32Å; H517-Q521 PolarHBondContact O-N 3.22Å
518	E	74.4	Confident	83.6	Confident	154 Å²	154	52.7 Å²	52.7	72%	0.72	29%	0.285	S	S	*	.	H	α-helix	trans	-73.1	-51.9	-179.3	-68	161.6	-156.5	0	0	110.7	P516 R520 Q521 V522	P516-E518 PolarHBondContact O-N 2.91Å; E518-R520 PolarHBondContact O-N 2.82Å; E518-Q521 PolarHBondContact O-N 3.47Å; E518-V522 PolarHBondContact O-N 2.88Å
519	E	78.1	Confident	83.4	Confident	113 Å²	113	55.5 Å²	55.5	53%	0.528	30%	0.3	S	S	.	.	H	α-helix	trans	-53.3	-38.6	173.8	-68.4	176.6	-154.6	0	0	112.8	T515 P516 Q521 V522 S523	T515-E519 HydrophobicContact CG2-CB 4.16Å; P516-E519 HydrophobicContact CB-CB 4.36Å; P516-E519 HydrophobicContact CB-CG 4.23Å; P516-E519 WeakPolarHBondContact CD-OE2 3.49Å; P516-E519 HydrophobicContact CG-CG 4.46Å; E519-Q521 VanDerWaalsContact C-N 3.33Å; E519-Q521 PolarHBondContact O-N 3.03Å; E519-V522 PolarHBondContact O-N 2.78Å; E519-S523 WeakPolarHBondContact O-CB 3.44Å; E519-S523 PolarHBondContact O-N 3.49Å; E519-S523 PolarHBondContact O-OG 2.95Å
520	R	79.9	Confident	83.1	Confident	34 Å²	34	60.3 Å²	60.3	13%	0.128	33%	0.331	C	S	.	.	H	α-helix	trans	-58.3	-44.1	174	177.1	177.1	-64.4	141.5	3.7	111.8	L511 D512 T515 P516 E518 I524	L511-R520 HydrophobicContact CD1-CG 3.69Å; L511-R520 HydrophobicContact CG-CG 3.98Å; D512-R520 PolarHBondContact O-NH2 3.49Å; T515-R520 HydrophobicContact CG2-CB 4.33Å; T515-R520 PolarHBondContact O-NH2 3.1Å; P516-R520 WeakPolarHBondContact O-CB 3.4Å; P516-R520 PolarHBondContact O-N 3.23Å; E518-R520 PolarHBondContact O-N 2.82Å; R520-I524 HydrophobicContact CG-CD1 3.87Å; R520-I524 WeakPolarHBondContact O-CB 3.49Å; R520-I524 WeakPolarHBondContact O-CD1 3.48Å; R520-I524 WeakPolarHBondContact O-CG1 3.38Å; R520-I524 PolarHBondContact O-N 2.72Å; R520-I524 VanDerWaalsContact O-N 3.08Å
521	Q	77.3	Confident	82.9	Confident	40 Å²	40	65.8 Å²	65.8	19%	0.187	36%	0.364	C	S	.	.	H	α-helix	trans	-71.9	-38.2	179.7	-169.2	62.6	59.2	0	0	111.5	H517 E518 E519 I524 N525	H517-Q521 PolarHBondContact O-N 3.22Å; E518-Q521 PolarHBondContact O-N 3.47Å; E519-Q521 VanDerWaalsContact C-N 3.33Å; E519-Q521 PolarHBondContact O-N 3.03Å; Q521-I524 PolarHBondContact O-N 3.35Å; Q521-N525 PolarHBondContact NE2-OD1 2.71Å; Q521-N525 WeakPolarHBondContact O-CB 3.38Å; Q521-N525 PolarHBondContact O-N 3.23Å; Q521-N525 PolarHBondContact O-OD1 3Å
522	V	86.5	Confident	83.2	Confident	97 Å²	97	66.9 Å²	66.9	59%	0.588	37%	0.372	S	S	*	.	H	α-helix	trans	-59.4	-48.2	173.9	176.3	0	0	0	0	110.6	E518 E519 I524 N525 A526	E518-V522 PolarHBondContact O-N 2.88Å; E519-V522 PolarHBondContact O-N 2.78Å; V522-I524 PolarHBondContact O-N 2.93Å; V522-N525 PolarHBondContact O-N 3.31Å; V522-A526 WeakPolarHBondContact O-CB 3.36Å; V522-A526 PolarHBondContact O-N 2.6Å
523	S	88.5	Confident	83.5	Confident	27 Å²	27	70.9 Å²	70.9	19%	0.189	40%	0.397	C	S	.	.	H	α-helix	trans	-63.7	-39.5	179.3	-58.4	0	0	0	0	112.9	E519 Y527	E519-S523 WeakPolarHBondContact O-CB 3.44Å; E519-S523 PolarHBondContact O-N 3.49Å; E519-S523 PolarHBondContact O-OG 2.95Å; S523-Y527 WeakPolarHBondContact O-CB 3.47Å; S523-Y527 PolarHBondContact O-N 2.84Å
524	I	86.9	Confident	84.6	Confident	15 Å²	15	70.3 Å²	70.3	8%	0.077	38%	0.376	C	S	.	.	H	α-helix	trans	-66.7	-40.2	175	-70	166.8	0	0	0	111.1	L511 R520 Q521 V522 N528 F537 I548	L511-I524 HydrophobicContact CD1-CD1 3.98Å; L511-I524 HydrophobicContact CD1-CG1 4.17Å; R520-I524 HydrophobicContact CG-CD1 3.87Å; R520-I524 WeakPolarHBondContact O-CB 3.49Å; R520-I524 WeakPolarHBondContact O-CD1 3.48Å; R520-I524 WeakPolarHBondContact O-CG1 3.38Å; R520-I524 PolarHBondContact O-N 2.72Å; R520-I524 VanDerWaalsContact O-N 3.08Å; Q521-I524 PolarHBondContact O-N 3.35Å; V522-I524 PolarHBondContact O-N 2.93Å; I524-N528 WeakPolarHBondContact O-CB 3.49Å; I524-N528 PolarHBondContact O-N 2.89Å; I524-N528 PolarHBondContact O-ND2 3.01Å; I524-F537 HydrophobicContact CG1-CE1 4.49Å; I524-F537 HydrophobicContact CG1-CZ 4.35Å; I524-I548 HydrophobicContact CD1-CB 4.22Å; I524-I548 HydrophobicContact CD1-CG2 3.77Å
525	N	87.6	Confident	85.6	Confident	89 Å²	89	63.9 Å²	63.9	48%	0.476	35%	0.346	S	S	.	.	H	α-helix	trans	-67.3	-51.7	178.2	-71.2	0.4	0	0	0	111	Q521 V522 Y527 N528 E529	Q521-N525 PolarHBondContact NE2-OD1 2.71Å; Q521-N525 WeakPolarHBondContact O-CB 3.38Å; Q521-N525 PolarHBondContact O-N 3.23Å; Q521-N525 PolarHBondContact O-OD1 3Å; V522-N525 PolarHBondContact O-N 3.31Å; N525-Y527 VanDerWaalsContact C-N 3.26Å; N525-Y527 PolarHBondContact O-N 2.91Å; N525-N528 CarbonylContact O-C 3.56Å; N525-N528 PolarHBondContact O-N 3.4Å; N525-E529 PolarHBondContact O-N 3.14Å
526	A	91.5	Very high	86.6	Confident	28 Å²	28	62.8 Å²	62.8	23%	0.231	34%	0.339	C	S	.	.	H	α-helix	trans	-59.2	-33.8	-177.9	0	0	0	0	0	113	V522 S532	V522-A526 WeakPolarHBondContact O-CB 3.36Å; V522-A526 PolarHBondContact O-N 2.6Å; A526-S532 VanDerWaalsContact O-CB 3.22Å; A526-S532 WeakPolarHBondContact O-CB 3.27Å; A526-S532 PolarHBondContact O-OG 2.93Å
527	Y	93.7	Very high	87.7	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-76.2	-34.2	174.3	-169.1	-90.4	0	0	0	113.3	R483 V484 L485 S523 N525 E529 K534 F537 L550 A553	R483-Y527 PolarHBondContact NH1-O 3.24Å; V484-Y527 PolarHBondContact N-OH 3.47Å; V484-Y527 PolarHBondContact O-OH 2.79Å; L485-Y527 HydrophobicContact CD2-CE1 4.05Å; S523-Y527 WeakPolarHBondContact O-CB 3.47Å; S523-Y527 PolarHBondContact O-N 2.84Å; N525-Y527 VanDerWaalsContact C-N 3.26Å; N525-Y527 PolarHBondContact O-N 2.91Å; Y527-E529 VanDerWaalsContact C-N 3.32Å; Y527-K534 HydrophobicContact CD2-CB 3.6Å; Y527-K534 HydrophobicContact CE2-CB 4.21Å; Y527-K534 WeakPolarHBondContact CE2-O 3.4Å; Y527-K534 HydrophobicContact CG-CB 4.48Å; Y527-F537 AromaticContact CD1-CD1 3.87Å; Y527-F537 HydrophobicContact CD1-CD1 3.87Å; Y527-F537 HydrophobicContact CD2-CB 4.05Å; Y527-F537 AromaticContact CD2-CD1 3.64Å; Y527-F537 HydrophobicContact CD2-CD1 3.64Å; Y527-F537 HydrophobicContact CD2-CG 4.23Å; Y527-F537 HydrophobicContact CE1-CB 4.49Å; Y527-F537 HydrophobicContact CE1-CD1 4.36Å; Y527-F537 HydrophobicContact CE2-CB 3.75Å; Y527-F537 HydrophobicContact CE2-CD1 4.19Å; Y527-F537 HydrophobicContact CE2-CG 4.43Å; Y527-F537 AromaticContact CG-CD1 3.46Å; Y527-F537 HydrophobicContact CG-CD1 3.46Å; Y527-F537 VanDerWaalsContact CG-CD1 3.46Å; Y527-F537 HydrophobicContact CG-CE1 4.1Å; Y527-F537 HydrophobicContact CG-CG 4.44Å; Y527-L550 HydrophobicContact CD1-CD2 3.94Å; Y527-L550 HydrophobicContact CE1-CD2 4.46Å; Y527-A553 HydrophobicContact CE1-CB 4.01Å
528	N	90.3	Very high	89	Confident	44 Å²	44	58 Å²	58	24%	0.235	31%	0.311	C	S	.	.	H	α-helix	trans	-81.1	-9.9	179.5	-80.3	-61.8	0	0	0	114	I524 N525 N549 T552	I524-N528 WeakPolarHBondContact O-CB 3.49Å; I524-N528 PolarHBondContact O-N 2.89Å; I524-N528 PolarHBondContact O-ND2 3.01Å; N525-N528 CarbonylContact O-C 3.56Å; N525-N528 PolarHBondContact O-N 3.4Å; N528-N549 PolarHBondContact ND2-O 2.71Å; N528-T552 HydrophobicContact CB-CG2 4.3Å; N528-T552 VanDerWaalsContact OD1-CG2 3.28Å; N528-T552 WeakPolarHBondContact OD1-CG2 3.43Å; N528-T552 PolarHBondContact OD1-OG1 2.73Å
529	E	92.3	Very high	89.8	Confident	116 Å²	116	50.7 Å²	50.7	54%	0.542	28%	0.277	S	S	.	.	S	Bend	trans	-58.4	139.2	-179.7	-164.1	168.9	-157.9	0	0	111.7	N525 Y527 N531 S532	N525-E529 PolarHBondContact O-N 3.14Å; Y527-E529 VanDerWaalsContact C-N 3.32Å; E529-N531 PolarHBondContact O-N 3.1Å; E529-S532 VanDerWaalsContact O-CB 3.31Å; E529-S532 WeakPolarHBondContact O-CB 3.42Å; E529-S532 PolarHBondContact O-N 3.32Å; E529-S532 VanDerWaalsContact O-N 3.13Å
530	P	88.1	Confident	90.3	Very high	111 Å²	111	45.8 Å²	45.8	72%	0.721	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	131.8	172.9	25.2	-34.8	0	0	0	109.9	S532	P530-S532 PolarHBondContact O-N 3Å
531	N	88	Confident	90.2	Very high	166 Å²	166	44.2 Å²	44.2	89%	0.888	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.6	22.1	-176.2	-50.3	-28.1	0	0	0	115.1	E529 T533	E529-N531 PolarHBondContact O-N 3.1Å; N531-T533 PolarHBondContact O-N 3.05Å
532	S	93.1	Very high	89.9	Confident	22 Å²	22	50.5 Å²	50.5	15%	0.154	27%	0.272	C	S	.	.			trans	-50.1	133.6	170.9	179.9	0	0	0	0	112.3	A526 E529 P530 K534	A526-S532 VanDerWaalsContact O-CB 3.22Å; A526-S532 WeakPolarHBondContact O-CB 3.27Å; A526-S532 PolarHBondContact O-OG 2.93Å; E529-S532 VanDerWaalsContact O-CB 3.31Å; E529-S532 WeakPolarHBondContact O-CB 3.42Å; E529-S532 PolarHBondContact O-N 3.32Å; E529-S532 VanDerWaalsContact O-N 3.13Å; P530-S532 PolarHBondContact O-N 3Å; S532-K534 PolarHBondContact O-N 3.37Å; S532-K534 PolarHBondContact OG-N 3.16Å
533	T	92.4	Very high	89.1	Confident	92 Å²	92	46.2 Å²	46.2	56%	0.564	25%	0.246	S	C	*	.			trans	-72.5	-11.2	175.5	59.6	0	0	0	0	113.5	E507 N531 F535	E507-T533 WeakPolarHBondContact OE1-CB 3.37Å; E507-T533 PolarHBondContact OE1-OG1 2.79Å; E507-T533 PolarHBondContact OE2-OG1 2.8Å; N531-T533 PolarHBondContact O-N 3.05Å; T533-F535 PolarHBondContact O-N 3.47Å; T533-F535 VanDerWaalsContact O-N 3.15Å
534	K	95	Very high	87.9	Confident	54 Å²	54	44.9 Å²	44.9	24%	0.235	24%	0.237	C	C	.	.			trans	-72.4	109	-175.7	-53.9	-51.4	-176.3	-169.6	0	110.9	R483 E507 Y527 S532	R483-K534 WeakPolarHBondContact CD-O 3.41Å; E507-K534 HydrophobicContact CB-CD 4Å; E507-K534 IonicContact OE2-NZ 2.79Å; E507-K534 PolarHBondContact OE2-NZ 2.98Å; Y527-K534 HydrophobicContact CD2-CB 3.6Å; Y527-K534 HydrophobicContact CE2-CB 4.21Å; Y527-K534 WeakPolarHBondContact CE2-O 3.4Å; Y527-K534 HydrophobicContact CG-CB 4.48Å; S532-K534 PolarHBondContact O-N 3.37Å; S532-K534 PolarHBondContact OG-N 3.16Å
535	F	96.3	Very high	86.8	Confident	16 Å²	16	44.3 Å²	44.3	7%	0.07	23%	0.234	C	C	.	.			trans	-82.7	-41.5	-178.5	172	-128.8	0	0	0	111.9	L474 M477 K478 S482 V484 Y506 E507 T533	L474-F535 HydrophobicContact CB-CE1 4.37Å; L474-F535 HydrophobicContact CD2-CE1 4.1Å; L474-F535 HydrophobicContact CD2-CZ 4.11Å; L474-F535 WeakPolarHBondContact O-CZ 3.24Å; M477-F535 HydrophobicContact CB-CE2 4.47Å; M477-F535 HydrophobicContact CB-CZ 4.33Å; K478-F535 HydrophobicContact CB-CD2 4.46Å; K478-F535 HydrophobicContact CB-CE1 4.11Å; K478-F535 HydrophobicContact CB-CE2 3.83Å; K478-F535 HydrophobicContact CB-CZ 3.65Å; K478-F535 HydrophobicContact CD-CD1 4.36Å; K478-F535 HydrophobicContact CD-CE1 4.35Å; K478-F535 HydrophobicContact CG-CD2 4.42Å; K478-F535 HydrophobicContact CG-CE1 4.47Å; K478-F535 HydrophobicContact CG-CE2 4.27Å; K478-F535 HydrophobicContact CG-CZ 4.32Å; S482-F535 WeakPolarHBondContact O-CD2 3.27Å; S482-F535 VanDerWaalsContact O-CE2 3.26Å; S482-F535 WeakPolarHBondContact O-CE2 3.3Å; V484-F535 HydrophobicContact CG2-CE2 3.76Å; V484-F535 HydrophobicContact CG2-CZ 3.88Å; V484-F535 PolarHBondContact N-O 3.27Å; Y506-F535 AromaticContact CD1-CD1 3.6Å; Y506-F535 HydrophobicContact CD1-CD1 3.6Å; Y506-F535 AromaticContact CD1-CE1 3.81Å; Y506-F535 HydrophobicContact CD1-CE1 3.81Å; Y506-F535 HydrophobicContact CE1-CD1 4.12Å; Y506-F535 AromaticContact CE1-CE1 3.86Å; Y506-F535 HydrophobicContact CE1-CE1 3.86Å; Y506-F535 HydrophobicContact CG-CD1 4.12Å; Y506-F535 HydrophobicContact CG-CE1 4.38Å; E507-F535 PolarHBondContact O-N 3.36Å; T533-F535 PolarHBondContact O-N 3.47Å; T533-F535 VanDerWaalsContact O-N 3.15Å
536	I	96.9	Very high	85.6	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	139.5	-174.2	-63.8	172.5	0	0	0	111.2	L474 V484 I486 Y506 E507 Y508 C509 M538	L474-I536 HydrophobicContact CD1-CD1 3.99Å; L474-I536 HydrophobicContact CD2-CD1 4.25Å; V484-I536 CarbonylContact O-C 3.6Å; V484-I536 WeakPolarHBondContact O-CA 3.46Å; I486-I536 HydrophobicContact CD1-CG2 3.79Å; I486-I536 HydrophobicContact CG1-CG2 4.11Å; Y506-I536 HydrophobicContact CD2-CD1 4.09Å; Y506-I536 HydrophobicContact CG-CD1 4.07Å; E507-I536 PolarHBondContact O-N 2.96Å; Y508-I536 CarbonylContact C-O 3.47Å; Y508-I536 WeakPolarHBondContact CA-O 3.35Å; C509-I536 PolarHBondContact N-O 2.89Å; I536-M538 HydrophobicContact CG2-CG 3.97Å
537	F	96.2	Very high	84.1	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	111.5	162	-148	135.3	0	0	0	109.8	V484 L485 I486 C509 L511 I524 Y527 L539 L550	V484-F537 PolarHBondContact O-N 3.34Å; L485-F537 WeakPolarHBondContact CA-O 3.39Å; L485-F537 HydrophobicContact CD2-CB 3.65Å; I486-F537 PolarHBondContact N-O 3.5Å; C509-F537 HydrophobicContact CB-CD1 3.87Å; C509-F537 HydrophobicContact CB-CD2 3.85Å; C509-F537 HydrophobicContact CB-CE1 3.75Å; C509-F537 HydrophobicContact CB-CE2 3.73Å; C509-F537 HydrophobicContact CB-CG 3.91Å; C509-F537 HydrophobicContact CB-CZ 3.68Å; C509-F537 WeakPolarHBondContact O-CA 3.31Å; C509-F537 WeakPolarHBondContact O-CD2 3.32Å; L511-F537 HydrophobicContact CB-CE2 3.6Å; L511-F537 HydrophobicContact CB-CZ 4.19Å; L511-F537 HydrophobicContact CD1-CE2 4.45Å; L511-F537 HydrophobicContact CD1-CZ 4.39Å; I524-F537 HydrophobicContact CG1-CE1 4.49Å; I524-F537 HydrophobicContact CG1-CZ 4.35Å; Y527-F537 AromaticContact CD1-CD1 3.87Å; Y527-F537 HydrophobicContact CD1-CD1 3.87Å; Y527-F537 HydrophobicContact CD2-CB 4.05Å; Y527-F537 AromaticContact CD2-CD1 3.64Å; Y527-F537 HydrophobicContact CD2-CD1 3.64Å; Y527-F537 HydrophobicContact CD2-CG 4.23Å; Y527-F537 HydrophobicContact CE1-CB 4.49Å; Y527-F537 HydrophobicContact CE1-CD1 4.36Å; Y527-F537 HydrophobicContact CE2-CB 3.75Å; Y527-F537 HydrophobicContact CE2-CD1 4.19Å; Y527-F537 HydrophobicContact CE2-CG 4.43Å; Y527-F537 AromaticContact CG-CD1 3.46Å; Y527-F537 HydrophobicContact CG-CD1 3.46Å; Y527-F537 VanDerWaalsContact CG-CD1 3.46Å; Y527-F537 HydrophobicContact CG-CE1 4.1Å; Y527-F537 HydrophobicContact CG-CG 4.44Å; F537-L539 HydrophobicContact CB-CD1 4.49Å; F537-L539 HydrophobicContact CD2-CD1 4.27Å; F537-L539 HydrophobicContact CD2-CD2 4.07Å; F537-L539 HydrophobicContact CD2-CG 3.84Å; F537-L539 HydrophobicContact CE2-CD2 4.07Å; F537-L539 HydrophobicContact CE2-CG 4.34Å; F537-L539 HydrophobicContact CG-CD1 4.44Å; F537-L539 HydrophobicContact CG-CG 4.48Å; F537-L550 HydrophobicContact CD1-CD1 4.28Å; F537-L550 HydrophobicContact CD1-CD2 3.77Å; F537-L550 HydrophobicContact CE1-CD2 3.88Å
538	M	95.1	Very high	83.4	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	124	173.3	-71.8	-176.8	-74.1	0	0	111	L494 L497 E498 Y508 C509 R510 L511 I536	L494-M538 HydrophobicContact CD2-CB 4.35Å; L497-M538 HydrophobicContact CB-SD 3.5Å; L497-M538 VanDerWaalsContact CB-SD 3.5Å; E498-M538 HydrophobicContact CB-CE 3.88Å; E498-M538 HydrophobicContact CB-SD 4.47Å; E498-M538 HydrophobicContact CG-CE 4.25Å; Y508-M538 HydrophobicContact CD1-CE 4.43Å; Y508-M538 HydrophobicContact CD2-CE 3.26Å; Y508-M538 HydrophobicContact CE2-CE 3.73Å; Y508-M538 HydrophobicContact CG-CE 3.68Å; C509-M538 PolarHBondContact O-N 3.42Å; R510-M538 WeakPolarHBondContact CA-O 3.49Å; L511-M538 PolarHBondContact N-O 3.18Å; I536-M538 HydrophobicContact CG2-CG 3.97Å
539	L	91.7	Very high	83	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	131.3	-172.9	-72.8	153.7	0	0	0	109.8	L485 I486 F487 S488 L511 F537 I548 L550	L485-L539 HydrophobicContact CB-CD1 4.38Å; L485-L539 HydrophobicContact CD1-CD1 4.43Å; L485-L539 HydrophobicContact CD2-CD1 4.37Å; I486-L539 PolarHBondContact O-N 3.21Å; F487-L539 VanDerWaalsContact CA-O 3.31Å; F487-L539 WeakPolarHBondContact CA-O 3.21Å; F487-L539 HydrophobicContact CD1-CB 3.53Å; F487-L539 HydrophobicContact CD1-CD1 4.26Å; F487-L539 HydrophobicContact CE1-CB 3.62Å; F487-L539 HydrophobicContact CE1-CD1 3.59Å; F487-L539 HydrophobicContact CE1-CG 4.15Å; F487-L539 HydrophobicContact CE2-CD1 4.29Å; F487-L539 HydrophobicContact CG-CB 4.31Å; F487-L539 HydrophobicContact CZ-CB 4.44Å; F487-L539 HydrophobicContact CZ-CD1 3.61Å; S488-L539 PolarHBondContact N-O 3.48Å; S488-L539 VanDerWaalsContact N-O 3.14Å; L511-L539 HydrophobicContact CB-CD2 3.9Å; L511-L539 HydrophobicContact CD1-CD2 3.99Å; L511-L539 HydrophobicContact CD2-CD2 4.27Å; L511-L539 HydrophobicContact CG-CD2 4.28Å; L511-L539 WeakPolarHBondContact O-CA 3.2Å; F537-L539 HydrophobicContact CB-CD1 4.49Å; F537-L539 HydrophobicContact CD2-CD1 4.27Å; F537-L539 HydrophobicContact CD2-CD2 4.07Å; F537-L539 HydrophobicContact CD2-CG 3.84Å; F537-L539 HydrophobicContact CE2-CD2 4.07Å; F537-L539 HydrophobicContact CE2-CG 4.34Å; F537-L539 HydrophobicContact CG-CD1 4.44Å; F537-L539 HydrophobicContact CG-CG 4.48Å; L539-I548 HydrophobicContact CD2-CD1 3.81Å; L539-L550 HydrophobicContact CD1-CD1 3.61Å
540	S	88.8	Confident	82.8	Confident	11 Å²	11	37.9 Å²	37.9	8%	0.077	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	132.9	162.8	79	0	0	0	0	108.7	S488 L511 R542 A543 G544	S488-S540 CarbonylContact O-C 3.51Å; S488-S540 VanDerWaalsContact O-CA 3.27Å; S488-S540 WeakPolarHBondContact O-CA 3.47Å; L511-S540 PolarHBondContact O-N 3.24Å; L511-S540 VanDerWaalsContact O-N 3.14Å; S540-R542 PolarHBondContact O-N 3.41Å; S540-A543 PolarHBondContact O-N 3.19Å; S540-A543 WeakPolarHBondContact OG-CB 3.48Å; S540-A543 PolarHBondContact OG-N 2.84Å; S540-G544 PolarHBondContact O-N 3.24Å
541	T	78.6	Confident	82.7	Confident	1 Å²	1	33 Å²	33	1%	0.006	17%	0.173	C	C	.	.	H	α-helix	trans	-55.1	-36.9	-170.9	-38	0	0	0	0	111.9	S488 Q489 G545 V567 A571	S488-T541 PolarHBondContact O-N 2.95Å; S488-T541 PolarHBondContact O-OG1 3.33Å; Q489-T541 PolarHBondContact N-OG1 3.37Å; T541-G545 PolarHBondContact O-N 2.98Å; T541-V567 HydrophobicContact CG2-CG1 3.94Å; T541-A571 HydrophobicContact CG2-CB 4.09Å
542	R	70.8	Confident	82.9	Confident	172 Å²	172	27 Å²	27	65%	0.649	14%	0.142	S	C	*	.	H	α-helix	trans	-69.2	-37	175.3	-68.2	-173.2	178.2	-166.9	-2.1	114.9	S540 L546	S540-R542 PolarHBondContact O-N 3.41Å; R542-L546 VanDerWaalsContact O-CG 3.27Å; R542-L546 WeakPolarHBondContact O-CG 3.17Å
543	A	68.6	Low	82.9	Confident	6 Å²	6	25.9 Å²	25.9	5%	0.05	14%	0.135	C	C	.	.	H	α-helix	trans	-82.7	-36.8	179.7	0	0	0	0	0	111.6	L511 S540 L546	L511-A543 HydrophobicContact CD2-CB 3.53Å; S540-A543 PolarHBondContact O-N 3.19Å; S540-A543 WeakPolarHBondContact OG-CB 3.48Å; S540-A543 PolarHBondContact OG-N 2.84Å; A543-L546 WeakPolarHBondContact O-CB 3.5Å; A543-L546 WeakPolarHBondContact O-CG 3.48Å; A543-L546 PolarHBondContact O-N 3.18Å
544	G	65.1	Low	83	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-68.3	-30.6	173.6	0	0	0	0	0	113.5	S540 L546 R574	S540-G544 PolarHBondContact O-N 3.24Å; G544-L546 PolarHBondContact O-N 3.1Å; G544-R574 VanDerWaalsContact O-CD 3.23Å; G544-R574 WeakPolarHBondContact O-CD 3.31Å; G544-R574 WeakPolarHBondContact O-CG 3.49Å
545	G	62.3	Low	83.1	Confident	2 Å²	2	19.5 Å²	19.5	2%	0.021	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-16.4	173.2	0	0	0	0	0	114.7	T541 G547 Q570	T541-G545 PolarHBondContact O-N 2.98Å; G545-G547 PolarHBondContact O-N 2.94Å; G545-Q570 WeakPolarHBondContact O-CG 3.12Å; G545-Q570 PolarHBondContact O-OE1 2.81Å
546	L	62.8	Low	83.1	Confident	63 Å²	63	18.7 Å²	18.7	33%	0.33	10%	0.096	S	C	.	.	S	Bend	trans	-75.5	40.2	-171.1	-56.1	176.5	0	0	0	115.4	S221 T222 R542 A543 G544 I548	S221-L546 VanDerWaalsContact CB-O 3.24Å; S221-L546 WeakPolarHBondContact CB-O 3.34Å; S221-L546 VanDerWaalsContact OG-CB 3.3Å; S221-L546 WeakPolarHBondContact OG-CB 3.42Å; S221-L546 PolarHBondContact OG-O 3.17Å; T222-L546 WeakPolarHBondContact CG2-O 3.07Å; R542-L546 VanDerWaalsContact O-CG 3.27Å; R542-L546 WeakPolarHBondContact O-CG 3.17Å; A543-L546 WeakPolarHBondContact O-CB 3.5Å; A543-L546 WeakPolarHBondContact O-CG 3.48Å; A543-L546 PolarHBondContact O-N 3.18Å; G544-L546 PolarHBondContact O-N 3.1Å; L546-I548 PolarHBondContact O-N 3.18Å
547	G	60.8	Low	83	Confident	18 Å²	18	18.7 Å²	18.7	19%	0.186	10%	0.096	C	C	.	.	S	Bend	trans	85.7	1.7	165.8	0	0	0	0	0	117	G545 R574	G545-G547 PolarHBondContact O-N 2.94Å; G547-R574 VanDerWaalsContact C-NH1 3.29Å; G547-R574 PolarHBondContact O-NH1 2.75Å
548	I	78.3	Confident	83	Confident	10 Å²	10	18.8 Å²	18.8	5%	0.051	10%	0.096	C	C	.	.			trans	-61.5	167.7	-177.1	65.7	177.5	0	0	0	114	L511 I524 L539 L546 L550 R574 R577	L511-I548 HydrophobicContact CD1-CD1 4.12Å; I524-I548 HydrophobicContact CD1-CB 4.22Å; I524-I548 HydrophobicContact CD1-CG2 3.77Å; L539-I548 HydrophobicContact CD2-CD1 3.81Å; L546-I548 PolarHBondContact O-N 3.18Å; I548-L550 HydrophobicContact CD1-CD1 3.66Å; I548-L550 HydrophobicContact CD1-CG 4.24Å; I548-L550 HydrophobicContact CG1-CD1 4.33Å; I548-R574 HydrophobicContact CG1-CG 4.08Å; I548-R574 WeakPolarHBondContact O-CD 3.48Å; I548-R574 PolarHBondContact O-NH1 2.9Å; I548-R577 PolarHBondContact O-NH1 2.69Å; I548-R577 VanDerWaalsContact O-NH1 3.08Å
549	N	82.1	Confident	83.1	Confident	51 Å²	51	18.8 Å²	18.8	27%	0.273	10%	0.096	S	C	.	.			trans	-116.9	119.2	177.7	-174.7	13.1	0	0	0	111.1	N528 A551 R577	N528-N549 PolarHBondContact ND2-O 2.71Å; N549-A551 PolarHBondContact OD1-N 3.13Å; N549-R577 VanDerWaalsContact CG-CZ 3.41Å; N549-R577 VanDerWaalsContact OD1-CD 3.31Å; N549-R577 WeakPolarHBondContact OD1-CD 3.28Å; N549-R577 VanDerWaalsContact OD1-CZ 3.29Å; N549-R577 PolarHBondContact OD1-NE 2.93Å
550	L	87.8	Confident	83.1	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.097	C	C	.	.			trans	-138.6	39.2	177.9	-64.4	171.2	0	0	0	110.5	L485 Y527 F537 L539 I548 T552 A553 R574	L485-L550 HydrophobicContact CD1-CB 3.98Å; L485-L550 HydrophobicContact CD1-CD1 3.98Å; L485-L550 HydrophobicContact CD2-CB 4.24Å; L485-L550 HydrophobicContact CD2-CD1 3.89Å; Y527-L550 HydrophobicContact CD1-CD2 3.94Å; Y527-L550 HydrophobicContact CE1-CD2 4.46Å; F537-L550 HydrophobicContact CD1-CD1 4.28Å; F537-L550 HydrophobicContact CD1-CD2 3.77Å; F537-L550 HydrophobicContact CE1-CD2 3.88Å; L539-L550 HydrophobicContact CD1-CD1 3.61Å; I548-L550 HydrophobicContact CD1-CD1 3.66Å; I548-L550 HydrophobicContact CD1-CG 4.24Å; I548-L550 HydrophobicContact CG1-CD1 4.33Å; L550-T552 PolarHBondContact O-N 2.66Å; L550-A553 PolarHBondContact O-N 3.22Å; L550-A553 VanDerWaalsContact O-N 3.12Å; L550-R574 CarbonylContact C-O 3.59Å; L550-R574 VanDerWaalsContact C-O 3.3Å; L550-R574 HydrophobicContact CB-CB 4.49Å; L550-R574 PolarHBondContact N-O 3.2Å; L550-R574 VanDerWaalsContact N-O 3.1Å
551	A	86.3	Confident	83.1	Confident	10 Å²	10	18.6 Å²	18.6	8%	0.083	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-5.2	178	0	0	0	0	0	114.4	N549 R574 R577 Q580	N549-A551 PolarHBondContact OD1-N 3.13Å; A551-R574 PolarHBondContact N-O 3.21Å; A551-R577 HydrophobicContact CB-CG 3.92Å; A551-Q580 PolarHBondContact O-NE2 2.97Å
552	T	91.9	Very high	83.4	Confident	38 Å²	38	19.3 Å²	19.3	23%	0.233	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-17.1	176.7	42.5	0	0	0	0	114	R483 N528 L550	R483-T552 PolarHBondContact NE-O 3.43Å; R483-T552 PolarHBondContact NH2-O 3.43Å; R483-T552 VanDerWaalsContact NH2-O 3.11Å; N528-T552 HydrophobicContact CB-CG2 4.3Å; N528-T552 VanDerWaalsContact OD1-CG2 3.28Å; N528-T552 WeakPolarHBondContact OD1-CG2 3.43Å; N528-T552 PolarHBondContact OD1-OG1 2.73Å; L550-T552 PolarHBondContact O-N 2.66Å
553	A	93.8	Very high	83.6	Confident	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.081	C	C	.	.			trans	-97.4	132.5	172.8	0	0	0	0	0	111.5	R483 L485 Y527 L550 A575 Q580	R483-A553 HydrophobicContact CB-CB 4.27Å; L485-A553 HydrophobicContact CD1-CB 4.19Å; L485-A553 HydrophobicContact CD2-CB 3.51Å; L485-A553 HydrophobicContact CG-CB 3.55Å; Y527-A553 HydrophobicContact CE1-CB 4.01Å; L550-A553 PolarHBondContact O-N 3.22Å; L550-A553 VanDerWaalsContact O-N 3.12Å; A553-A575 WeakPolarHBondContact O-CB 3.42Å; A553-Q580 PolarHBondContact O-NE2 2.83Å
554	D	94.3	Very high	84	Confident	11 Å²	11	17.3 Å²	17.3	6%	0.059	10%	0.095	C	C	.	.			trans	-103	-13.5	179.4	56.9	-49	0	0	0	113.7	S482 R483 K582 V584 R585	S482-D554 VanDerWaalsContact CA-OD1 3.26Å; S482-D554 WeakPolarHBondContact CA-OD1 3.26Å; S482-D554 WeakPolarHBondContact CB-OD1 3.27Å; S482-D554 VanDerWaalsContact CB-OD2 3.24Å; S482-D554 WeakPolarHBondContact CB-OD2 3.32Å; S482-D554 PolarHBondContact OG-OD2 3.15Å; R483-D554 PolarHBondContact N-OD1 3.2Å; R483-D554 PolarHBondContact O-N 2.9Å; D554-K582 HydrophobicContact CB-CB 3.68Å; D554-K582 HydrophobicContact CB-CD 3.73Å; D554-K582 HydrophobicContact CB-CG 4.36Å; D554-K582 VanDerWaalsContact CG-CD 3.41Å; D554-K582 IonicContact OD1-NZ 3.59Å; D554-K582 WeakPolarHBondContact OD2-CD 3.49Å; D554-K582 IonicContact OD2-NZ 2.67Å; D554-K582 PolarHBondContact OD2-NZ 2.9Å; D554-V584 VanDerWaalsContact O-CA 3.29Å; D554-V584 WeakPolarHBondContact O-CA 3.17Å; D554-R585 PolarHBondContact O-N 3.02Å
555	V	95.9	Very high	84.7	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	133.3	177.6	178.6	0	0	0	0	110.2	M477 R483 V484 L485 I557 R585 Y587	M477-V555 HydrophobicContact CG-CG1 4.44Å; M477-V555 HydrophobicContact CG-CG2 4.48Å; M477-V555 HydrophobicContact SD-CG1 4.27Å; M477-V555 HydrophobicContact SD-CG2 3.73Å; R483-V555 PolarHBondContact O-N 3.23Å; V484-V555 WeakPolarHBondContact CA-O 3.3Å; V484-V555 HydrophobicContact CG1-CG1 4.22Å; V484-V555 HydrophobicContact CG2-CB 4.15Å; V484-V555 HydrophobicContact CG2-CG1 4.25Å; L485-V555 PolarHBondContact N-O 3.45Å; V555-I557 HydrophobicContact CG1-CG1 4.32Å; V555-R585 WeakPolarHBondContact CA-O 3.45Å; V555-Y587 HydrophobicContact CG1-CD2 3.7Å; V555-Y587 HydrophobicContact CG1-CE2 3.69Å
556	V	96.1	Very high	85.3	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	122.7	175.2	178.2	0	0	0	0	109.1	L485 F487 L558 A575 V584 R585 V586 Y587	L485-V556 HydrophobicContact CB-CG2 4.42Å; L485-V556 HydrophobicContact CD1-CG2 4.3Å; F487-V556 HydrophobicContact CD2-CG1 3.75Å; F487-V556 HydrophobicContact CE2-CG1 3.71Å; V556-L558 HydrophobicContact CG1-CD2 4.11Å; V556-A575 HydrophobicContact CG2-CB 3.67Å; V556-V584 HydrophobicContact CG2-CG1 4.49Å; V556-R585 PolarHBondContact N-O 3.24Å; V556-V586 HydrophobicContact CB-CG1 4.37Å; V556-V586 HydrophobicContact CB-CG2 4.3Å; V556-V586 HydrophobicContact CG1-CG1 4.34Å; V556-V586 CarbonylContact O-C 3.25Å; V556-V586 VanDerWaalsContact O-CA 3.3Å; V556-V586 WeakPolarHBondContact O-CA 3.4Å; V556-Y587 PolarHBondContact O-N 3.1Å
557	I	96.7	Very high	86	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	121.4	173.2	-56.5	179.8	0	0	0	108.2	L470 L473 L474 V484 L485 I486 F487 V555 Y587 F589	L470-I557 HydrophobicContact CD1-CD1 3.59Å; L473-I557 HydrophobicContact CD2-CD1 3.99Å; L474-I557 HydrophobicContact CD2-CD1 4.33Å; V484-I557 HydrophobicContact CG1-CD1 3.67Å; V484-I557 HydrophobicContact CG1-CG1 3.92Å; L485-I557 PolarHBondContact O-N 3.48Å; I486-I557 HydrophobicContact CG1-CB 4.41Å; I486-I557 HydrophobicContact CG1-CD1 4.48Å; F487-I557 PolarHBondContact N-O 3.25Å; V555-I557 HydrophobicContact CG1-CG1 4.32Å; I557-Y587 CarbonylContact C-O 3.58Å; I557-Y587 WeakPolarHBondContact CA-O 3.39Å; I557-Y587 HydrophobicContact CG1-CD2 4.38Å; I557-F589 HydrophobicContact CG2-CD1 4.38Å; I557-F589 HydrophobicContact CG2-CD2 4.37Å; I557-F589 HydrophobicContact CG2-CE1 4.01Å; I557-F589 HydrophobicContact CG2-CE2 4.01Å; I557-F589 HydrophobicContact CG2-CZ 3.82Å
558	L	95.8	Very high	87.1	Confident	1 Å²	1	18 Å²	18	1%	0.005	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	99.9	167.8	-56.2	-177.3	0	0	0	107.3	F487 V556 D568 M572 V586 Y587 F589	F487-L558 HydrophobicContact CB-CD2 3.87Å; F487-L558 HydrophobicContact CD2-CD2 3.92Å; F487-L558 HydrophobicContact CG-CD2 4.18Å; V556-L558 HydrophobicContact CG1-CD2 4.11Å; L558-D568 HydrophobicContact CD1-CB 4.05Å; L558-M572 HydrophobicContact CD1-CE 3.84Å; L558-V586 HydrophobicContact CD1-CG1 4.37Å; L558-V586 HydrophobicContact CG-CG1 4.37Å; L558-Y587 PolarHBondContact N-O 3.06Å; L558-F589 PolarHBondContact O-N 3.34Å
559	Y	95.9	Very high	87.3	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.104	C	C	.	.	S	Bend	trans	-70.2	-36.8	-177.8	-167.4	-84.3	0	0	0	111.2	N440 K466 M467 F487 M493 L497 F589	N440-Y559 HydrophobicContact CB-CE1 3.99Å; N440-Y559 PolarHBondContact O-OH 3.33Å; K466-Y559 HydrophobicContact CB-CE1 4.23Å; K466-Y559 HydrophobicContact CB-CE2 3.75Å; K466-Y559 WeakPolarHBondContact CB-OH 3.49Å; K466-Y559 HydrophobicContact CD-CD1 4.01Å; K466-Y559 HydrophobicContact CD-CE1 3.64Å; K466-Y559 HydrophobicContact CD-CE2 4.41Å; K466-Y559 PolarHBondContact NZ-O 3.49Å; M467-Y559 HydrophobicContact SD-CE2 3.99Å; F487-Y559 WeakPolarHBondContact O-CB 3.44Å; F487-Y559 PolarHBondContact O-N 2.81Å; M493-Y559 HydrophobicContact CE-CE1 3.86Å; M493-Y559 HydrophobicContact CE-CE2 4.21Å; M493-Y559 WeakPolarHBondContact CE-OH 3.38Å; M493-Y559 HydrophobicContact CG-CD1 3.91Å; M493-Y559 HydrophobicContact CG-CE1 3.71Å; M493-Y559 HydrophobicContact SD-CD1 4.45Å; M493-Y559 HydrophobicContact SD-CE1 3.65Å; L497-Y559 HydrophobicContact CD2-CE2 4.37Å; Y559-F589 AromaticContact CD2-CD2 3.89Å; Y559-F589 HydrophobicContact CD2-CD2 3.89Å; Y559-F589 HydrophobicContact CD2-CE2 4.04Å; Y559-F589 HydrophobicContact CE2-CD2 4.28Å; Y559-F589 HydrophobicContact CE2-CE2 4.34Å; Y559-F589 HydrophobicContact CG-CD2 4.44Å
560	D	92.9	Very high	87.1	Confident	1 Å²	1	19.4 Å²	19.4	1%	0.005	10%	0.1	C	C	.	.	S	Bend	trans	-145.4	144.3	166.3	65.4	-34	0	0	0	112.9	R436 N440 S488 Q489	R436-D560 IonicContact NH2-OD2 3.42Å; R436-D560 PolarHBondContact NH2-OD2 3.35Å; N440-D560 VanDerWaalsContact ND2-CG 3.32Å; N440-D560 PolarHBondContact ND2-OD2 2.87Å; N440-D560 WeakPolarHBondContact OD1-CB 3.48Å; S488-D560 WeakPolarHBondContact CA-OD1 3.29Å; S488-D560 WeakPolarHBondContact CB-OD1 3.48Å; S488-D560 PolarHBondContact OG-OD1 3.19Å; Q489-D560 PolarHBondContact N-OD1 2.96Å
561	S	88.4	Confident	86.9	Confident	6 Å²	6	19.4 Å²	19.4	4%	0.042	10%	0.1	C	C	.	.			trans	-85.4	152.3	-171.7	-54.7	0	0	0	0	112.4	R436 D568 R588	R436-S561 PolarHBondContact NH2-O 3.26Å; S561-D568 WeakPolarHBondContact CA-OD2 3.34Å; S561-D568 WeakPolarHBondContact CB-OD2 3.46Å; S561-R588 PolarHBondContact OG-NH1 3.35Å
562	D	84.2	Confident	87	Confident	17 Å²	17	18.9 Å²	18.9	9%	0.091	10%	0.096	C	C	.	.			trans	-73.6	165.8	165.9	-151.6	-68.5	0	0	0	111.5	Q489 N564 V567 D568	Q489-D562 VanDerWaalsContact NE2-CG 3.34Å; Q489-D562 PolarHBondContact NE2-OD2 2.88Å; Q489-D562 PolarHBondContact OE1-OD2 2.94Å; D562-N564 VanDerWaalsContact C-N 3.28Å; D562-N564 PolarHBondContact OD1-N 3.01Å; D562-V567 HydrophobicContact CB-CB 4.03Å; D562-V567 HydrophobicContact CB-CG1 4.3Å; D562-D568 WeakPolarHBondContact CB-OD1 3.44Å; D562-D568 PolarHBondContact N-OD1 3.15Å; D562-D568 VanDerWaalsContact N-OD1 3.09Å; D562-D568 PolarHBondContact N-OD2 3.23Å
563	W	76.8	Confident	86.6	Confident	73 Å²	73	17.6 Å²	17.6	28%	0.277	9%	0.087	S	C	.	.	S	Bend	trans	-74.1	-21.7	164.2	-69.7	98.1	0	0	0	112.5	L432 I599 L627 I635	L432-W563 HydrophobicContact CD1-CH2 4.29Å; L432-W563 HydrophobicContact CD1-CZ2 4.33Å; L432-W563 HydrophobicContact CD2-CH2 3.7Å; L432-W563 HydrophobicContact CD2-CZ2 3.66Å; L432-W563 HydrophobicContact CG-CH2 4.27Å; L432-W563 HydrophobicContact CG-CZ2 3.98Å; W563-I599 HydrophobicContact CD2-CG2 4.26Å; W563-I599 HydrophobicContact CE3-CG1 4.14Å; W563-I599 HydrophobicContact CE3-CG2 4.05Å; W563-I599 HydrophobicContact CH2-CD1 3.61Å; W563-I599 HydrophobicContact CH2-CG1 3.45Å; W563-I599 VanDerWaalsContact CH2-CG1 3.45Å; W563-I599 HydrophobicContact CZ2-CD1 3.57Å; W563-I599 HydrophobicContact CZ2-CG1 3.94Å; W563-I599 HydrophobicContact CZ3-CB 4.42Å; W563-I599 HydrophobicContact CZ3-CD1 4.18Å; W563-I599 HydrophobicContact CZ3-CG1 3.57Å; W563-I599 HydrophobicContact CZ3-CG2 4.32Å; W563-L627 HydrophobicContact CD2-CD1 4.44Å; W563-L627 HydrophobicContact CE3-CD1 3.57Å; W563-L627 HydrophobicContact CE3-CD2 4.06Å; W563-L627 HydrophobicContact CE3-CG 4.48Å; W563-L627 HydrophobicContact CH2-CD2 3.9Å; W563-L627 HydrophobicContact CZ3-CD1 3.8Å; W563-L627 HydrophobicContact CZ3-CD2 3.37Å; W563-L627 HydrophobicContact CZ3-CG 4.24Å; W563-I635 HydrophobicContact CH2-CD1 4.03Å; W563-I635 HydrophobicContact CZ3-CD1 3.91Å
564	N	75.8	Confident	86.2	Confident	63 Å²	63	17.9 Å²	17.9	34%	0.337	9%	0.089	S	C	.	.	S	Bend	trans	-105.6	110.2	174.8	179.6	3.7	0	0	0	110.8	D562 Q566 V567	D562-N564 VanDerWaalsContact C-N 3.28Å; D562-N564 PolarHBondContact OD1-N 3.01Å; N564-Q566 PolarHBondContact O-N 3.22Å; N564-Q566 WeakPolarHBondContact OD1-CB 3.36Å; N564-Q566 WeakPolarHBondContact OD1-CG 3.49Å; N564-Q566 PolarHBondContact OD1-N 3.01Å; N564-V567 HydrophobicContact CB-CG2 4.01Å; N564-V567 PolarHBondContact O-N 3.42Å
565	P	78.9	Confident	85.9	Confident	12 Å²	12	17.4 Å²	17.4	8%	0.078	9%	0.086	C	C	.	.	H	α-helix	trans	-58.1	-26.1	-179.3	26.7	-37.6	0	0	0	113.4	V567 D568 L569 A603 L607	P565-V567 PolarHBondContact O-N 3.01Å; P565-D568 PolarHBondContact O-N 3.19Å; P565-L569 WeakPolarHBondContact O-CG 3.42Å; P565-L569 PolarHBondContact O-N 2.89Å; P565-A603 HydrophobicContact CB-CB 4.17Å; P565-A603 HydrophobicContact CG-CB 4.48Å; P565-A603 WeakPolarHBondContact CG-O 3.49Å; P565-L607 HydrophobicContact CB-CB 4.14Å; P565-L607 HydrophobicContact CG-CB 4.09Å
566	Q	75	Confident	85.5	Confident	54 Å²	54	17.9 Å²	17.9	25%	0.252	9%	0.088	S	C	.	.	H	α-helix	trans	-66.4	-26.9	-179.7	-55.4	178.9	1.4	0	0	112.3	N564 Q570 D610	N564-Q566 PolarHBondContact O-N 3.22Å; N564-Q566 WeakPolarHBondContact OD1-CB 3.36Å; N564-Q566 WeakPolarHBondContact OD1-CG 3.49Å; N564-Q566 PolarHBondContact OD1-N 3.01Å; Q566-Q570 WeakPolarHBondContact O-CB 3.11Å; Q566-Q570 PolarHBondContact O-N 3.4Å; Q566-D610 PolarHBondContact NE2-OD2 3.12Å
567	V	77.4	Confident	84.9	Confident	29 Å²	29	19.4 Å²	19.4	18%	0.176	9%	0.094	C	C	.	.	H	α-helix	trans	-71.5	-44.6	176.1	178.6	0	0	0	0	110.6	T541 D562 N564 P565 Q570 A571	T541-V567 HydrophobicContact CG2-CG1 3.94Å; D562-V567 HydrophobicContact CB-CB 4.03Å; D562-V567 HydrophobicContact CB-CG1 4.3Å; N564-V567 HydrophobicContact CB-CG2 4.01Å; N564-V567 PolarHBondContact O-N 3.42Å; P565-V567 PolarHBondContact O-N 3.01Å; V567-Q570 PolarHBondContact O-N 2.74Å; V567-A571 PolarHBondContact O-N 3.39Å
568	D	85.5	Confident	84	Confident	1 Å²	1	21.4 Å²	21.4	1%	0.005	10%	0.104	C	C	.	.	H	α-helix	trans	-66.3	-40.3	177.5	-69.2	-2.4	0	0	0	111.3	L558 S561 D562 P565 Q570 A571 M572 R588	L558-D568 HydrophobicContact CD1-CB 4.05Å; S561-D568 WeakPolarHBondContact CA-OD2 3.34Å; S561-D568 WeakPolarHBondContact CB-OD2 3.46Å; D562-D568 WeakPolarHBondContact CB-OD1 3.44Å; D562-D568 PolarHBondContact N-OD1 3.15Å; D562-D568 VanDerWaalsContact N-OD1 3.09Å; D562-D568 PolarHBondContact N-OD2 3.23Å; P565-D568 PolarHBondContact O-N 3.19Å; D568-Q570 PolarHBondContact O-N 3.15Å; D568-A571 WeakPolarHBondContact O-CB 3.14Å; D568-A571 PolarHBondContact O-N 2.85Å; D568-A571 VanDerWaalsContact O-N 3.15Å; D568-M572 WeakPolarHBondContact O-CG 3.49Å; D568-M572 PolarHBondContact O-N 2.75Å; D568-R588 IonicContact OD2-CZ 2.84Å; D568-R588 IonicContact OD2-NH1 3.83Å; D568-R588 PolarHBondContact OD2-NH1 2.81Å; D568-R588 IonicContact OD2-NH2 2.69Å
569	L	81.9	Confident	83.2	Confident	50 Å²	50	24.1 Å²	24.1	26%	0.262	13%	0.132	S	C	.	.	H	α-helix	trans	-60.6	-43.4	172.6	-73.8	167.9	0	0	0	112	P565 A571 M572 D573 L607	P565-L569 WeakPolarHBondContact O-CG 3.42Å; P565-L569 PolarHBondContact O-N 2.89Å; L569-A571 PolarHBondContact O-N 3.25Å; L569-M572 HydrophobicContact CD2-CE 4.45Å; L569-M572 HydrophobicContact CD2-SD 4.14Å; L569-M572 PolarHBondContact O-N 3.42Å; L569-D573 WeakPolarHBondContact O-CB 3.44Å; L569-D573 PolarHBondContact O-N 3.34Å; L569-L607 HydrophobicContact CD1-CD1 3.6Å; L569-L607 HydrophobicContact CD1-CD2 3.93Å; L569-L607 HydrophobicContact CD1-CG 4.44Å
570	Q	78.4	Confident	82.7	Confident	41 Å²	41	25.3 Å²	25.3	19%	0.192	14%	0.138	C	C	.	.	H	α-helix	trans	-62.1	-31.4	175.4	-179.7	173.1	66.6	0	0	112.2	M189 G545 Q566 V567 D568 R574	M189-Q570 HydrophobicContact CE-CG 4.32Å; M189-Q570 HydrophobicContact SD-CB 4.24Å; M189-Q570 HydrophobicContact SD-CG 3.8Å; G545-Q570 WeakPolarHBondContact O-CG 3.12Å; G545-Q570 PolarHBondContact O-OE1 2.81Å; Q566-Q570 WeakPolarHBondContact O-CB 3.11Å; Q566-Q570 PolarHBondContact O-N 3.4Å; V567-Q570 PolarHBondContact O-N 2.74Å; D568-Q570 PolarHBondContact O-N 3.15Å; Q570-R574 PolarHBondContact O-NE 3.4Å; Q570-R574 PolarHBondContact O-NH2 2.88Å
571	A	83.5	Confident	82.4	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-72.5	-47.1	173.4	0	0	0	0	0	112.7	F487 T541 V567 D568 L569 D573 R574	F487-A571 HydrophobicContact CD1-CB 3.9Å; F487-A571 HydrophobicContact CD2-CB 4.3Å; F487-A571 HydrophobicContact CE1-CB 3.72Å; F487-A571 HydrophobicContact CE2-CB 4.15Å; F487-A571 HydrophobicContact CG-CB 4.17Å; F487-A571 HydrophobicContact CZ-CB 3.86Å; F487-A571 WeakPolarHBondContact CZ-O 3.18Å; T541-A571 HydrophobicContact CG2-CB 4.09Å; V567-A571 PolarHBondContact O-N 3.39Å; D568-A571 WeakPolarHBondContact O-CB 3.14Å; D568-A571 PolarHBondContact O-N 2.85Å; D568-A571 VanDerWaalsContact O-N 3.15Å; L569-A571 PolarHBondContact O-N 3.25Å; A571-D573 PolarHBondContact O-N 2.72Å; A571-R574 VanDerWaalsContact O-CB 3.28Å; A571-R574 WeakPolarHBondContact O-CB 3.32Å; A571-R574 WeakPolarHBondContact O-CG 3.13Å; A571-R574 PolarHBondContact O-N 3.13Å
572	M	88.3	Confident	82.5	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-55.1	-42	173.6	-63.5	175.4	-158.8	0	0	111.8	K389 E391 L558 D568 L569 R574 A575 H576 V586	K389-M572 HydrophobicContact CD-CB 4.31Å; K389-M572 HydrophobicContact CD-SD 4.1Å; E391-M572 WeakPolarHBondContact OE1-CE 3.36Å; L558-M572 HydrophobicContact CD1-CE 3.84Å; D568-M572 WeakPolarHBondContact O-CG 3.49Å; D568-M572 PolarHBondContact O-N 2.75Å; L569-M572 HydrophobicContact CD2-CE 4.45Å; L569-M572 HydrophobicContact CD2-SD 4.14Å; L569-M572 PolarHBondContact O-N 3.42Å; M572-R574 PolarHBondContact O-N 3.36Å; M572-R574 VanDerWaalsContact O-N 3.13Å; M572-A575 PolarHBondContact O-N 2.99Å; M572-H576 PolarHBondContact O-N 3.25Å; M572-V586 HydrophobicContact CB-CG2 4.42Å; M572-V586 HydrophobicContact CE-CG1 4.07Å; M572-V586 HydrophobicContact CG-CG1 3.89Å; M572-V586 HydrophobicContact CG-CG2 4.02Å; M572-V586 HydrophobicContact SD-CG1 4.07Å; M572-V586 HydrophobicContact SD-CG2 4.14Å
573	D	83.8	Confident	82.8	Confident	10 Å²	10	39.3 Å²	39.3	5%	0.053	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	2.2	179.5	-81	10.7	0	0	0	114.2	M189 K379 K389 L569 A571 A575	M189-D573 HydrophobicContact CB-CB 4.42Å; K379-D573 IonicContact NZ-OD1 2.98Å; K379-D573 PolarHBondContact NZ-OD1 2.87Å; K379-D573 VanDerWaalsContact NZ-OD1 3.09Å; K379-D573 IonicContact NZ-OD2 3.81Å; K379-D573 PolarHBondContact NZ-OD2 3.01Å; K389-D573 IonicContact NZ-OD1 3.54Å; K389-D573 PolarHBondContact NZ-OD1 3.25Å; L569-D573 WeakPolarHBondContact O-CB 3.44Å; L569-D573 PolarHBondContact O-N 3.34Å; A571-D573 PolarHBondContact O-N 2.72Å; D573-A575 VanDerWaalsContact C-N 3.32Å
574	R	84.2	Confident	83.6	Confident	7 Å²	7	35.9 Å²	35.9	3%	0.026	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-34.4	162.6	-63.6	-44.5	93.1	-159.2	4.2	111.7	L485 F487 G544 G547 I548 L550 A551 Q570 A571 M572 R577	L485-R574 HydrophobicContact CD1-CB 4.35Å; F487-R574 HydrophobicContact CZ-CB 4.37Å; F487-R574 HydrophobicContact CZ-CG 4.15Å; G544-R574 VanDerWaalsContact O-CD 3.23Å; G544-R574 WeakPolarHBondContact O-CD 3.31Å; G544-R574 WeakPolarHBondContact O-CG 3.49Å; G547-R574 VanDerWaalsContact C-NH1 3.29Å; G547-R574 PolarHBondContact O-NH1 2.75Å; I548-R574 HydrophobicContact CG1-CG 4.08Å; I548-R574 WeakPolarHBondContact O-CD 3.48Å; I548-R574 PolarHBondContact O-NH1 2.9Å; L550-R574 CarbonylContact C-O 3.59Å; L550-R574 VanDerWaalsContact C-O 3.3Å; L550-R574 HydrophobicContact CB-CB 4.49Å; L550-R574 PolarHBondContact N-O 3.2Å; L550-R574 VanDerWaalsContact N-O 3.1Å; A551-R574 PolarHBondContact N-O 3.21Å; Q570-R574 PolarHBondContact O-NE 3.4Å; Q570-R574 PolarHBondContact O-NH2 2.88Å; A571-R574 VanDerWaalsContact O-CB 3.28Å; A571-R574 WeakPolarHBondContact O-CB 3.32Å; A571-R574 WeakPolarHBondContact O-CG 3.13Å; A571-R574 PolarHBondContact O-N 3.13Å; M572-R574 PolarHBondContact O-N 3.36Å; M572-R574 VanDerWaalsContact O-N 3.13Å; R574-R577 VanDerWaalsContact O-CD 3.25Å; R574-R577 WeakPolarHBondContact O-CD 3.28Å
575	A	87.8	Confident	84.5	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-43.5	176.9	0	0	0	0	0	112.1	L485 A553 V556 M572 D573 R577 V584	L485-A575 HydrophobicContact CD1-CB 4.04Å; A553-A575 WeakPolarHBondContact O-CB 3.42Å; V556-A575 HydrophobicContact CG2-CB 3.67Å; M572-A575 PolarHBondContact O-N 2.99Å; D573-A575 VanDerWaalsContact C-N 3.32Å; A575-R577 VanDerWaalsContact C-N 3.27Å; A575-R577 PolarHBondContact O-N 3.04Å; A575-V584 HydrophobicContact CB-CG1 4.49Å
576	H	88.7	Confident	85.3	Confident	11 Å²	11	36.1 Å²	36.1	5%	0.051	18%	0.182	C	C	.	.	S	Bend	trans	-80.1	69.7	179.6	-166.2	-116	0	0	0	112.5	K379 L387 K389 M572 V584	K379-H576 PolarHBondContact NZ-O 3.15Å; L387-H576 PolarHBondContact O-NE2 3.34Å; K389-H576 HydrophobicContact CB-CB 4.4Å; K389-H576 HydrophobicContact CD-CB 4.1Å; K389-H576 HydrophobicContact CG-CB 4.5Å; K389-H576 PolarHBondContact N-NE2 3.36Å; K389-H576 PolarHBondContact NZ-ND1 3.21Å; K389-H576 VanDerWaalsContact NZ-ND1 3.12Å; M572-H576 PolarHBondContact O-N 3.25Å; H576-V584 HydrophobicContact CB-CG1 4.41Å; H576-V584 HydrophobicContact CB-CG2 4.3Å
577	R	82.9	Confident	86.2	Confident	32 Å²	32	33.9 Å²	33.9	12%	0.121	17%	0.171	C	C	.	.	S	Bend	trans	-145.5	164.6	-178	59.2	177.5	-72.7	166.7	-5.7	112	I548 N549 A551 R574 A575 G579 Q580	I548-R577 PolarHBondContact O-NH1 2.69Å; I548-R577 VanDerWaalsContact O-NH1 3.08Å; N549-R577 VanDerWaalsContact CG-CZ 3.41Å; N549-R577 VanDerWaalsContact OD1-CD 3.31Å; N549-R577 WeakPolarHBondContact OD1-CD 3.28Å; N549-R577 VanDerWaalsContact OD1-CZ 3.29Å; N549-R577 PolarHBondContact OD1-NE 2.93Å; A551-R577 HydrophobicContact CB-CG 3.92Å; R574-R577 VanDerWaalsContact O-CD 3.25Å; R574-R577 WeakPolarHBondContact O-CD 3.28Å; A575-R577 VanDerWaalsContact C-N 3.27Å; A575-R577 PolarHBondContact O-N 3.04Å; R577-G579 PolarHBondContact O-N 3.32Å; R577-Q580 WeakPolarHBondContact O-CB 3.01Å; R577-Q580 PolarHBondContact O-N 3.17Å; R577-Q580 VanDerWaalsContact O-N 3.15Å
578	I	77.6	Confident	87.1	Confident	42 Å²	42	33.4 Å²	33.4	22%	0.215	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	131.7	177	-61	178	0	0	0	110	Y165 L191 E383	Y165-I578 HydrophobicContact CE1-CD1 4.46Å; Y165-I578 WeakPolarHBondContact OH-CD1 3.36Å; L191-I578 HydrophobicContact CD2-CD1 4.19Å; E383-I578 HydrophobicContact CG-CD1 4.27Å; E383-I578 HydrophobicContact CG-CG1 4.23Å
579	G	80.2	Confident	87.5	Confident	57 Å²	57	33.4 Å²	33.4	59%	0.588	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	115.2	-27.2	-168.4	0	0	0	0	0	112.6	R577	R577-G579 PolarHBondContact O-N 3.32Å
580	Q	85.5	Confident	88.1	Confident	25 Å²	25	31.1 Å²	31.1	12%	0.117	16%	0.155	C	C	.	.			trans	-70	141.5	172.6	179.2	58.4	-89	0	0	111.3	L386 A551 A553 R577 K582 V584	L386-Q580 HydrophobicContact CD1-CB 4.18Å; A551-Q580 PolarHBondContact O-NE2 2.97Å; A553-Q580 PolarHBondContact O-NE2 2.83Å; R577-Q580 WeakPolarHBondContact O-CB 3.01Å; R577-Q580 PolarHBondContact O-N 3.17Å; R577-Q580 VanDerWaalsContact O-N 3.15Å; Q580-K582 VanDerWaalsContact CG-O 3.27Å; Q580-K582 WeakPolarHBondContact CG-O 3.46Å; Q580-V584 HydrophobicContact CG-CG2 3.75Å
581	Q	85.3	Confident	88.7	Confident	177 Å²	177	29.2 Å²	29.2	83%	0.827	15%	0.146	S	C	*	.			trans	-120	-25.9	177.2	-65	-177.8	-12.5	0	0	113.2
582	K	89.9	Confident	88.9	Confident	88 Å²	88	31.4 Å²	31.4	38%	0.383	16%	0.156	S	C	.	.	S	Bend	trans	-87.3	157.3	176.4	-69.7	-171.2	178.7	-171.3	0	111.9	G481 D554 Q580 V584	G481-K582 PolarHBondContact O-NZ 3.45Å; D554-K582 HydrophobicContact CB-CB 3.68Å; D554-K582 HydrophobicContact CB-CD 3.73Å; D554-K582 HydrophobicContact CB-CG 4.36Å; D554-K582 VanDerWaalsContact CG-CD 3.41Å; D554-K582 IonicContact OD1-NZ 3.59Å; D554-K582 WeakPolarHBondContact OD2-CD 3.49Å; D554-K582 IonicContact OD2-NZ 2.67Å; D554-K582 PolarHBondContact OD2-NZ 2.9Å; Q580-K582 VanDerWaalsContact CG-O 3.27Å; Q580-K582 WeakPolarHBondContact CG-O 3.46Å; K582-V584 PolarHBondContact O-N 3.27Å
583	Q	90.9	Very high	88.7	Confident	54 Å²	54	33.2 Å²	33.2	25%	0.252	17%	0.165	S	C	.	.			trans	-64.2	111.1	170.2	171.6	58.8	74.4	0	0	110.8	P388 R585	P388-Q583 PolarHBondContact O-NE2 3.1Å; P388-Q583 PolarHBondContact O-OE1 3.44Å; Q583-R585 PolarHBondContact O-N 3.25Å
584	V	93.9	Very high	88.9	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.006	16%	0.163	C	C	.	.			trans	-68.3	128.1	177	-177.9	0	0	0	0	110.6	K389 K390 D554 V556 A575 H576 Q580 K582 V586	K389-V584 HydrophobicContact CB-CB 4.19Å; K389-V584 HydrophobicContact CB-CG1 4.34Å; K390-V584 PolarHBondContact N-O 2.91Å; D554-V584 VanDerWaalsContact O-CA 3.29Å; D554-V584 WeakPolarHBondContact O-CA 3.17Å; V556-V584 HydrophobicContact CG2-CG1 4.49Å; A575-V584 HydrophobicContact CB-CG1 4.49Å; H576-V584 HydrophobicContact CB-CG1 4.41Å; H576-V584 HydrophobicContact CB-CG2 4.3Å; Q580-V584 HydrophobicContact CG-CG2 3.75Å; K582-V584 PolarHBondContact O-N 3.27Å; V584-V586 HydrophobicContact CG1-CG2 4.26Å
585	R	94.6	Very high	89	Confident	80 Å²	80	32.4 Å²	32.4	30%	0.302	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	129.6	172	-57.6	-176.7	-171.1	151.5	0	109.4	D554 V555 V556 Q583 Y587	D554-R585 PolarHBondContact O-N 3.02Å; V555-R585 WeakPolarHBondContact CA-O 3.45Å; V556-R585 PolarHBondContact N-O 3.24Å; Q583-R585 PolarHBondContact O-N 3.25Å; R585-Y587 HydrophobicContact CB-CE2 4.13Å; R585-Y587 WeakPolarHBondContact CD-OH 3.31Å
586	V	95.3	Very high	89	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	118.7	177.2	-173.2	0	0	0	0	108.6	K389 K390 E391 I392 V556 L558 M572 V584	K389-V586 HydrophobicContact CD-CG2 4.39Å; K390-V586 PolarHBondContact O-N 2.96Å; E391-V586 CarbonylContact C-O 3.18Å; E391-V586 WeakPolarHBondContact CA-O 3.35Å; E391-V586 HydrophobicContact CB-CB 4.28Å; E391-V586 HydrophobicContact CG-CB 4.28Å; E391-V586 HydrophobicContact CG-CG1 4.31Å; I392-V586 PolarHBondContact N-O 3.08Å; V556-V586 HydrophobicContact CB-CG1 4.37Å; V556-V586 HydrophobicContact CB-CG2 4.3Å; V556-V586 HydrophobicContact CG1-CG1 4.34Å; V556-V586 CarbonylContact O-C 3.25Å; V556-V586 VanDerWaalsContact O-CA 3.3Å; V556-V586 WeakPolarHBondContact O-CA 3.4Å; L558-V586 HydrophobicContact CD1-CG1 4.37Å; L558-V586 HydrophobicContact CG-CG1 4.37Å; M572-V586 HydrophobicContact CB-CG2 4.42Å; M572-V586 HydrophobicContact CE-CG1 4.07Å; M572-V586 HydrophobicContact CG-CG1 3.89Å; M572-V586 HydrophobicContact CG-CG2 4.02Å; M572-V586 HydrophobicContact SD-CG1 4.07Å; M572-V586 HydrophobicContact SD-CG2 4.14Å; V584-V586 HydrophobicContact CG1-CG2 4.26Å
587	Y	95.5	Very high	89	Confident	6 Å²	6	33.8 Å²	33.8	2%	0.024	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	113.9	176.9	-62	-65	0	0	0	109.1	I392 I394 L473 M477 V555 V556 I557 L558 R585 L660	I392-Y587 HydrophobicContact CB-CD1 4.1Å; I392-Y587 HydrophobicContact CB-CE1 4.37Å; I392-Y587 HydrophobicContact CD1-CD1 4.34Å; I392-Y587 HydrophobicContact CD1-CE1 3.77Å; I392-Y587 WeakPolarHBondContact O-CA 3.47Å; I394-Y587 HydrophobicContact CD1-CD1 3.69Å; I394-Y587 HydrophobicContact CD1-CG 4.11Å; I394-Y587 HydrophobicContact CG1-CD1 4.41Å; L473-Y587 HydrophobicContact CD1-CE2 4.39Å; L473-Y587 HydrophobicContact CD2-CD2 3.99Å; L473-Y587 HydrophobicContact CD2-CE2 4.4Å; L473-Y587 HydrophobicContact CD2-CG 4.17Å; M477-Y587 HydrophobicContact SD-CE2 4.04Å; V555-Y587 HydrophobicContact CG1-CD2 3.7Å; V555-Y587 HydrophobicContact CG1-CE2 3.69Å; V556-Y587 PolarHBondContact O-N 3.1Å; I557-Y587 CarbonylContact C-O 3.58Å; I557-Y587 WeakPolarHBondContact CA-O 3.39Å; I557-Y587 HydrophobicContact CG1-CD2 4.38Å; L558-Y587 PolarHBondContact N-O 3.06Å; R585-Y587 HydrophobicContact CB-CE2 4.13Å; R585-Y587 WeakPolarHBondContact CD-OH 3.31Å; Y587-L660 HydrophobicContact CD1-CD2 3.86Å; Y587-L660 HydrophobicContact CE1-CD2 3.42Å; Y587-L660 VanDerWaalsContact CE1-CD2 3.42Å
588	R	94.9	Very high	89	Confident	20 Å²	20	33.9 Å²	33.9	8%	0.075	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	115.8	176.6	-177.9	-177	-62.7	-89.1	2.1	109.2	E391 I392 I394 S561 D568 I590	E391-R588 IonicContact OE1-CZ 2.85Å; E391-R588 IonicContact OE1-NE 2.71Å; E391-R588 PolarHBondContact OE1-NE 2.89Å; E391-R588 IonicContact OE1-NH2 2.81Å; E391-R588 PolarHBondContact OE1-NH2 2.96Å; I392-R588 PolarHBondContact O-N 3.24Å; I394-R588 PolarHBondContact N-O 3.12Å; S561-R588 PolarHBondContact OG-NH1 3.35Å; D568-R588 IonicContact OD2-CZ 2.84Å; D568-R588 IonicContact OD2-NH1 3.83Å; D568-R588 PolarHBondContact OD2-NH1 2.81Å; D568-R588 IonicContact OD2-NH2 2.69Å; R588-I590 HydrophobicContact CG-CG1 4.14Å
589	F	95.3	Very high	89.4	Confident	1 Å²	1	32.1 Å²	32.1	0%	0.004	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	129.2	175.3	-68.1	-3.3	0	0	0	110.2	I394 K466 V469 L470 L473 I557 L558 Y559	I394-F589 HydrophobicContact CB-CD1 4.15Å; I394-F589 HydrophobicContact CD1-CD1 4.34Å; I394-F589 HydrophobicContact CD1-CE1 3.98Å; K466-F589 HydrophobicContact CB-CD2 3.99Å; K466-F589 HydrophobicContact CB-CE2 4.49Å; K466-F589 HydrophobicContact CD-CB 4.2Å; K466-F589 HydrophobicContact CD-CD2 4.36Å; K466-F589 HydrophobicContact CG-CB 4.34Å; K466-F589 HydrophobicContact CG-CD2 4.2Å; K466-F589 WeakPolarHBondContact O-CE2 3.46Å; V469-F589 HydrophobicContact CG1-CE1 3.86Å; V469-F589 HydrophobicContact CG1-CZ 3.9Å; L470-F589 HydrophobicContact CB-CE2 4.09Å; L470-F589 HydrophobicContact CB-CZ 4.28Å; L470-F589 HydrophobicContact CD1-CE2 4.2Å; L470-F589 HydrophobicContact CD1-CZ 4.09Å; L473-F589 HydrophobicContact CD2-CE1 4.25Å; L473-F589 HydrophobicContact CD2-CZ 4.37Å; I557-F589 HydrophobicContact CG2-CD1 4.38Å; I557-F589 HydrophobicContact CG2-CD2 4.37Å; I557-F589 HydrophobicContact CG2-CE1 4.01Å; I557-F589 HydrophobicContact CG2-CE2 4.01Å; I557-F589 HydrophobicContact CG2-CZ 3.82Å; L558-F589 PolarHBondContact O-N 3.34Å; Y559-F589 AromaticContact CD2-CD2 3.89Å; Y559-F589 HydrophobicContact CD2-CD2 3.89Å; Y559-F589 HydrophobicContact CD2-CE2 4.04Å; Y559-F589 HydrophobicContact CE2-CD2 4.28Å; Y559-F589 HydrophobicContact CE2-CE2 4.34Å; Y559-F589 HydrophobicContact CG-CD2 4.44Å
590	I	92.9	Very high	89.7	Confident	2 Å²	2	29.8 Å²	29.8	1%	0.01	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	123.2	179.4	-50.2	-179	0	0	0	108.2	K393 I394 Y395 V396 R588 E592 E597 V600	K393-I590 HydrophobicContact CB-CD1 3.88Å; K393-I590 HydrophobicContact CD-CD1 4.07Å; K393-I590 HydrophobicContact CG-CD1 4.06Å; I394-I590 PolarHBondContact O-N 3.12Å; Y395-I590 CarbonylContact C-O 3.57Å; Y395-I590 WeakPolarHBondContact CA-O 3.44Å; Y395-I590 HydrophobicContact CD1-CB 4.37Å; Y395-I590 HydrophobicContact CD1-CG2 4.43Å; Y395-I590 HydrophobicContact CE1-CD1 4.23Å; Y395-I590 HydrophobicContact CE1-CG2 4.47Å; V396-I590 PolarHBondContact N-O 2.87Å; R588-I590 HydrophobicContact CG-CG1 4.14Å; I590-E592 PolarHBondContact O-N 2.95Å; I590-E597 HydrophobicContact CG2-CB 3.98Å; I590-E597 HydrophobicContact CG2-CG 4.42Å; I590-V600 HydrophobicContact CD1-CB 4.23Å; I590-V600 HydrophobicContact CD1-CG1 3.83Å; I590-V600 HydrophobicContact CD1-CG2 4.21Å; I590-V600 HydrophobicContact CG1-CG2 4.26Å
591	T	91.4	Very high	89.6	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.006	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	113.3	175.4	-42	0	0	0	0	110	V396 L398 C439 K466 T594 E596	V396-T591 CarbonylContact O-C 3.51Å; V396-T591 VanDerWaalsContact O-CA 3.29Å; V396-T591 WeakPolarHBondContact O-CA 3.23Å; L398-T591 HydrophobicContact CD2-CG2 3.67Å; L398-T591 HydrophobicContact CG-CG2 3.97Å; C439-T591 HydrophobicContact CB-CG2 4.48Å; C439-T591 WeakPolarHBondContact CB-OG1 3.17Å; K466-T591 WeakPolarHBondContact CE-OG1 3.35Å; T591-T594 HydrophobicContact CG2-CG2 3.66Å; T591-T594 PolarHBondContact O-OG1 3.36Å; T591-E596 WeakPolarHBondContact CB-OE2 3.36Å; T591-E596 PolarHBondContact N-OE2 2.74Å; T591-E596 PolarHBondContact OG1-OE2 3.02Å
592	E	87.3	Confident	89.3	Confident	46 Å²	46	25 Å²	25	22%	0.215	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	145.8	-176.6	-68.7	-163.2	138.9	0	0	111.8	Y395 V396 I590 T594 K666	Y395-E592 VanDerWaalsContact CB-OE1 3.28Å; Y395-E592 WeakPolarHBondContact CB-OE1 3.32Å; Y395-E592 HydrophobicContact CD1-CG 4.02Å; Y395-E592 HydrophobicContact CG-CG 4.33Å; V396-E592 PolarHBondContact O-N 2.64Å; I590-E592 PolarHBondContact O-N 2.95Å; E592-T594 WeakPolarHBondContact O-CG2 3.26Å; E592-T594 PolarHBondContact O-N 2.94Å; E592-K666 IonicContact OE1-NZ 3.57Å; E592-K666 PolarHBondContact OE1-NZ 3.23Å
593	N	84	Confident	88.7	Confident	37 Å²	37	21.2 Å²	21.2	20%	0.198	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.9	14.7	173.4	-50.7	-56.5	0	0	0	114.7	E597 G639 H642 E650	N593-E597 PolarHBondContact N-OE2 2.82Å; N593-G639 WeakPolarHBondContact O-CA 3.46Å; N593-H642 HydrophobicContact CB-CB 3.89Å; N593-H642 WeakPolarHBondContact CB-ND1 3.41Å; N593-H642 PolarHBondContact ND2-CE1 3.11Å; N593-E650 PolarHBondContact ND2-OE2 3.48Å
594	T	88.3	Confident	88.2	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	9%	0.091	C	C	.	.	S	Bend	trans	-110.7	-178.7	-179.9	73.3	0	0	0	0	113.4	L398 Y406 C439 T591 E592 E596	L398-T594 HydrophobicContact CD1-CG2 3.95Å; L398-T594 HydrophobicContact CD2-CG2 4.09Å; L398-T594 HydrophobicContact CG-CG2 4.1Å; Y406-T594 HydrophobicContact CE2-CG2 4.06Å; Y406-T594 WeakPolarHBondContact OH-CA 3.35Å; C439-T594 PolarHBondContact SG-OG1 2.95Å; T591-T594 HydrophobicContact CG2-CG2 3.66Å; T591-T594 PolarHBondContact O-OG1 3.36Å; E592-T594 WeakPolarHBondContact O-CG2 3.26Å; E592-T594 PolarHBondContact O-N 2.94Å; T594-E596 PolarHBondContact O-N 2.82Å; T594-E596 PolarHBondContact OG1-N 3.43Å; T594-E596 VanDerWaalsContact OG1-N 3.15Å
595	V	87.4	Confident	87.4	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-57.9	-25.6	168.6	-65.1	0	0	0	0	113.9	Y406 L432 L435 R436 I599 I635 I636	Y406-V595 PolarHBondContact OH-N 3.47Å; L432-V595 HydrophobicContact CD1-CB 4.03Å; L432-V595 HydrophobicContact CD1-CG1 4.02Å; L432-V595 HydrophobicContact CD1-CG2 4.38Å; L435-V595 HydrophobicContact CB-CG1 4.37Å; L435-V595 HydrophobicContact CB-CG2 3.83Å; L435-V595 HydrophobicContact CD1-CG1 3.83Å; R436-V595 HydrophobicContact CG-CG2 4.22Å; V595-I599 VanDerWaalsContact O-CG1 3.26Å; V595-I599 WeakPolarHBondContact O-CG1 3.19Å; V595-I599 PolarHBondContact O-N 3.12Å; V595-I635 HydrophobicContact CB-CG2 3.72Å; V595-I635 HydrophobicContact CG1-CG2 3.78Å; V595-I636 HydrophobicContact CG1-CG1 4.44Å
596	E	88.1	Confident	86.3	Confident	9 Å²	9	20.5 Å²	20.5	4%	0.042	9%	0.094	C	C	.	.	H	α-helix	trans	-69.3	-41.2	-176.5	-70.3	-163.5	132.5	0	0	113.4	C439 K466 T591 T594 R598 I599 V600	C439-E596 VanDerWaalsContact CB-CD 3.46Å; C439-E596 HydrophobicContact CB-CG 3.81Å; C439-E596 WeakPolarHBondContact CB-OE2 3.4Å; K466-E596 WeakPolarHBondContact CE-OE2 3.32Å; K466-E596 IonicContact NZ-OE1 2.66Å; K466-E596 PolarHBondContact NZ-OE1 3.3Å; K466-E596 IonicContact NZ-OE2 2.92Å; K466-E596 PolarHBondContact NZ-OE2 3.42Å; T591-E596 WeakPolarHBondContact CB-OE2 3.36Å; T591-E596 PolarHBondContact N-OE2 2.74Å; T591-E596 PolarHBondContact OG1-OE2 3.02Å; T594-E596 PolarHBondContact O-N 2.82Å; T594-E596 PolarHBondContact OG1-N 3.43Å; T594-E596 VanDerWaalsContact OG1-N 3.15Å; E596-R598 VanDerWaalsContact C-N 3.28Å; E596-R598 PolarHBondContact O-N 2.58Å; E596-I599 WeakPolarHBondContact O-CB 3.21Å; E596-I599 PolarHBondContact O-N 3.39Å; E596-V600 PolarHBondContact O-N 2.7Å
597	E	87.6	Confident	85.3	Confident	31 Å²	31	23.4 Å²	23.4	15%	0.145	11%	0.109	C	C	.	.	H	α-helix	trans	-57.5	-44.6	178.7	-175.3	163.2	-145.7	0	0	111	I590 N593 I599 V600 E601	I590-E597 HydrophobicContact CG2-CB 3.98Å; I590-E597 HydrophobicContact CG2-CG 4.42Å; N593-E597 PolarHBondContact N-OE2 2.82Å; E597-I599 VanDerWaalsContact C-N 3.3Å; E597-I599 PolarHBondContact O-N 3.18Å; E597-V600 PolarHBondContact O-N 3.28Å; E597-E601 WeakPolarHBondContact O-CG 3.43Å; E597-E601 PolarHBondContact O-N 3.01Å
598	R	83.4	Confident	84.2	Confident	35 Å²	35	27 Å²	27	13%	0.132	12%	0.123	C	C	.	.	H	α-helix	trans	-68.4	-24.1	176.2	-60.8	-49.7	-161.7	154.3	-2.9	114.2	E596 E601 R602 I635 H638 M687	E596-R598 VanDerWaalsContact C-N 3.28Å; E596-R598 PolarHBondContact O-N 2.58Å; R598-E601 WeakPolarHBondContact CD-OE2 3.24Å; R598-E601 IonicContact CZ-OE2 2.76Å; R598-E601 IonicContact NE-OE2 3.2Å; R598-E601 IonicContact NH1-OE1 3.76Å; R598-E601 IonicContact NH1-OE2 2.78Å; R598-E601 PolarHBondContact NH1-OE2 3.32Å; R598-R602 PolarHBondContact O-N 3.14Å; R598-I635 HydrophobicContact CB-CB 4.42Å; R598-I635 HydrophobicContact CB-CG1 3.99Å; R598-I635 HydrophobicContact CB-CG2 4.13Å; R598-H638 HydrophobicContact CG-CB 4.17Å; R598-H638 PolarHBondContact NE-CD2 3.19Å; R598-H638 VanDerWaalsContact NE-CD2 3.31Å; R598-H638 PolarHBondContact NE-CE1 3.32Å; R598-H638 PolarHBondContact NE-ND1 2.83Å; R598-H638 PolarHBondContact NE-NE2 2.81Å; R598-H638 PolarHBondContact NH2-CD2 3.38Å; R598-H638 PolarHBondContact NH2-NE2 3.45Å; R598-M687 PolarHBondContact NH1-SD 3.36Å
599	I	85.1	Confident	82.8	Confident	5 Å²	5	28 Å²	28	3%	0.026	13%	0.129	C	C	.	.	H	α-helix	trans	-71	-46.3	171.6	-66.6	168.2	0	0	0	109.7	R436 W563 V595 E596 E597 R602 A603	R436-I599 HydrophobicContact CG-CD1 4.17Å; W563-I599 HydrophobicContact CD2-CG2 4.26Å; W563-I599 HydrophobicContact CE3-CG1 4.14Å; W563-I599 HydrophobicContact CE3-CG2 4.05Å; W563-I599 HydrophobicContact CH2-CD1 3.61Å; W563-I599 HydrophobicContact CH2-CG1 3.45Å; W563-I599 VanDerWaalsContact CH2-CG1 3.45Å; W563-I599 HydrophobicContact CZ2-CD1 3.57Å; W563-I599 HydrophobicContact CZ2-CG1 3.94Å; W563-I599 HydrophobicContact CZ3-CB 4.42Å; W563-I599 HydrophobicContact CZ3-CD1 4.18Å; W563-I599 HydrophobicContact CZ3-CG1 3.57Å; W563-I599 HydrophobicContact CZ3-CG2 4.32Å; V595-I599 VanDerWaalsContact O-CG1 3.26Å; V595-I599 WeakPolarHBondContact O-CG1 3.19Å; V595-I599 PolarHBondContact O-N 3.12Å; E596-I599 WeakPolarHBondContact O-CB 3.21Å; E596-I599 PolarHBondContact O-N 3.39Å; E597-I599 VanDerWaalsContact C-N 3.3Å; E597-I599 PolarHBondContact O-N 3.18Å; I599-R602 PolarHBondContact O-N 2.93Å; I599-A603 WeakPolarHBondContact O-CB 3.36Å; I599-A603 PolarHBondContact O-N 2.86Å
600	V	86.2	Confident	81.3	Confident	7 Å²	7	28.8 Å²	28.8	4%	0.042	13%	0.134	C	C	.	.	H	α-helix	trans	-66.7	-45.1	-178.6	177	0	0	0	0	111.4	I590 E596 E597 R602 A603 E604	I590-V600 HydrophobicContact CD1-CB 4.23Å; I590-V600 HydrophobicContact CD1-CG1 3.83Å; I590-V600 HydrophobicContact CD1-CG2 4.21Å; I590-V600 HydrophobicContact CG1-CG2 4.26Å; E596-V600 PolarHBondContact O-N 2.7Å; E597-V600 PolarHBondContact O-N 3.28Å; V600-R602 VanDerWaalsContact C-N 3.32Å; V600-R602 PolarHBondContact O-N 2.78Å; V600-A603 WeakPolarHBondContact O-CB 3.2Å; V600-A603 PolarHBondContact O-N 3.01Å; V600-A603 VanDerWaalsContact O-N 3.14Å; V600-E604 VanDerWaalsContact CG1-OE1 3.25Å; V600-E604 WeakPolarHBondContact CG1-OE1 3.27Å; V600-E604 PolarHBondContact O-N 2.85Å
601	E	83.4	Confident	79.9	Confident	46 Å²	46	30.5 Å²	30.5	22%	0.215	15%	0.145	C	C	.	.	H	α-helix	trans	-54.5	-45.2	174	-74	-177	140.7	0	0	112.6	E597 R598 E604 M605 M670	E597-E601 WeakPolarHBondContact O-CG 3.43Å; E597-E601 PolarHBondContact O-N 3.01Å; R598-E601 WeakPolarHBondContact CD-OE2 3.24Å; R598-E601 IonicContact CZ-OE2 2.76Å; R598-E601 IonicContact NE-OE2 3.2Å; R598-E601 IonicContact NH1-OE1 3.76Å; R598-E601 IonicContact NH1-OE2 2.78Å; R598-E601 PolarHBondContact NH1-OE2 3.32Å; E601-E604 PolarHBondContact O-N 2.98Å; E601-M605 HydrophobicContact CB-CE 4.5Å; E601-M605 WeakPolarHBondContact O-CG 3.15Å; E601-M605 PolarHBondContact O-N 3.06Å; E601-M670 HydrophobicContact CG-CE 4.09Å
602	R	78.8	Confident	78.5	Confident	56 Å²	56	31.4 Å²	31.4	21%	0.211	15%	0.15	C	C	.	.	H	α-helix	trans	-72	-33.2	178.3	-72.6	-166.6	-175.2	152.4	15	112.8	R598 I599 V600 E604 M605 K606 E631 S634 I635	R598-R602 PolarHBondContact O-N 3.14Å; I599-R602 PolarHBondContact O-N 2.93Å; V600-R602 VanDerWaalsContact C-N 3.32Å; V600-R602 PolarHBondContact O-N 2.78Å; R602-E604 VanDerWaalsContact C-N 3.33Å; R602-M605 HydrophobicContact CG-CE 3.88Å; R602-K606 WeakPolarHBondContact O-CB 3.47Å; R602-K606 WeakPolarHBondContact O-CG 3.39Å; R602-K606 PolarHBondContact O-N 3.13Å; R602-E631 WeakPolarHBondContact CD-OE1 3.22Å; R602-E631 IonicContact CZ-OE1 3.68Å; R602-E631 IonicContact NE-OE1 3.45Å; R602-E631 VanDerWaalsContact NH1-CG 3.25Å; R602-E631 PolarHBondContact NH1-O 3.28Å; R602-E631 IonicContact NH1-OE1 2.78Å; R602-E631 PolarHBondContact NH1-OE1 2.7Å; R602-E631 PolarHBondContact NH2-O 3.41Å; R602-S634 PolarHBondContact NH2-OG 3.49Å; R602-I635 VanDerWaalsContact NH1-CD1 3.3Å
603	A	79.3	Confident	77.1	Confident	8 Å²	8	29.4 Å²	29.4	7%	0.066	14%	0.141	C	C	.	.	H	α-helix	trans	-63.2	-40.5	172.3	0	0	0	0	0	111.1	P565 I599 V600 K606 L607	P565-A603 HydrophobicContact CB-CB 4.17Å; P565-A603 HydrophobicContact CG-CB 4.48Å; P565-A603 WeakPolarHBondContact CG-O 3.49Å; I599-A603 WeakPolarHBondContact O-CB 3.36Å; I599-A603 PolarHBondContact O-N 2.86Å; V600-A603 WeakPolarHBondContact O-CB 3.2Å; V600-A603 PolarHBondContact O-N 3.01Å; V600-A603 VanDerWaalsContact O-N 3.14Å; A603-K606 PolarHBondContact O-N 3.09Å; A603-L607 WeakPolarHBondContact O-CB 3.27Å; A603-L607 PolarHBondContact O-N 2.79Å
604	E	79.9	Confident	75.9	Confident	39 Å²	39	30 Å²	30	18%	0.182	14%	0.144	C	C	.	.	H	α-helix	trans	-71.6	-41.1	176.4	-74.2	179.8	-121.5	0	0	113.4	K393 V600 E601 R602 K606 L607 R608 L674	K393-E604 WeakPolarHBondContact CE-OE1 3.39Å; K393-E604 IonicContact NZ-OE1 2.83Å; K393-E604 PolarHBondContact NZ-OE1 3.43Å; K393-E604 IonicContact NZ-OE2 2.75Å; K393-E604 PolarHBondContact NZ-OE2 3.3Å; V600-E604 VanDerWaalsContact CG1-OE1 3.25Å; V600-E604 WeakPolarHBondContact CG1-OE1 3.27Å; V600-E604 PolarHBondContact O-N 2.85Å; E601-E604 PolarHBondContact O-N 2.98Å; R602-E604 VanDerWaalsContact C-N 3.33Å; E604-K606 VanDerWaalsContact C-N 3.3Å; E604-K606 PolarHBondContact O-N 3.19Å; E604-L607 PolarHBondContact O-N 2.99Å; E604-R608 WeakPolarHBondContact O-CB 3.41Å; E604-R608 PolarHBondContact O-N 2.9Å; E604-L674 HydrophobicContact CB-CD1 4.07Å
605	M	75.8	Confident	74.3	Confident	38 Å²	38	37.6 Å²	37.6	19%	0.187	18%	0.179	C	C	.	.	H	α-helix	trans	-60.9	-40.3	172.7	-73.8	-174	-71	0	0	111.5	E601 R602 R608 L609 L674 F685	E601-M605 HydrophobicContact CB-CE 4.5Å; E601-M605 WeakPolarHBondContact O-CG 3.15Å; E601-M605 PolarHBondContact O-N 3.06Å; R602-M605 HydrophobicContact CG-CE 3.88Å; M605-R608 PolarHBondContact O-N 3.06Å; M605-L609 WeakPolarHBondContact O-CB 3.47Å; M605-L609 VanDerWaalsContact O-CG 3.31Å; M605-L609 WeakPolarHBondContact O-CG 3.34Å; M605-L609 PolarHBondContact O-N 3.04Å; M605-L674 HydrophobicContact CG-CD2 3.9Å; M605-F685 HydrophobicContact SD-CD1 4.46Å
606	K	73.4	Confident	72.4	Confident	44 Å²	44	40.7 Å²	40.7	19%	0.191	19%	0.194	C	C	.	.	H	α-helix	trans	-63.5	-46.3	172.6	-76.3	-177.1	175.9	-174.4	0	112.2	R602 A603 E604 R608 L609 D610 N625	R602-K606 WeakPolarHBondContact O-CB 3.47Å; R602-K606 WeakPolarHBondContact O-CG 3.39Å; R602-K606 PolarHBondContact O-N 3.13Å; A603-K606 PolarHBondContact O-N 3.09Å; E604-K606 VanDerWaalsContact C-N 3.3Å; E604-K606 PolarHBondContact O-N 3.19Å; K606-R608 VanDerWaalsContact C-N 3.29Å; K606-R608 PolarHBondContact O-N 3.19Å; K606-L609 PolarHBondContact O-N 3.38Å; K606-D610 WeakPolarHBondContact O-CB 3.28Å; K606-D610 PolarHBondContact O-N 3.11Å; K606-N625 PolarHBondContact NZ-O 3.11Å; K606-N625 VanDerWaalsContact NZ-O 3.08Å
607	L	74	Confident	70.4	Confident	61 Å²	61	40.7 Å²	40.7	32%	0.319	20%	0.196	S	C	.	.	H	α-helix	trans	-62.8	-35.1	176.8	-176.5	61.5	0	0	0	112.5	P565 L569 A603 E604 S611	P565-L607 HydrophobicContact CB-CB 4.14Å; P565-L607 HydrophobicContact CG-CB 4.09Å; L569-L607 HydrophobicContact CD1-CD1 3.6Å; L569-L607 HydrophobicContact CD1-CD2 3.93Å; L569-L607 HydrophobicContact CD1-CG 4.44Å; A603-L607 WeakPolarHBondContact O-CB 3.27Å; A603-L607 PolarHBondContact O-N 2.79Å; E604-L607 PolarHBondContact O-N 2.99Å; L607-S611 WeakPolarHBondContact O-CB 3.45Å; L607-S611 PolarHBondContact O-N 3.48Å
608	R	71.9	Confident	68.5	Low	81 Å²	81	42.1 Å²	42.1	31%	0.306	20%	0.2	S	C	.	.	H	α-helix	trans	-69.4	-45.3	176	-173.1	56.8	170.9	149.5	0.1	111.1	E604 M605 K606 S611 I612 L674 L682	E604-R608 WeakPolarHBondContact O-CB 3.41Å; E604-R608 PolarHBondContact O-N 2.9Å; M605-R608 PolarHBondContact O-N 3.06Å; K606-R608 VanDerWaalsContact C-N 3.29Å; K606-R608 PolarHBondContact O-N 3.19Å; R608-S611 PolarHBondContact O-N 2.9Å; R608-S611 PolarHBondContact O-OG 3.16Å; R608-I612 HydrophobicContact CG-CD1 4.14Å; R608-I612 WeakPolarHBondContact O-CG1 3.49Å; R608-I612 PolarHBondContact O-N 3.14Å; R608-L674 PolarHBondContact NE-O 2.88Å; R608-L674 VanDerWaalsContact NE-O 3.16Å; R608-L682 HydrophobicContact CG-CD1 4.11Å
609	L	66	Low	66.6	Low	40 Å²	40	44.5 Å²	44.5	21%	0.209	22%	0.215	C	C	.	.	H	α-helix	trans	-58.5	-53.1	172.3	-73.2	167.5	0	0	0	110.7	M605 K606 S611 I612 V613 L682 R683	M605-L609 WeakPolarHBondContact O-CB 3.47Å; M605-L609 VanDerWaalsContact O-CG 3.31Å; M605-L609 WeakPolarHBondContact O-CG 3.34Å; M605-L609 PolarHBondContact O-N 3.04Å; K606-L609 PolarHBondContact O-N 3.38Å; L609-S611 VanDerWaalsContact C-N 3.26Å; L609-S611 PolarHBondContact O-N 2.77Å; L609-I612 PolarHBondContact O-N 3.04Å; L609-I612 VanDerWaalsContact O-N 3.11Å; L609-V613 WeakPolarHBondContact O-CB 3.24Å; L609-V613 WeakPolarHBondContact O-CG2 3.41Å; L609-V613 PolarHBondContact O-N 2.9Å; L609-L682 HydrophobicContact CD2-CB 4.04Å; L609-R683 HydrophobicContact CD2-CG 4.34Å
610	D	63	Low	64.7	Low	19 Å²	19	45.9 Å²	45.9	10%	0.102	22%	0.224	C	C	.	.	H	α-helix	trans	-47.8	-48.6	172.6	-81.6	6.6	0	0	0	110.8	Q566 K606 I612 V613 I614	Q566-D610 PolarHBondContact NE2-OD2 3.12Å; K606-D610 WeakPolarHBondContact O-CB 3.28Å; K606-D610 PolarHBondContact O-N 3.11Å; D610-I612 PolarHBondContact O-N 3.1Å; D610-V613 PolarHBondContact O-N 3.2Å; D610-I614 WeakPolarHBondContact O-CB 3.36Å; D610-I614 WeakPolarHBondContact O-CD1 3.27Å; D610-I614 WeakPolarHBondContact O-CG1 3.39Å; D610-I614 PolarHBondContact O-N 3.45Å
611	S	63.9	Low	62.9	Low	37 Å²	37	50.5 Å²	50.5	26%	0.259	25%	0.248	S	C	.	.	H	α-helix	trans	-62	-41.5	-178.9	76.7	0	0	0	0	113.8	L607 R608 L609 Q615	L607-S611 WeakPolarHBondContact O-CB 3.45Å; L607-S611 PolarHBondContact O-N 3.48Å; R608-S611 PolarHBondContact O-N 2.9Å; R608-S611 PolarHBondContact O-OG 3.16Å; L609-S611 VanDerWaalsContact C-N 3.26Å; L609-S611 PolarHBondContact O-N 2.77Å; S611-Q615 WeakPolarHBondContact O-CG 3.23Å; S611-Q615 PolarHBondContact O-N 3.04Å; S611-Q615 VanDerWaalsContact O-N 3.14Å
612	I	62.4	Low	60.9	Low	20 Å²	20	51.5 Å²	51.5	10%	0.103	26%	0.259	C	S	.	.	H	α-helix	trans	-70.5	-41.7	178.3	-66.2	164	0	0	0	109.9	R608 L609 D610 I614 Q615 Q616 L682	R608-I612 HydrophobicContact CG-CD1 4.14Å; R608-I612 WeakPolarHBondContact O-CG1 3.49Å; R608-I612 PolarHBondContact O-N 3.14Å; L609-I612 PolarHBondContact O-N 3.04Å; L609-I612 VanDerWaalsContact O-N 3.11Å; D610-I612 PolarHBondContact O-N 3.1Å; I612-I614 VanDerWaalsContact C-N 3.34Å; I612-I614 PolarHBondContact O-N 3.35Å; I612-Q615 PolarHBondContact O-N 2.9Å; I612-Q615 VanDerWaalsContact O-N 3.15Å; I612-Q616 HydrophobicContact CG2-CG 4.31Å; I612-Q616 WeakPolarHBondContact O-CB 3.34Å; I612-Q616 WeakPolarHBondContact O-CG 3.42Å; I612-Q616 PolarHBondContact O-N 3.48Å; I612-L682 HydrophobicContact CD1-CD1 4.08Å
613	V	57.6	Low	59.1	Low	5 Å²	5	52.6 Å²	52.6	3%	0.03	28%	0.275	C	S	.	.	H	α-helix	trans	-67.4	-32.5	179.3	171	0	0	0	0	111.3	Q323 L609 D610 G617 R618 V620	Q323-V613 PolarHBondContact NE2-O 3.25Å; L609-V613 WeakPolarHBondContact O-CB 3.24Å; L609-V613 WeakPolarHBondContact O-CG2 3.41Å; L609-V613 PolarHBondContact O-N 2.9Å; D610-V613 PolarHBondContact O-N 3.2Å; V613-G617 CarbonylContact O-C 3.39Å; V613-G617 WeakPolarHBondContact O-CA 3.34Å; V613-G617 PolarHBondContact O-N 3.17Å; V613-R618 WeakPolarHBondContact CG1-O 3.49Å; V613-R618 PolarHBondContact O-N 3.27Å; V613-V620 HydrophobicContact CB-CG2 4.19Å; V613-V620 HydrophobicContact CG1-CG2 3.56Å; V613-V620 HydrophobicContact CG2-CG2 3.56Å
614	I	58.1	Low	57.7	Low	50 Å²	50	55.1 Å²	55.1	26%	0.256	30%	0.296	S	S	.	.	H	α-helix	trans	-67.4	-44.2	168.5	-67.9	160.8	0	0	0	111.2	P321 D610 I612	P321-I614 HydrophobicContact CB-CD1 3.98Å; P321-I614 HydrophobicContact CB-CG1 4.22Å; P321-I614 HydrophobicContact CG-CD1 4.03Å; D610-I614 WeakPolarHBondContact O-CB 3.36Å; D610-I614 WeakPolarHBondContact O-CD1 3.27Å; D610-I614 WeakPolarHBondContact O-CG1 3.39Å; D610-I614 PolarHBondContact O-N 3.45Å; I612-I614 VanDerWaalsContact C-N 3.34Å; I612-I614 PolarHBondContact O-N 3.35Å
615	Q	54.9	Low	56.1	Low	158 Å²	158	56.6 Å²	56.6	74%	0.738	31%	0.305	S	S	*	.	H	α-helix	trans	-73.2	-30.7	-176.7	-74.1	177.3	-20.3	0	0	113.3	S611 I612	S611-Q615 WeakPolarHBondContact O-CG 3.23Å; S611-Q615 PolarHBondContact O-N 3.04Å; S611-Q615 VanDerWaalsContact O-N 3.14Å; I612-Q615 PolarHBondContact O-N 2.9Å; I612-Q615 VanDerWaalsContact O-N 3.15Å
616	Q	47.5	Very low	55.1	Low	65 Å²	65	62.6 Å²	62.6	30%	0.304	33%	0.33	S	S	.	.	S	Bend	trans	-99.4	-1.2	176.4	-60.9	-178.6	2	0	0	113.4	V363 I612 R618 E679	V363-Q616 WeakPolarHBondContact CG1-O 3.49Å; I612-Q616 HydrophobicContact CG2-CG 4.31Å; I612-Q616 WeakPolarHBondContact O-CB 3.34Å; I612-Q616 WeakPolarHBondContact O-CG 3.42Å; I612-Q616 PolarHBondContact O-N 3.48Å; Q616-R618 HydrophobicContact CB-CG 4.38Å; Q616-R618 PolarHBondContact O-N 3.26Å; Q616-R618 VanDerWaalsContact OE1-NH1 3.14Å; Q616-E679 PolarHBondContact OE1-OE2 3.26Å
617	G	47.1	Very low	54.4	Low	9 Å²	9	62 Å²	62	9%	0.093	33%	0.329	C	S	.	.			trans	61.3	2.5	-179.5	0	0	0	0	0	117.4	V363 H367 V613	V363-G617 VanDerWaalsContact CG1-CA 3.4Å; V363-G617 WeakPolarHBondContact CG1-O 3.36Å; V363-G617 WeakPolarHBondContact CG2-O 3.22Å; H367-G617 VanDerWaalsContact NE2-CA 3.3Å; H367-G617 WeakPolarHBondContact NE2-CA 3.37Å; V613-G617 CarbonylContact O-C 3.39Å; V613-G617 WeakPolarHBondContact O-CA 3.34Å; V613-G617 PolarHBondContact O-N 3.17Å
618	R	47	Very low	54	Low	61 Å²	61	60.3 Å²	60.3	23%	0.23	33%	0.326	C	S	.	.			trans	-60	157.2	-173	-76.6	178.1	166.8	162	-2.3	112.8	V613 Q616 E679	V613-R618 WeakPolarHBondContact CG1-O 3.49Å; V613-R618 PolarHBondContact O-N 3.27Å; Q616-R618 HydrophobicContact CB-CG 4.38Å; Q616-R618 PolarHBondContact O-N 3.26Å; Q616-R618 VanDerWaalsContact OE1-NH1 3.14Å; R618-E679 IonicContact NH1-OE1 3.97Å; R618-E679 PolarHBondContact NH1-OE1 3.37Å; R618-E679 IonicContact NH1-OE2 2.6Å; R618-E679 PolarHBondContact NH1-OE2 3.19Å
619	L	43.4	Very low	53.9	Low	86 Å²	86	60.8 Å²	60.8	45%	0.45	33%	0.33	S	S	.	.			trans	-88.7	143.1	171.8	-63.3	162.7	0	0	0	109.9	L326	L326-L619 HydrophobicContact CD1-CD1 3.76Å; L326-L619 HydrophobicContact CD2-CD1 3.95Å; L326-L619 HydrophobicContact CD2-CD2 4.17Å; L326-L619 HydrophobicContact CG-CD1 3.67Å; L326-L619 HydrophobicContact CG-CD2 4.08Å
620	V	46.2	Very low	54.1	Low	34 Å²	34	64.6 Å²	64.6	21%	0.206	35%	0.351	C	S	.	.			trans	-116.3	137.2	176.1	173.5	0	0	0	0	108.7	V613	V613-V620 HydrophobicContact CB-CG2 4.19Å; V613-V620 HydrophobicContact CG1-CG2 3.56Å; V613-V620 HydrophobicContact CG2-CG2 3.56Å
621	D	46.6	Very low	54.5	Low	103 Å²	103	66.2 Å²	66.2	55%	0.551	36%	0.358	S	S	*	.			trans	-64.7	123	178.6	-171.1	-47.4	0	0	0	110.6	S623 A624	D621-S623 PolarHBondContact O-N 3.13Å; D621-S623 WeakPolarHBondContact OD1-CB 3.24Å; D621-S623 PolarHBondContact OD1-N 3.1Å; D621-S623 PolarHBondContact OD1-OG 3.37Å; D621-A624 PolarHBondContact O-N 3.15Å; D621-A624 VanDerWaalsContact O-N 3.15Å
622	P	41.5	Very low	54.9	Low	68 Å²	68	64.5 Å²	64.5	44%	0.442	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-65.9	-10.2	-176.9	26.5	-34.8	0	0	0	114.1
623	S	41.8	Very low	55.5	Low	79 Å²	79	64.6 Å²	64.6	55%	0.552	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-64.4	-39.5	170.9	64	0	0	0	0	112.5	D621 N625 K626	D621-S623 PolarHBondContact O-N 3.13Å; D621-S623 WeakPolarHBondContact OD1-CB 3.24Å; D621-S623 PolarHBondContact OD1-N 3.1Å; D621-S623 PolarHBondContact OD1-OG 3.37Å; S623-N625 PolarHBondContact O-N 3.49Å; S623-K626 PolarHBondContact O-N 3.31Å
624	A	50.5	Low	56.5	Low	60 Å²	60	65.8 Å²	65.8	50%	0.496	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-62.8	-17.2	-177	0	0	0	0	0	114.1	D621	D621-A624 PolarHBondContact O-N 3.15Å; D621-A624 VanDerWaalsContact O-N 3.15Å
625	N	46.6	Very low	57.5	Low	71 Å²	71	63.4 Å²	63.4	38%	0.38	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-77.8	-23.9	179.5	-96.8	-54.9	0	0	0	113.9	N324 K606 S623	N324-N625 PolarHBondContact OD1-ND2 2.96Å; K606-N625 PolarHBondContact NZ-O 3.11Å; K606-N625 VanDerWaalsContact NZ-O 3.08Å; S623-N625 PolarHBondContact O-N 3.49Å
626	K	54.5	Low	58.7	Low	163 Å²	163	55.9 Å²	55.9	71%	0.709	31%	0.308	S	S	*	.	S	Bend	trans	-94.6	126.7	-175.8	-67.2	173.8	-176.1	167.2	0	111.2	S623 G628	S623-K626 PolarHBondContact O-N 3.31Å; K626-G628 PolarHBondContact O-N 2.75Å
627	L	58.5	Low	60.1	Low	32 Å²	32	56.3 Å²	56.3	17%	0.168	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-56.7	124.9	177.8	-98.8	92.9	0	0	0	112.6	K425 W563 E631 M632 I635	K425-L627 WeakPolarHBondContact CE-O 3.35Å; K425-L627 PolarHBondContact NZ-O 3.4Å; W563-L627 HydrophobicContact CD2-CD1 4.44Å; W563-L627 HydrophobicContact CE3-CD1 3.57Å; W563-L627 HydrophobicContact CE3-CD2 4.06Å; W563-L627 HydrophobicContact CE3-CG 4.48Å; W563-L627 HydrophobicContact CH2-CD2 3.9Å; W563-L627 HydrophobicContact CZ3-CD1 3.8Å; W563-L627 HydrophobicContact CZ3-CD2 3.37Å; W563-L627 HydrophobicContact CZ3-CG 4.24Å; L627-E631 VanDerWaalsContact CA-OE2 3.24Å; L627-E631 WeakPolarHBondContact CA-OE2 3.36Å; L627-M632 HydrophobicContact CB-CG 4.27Å; L627-M632 HydrophobicContact CD2-CG 3.6Å; L627-I635 HydrophobicContact CD2-CD1 3.8Å
628	G	64.8	Low	61.4	Low	26 Å²	26	58.1 Å²	58.1	27%	0.268	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-66.3	168.6	172.8	0	0	0	0	0	112.9	K626 E631 M632	K626-G628 PolarHBondContact O-N 2.75Å; G628-E631 PolarHBondContact N-OE2 3.38Å; G628-M632 WeakPolarHBondContact O-CE 3.26Å; G628-M632 PolarHBondContact O-N 2.59Å
629	K	70.1	Confident	62.5	Low	90 Å²	90	55.2 Å²	55.2	39%	0.391	30%	0.302	S	S	.	.	H	α-helix	trans	-69	-47.8	172.6	-69	-169.2	-175.8	-173	0	110.1	M423 M632 L633	M423-K629 PolarHBondContact O-NZ 3.07Å; K629-M632 PolarHBondContact O-N 2.79Å; K629-M632 VanDerWaalsContact O-N 3.1Å; K629-L633 PolarHBondContact O-N 3.38Å
630	D	70	Confident	63.8	Low	121 Å²	121	51.2 Å²	51.2	65%	0.647	28%	0.281	S	S	*	.	H	α-helix	trans	-70.6	-36.1	-174.9	-39.1	-76.3	0	0	0	110.6	M632 L633 S634	D630-M632 VanDerWaalsContact C-N 3.32Å; D630-M632 PolarHBondContact O-N 3.46Å; D630-L633 PolarHBondContact O-N 2.95Å; D630-S634 WeakPolarHBondContact O-CB 3.47Å; D630-S634 PolarHBondContact O-N 3.21Å
631	E	72.3	Confident	64.9	Low	53 Å²	53	53.2 Å²	53.2	25%	0.248	29%	0.293	C	S	.	.	H	α-helix	trans	-52.7	-43.8	166.5	-107.7	-153	94.8	0	0	113.4	R602 L627 G628 I635	R602-E631 WeakPolarHBondContact CD-OE1 3.22Å; R602-E631 IonicContact CZ-OE1 3.68Å; R602-E631 IonicContact NE-OE1 3.45Å; R602-E631 VanDerWaalsContact NH1-CG 3.25Å; R602-E631 PolarHBondContact NH1-O 3.28Å; R602-E631 IonicContact NH1-OE1 2.78Å; R602-E631 PolarHBondContact NH1-OE1 2.7Å; R602-E631 PolarHBondContact NH2-O 3.41Å; L627-E631 VanDerWaalsContact CA-OE2 3.24Å; L627-E631 WeakPolarHBondContact CA-OE2 3.36Å; G628-E631 PolarHBondContact N-OE2 3.38Å; E631-I635 WeakPolarHBondContact O-CG1 3.39Å; E631-I635 PolarHBondContact O-N 2.69Å
632	M	72.7	Confident	66.1	Low	1 Å²	1	51.8 Å²	51.8	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-75.7	-36.3	178.8	-71.9	-175.2	-71	0	0	111.9	K425 L429 L432 L627 G628 K629 D630 S634 I635 I636	K425-M632 HydrophobicContact CD-CE 4.28Å; K425-M632 HydrophobicContact CG-CE 3.74Å; L429-M632 HydrophobicContact CD2-CE 4.43Å; L429-M632 HydrophobicContact CD2-SD 3.55Å; L429-M632 VanDerWaalsContact CD2-SD 3.55Å; L429-M632 HydrophobicContact CG-CE 4.37Å; L429-M632 HydrophobicContact CG-SD 3.97Å; L432-M632 HydrophobicContact CD2-CB 4.49Å; L432-M632 HydrophobicContact CD2-CG 4.04Å; L432-M632 HydrophobicContact CD2-SD 3.96Å; L627-M632 HydrophobicContact CB-CG 4.27Å; L627-M632 HydrophobicContact CD2-CG 3.6Å; G628-M632 WeakPolarHBondContact O-CE 3.26Å; G628-M632 PolarHBondContact O-N 2.59Å; K629-M632 PolarHBondContact O-N 2.79Å; K629-M632 VanDerWaalsContact O-N 3.1Å; D630-M632 VanDerWaalsContact C-N 3.32Å; D630-M632 PolarHBondContact O-N 3.46Å; M632-S634 VanDerWaalsContact C-N 3.33Å; M632-I635 PolarHBondContact O-N 3.38Å; M632-I636 VanDerWaalsContact O-CG1 3.31Å; M632-I636 WeakPolarHBondContact O-CG1 3.01Å; M632-I636 PolarHBondContact O-N 3.31Å
633	L	74.6	Confident	67.4	Low	21 Å²	21	48.7 Å²	48.7	11%	0.11	26%	0.263	C	S	.	.	H	α-helix	trans	-60.7	-43.3	173.2	-71.5	169	0	0	0	111.3	M423 L428 K629 D630 I636 R637	M423-L633 HydrophobicContact CE-CD2 4.02Å; M423-L633 HydrophobicContact SD-CD1 3.82Å; M423-L633 HydrophobicContact SD-CD2 4.02Å; M423-L633 HydrophobicContact SD-CG 4.44Å; L428-L633 HydrophobicContact CD1-CD2 4.01Å; L428-L633 HydrophobicContact CD1-CG 4.05Å; L428-L633 HydrophobicContact CD2-CD2 3.67Å; K629-L633 PolarHBondContact O-N 3.38Å; D630-L633 PolarHBondContact O-N 2.95Å; L633-I636 PolarHBondContact O-N 3.08Å; L633-R637 WeakPolarHBondContact O-CB 3.38Å; L633-R637 VanDerWaalsContact O-CG 3.29Å; L633-R637 WeakPolarHBondContact O-CG 3.29Å; L633-R637 PolarHBondContact O-N 3.23Å
634	S	77.6	Confident	68.7	Low	31 Å²	31	46.6 Å²	46.6	22%	0.217	24%	0.244	C	C	.	.	H	α-helix	trans	-57.4	-47.9	173.3	164.7	0	0	0	0	112.2	R602 D630 M632 I636 R637 H638	R602-S634 PolarHBondContact NH2-OG 3.49Å; D630-S634 WeakPolarHBondContact O-CB 3.47Å; D630-S634 PolarHBondContact O-N 3.21Å; M632-S634 VanDerWaalsContact C-N 3.33Å; S634-I636 PolarHBondContact O-N 3.36Å; S634-R637 PolarHBondContact O-N 2.89Å; S634-H638 PolarHBondContact O-N 3.15Å; S634-H638 VanDerWaalsContact O-N 3.13Å
635	I	79.3	Confident	69.6	Low	0 Å²	0	46 Å²	46	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-58.8	-46.7	176.7	-68.9	164.8	0	0	0	111.5	L432 W563 V595 R598 R602 L627 E631 M632 G639	L432-I635 HydrophobicContact CD1-CG2 4.07Å; W563-I635 HydrophobicContact CH2-CD1 4.03Å; W563-I635 HydrophobicContact CZ3-CD1 3.91Å; V595-I635 HydrophobicContact CB-CG2 3.72Å; V595-I635 HydrophobicContact CG1-CG2 3.78Å; R598-I635 HydrophobicContact CB-CB 4.42Å; R598-I635 HydrophobicContact CB-CG1 3.99Å; R598-I635 HydrophobicContact CB-CG2 4.13Å; R602-I635 VanDerWaalsContact NH1-CD1 3.3Å; L627-I635 HydrophobicContact CD2-CD1 3.8Å; E631-I635 WeakPolarHBondContact O-CG1 3.39Å; E631-I635 PolarHBondContact O-N 2.69Å; M632-I635 PolarHBondContact O-N 3.38Å; I635-G639 PolarHBondContact O-N 3.48Å
636	I	79.7	Confident	70.4	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-71.1	-40.1	-176.6	-61	162.7	0	0	0	111.4	L410 L417 L428 V431 L432 L435 V595 M632 L633 S634 H638 G639 A640	L410-I636 HydrophobicContact CD2-CG2 3.99Å; L417-I636 HydrophobicContact CD1-CG2 4.19Å; L417-I636 HydrophobicContact CD2-CB 4.43Å; L417-I636 HydrophobicContact CD2-CG2 3.62Å; L428-I636 HydrophobicContact CD2-CD1 4.17Å; V431-I636 HydrophobicContact CG1-CD1 4.47Å; L432-I636 HydrophobicContact CB-CD1 4.32Å; L432-I636 HydrophobicContact CD1-CG1 4.22Å; L435-I636 HydrophobicContact CD1-CG1 4.42Å; L435-I636 HydrophobicContact CD1-CG2 4Å; V595-I636 HydrophobicContact CG1-CG1 4.44Å; M632-I636 VanDerWaalsContact O-CG1 3.31Å; M632-I636 WeakPolarHBondContact O-CG1 3.01Å; M632-I636 PolarHBondContact O-N 3.31Å; L633-I636 PolarHBondContact O-N 3.08Å; S634-I636 PolarHBondContact O-N 3.36Å; I636-H638 PolarHBondContact O-N 3.32Å; I636-G639 PolarHBondContact O-N 2.81Å; I636-A640 PolarHBondContact O-N 3.46Å; I636-A640 VanDerWaalsContact O-N 3.14Å
637	R	76.6	Confident	70.6	Confident	74 Å²	74	42.8 Å²	42.8	28%	0.279	23%	0.225	S	C	.	.	H	α-helix	trans	-61.5	-43.1	177.7	-77.2	177.9	-179.9	-172.4	-0.2	112.1	L417 L633 S634 G639 A640 T641	L417-R637 PolarHBondContact O-NH2 3.26Å; L633-R637 WeakPolarHBondContact O-CB 3.38Å; L633-R637 VanDerWaalsContact O-CG 3.29Å; L633-R637 WeakPolarHBondContact O-CG 3.29Å; L633-R637 PolarHBondContact O-N 3.23Å; S634-R637 PolarHBondContact O-N 2.89Å; R637-G639 VanDerWaalsContact C-N 3.34Å; R637-G639 PolarHBondContact O-N 2.81Å; R637-A640 WeakPolarHBondContact O-CB 3.42Å; R637-A640 PolarHBondContact O-N 2.92Å; R637-T641 PolarHBondContact O-N 3.11Å
638	H	74.6	Confident	70.7	Confident	47 Å²	47	49.1 Å²	49.1	22%	0.218	25%	0.253	C	S	.	.	H	α-helix	trans	-57.8	-46.6	176.9	-174.3	-96.2	0	0	0	112.4	R598 S634 I636 A640 T641	R598-H638 HydrophobicContact CG-CB 4.17Å; R598-H638 PolarHBondContact NE-CD2 3.19Å; R598-H638 VanDerWaalsContact NE-CD2 3.31Å; R598-H638 PolarHBondContact NE-CE1 3.32Å; R598-H638 PolarHBondContact NE-ND1 2.83Å; R598-H638 PolarHBondContact NE-NE2 2.81Å; R598-H638 PolarHBondContact NH2-CD2 3.38Å; R598-H638 PolarHBondContact NH2-NE2 3.45Å; S634-H638 PolarHBondContact O-N 3.15Å; S634-H638 VanDerWaalsContact O-N 3.13Å; I636-H638 PolarHBondContact O-N 3.32Å; H638-A640 PolarHBondContact O-N 2.9Å; H638-T641 PolarHBondContact O-OG1 3.33Å
639	G	70.1	Confident	70.6	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-71.4	-11.8	177.4	0	0	0	0	0	114.4	Y406 N593 I635 I636 R637 V643	Y406-G639 VanDerWaalsContact CE1-O 3.26Å; Y406-G639 WeakPolarHBondContact CE1-O 3.29Å; N593-G639 WeakPolarHBondContact O-CA 3.46Å; I635-G639 PolarHBondContact O-N 3.48Å; I636-G639 PolarHBondContact O-N 2.81Å; R637-G639 VanDerWaalsContact C-N 3.34Å; R637-G639 PolarHBondContact O-N 2.81Å; G639-V643 WeakPolarHBondContact O-CG2 3.44Å
640	A	71.4	Confident	70.4	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.008	25%	0.254	C	S	.	.	H	α-helix	trans	-87	-48.1	179.3	0	0	0	0	0	112	L410 I636 R637 H638 H642 V643 F644	L410-A640 HydrophobicContact CD1-CB 3.75Å; L410-A640 HydrophobicContact CD2-CB 4.3Å; I636-A640 PolarHBondContact O-N 3.46Å; I636-A640 VanDerWaalsContact O-N 3.14Å; R637-A640 WeakPolarHBondContact O-CB 3.42Å; R637-A640 PolarHBondContact O-N 2.92Å; H638-A640 PolarHBondContact O-N 2.9Å; A640-H642 PolarHBondContact O-N 2.96Å; A640-V643 PolarHBondContact O-N 3.44Å; A640-F644 HydrophobicContact CB-CD2 4.39Å; A640-F644 HydrophobicContact CB-CE2 4.2Å; A640-F644 WeakPolarHBondContact O-CD2 3.28Å; A640-F644 PolarHBondContact O-N 2.79Å; A640-F644 VanDerWaalsContact O-N 3.1Å
641	T	70.1	Confident	70.2	Confident	76 Å²	76	45.1 Å²	45.1	47%	0.466	23%	0.234	S	C	.	.	H	α-helix	trans	-59.3	-44	-172.7	50.2	0	0	0	0	113	R637 H638 A645	R637-T641 PolarHBondContact O-N 3.11Å; H638-T641 PolarHBondContact O-OG1 3.33Å; T641-A645 PolarHBondContact O-N 2.9Å
642	H	70	Confident	69.8	Low	73 Å²	73	46.2 Å²	46.2	34%	0.338	24%	0.244	S	C	.	.	H	α-helix	trans	-70.8	-39.1	178.7	-165.3	-79.5	0	0	0	112.8	N593 A640 F644 A645 S646 E650	N593-H642 HydrophobicContact CB-CB 3.89Å; N593-H642 WeakPolarHBondContact CB-ND1 3.41Å; N593-H642 PolarHBondContact ND2-CE1 3.11Å; A640-H642 PolarHBondContact O-N 2.96Å; H642-F644 VanDerWaalsContact C-N 3.3Å; H642-F644 PolarHBondContact O-N 3.06Å; H642-A645 WeakPolarHBondContact O-CB 3.48Å; H642-A645 PolarHBondContact O-N 2.81Å; H642-S646 PolarHBondContact O-N 2.83Å; H642-S646 VanDerWaalsContact O-N 3.14Å; H642-S646 PolarHBondContact O-OG 2.95Å; H642-E650 IonicContact CE1-OE1 3.71Å; H642-E650 IonicContact CE1-OE2 3.92Å; H642-E650 IonicContact ND1-OE1 3.26Å
643	V	70.8	Confident	69.5	Low	3 Å²	3	52.7 Å²	52.7	2%	0.018	28%	0.279	C	S	.	.	H	α-helix	trans	-73.6	-20.9	-176.3	-180	0	0	0	0	112.7	L398 R403 Y406 G639 A640	L398-V643 HydrophobicContact CD1-CG1 4.48Å; L398-V643 HydrophobicContact CD1-CG2 3.91Å; R403-V643 HydrophobicContact CG-CG1 3.91Å; Y406-V643 HydrophobicContact CD1-CB 4.17Å; Y406-V643 HydrophobicContact CD1-CG1 3.75Å; Y406-V643 HydrophobicContact CD1-CG2 4.1Å; Y406-V643 HydrophobicContact CE1-CB 4.24Å; Y406-V643 HydrophobicContact CE1-CG1 4.32Å; Y406-V643 HydrophobicContact CE1-CG2 3.9Å; Y406-V643 HydrophobicContact CG-CG1 4.44Å; G639-V643 WeakPolarHBondContact O-CG2 3.44Å; A640-V643 PolarHBondContact O-N 3.44Å
644	F	69.1	Low	69.3	Low	36 Å²	36	53.9 Å²	53.9	16%	0.158	29%	0.285	C	S	.	.	H	α-helix	trans	-81.3	-20.5	165.9	-71	-63.2	0	0	0	113.5	T407 L410 M411 A640 H642 V694 F697	T407-F644 HydrophobicContact CG2-CD1 4.36Å; T407-F644 HydrophobicContact CG2-CE1 3.84Å; L410-F644 HydrophobicContact CB-CE2 4.38Å; L410-F644 HydrophobicContact CB-CZ 4.04Å; L410-F644 HydrophobicContact CD1-CE2 4.04Å; L410-F644 HydrophobicContact CD1-CZ 4.3Å; M411-F644 HydrophobicContact CE-CE1 3.97Å; M411-F644 HydrophobicContact CG-CE1 4.26Å; M411-F644 HydrophobicContact CG-CZ 4.4Å; A640-F644 HydrophobicContact CB-CD2 4.39Å; A640-F644 HydrophobicContact CB-CE2 4.2Å; A640-F644 WeakPolarHBondContact O-CD2 3.28Å; A640-F644 PolarHBondContact O-N 2.79Å; A640-F644 VanDerWaalsContact O-N 3.1Å; H642-F644 VanDerWaalsContact C-N 3.3Å; H642-F644 PolarHBondContact O-N 3.06Å; F644-V694 HydrophobicContact CE2-CG1 4.22Å; F644-F697 HydrophobicContact CB-CD1 4.34Å; F644-F697 HydrophobicContact CB-CE1 4.48Å
645	A	68.3	Low	69.2	Low	46 Å²	46	58.3 Å²	58.3	38%	0.38	31%	0.306	S	S	.	.	H	α-helix	trans	-79.3	-40.5	178.4	0	0	0	0	0	113.1	T641 H642 F697	T641-A645 PolarHBondContact O-N 2.9Å; H642-A645 WeakPolarHBondContact O-CB 3.48Å; H642-A645 PolarHBondContact O-N 2.81Å; A645-F697 HydrophobicContact CB-CE1 4.17Å; A645-F697 HydrophobicContact CB-CZ 3.72Å
646	S	63.3	Low	69.3	Low	25 Å²	25	59 Å²	59	18%	0.175	31%	0.31	C	S	.	.			trans	-89.2	126.2	-174.6	62.1	0	0	0	0	113.2	R403 H642 E650	R403-S646 WeakPolarHBondContact CD-O 3.41Å; R403-S646 PolarHBondContact NE-O 3.01Å; R403-S646 PolarHBondContact NE-OG 3.33Å; R403-S646 VanDerWaalsContact NE-OG 3.15Å; R403-S646 PolarHBondContact NH2-OG 3.1Å; H642-S646 PolarHBondContact O-N 2.83Å; H642-S646 VanDerWaalsContact O-N 3.14Å; H642-S646 PolarHBondContact O-OG 2.95Å; S646-E650 WeakPolarHBondContact CB-OE1 3.39Å; S646-E650 PolarHBondContact OG-OE1 3.15Å
647	K	58.2	Low	69.5	Low	143 Å²	143	62.9 Å²	62.9	62%	0.622	33%	0.331	S	S	*	.			trans	-104.3	-17	-178.3	-71.3	158.9	-176.3	157.1	0	113.8	E698	K647-E698 IonicContact NZ-OE1 2.79Å; K647-E698 PolarHBondContact NZ-OE1 2.96Å; K647-E698 IonicContact NZ-OE2 3.28Å; K647-E698 PolarHBondContact NZ-OE2 3.12Å
648	E	61.7	Low	69.9	Low	165 Å²	165	61.2 Å²	61.2	77%	0.771	33%	0.333	S	S	*	.	S	Bend	trans	-113.1	165.1	-175.8	-60	-167.5	157.4	0	0	113.2	R403 E650	R403-E648 PolarHBondContact NH1-O 3.08Å; R403-E648 PolarHBondContact NH2-O 3.38Å; E648-E650 PolarHBondContact O-N 3.2Å
649	S	62.4	Low	70.2	Confident	70 Å²	70	59.9 Å²	59.9	49%	0.49	33%	0.327	S	S	.	.			trans	-60.2	130	-176.4	-171.3	0	0	0	0	111.8
650	E	65.1	Low	70.9	Confident	39 Å²	39	60.9 Å²	60.9	18%	0.182	33%	0.332	C	S	.	.			trans	-89.9	-3.3	177.4	-87.4	166.6	-117.2	0	0	112.9	L398 R403 N593 H642 S646 E648 T652	L398-E650 PolarHBondContact O-N 2.95Å; R403-E650 IonicContact CZ-OE1 3.73Å; R403-E650 IonicContact NE-OE1 2.7Å; R403-E650 VanDerWaalsContact NH2-CD 3.35Å; R403-E650 IonicContact NH2-OE1 2.58Å; R403-E650 PolarHBondContact NH2-OE1 2.82Å; N593-E650 PolarHBondContact ND2-OE2 3.48Å; H642-E650 IonicContact CE1-OE1 3.71Å; H642-E650 IonicContact CE1-OE2 3.92Å; H642-E650 IonicContact ND1-OE1 3.26Å; S646-E650 WeakPolarHBondContact CB-OE1 3.39Å; S646-E650 PolarHBondContact OG-OE1 3.15Å; E648-E650 PolarHBondContact O-N 3.2Å; E650-T652 PolarHBondContact O-N 3.31Å
651	I	67.3	Low	71.6	Confident	44 Å²	44	67.8 Å²	67.8	23%	0.226	36%	0.364	C	S	.	.			trans	-74.9	104.9	171.5	-56.8	171.2	0	0	0	108.4	V468	V468-I651 HydrophobicContact CG1-CG2 4.33Å; V468-I651 HydrophobicContact CG2-CD1 4.35Å
652	T	63.6	Low	72.3	Confident	75 Å²	75	68.9 Å²	68.9	46%	0.46	36%	0.36	S	S	.	.			trans	-72.2	143.5	164.5	54.2	0	0	0	0	109.7	E650 D654	E650-T652 PolarHBondContact O-N 3.31Å; T652-D654 VanDerWaalsContact CB-OD2 3.29Å; T652-D654 WeakPolarHBondContact CB-OD2 3.32Å; T652-D654 PolarHBondContact O-N 2.88Å; T652-D654 VanDerWaalsContact O-N 3.13Å; T652-D654 VanDerWaalsContact OG1-CG 3.25Å; T652-D654 PolarHBondContact OG1-OD2 3.48Å
653	D	66.7	Low	72.9	Confident	138 Å²	138	65.5 Å²	65.5	74%	0.738	35%	0.345	S	S	*	.			trans	-83.9	29.3	174.6	-157.3	11.6	0	0	0	112.3	K472	K472-D653 WeakPolarHBondContact CE-OD1 3.47Å; K472-D653 PolarHBondContact NZ-O 3.37Å; K472-D653 VanDerWaalsContact NZ-O 3.12Å; K472-D653 IonicContact NZ-OD1 3.89Å; K472-D653 PolarHBondContact NZ-OD1 2.68Å
654	D	69.2	Low	73.5	Confident	46 Å²	46	68.7 Å²	68.7	25%	0.246	36%	0.36	C	S	.	.			trans	-56.8	148	-179.8	-68.2	-36.4	0	0	0	111.2	K472 T652 I659 R662	K472-D654 PolarHBondContact NZ-O 2.75Å; T652-D654 VanDerWaalsContact CB-OD2 3.29Å; T652-D654 WeakPolarHBondContact CB-OD2 3.32Å; T652-D654 PolarHBondContact O-N 2.88Å; T652-D654 VanDerWaalsContact O-N 3.13Å; T652-D654 VanDerWaalsContact OG1-CG 3.25Å; T652-D654 PolarHBondContact OG1-OD2 3.48Å; D654-I659 HydrophobicContact CB-CD1 4.08Å; D654-I659 HydrophobicContact CB-CG1 3.76Å; D654-I659 WeakPolarHBondContact O-CD1 3.48Å; D654-R662 IonicContact OD1-NH2 3.82Å; D654-R662 IonicContact OD2-CZ 3.59Å; D654-R662 IonicContact OD2-NH1 2.57Å; D654-R662 PolarHBondContact OD2-NH1 3.04Å; D654-R662 IonicContact OD2-NH2 2.72Å; D654-R662 PolarHBondContact OD2-NH2 2.71Å
655	D	76.5	Confident	74.4	Confident	123 Å²	123	73 Å²	73	66%	0.658	38%	0.375	S	S	*	.			trans	-62	145.5	170.8	-87.1	-45.7	0	0	0	111.5	D657 A658 I659	D655-D657 PolarHBondContact O-N 3.02Å; D655-D657 VanDerWaalsContact O-N 3.12Å; D655-A658 PolarHBondContact O-N 3.1Å; D655-I659 WeakPolarHBondContact O-CG1 3.48Å; D655-I659 PolarHBondContact O-N 3.42Å
656	I	80.8	Confident	75	Confident	15 Å²	15	73.5 Å²	73.5	8%	0.077	37%	0.369	C	S	.	.	H	α-helix	trans	-59	-31	-176.6	-169.8	59	0	0	0	112.3	V469 K472 L473 K476 I659 L660	V469-I656 HydrophobicContact CG1-CD1 4.29Å; K472-I656 HydrophobicContact CB-CB 4.16Å; K472-I656 HydrophobicContact CB-CD1 4.38Å; K472-I656 HydrophobicContact CB-CG1 4.45Å; L473-I656 HydrophobicContact CB-CD1 4.21Å; L473-I656 HydrophobicContact CB-CG1 4.38Å; L473-I656 HydrophobicContact CD1-CD1 4.38Å; L473-I656 HydrophobicContact CD1-CG1 4.1Å; K476-I656 HydrophobicContact CD-CG2 4.1Å; I656-I659 PolarHBondContact O-N 3.46Å; I656-L660 HydrophobicContact CG1-CD1 4.38Å; I656-L660 WeakPolarHBondContact O-CB 3.45Å; I656-L660 WeakPolarHBondContact O-CG 3.33Å; I656-L660 PolarHBondContact O-N 3Å
657	D	82.9	Confident	75.9	Confident	81 Å²	81	73.1 Å²	73.1	43%	0.433	37%	0.366	S	S	.	.	H	α-helix	trans	-72.2	-37.6	176.7	-65.7	-54	0	0	0	112.9	K476 D655 I659 L660 E661	K476-D657 IonicContact NZ-OD1 3.3Å; K476-D657 PolarHBondContact NZ-OD1 2.91Å; K476-D657 IonicContact NZ-OD2 3.38Å; K476-D657 PolarHBondContact NZ-OD2 3.08Å; D655-D657 PolarHBondContact O-N 3.02Å; D655-D657 VanDerWaalsContact O-N 3.12Å; D657-I659 VanDerWaalsContact C-N 3.32Å; D657-L660 PolarHBondContact O-N 3.23Å; D657-E661 WeakPolarHBondContact O-CB 3.43Å; D657-E661 PolarHBondContact O-N 3.36Å
658	A	84.9	Confident	77.1	Confident	40 Å²	40	71.4 Å²	71.4	33%	0.331	36%	0.361	S	S	.	.	H	α-helix	trans	-67.1	-35.3	173.3	0	0	0	0	0	111.6	D655 R662	D655-A658 PolarHBondContact O-N 3.1Å; A658-R662 WeakPolarHBondContact O-CB 3.42Å; A658-R662 PolarHBondContact O-N 3.08Å
659	I	82.7	Confident	78.2	Confident	18 Å²	18	68 Å²	68	9%	0.092	35%	0.345	C	S	.	.	H	α-helix	trans	-64.9	-43.4	171.5	-65.5	171	0	0	0	110.6	I394 D654 D655 I656 D657 G663	I394-I659 HydrophobicContact CG2-CG2 3.6Å; D654-I659 HydrophobicContact CB-CD1 4.08Å; D654-I659 HydrophobicContact CB-CG1 3.76Å; D654-I659 WeakPolarHBondContact O-CD1 3.48Å; D655-I659 WeakPolarHBondContact O-CG1 3.48Å; D655-I659 PolarHBondContact O-N 3.42Å; I656-I659 PolarHBondContact O-N 3.46Å; D657-I659 VanDerWaalsContact C-N 3.32Å; I659-G663 PolarHBondContact O-N 3.35Å
660	L	84.1	Confident	79	Confident	21 Å²	21	66.5 Å²	66.5	11%	0.11	33%	0.331	C	S	.	.	H	α-helix	trans	-66.6	-44.4	178.3	-76.2	174.6	0	0	0	112.6	I392 I394 Y587 I656 D657 G663 E664	I392-L660 HydrophobicContact CG2-CD2 4.23Å; I394-L660 HydrophobicContact CD1-CD2 3.68Å; I394-L660 HydrophobicContact CG1-CD2 4Å; Y587-L660 HydrophobicContact CD1-CD2 3.86Å; Y587-L660 HydrophobicContact CE1-CD2 3.42Å; Y587-L660 VanDerWaalsContact CE1-CD2 3.42Å; I656-L660 HydrophobicContact CG1-CD1 4.38Å; I656-L660 WeakPolarHBondContact O-CB 3.45Å; I656-L660 WeakPolarHBondContact O-CG 3.33Å; I656-L660 PolarHBondContact O-N 3Å; D657-L660 PolarHBondContact O-N 3.23Å; L660-G663 CarbonylContact O-C 3.57Å; L660-G663 WeakPolarHBondContact O-CA 3.16Å; L660-G663 PolarHBondContact O-N 2.86Å; L660-E664 PolarHBondContact O-N 2.96Å
661	E	85.8	Confident	79.6	Confident	146 Å²	146	71.9 Å²	71.9	68%	0.682	35%	0.354	S	S	*	.	H	α-helix	trans	-64.4	-44.5	177	-175.8	178.5	-162	0	0	111.4	D657 G663 E664 R665	D657-E661 WeakPolarHBondContact O-CB 3.43Å; D657-E661 PolarHBondContact O-N 3.36Å; E661-G663 PolarHBondContact O-N 3.06Å; E661-E664 PolarHBondContact O-N 3.42Å; E661-R665 WeakPolarHBondContact O-CB 3.29Å; E661-R665 PolarHBondContact O-N 3.34Å
662	R	84.4	Confident	80.4	Confident	99 Å²	99	76 Å²	76	37%	0.374	37%	0.372	S	S	.	.	H	α-helix	trans	-58.8	-38.3	172.5	-169.5	-174.6	-59	162.7	7	111.3	D654 A658 K666	D654-R662 IonicContact OD1-NH2 3.82Å; D654-R662 IonicContact OD2-CZ 3.59Å; D654-R662 IonicContact OD2-NH1 2.57Å; D654-R662 PolarHBondContact OD2-NH1 3.04Å; D654-R662 IonicContact OD2-NH2 2.72Å; D654-R662 PolarHBondContact OD2-NH2 2.71Å; A658-R662 WeakPolarHBondContact O-CB 3.42Å; A658-R662 PolarHBondContact O-N 3.08Å; R662-K666 WeakPolarHBondContact O-CB 3.38Å; R662-K666 WeakPolarHBondContact O-CG 3.34Å; R662-K666 PolarHBondContact O-N 3.39Å
663	G	82.3	Confident	81.2	Confident	3 Å²	3	78.8 Å²	78.8	3%	0.031	38%	0.377	C	S	.	.	H	α-helix	trans	-67.9	-47.1	175.3	0	0	0	0	0	113.9	K393 I659 L660 E661 T667	K393-G663 WeakPolarHBondContact O-CA 3.01Å; I659-G663 PolarHBondContact O-N 3.35Å; L660-G663 CarbonylContact O-C 3.57Å; L660-G663 WeakPolarHBondContact O-CA 3.16Å; L660-G663 PolarHBondContact O-N 2.86Å; E661-G663 PolarHBondContact O-N 3.06Å; G663-T667 VanDerWaalsContact O-CB 3.22Å; G663-T667 WeakPolarHBondContact O-CB 3.45Å; G663-T667 PolarHBondContact O-N 3.44Å; G663-T667 PolarHBondContact O-OG1 3Å
664	E	84.6	Confident	81.5	Confident	69 Å²	69	73.3 Å²	73.3	32%	0.322	35%	0.348	S	S	.	.	H	α-helix	trans	-60.7	-44.9	174.8	-76.4	-156.6	165	0	0	110.7	K390 I392 L660 E661 T667 M668	K390-E664 IonicContact NZ-OE1 3.66Å; I392-E664 HydrophobicContact CD1-CG 3.93Å; I392-E664 WeakPolarHBondContact CD1-OE1 3.48Å; I392-E664 HydrophobicContact CG1-CG 3.9Å; I392-E664 HydrophobicContact CG2-CG 3.89Å; L660-E664 PolarHBondContact O-N 2.96Å; E661-E664 PolarHBondContact O-N 3.42Å; E664-T667 WeakPolarHBondContact O-CB 3.33Å; E664-T667 PolarHBondContact O-N 2.78Å; E664-M668 HydrophobicContact CB-CE 4.4Å; E664-M668 WeakPolarHBondContact O-CG 3.35Å; E664-M668 PolarHBondContact O-N 3.43Å
665	R	86.8	Confident	81.7	Confident	127 Å²	127	74.5 Å²	74.5	48%	0.479	36%	0.36	S	S	.	.	H	α-helix	trans	-61.7	-53.3	176.7	-176.1	176.7	57.7	74.1	-2	112.5	E661 T667 M668 E669	E661-R665 WeakPolarHBondContact O-CB 3.29Å; E661-R665 PolarHBondContact O-N 3.34Å; R665-T667 PolarHBondContact O-N 3.38Å; R665-M668 PolarHBondContact O-N 2.96Å; R665-M668 VanDerWaalsContact O-N 3.11Å; R665-E669 WeakPolarHBondContact CD-OE1 3.23Å; R665-E669 HydrophobicContact CG-CG 4.39Å; R665-E669 VanDerWaalsContact CG-OE1 3.24Å; R665-E669 WeakPolarHBondContact CG-OE1 3.44Å; R665-E669 IonicContact CZ-OE1 3.37Å; R665-E669 IonicContact NE-OE1 2.86Å; R665-E669 IonicContact NH1-OE1 3.02Å; R665-E669 PolarHBondContact NH1-OE1 3.36Å; R665-E669 IonicContact NH1-OE2 3.22Å; R665-E669 PolarHBondContact NH1-OE2 2.72Å; R665-E669 WeakPolarHBondContact O-CG 3.45Å; R665-E669 PolarHBondContact O-N 3.13Å
666	K	82.8	Confident	81.7	Confident	56 Å²	56	73.2 Å²	73.2	24%	0.243	36%	0.361	C	S	.	.	H	α-helix	trans	-55.6	-37.4	174.9	-81.6	-170.1	171.5	-165.3	0	111.8	Y395 E592 R662 M670	Y395-K666 HydrophobicContact CD1-CD 4.39Å; Y395-K666 HydrophobicContact CD2-CB 4.23Å; Y395-K666 HydrophobicContact CD2-CD 3.56Å; Y395-K666 HydrophobicContact CE1-CD 4.44Å; Y395-K666 HydrophobicContact CE2-CB 3.69Å; Y395-K666 HydrophobicContact CE2-CD 3.63Å; Y395-K666 HydrophobicContact CE2-CG 4.32Å; Y395-K666 HydrophobicContact CG-CD 3.97Å; E592-K666 IonicContact OE1-NZ 3.57Å; E592-K666 PolarHBondContact OE1-NZ 3.23Å; R662-K666 WeakPolarHBondContact O-CB 3.38Å; R662-K666 WeakPolarHBondContact O-CG 3.34Å; R662-K666 PolarHBondContact O-N 3.39Å; K666-M670 WeakPolarHBondContact O-CB 3.38Å; K666-M670 PolarHBondContact O-N 3.45Å
667	T	82	Confident	81.1	Confident	18 Å²	18	74.5 Å²	74.5	11%	0.11	37%	0.368	C	S	.	.	H	α-helix	trans	-66.7	-41.3	178.4	-60.4	0	0	0	0	111.8	K393 G663 E664 R665 K671	K393-T667 WeakPolarHBondContact CB-OG1 3.47Å; K393-T667 HydrophobicContact CD-CG2 4.44Å; K393-T667 HydrophobicContact CG-CG2 4.4Å; K393-T667 WeakPolarHBondContact CG-OG1 3.25Å; K393-T667 PolarHBondContact N-OG1 3.17Å; K393-T667 VanDerWaalsContact N-OG1 3.16Å; G663-T667 VanDerWaalsContact O-CB 3.22Å; G663-T667 WeakPolarHBondContact O-CB 3.45Å; G663-T667 PolarHBondContact O-N 3.44Å; G663-T667 PolarHBondContact O-OG1 3Å; E664-T667 WeakPolarHBondContact O-CB 3.33Å; E664-T667 PolarHBondContact O-N 2.78Å; R665-T667 PolarHBondContact O-N 3.38Å; T667-K671 VanDerWaalsContact O-CB 3.25Å; T667-K671 WeakPolarHBondContact O-CB 3.28Å; T667-K671 PolarHBondContact O-N 3.37Å; T667-K671 VanDerWaalsContact O-N 3.07Å
668	M	83.5	Confident	80.2	Confident	106 Å²	106	72.3 Å²	72.3	52%	0.522	36%	0.364	S	S	.	.	H	α-helix	trans	-68.3	-48.2	175.6	-71.5	-174.6	-75.5	0	0	111.7	E664 R665 M670 K671 E672	E664-M668 HydrophobicContact CB-CE 4.4Å; E664-M668 WeakPolarHBondContact O-CG 3.35Å; E664-M668 PolarHBondContact O-N 3.43Å; R665-M668 PolarHBondContact O-N 2.96Å; R665-M668 VanDerWaalsContact O-N 3.11Å; M668-M670 VanDerWaalsContact C-N 3.34Å; M668-M670 PolarHBondContact O-N 3.16Å; M668-K671 WeakPolarHBondContact O-CB 2.89Å; M668-K671 PolarHBondContact O-N 2.89Å; M668-K671 VanDerWaalsContact O-N 3.08Å; M668-E672 WeakPolarHBondContact O-CG 3.45Å; M668-E672 PolarHBondContact O-N 3.41Å
669	E	84.2	Confident	78.7	Confident	94 Å²	94	72.3 Å²	72.3	44%	0.439	36%	0.357	S	S	.	.	H	α-helix	trans	-54.8	-46.2	176.4	-70.9	166.7	179.7	0	0	112.1	R665 E672 K673	R665-E669 WeakPolarHBondContact CD-OE1 3.23Å; R665-E669 HydrophobicContact CG-CG 4.39Å; R665-E669 VanDerWaalsContact CG-OE1 3.24Å; R665-E669 WeakPolarHBondContact CG-OE1 3.44Å; R665-E669 IonicContact CZ-OE1 3.37Å; R665-E669 IonicContact NE-OE1 2.86Å; R665-E669 IonicContact NH1-OE1 3.02Å; R665-E669 PolarHBondContact NH1-OE1 3.36Å; R665-E669 IonicContact NH1-OE2 3.22Å; R665-E669 PolarHBondContact NH1-OE2 2.72Å; R665-E669 WeakPolarHBondContact O-CG 3.45Å; R665-E669 PolarHBondContact O-N 3.13Å; E669-E672 PolarHBondContact O-N 3.15Å; E669-K673 WeakPolarHBondContact O-CB 3.47Å; E669-K673 PolarHBondContact O-N 3.11Å
670	M	77.9	Confident	77.3	Confident	38 Å²	38	75.5 Å²	75.5	19%	0.187	38%	0.381	C	S	.	.	H	α-helix	trans	-67	-38.1	177.3	-177.3	173.2	-81.4	0	0	112.2	K393 E601 K666 M668 K673 L674	K393-M670 PolarHBondContact NZ-SD 2.89Å; E601-M670 HydrophobicContact CG-CE 4.09Å; K666-M670 WeakPolarHBondContact O-CB 3.38Å; K666-M670 PolarHBondContact O-N 3.45Å; M668-M670 VanDerWaalsContact C-N 3.34Å; M668-M670 PolarHBondContact O-N 3.16Å; M670-K673 PolarHBondContact O-N 2.85Å; M670-L674 HydrophobicContact CG-CD1 4.01Å; M670-L674 WeakPolarHBondContact O-CB 3.36Å; M670-L674 WeakPolarHBondContact O-CG 3.4Å; M670-L674 PolarHBondContact O-N 2.88Å
671	K	79.7	Confident	76.1	Confident	153 Å²	153	77 Å²	77	67%	0.665	39%	0.393	S	S	*	.	H	α-helix	trans	-67.5	-39.3	177.8	-177.3	-179.4	176.7	-174.3	0	112	T667 M668 L674 S675	T667-K671 VanDerWaalsContact O-CB 3.25Å; T667-K671 WeakPolarHBondContact O-CB 3.28Å; T667-K671 PolarHBondContact O-N 3.37Å; T667-K671 VanDerWaalsContact O-N 3.07Å; M668-K671 WeakPolarHBondContact O-CB 2.89Å; M668-K671 PolarHBondContact O-N 2.89Å; M668-K671 VanDerWaalsContact O-N 3.08Å; K671-L674 PolarHBondContact O-N 3.04Å; K671-S675 WeakPolarHBondContact O-CB 3.31Å; K671-S675 PolarHBondContact O-N 2.74Å
672	E	83.7	Confident	74.7	Confident	129 Å²	129	70.5 Å²	70.5	60%	0.603	36%	0.363	S	S	*	.	H	α-helix	trans	-65.5	-45.6	174.3	-73	178.3	178.6	0	0	110.9	M668 E669 L674 S675 S676	M668-E672 WeakPolarHBondContact O-CG 3.45Å; M668-E672 PolarHBondContact O-N 3.41Å; E669-E672 PolarHBondContact O-N 3.15Å; E672-L674 VanDerWaalsContact C-N 3.35Å; E672-L674 PolarHBondContact O-N 2.82Å; E672-S675 WeakPolarHBondContact CA-OG 3.39Å; E672-S675 WeakPolarHBondContact O-CA 3.12Å; E672-S675 WeakPolarHBondContact O-CB 3.42Å; E672-S675 PolarHBondContact O-N 3.37Å; E672-S675 PolarHBondContact O-OG 2.79Å; E672-S676 PolarHBondContact O-N 3.02Å; E672-S676 PolarHBondContact O-OG 3.13Å
673	K	80.2	Confident	73.3	Confident	134 Å²	134	72 Å²	72	58%	0.583	37%	0.369	S	S	*	.	H	α-helix	trans	-58.4	-41.6	173.5	-170.9	178.1	-178.9	-178.4	0	112.8	E669 M670 S675 S676 L677	E669-K673 WeakPolarHBondContact O-CB 3.47Å; E669-K673 PolarHBondContact O-N 3.11Å; M670-K673 PolarHBondContact O-N 2.85Å; K673-S675 PolarHBondContact O-N 3.38Å; K673-S676 PolarHBondContact O-OG 3.29Å; K673-L677 HydrophobicContact CG-CD1 4.39Å; K673-L677 WeakPolarHBondContact O-CD1 3.13Å; K673-L677 VanDerWaalsContact O-CG 3.29Å; K673-L677 WeakPolarHBondContact O-CG 3.34Å; K673-L677 PolarHBondContact O-N 2.67Å
674	L	72.9	Confident	71.8	Confident	23 Å²	23	77.8 Å²	77.8	12%	0.12	40%	0.399	C	S	.	.	H	α-helix	trans	-73	-10.6	173.4	-74.5	168.1	0	0	0	113.9	E604 M605 R608 M670 K671 E672 L682	E604-L674 HydrophobicContact CB-CD1 4.07Å; M605-L674 HydrophobicContact CG-CD2 3.9Å; R608-L674 PolarHBondContact NE-O 2.88Å; R608-L674 VanDerWaalsContact NE-O 3.16Å; M670-L674 HydrophobicContact CG-CD1 4.01Å; M670-L674 WeakPolarHBondContact O-CB 3.36Å; M670-L674 WeakPolarHBondContact O-CG 3.4Å; M670-L674 PolarHBondContact O-N 2.88Å; K671-L674 PolarHBondContact O-N 3.04Å; E672-L674 VanDerWaalsContact C-N 3.35Å; E672-L674 PolarHBondContact O-N 2.82Å; L674-L682 HydrophobicContact CD2-CD2 4.39Å
675	S	73.6	Confident	70	Confident	72 Å²	72	78.8 Å²	78.8	50%	0.503	40%	0.403	S	S	.	.	H	α-helix	trans	-92.8	-31.5	174.3	80.5	0	0	0	0	112.9	K671 E672 K673	K671-S675 WeakPolarHBondContact O-CB 3.31Å; K671-S675 PolarHBondContact O-N 2.74Å; E672-S675 WeakPolarHBondContact CA-OG 3.39Å; E672-S675 WeakPolarHBondContact O-CA 3.12Å; E672-S675 WeakPolarHBondContact O-CB 3.42Å; E672-S675 PolarHBondContact O-N 3.37Å; E672-S675 PolarHBondContact O-OG 2.79Å; K673-S675 PolarHBondContact O-N 3.38Å
676	S	76.4	Confident	68	Low	96 Å²	96	78.2 Å²	78.2	67%	0.671	41%	0.414	S	S	*	.	H	α-helix	trans	-84.8	-21.9	178.5	60.1	0	0	0	0	113.9	E672 K673 G678	E672-S676 PolarHBondContact O-N 3.02Å; E672-S676 PolarHBondContact O-OG 3.13Å; K673-S676 PolarHBondContact O-OG 3.29Å; S676-G678 PolarHBondContact O-N 3.08Å
677	L	68.6	Low	66.3	Low	42 Å²	42	79.8 Å²	79.8	22%	0.22	42%	0.423	C	S	.	.	S	Bend	trans	-71.6	120.2	173.5	-73.9	166.9	0	0	0	111.6	K673 L682	K673-L677 HydrophobicContact CG-CD1 4.39Å; K673-L677 WeakPolarHBondContact O-CD1 3.13Å; K673-L677 VanDerWaalsContact O-CG 3.29Å; K673-L677 WeakPolarHBondContact O-CG 3.34Å; K673-L677 PolarHBondContact O-N 2.67Å; L677-L682 HydrophobicContact CB-CD2 3.81Å; L677-L682 HydrophobicContact CB-CG 4.01Å; L677-L682 HydrophobicContact CD1-CD2 4.16Å
678	G	62.7	Low	64.1	Low	35 Å²	35	86.4 Å²	86.4	36%	0.361	46%	0.457	S	S	.	.			trans	-75	163.7	178.8	0	0	0	0	0	114.3	S676 S680 S681 L682	S676-G678 PolarHBondContact O-N 3.08Å; G678-S680 VanDerWaalsContact C-N 3.32Å; G678-S680 PolarHBondContact O-N 3.45Å; G678-S681 WeakPolarHBondContact O-CB 3.37Å; G678-S681 PolarHBondContact O-N 3.12Å; G678-S681 VanDerWaalsContact O-N 3.1Å; G678-L682 WeakPolarHBondContact O-CG 3.46Å; G678-L682 PolarHBondContact O-N 3.23Å
679	E	55	Low	62	Low	40 Å²	40	84.6 Å²	84.6	19%	0.187	45%	0.453	C	S	.	.	H	α-helix	trans	-54.7	-42.5	-175.6	-170.3	-168.4	170.1	0	0	113.4	Q616 R618 L682 R683	Q616-E679 PolarHBondContact OE1-OE2 3.26Å; R618-E679 IonicContact NH1-OE1 3.97Å; R618-E679 PolarHBondContact NH1-OE1 3.37Å; R618-E679 IonicContact NH1-OE2 2.6Å; R618-E679 PolarHBondContact NH1-OE2 3.19Å; E679-L682 PolarHBondContact O-N 3.33Å; E679-R683 WeakPolarHBondContact O-CG 3.29Å; E679-R683 PolarHBondContact O-N 2.62Å; E679-R683 VanDerWaalsContact O-N 3.08Å; E679-R683 IonicContact OE1-CZ 3.75Å; E679-R683 IonicContact OE1-NE 3.94Å; E679-R683 PolarHBondContact OE1-NE 3.04Å; E679-R683 IonicContact OE1-NH2 3.8Å; E679-R683 PolarHBondContact OE1-NH2 3.31Å
680	S	52.5	Low	59.9	Low	84 Å²	84	88.3 Å²	88.3	59%	0.587	47%	0.47	S	S	*	.	H	α-helix	trans	-66.1	-43.5	177.3	48.6	0	0	0	0	112.3	G678 R683 N684	G678-S680 VanDerWaalsContact C-N 3.32Å; G678-S680 PolarHBondContact O-N 3.45Å; S680-R683 PolarHBondContact O-N 2.86Å; S680-N684 WeakPolarHBondContact O-CB 3.27Å; S680-N684 PolarHBondContact O-N 2.95Å; S680-N684 VanDerWaalsContact O-N 3.08Å
681	S	57.7	Low	58.1	Low	53 Å²	53	93.6 Å²	93.6	37%	0.371	50%	0.499	S	S	.	.	H	α-helix	trans	-62.5	-41.5	175.4	-53.6	0	0	0	0	111.8	G678 N684 F685	G678-S681 WeakPolarHBondContact O-CB 3.37Å; G678-S681 PolarHBondContact O-N 3.12Å; G678-S681 VanDerWaalsContact O-N 3.1Å; S681-N684 PolarHBondContact O-N 3.48Å; S681-F685 WeakPolarHBondContact O-CB 3.31Å; S681-F685 PolarHBondContact O-N 3.31Å; S681-F685 VanDerWaalsContact O-N 3.15Å
682	L	57.7	Low	56.3	Low	9 Å²	9	90.5 Å²	90.5	5%	0.047	49%	0.493	C	S	.	.	H	α-helix	trans	-67.6	-34.9	178.5	-70.6	172.2	0	0	0	113.1	R608 L609 I612 L674 L677 G678 E679	R608-L682 HydrophobicContact CG-CD1 4.11Å; L609-L682 HydrophobicContact CD2-CB 4.04Å; I612-L682 HydrophobicContact CD1-CD1 4.08Å; L674-L682 HydrophobicContact CD2-CD2 4.39Å; L677-L682 HydrophobicContact CB-CD2 3.81Å; L677-L682 HydrophobicContact CB-CG 4.01Å; L677-L682 HydrophobicContact CD1-CD2 4.16Å; G678-L682 WeakPolarHBondContact O-CG 3.46Å; G678-L682 PolarHBondContact O-N 3.23Å; E679-L682 PolarHBondContact O-N 3.33Å
683	R	55.4	Low	54.5	Low	130 Å²	130	86.9 Å²	86.9	49%	0.491	48%	0.482	S	S	.	.	H	α-helix	trans	-70.9	-35.7	173.7	-71.2	178.1	-171.6	-124.9	7.7	112.4	L609 E679 S680	L609-R683 HydrophobicContact CD2-CG 4.34Å; E679-R683 WeakPolarHBondContact O-CG 3.29Å; E679-R683 PolarHBondContact O-N 2.62Å; E679-R683 VanDerWaalsContact O-N 3.08Å; E679-R683 IonicContact OE1-CZ 3.75Å; E679-R683 IonicContact OE1-NE 3.94Å; E679-R683 PolarHBondContact OE1-NE 3.04Å; E679-R683 IonicContact OE1-NH2 3.8Å; E679-R683 PolarHBondContact OE1-NH2 3.31Å; S680-R683 PolarHBondContact O-N 2.86Å
684	N	49.2	Very low	53.1	Low	126 Å²	126	81.7 Å²	81.7	67%	0.674	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	8.4	-175.5	-66	2.8	0	0	0	113.6	S680 S681 T686	S680-N684 WeakPolarHBondContact O-CB 3.27Å; S680-N684 PolarHBondContact O-N 2.95Å; S680-N684 VanDerWaalsContact O-N 3.08Å; S681-N684 PolarHBondContact O-N 3.48Å; N684-T686 PolarHBondContact O-N 2.96Å
685	F	46.7	Very low	51.7	Low	89 Å²	89	82 Å²	82	39%	0.39	46%	0.461	S	S	.	.			trans	-80.1	56.8	-172.8	-141.2	-104.2	0	0	0	114.1	M605 S681 M687	M605-F685 HydrophobicContact SD-CD1 4.46Å; S681-F685 WeakPolarHBondContact O-CB 3.31Å; S681-F685 PolarHBondContact O-N 3.31Å; S681-F685 VanDerWaalsContact O-N 3.15Å; F685-M687 HydrophobicContact CD1-CG 3.76Å; F685-M687 HydrophobicContact CE1-CG 3.39Å; F685-M687 HydrophobicContact CE1-SD 4.04Å; F685-M687 HydrophobicContact CZ-CG 4.3Å; F685-M687 PolarHBondContact O-N 3.14Å; F685-M687 VanDerWaalsContact O-N 3.15Å
686	T	46.2	Very low	50.4	Low	116 Å²	116	82.2 Å²	82.2	71%	0.712	46%	0.46	S	S	*	.			trans	-65.5	106.4	153.1	45.1	0	0	0	0	107.6	N684 D688	N684-T686 PolarHBondContact O-N 2.96Å; T686-D688 PolarHBondContact O-N 2.96Å
687	M	45.7	Very low	48.7	Very low	89 Å²	89	80.7 Å²	80.7	44%	0.438	44%	0.441	S	S	.	.			trans	-65.6	106.8	170.1	-83.9	-162.1	67.5	0	0	109.1	R598 F685 T689	R598-M687 PolarHBondContact NH1-SD 3.36Å; F685-M687 HydrophobicContact CD1-CG 3.76Å; F685-M687 HydrophobicContact CE1-CG 3.39Å; F685-M687 HydrophobicContact CE1-SD 4.04Å; F685-M687 HydrophobicContact CZ-CG 4.3Å; F685-M687 PolarHBondContact O-N 3.14Å; F685-M687 VanDerWaalsContact O-N 3.15Å; M687-T689 PolarHBondContact O-N 3.06Å; M687-T689 PolarHBondContact O-OG1 2.92Å; M687-T689 VanDerWaalsContact O-OG1 3.12Å
688	D	36	Very low	47.1	Very low	156 Å²	156	84.5 Å²	84.5	83%	0.834	46%	0.458	S	S	*	.			trans	-54.1	107.7	173.4	-69.5	-46.2	0	0	0	109.2	T686	T686-D688 PolarHBondContact O-N 2.96Å
689	T	40	Very low	46.1	Very low	69 Å²	69	86.8 Å²	86.8	42%	0.423	48%	0.481	S	S	.	.			trans	-103.3	115	170.2	-27.2	0	0	0	0	104.8	M687	M687-T689 PolarHBondContact O-N 3.06Å; M687-T689 PolarHBondContact O-OG1 2.92Å; M687-T689 VanDerWaalsContact O-OG1 3.12Å
690	E	39.7	Very low	45.6	Very low	171 Å²	171	89.6 Å²	89.6	80%	0.799	49%	0.494	S	S	*	.			trans	-53.2	148.1	179.8	-63.1	-174.7	160.1	0	0	110.7	T692	E690-T692 PolarHBondContact O-N 3.15Å
691	N	40.7	Very low	45.6	Very low	150 Å²	150	88.7 Å²	88.7	80%	0.802	48%	0.483	S	S	*	.			trans	-77.2	44.4	-175.7	-84.8	-57.2	0	0	0	113	S693	N691-S693 PolarHBondContact O-N 3.24Å
692	T	42.2	Very low	45.4	Very low	88 Å²	88	88.5 Å²	88.5	54%	0.54	47%	0.474	S	S	.	.			trans	-65.7	127.3	175.1	-37.8	0	0	0	0	109.9	E690	E690-T692 PolarHBondContact O-N 3.15Å
693	S	45.6	Very low	45.3	Very low	52 Å²	52	94.9 Å²	94.9	36%	0.364	50%	0.498	S	S	.	.			trans	-75.2	137	-177.7	102	0	0	0	0	111.2	N691 Y695 T696	N691-S693 PolarHBondContact O-N 3.24Å; S693-Y695 PolarHBondContact O-N 3.01Å; S693-T696 PolarHBondContact O-N 3.09Å; S693-T696 PolarHBondContact O-OG1 2.94Å; S693-T696 PolarHBondContact OG-OG1 3.44Å
694	V	50.1	Low	44.8	Very low	26 Å²	26	95.1 Å²	95.1	16%	0.158	51%	0.505	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-7.4	-175.6	-171.1	0	0	0	0	112.2	N418 F644	N418-V694 PolarHBondContact OD1-N 3.01Å; F644-V694 HydrophobicContact CE2-CG1 4.22Å
695	Y	45.2	Very low	44.8	Very low	28 Å²	28	93.8 Å²	93.8	11%	0.11	49%	0.493	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-26.1	177.7	-72.4	-66.4	0	0	0	114.4	I414 D415 N418 S693 Y702 R703	I414-Y695 HydrophobicContact CD1-CD1 3.92Å; I414-Y695 HydrophobicContact CD1-CE1 3.91Å; I414-Y695 HydrophobicContact CG1-CD1 4.32Å; I414-Y695 HydrophobicContact CG1-CE1 3.89Å; I414-Y695 HydrophobicContact CG2-CE1 4.11Å; D415-Y695 WeakPolarHBondContact CA-OH 3.34Å; D415-Y695 PolarHBondContact OD1-OH 2.69Å; N418-Y695 HydrophobicContact CB-CD2 4.21Å; N418-Y695 HydrophobicContact CB-CE2 3.54Å; N418-Y695 VanDerWaalsContact CG-CE2 3.49Å; N418-Y695 WeakPolarHBondContact ND2-CE2 3.32Å; S693-Y695 PolarHBondContact O-N 3.01Å; Y695-Y702 PolarHBondContact O-N 3.2Å; Y695-R703 HydrophobicContact CD1-CG 3.69Å; Y695-R703 HydrophobicContact CE1-CG 3.87Å; Y695-R703 HydrophobicContact CG-CG 4.36Å
696	T	45.2	Very low	44.6	Very low	77 Å²	77	95 Å²	95	47%	0.472	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	103.7	-169.5	48.3	0	0	0	0	110.1	S693	S693-T696 PolarHBondContact O-N 3.09Å; S693-T696 PolarHBondContact O-OG1 2.94Å; S693-T696 PolarHBondContact OG-OG1 3.44Å
697	F	41.9	Very low	44.4	Very low	64 Å²	64	97 Å²	97	28%	0.281	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	138.8	-179.2	-160.2	-96.5	0	0	0	111.2	F644 A645 G699 E700 Y702	F644-F697 HydrophobicContact CB-CD1 4.34Å; F644-F697 HydrophobicContact CB-CE1 4.48Å; A645-F697 HydrophobicContact CB-CE1 4.17Å; A645-F697 HydrophobicContact CB-CZ 3.72Å; F697-G699 PolarHBondContact O-N 3.4Å; F697-E700 PolarHBondContact N-O 3.35Å; F697-E700 PolarHBondContact O-N 2.85Å; F697-Y702 HydrophobicContact CB-CE2 4.41Å
698	E	34.4	Very low	44.2	Very low	122 Å²	122	98.5 Å²	98.5	57%	0.57	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	9.8	-172.6	-71.5	176.5	151.1	0	0	116.1	K647	K647-E698 IonicContact NZ-OE1 2.79Å; K647-E698 PolarHBondContact NZ-OE1 2.96Å; K647-E698 IonicContact NZ-OE2 3.28Å; K647-E698 PolarHBondContact NZ-OE2 3.12Å
699	G	41.5	Very low	44.4	Very low	83 Å²	83	97.1 Å²	97.1	86%	0.856	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.3	-1.4	-175.9	0	0	0	0	0	115	F697	F697-G699 PolarHBondContact O-N 3.4Å
700	E	43.8	Very low	44.3	Very low	99 Å²	99	99.1 Å²	99.1	46%	0.463	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	141	172.4	-65.2	-171	160.2	0	0	111.6	F697 Y702 K705	F697-E700 PolarHBondContact N-O 3.35Å; F697-E700 PolarHBondContact O-N 2.85Å; E700-Y702 HydrophobicContact CB-CD2 4.41Å; E700-Y702 HydrophobicContact CB-CE2 3.98Å; E700-K705 IonicContact OE2-NZ 3.75Å; E700-K705 PolarHBondContact OE2-NZ 3.49Å
701	D	52.2	Low	44.1	Very low	65 Å²	65	98.1 Å²	98.1	35%	0.348	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	112.7	167.2	-173.9	-22.3	0	0	0	109.6	R703	D701-R703 PolarHBondContact O-N 3.32Å; D701-R703 VanDerWaalsContact O-N 3.12Å; D701-R703 VanDerWaalsContact OD1-CB 3.26Å; D701-R703 WeakPolarHBondContact OD1-CB 3.31Å; D701-R703 VanDerWaalsContact OD1-CD 3.32Å; D701-R703 WeakPolarHBondContact OD1-CD 3.4Å; D701-R703 WeakPolarHBondContact OD1-CG 3.39Å; D701-R703 PolarHBondContact OD1-N 3.26Å; D701-R703 IonicContact OD1-NE 2.74Å; D701-R703 WeakPolarHBondContact OD2-CD 3.5Å; D701-R703 IonicContact OD2-CZ 2.69Å; D701-R703 IonicContact OD2-NE 2.66Å; D701-R703 IonicContact OD2-NH1 3.99Å; D701-R703 PolarHBondContact OD2-NH1 2.9Å
702	Y	55	Low	44.1	Very low	49 Å²	49	100.1 Å²	100.1	19%	0.192	51%	0.511	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-2.4	-174.1	-81.7	-102	0	0	0	114.6	M411 Y695 F697 E700 E704 K705	M411-Y702 HydrophobicContact CE-CD1 4.11Å; M411-Y702 HydrophobicContact CE-CE1 4.37Å; Y695-Y702 PolarHBondContact O-N 3.2Å; F697-Y702 HydrophobicContact CB-CE2 4.41Å; E700-Y702 HydrophobicContact CB-CD2 4.41Å; E700-Y702 HydrophobicContact CB-CE2 3.98Å; Y702-E704 PolarHBondContact O-N 3.24Å; Y702-K705 HydrophobicContact CD1-CD 3.88Å; Y702-K705 HydrophobicContact CE1-CD 3.97Å
703	R	54.6	Low	43.8	Very low	144 Å²	144	102.8 Å²	102.8	54%	0.543	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-32.6	175.1	-72.9	169	-175.6	143.4	-9.8	113.8	Y695 D701 K706	Y695-R703 HydrophobicContact CD1-CG 3.69Å; Y695-R703 HydrophobicContact CE1-CG 3.87Å; Y695-R703 HydrophobicContact CG-CG 4.36Å; D701-R703 PolarHBondContact O-N 3.32Å; D701-R703 VanDerWaalsContact O-N 3.12Å; D701-R703 VanDerWaalsContact OD1-CB 3.26Å; D701-R703 WeakPolarHBondContact OD1-CB 3.31Å; D701-R703 VanDerWaalsContact OD1-CD 3.32Å; D701-R703 WeakPolarHBondContact OD1-CD 3.4Å; D701-R703 WeakPolarHBondContact OD1-CG 3.39Å; D701-R703 PolarHBondContact OD1-N 3.26Å; D701-R703 IonicContact OD1-NE 2.74Å; D701-R703 WeakPolarHBondContact OD2-CD 3.5Å; D701-R703 IonicContact OD2-CZ 2.69Å; D701-R703 IonicContact OD2-NE 2.66Å; D701-R703 IonicContact OD2-NH1 3.99Å; D701-R703 PolarHBondContact OD2-NH1 2.9Å; R703-K706 VanDerWaalsContact O-CB 3.23Å; R703-K706 WeakPolarHBondContact O-CB 3.26Å
704	E	45.8	Very low	43.1	Very low	135 Å²	135	106.2 Å²	106.2	63%	0.631	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-38.8	-173.5	-62.8	-131.7	106.5	0	0	113.3	Y702 K706 K707	Y702-E704 PolarHBondContact O-N 3.24Å; E704-K706 PolarHBondContact O-N 3.48Å; E704-K707 PolarHBondContact O-N 3.03Å; E704-K707 VanDerWaalsContact O-N 3.13Å; E704-K707 IonicContact OE1-NZ 2.74Å
705	K	48.8	Very low	42.2	Very low	98 Å²	98	108.5 Å²	108.5	43%	0.426	55%	0.546	S	S	.	.	G	3₁₀ helix	trans	-60.8	-19.7	-179.8	-69.8	169.8	-175.9	169.3	0	112.8	E700 Y702 K707 V708	E700-K705 IonicContact OE2-NZ 3.75Å; E700-K705 PolarHBondContact OE2-NZ 3.49Å; Y702-K705 HydrophobicContact CD1-CD 3.88Å; Y702-K705 HydrophobicContact CE1-CD 3.97Å; K705-K707 PolarHBondContact O-N 2.93Å; K705-K707 VanDerWaalsContact O-N 3.16Å; K705-V708 PolarHBondContact O-N 3.34Å
706	K	41.6	Very low	41.4	Very low	113 Å²	113	113.1 Å²	113.1	49%	0.491	58%	0.58	S	S	.	*	G	3₁₀ helix	trans	-56.3	-26	174	-159.3	173.9	-174.3	179.8	0	113.6	D415 R703 E704 V708	D415-K706 IonicContact OD1-NZ 3.6Å; D415-K706 PolarHBondContact OD1-NZ 3.15Å; D415-K706 IonicContact OD2-NZ 2.6Å; D415-K706 PolarHBondContact OD2-NZ 3.17Å; R703-K706 VanDerWaalsContact O-CB 3.23Å; R703-K706 WeakPolarHBondContact O-CB 3.26Å; E704-K706 PolarHBondContact O-N 3.48Å; K706-V708 VanDerWaalsContact C-N 3.26Å; K706-V708 PolarHBondContact O-N 2.8Å
707	K	43.1	Very low	40.9	Very low	158 Å²	158	116.4 Å²	116.4	69%	0.687	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-69	-16.3	179.1	-70.2	173.3	-179.3	162.1	0	114.5	E704 K705	E704-K707 PolarHBondContact O-N 3.03Å; E704-K707 VanDerWaalsContact O-N 3.13Å; E704-K707 IonicContact OE1-NZ 2.74Å; K705-K707 PolarHBondContact O-N 2.93Å; K705-K707 VanDerWaalsContact O-N 3.16Å
708	V	41.3	Very low	40.5	Very low	122 Å²	122	121.2 Å²	121.2	74%	0.739	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-92.1	-20	-171.5	-172.1	0	0	0	0	113	K705 K706 T710	K705-V708 PolarHBondContact O-N 3.34Å; K706-V708 VanDerWaalsContact C-N 3.26Å; K706-V708 PolarHBondContact O-N 2.8Å; V708-T710 VanDerWaalsContact C-N 3.34Å; V708-T710 PolarHBondContact O-N 3.43Å
709	I	40.3	Very low	40.5	Very low	127 Å²	127	124.6 Å²	124.6	65%	0.651	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	48.4	-173.1	-39.3	-178.6	0	0	0	111.4
710	T	37.4	Very low	40.3	Very low	111 Å²	111	130.3 Å²	130.3	68%	0.681	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-25.1	178.2	43.8	0	0	0	0	113.6	V708 W712	V708-T710 VanDerWaalsContact C-N 3.34Å; V708-T710 PolarHBondContact O-N 3.43Å; T710-W712 VanDerWaalsContact C-N 3.33Å; T710-W712 PolarHBondContact O-N 2.88Å; T710-W712 VanDerWaalsContact O-N 3.11Å
711	N	36.2	Very low	39.7	Very low	149 Å²	149	133.4 Å²	133.4	80%	0.797	63%	0.627	S	S	*	*			trans	-88.3	57.7	-176.2	-70.6	-13.6	0	0	0	113.1	I713	N711-I713 PolarHBondContact O-N 2.65Å
712	W	41	Very low	38.8	Very low	192 Å²	192	134.7 Å²	134.7	73%	0.727	65%	0.647	S	S	*	*			trans	-81.3	100.5	167.8	-177.5	-85.3	0	0	0	110.5	T710	T710-W712 VanDerWaalsContact C-N 3.33Å; T710-W712 PolarHBondContact O-N 2.88Å; T710-W712 VanDerWaalsContact O-N 3.11Å
713	I	35	Very low	37.8	Very low	144 Å²	144	139.9 Å²	139.9	74%	0.738	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-84.3	122.8	168.6	-61.5	171.9	0	0	0	107.5	N711 P715	N711-I713 PolarHBondContact O-N 2.65Å; I713-P715 VanDerWaalsContact O-CD 3.28Å; I713-P715 WeakPolarHBondContact O-CD 3.19Å
714	E	30.8	Very low	37.2	Very low	124 Å²	124	140.8 Å²	140.8	58%	0.579	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-61.1	123	169.4	-87	-155.4	133.5	0	0	109.8	K717	E714-K717 WeakPolarHBondContact OE1-CE 3.5Å; E714-K717 IonicContact OE1-NZ 3.39Å; E714-K717 PolarHBondContact OE1-NZ 3.35Å; E714-K717 IonicContact OE2-NZ 2.7Å; E714-K717 PolarHBondContact OE2-NZ 2.66Å
715	P	31.1	Very low	36.8	Very low	74 Å²	74	138 Å²	138	48%	0.481	68%	0.682	S	S	.	*	P	Polyproline II helix	trans	-62.7	145.7	171.6	-21.6	34.3	0	0	0	110.9	I713 K717	I713-P715 VanDerWaalsContact O-CD 3.28Å; I713-P715 WeakPolarHBondContact O-CD 3.19Å; P715-K717 PolarHBondContact O-N 2.83Å; P715-K717 VanDerWaalsContact O-N 3.13Å
716	P	28.6	Very low	36.1	Very low	126 Å²	126	137.1 Å²	137.1	82%	0.818	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-61.1	119.3	-178.9	24.4	-33.6	0	0	0	111	R718	P716-R718 PolarHBondContact O-N 3.02Å
717	K	35.3	Very low	36	Very low	145 Å²	145	137.2 Å²	137.2	63%	0.63	69%	0.691	S	S	*	*			trans	-62.7	106.9	-175.8	-74.7	158.7	179.2	150.4	0	110.6	E714 P715 E719	E714-K717 WeakPolarHBondContact OE1-CE 3.5Å; E714-K717 IonicContact OE1-NZ 3.39Å; E714-K717 PolarHBondContact OE1-NZ 3.35Å; E714-K717 IonicContact OE2-NZ 2.7Å; E714-K717 PolarHBondContact OE2-NZ 2.66Å; P715-K717 PolarHBondContact O-N 2.83Å; P715-K717 VanDerWaalsContact O-N 3.13Å; K717-E719 PolarHBondContact O-N 3.48Å
718	R	33.6	Very low	35.7	Very low	166 Å²	166	132.3 Å²	132.3	63%	0.626	68%	0.68	S	S	*	*			trans	-72.5	88.6	177.4	-167.4	-178.7	-168.6	-166.3	5.7	109.7	Y454 P716 R720	Y454-R718 VanDerWaalsContact CD2-NH1 3.27Å; P716-R718 PolarHBondContact O-N 3.02Å; R718-R720 PolarHBondContact O-N 3.44Å
719	E	32.8	Very low	35.6	Very low	193 Å²	193	134.2 Å²	134.2	90%	0.902	68%	0.675	S	S	*	*			trans	-61.7	88.6	-178.4	-70.1	-162.4	153.3	0	0	113.3	K717	K717-E719 PolarHBondContact O-N 3.48Å
720	R	37.1	Very low	35.7	Very low	202 Å²	202	133.6 Å²	133.6	76%	0.762	67%	0.667	S	S	*	*			trans	-88.6	136	148.2	-70	-176.3	174.2	177.6	-1.1	107.5	R718 A722	R718-R720 PolarHBondContact O-N 3.44Å; R720-A722 PolarHBondContact O-N 3.31Å
721	K	32.2	Very low	35.8	Very low	164 Å²	164	136.9 Å²	136.9	71%	0.713	67%	0.667	S	S	*	*			trans	-63.6	100.2	-174.7	-71.4	-179.9	179.6	173.7	0	111.6	N723	K721-N723 PolarHBondContact O-N 3.36Å
722	A	32.8	Very low	35.9	Very low	92 Å²	92	136.5 Å²	136.5	76%	0.76	66%	0.661	S	S	*	*			trans	-81.8	91.2	178.6	0	0	0	0	0	111.5	R720 Y724	R720-A722 PolarHBondContact O-N 3.31Å; A722-Y724 PolarHBondContact O-N 2.99Å
723	N	34.1	Very low	35.9	Very low	159 Å²	159	130.6 Å²	130.6	85%	0.85	65%	0.653	S	S	*	*			trans	-74.7	34.5	173.3	-75.3	1.1	0	0	0	113.1	K721	K721-N723 PolarHBondContact O-N 3.36Å
724	Y	41.6	Very low	36	Very low	163 Å²	163	128.1 Å²	128.1	64%	0.639	64%	0.641	S	S	*	*			trans	-144.8	96.6	-172.6	-139.4	-90.6	0	0	0	114	A722 V726	A722-Y724 PolarHBondContact O-N 2.99Å; Y724-V726 HydrophobicContact CD1-CG2 4.01Å; Y724-V726 PolarHBondContact O-N 2.98Å
725	A	38.4	Very low	36.3	Very low	75 Å²	75	132.2 Å²	132.2	62%	0.62	65%	0.651	S	S	*	*			trans	-82.4	86.9	170.6	0	0	0	0	0	110.1	D727 A728	A725-D727 PolarHBondContact O-N 3.37Å; A725-D727 VanDerWaalsContact O-N 3.15Å; A725-A728 HydrophobicContact CB-CB 4.4Å; A725-A728 WeakPolarHBondContact O-CB 3.48Å; A725-A728 PolarHBondContact O-N 2.74Å
726	V	34.4	Very low	36.6	Very low	81 Å²	81	134.5 Å²	134.5	49%	0.491	66%	0.663	S	S	.	*	H	α-helix	trans	-50.6	-39.6	-179.8	179.4	0	0	0	0	111.8	Y724 A728 Y729 F730	Y724-V726 HydrophobicContact CD1-CG2 4.01Å; Y724-V726 PolarHBondContact O-N 2.98Å; V726-A728 PolarHBondContact O-N 3.46Å; V726-Y729 PolarHBondContact O-N 2.89Å; V726-F730 HydrophobicContact CG1-CD2 4.1Å; V726-F730 HydrophobicContact CG1-CE2 4.03Å
727	D	38.2	Very low	37	Very low	115 Å²	115	133.7 Å²	133.7	62%	0.615	66%	0.661	S	S	*	*	H	α-helix	trans	-58.4	-27.6	179.3	-69.4	-0.8	0	0	0	114.8	A725 R731	A725-D727 PolarHBondContact O-N 3.37Å; A725-D727 VanDerWaalsContact O-N 3.15Å; D727-R731 WeakPolarHBondContact O-CB 3.47Å; D727-R731 PolarHBondContact O-N 3.2Å; D727-R731 VanDerWaalsContact O-N 3.15Å
728	A	37.3	Very low	37	Very low	55 Å²	55	134.5 Å²	134.5	46%	0.455	67%	0.667	S	S	.	*	H	α-helix	trans	-68.8	-45.9	-176	0	0	0	0	0	111.5	A725 V726 F730 R731 E732	A725-A728 HydrophobicContact CB-CB 4.4Å; A725-A728 WeakPolarHBondContact O-CB 3.48Å; A725-A728 PolarHBondContact O-N 2.74Å; V726-A728 PolarHBondContact O-N 3.46Å; A728-F730 PolarHBondContact O-N 2.67Å; A728-R731 WeakPolarHBondContact O-CB 3.48Å; A728-R731 PolarHBondContact O-N 2.95Å; A728-E732 PolarHBondContact O-N 3.36Å
729	Y	40.1	Very low	37.1	Very low	161 Å²	161	132.9 Å²	132.9	63%	0.631	68%	0.678	S	S	*	*	H	α-helix	trans	-66.5	-38.9	-178.2	-172.8	-93.6	0	0	0	112.3	V726 E732 A733	V726-Y729 PolarHBondContact O-N 2.89Å; Y729-E732 PolarHBondContact O-N 3.44Å; Y729-A733 WeakPolarHBondContact O-CB 3.29Å; Y729-A733 PolarHBondContact O-N 2.93Å; Y729-A733 VanDerWaalsContact O-N 3.11Å
730	F	41.6	Very low	37.5	Very low	114 Å²	114	131.7 Å²	131.7	50%	0.5	67%	0.67	S	S	.	*	H	α-helix	trans	-68.8	-32.6	175.1	-79.6	-80.4	0	0	0	112.8	V726 A728 E732 A733 L734	V726-F730 HydrophobicContact CG1-CD2 4.1Å; V726-F730 HydrophobicContact CG1-CE2 4.03Å; A728-F730 PolarHBondContact O-N 2.67Å; F730-E732 VanDerWaalsContact C-N 3.34Å; F730-A733 PolarHBondContact O-N 3.08Å; F730-L734 HydrophobicContact CB-CD1 4.4Å; F730-L734 VanDerWaalsContact O-CB 3.26Å; F730-L734 WeakPolarHBondContact O-CB 3.29Å; F730-L734 WeakPolarHBondContact O-CD1 3.11Å; F730-L734 VanDerWaalsContact O-CG 3.22Å; F730-L734 WeakPolarHBondContact O-CG 3.27Å; F730-L734 PolarHBondContact O-N 3.32Å; F730-L734 VanDerWaalsContact O-N 3.1Å
731	R	40.6	Very low	37.7	Very low	180 Å²	180	125.9 Å²	125.9	68%	0.679	66%	0.664	S	S	*	*	H	α-helix	trans	-66.2	-36.3	177.4	-156.1	176.3	-57.2	176.3	2.3	112.4	D727 A728	D727-R731 WeakPolarHBondContact O-CB 3.47Å; D727-R731 PolarHBondContact O-N 3.2Å; D727-R731 VanDerWaalsContact O-N 3.15Å; A728-R731 WeakPolarHBondContact O-CB 3.48Å; A728-R731 PolarHBondContact O-N 2.95Å
732	E	38	Very low	38	Very low	141 Å²	141	124.4 Å²	124.4	66%	0.659	67%	0.672	S	S	*	*	H	α-helix	trans	-71.4	-43.9	173.8	-151.5	65.6	-140.8	0	0	111.3	A728 Y729 F730 L734	A728-E732 PolarHBondContact O-N 3.36Å; Y729-E732 PolarHBondContact O-N 3.44Å; F730-E732 VanDerWaalsContact C-N 3.34Å; E732-L734 VanDerWaalsContact C-N 3.29Å; E732-L734 PolarHBondContact O-N 3.5Å
733	A	40	Very low	38.7	Very low	68 Å²	68	128 Å²	128	56%	0.562	67%	0.67	S	S	*	*	H	α-helix	trans	-72.9	-12.2	-177	0	0	0	0	0	115.2	Y729 F730	Y729-A733 WeakPolarHBondContact O-CB 3.29Å; Y729-A733 PolarHBondContact O-N 2.93Å; Y729-A733 VanDerWaalsContact O-N 3.11Å; F730-A733 PolarHBondContact O-N 3.08Å
734	L	37.3	Very low	39.2	Very low	92 Å²	92	122.5 Å²	122.5	48%	0.482	65%	0.646	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108.2	18.5	-174.5	-70.8	172.7	0	0	0	114.8	M426 F730 E732 V736	M426-L734 HydrophobicContact SD-CD1 4.12Å; F730-L734 HydrophobicContact CB-CD1 4.4Å; F730-L734 VanDerWaalsContact O-CB 3.26Å; F730-L734 WeakPolarHBondContact O-CB 3.29Å; F730-L734 WeakPolarHBondContact O-CD1 3.11Å; F730-L734 VanDerWaalsContact O-CG 3.22Å; F730-L734 WeakPolarHBondContact O-CG 3.27Å; F730-L734 PolarHBondContact O-N 3.32Å; F730-L734 VanDerWaalsContact O-N 3.1Å; E732-L734 VanDerWaalsContact C-N 3.29Å; E732-L734 PolarHBondContact O-N 3.5Å; L734-V736 PolarHBondContact O-N 3.34Å
735	R	37.7	Very low	39.7	Very low	210 Å²	210	118.9 Å²	118.9	79%	0.792	64%	0.643	S	S	*	*			trans	-70.9	64.5	167.3	-81.2	-172.8	166.5	-178.1	-1.9	112.6	S737	R735-S737 PolarHBondContact O-N 2.81Å
736	V	37.8	Very low	40.4	Very low	123 Å²	123	125.6 Å²	125.6	75%	0.745	65%	0.652	S	S	*	*			trans	-78.6	111.5	162.6	-178	0	0	0	0	107.4	L734 E738	L734-V736 PolarHBondContact O-N 3.34Å; V736-E738 PolarHBondContact O-N 3.47Å
737	S	37.1	Very low	41.4	Very low	109 Å²	109	124.7 Å²	124.7	76%	0.762	65%	0.648	S	S	*	*			trans	-66	123.2	171.3	52.7	0	0	0	0	110.1	R735	R735-S737 PolarHBondContact O-N 2.81Å
738	E	35.3	Very low	42.5	Very low	161 Å²	161	122.8 Å²	122.8	75%	0.752	64%	0.642	S	S	*	*			trans	-58.7	146.8	170.9	-62.6	-178.2	135	0	0	111.1	V736 K740	V736-E738 PolarHBondContact O-N 3.47Å; E738-K740 PolarHBondContact O-N 3.23Å
739	P	35.5	Very low	43.3	Very low	132 Å²	132	130.5 Å²	130.5	86%	0.857	67%	0.665	S	S	*	*			trans	-67.8	95.8	174.5	29	-33.9	0	0	0	109.4	A741	P739-A741 PolarHBondContact O-N 2.87Å
740	K	41	Very low	44.5	Very low	169 Å²	169	125.6 Å²	125.6	74%	0.735	65%	0.648	S	S	*	*			trans	-65.9	132.6	174.5	-65.3	-169.7	177	-173.4	0	108.9	E738	E738-K740 PolarHBondContact O-N 3.23Å
741	A	40.3	Very low	45.8	Very low	79 Å²	79	122.8 Å²	122.8	65%	0.653	64%	0.641	S	S	*	*			trans	-47.4	147.8	173.9	0	0	0	0	0	111.2	P739 K743	P739-A741 PolarHBondContact O-N 2.87Å; A741-K743 PolarHBondContact O-N 3.42Å
742	P	38.7	Very low	47.2	Very low	133 Å²	133	120.3 Å²	120.3	86%	0.864	64%	0.641	S	S	*	*			trans	-53.6	110.1	-171.6	20.7	-33.6	0	0	0	110.7
743	K	48.5	Very low	49.1	Very low	169 Å²	169	115 Å²	115	74%	0.735	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-73.3	134.3	176.7	-73.2	-160.1	166.5	-150.9	0	108.9	A741	A741-K743 PolarHBondContact O-N 3.42Å
744	A	44.9	Very low	51	Low	42 Å²	42	114.1 Å²	114.1	35%	0.347	60%	0.603	S	S	.	*	P	Polyproline II helix	trans	-49	152.7	167.1	0	0	0	0	0	111.3	R746 I778 Y780	A744-R746 PolarHBondContact O-N 3.08Å; A744-I778 HydrophobicContact CB-CD1 4.49Å; A744-Y780 HydrophobicContact CB-CD2 3.6Å; A744-Y780 HydrophobicContact CB-CE2 3.8Å
745	P	51.9	Low	53.1	Low	87 Å²	87	112.4 Å²	112.4	57%	0.565	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-50.3	133.9	177.7	20.4	-32.7	0	0	0	110.5	I778	P745-I778 HydrophobicContact CG-CD1 3.98Å
746	R	51.8	Low	55.4	Low	217 Å²	217	102.4 Å²	102.4	82%	0.819	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-69.9	141.4	-175.8	-60.5	-172.3	-170.5	-169.7	6.5	109.4	A744 Y774	A744-R746 PolarHBondContact O-N 3.08Å; R746-Y774 PolarHBondContact O-OH 2.88Å
747	P	55.8	Low	57.7	Low	62 Å²	62	97.1 Å²	97.1	40%	0.403	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-56.4	159.2	170.2	25.1	-34	0	0	0	111.9	Y774	P747-Y774 VanDerWaalsContact CA-CE1 3.41Å; P747-Y774 HydrophobicContact CB-CD1 3.69Å; P747-Y774 HydrophobicContact CB-CE1 3.95Å; P747-Y774 HydrophobicContact CB-CG 4.24Å
748	P	60.9	Low	60	Low	75 Å²	75	92.1 Å²	92.1	49%	0.487	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-51	153.4	171.1	23.1	-34.6	0	0	0	111	Q750 Y774	P748-Q750 PolarHBondContact O-N 3.02Å; P748-Y774 VanDerWaalsContact CD-CE2 3.49Å; P748-Y774 HydrophobicContact CG-CD2 4.29Å; P748-Y774 HydrophobicContact CG-CE2 4.48Å
749	K	55.1	Low	62.5	Low	216 Å²	216	85 Å²	85	94%	0.939	46%	0.455	S	S	*	.			trans	-64.6	96.2	-176.8	-69.5	-177.3	-177	175.3	0	110.5
750	Q	65.7	Low	64.8	Low	59 Å²	59	80 Å²	80	28%	0.276	42%	0.422	S	S	.	.			trans	-67	157.3	170	-69.7	-173.8	-58.8	0	0	111.2	P748 N752 L767 E770 I771	P748-Q750 PolarHBondContact O-N 3.02Å; Q750-N752 PolarHBondContact O-N 3.04Å; Q750-L767 HydrophobicContact CG-CD2 4.48Å; Q750-L767 PolarHBondContact NE2-O 3.26Å; Q750-L767 VanDerWaalsContact NE2-O 3.17Å; Q750-E770 PolarHBondContact NE2-OE2 2.78Å; Q750-I771 VanDerWaalsContact OE1-CG1 3.31Å
751	P	67.1	Low	66.6	Low	55 Å²	55	76 Å²	76	36%	0.357	41%	0.414	S	S	.	.			trans	-53.8	137.1	170.7	-24.6	34.8	0	0	0	111.4	V753 L820	P751-V753 HydrophobicContact CB-CG2 4.27Å; P751-V753 PolarHBondContact O-N 3.27Å; P751-L820 HydrophobicContact CB-CD2 3.75Å; P751-L820 HydrophobicContact CG-CD1 3.98Å; P751-L820 HydrophobicContact CG-CD2 3.83Å
752	N	70.9	Confident	68.6	Low	127 Å²	127	76.8 Å²	76.8	68%	0.679	40%	0.4	S	S	*	.			trans	-82.5	69.1	179.5	-175.4	80.5	0	0	0	110.8	Q750 Q754	Q750-N752 PolarHBondContact O-N 3.04Å; N752-Q754 PolarHBondContact O-N 3.45Å
753	V	77.3	Confident	70.8	Confident	31 Å²	31	70.5 Å²	70.5	19%	0.188	36%	0.359	C	S	.	.			trans	-61.9	125.7	174.9	-173.9	0	0	0	0	109.3	P751 F759 L763 F764 L767	P751-V753 HydrophobicContact CB-CG2 4.27Å; P751-V753 PolarHBondContact O-N 3.27Å; V753-F759 HydrophobicContact CG1-CB 4.14Å; V753-F759 HydrophobicContact CG1-CD2 3.5Å; V753-F759 VanDerWaalsContact CG1-CD2 3.5Å; V753-F759 HydrophobicContact CG1-CE2 3.97Å; V753-F759 HydrophobicContact CG1-CG 3.89Å; V753-L763 HydrophobicContact CG2-CD2 4.23Å; V753-F764 HydrophobicContact CB-CE1 4.43Å; V753-F764 HydrophobicContact CG1-CE1 3.66Å; V753-F764 HydrophobicContact CG1-CE2 4.39Å; V753-F764 HydrophobicContact CG1-CZ 3.5Å; V753-F764 VanDerWaalsContact CG1-CZ 3.5Å; V753-L767 HydrophobicContact CG2-CD1 3.91Å
754	Q	81	Confident	72.3	Confident	49 Å²	49	67.2 Å²	67.2	23%	0.229	35%	0.345	C	S	.	.			trans	-117.3	148.7	175.2	-66.8	163.7	106.2	0	0	110.9	N752 F756 Q757	N752-Q754 PolarHBondContact O-N 3.45Å; Q754-F756 HydrophobicContact CB-CD1 3.96Å; Q754-F756 HydrophobicContact CB-CE1 3.49Å; Q754-F756 VanDerWaalsContact CB-CE1 3.49Å; Q754-F756 HydrophobicContact CB-CZ 3.93Å; Q754-F756 HydrophobicContact CG-CE1 4Å; Q754-F756 HydrophobicContact CG-CZ 4.35Å; Q754-F756 PolarHBondContact O-N 2.76Å; Q754-Q757 HydrophobicContact CB-CG 4.23Å; Q754-Q757 VanDerWaalsContact NE2-OE1 3.15Å; Q754-Q757 WeakPolarHBondContact O-CB 3.22Å; Q754-Q757 PolarHBondContact O-N 3.2Å; Q754-Q757 VanDerWaalsContact O-N 3.12Å
755	D	81.8	Confident	74.1	Confident	55 Å²	55	70.1 Å²	70.1	29%	0.294	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-57.7	-49	-175.8	57.2	-20.9	0	0	0	112.9	Q757 F758 L876	D755-Q757 PolarHBondContact O-N 3.16Å; D755-F758 PolarHBondContact O-N 3.44Å; D755-L876 HydrophobicContact CB-CD2 3.97Å
756	F	84.3	Confident	75.6	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-65.2	-2	177.9	69	-93.1	0	0	0	115	Q754 K829 F832 Y865 L876	Q754-F756 HydrophobicContact CB-CD1 3.96Å; Q754-F756 HydrophobicContact CB-CE1 3.49Å; Q754-F756 VanDerWaalsContact CB-CE1 3.49Å; Q754-F756 HydrophobicContact CB-CZ 3.93Å; Q754-F756 HydrophobicContact CG-CE1 4Å; Q754-F756 HydrophobicContact CG-CZ 4.35Å; Q754-F756 PolarHBondContact O-N 2.76Å; F756-K829 HydrophobicContact CE1-CB 3.91Å; F756-K829 HydrophobicContact CE1-CD 3.98Å; F756-K829 HydrophobicContact CE1-CG 3.91Å; F756-K829 HydrophobicContact CZ-CB 3.66Å; F756-K829 HydrophobicContact CZ-CG 4.18Å; F756-F832 HydrophobicContact CB-CB 4.42Å; F756-F832 HydrophobicContact CB-CD1 3.87Å; F756-F832 HydrophobicContact CB-CD2 3.66Å; F756-F832 HydrophobicContact CB-CE1 3.94Å; F756-F832 HydrophobicContact CB-CE2 3.72Å; F756-F832 HydrophobicContact CB-CG 3.72Å; F756-F832 HydrophobicContact CB-CZ 3.86Å; F756-F832 HydrophobicContact CD1-CD1 4.12Å; F756-F832 HydrophobicContact CD1-CG 4.45Å; F756-F832 HydrophobicContact CD2-CB 3.7Å; F756-F832 HydrophobicContact CD2-CD1 4.41Å; F756-F832 HydrophobicContact CD2-CD2 4.4Å; F756-F832 AromaticContact CD2-CG 3.94Å; F756-F832 HydrophobicContact CD2-CG 3.94Å; F756-F832 HydrophobicContact CE2-CB 4.17Å; F756-F832 HydrophobicContact CG-CB 4.04Å; F756-F832 AromaticContact CG-CD1 3.87Å; F756-F832 HydrophobicContact CG-CD1 3.87Å; F756-F832 HydrophobicContact CG-CD2 4.2Å; F756-F832 HydrophobicContact CG-CE1 4.36Å; F756-F832 AromaticContact CG-CG 3.77Å; F756-F832 HydrophobicContact CG-CG 3.77Å; F756-Y865 WeakPolarHBondContact O-CE2 3.36Å; F756-Y865 PolarHBondContact O-OH 3.29Å; F756-L876 HydrophobicContact CB-CD2 4.3Å
757	Q	86.8	Confident	77.1	Confident	13 Å²	13	56.4 Å²	56.4	6%	0.061	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-96.9	-0.6	175.3	-57	-175.5	-82.4	0	0	112.7	Q754 D755 F759 F824 W827	Q754-Q757 HydrophobicContact CB-CG 4.23Å; Q754-Q757 VanDerWaalsContact NE2-OE1 3.15Å; Q754-Q757 WeakPolarHBondContact O-CB 3.22Å; Q754-Q757 PolarHBondContact O-N 3.2Å; Q754-Q757 VanDerWaalsContact O-N 3.12Å; D755-Q757 PolarHBondContact O-N 3.16Å; Q757-F759 VanDerWaalsContact C-N 3.32Å; Q757-F759 HydrophobicContact CB-CD2 3.77Å; Q757-F759 HydrophobicContact CB-CE2 3.45Å; Q757-F759 VanDerWaalsContact CB-CE2 3.45Å; Q757-F759 HydrophobicContact CB-CZ 4.48Å; Q757-F759 HydrophobicContact CG-CE2 4.36Å; Q757-F759 PolarHBondContact O-N 2.59Å; Q757-F824 PolarHBondContact NE2-O 2.97Å; Q757-F824 PolarHBondContact O-N 3.28Å; Q757-W827 PolarHBondContact NE2-O 2.95Å
758	F	86.6	Confident	78.3	Confident	4 Å²	4	58 Å²	58	2%	0.018	29%	0.292	C	S	.	.			trans	51.1	40.3	169.2	-59.1	-67.1	0	0	0	115.6	D755 F824 Y865 V868 F869 R872 L876	D755-F758 PolarHBondContact O-N 3.44Å; F758-F824 HydrophobicContact CB-CD2 4.24Å; F758-F824 HydrophobicContact CB-CE2 4.49Å; F758-F824 HydrophobicContact CD2-CD2 4.16Å; F758-F824 HydrophobicContact CD2-CE2 4.35Å; F758-Y865 HydrophobicContact CD2-CE2 4.02Å; F758-Y865 AromaticContact CE2-CE2 3.99Å; F758-Y865 HydrophobicContact CE2-CE2 3.99Å; F758-Y865 AromaticContact CE2-CZ 3.94Å; F758-V868 HydrophobicContact CB-CG1 4.27Å; F758-V868 HydrophobicContact CD2-CG1 4.39Å; F758-V868 HydrophobicContact CG-CG1 4.32Å; F758-F869 HydrophobicContact CE2-CB 4.1Å; F758-F869 HydrophobicContact CE2-CD2 4.14Å; F758-F869 HydrophobicContact CZ-CB 4.29Å; F758-F869 AromaticContact CZ-CD2 3.85Å; F758-F869 HydrophobicContact CZ-CD2 3.85Å; F758-F869 HydrophobicContact CZ-CG 4.47Å; F758-R872 HydrophobicContact CD1-CB 3.79Å; F758-R872 HydrophobicContact CE1-CB 3.91Å; F758-R872 PolarHBondContact O-NH1 3.46Å; F758-R872 PolarHBondContact O-NH2 3.17Å; F758-L876 HydrophobicContact CE1-CD1 4.48Å; F758-L876 HydrophobicContact CE1-CD2 3.83Å; F758-L876 HydrophobicContact CE1-CG 4.13Å; F758-L876 HydrophobicContact CZ-CD1 4.12Å; F758-L876 HydrophobicContact CZ-CD2 4.01Å; F758-L876 HydrophobicContact CZ-CG 4.25Å
759	F	86.3	Confident	79.4	Confident	12 Å²	12	57.1 Å²	57.1	5%	0.053	28%	0.28	C	S	.	.			trans	-60.3	155.4	172.8	-70.6	-92.9	0	0	0	112	V753 Q757 L763 F764 L820 T825 R872	V753-F759 HydrophobicContact CG1-CB 4.14Å; V753-F759 HydrophobicContact CG1-CD2 3.5Å; V753-F759 VanDerWaalsContact CG1-CD2 3.5Å; V753-F759 HydrophobicContact CG1-CE2 3.97Å; V753-F759 HydrophobicContact CG1-CG 3.89Å; Q757-F759 VanDerWaalsContact C-N 3.32Å; Q757-F759 HydrophobicContact CB-CD2 3.77Å; Q757-F759 HydrophobicContact CB-CE2 3.45Å; Q757-F759 VanDerWaalsContact CB-CE2 3.45Å; Q757-F759 HydrophobicContact CB-CZ 4.48Å; Q757-F759 HydrophobicContact CG-CE2 4.36Å; Q757-F759 PolarHBondContact O-N 2.59Å; F759-L763 HydrophobicContact CB-CD2 4.02Å; F759-L763 HydrophobicContact CD1-CD2 3.58Å; F759-L763 HydrophobicContact CE1-CD2 4.29Å; F759-L763 HydrophobicContact CG-CD2 4.03Å; F759-F764 HydrophobicContact CB-CE2 4.24Å; F759-L820 HydrophobicContact CE1-CD2 4.49Å; F759-T825 HydrophobicContact CE1-CG2 4.16Å; F759-T825 HydrophobicContact CZ-CG2 3.9Å; F759-R872 PolarHBondContact O-NH2 2.87Å
760	P	83.7	Confident	80.6	Confident	25 Å²	25	49.3 Å²	49.3	16%	0.162	25%	0.247	C	C	.	.			trans	-67.2	142.6	178.3	-21.8	34.2	0	0	0	112.5	R762 L763 L819 Q822	P760-R762 PolarHBondContact O-N 3.32Å; P760-R762 VanDerWaalsContact O-N 3.13Å; P760-L763 WeakPolarHBondContact O-CB 3.28Å; P760-L763 PolarHBondContact O-N 2.7Å; P760-L819 HydrophobicContact CB-CD2 3.99Å; P760-L819 HydrophobicContact CG-CD2 3.86Å; P760-Q822 HydrophobicContact CG-CB 4.19Å
761	P	80.1	Confident	81.3	Confident	87 Å²	87	48.4 Å²	48.4	57%	0.565	24%	0.243	S	C	*	.	H	α-helix	trans	-52.2	-36.9	178.1	-30.1	36.5	0	0	0	114.3	L763 F764	P761-L763 PolarHBondContact O-N 2.59Å; P761-F764 WeakPolarHBondContact O-CB 3.37Å; P761-F764 PolarHBondContact O-N 2.79Å
762	R	82.5	Confident	82	Confident	95 Å²	95	46.8 Å²	46.8	36%	0.358	23%	0.232	S	C	.	.	H	α-helix	trans	-55	-31.9	178.1	-176.6	57.9	176.9	162.2	8.7	114	P760 F764 E765 L766 E815 L819	P760-R762 PolarHBondContact O-N 3.32Å; P760-R762 VanDerWaalsContact O-N 3.13Å; R762-F764 VanDerWaalsContact C-N 3.29Å; R762-F764 PolarHBondContact O-N 3.2Å; R762-E765 WeakPolarHBondContact CD-OE2 3.46Å; R762-E765 IonicContact CZ-OE2 2.74Å; R762-E765 IonicContact NE-OE2 3.36Å; R762-E765 IonicContact NH1-OE2 3.1Å; R762-E765 PolarHBondContact NH1-OE2 2.86Å; R762-E765 PolarHBondContact O-N 2.89Å; R762-L766 PolarHBondContact O-N 2.91Å; R762-E815 WeakPolarHBondContact CG-OE1 3.37Å; R762-E815 IonicContact CZ-OE1 3.87Å; R762-E815 IonicContact CZ-OE2 2.7Å; R762-E815 IonicContact NE-OE1 2.63Å; R762-E815 PolarHBondContact NE-OE1 3.05Å; R762-E815 IonicContact NE-OE2 3.18Å; R762-E815 PolarHBondContact NE-OE2 3.24Å; R762-E815 IonicContact NH2-OE1 3.3Å; R762-E815 IonicContact NH2-OE2 2.7Å; R762-E815 PolarHBondContact NH2-OE2 3.44Å; R762-L819 HydrophobicContact CB-CD1 4.04Å; R762-L819 HydrophobicContact CG-CD1 3.68Å
763	L	83.6	Confident	82.5	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64	-35.9	176.1	179.4	60.8	0	0	0	111.8	V753 F759 P760 P761 L766 L767 K816 L819 L820	V753-L763 HydrophobicContact CG2-CD2 4.23Å; F759-L763 HydrophobicContact CB-CD2 4.02Å; F759-L763 HydrophobicContact CD1-CD2 3.58Å; F759-L763 HydrophobicContact CE1-CD2 4.29Å; F759-L763 HydrophobicContact CG-CD2 4.03Å; P760-L763 WeakPolarHBondContact O-CB 3.28Å; P760-L763 PolarHBondContact O-N 2.7Å; P761-L763 PolarHBondContact O-N 2.59Å; L763-L766 PolarHBondContact O-N 2.94Å; L763-L767 HydrophobicContact CD1-CD1 4.23Å; L763-L767 HydrophobicContact CD1-CG 4.36Å; L763-L767 HydrophobicContact CG-CD1 3.95Å; L763-L767 HydrophobicContact CG-CG 4.5Å; L763-L767 WeakPolarHBondContact O-CB 3.49Å; L763-L767 VanDerWaalsContact O-CG 3.26Å; L763-L767 WeakPolarHBondContact O-CG 3.27Å; L763-L767 PolarHBondContact O-N 2.82Å; L763-K816 HydrophobicContact CD1-CG 4.12Å; L763-L819 HydrophobicContact CB-CB 4.15Å; L763-L819 HydrophobicContact CB-CD1 4.49Å; L763-L819 HydrophobicContact CD1-CB 4.13Å; L763-L820 HydrophobicContact CD1-CD2 4.18Å; L763-L820 HydrophobicContact CD1-CG 3.93Å; L763-L820 HydrophobicContact CD2-CD2 3.81Å; L763-L820 HydrophobicContact CD2-CG 4.24Å
764	F	80.6	Confident	82.6	Confident	100 Å²	100	45.8 Å²	45.8	44%	0.439	22%	0.217	S	C	.	.	H	α-helix	trans	-71.3	-33.4	179.9	-61.1	-92.5	0	0	0	111.7	V753 F759 P761 R762 L767 E768	V753-F764 HydrophobicContact CB-CE1 4.43Å; V753-F764 HydrophobicContact CG1-CE1 3.66Å; V753-F764 HydrophobicContact CG1-CE2 4.39Å; V753-F764 HydrophobicContact CG1-CZ 3.5Å; V753-F764 VanDerWaalsContact CG1-CZ 3.5Å; F759-F764 HydrophobicContact CB-CE2 4.24Å; P761-F764 WeakPolarHBondContact O-CB 3.37Å; P761-F764 PolarHBondContact O-N 2.79Å; R762-F764 VanDerWaalsContact C-N 3.29Å; R762-F764 PolarHBondContact O-N 3.2Å; F764-L767 PolarHBondContact O-N 2.85Å; F764-E768 WeakPolarHBondContact O-CB 3.47Å; F764-E768 PolarHBondContact O-N 2.67Å
765	E	83.2	Confident	82.5	Confident	104 Å²	104	47.7 Å²	47.7	49%	0.486	22%	0.222	S	C	.	.	H	α-helix	trans	-61.2	-48	173.3	-58.3	179.2	171.4	0	0	111.5	R762 L767 E768 K769	R762-E765 WeakPolarHBondContact CD-OE2 3.46Å; R762-E765 IonicContact CZ-OE2 2.74Å; R762-E765 IonicContact NE-OE2 3.36Å; R762-E765 IonicContact NH1-OE2 3.1Å; R762-E765 PolarHBondContact NH1-OE2 2.86Å; R762-E765 PolarHBondContact O-N 2.89Å; E765-L767 PolarHBondContact O-N 3.12Å; E765-E768 PolarHBondContact O-N 3.09Å; E765-K769 PolarHBondContact O-N 3.09Å
766	L	83.6	Confident	82.5	Confident	2 Å²	2	49 Å²	49	1%	0.01	23%	0.226	C	C	.	.	H	α-helix	trans	-66	-38	179.1	-61.9	174.8	0	0	0	111.7	R762 L763 E770 L808 E812 E815 K816 L819	R762-L766 PolarHBondContact O-N 2.91Å; L763-L766 PolarHBondContact O-N 2.94Å; L766-E770 WeakPolarHBondContact O-CB 3.23Å; L766-E770 PolarHBondContact O-N 3.23Å; L766-E770 VanDerWaalsContact O-N 3.1Å; L766-L808 HydrophobicContact CB-CD2 4.49Å; L766-L808 HydrophobicContact CD2-CD2 4.11Å; L766-E812 HydrophobicContact CD2-CB 4.13Å; L766-E812 HydrophobicContact CD2-CG 4.09Å; L766-E815 HydrophobicContact CD1-CB 4.11Å; L766-E815 HydrophobicContact CD1-CG 4.11Å; L766-K816 HydrophobicContact CD1-CB 4.03Å; L766-L819 HydrophobicContact CD1-CD1 3.96Å
767	L	82.3	Confident	82.2	Confident	13 Å²	13	53.3 Å²	53.3	7%	0.068	25%	0.252	C	S	.	.	H	α-helix	trans	-69.1	-33.3	173.3	-70.2	170.5	0	0	0	112.7	Q750 V753 L763 F764 E765 I771	Q750-L767 HydrophobicContact CG-CD2 4.48Å; Q750-L767 PolarHBondContact NE2-O 3.26Å; Q750-L767 VanDerWaalsContact NE2-O 3.17Å; V753-L767 HydrophobicContact CG2-CD1 3.91Å; L763-L767 HydrophobicContact CD1-CD1 4.23Å; L763-L767 HydrophobicContact CD1-CG 4.36Å; L763-L767 HydrophobicContact CG-CD1 3.95Å; L763-L767 HydrophobicContact CG-CG 4.5Å; L763-L767 WeakPolarHBondContact O-CB 3.49Å; L763-L767 VanDerWaalsContact O-CG 3.26Å; L763-L767 WeakPolarHBondContact O-CG 3.27Å; L763-L767 PolarHBondContact O-N 2.82Å; F764-L767 PolarHBondContact O-N 2.85Å; E765-L767 PolarHBondContact O-N 3.12Å; L767-I771 WeakPolarHBondContact O-CD1 3.39Å; L767-I771 WeakPolarHBondContact O-CG1 3.32Å; L767-I771 PolarHBondContact O-N 3.38Å
768	E	81.7	Confident	81.8	Confident	97 Å²	97	55.6 Å²	55.6	45%	0.453	26%	0.264	S	S	.	.	H	α-helix	trans	-70.1	-44.6	173.8	-172.9	174.5	-179.4	0	0	111.2	F764 E765 E770 I771 L772	F764-E768 WeakPolarHBondContact O-CB 3.47Å; F764-E768 PolarHBondContact O-N 2.67Å; E765-E768 PolarHBondContact O-N 3.09Å; E768-E770 VanDerWaalsContact C-N 3.3Å; E768-E770 PolarHBondContact O-N 3.31Å; E768-I771 WeakPolarHBondContact O-CB 3Å; E768-I771 PolarHBondContact O-N 2.7Å; E768-I771 VanDerWaalsContact O-N 3.08Å; E768-L772 HydrophobicContact CG-CD1 3.94Å; E768-L772 HydrophobicContact CG-CG 4.21Å; E768-L772 WeakPolarHBondContact O-CG 3.21Å; E768-L772 PolarHBondContact O-N 2.78Å
769	K	83.7	Confident	81.1	Confident	56 Å²	56	58 Å²	58	24%	0.243	29%	0.291	C	S	.	.	H	α-helix	trans	-55.9	-45.1	174.7	-172.9	174.8	176.1	-162.7	0	111.3	E765 L772 F773 A807 L808 E812	E765-K769 PolarHBondContact O-N 3.09Å; K769-L772 PolarHBondContact O-N 3.03Å; K769-F773 WeakPolarHBondContact O-CB 3.28Å; K769-F773 PolarHBondContact O-N 3.32Å; K769-A807 WeakPolarHBondContact CE-O 3.29Å; K769-A807 PolarHBondContact NZ-O 2.94Å; K769-L808 HydrophobicContact CB-CD2 4.24Å; K769-L808 HydrophobicContact CD-CD2 3.86Å; K769-L808 HydrophobicContact CG-CD2 4.16Å; K769-E812 IonicContact NZ-OE1 2.65Å; K769-E812 PolarHBondContact NZ-OE1 2.96Å; K769-E812 IonicContact NZ-OE2 2.69Å; K769-E812 PolarHBondContact NZ-OE2 3.28Å
770	E	80.8	Confident	80.6	Confident	51 Å²	51	60.8 Å²	60.8	24%	0.238	30%	0.301	C	S	.	.	H	α-helix	trans	-60.1	-43.9	173.1	-179	178.3	-122.2	0	0	113.1	Q750 L766 E768 Y774 L808 K816	Q750-E770 PolarHBondContact NE2-OE2 2.78Å; L766-E770 WeakPolarHBondContact O-CB 3.23Å; L766-E770 PolarHBondContact O-N 3.23Å; L766-E770 VanDerWaalsContact O-N 3.1Å; E768-E770 VanDerWaalsContact C-N 3.3Å; E768-E770 PolarHBondContact O-N 3.31Å; E770-Y774 WeakPolarHBondContact O-CB 3.4Å; E770-Y774 PolarHBondContact O-N 2.87Å; E770-L808 HydrophobicContact CB-CD1 4.13Å; E770-K816 IonicContact OE1-NZ 3.42Å; E770-K816 PolarHBondContact OE1-NZ 3.32Å; E770-K816 IonicContact OE2-NZ 2.72Å; E770-K816 PolarHBondContact OE2-NZ 3.11Å
771	I	79.1	Confident	80.3	Confident	40 Å²	40	67.6 Å²	67.6	21%	0.205	33%	0.328	C	S	.	.	H	α-helix	trans	-63.1	-45.7	176.6	-70.8	160.5	0	0	0	111.2	Q750 L767 E768 Y774 R775	Q750-I771 VanDerWaalsContact OE1-CG1 3.31Å; L767-I771 WeakPolarHBondContact O-CD1 3.39Å; L767-I771 WeakPolarHBondContact O-CG1 3.32Å; L767-I771 PolarHBondContact O-N 3.38Å; E768-I771 WeakPolarHBondContact O-CB 3Å; E768-I771 PolarHBondContact O-N 2.7Å; E768-I771 VanDerWaalsContact O-N 3.08Å; I771-Y774 PolarHBondContact O-N 2.93Å; I771-R775 HydrophobicContact CG2-CG 4.41Å; I771-R775 VanDerWaalsContact CG2-NE 3.3Å; I771-R775 WeakPolarHBondContact O-CB 3.4Å; I771-R775 VanDerWaalsContact O-CG 3.29Å; I771-R775 WeakPolarHBondContact O-CG 3.37Å; I771-R775 PolarHBondContact O-N 3.09Å
772	L	82.3	Confident	80.2	Confident	22 Å²	22	63.9 Å²	63.9	12%	0.115	30%	0.304	C	S	.	.	H	α-helix	trans	-66.4	-43.9	-177.6	-67.5	171.8	0	0	0	110.7	E768 K769 Y774 R775 K776 K801 I802 A805	E768-L772 HydrophobicContact CG-CD1 3.94Å; E768-L772 HydrophobicContact CG-CG 4.21Å; E768-L772 WeakPolarHBondContact O-CG 3.21Å; E768-L772 PolarHBondContact O-N 2.78Å; K769-L772 PolarHBondContact O-N 3.03Å; L772-Y774 PolarHBondContact O-N 3.34Å; L772-R775 WeakPolarHBondContact O-CB 3.26Å; L772-R775 PolarHBondContact O-N 2.88Å; L772-K776 PolarHBondContact O-N 2.95Å; L772-K801 HydrophobicContact CD1-CB 4.32Å; L772-K801 HydrophobicContact CD2-CB 4.29Å; L772-I802 HydrophobicContact CD2-CG1 3.65Å; L772-A805 HydrophobicContact CB-CB 3.7Å
773	F	82.1	Confident	79.7	Confident	72 Å²	72	63.6 Å²	63.6	32%	0.316	31%	0.314	S	S	.	.	H	α-helix	trans	-63.6	-40.1	173.9	-175.4	-107.9	0	0	0	112.5	K769 K776 T777 A805 E806 A807	K769-F773 WeakPolarHBondContact O-CB 3.28Å; K769-F773 PolarHBondContact O-N 3.32Å; F773-K776 WeakPolarHBondContact O-CB 3.08Å; F773-K776 PolarHBondContact O-N 3.26Å; F773-T777 HydrophobicContact CD1-CG2 4.43Å; F773-T777 HydrophobicContact CE1-CG2 3.98Å; F773-T777 HydrophobicContact CE2-CG2 4.4Å; F773-T777 HydrophobicContact CZ-CG2 3.96Å; F773-T777 PolarHBondContact O-N 3.15Å; F773-A805 HydrophobicContact CB-CB 4.39Å; F773-E806 WeakPolarHBondContact CB-O 3.23Å; F773-A807 HydrophobicContact CD1-CB 4.2Å; F773-A807 HydrophobicContact CD2-CB 4.48Å; F773-A807 HydrophobicContact CE1-CB 3.87Å; F773-A807 HydrophobicContact CE2-CB 4.16Å; F773-A807 HydrophobicContact CG-CB 4.49Å; F773-A807 HydrophobicContact CZ-CB 3.85Å
774	Y	78.3	Confident	79	Confident	64 Å²	64	71 Å²	71	25%	0.251	34%	0.342	S	S	.	.	H	α-helix	trans	-63.1	-42.5	173	-176.6	-91.1	0	0	0	112.1	R746 P747 P748 E770 I771 L772 K776 T777 I778	R746-Y774 PolarHBondContact O-OH 2.88Å; P747-Y774 VanDerWaalsContact CA-CE1 3.41Å; P747-Y774 HydrophobicContact CB-CD1 3.69Å; P747-Y774 HydrophobicContact CB-CE1 3.95Å; P747-Y774 HydrophobicContact CB-CG 4.24Å; P748-Y774 VanDerWaalsContact CD-CE2 3.49Å; P748-Y774 HydrophobicContact CG-CD2 4.29Å; P748-Y774 HydrophobicContact CG-CE2 4.48Å; E770-Y774 WeakPolarHBondContact O-CB 3.4Å; E770-Y774 PolarHBondContact O-N 2.87Å; I771-Y774 PolarHBondContact O-N 2.93Å; L772-Y774 PolarHBondContact O-N 3.34Å; Y774-K776 VanDerWaalsContact C-N 3.26Å; Y774-K776 PolarHBondContact O-N 2.94Å; Y774-T777 PolarHBondContact O-N 3.02Å; Y774-T777 PolarHBondContact O-OG1 3.49Å; Y774-I778 HydrophobicContact CD1-CD1 4.4Å; Y774-I778 HydrophobicContact CD1-CG2 4.31Å; Y774-I778 HydrophobicContact CE1-CD1 3.92Å; Y774-I778 HydrophobicContact CE1-CG1 4.28Å; Y774-I778 HydrophobicContact CE1-CG2 3.64Å; Y774-I778 HydrophobicContact CE2-CG2 4.13Å; Y774-I778 WeakPolarHBondContact O-CG1 3.24Å; Y774-I778 PolarHBondContact O-N 2.7Å; Y774-I778 VanDerWaalsContact O-N 3.12Å
775	R	78.9	Confident	78.3	Confident	89 Å²	89	69.6 Å²	69.6	34%	0.336	34%	0.339	S	S	.	.	H	α-helix	trans	-59.1	-37.9	174.9	-74.9	174.5	-169.5	-180	7.4	111.9	I771 L772 I778 G779 Y780 I802	I771-R775 HydrophobicContact CG2-CG 4.41Å; I771-R775 VanDerWaalsContact CG2-NE 3.3Å; I771-R775 WeakPolarHBondContact O-CB 3.4Å; I771-R775 VanDerWaalsContact O-CG 3.29Å; I771-R775 WeakPolarHBondContact O-CG 3.37Å; I771-R775 PolarHBondContact O-N 3.09Å; L772-R775 WeakPolarHBondContact O-CB 3.26Å; L772-R775 PolarHBondContact O-N 2.88Å; R775-I778 WeakPolarHBondContact O-CG1 3.44Å; R775-G779 PolarHBondContact O-N 3.25Å; R775-Y780 HydrophobicContact CB-CD1 4.47Å; R775-Y780 HydrophobicContact CG-CD1 4.32Å; R775-Y780 HydrophobicContact CG-CG 4.44Å; R775-Y780 WeakPolarHBondContact O-CB 3.26Å; R775-Y780 PolarHBondContact O-N 3.32Å; R775-I802 HydrophobicContact CB-CD1 4.11Å; R775-I802 HydrophobicContact CB-CG1 4.15Å; R775-I802 HydrophobicContact CB-CG2 3.81Å
776	K	81.9	Confident	77.4	Confident	84 Å²	84	69.8 Å²	69.8	37%	0.365	35%	0.35	S	S	.	.	H	α-helix	trans	-62.9	-48.6	174.4	-168.7	178.5	-179.2	159.5	0	111.5	L772 F773 Y774 I778 G779 I802 D803 A805	L772-K776 PolarHBondContact O-N 2.95Å; F773-K776 WeakPolarHBondContact O-CB 3.08Å; F773-K776 PolarHBondContact O-N 3.26Å; Y774-K776 VanDerWaalsContact C-N 3.26Å; Y774-K776 PolarHBondContact O-N 2.94Å; K776-I778 VanDerWaalsContact C-N 3.33Å; K776-I778 PolarHBondContact O-N 3.29Å; K776-G779 PolarHBondContact O-N 3.02Å; K776-G779 VanDerWaalsContact O-N 3.08Å; K776-I802 HydrophobicContact CB-CG2 4.17Å; K776-I802 WeakPolarHBondContact CB-O 3.45Å; K776-I802 WeakPolarHBondContact CD-O 3.42Å; K776-I802 WeakPolarHBondContact CG-O 3.4Å; K776-D803 WeakPolarHBondContact CE-O 3.48Å; K776-D803 PolarHBondContact NZ-O 3.22Å; K776-A805 HydrophobicContact CD-CB 4.31Å; K776-A805 WeakPolarHBondContact CD-O 3.33Å; K776-A805 WeakPolarHBondContact CE-O 3.45Å; K776-A805 PolarHBondContact NZ-O 3.17Å
777	T	78.4	Confident	76.4	Confident	90 Å²	90	76.5 Å²	76.5	55%	0.552	39%	0.386	S	S	*	.	H	α-helix	trans	-67.3	-27.6	-178.8	59	0	0	0	0	114	F773 Y774	F773-T777 HydrophobicContact CD1-CG2 4.43Å; F773-T777 HydrophobicContact CE1-CG2 3.98Å; F773-T777 HydrophobicContact CE2-CG2 4.4Å; F773-T777 HydrophobicContact CZ-CG2 3.96Å; F773-T777 PolarHBondContact O-N 3.15Å; Y774-T777 PolarHBondContact O-N 3.02Å; Y774-T777 PolarHBondContact O-OG1 3.49Å
778	I	77.5	Confident	75.7	Confident	60 Å²	60	79.6 Å²	79.6	31%	0.308	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	3.3	172.3	68.6	163.2	0	0	0	114.5	A744 P745 Y774 R775 K776 Y780	A744-I778 HydrophobicContact CB-CD1 4.49Å; P745-I778 HydrophobicContact CG-CD1 3.98Å; Y774-I778 HydrophobicContact CD1-CD1 4.4Å; Y774-I778 HydrophobicContact CD1-CG2 4.31Å; Y774-I778 HydrophobicContact CE1-CD1 3.92Å; Y774-I778 HydrophobicContact CE1-CG1 4.28Å; Y774-I778 HydrophobicContact CE1-CG2 3.64Å; Y774-I778 HydrophobicContact CE2-CG2 4.13Å; Y774-I778 WeakPolarHBondContact O-CG1 3.24Å; Y774-I778 PolarHBondContact O-N 2.7Å; Y774-I778 VanDerWaalsContact O-N 3.12Å; R775-I778 WeakPolarHBondContact O-CG1 3.44Å; K776-I778 VanDerWaalsContact C-N 3.33Å; K776-I778 PolarHBondContact O-N 3.29Å; I778-Y780 VanDerWaalsContact C-N 3.31Å; I778-Y780 PolarHBondContact O-N 3.03Å
779	G	73.5	Confident	74.5	Confident	56 Å²	56	80.4 Å²	80.4	58%	0.577	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	30.6	-179.5	0	0	0	0	0	114.4	R775 K776 K781	R775-G779 PolarHBondContact O-N 3.25Å; K776-G779 PolarHBondContact O-N 3.02Å; K776-G779 VanDerWaalsContact O-N 3.08Å; G779-K781 PolarHBondContact O-N 3.43Å
780	Y	75.7	Confident	73.8	Confident	70 Å²	70	83.2 Å²	83.2	28%	0.275	43%	0.432	S	S	.	.			trans	-66.5	130.2	-176.5	179.9	-94.7	0	0	0	111.9	A744 R775 I778 V782 P783 Q799 I802	A744-Y780 HydrophobicContact CB-CD2 3.6Å; A744-Y780 HydrophobicContact CB-CE2 3.8Å; R775-Y780 HydrophobicContact CB-CD1 4.47Å; R775-Y780 HydrophobicContact CG-CD1 4.32Å; R775-Y780 HydrophobicContact CG-CG 4.44Å; R775-Y780 WeakPolarHBondContact O-CB 3.26Å; R775-Y780 PolarHBondContact O-N 3.32Å; I778-Y780 VanDerWaalsContact C-N 3.31Å; I778-Y780 PolarHBondContact O-N 3.03Å; Y780-V782 HydrophobicContact CE1-CG2 4.35Å; Y780-P783 VanDerWaalsContact OH-CD 3.29Å; Y780-P783 WeakPolarHBondContact OH-CD 3.44Å; Y780-Q799 PolarHBondContact O-NE2 2.98Å; Y780-I802 HydrophobicContact CD1-CD1 3.92Å; Y780-I802 HydrophobicContact CE1-CD1 4.4Å
781	K	76.8	Confident	73.2	Confident	168 Å²	168	81.5 Å²	81.5	73%	0.73	43%	0.426	S	S	*	.			trans	-108.1	132.3	172.5	-64.7	-169.4	177.7	-173.7	0	111.3	G779 P783 Q799	G779-K781 PolarHBondContact O-N 3.43Å; K781-P783 VanDerWaalsContact O-CD 3.32Å; K781-P783 WeakPolarHBondContact O-CD 3.41Å; K781-Q799 VanDerWaalsContact CA-OE1 3.27Å
782	V	77.3	Confident	72.8	Confident	9 Å²	9	82.1 Å²	82.1	6%	0.055	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-66.5	121	-177.6	-178.3	0	0	0	0	110.5	Y780 Q795 E798 Q799 I802	Y780-V782 HydrophobicContact CE1-CG2 4.35Å; V782-Q795 HydrophobicContact CB-CG 4.19Å; V782-Q795 HydrophobicContact CG1-CG 4.08Å; V782-Q795 PolarHBondContact O-NE2 3.4Å; V782-E798 HydrophobicContact CG1-CB 4.08Å; V782-E798 VanDerWaalsContact CG1-OE2 3.28Å; V782-E798 WeakPolarHBondContact CG1-OE2 3.21Å; V782-E798 HydrophobicContact CG2-CB 3.87Å; V782-Q799 HydrophobicContact CG2-CB 4.25Å; V782-I802 HydrophobicContact CG2-CD1 3.76Å
783	P	72.8	Confident	72.3	Confident	89 Å²	89	86.2 Å²	86.2	58%	0.578	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-72.7	141.6	175.1	-17.2	32	0	0	0	112	Y780 K781 N785	Y780-P783 VanDerWaalsContact OH-CD 3.29Å; Y780-P783 WeakPolarHBondContact OH-CD 3.44Å; K781-P783 VanDerWaalsContact O-CD 3.32Å; K781-P783 WeakPolarHBondContact O-CD 3.41Å; P783-N785 PolarHBondContact O-N 2.88Å
784	R	68.8	Low	71.9	Confident	155 Å²	155	85.4 Å²	85.4	59%	0.585	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-73.8	117.4	175.3	-168.4	175	173.6	-175.1	-1.2	111	S791	R784-S791 PolarHBondContact NE-OG 2.89Å; R784-S791 VanDerWaalsContact NE-OG 3.08Å; R784-S791 PolarHBondContact NH2-OG 3.3Å
785	N	66.4	Low	71.9	Confident	71 Å²	71	85.4 Å²	85.4	38%	0.38	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-83	120.6	173.5	-172.4	-7.8	0	0	0	110.7	P783 D787 I788 S791	P783-N785 PolarHBondContact O-N 2.88Å; N785-D787 VanDerWaalsContact C-N 3.32Å; N785-D787 PolarHBondContact O-N 3.25Å; N785-D787 PolarHBondContact OD1-N 2.97Å; N785-D787 VanDerWaalsContact OD1-N 3.08Å; N785-I788 HydrophobicContact CB-CD1 4.21Å; N785-I788 HydrophobicContact CB-CG1 4.38Å; N785-I788 WeakPolarHBondContact ND2-CD1 3.45Å; N785-S791 WeakPolarHBondContact O-CB 3.27Å
786	P	62.8	Low	71.8	Confident	108 Å²	108	89 Å²	89	70%	0.701	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-21.3	179.1	30.3	-36.4	0	0	0	114.1	I788	P786-I788 VanDerWaalsContact C-N 3.28Å; P786-I788 PolarHBondContact O-N 3.39Å
787	D	62.9	Low	71.7	Confident	143 Å²	143	90.4 Å²	90.4	77%	0.765	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	1.1	-169.8	-58.9	-36.9	0	0	0	113.9	N785	N785-D787 VanDerWaalsContact C-N 3.32Å; N785-D787 PolarHBondContact O-N 3.25Å; N785-D787 PolarHBondContact OD1-N 2.97Å; N785-D787 VanDerWaalsContact OD1-N 3.08Å
788	I	67.8	Low	71.5	Confident	78 Å²	78	90.5 Å²	90.5	40%	0.4	48%	0.479	S	S	.	.	S	Bend	trans	-116.8	127.3	-175.7	-49	-179.8	0	0	0	110.7	N785 P786 S791	N785-I788 HydrophobicContact CB-CD1 4.21Å; N785-I788 HydrophobicContact CB-CG1 4.38Å; N785-I788 WeakPolarHBondContact ND2-CD1 3.45Å; P786-I788 VanDerWaalsContact C-N 3.28Å; P786-I788 PolarHBondContact O-N 3.39Å; I788-S791 WeakPolarHBondContact O-CB 3.43Å; I788-S791 PolarHBondContact O-N 3.47Å
789	P	56.7	Low	71.6	Confident	114 Å²	114	89.3 Å²	89.3	74%	0.74	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	142.2	168.2	-25.7	35.4	0	0	0	112.2	S791	P789-S791 PolarHBondContact O-N 2.62Å
790	N	68.9	Low	72	Confident	114 Å²	114	88.4 Å²	88.4	61%	0.61	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	30.4	-174	-69.8	12.2	0	0	0	115.7	A792 Q793 V794	N790-A792 PolarHBondContact O-N 2.86Å; N790-Q793 PolarHBondContact ND2-OE1 2.77Å; N790-Q793 PolarHBondContact O-N 3.09Å; N790-V794 PolarHBondContact O-N 3.24Å
791	S	68.9	Low	72.3	Confident	15 Å²	15	90.5 Å²	90.5	11%	0.105	47%	0.47	C	S	.	.	H	α-helix	trans	-45	-27	176.8	54.6	0	0	0	0	116.9	R784 N785 I788 P789 Q795	R784-S791 PolarHBondContact NE-OG 2.89Å; R784-S791 VanDerWaalsContact NE-OG 3.08Å; R784-S791 PolarHBondContact NH2-OG 3.3Å; N785-S791 WeakPolarHBondContact O-CB 3.27Å; I788-S791 WeakPolarHBondContact O-CB 3.43Å; I788-S791 PolarHBondContact O-N 3.47Å; P789-S791 PolarHBondContact O-N 2.62Å; S791-Q795 VanDerWaalsContact O-CB 3.23Å; S791-Q795 WeakPolarHBondContact O-CB 3.3Å; S791-Q795 PolarHBondContact O-N 3.34Å; S791-Q795 VanDerWaalsContact O-N 3.15Å
792	A	69.9	Low	72.5	Confident	53 Å²	53	82.6 Å²	82.6	44%	0.438	44%	0.435	S	S	.	.	H	α-helix	trans	-79.6	-24.8	178.1	0	0	0	0	0	114.5	N790	N790-A792 PolarHBondContact O-N 2.86Å
793	Q	73.1	Confident	72.6	Confident	109 Å²	109	86.6 Å²	86.6	51%	0.509	46%	0.457	S	S	.	.	H	α-helix	trans	-76.2	-52	171.8	-74.5	-178.3	-73.2	0	0	110	N790 Q795 K796 E797	N790-Q793 PolarHBondContact ND2-OE1 2.77Å; N790-Q793 PolarHBondContact O-N 3.09Å; Q793-Q795 VanDerWaalsContact C-N 3.29Å; Q793-Q795 PolarHBondContact O-N 3.06Å; Q793-K796 WeakPolarHBondContact O-CA 3.43Å; Q793-K796 WeakPolarHBondContact O-CB 3.5Å; Q793-K796 PolarHBondContact O-N 2.82Å; Q793-E797 WeakPolarHBondContact O-CG 3.43Å; Q793-E797 PolarHBondContact O-N 3.13Å
794	V	72.9	Confident	73	Confident	55 Å²	55	89.4 Å²	89.4	33%	0.333	46%	0.462	S	S	.	.	H	α-helix	trans	-54.3	-44.9	177.8	-175.7	0	0	0	0	111.3	N790 K796 E797 E798	N790-V794 PolarHBondContact O-N 3.24Å; V794-K796 VanDerWaalsContact C-N 3.3Å; V794-K796 PolarHBondContact O-N 2.78Å; V794-E797 PolarHBondContact O-N 3.05Å; V794-E798 HydrophobicContact CG1-CG 4.39Å; V794-E798 WeakPolarHBondContact O-CB 3.45Å; V794-E798 WeakPolarHBondContact O-CG 3.12Å; V794-E798 PolarHBondContact O-N 2.87Å
795	Q	77.6	Confident	73.7	Confident	63 Å²	63	82.6 Å²	82.6	29%	0.294	44%	0.438	S	S	.	.	H	α-helix	trans	-59.3	-37.7	175.5	-174.4	-174.2	14.6	0	0	113	V782 S791 Q793 Q799	V782-Q795 HydrophobicContact CB-CG 4.19Å; V782-Q795 HydrophobicContact CG1-CG 4.08Å; V782-Q795 PolarHBondContact O-NE2 3.4Å; S791-Q795 VanDerWaalsContact O-CB 3.23Å; S791-Q795 WeakPolarHBondContact O-CB 3.3Å; S791-Q795 PolarHBondContact O-N 3.34Å; S791-Q795 VanDerWaalsContact O-N 3.15Å; Q793-Q795 VanDerWaalsContact C-N 3.29Å; Q793-Q795 PolarHBondContact O-N 3.06Å; Q795-Q799 WeakPolarHBondContact O-CB 3.37Å; Q795-Q799 PolarHBondContact O-N 3.05Å; Q795-Q799 VanDerWaalsContact O-N 3.11Å
796	K	78.1	Confident	74.3	Confident	165 Å²	165	85.9 Å²	85.9	72%	0.717	45%	0.451	S	S	*	.	H	α-helix	trans	-74.5	-39	179.8	-168.8	-173.8	177.8	-168.5	0	111.6	Q793 V794 Q799 A800	Q793-K796 WeakPolarHBondContact O-CA 3.43Å; Q793-K796 WeakPolarHBondContact O-CB 3.5Å; Q793-K796 PolarHBondContact O-N 2.82Å; V794-K796 VanDerWaalsContact C-N 3.3Å; V794-K796 PolarHBondContact O-N 2.78Å; K796-Q799 PolarHBondContact O-N 3.42Å; K796-A800 WeakPolarHBondContact O-CB 3.47Å; K796-A800 PolarHBondContact O-N 3.38Å
797	E	78.6	Confident	75.2	Confident	113 Å²	113	83.1 Å²	83.1	53%	0.528	44%	0.438	S	S	.	.	H	α-helix	trans	-68.1	-44.5	177.6	-70.6	159.2	-156	0	0	111.5	Q793 V794 Q799 A800 K801	Q793-E797 WeakPolarHBondContact O-CG 3.43Å; Q793-E797 PolarHBondContact O-N 3.13Å; V794-E797 PolarHBondContact O-N 3.05Å; E797-Q799 VanDerWaalsContact C-N 3.33Å; E797-Q799 PolarHBondContact O-N 3.46Å; E797-A800 PolarHBondContact O-N 2.94Å; E797-K801 WeakPolarHBondContact O-CG 3.49Å; E797-K801 PolarHBondContact O-N 2.93Å; E797-K801 VanDerWaalsContact O-N 3.15Å
798	E	75.4	Confident	76.1	Confident	93 Å²	93	77.7 Å²	77.7	44%	0.435	41%	0.409	S	S	.	.	H	α-helix	trans	-65.6	-33.8	173.4	-72.4	-167.2	150.6	0	0	112.7	V782 V794 I802	V782-E798 HydrophobicContact CG1-CB 4.08Å; V782-E798 VanDerWaalsContact CG1-OE2 3.28Å; V782-E798 WeakPolarHBondContact CG1-OE2 3.21Å; V782-E798 HydrophobicContact CG2-CB 3.87Å; V794-E798 HydrophobicContact CG1-CG 4.39Å; V794-E798 WeakPolarHBondContact O-CB 3.45Å; V794-E798 WeakPolarHBondContact O-CG 3.12Å; V794-E798 PolarHBondContact O-N 2.87Å; E798-I802 WeakPolarHBondContact O-CG1 3.27Å; E798-I802 PolarHBondContact O-N 3.11Å
799	Q	79.2	Confident	77	Confident	35 Å²	35	77.2 Å²	77.2	16%	0.164	41%	0.41	C	S	.	.	H	α-helix	trans	-69.4	-43.7	174.9	-170.6	66.8	55.9	0	0	111.3	Y780 K781 V782 Q795 K796 E797 K801 I802 D803	Y780-Q799 PolarHBondContact O-NE2 2.98Å; K781-Q799 VanDerWaalsContact CA-OE1 3.27Å; V782-Q799 HydrophobicContact CG2-CB 4.25Å; Q795-Q799 WeakPolarHBondContact O-CB 3.37Å; Q795-Q799 PolarHBondContact O-N 3.05Å; Q795-Q799 VanDerWaalsContact O-N 3.11Å; K796-Q799 PolarHBondContact O-N 3.42Å; E797-Q799 VanDerWaalsContact C-N 3.33Å; E797-Q799 PolarHBondContact O-N 3.46Å; Q799-K801 VanDerWaalsContact C-N 3.32Å; Q799-K801 PolarHBondContact O-N 3.24Å; Q799-I802 PolarHBondContact O-N 2.9Å; Q799-D803 PolarHBondContact NE2-OD1 3.47Å; Q799-D803 VanDerWaalsContact O-CG 3.28Å; Q799-D803 PolarHBondContact O-N 3.25Å
800	A	81.8	Confident	78.1	Confident	36 Å²	36	79.9 Å²	79.9	30%	0.298	41%	0.412	S	S	.	.	H	α-helix	trans	-57	-44.9	176.8	0	0	0	0	0	111.7	K796 E797 I802 D803 E804	K796-A800 WeakPolarHBondContact O-CB 3.47Å; K796-A800 PolarHBondContact O-N 3.38Å; E797-A800 PolarHBondContact O-N 2.94Å; A800-I802 PolarHBondContact O-N 3.26Å; A800-D803 PolarHBondContact O-N 3.05Å; A800-D803 VanDerWaalsContact O-N 3.15Å; A800-E804 WeakPolarHBondContact O-CB 3.2Å; A800-E804 WeakPolarHBondContact O-CG 3.42Å; A800-E804 PolarHBondContact O-N 3.08Å
801	K	82.3	Confident	78.8	Confident	115 Å²	115	82.2 Å²	82.2	50%	0.5	42%	0.419	S	S	.	.	H	α-helix	trans	-57	-30.3	174	-74.3	-178.2	171.6	-166.3	0	114.4	L772 E797 Q799	L772-K801 HydrophobicContact CD1-CB 4.32Å; L772-K801 HydrophobicContact CD2-CB 4.29Å; E797-K801 WeakPolarHBondContact O-CG 3.49Å; E797-K801 PolarHBondContact O-N 2.93Å; E797-K801 VanDerWaalsContact O-N 3.15Å; Q799-K801 VanDerWaalsContact C-N 3.32Å; Q799-K801 PolarHBondContact O-N 3.24Å
802	I	79.9	Confident	79.5	Confident	1 Å²	1	83.1 Å²	83.1	1%	0.005	42%	0.422	C	S	.	.	H	α-helix	trans	-81.9	-44.1	176.4	-66.2	167.6	0	0	0	110	L772 R775 K776 Y780 V782 E798 Q799 A800 E804 A805	L772-I802 HydrophobicContact CD2-CG1 3.65Å; R775-I802 HydrophobicContact CB-CD1 4.11Å; R775-I802 HydrophobicContact CB-CG1 4.15Å; R775-I802 HydrophobicContact CB-CG2 3.81Å; K776-I802 HydrophobicContact CB-CG2 4.17Å; K776-I802 WeakPolarHBondContact CB-O 3.45Å; K776-I802 WeakPolarHBondContact CD-O 3.42Å; K776-I802 WeakPolarHBondContact CG-O 3.4Å; Y780-I802 HydrophobicContact CD1-CD1 3.92Å; Y780-I802 HydrophobicContact CE1-CD1 4.4Å; V782-I802 HydrophobicContact CG2-CD1 3.76Å; E798-I802 WeakPolarHBondContact O-CG1 3.27Å; E798-I802 PolarHBondContact O-N 3.11Å; Q799-I802 PolarHBondContact O-N 2.9Å; A800-I802 PolarHBondContact O-N 3.26Å; I802-E804 VanDerWaalsContact C-N 3.29Å; I802-E804 PolarHBondContact O-N 3.02Å; I802-A805 WeakPolarHBondContact O-CB 3.38Å; I802-A805 PolarHBondContact O-N 2.93Å
803	D	79.3	Confident	80	Confident	94 Å²	94	84.3 Å²	84.3	50%	0.503	42%	0.421	S	S	.	.	H	α-helix	trans	-66.5	-31.8	-178.4	-63.5	-7.4	0	0	0	111.6	K776 Q799 A800	K776-D803 WeakPolarHBondContact CE-O 3.48Å; K776-D803 PolarHBondContact NZ-O 3.22Å; Q799-D803 PolarHBondContact NE2-OD1 3.47Å; Q799-D803 VanDerWaalsContact O-CG 3.28Å; Q799-D803 PolarHBondContact O-N 3.25Å; A800-D803 PolarHBondContact O-N 3.05Å; A800-D803 VanDerWaalsContact O-N 3.15Å
804	E	82.4	Confident	80.5	Confident	148 Å²	148	85.7 Å²	85.7	69%	0.692	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-14.9	176.9	-70.2	170.9	-172	0	0	113.9	A800 I802	A800-E804 WeakPolarHBondContact O-CB 3.2Å; A800-E804 WeakPolarHBondContact O-CG 3.42Å; A800-E804 PolarHBondContact O-N 3.08Å; I802-E804 VanDerWaalsContact C-N 3.29Å; I802-E804 PolarHBondContact O-N 3.02Å
805	A	82.4	Confident	81.1	Confident	11 Å²	11	86 Å²	86	9%	0.091	43%	0.425	C	S	.	.			trans	-63.2	142.2	-169.4	0	0	0	0	0	115.3	L772 F773 K776 I802	L772-A805 HydrophobicContact CB-CB 3.7Å; F773-A805 HydrophobicContact CB-CB 4.39Å; K776-A805 HydrophobicContact CD-CB 4.31Å; K776-A805 WeakPolarHBondContact CD-O 3.33Å; K776-A805 WeakPolarHBondContact CE-O 3.45Å; K776-A805 PolarHBondContact NZ-O 3.17Å; I802-A805 WeakPolarHBondContact O-CB 3.38Å; I802-A805 PolarHBondContact O-N 2.93Å
806	E	80.2	Confident	81.4	Confident	140 Å²	140	84 Å²	84	65%	0.654	42%	0.415	S	S	*	.			trans	-120.1	161.2	178.5	-61.6	-169.8	147.7	0	0	111.7	F773	F773-E806 WeakPolarHBondContact CB-O 3.23Å
807	A	80.6	Confident	81.6	Confident	50 Å²	50	82 Å²	82	41%	0.413	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-64.4	160	176.4	0	0	0	0	0	111.8	K769 F773	K769-A807 WeakPolarHBondContact CE-O 3.29Å; K769-A807 PolarHBondContact NZ-O 2.94Å; F773-A807 HydrophobicContact CD1-CB 4.2Å; F773-A807 HydrophobicContact CD2-CB 4.48Å; F773-A807 HydrophobicContact CE1-CB 3.87Å; F773-A807 HydrophobicContact CE2-CB 4.16Å; F773-A807 HydrophobicContact CG-CB 4.49Å; F773-A807 HydrophobicContact CZ-CB 3.85Å
808	L	82.9	Confident	81.9	Confident	30 Å²	30	80.9 Å²	80.9	16%	0.157	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-71.1	139.8	165.8	-65.8	172.8	0	0	0	109.7	L766 K769 E770 E812 L813 K816	L766-L808 HydrophobicContact CB-CD2 4.49Å; L766-L808 HydrophobicContact CD2-CD2 4.11Å; K769-L808 HydrophobicContact CB-CD2 4.24Å; K769-L808 HydrophobicContact CD-CD2 3.86Å; K769-L808 HydrophobicContact CG-CD2 4.16Å; E770-L808 HydrophobicContact CB-CD1 4.13Å; L808-E812 VanDerWaalsContact CA-OE2 3.28Å; L808-E812 WeakPolarHBondContact CA-OE2 3.35Å; L808-E812 HydrophobicContact CB-CB 4.24Å; L808-E812 HydrophobicContact CD2-CB 4.01Å; L808-L813 HydrophobicContact CB-CD2 4.09Å; L808-L813 HydrophobicContact CB-CG 4.04Å; L808-L813 HydrophobicContact CD1-CD2 3.78Å; L808-K816 HydrophobicContact CD1-CD 4.27Å
809	T	86.7	Confident	82.2	Confident	68 Å²	68	77.2 Å²	77.2	42%	0.417	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-74.4	166.4	169.1	66.5	0	0	0	0	111	E811 E812 L813	T809-E811 VanDerWaalsContact C-N 3.26Å; T809-E811 PolarHBondContact O-N 3.22Å; T809-E812 PolarHBondContact N-OE2 3.21Å; T809-E812 PolarHBondContact O-N 3.05Å; T809-E812 WeakPolarHBondContact OG1-CG 3.45Å; T809-E812 PolarHBondContact OG1-N 3.02Å; T809-E812 VanDerWaalsContact OG1-N 3.11Å; T809-L813 WeakPolarHBondContact O-CG 3.22Å; T809-L813 PolarHBondContact O-N 2.92Å
810	E	79.8	Confident	82.3	Confident	169 Å²	169	77.1 Å²	77.1	79%	0.79	39%	0.39	S	S	*	.	H	α-helix	trans	-61	-37.4	174.2	-63.8	-177.3	149.5	0	0	111.2	L813 E814	E810-L813 PolarHBondContact O-N 3.38Å; E810-E814 PolarHBondContact O-N 3.41Å; E810-E814 VanDerWaalsContact O-N 3.08Å
811	E	82.3	Confident	82.2	Confident	163 Å²	163	82.1 Å²	82.1	76%	0.762	41%	0.407	S	S	*	.	H	α-helix	trans	-63.2	-43	173.4	-59.7	178	156.5	0	0	112.6	T809 L813 E814 E815	T809-E811 VanDerWaalsContact C-N 3.26Å; T809-E811 PolarHBondContact O-N 3.22Å; E811-L813 VanDerWaalsContact C-N 3.29Å; E811-L813 PolarHBondContact O-N 3.49Å; E811-E814 PolarHBondContact O-N 3.09Å; E811-E815 PolarHBondContact O-N 3.12Å
812	E	84.1	Confident	82.2	Confident	34 Å²	34	82.7 Å²	82.7	16%	0.159	41%	0.411	C	S	.	.	H	α-helix	trans	-69	-26.4	176.5	-75	175.5	141	0	0	112.7	L766 K769 L808 T809 K816	L766-E812 HydrophobicContact CD2-CB 4.13Å; L766-E812 HydrophobicContact CD2-CG 4.09Å; K769-E812 IonicContact NZ-OE1 2.65Å; K769-E812 PolarHBondContact NZ-OE1 2.96Å; K769-E812 IonicContact NZ-OE2 2.69Å; K769-E812 PolarHBondContact NZ-OE2 3.28Å; L808-E812 VanDerWaalsContact CA-OE2 3.28Å; L808-E812 WeakPolarHBondContact CA-OE2 3.35Å; L808-E812 HydrophobicContact CB-CB 4.24Å; L808-E812 HydrophobicContact CD2-CB 4.01Å; T809-E812 PolarHBondContact N-OE2 3.21Å; T809-E812 PolarHBondContact O-N 3.05Å; T809-E812 WeakPolarHBondContact OG1-CG 3.45Å; T809-E812 PolarHBondContact OG1-N 3.02Å; T809-E812 VanDerWaalsContact OG1-N 3.11Å; E812-K816 VanDerWaalsContact O-CB 3.29Å; E812-K816 WeakPolarHBondContact O-CB 3.46Å; E812-K816 PolarHBondContact O-N 3.14Å
813	L	80.2	Confident	82.3	Confident	79 Å²	79	83 Å²	83	41%	0.414	42%	0.415	S	S	.	.	H	α-helix	trans	-72.3	-41.1	173	-71.7	168.9	0	0	0	111.4	L808 T809 E810 E811 K816 E817	L808-L813 HydrophobicContact CB-CD2 4.09Å; L808-L813 HydrophobicContact CB-CG 4.04Å; L808-L813 HydrophobicContact CD1-CD2 3.78Å; T809-L813 WeakPolarHBondContact O-CG 3.22Å; T809-L813 PolarHBondContact O-N 2.92Å; E810-L813 PolarHBondContact O-N 3.38Å; E811-L813 VanDerWaalsContact C-N 3.29Å; E811-L813 PolarHBondContact O-N 3.49Å; L813-K816 PolarHBondContact O-N 2.72Å; L813-E817 PolarHBondContact O-N 3.07Å
814	E	83.9	Confident	82.6	Confident	138 Å²	138	80.2 Å²	80.2	65%	0.645	40%	0.398	S	S	*	.	H	α-helix	trans	-66.7	-38.8	171.2	-68.5	-168.7	170.6	0	0	111.9	E810 E811 K816 E817 N818	E810-E814 PolarHBondContact O-N 3.41Å; E810-E814 VanDerWaalsContact O-N 3.08Å; E811-E814 PolarHBondContact O-N 3.09Å; E814-K816 VanDerWaalsContact C-N 3.32Å; E814-K816 PolarHBondContact O-N 2.7Å; E814-E817 PolarHBondContact O-N 3.13Å; E814-N818 PolarHBondContact O-N 3.27Å; E814-N818 PolarHBondContact O-ND2 3.4Å
815	E	86.1	Confident	82.5	Confident	62 Å²	62	77 Å²	77	29%	0.29	39%	0.389	S	S	.	.	H	α-helix	trans	-57.1	-47	172.7	-163.9	-169.8	171.3	0	0	110.6	R762 L766 E811 N818 L819	R762-E815 WeakPolarHBondContact CG-OE1 3.37Å; R762-E815 IonicContact CZ-OE1 3.87Å; R762-E815 IonicContact CZ-OE2 2.7Å; R762-E815 IonicContact NE-OE1 2.63Å; R762-E815 PolarHBondContact NE-OE1 3.05Å; R762-E815 IonicContact NE-OE2 3.18Å; R762-E815 PolarHBondContact NE-OE2 3.24Å; R762-E815 IonicContact NH2-OE1 3.3Å; R762-E815 IonicContact NH2-OE2 2.7Å; R762-E815 PolarHBondContact NH2-OE2 3.44Å; L766-E815 HydrophobicContact CD1-CB 4.11Å; L766-E815 HydrophobicContact CD1-CG 4.11Å; E811-E815 PolarHBondContact O-N 3.12Å; E815-N818 PolarHBondContact O-N 3.1Å; E815-L819 HydrophobicContact CG-CD1 3.9Å; E815-L819 HydrophobicContact CG-CG 4.49Å; E815-L819 WeakPolarHBondContact O-CB 3.41Å; E815-L819 VanDerWaalsContact O-CG 3.22Å; E815-L819 WeakPolarHBondContact O-CG 3.33Å; E815-L819 PolarHBondContact O-N 3.4Å
816	K	83.1	Confident	82.5	Confident	20 Å²	20	82.5 Å²	82.5	9%	0.087	42%	0.416	C	S	.	.	H	α-helix	trans	-62.4	-45.6	178	174.7	179.8	166.4	-179.4	0	113.2	L763 L766 E770 L808 E812 L813 E814 N818 L819 L820	L763-K816 HydrophobicContact CD1-CG 4.12Å; L766-K816 HydrophobicContact CD1-CB 4.03Å; E770-K816 IonicContact OE1-NZ 3.42Å; E770-K816 PolarHBondContact OE1-NZ 3.32Å; E770-K816 IonicContact OE2-NZ 2.72Å; E770-K816 PolarHBondContact OE2-NZ 3.11Å; L808-K816 HydrophobicContact CD1-CD 4.27Å; E812-K816 VanDerWaalsContact O-CB 3.29Å; E812-K816 WeakPolarHBondContact O-CB 3.46Å; E812-K816 PolarHBondContact O-N 3.14Å; L813-K816 PolarHBondContact O-N 2.72Å; E814-K816 VanDerWaalsContact C-N 3.32Å; E814-K816 PolarHBondContact O-N 2.7Å; K816-N818 VanDerWaalsContact C-N 3.33Å; K816-N818 PolarHBondContact O-N 2.74Å; K816-L819 PolarHBondContact O-N 3.23Å; K816-L820 HydrophobicContact CG-CD1 4.19Å; K816-L820 WeakPolarHBondContact O-CG 3.38Å; K816-L820 PolarHBondContact O-N 3.08Å; K816-L820 VanDerWaalsContact O-N 3.08Å
817	E	81.5	Confident	82.8	Confident	124 Å²	124	76 Å²	76	58%	0.579	39%	0.385	S	S	*	.	H	α-helix	trans	-60	-42	176.4	-78.2	-77.2	120.5	0	0	111.6	L813 E814	L813-E817 PolarHBondContact O-N 3.07Å; E814-E817 PolarHBondContact O-N 3.13Å
818	N	84.9	Confident	83.1	Confident	89 Å²	89	76 Å²	76	48%	0.476	38%	0.382	S	S	.	.	H	α-helix	trans	-68	-43.7	177.1	-76.5	-66.7	0	0	0	112.4	E814 E815 K816 L820 Q821	E814-N818 PolarHBondContact O-N 3.27Å; E814-N818 PolarHBondContact O-ND2 3.4Å; E815-N818 PolarHBondContact O-N 3.1Å; K816-N818 VanDerWaalsContact C-N 3.33Å; K816-N818 PolarHBondContact O-N 2.74Å; N818-L820 VanDerWaalsContact C-N 3.27Å; N818-L820 PolarHBondContact O-N 2.9Å; N818-Q821 PolarHBondContact O-N 3.4Å; N818-Q821 VanDerWaalsContact O-N 3.09Å
819	L	83.6	Confident	83.2	Confident	16 Å²	16	80 Å²	80	8%	0.084	40%	0.398	C	S	.	.	H	α-helix	trans	-66.1	-27	179.1	-70.2	168.5	0	0	0	113.1	P760 R762 L763 L766 E815 K816 Q821 Q822	P760-L819 HydrophobicContact CB-CD2 3.99Å; P760-L819 HydrophobicContact CG-CD2 3.86Å; R762-L819 HydrophobicContact CB-CD1 4.04Å; R762-L819 HydrophobicContact CG-CD1 3.68Å; L763-L819 HydrophobicContact CB-CB 4.15Å; L763-L819 HydrophobicContact CB-CD1 4.49Å; L763-L819 HydrophobicContact CD1-CB 4.13Å; L766-L819 HydrophobicContact CD1-CD1 3.96Å; E815-L819 HydrophobicContact CG-CD1 3.9Å; E815-L819 HydrophobicContact CG-CG 4.49Å; E815-L819 WeakPolarHBondContact O-CB 3.41Å; E815-L819 VanDerWaalsContact O-CG 3.22Å; E815-L819 WeakPolarHBondContact O-CG 3.33Å; E815-L819 PolarHBondContact O-N 3.4Å; K816-L819 PolarHBondContact O-N 3.23Å; L819-Q821 PolarHBondContact O-N 3.36Å; L819-Q822 PolarHBondContact O-N 3Å
820	L	80.6	Confident	83.2	Confident	32 Å²	32	84 Å²	84	17%	0.168	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-19.6	172.8	-77.7	164.3	0	0	0	113.6	P751 F759 L763 K816 N818	P751-L820 HydrophobicContact CB-CD2 3.75Å; P751-L820 HydrophobicContact CG-CD1 3.98Å; P751-L820 HydrophobicContact CG-CD2 3.83Å; F759-L820 HydrophobicContact CE1-CD2 4.49Å; L763-L820 HydrophobicContact CD1-CD2 4.18Å; L763-L820 HydrophobicContact CD1-CG 3.93Å; L763-L820 HydrophobicContact CD2-CD2 3.81Å; L763-L820 HydrophobicContact CD2-CG 4.24Å; K816-L820 HydrophobicContact CG-CD1 4.19Å; K816-L820 WeakPolarHBondContact O-CG 3.38Å; K816-L820 PolarHBondContact O-N 3.08Å; K816-L820 VanDerWaalsContact O-N 3.08Å; N818-L820 VanDerWaalsContact C-N 3.27Å; N818-L820 PolarHBondContact O-N 2.9Å
821	Q	79.6	Confident	83.6	Confident	141 Å²	141	77 Å²	77	66%	0.659	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-17	176.9	-61.2	178.7	35.8	0	0	113.1	N818 L819	N818-Q821 PolarHBondContact O-N 3.4Å; N818-Q821 VanDerWaalsContact O-N 3.09Å; L819-Q821 PolarHBondContact O-N 3.36Å
822	Q	81.3	Confident	84	Confident	127 Å²	127	70 Å²	70	59%	0.593	34%	0.341	S	S	*	.	S	Bend	trans	-86.4	-10.7	-173.5	-64.7	177.3	14.8	0	0	114.7	P760 L819	P760-Q822 HydrophobicContact CG-CB 4.19Å; L819-Q822 PolarHBondContact O-N 3Å
823	G	82.1	Confident	84.3	Confident	8 Å²	8	72.1 Å²	72.1	8%	0.082	35%	0.353	C	S	.	.	S	Bend	trans	-85	162.5	174.7	0	0	0	0	0	112.8	T825	G823-T825 PolarHBondContact O-N 3.15Å
824	F	85.3	Confident	84.7	Confident	35 Å²	35	70 Å²	70	15%	0.154	34%	0.341	C	S	.	.			trans	-72.6	63.1	173.7	-68.7	-78.2	0	0	0	111.9	Q757 F758 I826 W827 E864 Y865 V868	Q757-F824 PolarHBondContact NE2-O 2.97Å; Q757-F824 PolarHBondContact O-N 3.28Å; F758-F824 HydrophobicContact CB-CD2 4.24Å; F758-F824 HydrophobicContact CB-CE2 4.49Å; F758-F824 HydrophobicContact CD2-CD2 4.16Å; F758-F824 HydrophobicContact CD2-CE2 4.35Å; F824-I826 PolarHBondContact O-N 3.18Å; F824-W827 HydrophobicContact CB-CB 4.11Å; F824-W827 HydrophobicContact CB-CG 4.19Å; F824-W827 AromaticContact CD1-CD1 3.83Å; F824-W827 WeakPolarHBondContact O-CB 3.47Å; F824-W827 PolarHBondContact O-N 3.05Å; F824-E864 HydrophobicContact CE1-CG 4.3Å; F824-E864 HydrophobicContact CZ-CG 4.37Å; F824-Y865 HydrophobicContact CB-CD2 4.27Å; F824-Y865 HydrophobicContact CB-CE2 4.29Å; F824-Y865 AromaticContact CD1-CD2 3.91Å; F824-Y865 HydrophobicContact CD1-CD2 3.91Å; F824-Y865 AromaticContact CD2-CD2 3.81Å; F824-Y865 HydrophobicContact CD2-CD2 3.81Å; F824-Y865 HydrophobicContact CD2-CE2 4.04Å; F824-Y865 HydrophobicContact CE1-CD2 4.14Å; F824-Y865 HydrophobicContact CE2-CD2 4.04Å; F824-Y865 AromaticContact CG-CD2 3.74Å; F824-Y865 HydrophobicContact CG-CD2 3.74Å; F824-Y865 HydrophobicContact CG-CE2 4.12Å; F824-Y865 HydrophobicContact CZ-CD2 4.19Å; F824-V868 HydrophobicContact CE2-CB 3.87Å; F824-V868 HydrophobicContact CE2-CG1 3.93Å; F824-V868 HydrophobicContact CE2-CG2 4.13Å; F824-V868 HydrophobicContact CZ-CB 4.1Å; F824-V868 HydrophobicContact CZ-CG2 3.95Å
825	T	80.6	Confident	85.1	Confident	82 Å²	82	63.4 Å²	63.4	50%	0.503	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-33.4	-179.9	52.9	0	0	0	0	112.7	F759 G823 W827	F759-T825 HydrophobicContact CE1-CG2 4.16Å; F759-T825 HydrophobicContact CZ-CG2 3.9Å; G823-T825 PolarHBondContact O-N 3.15Å; T825-W827 VanDerWaalsContact C-N 3.25Å; T825-W827 PolarHBondContact O-N 3.39Å
826	I	83.1	Confident	85.3	Confident	125 Å²	125	61 Å²	61	64%	0.641	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-3.1	178.3	-25.6	178.8	0	0	0	112.8	F824 K857	F824-I826 PolarHBondContact O-N 3.18Å; I826-K857 WeakPolarHBondContact O-CE 3.38Å; I826-K857 PolarHBondContact O-NZ 3.49Å
827	W	86.6	Confident	85.6	Confident	5 Å²	5	66 Å²	66	2%	0.019	32%	0.321	C	S	.	.			trans	-97.8	120.3	173.3	-80.1	75.8	0	0	0	110.3	Q757 F824 T825 D831 F835 V854 K857 V862 Y865	Q757-W827 PolarHBondContact NE2-O 2.95Å; F824-W827 HydrophobicContact CB-CB 4.11Å; F824-W827 HydrophobicContact CB-CG 4.19Å; F824-W827 AromaticContact CD1-CD1 3.83Å; F824-W827 WeakPolarHBondContact O-CB 3.47Å; F824-W827 PolarHBondContact O-N 3.05Å; T825-W827 VanDerWaalsContact C-N 3.25Å; T825-W827 PolarHBondContact O-N 3.39Å; W827-D831 HydrophobicContact CE3-CB 3.96Å; W827-D831 HydrophobicContact CZ3-CB 4.26Å; W827-F835 HydrophobicContact CZ3-CB 4.15Å; W827-V854 HydrophobicContact CH2-CG1 4.11Å; W827-V854 HydrophobicContact CZ3-CG1 4.2Å; W827-K857 HydrophobicContact CH2-CG 4.36Å; W827-K857 HydrophobicContact CZ2-CD 4.36Å; W827-K857 HydrophobicContact CZ2-CG 4.1Å; W827-V862 HydrophobicContact CH2-CG2 4.12Å; W827-V862 HydrophobicContact CZ2-CG2 4.25Å; W827-Y865 HydrophobicContact CB-CE2 4.44Å; W827-Y865 AromaticContact CD1-CD2 3.99Å; W827-Y865 HydrophobicContact CD2-CD1 4.12Å; W827-Y865 AromaticContact CD2-CD2 3.71Å; W827-Y865 HydrophobicContact CD2-CD2 3.71Å; W827-Y865 HydrophobicContact CD2-CE1 4.38Å; W827-Y865 AromaticContact CD2-CE2 3.98Å; W827-Y865 HydrophobicContact CD2-CE2 3.98Å; W827-Y865 AromaticContact CD2-CG 3.78Å; W827-Y865 HydrophobicContact CD2-CG 3.78Å; W827-Y865 AromaticContact CE2-CD2 3.71Å; W827-Y865 AromaticContact CE2-CG 3.48Å; W827-Y865 VanDerWaalsContact CE2-CG 3.48Å; W827-Y865 AromaticContact CE3-CD1 3.9Å; W827-Y865 HydrophobicContact CE3-CD1 3.9Å; W827-Y865 HydrophobicContact CE3-CD2 4.21Å; W827-Y865 AromaticContact CE3-CE1 3.9Å; W827-Y865 HydrophobicContact CE3-CE1 3.9Å; W827-Y865 HydrophobicContact CE3-CE2 4.22Å; W827-Y865 HydrophobicContact CE3-CG 4.06Å; W827-Y865 AromaticContact CG-CD2 3.93Å; W827-Y865 HydrophobicContact CG-CD2 3.93Å; W827-Y865 HydrophobicContact CG-CE2 4.08Å; W827-Y865 HydrophobicContact CG-CG 4.46Å; W827-Y865 AromaticContact CH2-CD1 3.56Å; W827-Y865 HydrophobicContact CH2-CD1 3.56Å; W827-Y865 HydrophobicContact CH2-CE1 4.28Å; W827-Y865 AromaticContact CH2-CG 3.8Å; W827-Y865 HydrophobicContact CH2-CG 3.8Å; W827-Y865 AromaticContact CZ2-CD1 3.81Å; W827-Y865 HydrophobicContact CZ2-CD1 3.81Å; W827-Y865 HydrophobicContact CZ2-CD2 4.23Å; W827-Y865 AromaticContact CZ2-CG 3.51Å; W827-Y865 HydrophobicContact CZ2-CG 3.51Å; W827-Y865 AromaticContact CZ3-CD1 3.61Å; W827-Y865 HydrophobicContact CZ3-CD1 3.61Å; W827-Y865 AromaticContact CZ3-CE1 3.85Å; W827-Y865 HydrophobicContact CZ3-CE1 3.85Å; W827-Y865 HydrophobicContact CZ3-CG 4.07Å; W827-Y865 AromaticContact NE1-CD2 3.84Å; W827-Y865 AromaticContact NE1-CG 3.95Å
828	S	87.1	Confident	85.9	Confident	50 Å²	50	60.1 Å²	60.1	35%	0.35	29%	0.294	S	S	.	.			trans	-94.2	165.7	177.3	88.9	0	0	0	0	112.1	R830 D831 F832	S828-R830 PolarHBondContact O-N 2.83Å; S828-R830 PolarHBondContact OG-N 3.45Å; S828-D831 WeakPolarHBondContact CA-OD2 3.44Å; S828-D831 WeakPolarHBondContact CB-OD2 2.96Å; S828-D831 PolarHBondContact N-OD2 3.06Å; S828-D831 PolarHBondContact O-N 3.33Å; S828-D831 VanDerWaalsContact O-N 3.1Å; S828-D831 PolarHBondContact OG-OD1 2.69Å; S828-D831 PolarHBondContact OG-OD2 2.91Å; S828-F832 PolarHBondContact O-N 2.93Å; S828-F832 VanDerWaalsContact O-N 3.1Å
829	K	84.9	Confident	86.1	Confident	114 Å²	114	55.9 Å²	55.9	50%	0.496	27%	0.271	S	S	.	.	H	α-helix	trans	-65.8	-17	176.3	-163.7	157.5	-170.3	139.3	0	113.1	F756 N833	F756-K829 HydrophobicContact CE1-CB 3.91Å; F756-K829 HydrophobicContact CE1-CD 3.98Å; F756-K829 HydrophobicContact CE1-CG 3.91Å; F756-K829 HydrophobicContact CZ-CB 3.66Å; F756-K829 HydrophobicContact CZ-CG 4.18Å; K829-N833 PolarHBondContact O-N 3.43Å; K829-N833 PolarHBondContact O-ND2 2.78Å
830	R	86.6	Confident	86.3	Confident	152 Å²	152	57.1 Å²	57.1	57%	0.574	28%	0.276	S	S	*	.	H	α-helix	trans	-69.9	-51.2	169.7	173.9	-171.8	176.8	156.6	-0.4	109.7	S828 F832 N833 Q834 E855	S828-R830 PolarHBondContact O-N 2.83Å; S828-R830 PolarHBondContact OG-N 3.45Å; R830-F832 PolarHBondContact O-N 3.29Å; R830-N833 CarbonylContact O-C 3.57Å; R830-N833 WeakPolarHBondContact O-CA 3.24Å; R830-N833 WeakPolarHBondContact O-CB 3.35Å; R830-N833 PolarHBondContact O-N 3.06Å; R830-Q834 HydrophobicContact CG-CG 4.5Å; R830-Q834 PolarHBondContact O-N 2.78Å; R830-E855 IonicContact CZ-OE2 2.78Å; R830-E855 IonicContact NE-OE2 2.8Å; R830-E855 IonicContact NH2-OE2 3.5Å; R830-E855 PolarHBondContact NH2-OE2 3.29Å
831	D	88.9	Confident	86.5	Confident	22 Å²	22	60.6 Å²	60.6	12%	0.118	29%	0.29	C	S	.	.	H	α-helix	trans	-68.8	-40.4	-168.6	-33.8	-29.9	0	0	0	109.9	W827 S828 N833 Q834 F835 V854	W827-D831 HydrophobicContact CE3-CB 3.96Å; W827-D831 HydrophobicContact CZ3-CB 4.26Å; S828-D831 WeakPolarHBondContact CA-OD2 3.44Å; S828-D831 WeakPolarHBondContact CB-OD2 2.96Å; S828-D831 PolarHBondContact N-OD2 3.06Å; S828-D831 PolarHBondContact O-N 3.33Å; S828-D831 VanDerWaalsContact O-N 3.1Å; S828-D831 PolarHBondContact OG-OD1 2.69Å; S828-D831 PolarHBondContact OG-OD2 2.91Å; D831-N833 PolarHBondContact O-N 3.46Å; D831-Q834 WeakPolarHBondContact O-CB 3.43Å; D831-Q834 PolarHBondContact O-N 2.65Å; D831-Q834 VanDerWaalsContact O-N 3.1Å; D831-F835 WeakPolarHBondContact O-CB 3.4Å; D831-F835 PolarHBondContact O-N 3.23Å; D831-V854 HydrophobicContact CB-CG1 4.41Å
832	F	89.9	Confident	86.7	Confident	16 Å²	16	58.6 Å²	58.6	7%	0.07	28%	0.276	C	S	.	.	H	α-helix	trans	-55.4	-46.6	167.1	177.2	-117.2	0	0	0	112.6	F756 S828 R830 Q834 F835 I836 Y865 F869 L876 I882	F756-F832 HydrophobicContact CB-CB 4.42Å; F756-F832 HydrophobicContact CB-CD1 3.87Å; F756-F832 HydrophobicContact CB-CD2 3.66Å; F756-F832 HydrophobicContact CB-CE1 3.94Å; F756-F832 HydrophobicContact CB-CE2 3.72Å; F756-F832 HydrophobicContact CB-CG 3.72Å; F756-F832 HydrophobicContact CB-CZ 3.86Å; F756-F832 HydrophobicContact CD1-CD1 4.12Å; F756-F832 HydrophobicContact CD1-CG 4.45Å; F756-F832 HydrophobicContact CD2-CB 3.7Å; F756-F832 HydrophobicContact CD2-CD1 4.41Å; F756-F832 HydrophobicContact CD2-CD2 4.4Å; F756-F832 AromaticContact CD2-CG 3.94Å; F756-F832 HydrophobicContact CD2-CG 3.94Å; F756-F832 HydrophobicContact CE2-CB 4.17Å; F756-F832 HydrophobicContact CG-CB 4.04Å; F756-F832 AromaticContact CG-CD1 3.87Å; F756-F832 HydrophobicContact CG-CD1 3.87Å; F756-F832 HydrophobicContact CG-CD2 4.2Å; F756-F832 HydrophobicContact CG-CE1 4.36Å; F756-F832 AromaticContact CG-CG 3.77Å; F756-F832 HydrophobicContact CG-CG 3.77Å; S828-F832 PolarHBondContact O-N 2.93Å; S828-F832 VanDerWaalsContact O-N 3.1Å; R830-F832 PolarHBondContact O-N 3.29Å; F832-Q834 VanDerWaalsContact C-N 3.28Å; F832-Q834 PolarHBondContact O-N 3.07Å; F832-F835 PolarHBondContact O-N 3.49Å; F832-I836 HydrophobicContact CD2-CG1 4.28Å; F832-I836 HydrophobicContact CE1-CG1 4.45Å; F832-I836 HydrophobicContact CE2-CD1 3.98Å; F832-I836 HydrophobicContact CE2-CG1 3.91Å; F832-I836 HydrophobicContact CZ-CD1 4.3Å; F832-I836 HydrophobicContact CZ-CG1 4.01Å; F832-I836 WeakPolarHBondContact O-CG1 3.41Å; F832-I836 PolarHBondContact O-N 2.98Å; F832-Y865 HydrophobicContact CD2-CE1 4.4Å; F832-Y865 VanDerWaalsContact CD2-OH 3.25Å; F832-Y865 WeakPolarHBondContact CD2-OH 3.21Å; F832-F869 HydrophobicContact CE2-CD2 4.22Å; F832-F869 AromaticContact CE2-CE2 3.88Å; F832-F869 HydrophobicContact CE2-CE2 3.88Å; F832-L876 HydrophobicContact CE2-CD1 4.37Å; F832-L876 HydrophobicContact CZ-CD1 4.16Å; F832-I882 HydrophobicContact CZ-CD1 4.03Å
833	N	89.6	Confident	86.9	Confident	77 Å²	77	52.8 Å²	52.8	41%	0.412	25%	0.251	S	S	.	.	H	α-helix	trans	-69.9	-21.6	177.1	-85	-86.5	0	0	0	113.4	K829 R830 D831 K837	K829-N833 PolarHBondContact O-N 3.43Å; K829-N833 PolarHBondContact O-ND2 2.78Å; R830-N833 CarbonylContact O-C 3.57Å; R830-N833 WeakPolarHBondContact O-CA 3.24Å; R830-N833 WeakPolarHBondContact O-CB 3.35Å; R830-N833 PolarHBondContact O-N 3.06Å; D831-N833 PolarHBondContact O-N 3.46Å; N833-K837 WeakPolarHBondContact O-CD 3.3Å; N833-K837 VanDerWaalsContact O-CG 3.25Å; N833-K837 WeakPolarHBondContact O-CG 3.39Å; N833-K837 PolarHBondContact O-N 3.49Å
834	Q	89.8	Confident	87.1	Confident	35 Å²	35	55.8 Å²	55.8	16%	0.164	26%	0.26	C	S	.	.	H	α-helix	trans	-76.5	-45.9	170.1	-72	-179.2	-75.7	0	0	110.5	R830 D831 F832 I836 K837 A838 E855	R830-Q834 HydrophobicContact CG-CG 4.5Å; R830-Q834 PolarHBondContact O-N 2.78Å; D831-Q834 WeakPolarHBondContact O-CB 3.43Å; D831-Q834 PolarHBondContact O-N 2.65Å; D831-Q834 VanDerWaalsContact O-N 3.1Å; F832-Q834 VanDerWaalsContact C-N 3.28Å; F832-Q834 PolarHBondContact O-N 3.07Å; Q834-I836 PolarHBondContact O-N 3.43Å; Q834-K837 PolarHBondContact O-N 2.87Å; Q834-K837 VanDerWaalsContact O-N 3.16Å; Q834-A838 WeakPolarHBondContact O-CB 3.48Å; Q834-A838 PolarHBondContact O-N 3.03Å; Q834-E855 PolarHBondContact NE2-OE2 3.36Å
835	F	91.8	Very high	86.9	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-56.3	-49	175.6	177.2	-100.7	0	0	0	112.4	W827 D831 F832 K837 A838 N839 I850 V854 V862 Y865 F869	W827-F835 HydrophobicContact CZ3-CB 4.15Å; D831-F835 WeakPolarHBondContact O-CB 3.4Å; D831-F835 PolarHBondContact O-N 3.23Å; F832-F835 PolarHBondContact O-N 3.49Å; F835-K837 VanDerWaalsContact C-N 3.32Å; F835-K837 PolarHBondContact O-N 2.86Å; F835-A838 PolarHBondContact O-N 3.05Å; F835-N839 WeakPolarHBondContact CE2-ND2 3.38Å; F835-N839 WeakPolarHBondContact CZ-ND2 3.45Å; F835-N839 PolarHBondContact O-N 3.12Å; F835-N839 PolarHBondContact O-ND2 3.43Å; F835-I850 HydrophobicContact CD2-CG2 3.68Å; F835-I850 HydrophobicContact CE2-CG2 3.83Å; F835-V854 HydrophobicContact CB-CG2 4.05Å; F835-V854 HydrophobicContact CD2-CG2 4.46Å; F835-V862 HydrophobicContact CD2-CG1 4.27Å; F835-V862 HydrophobicContact CE2-CG1 4.35Å; F835-Y865 HydrophobicContact CD1-CD1 4.4Å; F835-Y865 HydrophobicContact CD1-CE1 4.06Å; F835-Y865 HydrophobicContact CE1-CD1 4.45Å; F835-Y865 HydrophobicContact CE1-CE1 4.29Å; F835-Y865 HydrophobicContact CG-CD1 4.49Å; F835-Y865 HydrophobicContact CG-CE1 4.42Å; F835-F869 HydrophobicContact CE1-CB 4.31Å; F835-F869 AromaticContact CE1-CD1 3.74Å; F835-F869 HydrophobicContact CE1-CD1 3.74Å; F835-F869 HydrophobicContact CE1-CD2 4.22Å; F835-F869 HydrophobicContact CE1-CE1 4.11Å; F835-F869 AromaticContact CE1-CG 3.81Å; F835-F869 HydrophobicContact CE1-CG 3.81Å; F835-F869 HydrophobicContact CZ-CD1 4.25Å; F835-F869 HydrophobicContact CZ-CG 4.45Å
836	I	90.9	Very high	87.1	Confident	10 Å²	10	59.8 Å²	59.8	5%	0.051	28%	0.28	C	S	.	.	H	α-helix	trans	-62.5	-36.7	177.1	-61.7	-53.9	0	0	0	112.3	F832 Q834 N839 E840 F869 I882 I886	F832-I836 HydrophobicContact CD2-CG1 4.28Å; F832-I836 HydrophobicContact CE1-CG1 4.45Å; F832-I836 HydrophobicContact CE2-CD1 3.98Å; F832-I836 HydrophobicContact CE2-CG1 3.91Å; F832-I836 HydrophobicContact CZ-CD1 4.3Å; F832-I836 HydrophobicContact CZ-CG1 4.01Å; F832-I836 WeakPolarHBondContact O-CG1 3.41Å; F832-I836 PolarHBondContact O-N 2.98Å; Q834-I836 PolarHBondContact O-N 3.43Å; I836-N839 PolarHBondContact O-N 3.17Å; I836-E840 PolarHBondContact O-N 2.75Å; I836-F869 HydrophobicContact CD1-CE1 4.42Å; I836-F869 HydrophobicContact CD1-CE2 3.81Å; I836-F869 HydrophobicContact CD1-CZ 3.61Å; I836-I882 HydrophobicContact CD1-CG2 3.65Å; I836-I882 HydrophobicContact CG1-CG2 4.23Å; I836-I882 HydrophobicContact CG2-CG2 4.06Å; I836-I886 HydrophobicContact CD1-CD1 4.31Å
837	K	88.6	Confident	87.2	Confident	127 Å²	127	57 Å²	57	55%	0.552	27%	0.265	S	S	*	.	H	α-helix	trans	-70.7	-37.5	175.8	-76.9	175.7	-179.4	179.6	0	113	N833 Q834 F835 N839 E840 K841	N833-K837 WeakPolarHBondContact O-CD 3.3Å; N833-K837 VanDerWaalsContact O-CG 3.25Å; N833-K837 WeakPolarHBondContact O-CG 3.39Å; N833-K837 PolarHBondContact O-N 3.49Å; Q834-K837 PolarHBondContact O-N 2.87Å; Q834-K837 VanDerWaalsContact O-N 3.16Å; F835-K837 VanDerWaalsContact C-N 3.32Å; F835-K837 PolarHBondContact O-N 2.86Å; K837-N839 VanDerWaalsContact C-N 3.32Å; K837-E840 PolarHBondContact O-N 2.79Å; K837-K841 WeakPolarHBondContact O-CB 3.36Å; K837-K841 PolarHBondContact O-N 3.08Å
838	A	88.6	Confident	87.2	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-64.2	-40.9	175	0	0	0	0	0	110.6	Q834 F835 K841 W842 I850 E853	Q834-A838 WeakPolarHBondContact O-CB 3.48Å; Q834-A838 PolarHBondContact O-N 3.03Å; F835-A838 PolarHBondContact O-N 3.05Å; A838-K841 PolarHBondContact O-N 3.23Å; A838-K841 VanDerWaalsContact O-N 3.1Å; A838-W842 PolarHBondContact O-N 3.19Å; A838-I850 HydrophobicContact CB-CB 4.2Å; A838-I850 HydrophobicContact CB-CG1 3.97Å; A838-I850 HydrophobicContact CB-CG2 4.04Å; A838-E853 HydrophobicContact CB-CB 4.23Å
839	N	88.1	Confident	87.1	Confident	0 Å²	0	62 Å²	62	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-61.9	-40.2	171.2	-79.6	-94.1	0	0	0	112.8	F835 I836 K837 K841 G843 I886	F835-N839 WeakPolarHBondContact CE2-ND2 3.38Å; F835-N839 WeakPolarHBondContact CZ-ND2 3.45Å; F835-N839 PolarHBondContact O-N 3.12Å; F835-N839 PolarHBondContact O-ND2 3.43Å; I836-N839 PolarHBondContact O-N 3.17Å; K837-N839 VanDerWaalsContact C-N 3.32Å; N839-K841 PolarHBondContact O-N 2.85Å; N839-G843 VanDerWaalsContact O-CA 3.24Å; N839-G843 WeakPolarHBondContact O-CA 3.38Å; N839-G843 PolarHBondContact O-N 2.99Å; N839-I886 HydrophobicContact CB-CD1 3.83Å; N839-I886 HydrophobicContact CB-CG1 3.91Å; N839-I886 HydrophobicContact CB-CG2 4.22Å
840	E	87.9	Confident	87.3	Confident	41 Å²	41	56.6 Å²	56.6	19%	0.192	26%	0.261	C	S	.	.	H	α-helix	trans	-63.1	-28.6	172.4	-176.7	-178.6	-179.1	0	0	112.7	I836 K837 Q885 G889 R892	I836-E840 PolarHBondContact O-N 2.75Å; K837-E840 PolarHBondContact O-N 2.79Å; E840-Q885 HydrophobicContact CB-CG 4.47Å; E840-Q885 HydrophobicContact CG-CG 4.31Å; E840-Q885 WeakPolarHBondContact OE2-CG 3.45Å; E840-Q885 PolarHBondContact OE2-NE2 3.15Å; E840-G889 WeakPolarHBondContact O-CA 3.41Å; E840-R892 IonicContact OE1-CZ 3.51Å; E840-R892 IonicContact OE1-NH1 2.73Å; E840-R892 PolarHBondContact OE1-NH1 3.25Å; E840-R892 IonicContact OE1-NH2 3.39Å
841	K	84.5	Confident	87.3	Confident	106 Å²	106	49.9 Å²	49.9	46%	0.461	24%	0.238	S	C	.	.	H	α-helix	trans	-92.6	-37.8	-170.9	-176.2	-178.2	171.4	-162.3	0	114	K837 A838 N839 E853 I893	K837-K841 WeakPolarHBondContact O-CB 3.36Å; K837-K841 PolarHBondContact O-N 3.08Å; A838-K841 PolarHBondContact O-N 3.23Å; A838-K841 VanDerWaalsContact O-N 3.1Å; N839-K841 PolarHBondContact O-N 2.85Å; K841-E853 WeakPolarHBondContact CD-OE1 3.39Å; K841-E853 WeakPolarHBondContact CD-OE2 3.45Å; K841-E853 WeakPolarHBondContact CE-OE2 3.44Å; K841-E853 IonicContact NZ-OE1 2.69Å; K841-E853 PolarHBondContact NZ-OE1 3.36Å; K841-E853 IonicContact NZ-OE2 3.53Å; K841-E853 PolarHBondContact NZ-OE2 3.48Å; K841-I893 WeakPolarHBondContact O-CD1 3.35Å
842	W	85.7	Confident	87.2	Confident	98 Å²	98	56.6 Å²	56.6	37%	0.371	26%	0.262	S	S	.	.	H	α-helix	trans	-110	-18.2	-176.9	-54.6	106.8	0	0	0	113.2	A838 D846 N849 E853 I893	A838-W842 PolarHBondContact O-N 3.19Å; W842-D846 HydrophobicContact CB-CB 3.98Å; W842-N849 HydrophobicContact CB-CB 4.44Å; W842-N849 HydrophobicContact CD2-CB 3.59Å; W842-N849 HydrophobicContact CE3-CB 3.94Å; W842-N849 HydrophobicContact CG-CB 3.8Å; W842-N849 HydrophobicContact CZ2-CB 4.33Å; W842-N849 HydrophobicContact CZ3-CB 4.45Å; W842-E853 PolarHBondContact NE1-OE2 3.22Å; W842-I893 VanDerWaalsContact C-CD1 3.49Å
843	G	85.4	Confident	86.9	Confident	6 Å²	6	58.8 Å²	58.8	6%	0.062	27%	0.272	C	S	.	.			trans	85.2	158.4	-171.6	0	0	0	0	0	112	N839 D845 D846	N839-G843 VanDerWaalsContact O-CA 3.24Å; N839-G843 WeakPolarHBondContact O-CA 3.38Å; N839-G843 PolarHBondContact O-N 2.99Å; G843-D845 PolarHBondContact O-N 2.73Å; G843-D845 VanDerWaalsContact O-N 3.14Å; G843-D846 PolarHBondContact O-N 2.84Å
844	R	84.9	Confident	86.8	Confident	71 Å²	71	55.3 Å²	55.3	27%	0.268	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-20.3	-171.5	71.7	-169.6	72.1	-162	6.2	115.9	W870 E890	R844-W870 HydrophobicContact CB-CH2 4.11Å; R844-W870 HydrophobicContact CB-CZ2 3.47Å; R844-W870 VanDerWaalsContact CB-CZ2 3.47Å; R844-E890 WeakPolarHBondContact CG-OE1 3.29Å; R844-E890 IonicContact CZ-OE1 3.82Å; R844-E890 IonicContact CZ-OE2 2.65Å; R844-E890 PolarHBondContact N-OE1 2.76Å; R844-E890 IonicContact NE-OE1 2.7Å; R844-E890 PolarHBondContact NE-OE1 2.92Å; R844-E890 IonicContact NE-OE2 3.2Å; R844-E890 PolarHBondContact NE-OE2 3.14Å; R844-E890 IonicContact NH2-OE1 2.87Å; R844-E890 IonicContact NH2-OE2 2.66Å; R844-E890 PolarHBondContact NH2-OE2 3.32Å
845	D	81.6	Confident	86.4	Confident	150 Å²	150	59 Å²	59	80%	0.802	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-18.2	-174	-55	-47	0	0	0	113.2	G843 I847	G843-D845 PolarHBondContact O-N 2.73Å; G843-D845 VanDerWaalsContact O-N 3.14Å; D845-I847 PolarHBondContact O-N 2.81Å
846	D	85.2	Confident	85.8	Confident	51 Å²	51	62.9 Å²	62.9	27%	0.273	31%	0.311	S	S	.	.			trans	-94.2	65.8	-175	-168.9	-13	0	0	0	111.8	W842 G843 E848 N849 I850	W842-D846 HydrophobicContact CB-CB 3.98Å; G843-D846 PolarHBondContact O-N 2.84Å; D846-E848 PolarHBondContact O-N 2.74Å; D846-N849 VanDerWaalsContact CG-ND2 3.3Å; D846-N849 PolarHBondContact O-N 2.81Å; D846-N849 WeakPolarHBondContact OD1-CB 3.44Å; D846-N849 PolarHBondContact OD1-N 3.25Å; D846-N849 PolarHBondContact OD1-ND2 3.46Å; D846-N849 PolarHBondContact OD2-ND2 2.67Å; D846-I850 WeakPolarHBondContact O-CD1 3.26Å; D846-I850 VanDerWaalsContact O-CG1 3.27Å; D846-I850 WeakPolarHBondContact O-CG1 2.97Å; D846-I850 PolarHBondContact O-N 2.91Å
847	I	85.6	Confident	85.6	Confident	66 Å²	66	63.8 Å²	63.8	34%	0.338	32%	0.315	S	S	.	.	H	α-helix	trans	-59.9	-31	-178.5	-57.6	177.4	0	0	0	111.4	D845 I850 A851 M863	D845-I847 PolarHBondContact O-N 2.81Å; I847-I850 PolarHBondContact O-N 2.83Å; I847-A851 WeakPolarHBondContact O-CB 3.2Å; I847-A851 PolarHBondContact O-N 3.09Å; I847-M863 HydrophobicContact CG2-CB 4.45Å
848	E	85.2	Confident	85.5	Confident	126 Å²	126	61 Å²	61	59%	0.589	31%	0.308	S	S	*	.	H	α-helix	trans	-67.8	-47	-179.4	-161.2	-168.5	175	0	0	111.9	D846 A851 R852	D846-E848 PolarHBondContact O-N 2.74Å; E848-A851 PolarHBondContact O-N 3.36Å; E848-R852 VanDerWaalsContact O-CG 3.32Å; E848-R852 WeakPolarHBondContact O-CG 3.3Å; E848-R852 PolarHBondContact O-N 2.8Å; E848-R852 IonicContact OE1-CZ 3.49Å; E848-R852 IonicContact OE1-NE 2.66Å; E848-R852 IonicContact OE1-NH2 2.64Å; E848-R852 PolarHBondContact OE1-NH2 2.8Å; E848-R852 IonicContact OE2-NH2 3.6Å
849	N	85.7	Confident	85.4	Confident	33 Å²	33	65.2 Å²	65.2	18%	0.176	34%	0.336	C	S	.	.	H	α-helix	trans	-74.8	-26.4	175.9	-68.5	-58.5	0	0	0	112.8	W842 D846 R852 E853	W842-N849 HydrophobicContact CB-CB 4.44Å; W842-N849 HydrophobicContact CD2-CB 3.59Å; W842-N849 HydrophobicContact CE3-CB 3.94Å; W842-N849 HydrophobicContact CG-CB 3.8Å; W842-N849 HydrophobicContact CZ2-CB 4.33Å; W842-N849 HydrophobicContact CZ3-CB 4.45Å; D846-N849 VanDerWaalsContact CG-ND2 3.3Å; D846-N849 PolarHBondContact O-N 2.81Å; D846-N849 WeakPolarHBondContact OD1-CB 3.44Å; D846-N849 PolarHBondContact OD1-N 3.25Å; D846-N849 PolarHBondContact OD1-ND2 3.46Å; D846-N849 PolarHBondContact OD2-ND2 2.67Å; N849-R852 PolarHBondContact OD1-NH1 2.86Å; N849-E853 PolarHBondContact O-N 3.32Å
850	I	87.9	Confident	85.3	Confident	1 Å²	1	72.5 Å²	72.5	1%	0.005	37%	0.37	C	S	.	.	H	α-helix	trans	-62	-49.7	168.8	-70.4	164.1	0	0	0	110.9	F835 A838 D846 I847 R852 E853 V854 V862	F835-I850 HydrophobicContact CD2-CG2 3.68Å; F835-I850 HydrophobicContact CE2-CG2 3.83Å; A838-I850 HydrophobicContact CB-CB 4.2Å; A838-I850 HydrophobicContact CB-CG1 3.97Å; A838-I850 HydrophobicContact CB-CG2 4.04Å; D846-I850 WeakPolarHBondContact O-CD1 3.26Å; D846-I850 VanDerWaalsContact O-CG1 3.27Å; D846-I850 WeakPolarHBondContact O-CG1 2.97Å; D846-I850 PolarHBondContact O-N 2.91Å; I847-I850 PolarHBondContact O-N 2.83Å; I850-R852 VanDerWaalsContact C-N 3.28Å; I850-R852 PolarHBondContact O-N 2.85Å; I850-E853 PolarHBondContact O-N 3.42Å; I850-V854 PolarHBondContact O-N 2.91Å; I850-V862 HydrophobicContact CG2-CG1 3.98Å
851	A	87.6	Confident	85.3	Confident	12 Å²	12	72.8 Å²	72.8	10%	0.099	37%	0.371	C	S	.	.	H	α-helix	trans	-60.2	-35.3	179.6	0	0	0	0	0	113.1	I847 E848 E853 P859 V862	I847-A851 WeakPolarHBondContact O-CB 3.2Å; I847-A851 PolarHBondContact O-N 3.09Å; E848-A851 PolarHBondContact O-N 3.36Å; A851-E853 VanDerWaalsContact C-N 3.26Å; A851-E853 PolarHBondContact O-N 2.82Å; A851-P859 HydrophobicContact CB-CB 4.07Å; A851-P859 HydrophobicContact CB-CG 4.46Å; A851-V862 HydrophobicContact CB-CB 4.19Å; A851-V862 HydrophobicContact CB-CG1 4.19Å; A851-V862 HydrophobicContact CB-CG2 4.47Å
852	R	86.7	Confident	85.5	Confident	162 Å²	162	67.8 Å²	67.8	61%	0.611	35%	0.349	S	S	*	.	H	α-helix	trans	-68.1	-19.9	175.9	-67.6	167.5	-174	176.8	-3.9	114.1	E848 N849 I850	E848-R852 VanDerWaalsContact O-CG 3.32Å; E848-R852 WeakPolarHBondContact O-CG 3.3Å; E848-R852 PolarHBondContact O-N 2.8Å; E848-R852 IonicContact OE1-CZ 3.49Å; E848-R852 IonicContact OE1-NE 2.66Å; E848-R852 IonicContact OE1-NH2 2.64Å; E848-R852 PolarHBondContact OE1-NH2 2.8Å; E848-R852 IonicContact OE2-NH2 3.6Å; N849-R852 PolarHBondContact OD1-NH1 2.86Å; I850-R852 VanDerWaalsContact C-N 3.28Å; I850-R852 PolarHBondContact O-N 2.85Å
853	E	84.7	Confident	85.6	Confident	63 Å²	63	68.4 Å²	68.4	29%	0.294	36%	0.358	S	S	.	.	H	α-helix	trans	-106.4	-9.5	-175.3	-166.8	154.5	-176.5	0	0	113.9	A838 K841 W842 N849 I850 A851 E855	A838-E853 HydrophobicContact CB-CB 4.23Å; K841-E853 WeakPolarHBondContact CD-OE1 3.39Å; K841-E853 WeakPolarHBondContact CD-OE2 3.45Å; K841-E853 WeakPolarHBondContact CE-OE2 3.44Å; K841-E853 IonicContact NZ-OE1 2.69Å; K841-E853 PolarHBondContact NZ-OE1 3.36Å; K841-E853 IonicContact NZ-OE2 3.53Å; K841-E853 PolarHBondContact NZ-OE2 3.48Å; W842-E853 PolarHBondContact NE1-OE2 3.22Å; N849-E853 PolarHBondContact O-N 3.32Å; I850-E853 PolarHBondContact O-N 3.42Å; A851-E853 VanDerWaalsContact C-N 3.26Å; A851-E853 PolarHBondContact O-N 2.82Å; E853-E855 PolarHBondContact O-N 3.31Å
854	V	87.5	Confident	85.7	Confident	3 Å²	3	73.8 Å²	73.8	2%	0.018	38%	0.382	C	S	.	.	S	Bend	trans	-86.1	89.6	167.8	-177.3	0	0	0	0	109.3	W827 D831 F835 I850 G856 K857 V862	W827-V854 HydrophobicContact CH2-CG1 4.11Å; W827-V854 HydrophobicContact CZ3-CG1 4.2Å; D831-V854 HydrophobicContact CB-CG1 4.41Å; F835-V854 HydrophobicContact CB-CG2 4.05Å; F835-V854 HydrophobicContact CD2-CG2 4.46Å; I850-V854 PolarHBondContact O-N 2.91Å; V854-G856 PolarHBondContact O-N 3.3Å; V854-K857 HydrophobicContact CG1-CB 3.97Å; V854-K857 HydrophobicContact CG1-CG 3.77Å; V854-K857 PolarHBondContact O-N 2.92Å; V854-V862 HydrophobicContact CB-CG2 4.13Å; V854-V862 HydrophobicContact CG1-CG2 4.27Å
855	E	79.4	Confident	86	Confident	113 Å²	113	70.4 Å²	70.4	53%	0.528	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	122.6	-177.4	-64	172.8	127.2	0	0	112.5	R830 Q834 E853	R830-E855 IonicContact CZ-OE2 2.78Å; R830-E855 IonicContact NE-OE2 2.8Å; R830-E855 IonicContact NH2-OE2 3.5Å; R830-E855 PolarHBondContact NH2-OE2 3.29Å; Q834-E855 PolarHBondContact NE2-OE2 3.36Å; E853-E855 PolarHBondContact O-N 3.31Å
856	G	79.8	Confident	86.4	Confident	82 Å²	82	63.5 Å²	63.5	85%	0.845	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.4	13.1	173.9	0	0	0	0	0	115.4	V854	V854-G856 PolarHBondContact O-N 3.3Å
857	K	86.3	Confident	86.6	Confident	28 Å²	28	64 Å²	64	12%	0.122	34%	0.343	C	S	.	.			trans	-113.2	149.6	167.7	-69.1	-62	-174.7	-169.9	0	112.2	I826 W827 V854 E861 V862	I826-K857 WeakPolarHBondContact O-CE 3.38Å; I826-K857 PolarHBondContact O-NZ 3.49Å; W827-K857 HydrophobicContact CH2-CG 4.36Å; W827-K857 HydrophobicContact CZ2-CD 4.36Å; W827-K857 HydrophobicContact CZ2-CG 4.1Å; V854-K857 HydrophobicContact CG1-CB 3.97Å; V854-K857 HydrophobicContact CG1-CG 3.77Å; V854-K857 PolarHBondContact O-N 2.92Å; K857-E861 HydrophobicContact CD-CB 4.25Å; K857-E861 WeakPolarHBondContact CD-OE1 3.31Å; K857-E861 WeakPolarHBondContact CE-OE1 3.47Å; K857-E861 IonicContact NZ-OE1 2.69Å; K857-E861 PolarHBondContact NZ-OE1 3.47Å; K857-V862 HydrophobicContact CB-CG2 3.61Å; K857-V862 HydrophobicContact CG-CG2 4.44Å
858	T	87.6	Confident	86.7	Confident	68 Å²	68	62.4 Å²	62.4	42%	0.417	34%	0.337	S	S	.	.			trans	-76.2	153.6	168.6	59	0	0	0	0	110.6	E860 E861 V862	T858-E860 PolarHBondContact O-N 3.46Å; T858-E861 PolarHBondContact N-OE2 3.04Å; T858-E861 PolarHBondContact O-N 3.4Å; T858-E861 WeakPolarHBondContact OG1-CB 3.42Å; T858-E861 VanDerWaalsContact OG1-CG 3.25Å; T858-E861 WeakPolarHBondContact OG1-CG 3.34Å; T858-E861 PolarHBondContact OG1-N 3.44Å; T858-E861 PolarHBondContact OG1-OE2 2.99Å; T858-V862 WeakPolarHBondContact O-CG2 3.3Å; T858-V862 PolarHBondContact O-N 3.16Å; T858-V862 VanDerWaalsContact O-N 3.1Å
859	P	86.9	Confident	87	Confident	90 Å²	90	56.4 Å²	56.4	58%	0.584	31%	0.308	S	S	*	.	H	α-helix	trans	-58.8	-30.1	175.2	-25.1	35.3	0	0	0	113.4	A851 V862 M863	A851-P859 HydrophobicContact CB-CB 4.07Å; A851-P859 HydrophobicContact CB-CG 4.46Å; P859-V862 PolarHBondContact O-N 3.42Å; P859-M863 WeakPolarHBondContact O-CB 3.37Å; P859-M863 PolarHBondContact O-N 3.35Å
860	E	86.3	Confident	87.1	Confident	152 Å²	152	58.1 Å²	58.1	71%	0.71	31%	0.313	S	S	*	.	H	α-helix	trans	-68.8	-49.1	177.7	-64.9	173.7	-178.2	0	0	111.3	T858 V862 M863 E864	T858-E860 PolarHBondContact O-N 3.46Å; E860-V862 VanDerWaalsContact C-N 3.29Å; E860-V862 PolarHBondContact O-N 3.11Å; E860-M863 PolarHBondContact O-N 3.03Å; E860-E864 PolarHBondContact O-N 3.08Å
861	E	87.6	Confident	87.1	Confident	48 Å²	48	65.1 Å²	65.1	22%	0.224	35%	0.345	C	S	.	.	H	α-helix	trans	-58.2	-38.6	172.5	-75.8	169.8	99.6	0	0	112.6	K857 T858 Y865	K857-E861 HydrophobicContact CD-CB 4.25Å; K857-E861 WeakPolarHBondContact CD-OE1 3.31Å; K857-E861 WeakPolarHBondContact CE-OE1 3.47Å; K857-E861 IonicContact NZ-OE1 2.69Å; K857-E861 PolarHBondContact NZ-OE1 3.47Å; T858-E861 PolarHBondContact N-OE2 3.04Å; T858-E861 PolarHBondContact O-N 3.4Å; T858-E861 WeakPolarHBondContact OG1-CB 3.42Å; T858-E861 VanDerWaalsContact OG1-CG 3.25Å; T858-E861 WeakPolarHBondContact OG1-CG 3.34Å; T858-E861 PolarHBondContact OG1-N 3.44Å; T858-E861 PolarHBondContact OG1-OE2 2.99Å; E861-Y865 WeakPolarHBondContact O-CB 3.37Å; E861-Y865 PolarHBondContact O-N 3.49Å
862	V	87.8	Confident	87	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-70.7	-37.2	179.1	178.1	0	0	0	0	111.1	W827 F835 I850 A851 V854 K857 T858 P859 E860 S866	W827-V862 HydrophobicContact CH2-CG2 4.12Å; W827-V862 HydrophobicContact CZ2-CG2 4.25Å; F835-V862 HydrophobicContact CD2-CG1 4.27Å; F835-V862 HydrophobicContact CE2-CG1 4.35Å; I850-V862 HydrophobicContact CG2-CG1 3.98Å; A851-V862 HydrophobicContact CB-CB 4.19Å; A851-V862 HydrophobicContact CB-CG1 4.19Å; A851-V862 HydrophobicContact CB-CG2 4.47Å; V854-V862 HydrophobicContact CB-CG2 4.13Å; V854-V862 HydrophobicContact CG1-CG2 4.27Å; K857-V862 HydrophobicContact CB-CG2 3.61Å; K857-V862 HydrophobicContact CG-CG2 4.44Å; T858-V862 WeakPolarHBondContact O-CG2 3.3Å; T858-V862 PolarHBondContact O-N 3.16Å; T858-V862 VanDerWaalsContact O-N 3.1Å; P859-V862 PolarHBondContact O-N 3.42Å; E860-V862 VanDerWaalsContact C-N 3.29Å; E860-V862 PolarHBondContact O-N 3.11Å; V862-S866 WeakPolarHBondContact O-CB 3.41Å; V862-S866 PolarHBondContact O-N 3.11Å
863	M	88.7	Confident	86.9	Confident	111 Å²	111	60 Å²	60	55%	0.547	33%	0.325	S	S	.	.	H	α-helix	trans	-67.6	-45.6	175.7	-176.1	176.8	65.6	0	0	111.8	I847 P859 E860 S866 A867	I847-M863 HydrophobicContact CG2-CB 4.45Å; P859-M863 WeakPolarHBondContact O-CB 3.37Å; P859-M863 PolarHBondContact O-N 3.35Å; E860-M863 PolarHBondContact O-N 3.03Å; M863-S866 PolarHBondContact O-N 3.32Å; M863-A867 PolarHBondContact O-N 3.26Å
864	E	87.8	Confident	86.8	Confident	120 Å²	120	63.5 Å²	63.5	56%	0.561	35%	0.346	S	S	*	.	H	α-helix	trans	-61	-50	175.8	-178.1	179.1	-140.9	0	0	111.3	F824 E860 S866 A867 V868	F824-E864 HydrophobicContact CE1-CG 4.3Å; F824-E864 HydrophobicContact CZ-CG 4.37Å; E860-E864 PolarHBondContact O-N 3.08Å; E864-S866 VanDerWaalsContact C-N 3.32Å; E864-S866 PolarHBondContact O-N 3.34Å; E864-A867 PolarHBondContact O-N 2.94Å; E864-V868 PolarHBondContact O-N 3.27Å; E864-V868 VanDerWaalsContact O-N 3.17Å
865	Y	90.8	Very high	86.6	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-61.6	-39.5	176.2	-175	-97.5	0	0	0	112.1	F756 F758 F824 W827 F832 F835 E861 A867 F869	F756-Y865 WeakPolarHBondContact O-CE2 3.36Å; F756-Y865 PolarHBondContact O-OH 3.29Å; F758-Y865 HydrophobicContact CD2-CE2 4.02Å; F758-Y865 AromaticContact CE2-CE2 3.99Å; F758-Y865 HydrophobicContact CE2-CE2 3.99Å; F758-Y865 AromaticContact CE2-CZ 3.94Å; F824-Y865 HydrophobicContact CB-CD2 4.27Å; F824-Y865 HydrophobicContact CB-CE2 4.29Å; F824-Y865 AromaticContact CD1-CD2 3.91Å; F824-Y865 HydrophobicContact CD1-CD2 3.91Å; F824-Y865 AromaticContact CD2-CD2 3.81Å; F824-Y865 HydrophobicContact CD2-CD2 3.81Å; F824-Y865 HydrophobicContact CD2-CE2 4.04Å; F824-Y865 HydrophobicContact CE1-CD2 4.14Å; F824-Y865 HydrophobicContact CE2-CD2 4.04Å; F824-Y865 AromaticContact CG-CD2 3.74Å; F824-Y865 HydrophobicContact CG-CD2 3.74Å; F824-Y865 HydrophobicContact CG-CE2 4.12Å; F824-Y865 HydrophobicContact CZ-CD2 4.19Å; W827-Y865 HydrophobicContact CB-CE2 4.44Å; W827-Y865 AromaticContact CD1-CD2 3.99Å; W827-Y865 HydrophobicContact CD2-CD1 4.12Å; W827-Y865 AromaticContact CD2-CD2 3.71Å; W827-Y865 HydrophobicContact CD2-CD2 3.71Å; W827-Y865 HydrophobicContact CD2-CE1 4.38Å; W827-Y865 AromaticContact CD2-CE2 3.98Å; W827-Y865 HydrophobicContact CD2-CE2 3.98Å; W827-Y865 AromaticContact CD2-CG 3.78Å; W827-Y865 HydrophobicContact CD2-CG 3.78Å; W827-Y865 AromaticContact CE2-CD2 3.71Å; W827-Y865 AromaticContact CE2-CG 3.48Å; W827-Y865 VanDerWaalsContact CE2-CG 3.48Å; W827-Y865 AromaticContact CE3-CD1 3.9Å; W827-Y865 HydrophobicContact CE3-CD1 3.9Å; W827-Y865 HydrophobicContact CE3-CD2 4.21Å; W827-Y865 AromaticContact CE3-CE1 3.9Å; W827-Y865 HydrophobicContact CE3-CE1 3.9Å; W827-Y865 HydrophobicContact CE3-CE2 4.22Å; W827-Y865 HydrophobicContact CE3-CG 4.06Å; W827-Y865 AromaticContact CG-CD2 3.93Å; W827-Y865 HydrophobicContact CG-CD2 3.93Å; W827-Y865 HydrophobicContact CG-CE2 4.08Å; W827-Y865 HydrophobicContact CG-CG 4.46Å; W827-Y865 AromaticContact CH2-CD1 3.56Å; W827-Y865 HydrophobicContact CH2-CD1 3.56Å; W827-Y865 HydrophobicContact CH2-CE1 4.28Å; W827-Y865 AromaticContact CH2-CG 3.8Å; W827-Y865 HydrophobicContact CH2-CG 3.8Å; W827-Y865 AromaticContact CZ2-CD1 3.81Å; W827-Y865 HydrophobicContact CZ2-CD1 3.81Å; W827-Y865 HydrophobicContact CZ2-CD2 4.23Å; W827-Y865 AromaticContact CZ2-CG 3.51Å; W827-Y865 HydrophobicContact CZ2-CG 3.51Å; W827-Y865 AromaticContact CZ3-CD1 3.61Å; W827-Y865 HydrophobicContact CZ3-CD1 3.61Å; W827-Y865 AromaticContact CZ3-CE1 3.85Å; W827-Y865 HydrophobicContact CZ3-CE1 3.85Å; W827-Y865 HydrophobicContact CZ3-CG 4.07Å; W827-Y865 AromaticContact NE1-CD2 3.84Å; W827-Y865 AromaticContact NE1-CG 3.95Å; F832-Y865 HydrophobicContact CD2-CE1 4.4Å; F832-Y865 VanDerWaalsContact CD2-OH 3.25Å; F832-Y865 WeakPolarHBondContact CD2-OH 3.21Å; F835-Y865 HydrophobicContact CD1-CD1 4.4Å; F835-Y865 HydrophobicContact CD1-CE1 4.06Å; F835-Y865 HydrophobicContact CE1-CD1 4.45Å; F835-Y865 HydrophobicContact CE1-CE1 4.29Å; F835-Y865 HydrophobicContact CG-CD1 4.49Å; F835-Y865 HydrophobicContact CG-CE1 4.42Å; E861-Y865 WeakPolarHBondContact O-CB 3.37Å; E861-Y865 PolarHBondContact O-N 3.49Å; Y865-A867 VanDerWaalsContact C-N 3.33Å; Y865-A867 PolarHBondContact O-N 3.19Å; Y865-F869 HydrophobicContact CE1-CB 4.34Å; Y865-F869 WeakPolarHBondContact O-CB 3.48Å; Y865-F869 PolarHBondContact O-N 2.93Å
866	S	89.5	Confident	86.8	Confident	4 Å²	4	62.8 Å²	62.8	3%	0.028	34%	0.342	C	S	.	.	H	α-helix	trans	-64.6	-36.6	177.4	-170.9	0	0	0	0	112.3	V862 M863 E864 W870	V862-S866 WeakPolarHBondContact O-CB 3.41Å; V862-S866 PolarHBondContact O-N 3.11Å; M863-S866 PolarHBondContact O-N 3.32Å; E864-S866 VanDerWaalsContact C-N 3.32Å; E864-S866 PolarHBondContact O-N 3.34Å; S866-W870 PolarHBondContact O-N 3.11Å; S866-W870 VanDerWaalsContact O-N 3.08Å; S866-W870 PolarHBondContact OG-NE1 3.18Å
867	A	89.3	Confident	86.8	Confident	62 Å²	62	67.7 Å²	67.7	51%	0.512	34%	0.343	S	S	.	.	H	α-helix	trans	-64.8	-53	176.7	0	0	0	0	0	111	M863 E864 Y865 F869 W870 E871	M863-A867 PolarHBondContact O-N 3.26Å; E864-A867 PolarHBondContact O-N 2.94Å; Y865-A867 VanDerWaalsContact C-N 3.33Å; Y865-A867 PolarHBondContact O-N 3.19Å; A867-F869 VanDerWaalsContact C-N 3.31Å; A867-F869 PolarHBondContact O-N 3.08Å; A867-W870 PolarHBondContact O-N 3.06Å; A867-E871 PolarHBondContact O-N 3.15Å; A867-E871 VanDerWaalsContact O-N 3.08Å
868	V	88.4	Confident	86.5	Confident	32 Å²	32	70.3 Å²	70.3	19%	0.194	36%	0.359	C	S	.	.	H	α-helix	trans	-66.5	-34.5	179.4	-175.1	0	0	0	0	111.6	F758 F824 E864 E871 R872	F758-V868 HydrophobicContact CB-CG1 4.27Å; F758-V868 HydrophobicContact CD2-CG1 4.39Å; F758-V868 HydrophobicContact CG-CG1 4.32Å; F824-V868 HydrophobicContact CE2-CB 3.87Å; F824-V868 HydrophobicContact CE2-CG1 3.93Å; F824-V868 HydrophobicContact CE2-CG2 4.13Å; F824-V868 HydrophobicContact CZ-CB 4.1Å; F824-V868 HydrophobicContact CZ-CG2 3.95Å; E864-V868 PolarHBondContact O-N 3.27Å; E864-V868 VanDerWaalsContact O-N 3.17Å; V868-E871 PolarHBondContact O-N 3.38Å; V868-R872 HydrophobicContact CG1-CG 4.43Å; V868-R872 WeakPolarHBondContact O-CB 3.41Å; V868-R872 PolarHBondContact O-N 3.27Å
869	F	90.1	Very high	86.4	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-58.2	-52.1	172.4	173.2	-91.6	0	0	0	111.2	F758 F832 F835 I836 Y865 A867 E871 R872 C873 L876 I882	F758-F869 HydrophobicContact CE2-CB 4.1Å; F758-F869 HydrophobicContact CE2-CD2 4.14Å; F758-F869 HydrophobicContact CZ-CB 4.29Å; F758-F869 AromaticContact CZ-CD2 3.85Å; F758-F869 HydrophobicContact CZ-CD2 3.85Å; F758-F869 HydrophobicContact CZ-CG 4.47Å; F832-F869 HydrophobicContact CE2-CD2 4.22Å; F832-F869 AromaticContact CE2-CE2 3.88Å; F832-F869 HydrophobicContact CE2-CE2 3.88Å; F835-F869 HydrophobicContact CE1-CB 4.31Å; F835-F869 AromaticContact CE1-CD1 3.74Å; F835-F869 HydrophobicContact CE1-CD1 3.74Å; F835-F869 HydrophobicContact CE1-CD2 4.22Å; F835-F869 HydrophobicContact CE1-CE1 4.11Å; F835-F869 AromaticContact CE1-CG 3.81Å; F835-F869 HydrophobicContact CE1-CG 3.81Å; F835-F869 HydrophobicContact CZ-CD1 4.25Å; F835-F869 HydrophobicContact CZ-CG 4.45Å; I836-F869 HydrophobicContact CD1-CE1 4.42Å; I836-F869 HydrophobicContact CD1-CE2 3.81Å; I836-F869 HydrophobicContact CD1-CZ 3.61Å; Y865-F869 HydrophobicContact CE1-CB 4.34Å; Y865-F869 WeakPolarHBondContact O-CB 3.48Å; Y865-F869 PolarHBondContact O-N 2.93Å; A867-F869 VanDerWaalsContact C-N 3.31Å; A867-F869 PolarHBondContact O-N 3.08Å; F869-E871 VanDerWaalsContact C-N 3.31Å; F869-E871 PolarHBondContact O-N 3.39Å; F869-R872 PolarHBondContact O-N 2.98Å; F869-C873 HydrophobicContact CZ-CB 4.41Å; F869-C873 VanDerWaalsContact O-CA 3.28Å; F869-C873 WeakPolarHBondContact O-CA 3.42Å; F869-C873 WeakPolarHBondContact O-CB 3.46Å; F869-C873 PolarHBondContact O-N 3.07Å; F869-L876 HydrophobicContact CD2-CD1 4.17Å; F869-L876 HydrophobicContact CE2-CD1 3.62Å; F869-I882 HydrophobicContact CZ-CG2 4.34Å
870	W	88.1	Confident	86.3	Confident	69 Å²	69	72.2 Å²	72.2	26%	0.261	36%	0.356	S	S	.	.	H	α-helix	trans	-70	-25.8	-178.2	-71	121.9	0	0	0	113.7	R844 S866 A867 M883 I886	R844-W870 HydrophobicContact CB-CH2 4.11Å; R844-W870 HydrophobicContact CB-CZ2 3.47Å; R844-W870 VanDerWaalsContact CB-CZ2 3.47Å; S866-W870 PolarHBondContact O-N 3.11Å; S866-W870 VanDerWaalsContact O-N 3.08Å; S866-W870 PolarHBondContact OG-NE1 3.18Å; A867-W870 PolarHBondContact O-N 3.06Å; W870-M883 HydrophobicContact CH2-SD 4.41Å; W870-M883 HydrophobicContact CZ3-CE 4.11Å; W870-M883 HydrophobicContact CZ3-SD 3.74Å; W870-I886 HydrophobicContact CH2-CD1 3.83Å; W870-I886 HydrophobicContact CH2-CG2 4.47Å; W870-I886 HydrophobicContact CZ2-CD1 4.36Å
871	E	88.2	Confident	86.3	Confident	149 Å²	149	70.9 Å²	70.9	70%	0.696	35%	0.348	S	S	*	.	H	α-helix	trans	-74.3	-45.6	173.2	-174.3	173.9	-153.9	0	0	112.4	A867 V868 F869	A867-E871 PolarHBondContact O-N 3.15Å; A867-E871 VanDerWaalsContact O-N 3.08Å; V868-E871 PolarHBondContact O-N 3.38Å; F869-E871 VanDerWaalsContact C-N 3.31Å; F869-E871 PolarHBondContact O-N 3.39Å
872	R	86.5	Confident	86.3	Confident	55 Å²	55	69.4 Å²	69.4	21%	0.208	34%	0.341	C	S	.	.	H	α-helix	trans	-108	9.1	-170.4	-64.9	178.6	62.6	-160.8	-10.3	114.6	F758 F759 V868 F869 N874 E875	F758-R872 HydrophobicContact CD1-CB 3.79Å; F758-R872 HydrophobicContact CE1-CB 3.91Å; F758-R872 PolarHBondContact O-NH1 3.46Å; F758-R872 PolarHBondContact O-NH2 3.17Å; F759-R872 PolarHBondContact O-NH2 2.87Å; V868-R872 HydrophobicContact CG1-CG 4.43Å; V868-R872 WeakPolarHBondContact O-CB 3.41Å; V868-R872 PolarHBondContact O-N 3.27Å; F869-R872 PolarHBondContact O-N 2.98Å; R872-N874 PolarHBondContact O-N 3.19Å; R872-E875 IonicContact CZ-OE1 2.66Å; R872-E875 IonicContact CZ-OE2 3.77Å; R872-E875 IonicContact NE-OE1 2.7Å; R872-E875 PolarHBondContact NE-OE1 3.37Å; R872-E875 IonicContact NE-OE2 2.65Å; R872-E875 PolarHBondContact NE-OE2 2.99Å; R872-E875 IonicContact NH2-OE1 3.09Å; R872-E875 PolarHBondContact NH2-OE1 3.06Å; R872-E875 IonicContact NH2-OE2 2.67Å; R872-E875 PolarHBondContact NH2-OE2 2.72Å; R872-E875 WeakPolarHBondContact O-CB 3.44Å; R872-E875 PolarHBondContact O-N 2.58Å
873	C	83.8	Confident	86.2	Confident	12 Å²	12	71.3 Å²	71.3	8%	0.081	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-53.4	-27.1	-178	59.1	0	0	0	0	114.4	F869 E875 L876 I879	F869-C873 HydrophobicContact CZ-CB 4.41Å; F869-C873 VanDerWaalsContact O-CA 3.28Å; F869-C873 WeakPolarHBondContact O-CA 3.42Å; F869-C873 WeakPolarHBondContact O-CB 3.46Å; F869-C873 PolarHBondContact O-N 3.07Å; C873-E875 PolarHBondContact O-N 2.84Å; C873-L876 WeakPolarHBondContact O-CB 3.34Å; C873-L876 WeakPolarHBondContact O-CG 3.36Å; C873-L876 PolarHBondContact O-N 2.92Å; C873-L876 VanDerWaalsContact O-N 3.15Å; C873-I879 HydrophobicContact CB-CD1 3.68Å; C873-I879 HydrophobicContact CB-CG1 4.4Å; C873-I879 WeakPolarHBondContact O-CD1 3.15Å; C873-I879 WeakPolarHBondContact O-CG1 3.37Å
874	N	83.2	Confident	86.2	Confident	135 Å²	135	67.9 Å²	67.9	72%	0.722	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-66.1	-13.7	178.2	-58.6	-54.1	0	0	0	113.9	R872 L876	R872-N874 PolarHBondContact O-N 3.19Å; N874-L876 VanDerWaalsContact C-N 3.32Å
875	E	81.9	Confident	86.2	Confident	96 Å²	96	64.7 Å²	64.7	45%	0.449	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-79.3	-13.1	174.1	-62.6	175.3	-157.4	0	0	113	R872 C873	R872-E875 IonicContact CZ-OE1 2.66Å; R872-E875 IonicContact CZ-OE2 3.77Å; R872-E875 IonicContact NE-OE1 2.7Å; R872-E875 PolarHBondContact NE-OE1 3.37Å; R872-E875 IonicContact NE-OE2 2.65Å; R872-E875 PolarHBondContact NE-OE2 2.99Å; R872-E875 IonicContact NH2-OE1 3.09Å; R872-E875 PolarHBondContact NH2-OE1 3.06Å; R872-E875 IonicContact NH2-OE2 2.67Å; R872-E875 PolarHBondContact NH2-OE2 2.72Å; R872-E875 WeakPolarHBondContact O-CB 3.44Å; R872-E875 PolarHBondContact O-N 2.58Å; C873-E875 PolarHBondContact O-N 2.84Å
876	L	83.5	Confident	86	Confident	5 Å²	5	64.7 Å²	64.7	3%	0.026	33%	0.325	C	S	.	.			trans	-83.4	130.5	-175	-55.2	177.7	0	0	0	112	D755 F756 F758 F832 F869 C873 N874 D878 I879	D755-L876 HydrophobicContact CB-CD2 3.97Å; F756-L876 HydrophobicContact CB-CD2 4.3Å; F758-L876 HydrophobicContact CE1-CD1 4.48Å; F758-L876 HydrophobicContact CE1-CD2 3.83Å; F758-L876 HydrophobicContact CE1-CG 4.13Å; F758-L876 HydrophobicContact CZ-CD1 4.12Å; F758-L876 HydrophobicContact CZ-CD2 4.01Å; F758-L876 HydrophobicContact CZ-CG 4.25Å; F832-L876 HydrophobicContact CE2-CD1 4.37Å; F832-L876 HydrophobicContact CZ-CD1 4.16Å; F869-L876 HydrophobicContact CD2-CD1 4.17Å; F869-L876 HydrophobicContact CE2-CD1 3.62Å; C873-L876 WeakPolarHBondContact O-CB 3.34Å; C873-L876 WeakPolarHBondContact O-CG 3.36Å; C873-L876 PolarHBondContact O-N 2.92Å; C873-L876 VanDerWaalsContact O-N 3.15Å; N874-L876 VanDerWaalsContact C-N 3.32Å; L876-D878 PolarHBondContact O-N 3.09Å; L876-I879 HydrophobicContact CB-CB 4.29Å; L876-I879 WeakPolarHBondContact O-CB 3.41Å; L876-I879 WeakPolarHBondContact O-CG2 3.13Å; L876-I879 PolarHBondContact O-N 3.49Å
877	Q	79.8	Confident	86	Confident	186 Å²	186	69.2 Å²	69.2	87%	0.869	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-25.4	-173.7	-62.3	-175.4	-4.7	0	0	114.1
878	D	81.3	Confident	85.8	Confident	82 Å²	82	72.3 Å²	72.3	44%	0.439	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	14	-177.9	-112.1	-23.4	0	0	0	112.1	L876 E880 K881 I882	L876-D878 PolarHBondContact O-N 3.09Å; D878-E880 PolarHBondContact O-N 3.49Å; D878-K881 WeakPolarHBondContact O-CB 3.38Å; D878-K881 PolarHBondContact O-N 3.5Å; D878-K881 VanDerWaalsContact O-N 3.15Å; D878-K881 WeakPolarHBondContact OD1-CD 3.43Å; D878-K881 IonicContact OD1-NZ 2.7Å; D878-K881 PolarHBondContact OD1-NZ 2.78Å; D878-K881 IonicContact OD2-NZ 3.49Å; D878-K881 PolarHBondContact OD2-NZ 2.79Å; D878-I882 HydrophobicContact CB-CD1 4.08Å; D878-I882 HydrophobicContact CB-CG1 4.44Å; D878-I882 WeakPolarHBondContact O-CG1 3.44Å; D878-I882 PolarHBondContact O-N 3.46Å; D878-I882 VanDerWaalsContact O-N 3.12Å
879	I	85.9	Confident	85.7	Confident	27 Å²	27	70.9 Å²	70.9	14%	0.138	34%	0.335	C	S	.	.	H	α-helix	trans	-56.9	-45.9	-165.5	-174.5	56	0	0	0	114.8	C873 L876 K881 I882 M883	C873-I879 HydrophobicContact CB-CD1 3.68Å; C873-I879 HydrophobicContact CB-CG1 4.4Å; C873-I879 WeakPolarHBondContact O-CD1 3.15Å; C873-I879 WeakPolarHBondContact O-CG1 3.37Å; L876-I879 HydrophobicContact CB-CB 4.29Å; L876-I879 WeakPolarHBondContact O-CB 3.41Å; L876-I879 WeakPolarHBondContact O-CG2 3.13Å; L876-I879 PolarHBondContact O-N 3.49Å; I879-K881 PolarHBondContact O-N 3.26Å; I879-K881 VanDerWaalsContact O-N 3.14Å; I879-I882 PolarHBondContact O-N 3.44Å; I879-I882 VanDerWaalsContact O-N 3.07Å; I879-M883 HydrophobicContact CD1-CG 3.71Å; I879-M883 HydrophobicContact CD1-SD 4.16Å; I879-M883 HydrophobicContact CG1-CG 4Å; I879-M883 WeakPolarHBondContact O-CG 3.31Å; I879-M883 PolarHBondContact O-N 3.11Å
880	E	84.4	Confident	85.5	Confident	172 Å²	172	72.8 Å²	72.8	80%	0.804	34%	0.344	S	S	*	.	H	α-helix	trans	-54.7	-38.9	-179.3	-62	-173.5	156	0	0	112.1	D878 A884	D878-E880 PolarHBondContact O-N 3.49Å; E880-A884 WeakPolarHBondContact O-CB 3.49Å; E880-A884 PolarHBondContact O-N 2.96Å
881	K	86.4	Confident	85.3	Confident	124 Å²	124	72.6 Å²	72.6	54%	0.539	36%	0.357	S	S	.	.	H	α-helix	trans	-78.9	-31.5	-178	168.6	-177	155.6	-147.2	0	112.3	D878 I879 Q885	D878-K881 WeakPolarHBondContact O-CB 3.38Å; D878-K881 PolarHBondContact O-N 3.5Å; D878-K881 VanDerWaalsContact O-N 3.15Å; D878-K881 WeakPolarHBondContact OD1-CD 3.43Å; D878-K881 IonicContact OD1-NZ 2.7Å; D878-K881 PolarHBondContact OD1-NZ 2.78Å; D878-K881 IonicContact OD2-NZ 3.49Å; D878-K881 PolarHBondContact OD2-NZ 2.79Å; I879-K881 PolarHBondContact O-N 3.26Å; I879-K881 VanDerWaalsContact O-N 3.14Å; K881-Q885 WeakPolarHBondContact O-CB 3.37Å; K881-Q885 PolarHBondContact O-N 2.83Å; K881-Q885 VanDerWaalsContact O-N 3.13Å
882	I	86.6	Confident	85	Confident	17 Å²	17	71.8 Å²	71.8	9%	0.087	35%	0.348	C	S	.	.	H	α-helix	trans	-69.4	-49.2	172.2	-67.3	166	0	0	0	109.9	F832 I836 F869 D878 I879 A884 Q885 I886	F832-I882 HydrophobicContact CZ-CD1 4.03Å; I836-I882 HydrophobicContact CD1-CG2 3.65Å; I836-I882 HydrophobicContact CG1-CG2 4.23Å; I836-I882 HydrophobicContact CG2-CG2 4.06Å; F869-I882 HydrophobicContact CZ-CG2 4.34Å; D878-I882 HydrophobicContact CB-CD1 4.08Å; D878-I882 HydrophobicContact CB-CG1 4.44Å; D878-I882 WeakPolarHBondContact O-CG1 3.44Å; D878-I882 PolarHBondContact O-N 3.46Å; D878-I882 VanDerWaalsContact O-N 3.12Å; I879-I882 PolarHBondContact O-N 3.44Å; I879-I882 VanDerWaalsContact O-N 3.07Å; I882-A884 PolarHBondContact O-N 2.82Å; I882-Q885 WeakPolarHBondContact O-CA 3.41Å; I882-Q885 WeakPolarHBondContact O-CB 3.17Å; I882-Q885 PolarHBondContact O-N 2.69Å; I882-I886 HydrophobicContact CG2-CD1 4.21Å; I882-I886 PolarHBondContact O-N 2.98Å
883	M	86.6	Confident	84.9	Confident	39 Å²	39	71.5 Å²	71.5	19%	0.192	35%	0.35	C	S	.	.	H	α-helix	trans	-57.4	-51.3	174.6	-70.1	-56.4	-64	0	0	111.1	W870 I879 Q885 I886 E887	W870-M883 HydrophobicContact CH2-SD 4.41Å; W870-M883 HydrophobicContact CZ3-CE 4.11Å; W870-M883 HydrophobicContact CZ3-SD 3.74Å; I879-M883 HydrophobicContact CD1-CG 3.71Å; I879-M883 HydrophobicContact CD1-SD 4.16Å; I879-M883 HydrophobicContact CG1-CG 4Å; I879-M883 WeakPolarHBondContact O-CG 3.31Å; I879-M883 PolarHBondContact O-N 3.11Å; M883-Q885 PolarHBondContact O-N 3.14Å; M883-I886 PolarHBondContact O-N 3.33Å; M883-I886 VanDerWaalsContact O-N 3.12Å; M883-E887 WeakPolarHBondContact O-CB 3.46Å; M883-E887 WeakPolarHBondContact O-CG 3.18Å; M883-E887 PolarHBondContact O-N 2.76Å
884	A	87.4	Confident	84.9	Confident	40 Å²	40	77.1 Å²	77.1	33%	0.331	38%	0.375	S	S	.	.	H	α-helix	trans	-62.6	-14.4	175.9	0	0	0	0	0	113.5	E880 I882 R888	E880-A884 WeakPolarHBondContact O-CB 3.49Å; E880-A884 PolarHBondContact O-N 2.96Å; I882-A884 PolarHBondContact O-N 2.82Å; A884-R888 WeakPolarHBondContact O-CB 3.3Å; A884-R888 VanDerWaalsContact O-CG 3.3Å; A884-R888 WeakPolarHBondContact O-CG 3.47Å; A884-R888 PolarHBondContact O-NE 3.16Å; A884-R888 PolarHBondContact O-NH2 2.91Å
885	Q	87.6	Confident	84.8	Confident	53 Å²	53	75.8 Å²	75.8	25%	0.248	36%	0.36	C	S	.	.	H	α-helix	trans	-83.4	-48.5	169.9	-177.2	173.3	-21.4	0	0	111.8	E840 K881 I882 M883 R888 G889	E840-Q885 HydrophobicContact CB-CG 4.47Å; E840-Q885 HydrophobicContact CG-CG 4.31Å; E840-Q885 WeakPolarHBondContact OE2-CG 3.45Å; E840-Q885 PolarHBondContact OE2-NE2 3.15Å; K881-Q885 WeakPolarHBondContact O-CB 3.37Å; K881-Q885 PolarHBondContact O-N 2.83Å; K881-Q885 VanDerWaalsContact O-N 3.13Å; I882-Q885 WeakPolarHBondContact O-CA 3.41Å; I882-Q885 WeakPolarHBondContact O-CB 3.17Å; I882-Q885 PolarHBondContact O-N 2.69Å; M883-Q885 PolarHBondContact O-N 3.14Å; Q885-R888 VanDerWaalsContact CA-NH2 3.31Å; Q885-R888 PolarHBondContact O-N 3.39Å; Q885-G889 PolarHBondContact O-N 2.96Å
886	I	87.8	Confident	84.8	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-62.1	-46	178.7	-63	171	0	0	0	110.4	I836 N839 W870 I882 M883 R888 G889 E890	I836-I886 HydrophobicContact CD1-CD1 4.31Å; N839-I886 HydrophobicContact CB-CD1 3.83Å; N839-I886 HydrophobicContact CB-CG1 3.91Å; N839-I886 HydrophobicContact CB-CG2 4.22Å; W870-I886 HydrophobicContact CH2-CD1 3.83Å; W870-I886 HydrophobicContact CH2-CG2 4.47Å; W870-I886 HydrophobicContact CZ2-CD1 4.36Å; I882-I886 HydrophobicContact CG2-CD1 4.21Å; I882-I886 PolarHBondContact O-N 2.98Å; M883-I886 PolarHBondContact O-N 3.33Å; M883-I886 VanDerWaalsContact O-N 3.12Å; I886-R888 VanDerWaalsContact C-N 3.3Å; I886-R888 PolarHBondContact O-N 2.62Å; I886-G889 CarbonylContact O-C 3.48Å; I886-G889 VanDerWaalsContact O-CA 3.27Å; I886-G889 WeakPolarHBondContact O-CA 3.22Å; I886-G889 PolarHBondContact O-N 3.26Å; I886-E890 HydrophobicContact CG2-CG 4.38Å; I886-E890 PolarHBondContact O-N 3.49Å
887	E	88.8	Confident	84.9	Confident	99 Å²	99	80.1 Å²	80.1	46%	0.463	38%	0.378	S	S	.	.	H	α-helix	trans	-62.3	-34.2	177.5	-69.3	173.8	179.3	0	0	112.9	M883 G889 A891	M883-E887 WeakPolarHBondContact O-CB 3.46Å; M883-E887 WeakPolarHBondContact O-CG 3.18Å; M883-E887 PolarHBondContact O-N 2.76Å; E887-G889 VanDerWaalsContact C-N 3.31Å; E887-A891 WeakPolarHBondContact O-CB 3.45Å; E887-A891 PolarHBondContact O-N 3.37Å
888	R	86.6	Confident	85.1	Confident	127 Å²	127	73.8 Å²	73.8	48%	0.479	35%	0.354	S	S	.	.	H	α-helix	trans	-69.3	-30	171.6	-84	-176.7	-68.8	127.9	6.4	112.3	A884 Q885 I886 R892	A884-R888 WeakPolarHBondContact O-CB 3.3Å; A884-R888 VanDerWaalsContact O-CG 3.3Å; A884-R888 WeakPolarHBondContact O-CG 3.47Å; A884-R888 PolarHBondContact O-NE 3.16Å; A884-R888 PolarHBondContact O-NH2 2.91Å; Q885-R888 VanDerWaalsContact CA-NH2 3.31Å; Q885-R888 PolarHBondContact O-N 3.39Å; I886-R888 VanDerWaalsContact C-N 3.3Å; I886-R888 PolarHBondContact O-N 2.62Å; R888-R892 VanDerWaalsContact O-CD 3.31Å; R888-R892 WeakPolarHBondContact O-CD 3.12Å; R888-R892 VanDerWaalsContact O-CG 3.22Å; R888-R892 WeakPolarHBondContact O-CG 3.26Å; R888-R892 PolarHBondContact O-N 2.81Å
889	G	84.8	Confident	85.3	Confident	1 Å²	1	70.2 Å²	70.2	1%	0.01	34%	0.335	C	S	.	.	H	α-helix	trans	-63.9	-59.5	169	0	0	0	0	0	111.7	E840 Q885 I886 E887 A891 R892 I893	E840-G889 WeakPolarHBondContact O-CA 3.41Å; Q885-G889 PolarHBondContact O-N 2.96Å; I886-G889 CarbonylContact O-C 3.48Å; I886-G889 VanDerWaalsContact O-CA 3.27Å; I886-G889 WeakPolarHBondContact O-CA 3.22Å; I886-G889 PolarHBondContact O-N 3.26Å; E887-G889 VanDerWaalsContact C-N 3.31Å; G889-A891 VanDerWaalsContact C-N 3.3Å; G889-A891 PolarHBondContact O-N 2.9Å; G889-R892 WeakPolarHBondContact O-CA 3.31Å; G889-R892 WeakPolarHBondContact O-CB 3.42Å; G889-R892 PolarHBondContact O-N 3.39Å; G889-I893 WeakPolarHBondContact O-CG1 3.48Å; G889-I893 PolarHBondContact O-N 2.82Å
890	E	86.6	Confident	85.3	Confident	41 Å²	41	73.6 Å²	73.6	19%	0.192	35%	0.349	C	S	.	.	H	α-helix	trans	-55.9	-41.8	179.5	-67.9	169.7	158.2	0	0	112.3	R844 I886 R892 I893 Q894	R844-E890 WeakPolarHBondContact CG-OE1 3.29Å; R844-E890 IonicContact CZ-OE1 3.82Å; R844-E890 IonicContact CZ-OE2 2.65Å; R844-E890 PolarHBondContact N-OE1 2.76Å; R844-E890 IonicContact NE-OE1 2.7Å; R844-E890 PolarHBondContact NE-OE1 2.92Å; R844-E890 IonicContact NE-OE2 3.2Å; R844-E890 PolarHBondContact NE-OE2 3.14Å; R844-E890 IonicContact NH2-OE1 2.87Å; R844-E890 IonicContact NH2-OE2 2.66Å; R844-E890 PolarHBondContact NH2-OE2 3.32Å; I886-E890 HydrophobicContact CG2-CG 4.38Å; I886-E890 PolarHBondContact O-N 3.49Å; E890-R892 VanDerWaalsContact C-N 3.31Å; E890-R892 PolarHBondContact O-N 3.39Å; E890-I893 PolarHBondContact O-N 3.3Å; E890-Q894 WeakPolarHBondContact O-CB 3.27Å; E890-Q894 PolarHBondContact O-N 2.92Å
891	A	83.9	Confident	85.4	Confident	64 Å²	64	72.6 Å²	72.6	53%	0.529	34%	0.341	S	S	.	.	H	α-helix	trans	-61.9	-34.4	173.8	0	0	0	0	0	113.3	E887 G889 R895	E887-A891 WeakPolarHBondContact O-CB 3.45Å; E887-A891 PolarHBondContact O-N 3.37Å; G889-A891 VanDerWaalsContact C-N 3.3Å; G889-A891 PolarHBondContact O-N 2.9Å; A891-R895 WeakPolarHBondContact O-CB 3.35Å; A891-R895 PolarHBondContact O-N 3.43Å
892	R	82.3	Confident	85.4	Confident	133 Å²	133	67.1 Å²	67.1	50%	0.502	32%	0.32	S	S	.	.	H	α-helix	trans	-71.7	-42	173.3	-68.4	159.8	177.8	161.5	0.1	111.6	E840 R888 G889 E890 R895 R896	E840-R892 IonicContact OE1-CZ 3.51Å; E840-R892 IonicContact OE1-NH1 2.73Å; E840-R892 PolarHBondContact OE1-NH1 3.25Å; E840-R892 IonicContact OE1-NH2 3.39Å; R888-R892 VanDerWaalsContact O-CD 3.31Å; R888-R892 WeakPolarHBondContact O-CD 3.12Å; R888-R892 VanDerWaalsContact O-CG 3.22Å; R888-R892 WeakPolarHBondContact O-CG 3.26Å; R888-R892 PolarHBondContact O-N 2.81Å; G889-R892 WeakPolarHBondContact O-CA 3.31Å; G889-R892 WeakPolarHBondContact O-CB 3.42Å; G889-R892 PolarHBondContact O-N 3.39Å; E890-R892 VanDerWaalsContact C-N 3.31Å; E890-R892 PolarHBondContact O-N 3.39Å; R892-R895 PolarHBondContact O-N 3.23Å; R892-R896 WeakPolarHBondContact O-CG 3.44Å; R892-R896 PolarHBondContact O-N 2.94Å
893	I	83.1	Confident	85.4	Confident	48 Å²	48	66.5 Å²	66.5	25%	0.246	32%	0.316	C	S	.	.	H	α-helix	trans	-59.8	-52.2	177.6	-62.6	167	0	0	0	109.3	K841 W842 G889 E890 R895 R896 I897	K841-I893 WeakPolarHBondContact O-CD1 3.35Å; W842-I893 VanDerWaalsContact C-CD1 3.49Å; G889-I893 WeakPolarHBondContact O-CG1 3.48Å; G889-I893 PolarHBondContact O-N 2.82Å; E890-I893 PolarHBondContact O-N 3.3Å; I893-R895 VanDerWaalsContact C-N 3.27Å; I893-R895 PolarHBondContact O-N 3.23Å; I893-R896 WeakPolarHBondContact O-CB 3.22Å; I893-R896 PolarHBondContact O-N 2.84Å; I893-R896 VanDerWaalsContact O-N 3.09Å; I893-I897 HydrophobicContact CG2-CD1 4Å; I893-I897 WeakPolarHBondContact O-CG1 3.43Å; I893-I897 PolarHBondContact O-N 3.11Å
894	Q	83.5	Confident	85.4	Confident	130 Å²	130	68.2 Å²	68.2	61%	0.607	33%	0.326	S	S	*	.	H	α-helix	trans	-62.1	-34.3	177.7	-172.6	66.5	-21.9	0	0	112.4	E890 S898	E890-Q894 WeakPolarHBondContact O-CB 3.27Å; E890-Q894 PolarHBondContact O-N 2.92Å; Q894-S898 WeakPolarHBondContact O-CB 3.2Å; Q894-S898 PolarHBondContact O-N 2.91Å
895	R	82.9	Confident	85.4	Confident	107 Å²	107	69 Å²	69	40%	0.404	33%	0.329	S	S	.	.	H	α-helix	trans	-66.5	-41.3	173.1	-172.9	65.7	-178.1	144.6	8.7	112.3	A891 R892 I893 S898 I899 E991	A891-R895 WeakPolarHBondContact O-CB 3.35Å; A891-R895 PolarHBondContact O-N 3.43Å; R892-R895 PolarHBondContact O-N 3.23Å; I893-R895 VanDerWaalsContact C-N 3.27Å; I893-R895 PolarHBondContact O-N 3.23Å; R895-S898 PolarHBondContact O-N 3.05Å; R895-I899 HydrophobicContact CG-CD1 4.04Å; R895-I899 VanDerWaalsContact O-CG1 3.27Å; R895-I899 WeakPolarHBondContact O-CG1 3.34Å; R895-I899 PolarHBondContact O-N 2.99Å; R895-E991 IonicContact CZ-OE1 2.7Å; R895-E991 IonicContact CZ-OE2 2.88Å; R895-E991 VanDerWaalsContact NH1-CD 3.27Å; R895-E991 IonicContact NH1-OE1 2.69Å; R895-E991 PolarHBondContact NH1-OE1 2.93Å; R895-E991 IonicContact NH1-OE2 3.88Å; R895-E991 PolarHBondContact NH1-OE2 3.38Å; R895-E991 IonicContact NH2-OE1 3.87Å; R895-E991 IonicContact NH2-OE2 3.34Å; R895-E991 PolarHBondContact NH2-OE2 3.4Å
896	R	81.8	Confident	85.4	Confident	99 Å²	99	66.5 Å²	66.5	37%	0.374	32%	0.318	S	S	.	.	H	α-helix	trans	-59.9	-48.6	173.7	-71.1	178.6	-178.9	-165.3	1.6	110.7	R892 I893 S898 I899 K900 F946 D947 E949	R892-R896 WeakPolarHBondContact O-CG 3.44Å; R892-R896 PolarHBondContact O-N 2.94Å; I893-R896 WeakPolarHBondContact O-CB 3.22Å; I893-R896 PolarHBondContact O-N 2.84Å; I893-R896 VanDerWaalsContact O-N 3.09Å; R896-S898 PolarHBondContact O-N 2.83Å; R896-I899 PolarHBondContact O-N 3.38Å; R896-K900 WeakPolarHBondContact O-CB 3.4Å; R896-K900 PolarHBondContact O-N 3.29Å; R896-F946 HydrophobicContact CG-CD1 4.47Å; R896-F946 HydrophobicContact CG-CE1 4.17Å; R896-D947 PolarHBondContact NH1-O 2.88Å; R896-E949 IonicContact NH2-OE1 3.23Å
897	I	84	Confident	85.4	Confident	93 Å²	93	67.3 Å²	67.3	48%	0.477	32%	0.322	S	S	.	.	H	α-helix	trans	-58.9	-44.8	178.2	-64.8	167.6	0	0	0	111.6	I893 K900 K901	I893-I897 HydrophobicContact CG2-CD1 4Å; I893-I897 WeakPolarHBondContact O-CG1 3.43Å; I893-I897 PolarHBondContact O-N 3.11Å; I897-K900 PolarHBondContact O-N 3.46Å; I897-K901 WeakPolarHBondContact O-CB 3.24Å; I897-K901 PolarHBondContact O-N 3.12Å
898	S	85.4	Confident	85.2	Confident	53 Å²	53	65.9 Å²	65.9	37%	0.371	33%	0.334	S	S	.	.	H	α-helix	trans	-58.9	-48.7	175.4	-176.6	0	0	0	0	112.3	Q894 R895 R896 K901 A902 E991	Q894-S898 WeakPolarHBondContact O-CB 3.2Å; Q894-S898 PolarHBondContact O-N 2.91Å; R895-S898 PolarHBondContact O-N 3.05Å; R896-S898 PolarHBondContact O-N 2.83Å; S898-K901 PolarHBondContact O-N 3.13Å; S898-A902 WeakPolarHBondContact O-CB 3.17Å; S898-A902 PolarHBondContact O-N 3.44Å; S898-E991 PolarHBondContact OG-OE1 3.03Å
899	I	85.4	Confident	85.2	Confident	8 Å²	8	64.6 Å²	64.6	4%	0.041	33%	0.329	C	S	.	.	H	α-helix	trans	-63.3	-45.1	-179	-70.4	172.6	0	0	0	110.9	R895 R896 A902 L903 F946 I987	R895-I899 HydrophobicContact CG-CD1 4.04Å; R895-I899 VanDerWaalsContact O-CG1 3.27Å; R895-I899 WeakPolarHBondContact O-CG1 3.34Å; R895-I899 PolarHBondContact O-N 2.99Å; R896-I899 PolarHBondContact O-N 3.38Å; I899-A902 PolarHBondContact O-N 2.87Å; I899-L903 HydrophobicContact CG2-CD1 3.96Å; I899-L903 HydrophobicContact CG2-CG 4.44Å; I899-L903 WeakPolarHBondContact O-CG 3.35Å; I899-L903 PolarHBondContact O-N 3.05Å; I899-F946 HydrophobicContact CB-CE1 4.29Å; I899-F946 HydrophobicContact CB-CZ 4.47Å; I899-F946 HydrophobicContact CD1-CE1 3.95Å; I899-F946 HydrophobicContact CD1-CE2 4.48Å; I899-F946 HydrophobicContact CD1-CZ 3.66Å; I899-F946 HydrophobicContact CG2-CD1 4.11Å; I899-F946 HydrophobicContact CG2-CD2 4.03Å; I899-F946 HydrophobicContact CG2-CE1 3.99Å; I899-F946 HydrophobicContact CG2-CE2 3.9Å; I899-F946 HydrophobicContact CG2-CG 4.14Å; I899-F946 HydrophobicContact CG2-CZ 3.89Å; I899-I987 HydrophobicContact CB-CG2 4.4Å; I899-I987 HydrophobicContact CD1-CG2 4.2Å; I899-I987 HydrophobicContact CG1-CG2 3.83Å; I899-I987 HydrophobicContact CG2-CD1 3.82Å; I899-I987 HydrophobicContact CG2-CG1 4.23Å; I899-I987 HydrophobicContact CG2-CG2 3.92Å
900	K	85.4	Confident	85.4	Confident	98 Å²	98	67.3 Å²	67.3	43%	0.426	34%	0.339	S	S	.	.	H	α-helix	trans	-56.2	-54	176.5	-171.6	169.9	-174.1	166.6	0	111.2	R896 I897 A902 L903 D904 D947	R896-K900 WeakPolarHBondContact O-CB 3.4Å; R896-K900 PolarHBondContact O-N 3.29Å; I897-K900 PolarHBondContact O-N 3.46Å; K900-A902 VanDerWaalsContact C-N 3.29Å; K900-A902 PolarHBondContact O-N 2.86Å; K900-L903 PolarHBondContact O-N 3.49Å; K900-L903 VanDerWaalsContact O-N 3.12Å; K900-D904 PolarHBondContact O-N 3.15Å; K900-D904 VanDerWaalsContact O-OD2 3.12Å; K900-D947 WeakPolarHBondContact CD-OD2 3.42Å; K900-D947 WeakPolarHBondContact CE-OD2 3.35Å; K900-D947 IonicContact NZ-OD2 3.88Å; K900-D947 PolarHBondContact NZ-OD2 2.84Å
901	K	86.8	Confident	85.1	Confident	150 Å²	150	75.3 Å²	75.3	65%	0.652	37%	0.373	S	S	*	.	H	α-helix	trans	-57.9	-37.4	176	-176.4	179.1	177.3	-176.4	0	113.1	I897 S898 S905	I897-K901 WeakPolarHBondContact O-CB 3.24Å; I897-K901 PolarHBondContact O-N 3.12Å; S898-K901 PolarHBondContact O-N 3.13Å; K901-S905 WeakPolarHBondContact O-CB 3.37Å; K901-S905 PolarHBondContact O-N 3.04Å
902	A	86	Confident	85.2	Confident	10 Å²	10	73.9 Å²	73.9	8%	0.083	36%	0.362	C	S	.	.	H	α-helix	trans	-69.1	-38.8	177.4	0	0	0	0	0	112.6	S898 I899 K900 K906 E991 N994	S898-A902 WeakPolarHBondContact O-CB 3.17Å; S898-A902 PolarHBondContact O-N 3.44Å; I899-A902 PolarHBondContact O-N 2.87Å; K900-A902 VanDerWaalsContact C-N 3.29Å; K900-A902 PolarHBondContact O-N 2.86Å; A902-K906 VanDerWaalsContact O-CB 3.3Å; A902-K906 WeakPolarHBondContact O-CB 3.22Å; A902-K906 PolarHBondContact O-N 3.21Å; A902-K906 VanDerWaalsContact O-N 3.1Å; A902-E991 HydrophobicContact CB-CG 3.78Å; A902-N994 WeakPolarHBondContact CA-ND2 3.46Å; A902-N994 PolarHBondContact O-ND2 3.25Å
903	L	86.8	Confident	85.4	Confident	3 Å²	3	68.9 Å²	68.9	2%	0.016	35%	0.346	C	S	.	.	H	α-helix	trans	-68.4	-47.3	174.5	-70	172	0	0	0	111.5	I899 K900 S905 K906 I907 I938 I987 I990	I899-L903 HydrophobicContact CG2-CD1 3.96Å; I899-L903 HydrophobicContact CG2-CG 4.44Å; I899-L903 WeakPolarHBondContact O-CG 3.35Å; I899-L903 PolarHBondContact O-N 3.05Å; K900-L903 PolarHBondContact O-N 3.49Å; K900-L903 VanDerWaalsContact O-N 3.12Å; L903-S905 PolarHBondContact O-N 3.03Å; L903-K906 PolarHBondContact O-N 2.92Å; L903-K906 VanDerWaalsContact O-N 3.15Å; L903-I907 WeakPolarHBondContact O-CB 3.41Å; L903-I907 WeakPolarHBondContact O-CG1 3.43Å; L903-I907 PolarHBondContact O-N 3.37Å; L903-I938 HydrophobicContact CD2-CD1 4.11Å; L903-I938 HydrophobicContact CD2-CG2 4.06Å; L903-I987 HydrophobicContact CD2-CG1 4.3Å; L903-I990 HydrophobicContact CD2-CD1 4.24Å
904	D	87.1	Confident	85.5	Confident	75 Å²	75	70.5 Å²	70.5	40%	0.401	35%	0.352	S	S	.	.	H	α-helix	trans	-56	-50	175.6	-69.4	-41.8	0	0	0	111.2	K900 K906 I907 G908 H942	K900-D904 PolarHBondContact O-N 3.15Å; K900-D904 VanDerWaalsContact O-OD2 3.12Å; D904-K906 VanDerWaalsContact C-N 3.28Å; D904-K906 PolarHBondContact O-N 3.36Å; D904-I907 PolarHBondContact O-N 3.4Å; D904-G908 PolarHBondContact O-N 2.72Å; D904-H942 IonicContact OD1-CD2 3.3Å; D904-H942 IonicContact OD1-CE1 3.8Å; D904-H942 IonicContact OD1-NE2 2.74Å; D904-H942 PolarHBondContact OD1-NE2 3.17Å
905	S	87.6	Confident	85.5	Confident	57 Å²	57	71.5 Å²	71.5	40%	0.399	36%	0.356	S	S	.	.	H	α-helix	trans	-62.2	-31.9	178.1	-178.2	0	0	0	0	113.2	K901 L903 R909	K901-S905 WeakPolarHBondContact O-CB 3.37Å; K901-S905 PolarHBondContact O-N 3.04Å; L903-S905 PolarHBondContact O-N 3.03Å; S905-R909 WeakPolarHBondContact O-CG 3.44Å; S905-R909 PolarHBondContact O-NE 3.27Å; S905-R909 PolarHBondContact O-NH2 3.26Å; S905-R909 PolarHBondContact OG-NH2 3.2Å
906	K	86.6	Confident	85.6	Confident	1 Å²	1	70.9 Å²	70.9	0%	0.004	36%	0.358	C	S	.	.	H	α-helix	trans	-78.2	-43	177.7	178.1	68.3	-175	-175.2	0	112.1	A902 L903 D904 Y910 L917 R918 I990 E993	A902-K906 VanDerWaalsContact O-CB 3.3Å; A902-K906 WeakPolarHBondContact O-CB 3.22Å; A902-K906 PolarHBondContact O-N 3.21Å; A902-K906 VanDerWaalsContact O-N 3.1Å; L903-K906 PolarHBondContact O-N 2.92Å; L903-K906 VanDerWaalsContact O-N 3.15Å; D904-K906 VanDerWaalsContact C-N 3.28Å; D904-K906 PolarHBondContact O-N 3.36Å; K906-Y910 VanDerWaalsContact O-CD2 3.31Å; K906-Y910 WeakPolarHBondContact O-CD2 3.38Å; K906-Y910 WeakPolarHBondContact O-CE2 3.49Å; K906-L917 HydrophobicContact CG-CD1 4.24Å; K906-R918 VanDerWaalsContact CE-O 3.3Å; K906-R918 WeakPolarHBondContact CE-O 3.42Å; K906-R918 PolarHBondContact NZ-O 3.21Å; K906-I990 HydrophobicContact CB-CG2 3.6Å; K906-I990 HydrophobicContact CD-CG1 4.24Å; K906-I990 HydrophobicContact CD-CG2 4.21Å; K906-I990 HydrophobicContact CG-CD1 4.12Å; K906-I990 HydrophobicContact CG-CG1 4.03Å; K906-I990 HydrophobicContact CG-CG2 3.8Å; K906-E993 IonicContact NZ-OE1 3.79Å; K906-E993 PolarHBondContact NZ-OE1 3.43Å; K906-E993 IonicContact NZ-OE2 3.57Å; K906-E993 PolarHBondContact NZ-OE2 3.38Å
907	I	87	Confident	85.9	Confident	16 Å²	16	66.3 Å²	66.3	8%	0.082	34%	0.34	C	S	.	.	H	α-helix	trans	-76.5	-39.5	-174.7	-73	170	0	0	0	110.9	L903 D904 R909 Y910 P913 L917 I938 H942	L903-I907 WeakPolarHBondContact O-CB 3.41Å; L903-I907 WeakPolarHBondContact O-CG1 3.43Å; L903-I907 PolarHBondContact O-N 3.37Å; D904-I907 PolarHBondContact O-N 3.4Å; I907-R909 PolarHBondContact O-N 2.98Å; I907-Y910 PolarHBondContact O-N 3.23Å; I907-P913 HydrophobicContact CG2-CB 4.08Å; I907-P913 HydrophobicContact CG2-CG 3.71Å; I907-L917 HydrophobicContact CG1-CD1 3.81Å; I907-I938 HydrophobicContact CD1-CG2 4.28Å; I907-H942 HydrophobicContact CD1-CB 3.31Å
908	G	86.3	Confident	85.8	Confident	69 Å²	69	70.3 Å²	70.3	71%	0.711	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-10.7	176.8	0	0	0	0	0	115.6	D904 Y910	D904-G908 PolarHBondContact O-N 2.72Å; G908-Y910 VanDerWaalsContact C-N 3.31Å
909	R	86.7	Confident	85.7	Confident	101 Å²	101	68.4 Å²	68.4	38%	0.381	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-14.9	172.8	-66.1	173.3	-162.9	148.4	18.6	113.7	S905 I907 E993 N994 L997	S905-R909 WeakPolarHBondContact O-CG 3.44Å; S905-R909 PolarHBondContact O-NE 3.27Å; S905-R909 PolarHBondContact O-NH2 3.26Å; S905-R909 PolarHBondContact OG-NH2 3.2Å; I907-R909 PolarHBondContact O-N 2.98Å; R909-E993 IonicContact NH1-OE1 2.75Å; R909-E993 PolarHBondContact NH1-OE1 3.3Å; R909-N994 VanDerWaalsContact CZ-OD1 3.25Å; R909-N994 PolarHBondContact NH1-OD1 3.41Å; R909-N994 PolarHBondContact NH2-OD1 3.1Å; R909-L997 VanDerWaalsContact NH1-CD1 3.34Å
910	Y	87.4	Confident	85.5	Confident	57 Å²	57	71.2 Å²	71.2	22%	0.224	36%	0.355	C	S	.	.			trans	-118.8	130.6	-172.1	-59.6	-80.7	0	0	0	111.3	K906 I907 G908 A912 Q916 L917 R918	K906-Y910 VanDerWaalsContact O-CD2 3.31Å; K906-Y910 WeakPolarHBondContact O-CD2 3.38Å; K906-Y910 WeakPolarHBondContact O-CE2 3.49Å; I907-Y910 PolarHBondContact O-N 3.23Å; G908-Y910 VanDerWaalsContact C-N 3.31Å; Y910-A912 VanDerWaalsContact C-N 3.33Å; Y910-Q916 HydrophobicContact CD1-CB 3.79Å; Y910-Q916 WeakPolarHBondContact CD1-O 3.35Å; Y910-Q916 VanDerWaalsContact CE1-O 3.26Å; Y910-Q916 WeakPolarHBondContact CE1-O 3.37Å; Y910-Q916 HydrophobicContact CG-CB 4.38Å; Y910-L917 HydrophobicContact CD2-CB 3.9Å; Y910-L917 HydrophobicContact CD2-CD1 4.19Å; Y910-L917 HydrophobicContact CD2-CG 4.04Å; Y910-L917 HydrophobicContact CE2-CB 3.98Å; Y910-L917 HydrophobicContact CE2-CD1 4.25Å; Y910-L917 HydrophobicContact CE2-CG 3.8Å; Y910-L917 HydrophobicContact CG-CB 4.25Å; Y910-R918 PolarHBondContact OH-N 3.07Å; Y910-R918 PolarHBondContact OH-O 2.74Å
911	K	82	Confident	85.2	Confident	210 Å²	210	67.6 Å²	67.6	91%	0.913	34%	0.339	S	S	*	.	S	Bend	trans	-70.6	-29.7	177.1	-69.4	-170.7	177	-174.4	0	112.6
912	A	85.8	Confident	84.4	Confident	34 Å²	34	63.5 Å²	63.5	28%	0.281	34%	0.34	S	S	.	.	S	Bend	trans	-133	79.5	174.3	0	0	0	0	0	110.5	Y910 F914 H915 Q916	Y910-A912 VanDerWaalsContact C-N 3.33Å; A912-F914 PolarHBondContact O-N 3.3Å; A912-H915 PolarHBondContact O-N 3.04Å; A912-Q916 HydrophobicContact CB-CG 4.23Å; A912-Q916 WeakPolarHBondContact O-CB 3.29Å; A912-Q916 WeakPolarHBondContact O-CG 3.25Å; A912-Q916 PolarHBondContact O-N 3.33Å
913	P	86.2	Confident	83.4	Confident	27 Å²	27	69.9 Å²	69.9	18%	0.175	38%	0.378	C	S	.	.	H	α-helix	trans	-52.4	-45.8	-170.8	-28.9	35.6	0	0	0	114.3	I907 H915 Q916 L917 R935	I907-P913 HydrophobicContact CG2-CB 4.08Å; I907-P913 HydrophobicContact CG2-CG 3.71Å; P913-H915 PolarHBondContact O-N 2.8Å; P913-Q916 PolarHBondContact O-N 2.95Å; P913-L917 WeakPolarHBondContact O-CB 3.49Å; P913-L917 PolarHBondContact O-N 3.17Å; P913-R935 WeakPolarHBondContact O-CD 3.31Å
914	F	84.6	Confident	81.9	Confident	83 Å²	83	76.4 Å²	76.4	36%	0.364	41%	0.413	S	S	.	.	H	α-helix	trans	-58.8	-19.1	178.3	-76	-85.3	0	0	0	115.1	A912 R935 F936 C939 M940	A912-F914 PolarHBondContact O-N 3.3Å; F914-R935 VanDerWaalsContact C-CD 3.43Å; F914-R935 WeakPolarHBondContact O-CD 3.45Å; F914-F936 HydrophobicContact CD1-CD2 4.07Å; F914-F936 AromaticContact CE1-CD2 3.81Å; F914-F936 HydrophobicContact CE1-CD2 3.81Å; F914-F936 HydrophobicContact CE1-CE2 4.14Å; F914-C939 HydrophobicContact CD1-CB 3.71Å; F914-C939 HydrophobicContact CD2-CB 4.03Å; F914-C939 HydrophobicContact CE1-CB 3.42Å; F914-C939 VanDerWaalsContact CE1-CB 3.42Å; F914-C939 HydrophobicContact CE2-CB 3.76Å; F914-C939 HydrophobicContact CG-CB 4.01Å; F914-C939 HydrophobicContact CZ-CB 3.45Å; F914-C939 VanDerWaalsContact CZ-CB 3.45Å; F914-M940 HydrophobicContact CE1-CG 4.06Å; F914-M940 HydrophobicContact CE1-SD 4.03Å; F914-M940 HydrophobicContact CZ-CG 4.29Å; F914-M940 HydrophobicContact CZ-SD 3.81Å
915	H	83.3	Confident	80.6	Confident	151 Å²	151	78 Å²	78	70%	0.699	42%	0.416	S	S	*	.	H	α-helix	trans	-113.2	-24.6	178.5	-60.9	103.5	0	0	0	113.3	A912 P913	A912-H915 PolarHBondContact O-N 3.04Å; P913-H915 PolarHBondContact O-N 2.8Å
916	Q	85.4	Confident	79.2	Confident	94 Å²	94	77 Å²	77	44%	0.439	42%	0.415	S	S	.	.	H	α-helix	trans	-112.8	-22.5	-167.4	-63.1	175.6	-17.4	0	0	114.3	Y910 A912 P913 R918	Y910-Q916 HydrophobicContact CD1-CB 3.79Å; Y910-Q916 WeakPolarHBondContact CD1-O 3.35Å; Y910-Q916 VanDerWaalsContact CE1-O 3.26Å; Y910-Q916 WeakPolarHBondContact CE1-O 3.37Å; Y910-Q916 HydrophobicContact CG-CB 4.38Å; A912-Q916 HydrophobicContact CB-CG 4.23Å; A912-Q916 WeakPolarHBondContact O-CB 3.29Å; A912-Q916 WeakPolarHBondContact O-CG 3.25Å; A912-Q916 PolarHBondContact O-N 3.33Å; P913-Q916 PolarHBondContact O-N 2.95Å; Q916-R918 PolarHBondContact O-N 2.87Å
917	L	87.5	Confident	78	Confident	2 Å²	2	87 Å²	87	1%	0.01	46%	0.458	C	S	.	.			trans	-67.2	125.8	-174.3	-178.2	155.4	0	0	0	110.7	K906 I907 Y910 P913 I919 R935 I938	K906-L917 HydrophobicContact CG-CD1 4.24Å; I907-L917 HydrophobicContact CG1-CD1 3.81Å; Y910-L917 HydrophobicContact CD2-CB 3.9Å; Y910-L917 HydrophobicContact CD2-CD1 4.19Å; Y910-L917 HydrophobicContact CD2-CG 4.04Å; Y910-L917 HydrophobicContact CE2-CB 3.98Å; Y910-L917 HydrophobicContact CE2-CD1 4.25Å; Y910-L917 HydrophobicContact CE2-CG 3.8Å; Y910-L917 HydrophobicContact CG-CB 4.25Å; P913-L917 WeakPolarHBondContact O-CB 3.49Å; P913-L917 PolarHBondContact O-N 3.17Å; L917-I919 HydrophobicContact CD2-CD1 4.16Å; L917-I919 HydrophobicContact CD2-CG1 3.71Å; L917-R935 HydrophobicContact CB-CG 4.08Å; L917-R935 HydrophobicContact CD2-CG 4.21Å; L917-R935 PolarHBondContact O-NE 2.91Å; L917-I938 HydrophobicContact CD1-CG2 4.29Å
918	R	83.1	Confident	77.3	Confident	177 Å²	177	91.6 Å²	91.6	67%	0.668	48%	0.483	S	S	*	.			trans	-117.1	145.6	174.3	-64.9	-172.2	179.2	-155.4	-1.8	109.4	K906 Y910 Q916	K906-R918 VanDerWaalsContact CE-O 3.3Å; K906-R918 WeakPolarHBondContact CE-O 3.42Å; K906-R918 PolarHBondContact NZ-O 3.21Å; Y910-R918 PolarHBondContact OH-N 3.07Å; Y910-R918 PolarHBondContact OH-O 2.74Å; Q916-R918 PolarHBondContact O-N 2.87Å
919	I	83.8	Confident	77.1	Confident	13 Å²	13	89.9 Å²	89.9	7%	0.067	46%	0.456	C	S	.	.			trans	-114.7	135.3	-179.1	-59.1	176.8	0	0	0	108.3	L917 Y921 D934 I938 L986 L989	L917-I919 HydrophobicContact CD2-CD1 4.16Å; L917-I919 HydrophobicContact CD2-CG1 3.71Å; I919-Y921 HydrophobicContact CB-CE1 4.22Å; I919-Y921 HydrophobicContact CB-CE2 4.17Å; I919-Y921 HydrophobicContact CG2-CD1 4.4Å; I919-Y921 HydrophobicContact CG2-CE1 4.06Å; I919-Y921 VanDerWaalsContact O-CD2 3.25Å; I919-Y921 WeakPolarHBondContact O-CD2 3.33Å; I919-Y921 VanDerWaalsContact O-CE2 3.25Å; I919-Y921 WeakPolarHBondContact O-CE2 3.09Å; I919-Y921 PolarHBondContact O-N 2.86Å; I919-D934 HydrophobicContact CD1-CB 4.25Å; I919-I938 HydrophobicContact CD1-CG1 4.12Å; I919-L986 HydrophobicContact CD1-CB 4.47Å; I919-L986 HydrophobicContact CD1-CD1 4.49Å; I919-L986 HydrophobicContact CD1-CD2 4Å; I919-L989 HydrophobicContact CG2-CB 4.19Å; I919-L989 HydrophobicContact CG2-CD1 4.22Å
920	S	80.9	Confident	77.1	Confident	67 Å²	67	88.6 Å²	88.6	47%	0.469	46%	0.459	S	S	.	.			trans	-82.6	105.4	174.2	-169.5	0	0	0	0	110.5
921	Y	78.6	Confident	77	Confident	22 Å²	22	89 Å²	89	9%	0.086	46%	0.463	C	S	.	.			trans	-83.3	-10.2	-177.7	-59.2	-79.8	0	0	0	114.5	I919 K925 E931 D934 L986 L989	I919-Y921 HydrophobicContact CB-CE1 4.22Å; I919-Y921 HydrophobicContact CB-CE2 4.17Å; I919-Y921 HydrophobicContact CG2-CD1 4.4Å; I919-Y921 HydrophobicContact CG2-CE1 4.06Å; I919-Y921 VanDerWaalsContact O-CD2 3.25Å; I919-Y921 WeakPolarHBondContact O-CD2 3.33Å; I919-Y921 VanDerWaalsContact O-CE2 3.25Å; I919-Y921 WeakPolarHBondContact O-CE2 3.09Å; I919-Y921 PolarHBondContact O-N 2.86Å; Y921-K925 HydrophobicContact CD2-CD 4.28Å; Y921-K925 HydrophobicContact CD2-CG 4.43Å; Y921-K925 HydrophobicContact CG-CG 4.23Å; Y921-E931 HydrophobicContact CE2-CG 3.78Å; Y921-D934 WeakPolarHBondContact CE1-OD2 3.35Å; Y921-D934 WeakPolarHBondContact OH-CB 3.37Å; Y921-D934 PolarHBondContact OH-OD2 3.46Å; Y921-L986 HydrophobicContact CE1-CD2 4Å; Y921-L989 HydrophobicContact CD1-CD1 3.97Å
922	G	70.4	Confident	77.1	Confident	64 Å²	64	85.4 Å²	85.4	66%	0.66	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	-147.8	-171	0	0	0	0	0	112.6	N924	G922-N924 VanDerWaalsContact C-N 3.3Å; G922-N924 PolarHBondContact O-N 2.86Å
923	T	63.4	Low	77.2	Confident	144 Å²	144	84.5 Å²	84.5	88%	0.883	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-15.3	178.9	43	0	0	0	0	114.4
924	N	55.5	Low	77.4	Confident	141 Å²	141	83.3 Å²	83.3	75%	0.754	43%	0.431	S	S	*	.			trans	-108.8	54.9	-172.1	-75.7	-16.8	0	0	0	112.7	G922 G926	G922-N924 VanDerWaalsContact C-N 3.3Å; G922-N924 PolarHBondContact O-N 2.86Å; N924-G926 VanDerWaalsContact C-N 3.3Å; N924-G926 PolarHBondContact O-N 3Å
925	K	60	Low	77.7	Confident	108 Å²	108	81 Å²	81	47%	0.47	42%	0.42	S	S	.	.			trans	-70.9	86.5	168.5	-168.6	173.2	179.8	179.2	0	110.1	Y921 K927 E931	Y921-K925 HydrophobicContact CD2-CD 4.28Å; Y921-K925 HydrophobicContact CD2-CG 4.43Å; Y921-K925 HydrophobicContact CG-CG 4.23Å; K925-K927 PolarHBondContact O-N 3.3Å; K925-E931 IonicContact NZ-OE1 3.65Å; K925-E931 PolarHBondContact NZ-OE1 3.44Å
926	G	59.6	Low	78	Confident	37 Å²	37	74.6 Å²	74.6	38%	0.381	39%	0.39	S	S	.	.			trans	-57.1	127.2	179.4	0	0	0	0	0	111.9	N924 N928	N924-G926 VanDerWaalsContact C-N 3.3Å; N924-G926 PolarHBondContact O-N 3Å; G926-N928 PolarHBondContact O-N 2.88Å
927	K	60.5	Low	78.3	Confident	209 Å²	209	70.1 Å²	70.1	91%	0.909	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-1.8	-162.9	-65	-173.4	176.2	-176.7	0	117	K925	K925-K927 PolarHBondContact O-N 3.3Å
928	N	72.3	Confident	78.4	Confident	113 Å²	113	70 Å²	70	60%	0.604	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	-5.7	-161	-62.5	30	0	0	0	114.9	G926 F970	G926-N928 PolarHBondContact O-N 2.88Å; N928-F970 HydrophobicContact CB-CZ 4.19Å; N928-F970 WeakPolarHBondContact O-CE1 3.46Å; N928-F970 WeakPolarHBondContact O-CZ 3.41Å
929	Y	83.1	Confident	78.8	Confident	34 Å²	34	61.8 Å²	61.8	13%	0.133	34%	0.339	C	S	.	.			trans	-133	139.6	178.7	-73	-94.9	0	0	0	109.5	E933 L937 F970 L971 R982	Y929-E933 WeakPolarHBondContact CA-OE2 3.37Å; Y929-E933 HydrophobicContact CD1-CB 4.44Å; Y929-E933 WeakPolarHBondContact CD1-OE2 3.27Å; Y929-L937 HydrophobicContact CE1-CD1 4.48Å; Y929-F970 HydrophobicContact CD1-CE1 4.01Å; Y929-F970 HydrophobicContact CD2-CE1 4.39Å; Y929-F970 AromaticContact CE1-CE1 3.88Å; Y929-F970 HydrophobicContact CE1-CE1 3.88Å; Y929-F970 HydrophobicContact CE1-CZ 4.49Å; Y929-F970 HydrophobicContact CE2-CE1 4.27Å; Y929-F970 HydrophobicContact CE2-CZ 4.19Å; Y929-F970 HydrophobicContact CG-CE1 4.27Å; Y929-L971 HydrophobicContact CD1-CD1 4.29Å; Y929-L971 HydrophobicContact CE1-CD1 3.91Å; Y929-R982 HydrophobicContact CD1-CG 4.2Å; Y929-R982 HydrophobicContact CD2-CG 4.26Å; Y929-R982 HydrophobicContact CE1-CB 4.48Å; Y929-R982 HydrophobicContact CE1-CG 3.99Å; Y929-R982 HydrophobicContact CE2-CB 4.41Å; Y929-R982 HydrophobicContact CE2-CG 4.05Å; Y929-R982 HydrophobicContact CG-CG 4.34Å
930	T	86.4	Confident	79	Confident	73 Å²	73	62 Å²	62	45%	0.448	34%	0.34	S	S	.	.			trans	-82.2	162.9	171.6	67.3	0	0	0	0	112.3	E932 E933 D934	T930-E932 PolarHBondContact O-N 3.02Å; T930-E933 WeakPolarHBondContact CB-OE1 3.22Å; T930-E933 WeakPolarHBondContact CG2-OE1 3.37Å; T930-E933 VanDerWaalsContact N-CD 3.34Å; T930-E933 PolarHBondContact N-OE1 3.37Å; T930-E933 PolarHBondContact N-OE2 3.25Å; T930-E933 PolarHBondContact O-N 3.05Å; T930-E933 VanDerWaalsContact OG1-CD 3.29Å; T930-E933 WeakPolarHBondContact OG1-CG 3.41Å; T930-E933 PolarHBondContact OG1-N 3.31Å; T930-E933 PolarHBondContact OG1-OE1 3.1Å; T930-D934 PolarHBondContact O-N 2.88Å; T930-D934 VanDerWaalsContact O-N 3.13Å
931	E	83.8	Confident	79.5	Confident	66 Å²	66	58.8 Å²	58.8	31%	0.308	32%	0.317	S	S	.	.	H	α-helix	trans	-67.5	-17.7	177.4	-57.8	-169.2	-170.2	0	0	113.2	Y921 K925 R935	Y921-E931 HydrophobicContact CE2-CG 3.78Å; K925-E931 IonicContact NZ-OE1 3.65Å; K925-E931 PolarHBondContact NZ-OE1 3.44Å; E931-R935 WeakPolarHBondContact O-CB 3.41Å; E931-R935 PolarHBondContact O-N 3.33Å; E931-R935 VanDerWaalsContact O-N 3.12Å
932	E	85	Confident	80	Confident	134 Å²	134	60.9 Å²	60.9	63%	0.626	33%	0.328	S	S	*	.	H	α-helix	trans	-83.5	-40.5	179.5	-55.8	-165.9	149.5	0	0	111.3	T930 F936	T930-E932 PolarHBondContact O-N 3.02Å; E932-F936 WeakPolarHBondContact O-CB 3.49Å; E932-F936 PolarHBondContact O-N 3.25Å
933	E	88.3	Confident	80.7	Confident	16 Å²	16	65.3 Å²	65.3	8%	0.075	33%	0.329	C	S	.	.	H	α-helix	trans	-57.6	-54.3	167.6	-65	155.6	-118.1	0	0	110.6	Y929 T930 R935 F936 L937 F965 L971	Y929-E933 WeakPolarHBondContact CA-OE2 3.37Å; Y929-E933 HydrophobicContact CD1-CB 4.44Å; Y929-E933 WeakPolarHBondContact CD1-OE2 3.27Å; T930-E933 WeakPolarHBondContact CB-OE1 3.22Å; T930-E933 WeakPolarHBondContact CG2-OE1 3.37Å; T930-E933 VanDerWaalsContact N-CD 3.34Å; T930-E933 PolarHBondContact N-OE1 3.37Å; T930-E933 PolarHBondContact N-OE2 3.25Å; T930-E933 PolarHBondContact O-N 3.05Å; T930-E933 VanDerWaalsContact OG1-CD 3.29Å; T930-E933 WeakPolarHBondContact OG1-CG 3.41Å; T930-E933 PolarHBondContact OG1-N 3.31Å; T930-E933 PolarHBondContact OG1-OE1 3.1Å; E933-R935 VanDerWaalsContact C-N 3.32Å; E933-R935 PolarHBondContact O-N 3.28Å; E933-F936 PolarHBondContact O-N 3.22Å; E933-F936 VanDerWaalsContact O-N 3.13Å; E933-L937 VanDerWaalsContact O-CG 3.32Å; E933-L937 WeakPolarHBondContact O-CG 3.44Å; E933-L937 PolarHBondContact O-N 3.33Å; E933-F965 HydrophobicContact CG-CE1 4.13Å; E933-L971 HydrophobicContact CB-CD1 4.37Å; E933-L971 HydrophobicContact CB-CD2 4.47Å; E933-L971 HydrophobicContact CG-CD1 4.41Å; E933-L971 HydrophobicContact CG-CD2 4.21Å
934	D	90.1	Very high	81.8	Confident	1 Å²	1	60 Å²	60	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-60.3	-39.9	-178.4	-75	-33.4	0	0	0	112.5	I919 Y921 T930 L937 I938 R982 L986	I919-D934 HydrophobicContact CD1-CB 4.25Å; Y921-D934 WeakPolarHBondContact CE1-OD2 3.35Å; Y921-D934 WeakPolarHBondContact OH-CB 3.37Å; Y921-D934 PolarHBondContact OH-OD2 3.46Å; T930-D934 PolarHBondContact O-N 2.88Å; T930-D934 VanDerWaalsContact O-N 3.13Å; D934-L937 PolarHBondContact O-N 3.21Å; D934-I938 PolarHBondContact O-N 3.16Å; D934-I938 VanDerWaalsContact O-N 3.12Å; D934-R982 VanDerWaalsContact CG-NH2 3.32Å; D934-R982 IonicContact OD1-CZ 2.81Å; D934-R982 IonicContact OD1-NE 3.27Å; D934-R982 PolarHBondContact OD1-NE 3.39Å; D934-R982 IonicContact OD1-NH2 2.83Å; D934-R982 PolarHBondContact OD1-NH2 3.07Å; D934-R982 IonicContact OD2-CZ 2.72Å; D934-R982 IonicContact OD2-NE 3.43Å; D934-R982 IonicContact OD2-NH2 3.76Å; D934-R982 PolarHBondContact OD2-NH2 3.24Å; D934-L986 HydrophobicContact CB-CD1 3.81Å; D934-L986 HydrophobicContact CB-CD2 3.98Å; D934-L986 WeakPolarHBondContact OD1-CD1 3.38Å
935	R	90.1	Very high	83.1	Confident	35 Å²	35	54.4 Å²	54.4	13%	0.132	27%	0.27	C	S	.	.	H	α-helix	trans	-62.4	-47.1	174.3	-174.9	-167.5	-61.3	144	8	111.1	P913 F914 L917 E931 E933 I938 C939	P913-R935 WeakPolarHBondContact O-CD 3.31Å; F914-R935 VanDerWaalsContact C-CD 3.43Å; F914-R935 WeakPolarHBondContact O-CD 3.45Å; L917-R935 HydrophobicContact CB-CG 4.08Å; L917-R935 HydrophobicContact CD2-CG 4.21Å; L917-R935 PolarHBondContact O-NE 2.91Å; E931-R935 WeakPolarHBondContact O-CB 3.41Å; E931-R935 PolarHBondContact O-N 3.33Å; E931-R935 VanDerWaalsContact O-N 3.12Å; E933-R935 VanDerWaalsContact C-N 3.32Å; E933-R935 PolarHBondContact O-N 3.28Å; R935-I938 PolarHBondContact O-N 3.13Å; R935-C939 WeakPolarHBondContact O-CB 3.34Å; R935-C939 PolarHBondContact O-N 2.7Å; R935-C939 PolarHBondContact O-SG 2.65Å
936	F	90.8	Very high	83.9	Confident	16 Å²	16	50.9 Å²	50.9	7%	0.07	26%	0.255	C	S	.	.	H	α-helix	trans	-63.1	-43.5	178.3	-179.1	-96	0	0	0	111.9	F914 E932 E933 I938 C939 M940 I959 F965	F914-F936 HydrophobicContact CD1-CD2 4.07Å; F914-F936 AromaticContact CE1-CD2 3.81Å; F914-F936 HydrophobicContact CE1-CD2 3.81Å; F914-F936 HydrophobicContact CE1-CE2 4.14Å; E932-F936 WeakPolarHBondContact O-CB 3.49Å; E932-F936 PolarHBondContact O-N 3.25Å; E933-F936 PolarHBondContact O-N 3.22Å; E933-F936 VanDerWaalsContact O-N 3.13Å; F936-I938 PolarHBondContact O-N 2.65Å; F936-C939 PolarHBondContact O-N 3.27Å; F936-M940 HydrophobicContact CD1-CG 3.99Å; F936-M940 HydrophobicContact CD2-CG 4Å; F936-M940 HydrophobicContact CE1-CB 4.43Å; F936-M940 HydrophobicContact CE1-CG 3.59Å; F936-M940 HydrophobicContact CE2-CG 3.61Å; F936-M940 HydrophobicContact CE2-SD 4.17Å; F936-M940 HydrophobicContact CG-CG 4.21Å; F936-M940 HydrophobicContact CZ-CG 3.41Å; F936-M940 VanDerWaalsContact CZ-CG 3.41Å; F936-M940 HydrophobicContact CZ-SD 4.17Å; F936-M940 WeakPolarHBondContact O-CB 3.2Å; F936-M940 WeakPolarHBondContact O-CG 3.35Å; F936-M940 PolarHBondContact O-N 3.15Å; F936-I959 HydrophobicContact CD1-CG1 4.32Å; F936-I959 HydrophobicContact CE1-CG1 3.87Å; F936-F965 HydrophobicContact CB-CE2 4.05Å; F936-F965 HydrophobicContact CB-CZ 3.87Å; F936-F965 HydrophobicContact CD1-CD2 4.46Å; F936-F965 AromaticContact CD1-CE2 3.46Å; F936-F965 HydrophobicContact CD1-CE2 3.46Å; F936-F965 VanDerWaalsContact CD1-CE2 3.46Å; F936-F965 HydrophobicContact CD1-CZ 4.11Å; F936-F965 HydrophobicContact CD2-CE2 4.05Å; F936-F965 HydrophobicContact CE1-CD2 4.39Å; F936-F965 AromaticContact CE1-CE2 3.76Å; F936-F965 HydrophobicContact CE1-CE2 3.76Å; F936-F965 HydrophobicContact CE2-CE2 4.32Å; F936-F965 AromaticContact CG-CE2 3.58Å; F936-F965 HydrophobicContact CG-CE2 3.58Å; F936-F965 AromaticContact CG-CZ 3.95Å; F936-F965 HydrophobicContact CG-CZ 3.95Å; F936-F965 HydrophobicContact CZ-CE2 4.16Å
937	L	90.8	Very high	84.4	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-55.2	-50.2	176.4	-70.6	174.8	0	0	0	111	Y929 E933 D934 L941 L955 I959 L979 R982 L986	Y929-L937 HydrophobicContact CE1-CD1 4.48Å; E933-L937 VanDerWaalsContact O-CG 3.32Å; E933-L937 WeakPolarHBondContact O-CG 3.44Å; E933-L937 PolarHBondContact O-N 3.33Å; D934-L937 PolarHBondContact O-N 3.21Å; L937-L941 WeakPolarHBondContact O-CB 3.32Å; L937-L941 PolarHBondContact O-N 3.4Å; L937-L955 HydrophobicContact CD2-CD1 4.39Å; L937-L955 HydrophobicContact CD2-CD2 4Å; L937-L955 HydrophobicContact CD2-CG 4.3Å; L937-I959 HydrophobicContact CD2-CD1 3.72Å; L937-L979 HydrophobicContact CD2-CD2 3.99Å; L937-R982 HydrophobicContact CD1-CB 4.49Å; L937-R982 HydrophobicContact CD1-CG 3.92Å; L937-L986 HydrophobicContact CB-CD1 4.46Å
938	I	91	Very high	85.2	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-66.5	-44.3	179.7	-71.9	-60.9	0	0	0	112.5	L903 I907 L917 I919 D934 R935 F936 L941 H942 L986 I987 I990	L903-I938 HydrophobicContact CD2-CD1 4.11Å; L903-I938 HydrophobicContact CD2-CG2 4.06Å; I907-I938 HydrophobicContact CD1-CG2 4.28Å; L917-I938 HydrophobicContact CD1-CG2 4.29Å; I919-I938 HydrophobicContact CD1-CG1 4.12Å; D934-I938 PolarHBondContact O-N 3.16Å; D934-I938 VanDerWaalsContact O-N 3.12Å; R935-I938 PolarHBondContact O-N 3.13Å; F936-I938 PolarHBondContact O-N 2.65Å; I938-L941 PolarHBondContact O-N 2.86Å; I938-H942 PolarHBondContact O-N 3.3Å; I938-H942 VanDerWaalsContact O-N 3.09Å; I938-L986 HydrophobicContact CD1-CB 3.67Å; I938-L986 HydrophobicContact CD1-CD1 4.22Å; I938-L986 HydrophobicContact CG1-CB 3.91Å; I938-L986 HydrophobicContact CG1-CD1 3.85Å; I938-I987 HydrophobicContact CD1-CG1 4.38Å; I938-I990 HydrophobicContact CD1-CD1 3.95Å; I938-I990 HydrophobicContact CG1-CD1 4.06Å; I938-I990 HydrophobicContact CG2-CD1 4.01Å
939	C	90.2	Very high	85.2	Confident	5 Å²	5	49.7 Å²	49.7	3%	0.034	24%	0.239	C	C	.	.	H	α-helix	trans	-68.3	-34.8	-180	-66.3	0	0	0	0	112.9	F914 R935 F936 K943	F914-C939 HydrophobicContact CD1-CB 3.71Å; F914-C939 HydrophobicContact CD2-CB 4.03Å; F914-C939 HydrophobicContact CE1-CB 3.42Å; F914-C939 VanDerWaalsContact CE1-CB 3.42Å; F914-C939 HydrophobicContact CE2-CB 3.76Å; F914-C939 HydrophobicContact CG-CB 4.01Å; F914-C939 HydrophobicContact CZ-CB 3.45Å; F914-C939 VanDerWaalsContact CZ-CB 3.45Å; R935-C939 WeakPolarHBondContact O-CB 3.34Å; R935-C939 PolarHBondContact O-N 2.7Å; R935-C939 PolarHBondContact O-SG 2.65Å; F936-C939 PolarHBondContact O-N 3.27Å; C939-K943 WeakPolarHBondContact O-CB 3.1Å; C939-K943 PolarHBondContact O-N 3.34Å; C939-K943 VanDerWaalsContact O-N 3.12Å
940	M	89.3	Confident	85.2	Confident	17 Å²	17	50.7 Å²	50.7	8%	0.084	25%	0.252	C	S	.	.	H	α-helix	trans	-75.8	-37.7	173.9	-74.9	-55.6	-53	0	0	112.9	F914 F936 H942 K943 L944 L955 C958	F914-M940 HydrophobicContact CE1-CG 4.06Å; F914-M940 HydrophobicContact CE1-SD 4.03Å; F914-M940 HydrophobicContact CZ-CG 4.29Å; F914-M940 HydrophobicContact CZ-SD 3.81Å; F936-M940 HydrophobicContact CD1-CG 3.99Å; F936-M940 HydrophobicContact CD2-CG 4Å; F936-M940 HydrophobicContact CE1-CB 4.43Å; F936-M940 HydrophobicContact CE1-CG 3.59Å; F936-M940 HydrophobicContact CE2-CG 3.61Å; F936-M940 HydrophobicContact CE2-SD 4.17Å; F936-M940 HydrophobicContact CG-CG 4.21Å; F936-M940 HydrophobicContact CZ-CG 3.41Å; F936-M940 VanDerWaalsContact CZ-CG 3.41Å; F936-M940 HydrophobicContact CZ-SD 4.17Å; F936-M940 WeakPolarHBondContact O-CB 3.2Å; F936-M940 WeakPolarHBondContact O-CG 3.35Å; F936-M940 PolarHBondContact O-N 3.15Å; M940-H942 VanDerWaalsContact C-N 3.26Å; M940-H942 PolarHBondContact O-N 2.83Å; M940-K943 HydrophobicContact CE-CD 4.39Å; M940-K943 PolarHBondContact O-N 2.61Å; M940-K943 HydrophobicContact SD-CD 4.28Å; M940-L944 HydrophobicContact CE-CD1 4.23Å; M940-L944 HydrophobicContact CE-CD2 4.39Å; M940-L944 HydrophobicContact CE-CG 4.1Å; M940-L944 WeakPolarHBondContact O-CB 3.39Å; M940-L944 VanDerWaalsContact O-CG 3.31Å; M940-L944 WeakPolarHBondContact O-CG 3.26Å; M940-L944 PolarHBondContact O-N 2.67Å; M940-L955 HydrophobicContact CB-CD1 3.42Å; M940-L955 VanDerWaalsContact CB-CD1 3.42Å; M940-L955 HydrophobicContact CG-CD1 4.4Å; M940-C958 HydrophobicContact CE-CB 3.89Å
941	L	89.8	Confident	85.2	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-60.5	-37.7	175.4	-175.9	67.4	0	0	0	111.7	L937 I938 G945 F946 V951 Y952 C983 I987	L937-L941 WeakPolarHBondContact O-CB 3.32Å; L937-L941 PolarHBondContact O-N 3.4Å; I938-L941 PolarHBondContact O-N 2.86Å; L941-G945 PolarHBondContact O-N 3.02Å; L941-F946 HydrophobicContact CD1-CD2 4.15Å; L941-F946 HydrophobicContact CD2-CD2 4.1Å; L941-F946 HydrophobicContact CG-CD2 4.21Å; L941-V951 HydrophobicContact CD1-CG1 3.72Å; L941-Y952 HydrophobicContact CD1-CE1 3.73Å; L941-C983 HydrophobicContact CD2-CB 3.84Å; L941-I987 HydrophobicContact CD2-CD1 3.95Å
942	H	89.1	Confident	85.4	Confident	65 Å²	65	45.1 Å²	45.1	30%	0.301	22%	0.22	S	C	.	.	H	α-helix	trans	-66.4	-50.5	171.1	-177.7	-108.3	0	0	0	112.1	D904 I907 I938 M940 L944 G945	D904-H942 IonicContact OD1-CD2 3.3Å; D904-H942 IonicContact OD1-CE1 3.8Å; D904-H942 IonicContact OD1-NE2 2.74Å; D904-H942 PolarHBondContact OD1-NE2 3.17Å; I907-H942 HydrophobicContact CD1-CB 3.31Å; I938-H942 PolarHBondContact O-N 3.3Å; I938-H942 VanDerWaalsContact O-N 3.09Å; M940-H942 VanDerWaalsContact C-N 3.26Å; M940-H942 PolarHBondContact O-N 2.83Å; H942-L944 VanDerWaalsContact C-N 3.33Å; H942-L944 PolarHBondContact O-N 3.02Å; H942-G945 PolarHBondContact O-N 3.12Å; H942-G945 VanDerWaalsContact O-N 3.1Å
943	K	86.9	Confident	85.6	Confident	158 Å²	158	42.6 Å²	42.6	69%	0.687	21%	0.21	S	C	*	.	H	α-helix	trans	-61.4	-35.7	-179.2	-175.2	178.9	177.4	-176.4	0	113.9	C939 M940	C939-K943 WeakPolarHBondContact O-CB 3.1Å; C939-K943 PolarHBondContact O-N 3.34Å; C939-K943 VanDerWaalsContact O-N 3.12Å; M940-K943 HydrophobicContact CE-CD 4.39Å; M940-K943 PolarHBondContact O-N 2.61Å; M940-K943 HydrophobicContact SD-CD 4.28Å
944	L	86	Confident	85.6	Confident	31 Å²	31	44 Å²	44	16%	0.162	22%	0.217	C	C	.	.	H	α-helix	trans	-79.9	-20.2	177.7	-66.7	170	0	0	0	112.7	M940 H942 K948 V951 E954 L955	M940-L944 HydrophobicContact CE-CD1 4.23Å; M940-L944 HydrophobicContact CE-CD2 4.39Å; M940-L944 HydrophobicContact CE-CG 4.1Å; M940-L944 WeakPolarHBondContact O-CB 3.39Å; M940-L944 VanDerWaalsContact O-CG 3.31Å; M940-L944 WeakPolarHBondContact O-CG 3.26Å; M940-L944 PolarHBondContact O-N 2.67Å; H942-L944 VanDerWaalsContact C-N 3.33Å; H942-L944 PolarHBondContact O-N 3.02Å; L944-K948 VanDerWaalsContact O-CE 3.22Å; L944-K948 WeakPolarHBondContact O-CE 3.49Å; L944-V951 HydrophobicContact CB-CG1 3.95Å; L944-E954 HydrophobicContact CD1-CB 4.03Å; L944-E954 HydrophobicContact CD2-CB 4.32Å; L944-L955 HydrophobicContact CD1-CB 4Å; L944-L955 HydrophobicContact CD1-CD1 4.41Å
945	G	81.9	Confident	85.6	Confident	24 Å²	24	44 Å²	44	25%	0.247	22%	0.217	C	C	.	.			trans	80.7	112.6	-177.5	0	0	0	0	0	112.5	L941 H942 D947 V951	L941-G945 PolarHBondContact O-N 3.02Å; H942-G945 PolarHBondContact O-N 3.12Å; H942-G945 VanDerWaalsContact O-N 3.1Å; G945-D947 PolarHBondContact O-N 3.24Å; G945-V951 WeakPolarHBondContact O-CG2 3.34Å
946	F	78.1	Confident	85.6	Confident	34 Å²	34	45.4 Å²	45.4	15%	0.149	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-16.7	-179	-175.4	-92.4	0	0	0	114.8	R896 I899 L941 Y952 I987	R896-F946 HydrophobicContact CG-CD1 4.47Å; R896-F946 HydrophobicContact CG-CE1 4.17Å; I899-F946 HydrophobicContact CB-CE1 4.29Å; I899-F946 HydrophobicContact CB-CZ 4.47Å; I899-F946 HydrophobicContact CD1-CE1 3.95Å; I899-F946 HydrophobicContact CD1-CE2 4.48Å; I899-F946 HydrophobicContact CD1-CZ 3.66Å; I899-F946 HydrophobicContact CG2-CD1 4.11Å; I899-F946 HydrophobicContact CG2-CD2 4.03Å; I899-F946 HydrophobicContact CG2-CE1 3.99Å; I899-F946 HydrophobicContact CG2-CE2 3.9Å; I899-F946 HydrophobicContact CG2-CG 4.14Å; I899-F946 HydrophobicContact CG2-CZ 3.89Å; L941-F946 HydrophobicContact CD1-CD2 4.15Å; L941-F946 HydrophobicContact CD2-CD2 4.1Å; L941-F946 HydrophobicContact CG-CD2 4.21Å; F946-Y952 WeakPolarHBondContact CE2-OH 3.31Å; F946-I987 HydrophobicContact CD2-CD1 4.24Å; F946-I987 HydrophobicContact CE2-CD1 3.68Å
947	D	69.1	Low	85.5	Confident	57 Å²	57	50.5 Å²	50.5	31%	0.305	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-16.6	-168.3	-55.3	-48.4	0	0	0	114.8	R896 K900 G945	R896-D947 PolarHBondContact NH1-O 2.88Å; K900-D947 WeakPolarHBondContact CD-OD2 3.42Å; K900-D947 WeakPolarHBondContact CE-OD2 3.35Å; K900-D947 IonicContact NZ-OD2 3.88Å; K900-D947 PolarHBondContact NZ-OD2 2.84Å; G945-D947 PolarHBondContact O-N 3.24Å
948	K	77.3	Confident	85.4	Confident	102 Å²	102	52.2 Å²	52.2	44%	0.443	26%	0.258	S	S	.	.	S	Bend	trans	-76.6	168.2	174.9	-34.7	176.1	-172.5	171.1	0	111.1	L944 V951 E954	L944-K948 VanDerWaalsContact O-CE 3.22Å; L944-K948 WeakPolarHBondContact O-CE 3.49Å; K948-V951 HydrophobicContact CB-CG2 3.6Å; K948-V951 HydrophobicContact CD-CG2 4.45Å; K948-V951 HydrophobicContact CG-CG2 4.09Å; K948-V951 VanDerWaalsContact O-CG2 3.3Å; K948-V951 WeakPolarHBondContact O-CG2 3.39Å; K948-E954 WeakPolarHBondContact CD-OE1 3.49Å; K948-E954 IonicContact NZ-OE1 2.68Å; K948-E954 PolarHBondContact NZ-OE1 3.46Å; K948-E954 IonicContact NZ-OE2 2.61Å; K948-E954 PolarHBondContact NZ-OE2 2.79Å
949	E	72.6	Confident	85.4	Confident	175 Å²	175	52.3 Å²	52.3	82%	0.818	26%	0.258	S	S	*	.	S	Bend	trans	-91.9	-26.4	175.2	-52.8	-160.4	138	0	0	112.7	R896 V951	R896-E949 IonicContact NH2-OE1 3.23Å; E949-V951 PolarHBondContact O-N 3.2Å
950	S	82.6	Confident	85.3	Confident	56 Å²	56	57.9 Å²	57.9	39%	0.392	28%	0.279	S	S	.	.	S	Bend	trans	-80	-6.1	-179.4	48	0	0	0	0	115.6	Y952 D953 E954	S950-Y952 VanDerWaalsContact C-N 3.25Å; S950-Y952 PolarHBondContact O-N 2.71Å; S950-D953 PolarHBondContact O-N 3.12Å; S950-E954 WeakPolarHBondContact CB-OE1 3.43Å; S950-E954 PolarHBondContact O-N 2.81Å; S950-E954 PolarHBondContact OG-OE1 2.66Å
951	V	86.4	Confident	85.2	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-55.6	-36.9	-163.8	-169.8	0	0	0	0	113.2	L941 L944 G945 K948 E949 E954 L955	L941-V951 HydrophobicContact CD1-CG1 3.72Å; L944-V951 HydrophobicContact CB-CG1 3.95Å; G945-V951 WeakPolarHBondContact O-CG2 3.34Å; K948-V951 HydrophobicContact CB-CG2 3.6Å; K948-V951 HydrophobicContact CD-CG2 4.45Å; K948-V951 HydrophobicContact CG-CG2 4.09Å; K948-V951 VanDerWaalsContact O-CG2 3.3Å; K948-V951 WeakPolarHBondContact O-CG2 3.39Å; E949-V951 PolarHBondContact O-N 3.2Å; V951-E954 PolarHBondContact O-N 2.92Å; V951-L955 WeakPolarHBondContact O-CB 3.25Å; V951-L955 PolarHBondContact O-N 2.91Å
952	Y	88.8	Confident	85.1	Confident	22 Å²	22	64.2 Å²	64.2	9%	0.086	31%	0.314	C	S	.	.	H	α-helix	trans	-77.1	-22.1	-176.2	-62.8	-75	0	0	0	113.7	L941 F946 S950 L955 R956 Q980 C983	L941-Y952 HydrophobicContact CD1-CE1 3.73Å; F946-Y952 WeakPolarHBondContact CE2-OH 3.31Å; S950-Y952 VanDerWaalsContact C-N 3.25Å; S950-Y952 PolarHBondContact O-N 2.71Å; Y952-L955 HydrophobicContact CD1-CD2 4.28Å; Y952-R956 WeakPolarHBondContact O-CB 3.23Å; Y952-R956 PolarHBondContact O-N 2.85Å; Y952-Q980 HydrophobicContact CD1-CB 3.73Å; Y952-Q980 HydrophobicContact CD1-CG 4.26Å; Y952-Q980 HydrophobicContact CD2-CB 4.12Å; Y952-Q980 HydrophobicContact CD2-CG 4.01Å; Y952-Q980 HydrophobicContact CE1-CB 3.92Å; Y952-Q980 HydrophobicContact CE1-CG 4.06Å; Y952-Q980 HydrophobicContact CE2-CB 4.31Å; Y952-Q980 HydrophobicContact CE2-CG 3.8Å; Y952-Q980 HydrophobicContact CG-CB 3.84Å; Y952-Q980 HydrophobicContact CG-CG 4.24Å; Y952-C983 HydrophobicContact CE1-CB 3.93Å
953	D	87.9	Confident	84.9	Confident	80 Å²	80	66.5 Å²	66.5	43%	0.428	34%	0.335	S	S	.	.	H	α-helix	trans	-86.2	-36.1	170.1	-78.2	-68.3	0	0	0	111.6	S950 L955 R956 Q957 A976	S950-D953 PolarHBondContact O-N 3.12Å; D953-L955 VanDerWaalsContact C-N 3.33Å; D953-L955 PolarHBondContact O-N 3.2Å; D953-R956 WeakPolarHBondContact O-CB 3.24Å; D953-R956 PolarHBondContact O-N 3.1Å; D953-Q957 WeakPolarHBondContact O-CG 3.42Å; D953-Q957 PolarHBondContact O-N 2.66Å; D953-A976 WeakPolarHBondContact OD1-CB 3.43Å; D953-A976 WeakPolarHBondContact OD2-CB 3.29Å
954	E	88.4	Confident	84.7	Confident	46 Å²	46	65 Å²	65	22%	0.215	33%	0.33	C	S	.	.	H	α-helix	trans	-57.8	-45.4	166.8	-71	174.6	-135.9	0	0	111.1	L944 K948 S950 V951 R956 Q957 C958	L944-E954 HydrophobicContact CD1-CB 4.03Å; L944-E954 HydrophobicContact CD2-CB 4.32Å; K948-E954 WeakPolarHBondContact CD-OE1 3.49Å; K948-E954 IonicContact NZ-OE1 2.68Å; K948-E954 PolarHBondContact NZ-OE1 3.46Å; K948-E954 IonicContact NZ-OE2 2.61Å; K948-E954 PolarHBondContact NZ-OE2 2.79Å; S950-E954 WeakPolarHBondContact CB-OE1 3.43Å; S950-E954 PolarHBondContact O-N 2.81Å; S950-E954 PolarHBondContact OG-OE1 2.66Å; V951-E954 PolarHBondContact O-N 2.92Å; E954-R956 VanDerWaalsContact C-N 3.33Å; E954-R956 PolarHBondContact O-N 3.33Å; E954-Q957 PolarHBondContact O-N 3.35Å; E954-C958 PolarHBondContact O-N 3.36Å; E954-C958 PolarHBondContact O-SG 2.87Å
955	L	90.4	Very high	84.8	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-60.9	-40.5	175.1	-179.6	62.3	0	0	0	111.7	L937 M940 L944 V951 Y952 D953 C958 I959	L937-L955 HydrophobicContact CD2-CD1 4.39Å; L937-L955 HydrophobicContact CD2-CD2 4Å; L937-L955 HydrophobicContact CD2-CG 4.3Å; M940-L955 HydrophobicContact CB-CD1 3.42Å; M940-L955 VanDerWaalsContact CB-CD1 3.42Å; M940-L955 HydrophobicContact CG-CD1 4.4Å; L944-L955 HydrophobicContact CD1-CB 4Å; L944-L955 HydrophobicContact CD1-CD1 4.41Å; V951-L955 WeakPolarHBondContact O-CB 3.25Å; V951-L955 PolarHBondContact O-N 2.91Å; Y952-L955 HydrophobicContact CD1-CD2 4.28Å; D953-L955 VanDerWaalsContact C-N 3.33Å; D953-L955 PolarHBondContact O-N 3.2Å; L955-C958 WeakPolarHBondContact O-CB 3.01Å; L955-C958 PolarHBondContact O-N 3.39Å; L955-I959 HydrophobicContact CG-CD1 4.29Å; L955-I959 VanDerWaalsContact O-CG1 3.31Å; L955-I959 WeakPolarHBondContact O-CG1 3.43Å; L955-I959 PolarHBondContact O-N 3.35Å
956	R	90.8	Very high	84.8	Confident	65 Å²	65	71.5 Å²	71.5	25%	0.245	35%	0.346	C	S	.	.	H	α-helix	trans	-65.8	-37.6	176.7	-169.3	-179	-174.3	-141.5	-0.6	112.4	Y952 D953 E954 R960 R974 L979	Y952-R956 WeakPolarHBondContact O-CB 3.23Å; Y952-R956 PolarHBondContact O-N 2.85Å; D953-R956 WeakPolarHBondContact O-CB 3.24Å; D953-R956 PolarHBondContact O-N 3.1Å; E954-R956 VanDerWaalsContact C-N 3.33Å; E954-R956 PolarHBondContact O-N 3.33Å; R956-R960 WeakPolarHBondContact O-CG 3.48Å; R956-R960 PolarHBondContact O-N 2.75Å; R956-R960 VanDerWaalsContact O-N 3.13Å; R956-R974 PolarHBondContact NE-O 3.32Å; R956-R974 PolarHBondContact NH2-O 2.64Å; R956-L979 HydrophobicContact CB-CD1 3.86Å; R956-L979 HydrophobicContact CG-CD1 4.1Å
957	Q	88.8	Confident	85.1	Confident	123 Å²	123	78.7 Å²	78.7	58%	0.575	38%	0.377	S	S	*	.	H	α-helix	trans	-66.4	-43.8	171	-67.7	177.9	17.2	0	0	111.1	D953 E954 I959 R960 N961	D953-Q957 WeakPolarHBondContact O-CG 3.42Å; D953-Q957 PolarHBondContact O-N 2.66Å; E954-Q957 PolarHBondContact O-N 3.35Å; Q957-I959 VanDerWaalsContact C-N 3.33Å; Q957-I959 PolarHBondContact O-N 3.07Å; Q957-R960 PolarHBondContact O-N 3.16Å; Q957-R960 VanDerWaalsContact O-N 3.11Å; Q957-N961 WeakPolarHBondContact O-CB 3.19Å; Q957-N961 VanDerWaalsContact O-CG 3.31Å; Q957-N961 PolarHBondContact O-N 2.69Å
958	C	88.7	Confident	85.8	Confident	37 Å²	37	77.7 Å²	77.7	25%	0.25	37%	0.372	C	S	.	.	H	α-helix	trans	-59.7	-40.5	176.3	-66.3	0	0	0	0	112.6	M940 E954 L955 S962	M940-C958 HydrophobicContact CE-CB 3.89Å; E954-C958 PolarHBondContact O-N 3.36Å; E954-C958 PolarHBondContact O-SG 2.87Å; L955-C958 WeakPolarHBondContact O-CB 3.01Å; L955-C958 PolarHBondContact O-N 3.39Å; C958-S962 VanDerWaalsContact O-CB 3.28Å; C958-S962 WeakPolarHBondContact O-CB 3.44Å; C958-S962 PolarHBondContact O-N 2.72Å
959	I	89.8	Confident	86	Confident	1 Å²	1	82.7 Å²	82.7	1%	0.005	39%	0.388	C	S	.	.	H	α-helix	trans	-60.6	-46.7	172.5	-73.3	163.4	0	0	0	111.2	F936 L937 L955 Q957 N961 S962 L971 K972 L979	F936-I959 HydrophobicContact CD1-CG1 4.32Å; F936-I959 HydrophobicContact CE1-CG1 3.87Å; L937-I959 HydrophobicContact CD2-CD1 3.72Å; L955-I959 HydrophobicContact CG-CD1 4.29Å; L955-I959 VanDerWaalsContact O-CG1 3.31Å; L955-I959 WeakPolarHBondContact O-CG1 3.43Å; L955-I959 PolarHBondContact O-N 3.35Å; Q957-I959 VanDerWaalsContact C-N 3.33Å; Q957-I959 PolarHBondContact O-N 3.07Å; I959-N961 VanDerWaalsContact C-N 3.33Å; I959-N961 PolarHBondContact O-N 3.33Å; I959-S962 PolarHBondContact O-N 3.25Å; I959-L971 HydrophobicContact CD1-CD2 4.24Å; I959-L971 HydrophobicContact CD1-CG 4.19Å; I959-L971 HydrophobicContact CG1-CD2 4.07Å; I959-L971 HydrophobicContact CG1-CG 4.46Å; I959-L971 HydrophobicContact CG2-CB 4.41Å; I959-L971 HydrophobicContact CG2-CD2 3.75Å; I959-L971 HydrophobicContact CG2-CG 3.79Å; I959-K972 HydrophobicContact CG2-CG 4.16Å; I959-L979 HydrophobicContact CD1-CD1 3.65Å; I959-L979 HydrophobicContact CD1-CD2 3.82Å; I959-L979 HydrophobicContact CD1-CG 4.39Å
960	R	88.1	Confident	86.7	Confident	123 Å²	123	77.8 Å²	77.8	46%	0.464	36%	0.364	S	S	.	.	H	α-helix	trans	-63.5	-39.4	-178.1	-77.2	171.6	167.8	-156.5	-9.9	112.6	R956 Q957 K972	R956-R960 WeakPolarHBondContact O-CG 3.48Å; R956-R960 PolarHBondContact O-N 2.75Å; R956-R960 VanDerWaalsContact O-N 3.13Å; Q957-R960 PolarHBondContact O-N 3.16Å; Q957-R960 VanDerWaalsContact O-N 3.11Å; R960-K972 HydrophobicContact CG-CG 4.44Å; R960-K972 VanDerWaalsContact O-CE 3.29Å; R960-K972 WeakPolarHBondContact O-CE 3.1Å; R960-K972 PolarHBondContact O-NZ 3.05Å
961	N	87.7	Confident	86.9	Confident	132 Å²	132	75.2 Å²	75.2	71%	0.706	35%	0.346	S	S	*	.	H	α-helix	trans	-86.7	-15.5	-176.1	-62.3	-1.6	0	0	0	113.3	Q957 I959 P963	Q957-N961 WeakPolarHBondContact O-CB 3.19Å; Q957-N961 VanDerWaalsContact O-CG 3.31Å; Q957-N961 PolarHBondContact O-N 2.69Å; I959-N961 VanDerWaalsContact C-N 3.33Å; I959-N961 PolarHBondContact O-N 3.33Å; N961-P963 WeakPolarHBondContact O-CD 3.48Å
962	S	86.9	Confident	86.9	Confident	17 Å²	17	77.1 Å²	77.1	12%	0.119	35%	0.354	C	S	.	.			trans	-69.9	123.3	-179.6	-176.1	0	0	0	0	111.8	C958 I959 Q964 F965	C958-S962 VanDerWaalsContact O-CB 3.28Å; C958-S962 WeakPolarHBondContact O-CB 3.44Å; C958-S962 PolarHBondContact O-N 2.72Å; I959-S962 PolarHBondContact O-N 3.25Å; S962-Q964 VanDerWaalsContact C-N 3.29Å; S962-Q964 PolarHBondContact O-N 2.68Å; S962-Q964 WeakPolarHBondContact OG-CG 3.38Å; S962-Q964 PolarHBondContact OG-NE2 3.15Å; S962-F965 PolarHBondContact O-N 3.14Å
963	P	84.9	Confident	86.8	Confident	113 Å²	113	78.2 Å²	78.2	73%	0.734	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-59.8	-33.6	-178.7	-26.6	35.6	0	0	0	114.4	N961 F965 R966	N961-P963 WeakPolarHBondContact O-CD 3.48Å; P963-F965 PolarHBondContact O-N 3.04Å; P963-R966 WeakPolarHBondContact O-CB 3.38Å; P963-R966 PolarHBondContact O-N 2.9Å
964	Q	83.6	Confident	86.9	Confident	126 Å²	126	77 Å²	77	59%	0.589	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-64.6	-27.1	-178	76.7	-151.9	10.3	0	0	112.9	S962	S962-Q964 VanDerWaalsContact C-N 3.29Å; S962-Q964 PolarHBondContact O-N 2.68Å; S962-Q964 WeakPolarHBondContact OG-CG 3.38Å; S962-Q964 PolarHBondContact OG-NE2 3.15Å
965	F	87.3	Confident	87	Confident	15 Å²	15	76.8 Å²	76.8	7%	0.066	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-97.4	21	175.1	-57	-57.1	0	0	0	111.9	E933 F936 S962 P963 F967 D968 L971 K972	E933-F965 HydrophobicContact CG-CE1 4.13Å; F936-F965 HydrophobicContact CB-CE2 4.05Å; F936-F965 HydrophobicContact CB-CZ 3.87Å; F936-F965 HydrophobicContact CD1-CD2 4.46Å; F936-F965 AromaticContact CD1-CE2 3.46Å; F936-F965 HydrophobicContact CD1-CE2 3.46Å; F936-F965 VanDerWaalsContact CD1-CE2 3.46Å; F936-F965 HydrophobicContact CD1-CZ 4.11Å; F936-F965 HydrophobicContact CD2-CE2 4.05Å; F936-F965 HydrophobicContact CE1-CD2 4.39Å; F936-F965 AromaticContact CE1-CE2 3.76Å; F936-F965 HydrophobicContact CE1-CE2 3.76Å; F936-F965 HydrophobicContact CE2-CE2 4.32Å; F936-F965 AromaticContact CG-CE2 3.58Å; F936-F965 HydrophobicContact CG-CE2 3.58Å; F936-F965 AromaticContact CG-CZ 3.95Å; F936-F965 HydrophobicContact CG-CZ 3.95Å; F936-F965 HydrophobicContact CZ-CE2 4.16Å; S962-F965 PolarHBondContact O-N 3.14Å; P963-F965 PolarHBondContact O-N 3.04Å; F965-F967 PolarHBondContact O-N 3.25Å; F965-F967 VanDerWaalsContact O-N 3.16Å; F965-D968 HydrophobicContact CB-CB 4.1Å; F965-D968 HydrophobicContact CD1-CB 4.16Å; F965-D968 PolarHBondContact O-N 3.31Å; F965-L971 HydrophobicContact CD1-CD2 3.97Å; F965-L971 HydrophobicContact CD2-CD2 3.96Å; F965-L971 HydrophobicContact CE1-CD2 3.93Å; F965-L971 HydrophobicContact CE2-CD2 3.91Å; F965-L971 HydrophobicContact CG-CD2 4.01Å; F965-L971 HydrophobicContact CZ-CD2 3.91Å; F965-K972 WeakPolarHBondContact O-CD 3.5Å; F965-K972 WeakPolarHBondContact O-CE 3.25Å; F965-K972 PolarHBondContact O-NZ 3.14Å; F965-K972 VanDerWaalsContact O-NZ 3.07Å
966	R	82.1	Confident	86.9	Confident	177 Å²	177	77.5 Å²	77.5	67%	0.668	36%	0.362	S	S	*	.	S	Bend	trans	-48.3	-48.1	-177.7	-178.2	172.2	179.1	102.8	-0.7	111.9	P963 K972	P963-R966 WeakPolarHBondContact O-CB 3.38Å; P963-R966 PolarHBondContact O-N 2.9Å; R966-K972 PolarHBondContact O-NZ 3.3Å
967	F	84.8	Confident	86.8	Confident	185 Å²	185	78.2 Å²	78.2	81%	0.811	37%	0.369	S	S	*	.	S	Bend	trans	-101.3	-3	-176.6	-54.6	-73	0	0	0	114.4	F965 W969	F965-F967 PolarHBondContact O-N 3.25Å; F965-F967 VanDerWaalsContact O-N 3.16Å; F967-W969 PolarHBondContact O-N 3.25Å
968	D	84.2	Confident	86.8	Confident	37 Å²	37	74.7 Å²	74.7	20%	0.198	35%	0.353	C	S	.	.			trans	-77.8	90	175.8	179.5	-0.1	0	0	0	110.5	F965 F970 L971 K972	F965-D968 HydrophobicContact CB-CB 4.1Å; F965-D968 HydrophobicContact CD1-CB 4.16Å; F965-D968 PolarHBondContact O-N 3.31Å; D968-F970 VanDerWaalsContact C-N 3.31Å; D968-F970 WeakPolarHBondContact OD1-CA 3.22Å; D968-F970 WeakPolarHBondContact OD1-CB 3.46Å; D968-F970 PolarHBondContact OD1-N 2.78Å; D968-L971 PolarHBondContact OD1-N 3.22Å; D968-L971 WeakPolarHBondContact OD2-CB 3.39Å; D968-K972 VanDerWaalsContact O-CB 3.3Å; D968-K972 WeakPolarHBondContact O-CB 3.14Å; D968-K972 VanDerWaalsContact O-CG 3.29Å; D968-K972 WeakPolarHBondContact O-CG 3.28Å; D968-K972 PolarHBondContact O-N 3.3Å
969	W	82.3	Confident	86.8	Confident	206 Å²	206	73 Å²	73	78%	0.78	34%	0.341	S	S	*	.	H	α-helix	trans	-73	-23.3	174.7	-162.4	-107.5	0	0	0	112.8	F967 S973	F967-W969 PolarHBondContact O-N 3.25Å; W969-S973 WeakPolarHBondContact O-CB 3.48Å; W969-S973 PolarHBondContact O-N 3.46Å; W969-S973 PolarHBondContact O-OG 3.08Å
970	F	86.9	Confident	86.8	Confident	73 Å²	73	76.6 Å²	76.6	32%	0.32	36%	0.358	S	S	.	.	H	α-helix	trans	-67.9	-50.5	-179.8	171.9	-97.7	0	0	0	110.8	N928 Y929 D968 S973 R974	N928-F970 HydrophobicContact CB-CZ 4.19Å; N928-F970 WeakPolarHBondContact O-CE1 3.46Å; N928-F970 WeakPolarHBondContact O-CZ 3.41Å; Y929-F970 HydrophobicContact CD1-CE1 4.01Å; Y929-F970 HydrophobicContact CD2-CE1 4.39Å; Y929-F970 AromaticContact CE1-CE1 3.88Å; Y929-F970 HydrophobicContact CE1-CE1 3.88Å; Y929-F970 HydrophobicContact CE1-CZ 4.49Å; Y929-F970 HydrophobicContact CE2-CE1 4.27Å; Y929-F970 HydrophobicContact CE2-CZ 4.19Å; Y929-F970 HydrophobicContact CG-CE1 4.27Å; D968-F970 VanDerWaalsContact C-N 3.31Å; D968-F970 WeakPolarHBondContact OD1-CA 3.22Å; D968-F970 WeakPolarHBondContact OD1-CB 3.46Å; D968-F970 PolarHBondContact OD1-N 2.78Å; F970-S973 PolarHBondContact O-OG 3.44Å; F970-R974 PolarHBondContact O-NE 3.38Å
971	L	87	Confident	86.8	Confident	2 Å²	2	78 Å²	78	1%	0.01	36%	0.364	C	S	.	.	H	α-helix	trans	-71.2	-40.6	178.2	-167.1	73.3	0	0	0	111.5	Y929 E933 I959 F965 D968 S973 R974 L979	Y929-L971 HydrophobicContact CD1-CD1 4.29Å; Y929-L971 HydrophobicContact CE1-CD1 3.91Å; E933-L971 HydrophobicContact CB-CD1 4.37Å; E933-L971 HydrophobicContact CB-CD2 4.47Å; E933-L971 HydrophobicContact CG-CD1 4.41Å; E933-L971 HydrophobicContact CG-CD2 4.21Å; I959-L971 HydrophobicContact CD1-CD2 4.24Å; I959-L971 HydrophobicContact CD1-CG 4.19Å; I959-L971 HydrophobicContact CG1-CD2 4.07Å; I959-L971 HydrophobicContact CG1-CG 4.46Å; I959-L971 HydrophobicContact CG2-CB 4.41Å; I959-L971 HydrophobicContact CG2-CD2 3.75Å; I959-L971 HydrophobicContact CG2-CG 3.79Å; F965-L971 HydrophobicContact CD1-CD2 3.97Å; F965-L971 HydrophobicContact CD2-CD2 3.96Å; F965-L971 HydrophobicContact CE1-CD2 3.93Å; F965-L971 HydrophobicContact CE2-CD2 3.91Å; F965-L971 HydrophobicContact CG-CD2 4.01Å; F965-L971 HydrophobicContact CZ-CD2 3.91Å; D968-L971 PolarHBondContact OD1-N 3.22Å; D968-L971 WeakPolarHBondContact OD2-CB 3.39Å; L971-S973 VanDerWaalsContact C-N 3.31Å; L971-S973 PolarHBondContact O-N 3.41Å; L971-R974 WeakPolarHBondContact O-CB 3.48Å; L971-R974 WeakPolarHBondContact O-CG 3.44Å; L971-R974 PolarHBondContact O-N 3.35Å; L971-L979 HydrophobicContact CD1-CD2 4.2Å
972	K	86.3	Confident	86.8	Confident	39 Å²	39	73.4 Å²	73.4	17%	0.17	34%	0.336	C	S	.	.	H	α-helix	trans	-65.6	-27.1	178.6	-78.3	179.6	166.7	177.8	0	114.9	I959 R960 F965 R966 D968	I959-K972 HydrophobicContact CG2-CG 4.16Å; R960-K972 HydrophobicContact CG-CG 4.44Å; R960-K972 VanDerWaalsContact O-CE 3.29Å; R960-K972 WeakPolarHBondContact O-CE 3.1Å; R960-K972 PolarHBondContact O-NZ 3.05Å; F965-K972 WeakPolarHBondContact O-CD 3.5Å; F965-K972 WeakPolarHBondContact O-CE 3.25Å; F965-K972 PolarHBondContact O-NZ 3.14Å; F965-K972 VanDerWaalsContact O-NZ 3.07Å; R966-K972 PolarHBondContact O-NZ 3.3Å; D968-K972 VanDerWaalsContact O-CB 3.3Å; D968-K972 WeakPolarHBondContact O-CB 3.14Å; D968-K972 VanDerWaalsContact O-CG 3.29Å; D968-K972 WeakPolarHBondContact O-CG 3.28Å; D968-K972 PolarHBondContact O-N 3.3Å
973	S	86.5	Confident	86.9	Confident	45 Å²	45	72.6 Å²	72.6	32%	0.315	33%	0.33	S	S	.	.	H	α-helix	trans	-79.6	-14.9	176.9	56.9	0	0	0	0	113.9	W969 F970 L971	W969-S973 WeakPolarHBondContact O-CB 3.48Å; W969-S973 PolarHBondContact O-N 3.46Å; W969-S973 PolarHBondContact O-OG 3.08Å; F970-S973 PolarHBondContact O-OG 3.44Å; L971-S973 VanDerWaalsContact C-N 3.31Å; L971-S973 PolarHBondContact O-N 3.41Å
974	R	89.8	Confident	87.1	Confident	55 Å²	55	70.2 Å²	70.2	21%	0.208	31%	0.312	C	S	.	.			trans	-59.1	148.8	-179.2	-60.9	-53.8	91.1	-143.6	8.5	112.4	R956 F970 L971 E978 L979	R956-R974 PolarHBondContact NE-O 3.32Å; R956-R974 PolarHBondContact NH2-O 2.64Å; F970-R974 PolarHBondContact O-NE 3.38Å; L971-R974 WeakPolarHBondContact O-CB 3.48Å; L971-R974 WeakPolarHBondContact O-CG 3.44Å; L971-R974 PolarHBondContact O-N 3.35Å; R974-E978 WeakPolarHBondContact CA-OE2 3.13Å; R974-E978 HydrophobicContact CB-CB 4.4Å; R974-E978 WeakPolarHBondContact CD-OE2 3.47Å; R974-E978 IonicContact CZ-OE2 3.99Å; R974-E978 IonicContact NE-OE2 3.87Å; R974-E978 IonicContact NH1-OE2 3.63Å; R974-E978 PolarHBondContact NH1-OE2 3.3Å; R974-L979 HydrophobicContact CB-CD2 3.72Å; R974-L979 HydrophobicContact CB-CG 3.87Å; R974-L979 HydrophobicContact CG-CD2 3.98Å
975	T	91.3	Very high	87.3	Confident	42 Å²	42	67.7 Å²	67.7	26%	0.258	31%	0.305	S	S	.	.			trans	-87	156.4	168	63.3	0	0	0	0	111.2	M977 E978 L979	T975-M977 PolarHBondContact O-N 3.36Å; T975-E978 PolarHBondContact N-OE2 3.25Å; T975-E978 VanDerWaalsContact N-OE2 3.16Å; T975-E978 WeakPolarHBondContact O-CB 2.94Å; T975-E978 PolarHBondContact O-N 3.45Å; T975-E978 WeakPolarHBondContact OG1-CG 3.43Å; T975-E978 PolarHBondContact OG1-N 3.08Å; T975-E978 PolarHBondContact OG1-OE1 3.13Å; T975-L979 PolarHBondContact O-N 2.87Å
976	A	88.4	Confident	87.3	Confident	14 Å²	14	67 Å²	67	12%	0.116	30%	0.302	C	S	.	.	H	α-helix	trans	-55.7	-37.8	177.7	0	0	0	0	0	112.5	D953 E978 L979 Q980	D953-A976 WeakPolarHBondContact OD1-CB 3.43Å; D953-A976 WeakPolarHBondContact OD2-CB 3.29Å; A976-E978 PolarHBondContact O-N 3.15Å; A976-L979 PolarHBondContact O-N 3.46Å; A976-Q980 VanDerWaalsContact O-CB 3.28Å; A976-Q980 WeakPolarHBondContact O-CB 3.48Å; A976-Q980 PolarHBondContact O-N 3.42Å
977	M	87.8	Confident	87.6	Confident	80 Å²	80	58.6 Å²	58.6	39%	0.394	27%	0.27	S	S	.	.	H	α-helix	trans	-65.1	-33.3	174.2	-173.6	-176.5	62.7	0	0	113.3	T975 R981	T975-M977 PolarHBondContact O-N 3.36Å; M977-R981 VanDerWaalsContact O-CG 3.25Å; M977-R981 WeakPolarHBondContact O-CG 3.39Å; M977-R981 PolarHBondContact O-N 3.12Å
978	E	87.7	Confident	87.8	Confident	50 Å²	50	53 Å²	53	23%	0.234	25%	0.252	C	S	.	.	H	α-helix	trans	-72.1	-42.6	174.6	-74.2	153.8	-146.4	0	0	111.6	R974 T975 A976 Q980 R981 R982	R974-E978 WeakPolarHBondContact CA-OE2 3.13Å; R974-E978 HydrophobicContact CB-CB 4.4Å; R974-E978 WeakPolarHBondContact CD-OE2 3.47Å; R974-E978 IonicContact CZ-OE2 3.99Å; R974-E978 IonicContact NE-OE2 3.87Å; R974-E978 IonicContact NH1-OE2 3.63Å; R974-E978 PolarHBondContact NH1-OE2 3.3Å; T975-E978 PolarHBondContact N-OE2 3.25Å; T975-E978 VanDerWaalsContact N-OE2 3.16Å; T975-E978 WeakPolarHBondContact O-CB 2.94Å; T975-E978 PolarHBondContact O-N 3.45Å; T975-E978 WeakPolarHBondContact OG1-CG 3.43Å; T975-E978 PolarHBondContact OG1-N 3.08Å; T975-E978 PolarHBondContact OG1-OE1 3.13Å; A976-E978 PolarHBondContact O-N 3.15Å; E978-Q980 VanDerWaalsContact C-N 3.32Å; E978-Q980 PolarHBondContact O-N 3.05Å; E978-R981 PolarHBondContact O-N 3.41Å; E978-R982 PolarHBondContact O-N 3.5Å
979	L	88.9	Confident	87.9	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-60.8	-42.4	173.4	-63.2	175	0	0	0	110.8	L937 R956 I959 L971 R974 T975 A976 R982 C983	L937-L979 HydrophobicContact CD2-CD2 3.99Å; R956-L979 HydrophobicContact CB-CD1 3.86Å; R956-L979 HydrophobicContact CG-CD1 4.1Å; I959-L979 HydrophobicContact CD1-CD1 3.65Å; I959-L979 HydrophobicContact CD1-CD2 3.82Å; I959-L979 HydrophobicContact CD1-CG 4.39Å; L971-L979 HydrophobicContact CD1-CD2 4.2Å; R974-L979 HydrophobicContact CB-CD2 3.72Å; R974-L979 HydrophobicContact CB-CG 3.87Å; R974-L979 HydrophobicContact CG-CD2 3.98Å; T975-L979 PolarHBondContact O-N 2.87Å; A976-L979 PolarHBondContact O-N 3.46Å; L979-R982 PolarHBondContact O-N 2.64Å; L979-C983 WeakPolarHBondContact O-CB 3.46Å; L979-C983 PolarHBondContact O-N 3.01Å; L979-C983 PolarHBondContact O-SG 3.26Å
980	Q	89.4	Confident	88.2	Confident	77 Å²	77	43 Å²	43	36%	0.36	21%	0.213	S	C	.	.	H	α-helix	trans	-60	-46.4	174.1	-175.4	-176.6	41.6	0	0	112.2	Y952 A976 E978 R982 C983 N984	Y952-Q980 HydrophobicContact CD1-CB 3.73Å; Y952-Q980 HydrophobicContact CD1-CG 4.26Å; Y952-Q980 HydrophobicContact CD2-CB 4.12Å; Y952-Q980 HydrophobicContact CD2-CG 4.01Å; Y952-Q980 HydrophobicContact CE1-CB 3.92Å; Y952-Q980 HydrophobicContact CE1-CG 4.06Å; Y952-Q980 HydrophobicContact CE2-CB 4.31Å; Y952-Q980 HydrophobicContact CE2-CG 3.8Å; Y952-Q980 HydrophobicContact CG-CB 3.84Å; Y952-Q980 HydrophobicContact CG-CG 4.24Å; A976-Q980 VanDerWaalsContact O-CB 3.28Å; A976-Q980 WeakPolarHBondContact O-CB 3.48Å; A976-Q980 PolarHBondContact O-N 3.42Å; E978-Q980 VanDerWaalsContact C-N 3.32Å; E978-Q980 PolarHBondContact O-N 3.05Å; Q980-R982 VanDerWaalsContact C-N 3.32Å; Q980-R982 PolarHBondContact O-N 2.78Å; Q980-C983 PolarHBondContact O-N 2.92Å; Q980-N984 WeakPolarHBondContact O-CB 3.45Å; Q980-N984 VanDerWaalsContact O-CG 3.24Å; Q980-N984 PolarHBondContact O-N 2.94Å; Q980-N984 PolarHBondContact O-ND2 3.27Å
981	R	88.3	Confident	88.1	Confident	154 Å²	154	40.5 Å²	40.5	58%	0.581	20%	0.202	S	C	*	.	H	α-helix	trans	-60.2	-39.7	174.8	-73.4	169.7	-173.8	-161.2	1.2	112	M977 E978 T985	M977-R981 VanDerWaalsContact O-CG 3.25Å; M977-R981 WeakPolarHBondContact O-CG 3.39Å; M977-R981 PolarHBondContact O-N 3.12Å; E978-R981 PolarHBondContact O-N 3.41Å; R981-T985 PolarHBondContact O-N 2.97Å; R981-T985 PolarHBondContact O-OG1 3.24Å
982	R	89.2	Confident	88.1	Confident	34 Å²	34	47.2 Å²	47.2	13%	0.128	23%	0.228	C	C	.	.	H	α-helix	trans	-67.3	-50.7	175.6	-173.4	58.9	178.6	-176.9	0.2	111.2	Y929 D934 L937 E978 L979 Q980 N984 T985 L986	Y929-R982 HydrophobicContact CD1-CG 4.2Å; Y929-R982 HydrophobicContact CD2-CG 4.26Å; Y929-R982 HydrophobicContact CE1-CB 4.48Å; Y929-R982 HydrophobicContact CE1-CG 3.99Å; Y929-R982 HydrophobicContact CE2-CB 4.41Å; Y929-R982 HydrophobicContact CE2-CG 4.05Å; Y929-R982 HydrophobicContact CG-CG 4.34Å; D934-R982 VanDerWaalsContact CG-NH2 3.32Å; D934-R982 IonicContact OD1-CZ 2.81Å; D934-R982 IonicContact OD1-NE 3.27Å; D934-R982 PolarHBondContact OD1-NE 3.39Å; D934-R982 IonicContact OD1-NH2 2.83Å; D934-R982 PolarHBondContact OD1-NH2 3.07Å; D934-R982 IonicContact OD2-CZ 2.72Å; D934-R982 IonicContact OD2-NE 3.43Å; D934-R982 IonicContact OD2-NH2 3.76Å; D934-R982 PolarHBondContact OD2-NH2 3.24Å; L937-R982 HydrophobicContact CD1-CB 4.49Å; L937-R982 HydrophobicContact CD1-CG 3.92Å; E978-R982 PolarHBondContact O-N 3.5Å; L979-R982 PolarHBondContact O-N 2.64Å; Q980-R982 VanDerWaalsContact C-N 3.32Å; Q980-R982 PolarHBondContact O-N 2.78Å; R982-N984 VanDerWaalsContact C-N 3.34Å; R982-N984 PolarHBondContact O-N 2.76Å; R982-T985 WeakPolarHBondContact O-CA 3.2Å; R982-T985 VanDerWaalsContact O-CB 3.31Å; R982-T985 WeakPolarHBondContact O-CB 3.12Å; R982-T985 PolarHBondContact O-N 3.13Å; R982-L986 HydrophobicContact CG-CD1 4.29Å; R982-L986 WeakPolarHBondContact O-CG 3.26Å; R982-L986 PolarHBondContact O-N 3.04Å
983	C	88.9	Confident	88	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-54.8	-46.6	177.5	-68.8	0	0	0	0	112.3	L941 Y952 L979 Q980 T985 L986 I987	L941-C983 HydrophobicContact CD2-CB 3.84Å; Y952-C983 HydrophobicContact CE1-CB 3.93Å; L979-C983 WeakPolarHBondContact O-CB 3.46Å; L979-C983 PolarHBondContact O-N 3.01Å; L979-C983 PolarHBondContact O-SG 3.26Å; Q980-C983 PolarHBondContact O-N 2.92Å; C983-T985 PolarHBondContact O-N 3.11Å; C983-L986 PolarHBondContact O-N 2.93Å; C983-L986 VanDerWaalsContact O-N 3.15Å; C983-I987 WeakPolarHBondContact O-CB 3.29Å; C983-I987 VanDerWaalsContact O-CG1 3.28Å; C983-I987 WeakPolarHBondContact O-CG1 3.35Å; C983-I987 PolarHBondContact O-N 3.23Å
984	N	88.8	Confident	88	Confident	64 Å²	64	45.4 Å²	45.4	34%	0.342	22%	0.215	S	C	.	.	H	α-helix	trans	-60.3	-33.5	176.6	-73.5	-14.1	0	0	0	112.7	Q980 R982 T988	Q980-N984 WeakPolarHBondContact O-CB 3.45Å; Q980-N984 VanDerWaalsContact O-CG 3.24Å; Q980-N984 PolarHBondContact O-N 2.94Å; Q980-N984 PolarHBondContact O-ND2 3.27Å; R982-N984 VanDerWaalsContact C-N 3.34Å; R982-N984 PolarHBondContact O-N 2.76Å; N984-T988 PolarHBondContact O-N 3.02Å; N984-T988 VanDerWaalsContact O-N 3.12Å; N984-T988 PolarHBondContact O-OG1 3.08Å; N984-T988 VanDerWaalsContact O-OG1 3.06Å
985	T	87.6	Confident	87.6	Confident	72 Å²	72	48.3 Å²	48.3	44%	0.442	23%	0.232	S	C	.	.	H	α-helix	trans	-69.5	-45	175.2	-56.1	0	0	0	0	111	R981 R982 C983 T988 L989	R981-T985 PolarHBondContact O-N 2.97Å; R981-T985 PolarHBondContact O-OG1 3.24Å; R982-T985 WeakPolarHBondContact O-CA 3.2Å; R982-T985 VanDerWaalsContact O-CB 3.31Å; R982-T985 WeakPolarHBondContact O-CB 3.12Å; R982-T985 PolarHBondContact O-N 3.13Å; C983-T985 PolarHBondContact O-N 3.11Å; T985-T988 PolarHBondContact O-N 2.91Å; T985-L989 WeakPolarHBondContact O-CG 3.47Å; T985-L989 PolarHBondContact O-N 3.34Å; T985-L989 VanDerWaalsContact O-N 3.13Å
986	L	87.7	Confident	87.2	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-64.7	-38.7	177	-59.5	174.3	0	0	0	111.8	I919 Y921 D934 L937 I938 R982 C983 L989 I990	I919-L986 HydrophobicContact CD1-CB 4.47Å; I919-L986 HydrophobicContact CD1-CD1 4.49Å; I919-L986 HydrophobicContact CD1-CD2 4Å; Y921-L986 HydrophobicContact CE1-CD2 4Å; D934-L986 HydrophobicContact CB-CD1 3.81Å; D934-L986 HydrophobicContact CB-CD2 3.98Å; D934-L986 WeakPolarHBondContact OD1-CD1 3.38Å; L937-L986 HydrophobicContact CB-CD1 4.46Å; I938-L986 HydrophobicContact CD1-CB 3.67Å; I938-L986 HydrophobicContact CD1-CD1 4.22Å; I938-L986 HydrophobicContact CG1-CB 3.91Å; I938-L986 HydrophobicContact CG1-CD1 3.85Å; R982-L986 HydrophobicContact CG-CD1 4.29Å; R982-L986 WeakPolarHBondContact O-CG 3.26Å; R982-L986 PolarHBondContact O-N 3.04Å; C983-L986 PolarHBondContact O-N 2.93Å; C983-L986 VanDerWaalsContact O-N 3.15Å; L986-L989 PolarHBondContact O-N 2.86Å; L986-I990 VanDerWaalsContact O-CG1 3.3Å; L986-I990 WeakPolarHBondContact O-CG1 3.18Å; L986-I990 PolarHBondContact O-N 3.01Å
987	I	88.6	Confident	86.8	Confident	2 Å²	2	53 Å²	53	1%	0.01	25%	0.251	C	S	.	.	H	α-helix	trans	-59	-49.7	173	-73	161.8	0	0	0	110.6	I899 L903 I938 L941 F946 C983 L989 I990 E991	I899-I987 HydrophobicContact CB-CG2 4.4Å; I899-I987 HydrophobicContact CD1-CG2 4.2Å; I899-I987 HydrophobicContact CG1-CG2 3.83Å; I899-I987 HydrophobicContact CG2-CD1 3.82Å; I899-I987 HydrophobicContact CG2-CG1 4.23Å; I899-I987 HydrophobicContact CG2-CG2 3.92Å; L903-I987 HydrophobicContact CD2-CG1 4.3Å; I938-I987 HydrophobicContact CD1-CG1 4.38Å; L941-I987 HydrophobicContact CD2-CD1 3.95Å; F946-I987 HydrophobicContact CD2-CD1 4.24Å; F946-I987 HydrophobicContact CE2-CD1 3.68Å; C983-I987 WeakPolarHBondContact O-CB 3.29Å; C983-I987 VanDerWaalsContact O-CG1 3.28Å; C983-I987 WeakPolarHBondContact O-CG1 3.35Å; C983-I987 PolarHBondContact O-N 3.23Å; I987-L989 VanDerWaalsContact C-N 3.28Å; I987-L989 PolarHBondContact O-N 2.6Å; I987-I990 CarbonylContact O-C 3.58Å; I987-I990 WeakPolarHBondContact O-CB 3.29Å; I987-I990 PolarHBondContact O-N 3.5Å; I987-E991 HydrophobicContact CG2-CG 4.34Å; I987-E991 WeakPolarHBondContact O-CG 3.09Å; I987-E991 PolarHBondContact O-N 2.67Å
988	T	88.1	Confident	86.4	Confident	68 Å²	68	54 Å²	54	42%	0.417	26%	0.255	S	S	.	.	H	α-helix	trans	-61.3	-34.4	178.5	-60.1	0	0	0	0	112.7	N984 T985 R992	N984-T988 PolarHBondContact O-N 3.02Å; N984-T988 VanDerWaalsContact O-N 3.12Å; N984-T988 PolarHBondContact O-OG1 3.08Å; N984-T988 VanDerWaalsContact O-OG1 3.06Å; T985-T988 PolarHBondContact O-N 2.91Å; T988-R992 WeakPolarHBondContact O-CB 3.49Å; T988-R992 PolarHBondContact O-N 3.4Å; T988-R992 VanDerWaalsContact O-N 3.11Å
989	L	87.1	Confident	86.2	Confident	31 Å²	31	58 Å²	58	16%	0.162	27%	0.273	C	S	.	.	H	α-helix	trans	-67.3	-42.4	172.6	-67.7	171	0	0	0	111.7	I919 Y921 T985 L986 I987 R992 E993	I919-L989 HydrophobicContact CG2-CB 4.19Å; I919-L989 HydrophobicContact CG2-CD1 4.22Å; Y921-L989 HydrophobicContact CD1-CD1 3.97Å; T985-L989 WeakPolarHBondContact O-CG 3.47Å; T985-L989 PolarHBondContact O-N 3.34Å; T985-L989 VanDerWaalsContact O-N 3.13Å; L986-L989 PolarHBondContact O-N 2.86Å; I987-L989 VanDerWaalsContact C-N 3.28Å; I987-L989 PolarHBondContact O-N 2.6Å; L989-R992 PolarHBondContact O-N 3.46Å; L989-E993 WeakPolarHBondContact O-CB 3.44Å; L989-E993 PolarHBondContact O-N 3.45Å
990	I	87.3	Confident	85.7	Confident	1 Å²	1	65.7 Å²	65.7	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-65.4	-41.6	176.7	-72.3	164.2	0	0	0	111.6	L903 K906 I938 L986 I987 E993 N994	L903-I990 HydrophobicContact CD2-CD1 4.24Å; K906-I990 HydrophobicContact CB-CG2 3.6Å; K906-I990 HydrophobicContact CD-CG1 4.24Å; K906-I990 HydrophobicContact CD-CG2 4.21Å; K906-I990 HydrophobicContact CG-CD1 4.12Å; K906-I990 HydrophobicContact CG-CG1 4.03Å; K906-I990 HydrophobicContact CG-CG2 3.8Å; I938-I990 HydrophobicContact CD1-CD1 3.95Å; I938-I990 HydrophobicContact CG1-CD1 4.06Å; I938-I990 HydrophobicContact CG2-CD1 4.01Å; L986-I990 VanDerWaalsContact O-CG1 3.3Å; L986-I990 WeakPolarHBondContact O-CG1 3.18Å; L986-I990 PolarHBondContact O-N 3.01Å; I987-I990 CarbonylContact O-C 3.58Å; I987-I990 WeakPolarHBondContact O-CB 3.29Å; I987-I990 PolarHBondContact O-N 3.5Å; I990-E993 PolarHBondContact O-N 3.22Å; I990-N994 VanDerWaalsContact O-CB 3.31Å; I990-N994 WeakPolarHBondContact O-CB 3.39Å; I990-N994 PolarHBondContact O-N 2.54Å; I990-N994 PolarHBondContact O-ND2 2.92Å; I990-N994 PolarHBondContact O-OD1 3.26Å
991	E	86.7	Confident	85.2	Confident	20 Å²	20	67.3 Å²	67.3	9%	0.093	31%	0.31	C	S	.	.	H	α-helix	trans	-62.5	-41.9	175.3	-73.3	-175.6	128.3	0	0	111.7	R895 S898 A902 I987 N994 M995	R895-E991 IonicContact CZ-OE1 2.7Å; R895-E991 IonicContact CZ-OE2 2.88Å; R895-E991 VanDerWaalsContact NH1-CD 3.27Å; R895-E991 IonicContact NH1-OE1 2.69Å; R895-E991 PolarHBondContact NH1-OE1 2.93Å; R895-E991 IonicContact NH1-OE2 3.88Å; R895-E991 PolarHBondContact NH1-OE2 3.38Å; R895-E991 IonicContact NH2-OE1 3.87Å; R895-E991 IonicContact NH2-OE2 3.34Å; R895-E991 PolarHBondContact NH2-OE2 3.4Å; S898-E991 PolarHBondContact OG-OE1 3.03Å; A902-E991 HydrophobicContact CB-CG 3.78Å; I987-E991 HydrophobicContact CG2-CG 4.34Å; I987-E991 WeakPolarHBondContact O-CG 3.09Å; I987-E991 PolarHBondContact O-N 2.67Å; E991-N994 PolarHBondContact O-N 3.48Å; E991-M995 HydrophobicContact CB-CE 4.29Å; E991-M995 VanDerWaalsContact O-CE 3.32Å; E991-M995 WeakPolarHBondContact O-CE 3.35Å; E991-M995 WeakPolarHBondContact O-CG 3.48Å; E991-M995 PolarHBondContact O-N 3.14Å
992	R	85.6	Confident	84.6	Confident	144 Å²	144	65.4 Å²	65.4	54%	0.543	31%	0.306	S	S	.	.	H	α-helix	trans	-63.4	-48.8	174	-173.1	-178.2	-61.6	179	0.5	112	T988 L989 N994 M995 E996	T988-R992 WeakPolarHBondContact O-CB 3.49Å; T988-R992 PolarHBondContact O-N 3.4Å; T988-R992 VanDerWaalsContact O-N 3.11Å; L989-R992 PolarHBondContact O-N 3.46Å; R992-N994 VanDerWaalsContact C-N 3.27Å; R992-N994 PolarHBondContact O-N 3.21Å; R992-M995 PolarHBondContact O-N 3Å; R992-M995 VanDerWaalsContact O-N 3.15Å; R992-E996 HydrophobicContact CG-CG 4.49Å; R992-E996 WeakPolarHBondContact CG-OE1 3.4Å; R992-E996 WeakPolarHBondContact O-CG 3.36Å; R992-E996 PolarHBondContact O-N 3.39Å
993	E	85.2	Confident	84	Confident	31 Å²	31	66.1 Å²	66.1	15%	0.145	32%	0.319	C	S	.	.	H	α-helix	trans	-58.4	-40.6	177.4	-169.4	-164.1	121.5	0	0	111.4	K906 R909 L989 I990 L997	K906-E993 IonicContact NZ-OE1 3.79Å; K906-E993 PolarHBondContact NZ-OE1 3.43Å; K906-E993 IonicContact NZ-OE2 3.57Å; K906-E993 PolarHBondContact NZ-OE2 3.38Å; R909-E993 IonicContact NH1-OE1 2.75Å; R909-E993 PolarHBondContact NH1-OE1 3.3Å; L989-E993 WeakPolarHBondContact O-CB 3.44Å; L989-E993 PolarHBondContact O-N 3.45Å; I990-E993 PolarHBondContact O-N 3.22Å; E993-L997 HydrophobicContact CG-CD1 4.08Å; E993-L997 WeakPolarHBondContact O-CB 3.45Å; E993-L997 WeakPolarHBondContact O-CD1 3.5Å; E993-L997 VanDerWaalsContact O-CG 3.23Å; E993-L997 WeakPolarHBondContact O-CG 3.38Å; E993-L997 PolarHBondContact O-N 3.25Å
994	N	85.1	Confident	83.1	Confident	14 Å²	14	71.2 Å²	71.2	8%	0.075	34%	0.343	C	S	.	.	H	α-helix	trans	-64.6	-42.1	176.1	-70.1	-12.5	0	0	0	112.1	A902 R909 I990 E991 R992 L997 E998	A902-N994 WeakPolarHBondContact CA-ND2 3.46Å; A902-N994 PolarHBondContact O-ND2 3.25Å; R909-N994 VanDerWaalsContact CZ-OD1 3.25Å; R909-N994 PolarHBondContact NH1-OD1 3.41Å; R909-N994 PolarHBondContact NH2-OD1 3.1Å; I990-N994 VanDerWaalsContact O-CB 3.31Å; I990-N994 WeakPolarHBondContact O-CB 3.39Å; I990-N994 PolarHBondContact O-N 2.54Å; I990-N994 PolarHBondContact O-ND2 2.92Å; I990-N994 PolarHBondContact O-OD1 3.26Å; E991-N994 PolarHBondContact O-N 3.48Å; R992-N994 VanDerWaalsContact C-N 3.27Å; R992-N994 PolarHBondContact O-N 3.21Å; N994-L997 PolarHBondContact O-N 3.1Å; N994-E998 WeakPolarHBondContact O-CB 3.41Å; N994-E998 PolarHBondContact O-N 2.87Å
995	M	82.7	Confident	82.1	Confident	117 Å²	117	74.9 Å²	74.9	58%	0.576	36%	0.355	S	S	*	.	H	α-helix	trans	-65.3	-46.6	175.2	-75.7	-177.3	-83.4	0	0	112	E991 R992 L997 E998 E999	E991-M995 HydrophobicContact CB-CE 4.29Å; E991-M995 VanDerWaalsContact O-CE 3.32Å; E991-M995 WeakPolarHBondContact O-CE 3.35Å; E991-M995 WeakPolarHBondContact O-CG 3.48Å; E991-M995 PolarHBondContact O-N 3.14Å; R992-M995 PolarHBondContact O-N 3Å; R992-M995 VanDerWaalsContact O-N 3.15Å; M995-L997 VanDerWaalsContact C-N 3.28Å; M995-L997 PolarHBondContact O-N 3.24Å; M995-E998 PolarHBondContact O-N 3.15Å; M995-E999 WeakPolarHBondContact O-CG 3.49Å; M995-E999 PolarHBondContact O-N 2.99Å
996	E	83.1	Confident	81.2	Confident	86 Å²	86	80.2 Å²	80.2	40%	0.402	37%	0.373	S	S	.	.	H	α-helix	trans	-59	-38	176.1	-72.7	179	-149.1	0	0	112.2	R992 R1000	R992-E996 HydrophobicContact CG-CG 4.49Å; R992-E996 WeakPolarHBondContact CG-OE1 3.4Å; R992-E996 WeakPolarHBondContact O-CG 3.36Å; R992-E996 PolarHBondContact O-N 3.39Å; E996-R1000 WeakPolarHBondContact O-CB 3.29Å; E996-R1000 VanDerWaalsContact O-CG 3.24Å; E996-R1000 WeakPolarHBondContact O-CG 3.21Å; E996-R1000 PolarHBondContact O-N 3.39Å
997	L	78.9	Confident	80.1	Confident	68 Å²	68	89.1 Å²	89.1	36%	0.356	41%	0.411	S	S	.	.	H	α-helix	trans	-72.4	-41.3	176.1	-72.7	168.6	0	0	0	112.4	R909 E993 N994 M995 E999 R1000 E1001	R909-L997 VanDerWaalsContact NH1-CD1 3.34Å; E993-L997 HydrophobicContact CG-CD1 4.08Å; E993-L997 WeakPolarHBondContact O-CB 3.45Å; E993-L997 WeakPolarHBondContact O-CD1 3.5Å; E993-L997 VanDerWaalsContact O-CG 3.23Å; E993-L997 WeakPolarHBondContact O-CG 3.38Å; E993-L997 PolarHBondContact O-N 3.25Å; N994-L997 PolarHBondContact O-N 3.1Å; M995-L997 VanDerWaalsContact C-N 3.28Å; M995-L997 PolarHBondContact O-N 3.24Å; L997-E999 VanDerWaalsContact C-N 3.32Å; L997-E999 PolarHBondContact O-N 3.36Å; L997-R1000 PolarHBondContact O-N 2.92Å; L997-E1001 PolarHBondContact O-N 3.07Å
998	E	80.3	Confident	78.7	Confident	101 Å²	101	98.2 Å²	98.2	47%	0.472	45%	0.445	S	S	.	.	H	α-helix	trans	-61.4	-39.5	172.9	-87.1	-162.6	-147.7	0	0	112.1	N994 M995 E1001 K1002	N994-E998 WeakPolarHBondContact O-CB 3.41Å; N994-E998 PolarHBondContact O-N 2.87Å; M995-E998 PolarHBondContact O-N 3.15Å; E998-E1001 PolarHBondContact O-N 2.57Å; E998-K1002 WeakPolarHBondContact O-CB 3.43Å; E998-K1002 VanDerWaalsContact O-CD 3.23Å; E998-K1002 WeakPolarHBondContact O-CD 3.41Å; E998-K1002 WeakPolarHBondContact O-CG 3.33Å; E998-K1002 PolarHBondContact O-N 3.19Å; E998-K1002 WeakPolarHBondContact OE2-CE 3.37Å; E998-K1002 IonicContact OE2-NZ 3.5Å; E998-K1002 PolarHBondContact OE2-NZ 3.17Å
999	E	82	Confident	76.8	Confident	134 Å²	134	97.3 Å²	97.3	63%	0.626	45%	0.45	S	S	*	.	H	α-helix	trans	-67.7	-41.1	175.5	-73.1	-169.8	156.4	0	0	112.2	M995 L997 K1002 A1003	M995-E999 WeakPolarHBondContact O-CG 3.49Å; M995-E999 PolarHBondContact O-N 2.99Å; L997-E999 VanDerWaalsContact C-N 3.32Å; L997-E999 PolarHBondContact O-N 3.36Å; E999-K1002 PolarHBondContact O-N 3.21Å; E999-A1003 WeakPolarHBondContact O-CB 3.45Å; E999-A1003 PolarHBondContact O-N 3.12Å
1000	R	80	Confident	75	Confident	162 Å²	162	102.3 Å²	102.3	61%	0.611	48%	0.484	S	S	*	.	H	α-helix	trans	-60.9	-44.9	171.9	-74.4	172.5	-170.2	-155.5	6.5	111.6	E996 L997 K1002 A1003 E1004	E996-R1000 WeakPolarHBondContact O-CB 3.29Å; E996-R1000 VanDerWaalsContact O-CG 3.24Å; E996-R1000 WeakPolarHBondContact O-CG 3.21Å; E996-R1000 PolarHBondContact O-N 3.39Å; L997-R1000 PolarHBondContact O-N 2.92Å; R1000-K1002 PolarHBondContact O-N 2.94Å; R1000-A1003 PolarHBondContact O-N 3Å; R1000-E1004 PolarHBondContact O-N 3.48Å
1001	E	77.8	Confident	72.9	Confident	111 Å²	111	112 Å²	112	52%	0.519	53%	0.526	S	S	.	.	H	α-helix	trans	-60.8	-43.4	173.9	-86.6	-158.7	-155.9	0	0	112.4	L997 E998 A1003 E1004 K1005	L997-E1001 PolarHBondContact O-N 3.07Å; E998-E1001 PolarHBondContact O-N 2.57Å; E1001-A1003 VanDerWaalsContact C-N 3.29Å; E1001-A1003 PolarHBondContact O-N 3.44Å; E1001-E1004 PolarHBondContact O-N 2.8Å; E1001-K1005 VanDerWaalsContact O-CB 3.26Å; E1001-K1005 WeakPolarHBondContact O-CB 3.47Å; E1001-K1005 WeakPolarHBondContact O-CD 3.42Å; E1001-K1005 VanDerWaalsContact O-CG 3.25Å; E1001-K1005 WeakPolarHBondContact O-CG 3.42Å; E1001-K1005 PolarHBondContact O-N 3.26Å; E1001-K1005 IonicContact OE2-NZ 2.85Å; E1001-K1005 PolarHBondContact OE2-NZ 3.18Å
1002	K	77.2	Confident	70.5	Confident	113 Å²	113	116.9 Å²	116.9	49%	0.491	56%	0.563	S	S	.	*	H	α-helix	trans	-64.9	-33.9	176.9	-70.1	158.7	-163.8	167.5	0	111.3	E998 E999 R1000 K1006	E998-K1002 WeakPolarHBondContact O-CB 3.43Å; E998-K1002 VanDerWaalsContact O-CD 3.23Å; E998-K1002 WeakPolarHBondContact O-CD 3.41Å; E998-K1002 WeakPolarHBondContact O-CG 3.33Å; E998-K1002 PolarHBondContact O-N 3.19Å; E998-K1002 WeakPolarHBondContact OE2-CE 3.37Å; E998-K1002 IonicContact OE2-NZ 3.5Å; E998-K1002 PolarHBondContact OE2-NZ 3.17Å; E999-K1002 PolarHBondContact O-N 3.21Å; R1000-K1002 PolarHBondContact O-N 2.94Å; K1002-K1006 WeakPolarHBondContact O-CG 3.46Å; K1002-K1006 PolarHBondContact O-N 2.69Å; K1002-K1006 VanDerWaalsContact O-N 3.13Å
1003	A	75	Confident	68.2	Low	49 Å²	49	113.9 Å²	113.9	41%	0.405	58%	0.576	S	S	.	*	H	α-helix	trans	-73	-40.3	173.7	0	0	0	0	0	112.8	E999 R1000 E1001 K1006 K1007	E999-A1003 WeakPolarHBondContact O-CB 3.45Å; E999-A1003 PolarHBondContact O-N 3.12Å; R1000-A1003 PolarHBondContact O-N 3Å; E1001-A1003 VanDerWaalsContact C-N 3.29Å; E1001-A1003 PolarHBondContact O-N 3.44Å; A1003-K1006 WeakPolarHBondContact O-CB 3.32Å; A1003-K1006 PolarHBondContact O-N 2.66Å; A1003-K1007 PolarHBondContact O-N 2.74Å
1004	E	70.9	Confident	65.7	Low	108 Å²	108	118.5 Å²	118.5	51%	0.505	61%	0.612	S	S	.	*	H	α-helix	trans	-68.4	-40	174.4	-74.8	-156.4	176.1	0	0	112.3	R1000 E1001 K1006 K1007 R1008	R1000-E1004 PolarHBondContact O-N 3.48Å; E1001-E1004 PolarHBondContact O-N 2.8Å; E1004-K1006 PolarHBondContact O-N 2.72Å; E1004-K1007 CarbonylContact O-C 3.51Å; E1004-K1007 PolarHBondContact O-N 3.32Å; E1004-R1008 WeakPolarHBondContact O-CG 3.24Å; E1004-R1008 PolarHBondContact O-N 2.91Å; E1004-R1008 IonicContact OE2-NH2 3.93Å
1005	K	68.4	Low	63.4	Low	140 Å²	140	122.6 Å²	122.6	61%	0.609	65%	0.648	S	S	*	*	H	α-helix	trans	-63.7	-26.8	172.4	-73.2	163.2	177	164.9	0	112	E1001	E1001-K1005 VanDerWaalsContact O-CB 3.26Å; E1001-K1005 WeakPolarHBondContact O-CB 3.47Å; E1001-K1005 WeakPolarHBondContact O-CD 3.42Å; E1001-K1005 VanDerWaalsContact O-CG 3.25Å; E1001-K1005 WeakPolarHBondContact O-CG 3.42Å; E1001-K1005 PolarHBondContact O-N 3.26Å; E1001-K1005 IonicContact OE2-NZ 2.85Å; E1001-K1005 PolarHBondContact OE2-NZ 3.18Å
1006	K	67.4	Low	61	Low	185 Å²	185	126.5 Å²	126.5	80%	0.804	67%	0.665	S	S	*	*	H	α-helix	trans	-77.8	-32.6	167.7	-79	178	176.2	-179.5	0	113.9	K1002 A1003 E1004	K1002-K1006 WeakPolarHBondContact O-CG 3.46Å; K1002-K1006 PolarHBondContact O-N 2.69Å; K1002-K1006 VanDerWaalsContact O-N 3.13Å; A1003-K1006 WeakPolarHBondContact O-CB 3.32Å; A1003-K1006 PolarHBondContact O-N 2.66Å; E1004-K1006 PolarHBondContact O-N 2.72Å
1007	K	64.4	Low	58.7	Low	186 Å²	186	132 Å²	132	81%	0.809	69%	0.687	S	S	*	*	H	α-helix	trans	-75.3	-31.1	175.4	-76.6	-178	174.8	-178.6	0	113	A1003 E1004 G1009	A1003-K1007 PolarHBondContact O-N 2.74Å; E1004-K1007 CarbonylContact O-C 3.51Å; E1004-K1007 PolarHBondContact O-N 3.32Å; K1007-G1009 VanDerWaalsContact C-N 3.28Å; K1007-G1009 PolarHBondContact O-N 3.02Å
1008	R	58.7	Low	56.3	Low	193 Å²	193	140 Å²	140	73%	0.728	71%	0.713	S	S	*	*	S	Bend	trans	-79.4	75.5	174.2	-68	-175	-172.3	-161.9	5.2	110.5	E1004	E1004-R1008 WeakPolarHBondContact O-CG 3.24Å; E1004-R1008 PolarHBondContact O-N 2.91Å; E1004-R1008 IonicContact OE2-NH2 3.93Å
1009	G	48.5	Very low	54	Low	49 Å²	49	144.5 Å²	144.5	51%	0.505	73%	0.731	S	S	.	*			trans	-54.7	158.7	165.3	0	0	0	0	0	112.1	K1007 K1011	K1007-G1009 VanDerWaalsContact C-N 3.28Å; K1007-G1009 PolarHBondContact O-N 3.02Å; G1009-K1011 PolarHBondContact O-N 2.92Å; G1009-K1011 VanDerWaalsContact O-N 3.12Å
1010	P	49	Very low	51.6	Low	136 Å²	136	142.3 Å²	142.3	88%	0.883	74%	0.735	S	S	*	*			trans	-65.7	113.9	-166.3	26.5	-34.9	0	0	0	111.8
1011	K	43.7	Very low	49.3	Very low	206 Å²	206	143.8 Å²	143.8	90%	0.896	75%	0.749	S	S	*	*			trans	-74.4	132.8	165.7	-85.6	-165.4	169.3	-171	0	109.8	G1009	G1009-K1011 PolarHBondContact O-N 2.92Å; G1009-K1011 VanDerWaalsContact O-N 3.12Å
1012	S	37.5	Very low	47	Very low	122 Å²	122	142.1 Å²	142.1	85%	0.853	76%	0.762	S	S	*	*			trans	-61.2	143.3	177.5	39.6	0	0	0	0	111.6
1013	G	37	Very low	44.9	Very low	81 Å²	81	143.5 Å²	143.5	84%	0.835	78%	0.78	S	S	*	*			trans	-86.4	178	-172.8	0	0	0	0	0	114.8
1014	S	32.3	Very low	43.4	Very low	128 Å²	128	147 Å²	147	90%	0.895	80%	0.799	S	S	*	*			trans	-135.1	151.3	148.2	56	0	0	0	0	107.2
1015	A	36.2	Very low	41.8	Very low	100 Å²	100	148.9 Å²	148.9	83%	0.826	81%	0.812	S	S	*	*			trans	-136.9	146.3	-166.3	0	0	0	0	0	112.1
1016	Q	33.2	Very low	40	Very low	199 Å²	199	145.7 Å²	145.7	93%	0.93	82%	0.819	S	S	*	*			trans	-128.3	135.2	162	-81.2	-171.3	-15.9	0	0	111.4
1017	K	34.6	Very low	38.3	Very low	200 Å²	200	148.1 Å²	148.1	87%	0.87	82%	0.823	S	S	*	*			trans	-80.3	152.9	-171.1	-59.9	164.7	173.2	172.6	0	111.5
1018	R	29.2	Very low	36.7	Very low	236 Å²	236	143.1 Å²	143.1	89%	0.891	82%	0.824	S	S	*	*				-175.6	139.9	103.2	-98.9	167	178.8	-171	-0.5	114.1
1019	K	30.6	Very low	35.5	Very low	197 Å²	197	145.5 Å²	145.5	86%	0.857	83%	0.834	S	S	*	*			trans	30.4	114.1	149.5	-67	-167.5	170.5	-163.4	0	118.4
1020	A	31.1	Very low	34.6	Very low	87 Å²	87	154.4 Å²	154.4	72%	0.719	85%	0.852	S	S	*	*				104.6	153.5	86.3	0	0	0	0	0	109.2
1021	E	32.1	Very low	33.8	Very low	194 Å²	194	157 Å²	157	91%	0.907	85%	0.849	S	S	*	*			cis	-152.3	168.9	8.1	-143.6	152.5	-126.4	0	0	108.9
1022	G	30.6	Very low	33.7	Very low	76 Å²	76	156.7 Å²	156.7	78%	0.784	85%	0.848	S	S	*	*			trans	104.7	105.9	168.6	0	0	0	0	0	117.8
1023	T	33.1	Very low	33.4	Very low	141 Å²	141	158.4 Å²	158.4	87%	0.865	85%	0.847	S	S	*	*			trans	-114.4	169.5	171.2	42.4	0	0	0	0	110.1
1024	P	43.9	Very low	33.4	Very low	124 Å²	124	163.5 Å²	163.5	81%	0.805	85%	0.846	S	S	*	*			cis	-133.6	173.7	14.9	38.5	-19.2	0	0	0	117.6
1025	D	36.4	Very low	33.4	Very low	146 Å²	146	169.1 Å²	169.1	78%	0.781	86%	0.864	S	S	*	*			trans	-92.3	150.4	173.9	170.1	39.5	0	0	0	112.6
1026	G	30.6	Very low	33.3	Very low	74 Å²	74	172.6 Å²	172.6	76%	0.763	87%	0.866	S	S	*	*			trans	-122.3	61.2	-166.2	0	0	0	0	0	115
1027	R	32.7	Very low	33.3	Very low	235 Å²	235	171.2 Å²	171.2	89%	0.887	86%	0.863	S	S	*	*			trans	-37	133.6	179.9	-60.2	168.4	174.2	171.6	-2.8	116.6
1028	G	29.1	Very low	33.2	Very low	81 Å²	81	169.6 Å²	169.6	84%	0.835	86%	0.863	S	S	*	*			trans	-160.8	105.7	161.5	0	0	0	0	0	114.3
1029	R	33.7	Very low	33.4	Very low	244 Å²	244	165.6 Å²	165.6	92%	0.921	86%	0.861	S	S	*	*			trans	-146.7	93.8	-178.6	-169	-173	-170.4	-164.8	5.8	114
1030	R	31.1	Very low	33.6	Very low	235 Å²	235	163.7 Å²	163.7	89%	0.887	86%	0.861	S	S	*	*			trans	-179.5	150.6	166.8	-102.7	163.4	-173.1	-156.6	3.6	107.6
1031	K	31.8	Very low	33.8	Very low	190 Å²	190	168.8 Å²	168.8	83%	0.826	87%	0.871	S	S	*	*			cis	-159	162.5	-11.8	-145.2	-178.2	-177.2	-171.4	0	108.3
1032	K	40.8	Very low	33.9	Very low	201 Å²	201	167 Å²	167	87%	0.874	87%	0.868	S	S	*	*			trans	-63.7	147.4	177.1	-66.8	-179.2	171.8	-172.8	0	113.9
1033	L	32.2	Very low	34.1	Very low	157 Å²	157	174 Å²	174	82%	0.822	88%	0.875	S	S	*	*			trans	-157	125.4	133.9	-93.2	156.3	0	0	0	105.3
1034	K	35.2	Very low	34.2	Very low	189 Å²	189	176.8 Å²	176.8	82%	0.822	88%	0.875	S	S	*	*				39.4	118.7	97.3	-75.9	-166.6	169.7	-165.2	0	112
1035	L	33.1	Very low	33.3	Very low	245 Å²	245	181.5 Å²	181.5	100%	1.283	88%	0.882	S	S	*	*			cis	-105	0	38	-119.4	131.4	0	0	0	115.6

Retrieved 1,035 of 1,035 residues in 339.6 ms (Link to these results)

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