A0A087Y6W2_POEFO Loading...

RAS guanyl-releasing protein 1

AlphaFold DB , UniProt , Accession A0A087Y6W2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 814 aa.

						>A0A087Y6W2_POEFO|A0A087Y6W2
MDSLVEPLVAQYLAMGCQSKENQNESITADEKGTDDMRVTPGYTPNRSRVSPPRRPHRFHKPVSSPIIPNKSVMSLGHLTKASWEELIQACLELFADADGCVRKTSHVLNITLTMHRLLMSSSDLLDRLINLYPFTRTLTFKTALDNDQPAECQRICYLIRHWIQEFWMMFRLPHSLSDSLDDFRDLLREHGQEHLCSLLETKWINERERSWKASQKIQANYSKKRKVSLLFDHLEPSELADHLTFLEFKSFCRISFVDYINYIRSCCMKDIPVLERSIALCNGISQWVQLMVLSRPTAQLRAEVFTKFIHVAKCLHLMHNYNTLMAVVGGLCHSSISRLKDTTSHVPNEVTKVLNEMTDLLSSCRNYDNYRQAYNKVTGFKIPILGVHLKDLISVNEAMPDYVDDNKVNVQKLQALYNHINELIQLQQIPSQLDANKDLVHLLTLSLDLYYTEDEIYELSYAREPKNCKAPPATPSKPPVYVDWASGVAPKPDPRTISKHVQRMVDSVFKNYDLDQNGFISHDDFEKIAASFPFSFCVMDKEKKGLVSREEITAYFMRASVICSKLGLGFVHNFQETTYMKPTFCDNCSGFLWGVIKQGYRCRDCGMNCHKLCKDQVAFECKKNTRSTNAVDSPTPSSTPIASSTSEVYLKKLIIRWLSLGSEECPFPYPSDGRRDWSPESPITPNWRPARVHSYTQTEGPQLSSMTPEASRLQSSLLIPVPPILPSCPSPVPLRKQRYCAKWENRASVLQKPKEPVEESKCTYESLEYENLRLQQDNEALREKLRETKLEVEKLKSYLKKHALHPVEEDSSS
					

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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	28.8	Very low	27.5	Very low	216 Å²	216	127.3 Å²	127.3	100%	1.064	71%	0.706	S	S	*	*				0	64.1	0	-170.8	-170.3	-65.6	0	0	109.4
2	D	25.2	Very low	28.1	Very low	149 Å²	149	130.4 Å²	130.4	80%	0.797	70%	0.701	S	S	*	*			trans	-122.5	6.2	-142	-39.1	-60.6	0	0	0	115.5	L4	D2-L4 PolarHBondContact O-N 3.15Å
3	S	24.3	Very low	28.4	Very low	114 Å²	114	129.8 Å²	129.8	80%	0.797	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	29.3	-168.4	-162.6	0	0	0	0	114.7
4	L	29.3	Very low	28.4	Very low	146 Å²	146	124.4 Å²	124.4	76%	0.764	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.4	9.7	-172.5	-73.7	174.8	0	0	0	115.4	D2	D2-L4 PolarHBondContact O-N 3.15Å
5	V	30.3	Very low	28.6	Very low	113 Å²	113	125.3 Å²	125.3	69%	0.685	68%	0.679	S	S	*	*	S	Bend	trans	-97.7	-37.2	-176.6	-175.9	0	0	0	0	112.8
6	E	26.2	Very low	28.7	Very low	175 Å²	175	121.3 Å²	121.3	82%	0.818	68%	0.676	S	S	*	*	H	α-helix	trans	-70.4	-38.4	-173.6	-60.4	-177.7	128.2	0	0	115.9	L8	E6-L8 VanDerWaalsContact C-N 3.29Å; E6-L8 PolarHBondContact O-N 2.97Å
7	P	24.8	Very low	28.7	Very low	79 Å²	79	119.5 Å²	119.5	51%	0.513	67%	0.672	S	S	.	*	H	α-helix	trans	-63.4	-29.7	-174.2	-25.6	35.5	0	0	0	115	A10 Q11	P7-A10 PolarHBondContact O-N 2.64Å; P7-Q11 PolarHBondContact O-N 2.74Å; P7-Q11 VanDerWaalsContact O-N 3.11Å
8	L	29.6	Very low	28.6	Very low	112 Å²	112	122.9 Å²	122.9	59%	0.586	68%	0.682	S	S	*	*	H	α-helix	trans	-71.1	-31.9	-173	-85.3	159.1	0	0	0	113.4	E6	E6-L8 VanDerWaalsContact C-N 3.29Å; E6-L8 PolarHBondContact O-N 2.97Å
9	V	29	Very low	28.7	Very low	98 Å²	98	122.3 Å²	122.3	59%	0.594	69%	0.687	S	S	*	*	H	α-helix	trans	-72.6	-43.1	176.1	-176.7	0	0	0	0	110.3	Q11 Y12 L13	V9-Q11 PolarHBondContact O-N 2.66Å; V9-Y12 PolarHBondContact O-N 3.19Å; V9-L13 HydrophobicContact CG1-CD1 4.3Å; V9-L13 PolarHBondContact O-N 3.5Å
10	A	25.7	Very low	28.8	Very low	63 Å²	63	125.8 Å²	125.8	52%	0.521	70%	0.695	S	S	.	*	H	α-helix	trans	-61.9	-40.8	178.3	0	0	0	0	0	112.5	P7 Y12 L13 A14	P7-A10 PolarHBondContact O-N 2.64Å; A10-Y12 VanDerWaalsContact C-N 3.33Å; A10-Y12 PolarHBondContact O-N 3.15Å; A10-L13 PolarHBondContact O-N 3.39Å; A10-A14 WeakPolarHBondContact O-CB 3.48Å; A10-A14 PolarHBondContact O-N 2.9Å
11	Q	29.7	Very low	28.7	Very low	135 Å²	135	128.5 Å²	128.5	63%	0.631	70%	0.702	S	S	*	*	H	α-helix	trans	-67.4	-30.7	-177.4	-161.5	169.3	19	0	0	113.2	P7 V9	P7-Q11 PolarHBondContact O-N 2.74Å; P7-Q11 VanDerWaalsContact O-N 3.11Å; V9-Q11 PolarHBondContact O-N 2.66Å
12	Y	33.8	Very low	28.7	Very low	165 Å²	165	125.5 Å²	125.5	65%	0.647	69%	0.69	S	S	*	*	H	α-helix	trans	-77.5	-35.8	174.5	-99.1	-83.1	0	0	0	113.5	V9 A10	V9-Y12 PolarHBondContact O-N 3.19Å; A10-Y12 VanDerWaalsContact C-N 3.33Å; A10-Y12 PolarHBondContact O-N 3.15Å
13	L	32.4	Very low	28.9	Very low	122 Å²	122	127 Å²	127	64%	0.639	69%	0.693	S	S	*	*	H	α-helix	trans	-67.2	-37.4	173.9	-69.8	171.8	0	0	0	111.9	V9 A10 M15 G16	V9-L13 HydrophobicContact CG1-CD1 4.3Å; V9-L13 PolarHBondContact O-N 3.5Å; A10-L13 PolarHBondContact O-N 3.39Å; L13-M15 VanDerWaalsContact C-N 3.31Å; L13-M15 PolarHBondContact O-N 2.76Å; L13-G16 PolarHBondContact O-N 2.9Å
14	A	28.8	Very low	28.9	Very low	54 Å²	54	129.9 Å²	129.9	45%	0.446	70%	0.699	S	S	.	*	H	α-helix	trans	-58.3	-38.1	178.5	0	0	0	0	0	113.4	A10 G16 C17	A10-A14 WeakPolarHBondContact O-CB 3.48Å; A10-A14 PolarHBondContact O-N 2.9Å; A14-G16 PolarHBondContact O-N 2.82Å; A14-C17 PolarHBondContact O-N 3.02Å; A14-C17 VanDerWaalsContact O-N 3.13Å
15	M	31.3	Very low	28.7	Very low	138 Å²	138	132.5 Å²	132.5	68%	0.68	71%	0.707	S	S	*	*	H	α-helix	trans	-71.3	-12.1	176.5	-66.5	-155.3	-64.9	0	0	113.8	L13	L13-M15 VanDerWaalsContact C-N 3.31Å; L13-M15 PolarHBondContact O-N 2.76Å
16	G	30.5	Very low	28.3	Very low	62 Å²	62	132.3 Å²	132.3	64%	0.639	71%	0.711	S	S	*	*	H	α-helix	trans	-77.5	-23.8	168.7	0	0	0	0	0	114	L13 A14	L13-G16 PolarHBondContact O-N 2.9Å; A14-G16 PolarHBondContact O-N 2.82Å
17	C	27.4	Very low	28.3	Very low	90 Å²	90	132.4 Å²	132.4	61%	0.608	72%	0.715	S	S	*	*	H	α-helix	trans	-97.7	-19	-169.4	-70.2	0	0	0	0	115.2	A14 S19 K20	A14-C17 PolarHBondContact O-N 3.02Å; A14-C17 VanDerWaalsContact O-N 3.13Å; C17-S19 PolarHBondContact O-N 3.45Å; C17-K20 PolarHBondContact O-N 3.38Å
18	Q	28.2	Very low	28.2	Very low	181 Å²	181	134.5 Å²	134.5	85%	0.846	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	29.7	-179.2	-66.6	-167	-16.1	0	0	115.1
19	S	30.3	Very low	28	Very low	111 Å²	111	133.6 Å²	133.6	78%	0.776	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.7	3.7	178.4	-161.9	0	0	0	0	113.2	C17	C17-S19 PolarHBondContact O-N 3.45Å
20	K	29.6	Very low	27.8	Very low	193 Å²	193	136.2 Å²	136.2	84%	0.839	75%	0.746	S	S	*	*	S	Bend	trans	-130	-9.3	-177.6	-81.1	-169.4	173.3	-178.7	0	117.4	C17	C17-K20 PolarHBondContact O-N 3.38Å
21	E	26.8	Very low	27.8	Very low	182 Å²	182	140 Å²	140	85%	0.85	75%	0.754	S	S	*	*	S	Bend	trans	-104.2	72.7	176.9	-67.1	-174.8	148.3	0	0	111.2
22	N	28.6	Very low	27.7	Very low	153 Å²	153	142.5 Å²	142.5	82%	0.818	76%	0.762	S	S	*	*	S	Bend	trans	-165.6	48.2	163.3	-107.5	-46.4	0	0	0	112.1
23	Q	29.4	Very low	27.4	Very low	181 Å²	181	137.6 Å²	137.6	85%	0.846	76%	0.762	S	S	*	*			trans	-170.1	84.2	167.7	-114.9	150.3	96.5	0	0	110.5
24	N	24.9	Very low	27.1	Very low	174 Å²	174	138.1 Å²	138.1	93%	0.93	77%	0.77	S	S	*	*			trans	-178.2	75	155.5	-97.3	-14	0	0	0	110.9
25	E	24.6	Very low	27	Very low	201 Å²	201	142.6 Å²	142.6	94%	0.939	79%	0.787	S	S	*	*			trans	-124.2	131.9	147.2	-76.9	-163.4	136.8	0	0	107.6
26	S	23.3	Very low	26.9	Very low	110 Å²	110	141.7 Å²	141.7	77%	0.769	79%	0.785	S	S	*	*			trans	-111.4	130.9	-175.2	54.2	0	0	0	0	110
27	I	24.7	Very low	26.8	Very low	176 Å²	176	145.2 Å²	145.2	90%	0.903	79%	0.786	S	S	*	*			trans	-107.6	137.6	167	-61.6	-179.9	0	0	0	107.4
28	T	23.1	Very low	26.6	Very low	123 Å²	123	150.9 Å²	150.9	76%	0.755	80%	0.795	S	S	*	*			trans	-106	165.9	-170.1	47.1	0	0	0	0	112.7
29	A	24.9	Very low	26.6	Very low	94 Å²	94	148.5 Å²	148.5	78%	0.777	79%	0.792	S	S	*	*			trans	70.7	153.1	-178.6	0	0	0	0	0	115
30	D	24.8	Very low	26.2	Very low	152 Å²	152	149.4 Å²	149.4	81%	0.813	79%	0.793	S	S	*	*			cis	-140.4	-176.3	14.6	-146.3	-16.2	0	0	0	113.9
31	E	26.7	Very low	26.7	Very low	144 Å²	144	146.2 Å²	146.2	67%	0.673	79%	0.792	S	S	*	*			trans	-77	174.3	-164.6	-54.6	-176.7	133.4	0	0	119.6
32	K	27.9	Very low	26.7	Very low	186 Å²	186	140.9 Å²	140.9	81%	0.809	79%	0.786	S	S	*	*			trans	98.4	138.5	141.8	-78.9	-178	178.9	78.8	0	122.2
33	G	26.1	Very low	26.5	Very low	62 Å²	62	144.7 Å²	144.7	64%	0.639	79%	0.79	S	S	*	*			trans	99.7	128.8	159.8	0	0	0	0	0	115.3
34	T	27.2	Very low	26.2	Very low	133 Å²	133	141.8 Å²	141.8	82%	0.816	79%	0.785	S	S	*	*			cis	65	127.9	39.5	75.8	0	0	0	0	114.1
35	D	27.6	Very low	26.8	Very low	149 Å²	149	138.9 Å²	138.9	80%	0.797	78%	0.776	S	S	*	*			cis	-159.5	168.7	-1.4	-137.7	-23.8	0	0	0	114.4
36	D	27.3	Very low	26.7	Very low	119 Å²	119	136.2 Å²	136.2	64%	0.636	77%	0.768	S	S	*	*			trans	28.3	151.7	151.9	-132.8	-0.2	0	0	0	127.3
37	M	28.8	Very low	26.8	Very low	135 Å²	135	141.6 Å²	141.6	67%	0.665	77%	0.771	S	S	*	*			trans	57	166.4	151.7	-65	-120.1	-176.3	0	0	123.5
38	R	24.7	Very low	26.7	Very low	210 Å²	210	138.4 Å²	138.4	79%	0.792	77%	0.765	S	S	*	*			cis	-175.1	174.4	-41.4	-165.6	169.2	-173.8	-167.9	4.8	108.8
39	V	27.2	Very low	26.8	Very low	131 Å²	131	144.6 Å²	144.6	79%	0.794	77%	0.774	S	S	*	*			trans	96.9	136.6	158.2	-173.3	0	0	0	0	118.9
40	T	22.4	Very low	26.8	Very low	129 Å²	129	147 Å²	147	79%	0.791	78%	0.779	S	S	*	*			trans	-131.3	-170.7	174.7	6.2	0	0	0	0	107.5
41	P	40.4	Very low	26.6	Very low	127 Å²	127	145 Å²	145	83%	0.825	78%	0.777	S	S	*	*			cis	-133.4	-167.1	3.1	42.6	-24.2	0	0	0	114.4
42	G	25.1	Very low	26.5	Very low	69 Å²	69	143.8 Å²	143.8	71%	0.711	78%	0.781	S	S	*	*			trans	170.5	66.9	166.1	0	0	0	0	0	121.8
43	Y	25.1	Very low	26.3	Very low	234 Å²	234	141 Å²	141	92%	0.918	78%	0.783	S	S	*	*			trans	54.5	175.8	153.2	-98.5	-98.7	0	0	0	122.6
44	T	22.5	Very low	26	Very low	120 Å²	120	149.8 Å²	149.8	74%	0.736	80%	0.796	S	S	*	*			trans	-139.1	-177.8	-162	60.8	0	0	0	0	109.9
45	P	37.8	Very low	26.2	Very low	113 Å²	113	154.2 Å²	154.2	73%	0.734	80%	0.798	S	S	*	*			cis	-146.2	-174.9	13.3	42.8	-21.2	0	0	0	119.3
46	N	24.2	Very low	26	Very low	145 Å²	145	152.8 Å²	152.8	78%	0.775	80%	0.797	S	S	*	*			trans	101.6	92.3	142.6	-114.5	-12.2	0	0	0	122.6
47	R	24.3	Very low	25.9	Very low	223 Å²	223	155.2 Å²	155.2	84%	0.842	80%	0.804	S	S	*	*				90.6	120.1	128.3	-126.9	176.7	-170.4	-174.6	2.6	122.2
48	S	22.3	Very low	25.6	Very low	109 Å²	109	160 Å²	160	76%	0.762	82%	0.815	S	S	*	*			trans	60.7	93	148.1	50.6	0	0	0	0	120.2
49	R	25.7	Very low	25.6	Very low	252 Å²	252	159.1 Å²	159.1	95%	0.951	82%	0.817	S	S	*	*			trans	-139.4	146	140.9	-116.5	-177.6	-174.5	-167.6	1.9	110.5
50	V	23.8	Very low	25.4	Very low	144 Å²	144	161.8 Å²	161.8	87%	0.873	82%	0.82	S	S	*	*			trans	-97.2	128.8	-178.5	177.7	0	0	0	0	110
51	S	21.9	Very low	25.5	Very low	111 Å²	111	164.5 Å²	164.5	78%	0.776	82%	0.821	S	S	*	*			trans	-165.8	159.6	168.1	-85.2	0	0	0	0	110.2
52	P	24.4	Very low	24.6	Very low	118 Å²	118	164.9 Å²	164.9	77%	0.766	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-88.5	156.8	-156.2	33.6	-37.1	0	0	0	115.3
53	P	22.7	Very low	24.5	Very low	129 Å²	129	167.7 Å²	167.7	84%	0.838	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-78.4	142.4	175	32.1	-34.5	0	0	0	113
54	R	21.6	Very low	24.6	Very low	245 Å²	245	161.6 Å²	161.6	93%	0.925	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-87.7	164.9	162.2	-109.7	-175.4	174.5	-160.9	0.1	110.6
55	R	29.7	Very low	24.6	Very low	226 Å²	226	160.9 Å²	160.9	85%	0.853	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-54.9	156	174.4	-59.1	176.7	179.8	171.4	-2.4	112.7
56	P	25.2	Very low	24	Very low	119 Å²	119	161.5 Å²	161.5	77%	0.773	82%	0.822	S	S	*	*			trans	-120.4	168.4	130.9	36.3	-31.1	0	0	0	113.3
57	H	24.1	Very low	24.2	Very low	170 Å²	170	162.3 Å²	162.3	79%	0.787	83%	0.825	S	S	*	*			trans	-74.7	173.9	168.2	-66.1	-91.1	0	0	0	109.9
58	R	23.2	Very low	24.4	Very low	236 Å²	236	158.8 Å²	158.8	89%	0.891	82%	0.821	S	S	*	*			cis	-161.6	174	42	-146.7	173.2	-169.3	172.7	2.6	112
59	F	24.2	Very low	24.7	Very low	191 Å²	191	159.3 Å²	159.3	84%	0.838	82%	0.822	S	S	*	*			trans	-52.9	142.2	-174.5	-72	-101	0	0	0	115.8
60	H	23.7	Very low	24.9	Very low	187 Å²	187	154.2 Å²	154.2	87%	0.866	81%	0.814	S	S	*	*			trans	-122.3	154.2	145.6	-94.4	-100.4	0	0	0	109.4
61	K	23.8	Very low	25.1	Very low	186 Å²	186	155 Å²	155	81%	0.809	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-65.5	157	176.1	-75.9	-179.6	176.6	-179.6	0	111.1	V63	K61-V63 PolarHBondContact O-N 3Å; K61-V63 VanDerWaalsContact O-N 3.15Å
62	P	22.3	Very low	25.4	Very low	135 Å²	135	154.4 Å²	154.4	88%	0.877	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-60.5	118.8	-179.1	24.7	-34.8	0	0	0	111.3
63	V	22.1	Very low	25.8	Very low	129 Å²	129	155 Å²	155	78%	0.782	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-89.6	144.6	166.1	179.5	0	0	0	0	107.8	K61	K61-V63 PolarHBondContact O-N 3Å; K61-V63 VanDerWaalsContact O-N 3.15Å
64	S	26.1	Very low	26.7	Very low	105 Å²	105	154.7 Å²	154.7	73%	0.734	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-55.8	149	175.5	39.4	0	0	0	0	112.3
65	S	23.7	Very low	27.4	Very low	105 Å²	105	148.2 Å²	148.2	73%	0.734	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-56.2	131.5	176.9	49.2	0	0	0	0	111.3	I67	S65-I67 PolarHBondContact O-N 2.78Å
66	P	25	Very low	28.3	Very low	126 Å²	126	139 Å²	139	82%	0.818	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-65.4	130.8	-177.7	26.6	-34.2	0	0	0	111.1
67	I	29.1	Very low	29.6	Very low	163 Å²	163	135.7 Å²	135.7	84%	0.836	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-65.2	144.2	175.8	-64.4	169.7	0	0	0	109.5	S65	S65-I67 PolarHBondContact O-N 2.78Å
68	I	28.7	Very low	31.2	Very low	148 Å²	148	136.5 Å²	136.5	76%	0.759	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-59.3	128	179.3	-62.2	164.8	0	0	0	109.9	N70	I68-N70 PolarHBondContact O-N 3.4Å; I68-N70 VanDerWaalsContact O-N 3.1Å
69	P	27.3	Very low	33.3	Very low	120 Å²	120	127.7 Å²	127.7	78%	0.779	71%	0.713	S	S	*	*			trans	-73	106	-179.6	28.4	-33.9	0	0	0	112
70	N	29.6	Very low	35.5	Very low	145 Å²	145	122.2 Å²	122.2	78%	0.775	70%	0.695	S	S	*	*			trans	38.7	80.4	155.6	-66.4	-8.3	0	0	0	118.1	I68	I68-N70 PolarHBondContact O-N 3.4Å; I68-N70 VanDerWaalsContact O-N 3.1Å
71	K	29.4	Very low	38.2	Very low	160 Å²	160	116.8 Å²	116.8	70%	0.696	67%	0.669	S	S	*	*	S	Bend		-81.2	148.1	119.6	-75.2	-177.1	-179.7	175.7	0	107.3	V73	K71-V73 PolarHBondContact O-N 3.14Å
72	S	26.9	Very low	41	Very low	100 Å²	100	107.9 Å²	107.9	70%	0.699	63%	0.631	S	S	*	*			trans	-54.9	107.7	-171.2	-168.6	0	0	0	0	112.5	M74	S72-M74 VanDerWaalsContact C-N 3.27Å; S72-M74 PolarHBondContact O-N 3.4Å; S72-M74 WeakPolarHBondContact OG-CG 3.3Å
73	V	33.8	Very low	44.1	Very low	131 Å²	131	102.7 Å²	102.7	79%	0.794	60%	0.597	S	S	*	*			trans	-76.6	86.2	170.1	-179.4	0	0	0	0	106.9	K71 S75	K71-V73 PolarHBondContact O-N 3.14Å; V73-S75 PolarHBondContact O-N 2.91Å
74	M	40.8	Very low	47	Very low	121 Å²	121	97.1 Å²	97.1	60%	0.596	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-69.6	120.9	-175.6	-63	-157.7	71.8	0	0	110.2	S72 L76	S72-M74 VanDerWaalsContact C-N 3.27Å; S72-M74 PolarHBondContact O-N 3.4Å; S72-M74 WeakPolarHBondContact OG-CG 3.3Å; M74-L76 PolarHBondContact O-N 2.78Å
75	S	36.7	Very low	49.7	Very low	109 Å²	109	96.3 Å²	96.3	76%	0.762	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-55.8	118.2	-171.8	-172.2	0	0	0	0	112	V73 G77	V73-S75 PolarHBondContact O-N 2.91Å; S75-G77 PolarHBondContact O-N 2.79Å
76	L	49.2	Very low	52.5	Low	32 Å²	32	95.1 Å²	95.1	17%	0.168	53%	0.53	C	S	.	.	P	Polyproline II helix	trans	-73.7	118.4	161.2	-160.5	81.7	0	0	0	106.8	M74 H78 L79 V108 I111 V411	M74-L76 PolarHBondContact O-N 2.78Å; L76-H78 PolarHBondContact O-N 3.22Å; L76-L79 VanDerWaalsContact CD2-O 3.3Å; L76-L79 WeakPolarHBondContact CD2-O 3.41Å; L76-V108 HydrophobicContact CD1-CG2 3.77Å; L76-V108 HydrophobicContact CG-CG2 4.46Å; L76-I111 HydrophobicContact CD1-CD1 4.21Å; L76-V411 HydrophobicContact CD2-CB 4.45Å; L76-V411 HydrophobicContact CD2-CG1 3.7Å
77	G	52.3	Low	55.3	Low	50 Å²	50	89.2 Å²	89.2	52%	0.515	49%	0.491	S	S	.	.			trans	-64.7	98	-174.1	0	0	0	0	0	112.5	S75 L79	S75-G77 PolarHBondContact O-N 2.79Å; G77-L79 PolarHBondContact O-N 2.75Å
78	H	57.3	Low	57.9	Low	188 Å²	188	81.7 Å²	81.7	87%	0.87	45%	0.452	S	S	*	.	S	Bend	trans	55.8	-21.2	174	-70.8	-81.3	0	0	0	119.2	L76 T80	L76-H78 PolarHBondContact O-N 3.22Å; H78-T80 PolarHBondContact O-N 2.6Å
79	L	66.8	Low	60.4	Low	50 Å²	50	78.7 Å²	78.7	26%	0.262	44%	0.435	S	S	.	.			trans	-81.2	69.3	-172.9	-65.2	168.5	0	0	0	113.2	L76 G77 A82 A90 V411	L76-L79 VanDerWaalsContact CD2-O 3.3Å; L76-L79 WeakPolarHBondContact CD2-O 3.41Å; G77-L79 PolarHBondContact O-N 2.75Å; L79-A82 HydrophobicContact CD2-CB 4.2Å; L79-A90 HydrophobicContact CD1-CB 3.97Å; L79-V411 WeakPolarHBondContact O-CB 3.44Å
80	T	71.5	Confident	62.9	Low	77 Å²	77	74.1 Å²	74.1	47%	0.472	41%	0.407	S	S	.	.	S	Bend	trans	-74	-32.6	174.5	54.8	0	0	0	0	113.2	H78 V411	H78-T80 PolarHBondContact O-N 2.6Å; T80-V411 PolarHBondContact O-N 3.28Å
81	K	80.8	Confident	65.4	Low	72 Å²	72	67.3 Å²	67.3	31%	0.313	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	140.9	167.9	60.8	173.3	-176.5	166.5	0	109.5	V404 D405 K408 V409	K81-V404 HydrophobicContact CD-CB 4.37Å; K81-V404 HydrophobicContact CD-CG1 4.32Å; K81-D405 IonicContact NZ-OD2 2.66Å; K81-D405 PolarHBondContact NZ-OD2 2.8Å; K81-K408 HydrophobicContact CB-CB 4.26Å; K81-V409 WeakPolarHBondContact CA-O 3.23Å
82	A	82.6	Confident	67.8	Low	0 Å²	0	60.3 Å²	60.3	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	154.5	-176.2	0	0	0	0	0	111.3	L79 E86 L87 K408 V409 V411	L79-A82 HydrophobicContact CD2-CB 4.2Å; A82-E86 VanDerWaalsContact CA-OE2 3.26Å; A82-E86 WeakPolarHBondContact CA-OE2 3.37Å; A82-E86 HydrophobicContact CB-CB 4.16Å; A82-L87 HydrophobicContact CB-CD1 4.41Å; A82-L87 HydrophobicContact CB-CD2 3.91Å; A82-L87 HydrophobicContact CB-CG 3.76Å; A82-K408 CarbonylContact O-C 3.53Å; A82-V409 PolarHBondContact N-O 3.14Å; A82-V409 WeakPolarHBondContact O-CB 3.2Å; A82-V409 PolarHBondContact O-N 3.1Å; A82-V411 HydrophobicContact CB-CG2 4.08Å
83	S	86	Confident	70.1	Confident	25 Å²	25	61 Å²	61	18%	0.175	33%	0.334	C	S	.	.			trans	-75.9	168.4	166.8	91.9	0	0	0	0	111.1	E85 E86 L87	S83-E85 VanDerWaalsContact C-N 3.27Å; S83-E85 WeakPolarHBondContact CB-OE2 3.49Å; S83-E85 PolarHBondContact O-N 3.45Å; S83-E85 PolarHBondContact OG-N 3.23Å; S83-E85 PolarHBondContact OG-OE2 3.19Å; S83-E86 PolarHBondContact N-OE2 2.97Å; S83-E86 PolarHBondContact O-N 3.34Å; S83-E86 PolarHBondContact OG-N 3.1Å; S83-E86 VanDerWaalsContact OG-N 3.14Å; S83-L87 WeakPolarHBondContact O-CG 3.32Å; S83-L87 PolarHBondContact O-N 2.63Å
84	W	83.1	Confident	72.2	Confident	13 Å²	13	56.1 Å²	56.1	5%	0.049	30%	0.303	C	S	.	.	H	α-helix	trans	-65.9	-34.3	175.6	-83	108.4	0	0	0	112.1	L87 I88 T112 H116 L119 M120 V409 L414	W84-L87 HydrophobicContact CE3-CD1 4.25Å; W84-L87 HydrophobicContact CZ3-CD1 4.29Å; W84-L87 PolarHBondContact O-N 2.99Å; W84-I88 WeakPolarHBondContact O-CB 3.35Å; W84-I88 WeakPolarHBondContact O-CD1 3.26Å; W84-I88 WeakPolarHBondContact O-CG1 3.44Å; W84-I88 PolarHBondContact O-N 3.2Å; W84-T112 HydrophobicContact CZ3-CG2 4.02Å; W84-H116 HydrophobicContact CH2-CB 3.57Å; W84-H116 HydrophobicContact CZ2-CB 4.38Å; W84-H116 HydrophobicContact CZ3-CB 3.89Å; W84-L119 HydrophobicContact CZ2-CB 4.08Å; W84-L119 HydrophobicContact CZ2-CD1 4.08Å; W84-M120 HydrophobicContact CB-CE 4.29Å; W84-M120 HydrophobicContact CD2-CE 3.55Å; W84-M120 HydrophobicContact CD2-SD 4.06Å; W84-M120 HydrophobicContact CE3-CE 4.23Å; W84-M120 HydrophobicContact CE3-SD 4.18Å; W84-M120 HydrophobicContact CG-CE 3.52Å; W84-M120 HydrophobicContact CZ2-CE 4.46Å; W84-M120 HydrophobicContact CZ2-CG 4.37Å; W84-M120 HydrophobicContact CZ2-SD 4.43Å; W84-M120 HydrophobicContact CZ3-SD 4.44Å; W84-V409 HydrophobicContact CD2-CG2 4.21Å; W84-V409 HydrophobicContact CG-CG2 4.22Å; W84-V409 HydrophobicContact CZ2-CG1 4.44Å; W84-V409 HydrophobicContact CZ2-CG2 4.12Å; W84-V409 VanDerWaalsContact NE1-CG2 3.34Å; W84-L414 HydrophobicContact CH2-CD1 4.46Å
85	E	83.7	Confident	73.7	Confident	88 Å²	88	50.5 Å²	50.5	41%	0.411	28%	0.275	S	S	.	.	H	α-helix	trans	-66.9	-45	176	-53.3	71.9	-156	0	0	110.5	S83 L87 I88 Q89 R128	S83-E85 VanDerWaalsContact C-N 3.27Å; S83-E85 WeakPolarHBondContact CB-OE2 3.49Å; S83-E85 PolarHBondContact O-N 3.45Å; S83-E85 PolarHBondContact OG-N 3.23Å; S83-E85 PolarHBondContact OG-OE2 3.19Å; E85-L87 VanDerWaalsContact C-N 3.35Å; E85-L87 PolarHBondContact O-N 3.28Å; E85-I88 PolarHBondContact O-N 3.48Å; E85-Q89 WeakPolarHBondContact O-CB 3.47Å; E85-Q89 PolarHBondContact O-N 3.37Å; E85-R128 IonicContact OE1-CZ 3.86Å; E85-R128 IonicContact OE1-NH1 2.67Å; E85-R128 PolarHBondContact OE1-NH1 3.38Å
86	E	82.8	Confident	74.9	Confident	79 Å²	79	46.9 Å²	46.9	37%	0.369	25%	0.252	S	S	.	.	H	α-helix	trans	-60.9	-40.8	173.5	-69	171.6	165.1	0	0	111.9	A82 S83 A90 K408	A82-E86 VanDerWaalsContact CA-OE2 3.26Å; A82-E86 WeakPolarHBondContact CA-OE2 3.37Å; A82-E86 HydrophobicContact CB-CB 4.16Å; S83-E86 PolarHBondContact N-OE2 2.97Å; S83-E86 PolarHBondContact O-N 3.34Å; S83-E86 PolarHBondContact OG-N 3.1Å; S83-E86 VanDerWaalsContact OG-N 3.14Å; E86-A90 WeakPolarHBondContact O-CB 3.29Å; E86-A90 PolarHBondContact O-N 3.45Å; E86-K408 IonicContact OE1-NZ 2.64Å; E86-K408 PolarHBondContact OE1-NZ 2.88Å; E86-K408 IonicContact OE2-NZ 2.74Å; E86-K408 PolarHBondContact OE2-NZ 3.35Å
87	L	83.8	Confident	75.4	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-69.4	-40.1	176.7	-73.4	170.9	0	0	0	113.1	A82 S83 W84 E85 C91 T112 V409 V411	A82-L87 HydrophobicContact CB-CD1 4.41Å; A82-L87 HydrophobicContact CB-CD2 3.91Å; A82-L87 HydrophobicContact CB-CG 3.76Å; S83-L87 WeakPolarHBondContact O-CG 3.32Å; S83-L87 PolarHBondContact O-N 2.63Å; W84-L87 HydrophobicContact CE3-CD1 4.25Å; W84-L87 HydrophobicContact CZ3-CD1 4.29Å; W84-L87 PolarHBondContact O-N 2.99Å; E85-L87 VanDerWaalsContact C-N 3.35Å; E85-L87 PolarHBondContact O-N 3.28Å; L87-C91 PolarHBondContact O-N 3.31Å; L87-C91 VanDerWaalsContact O-N 3.08Å; L87-C91 PolarHBondContact O-SG 3.21Å; L87-T112 HydrophobicContact CB-CG2 4.47Å; L87-V409 HydrophobicContact CD1-CB 4.25Å; L87-V409 HydrophobicContact CD1-CG1 4.32Å; L87-V409 HydrophobicContact CD1-CG2 4.46Å; L87-V411 HydrophobicContact CD1-CG2 4.41Å; L87-V411 HydrophobicContact CD2-CG1 4.5Å; L87-V411 HydrophobicContact CD2-CG2 4.08Å
88	I	83	Confident	75.6	Confident	5 Å²	5	49.6 Å²	49.6	3%	0.026	27%	0.266	C	S	.	.	H	α-helix	trans	-67.1	-45.3	177.6	-71.4	162.1	0	0	0	110.1	W84 E85 A90 C91 L92 L125 R128 L129 L132	W84-I88 WeakPolarHBondContact O-CB 3.35Å; W84-I88 WeakPolarHBondContact O-CD1 3.26Å; W84-I88 WeakPolarHBondContact O-CG1 3.44Å; W84-I88 PolarHBondContact O-N 3.2Å; E85-I88 PolarHBondContact O-N 3.48Å; I88-A90 PolarHBondContact O-N 3.24Å; I88-C91 CarbonylContact O-C 3.57Å; I88-C91 WeakPolarHBondContact O-CA 3.36Å; I88-C91 WeakPolarHBondContact O-CB 3.31Å; I88-C91 PolarHBondContact O-N 2.85Å; I88-L92 HydrophobicContact CG2-CD1 3.99Å; I88-L92 HydrophobicContact CG2-CG 4.4Å; I88-L92 WeakPolarHBondContact O-CG 3.16Å; I88-L92 PolarHBondContact O-N 3Å; I88-L125 HydrophobicContact CD1-CD1 3.86Å; I88-L125 HydrophobicContact CG1-CD1 4.07Å; I88-R128 HydrophobicContact CD1-CB 4.13Å; I88-L129 HydrophobicContact CG2-CD2 3.5Å; I88-L129 HydrophobicContact CG2-CG 4.44Å; I88-L132 HydrophobicContact CB-CD1 4.19Å; I88-L132 HydrophobicContact CD1-CD1 4.39Å; I88-L132 HydrophobicContact CG2-CD1 3.43Å; I88-L132 VanDerWaalsContact CG2-CD1 3.43Å
89	Q	80.6	Confident	75.7	Confident	86 Å²	86	47 Å²	47	40%	0.402	26%	0.259	S	S	.	.	H	α-helix	trans	-58.8	-47.1	176.5	-178.6	59.7	23.5	0	0	111.4	E85 C91 L92 E93	E85-Q89 WeakPolarHBondContact O-CB 3.47Å; E85-Q89 PolarHBondContact O-N 3.37Å; Q89-C91 PolarHBondContact O-N 3.37Å; Q89-L92 PolarHBondContact O-N 3.3Å; Q89-E93 WeakPolarHBondContact CG-OE1 3.11Å; Q89-E93 PolarHBondContact NE2-OE1 3.06Å; Q89-E93 WeakPolarHBondContact O-CG 3.49Å; Q89-E93 PolarHBondContact O-N 2.93Å
90	A	80.8	Confident	75.4	Confident	23 Å²	23	44.9 Å²	44.9	19%	0.19	25%	0.249	C	C	.	.	H	α-helix	trans	-61.5	-25	174.3	0	0	0	0	0	113.5	L79 E86 I88 L94	L79-A90 HydrophobicContact CD1-CB 3.97Å; E86-A90 WeakPolarHBondContact O-CB 3.29Å; E86-A90 PolarHBondContact O-N 3.45Å; I88-A90 PolarHBondContact O-N 3.24Å; A90-L94 WeakPolarHBondContact O-CG 3.42Å
91	C	81.9	Confident	74.9	Confident	2 Å²	2	45 Å²	45	1%	0.014	25%	0.252	C	S	.	.	H	α-helix	trans	-79.1	-36.3	171.9	-67.2	0	0	0	0	112.6	L87 I88 Q89 L94 F95 L109 L159	L87-C91 PolarHBondContact O-N 3.31Å; L87-C91 VanDerWaalsContact O-N 3.08Å; L87-C91 PolarHBondContact O-SG 3.21Å; I88-C91 CarbonylContact O-C 3.57Å; I88-C91 WeakPolarHBondContact O-CA 3.36Å; I88-C91 WeakPolarHBondContact O-CB 3.31Å; I88-C91 PolarHBondContact O-N 2.85Å; Q89-C91 PolarHBondContact O-N 3.37Å; C91-L94 PolarHBondContact O-N 3.06Å; C91-F95 WeakPolarHBondContact O-CD2 3.34Å; C91-L109 HydrophobicContact CB-CD1 3.97Å; C91-L159 HydrophobicContact CB-CD1 4.26Å; C91-L159 HydrophobicContact CB-CD2 4.3Å
92	L	78.9	Confident	74.3	Confident	14 Å²	14	43.9 Å²	43.9	7%	0.073	25%	0.251	C	S	.	.	H	α-helix	trans	-69.2	-36.8	178.1	-70.5	168.6	0	0	0	112.4	I88 Q89 L94 F95 R155 I156 L159	I88-L92 HydrophobicContact CG2-CD1 3.99Å; I88-L92 HydrophobicContact CG2-CG 4.4Å; I88-L92 WeakPolarHBondContact O-CG 3.16Å; I88-L92 PolarHBondContact O-N 3Å; Q89-L92 PolarHBondContact O-N 3.3Å; L92-L94 PolarHBondContact O-N 3.01Å; L92-F95 PolarHBondContact O-N 3.01Å; L92-R155 HydrophobicContact CD2-CB 4.22Å; L92-I156 HydrophobicContact CD1-CG1 4.24Å; L92-I156 HydrophobicContact CD2-CB 4.33Å; L92-I156 HydrophobicContact CD2-CG1 3.7Å; L92-L159 HydrophobicContact CD2-CB 4.11Å; L92-L159 HydrophobicContact CD2-CD2 3.58Å; L92-L159 HydrophobicContact CD2-CG 4.5Å; L92-L159 HydrophobicContact CG-CD2 3.99Å
93	E	76.9	Confident	73.2	Confident	114 Å²	114	50.4 Å²	50.4	53%	0.533	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-62.4	-24.5	177.3	-73.9	172.1	-167.7	0	0	113.3	Q89 F95 A96	Q89-E93 WeakPolarHBondContact CG-OE1 3.11Å; Q89-E93 PolarHBondContact NE2-OE1 3.06Å; Q89-E93 WeakPolarHBondContact O-CG 3.49Å; Q89-E93 PolarHBondContact O-N 2.93Å; E93-F95 PolarHBondContact O-N 3.08Å; E93-A96 VanDerWaalsContact O-CB 3.29Å; E93-A96 WeakPolarHBondContact O-CB 3.47Å; E93-A96 PolarHBondContact O-N 3.46Å
94	L	76	Confident	71.7	Confident	29 Å²	29	57.4 Å²	57.4	15%	0.152	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-69.1	-16.6	174.8	-62.5	173.5	0	0	0	113.8	A90 C91 L92 V102 R103 L109	A90-L94 WeakPolarHBondContact O-CG 3.42Å; C91-L94 PolarHBondContact O-N 3.06Å; L92-L94 PolarHBondContact O-N 3.01Å; L94-V102 HydrophobicContact CB-CG1 4.38Å; L94-R103 PolarHBondContact O-N 2.88Å; L94-L109 HydrophobicContact CD1-CB 3.95Å
95	F	72.8	Confident	70.3	Confident	3 Å²	3	61.3 Å²	61.3	1%	0.013	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-104	23.2	178.4	-66.2	-89.5	0	0	0	112.7	C91 L92 E93 D97 V102 L109 R155 L159 H162	C91-F95 WeakPolarHBondContact O-CD2 3.34Å; L92-F95 PolarHBondContact O-N 3.01Å; E93-F95 PolarHBondContact O-N 3.08Å; F95-D97 PolarHBondContact O-N 3.21Å; F95-V102 HydrophobicContact CD1-CG2 4.24Å; F95-V102 HydrophobicContact CE1-CG2 3.57Å; F95-V102 HydrophobicContact CE2-CG2 4.47Å; F95-V102 HydrophobicContact CZ-CG2 3.7Å; F95-L109 HydrophobicContact CE2-CD1 4.02Å; F95-L109 HydrophobicContact CE2-CD2 3.86Å; F95-L109 HydrophobicContact CZ-CD2 3.88Å; F95-R155 HydrophobicContact CB-CG 4.38Å; F95-L159 HydrophobicContact CD2-CB 4.27Å; F95-L159 HydrophobicContact CE2-CB 4.1Å; F95-L159 HydrophobicContact CE2-CD1 3.81Å; F95-L159 HydrophobicContact CZ-CD1 4.47Å; F95-H162 HydrophobicContact CE1-CB 4.02Å; F95-H162 HydrophobicContact CZ-CB 3.69Å; F95-H162 AromaticContact CZ-CG 3.93Å
96	A	61.7	Low	69.4	Low	33 Å²	33	59 Å²	59	27%	0.273	32%	0.322	S	S	.	.			trans	-70.5	17.7	-174	0	0	0	0	0	116.3	E93 R103	E93-A96 VanDerWaalsContact O-CB 3.29Å; E93-A96 WeakPolarHBondContact O-CB 3.47Å; E93-A96 PolarHBondContact O-N 3.46Å; A96-R103 PolarHBondContact O-NH1 3.13Å
97	D	60	Low	69.1	Low	57 Å²	57	59.1 Å²	59.1	31%	0.305	32%	0.322	S	S	.	.	S	Bend	trans	-117.2	142.5	174.5	-77.7	-42.7	0	0	0	111.4	F95 D99 G100 R103	F95-D97 PolarHBondContact O-N 3.21Å; D97-D99 PolarHBondContact O-N 3.42Å; D97-D99 VanDerWaalsContact O-N 3.16Å; D97-G100 PolarHBondContact O-N 3.46Å; D97-R103 IonicContact OD1-CZ 3.92Å; D97-R103 IonicContact OD1-NH1 2.93Å; D97-R103 PolarHBondContact OD1-NH1 3.29Å; D97-R103 IonicContact OD1-NH2 3.26Å; D97-R103 PolarHBondContact OD1-NH2 3.4Å; D97-R103 IonicContact OD2-CZ 3.28Å; D97-R103 IonicContact OD2-NE 3.07Å; D97-R103 PolarHBondContact OD2-NE 3.44Å; D97-R103 IonicContact OD2-NH1 3.88Å; D97-R103 PolarHBondContact OD2-NH1 2.98Å; D97-R103 IonicContact OD2-NH2 2.99Å; D97-R103 PolarHBondContact OD2-NH2 3.1Å
98	A	56.5	Low	68.9	Low	81 Å²	81	60.3 Å²	60.3	67%	0.669	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-23	-176.2	0	0	0	0	0	113.9	G100 Y158	A98-G100 PolarHBondContact O-N 3.46Å; A98-Y158 PolarHBondContact O-OH 2.98Å
99	D	58.7	Low	69	Low	135 Å²	135	60.1 Å²	60.1	72%	0.722	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-2.9	176.9	-54.5	-64.7	0	0	0	113.6	D97 C101	D97-D99 PolarHBondContact O-N 3.42Å; D97-D99 VanDerWaalsContact O-N 3.16Å; D99-C101 VanDerWaalsContact C-N 3.27Å; D99-C101 PolarHBondContact O-N 3.37Å
100	G	61	Low	69.2	Low	5 Å²	5	57.2 Å²	57.2	5%	0.052	32%	0.316	C	S	.	.			trans	65.8	27	179.3	0	0	0	0	0	114.1	D97 A98 R161	D97-G100 PolarHBondContact O-N 3.46Å; A98-G100 PolarHBondContact O-N 3.46Å; G100-R161 PolarHBondContact O-NH2 2.93Å; G100-R161 VanDerWaalsContact O-NH2 3.09Å
101	C	62.3	Low	69.5	Low	80 Å²	80	56.3 Å²	56.3	54%	0.541	31%	0.307	S	S	.	.			trans	-93	142.7	177.8	-72.9	0	0	0	0	111.8	D99	D99-C101 VanDerWaalsContact C-N 3.27Å; D99-C101 PolarHBondContact O-N 3.37Å
102	V	67.9	Low	69.8	Low	48 Å²	48	56.5 Å²	56.5	29%	0.291	31%	0.309	S	S	.	.			trans	-80.8	121.3	-177.8	179.3	0	0	0	0	110.9	L94 F95 K104 L109	L94-V102 HydrophobicContact CB-CG1 4.38Å; F95-V102 HydrophobicContact CD1-CG2 4.24Å; F95-V102 HydrophobicContact CE1-CG2 3.57Å; F95-V102 HydrophobicContact CE2-CG2 4.47Å; F95-V102 HydrophobicContact CZ-CG2 3.7Å; V102-K104 PolarHBondContact O-N 2.88Å; V102-L109 HydrophobicContact CG1-CD2 4.37Å; V102-L109 HydrophobicContact CG2-CD2 4.27Å
103	R	58.1	Low	70.2	Confident	137 Å²	137	56 Å²	56	52%	0.517	31%	0.306	S	S	.	.			trans	-65.5	8.5	-174	-97.2	-173.6	157.4	108.2	12.7	117.7	L94 A96 D97	L94-R103 PolarHBondContact O-N 2.88Å; A96-R103 PolarHBondContact O-NH1 3.13Å; D97-R103 IonicContact OD1-CZ 3.92Å; D97-R103 IonicContact OD1-NH1 2.93Å; D97-R103 PolarHBondContact OD1-NH1 3.29Å; D97-R103 IonicContact OD1-NH2 3.26Å; D97-R103 PolarHBondContact OD1-NH2 3.4Å; D97-R103 IonicContact OD2-CZ 3.28Å; D97-R103 IonicContact OD2-NE 3.07Å; D97-R103 PolarHBondContact OD2-NE 3.44Å; D97-R103 IonicContact OD2-NH1 3.88Å; D97-R103 PolarHBondContact OD2-NH1 2.98Å; D97-R103 IonicContact OD2-NH2 2.99Å; D97-R103 PolarHBondContact OD2-NH2 3.1Å
104	K	54.5	Low	70.6	Confident	172 Å²	172	50.6 Å²	50.6	75%	0.748	28%	0.281	S	S	*	.	S	Bend	trans	95.9	163.8	-173.1	-62.6	176.8	175	172.5	0	115.5	V102	V102-K104 PolarHBondContact O-N 2.88Å
105	T	55.4	Low	71.2	Confident	95 Å²	95	49.2 Å²	49.2	58%	0.583	27%	0.273	S	S	*	.			trans	56.7	60.5	-171.2	28.1	0	0	0	0	114.2	H107	T105-H107 PolarHBondContact O-N 2.86Å
106	S	63.6	Low	72	Confident	40 Å²	40	49 Å²	49	28%	0.28	27%	0.273	S	S	.	.	H	α-helix	trans	-66.1	6.5	169.8	89	0	0	0	0	114	L109 N110	S106-L109 WeakPolarHBondContact O-CB 3.34Å; S106-L109 PolarHBondContact O-N 2.89Å; S106-N110 VanDerWaalsContact O-CB 3.26Å; S106-N110 WeakPolarHBondContact O-CB 3.33Å; S106-N110 PolarHBondContact O-N 2.71Å; S106-N110 PolarHBondContact O-OD1 3.02Å; S106-N110 PolarHBondContact OG-OD1 3.31Å; S106-N110 VanDerWaalsContact OG-OD1 3.1Å
107	H	75.9	Confident	73.1	Confident	81 Å²	81	49.4 Å²	49.4	38%	0.375	27%	0.267	S	S	.	.	H	α-helix	trans	-62.9	-45	177.9	-68.6	-57.1	0	0	0	112.5	T105 N110 I111	T105-H107 PolarHBondContact O-N 2.86Å; H107-N110 PolarHBondContact O-N 2.88Å; H107-I111 WeakPolarHBondContact O-CB 3.47Å; H107-I111 VanDerWaalsContact O-CD1 3.27Å; H107-I111 WeakPolarHBondContact O-CD1 3.42Å; H107-I111 WeakPolarHBondContact O-CG1 3.35Å; H107-I111 PolarHBondContact O-N 3.02Å
108	V	80.9	Confident	74.4	Confident	27 Å²	27	47.8 Å²	47.8	16%	0.164	26%	0.259	C	S	.	.	H	α-helix	trans	-60.9	-50.3	174.5	-179.6	0	0	0	0	109.6	L76 N110 I111 T112	L76-V108 HydrophobicContact CD1-CG2 3.77Å; L76-V108 HydrophobicContact CG-CG2 4.46Å; V108-N110 PolarHBondContact O-N 3.45Å; V108-I111 PolarHBondContact O-N 2.67Å; V108-T112 WeakPolarHBondContact O-CB 3.35Å; V108-T112 PolarHBondContact O-N 3.41Å; V108-T112 PolarHBondContact O-OG1 3.27Å
109	L	84.4	Confident	75.8	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-52.5	-50	177.1	-176.4	60	0	0	0	112.7	C91 L94 F95 V102 S106 L113 L159	C91-L109 HydrophobicContact CB-CD1 3.97Å; L94-L109 HydrophobicContact CD1-CB 3.95Å; F95-L109 HydrophobicContact CE2-CD1 4.02Å; F95-L109 HydrophobicContact CE2-CD2 3.86Å; F95-L109 HydrophobicContact CZ-CD2 3.88Å; V102-L109 HydrophobicContact CG1-CD2 4.37Å; V102-L109 HydrophobicContact CG2-CD2 4.27Å; S106-L109 WeakPolarHBondContact O-CB 3.34Å; S106-L109 PolarHBondContact O-N 2.89Å; L109-L113 HydrophobicContact CD1-CD1 3.6Å; L109-L113 HydrophobicContact CD1-CG 4.12Å; L109-L113 HydrophobicContact CG-CD1 4.02Å; L109-L113 VanDerWaalsContact O-CB 3.27Å; L109-L113 WeakPolarHBondContact O-CB 3.32Å; L109-L113 VanDerWaalsContact O-CG 3.26Å; L109-L113 WeakPolarHBondContact O-CG 3.24Å; L109-L113 PolarHBondContact O-N 3Å; L109-L159 HydrophobicContact CD1-CD1 3.36Å
110	N	86	Confident	77.1	Confident	26 Å²	26	40.3 Å²	40.3	14%	0.139	21%	0.207	C	C	.	.	H	α-helix	trans	-66.1	-41.6	178.5	-66.5	9.6	0	0	0	111.8	S106 H107 V108 T114 F167 Y418	S106-N110 VanDerWaalsContact O-CB 3.26Å; S106-N110 WeakPolarHBondContact O-CB 3.33Å; S106-N110 PolarHBondContact O-N 2.71Å; S106-N110 PolarHBondContact O-OD1 3.02Å; S106-N110 PolarHBondContact OG-OD1 3.31Å; S106-N110 VanDerWaalsContact OG-OD1 3.1Å; H107-N110 PolarHBondContact O-N 2.88Å; V108-N110 PolarHBondContact O-N 3.45Å; N110-T114 WeakPolarHBondContact O-CB 3.07Å; N110-T114 VanDerWaalsContact O-CG2 3.28Å; N110-T114 WeakPolarHBondContact O-CG2 3.16Å; N110-T114 PolarHBondContact O-N 2.77Å; N110-T114 VanDerWaalsContact O-N 3.1Å; N110-T114 PolarHBondContact O-OG1 3.01Å; N110-F167 HydrophobicContact CB-CZ 4.3Å; N110-Y418 HydrophobicContact CB-CE2 3.92Å; N110-Y418 WeakPolarHBondContact CB-OH 3.18Å; N110-Y418 PolarHBondContact ND2-OH 3.2Å; N110-Y418 VanDerWaalsContact ND2-OH 3.15Å
111	I	87.1	Confident	78.4	Confident	3 Å²	3	42.1 Å²	42.1	2%	0.015	22%	0.218	C	C	.	.	H	α-helix	trans	-62.7	-50.2	177.4	-69.3	160.2	0	0	0	109.3	L76 H107 V108 T114 M115 L414 Q415 Y418	L76-I111 HydrophobicContact CD1-CD1 4.21Å; H107-I111 WeakPolarHBondContact O-CB 3.47Å; H107-I111 VanDerWaalsContact O-CD1 3.27Å; H107-I111 WeakPolarHBondContact O-CD1 3.42Å; H107-I111 WeakPolarHBondContact O-CG1 3.35Å; H107-I111 PolarHBondContact O-N 3.02Å; V108-I111 PolarHBondContact O-N 2.67Å; I111-T114 PolarHBondContact O-N 2.84Å; I111-M115 HydrophobicContact CG2-CG 4.17Å; I111-M115 WeakPolarHBondContact O-CB 3.39Å; I111-M115 VanDerWaalsContact O-CG 3.31Å; I111-M115 WeakPolarHBondContact O-CG 3.5Å; I111-M115 PolarHBondContact O-N 3.41Å; I111-L414 HydrophobicContact CG2-CB 3.74Å; I111-Q415 HydrophobicContact CD1-CB 3.96Å; I111-Q415 HydrophobicContact CD1-CG 3.84Å; I111-Y418 HydrophobicContact CD1-CD1 4.29Å; I111-Y418 HydrophobicContact CG1-CD1 3.57Å; I111-Y418 HydrophobicContact CG1-CD2 4.15Å; I111-Y418 HydrophobicContact CG1-CE1 4.18Å; I111-Y418 HydrophobicContact CG1-CG 3.57Å
112	T	86.6	Confident	79.5	Confident	6 Å²	6	38.7 Å²	38.7	4%	0.037	20%	0.195	C	C	.	.	H	α-helix	trans	-59.7	-52.5	178.7	-56.4	0	0	0	0	111.5	W84 L87 V108 T114 H116	W84-T112 HydrophobicContact CZ3-CG2 4.02Å; L87-T112 HydrophobicContact CB-CG2 4.47Å; V108-T112 WeakPolarHBondContact O-CB 3.35Å; V108-T112 PolarHBondContact O-N 3.41Å; V108-T112 PolarHBondContact O-OG1 3.27Å; T112-T114 VanDerWaalsContact C-N 3.27Å; T112-T114 PolarHBondContact O-N 2.91Å; T112-H116 WeakPolarHBondContact O-CB 3.37Å; T112-H116 PolarHBondContact O-N 3.46Å; T112-H116 PolarHBondContact O-ND1 2.8Å
113	L	87.4	Confident	80.3	Confident	4 Å²	4	37.1 Å²	37.1	2%	0.021	19%	0.187	C	C	.	.	H	α-helix	trans	-74	-8.7	-175.9	-66.6	-179.7	0	0	0	115.3	L109 H116 L125 L159 W163 F167	L109-L113 HydrophobicContact CD1-CD1 3.6Å; L109-L113 HydrophobicContact CD1-CG 4.12Å; L109-L113 HydrophobicContact CG-CD1 4.02Å; L109-L113 VanDerWaalsContact O-CB 3.27Å; L109-L113 WeakPolarHBondContact O-CB 3.32Å; L109-L113 VanDerWaalsContact O-CG 3.26Å; L109-L113 WeakPolarHBondContact O-CG 3.24Å; L109-L113 PolarHBondContact O-N 3Å; L113-H116 PolarHBondContact O-CE1 3Å; L113-H116 VanDerWaalsContact O-CE1 3.3Å; L113-H116 PolarHBondContact O-ND1 2.87Å; L113-L125 HydrophobicContact CD2-CD2 4.47Å; L113-L159 HydrophobicContact CD1-CD1 4.1Å; L113-L159 HydrophobicContact CD2-CD1 4.32Å; L113-W163 HydrophobicContact CB-CG 4.44Å; L113-W163 HydrophobicContact CD1-CB 3.88Å; L113-W163 HydrophobicContact CD1-CG 4.15Å; L113-W163 HydrophobicContact CD2-CB 4.09Å; L113-W163 HydrophobicContact CD2-CD2 3.94Å; L113-W163 HydrophobicContact CD2-CE3 4.45Å; L113-W163 HydrophobicContact CD2-CG 3.76Å; L113-W163 HydrophobicContact CG-CG 4.34Å; L113-W163 PolarHBondContact O-NE1 3.26Å; L113-F167 HydrophobicContact CB-CD2 4.17Å; L113-F167 HydrophobicContact CB-CE2 4.18Å; L113-F167 HydrophobicContact CD1-CE2 4.46Å
114	T	86.1	Confident	81.6	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-110	-44.8	174.9	60.1	0	0	0	0	113.3	N110 I111 T112 F167 M170 F257 I261 Y418	N110-T114 WeakPolarHBondContact O-CB 3.07Å; N110-T114 VanDerWaalsContact O-CG2 3.28Å; N110-T114 WeakPolarHBondContact O-CG2 3.16Å; N110-T114 PolarHBondContact O-N 2.77Å; N110-T114 VanDerWaalsContact O-N 3.1Å; N110-T114 PolarHBondContact O-OG1 3.01Å; I111-T114 PolarHBondContact O-N 2.84Å; T112-T114 VanDerWaalsContact C-N 3.27Å; T112-T114 PolarHBondContact O-N 2.91Å; T114-F167 HydrophobicContact CG2-CD1 3.58Å; T114-F167 HydrophobicContact CG2-CE1 3.29Å; T114-F167 HydrophobicContact CG2-CE2 4.27Å; T114-F167 HydrophobicContact CG2-CG 4.19Å; T114-F167 HydrophobicContact CG2-CZ 3.68Å; T114-M170 HydrophobicContact CG2-CE 3.95Å; T114-F257 HydrophobicContact CG2-CE1 4.41Å; T114-I261 WeakPolarHBondContact O-CD1 3.43Å; T114-Y418 WeakPolarHBondContact OG1-CD2 3.35Å
115	M	88.9	Confident	83.1	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-86.3	-12.6	-169.8	-54.8	-57.2	-54.4	0	0	113.6	I111 R117 L118 F257 L414 L417 Y418 I421	I111-M115 HydrophobicContact CG2-CG 4.17Å; I111-M115 WeakPolarHBondContact O-CB 3.39Å; I111-M115 VanDerWaalsContact O-CG 3.31Å; I111-M115 WeakPolarHBondContact O-CG 3.5Å; I111-M115 PolarHBondContact O-N 3.41Å; M115-R117 PolarHBondContact O-N 3.27Å; M115-R117 VanDerWaalsContact O-N 3.11Å; M115-L118 HydrophobicContact CE-CD1 3.49Å; M115-L118 VanDerWaalsContact CE-CD1 3.49Å; M115-L118 HydrophobicContact CE-CG 4.3Å; M115-L118 WeakPolarHBondContact O-CB 3.44Å; M115-L118 PolarHBondContact O-N 3.03Å; M115-F257 HydrophobicContact SD-CE1 3.57Å; M115-F257 VanDerWaalsContact SD-CE1 3.57Å; M115-F257 HydrophobicContact SD-CZ 3.62Å; M115-L414 HydrophobicContact CB-CB 4.04Å; M115-L414 HydrophobicContact CB-CD1 4.32Å; M115-L414 HydrophobicContact CB-CD2 4.06Å; M115-L414 HydrophobicContact CB-CG 4.36Å; M115-L414 HydrophobicContact CG-CB 4.31Å; M115-L417 HydrophobicContact CE-CB 3.6Å; M115-L417 HydrophobicContact CE-CD1 4.41Å; M115-Y418 HydrophobicContact CG-CD2 4.36Å; M115-Y418 HydrophobicContact SD-CD2 4.31Å; M115-I421 HydrophobicContact CE-CD1 4.34Å; M115-I421 HydrophobicContact SD-CD1 4.48Å
116	H	88.8	Confident	84.5	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.117	C	C	.	.	G	3₁₀ helix	trans	-53	-33.6	176.5	68.8	-67.1	0	0	0	112.9	W84 T112 L113 L118 L119 M120 S122 L125 W163	W84-H116 HydrophobicContact CH2-CB 3.57Å; W84-H116 HydrophobicContact CZ2-CB 4.38Å; W84-H116 HydrophobicContact CZ3-CB 3.89Å; T112-H116 WeakPolarHBondContact O-CB 3.37Å; T112-H116 PolarHBondContact O-N 3.46Å; T112-H116 PolarHBondContact O-ND1 2.8Å; L113-H116 PolarHBondContact O-CE1 3Å; L113-H116 VanDerWaalsContact O-CE1 3.3Å; L113-H116 PolarHBondContact O-ND1 2.87Å; H116-L118 PolarHBondContact O-N 2.66Å; H116-L119 PolarHBondContact O-N 3.19Å; H116-M120 HydrophobicContact CB-CG 4.03Å; H116-M120 HydrophobicContact CB-SD 4.36Å; H116-M120 WeakPolarHBondContact O-CG 3.04Å; H116-M120 PolarHBondContact O-N 3.48Å; H116-M120 VanDerWaalsContact O-O 3.06Å; H116-S122 PolarHBondContact NE2-OG 3.19Å; H116-L125 HydrophobicContact CB-CD2 4.06Å; H116-L125 VanDerWaalsContact CD2-CD2 3.46Å; H116-L125 WeakPolarHBondContact CD2-CD2 3.49Å; H116-W163 AromaticContact CE1-CZ2 3.69Å; H116-W163 AromaticContact NE2-CZ2 3.55Å
117	R	86	Confident	85.4	Confident	40 Å²	40	22 Å²	22	15%	0.151	12%	0.117	C	C	.	.	G	3₁₀ helix	trans	-61.2	-9.7	177.6	-68.9	-173.3	69.2	-98.3	-1.7	115.6	M115 M120 I261 N262	M115-R117 PolarHBondContact O-N 3.27Å; M115-R117 VanDerWaalsContact O-N 3.11Å; R117-M120 VanDerWaalsContact CA-O 3.32Å; R117-M120 WeakPolarHBondContact CA-O 3.36Å; R117-I261 HydrophobicContact CB-CD1 4.31Å; R117-I261 HydrophobicContact CB-CG2 3.85Å; R117-N262 PolarHBondContact NH1-OD1 2.93Å; R117-N262 PolarHBondContact NH2-OD1 3.17Å
118	L	85.6	Confident	85.6	Confident	24 Å²	24	22.9 Å²	22.9	13%	0.126	12%	0.117	C	C	.	.	G	3₁₀ helix	trans	-75.1	-36.1	166.6	-71	176.6	0	0	0	112.2	M115 H116 I261 I264 L414 L417	M115-L118 HydrophobicContact CE-CD1 3.49Å; M115-L118 VanDerWaalsContact CE-CD1 3.49Å; M115-L118 HydrophobicContact CE-CG 4.3Å; M115-L118 WeakPolarHBondContact O-CB 3.44Å; M115-L118 PolarHBondContact O-N 3.03Å; H116-L118 PolarHBondContact O-N 2.66Å; L118-I261 HydrophobicContact CD2-CG2 3.84Å; L118-I261 HydrophobicContact CG-CG2 4.14Å; L118-I264 HydrophobicContact CD2-CB 4.07Å; L118-I264 HydrophobicContact CD2-CG2 3.73Å; L118-L414 HydrophobicContact CD1-CD2 4.17Å; L118-L417 HydrophobicContact CD1-CD1 3.73Å
119	L	86.9	Confident	85.6	Confident	34 Å²	34	21.7 Å²	21.7	18%	0.178	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.1	-22.2	-164.9	-55.3	-169.6	0	0	0	114.4	W84 H116 D402 V409 L414	W84-L119 HydrophobicContact CZ2-CB 4.08Å; W84-L119 HydrophobicContact CZ2-CD1 4.08Å; H116-L119 PolarHBondContact O-N 3.19Å; L119-D402 HydrophobicContact CD2-CB 3.55Å; L119-D402 WeakPolarHBondContact CD2-OD1 3.39Å; L119-V409 HydrophobicContact CD1-CG1 3.78Å; L119-V409 HydrophobicContact CD1-CG2 4.47Å; L119-L414 HydrophobicContact CD1-CD1 4.5Å; L119-L414 HydrophobicContact CD1-CD2 4.22Å
120	M	86.6	Confident	85.2	Confident	25 Å²	25	23 Å²	23	12%	0.123	12%	0.117	C	C	.	.	S	Bend	trans	-149.2	165.9	177.9	55.6	169.8	48.1	0	0	110.3	W84 H116 R117 D124 L125	W84-M120 HydrophobicContact CB-CE 4.29Å; W84-M120 HydrophobicContact CD2-CE 3.55Å; W84-M120 HydrophobicContact CD2-SD 4.06Å; W84-M120 HydrophobicContact CE3-CE 4.23Å; W84-M120 HydrophobicContact CE3-SD 4.18Å; W84-M120 HydrophobicContact CG-CE 3.52Å; W84-M120 HydrophobicContact CZ2-CE 4.46Å; W84-M120 HydrophobicContact CZ2-CG 4.37Å; W84-M120 HydrophobicContact CZ2-SD 4.43Å; W84-M120 HydrophobicContact CZ3-SD 4.44Å; H116-M120 HydrophobicContact CB-CG 4.03Å; H116-M120 HydrophobicContact CB-SD 4.36Å; H116-M120 WeakPolarHBondContact O-CG 3.04Å; H116-M120 PolarHBondContact O-N 3.48Å; H116-M120 VanDerWaalsContact O-O 3.06Å; R117-M120 VanDerWaalsContact CA-O 3.32Å; R117-M120 WeakPolarHBondContact CA-O 3.36Å; M120-D124 HydrophobicContact CB-CB 4.21Å; M120-L125 HydrophobicContact SD-CB 3.78Å; M120-L125 HydrophobicContact SD-CD1 4.06Å; M120-L125 HydrophobicContact SD-CG 4.46Å
121	S	86.8	Confident	84.6	Confident	43 Å²	43	27.1 Å²	27.1	30%	0.301	14%	0.139	S	C	.	.			trans	-77.3	164	169.6	77.3	0	0	0	0	111.4	S123 D124 L125	S121-S123 VanDerWaalsContact C-N 3.3Å; S121-S123 PolarHBondContact OG-N 3.23Å; S121-S123 PolarHBondContact OG-OG 2.95Å; S121-D124 WeakPolarHBondContact CA-OD2 3.33Å; S121-D124 WeakPolarHBondContact CB-OD2 3.49Å; S121-D124 PolarHBondContact N-OD2 3.3Å; S121-D124 PolarHBondContact O-N 3.05Å; S121-D124 PolarHBondContact OG-N 3.11Å; S121-D124 PolarHBondContact OG-OD1 3.47Å; S121-D124 PolarHBondContact OG-OD2 2.82Å; S121-L125 PolarHBondContact O-N 3.04Å
122	S	86.7	Confident	83.6	Confident	7 Å²	7	29.5 Å²	29.5	5%	0.049	15%	0.151	C	C	.	.	H	α-helix	trans	-69	-30	172.6	-65	0	0	0	0	112.5	H116 L125 L126	H116-S122 PolarHBondContact NE2-OG 3.19Å; S122-L125 PolarHBondContact O-N 2.74Å; S122-L126 WeakPolarHBondContact O-CB 3.12Å; S122-L126 PolarHBondContact O-N 3.5Å
123	S	84.2	Confident	82.4	Confident	16 Å²	16	30.9 Å²	30.9	11%	0.112	16%	0.156	C	C	.	.	H	α-helix	trans	-63.7	-48.6	171.1	28	0	0	0	0	109.8	S121 L125 L126 D127 S176	S121-S123 VanDerWaalsContact C-N 3.3Å; S121-S123 PolarHBondContact OG-N 3.23Å; S121-S123 PolarHBondContact OG-OG 2.95Å; S123-L125 PolarHBondContact O-N 3.42Å; S123-L125 VanDerWaalsContact O-N 3.13Å; S123-L126 CarbonylContact O-C 3.59Å; S123-L126 WeakPolarHBondContact O-CA 3.27Å; S123-L126 PolarHBondContact O-N 2.86Å; S123-D127 WeakPolarHBondContact O-CB 3.46Å; S123-D127 PolarHBondContact O-N 3.06Å; S123-S176 PolarHBondContact OG-OG 2.89Å
124	D	84.9	Confident	80.6	Confident	70 Å²	70	32.6 Å²	32.6	37%	0.374	17%	0.167	S	C	.	.	H	α-helix	trans	-58	-35	177.7	-48.9	-48.3	0	0	0	112.9	M120 S121 R128	M120-D124 HydrophobicContact CB-CB 4.21Å; S121-D124 WeakPolarHBondContact CA-OD2 3.33Å; S121-D124 WeakPolarHBondContact CB-OD2 3.49Å; S121-D124 PolarHBondContact N-OD2 3.3Å; S121-D124 PolarHBondContact O-N 3.05Å; S121-D124 PolarHBondContact OG-N 3.11Å; S121-D124 PolarHBondContact OG-OD1 3.47Å; S121-D124 PolarHBondContact OG-OD2 2.82Å; D124-R128 VanDerWaalsContact O-CB 3.26Å; D124-R128 WeakPolarHBondContact O-CB 3.33Å; D124-R128 VanDerWaalsContact O-CD 3.28Å; D124-R128 WeakPolarHBondContact O-CD 3.44Å; D124-R128 WeakPolarHBondContact O-CG 3.14Å; D124-R128 PolarHBondContact O-N 3.43Å
125	L	86.6	Confident	78.5	Confident	3 Å²	3	40.7 Å²	40.7	2%	0.016	20%	0.203	C	C	.	.	H	α-helix	trans	-69.6	-42.7	175	-179	60.4	0	0	0	112	I88 L113 H116 M120 S121 S122 S123 R128 L129 W163	I88-L125 HydrophobicContact CD1-CD1 3.86Å; I88-L125 HydrophobicContact CG1-CD1 4.07Å; L113-L125 HydrophobicContact CD2-CD2 4.47Å; H116-L125 HydrophobicContact CB-CD2 4.06Å; H116-L125 VanDerWaalsContact CD2-CD2 3.46Å; H116-L125 WeakPolarHBondContact CD2-CD2 3.49Å; M120-L125 HydrophobicContact SD-CB 3.78Å; M120-L125 HydrophobicContact SD-CD1 4.06Å; M120-L125 HydrophobicContact SD-CG 4.46Å; S121-L125 PolarHBondContact O-N 3.04Å; S122-L125 PolarHBondContact O-N 2.74Å; S123-L125 PolarHBondContact O-N 3.42Å; S123-L125 VanDerWaalsContact O-N 3.13Å; L125-R128 PolarHBondContact O-N 2.92Å; L125-L129 HydrophobicContact CG-CD1 4.49Å; L125-L129 WeakPolarHBondContact O-CG 3.47Å; L125-L129 PolarHBondContact O-N 3.01Å; L125-W163 HydrophobicContact CB-CH2 4.4Å; L125-W163 HydrophobicContact CD2-CH2 4.02Å; L125-W163 HydrophobicContact CD2-CZ2 4.19Å; L125-W163 HydrophobicContact CD2-CZ3 4.46Å; L125-W163 HydrophobicContact CG-CH2 4.38Å
126	L	84.3	Confident	76.3	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-67	-45.5	176.5	-178.6	55.8	0	0	0	110.7	S122 S123 R128 L129 I130 I160 W163 L177 L181	S122-L126 WeakPolarHBondContact O-CB 3.12Å; S122-L126 PolarHBondContact O-N 3.5Å; S123-L126 CarbonylContact O-C 3.59Å; S123-L126 WeakPolarHBondContact O-CA 3.27Å; S123-L126 PolarHBondContact O-N 2.86Å; L126-R128 PolarHBondContact O-N 2.86Å; L126-L129 CarbonylContact O-C 3.58Å; L126-L129 WeakPolarHBondContact O-CA 3.28Å; L126-L129 WeakPolarHBondContact O-CB 3.47Å; L126-L129 PolarHBondContact O-N 3.46Å; L126-I130 HydrophobicContact CD1-CD1 4.2Å; L126-I130 HydrophobicContact CD1-CG1 4.36Å; L126-I130 HydrophobicContact CG-CD1 3.86Å; L126-I130 HydrophobicContact CG-CG1 4.49Å; L126-I130 VanDerWaalsContact O-CG1 3.25Å; L126-I130 WeakPolarHBondContact O-CG1 3.38Å; L126-I130 PolarHBondContact O-N 3.12Å; L126-I160 HydrophobicContact CD1-CD1 3.77Å; L126-I160 HydrophobicContact CD1-CG1 4.31Å; L126-W163 HydrophobicContact CB-CZ3 4.29Å; L126-L177 HydrophobicContact CB-CD1 4.2Å; L126-L177 HydrophobicContact CD2-CD1 3.84Å; L126-L181 HydrophobicContact CD2-CB 3.88Å; L126-L181 HydrophobicContact CD2-CD1 4.3Å
127	D	82.2	Confident	74.2	Confident	53 Å²	53	53.2 Å²	53.2	28%	0.283	26%	0.257	S	S	.	.	H	α-helix	trans	-60.8	-32.6	174.7	-57.8	-21	0	0	0	111	S123 N131 S180	S123-D127 WeakPolarHBondContact O-CB 3.46Å; S123-D127 PolarHBondContact O-N 3.06Å; D127-N131 WeakPolarHBondContact O-CB 3.34Å; D127-N131 PolarHBondContact O-N 3.27Å; D127-N131 PolarHBondContact O-ND2 3.31Å; D127-S180 VanDerWaalsContact OD1-CB 3.3Å; D127-S180 WeakPolarHBondContact OD1-CB 3.38Å; D127-S180 PolarHBondContact OD1-OG 3.44Å
128	R	81.4	Confident	71.8	Confident	99 Å²	99	57.7 Å²	57.7	37%	0.374	29%	0.289	S	S	.	.	H	α-helix	trans	-71.7	-36.6	171.4	-79.3	165.1	171	-85.2	-0.6	113.3	E85 I88 D124 L125 L126 N131 L132	E85-R128 IonicContact OE1-CZ 3.86Å; E85-R128 IonicContact OE1-NH1 2.67Å; E85-R128 PolarHBondContact OE1-NH1 3.38Å; I88-R128 HydrophobicContact CD1-CB 4.13Å; D124-R128 VanDerWaalsContact O-CB 3.26Å; D124-R128 WeakPolarHBondContact O-CB 3.33Å; D124-R128 VanDerWaalsContact O-CD 3.28Å; D124-R128 WeakPolarHBondContact O-CD 3.44Å; D124-R128 WeakPolarHBondContact O-CG 3.14Å; D124-R128 PolarHBondContact O-N 3.43Å; L125-R128 PolarHBondContact O-N 2.92Å; L126-R128 PolarHBondContact O-N 2.86Å; R128-N131 CarbonylContact O-C 3.53Å; R128-N131 PolarHBondContact O-N 3.17Å; R128-L132 WeakPolarHBondContact O-CG 3.19Å; R128-L132 PolarHBondContact O-N 2.92Å; R128-L132 VanDerWaalsContact O-N 3.09Å
129	L	80.7	Confident	69.4	Low	2 Å²	2	63.1 Å²	63.1	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-64.4	-43.2	170.7	-74.6	161	0	0	0	111.1	I88 L125 L126 L132 L159 I160	I88-L129 HydrophobicContact CG2-CD2 3.5Å; I88-L129 HydrophobicContact CG2-CG 4.44Å; L125-L129 HydrophobicContact CG-CD1 4.49Å; L125-L129 WeakPolarHBondContact O-CG 3.47Å; L125-L129 PolarHBondContact O-N 3.01Å; L126-L129 CarbonylContact O-C 3.58Å; L126-L129 WeakPolarHBondContact O-CA 3.28Å; L126-L129 WeakPolarHBondContact O-CB 3.47Å; L126-L129 PolarHBondContact O-N 3.46Å; L129-L132 PolarHBondContact O-N 2.93Å; L129-L159 HydrophobicContact CD2-CD2 3.65Å; L129-I160 HydrophobicContact CD1-CG1 4.28Å
130	I	75.9	Confident	67	Low	28 Å²	28	64.3 Å²	64.3	14%	0.144	33%	0.326	C	S	.	.	H	α-helix	trans	-65.4	-38.6	174.4	-61.9	162.2	0	0	0	110.4	L126 L132 Y133 P134 S180 F184	L126-I130 HydrophobicContact CD1-CD1 4.2Å; L126-I130 HydrophobicContact CD1-CG1 4.36Å; L126-I130 HydrophobicContact CG-CD1 3.86Å; L126-I130 HydrophobicContact CG-CG1 4.49Å; L126-I130 VanDerWaalsContact O-CG1 3.25Å; L126-I130 WeakPolarHBondContact O-CG1 3.38Å; L126-I130 PolarHBondContact O-N 3.12Å; I130-L132 PolarHBondContact O-N 3.04Å; I130-Y133 WeakPolarHBondContact O-CB 3.47Å; I130-Y133 PolarHBondContact O-N 2.76Å; I130-P134 WeakPolarHBondContact O-CD 3.48Å; I130-S180 WeakPolarHBondContact CD1-O 3.31Å; I130-F184 HydrophobicContact CD1-CB 3.8Å; I130-F184 HydrophobicContact CD1-CD2 4.4Å; I130-F184 HydrophobicContact CD1-CG 4.2Å; I130-F184 HydrophobicContact CG1-CB 4.1Å; I130-F184 HydrophobicContact CG1-CD2 3.76Å; I130-F184 HydrophobicContact CG1-CE2 4.36Å; I130-F184 HydrophobicContact CG1-CG 3.93Å; I130-F184 HydrophobicContact CG2-CD2 4.35Å
131	N	72.6	Confident	64.5	Low	112 Å²	112	72.9 Å²	72.9	60%	0.599	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	5.7	176.1	-76.8	-72	0	0	0	114.6	D127 R128 P134	D127-N131 WeakPolarHBondContact O-CB 3.34Å; D127-N131 PolarHBondContact O-N 3.27Å; D127-N131 PolarHBondContact O-ND2 3.31Å; R128-N131 CarbonylContact O-C 3.53Å; R128-N131 PolarHBondContact O-N 3.17Å; N131-P134 VanDerWaalsContact C-CD 3.44Å
132	L	67.7	Low	61.9	Low	53 Å²	53	80.6 Å²	80.6	28%	0.277	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-27.5	160.6	-73.3	163.6	0	0	0	112.6	I88 R128 L129 I130 P134 F135	I88-L132 HydrophobicContact CB-CD1 4.19Å; I88-L132 HydrophobicContact CD1-CD1 4.39Å; I88-L132 HydrophobicContact CG2-CD1 3.43Å; I88-L132 VanDerWaalsContact CG2-CD1 3.43Å; R128-L132 WeakPolarHBondContact O-CG 3.19Å; R128-L132 PolarHBondContact O-N 2.92Å; R128-L132 VanDerWaalsContact O-N 3.09Å; L129-L132 PolarHBondContact O-N 2.93Å; I130-L132 PolarHBondContact O-N 3.04Å; L132-P134 VanDerWaalsContact C-CD 3.42Å; L132-P134 VanDerWaalsContact C-N 3.27Å; L132-F135 PolarHBondContact O-N 3.33Å
133	Y	60	Low	59.4	Low	36 Å²	36	84.9 Å²	84.9	14%	0.141	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-48.3	-38	169.3	-163.7	-90.4	0	0	0	113.8	I130 T136 C153 F184 L187 L188	I130-Y133 WeakPolarHBondContact O-CB 3.47Å; I130-Y133 PolarHBondContact O-N 2.76Å; Y133-T136 PolarHBondContact O-OG1 3.39Å; Y133-C153 HydrophobicContact CE2-CB 4.11Å; Y133-C153 WeakPolarHBondContact CE2-SG 3.42Å; Y133-F184 HydrophobicContact CD2-CE2 4.19Å; Y133-F184 HydrophobicContact CE2-CE2 4.39Å; Y133-L187 HydrophobicContact CD1-CD2 4.1Å; Y133-L187 HydrophobicContact CE1-CD2 3.59Å; Y133-L188 HydrophobicContact CE2-CD2 4.15Å
134	P	49.3	Very low	57.1	Low	39 Å²	39	87 Å²	87	25%	0.253	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-93.1	13.2	176	39.3	-40.3	0	0	0	115.2	I130 N131 L132 T136 R137	I130-P134 WeakPolarHBondContact O-CD 3.48Å; N131-P134 VanDerWaalsContact C-CD 3.44Å; L132-P134 VanDerWaalsContact C-CD 3.42Å; L132-P134 VanDerWaalsContact C-N 3.27Å; P134-T136 PolarHBondContact O-N 3.18Å; P134-R137 HydrophobicContact CB-CB 3.91Å; P134-R137 WeakPolarHBondContact O-CA 3.39Å; P134-R137 WeakPolarHBondContact O-CB 3.47Å; P134-R137 PolarHBondContact O-N 2.96Å
135	F	42.9	Very low	54.8	Low	170 Å²	170	91.3 Å²	91.3	75%	0.746	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-67	-19.1	169.2	-154.4	-96.5	0	0	0	111.7	L132 R137	L132-F135 PolarHBondContact O-N 3.33Å; F135-R137 VanDerWaalsContact C-N 3.32Å
136	T	43.1	Very low	52.3	Low	61 Å²	61	97.8 Å²	97.8	37%	0.374	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-71.1	-18.7	164.3	56.3	0	0	0	0	113.5	Y133 P134 T138 L139 T140	Y133-T136 PolarHBondContact O-OG1 3.39Å; P134-T136 PolarHBondContact O-N 3.18Å; T136-T138 VanDerWaalsContact C-N 3.3Å; T136-T138 PolarHBondContact O-N 2.99Å; T136-L139 PolarHBondContact O-N 2.99Å; T136-T140 PolarHBondContact O-OG1 3.41Å
137	R	44.1	Very low	50	Low	203 Å²	203	104.2 Å²	104.2	77%	0.766	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-24.7	-171.3	-163.7	172.6	-176.4	163	3.3	114	P134 F135	P134-R137 HydrophobicContact CB-CB 3.91Å; P134-R137 WeakPolarHBondContact O-CA 3.39Å; P134-R137 WeakPolarHBondContact O-CB 3.47Å; P134-R137 PolarHBondContact O-N 2.96Å; F135-R137 VanDerWaalsContact C-N 3.32Å
138	T	35	Very low	48.3	Very low	134 Å²	134	108.9 Å²	108.9	82%	0.822	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-15.6	-175	-39.3	0	0	0	0	113.7	T136	T136-T138 VanDerWaalsContact C-N 3.3Å; T136-T138 PolarHBondContact O-N 2.99Å
139	L	36.7	Very low	46.9	Very low	138 Å²	138	109.4 Å²	109.4	72%	0.723	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.2	-10.1	-171.3	-116.6	164.4	0	0	0	114.8	T136 T143	T136-L139 PolarHBondContact O-N 2.99Å; L139-T143 PolarHBondContact O-OG1 3.29Å
140	T	35.3	Very low	45.8	Very low	58 Å²	58	111.7 Å²	111.7	36%	0.356	57%	0.573	S	S	.	*			trans	-132.7	20.2	-168.3	37	0	0	0	0	117.1	T136 K142 A144	T136-T140 PolarHBondContact O-OG1 3.41Å; T140-K142 PolarHBondContact O-N 2.93Å; T140-A144 HydrophobicContact CG2-CB 3.7Å
141	F	35.3	Very low	45.3	Very low	206 Å²	206	112.4 Å²	112.4	90%	0.904	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	11.8	161.3	-133.7	-86.5	0	0	0	113.9
142	K	31.4	Very low	44.9	Very low	205 Å²	205	111.4 Å²	111.4	89%	0.891	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145.2	7.7	175.8	-130.3	175.4	-173.5	177.6	0	114.8	T140	T140-K142 PolarHBondContact O-N 2.93Å
143	T	33.2	Very low	45.1	Very low	96 Å²	96	109.9 Å²	109.9	59%	0.589	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-154.1	0.6	-159.4	9.1	0	0	0	0	115.1	L139	L139-T143 PolarHBondContact O-OG1 3.29Å
144	A	36.1	Very low	45.8	Very low	60 Å²	60	110.4 Å²	110.4	50%	0.496	57%	0.572	S	S	.	*			trans	-113.3	57.9	174.2	0	0	0	0	0	112.4	T140	T140-A144 HydrophobicContact CG2-CB 3.7Å
145	L	36.4	Very low	47	Very low	162 Å²	162	112 Å²	112	85%	0.848	57%	0.573	S	S	*	*	S	Bend	trans	-94.8	-18	160.6	-143.1	74.7	0	0	0	112
146	D	34.7	Very low	48.8	Very low	139 Å²	139	104.4 Å²	104.4	74%	0.743	54%	0.54	S	S	*	.	S	Bend	trans	-134.2	18	-161.3	-59.7	-69.3	0	0	0	115.6
147	N	37	Very low	50.5	Low	135 Å²	135	101.5 Å²	101.5	72%	0.722	52%	0.523	S	S	*	.			trans	-142.5	129.4	177.1	-84.9	-80.5	0	0	0	114.2	Q149	N147-Q149 PolarHBondContact O-N 3.43Å
148	D	46.6	Very low	52.4	Low	151 Å²	151	93.6 Å²	93.6	81%	0.807	49%	0.493	S	S	*	.			trans	-65	120.5	175.4	-89	-56.3	0	0	0	112.6
149	Q	51.3	Low	54.7	Low	109 Å²	109	87.4 Å²	87.4	51%	0.509	46%	0.455	S	S	.	.			trans	-118.4	25.6	170	-77.1	-71.2	-4.3	0	0	115.9	N147 A151	N147-Q149 PolarHBondContact O-N 3.43Å; Q149-A151 VanDerWaalsContact C-N 3.26Å; Q149-A151 PolarHBondContact O-N 2.84Å
150	P	58.2	Low	57	Low	51 Å²	51	80.8 Å²	80.8	33%	0.331	42%	0.42	S	S	.	.	H	α-helix	trans	-69.8	-23.5	179.8	31.7	-35.5	0	0	0	113.2	E152 Q154	P150-E152 PolarHBondContact O-N 3.39Å; P150-Q154 WeakPolarHBondContact O-CB 3.46Å; P150-Q154 VanDerWaalsContact O-CG 3.28Å; P150-Q154 WeakPolarHBondContact O-CG 3.44Å; P150-Q154 PolarHBondContact O-N 2.84Å
151	A	63.8	Low	59.3	Low	42 Å²	42	80.5 Å²	80.5	35%	0.347	41%	0.413	S	S	.	.	H	α-helix	trans	-67.8	-33	-169.7	0	0	0	0	0	114.1	Q149 R155	Q149-A151 VanDerWaalsContact C-N 3.26Å; Q149-A151 PolarHBondContact O-N 2.84Å; A151-R155 VanDerWaalsContact O-CG 3.28Å; A151-R155 WeakPolarHBondContact O-CG 3.35Å; A151-R155 PolarHBondContact O-N 3.44Å
152	E	65.9	Low	61.6	Low	91 Å²	91	72 Å²	72	43%	0.425	38%	0.376	S	S	.	.	H	α-helix	trans	-79	-40.9	-179.2	-59.5	-161.3	153.9	0	0	111.7	P150 Q154 R155 I156	P150-E152 PolarHBondContact O-N 3.39Å; E152-Q154 VanDerWaalsContact C-N 3.28Å; E152-Q154 PolarHBondContact O-N 2.99Å; E152-R155 PolarHBondContact O-N 2.88Å; E152-R155 VanDerWaalsContact O-N 3.15Å; E152-I156 WeakPolarHBondContact O-CG1 3.44Å; E152-I156 PolarHBondContact O-N 3.43Å
153	C	70.3	Confident	64.2	Low	21 Å²	21	62.3 Å²	62.3	14%	0.142	33%	0.333	C	S	.	.	H	α-helix	trans	-58.3	-41.6	170.1	-57.6	0	0	0	0	111.5	Y133 I156 C157 L196	Y133-C153 HydrophobicContact CE2-CB 4.11Å; Y133-C153 WeakPolarHBondContact CE2-SG 3.42Å; C153-I156 PolarHBondContact O-N 2.98Å; C153-C157 PolarHBondContact O-N 3.03Å; C153-C157 PolarHBondContact O-SG 3.41Å; C153-L196 HydrophobicContact CB-CD1 4.36Å
154	Q	74.4	Confident	66.6	Low	48 Å²	48	57.9 Å²	57.9	22%	0.224	31%	0.306	C	S	.	.	H	α-helix	trans	-61.5	-45	173.3	-78.6	169.4	-5.5	0	0	112.4	P150 E152 I156 C157 Y158 L196	P150-Q154 WeakPolarHBondContact O-CB 3.46Å; P150-Q154 VanDerWaalsContact O-CG 3.28Å; P150-Q154 WeakPolarHBondContact O-CG 3.44Å; P150-Q154 PolarHBondContact O-N 2.84Å; E152-Q154 VanDerWaalsContact C-N 3.28Å; E152-Q154 PolarHBondContact O-N 2.99Å; Q154-I156 PolarHBondContact O-N 3.03Å; Q154-C157 PolarHBondContact O-N 3.11Å; Q154-Y158 HydrophobicContact CB-CD2 4.48Å; Q154-Y158 HydrophobicContact CB-CE2 4.09Å; Q154-Y158 WeakPolarHBondContact O-CD2 3.45Å; Q154-Y158 PolarHBondContact O-N 3.39Å; Q154-L196 HydrophobicContact CG-CD1 4.24Å; Q154-L196 HydrophobicContact CG-CD2 3.78Å
155	R	76.4	Confident	68.7	Low	73 Å²	73	58.2 Å²	58.2	28%	0.275	30%	0.297	S	S	.	.	H	α-helix	trans	-60.1	-43.8	175.6	-73.9	166	-171.2	165.9	0	112.6	L92 F95 A151 E152 C157 Y158 L159	L92-R155 HydrophobicContact CD2-CB 4.22Å; F95-R155 HydrophobicContact CB-CG 4.38Å; A151-R155 VanDerWaalsContact O-CG 3.28Å; A151-R155 WeakPolarHBondContact O-CG 3.35Å; A151-R155 PolarHBondContact O-N 3.44Å; E152-R155 PolarHBondContact O-N 2.88Å; E152-R155 VanDerWaalsContact O-N 3.15Å; R155-C157 VanDerWaalsContact C-N 3.33Å; R155-C157 PolarHBondContact O-N 3.02Å; R155-Y158 PolarHBondContact O-N 3.09Å; R155-L159 WeakPolarHBondContact O-CB 3.47Å; R155-L159 PolarHBondContact O-N 3.19Å
156	I	79.1	Confident	70.7	Confident	10 Å²	10	55.5 Å²	55.5	5%	0.051	28%	0.28	C	S	.	.	H	α-helix	trans	-60.8	-44.8	175.1	-65.8	167.4	0	0	0	110	L92 E152 C153 Q154 Y158 L159 I160 F184	L92-I156 HydrophobicContact CD1-CG1 4.24Å; L92-I156 HydrophobicContact CD2-CB 4.33Å; L92-I156 HydrophobicContact CD2-CG1 3.7Å; E152-I156 WeakPolarHBondContact O-CG1 3.44Å; E152-I156 PolarHBondContact O-N 3.43Å; C153-I156 PolarHBondContact O-N 2.98Å; Q154-I156 PolarHBondContact O-N 3.03Å; I156-Y158 PolarHBondContact O-N 3.24Å; I156-L159 PolarHBondContact O-N 3.26Å; I156-I160 HydrophobicContact CG2-CD1 3.78Å; I156-I160 WeakPolarHBondContact O-CG1 3.09Å; I156-I160 PolarHBondContact O-N 3.39Å; I156-F184 HydrophobicContact CG2-CZ 4.21Å
157	C	80.4	Confident	72.8	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-66.1	-35.4	177.5	-65.3	0	0	0	0	113.1	C153 Q154 R155 R161 L196 L199 L200	C153-C157 PolarHBondContact O-N 3.03Å; C153-C157 PolarHBondContact O-SG 3.41Å; Q154-C157 PolarHBondContact O-N 3.11Å; R155-C157 VanDerWaalsContact C-N 3.33Å; R155-C157 PolarHBondContact O-N 3.02Å; C157-R161 VanDerWaalsContact O-CB 3.23Å; C157-R161 WeakPolarHBondContact O-CB 3.28Å; C157-R161 PolarHBondContact O-N 3.43Å; C157-L196 HydrophobicContact CB-CB 4.44Å; C157-L199 HydrophobicContact CB-CD1 4.32Å; C157-L200 HydrophobicContact CB-CD2 4.34Å
158	Y	82.9	Confident	74.8	Confident	36 Å²	36	44.9 Å²	44.9	14%	0.141	22%	0.221	C	C	.	.	H	α-helix	trans	-70.2	-37.7	173.6	-67.3	-44.9	0	0	0	112.9	A98 Q154 R155 I156 R161 H162 L199	A98-Y158 PolarHBondContact O-OH 2.98Å; Q154-Y158 HydrophobicContact CB-CD2 4.48Å; Q154-Y158 HydrophobicContact CB-CE2 4.09Å; Q154-Y158 WeakPolarHBondContact O-CD2 3.45Å; Q154-Y158 PolarHBondContact O-N 3.39Å; R155-Y158 PolarHBondContact O-N 3.09Å; I156-Y158 PolarHBondContact O-N 3.24Å; Y158-R161 PolarHBondContact O-N 3.33Å; Y158-H162 WeakPolarHBondContact O-CB 3.35Å; Y158-H162 PolarHBondContact O-N 2.76Å; Y158-L199 HydrophobicContact CD1-CD1 4.06Å; Y158-L199 HydrophobicContact CE1-CD1 3.71Å; Y158-L199 HydrophobicContact CE1-CD2 4.47Å
159	L	84	Confident	76	Confident	4 Å²	4	40.2 Å²	40.2	2%	0.021	20%	0.195	C	C	.	.	H	α-helix	trans	-62.3	-48.2	173.1	173.1	59.3	0	0	0	111.2	C91 L92 F95 L109 L113 L129 R155 I156 H162 W163	C91-L159 HydrophobicContact CB-CD1 4.26Å; C91-L159 HydrophobicContact CB-CD2 4.3Å; L92-L159 HydrophobicContact CD2-CB 4.11Å; L92-L159 HydrophobicContact CD2-CD2 3.58Å; L92-L159 HydrophobicContact CD2-CG 4.5Å; L92-L159 HydrophobicContact CG-CD2 3.99Å; F95-L159 HydrophobicContact CD2-CB 4.27Å; F95-L159 HydrophobicContact CE2-CB 4.1Å; F95-L159 HydrophobicContact CE2-CD1 3.81Å; F95-L159 HydrophobicContact CZ-CD1 4.47Å; L109-L159 HydrophobicContact CD1-CD1 3.36Å; L113-L159 HydrophobicContact CD1-CD1 4.1Å; L113-L159 HydrophobicContact CD2-CD1 4.32Å; L129-L159 HydrophobicContact CD2-CD2 3.65Å; R155-L159 WeakPolarHBondContact O-CB 3.47Å; R155-L159 PolarHBondContact O-N 3.19Å; I156-L159 PolarHBondContact O-N 3.26Å; L159-H162 PolarHBondContact O-N 3.34Å; L159-W163 PolarHBondContact O-N 3.4Å
160	I	83.4	Confident	77.1	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-66.3	-42.6	177.2	-61.9	165.7	0	0	0	110.4	L126 L129 I156 H162 W163 I164 L181 F184 L200	L126-I160 HydrophobicContact CD1-CD1 3.77Å; L126-I160 HydrophobicContact CD1-CG1 4.31Å; L129-I160 HydrophobicContact CD1-CG1 4.28Å; I156-I160 HydrophobicContact CG2-CD1 3.78Å; I156-I160 WeakPolarHBondContact O-CG1 3.09Å; I156-I160 PolarHBondContact O-N 3.39Å; I160-H162 VanDerWaalsContact C-N 3.3Å; I160-H162 PolarHBondContact O-N 2.77Å; I160-W163 WeakPolarHBondContact O-CB 3.3Å; I160-W163 PolarHBondContact O-N 3.48Å; I160-W163 VanDerWaalsContact O-N 3.15Å; I160-I164 HydrophobicContact CG2-CD1 3.82Å; I160-I164 HydrophobicContact CG2-CG1 4.24Å; I160-I164 VanDerWaalsContact O-CG1 3.28Å; I160-I164 WeakPolarHBondContact O-CG1 3.47Å; I160-I164 PolarHBondContact O-N 3.01Å; I160-L181 HydrophobicContact CG2-CD1 4.02Å; I160-F184 HydrophobicContact CD1-CD1 4.17Å; I160-F184 HydrophobicContact CD1-CE1 3.73Å; I160-L200 HydrophobicContact CB-CD2 3.8Å; I160-L200 HydrophobicContact CG2-CD2 3.69Å
161	R	85.1	Confident	77.9	Confident	52 Å²	52	34.4 Å²	34.4	20%	0.196	16%	0.163	C	C	.	.	H	α-helix	trans	-53.7	-46.4	172.2	178.1	178.2	64.7	82.8	-7.4	111.4	G100 C157 Y158 I164 Q165 L199	G100-R161 PolarHBondContact O-NH2 2.93Å; G100-R161 VanDerWaalsContact O-NH2 3.09Å; C157-R161 VanDerWaalsContact O-CB 3.23Å; C157-R161 WeakPolarHBondContact O-CB 3.28Å; C157-R161 PolarHBondContact O-N 3.43Å; Y158-R161 PolarHBondContact O-N 3.33Å; R161-I164 PolarHBondContact O-N 2.96Å; R161-Q165 HydrophobicContact CG-CG 4.25Å; R161-Q165 VanDerWaalsContact O-CB 3.25Å; R161-Q165 WeakPolarHBondContact O-CB 3.26Å; R161-Q165 VanDerWaalsContact O-CG 3.24Å; R161-Q165 WeakPolarHBondContact O-CG 3.2Å; R161-Q165 PolarHBondContact O-N 3.29Å; R161-L199 WeakPolarHBondContact CB-O 3.12Å; R161-L199 WeakPolarHBondContact CG-O 3.04Å
162	H	83.7	Confident	78.1	Confident	28 Å²	28	38.1 Å²	38.1	13%	0.13	17%	0.168	C	C	.	.	H	α-helix	trans	-65.4	-41.6	178.2	-178.9	72.3	0	0	0	112.1	F95 Y158 L159 I160 I164 Q165 E166	F95-H162 HydrophobicContact CE1-CB 4.02Å; F95-H162 HydrophobicContact CZ-CB 3.69Å; F95-H162 AromaticContact CZ-CG 3.93Å; Y158-H162 WeakPolarHBondContact O-CB 3.35Å; Y158-H162 PolarHBondContact O-N 2.76Å; L159-H162 PolarHBondContact O-N 3.34Å; I160-H162 VanDerWaalsContact C-N 3.3Å; I160-H162 PolarHBondContact O-N 2.77Å; H162-I164 PolarHBondContact O-N 3.11Å; H162-Q165 PolarHBondContact O-N 3.46Å; H162-E166 VanDerWaalsContact CE1-CG 3.41Å; H162-E166 WeakPolarHBondContact CE1-CG 3.49Å; H162-E166 PolarHBondContact O-N 3.22Å
163	W	85.4	Confident	77.6	Confident	1 Å²	1	39.2 Å²	39.2	0%	0.004	18%	0.176	C	C	.	.	H	α-helix	trans	-60.4	-44.9	175.9	-172.1	24.2	0	0	0	112	L113 H116 L125 L126 L159 I160 F167 F171 L177	L113-W163 HydrophobicContact CB-CG 4.44Å; L113-W163 HydrophobicContact CD1-CB 3.88Å; L113-W163 HydrophobicContact CD1-CG 4.15Å; L113-W163 HydrophobicContact CD2-CB 4.09Å; L113-W163 HydrophobicContact CD2-CD2 3.94Å; L113-W163 HydrophobicContact CD2-CE3 4.45Å; L113-W163 HydrophobicContact CD2-CG 3.76Å; L113-W163 HydrophobicContact CG-CG 4.34Å; L113-W163 PolarHBondContact O-NE1 3.26Å; H116-W163 AromaticContact CE1-CZ2 3.69Å; H116-W163 AromaticContact NE2-CZ2 3.55Å; L125-W163 HydrophobicContact CB-CH2 4.4Å; L125-W163 HydrophobicContact CD2-CH2 4.02Å; L125-W163 HydrophobicContact CD2-CZ2 4.19Å; L125-W163 HydrophobicContact CD2-CZ3 4.46Å; L125-W163 HydrophobicContact CG-CH2 4.38Å; L126-W163 HydrophobicContact CB-CZ3 4.29Å; L159-W163 PolarHBondContact O-N 3.4Å; I160-W163 WeakPolarHBondContact O-CB 3.3Å; I160-W163 PolarHBondContact O-N 3.48Å; I160-W163 VanDerWaalsContact O-N 3.15Å; W163-F167 CarbonylContact O-C 3.58Å; W163-F167 WeakPolarHBondContact O-CA 3.48Å; W163-F167 WeakPolarHBondContact O-CB 3.22Å; W163-F167 PolarHBondContact O-N 2.84Å; W163-F171 AromaticContact CD2-CE2 3.88Å; W163-F171 HydrophobicContact CD2-CE2 3.88Å; W163-F171 AromaticContact CD2-CZ 3.6Å; W163-F171 HydrophobicContact CD2-CZ 3.6Å; W163-F171 HydrophobicContact CE3-CE2 4.4Å; W163-F171 AromaticContact CE3-CZ 3.65Å; W163-F171 HydrophobicContact CE3-CZ 3.65Å; W163-F171 AromaticContact CG-CE2 3.91Å; W163-F171 HydrophobicContact CG-CE2 3.91Å; W163-F171 HydrophobicContact CG-CZ 4.01Å; W163-F171 HydrophobicContact CH2-CZ 4.45Å; W163-F171 HydrophobicContact CZ2-CZ 4.42Å; W163-F171 HydrophobicContact CZ3-CZ 4.1Å; W163-L177 HydrophobicContact CH2-CD1 4.22Å
164	I	82.8	Confident	77.3	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.01	18%	0.184	C	C	.	.	H	α-helix	trans	-63.9	-46.2	173.3	-59.4	167.7	0	0	0	109.9	I160 R161 H162 W168 F171 L181 T202 W204 I205	I160-I164 HydrophobicContact CG2-CD1 3.82Å; I160-I164 HydrophobicContact CG2-CG1 4.24Å; I160-I164 VanDerWaalsContact O-CG1 3.28Å; I160-I164 WeakPolarHBondContact O-CG1 3.47Å; I160-I164 PolarHBondContact O-N 3.01Å; R161-I164 PolarHBondContact O-N 2.96Å; H162-I164 PolarHBondContact O-N 3.11Å; I164-W168 VanDerWaalsContact O-CA 3.25Å; I164-W168 WeakPolarHBondContact O-CA 3.18Å; I164-W168 VanDerWaalsContact O-CB 3.25Å; I164-W168 WeakPolarHBondContact O-CB 3.21Å; I164-W168 PolarHBondContact O-N 3Å; I164-W168 VanDerWaalsContact O-N 3.09Å; I164-F171 HydrophobicContact CB-CE2 4.27Å; I164-F171 HydrophobicContact CG1-CD1 4.31Å; I164-F171 HydrophobicContact CG1-CD2 4.2Å; I164-F171 HydrophobicContact CG1-CE1 3.85Å; I164-F171 HydrophobicContact CG1-CE2 3.74Å; I164-F171 HydrophobicContact CG1-CG 4.47Å; I164-F171 HydrophobicContact CG1-CZ 3.54Å; I164-L181 HydrophobicContact CD1-CD2 4.09Å; I164-T202 HydrophobicContact CD1-CG2 4.35Å; I164-T202 HydrophobicContact CG2-CG2 4.36Å; I164-W204 HydrophobicContact CG2-CH2 3.82Å; I164-W204 HydrophobicContact CG2-CZ2 3.55Å; I164-W204 WeakPolarHBondContact O-CH2 3.47Å; I164-I205 HydrophobicContact CG2-CD1 3.91Å; I164-I205 HydrophobicContact CG2-CG1 4.47Å
165	Q	80.9	Confident	77	Confident	68 Å²	68	45.6 Å²	45.6	32%	0.318	21%	0.208	S	C	.	.	H	α-helix	trans	-67.9	-39.5	-175	-77.7	179.7	-16	0	0	114.5	R161 H162 W204 R208	R161-Q165 HydrophobicContact CG-CG 4.25Å; R161-Q165 VanDerWaalsContact O-CB 3.25Å; R161-Q165 WeakPolarHBondContact O-CB 3.26Å; R161-Q165 VanDerWaalsContact O-CG 3.24Å; R161-Q165 WeakPolarHBondContact O-CG 3.2Å; R161-Q165 PolarHBondContact O-N 3.29Å; H162-Q165 PolarHBondContact O-N 3.46Å; Q165-W204 HydrophobicContact CG-CH2 4.26Å; Q165-W204 HydrophobicContact CG-CZ2 3.99Å; Q165-R208 VanDerWaalsContact O-CZ 3.24Å; Q165-R208 PolarHBondContact O-NH1 3.05Å; Q165-R208 PolarHBondContact O-NH2 3.22Å
166	E	78.6	Confident	76.9	Confident	104 Å²	104	44.8 Å²	44.8	49%	0.486	21%	0.213	S	C	.	.	H	α-helix	trans	-89.3	-40.5	178.1	-65	-51	116.9	0	0	112.3	H162	H162-E166 VanDerWaalsContact CE1-CG 3.41Å; H162-E166 WeakPolarHBondContact CE1-CG 3.49Å; H162-E166 PolarHBondContact O-N 3.22Å
167	F	78.9	Confident	77	Confident	37 Å²	37	44.3 Å²	44.3	16%	0.162	21%	0.21	C	C	.	.	H	α-helix	trans	-112.9	28.7	-169.1	-52.8	-70.5	0	0	0	113.7	N110 L113 T114 W163 M169 M170	N110-F167 HydrophobicContact CB-CZ 4.3Å; L113-F167 HydrophobicContact CB-CD2 4.17Å; L113-F167 HydrophobicContact CB-CE2 4.18Å; L113-F167 HydrophobicContact CD1-CE2 4.46Å; T114-F167 HydrophobicContact CG2-CD1 3.58Å; T114-F167 HydrophobicContact CG2-CE1 3.29Å; T114-F167 HydrophobicContact CG2-CE2 4.27Å; T114-F167 HydrophobicContact CG2-CG 4.19Å; T114-F167 HydrophobicContact CG2-CZ 3.68Å; W163-F167 CarbonylContact O-C 3.58Å; W163-F167 WeakPolarHBondContact O-CA 3.48Å; W163-F167 WeakPolarHBondContact O-CB 3.22Å; W163-F167 PolarHBondContact O-N 2.84Å; F167-M169 PolarHBondContact O-N 3.32Å; F167-M170 HydrophobicContact CB-CE 4.11Å; F167-M170 HydrophobicContact CB-CG 4.37Å; F167-M170 HydrophobicContact CB-SD 4.31Å; F167-M170 HydrophobicContact CD1-CE 4.37Å; F167-M170 HydrophobicContact CG-CE 4.42Å; F167-M170 WeakPolarHBondContact O-CB 3.26Å; F167-M170 WeakPolarHBondContact O-CG 3.44Å; F167-M170 PolarHBondContact O-N 3.48Å
168	W	78.4	Confident	76.9	Confident	14 Å²	14	46.5 Å²	46.5	5%	0.053	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-41.2	-32.1	179.4	64.5	-89.4	0	0	0	115.9	I164 M170 F171 W204 I205 E209 W212	I164-W168 VanDerWaalsContact O-CA 3.25Å; I164-W168 WeakPolarHBondContact O-CA 3.18Å; I164-W168 VanDerWaalsContact O-CB 3.25Å; I164-W168 WeakPolarHBondContact O-CB 3.21Å; I164-W168 PolarHBondContact O-N 3Å; I164-W168 VanDerWaalsContact O-N 3.09Å; W168-M170 PolarHBondContact O-N 3.07Å; W168-F171 PolarHBondContact O-N 3.09Å; W168-F171 VanDerWaalsContact O-N 3.12Å; W168-W204 HydrophobicContact CB-CH2 4.32Å; W168-W204 HydrophobicContact CB-CZ3 4.23Å; W168-I205 HydrophobicContact CB-CD1 4.47Å; W168-I205 HydrophobicContact CB-CG1 4.25Å; W168-I205 HydrophobicContact CB-CG2 4.38Å; W168-I205 HydrophobicContact CE3-CG2 3.81Å; W168-E209 HydrophobicContact CH2-CB 3.95Å; W168-E209 HydrophobicContact CH2-CG 3.82Å; W168-E209 HydrophobicContact CZ3-CB 3.71Å; W168-E209 HydrophobicContact CZ3-CG 3.73Å; W168-W212 HydrophobicContact CH2-CB 4.39Å; W168-W212 HydrophobicContact CH2-CD2 4.34Å; W168-W212 HydrophobicContact CH2-CE3 4.29Å; W168-W212 HydrophobicContact CH2-CG 4.42Å; W168-W212 HydrophobicContact CZ2-CB 4.14Å; W168-W212 HydrophobicContact CZ2-CD2 4.18Å; W168-W212 HydrophobicContact CZ2-CG 4.01Å
169	M	72	Confident	76.8	Confident	54 Å²	54	48.9 Å²	48.9	27%	0.266	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-59.5	-24.1	177.1	-68.6	-173	-73.7	0	0	113.7	F167 R172 W212	F167-M169 PolarHBondContact O-N 3.32Å; M169-R172 WeakPolarHBondContact O-CB 3.22Å; M169-W212 HydrophobicContact SD-CH2 4.37Å; M169-W212 HydrophobicContact SD-CZ2 4.36Å
170	M	74.3	Confident	76.7	Confident	11 Å²	11	49.4 Å²	49.4	5%	0.054	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-74	-30	177.5	-57.9	-165.4	-171.3	0	0	112.7	T114 F167 W168 R172 P174 V258	T114-M170 HydrophobicContact CG2-CE 3.95Å; F167-M170 HydrophobicContact CB-CE 4.11Å; F167-M170 HydrophobicContact CB-CG 4.37Å; F167-M170 HydrophobicContact CB-SD 4.31Å; F167-M170 HydrophobicContact CD1-CE 4.37Å; F167-M170 HydrophobicContact CG-CE 4.42Å; F167-M170 WeakPolarHBondContact O-CB 3.26Å; F167-M170 WeakPolarHBondContact O-CG 3.44Å; F167-M170 PolarHBondContact O-N 3.48Å; W168-M170 PolarHBondContact O-N 3.07Å; M170-R172 PolarHBondContact O-N 3.39Å; M170-P174 VanDerWaalsContact O-CD 3.27Å; M170-P174 WeakPolarHBondContact O-CD 3.47Å; M170-V258 HydrophobicContact CE-CG2 4.39Å; M170-V258 HydrophobicContact CG-CG2 3.97Å
171	F	75.3	Confident	76.7	Confident	27 Å²	27	49.4 Å²	49.4	12%	0.118	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-81.6	6.3	178.5	-66	-91.6	0	0	0	113.5	W163 I164 W168 L177 L181 I205	W163-F171 AromaticContact CD2-CE2 3.88Å; W163-F171 HydrophobicContact CD2-CE2 3.88Å; W163-F171 AromaticContact CD2-CZ 3.6Å; W163-F171 HydrophobicContact CD2-CZ 3.6Å; W163-F171 HydrophobicContact CE3-CE2 4.4Å; W163-F171 AromaticContact CE3-CZ 3.65Å; W163-F171 HydrophobicContact CE3-CZ 3.65Å; W163-F171 AromaticContact CG-CE2 3.91Å; W163-F171 HydrophobicContact CG-CE2 3.91Å; W163-F171 HydrophobicContact CG-CZ 4.01Å; W163-F171 HydrophobicContact CH2-CZ 4.45Å; W163-F171 HydrophobicContact CZ2-CZ 4.42Å; W163-F171 HydrophobicContact CZ3-CZ 4.1Å; I164-F171 HydrophobicContact CB-CE2 4.27Å; I164-F171 HydrophobicContact CG1-CD1 4.31Å; I164-F171 HydrophobicContact CG1-CD2 4.2Å; I164-F171 HydrophobicContact CG1-CE1 3.85Å; I164-F171 HydrophobicContact CG1-CE2 3.74Å; I164-F171 HydrophobicContact CG1-CG 4.47Å; I164-F171 HydrophobicContact CG1-CZ 3.54Å; W168-F171 PolarHBondContact O-N 3.09Å; W168-F171 VanDerWaalsContact O-N 3.12Å; F171-L177 HydrophobicContact CD1-CD1 4.48Å; F171-L177 HydrophobicContact CD1-CD2 3.75Å; F171-L177 HydrophobicContact CD1-CG 3.84Å; F171-L177 HydrophobicContact CE1-CD1 4.11Å; F171-L177 HydrophobicContact CE1-CD2 3.99Å; F171-L177 HydrophobicContact CE1-CG 3.98Å; F171-L177 HydrophobicContact CG-CD2 4.13Å; F171-L181 HydrophobicContact CD1-CD2 4.36Å; F171-L181 HydrophobicContact CE1-CD2 4.32Å; F171-I205 HydrophobicContact CB-CD1 4.05Å
172	R	68.1	Low	76.5	Confident	120 Å²	120	49.8 Å²	49.8	45%	0.453	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-95.5	-10.7	-172.2	-160.1	-167.3	61.8	148	-0.9	114.7	M169 M170 E209	M169-R172 WeakPolarHBondContact O-CB 3.22Å; M170-R172 PolarHBondContact O-N 3.39Å; R172-E209 WeakPolarHBondContact CD-OE1 3.29Å; R172-E209 IonicContact CZ-OE1 3.68Å; R172-E209 IonicContact NE-OE1 3.94Å; R172-E209 IonicContact NH1-OE1 3.65Å; R172-E209 PolarHBondContact NH1-OE1 2.94Å
173	L	56.1	Low	76.4	Confident	113 Å²	113	54 Å²	54	59%	0.592	27%	0.274	S	S	*	.	S	Bend	trans	-132.1	-40.1	-162	-77.9	165.5	0	0	0	116.1
174	P	63.1	Low	76.3	Confident	46 Å²	46	54 Å²	54	30%	0.299	28%	0.275	S	S	.	.			trans	-87.2	117.3	176.1	4.7	14.1	0	0	0	109.4	M170 S176 L177	M170-P174 VanDerWaalsContact O-CD 3.27Å; M170-P174 WeakPolarHBondContact O-CD 3.47Å; P174-S176 VanDerWaalsContact C-N 3.27Å; P174-S176 PolarHBondContact O-N 3.4Å; P174-L177 HydrophobicContact CB-CB 3.93Å; P174-L177 HydrophobicContact CG-CB 3.89Å; P174-L177 HydrophobicContact CG-CD2 4.17Å; P174-L177 PolarHBondContact O-N 3.24Å
175	H	67.8	Low	76.3	Confident	158 Å²	158	55.6 Å²	55.6	73%	0.731	28%	0.281	S	S	*	.	H	α-helix	trans	-55.3	-46.7	169.5	-70.1	-73.5	0	0	0	110.4	L177 S178 D179	H175-L177 PolarHBondContact O-N 2.94Å; H175-S178 CarbonylContact O-C 3.59Å; H175-S178 WeakPolarHBondContact O-CA 3.28Å; H175-S178 WeakPolarHBondContact O-CB 3.49Å; H175-S178 PolarHBondContact O-N 3.11Å; H175-D179 VanDerWaalsContact C-CG 3.49Å; H175-D179 PolarHBondContact O-N 3.37Å; H175-D179 VanDerWaalsContact O-OD2 3.11Å
176	S	75.2	Confident	76.4	Confident	55 Å²	55	56.2 Å²	56.2	39%	0.385	29%	0.286	S	S	.	.	H	α-helix	trans	-54.2	-23.5	177.4	65.2	0	0	0	0	115.5	S123 P174 D179 S180	S123-S176 PolarHBondContact OG-OG 2.89Å; P174-S176 VanDerWaalsContact C-N 3.27Å; P174-S176 PolarHBondContact O-N 3.4Å; S176-D179 WeakPolarHBondContact CA-OD2 3.08Å; S176-D179 PolarHBondContact N-OD2 2.89Å; S176-S180 WeakPolarHBondContact O-CB 3.35Å; S176-S180 PolarHBondContact O-N 2.8Å; S176-S180 VanDerWaalsContact O-N 3.09Å; S176-S180 PolarHBondContact O-OG 3.23Å
177	L	80	Confident	76.4	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-84.2	-26.5	175.3	-178.9	62.7	0	0	0	112.6	L126 W163 F171 P174 H175 L181	L126-L177 HydrophobicContact CB-CD1 4.2Å; L126-L177 HydrophobicContact CD2-CD1 3.84Å; W163-L177 HydrophobicContact CH2-CD1 4.22Å; F171-L177 HydrophobicContact CD1-CD1 4.48Å; F171-L177 HydrophobicContact CD1-CD2 3.75Å; F171-L177 HydrophobicContact CD1-CG 3.84Å; F171-L177 HydrophobicContact CE1-CD1 4.11Å; F171-L177 HydrophobicContact CE1-CD2 3.99Å; F171-L177 HydrophobicContact CE1-CG 3.98Å; F171-L177 HydrophobicContact CG-CD2 4.13Å; P174-L177 HydrophobicContact CB-CB 3.93Å; P174-L177 HydrophobicContact CG-CB 3.89Å; P174-L177 HydrophobicContact CG-CD2 4.17Å; P174-L177 PolarHBondContact O-N 3.24Å; H175-L177 PolarHBondContact O-N 2.94Å; L177-L181 VanDerWaalsContact O-CB 3.3Å; L177-L181 WeakPolarHBondContact O-CB 3.26Å
178	S	79	Confident	76.4	Confident	46 Å²	46	52 Å²	52	32%	0.322	27%	0.268	S	S	.	.	H	α-helix	trans	-74.3	-44.7	165.8	-158.6	0	0	0	0	109.8	H175 L181 D182	H175-S178 CarbonylContact O-C 3.59Å; H175-S178 WeakPolarHBondContact O-CA 3.28Å; H175-S178 WeakPolarHBondContact O-CB 3.49Å; H175-S178 PolarHBondContact O-N 3.11Å; S178-L181 CarbonylContact O-C 3.52Å; S178-L181 WeakPolarHBondContact O-CA 3.46Å; S178-L181 WeakPolarHBondContact O-CB 3.48Å; S178-L181 PolarHBondContact O-N 3.33Å; S178-D182 PolarHBondContact O-N 3.26Å; S178-D182 PolarHBondContact OG-OD2 2.91Å
179	D	80.9	Confident	76.6	Confident	86 Å²	86	57.2 Å²	57.2	46%	0.46	29%	0.288	S	S	.	.	H	α-helix	trans	-58.1	-54.7	-177.6	-49.5	-29.8	0	0	0	110.5	H175 S176 L181 D182 D183	H175-D179 VanDerWaalsContact C-CG 3.49Å; H175-D179 PolarHBondContact O-N 3.37Å; H175-D179 VanDerWaalsContact O-OD2 3.11Å; S176-D179 WeakPolarHBondContact CA-OD2 3.08Å; S176-D179 PolarHBondContact N-OD2 2.89Å; D179-L181 PolarHBondContact O-N 3.23Å; D179-L181 VanDerWaalsContact O-N 3.13Å; D179-D182 PolarHBondContact O-N 3.44Å; D179-D182 VanDerWaalsContact O-N 3.13Å; D179-D183 PolarHBondContact O-N 3.21Å
180	S	81	Confident	76.8	Confident	15 Å²	15	62.6 Å²	62.6	11%	0.105	31%	0.312	C	S	.	.	H	α-helix	trans	-59.3	-24.4	173.1	-68.5	0	0	0	0	114.3	D127 I130 S176 F184	D127-S180 VanDerWaalsContact OD1-CB 3.3Å; D127-S180 WeakPolarHBondContact OD1-CB 3.38Å; D127-S180 PolarHBondContact OD1-OG 3.44Å; I130-S180 WeakPolarHBondContact CD1-O 3.31Å; S176-S180 WeakPolarHBondContact O-CB 3.35Å; S176-S180 PolarHBondContact O-N 2.8Å; S176-S180 VanDerWaalsContact O-N 3.09Å; S176-S180 PolarHBondContact O-OG 3.23Å; S180-F184 WeakPolarHBondContact O-CB 3.43Å; S180-F184 PolarHBondContact O-N 2.82Å
181	L	83.3	Confident	76.6	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-83.3	-33.4	178.1	-176.4	65.9	0	0	0	111.9	L126 I160 I164 F171 L177 S178 D179 R185 T202	L126-L181 HydrophobicContact CD2-CB 3.88Å; L126-L181 HydrophobicContact CD2-CD1 4.3Å; I160-L181 HydrophobicContact CG2-CD1 4.02Å; I164-L181 HydrophobicContact CD1-CD2 4.09Å; F171-L181 HydrophobicContact CD1-CD2 4.36Å; F171-L181 HydrophobicContact CE1-CD2 4.32Å; L177-L181 VanDerWaalsContact O-CB 3.3Å; L177-L181 WeakPolarHBondContact O-CB 3.26Å; S178-L181 CarbonylContact O-C 3.52Å; S178-L181 WeakPolarHBondContact O-CA 3.46Å; S178-L181 WeakPolarHBondContact O-CB 3.48Å; S178-L181 PolarHBondContact O-N 3.33Å; D179-L181 PolarHBondContact O-N 3.23Å; D179-L181 VanDerWaalsContact O-N 3.13Å; L181-R185 VanDerWaalsContact O-CG 3.3Å; L181-R185 WeakPolarHBondContact O-CG 3.4Å; L181-R185 PolarHBondContact O-N 2.68Å; L181-R185 VanDerWaalsContact O-N 3.08Å; L181-T202 HydrophobicContact CD2-CG2 3.68Å
182	D	82.6	Confident	76.3	Confident	60 Å²	60	68.7 Å²	68.7	32%	0.321	36%	0.356	S	S	.	.	H	α-helix	trans	-74.6	-41.2	174.3	-76.5	-55.5	0	0	0	110.8	S178 D179 F184 R185 D186	S178-D182 PolarHBondContact O-N 3.26Å; S178-D182 PolarHBondContact OG-OD2 2.91Å; D179-D182 PolarHBondContact O-N 3.44Å; D179-D182 VanDerWaalsContact O-N 3.13Å; D182-F184 VanDerWaalsContact C-N 3.26Å; D182-F184 PolarHBondContact O-N 3Å; D182-R185 WeakPolarHBondContact O-CB 3.49Å; D182-R185 PolarHBondContact O-N 3.02Å; D182-R185 WeakPolarHBondContact OD1-CD 3.33Å; D182-R185 IonicContact OD1-CZ 3.72Å; D182-R185 IonicContact OD1-NE 2.68Å; D182-R185 IonicContact OD1-NH1 3.81Å; D182-R185 PolarHBondContact OD1-NH1 3.46Å; D182-R185 IonicContact OD2-NH1 3Å; D182-D186 PolarHBondContact O-N 3.15Å
183	D	81.8	Confident	76.5	Confident	117 Å²	117	64.9 Å²	64.9	63%	0.626	34%	0.344	S	S	*	.	H	α-helix	trans	-53.7	-42.7	168.1	-73.7	-21	0	0	0	111.6	D179 L187	D179-D183 PolarHBondContact O-N 3.21Å; D183-L187 WeakPolarHBondContact O-CB 3.28Å; D183-L187 PolarHBondContact O-N 2.95Å
184	F	81.9	Confident	77.5	Confident	2 Å²	2	64.8 Å²	64.8	1%	0.009	34%	0.34	C	S	.	.	H	α-helix	trans	-69.6	-34.3	176.6	-176.5	-126.2	0	0	0	113.4	I130 Y133 I156 I160 S180 D182 L188 L200	I130-F184 HydrophobicContact CD1-CB 3.8Å; I130-F184 HydrophobicContact CD1-CD2 4.4Å; I130-F184 HydrophobicContact CD1-CG 4.2Å; I130-F184 HydrophobicContact CG1-CB 4.1Å; I130-F184 HydrophobicContact CG1-CD2 3.76Å; I130-F184 HydrophobicContact CG1-CE2 4.36Å; I130-F184 HydrophobicContact CG1-CG 3.93Å; I130-F184 HydrophobicContact CG2-CD2 4.35Å; Y133-F184 HydrophobicContact CD2-CE2 4.19Å; Y133-F184 HydrophobicContact CE2-CE2 4.39Å; I156-F184 HydrophobicContact CG2-CZ 4.21Å; I160-F184 HydrophobicContact CD1-CD1 4.17Å; I160-F184 HydrophobicContact CD1-CE1 3.73Å; S180-F184 WeakPolarHBondContact O-CB 3.43Å; S180-F184 PolarHBondContact O-N 2.82Å; D182-F184 VanDerWaalsContact C-N 3.26Å; D182-F184 PolarHBondContact O-N 3Å; F184-L188 HydrophobicContact CD1-CD1 4.14Å; F184-L188 HydrophobicContact CD2-CG 4.47Å; F184-L188 HydrophobicContact CE1-CD1 3.78Å; F184-L188 HydrophobicContact CE1-CG 4.43Å; F184-L188 HydrophobicContact CE2-CD1 4.37Å; F184-L188 HydrophobicContact CE2-CD2 4.39Å; F184-L188 HydrophobicContact CE2-CG 4.14Å; F184-L188 HydrophobicContact CZ-CD1 3.91Å; F184-L188 HydrophobicContact CZ-CD2 4.26Å; F184-L188 HydrophobicContact CZ-CG 4.11Å; F184-L188 WeakPolarHBondContact O-CG 3.32Å; F184-L188 PolarHBondContact O-N 2.76Å; F184-L200 HydrophobicContact CD1-CD1 3.81Å; F184-L200 HydrophobicContact CE1-CD1 3.76Å
185	R	82.9	Confident	78.2	Confident	35 Å²	35	68 Å²	68	13%	0.132	35%	0.351	C	S	.	.	H	α-helix	trans	-66	-39.9	175.3	-75.1	165	179.7	166.2	3	111.8	L181 D182 L188 R189 C197 L200 T202	L181-R185 VanDerWaalsContact O-CG 3.3Å; L181-R185 WeakPolarHBondContact O-CG 3.4Å; L181-R185 PolarHBondContact O-N 2.68Å; L181-R185 VanDerWaalsContact O-N 3.08Å; D182-R185 WeakPolarHBondContact O-CB 3.49Å; D182-R185 PolarHBondContact O-N 3.02Å; D182-R185 WeakPolarHBondContact OD1-CD 3.33Å; D182-R185 IonicContact OD1-CZ 3.72Å; D182-R185 IonicContact OD1-NE 2.68Å; D182-R185 IonicContact OD1-NH1 3.81Å; D182-R185 PolarHBondContact OD1-NH1 3.46Å; D182-R185 IonicContact OD2-NH1 3Å; R185-L188 PolarHBondContact O-N 3.47Å; R185-R189 PolarHBondContact O-N 3.09Å; R185-R189 VanDerWaalsContact O-N 3.08Å; R185-C197 PolarHBondContact O-SG 2.91Å; R185-C197 VanDerWaalsContact O-SG 3.41Å; R185-L200 PolarHBondContact NH2-O 3.46Å; R185-T202 PolarHBondContact NH2-OG1 3.41Å
186	D	82.5	Confident	78.6	Confident	81 Å²	81	60.6 Å²	60.6	43%	0.433	32%	0.317	S	S	.	.	H	α-helix	trans	-76.7	-32.9	177.6	-77.3	-25.7	0	0	0	111.8	D182 L188 R189 E190	D182-D186 PolarHBondContact O-N 3.15Å; D186-L188 PolarHBondContact O-N 3.38Å; D186-R189 WeakPolarHBondContact O-CA 3.26Å; D186-R189 VanDerWaalsContact O-CB 3.28Å; D186-R189 WeakPolarHBondContact O-CB 3.35Å; D186-R189 PolarHBondContact O-N 3.35Å; D186-R189 IonicContact OD1-CZ 2.62Å; D186-R189 VanDerWaalsContact OD1-CZ 3.3Å; D186-R189 IonicContact OD1-NE 2.81Å; D186-R189 PolarHBondContact OD1-NE 3.1Å; D186-R189 IonicContact OD1-NH2 3.84Å; D186-R189 PolarHBondContact OD1-NH2 3.16Å; D186-E190 PolarHBondContact O-N 3.17Å
187	L	79.4	Confident	78.7	Confident	51 Å²	51	59 Å²	59	27%	0.267	31%	0.305	S	S	.	.	H	α-helix	trans	-59.3	-43.5	167.4	-172.4	151.8	0	0	0	111.9	Y133 D183 R189 E190 H191	Y133-L187 HydrophobicContact CD1-CD2 4.1Å; Y133-L187 HydrophobicContact CE1-CD2 3.59Å; D183-L187 WeakPolarHBondContact O-CB 3.28Å; D183-L187 PolarHBondContact O-N 2.95Å; L187-R189 VanDerWaalsContact C-N 3.26Å; L187-R189 PolarHBondContact O-N 3.04Å; L187-E190 PolarHBondContact O-N 3.43Å; L187-H191 PolarHBondContact O-N 3.43Å; L187-H191 PolarHBondContact O-ND1 3.05Å
188	L	79.2	Confident	78.6	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-62.8	-32.1	173.2	-75.7	170.8	0	0	0	112.5	Y133 F184 R185 D186 G192 Q193 L196 C197 L200	Y133-L188 HydrophobicContact CE2-CD2 4.15Å; F184-L188 HydrophobicContact CD1-CD1 4.14Å; F184-L188 HydrophobicContact CD2-CG 4.47Å; F184-L188 HydrophobicContact CE1-CD1 3.78Å; F184-L188 HydrophobicContact CE1-CG 4.43Å; F184-L188 HydrophobicContact CE2-CD1 4.37Å; F184-L188 HydrophobicContact CE2-CD2 4.39Å; F184-L188 HydrophobicContact CE2-CG 4.14Å; F184-L188 HydrophobicContact CZ-CD1 3.91Å; F184-L188 HydrophobicContact CZ-CD2 4.26Å; F184-L188 HydrophobicContact CZ-CG 4.11Å; F184-L188 WeakPolarHBondContact O-CG 3.32Å; F184-L188 PolarHBondContact O-N 2.76Å; R185-L188 PolarHBondContact O-N 3.47Å; D186-L188 PolarHBondContact O-N 3.38Å; L188-G192 PolarHBondContact O-N 3.32Å; L188-Q193 HydrophobicContact CD2-CB 4.32Å; L188-Q193 PolarHBondContact O-N 3.22Å; L188-L196 HydrophobicContact CD1-CB 4.42Å; L188-L196 HydrophobicContact CD2-CD1 4.44Å; L188-C197 VanDerWaalsContact CB-SG 3.56Å; L188-L200 HydrophobicContact CD1-CD1 3.67Å
189	R	81.7	Confident	78.4	Confident	124 Å²	124	62.6 Å²	62.6	47%	0.468	33%	0.327	S	S	.	.	H	α-helix	trans	-69.4	-45	175.5	-164.9	-164.1	-50.6	-79.1	2.2	112.1	R185 D186 L187 H191 G192 E194	R185-R189 PolarHBondContact O-N 3.09Å; R185-R189 VanDerWaalsContact O-N 3.08Å; D186-R189 WeakPolarHBondContact O-CA 3.26Å; D186-R189 VanDerWaalsContact O-CB 3.28Å; D186-R189 WeakPolarHBondContact O-CB 3.35Å; D186-R189 PolarHBondContact O-N 3.35Å; D186-R189 IonicContact OD1-CZ 2.62Å; D186-R189 VanDerWaalsContact OD1-CZ 3.3Å; D186-R189 IonicContact OD1-NE 2.81Å; D186-R189 PolarHBondContact OD1-NE 3.1Å; D186-R189 IonicContact OD1-NH2 3.84Å; D186-R189 PolarHBondContact OD1-NH2 3.16Å; L187-R189 VanDerWaalsContact C-N 3.26Å; L187-R189 PolarHBondContact O-N 3.04Å; R189-H191 PolarHBondContact O-N 3Å; R189-G192 PolarHBondContact O-N 3.11Å; R189-E194 HydrophobicContact CG-CG 4.08Å; R189-E194 WeakPolarHBondContact CG-OE1 3.4Å; R189-E194 IonicContact CZ-OE1 3.62Å; R189-E194 IonicContact NH1-OE1 2.79Å; R189-E194 PolarHBondContact NH1-OE1 3.37Å
190	E	77	Confident	78.4	Confident	167 Å²	167	58.5 Å²	58.5	78%	0.78	31%	0.305	S	S	*	.	H	α-helix	trans	-57.3	-35.2	174.8	-70.9	-172.4	151.5	0	0	112.1	D186 L187 G192	D186-E190 PolarHBondContact O-N 3.17Å; L187-E190 PolarHBondContact O-N 3.43Å; E190-G192 VanDerWaalsContact C-N 3.28Å; E190-G192 PolarHBondContact O-N 2.95Å
191	H	70.3	Confident	78.1	Confident	107 Å²	107	61.3 Å²	61.3	50%	0.495	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	7.3	176.5	-65.1	76.3	0	0	0	113.7	L187 R189 Q193	L187-H191 PolarHBondContact O-N 3.43Å; L187-H191 PolarHBondContact O-ND1 3.05Å; R189-H191 PolarHBondContact O-N 3Å; H191-Q193 VanDerWaalsContact C-N 3.3Å; H191-Q193 PolarHBondContact O-N 3.49Å
192	G	69.3	Low	77.6	Confident	59 Å²	59	62.7 Å²	62.7	61%	0.608	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.9	12.2	176.5	0	0	0	0	0	115.5	L188 R189 E190 E194	L188-G192 PolarHBondContact O-N 3.32Å; R189-G192 PolarHBondContact O-N 3.11Å; E190-G192 VanDerWaalsContact C-N 3.28Å; E190-G192 PolarHBondContact O-N 2.95Å; G192-E194 VanDerWaalsContact C-N 3.34Å; G192-E194 PolarHBondContact O-N 2.99Å
193	Q	71.9	Confident	77.1	Confident	41 Å²	41	66.8 Å²	66.8	19%	0.192	34%	0.34	C	S	.	.			trans	-94.7	37.9	-174.4	-60.3	-166.8	-3.3	0	0	113.2	L188 H191 H195 L196	L188-Q193 HydrophobicContact CD2-CB 4.32Å; L188-Q193 PolarHBondContact O-N 3.22Å; H191-Q193 VanDerWaalsContact C-N 3.3Å; H191-Q193 PolarHBondContact O-N 3.49Å; Q193-H195 PolarHBondContact O-N 2.81Å; Q193-L196 HydrophobicContact CB-CD1 4.25Å; Q193-L196 HydrophobicContact CB-CG 4.41Å; Q193-L196 PolarHBondContact O-N 3.28Å; Q193-L196 VanDerWaalsContact OE1-CD1 3.3Å
194	E	77.4	Confident	76.4	Confident	110 Å²	110	64.5 Å²	64.5	51%	0.514	32%	0.323	S	S	.	.	H	α-helix	trans	-53.8	-28.3	-175	-66.5	-155.5	122.2	0	0	114.3	R189 G192 L196 C197	R189-E194 HydrophobicContact CG-CG 4.08Å; R189-E194 WeakPolarHBondContact CG-OE1 3.4Å; R189-E194 IonicContact CZ-OE1 3.62Å; R189-E194 IonicContact NH1-OE1 2.79Å; R189-E194 PolarHBondContact NH1-OE1 3.37Å; G192-E194 VanDerWaalsContact C-N 3.34Å; G192-E194 PolarHBondContact O-N 2.99Å; E194-L196 PolarHBondContact O-N 3.36Å; E194-C197 WeakPolarHBondContact O-CB 3.27Å; E194-C197 PolarHBondContact O-N 2.91Å; E194-C197 VanDerWaalsContact O-N 3.14Å
195	H	76.7	Confident	75.9	Confident	113 Å²	113	64.8 Å²	64.8	52%	0.523	32%	0.324	S	S	.	.	H	α-helix	trans	-59	-32.9	175.4	69.4	-83.8	0	0	0	112.9	Q193 S198	Q193-H195 PolarHBondContact O-N 2.81Å; H195-S198 PolarHBondContact O-OG 3.28Å
196	L	75.8	Confident	75.1	Confident	3 Å²	3	68.1 Å²	68.1	2%	0.016	35%	0.345	C	S	.	.	H	α-helix	trans	-75.7	-29.6	176.9	-58.2	-174.8	0	0	0	112.6	C153 Q154 C157 L188 Q193 E194 S198 L199	C153-L196 HydrophobicContact CB-CD1 4.36Å; Q154-L196 HydrophobicContact CG-CD1 4.24Å; Q154-L196 HydrophobicContact CG-CD2 3.78Å; C157-L196 HydrophobicContact CB-CB 4.44Å; L188-L196 HydrophobicContact CD1-CB 4.42Å; L188-L196 HydrophobicContact CD2-CD1 4.44Å; Q193-L196 HydrophobicContact CB-CD1 4.25Å; Q193-L196 HydrophobicContact CB-CG 4.41Å; Q193-L196 PolarHBondContact O-N 3.28Å; Q193-L196 VanDerWaalsContact OE1-CD1 3.3Å; E194-L196 PolarHBondContact O-N 3.36Å; L196-S198 PolarHBondContact O-N 2.62Å; L196-L199 HydrophobicContact CD2-CD1 3.87Å; L196-L199 VanDerWaalsContact O-CB 3.3Å; L196-L199 WeakPolarHBondContact O-CB 3.15Å; L196-L199 PolarHBondContact O-N 3.1Å
197	C	77.6	Confident	74.2	Confident	21 Å²	21	70.3 Å²	70.3	14%	0.142	35%	0.352	C	S	.	.	H	α-helix	trans	-59.9	-29.3	177	-56.6	0	0	0	0	112	R185 L188 E194 L199 L200	R185-C197 PolarHBondContact O-SG 2.91Å; R185-C197 VanDerWaalsContact O-SG 3.41Å; L188-C197 VanDerWaalsContact CB-SG 3.56Å; E194-C197 WeakPolarHBondContact O-CB 3.27Å; E194-C197 PolarHBondContact O-N 2.91Å; E194-C197 VanDerWaalsContact O-N 3.14Å; C197-L199 VanDerWaalsContact C-N 3.29Å; C197-L199 PolarHBondContact O-N 2.89Å; C197-L200 PolarHBondContact O-N 3.32Å
198	S	78.3	Confident	73.4	Confident	77 Å²	77	72.2 Å²	72.2	54%	0.538	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-63.9	-28.8	173.4	77.4	0	0	0	0	113.9	H195 L196 L200	H195-S198 PolarHBondContact O-OG 3.28Å; L196-S198 PolarHBondContact O-N 2.62Å; S198-L200 VanDerWaalsContact C-N 3.26Å; S198-L200 PolarHBondContact O-N 3.29Å
199	L	76.1	Confident	72.6	Confident	46 Å²	46	73.6 Å²	73.6	24%	0.241	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-74.2	-20.9	177.9	-57.5	175.9	0	0	0	112.3	C157 Y158 R161 L196 C197	C157-L199 HydrophobicContact CB-CD1 4.32Å; Y158-L199 HydrophobicContact CD1-CD1 4.06Å; Y158-L199 HydrophobicContact CE1-CD1 3.71Å; Y158-L199 HydrophobicContact CE1-CD2 4.47Å; R161-L199 WeakPolarHBondContact CB-O 3.12Å; R161-L199 WeakPolarHBondContact CG-O 3.04Å; L196-L199 HydrophobicContact CD2-CD1 3.87Å; L196-L199 VanDerWaalsContact O-CB 3.3Å; L196-L199 WeakPolarHBondContact O-CB 3.15Å; L196-L199 PolarHBondContact O-N 3.1Å; C197-L199 VanDerWaalsContact C-N 3.29Å; C197-L199 PolarHBondContact O-N 2.89Å
200	L	79	Confident	71.6	Confident	0 Å²	0	76 Å²	76	0%	0	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-99.2	5.9	-172.8	-56.6	-179.7	0	0	0	113	C157 I160 F184 R185 L188 C197 S198 T202	C157-L200 HydrophobicContact CB-CD2 4.34Å; I160-L200 HydrophobicContact CB-CD2 3.8Å; I160-L200 HydrophobicContact CG2-CD2 3.69Å; F184-L200 HydrophobicContact CD1-CD1 3.81Å; F184-L200 HydrophobicContact CE1-CD1 3.76Å; R185-L200 PolarHBondContact NH2-O 3.46Å; L188-L200 HydrophobicContact CD1-CD1 3.67Å; C197-L200 PolarHBondContact O-N 3.32Å; S198-L200 VanDerWaalsContact C-N 3.26Å; S198-L200 PolarHBondContact O-N 3.29Å; L200-T202 PolarHBondContact O-N 2.83Å
201	E	76.2	Confident	70.8	Confident	73 Å²	73	71.4 Å²	71.4	34%	0.341	36%	0.358	S	S	.	.			trans	-61.6	133.8	-175.5	-73.3	-148.3	154	0	0	113.6	K203 W204	E201-K203 WeakPolarHBondContact OE1-CE 3.4Å; E201-K203 IonicContact OE1-NZ 2.76Å; E201-K203 PolarHBondContact OE1-NZ 3.49Å; E201-K203 WeakPolarHBondContact OE2-CD 3.28Å; E201-K203 IonicContact OE2-NZ 3.75Å; E201-W204 PolarHBondContact O-NE1 3.2Å
202	T	73.3	Confident	70.3	Confident	30 Å²	30	70.4 Å²	70.4	18%	0.184	35%	0.35	C	S	.	.			trans	-104.5	-4.8	178.8	45	0	0	0	0	113.7	I164 L181 R185 L200 W204 I205	I164-T202 HydrophobicContact CD1-CG2 4.35Å; I164-T202 HydrophobicContact CG2-CG2 4.36Å; L181-T202 HydrophobicContact CD2-CG2 3.68Å; R185-T202 PolarHBondContact NH2-OG1 3.41Å; L200-T202 PolarHBondContact O-N 2.83Å; T202-W204 VanDerWaalsContact C-N 3.34Å; T202-W204 PolarHBondContact O-N 3.15Å; T202-I205 HydrophobicContact CG2-CD1 3.83Å; T202-I205 VanDerWaalsContact O-CB 3.28Å; T202-I205 WeakPolarHBondContact O-CB 3.38Å; T202-I205 VanDerWaalsContact O-CG1 3.26Å; T202-I205 WeakPolarHBondContact O-CG1 3.46Å; T202-I205 PolarHBondContact O-N 3.48Å
203	K	70.4	Confident	69.8	Low	145 Å²	145	72.4 Å²	72.4	63%	0.63	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-44.2	-172.4	-63.2	173.5	-172.2	157.1	0	113.3	E201 I205	E201-K203 WeakPolarHBondContact OE1-CE 3.4Å; E201-K203 IonicContact OE1-NZ 2.76Å; E201-K203 PolarHBondContact OE1-NZ 3.49Å; E201-K203 WeakPolarHBondContact OE2-CD 3.28Å; E201-K203 IonicContact OE2-NZ 3.75Å; K203-I205 PolarHBondContact O-N 3.48Å
204	W	68.3	Low	68.7	Low	69 Å²	69	72.5 Å²	72.5	26%	0.261	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-11.6	-178	56.4	-96.9	0	0	0	114	I164 Q165 W168 E201 T202 N206 E207 R208	I164-W204 HydrophobicContact CG2-CH2 3.82Å; I164-W204 HydrophobicContact CG2-CZ2 3.55Å; I164-W204 WeakPolarHBondContact O-CH2 3.47Å; Q165-W204 HydrophobicContact CG-CH2 4.26Å; Q165-W204 HydrophobicContact CG-CZ2 3.99Å; W168-W204 HydrophobicContact CB-CH2 4.32Å; W168-W204 HydrophobicContact CB-CZ3 4.23Å; E201-W204 PolarHBondContact O-NE1 3.2Å; T202-W204 VanDerWaalsContact C-N 3.34Å; T202-W204 PolarHBondContact O-N 3.15Å; W204-N206 VanDerWaalsContact C-N 3.3Å; W204-N206 PolarHBondContact O-N 3.1Å; W204-E207 PolarHBondContact O-N 3.07Å; W204-R208 HydrophobicContact CE3-CB 4.17Å; W204-R208 HydrophobicContact CZ3-CB 4.47Å; W204-R208 WeakPolarHBondContact O-CB 3.39Å; W204-R208 PolarHBondContact O-N 3.3Å
205	I	70.4	Confident	67.3	Low	9 Å²	9	71.7 Å²	71.7	5%	0.046	36%	0.356	C	S	.	.	H	α-helix	trans	-60.4	-41	-179.9	-65.9	176.1	0	0	0	111	I164 W168 F171 T202 K203 E207 R208 E209	I164-I205 HydrophobicContact CG2-CD1 3.91Å; I164-I205 HydrophobicContact CG2-CG1 4.47Å; W168-I205 HydrophobicContact CB-CD1 4.47Å; W168-I205 HydrophobicContact CB-CG1 4.25Å; W168-I205 HydrophobicContact CB-CG2 4.38Å; W168-I205 HydrophobicContact CE3-CG2 3.81Å; F171-I205 HydrophobicContact CB-CD1 4.05Å; T202-I205 HydrophobicContact CG2-CD1 3.83Å; T202-I205 VanDerWaalsContact O-CB 3.28Å; T202-I205 WeakPolarHBondContact O-CB 3.38Å; T202-I205 VanDerWaalsContact O-CG1 3.26Å; T202-I205 WeakPolarHBondContact O-CG1 3.46Å; T202-I205 PolarHBondContact O-N 3.48Å; K203-I205 PolarHBondContact O-N 3.48Å; I205-E207 VanDerWaalsContact C-N 3.32Å; I205-E207 PolarHBondContact O-N 3.29Å; I205-R208 PolarHBondContact O-N 3.43Å; I205-E209 WeakPolarHBondContact O-CB 3.35Å; I205-E209 PolarHBondContact O-N 3.29Å
206	N	66.6	Low	66.1	Low	104 Å²	104	68.7 Å²	68.7	56%	0.556	34%	0.342	S	S	*	.	H	α-helix	trans	-66.4	-34.8	179.7	-70.8	-39.1	0	0	0	112.3	W204 R210	W204-N206 VanDerWaalsContact C-N 3.3Å; W204-N206 PolarHBondContact O-N 3.1Å; N206-R210 WeakPolarHBondContact O-CB 3.09Å; N206-R210 PolarHBondContact O-N 2.99Å
207	E	63.1	Low	65	Low	127 Å²	127	76 Å²	76	59%	0.593	37%	0.374	S	S	*	.	H	α-helix	trans	-74.4	-40.5	176.3	-58.1	-171.2	140.7	0	0	111.4	W204 I205 E209 R210 S211	W204-E207 PolarHBondContact O-N 3.07Å; I205-E207 VanDerWaalsContact C-N 3.32Å; I205-E207 PolarHBondContact O-N 3.29Å; E207-E209 VanDerWaalsContact C-N 3.33Å; E207-E209 PolarHBondContact O-N 3.38Å; E207-R210 WeakPolarHBondContact O-CB 3.47Å; E207-R210 PolarHBondContact O-N 3.27Å; E207-S211 WeakPolarHBondContact O-CB 3.46Å; E207-S211 PolarHBondContact O-N 3.43Å
208	R	64	Low	63.8	Low	92 Å²	92	76.9 Å²	76.9	35%	0.347	38%	0.377	S	S	.	.	H	α-helix	trans	-65.5	-35	173.3	-166.2	176.7	-176.6	179.1	-10.9	111.9	Q165 W204 I205 S211 W212	Q165-R208 VanDerWaalsContact O-CZ 3.24Å; Q165-R208 PolarHBondContact O-NH1 3.05Å; Q165-R208 PolarHBondContact O-NH2 3.22Å; W204-R208 HydrophobicContact CE3-CB 4.17Å; W204-R208 HydrophobicContact CZ3-CB 4.47Å; W204-R208 WeakPolarHBondContact O-CB 3.39Å; W204-R208 PolarHBondContact O-N 3.3Å; I205-R208 PolarHBondContact O-N 3.43Å; R208-S211 PolarHBondContact O-N 3.03Å; R208-W212 VanDerWaalsContact O-CB 3.23Å; R208-W212 WeakPolarHBondContact O-CB 3.45Å; R208-W212 PolarHBondContact O-N 2.94Å
209	E	62.5	Low	62.2	Low	28 Å²	28	82.3 Å²	82.3	13%	0.131	39%	0.393	C	S	.	.	H	α-helix	trans	-67	-43.3	172	-163	-148.9	-153.6	0	0	111.1	W168 R172 I205 E207 S211 W212 K213	W168-E209 HydrophobicContact CH2-CB 3.95Å; W168-E209 HydrophobicContact CH2-CG 3.82Å; W168-E209 HydrophobicContact CZ3-CB 3.71Å; W168-E209 HydrophobicContact CZ3-CG 3.73Å; R172-E209 WeakPolarHBondContact CD-OE1 3.29Å; R172-E209 IonicContact CZ-OE1 3.68Å; R172-E209 IonicContact NE-OE1 3.94Å; R172-E209 IonicContact NH1-OE1 3.65Å; R172-E209 PolarHBondContact NH1-OE1 2.94Å; I205-E209 WeakPolarHBondContact O-CB 3.35Å; I205-E209 PolarHBondContact O-N 3.29Å; E207-E209 VanDerWaalsContact C-N 3.33Å; E207-E209 PolarHBondContact O-N 3.38Å; E209-S211 VanDerWaalsContact C-N 3.3Å; E209-S211 PolarHBondContact O-N 3.19Å; E209-W212 PolarHBondContact O-N 3.48Å; E209-K213 HydrophobicContact CG-CD 4.14Å; E209-K213 HydrophobicContact CG-CG 4.49Å; E209-K213 VanDerWaalsContact O-CB 3.26Å; E209-K213 WeakPolarHBondContact O-CB 3.37Å; E209-K213 VanDerWaalsContact O-CG 3.26Å; E209-K213 WeakPolarHBondContact O-CG 3.34Å; E209-K213 PolarHBondContact O-N 3.03Å; E209-K213 WeakPolarHBondContact OE1-CE 3.48Å; E209-K213 IonicContact OE1-NZ 2.81Å; E209-K213 PolarHBondContact OE1-NZ 3.3Å; E209-K213 WeakPolarHBondContact OE2-CE 3.49Å; E209-K213 IonicContact OE2-NZ 3.22Å; E209-K213 PolarHBondContact OE2-NZ 3.01Å
210	R	60.3	Low	60.7	Low	174 Å²	174	80.7 Å²	80.7	66%	0.657	39%	0.387	S	S	*	.	H	α-helix	trans	-60.7	-40.1	174.8	-166.3	-176.4	-67	147.5	-3.1	111.4	N206 E207 A214	N206-R210 WeakPolarHBondContact O-CB 3.09Å; N206-R210 PolarHBondContact O-N 2.99Å; E207-R210 WeakPolarHBondContact O-CB 3.47Å; E207-R210 PolarHBondContact O-N 3.27Å; R210-A214 WeakPolarHBondContact O-CB 3.36Å; R210-A214 PolarHBondContact O-N 3.39Å; R210-A214 VanDerWaalsContact O-N 3.15Å
211	S	58.6	Low	59	Low	71 Å²	71	86.2 Å²	86.2	50%	0.497	42%	0.416	S	S	.	.	H	α-helix	trans	-67.9	-48.9	174.6	-172.5	0	0	0	0	112.1	E207 R208 E209 K213 A214 S215	E207-S211 WeakPolarHBondContact O-CB 3.46Å; E207-S211 PolarHBondContact O-N 3.43Å; R208-S211 PolarHBondContact O-N 3.03Å; E209-S211 VanDerWaalsContact C-N 3.3Å; E209-S211 PolarHBondContact O-N 3.19Å; S211-K213 PolarHBondContact O-N 3.31Å; S211-A214 CarbonylContact O-C 3.58Å; S211-A214 VanDerWaalsContact O-CA 3.29Å; S211-A214 WeakPolarHBondContact O-CA 3.32Å; S211-A214 VanDerWaalsContact O-CB 3.27Å; S211-A214 WeakPolarHBondContact O-CB 3.46Å; S211-A214 PolarHBondContact O-N 3.22Å; S211-S215 PolarHBondContact O-N 3.03Å; S211-S215 PolarHBondContact O-OG 3.36Å
212	W	60.1	Low	57.5	Low	87 Å²	87	92.5 Å²	92.5	33%	0.33	44%	0.439	S	S	.	.	H	α-helix	trans	-61.5	-43.2	177.9	-175.1	82.2	0	0	0	112	W168 M169 R208 E209 A214 S215 Q216	W168-W212 HydrophobicContact CH2-CB 4.39Å; W168-W212 HydrophobicContact CH2-CD2 4.34Å; W168-W212 HydrophobicContact CH2-CE3 4.29Å; W168-W212 HydrophobicContact CH2-CG 4.42Å; W168-W212 HydrophobicContact CZ2-CB 4.14Å; W168-W212 HydrophobicContact CZ2-CD2 4.18Å; W168-W212 HydrophobicContact CZ2-CG 4.01Å; M169-W212 HydrophobicContact SD-CH2 4.37Å; M169-W212 HydrophobicContact SD-CZ2 4.36Å; R208-W212 VanDerWaalsContact O-CB 3.23Å; R208-W212 WeakPolarHBondContact O-CB 3.45Å; R208-W212 PolarHBondContact O-N 2.94Å; E209-W212 PolarHBondContact O-N 3.48Å; W212-A214 PolarHBondContact O-N 3.44Å; W212-S215 PolarHBondContact O-N 2.97Å; W212-Q216 HydrophobicContact CD2-CG 4.47Å; W212-Q216 VanDerWaalsContact CH2-NE2 3.29Å; W212-Q216 WeakPolarHBondContact O-CG 3.41Å; W212-Q216 PolarHBondContact O-N 2.81Å
213	K	59.7	Low	56	Low	101 Å²	101	93.7 Å²	93.7	44%	0.439	45%	0.448	S	S	.	.	H	α-helix	trans	-61.8	-22.7	170.3	-74.2	171.5	174.8	170.9	0	113.1	E209 S211	E209-K213 HydrophobicContact CG-CD 4.14Å; E209-K213 HydrophobicContact CG-CG 4.49Å; E209-K213 VanDerWaalsContact O-CB 3.26Å; E209-K213 WeakPolarHBondContact O-CB 3.37Å; E209-K213 VanDerWaalsContact O-CG 3.26Å; E209-K213 WeakPolarHBondContact O-CG 3.34Å; E209-K213 PolarHBondContact O-N 3.03Å; E209-K213 WeakPolarHBondContact OE1-CE 3.48Å; E209-K213 IonicContact OE1-NZ 2.81Å; E209-K213 PolarHBondContact OE1-NZ 3.3Å; E209-K213 WeakPolarHBondContact OE2-CE 3.49Å; E209-K213 IonicContact OE2-NZ 3.22Å; E209-K213 PolarHBondContact OE2-NZ 3.01Å; S211-K213 PolarHBondContact O-N 3.31Å
214	A	49	Very low	54.7	Low	43 Å²	43	96.8 Å²	96.8	36%	0.355	46%	0.461	S	S	.	.	H	α-helix	trans	-84.6	-40.9	172.1	0	0	0	0	0	112.2	R210 S211 W212 Q216 K217	R210-A214 WeakPolarHBondContact O-CB 3.36Å; R210-A214 PolarHBondContact O-N 3.39Å; R210-A214 VanDerWaalsContact O-N 3.15Å; S211-A214 CarbonylContact O-C 3.58Å; S211-A214 VanDerWaalsContact O-CA 3.29Å; S211-A214 WeakPolarHBondContact O-CA 3.32Å; S211-A214 VanDerWaalsContact O-CB 3.27Å; S211-A214 WeakPolarHBondContact O-CB 3.46Å; S211-A214 PolarHBondContact O-N 3.22Å; W212-A214 PolarHBondContact O-N 3.44Å; A214-Q216 VanDerWaalsContact C-N 3.28Å; A214-Q216 PolarHBondContact O-N 2.99Å; A214-K217 WeakPolarHBondContact O-CA 3.3Å; A214-K217 WeakPolarHBondContact O-CB 3.39Å; A214-K217 WeakPolarHBondContact O-CG 3.19Å; A214-K217 PolarHBondContact O-N 2.76Å
215	S	47.2	Very low	53.6	Low	92 Å²	92	103.2 Å²	103.2	64%	0.643	49%	0.491	S	S	*	.	H	α-helix	trans	-62.3	-33.5	172.9	-52.6	0	0	0	0	112.4	S211 W212 K217	S211-S215 PolarHBondContact O-N 3.03Å; S211-S215 PolarHBondContact O-OG 3.36Å; W212-S215 PolarHBondContact O-N 2.97Å; S215-K217 PolarHBondContact O-N 3.03Å
216	Q	52.3	Low	52.5	Low	50 Å²	50	111.4 Å²	111.4	23%	0.234	52%	0.522	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-6.7	170.4	-70.7	-157	-17.1	0	0	114.4	W212 A214 I218 C253	W212-Q216 HydrophobicContact CD2-CG 4.47Å; W212-Q216 VanDerWaalsContact CH2-NE2 3.29Å; W212-Q216 WeakPolarHBondContact O-CG 3.41Å; W212-Q216 PolarHBondContact O-N 2.81Å; A214-Q216 VanDerWaalsContact C-N 3.28Å; A214-Q216 PolarHBondContact O-N 2.99Å; Q216-I218 PolarHBondContact O-N 3.01Å; Q216-C253 PolarHBondContact NE2-O 3.48Å
217	K	52.9	Low	51.9	Low	157 Å²	157	115.6 Å²	115.6	68%	0.683	54%	0.535	S	S	*	.	S	Bend	trans	-76.5	84	162.9	-57.2	170.1	-175.5	169.7	0	107	A214 S215 Q219	A214-K217 WeakPolarHBondContact O-CA 3.3Å; A214-K217 WeakPolarHBondContact O-CB 3.39Å; A214-K217 WeakPolarHBondContact O-CG 3.19Å; A214-K217 PolarHBondContact O-N 2.76Å; S215-K217 PolarHBondContact O-N 3.03Å; K217-Q219 PolarHBondContact O-N 3.47Å; K217-Q219 VanDerWaalsContact O-N 3.07Å
218	I	52.7	Low	51.5	Low	40 Å²	40	110.5 Å²	110.5	21%	0.205	51%	0.512	C	S	.	.			trans	-39.8	121	172.5	-58.2	169.2	0	0	0	108.1	Q216 A220 F246 F249 K250	Q216-I218 PolarHBondContact O-N 3.01Å; I218-A220 VanDerWaalsContact C-N 3.26Å; I218-A220 PolarHBondContact O-N 3.13Å; I218-F246 HydrophobicContact CB-CD2 4.46Å; I218-F246 HydrophobicContact CB-CE2 3.63Å; I218-F246 HydrophobicContact CB-CZ 4.2Å; I218-F246 HydrophobicContact CD1-CD2 3.79Å; I218-F246 HydrophobicContact CD1-CE2 3.62Å; I218-F246 HydrophobicContact CD1-CG 4.45Å; I218-F246 HydrophobicContact CD1-CZ 4.13Å; I218-F246 HydrophobicContact CG1-CE2 4.21Å; I218-F246 HydrophobicContact CG2-CD2 4.15Å; I218-F246 HydrophobicContact CG2-CE2 3.61Å; I218-F249 HydrophobicContact CD1-CD1 4.36Å; I218-K250 HydrophobicContact CD1-CB 4.07Å
219	Q	44.8	Very low	51.4	Low	190 Å²	190	107.8 Å²	107.8	89%	0.888	51%	0.508	S	S	*	.			trans	-72	83.4	-166.9	-174.1	173.5	-3	0	0	109.6	K217 N221	K217-Q219 PolarHBondContact O-N 3.47Å; K217-Q219 VanDerWaalsContact O-N 3.07Å; Q219-N221 PolarHBondContact O-N 3.22Å; Q219-N221 VanDerWaalsContact O-N 3.08Å
220	A	44	Very low	51.7	Low	13 Å²	13	106.7 Å²	106.7	11%	0.107	50%	0.503	C	S	.	.			trans	-53.7	119	-178.6	0	0	0	0	0	109.4	I218 K438	I218-A220 VanDerWaalsContact C-N 3.26Å; I218-A220 PolarHBondContact O-N 3.13Å; A220-K438 HydrophobicContact CB-CD 4.26Å; A220-K438 VanDerWaalsContact CB-CE 3.44Å; A220-K438 HydrophobicContact CB-CG 4.3Å
221	N	42.6	Very low	52.3	Low	115 Å²	115	99 Å²	99	62%	0.615	47%	0.474	S	S	*	.			trans	-69.8	136.6	-172.4	-147.9	-8.5	0	0	0	108.2	Q219 S223 D435	Q219-N221 PolarHBondContact O-N 3.22Å; Q219-N221 VanDerWaalsContact O-N 3.08Å; N221-S223 PolarHBondContact O-N 2.6Å; N221-D435 VanDerWaalsContact CB-OD1 3.28Å; N221-D435 WeakPolarHBondContact CB-OD1 3.32Å
222	Y	45.2	Very low	53.2	Low	206 Å²	206	96 Å²	96	81%	0.808	45%	0.452	S	S	*	.			trans	-83.4	45.4	174.5	-74.8	-95.6	0	0	0	110.2	K224	Y222-K224 PolarHBondContact O-N 3.05Å
223	S	41.2	Very low	54	Low	55 Å²	55	95.5 Å²	95.5	39%	0.385	46%	0.456	S	S	.	.			trans	-50.5	124.1	174.9	-69.4	0	0	0	0	109.8	N221 K225 D435	N221-S223 PolarHBondContact O-N 2.6Å; S223-K225 PolarHBondContact O-N 3.42Å; S223-D435 VanDerWaalsContact CB-OD2 3.23Å; S223-D435 WeakPolarHBondContact CB-OD2 3.49Å; S223-D435 PolarHBondContact OG-OD2 2.89Å
224	K	44.3	Very low	54.8	Low	209 Å²	209	97 Å²	97	91%	0.909	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-42.9	91.3	-168.8	-67.1	175.4	178.2	175.7	0	113	Y222 R226	Y222-K224 PolarHBondContact O-N 3.05Å; K224-R226 VanDerWaalsContact C-N 3.29Å; K224-R226 PolarHBondContact O-N 3.47Å
225	K	43.9	Very low	56.5	Low	204 Å²	204	95.3 Å²	95.3	89%	0.887	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	2.9	69.2	-176.4	-65.8	-173.5	-179.1	-179	0	115.1	S223 K227	S223-K225 PolarHBondContact O-N 3.42Å; K225-K227 PolarHBondContact O-N 3.37Å
226	R	46.8	Very low	58.4	Low	182 Å²	182	96.4 Å²	96.4	69%	0.687	44%	0.444	S	S	*	.			trans	-65	124.9	167.1	-173.8	-173.9	-72.1	-176.2	0.3	106.4	K224 V228 E239	K224-R226 VanDerWaalsContact C-N 3.29Å; K224-R226 PolarHBondContact O-N 3.47Å; R226-V228 HydrophobicContact CG-CG2 4.48Å; R226-V228 PolarHBondContact O-N 2.95Å; R226-E239 IonicContact CZ-OE1 3.91Å; R226-E239 IonicContact NH1-OE1 2.88Å; R226-E239 PolarHBondContact NH1-OE1 3.4Å
227	K	54	Low	60.3	Low	192 Å²	192	95.1 Å²	95.1	84%	0.835	44%	0.44	S	S	*	.			trans	-72.1	77.3	174.2	-72.1	-170	175.7	-171.3	0	109.3	K225 S229	K225-K227 PolarHBondContact O-N 3.37Å; K227-S229 PolarHBondContact O-N 2.73Å
228	V	55.4	Low	62	Low	20 Å²	20	90.2 Å²	90.2	12%	0.121	43%	0.426	C	S	.	.			trans	-65	124.2	171	-179.4	0	0	0	0	107.6	R226 L230 L235 L440	R226-V228 HydrophobicContact CG-CG2 4.48Å; R226-V228 PolarHBondContact O-N 2.95Å; V228-L230 PolarHBondContact O-N 2.73Å; V228-L235 HydrophobicContact CG1-CD1 4.11Å; V228-L440 HydrophobicContact CG1-CD1 3.74Å
229	S	61.8	Low	63.7	Low	35 Å²	35	90.1 Å²	90.1	25%	0.245	42%	0.424	C	S	.	.			trans	-69.1	131.7	174.2	-168.8	0	0	0	0	109.4	K227 L231	K227-S229 PolarHBondContact O-N 2.73Å; S229-L231 PolarHBondContact O-N 3.37Å; S229-L231 WeakPolarHBondContact OG-CB 3.25Å; S229-L231 PolarHBondContact OG-N 2.76Å
230	L	68.3	Low	65.8	Low	5 Å²	5	81.1 Å²	81.1	3%	0.026	38%	0.382	C	S	.	.			trans	-80.6	9.8	171.7	-58	-178.6	0	0	0	112	V228 D439 L440 L443 N512 Y513	V228-L230 PolarHBondContact O-N 2.73Å; L230-D439 HydrophobicContact CD1-CB 4.5Å; L230-D439 HydrophobicContact CD2-CB 4.1Å; L230-L440 HydrophobicContact CD2-CB 3.86Å; L230-L440 HydrophobicContact CD2-CD1 4.22Å; L230-L440 HydrophobicContact CD2-CG 4.31Å; L230-L443 HydrophobicContact CB-CD1 3.86Å; L230-L443 VanDerWaalsContact O-CD1 3.24Å; L230-L443 WeakPolarHBondContact O-CD1 3.47Å; L230-N512 HydrophobicContact CD1-CB 4.04Å; L230-Y513 HydrophobicContact CB-CE2 3.97Å; L230-Y513 HydrophobicContact CD1-CE2 3.96Å; L230-Y513 HydrophobicContact CG-CE2 4.27Å; L230-Y513 PolarHBondContact N-OH 3.21Å
231	L	73.1	Confident	68.1	Low	11 Å²	11	80.5 Å²	80.5	6%	0.058	38%	0.377	C	S	.	.			trans	-97.9	124.1	-177.7	-54.9	-178.3	0	0	0	110.6	S229 D233 H234 L235 Y513 K528 I529	S229-L231 PolarHBondContact O-N 3.37Å; S229-L231 WeakPolarHBondContact OG-CB 3.25Å; S229-L231 PolarHBondContact OG-N 2.76Å; L231-D233 VanDerWaalsContact C-N 3.26Å; L231-D233 PolarHBondContact O-N 3.05Å; L231-H234 PolarHBondContact O-N 3.05Å; L231-H234 VanDerWaalsContact O-N 3.16Å; L231-L235 PolarHBondContact O-N 2.96Å; L231-Y513 WeakPolarHBondContact CG-OH 3.43Å; L231-K528 HydrophobicContact CD1-CB 3.69Å; L231-K528 HydrophobicContact CD1-CD 3.9Å; L231-K528 HydrophobicContact CD1-CG 4.25Å; L231-K528 VanDerWaalsContact CD2-C 3.5Å; L231-K528 HydrophobicContact CD2-CB 3.58Å; L231-K528 HydrophobicContact CG-CB 4.24Å; L231-I529 HydrophobicContact CD2-CB 4.41Å; L231-I529 HydrophobicContact CD2-CG1 3.73Å
232	F	79	Confident	70.3	Confident	10 Å²	10	77.6 Å²	77.6	4%	0.044	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-40.8	-177.3	174.9	-93.1	0	0	0	112.6	H234 L235 L240 W288 M292 V305 K308 F309 S532	F232-H234 PolarHBondContact O-N 3.31Å; F232-L235 PolarHBondContact O-N 3.39Å; F232-L240 HydrophobicContact CD2-CD2 4.41Å; F232-L240 HydrophobicContact CE2-CD2 3.87Å; F232-W288 HydrophobicContact CD2-CH2 4.13Å; F232-W288 AromaticContact CD2-CZ2 3.96Å; F232-W288 HydrophobicContact CD2-CZ2 3.96Å; F232-W288 AromaticContact CE2-CH2 3.83Å; F232-W288 HydrophobicContact CE2-CH2 3.83Å; F232-W288 AromaticContact CE2-CZ2 4Å; F232-W288 HydrophobicContact CE2-CZ2 4Å; F232-M292 HydrophobicContact CD2-SD 4.46Å; F232-V305 HydrophobicContact CE1-CG1 4.08Å; F232-V305 HydrophobicContact CE1-CG2 4.22Å; F232-V305 HydrophobicContact CZ-CG1 4.2Å; F232-K308 HydrophobicContact CE1-CD 4.22Å; F232-K308 HydrophobicContact CZ-CD 4.29Å; F232-K308 PolarHBondContact O-NZ 3.14Å; F232-F309 AromaticContact CE2-CE1 3.94Å; F232-F309 HydrophobicContact CE2-CE1 3.94Å; F232-F309 AromaticContact CE2-CZ 3.71Å; F232-F309 HydrophobicContact CE2-CZ 3.71Å; F232-F309 HydrophobicContact CZ-CE1 4.05Å; F232-F309 HydrophobicContact CZ-CE2 4.01Å; F232-F309 AromaticContact CZ-CZ 3.59Å; F232-F309 HydrophobicContact CZ-CZ 3.59Å; F232-S532 PolarHBondContact N-OG 3.19Å
233	D	75.8	Confident	72.4	Confident	75 Å²	75	68 Å²	68	40%	0.401	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-33.7	-176.3	-57.9	-70.8	0	0	0	112.8	L231 R296 K308	L231-D233 VanDerWaalsContact C-N 3.26Å; L231-D233 PolarHBondContact O-N 3.05Å; D233-R296 IonicContact OD1-CZ 2.81Å; D233-R296 IonicContact OD1-NE 2.69Å; D233-R296 IonicContact OD1-NH2 2.59Å; D233-R296 PolarHBondContact OD1-NH2 2.81Å; D233-R296 IonicContact OD2-NH2 3.19Å; D233-R296 PolarHBondContact OD2-NH2 2.7Å; D233-K308 VanDerWaalsContact C-NZ 3.33Å; D233-K308 PolarHBondContact O-NZ 2.84Å
234	H	77.1	Confident	74.7	Confident	133 Å²	133	65.4 Å²	65.4	62%	0.616	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-7.9	179.8	-58.3	-43.6	0	0	0	114.8	L231 F232	L231-H234 PolarHBondContact O-N 3.05Å; L231-H234 VanDerWaalsContact O-N 3.16Å; F232-H234 PolarHBondContact O-N 3.31Å
235	L	83.3	Confident	77	Confident	7 Å²	7	55.5 Å²	55.5	4%	0.037	26%	0.263	C	S	.	.	S	Bend	trans	-72	131.1	175.9	-176	64	0	0	0	111	V228 L231 F232 E239 L240 K308 L440	V228-L235 HydrophobicContact CG1-CD1 4.11Å; L231-L235 PolarHBondContact O-N 2.96Å; F232-L235 PolarHBondContact O-N 3.39Å; L235-E239 HydrophobicContact CD1-CB 3.83Å; L235-L240 HydrophobicContact CD2-CB 3.75Å; L235-L240 HydrophobicContact CD2-CD1 3.94Å; L235-L240 HydrophobicContact CD2-CG 4.26Å; L235-L240 HydrophobicContact CG-CB 4.2Å; L235-K308 WeakPolarHBondContact O-CE 3.42Å; L235-K308 PolarHBondContact O-NZ 2.87Å; L235-L440 HydrophobicContact CD1-CD1 3.58Å; L235-L440 HydrophobicContact CD2-CD1 3.91Å; L235-L440 HydrophobicContact CD2-CD2 4.11Å; L235-L440 HydrophobicContact CG-CD1 4.35Å
236	E	87.6	Confident	79.1	Confident	115 Å²	115	46.3 Å²	46.3	54%	0.537	22%	0.223	S	C	.	.			trans	-69.4	146.1	178.5	-76.7	-62	155.5	0	0	112.3	S238 E239 L240	E236-S238 PolarHBondContact O-N 3.31Å; E236-E239 HydrophobicContact CB-CB 4.37Å; E236-E239 HydrophobicContact CB-CG 4.22Å; E236-E239 PolarHBondContact O-N 3.02Å; E236-E239 VanDerWaalsContact O-N 3.16Å; E236-L240 PolarHBondContact O-N 3.49Å
237	P	91.8	Very high	81.1	Confident	23 Å²	23	38.5 Å²	38.5	15%	0.149	20%	0.195	C	C	.	.	H	α-helix	trans	-61.5	-28.4	-179.5	-23.4	34.4	0	0	0	114.2	A241 K308 H311 V312	P237-A241 WeakPolarHBondContact O-CB 3.49Å; P237-A241 PolarHBondContact O-N 3.25Å; P237-A241 VanDerWaalsContact O-N 3.14Å; P237-K308 HydrophobicContact CG-CG 4.33Å; P237-H311 HydrophobicContact CB-CB 3.75Å; P237-H311 HydrophobicContact CG-CB 3.88Å; P237-V312 HydrophobicContact CB-CG2 4Å
238	S	90.1	Very high	82.9	Confident	55 Å²	55	29.4 Å²	29.4	39%	0.385	16%	0.155	S	C	.	.	H	α-helix	trans	-69.3	-51.6	171.2	45.9	0	0	0	0	111.7	E236 L240 A241 D242	E236-S238 PolarHBondContact O-N 3.31Å; S238-L240 VanDerWaalsContact C-N 3.25Å; S238-L240 PolarHBondContact O-N 2.96Å; S238-A241 CarbonylContact O-C 3.44Å; S238-A241 WeakPolarHBondContact O-CA 3.38Å; S238-A241 WeakPolarHBondContact O-CB 3.44Å; S238-A241 PolarHBondContact O-N 3.05Å; S238-D242 PolarHBondContact O-N 3.01Å
239	E	87.6	Confident	84.5	Confident	37 Å²	37	29 Å²	29	17%	0.173	15%	0.152	C	C	.	.	H	α-helix	trans	-59.1	-38.2	178.5	-65.9	-170	159	0	0	110.9	R226 L235 E236 D242 H243	R226-E239 IonicContact CZ-OE1 3.91Å; R226-E239 IonicContact NH1-OE1 2.88Å; R226-E239 PolarHBondContact NH1-OE1 3.4Å; L235-E239 HydrophobicContact CD1-CB 3.83Å; E236-E239 HydrophobicContact CB-CB 4.37Å; E236-E239 HydrophobicContact CB-CG 4.22Å; E236-E239 PolarHBondContact O-N 3.02Å; E236-E239 VanDerWaalsContact O-N 3.16Å; E239-D242 PolarHBondContact O-N 3.27Å; E239-H243 PolarHBondContact O-N 2.88Å; E239-H243 VanDerWaalsContact O-N 3.17Å; E239-H243 PolarHBondContact O-ND1 3.49Å
240	L	89.2	Confident	85.7	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-64.7	-41	172.6	-178.3	51.6	0	0	0	112.8	F232 L235 E236 S238 H243 L244 W288 F309 V312 L444	F232-L240 HydrophobicContact CD2-CD2 4.41Å; F232-L240 HydrophobicContact CE2-CD2 3.87Å; L235-L240 HydrophobicContact CD2-CB 3.75Å; L235-L240 HydrophobicContact CD2-CD1 3.94Å; L235-L240 HydrophobicContact CD2-CG 4.26Å; L235-L240 HydrophobicContact CG-CB 4.2Å; E236-L240 PolarHBondContact O-N 3.49Å; S238-L240 VanDerWaalsContact C-N 3.25Å; S238-L240 PolarHBondContact O-N 2.96Å; L240-H243 PolarHBondContact O-N 2.96Å; L240-L244 HydrophobicContact CD1-CD1 3.95Å; L240-L244 HydrophobicContact CD1-CG 4Å; L240-L244 HydrophobicContact CG-CD1 4.03Å; L240-L244 WeakPolarHBondContact O-CB 3.45Å; L240-L244 VanDerWaalsContact O-CG 3.32Å; L240-L244 WeakPolarHBondContact O-CG 3.36Å; L240-L244 PolarHBondContact O-N 3.19Å; L240-W288 HydrophobicContact CD1-CH2 3.98Å; L240-W288 HydrophobicContact CD2-CH2 4.02Å; L240-F309 HydrophobicContact CD2-CE1 4.42Å; L240-V312 HydrophobicContact CB-CG2 4.25Å; L240-V312 HydrophobicContact CD2-CG2 3.75Å; L240-V312 HydrophobicContact CG-CG1 4.38Å; L240-V312 HydrophobicContact CG-CG2 4.11Å; L240-L444 HydrophobicContact CD1-CD1 4.04Å; L240-L444 HydrophobicContact CD1-CD2 4.04Å
241	A	92.2	Very high	86.6	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-64	-37.9	175.3	0	0	0	0	0	112.6	P237 S238 T245 V312 C315 L316 M319	P237-A241 WeakPolarHBondContact O-CB 3.49Å; P237-A241 PolarHBondContact O-N 3.25Å; P237-A241 VanDerWaalsContact O-N 3.14Å; S238-A241 CarbonylContact O-C 3.44Å; S238-A241 WeakPolarHBondContact O-CA 3.38Å; S238-A241 WeakPolarHBondContact O-CB 3.44Å; S238-A241 PolarHBondContact O-N 3.05Å; A241-T245 VanDerWaalsContact O-CB 3.23Å; A241-T245 WeakPolarHBondContact O-CB 3.43Å; A241-T245 PolarHBondContact O-N 3.35Å; A241-T245 PolarHBondContact O-OG1 2.78Å; A241-V312 HydrophobicContact CB-CG1 4.18Å; A241-C315 HydrophobicContact CB-CB 3.47Å; A241-C315 VanDerWaalsContact CB-CB 3.47Å; A241-L316 HydrophobicContact CB-CD2 3.9Å; A241-L316 HydrophobicContact CB-CG 3.97Å; A241-M319 HydrophobicContact CB-SD 3.92Å
242	D	89.1	Confident	87.4	Confident	54 Å²	54	30.5 Å²	30.5	29%	0.289	16%	0.155	S	C	.	.	H	α-helix	trans	-59.9	-48.8	174.6	-73.1	-48.5	0	0	0	111.8	S238 E239 T245 F246 M319	S238-D242 PolarHBondContact O-N 3.01Å; E239-D242 PolarHBondContact O-N 3.27Å; D242-T245 PolarHBondContact O-N 3.47Å; D242-F246 WeakPolarHBondContact O-CB 3.45Å; D242-F246 PolarHBondContact O-N 3.15Å; D242-M319 WeakPolarHBondContact OD1-CE 3.37Å
243	H	88.1	Confident	87.8	Confident	6 Å²	6	30.9 Å²	30.9	3%	0.028	16%	0.158	C	C	.	.	H	α-helix	trans	-72.5	-35	-176.3	-68.4	72.1	0	0	0	112.7	E239 L240 L247 N437 L440 L444	E239-H243 PolarHBondContact O-N 2.88Å; E239-H243 VanDerWaalsContact O-N 3.17Å; E239-H243 PolarHBondContact O-ND1 3.49Å; L240-H243 PolarHBondContact O-N 2.96Å; H243-L247 WeakPolarHBondContact O-CG 3.24Å; H243-L247 PolarHBondContact O-N 2.94Å; H243-N437 WeakPolarHBondContact NE2-CB 3.41Å; H243-N437 PolarHBondContact NE2-N 2.62Å; H243-L440 HydrophobicContact CB-CD2 3.85Å; H243-L444 HydrophobicContact CB-CD1 3.72Å
244	L	91	Very high	88.2	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-67.7	-40.9	171.4	-68.5	171.6	0	0	0	111.5	L240 F246 L247 E248 I285 W288 V312 T324 L444 L448	L240-L244 HydrophobicContact CD1-CD1 3.95Å; L240-L244 HydrophobicContact CD1-CG 4Å; L240-L244 HydrophobicContact CG-CD1 4.03Å; L240-L244 WeakPolarHBondContact O-CB 3.45Å; L240-L244 VanDerWaalsContact O-CG 3.32Å; L240-L244 WeakPolarHBondContact O-CG 3.36Å; L240-L244 PolarHBondContact O-N 3.19Å; L244-F246 VanDerWaalsContact C-N 3.34Å; L244-F246 PolarHBondContact O-N 3.36Å; L244-L247 PolarHBondContact O-N 3.48Å; L244-E248 WeakPolarHBondContact O-CB 3.41Å; L244-E248 PolarHBondContact O-N 3.03Å; L244-I285 HydrophobicContact CD2-CD1 4.18Å; L244-I285 HydrophobicContact CD2-CG1 4.25Å; L244-W288 HydrophobicContact CD1-CZ3 4.42Å; L244-V312 HydrophobicContact CD1-CG1 4.23Å; L244-T324 HydrophobicContact CB-CG2 4.02Å; L244-T324 HydrophobicContact CD1-CG2 4.44Å; L244-L444 HydrophobicContact CD2-CD1 4.32Å; L244-L448 HydrophobicContact CD2-CD1 4.26Å
245	T	91.9	Very high	88.7	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-65	-37.7	175.9	-57.9	0	0	0	0	111.9	A241 D242 E248 F249 L316 M319 N321 F381 I383 L434	A241-T245 VanDerWaalsContact O-CB 3.23Å; A241-T245 WeakPolarHBondContact O-CB 3.43Å; A241-T245 PolarHBondContact O-N 3.35Å; A241-T245 PolarHBondContact O-OG1 2.78Å; D242-T245 PolarHBondContact O-N 3.47Å; T245-E248 PolarHBondContact O-N 3.38Å; T245-F249 VanDerWaalsContact O-CB 3.23Å; T245-F249 WeakPolarHBondContact O-CB 3.41Å; T245-F249 PolarHBondContact O-N 3.31Å; T245-L316 WeakPolarHBondContact OG1-CD2 3.44Å; T245-M319 HydrophobicContact CG2-CE 3.88Å; T245-N321 WeakPolarHBondContact CA-ND2 3.41Å; T245-N321 WeakPolarHBondContact CB-ND2 3.37Å; T245-N321 HydrophobicContact CG2-CB 4.01Å; T245-N321 PolarHBondContact OG1-ND2 2.92Å; T245-F381 HydrophobicContact CG2-CE1 4Å; T245-F381 HydrophobicContact CG2-CZ 4.05Å; T245-I383 HydrophobicContact CG2-CD1 3.86Å; T245-L434 HydrophobicContact CG2-CD1 3.94Å; T245-L434 HydrophobicContact CG2-CD2 4.08Å
246	F	88.7	Confident	88.9	Confident	12 Å²	12	26.7 Å²	26.7	5%	0.053	13%	0.134	C	C	.	.	H	α-helix	trans	-62.9	-43.3	172.1	174.6	-83.7	0	0	0	112.3	I218 D242 L244 K250 L434 A436 V441	I218-F246 HydrophobicContact CB-CD2 4.46Å; I218-F246 HydrophobicContact CB-CE2 3.63Å; I218-F246 HydrophobicContact CB-CZ 4.2Å; I218-F246 HydrophobicContact CD1-CD2 3.79Å; I218-F246 HydrophobicContact CD1-CE2 3.62Å; I218-F246 HydrophobicContact CD1-CG 4.45Å; I218-F246 HydrophobicContact CD1-CZ 4.13Å; I218-F246 HydrophobicContact CG1-CE2 4.21Å; I218-F246 HydrophobicContact CG2-CD2 4.15Å; I218-F246 HydrophobicContact CG2-CE2 3.61Å; D242-F246 WeakPolarHBondContact O-CB 3.45Å; D242-F246 PolarHBondContact O-N 3.15Å; L244-F246 VanDerWaalsContact C-N 3.34Å; L244-F246 PolarHBondContact O-N 3.36Å; F246-K250 HydrophobicContact CE1-CD 3.92Å; F246-K250 HydrophobicContact CZ-CD 4.4Å; F246-K250 WeakPolarHBondContact O-CB 3.14Å; F246-K250 PolarHBondContact O-N 2.99Å; F246-L434 HydrophobicContact CB-CD1 4.36Å; F246-L434 HydrophobicContact CD2-CB 4.47Å; F246-A436 HydrophobicContact CB-CB 3.68Å; F246-A436 HydrophobicContact CD1-CB 3.87Å; F246-A436 HydrophobicContact CD2-CB 3.38Å; F246-A436 HydrophobicContact CE1-CB 4.32Å; F246-A436 HydrophobicContact CE2-CB 3.85Å; F246-A436 HydrophobicContact CG-CB 3.38Å; F246-A436 HydrophobicContact CZ-CB 4.31Å; F246-V441 HydrophobicContact CD1-CG1 4.4Å; F246-V441 HydrophobicContact CD1-CG2 3.8Å; F246-V441 HydrophobicContact CE1-CG1 4.07Å; F246-V441 HydrophobicContact CE1-CG2 3.87Å
247	L	87.9	Confident	88.8	Confident	17 Å²	17	22.3 Å²	22.3	9%	0.089	11%	0.113	C	C	.	.	H	α-helix	trans	-62.1	-47.5	176	-82.1	168.5	0	0	0	111.4	H243 L244 S251 L281 V441 L444 L448	H243-L247 WeakPolarHBondContact O-CG 3.24Å; H243-L247 PolarHBondContact O-N 2.94Å; L244-L247 PolarHBondContact O-N 3.48Å; L247-S251 PolarHBondContact O-N 3.04Å; L247-L281 HydrophobicContact CB-CD2 4.4Å; L247-V441 HydrophobicContact CD2-CG1 3.91Å; L247-V441 HydrophobicContact CG-CG1 4.4Å; L247-L444 HydrophobicContact CD1-CB 3.84Å; L247-L444 HydrophobicContact CD1-CD1 4.28Å; L247-L448 HydrophobicContact CD1-CD1 4.01Å
248	E	91.1	Very high	88.5	Confident	1 Å²	1	21.8 Å²	21.8	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-65	-51	-179.6	-173.6	57.6	-145.6	0	0	111.9	L244 T245 K250 S251 F252 L281 N323 T324 I383	L244-E248 WeakPolarHBondContact O-CB 3.41Å; L244-E248 PolarHBondContact O-N 3.03Å; T245-E248 PolarHBondContact O-N 3.38Å; E248-K250 VanDerWaalsContact C-N 3.3Å; E248-K250 PolarHBondContact O-N 2.9Å; E248-S251 CarbonylContact O-C 3.59Å; E248-S251 WeakPolarHBondContact O-CA 3.42Å; E248-S251 VanDerWaalsContact O-CB 3.29Å; E248-S251 WeakPolarHBondContact O-CB 3.44Å; E248-S251 PolarHBondContact O-N 3.12Å; E248-F252 PolarHBondContact O-N 2.89Å; E248-L281 WeakPolarHBondContact OE2-CD2 3.38Å; E248-N323 HydrophobicContact CG-CB 4.3Å; E248-N323 PolarHBondContact OE1-ND2 3.29Å; E248-T324 WeakPolarHBondContact CB-OG1 3.23Å; E248-I383 HydrophobicContact CB-CD1 4.42Å; E248-I383 HydrophobicContact CG-CD1 4.3Å; E248-I383 HydrophobicContact CG-CG2 4.26Å
249	F	89.6	Confident	88.4	Confident	12 Å²	12	20 Å²	20	5%	0.053	10%	0.095	C	C	.	.	H	α-helix	trans	-59	-41.2	178.7	-171.8	-116.9	0	0	0	111.8	I218 T245 S251 F252 C253 F381 I383	I218-F249 HydrophobicContact CD1-CD1 4.36Å; T245-F249 VanDerWaalsContact O-CB 3.23Å; T245-F249 WeakPolarHBondContact O-CB 3.41Å; T245-F249 PolarHBondContact O-N 3.31Å; F249-S251 PolarHBondContact O-N 3.34Å; F249-F252 HydrophobicContact CD2-CD1 4.39Å; F249-F252 PolarHBondContact O-N 3.09Å; F249-C253 VanDerWaalsContact CE2-SG 3.55Å; F249-C253 VanDerWaalsContact CZ-SG 3.51Å; F249-C253 WeakPolarHBondContact O-CB 3.43Å; F249-C253 PolarHBondContact O-N 3.49Å; F249-C253 PolarHBondContact O-SG 3.18Å; F249-F381 HydrophobicContact CD1-CE2 4.29Å; F249-F381 AromaticContact CD2-CE2 3.71Å; F249-F381 HydrophobicContact CD2-CE2 3.71Å; F249-F381 HydrophobicContact CD2-CZ 4.09Å; F249-F381 HydrophobicContact CE1-CE2 4.26Å; F249-F381 HydrophobicContact CE2-CD2 4.44Å; F249-F381 AromaticContact CE2-CE2 3.68Å; F249-F381 HydrophobicContact CE2-CE2 3.68Å; F249-F381 HydrophobicContact CE2-CZ 4.49Å; F249-F381 HydrophobicContact CG-CE2 4.03Å; F249-F381 HydrophobicContact CG-CZ 4.25Å; F249-F381 AromaticContact CZ-CE2 3.96Å; F249-F381 HydrophobicContact CZ-CE2 3.96Å; F249-I383 HydrophobicContact CB-CD1 3.87Å; F249-I383 HydrophobicContact CD2-CD1 4.27Å; F249-I383 HydrophobicContact CD2-CG1 4.42Å
250	K	86.4	Confident	88.5	Confident	71 Å²	71	18.3 Å²	18.3	31%	0.309	9%	0.087	S	C	.	.	H	α-helix	trans	-66.5	-23.6	174.1	-177.6	-178.8	174.5	-171.5	0	113.5	I218 F246 E248 R254	I218-K250 HydrophobicContact CD1-CB 4.07Å; F246-K250 HydrophobicContact CE1-CD 3.92Å; F246-K250 HydrophobicContact CZ-CD 4.4Å; F246-K250 WeakPolarHBondContact O-CB 3.14Å; F246-K250 PolarHBondContact O-N 2.99Å; E248-K250 VanDerWaalsContact C-N 3.3Å; E248-K250 PolarHBondContact O-N 2.9Å; K250-R254 VanDerWaalsContact O-CD 3.24Å; K250-R254 WeakPolarHBondContact O-CD 3.4Å; K250-R254 WeakPolarHBondContact O-CG 3.38Å
251	S	87.8	Confident	88.5	Confident	9 Å²	9	18.2 Å²	18.2	6%	0.063	9%	0.087	C	C	.	.	H	α-helix	trans	-78.3	-50.7	170.8	-147.3	0	0	0	0	110.2	L247 E248 F249 C253 R254	L247-S251 PolarHBondContact O-N 3.04Å; E248-S251 CarbonylContact O-C 3.59Å; E248-S251 WeakPolarHBondContact O-CA 3.42Å; E248-S251 VanDerWaalsContact O-CB 3.29Å; E248-S251 WeakPolarHBondContact O-CB 3.44Å; E248-S251 PolarHBondContact O-N 3.12Å; F249-S251 PolarHBondContact O-N 3.34Å; S251-C253 PolarHBondContact O-N 3.22Å; S251-R254 WeakPolarHBondContact O-CB 3.38Å; S251-R254 PolarHBondContact O-N 2.96Å; S251-R254 VanDerWaalsContact O-N 3.11Å
252	F	90.1	Very high	88.3	Confident	3 Å²	3	20.1 Å²	20.1	1%	0.013	10%	0.097	C	C	.	.	H	α-helix	trans	-55.9	-47.8	179.1	177.4	-116.5	0	0	0	113	E248 F249 R254 I255 P384 L386 L424 L427 Q428	E248-F252 PolarHBondContact O-N 2.89Å; F249-F252 HydrophobicContact CD2-CD1 4.39Å; F249-F252 PolarHBondContact O-N 3.09Å; F252-R254 PolarHBondContact O-N 3.15Å; F252-R254 VanDerWaalsContact O-N 3.08Å; F252-I255 HydrophobicContact CD2-CD1 4.34Å; F252-I255 WeakPolarHBondContact O-CB 3.39Å; F252-I255 WeakPolarHBondContact O-CG1 3.24Å; F252-I255 PolarHBondContact O-N 3.2Å; F252-P384 HydrophobicContact CE2-CG 4.34Å; F252-P384 HydrophobicContact CZ-CG 4.21Å; F252-L386 HydrophobicContact CE2-CD1 4.35Å; F252-L424 HydrophobicContact CZ-CB 4.49Å; F252-L424 VanDerWaalsContact CZ-O 3.31Å; F252-L424 WeakPolarHBondContact CZ-O 3.25Å; F252-L427 HydrophobicContact CE1-CB 3.97Å; F252-L427 HydrophobicContact CZ-CB 4.3Å; F252-Q428 HydrophobicContact CD1-CG 3.83Å; F252-Q428 HydrophobicContact CE1-CG 3.5Å; F252-Q428 HydrophobicContact CZ-CG 4.04Å; F252-Q428 PolarHBondContact O-NE2 2.9Å
253	C	86.5	Confident	88.3	Confident	17 Å²	17	18.7 Å²	18.7	12%	0.115	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-10	-180	-63.8	0	0	0	0	114.5	Q216 F249 S251 Q428	Q216-C253 PolarHBondContact NE2-O 3.48Å; F249-C253 VanDerWaalsContact CE2-SG 3.55Å; F249-C253 VanDerWaalsContact CZ-SG 3.51Å; F249-C253 WeakPolarHBondContact O-CB 3.43Å; F249-C253 PolarHBondContact O-N 3.49Å; F249-C253 PolarHBondContact O-SG 3.18Å; S251-C253 PolarHBondContact O-N 3.22Å; C253-Q428 HydrophobicContact CB-CB 4.3Å; C253-Q428 HydrophobicContact CB-CG 4.45Å
254	R	85.4	Confident	88.4	Confident	109 Å²	109	18.4 Å²	18.4	41%	0.411	9%	0.086	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-23.2	172.3	-68.2	163.5	162.9	178.9	-11.5	112.7	K250 S251 F252 S256 V274	K250-R254 VanDerWaalsContact O-CD 3.24Å; K250-R254 WeakPolarHBondContact O-CD 3.4Å; K250-R254 WeakPolarHBondContact O-CG 3.38Å; S251-R254 WeakPolarHBondContact O-CB 3.38Å; S251-R254 PolarHBondContact O-N 2.96Å; S251-R254 VanDerWaalsContact O-N 3.11Å; F252-R254 PolarHBondContact O-N 3.15Å; F252-R254 VanDerWaalsContact O-N 3.08Å; R254-S256 PolarHBondContact O-N 3.33Å; R254-V274 HydrophobicContact CB-CG1 3.85Å; R254-V274 WeakPolarHBondContact O-CG1 3.45Å
255	I	88.1	Confident	88.1	Confident	1 Å²	1	25.9 Å²	25.9	1%	0.005	12%	0.115	C	C	.	.			trans	-71	112.9	-177.1	-49.7	175.6	0	0	0	108.3	F252 D259 Y260 V274 L275 L386 Q428	F252-I255 HydrophobicContact CD2-CD1 4.34Å; F252-I255 WeakPolarHBondContact O-CB 3.39Å; F252-I255 WeakPolarHBondContact O-CG1 3.24Å; F252-I255 PolarHBondContact O-N 3.2Å; I255-D259 HydrophobicContact CG2-CB 3.99Å; I255-Y260 HydrophobicContact CB-CE2 4.32Å; I255-Y260 HydrophobicContact CG2-CD2 4.1Å; I255-Y260 HydrophobicContact CG2-CE1 4.29Å; I255-Y260 HydrophobicContact CG2-CE2 3.56Å; I255-V274 HydrophobicContact CB-CG1 4.49Å; I255-V274 HydrophobicContact CG1-CG1 4.15Å; I255-L275 HydrophobicContact CD1-CD1 4.08Å; I255-L386 HydrophobicContact CD1-CD2 3.59Å; I255-Q428 PolarHBondContact O-NE2 2.86Å
256	S	86	Confident	87.7	Confident	18 Å²	18	28.6 Å²	28.6	13%	0.126	13%	0.134	C	C	.	.			trans	-88.5	163.9	-177.5	73.8	0	0	0	0	111.9	R254 V258 D259 Y260	R254-S256 PolarHBondContact O-N 3.33Å; S256-V258 PolarHBondContact O-N 3.31Å; S256-V258 PolarHBondContact OG-N 3.5Å; S256-D259 WeakPolarHBondContact CB-OD2 3.42Å; S256-D259 PolarHBondContact N-OD2 3.38Å; S256-D259 WeakPolarHBondContact O-CB 3.4Å; S256-D259 PolarHBondContact O-N 2.9Å; S256-D259 PolarHBondContact OG-N 2.83Å; S256-D259 PolarHBondContact OG-OD2 3.44Å; S256-Y260 VanDerWaalsContact O-CD2 3.28Å; S256-Y260 WeakPolarHBondContact O-CD2 3.23Å; S256-Y260 PolarHBondContact O-N 3.42Å
257	F	86.7	Confident	87.2	Confident	23 Å²	23	31.5 Å²	31.5	10%	0.101	16%	0.155	C	C	.	.	H	α-helix	trans	-54.3	-35.3	171.8	-157.6	-70.9	0	0	0	112	T114 M115 D259 Y260 I261 Y418 I421 I425	T114-F257 HydrophobicContact CG2-CE1 4.41Å; M115-F257 HydrophobicContact SD-CE1 3.57Å; M115-F257 VanDerWaalsContact SD-CE1 3.57Å; M115-F257 HydrophobicContact SD-CZ 3.62Å; F257-D259 PolarHBondContact O-N 3.47Å; F257-Y260 PolarHBondContact O-N 3.4Å; F257-I261 HydrophobicContact CD1-CD1 3.58Å; F257-I261 HydrophobicContact CD1-CG1 4.01Å; F257-I261 HydrophobicContact CE1-CD1 3.76Å; F257-I261 HydrophobicContact CE1-CG1 4.01Å; F257-I261 WeakPolarHBondContact O-CG1 3.28Å; F257-I261 PolarHBondContact O-N 3.47Å; F257-Y418 HydrophobicContact CE2-CD2 4.03Å; F257-Y418 HydrophobicContact CE2-CE2 4.11Å; F257-Y418 AromaticContact CZ-CD2 3.68Å; F257-Y418 HydrophobicContact CZ-CD2 3.68Å; F257-Y418 HydrophobicContact CZ-CE2 4.17Å; F257-I421 HydrophobicContact CD1-CG2 4.2Å; F257-I421 HydrophobicContact CD2-CB 4.34Å; F257-I421 HydrophobicContact CD2-CG2 3.47Å; F257-I421 VanDerWaalsContact CD2-CG2 3.47Å; F257-I421 HydrophobicContact CE1-CD1 4.1Å; F257-I421 HydrophobicContact CE1-CG2 4.16Å; F257-I421 HydrophobicContact CE2-CB 3.8Å; F257-I421 HydrophobicContact CE2-CG2 3.45Å; F257-I421 VanDerWaalsContact CE2-CG2 3.45Å; F257-I421 HydrophobicContact CG-CG2 3.85Å; F257-I421 HydrophobicContact CZ-CB 3.9Å; F257-I421 HydrophobicContact CZ-CD1 4.12Å; F257-I421 HydrophobicContact CZ-CG2 3.8Å; F257-I425 HydrophobicContact CD2-CG1 4.15Å
258	V	84.4	Confident	86.6	Confident	12 Å²	12	33.1 Å²	33.1	7%	0.073	17%	0.166	C	C	.	.	H	α-helix	trans	-64.7	-36.8	177.2	164.8	0	0	0	0	112.2	M170 S256 I261 N262	M170-V258 HydrophobicContact CE-CG2 4.39Å; M170-V258 HydrophobicContact CG-CG2 3.97Å; S256-V258 PolarHBondContact O-N 3.31Å; S256-V258 PolarHBondContact OG-N 3.5Å; V258-I261 PolarHBondContact O-N 3.19Å; V258-N262 WeakPolarHBondContact O-CB 3.41Å; V258-N262 PolarHBondContact O-N 3.21Å; V258-N262 PolarHBondContact O-ND2 2.9Å; V258-N262 PolarHBondContact O-OD1 2.89Å
259	D	88.1	Confident	85.6	Confident	17 Å²	17	33.9 Å²	33.9	9%	0.091	17%	0.17	C	C	.	.	H	α-helix	trans	-66.3	-40.5	178.8	-61.6	-68	0	0	0	111.4	I255 S256 F257 N262 Y263 I272	I255-D259 HydrophobicContact CG2-CB 3.99Å; S256-D259 WeakPolarHBondContact CB-OD2 3.42Å; S256-D259 PolarHBondContact N-OD2 3.38Å; S256-D259 WeakPolarHBondContact O-CB 3.4Å; S256-D259 PolarHBondContact O-N 2.9Å; S256-D259 PolarHBondContact OG-N 2.83Å; S256-D259 PolarHBondContact OG-OD2 3.44Å; F257-D259 PolarHBondContact O-N 3.47Å; D259-N262 PolarHBondContact O-N 2.89Å; D259-Y263 WeakPolarHBondContact O-CB 3.5Å; D259-Y263 PolarHBondContact O-N 3.29Å; D259-I272 HydrophobicContact CB-CG2 3.87Å
260	Y	90.8	Very high	84.6	Confident	1 Å²	1	40.2 Å²	40.2	0%	0.004	20%	0.198	C	C	.	.	H	α-helix	trans	-64	-44.1	174.9	-68.3	-74.8	0	0	0	112.4	I255 S256 F257 N262 Y263 I264 L386 L390 L393 I421 L424 I425	I255-Y260 HydrophobicContact CB-CE2 4.32Å; I255-Y260 HydrophobicContact CG2-CD2 4.1Å; I255-Y260 HydrophobicContact CG2-CE1 4.29Å; I255-Y260 HydrophobicContact CG2-CE2 3.56Å; S256-Y260 VanDerWaalsContact O-CD2 3.28Å; S256-Y260 WeakPolarHBondContact O-CD2 3.23Å; S256-Y260 PolarHBondContact O-N 3.42Å; F257-Y260 PolarHBondContact O-N 3.4Å; Y260-N262 VanDerWaalsContact C-N 3.34Å; Y260-N262 PolarHBondContact O-N 2.85Å; Y260-Y263 PolarHBondContact O-N 2.98Å; Y260-I264 WeakPolarHBondContact O-CD1 3.35Å; Y260-I264 VanDerWaalsContact O-CG1 3.29Å; Y260-I264 WeakPolarHBondContact O-CG1 3.11Å; Y260-I264 PolarHBondContact O-N 3.48Å; Y260-L386 HydrophobicContact CE1-CD1 4.1Å; Y260-L390 HydrophobicContact CD1-CD2 3.93Å; Y260-L390 HydrophobicContact CE1-CD2 3.9Å; Y260-L393 HydrophobicContact CD1-CD1 3.99Å; Y260-I421 HydrophobicContact CD2-CG2 3.73Å; Y260-I421 HydrophobicContact CE2-CG2 4.46Å; Y260-I421 HydrophobicContact CG-CG1 4.48Å; Y260-I421 HydrophobicContact CG-CG2 4Å; Y260-L424 HydrophobicContact CD1-CD1 4.41Å; Y260-L424 HydrophobicContact CE1-CD1 3.69Å; Y260-I425 HydrophobicContact CD2-CD1 4.47Å; Y260-I425 HydrophobicContact CE2-CD1 4.02Å
261	I	88.6	Confident	83.9	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-59.3	-46.8	174.4	-66	164.7	0	0	0	110.7	T114 R117 L118 F257 V258 Y263 I264 R265	T114-I261 WeakPolarHBondContact O-CD1 3.43Å; R117-I261 HydrophobicContact CB-CD1 4.31Å; R117-I261 HydrophobicContact CB-CG2 3.85Å; L118-I261 HydrophobicContact CD2-CG2 3.84Å; L118-I261 HydrophobicContact CG-CG2 4.14Å; F257-I261 HydrophobicContact CD1-CD1 3.58Å; F257-I261 HydrophobicContact CD1-CG1 4.01Å; F257-I261 HydrophobicContact CE1-CD1 3.76Å; F257-I261 HydrophobicContact CE1-CG1 4.01Å; F257-I261 WeakPolarHBondContact O-CG1 3.28Å; F257-I261 PolarHBondContact O-N 3.47Å; V258-I261 PolarHBondContact O-N 3.19Å; I261-Y263 VanDerWaalsContact C-N 3.29Å; I261-Y263 PolarHBondContact O-N 3.49Å; I261-I264 PolarHBondContact O-N 3.36Å; I261-R265 WeakPolarHBondContact O-CB 3.3Å; I261-R265 PolarHBondContact O-N 2.97Å
262	N	88	Confident	83.7	Confident	39 Å²	39	44 Å²	44	21%	0.209	22%	0.221	C	C	.	.	H	α-helix	trans	-59.7	-43	-179	-67.3	-10.1	0	0	0	110.6	R117 V258 D259 Y260 R265 S266 I272	R117-N262 PolarHBondContact NH1-OD1 2.93Å; R117-N262 PolarHBondContact NH2-OD1 3.17Å; V258-N262 WeakPolarHBondContact O-CB 3.41Å; V258-N262 PolarHBondContact O-N 3.21Å; V258-N262 PolarHBondContact O-ND2 2.9Å; V258-N262 PolarHBondContact O-OD1 2.89Å; D259-N262 PolarHBondContact O-N 2.89Å; Y260-N262 VanDerWaalsContact C-N 3.34Å; Y260-N262 PolarHBondContact O-N 2.85Å; N262-R265 PolarHBondContact O-N 3.43Å; N262-S266 PolarHBondContact O-N 3.21Å; N262-S266 PolarHBondContact O-OG 3.05Å; N262-I272 HydrophobicContact CB-CD1 3.87Å; N262-I272 HydrophobicContact CB-CG1 4.26Å
263	Y	89.7	Confident	83.4	Confident	25 Å²	25	47.2 Å²	47.2	10%	0.098	24%	0.242	C	C	.	.	H	α-helix	trans	-64	-42.5	177.6	169	-110.2	0	0	0	113.2	D259 Y260 I261 R265 S266 C267 M269 I272 L275 L390 I394	D259-Y263 WeakPolarHBondContact O-CB 3.5Å; D259-Y263 PolarHBondContact O-N 3.29Å; Y260-Y263 PolarHBondContact O-N 2.98Å; I261-Y263 VanDerWaalsContact C-N 3.29Å; I261-Y263 PolarHBondContact O-N 3.49Å; Y263-R265 VanDerWaalsContact C-N 3.28Å; Y263-R265 PolarHBondContact O-N 3.38Å; Y263-S266 PolarHBondContact O-N 2.6Å; Y263-S266 PolarHBondContact O-OG 3.33Å; Y263-C267 WeakPolarHBondContact O-CA 3.28Å; Y263-C267 PolarHBondContact O-N 3.01Å; Y263-M269 HydrophobicContact CD2-CG 3.41Å; Y263-M269 VanDerWaalsContact CD2-CG 3.41Å; Y263-M269 HydrophobicContact CD2-SD 4.33Å; Y263-M269 HydrophobicContact CE2-CG 3.43Å; Y263-M269 VanDerWaalsContact CE2-CG 3.43Å; Y263-M269 HydrophobicContact CE2-SD 3.97Å; Y263-I272 VanDerWaalsContact CA-CD1 3.41Å; Y263-I272 VanDerWaalsContact N-CD1 3.27Å; Y263-L275 HydrophobicContact CD2-CD2 4.16Å; Y263-L275 HydrophobicContact CG-CD2 4.04Å; Y263-L390 HydrophobicContact CD1-CD2 3.77Å; Y263-L390 HydrophobicContact CE1-CB 3.72Å; Y263-L390 HydrophobicContact CE1-CD2 3.72Å; Y263-L390 HydrophobicContact CE1-CG 4.18Å; Y263-I394 HydrophobicContact CD1-CD1 4.31Å; Y263-I394 HydrophobicContact CE1-CD1 3.79Å; Y263-I394 HydrophobicContact CE1-CG1 3.71Å
264	I	89.5	Confident	83.3	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62.6	-38.7	176.2	-68	161.3	0	0	0	110.7	L118 Y260 I261 L393 N397 L417 I421	L118-I264 HydrophobicContact CD2-CB 4.07Å; L118-I264 HydrophobicContact CD2-CG2 3.73Å; Y260-I264 WeakPolarHBondContact O-CD1 3.35Å; Y260-I264 VanDerWaalsContact O-CG1 3.29Å; Y260-I264 WeakPolarHBondContact O-CG1 3.11Å; Y260-I264 PolarHBondContact O-N 3.48Å; I261-I264 PolarHBondContact O-N 3.36Å; I264-L393 HydrophobicContact CD1-CB 4.22Å; I264-L393 HydrophobicContact CD1-CD1 4.41Å; I264-L393 HydrophobicContact CD1-CD2 4.32Å; I264-L393 HydrophobicContact CG1-CB 4.22Å; I264-N397 HydrophobicContact CG2-CB 3.77Å; I264-N397 VanDerWaalsContact CG2-CG 3.44Å; I264-N397 PolarHBondContact O-ND2 3.44Å; I264-L417 HydrophobicContact CD1-CD2 4.26Å; I264-I421 HydrophobicContact CD1-CD1 3.92Å
265	R	85.6	Confident	83.4	Confident	157 Å²	157	42.5 Å²	42.5	59%	0.592	22%	0.224	S	C	*	.	H	α-helix	trans	-76.4	-30.3	-178.1	-166.3	-177.3	68.8	171.8	6.9	113.7	I261 N262 Y263	I261-R265 WeakPolarHBondContact O-CB 3.3Å; I261-R265 PolarHBondContact O-N 2.97Å; N262-R265 PolarHBondContact O-N 3.43Å; Y263-R265 VanDerWaalsContact C-N 3.28Å; Y263-R265 PolarHBondContact O-N 3.38Å
266	S	82.4	Confident	83.2	Confident	57 Å²	57	44.7 Å²	44.7	40%	0.399	24%	0.235	S	C	.	.	H	α-helix	trans	-90.5	-16.2	177.1	57.1	0	0	0	0	113.7	N262 Y263 C268	N262-S266 PolarHBondContact O-N 3.21Å; N262-S266 PolarHBondContact O-OG 3.05Å; Y263-S266 PolarHBondContact O-N 2.6Å; Y263-S266 PolarHBondContact O-OG 3.33Å; S266-C268 WeakPolarHBondContact O-CB 3.49Å; S266-C268 PolarHBondContact O-N 2.82Å; S266-C268 PolarHBondContact OG-N 3.38Å; S266-C268 PolarHBondContact OG-O 3.34Å
267	C	79.3	Confident	83.2	Confident	73 Å²	73	49 Å²	49	49%	0.493	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.6	21.4	-162.9	-63.6	0	0	0	0	113.8	Y263	Y263-C267 WeakPolarHBondContact O-CA 3.28Å; Y263-C267 PolarHBondContact O-N 3.01Å
268	C	73.7	Confident	83.2	Confident	50 Å²	50	48 Å²	48	34%	0.338	24%	0.244	S	C	.	.	S	Bend	trans	-153.8	145.5	-166.7	-165.4	0	0	0	0	110.9	S266	S266-C268 WeakPolarHBondContact O-CB 3.49Å; S266-C268 PolarHBondContact O-N 2.82Å; S266-C268 PolarHBondContact OG-N 3.38Å; S266-C268 PolarHBondContact OG-O 3.34Å
269	M	70	Confident	83.2	Confident	17 Å²	17	47.4 Å²	47.4	8%	0.084	24%	0.24	C	C	.	.			trans	-91.4	-3	-172.9	-63.9	179.2	-76.5	0	0	114	Y263 I272 L275 E276 I279 L390 W485 A486 V489	Y263-M269 HydrophobicContact CD2-CG 3.41Å; Y263-M269 VanDerWaalsContact CD2-CG 3.41Å; Y263-M269 HydrophobicContact CD2-SD 4.33Å; Y263-M269 HydrophobicContact CE2-CG 3.43Å; Y263-M269 VanDerWaalsContact CE2-CG 3.43Å; Y263-M269 HydrophobicContact CE2-SD 3.97Å; M269-I272 PolarHBondContact O-N 2.89Å; M269-L275 HydrophobicContact CB-CD2 4.49Å; M269-L275 HydrophobicContact CG-CD2 3.76Å; M269-L275 HydrophobicContact CG-CG 4.36Å; M269-L275 HydrophobicContact SD-CD2 3.88Å; M269-L275 HydrophobicContact SD-CG 4.11Å; M269-E276 VanDerWaalsContact O-CG 3.24Å; M269-E276 WeakPolarHBondContact O-CG 3.44Å; M269-I279 HydrophobicContact CB-CD1 4.13Å; M269-I279 HydrophobicContact CE-CD1 3.53Å; M269-I279 HydrophobicContact CG-CD1 4.32Å; M269-I279 HydrophobicContact SD-CD1 3.35Å; M269-I279 WeakPolarHBondContact SD-CD1 3.35Å; M269-I279 HydrophobicContact SD-CG1 4.36Å; M269-L390 HydrophobicContact SD-CD1 4.22Å; M269-W485 HydrophobicContact CE-CE3 4.29Å; M269-W485 HydrophobicContact SD-CZ3 4.21Å; M269-A486 HydrophobicContact CE-CB 3.67Å; M269-V489 HydrophobicContact CB-CG2 4.4Å
270	K	68.9	Low	83	Confident	145 Å²	145	47.8 Å²	47.8	63%	0.63	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.9	140.9	170.6	-68.6	174.2	-177.9	172.7	0	110.7	I272	K270-I272 PolarHBondContact O-N 3.35Å
271	D	72.9	Confident	82.8	Confident	154 Å²	154	49 Å²	49	82%	0.824	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	14.3	178.2	-50.2	-57.5	0	0	0	114.6	P273	D271-P273 WeakPolarHBondContact O-CD 3.45Å
272	I	83	Confident	82.8	Confident	6 Å²	6	49 Å²	49	3%	0.031	25%	0.253	C	S	.	.			trans	-113.9	68.7	173.2	-47.9	177.6	0	0	0	109.1	D259 N262 Y263 M269 K270 V274 L275 E276	D259-I272 HydrophobicContact CB-CG2 3.87Å; N262-I272 HydrophobicContact CB-CD1 3.87Å; N262-I272 HydrophobicContact CB-CG1 4.26Å; Y263-I272 VanDerWaalsContact CA-CD1 3.41Å; Y263-I272 VanDerWaalsContact N-CD1 3.27Å; M269-I272 PolarHBondContact O-N 2.89Å; K270-I272 PolarHBondContact O-N 3.35Å; I272-V274 PolarHBondContact O-N 3.39Å; I272-L275 HydrophobicContact CB-CB 4.26Å; I272-L275 HydrophobicContact CG2-CB 3.68Å; I272-L275 HydrophobicContact CG2-CD2 4.48Å; I272-L275 PolarHBondContact O-N 3.05Å; I272-E276 WeakPolarHBondContact O-CG 3.48Å; I272-E276 PolarHBondContact O-N 3.08Å
273	P	82.9	Confident	82.8	Confident	70 Å²	70	49.1 Å²	49.1	46%	0.455	25%	0.253	S	S	.	.	H	α-helix	trans	-66.2	-11.4	-165.5	27.6	-37.9	0	0	0	114.3	D271 E276 R277	D271-P273 WeakPolarHBondContact O-CD 3.45Å; P273-E276 WeakPolarHBondContact CA-OE2 3.43Å; P273-R277 WeakPolarHBondContact O-CG 3.4Å; P273-R277 PolarHBondContact O-NE 3.36Å; P273-R277 PolarHBondContact O-NH2 3.45Å
274	V	85.8	Confident	82.6	Confident	26 Å²	26	48.2 Å²	48.2	16%	0.158	25%	0.251	C	S	.	.	H	α-helix	trans	-76	-47	171.3	-171.4	0	0	0	0	110.8	R254 I255 I272 R277 S278	R254-V274 HydrophobicContact CB-CG1 3.85Å; R254-V274 WeakPolarHBondContact O-CG1 3.45Å; I255-V274 HydrophobicContact CB-CG1 4.49Å; I255-V274 HydrophobicContact CG1-CG1 4.15Å; I272-V274 PolarHBondContact O-N 3.39Å; V274-R277 PolarHBondContact O-N 2.94Å; V274-S278 PolarHBondContact O-N 3.21Å
275	L	86.8	Confident	82.7	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-68.4	-47.9	179.9	-172.7	57.6	0	0	0	110.3	I255 Y263 M269 I272 R277 S278 I279 L386 L390	I255-L275 HydrophobicContact CD1-CD1 4.08Å; Y263-L275 HydrophobicContact CD2-CD2 4.16Å; Y263-L275 HydrophobicContact CG-CD2 4.04Å; M269-L275 HydrophobicContact CB-CD2 4.49Å; M269-L275 HydrophobicContact CG-CD2 3.76Å; M269-L275 HydrophobicContact CG-CG 4.36Å; M269-L275 HydrophobicContact SD-CD2 3.88Å; M269-L275 HydrophobicContact SD-CG 4.11Å; I272-L275 HydrophobicContact CB-CB 4.26Å; I272-L275 HydrophobicContact CG2-CB 3.68Å; I272-L275 HydrophobicContact CG2-CD2 4.48Å; I272-L275 PolarHBondContact O-N 3.05Å; L275-R277 PolarHBondContact O-N 2.62Å; L275-R277 VanDerWaalsContact O-N 3.13Å; L275-S278 WeakPolarHBondContact O-CA 3.28Å; L275-S278 WeakPolarHBondContact O-CB 3.39Å; L275-S278 PolarHBondContact O-N 2.97Å; L275-I279 VanDerWaalsContact O-CG1 3.29Å; L275-I279 WeakPolarHBondContact O-CG1 3.3Å; L275-I279 PolarHBondContact O-N 2.95Å; L275-I279 VanDerWaalsContact O-N 3.13Å; L275-L386 HydrophobicContact CD1-CD2 3.88Å; L275-L390 HydrophobicContact CD1-CD1 4.19Å
276	E	84.8	Confident	83	Confident	48 Å²	48	41.1 Å²	41.1	22%	0.224	23%	0.226	C	C	.	.	H	α-helix	trans	-49.1	-40.1	174.6	-65	-179.5	144.3	0	0	112.6	M269 I272 P273 I279 A280 V489	M269-E276 VanDerWaalsContact O-CG 3.24Å; M269-E276 WeakPolarHBondContact O-CG 3.44Å; I272-E276 WeakPolarHBondContact O-CG 3.48Å; I272-E276 PolarHBondContact O-N 3.08Å; P273-E276 WeakPolarHBondContact CA-OE2 3.43Å; E276-I279 PolarHBondContact O-N 3.18Å; E276-A280 WeakPolarHBondContact O-CB 3.41Å; E276-A280 PolarHBondContact O-N 2.98Å; E276-V489 HydrophobicContact CB-CG1 3.88Å; E276-V489 HydrophobicContact CG-CG1 3.79Å
277	R	84.3	Confident	83.2	Confident	109 Å²	109	39.4 Å²	39.4	41%	0.411	21%	0.211	S	C	.	.	H	α-helix	trans	-71.8	-23.7	177.7	-82	-177	-80.2	101.6	-3.2	114.6	P273 V274 L275 L281	P273-R277 WeakPolarHBondContact O-CG 3.4Å; P273-R277 PolarHBondContact O-NE 3.36Å; P273-R277 PolarHBondContact O-NH2 3.45Å; V274-R277 PolarHBondContact O-N 2.94Å; L275-R277 PolarHBondContact O-N 2.62Å; L275-R277 VanDerWaalsContact O-N 3.13Å; R277-L281 PolarHBondContact O-N 3.13Å
278	S	87.9	Confident	83.7	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-76.4	-39.2	170	173.2	0	0	0	0	110.9	V274 L275 L281 C282	V274-S278 PolarHBondContact O-N 3.21Å; L275-S278 WeakPolarHBondContact O-CA 3.28Å; L275-S278 WeakPolarHBondContact O-CB 3.39Å; L275-S278 PolarHBondContact O-N 2.97Å; S278-L281 PolarHBondContact O-N 3.25Å; S278-C282 PolarHBondContact O-N 3.09Å; S278-C282 VanDerWaalsContact O-N 3.12Å
279	I	84.8	Confident	84.6	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-59.2	-50.1	172.2	-33.2	-170.4	0	0	0	110.7	M269 L275 E276 L281 C282 N283 W485 A486 V489	M269-I279 HydrophobicContact CB-CD1 4.13Å; M269-I279 HydrophobicContact CE-CD1 3.53Å; M269-I279 HydrophobicContact CG-CD1 4.32Å; M269-I279 HydrophobicContact SD-CD1 3.35Å; M269-I279 WeakPolarHBondContact SD-CD1 3.35Å; M269-I279 HydrophobicContact SD-CG1 4.36Å; L275-I279 VanDerWaalsContact O-CG1 3.29Å; L275-I279 WeakPolarHBondContact O-CG1 3.3Å; L275-I279 PolarHBondContact O-N 2.95Å; L275-I279 VanDerWaalsContact O-N 3.13Å; E276-I279 PolarHBondContact O-N 3.18Å; I279-L281 VanDerWaalsContact C-N 3.26Å; I279-L281 PolarHBondContact O-N 3.35Å; I279-C282 PolarHBondContact O-N 3.3Å; I279-C282 VanDerWaalsContact O-N 3.14Å; I279-N283 WeakPolarHBondContact O-CB 3.46Å; I279-N283 PolarHBondContact O-N 3.44Å; I279-N283 PolarHBondContact O-OD1 3.08Å; I279-W485 HydrophobicContact CB-CH2 3.84Å; I279-W485 HydrophobicContact CB-CZ2 3.97Å; I279-W485 HydrophobicContact CB-CZ3 4.33Å; I279-W485 HydrophobicContact CD1-CH2 4.36Å; I279-W485 HydrophobicContact CD1-CZ3 4.03Å; I279-W485 HydrophobicContact CG1-CH2 3.58Å; I279-W485 HydrophobicContact CG1-CZ2 4.23Å; I279-W485 HydrophobicContact CG1-CZ3 3.75Å; I279-W485 HydrophobicContact CG2-CD2 4.13Å; I279-W485 HydrophobicContact CG2-CE3 4.26Å; I279-W485 HydrophobicContact CG2-CH2 3.83Å; I279-W485 HydrophobicContact CG2-CZ2 3.62Å; I279-W485 HydrophobicContact CG2-CZ3 4.12Å; I279-A486 HydrophobicContact CD1-CB 3.91Å; I279-A486 HydrophobicContact CG2-CB 3.63Å; I279-V489 HydrophobicContact CD1-CB 4.02Å; I279-V489 HydrophobicContact CD1-CG1 3.88Å; I279-V489 HydrophobicContact CD1-CG2 4.06Å
280	A	83.6	Confident	85.5	Confident	25 Å²	25	33.2 Å²	33.2	21%	0.207	17%	0.17	C	C	.	.	H	α-helix	trans	-58.6	-37	-179.1	0	0	0	0	0	112.8	E276 G284 P491	E276-A280 WeakPolarHBondContact O-CB 3.41Å; E276-A280 PolarHBondContact O-N 2.98Å; A280-G284 WeakPolarHBondContact O-CA 3.49Å; A280-G284 PolarHBondContact O-N 3.24Å; A280-P491 HydrophobicContact CB-CG 3.6Å
281	L	86.8	Confident	86.3	Confident	26 Å²	26	26.6 Å²	26.6	14%	0.136	14%	0.142	C	C	.	.	H	α-helix	trans	-67.4	-46.9	175.3	-177.5	61.5	0	0	0	111.6	L247 E248 R277 S278 I279 G284 I285 L448	L247-L281 HydrophobicContact CB-CD2 4.4Å; E248-L281 WeakPolarHBondContact OE2-CD2 3.38Å; R277-L281 PolarHBondContact O-N 3.13Å; S278-L281 PolarHBondContact O-N 3.25Å; I279-L281 VanDerWaalsContact C-N 3.26Å; I279-L281 PolarHBondContact O-N 3.35Å; L281-G284 PolarHBondContact O-N 3.28Å; L281-I285 HydrophobicContact CD1-CD1 4.1Å; L281-I285 HydrophobicContact CD1-CG1 4.41Å; L281-I285 HydrophobicContact CG-CD1 4.05Å; L281-I285 WeakPolarHBondContact O-CB 3.48Å; L281-I285 WeakPolarHBondContact O-CG1 3.22Å; L281-I285 PolarHBondContact O-N 3.38Å; L281-L448 HydrophobicContact CD1-CD1 3.93Å
282	C	87.9	Confident	86.9	Confident	2 Å²	2	19.3 Å²	19.3	1%	0.014	10%	0.103	C	C	.	.	H	α-helix	trans	-61.9	-45.8	177.9	-176.1	0	0	0	0	112.1	S278 I279 I285 S286 A327 W485	S278-C282 PolarHBondContact O-N 3.09Å; S278-C282 VanDerWaalsContact O-N 3.12Å; I279-C282 PolarHBondContact O-N 3.3Å; I279-C282 VanDerWaalsContact O-N 3.14Å; C282-I285 PolarHBondContact O-N 3.3Å; C282-S286 PolarHBondContact O-N 2.96Å; C282-S286 PolarHBondContact O-OG 2.95Å; C282-A327 WeakPolarHBondContact O-CB 3.46Å; C282-W485 HydrophobicContact CB-CZ2 4.12Å
283	N	87.1	Confident	87.2	Confident	40 Å²	40	19 Å²	19	21%	0.214	10%	0.101	C	C	.	.	H	α-helix	trans	-69.4	-39.9	177.7	-66.1	3.9	0	0	0	111.2	I279 S286 Q287	I279-N283 WeakPolarHBondContact O-CB 3.46Å; I279-N283 PolarHBondContact O-N 3.44Å; I279-N283 PolarHBondContact O-OD1 3.08Å; N283-S286 CarbonylContact O-C 3.58Å; N283-S286 WeakPolarHBondContact O-CA 3.4Å; N283-S286 WeakPolarHBondContact O-CB 3.48Å; N283-S286 PolarHBondContact O-N 2.97Å; N283-S286 VanDerWaalsContact O-N 3.14Å; N283-Q287 PolarHBondContact O-N 3.05Å
284	G	87	Confident	87.2	Confident	6 Å²	6	15.9 Å²	15.9	6%	0.062	8%	0.081	C	C	.	.	H	α-helix	trans	-63.2	-39.6	175.5	0	0	0	0	0	112.8	A280 L281 S286 Q287 W288	A280-G284 WeakPolarHBondContact O-CA 3.49Å; A280-G284 PolarHBondContact O-N 3.24Å; L281-G284 PolarHBondContact O-N 3.28Å; G284-S286 VanDerWaalsContact C-N 3.35Å; G284-Q287 PolarHBondContact O-N 3.14Å; G284-W288 WeakPolarHBondContact O-CB 3.41Å; G284-W288 PolarHBondContact O-N 3.39Å
285	I	91.3	Very high	86.8	Confident	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-63.1	-43.1	170.8	-69.3	166.1	0	0	0	110.3	L244 L281 C282 W288 V289 T324 A327 V328 L448	L244-I285 HydrophobicContact CD2-CD1 4.18Å; L244-I285 HydrophobicContact CD2-CG1 4.25Å; L281-I285 HydrophobicContact CD1-CD1 4.1Å; L281-I285 HydrophobicContact CD1-CG1 4.41Å; L281-I285 HydrophobicContact CG-CD1 4.05Å; L281-I285 WeakPolarHBondContact O-CB 3.48Å; L281-I285 WeakPolarHBondContact O-CG1 3.22Å; L281-I285 PolarHBondContact O-N 3.38Å; C282-I285 PolarHBondContact O-N 3.3Å; I285-W288 PolarHBondContact O-N 2.9Å; I285-V289 WeakPolarHBondContact O-CG2 3.49Å; I285-V289 PolarHBondContact O-N 3.25Å; I285-T324 HydrophobicContact CD1-CG2 4.2Å; I285-T324 HydrophobicContact CG2-CG2 4.37Å; I285-A327 HydrophobicContact CB-CB 4.17Å; I285-A327 HydrophobicContact CG2-CB 3.84Å; I285-V328 HydrophobicContact CG2-CG2 4.04Å; I285-L448 HydrophobicContact CB-CD2 4.24Å; I285-L448 HydrophobicContact CG1-CD1 3.9Å; I285-L448 HydrophobicContact CG1-CD2 3.6Å; I285-L448 HydrophobicContact CG1-CG 4.4Å
286	S	91.2	Very high	86.5	Confident	9 Å²	9	16.8 Å²	16.8	6%	0.063	8%	0.084	C	C	.	.	H	α-helix	trans	-63.6	-41.4	178.9	-53.9	0	0	0	0	112.5	C282 N283 G284 Q290 A327	C282-S286 PolarHBondContact O-N 2.96Å; C282-S286 PolarHBondContact O-OG 2.95Å; N283-S286 CarbonylContact O-C 3.58Å; N283-S286 WeakPolarHBondContact O-CA 3.4Å; N283-S286 WeakPolarHBondContact O-CB 3.48Å; N283-S286 PolarHBondContact O-N 2.97Å; N283-S286 VanDerWaalsContact O-N 3.14Å; G284-S286 VanDerWaalsContact C-N 3.35Å; S286-Q290 WeakPolarHBondContact O-CG 3.2Å; S286-Q290 PolarHBondContact O-NE2 3.14Å; S286-Q290 VanDerWaalsContact O-NE2 3.13Å; S286-A327 WeakPolarHBondContact OG-CA 3.43Å; S286-A327 WeakPolarHBondContact OG-CB 3.25Å; S286-A327 PolarHBondContact OG-O 3.43Å
287	Q	88.3	Confident	86	Confident	20 Å²	20	18.9 Å²	18.9	9%	0.093	10%	0.102	C	C	.	.	H	α-helix	trans	-72.5	-42.1	173.8	-71.8	-163.2	-11.3	0	0	111.6	N283 G284 V289 Q290 L291 Y452 E454 I457	N283-Q287 PolarHBondContact O-N 3.05Å; G284-Q287 PolarHBondContact O-N 3.14Å; Q287-V289 VanDerWaalsContact C-N 3.34Å; Q287-V289 PolarHBondContact O-N 3.15Å; Q287-Q290 WeakPolarHBondContact O-CB 3.28Å; Q287-Q290 PolarHBondContact O-N 3.36Å; Q287-Q290 VanDerWaalsContact O-N 3.11Å; Q287-L291 HydrophobicContact CB-CD1 4.21Å; Q287-L291 WeakPolarHBondContact O-CB 3.42Å; Q287-L291 WeakPolarHBondContact O-CD1 3.35Å; Q287-L291 WeakPolarHBondContact O-CG 3.33Å; Q287-L291 PolarHBondContact O-N 2.61Å; Q287-Y452 PolarHBondContact NE2-O 2.95Å; Q287-Y452 PolarHBondContact OE1-O 3.24Å; Q287-E454 PolarHBondContact NE2-OE1 3Å; Q287-I457 HydrophobicContact CB-CD1 4.29Å; Q287-I457 HydrophobicContact CG-CD1 3.81Å
288	W	89.6	Confident	85.8	Confident	3 Å²	3	17.1 Å²	17.1	1%	0.011	10%	0.103	C	C	.	.	H	α-helix	trans	-58.6	-41.6	178.3	175.7	74.6	0	0	0	112.5	F232 L240 L244 G284 I285 L291 M292 F309 L444 S447 L448	F232-W288 HydrophobicContact CD2-CH2 4.13Å; F232-W288 AromaticContact CD2-CZ2 3.96Å; F232-W288 HydrophobicContact CD2-CZ2 3.96Å; F232-W288 AromaticContact CE2-CH2 3.83Å; F232-W288 HydrophobicContact CE2-CH2 3.83Å; F232-W288 AromaticContact CE2-CZ2 4Å; F232-W288 HydrophobicContact CE2-CZ2 4Å; L240-W288 HydrophobicContact CD1-CH2 3.98Å; L240-W288 HydrophobicContact CD2-CH2 4.02Å; L244-W288 HydrophobicContact CD1-CZ3 4.42Å; G284-W288 WeakPolarHBondContact O-CB 3.41Å; G284-W288 PolarHBondContact O-N 3.39Å; I285-W288 PolarHBondContact O-N 2.9Å; W288-L291 PolarHBondContact O-N 3.12Å; W288-M292 HydrophobicContact CD2-CG 4.07Å; W288-M292 HydrophobicContact CG-CG 4.13Å; W288-M292 HydrophobicContact CZ2-CG 4.17Å; W288-M292 HydrophobicContact CZ2-SD 4.12Å; W288-M292 VanDerWaalsContact O-CB 3.26Å; W288-M292 WeakPolarHBondContact O-CB 3.47Å; W288-M292 WeakPolarHBondContact O-CG 3.31Å; W288-M292 PolarHBondContact O-N 3.44Å; W288-F309 HydrophobicContact CE3-CE1 4.22Å; W288-F309 HydrophobicContact CE3-CZ 4.33Å; W288-F309 AromaticContact CH2-CE1 3.93Å; W288-F309 HydrophobicContact CH2-CE1 3.93Å; W288-F309 HydrophobicContact CH2-CZ 4.16Å; W288-F309 AromaticContact CZ3-CE1 3.58Å; W288-F309 HydrophobicContact CZ3-CE1 3.58Å; W288-F309 AromaticContact CZ3-CZ 4Å; W288-F309 HydrophobicContact CZ3-CZ 4Å; W288-L444 HydrophobicContact CH2-CD2 4.09Å; W288-L444 HydrophobicContact CZ2-CD2 4.05Å; W288-S447 PolarHBondContact NE1-OG 3.01Å; W288-L448 HydrophobicContact CB-CD2 3.64Å; W288-L448 HydrophobicContact CD2-CD2 4.05Å; W288-L448 HydrophobicContact CE3-CD2 4.2Å; W288-L448 HydrophobicContact CG-CD2 3.83Å
289	V	91.8	Very high	85.7	Confident	1 Å²	1	18 Å²	18	1%	0.006	11%	0.11	C	C	.	.	H	α-helix	trans	-58.3	-48.6	172.9	167.5	0	0	0	0	111.5	I285 Q287 M292 V293 F309 V328 L332	I285-V289 WeakPolarHBondContact O-CG2 3.49Å; I285-V289 PolarHBondContact O-N 3.25Å; Q287-V289 VanDerWaalsContact C-N 3.34Å; Q287-V289 PolarHBondContact O-N 3.15Å; V289-M292 PolarHBondContact O-N 3.37Å; V289-V293 WeakPolarHBondContact O-CG2 3.33Å; V289-V293 PolarHBondContact O-N 2.97Å; V289-V293 VanDerWaalsContact O-N 3.15Å; V289-F309 HydrophobicContact CB-CE2 4.49Å; V289-F309 HydrophobicContact CG1-CD2 3.98Å; V289-F309 HydrophobicContact CG1-CE2 4.29Å; V289-F309 HydrophobicContact CG1-CG 4.13Å; V289-F309 HydrophobicContact CG2-CD1 3.95Å; V289-F309 HydrophobicContact CG2-CE1 3.86Å; V289-F309 HydrophobicContact CG2-CE2 4.49Å; V289-F309 HydrophobicContact CG2-CG 4.33Å; V289-F309 HydrophobicContact CG2-CZ 4.14Å; V289-V328 HydrophobicContact CG2-CG1 4.33Å; V289-V328 HydrophobicContact CG2-CG2 4.2Å; V289-L332 HydrophobicContact CG1-CD2 3.82Å; V289-L332 HydrophobicContact CG1-CG 3.9Å
290	Q	88.8	Confident	85.9	Confident	7 Å²	7	23.3 Å²	23.3	3%	0.033	14%	0.135	C	C	.	.	H	α-helix	trans	-60.8	-47.5	178	-65.4	173	62.2	0	0	111.8	S286 Q287 V293 L294 G331 H334 S336 I337 I457	S286-Q290 WeakPolarHBondContact O-CG 3.2Å; S286-Q290 PolarHBondContact O-NE2 3.14Å; S286-Q290 VanDerWaalsContact O-NE2 3.13Å; Q287-Q290 WeakPolarHBondContact O-CB 3.28Å; Q287-Q290 PolarHBondContact O-N 3.36Å; Q287-Q290 VanDerWaalsContact O-N 3.11Å; Q290-V293 PolarHBondContact O-N 2.79Å; Q290-L294 WeakPolarHBondContact O-CB 3.38Å; Q290-L294 WeakPolarHBondContact O-CG 3.48Å; Q290-L294 PolarHBondContact O-N 3Å; Q290-G331 VanDerWaalsContact CG-O 3.28Å; Q290-G331 WeakPolarHBondContact CG-O 3.43Å; Q290-H334 HydrophobicContact CG-CB 4.29Å; Q290-H334 PolarHBondContact OE1-ND1 3.31Å; Q290-S336 PolarHBondContact OE1-OG 3.11Å; Q290-I337 HydrophobicContact CB-CD1 4.08Å; Q290-I337 HydrophobicContact CB-CG1 4.11Å; Q290-I337 HydrophobicContact CG-CD1 4.39Å; Q290-I337 HydrophobicContact CG-CG1 3.87Å; Q290-I457 HydrophobicContact CB-CG2 4.09Å
291	L	85.4	Confident	86	Confident	5 Å²	5	25.3 Å²	25.3	3%	0.026	14%	0.142	C	C	.	.	H	α-helix	trans	-69.2	-35	-177	-66.1	161.5	0	0	0	112.1	Q287 W288 L294 S295 Y452 I457 L460 P534	Q287-L291 HydrophobicContact CB-CD1 4.21Å; Q287-L291 WeakPolarHBondContact O-CB 3.42Å; Q287-L291 WeakPolarHBondContact O-CD1 3.35Å; Q287-L291 WeakPolarHBondContact O-CG 3.33Å; Q287-L291 PolarHBondContact O-N 2.61Å; W288-L291 PolarHBondContact O-N 3.12Å; L291-L294 CarbonylContact O-C 3.49Å; L291-L294 PolarHBondContact O-N 3Å; L291-S295 WeakPolarHBondContact O-CB 3.41Å; L291-S295 PolarHBondContact O-N 3.18Å; L291-Y452 HydrophobicContact CD1-CD2 3.42Å; L291-Y452 VanDerWaalsContact CD1-CD2 3.42Å; L291-Y452 HydrophobicContact CD1-CE2 3.54Å; L291-Y452 HydrophobicContact CD2-CD2 3.59Å; L291-Y452 HydrophobicContact CD2-CE2 3.4Å; L291-Y452 VanDerWaalsContact CD2-CE2 3.4Å; L291-Y452 HydrophobicContact CD2-CG 4.17Å; L291-Y452 HydrophobicContact CG-CD2 4.12Å; L291-Y452 HydrophobicContact CG-CE2 4.1Å; L291-I457 HydrophobicContact CD2-CG1 4.36Å; L291-L460 HydrophobicContact CD2-CD1 4.2Å; L291-P534 HydrophobicContact CB-CB 3.61Å; L291-P534 HydrophobicContact CB-CG 4.12Å
292	M	86.7	Confident	86.1	Confident	1 Å²	1	24.4 Å²	24.4	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-67.5	-39.9	175	-72.4	-90.3	65.2	0	0	111.3	F232 W288 V289 S295 V305 F309 P534	F232-M292 HydrophobicContact CD2-SD 4.46Å; W288-M292 HydrophobicContact CD2-CG 4.07Å; W288-M292 HydrophobicContact CG-CG 4.13Å; W288-M292 HydrophobicContact CZ2-CG 4.17Å; W288-M292 HydrophobicContact CZ2-SD 4.12Å; W288-M292 VanDerWaalsContact O-CB 3.26Å; W288-M292 WeakPolarHBondContact O-CB 3.47Å; W288-M292 WeakPolarHBondContact O-CG 3.31Å; W288-M292 PolarHBondContact O-N 3.44Å; V289-M292 PolarHBondContact O-N 3.37Å; M292-S295 WeakPolarHBondContact O-CB 3.38Å; M292-S295 PolarHBondContact O-N 3.05Å; M292-S295 PolarHBondContact O-OG 3.42Å; M292-V305 HydrophobicContact CB-CG1 4.45Å; M292-F309 HydrophobicContact CB-CE2 3.78Å; M292-F309 HydrophobicContact CB-CZ 3.86Å; M292-F309 HydrophobicContact CG-CZ 4.29Å; M292-P534 HydrophobicContact CE-CB 4.35Å
293	V	88.8	Confident	86.3	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-61.4	-51.4	168.9	175	0	0	0	0	110.3	V289 Q290 S295 R296 R302 V305 F306 F309 I337 L340	V289-V293 WeakPolarHBondContact O-CG2 3.33Å; V289-V293 PolarHBondContact O-N 2.97Å; V289-V293 VanDerWaalsContact O-N 3.15Å; Q290-V293 PolarHBondContact O-N 2.79Å; V293-S295 PolarHBondContact O-N 2.82Å; V293-R296 PolarHBondContact O-N 3.45Å; V293-R302 HydrophobicContact CG1-CB 4.19Å; V293-R302 HydrophobicContact CG1-CG 4.49Å; V293-R302 VanDerWaalsContact O-CG 3.29Å; V293-R302 WeakPolarHBondContact O-CG 3.25Å; V293-V305 HydrophobicContact CG2-CG1 4.02Å; V293-F306 HydrophobicContact CG2-CB 4.37Å; V293-F309 HydrophobicContact CG2-CD2 4.2Å; V293-F309 HydrophobicContact CG2-CE2 4.39Å; V293-I337 HydrophobicContact CB-CD1 4.23Å; V293-I337 HydrophobicContact CG1-CD1 4.19Å; V293-L340 HydrophobicContact CG1-CD1 4.42Å
294	L	82.6	Confident	86.6	Confident	5 Å²	5	27.1 Å²	27.1	3%	0.026	15%	0.149	C	C	.	.	H	α-helix	trans	-67.8	-17.5	-178.8	-68.2	172.1	0	0	0	114.3	Q290 L291 R296 I337 L340 I457 L460 R464	Q290-L294 WeakPolarHBondContact O-CB 3.38Å; Q290-L294 WeakPolarHBondContact O-CG 3.48Å; Q290-L294 PolarHBondContact O-N 3Å; L291-L294 CarbonylContact O-C 3.49Å; L291-L294 PolarHBondContact O-N 3Å; L294-R296 VanDerWaalsContact C-N 3.29Å; L294-R296 PolarHBondContact O-N 3.41Å; L294-I337 HydrophobicContact CD1-CD1 4.14Å; L294-I337 HydrophobicContact CD2-CD1 4.29Å; L294-I337 HydrophobicContact CG-CD1 3.87Å; L294-L340 HydrophobicContact CD2-CD1 3.98Å; L294-I457 HydrophobicContact CD1-CG2 3.58Å; L294-L460 HydrophobicContact CD1-CB 4.22Å; L294-R464 HydrophobicContact CD2-CG 4.2Å; L294-R464 PolarHBondContact O-NE 2.99Å; L294-R464 PolarHBondContact O-NH2 3.22Å
295	S	78.6	Confident	86.8	Confident	18 Å²	18	27.1 Å²	27.1	13%	0.126	15%	0.148	C	C	.	.	H	α-helix	trans	-63.3	-33.5	175	79.4	0	0	0	0	112.5	L291 M292 V293	L291-S295 WeakPolarHBondContact O-CB 3.41Å; L291-S295 PolarHBondContact O-N 3.18Å; M292-S295 WeakPolarHBondContact O-CB 3.38Å; M292-S295 PolarHBondContact O-N 3.05Å; M292-S295 PolarHBondContact O-OG 3.42Å; V293-S295 PolarHBondContact O-N 2.82Å
296	R	79.4	Confident	87	Confident	27 Å²	27	28 Å²	28	10%	0.102	15%	0.152	C	C	.	.	S	Bend	trans	-80.5	131.2	-174	-58.2	-56.5	-170.3	-121.6	17.5	111.2	D233 V293 L294 L301 R302 V305 A531	D233-R296 IonicContact OD1-CZ 2.81Å; D233-R296 IonicContact OD1-NE 2.69Å; D233-R296 IonicContact OD1-NH2 2.59Å; D233-R296 PolarHBondContact OD1-NH2 2.81Å; D233-R296 IonicContact OD2-NH2 3.19Å; D233-R296 PolarHBondContact OD2-NH2 2.7Å; V293-R296 PolarHBondContact O-N 3.45Å; L294-R296 VanDerWaalsContact C-N 3.29Å; L294-R296 PolarHBondContact O-N 3.41Å; R296-L301 HydrophobicContact CB-CB 3.86Å; R296-L301 HydrophobicContact CG-CB 4.35Å; R296-R302 HydrophobicContact CB-CG 3.95Å; R296-R302 VanDerWaalsContact O-CG 3.27Å; R296-R302 WeakPolarHBondContact O-CG 3.25Å; R296-R302 PolarHBondContact O-NH1 3.03Å; R296-V305 HydrophobicContact CG-CG2 3.71Å; R296-A531 PolarHBondContact NH1-O 3.47Å; R296-A531 PolarHBondContact NH2-O 3.47Å
297	P	75.1	Confident	87.2	Confident	92 Å²	92	28.9 Å²	28.9	60%	0.597	16%	0.156	S	C	*	.	S	Bend	trans	-75.1	-37.6	-167.2	27.5	-34.7	0	0	0	113.9	R302	P297-R302 PolarHBondContact O-NH1 3.24Å
298	T	79.2	Confident	87.5	Confident	72 Å²	72	29.5 Å²	29.5	44%	0.442	16%	0.159	S	C	.	.	S	Bend	trans	-99.6	150.6	-176.8	61.6	0	0	0	0	111.9	Q300 L301 R302	T298-Q300 VanDerWaalsContact C-N 3.28Å; T298-Q300 PolarHBondContact O-N 3.1Å; T298-L301 PolarHBondContact O-N 3.39Å; T298-L301 WeakPolarHBondContact OG1-CD1 3.48Å; T298-L301 VanDerWaalsContact OG1-CG 3.29Å; T298-L301 WeakPolarHBondContact OG1-CG 3.27Å; T298-R302 WeakPolarHBondContact O-CG 3.48Å; T298-R302 PolarHBondContact O-N 3.09Å
299	A	85.4	Confident	87.8	Confident	19 Å²	19	29.4 Å²	29.4	16%	0.157	16%	0.158	C	C	.	.	H	α-helix	trans	-58.1	-37.9	-179.5	0	0	0	0	0	112.9	R302 A303 D342	A299-R302 WeakPolarHBondContact O-CB 3.44Å; A299-R302 PolarHBondContact O-N 3.28Å; A299-A303 WeakPolarHBondContact O-CB 3.33Å; A299-A303 PolarHBondContact O-N 2.95Å; A299-D342 HydrophobicContact CB-CB 4.29Å
300	Q	89.6	Confident	88	Confident	112 Å²	112	29.4 Å²	29.4	52%	0.523	16%	0.158	S	C	.	.	H	α-helix	trans	-62.3	-51.5	175.8	-172	-169.1	-34.8	0	0	112.2	T298 R302 A303 E304	T298-Q300 VanDerWaalsContact C-N 3.28Å; T298-Q300 PolarHBondContact O-N 3.1Å; Q300-R302 PolarHBondContact O-N 3.44Å; Q300-A303 WeakPolarHBondContact O-CA 3.39Å; Q300-A303 WeakPolarHBondContact O-CB 3.47Å; Q300-A303 PolarHBondContact O-N 3.32Å; Q300-E304 WeakPolarHBondContact CG-OE1 3.41Å; Q300-E304 PolarHBondContact NE2-OE1 3.47Å; Q300-E304 WeakPolarHBondContact O-CG 3.45Å; Q300-E304 PolarHBondContact O-N 3.41Å
301	L	84.8	Confident	88.4	Confident	67 Å²	67	32 Å²	32	35%	0.351	17%	0.17	S	C	.	.	H	α-helix	trans	-64.2	-29.2	178.7	-65.7	175.3	0	0	0	111.9	R296 T298 E304 V305	R296-L301 HydrophobicContact CB-CB 3.86Å; R296-L301 HydrophobicContact CG-CB 4.35Å; T298-L301 PolarHBondContact O-N 3.39Å; T298-L301 WeakPolarHBondContact OG1-CD1 3.48Å; T298-L301 VanDerWaalsContact OG1-CG 3.29Å; T298-L301 WeakPolarHBondContact OG1-CG 3.27Å; L301-E304 WeakPolarHBondContact CD2-OE2 3.29Å; L301-V305 WeakPolarHBondContact O-CG2 3.48Å; L301-V305 PolarHBondContact O-N 3.09Å
302	R	89.1	Confident	88.9	Confident	7 Å²	7	31.7 Å²	31.7	3%	0.026	17%	0.169	C	C	.	.	H	α-helix	trans	-66.6	-42.9	169.3	-68	-162.5	-70.2	-84.9	5.9	112.1	V293 R296 P297 T298 A299 Q300 E304 V305 F306 T343 E465	V293-R302 HydrophobicContact CG1-CB 4.19Å; V293-R302 HydrophobicContact CG1-CG 4.49Å; V293-R302 VanDerWaalsContact O-CG 3.29Å; V293-R302 WeakPolarHBondContact O-CG 3.25Å; R296-R302 HydrophobicContact CB-CG 3.95Å; R296-R302 VanDerWaalsContact O-CG 3.27Å; R296-R302 WeakPolarHBondContact O-CG 3.25Å; R296-R302 PolarHBondContact O-NH1 3.03Å; P297-R302 PolarHBondContact O-NH1 3.24Å; T298-R302 WeakPolarHBondContact O-CG 3.48Å; T298-R302 PolarHBondContact O-N 3.09Å; A299-R302 WeakPolarHBondContact O-CB 3.44Å; A299-R302 PolarHBondContact O-N 3.28Å; Q300-R302 PolarHBondContact O-N 3.44Å; R302-E304 VanDerWaalsContact C-N 3.33Å; R302-E304 PolarHBondContact O-N 3.36Å; R302-V305 PolarHBondContact O-N 3.31Å; R302-F306 VanDerWaalsContact O-CB 3.26Å; R302-F306 WeakPolarHBondContact O-CB 3.27Å; R302-F306 PolarHBondContact O-N 2.88Å; R302-T343 HydrophobicContact CB-CG2 3.55Å; R302-T343 PolarHBondContact NE-OG1 3.01Å; R302-E465 IonicContact CZ-OE1 2.71Å; R302-E465 IonicContact NE-OE1 3.76Å; R302-E465 IonicContact NH2-OE1 3.61Å; R302-E465 PolarHBondContact NH2-OE1 2.87Å
303	A	93.3	Very high	89.4	Confident	3 Å²	3	31.7 Å²	31.7	3%	0.025	17%	0.169	C	C	.	.	H	α-helix	trans	-66.6	-33.7	178.9	0	0	0	0	0	112.5	A299 Q300 T307 T343 H346 V347	A299-A303 WeakPolarHBondContact O-CB 3.33Å; A299-A303 PolarHBondContact O-N 2.95Å; Q300-A303 WeakPolarHBondContact O-CA 3.39Å; Q300-A303 WeakPolarHBondContact O-CB 3.47Å; Q300-A303 PolarHBondContact O-N 3.32Å; A303-T307 WeakPolarHBondContact O-CB 3.43Å; A303-T307 PolarHBondContact O-N 3.29Å; A303-T307 PolarHBondContact O-OG1 3.16Å; A303-T343 HydrophobicContact CB-CG2 4.23Å; A303-H346 HydrophobicContact CB-CB 3.62Å; A303-V347 HydrophobicContact CB-CG2 3.82Å
304	E	92.4	Very high	89.8	Confident	95 Å²	95	34.9 Å²	34.9	44%	0.444	18%	0.183	S	C	.	.	H	α-helix	trans	-63.4	-49	172	-71.1	167.3	-157.5	0	0	111.4	Q300 L301 R302 T307 K308	Q300-E304 WeakPolarHBondContact CG-OE1 3.41Å; Q300-E304 PolarHBondContact NE2-OE1 3.47Å; Q300-E304 WeakPolarHBondContact O-CG 3.45Å; Q300-E304 PolarHBondContact O-N 3.41Å; L301-E304 WeakPolarHBondContact CD2-OE2 3.29Å; R302-E304 VanDerWaalsContact C-N 3.33Å; R302-E304 PolarHBondContact O-N 3.36Å; E304-T307 PolarHBondContact O-N 2.93Å; E304-K308 PolarHBondContact O-N 3.38Å
305	V	91.9	Very high	90.4	Very high	7 Å²	7	36 Å²	36	4%	0.042	19%	0.19	C	C	.	.	H	α-helix	trans	-65.5	-41.2	176.3	173.7	0	0	0	0	112.2	F232 M292 V293 R296 L301 R302 T307 K308 F309	F232-V305 HydrophobicContact CE1-CG1 4.08Å; F232-V305 HydrophobicContact CE1-CG2 4.22Å; F232-V305 HydrophobicContact CZ-CG1 4.2Å; M292-V305 HydrophobicContact CB-CG1 4.45Å; V293-V305 HydrophobicContact CG2-CG1 4.02Å; R296-V305 HydrophobicContact CG-CG2 3.71Å; L301-V305 WeakPolarHBondContact O-CG2 3.48Å; L301-V305 PolarHBondContact O-N 3.09Å; R302-V305 PolarHBondContact O-N 3.31Å; V305-T307 PolarHBondContact O-N 3.44Å; V305-K308 WeakPolarHBondContact O-CB 3.41Å; V305-K308 PolarHBondContact O-N 3.41Å; V305-F309 HydrophobicContact CG1-CD2 3.85Å; V305-F309 HydrophobicContact CG1-CE2 3.53Å; V305-F309 WeakPolarHBondContact O-CD2 3.3Å; V305-F309 PolarHBondContact O-N 3.36Å
306	F	94.7	Very high	91.2	Very high	19 Å²	19	35.1 Å²	35.1	8%	0.083	18%	0.184	C	C	.	.	H	α-helix	trans	-59.8	-45.2	174.1	-175.6	-92	0	0	0	111.4	V293 R302 K308 F309 I310 L332 I337 V347 L355	V293-F306 HydrophobicContact CG2-CB 4.37Å; R302-F306 VanDerWaalsContact O-CB 3.26Å; R302-F306 WeakPolarHBondContact O-CB 3.27Å; R302-F306 PolarHBondContact O-N 2.88Å; F306-K308 VanDerWaalsContact C-N 3.32Å; F306-K308 PolarHBondContact O-N 3Å; F306-F309 PolarHBondContact O-N 2.87Å; F306-I310 HydrophobicContact CD1-CD1 3.73Å; F306-I310 HydrophobicContact CE1-CD1 3.46Å; F306-I310 VanDerWaalsContact CE1-CD1 3.46Å; F306-I310 HydrophobicContact CZ-CD1 4.2Å; F306-I310 PolarHBondContact O-N 3.46Å; F306-I310 VanDerWaalsContact O-N 3.15Å; F306-L332 HydrophobicContact CD2-CD2 3.49Å; F306-L332 VanDerWaalsContact CD2-CD2 3.49Å; F306-L332 HydrophobicContact CE2-CB 4.13Å; F306-L332 HydrophobicContact CE2-CD2 3.7Å; F306-L332 HydrophobicContact CE2-CG 4.48Å; F306-L332 HydrophobicContact CG-CD2 4.18Å; F306-I337 HydrophobicContact CD2-CG2 3.89Å; F306-I337 HydrophobicContact CE2-CG2 3.7Å; F306-V347 HydrophobicContact CD1-CG1 4.1Å; F306-V347 HydrophobicContact CD1-CG2 3.65Å; F306-V347 HydrophobicContact CE1-CG1 4.19Å; F306-V347 HydrophobicContact CE1-CG2 4.09Å; F306-V347 HydrophobicContact CG-CG2 4.48Å; F306-L355 HydrophobicContact CE1-CD2 4.19Å; F306-L355 HydrophobicContact CZ-CD2 3.69Å
307	T	95.3	Very high	92	Very high	26 Å²	26	37 Å²	37	16%	0.16	19%	0.194	C	C	.	.	H	α-helix	trans	-62.1	-38.6	173.9	-63.8	0	0	0	0	111.8	A303 E304 V305 I310 H311 V351	A303-T307 WeakPolarHBondContact O-CB 3.43Å; A303-T307 PolarHBondContact O-N 3.29Å; A303-T307 PolarHBondContact O-OG1 3.16Å; E304-T307 PolarHBondContact O-N 2.93Å; V305-T307 PolarHBondContact O-N 3.44Å; T307-I310 PolarHBondContact O-N 3.48Å; T307-H311 PolarHBondContact O-N 3Å; T307-H311 PolarHBondContact O-ND1 3.01Å; T307-V351 HydrophobicContact CG2-CG1 4.03Å; T307-V351 HydrophobicContact CG2-CG2 3.87Å
308	K	95	Very high	92.8	Very high	33 Å²	33	39.1 Å²	39.1	14%	0.143	20%	0.2	C	C	.	.	H	α-helix	trans	-62.8	-45.3	176.3	-166.2	168.9	-169.7	171.8	0	111.7	F232 D233 L235 P237 E304 V305 F306 I310 H311 V312	F232-K308 HydrophobicContact CE1-CD 4.22Å; F232-K308 HydrophobicContact CZ-CD 4.29Å; F232-K308 PolarHBondContact O-NZ 3.14Å; D233-K308 VanDerWaalsContact C-NZ 3.33Å; D233-K308 PolarHBondContact O-NZ 2.84Å; L235-K308 WeakPolarHBondContact O-CE 3.42Å; L235-K308 PolarHBondContact O-NZ 2.87Å; P237-K308 HydrophobicContact CG-CG 4.33Å; E304-K308 PolarHBondContact O-N 3.38Å; V305-K308 WeakPolarHBondContact O-CB 3.41Å; V305-K308 PolarHBondContact O-N 3.41Å; F306-K308 VanDerWaalsContact C-N 3.32Å; F306-K308 PolarHBondContact O-N 3Å; K308-I310 VanDerWaalsContact C-N 3.33Å; K308-I310 PolarHBondContact O-N 2.73Å; K308-H311 WeakPolarHBondContact O-CA 3.45Å; K308-H311 WeakPolarHBondContact O-CB 3.46Å; K308-H311 PolarHBondContact O-N 2.84Å; K308-V312 WeakPolarHBondContact O-CG2 3.3Å; K308-V312 PolarHBondContact O-N 3.48Å
309	F	96.1	Very high	93.4	Very high	1 Å²	1	37.5 Å²	37.5	0%	0.004	19%	0.187	C	C	.	.	H	α-helix	trans	-65.3	-31.5	176.7	-75.6	-56.7	0	0	0	113.8	F232 L240 W288 V289 M292 V293 V305 F306 H311 V312 A313 V328 L332	F232-F309 AromaticContact CE2-CE1 3.94Å; F232-F309 HydrophobicContact CE2-CE1 3.94Å; F232-F309 AromaticContact CE2-CZ 3.71Å; F232-F309 HydrophobicContact CE2-CZ 3.71Å; F232-F309 HydrophobicContact CZ-CE1 4.05Å; F232-F309 HydrophobicContact CZ-CE2 4.01Å; F232-F309 AromaticContact CZ-CZ 3.59Å; F232-F309 HydrophobicContact CZ-CZ 3.59Å; L240-F309 HydrophobicContact CD2-CE1 4.42Å; W288-F309 HydrophobicContact CE3-CE1 4.22Å; W288-F309 HydrophobicContact CE3-CZ 4.33Å; W288-F309 AromaticContact CH2-CE1 3.93Å; W288-F309 HydrophobicContact CH2-CE1 3.93Å; W288-F309 HydrophobicContact CH2-CZ 4.16Å; W288-F309 AromaticContact CZ3-CE1 3.58Å; W288-F309 HydrophobicContact CZ3-CE1 3.58Å; W288-F309 AromaticContact CZ3-CZ 4Å; W288-F309 HydrophobicContact CZ3-CZ 4Å; V289-F309 HydrophobicContact CB-CE2 4.49Å; V289-F309 HydrophobicContact CG1-CD2 3.98Å; V289-F309 HydrophobicContact CG1-CE2 4.29Å; V289-F309 HydrophobicContact CG1-CG 4.13Å; V289-F309 HydrophobicContact CG2-CD1 3.95Å; V289-F309 HydrophobicContact CG2-CE1 3.86Å; V289-F309 HydrophobicContact CG2-CE2 4.49Å; V289-F309 HydrophobicContact CG2-CG 4.33Å; V289-F309 HydrophobicContact CG2-CZ 4.14Å; M292-F309 HydrophobicContact CB-CE2 3.78Å; M292-F309 HydrophobicContact CB-CZ 3.86Å; M292-F309 HydrophobicContact CG-CZ 4.29Å; V293-F309 HydrophobicContact CG2-CD2 4.2Å; V293-F309 HydrophobicContact CG2-CE2 4.39Å; V305-F309 HydrophobicContact CG1-CD2 3.85Å; V305-F309 HydrophobicContact CG1-CE2 3.53Å; V305-F309 WeakPolarHBondContact O-CD2 3.3Å; V305-F309 PolarHBondContact O-N 3.36Å; F306-F309 PolarHBondContact O-N 2.87Å; F309-H311 VanDerWaalsContact C-N 3.29Å; F309-H311 PolarHBondContact O-N 2.95Å; F309-V312 HydrophobicContact CD1-CG2 4.44Å; F309-V312 WeakPolarHBondContact O-CB 3.24Å; F309-V312 PolarHBondContact O-N 2.69Å; F309-A313 WeakPolarHBondContact O-CB 3.16Å; F309-A313 PolarHBondContact O-N 3.09Å; F309-V328 HydrophobicContact CB-CG1 4.26Å; F309-L332 HydrophobicContact CB-CD1 4.06Å; F309-L332 HydrophobicContact CB-CD2 3.94Å; F309-L332 HydrophobicContact CB-CG 4.38Å
310	I	96.4	Very high	93.8	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-67	-32.2	171.7	-66.9	165.8	0	0	0	111.2	F306 T307 K308 A313 K314 L332 V351 V354 L355	F306-I310 HydrophobicContact CD1-CD1 3.73Å; F306-I310 HydrophobicContact CE1-CD1 3.46Å; F306-I310 VanDerWaalsContact CE1-CD1 3.46Å; F306-I310 HydrophobicContact CZ-CD1 4.2Å; F306-I310 PolarHBondContact O-N 3.46Å; F306-I310 VanDerWaalsContact O-N 3.15Å; T307-I310 PolarHBondContact O-N 3.48Å; K308-I310 VanDerWaalsContact C-N 3.33Å; K308-I310 PolarHBondContact O-N 2.73Å; I310-A313 PolarHBondContact O-N 3.12Å; I310-K314 WeakPolarHBondContact O-CG 3.36Å; I310-K314 PolarHBondContact O-N 2.77Å; I310-L332 HydrophobicContact CG1-CD1 3.72Å; I310-V351 HydrophobicContact CB-CG1 4.02Å; I310-V351 HydrophobicContact CD1-CG1 3.47Å; I310-V351 VanDerWaalsContact CD1-CG1 3.47Å; I310-V351 HydrophobicContact CG1-CG1 4.33Å; I310-V351 HydrophobicContact CG2-CG1 3.96Å; I310-V354 HydrophobicContact CG2-CB 4.21Å; I310-V354 HydrophobicContact CG2-CG1 3.9Å; I310-L355 HydrophobicContact CD1-CB 3.96Å; I310-L355 HydrophobicContact CD1-CD2 4.18Å; I310-L355 HydrophobicContact CD1-CG 4.48Å; I310-L355 HydrophobicContact CG1-CB 4.37Å; I310-L355 HydrophobicContact CG1-CD1 4.44Å
311	H	96.3	Very high	94.1	Very high	61 Å²	61	34.2 Å²	34.2	28%	0.282	17%	0.169	S	C	.	.	H	α-helix	trans	-71.1	-37.7	170.9	-70.4	91.9	0	0	0	112.8	P237 T307 K308 F309 A313 K314 C315	P237-H311 HydrophobicContact CB-CB 3.75Å; P237-H311 HydrophobicContact CG-CB 3.88Å; T307-H311 PolarHBondContact O-N 3Å; T307-H311 PolarHBondContact O-ND1 3.01Å; K308-H311 WeakPolarHBondContact O-CA 3.45Å; K308-H311 WeakPolarHBondContact O-CB 3.46Å; K308-H311 PolarHBondContact O-N 2.84Å; F309-H311 VanDerWaalsContact C-N 3.29Å; F309-H311 PolarHBondContact O-N 2.95Å; H311-A313 VanDerWaalsContact C-N 3.3Å; H311-A313 PolarHBondContact O-N 2.69Å; H311-K314 PolarHBondContact CD2-NZ 2.88Å; H311-K314 PolarHBondContact NE2-NZ 2.87Å; H311-K314 WeakPolarHBondContact O-CB 3.4Å; H311-K314 PolarHBondContact O-N 3.03Å; H311-C315 PolarHBondContact O-N 3.12Å; H311-C315 VanDerWaalsContact O-N 3.14Å; H311-C315 PolarHBondContact O-SG 3.46Å; H311-C315 VanDerWaalsContact O-SG 3.41Å
312	V	96.3	Very high	94.6	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-58.9	-43.6	170	178.7	0	0	0	0	110.3	P237 L240 A241 L244 K308 F309 K314 C315 L316	P237-V312 HydrophobicContact CB-CG2 4Å; L240-V312 HydrophobicContact CB-CG2 4.25Å; L240-V312 HydrophobicContact CD2-CG2 3.75Å; L240-V312 HydrophobicContact CG-CG1 4.38Å; L240-V312 HydrophobicContact CG-CG2 4.11Å; A241-V312 HydrophobicContact CB-CG1 4.18Å; L244-V312 HydrophobicContact CD1-CG1 4.23Å; K308-V312 WeakPolarHBondContact O-CG2 3.3Å; K308-V312 PolarHBondContact O-N 3.48Å; F309-V312 HydrophobicContact CD1-CG2 4.44Å; F309-V312 WeakPolarHBondContact O-CB 3.24Å; F309-V312 PolarHBondContact O-N 2.69Å; V312-K314 VanDerWaalsContact C-N 3.35Å; V312-K314 PolarHBondContact O-N 3.25Å; V312-C315 WeakPolarHBondContact O-CB 3.29Å; V312-C315 PolarHBondContact O-N 3.46Å; V312-C315 VanDerWaalsContact O-N 3.14Å; V312-L316 HydrophobicContact CG1-CD1 3.98Å; V312-L316 HydrophobicContact CG1-CG 4.29Å; V312-L316 WeakPolarHBondContact O-CG 3.32Å; V312-L316 PolarHBondContact O-N 3.22Å
313	A	96.8	Very high	94.9	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-62.6	-36.1	176.2	0	0	0	0	0	112.8	F309 I310 H311 C315 L316 H317 L325 V328 V329 M358	F309-A313 WeakPolarHBondContact O-CB 3.16Å; F309-A313 PolarHBondContact O-N 3.09Å; I310-A313 PolarHBondContact O-N 3.12Å; H311-A313 VanDerWaalsContact C-N 3.3Å; H311-A313 PolarHBondContact O-N 2.69Å; A313-C315 PolarHBondContact O-N 2.74Å; A313-L316 PolarHBondContact O-N 2.82Å; A313-H317 PolarHBondContact O-N 2.6Å; A313-L325 HydrophobicContact CB-CD1 3.76Å; A313-L325 VanDerWaalsContact O-CD1 3.23Å; A313-L325 WeakPolarHBondContact O-CD1 3.41Å; A313-V328 HydrophobicContact CB-CG1 4.27Å; A313-V329 HydrophobicContact CB-CG2 4.32Å; A313-M358 VanDerWaalsContact C-CE 3.43Å; A313-M358 HydrophobicContact CB-CE 3.94Å; A313-M358 HydrophobicContact CB-SD 3.51Å; A313-M358 VanDerWaalsContact CB-SD 3.51Å
314	K	96.5	Very high	95.1	Very high	68 Å²	68	31 Å²	31	30%	0.296	15%	0.152	S	C	.	.	H	α-helix	trans	-58.7	-48.2	170.9	-69.5	174	-175.3	173.5	0	110.6	I310 H311 V312 H317 L318 V354 M358	I310-K314 WeakPolarHBondContact O-CG 3.36Å; I310-K314 PolarHBondContact O-N 2.77Å; H311-K314 PolarHBondContact CD2-NZ 2.88Å; H311-K314 PolarHBondContact NE2-NZ 2.87Å; H311-K314 WeakPolarHBondContact O-CB 3.4Å; H311-K314 PolarHBondContact O-N 3.03Å; V312-K314 VanDerWaalsContact C-N 3.35Å; V312-K314 PolarHBondContact O-N 3.25Å; K314-H317 PolarHBondContact O-N 3.34Å; K314-L318 WeakPolarHBondContact O-CG 3.39Å; K314-L318 PolarHBondContact O-N 3.17Å; K314-L318 VanDerWaalsContact O-N 3.09Å; K314-V354 HydrophobicContact CD-CG1 4.39Å; K314-V354 HydrophobicContact CG-CG1 3.87Å; K314-M358 VanDerWaalsContact CA-CE 3.49Å; K314-M358 HydrophobicContact CB-CE 4.16Å; K314-M358 HydrophobicContact CG-CE 3.69Å; K314-M358 VanDerWaalsContact N-CE 3.28Å
315	C	95.6	Very high	95.3	Very high	28 Å²	28	26.5 Å²	26.5	19%	0.189	13%	0.131	C	C	.	.	H	α-helix	trans	-62.5	-46.8	179	-62.8	0	0	0	0	111.8	A241 H311 V312 A313 H317 L318 M319	A241-C315 HydrophobicContact CB-CB 3.47Å; A241-C315 VanDerWaalsContact CB-CB 3.47Å; H311-C315 PolarHBondContact O-N 3.12Å; H311-C315 VanDerWaalsContact O-N 3.14Å; H311-C315 PolarHBondContact O-SG 3.46Å; H311-C315 VanDerWaalsContact O-SG 3.41Å; V312-C315 WeakPolarHBondContact O-CB 3.29Å; V312-C315 PolarHBondContact O-N 3.46Å; V312-C315 VanDerWaalsContact O-N 3.14Å; A313-C315 PolarHBondContact O-N 2.74Å; C315-H317 VanDerWaalsContact C-N 3.29Å; C315-H317 PolarHBondContact O-N 3.4Å; C315-L318 WeakPolarHBondContact O-CB 3.45Å; C315-L318 PolarHBondContact O-N 3.04Å; C315-L318 VanDerWaalsContact O-N 3.11Å; C315-M319 VanDerWaalsContact O-CG 3.26Å; C315-M319 WeakPolarHBondContact O-CG 3.48Å; C315-M319 PolarHBondContact O-N 2.95Å
316	L	95.6	Very high	95.4	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-58.5	-37.7	177.4	-69	170.2	0	0	0	113.1	A241 T245 V312 A313 M319 H320 N321 T324 L325 V328	A241-L316 HydrophobicContact CB-CD2 3.9Å; A241-L316 HydrophobicContact CB-CG 3.97Å; T245-L316 WeakPolarHBondContact OG1-CD2 3.44Å; V312-L316 HydrophobicContact CG1-CD1 3.98Å; V312-L316 HydrophobicContact CG1-CG 4.29Å; V312-L316 WeakPolarHBondContact O-CG 3.32Å; V312-L316 PolarHBondContact O-N 3.22Å; A313-L316 PolarHBondContact O-N 2.82Å; L316-M319 PolarHBondContact O-N 2.93Å; L316-H320 PolarHBondContact O-N 3.33Å; L316-N321 HydrophobicContact CD2-CB 4.28Å; L316-N321 PolarHBondContact O-N 3.48Å; L316-T324 HydrophobicContact CD1-CG2 3.69Å; L316-T324 HydrophobicContact CD2-CG2 4.02Å; L316-L325 HydrophobicContact CB-CB 4.23Å; L316-L325 HydrophobicContact CB-CD1 4.31Å; L316-V328 HydrophobicContact CD1-CB 4.49Å; L316-V328 HydrophobicContact CD1-CG2 3.91Å
317	H	95.5	Very high	95.4	Very high	66 Å²	66	25.8 Å²	25.8	31%	0.306	13%	0.127	S	C	.	.	H	α-helix	trans	-67.7	-42.6	174.7	-174.7	-162.5	0	0	0	112.2	A313 K314 C315 M319 H320 Y322 L325 L361	A313-H317 PolarHBondContact O-N 2.6Å; K314-H317 PolarHBondContact O-N 3.34Å; C315-H317 VanDerWaalsContact C-N 3.29Å; C315-H317 PolarHBondContact O-N 3.4Å; H317-M319 VanDerWaalsContact C-N 3.29Å; H317-M319 PolarHBondContact O-N 3.14Å; H317-H320 PolarHBondContact O-N 2.84Å; H317-H320 PolarHBondContact O-ND1 3.41Å; H317-H320 VanDerWaalsContact O-ND1 3.12Å; H317-Y322 AromaticContact CD2-CE1 3.98Å; H317-L325 HydrophobicContact CB-CD1 4.37Å; H317-L325 HydrophobicContact CB-CD2 3.84Å; H317-L361 WeakPolarHBondContact NE2-CD2 3.47Å
318	L	93.8	Very high	95.4	Very high	136 Å²	136	24.5 Å²	24.5	71%	0.712	12%	0.12	S	C	*	.	H	α-helix	trans	-64.1	-32.9	174.8	-68.7	169.9	0	0	0	112.5	K314 C315 H320	K314-L318 WeakPolarHBondContact O-CG 3.39Å; K314-L318 PolarHBondContact O-N 3.17Å; K314-L318 VanDerWaalsContact O-N 3.09Å; C315-L318 WeakPolarHBondContact O-CB 3.45Å; C315-L318 PolarHBondContact O-N 3.04Å; C315-L318 VanDerWaalsContact O-N 3.11Å; L318-H320 PolarHBondContact O-N 3.07Å
319	M	91.4	Very high	95.4	Very high	38 Å²	38	23 Å²	23	19%	0.187	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-2.6	173	-65.2	176.7	79.6	0	0	114	A241 D242 T245 C315 L316 H317 N321 L434	A241-M319 HydrophobicContact CB-SD 3.92Å; D242-M319 WeakPolarHBondContact OD1-CE 3.37Å; T245-M319 HydrophobicContact CG2-CE 3.88Å; C315-M319 VanDerWaalsContact O-CG 3.26Å; C315-M319 WeakPolarHBondContact O-CG 3.48Å; C315-M319 PolarHBondContact O-N 2.95Å; L316-M319 PolarHBondContact O-N 2.93Å; H317-M319 VanDerWaalsContact C-N 3.29Å; H317-M319 PolarHBondContact O-N 3.14Å; M319-N321 PolarHBondContact O-N 2.92Å; M319-L434 HydrophobicContact CE-CD2 3.38Å
320	H	94.3	Very high	95.1	Very high	63 Å²	63	23.2 Å²	23.2	29%	0.292	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	28.4	-176.1	-48.3	-35.8	0	0	0	114.1	L316 H317 L318 Y322 V378 K382 I383	L316-H320 PolarHBondContact O-N 3.33Å; H317-H320 PolarHBondContact O-N 2.84Å; H317-H320 PolarHBondContact O-ND1 3.41Å; H317-H320 VanDerWaalsContact O-ND1 3.12Å; L318-H320 PolarHBondContact O-N 3.07Å; H320-Y322 HydrophobicContact CB-CE2 4.05Å; H320-Y322 WeakPolarHBondContact O-CD2 3.48Å; H320-Y322 PolarHBondContact O-N 2.93Å; H320-V378 HydrophobicContact CB-CG1 3.96Å; H320-V378 HydrophobicContact CB-CG2 4.49Å; H320-V378 WeakPolarHBondContact CD2-CG1 3.23Å; H320-K382 HydrophobicContact CB-CB 3.86Å; H320-K382 WeakPolarHBondContact O-CA 3.44Å; H320-I383 PolarHBondContact O-N 2.87Å
321	N	94.9	Very high	94.9	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.115	C	C	.	.	B	Isolated β-bridge	trans	-89.1	86	171.5	177.7	0.6	0	0	0	109.6	T245 L316 M319 N323 T324 L325 I383	T245-N321 WeakPolarHBondContact CA-ND2 3.41Å; T245-N321 WeakPolarHBondContact CB-ND2 3.37Å; T245-N321 HydrophobicContact CG2-CB 4.01Å; T245-N321 PolarHBondContact OG1-ND2 2.92Å; L316-N321 HydrophobicContact CD2-CB 4.28Å; L316-N321 PolarHBondContact O-N 3.48Å; M319-N321 PolarHBondContact O-N 2.92Å; N321-N323 PolarHBondContact OD1-N 2.99Å; N321-T324 WeakPolarHBondContact ND2-CB 3.43Å; N321-T324 PolarHBondContact ND2-OG1 3.24Å; N321-T324 PolarHBondContact OD1-N 2.87Å; N321-T324 PolarHBondContact OD1-OG1 2.82Å; N321-L325 WeakPolarHBondContact O-CB 3.48Å; N321-L325 PolarHBondContact O-N 2.89Å; N321-I383 HydrophobicContact CB-CB 4.48Å; N321-I383 HydrophobicContact CB-CD1 4.31Å; N321-I383 HydrophobicContact CB-CG1 4.41Å
322	Y	96.3	Very high	94.7	Very high	4 Å²	4	20.4 Å²	20.4	2%	0.016	10%	0.103	C	C	.	.	H	α-helix	trans	-75.5	-27.6	-177.4	-61.4	-82.4	0	0	0	112.8	H317 H320 L325 M326 Y371 A374 Y375 I383	H317-Y322 AromaticContact CD2-CE1 3.98Å; H320-Y322 HydrophobicContact CB-CE2 4.05Å; H320-Y322 WeakPolarHBondContact O-CD2 3.48Å; H320-Y322 PolarHBondContact O-N 2.93Å; Y322-L325 HydrophobicContact CD1-CD2 4.25Å; Y322-L325 PolarHBondContact O-N 3.07Å; Y322-M326 WeakPolarHBondContact O-CB 3.5Å; Y322-M326 PolarHBondContact O-N 2.89Å; Y322-Y371 AromaticContact CD1-CD2 3.94Å; Y322-Y371 HydrophobicContact CD1-CD2 3.94Å; Y322-Y371 HydrophobicContact CD1-CE2 4.11Å; Y322-Y371 HydrophobicContact CD2-CE2 4.08Å; Y322-Y371 HydrophobicContact CG-CD2 4.01Å; Y322-Y371 AromaticContact CG-CE2 3.68Å; Y322-Y371 HydrophobicContact CG-CE2 3.68Å; Y322-A374 HydrophobicContact CE1-CB 4.48Å; Y322-Y375 HydrophobicContact CD2-CD2 4Å; Y322-Y375 HydrophobicContact CE2-CD2 4.14Å; Y322-I383 WeakPolarHBondContact CB-O 3.26Å; Y322-I383 PolarHBondContact N-O 2.94Å
323	N	95.3	Very high	94.5	Very high	4 Å²	4	21.2 Å²	21.2	2%	0.021	11%	0.108	C	C	.	.	H	α-helix	trans	-66.7	-50.9	-179.8	-147.9	38.2	0	0	0	111.7	E248 N321 L325 M326 A327 I383 P384 I385 L386	E248-N323 HydrophobicContact CG-CB 4.3Å; E248-N323 PolarHBondContact OE1-ND2 3.29Å; N321-N323 PolarHBondContact OD1-N 2.99Å; N323-L325 VanDerWaalsContact C-N 3.34Å; N323-M326 WeakPolarHBondContact O-CB 3.37Å; N323-M326 PolarHBondContact O-N 3.02Å; N323-A327 PolarHBondContact O-N 3.18Å; N323-A327 VanDerWaalsContact O-N 3.12Å; N323-I383 HydrophobicContact CB-CG2 3.99Å; N323-P384 WeakPolarHBondContact CB-O 3.18Å; N323-I385 WeakPolarHBondContact OD1-CA 3.32Å; N323-L386 PolarHBondContact OD1-N 3.07Å
324	T	95.8	Very high	94.2	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.006	12%	0.118	C	C	.	.	H	α-helix	trans	-70.7	-31.5	176.3	-49.1	0	0	0	0	111.8	L244 E248 I285 L316 N321 M326 A327 V328	L244-T324 HydrophobicContact CB-CG2 4.02Å; L244-T324 HydrophobicContact CD1-CG2 4.44Å; E248-T324 WeakPolarHBondContact CB-OG1 3.23Å; I285-T324 HydrophobicContact CD1-CG2 4.2Å; I285-T324 HydrophobicContact CG2-CG2 4.37Å; L316-T324 HydrophobicContact CD1-CG2 3.69Å; L316-T324 HydrophobicContact CD2-CG2 4.02Å; N321-T324 WeakPolarHBondContact ND2-CB 3.43Å; N321-T324 PolarHBondContact ND2-OG1 3.24Å; N321-T324 PolarHBondContact OD1-N 2.87Å; N321-T324 PolarHBondContact OD1-OG1 2.82Å; T324-M326 VanDerWaalsContact C-N 3.31Å; T324-M326 PolarHBondContact O-N 3.23Å; T324-A327 PolarHBondContact O-N 2.8Å; T324-V328 HydrophobicContact CG2-CG2 4.33Å; T324-V328 WeakPolarHBondContact O-CG2 3.41Å; T324-V328 PolarHBondContact O-N 3.44Å
325	L	96.8	Very high	93.9	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-58.9	-43.9	171.8	-178.5	64.3	0	0	0	111.1	A313 L316 H317 N321 Y322 N323 V328 V329 M358 L361 L362	A313-L325 HydrophobicContact CB-CD1 3.76Å; A313-L325 VanDerWaalsContact O-CD1 3.23Å; A313-L325 WeakPolarHBondContact O-CD1 3.41Å; L316-L325 HydrophobicContact CB-CB 4.23Å; L316-L325 HydrophobicContact CB-CD1 4.31Å; H317-L325 HydrophobicContact CB-CD1 4.37Å; H317-L325 HydrophobicContact CB-CD2 3.84Å; N321-L325 WeakPolarHBondContact O-CB 3.48Å; N321-L325 PolarHBondContact O-N 2.89Å; Y322-L325 HydrophobicContact CD1-CD2 4.25Å; Y322-L325 PolarHBondContact O-N 3.07Å; N323-L325 VanDerWaalsContact C-N 3.34Å; L325-V328 PolarHBondContact O-N 3.13Å; L325-V329 HydrophobicContact CD1-CG2 4.06Å; L325-V329 HydrophobicContact CG-CG2 4.47Å; L325-V329 WeakPolarHBondContact O-CB 3.45Å; L325-V329 VanDerWaalsContact O-CG2 3.28Å; L325-V329 WeakPolarHBondContact O-CG2 3.23Å; L325-V329 PolarHBondContact O-N 2.79Å; L325-M358 HydrophobicContact CD1-SD 4.41Å; L325-L361 HydrophobicContact CD2-CD2 4.39Å; L325-L362 HydrophobicContact CG-CD1 4.19Å
326	M	94.6	Very high	93.4	Very high	11 Å²	11	21.6 Å²	21.6	5%	0.054	12%	0.115	C	C	.	.	H	α-helix	trans	-60.4	-46.3	174.4	-172.4	62.6	164.1	0	0	111.5	Y322 N323 T324 G330 L362 Y368 I385 V481 V483	Y322-M326 WeakPolarHBondContact O-CB 3.5Å; Y322-M326 PolarHBondContact O-N 2.89Å; N323-M326 WeakPolarHBondContact O-CB 3.37Å; N323-M326 PolarHBondContact O-N 3.02Å; T324-M326 VanDerWaalsContact C-N 3.31Å; T324-M326 PolarHBondContact O-N 3.23Å; M326-G330 PolarHBondContact O-N 3Å; M326-L362 HydrophobicContact CB-CD2 4.27Å; M326-L362 HydrophobicContact SD-CB 3.91Å; M326-L362 HydrophobicContact SD-CD1 3.98Å; M326-L362 HydrophobicContact SD-CD2 3.99Å; M326-L362 HydrophobicContact SD-CG 4.2Å; M326-Y368 HydrophobicContact CE-CE1 4Å; M326-I385 HydrophobicContact CB-CD1 4.31Å; M326-I385 HydrophobicContact CB-CG1 4.42Å; M326-I385 HydrophobicContact CB-CG2 4.33Å; M326-I385 HydrophobicContact CG-CG2 4.17Å; M326-V481 HydrophobicContact CE-CG1 3.74Å; M326-V481 HydrophobicContact SD-CG1 3.59Å; M326-V481 VanDerWaalsContact SD-CG1 3.59Å; M326-V483 HydrophobicContact CE-CG2 4.01Å; M326-V483 HydrophobicContact CG-CG2 3.86Å; M326-V483 WeakPolarHBondContact O-CG2 3.26Å; M326-V483 HydrophobicContact SD-CG2 4.09Å
327	A	93.9	Very high	93.3	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-58.8	-48.8	176.9	0	0	0	0	0	113.1	C282 I285 S286 N323 T324 G331	C282-A327 WeakPolarHBondContact O-CB 3.46Å; I285-A327 HydrophobicContact CB-CB 4.17Å; I285-A327 HydrophobicContact CG2-CB 3.84Å; S286-A327 WeakPolarHBondContact OG-CA 3.43Å; S286-A327 WeakPolarHBondContact OG-CB 3.25Å; S286-A327 PolarHBondContact OG-O 3.43Å; N323-A327 PolarHBondContact O-N 3.18Å; N323-A327 VanDerWaalsContact O-N 3.12Å; T324-A327 PolarHBondContact O-N 2.8Å; A327-G331 PolarHBondContact O-N 3.31Å
328	V	95.6	Very high	93.1	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-67.5	-45.8	-178.8	175.6	0	0	0	0	111.2	I285 V289 F309 A313 L316 T324 L325 G331 L332	I285-V328 HydrophobicContact CG2-CG2 4.04Å; V289-V328 HydrophobicContact CG2-CG1 4.33Å; V289-V328 HydrophobicContact CG2-CG2 4.2Å; F309-V328 HydrophobicContact CB-CG1 4.26Å; A313-V328 HydrophobicContact CB-CG1 4.27Å; L316-V328 HydrophobicContact CD1-CB 4.49Å; L316-V328 HydrophobicContact CD1-CG2 3.91Å; T324-V328 HydrophobicContact CG2-CG2 4.33Å; T324-V328 WeakPolarHBondContact O-CG2 3.41Å; T324-V328 PolarHBondContact O-N 3.44Å; L325-V328 PolarHBondContact O-N 3.13Å; V328-G331 PolarHBondContact O-N 3.15Å; V328-L332 HydrophobicContact CG1-CD1 4.11Å; V328-L332 VanDerWaalsContact O-CG 3.31Å; V328-L332 WeakPolarHBondContact O-CG 3.31Å; V328-L332 PolarHBondContact O-N 3.01Å
329	V	94.8	Very high	92.9	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-67.5	-39	179.3	175	0	0	0	0	111.2	A313 L325 L332 C333 L355 M358 L362	A313-V329 HydrophobicContact CB-CG2 4.32Å; L325-V329 HydrophobicContact CD1-CG2 4.06Å; L325-V329 HydrophobicContact CG-CG2 4.47Å; L325-V329 WeakPolarHBondContact O-CB 3.45Å; L325-V329 VanDerWaalsContact O-CG2 3.28Å; L325-V329 WeakPolarHBondContact O-CG2 3.23Å; L325-V329 PolarHBondContact O-N 2.79Å; V329-L332 PolarHBondContact O-N 2.87Å; V329-C333 VanDerWaalsContact O-CB 3.27Å; V329-C333 WeakPolarHBondContact O-CB 3.28Å; V329-C333 PolarHBondContact O-N 2.81Å; V329-C333 PolarHBondContact O-SG 3.49Å; V329-L355 HydrophobicContact CG1-CD1 4.24Å; V329-M358 HydrophobicContact CG2-CB 3.93Å; V329-M358 HydrophobicContact CG2-SD 4.3Å; V329-L362 HydrophobicContact CB-CD1 3.62Å; V329-L362 HydrophobicContact CG1-CD1 3.84Å; V329-L362 HydrophobicContact CG2-CD1 3.83Å
330	G	91.5	Very high	92.8	Very high	6 Å²	6	15.2 Å²	15.2	6%	0.062	9%	0.085	C	C	.	.	H	α-helix	trans	-60	-47	172.8	0	0	0	0	0	112.8	M326 L332 C333 H334	M326-G330 PolarHBondContact O-N 3Å; G330-L332 PolarHBondContact O-N 3.07Å; G330-C333 CarbonylContact O-C 3.35Å; G330-C333 PolarHBondContact O-N 3.01Å; G330-H334 PolarHBondContact O-N 3.38Å
331	G	91.1	Very high	92.7	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-59.2	-42.7	174.7	0	0	0	0	0	113.2	Q290 A327 V328 H334	Q290-G331 VanDerWaalsContact CG-O 3.28Å; Q290-G331 WeakPolarHBondContact CG-O 3.43Å; A327-G331 PolarHBondContact O-N 3.31Å; V328-G331 PolarHBondContact O-N 3.15Å; G331-H334 PolarHBondContact O-N 3.12Å
332	L	92.6	Very high	92.4	Very high	3 Å²	3	22.2 Å²	22.2	2%	0.016	12%	0.119	C	C	.	.	H	α-helix	trans	-68.8	-33.5	175.4	-66.8	170.4	0	0	0	113.1	V289 F306 F309 I310 V328 V329 G330 H334 L355	V289-L332 HydrophobicContact CG1-CD2 3.82Å; V289-L332 HydrophobicContact CG1-CG 3.9Å; F306-L332 HydrophobicContact CD2-CD2 3.49Å; F306-L332 VanDerWaalsContact CD2-CD2 3.49Å; F306-L332 HydrophobicContact CE2-CB 4.13Å; F306-L332 HydrophobicContact CE2-CD2 3.7Å; F306-L332 HydrophobicContact CE2-CG 4.48Å; F306-L332 HydrophobicContact CG-CD2 4.18Å; F309-L332 HydrophobicContact CB-CD1 4.06Å; F309-L332 HydrophobicContact CB-CD2 3.94Å; F309-L332 HydrophobicContact CB-CG 4.38Å; I310-L332 HydrophobicContact CG1-CD1 3.72Å; V328-L332 HydrophobicContact CG1-CD1 4.11Å; V328-L332 VanDerWaalsContact O-CG 3.31Å; V328-L332 WeakPolarHBondContact O-CG 3.31Å; V328-L332 PolarHBondContact O-N 3.01Å; V329-L332 PolarHBondContact O-N 2.87Å; G330-L332 PolarHBondContact O-N 3.07Å; L332-H334 VanDerWaalsContact C-N 3.34Å; L332-L355 HydrophobicContact CB-CD1 4.35Å; L332-L355 HydrophobicContact CD1-CD1 4.27Å
333	C	92.3	Very high	92.2	Very high	18 Å²	18	22.2 Å²	22.2	12%	0.122	12%	0.119	C	C	.	.	H	α-helix	trans	-83	-6.5	178.1	-66.8	0	0	0	0	113.8	V329 G330	V329-C333 VanDerWaalsContact O-CB 3.27Å; V329-C333 WeakPolarHBondContact O-CB 3.28Å; V329-C333 PolarHBondContact O-N 2.81Å; V329-C333 PolarHBondContact O-SG 3.49Å; G330-C333 CarbonylContact O-C 3.35Å; G330-C333 PolarHBondContact O-N 3.01Å
334	H	90.8	Very high	92	Very high	43 Å²	43	24.7 Å²	24.7	20%	0.199	14%	0.135	C	C	.	.	S	Bend	trans	-65	155	-172.5	-171.4	-124.5	0	0	0	112.9	Q290 G330 G331 L332 S336 I337 S338 E454	Q290-H334 HydrophobicContact CG-CB 4.29Å; Q290-H334 PolarHBondContact OE1-ND1 3.31Å; G330-H334 PolarHBondContact O-N 3.38Å; G331-H334 PolarHBondContact O-N 3.12Å; L332-H334 VanDerWaalsContact C-N 3.34Å; H334-S336 PolarHBondContact ND1-OG 3.23Å; H334-S336 PolarHBondContact O-N 3.46Å; H334-I337 PolarHBondContact O-N 2.93Å; H334-S338 WeakPolarHBondContact O-CB 3.46Å; H334-S338 PolarHBondContact O-N 3.36Å; H334-E454 IonicContact CE1-OE2 3.96Å; H334-E454 PolarHBondContact CE1-OE2 3.01Å; H334-E454 IonicContact ND1-OE2 2.65Å; H334-E454 IonicContact NE2-OE2 3.29Å
335	S	88.6	Confident	91.8	Very high	61 Å²	61	29 Å²	29	43%	0.427	17%	0.165	S	C	.	.	H	α-helix	trans	-56.1	-33.3	-175.8	69.2	0	0	0	0	113.7	I337 R339	S335-I337 VanDerWaalsContact C-N 3.35Å; S335-R339 VanDerWaalsContact O-CG 3.26Å; S335-R339 WeakPolarHBondContact O-CG 3.38Å
336	S	87	Confident	91.6	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-68.8	-28.6	175.8	62.9	0	0	0	0	112.9	Q290 H334 R339 S461	Q290-S336 PolarHBondContact OE1-OG 3.11Å; H334-S336 PolarHBondContact ND1-OG 3.23Å; H334-S336 PolarHBondContact O-N 3.46Å; S336-R339 WeakPolarHBondContact O-CG 3.29Å; S336-S461 WeakPolarHBondContact O-CB 3.35Å; S336-S461 PolarHBondContact O-OG 3.26Å
337	I	92.3	Very high	91.6	Very high	5 Å²	5	33.8 Å²	33.8	3%	0.026	19%	0.187	C	C	.	.	H	α-helix	trans	-100	-45.6	-177.4	-53.5	-54.5	0	0	0	111.2	Q290 V293 L294 F306 H334 S335 R339 L340	Q290-I337 HydrophobicContact CB-CD1 4.08Å; Q290-I337 HydrophobicContact CB-CG1 4.11Å; Q290-I337 HydrophobicContact CG-CD1 4.39Å; Q290-I337 HydrophobicContact CG-CG1 3.87Å; V293-I337 HydrophobicContact CB-CD1 4.23Å; V293-I337 HydrophobicContact CG1-CD1 4.19Å; L294-I337 HydrophobicContact CD1-CD1 4.14Å; L294-I337 HydrophobicContact CD2-CD1 4.29Å; L294-I337 HydrophobicContact CG-CD1 3.87Å; F306-I337 HydrophobicContact CD2-CG2 3.89Å; F306-I337 HydrophobicContact CE2-CG2 3.7Å; H334-I337 PolarHBondContact O-N 2.93Å; S335-I337 VanDerWaalsContact C-N 3.35Å; I337-R339 PolarHBondContact O-N 3.37Å; I337-L340 HydrophobicContact CD1-CD1 4.26Å; I337-L340 VanDerWaalsContact O-CB 3.28Å; I337-L340 WeakPolarHBondContact O-CB 3.49Å; I337-L340 WeakPolarHBondContact O-CG 3.49Å; I337-L340 PolarHBondContact O-N 3.44Å
338	S	91.1	Very high	91.6	Very high	54 Å²	54	36.5 Å²	36.5	38%	0.378	21%	0.205	S	C	.	.	H	α-helix	trans	-58.4	-24	179.9	-178.3	0	0	0	0	113.4	H334 K341	H334-S338 WeakPolarHBondContact O-CB 3.46Å; H334-S338 PolarHBondContact O-N 3.36Å; S338-K341 WeakPolarHBondContact O-CE 3.45Å; S338-K341 PolarHBondContact O-NZ 3.11Å
339	R	90.9	Very high	91.4	Very high	45 Å²	45	42.7 Å²	42.7	17%	0.17	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-16	174	67.8	176.9	-66.9	-67.3	-9	115.2	S335 S336 I337 K341 S461 E465	S335-R339 VanDerWaalsContact O-CG 3.26Å; S335-R339 WeakPolarHBondContact O-CG 3.38Å; S336-R339 WeakPolarHBondContact O-CG 3.29Å; I337-R339 PolarHBondContact O-N 3.37Å; R339-K341 PolarHBondContact O-N 2.88Å; R339-S461 VanDerWaalsContact CD-OG 3.27Å; R339-S461 WeakPolarHBondContact CD-OG 3.42Å; R339-S461 WeakPolarHBondContact CG-OG 3.38Å; R339-S461 VanDerWaalsContact NH1-C 3.26Å; R339-S461 PolarHBondContact NH1-O 3.17Å; R339-S461 PolarHBondContact NH1-OG 3.08Å; R339-E465 VanDerWaalsContact CZ-O 3.31Å; R339-E465 PolarHBondContact NH1-O 3.27Å; R339-E465 PolarHBondContact NH2-O 3.09Å
340	L	89.3	Confident	91.4	Very high	1 Å²	1	49 Å²	49	1%	0.005	27%	0.268	C	S	.	.			trans	-78.4	80.7	-173.5	-60.6	175.7	0	0	0	111.3	V293 L294 I337 T344 S461 E465	V293-L340 HydrophobicContact CG1-CD1 4.42Å; L294-L340 HydrophobicContact CD2-CD1 3.98Å; I337-L340 HydrophobicContact CD1-CD1 4.26Å; I337-L340 VanDerWaalsContact O-CB 3.28Å; I337-L340 WeakPolarHBondContact O-CB 3.49Å; I337-L340 WeakPolarHBondContact O-CG 3.49Å; I337-L340 PolarHBondContact O-N 3.44Å; L340-T344 WeakPolarHBondContact O-CB 3.42Å; L340-T344 PolarHBondContact O-N 3.03Å; L340-T344 PolarHBondContact O-OG1 3.42Å; L340-S461 WeakPolarHBondContact CD2-OG 3.41Å; L340-E465 WeakPolarHBondContact CA-OE2 3.45Å; L340-E465 HydrophobicContact CD2-CB 3.86Å; L340-E465 HydrophobicContact CD2-CG 3.91Å
341	K	91.6	Very high	91.5	Very high	127 Å²	127	49.1 Å²	49.1	55%	0.552	27%	0.268	S	S	*	.	H	α-helix	trans	-74.8	-29.6	-173.9	-59.9	-44.7	-174.8	-167.5	0	113.3	S338 R339 T344 S345 E465	S338-K341 WeakPolarHBondContact O-CE 3.45Å; S338-K341 PolarHBondContact O-NZ 3.11Å; R339-K341 PolarHBondContact O-N 2.88Å; K341-T344 PolarHBondContact O-N 3.5Å; K341-S345 PolarHBondContact O-N 3.19Å; K341-E465 PolarHBondContact N-OE2 3.45Å
342	D	88.5	Confident	91.5	Very high	84 Å²	84	51.1 Å²	51.1	45%	0.449	28%	0.28	S	S	.	.	H	α-helix	trans	-73.8	-35.4	175.9	-59.1	-22.5	0	0	0	110	A299 S345 H346 E465	A299-D342 HydrophobicContact CB-CB 4.29Å; D342-S345 PolarHBondContact O-OG 3.45Å; D342-H346 PolarHBondContact O-ND1 3.18Å; D342-E465 HydrophobicContact CB-CG 4.45Å; D342-E465 PolarHBondContact N-OE2 3.27Å
343	T	91.3	Very high	91.7	Very high	3 Å²	3	57 Å²	57	2%	0.018	31%	0.305	C	S	.	.	H	α-helix	trans	-63.9	-47.1	168.2	-59.1	0	0	0	0	111.3	R302 A303 S345 H346 E465	R302-T343 HydrophobicContact CB-CG2 3.55Å; R302-T343 PolarHBondContact NE-OG1 3.01Å; A303-T343 HydrophobicContact CB-CG2 4.23Å; T343-S345 VanDerWaalsContact C-N 3.3Å; T343-S345 PolarHBondContact O-N 3.06Å; T343-H346 PolarHBondContact O-N 2.98Å; T343-H346 VanDerWaalsContact O-N 3.14Å; T343-E465 WeakPolarHBondContact CB-OE1 3.26Å; T343-E465 PolarHBondContact N-OE1 3.38Å; T343-E465 VanDerWaalsContact N-OE1 3.08Å; T343-E465 PolarHBondContact OG1-OE1 3.44Å
344	T	90.9	Very high	91.8	Very high	57 Å²	57	57.3 Å²	57.3	35%	0.35	31%	0.306	S	S	.	.	H	α-helix	trans	-60.6	-36.7	-176.7	-55.4	0	0	0	0	112.4	L340 K341 H346 V347	L340-T344 WeakPolarHBondContact O-CB 3.42Å; L340-T344 PolarHBondContact O-N 3.03Å; L340-T344 PolarHBondContact O-OG1 3.42Å; K341-T344 PolarHBondContact O-N 3.5Å; T344-H346 PolarHBondContact O-N 3.14Å; T344-V347 PolarHBondContact O-N 3.14Å; T344-V347 VanDerWaalsContact O-N 3.12Å
345	S	92.6	Very high	91.9	Very high	91 Å²	91	56.2 Å²	56.2	64%	0.636	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-14.5	179.9	63.7	0	0	0	0	114.5	K341 D342 T343	K341-S345 PolarHBondContact O-N 3.19Å; D342-S345 PolarHBondContact O-OG 3.45Å; T343-S345 VanDerWaalsContact C-N 3.3Å; T343-S345 PolarHBondContact O-N 3.06Å
346	H	93	Very high	92.2	Very high	101 Å²	101	58 Å²	58	47%	0.468	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-1.5	174.9	-66.2	74.1	0	0	0	113	A303 D342 T343 T344	A303-H346 HydrophobicContact CB-CB 3.62Å; D342-H346 PolarHBondContact O-ND1 3.18Å; T343-H346 PolarHBondContact O-N 2.98Å; T343-H346 VanDerWaalsContact O-N 3.14Å; T344-H346 PolarHBondContact O-N 3.14Å
347	V	93.4	Very high	92.6	Very high	10 Å²	10	62.7 Å²	62.7	6%	0.061	33%	0.328	C	S	.	.	S	Bend	trans	-89.4	130.1	179.1	-178.8	0	0	0	0	110.1	A303 F306 T344 V351	A303-V347 HydrophobicContact CB-CG2 3.82Å; F306-V347 HydrophobicContact CD1-CG1 4.1Å; F306-V347 HydrophobicContact CD1-CG2 3.65Å; F306-V347 HydrophobicContact CE1-CG1 4.19Å; F306-V347 HydrophobicContact CE1-CG2 4.09Å; F306-V347 HydrophobicContact CG-CG2 4.48Å; T344-V347 PolarHBondContact O-N 3.14Å; T344-V347 VanDerWaalsContact O-N 3.12Å; V347-V351 HydrophobicContact CG1-CB 4.01Å; V347-V351 HydrophobicContact CG1-CG1 3.73Å
348	P	94	Very high	92.7	Very high	58 Å²	58	62.9 Å²	62.9	38%	0.377	33%	0.329	S	S	.	.			trans	-58.3	145.4	177.1	-25.2	34.4	0	0	0	113.5	E350 V351 T352	P348-E350 WeakPolarHBondContact CB-OE2 3.41Å; P348-E350 PolarHBondContact O-N 3.19Å; P348-V351 HydrophobicContact CB-CB 4.35Å; P348-V351 HydrophobicContact CB-CG2 4.04Å; P348-V351 HydrophobicContact CG-CG2 4.22Å; P348-V351 WeakPolarHBondContact O-CB 3.42Å; P348-V351 PolarHBondContact O-N 2.88Å; P348-V351 VanDerWaalsContact O-N 3.11Å; P348-T352 PolarHBondContact O-N 3.12Å; P348-T352 PolarHBondContact O-OG1 3.12Å
349	N	92.8	Very high	92.8	Very high	129 Å²	129	61.8 Å²	61.8	69%	0.69	32%	0.32	S	S	*	.	H	α-helix	trans	-63.2	-31.8	-177.7	-72.7	-50.3	0	0	0	112.3	V351 T352 K353	N349-V351 VanDerWaalsContact C-N 3.33Å; N349-T352 PolarHBondContact O-N 3.23Å; N349-K353 WeakPolarHBondContact O-CB 3.28Å; N349-K353 PolarHBondContact O-N 2.96Å
350	E	94	Very high	92.9	Very high	132 Å²	132	63.8 Å²	63.8	62%	0.617	33%	0.334	S	S	*	.	H	α-helix	trans	-66.4	-37.9	177.9	-58.4	65.3	-140.9	0	0	110.8	P348 V354	P348-E350 WeakPolarHBondContact CB-OE2 3.41Å; P348-E350 PolarHBondContact O-N 3.19Å; E350-V354 WeakPolarHBondContact O-CG2 3.37Å; E350-V354 PolarHBondContact O-N 3.3Å
351	V	92.9	Very high	93.2	Very high	10 Å²	10	64.9 Å²	64.9	6%	0.061	34%	0.34	C	S	.	.	H	α-helix	trans	-71.7	-43.5	176.4	173.2	0	0	0	0	109.8	T307 I310 V347 P348 N349 K353 V354 L355	T307-V351 HydrophobicContact CG2-CG1 4.03Å; T307-V351 HydrophobicContact CG2-CG2 3.87Å; I310-V351 HydrophobicContact CB-CG1 4.02Å; I310-V351 HydrophobicContact CD1-CG1 3.47Å; I310-V351 VanDerWaalsContact CD1-CG1 3.47Å; I310-V351 HydrophobicContact CG1-CG1 4.33Å; I310-V351 HydrophobicContact CG2-CG1 3.96Å; V347-V351 HydrophobicContact CG1-CB 4.01Å; V347-V351 HydrophobicContact CG1-CG1 3.73Å; P348-V351 HydrophobicContact CB-CB 4.35Å; P348-V351 HydrophobicContact CB-CG2 4.04Å; P348-V351 HydrophobicContact CG-CG2 4.22Å; P348-V351 WeakPolarHBondContact O-CB 3.42Å; P348-V351 PolarHBondContact O-N 2.88Å; P348-V351 VanDerWaalsContact O-N 3.11Å; N349-V351 VanDerWaalsContact C-N 3.33Å; V351-K353 VanDerWaalsContact C-N 3.34Å; V351-K353 PolarHBondContact O-N 3.48Å; V351-V354 PolarHBondContact O-N 3.21Å; V351-L355 PolarHBondContact O-N 3.29Å; V351-L355 VanDerWaalsContact O-N 3.09Å
352	T	92.4	Very high	93.2	Very high	41 Å²	41	58.8 Å²	58.8	25%	0.252	31%	0.314	S	S	.	.	H	α-helix	trans	-62.6	-37.4	174	-59	0	0	0	0	112.2	P348 N349 L355 N356	P348-T352 PolarHBondContact O-N 3.12Å; P348-T352 PolarHBondContact O-OG1 3.12Å; N349-T352 PolarHBondContact O-N 3.23Å; T352-L355 PolarHBondContact O-N 2.86Å; T352-N356 PolarHBondContact O-N 3.26Å; T352-N356 VanDerWaalsContact O-N 3.1Å; T352-N356 PolarHBondContact O-ND2 3.25Å
353	K	95.4	Very high	93.2	Very high	127 Å²	127	55.9 Å²	55.9	55%	0.552	30%	0.3	S	S	*	.	H	α-helix	trans	-60.8	-46.4	174.2	-178	176	-179.5	-78.2	0	111.6	N349 V351 L355 N356 E357	N349-K353 WeakPolarHBondContact O-CB 3.28Å; N349-K353 PolarHBondContact O-N 2.96Å; V351-K353 VanDerWaalsContact C-N 3.34Å; V351-K353 PolarHBondContact O-N 3.48Å; K353-L355 PolarHBondContact O-N 2.95Å; K353-N356 WeakPolarHBondContact O-CB 3.5Å; K353-N356 PolarHBondContact O-N 3.05Å; K353-E357 IonicContact NZ-OE1 2.68Å; K353-E357 PolarHBondContact NZ-OE1 2.69Å; K353-E357 WeakPolarHBondContact O-CG 3.48Å; K353-E357 PolarHBondContact O-N 2.88Å
354	V	95.2	Very high	92.9	Very high	24 Å²	24	59.3 Å²	59.3	15%	0.145	32%	0.324	C	S	.	.	H	α-helix	trans	-62.5	-41.2	177.8	171.8	0	0	0	0	111.8	I310 K314 E350 V351 N356 E357 M358	I310-V354 HydrophobicContact CG2-CB 4.21Å; I310-V354 HydrophobicContact CG2-CG1 3.9Å; K314-V354 HydrophobicContact CD-CG1 4.39Å; K314-V354 HydrophobicContact CG-CG1 3.87Å; E350-V354 WeakPolarHBondContact O-CG2 3.37Å; E350-V354 PolarHBondContact O-N 3.3Å; V351-V354 PolarHBondContact O-N 3.21Å; V354-N356 VanDerWaalsContact C-N 3.32Å; V354-N356 PolarHBondContact O-N 3.35Å; V354-E357 PolarHBondContact O-N 2.99Å; V354-M358 HydrophobicContact CG1-CE 3.46Å; V354-M358 VanDerWaalsContact CG1-CE 3.46Å; V354-M358 HydrophobicContact CG1-SD 4Å; V354-M358 WeakPolarHBondContact O-CG 3.28Å; V354-M358 PolarHBondContact O-N 3.21Å
355	L	93.4	Very high	92.5	Very high	20 Å²	20	60.4 Å²	60.4	11%	0.105	33%	0.333	C	S	.	.	H	α-helix	trans	-58.8	-45.4	174.4	180	62.1	0	0	0	110.8	F306 I310 V329 L332 V351 T352 K353 E357 M358 T359	F306-L355 HydrophobicContact CE1-CD2 4.19Å; F306-L355 HydrophobicContact CZ-CD2 3.69Å; I310-L355 HydrophobicContact CD1-CB 3.96Å; I310-L355 HydrophobicContact CD1-CD2 4.18Å; I310-L355 HydrophobicContact CD1-CG 4.48Å; I310-L355 HydrophobicContact CG1-CB 4.37Å; I310-L355 HydrophobicContact CG1-CD1 4.44Å; V329-L355 HydrophobicContact CG1-CD1 4.24Å; L332-L355 HydrophobicContact CB-CD1 4.35Å; L332-L355 HydrophobicContact CD1-CD1 4.27Å; V351-L355 PolarHBondContact O-N 3.29Å; V351-L355 VanDerWaalsContact O-N 3.09Å; T352-L355 PolarHBondContact O-N 2.86Å; K353-L355 PolarHBondContact O-N 2.95Å; L355-E357 VanDerWaalsContact C-N 3.34Å; L355-E357 PolarHBondContact O-N 2.99Å; L355-M358 PolarHBondContact O-N 3.46Å; L355-T359 WeakPolarHBondContact O-CB 3.26Å; L355-T359 PolarHBondContact O-N 3.42Å; L355-T359 PolarHBondContact O-OG1 2.94Å
356	N	94.1	Very high	92.1	Very high	99 Å²	99	66.1 Å²	66.1	53%	0.529	34%	0.341	S	S	.	.	H	α-helix	trans	-61.7	-38	176.6	-74.1	-69	0	0	0	113.1	T352 K353 V354 T359 D360	T352-N356 PolarHBondContact O-N 3.26Å; T352-N356 VanDerWaalsContact O-N 3.1Å; T352-N356 PolarHBondContact O-ND2 3.25Å; K353-N356 WeakPolarHBondContact O-CB 3.5Å; K353-N356 PolarHBondContact O-N 3.05Å; V354-N356 VanDerWaalsContact C-N 3.32Å; V354-N356 PolarHBondContact O-N 3.35Å; N356-T359 PolarHBondContact O-N 3.31Å; N356-D360 PolarHBondContact O-N 2.88Å
357	E	95.8	Very high	91.8	Very high	98 Å²	98	64.1 Å²	64.1	46%	0.458	33%	0.334	S	S	.	.	H	α-helix	trans	-63.8	-40.1	175.4	-71.1	167.2	176.2	0	0	112.1	K353 V354 L355 L361	K353-E357 IonicContact NZ-OE1 2.68Å; K353-E357 PolarHBondContact NZ-OE1 2.69Å; K353-E357 WeakPolarHBondContact O-CG 3.48Å; K353-E357 PolarHBondContact O-N 2.88Å; V354-E357 PolarHBondContact O-N 2.99Å; L355-E357 VanDerWaalsContact C-N 3.34Å; L355-E357 PolarHBondContact O-N 2.99Å; E357-L361 WeakPolarHBondContact O-CB 3.44Å; E357-L361 PolarHBondContact O-N 3.11Å
358	M	94.6	Very high	91.8	Very high	9 Å²	9	65.6 Å²	65.6	4%	0.044	34%	0.338	C	S	.	.	H	α-helix	trans	-70.4	-39.3	174.9	-66.8	168	177	0	0	112.4	A313 K314 L325 V329 V354 L355 D360 L361 L362	A313-M358 VanDerWaalsContact C-CE 3.43Å; A313-M358 HydrophobicContact CB-CE 3.94Å; A313-M358 HydrophobicContact CB-SD 3.51Å; A313-M358 VanDerWaalsContact CB-SD 3.51Å; K314-M358 VanDerWaalsContact CA-CE 3.49Å; K314-M358 HydrophobicContact CB-CE 4.16Å; K314-M358 HydrophobicContact CG-CE 3.69Å; K314-M358 VanDerWaalsContact N-CE 3.28Å; L325-M358 HydrophobicContact CD1-SD 4.41Å; V329-M358 HydrophobicContact CG2-CB 3.93Å; V329-M358 HydrophobicContact CG2-SD 4.3Å; V354-M358 HydrophobicContact CG1-CE 3.46Å; V354-M358 VanDerWaalsContact CG1-CE 3.46Å; V354-M358 HydrophobicContact CG1-SD 4Å; V354-M358 WeakPolarHBondContact O-CG 3.28Å; V354-M358 PolarHBondContact O-N 3.21Å; L355-M358 PolarHBondContact O-N 3.46Å; M358-D360 VanDerWaalsContact C-N 3.31Å; M358-D360 PolarHBondContact O-N 2.96Å; M358-L361 PolarHBondContact O-N 3.42Å; M358-L362 WeakPolarHBondContact O-CB 3.43Å; M358-L362 WeakPolarHBondContact O-CG 3.39Å; M358-L362 PolarHBondContact O-N 3.01Å
359	T	92.7	Very high	91.7	Very high	31 Å²	31	64.4 Å²	64.4	19%	0.19	33%	0.329	C	S	.	.	H	α-helix	trans	-63.3	-36.5	175.6	-60.1	0	0	0	0	111.6	L355 N356 S363 V481	L355-T359 WeakPolarHBondContact O-CB 3.26Å; L355-T359 PolarHBondContact O-N 3.42Å; L355-T359 PolarHBondContact O-OG1 2.94Å; N356-T359 PolarHBondContact O-N 3.31Å; T359-S363 PolarHBondContact O-N 3.38Å; T359-S363 VanDerWaalsContact O-N 3.15Å; T359-V481 HydrophobicContact CG2-CB 4.49Å; T359-V481 HydrophobicContact CG2-CG2 3.61Å; T359-V481 WeakPolarHBondContact O-CG2 3.49Å
360	D	93.7	Very high	91.8	Very high	87 Å²	87	61.1 Å²	61.1	47%	0.465	31%	0.311	S	S	.	.	H	α-helix	trans	-74	-39.9	175	-160.7	78.4	0	0	0	112.2	N356 M358 L362 S363 N370	N356-D360 PolarHBondContact O-N 2.88Å; M358-D360 VanDerWaalsContact C-N 3.31Å; M358-D360 PolarHBondContact O-N 2.96Å; D360-L362 VanDerWaalsContact C-N 3.34Å; D360-L362 PolarHBondContact O-N 3.23Å; D360-S363 WeakPolarHBondContact O-CB 3.42Å; D360-S363 PolarHBondContact O-N 2.82Å; D360-N370 PolarHBondContact O-ND2 3.14Å; D360-N370 PolarHBondContact OD2-ND2 3.48Å
361	L	93.9	Very high	91.8	Very high	24 Å²	24	54.8 Å²	54.8	13%	0.126	28%	0.282	C	S	.	.	H	α-helix	trans	-58	-44	173.2	173.1	63.8	0	0	0	112.5	H317 L325 E357 M358 S363 N370 Y371 A374	H317-L361 WeakPolarHBondContact NE2-CD2 3.47Å; L325-L361 HydrophobicContact CD2-CD2 4.39Å; E357-L361 WeakPolarHBondContact O-CB 3.44Å; E357-L361 PolarHBondContact O-N 3.11Å; M358-L361 PolarHBondContact O-N 3.42Å; L361-S363 VanDerWaalsContact C-N 3.31Å; L361-N370 WeakPolarHBondContact O-CB 3.29Å; L361-Y371 PolarHBondContact O-N 2.86Å; L361-Y371 VanDerWaalsContact O-N 3.09Å; L361-A374 HydrophobicContact CD1-CB 3.76Å
362	L	92	Very high	91.9	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	2.9	-179.5	-66.5	172.9	0	0	0	113.9	L325 M326 V329 M358 D360 S364 Y368 I385 V481	L325-L362 HydrophobicContact CG-CD1 4.19Å; M326-L362 HydrophobicContact CB-CD2 4.27Å; M326-L362 HydrophobicContact SD-CB 3.91Å; M326-L362 HydrophobicContact SD-CD1 3.98Å; M326-L362 HydrophobicContact SD-CD2 3.99Å; M326-L362 HydrophobicContact SD-CG 4.2Å; V329-L362 HydrophobicContact CB-CD1 3.62Å; V329-L362 HydrophobicContact CG1-CD1 3.84Å; V329-L362 HydrophobicContact CG2-CD1 3.83Å; M358-L362 WeakPolarHBondContact O-CB 3.43Å; M358-L362 WeakPolarHBondContact O-CG 3.39Å; M358-L362 PolarHBondContact O-N 3.01Å; D360-L362 VanDerWaalsContact C-N 3.34Å; D360-L362 PolarHBondContact O-N 3.23Å; L362-S364 PolarHBondContact O-N 3.02Å; L362-Y368 WeakPolarHBondContact O-CD1 3.41Å; L362-Y368 WeakPolarHBondContact O-CE1 3.33Å; L362-I385 HydrophobicContact CD2-CD1 3.65Å; L362-V481 HydrophobicContact CB-CG1 4.3Å; L362-V481 HydrophobicContact CB-CG2 4.44Å
363	S	89.5	Confident	92.1	Very high	22 Å²	22	59.2 Å²	59.2	15%	0.154	30%	0.297	C	S	.	.			trans	-60.2	134.4	-175.3	-177.9	0	0	0	0	112.2	T359 D360 L361 C365 Y368	T359-S363 PolarHBondContact O-N 3.38Å; T359-S363 VanDerWaalsContact O-N 3.15Å; D360-S363 WeakPolarHBondContact O-CB 3.42Å; D360-S363 PolarHBondContact O-N 2.82Å; L361-S363 VanDerWaalsContact C-N 3.31Å; S363-C365 PolarHBondContact O-N 2.92Å; S363-C365 WeakPolarHBondContact OG-CB 3.39Å; S363-C365 PolarHBondContact OG-N 3.08Å; S363-C365 PolarHBondContact OG-SG 2.75Å; S363-Y368 WeakPolarHBondContact O-CA 3.4Å; S363-Y368 WeakPolarHBondContact O-CD1 3.27Å
364	S	85.1	Confident	92	Very high	75 Å²	75	54.1 Å²	54.1	52%	0.524	28%	0.278	S	S	.	.			trans	-69.5	-8.6	175.2	60.1	0	0	0	0	113.6	L362 R366 N367 Y368	L362-S364 PolarHBondContact O-N 3.02Å; S364-R366 PolarHBondContact O-N 2.84Å; S364-N367 PolarHBondContact O-N 3.19Å; S364-N367 VanDerWaalsContact O-N 3.11Å; S364-Y368 PolarHBondContact O-N 2.76Å
365	C	81.4	Confident	92	Very high	81 Å²	81	53.2 Å²	53.2	55%	0.547	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-49.1	135.4	175.2	-71.3	0	0	0	0	112.1	S363 N367 Y368 D369	S363-C365 PolarHBondContact O-N 2.92Å; S363-C365 WeakPolarHBondContact OG-CB 3.39Å; S363-C365 PolarHBondContact OG-N 3.08Å; S363-C365 PolarHBondContact OG-SG 2.75Å; C365-N367 PolarHBondContact O-N 2.84Å; C365-Y368 PolarHBondContact O-N 2.91Å; C365-D369 PolarHBondContact O-N 3.06Å
366	R	84.6	Confident	92	Very high	210 Å²	210	57.3 Å²	57.3	79%	0.792	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	53.6	32.9	-179.1	-54.9	179.2	71.4	-146.9	-7	113.7	S364 D369	S364-R366 PolarHBondContact O-N 2.84Å; R366-D369 HydrophobicContact CB-CB 3.85Å; R366-D369 IonicContact CZ-OD2 2.89Å; R366-D369 VanDerWaalsContact CZ-OD2 3.28Å; R366-D369 IonicContact NE-OD2 2.64Å; R366-D369 IonicContact NH1-OD2 2.63Å; R366-D369 PolarHBondContact NH1-OD2 2.94Å; R366-D369 IonicContact NH2-OD2 3.65Å
367	N	88	Confident	92	Very high	59 Å²	59	60 Å²	60	32%	0.316	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	61.1	48.9	-176.3	-162.3	49.4	0	0	0	113.3	S364 C365 R372 K391	S364-N367 PolarHBondContact O-N 3.19Å; S364-N367 VanDerWaalsContact O-N 3.11Å; C365-N367 PolarHBondContact O-N 2.84Å; N367-R372 PolarHBondContact ND2-NH2 2.77Å; N367-R372 PolarHBondContact O-NE 3.33Å; N367-K391 PolarHBondContact OD1-NZ 3.18Å
368	Y	92.5	Very high	91.8	Very high	41 Å²	41	56.1 Å²	56.1	16%	0.161	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.8	38.5	178.2	-56	-85.7	0	0	0	114.6	M326 L362 S363 S364 C365 N370 Y371 R372 V388	M326-Y368 HydrophobicContact CE-CE1 4Å; L362-Y368 WeakPolarHBondContact O-CD1 3.41Å; L362-Y368 WeakPolarHBondContact O-CE1 3.33Å; S363-Y368 WeakPolarHBondContact O-CA 3.4Å; S363-Y368 WeakPolarHBondContact O-CD1 3.27Å; S364-Y368 PolarHBondContact O-N 2.76Å; C365-Y368 PolarHBondContact O-N 2.91Å; Y368-N370 PolarHBondContact O-N 3.13Å; Y368-Y371 PolarHBondContact O-N 3.49Å; Y368-R372 WeakPolarHBondContact O-CB 3.24Å; Y368-R372 VanDerWaalsContact O-CG 3.28Å; Y368-R372 WeakPolarHBondContact O-CG 3.49Å; Y368-R372 PolarHBondContact O-N 3.12Å; Y368-V388 HydrophobicContact CD1-CG2 4.38Å; Y368-V388 HydrophobicContact CD2-CG1 4.05Å; Y368-V388 HydrophobicContact CD2-CG2 3.73Å; Y368-V388 HydrophobicContact CE1-CG2 4.48Å; Y368-V388 HydrophobicContact CE2-CG2 3.85Å; Y368-V388 HydrophobicContact CG-CG1 4.47Å; Y368-V388 HydrophobicContact CG-CG2 4.02Å
369	D	91.8	Very high	91.5	Very high	34 Å²	34	62 Å²	62	18%	0.182	32%	0.32	C	S	.	.	H	α-helix	trans	-55.1	-47.4	-178.2	-175.5	19.1	0	0	0	112.6	C365 R366 Y371 R372 Q373	C365-D369 PolarHBondContact O-N 3.06Å; R366-D369 HydrophobicContact CB-CB 3.85Å; R366-D369 IonicContact CZ-OD2 2.89Å; R366-D369 VanDerWaalsContact CZ-OD2 3.28Å; R366-D369 IonicContact NE-OD2 2.64Å; R366-D369 IonicContact NH1-OD2 2.63Å; R366-D369 PolarHBondContact NH1-OD2 2.94Å; R366-D369 IonicContact NH2-OD2 3.65Å; D369-Y371 PolarHBondContact O-N 3.05Å; D369-R372 PolarHBondContact O-N 3.28Å; D369-Q373 VanDerWaalsContact CG-NE2 3.34Å; D369-Q373 WeakPolarHBondContact O-CB 3.19Å; D369-Q373 WeakPolarHBondContact O-CG 3.43Å; D369-Q373 PolarHBondContact O-N 3.47Å; D369-Q373 PolarHBondContact OD1-NE2 3.05Å; D369-Q373 PolarHBondContact OD2-NE2 3.23Å
370	N	93.9	Very high	91.2	Very high	59 Å²	59	62.7 Å²	62.7	32%	0.316	33%	0.334	S	S	.	.	H	α-helix	trans	-57.4	-51.5	177.8	-73.1	-7.3	0	0	0	112.3	D360 L361 Y368 Q373 A374	D360-N370 PolarHBondContact O-ND2 3.14Å; D360-N370 PolarHBondContact OD2-ND2 3.48Å; L361-N370 WeakPolarHBondContact O-CB 3.29Å; Y368-N370 PolarHBondContact O-N 3.13Å; N370-Q373 PolarHBondContact O-N 2.77Å; N370-A374 PolarHBondContact O-N 2.84Å
371	Y	95.6	Very high	91	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-57.9	-49.3	175	155.8	-107.9	0	0	0	111.5	Y322 L361 Y368 D369 Q373 A374 Y375 P384 I385 V388 H389	Y322-Y371 AromaticContact CD1-CD2 3.94Å; Y322-Y371 HydrophobicContact CD1-CD2 3.94Å; Y322-Y371 HydrophobicContact CD1-CE2 4.11Å; Y322-Y371 HydrophobicContact CD2-CE2 4.08Å; Y322-Y371 HydrophobicContact CG-CD2 4.01Å; Y322-Y371 AromaticContact CG-CE2 3.68Å; Y322-Y371 HydrophobicContact CG-CE2 3.68Å; L361-Y371 PolarHBondContact O-N 2.86Å; L361-Y371 VanDerWaalsContact O-N 3.09Å; Y368-Y371 PolarHBondContact O-N 3.49Å; D369-Y371 PolarHBondContact O-N 3.05Å; Y371-Q373 VanDerWaalsContact C-N 3.32Å; Y371-Q373 PolarHBondContact O-N 3.44Å; Y371-A374 PolarHBondContact O-N 3.25Å; Y371-A374 VanDerWaalsContact O-N 3.11Å; Y371-Y375 HydrophobicContact CE2-CD2 4.04Å; Y371-Y375 HydrophobicContact CE2-CG 4.12Å; Y371-Y375 VanDerWaalsContact O-CB 3.26Å; Y371-Y375 WeakPolarHBondContact O-CB 3.48Å; Y371-Y375 PolarHBondContact O-N 3.14Å; Y371-P384 WeakPolarHBondContact OH-CA 3.45Å; Y371-I385 HydrophobicContact CD1-CD1 4.08Å; Y371-I385 HydrophobicContact CD2-CD1 3.59Å; Y371-I385 HydrophobicContact CD2-CG1 4.07Å; Y371-I385 HydrophobicContact CE1-CB 4.35Å; Y371-I385 HydrophobicContact CE1-CD1 4.22Å; Y371-I385 HydrophobicContact CE1-CG1 4.33Å; Y371-I385 HydrophobicContact CE2-CB 4.43Å; Y371-I385 HydrophobicContact CE2-CD1 3.75Å; Y371-I385 HydrophobicContact CE2-CG1 3.67Å; Y371-I385 HydrophobicContact CG-CD1 3.77Å; Y371-I385 PolarHBondContact OH-N 3.13Å; Y371-V388 HydrophobicContact CD1-CG1 4.49Å; Y371-V388 HydrophobicContact CE1-CB 4.33Å; Y371-V388 HydrophobicContact CE1-CG1 4.16Å; Y371-V388 HydrophobicContact CE1-CG2 4.45Å; Y371-H389 PolarHBondContact OH-NE2 3.09Å
372	R	95.1	Very high	91	Very high	57 Å²	57	60.5 Å²	60.5	22%	0.215	32%	0.32	C	S	.	.	H	α-helix	trans	-60.7	-40.9	-179.2	-70.4	172.9	-170.7	-84.8	9.2	111.7	N367 Y368 D369 N376 V388 D392	N367-R372 PolarHBondContact ND2-NH2 2.77Å; N367-R372 PolarHBondContact O-NE 3.33Å; Y368-R372 WeakPolarHBondContact O-CB 3.24Å; Y368-R372 VanDerWaalsContact O-CG 3.28Å; Y368-R372 WeakPolarHBondContact O-CG 3.49Å; Y368-R372 PolarHBondContact O-N 3.12Å; D369-R372 PolarHBondContact O-N 3.28Å; R372-N376 VanDerWaalsContact O-CB 3.22Å; R372-N376 WeakPolarHBondContact O-CB 3.41Å; R372-N376 PolarHBondContact O-N 3.34Å; R372-N376 PolarHBondContact O-ND2 3.3Å; R372-V388 VanDerWaalsContact NH2-CG1 3.32Å; R372-D392 IonicContact CZ-OD1 3.27Å; R372-D392 IonicContact CZ-OD2 3.01Å; R372-D392 VanDerWaalsContact CZ-OD2 3.29Å; R372-D392 IonicContact NH1-OD1 2.66Å; R372-D392 IonicContact NH1-OD2 3.03Å; R372-D392 PolarHBondContact NH1-OD2 3.13Å; R372-D392 VanDerWaalsContact NH2-CG 3.28Å; R372-D392 IonicContact NH2-OD1 3.56Å; R372-D392 PolarHBondContact NH2-OD1 2.68Å; R372-D392 IonicContact NH2-OD2 2.74Å; R372-D392 PolarHBondContact NH2-OD2 2.87Å
373	Q	94.9	Very high	91.1	Very high	87 Å²	87	60.5 Å²	60.5	41%	0.407	32%	0.32	S	S	.	.	H	α-helix	trans	-65.2	-36.6	175.3	-73.3	-176.6	43.3	0	0	113	D369 N370 Y371 K377	D369-Q373 VanDerWaalsContact CG-NE2 3.34Å; D369-Q373 WeakPolarHBondContact O-CB 3.19Å; D369-Q373 WeakPolarHBondContact O-CG 3.43Å; D369-Q373 PolarHBondContact O-N 3.47Å; D369-Q373 PolarHBondContact OD1-NE2 3.05Å; D369-Q373 PolarHBondContact OD2-NE2 3.23Å; N370-Q373 PolarHBondContact O-N 2.77Å; Y371-Q373 VanDerWaalsContact C-N 3.32Å; Y371-Q373 PolarHBondContact O-N 3.44Å; Q373-K377 WeakPolarHBondContact O-CD 3.45Å; Q373-K377 VanDerWaalsContact O-CE 3.3Å; Q373-K377 WeakPolarHBondContact O-CE 3.48Å; Q373-K377 WeakPolarHBondContact O-CG 3.49Å
374	A	95	Very high	91.3	Very high	20 Å²	20	59.5 Å²	59.5	17%	0.165	31%	0.313	C	S	.	.	H	α-helix	trans	-70.3	-51.9	174.3	0	0	0	0	0	111.2	Y322 L361 N370 Y371 N376 K377 V378	Y322-A374 HydrophobicContact CE1-CB 4.48Å; L361-A374 HydrophobicContact CD1-CB 3.76Å; N370-A374 PolarHBondContact O-N 2.84Å; Y371-A374 PolarHBondContact O-N 3.25Å; Y371-A374 VanDerWaalsContact O-N 3.11Å; A374-N376 VanDerWaalsContact C-N 3.27Å; A374-N376 PolarHBondContact O-N 2.64Å; A374-K377 WeakPolarHBondContact O-CB 3.47Å; A374-K377 PolarHBondContact O-N 3.23Å; A374-V378 PolarHBondContact O-N 3.2Å
375	Y	94.8	Very high	91.8	Very high	4 Å²	4	56.4 Å²	56.4	2%	0.016	29%	0.29	C	S	.	.	H	α-helix	trans	-56.6	-36.8	179.6	178	-94.8	0	0	0	113.3	Y322 Y371 V378 K382 P384 L427	Y322-Y375 HydrophobicContact CD2-CD2 4Å; Y322-Y375 HydrophobicContact CE2-CD2 4.14Å; Y371-Y375 HydrophobicContact CE2-CD2 4.04Å; Y371-Y375 HydrophobicContact CE2-CG 4.12Å; Y371-Y375 VanDerWaalsContact O-CB 3.26Å; Y371-Y375 WeakPolarHBondContact O-CB 3.48Å; Y371-Y375 PolarHBondContact O-N 3.14Å; Y375-V378 PolarHBondContact O-N 3.09Å; Y375-K382 HydrophobicContact CD2-CD 3.94Å; Y375-K382 HydrophobicContact CE2-CD 3.57Å; Y375-K382 HydrophobicContact CE2-CG 3.87Å; Y375-K382 VanDerWaalsContact CZ-CE 3.48Å; Y375-K382 PolarHBondContact O-NZ 2.8Å; Y375-P384 HydrophobicContact CE2-CB 3.75Å; Y375-L427 WeakPolarHBondContact OH-CD1 3.35Å
376	N	93.7	Very high	92.3	Very high	107 Å²	107	52.6 Å²	52.6	57%	0.572	26%	0.264	S	S	*	.	H	α-helix	trans	-76	-20.7	177.3	-74.5	-22.2	0	0	0	114.1	R372 A374	R372-N376 VanDerWaalsContact O-CB 3.22Å; R372-N376 WeakPolarHBondContact O-CB 3.41Å; R372-N376 PolarHBondContact O-N 3.34Å; R372-N376 PolarHBondContact O-ND2 3.3Å; A374-N376 VanDerWaalsContact C-N 3.27Å; A374-N376 PolarHBondContact O-N 2.64Å
377	K	93.6	Very high	92.5	Very high	155 Å²	155	43.4 Å²	43.4	67%	0.674	24%	0.235	S	C	*	.	H	α-helix	trans	-80.1	-24.6	173.6	-69.8	162.7	-168.5	167.2	0	112.2	Q373 A374	Q373-K377 WeakPolarHBondContact O-CD 3.45Å; Q373-K377 VanDerWaalsContact O-CE 3.3Å; Q373-K377 WeakPolarHBondContact O-CE 3.48Å; Q373-K377 WeakPolarHBondContact O-CG 3.49Å; A374-K377 WeakPolarHBondContact O-CB 3.47Å; A374-K377 PolarHBondContact O-N 3.23Å
378	V	92.1	Very high	92.6	Very high	17 Å²	17	40.8 Å²	40.8	10%	0.103	22%	0.221	C	C	.	.			trans	-79.1	127.2	-179.8	177	0	0	0	0	111.8	H320 A374 Y375 K382	H320-V378 HydrophobicContact CB-CG1 3.96Å; H320-V378 HydrophobicContact CB-CG2 4.49Å; H320-V378 WeakPolarHBondContact CD2-CG1 3.23Å; A374-V378 PolarHBondContact O-N 3.2Å; Y375-V378 PolarHBondContact O-N 3.09Å; V378-K382 HydrophobicContact CB-CD 4.05Å; V378-K382 HydrophobicContact CG1-CB 4.06Å; V378-K382 HydrophobicContact CG1-CD 3.87Å; V378-K382 PolarHBondContact O-NZ 2.73Å
379	T	86.8	Confident	92.7	Very high	131 Å²	131	39.4 Å²	39.4	80%	0.804	22%	0.216	S	C	*	.			trans	-110.9	148.1	170.3	54.5	0	0	0	0	110.8
380	G	87.3	Confident	92.7	Very high	47 Å²	47	37.9 Å²	37.9	49%	0.485	21%	0.208	S	C	.	.	S	Bend	trans	89.1	-149.6	-176.1	0	0	0	0	0	112.4	K382 I430	G380-K382 PolarHBondContact O-N 2.99Å; G380-I430 WeakPolarHBondContact O-CD1 3.41Å
381	F	90.2	Very high	92.5	Very high	45 Å²	45	40.3 Å²	40.3	20%	0.197	22%	0.216	C	C	.	.	S	Bend	trans	-63.7	128.1	-177.3	-178.9	-91.7	0	0	0	111.7	T245 F249 I383 I430 L434	T245-F381 HydrophobicContact CG2-CE1 4Å; T245-F381 HydrophobicContact CG2-CZ 4.05Å; F249-F381 HydrophobicContact CD1-CE2 4.29Å; F249-F381 AromaticContact CD2-CE2 3.71Å; F249-F381 HydrophobicContact CD2-CE2 3.71Å; F249-F381 HydrophobicContact CD2-CZ 4.09Å; F249-F381 HydrophobicContact CE1-CE2 4.26Å; F249-F381 HydrophobicContact CE2-CD2 4.44Å; F249-F381 AromaticContact CE2-CE2 3.68Å; F249-F381 HydrophobicContact CE2-CE2 3.68Å; F249-F381 HydrophobicContact CE2-CZ 4.49Å; F249-F381 HydrophobicContact CG-CE2 4.03Å; F249-F381 HydrophobicContact CG-CZ 4.25Å; F249-F381 AromaticContact CZ-CE2 3.96Å; F249-F381 HydrophobicContact CZ-CE2 3.96Å; F381-I383 HydrophobicContact CE1-CG1 4.29Å; F381-I383 HydrophobicContact CZ-CD1 4.13Å; F381-I383 HydrophobicContact CZ-CG1 4.03Å; F381-I430 HydrophobicContact CB-CG2 4.14Å; F381-I430 HydrophobicContact CD2-CG2 4.49Å; F381-L434 HydrophobicContact CZ-CD1 4.09Å
382	K	92.4	Very high	92.3	Very high	19 Å²	19	41.3 Å²	41.3	8%	0.083	22%	0.221	C	C	.	.			trans	-159.9	150.3	173	61	-170.7	-177.7	-178.1	0	110	H320 Y375 V378 G380 L427	H320-K382 HydrophobicContact CB-CB 3.86Å; H320-K382 WeakPolarHBondContact O-CA 3.44Å; Y375-K382 HydrophobicContact CD2-CD 3.94Å; Y375-K382 HydrophobicContact CE2-CD 3.57Å; Y375-K382 HydrophobicContact CE2-CG 3.87Å; Y375-K382 VanDerWaalsContact CZ-CE 3.48Å; Y375-K382 PolarHBondContact O-NZ 2.8Å; V378-K382 HydrophobicContact CB-CD 4.05Å; V378-K382 HydrophobicContact CG1-CB 4.06Å; V378-K382 HydrophobicContact CG1-CD 3.87Å; V378-K382 PolarHBondContact O-NZ 2.73Å; G380-K382 PolarHBondContact O-N 2.99Å; K382-L427 HydrophobicContact CG-CD2 3.88Å
383	I	93.7	Very high	92.2	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-113.6	118.8	174	-49.7	-173.7	0	0	0	108.5	T245 E248 F249 H320 N321 Y322 N323 F381	T245-I383 HydrophobicContact CG2-CD1 3.86Å; E248-I383 HydrophobicContact CB-CD1 4.42Å; E248-I383 HydrophobicContact CG-CD1 4.3Å; E248-I383 HydrophobicContact CG-CG2 4.26Å; F249-I383 HydrophobicContact CB-CD1 3.87Å; F249-I383 HydrophobicContact CD2-CD1 4.27Å; F249-I383 HydrophobicContact CD2-CG1 4.42Å; H320-I383 PolarHBondContact O-N 2.87Å; N321-I383 HydrophobicContact CB-CB 4.48Å; N321-I383 HydrophobicContact CB-CD1 4.31Å; N321-I383 HydrophobicContact CB-CG1 4.41Å; Y322-I383 WeakPolarHBondContact CB-O 3.26Å; Y322-I383 PolarHBondContact N-O 2.94Å; N323-I383 HydrophobicContact CB-CG2 3.99Å; F381-I383 HydrophobicContact CE1-CG1 4.29Å; F381-I383 HydrophobicContact CZ-CD1 4.13Å; F381-I383 HydrophobicContact CZ-CG1 4.03Å
384	P	95.2	Very high	92	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.006	20%	0.197	C	C	.	.			trans	-73	154.2	-179.6	29.9	-33.3	0	0	0	111.7	F252 N323 Y371 Y375 L386 L424 L427	F252-P384 HydrophobicContact CE2-CG 4.34Å; F252-P384 HydrophobicContact CZ-CG 4.21Å; N323-P384 WeakPolarHBondContact CB-O 3.18Å; Y371-P384 WeakPolarHBondContact OH-CA 3.45Å; Y375-P384 HydrophobicContact CE2-CB 3.75Å; P384-L386 PolarHBondContact O-N 2.93Å; P384-L424 HydrophobicContact CB-CD2 4.43Å; P384-L424 HydrophobicContact CG-CD2 3.83Å; P384-L427 HydrophobicContact CG-CD1 3.98Å
385	I	94.8	Very high	91.9	Very high	9 Å²	9	37.1 Å²	37.1	5%	0.046	21%	0.207	C	C	.	.			trans	-71.2	98.7	169	-53.7	174.4	0	0	0	107.9	N323 M326 L362 Y371 G387 V388 H389	N323-I385 WeakPolarHBondContact OD1-CA 3.32Å; M326-I385 HydrophobicContact CB-CD1 4.31Å; M326-I385 HydrophobicContact CB-CG1 4.42Å; M326-I385 HydrophobicContact CB-CG2 4.33Å; M326-I385 HydrophobicContact CG-CG2 4.17Å; L362-I385 HydrophobicContact CD2-CD1 3.65Å; Y371-I385 HydrophobicContact CD1-CD1 4.08Å; Y371-I385 HydrophobicContact CD2-CD1 3.59Å; Y371-I385 HydrophobicContact CD2-CG1 4.07Å; Y371-I385 HydrophobicContact CE1-CB 4.35Å; Y371-I385 HydrophobicContact CE1-CD1 4.22Å; Y371-I385 HydrophobicContact CE1-CG1 4.33Å; Y371-I385 HydrophobicContact CE2-CB 4.43Å; Y371-I385 HydrophobicContact CE2-CD1 3.75Å; Y371-I385 HydrophobicContact CE2-CG1 3.67Å; Y371-I385 HydrophobicContact CG-CD1 3.77Å; Y371-I385 PolarHBondContact OH-N 3.13Å; I385-G387 VanDerWaalsContact C-N 3.32Å; I385-G387 PolarHBondContact O-N 2.81Å; I385-V388 HydrophobicContact CB-CB 4.44Å; I385-V388 HydrophobicContact CB-CG2 3.92Å; I385-V388 HydrophobicContact CG2-CG2 3.78Å; I385-V388 WeakPolarHBondContact O-CB 3.41Å; I385-V388 PolarHBondContact O-N 3.33Å; I385-H389 PolarHBondContact O-CD2 3.29Å
386	L	91.9	Very high	91.8	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-57.5	-43.8	-164.5	-175.7	60.9	0	0	0	112.3	F252 I255 Y260 L275 N323 P384 V388 H389 L390	F252-L386 HydrophobicContact CE2-CD1 4.35Å; I255-L386 HydrophobicContact CD1-CD2 3.59Å; Y260-L386 HydrophobicContact CE1-CD1 4.1Å; L275-L386 HydrophobicContact CD1-CD2 3.88Å; N323-L386 PolarHBondContact OD1-N 3.07Å; P384-L386 PolarHBondContact O-N 2.93Å; L386-V388 PolarHBondContact O-N 3.42Å; L386-H389 PolarHBondContact O-N 3.27Å; L386-L390 HydrophobicContact CD1-CG 4.33Å; L386-L390 HydrophobicContact CD2-CD1 4.49Å; L386-L390 HydrophobicContact CG-CD1 4Å; L386-L390 HydrophobicContact CG-CG 4.11Å; L386-L390 WeakPolarHBondContact O-CG 3.47Å; L386-L390 PolarHBondContact O-N 2.63Å
387	G	89.1	Confident	91.7	Very high	17 Å²	17	35.1 Å²	35.1	18%	0.175	20%	0.198	C	C	.	.	H	α-helix	trans	-58.3	-28.2	178	0	0	0	0	0	114.9	I385 K391	I385-G387 VanDerWaalsContact C-N 3.32Å; I385-G387 PolarHBondContact O-N 2.81Å; G387-K391 WeakPolarHBondContact O-CB 3.32Å; G387-K391 PolarHBondContact O-N 3.15Å; G387-K391 VanDerWaalsContact O-N 3.1Å
388	V	91.2	Very high	91.6	Very high	4 Å²	4	34.5 Å²	34.5	2%	0.024	20%	0.197	C	C	.	.	H	α-helix	trans	-70.5	-41.2	175.7	-179.9	0	0	0	0	110.6	Y368 Y371 R372 I385 L386 D392	Y368-V388 HydrophobicContact CD1-CG2 4.38Å; Y368-V388 HydrophobicContact CD2-CG1 4.05Å; Y368-V388 HydrophobicContact CD2-CG2 3.73Å; Y368-V388 HydrophobicContact CE1-CG2 4.48Å; Y368-V388 HydrophobicContact CE2-CG2 3.85Å; Y368-V388 HydrophobicContact CG-CG1 4.47Å; Y368-V388 HydrophobicContact CG-CG2 4.02Å; Y371-V388 HydrophobicContact CD1-CG1 4.49Å; Y371-V388 HydrophobicContact CE1-CB 4.33Å; Y371-V388 HydrophobicContact CE1-CG1 4.16Å; Y371-V388 HydrophobicContact CE1-CG2 4.45Å; R372-V388 VanDerWaalsContact NH2-CG1 3.32Å; I385-V388 HydrophobicContact CB-CB 4.44Å; I385-V388 HydrophobicContact CB-CG2 3.92Å; I385-V388 HydrophobicContact CG2-CG2 3.78Å; I385-V388 WeakPolarHBondContact O-CB 3.41Å; I385-V388 PolarHBondContact O-N 3.33Å; L386-V388 PolarHBondContact O-N 3.42Å; V388-D392 VanDerWaalsContact O-CG 3.27Å; V388-D392 PolarHBondContact O-N 3.15Å; V388-D392 VanDerWaalsContact O-N 3.11Å
389	H	92.9	Very high	91.6	Very high	11 Å²	11	37.6 Å²	37.6	5%	0.051	23%	0.225	C	C	.	.	H	α-helix	trans	-75.5	-36.5	178.8	-70	-94.5	0	0	0	112.3	Y371 I385 L386 K391 D392 L393 H420 L424	Y371-H389 PolarHBondContact OH-NE2 3.09Å; I385-H389 PolarHBondContact O-CD2 3.29Å; L386-H389 PolarHBondContact O-N 3.27Å; H389-K391 VanDerWaalsContact C-N 3.34Å; H389-K391 PolarHBondContact O-N 3.14Å; H389-D392 PolarHBondContact O-N 3.17Å; H389-L393 WeakPolarHBondContact O-CG 3.26Å; H389-L393 PolarHBondContact O-N 2.99Å; H389-H420 WeakPolarHBondContact CB-NE2 3.4Å; H389-H420 AromaticContact CG-NE2 3.62Å; H389-H420 AromaticContact ND1-CE1 3.59Å; H389-H420 AromaticContact ND1-NE2 3Å; H389-H420 PolarHBondContact ND1-NE2 3.09Å; H389-L424 HydrophobicContact CB-CD1 4.16Å; H389-L424 HydrophobicContact CB-CD2 4.16Å
390	L	91.6	Very high	91.7	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-59.7	-44.2	171.1	-67.5	176.7	0	0	0	111.5	Y260 Y263 M269 L275 L386 D392 L393 I394 W485	Y260-L390 HydrophobicContact CD1-CD2 3.93Å; Y260-L390 HydrophobicContact CE1-CD2 3.9Å; Y263-L390 HydrophobicContact CD1-CD2 3.77Å; Y263-L390 HydrophobicContact CE1-CB 3.72Å; Y263-L390 HydrophobicContact CE1-CD2 3.72Å; Y263-L390 HydrophobicContact CE1-CG 4.18Å; M269-L390 HydrophobicContact SD-CD1 4.22Å; L275-L390 HydrophobicContact CD1-CD1 4.19Å; L386-L390 HydrophobicContact CD1-CG 4.33Å; L386-L390 HydrophobicContact CD2-CD1 4.49Å; L386-L390 HydrophobicContact CG-CD1 4Å; L386-L390 HydrophobicContact CG-CG 4.11Å; L386-L390 WeakPolarHBondContact O-CG 3.47Å; L386-L390 PolarHBondContact O-N 2.63Å; L390-D392 VanDerWaalsContact C-N 3.35Å; L390-D392 PolarHBondContact O-N 3.08Å; L390-L393 PolarHBondContact O-N 3.39Å; L390-I394 PolarHBondContact O-N 3.05Å; L390-I394 VanDerWaalsContact O-N 3.07Å; L390-W485 HydrophobicContact CD1-CE3 4.37Å; L390-W485 HydrophobicContact CD1-CZ3 3.78Å
391	K	90.4	Very high	91.9	Very high	111 Å²	111	35.5 Å²	35.5	48%	0.483	20%	0.201	S	C	.	.	H	α-helix	trans	-60.2	-43.1	173.7	-177.6	-170.5	174.9	-170	0	112	N367 G387 H389 I394 S395	N367-K391 PolarHBondContact OD1-NZ 3.18Å; G387-K391 WeakPolarHBondContact O-CB 3.32Å; G387-K391 PolarHBondContact O-N 3.15Å; G387-K391 VanDerWaalsContact O-N 3.1Å; H389-K391 VanDerWaalsContact C-N 3.34Å; H389-K391 PolarHBondContact O-N 3.14Å; K391-I394 PolarHBondContact O-N 3Å; K391-S395 PolarHBondContact O-N 3.41Å
392	D	92.1	Very high	91.8	Very high	20 Å²	20	36 Å²	36	11%	0.107	21%	0.206	C	C	.	.	H	α-helix	trans	-61.2	-45.3	176.8	-67.9	-15.9	0	0	0	110.9	R372 V388 H389 L390 I394 S395 V396 H420	R372-D392 IonicContact CZ-OD1 3.27Å; R372-D392 IonicContact CZ-OD2 3.01Å; R372-D392 VanDerWaalsContact CZ-OD2 3.29Å; R372-D392 IonicContact NH1-OD1 2.66Å; R372-D392 IonicContact NH1-OD2 3.03Å; R372-D392 PolarHBondContact NH1-OD2 3.13Å; R372-D392 VanDerWaalsContact NH2-CG 3.28Å; R372-D392 IonicContact NH2-OD1 3.56Å; R372-D392 PolarHBondContact NH2-OD1 2.68Å; R372-D392 IonicContact NH2-OD2 2.74Å; R372-D392 PolarHBondContact NH2-OD2 2.87Å; V388-D392 VanDerWaalsContact O-CG 3.27Å; V388-D392 PolarHBondContact O-N 3.15Å; V388-D392 VanDerWaalsContact O-N 3.11Å; H389-D392 PolarHBondContact O-N 3.17Å; L390-D392 VanDerWaalsContact C-N 3.35Å; L390-D392 PolarHBondContact O-N 3.08Å; D392-I394 PolarHBondContact O-N 2.68Å; D392-S395 PolarHBondContact O-N 3.36Å; D392-S395 PolarHBondContact O-OG 3.35Å; D392-V396 WeakPolarHBondContact O-CG2 3.48Å; D392-V396 PolarHBondContact O-N 2.8Å; D392-H420 IonicContact OD2-CE1 3.8Å
393	L	92.6	Very high	91.6	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-57.8	-44.6	176.2	-71	171.4	0	0	0	112.8	Y260 I264 H389 L390 V396 N397 L417 H420 I421	Y260-L393 HydrophobicContact CD1-CD1 3.99Å; I264-L393 HydrophobicContact CD1-CB 4.22Å; I264-L393 HydrophobicContact CD1-CD1 4.41Å; I264-L393 HydrophobicContact CD1-CD2 4.32Å; I264-L393 HydrophobicContact CG1-CB 4.22Å; H389-L393 WeakPolarHBondContact O-CG 3.26Å; H389-L393 PolarHBondContact O-N 2.99Å; L390-L393 PolarHBondContact O-N 3.39Å; L393-V396 PolarHBondContact O-N 3.18Å; L393-N397 WeakPolarHBondContact O-CB 3.32Å; L393-N397 PolarHBondContact O-N 3.46Å; L393-L417 HydrophobicContact CD2-CD2 3.97Å; L393-L417 WeakPolarHBondContact O-CD2 3.49Å; L393-H420 HydrophobicContact CD2-CB 3.8Å; L393-I421 HydrophobicContact CD1-CG1 4.12Å; L393-I421 HydrophobicContact CD2-CD1 4.49Å; L393-I421 HydrophobicContact CD2-CG1 3.8Å
394	I	91.8	Very high	91.2	Very high	21 Å²	21	41.5 Å²	41.5	11%	0.108	23%	0.232	C	C	.	.	H	α-helix	trans	-63.6	-45.2	175	-63.2	-60.1	0	0	0	110.8	Y263 L390 K391 D392 V396 N397 E398	Y263-I394 HydrophobicContact CD1-CD1 4.31Å; Y263-I394 HydrophobicContact CE1-CD1 3.79Å; Y263-I394 HydrophobicContact CE1-CG1 3.71Å; L390-I394 PolarHBondContact O-N 3.05Å; L390-I394 VanDerWaalsContact O-N 3.07Å; K391-I394 PolarHBondContact O-N 3Å; D392-I394 PolarHBondContact O-N 2.68Å; I394-V396 VanDerWaalsContact C-N 3.28Å; I394-V396 PolarHBondContact O-N 3.05Å; I394-N397 WeakPolarHBondContact O-CA 3.07Å; I394-N397 WeakPolarHBondContact O-CB 3.48Å; I394-N397 PolarHBondContact O-N 3.4Å; I394-E398 HydrophobicContact CG2-CG 4.18Å; I394-E398 WeakPolarHBondContact CG2-OE1 3.22Å; I394-E398 WeakPolarHBondContact O-CG 3.34Å; I394-E398 PolarHBondContact O-N 2.88Å
395	S	91.8	Very high	90.4	Very high	55 Å²	55	46.2 Å²	46.2	39%	0.385	26%	0.257	S	S	.	.	H	α-helix	trans	-63	-33	179	73.1	0	0	0	0	113.4	K391 D392 A399	K391-S395 PolarHBondContact O-N 3.41Å; D392-S395 PolarHBondContact O-N 3.36Å; D392-S395 PolarHBondContact O-OG 3.35Å; S395-A399 WeakPolarHBondContact O-CB 3.46Å; S395-A399 PolarHBondContact O-N 2.74Å
396	V	92.3	Very high	89.4	Confident	40 Å²	40	52.7 Å²	52.7	24%	0.242	29%	0.292	C	S	.	.	H	α-helix	trans	-72.4	-31.9	173.3	172.5	0	0	0	0	111.3	D392 L393 I394 M400 A416 L417	D392-V396 WeakPolarHBondContact O-CG2 3.48Å; D392-V396 PolarHBondContact O-N 2.8Å; L393-V396 PolarHBondContact O-N 3.18Å; I394-V396 VanDerWaalsContact C-N 3.28Å; I394-V396 PolarHBondContact O-N 3.05Å; V396-M400 HydrophobicContact CG1-CE 3.53Å; V396-A416 HydrophobicContact CG1-CB 3.93Å; V396-L417 HydrophobicContact CB-CD2 3.84Å; V396-L417 HydrophobicContact CG1-CD2 3.53Å; V396-L417 HydrophobicContact CG1-CG 3.84Å
397	N	91.9	Very high	88.8	Confident	28 Å²	28	58.6 Å²	58.6	15%	0.15	32%	0.323	C	S	.	.	H	α-helix	trans	-71.1	-40.4	174.8	-171.8	46.9	0	0	0	112.7	I264 L393 I394 M400 K413	I264-N397 HydrophobicContact CG2-CB 3.77Å; I264-N397 VanDerWaalsContact CG2-CG 3.44Å; I264-N397 PolarHBondContact O-ND2 3.44Å; L393-N397 WeakPolarHBondContact O-CB 3.32Å; L393-N397 PolarHBondContact O-N 3.46Å; I394-N397 WeakPolarHBondContact O-CA 3.07Å; I394-N397 WeakPolarHBondContact O-CB 3.48Å; I394-N397 PolarHBondContact O-N 3.4Å; N397-M400 VanDerWaalsContact O-O 3.12Å; N397-K413 WeakPolarHBondContact O-CE 3.46Å; N397-K413 PolarHBondContact O-NZ 2.97Å; N397-K413 WeakPolarHBondContact OD1-CE 3.34Å; N397-K413 PolarHBondContact OD1-NZ 3.48Å
398	E	91.8	Very high	88.7	Confident	142 Å²	142	60.1 Å²	60.1	66%	0.664	33%	0.325	S	S	*	.	H	α-helix	trans	-76.9	-35.1	-180	-68.5	172.9	163.6	0	0	112.7	I394 M400	I394-E398 HydrophobicContact CG2-CG 4.18Å; I394-E398 WeakPolarHBondContact CG2-OE1 3.22Å; I394-E398 WeakPolarHBondContact O-CG 3.34Å; I394-E398 PolarHBondContact O-N 2.88Å; E398-M400 VanDerWaalsContact C-N 3.31Å; E398-M400 PolarHBondContact O-N 3.26Å
399	A	91.6	Very high	88.6	Confident	83 Å²	83	60 Å²	60	69%	0.686	32%	0.324	S	S	*	.	S	Bend	trans	-77.5	-9.6	-176.7	0	0	0	0	0	114.8	S395	S395-A399 WeakPolarHBondContact O-CB 3.46Å; S395-A399 PolarHBondContact O-N 2.74Å
400	M	90.1	Very high	88.5	Confident	51 Å²	51	60 Å²	60	25%	0.251	33%	0.325	S	S	.	.	S	Bend	trans	-131.6	132.1	179.9	-75	-174.8	-74.7	0	0	111.5	V396 N397 E398 K413 A416	V396-M400 HydrophobicContact CG1-CE 3.53Å; N397-M400 VanDerWaalsContact O-O 3.12Å; E398-M400 VanDerWaalsContact C-N 3.31Å; E398-M400 PolarHBondContact O-N 3.26Å; M400-K413 HydrophobicContact CB-CB 4.04Å; M400-K413 HydrophobicContact CB-CD 4Å; M400-K413 HydrophobicContact CB-CG 3.98Å; M400-K413 HydrophobicContact CE-CB 4.2Å; M400-K413 HydrophobicContact CE-CG 4.26Å; M400-K413 WeakPolarHBondContact O-CD 3.49Å; M400-K413 VanDerWaalsContact O-CE 3.24Å; M400-K413 WeakPolarHBondContact O-CE 3.17Å; M400-K413 PolarHBondContact O-NZ 3.48Å; M400-K413 HydrophobicContact SD-CB 4.16Å; M400-A416 HydrophobicContact CE-CB 3.98Å
401	P	90.1	Very high	88.3	Confident	82 Å²	82	60.2 Å²	60.2	53%	0.532	33%	0.326	S	S	.	.			trans	-70.6	151.1	174.2	32.6	-36.2	0	0	0	110.5	Y403 N410	P401-Y403 VanDerWaalsContact C-N 3.34Å; P401-Y403 WeakPolarHBondContact CB-O 3.24Å; P401-N410 WeakPolarHBondContact O-CB 3.27Å; P401-N410 PolarHBondContact O-ND2 3.31Å
402	D	88.9	Confident	88.3	Confident	56 Å²	56	59.9 Å²	59.9	30%	0.299	33%	0.326	S	S	.	.	S	Bend	trans	-70.2	-32.1	178	-66.4	-56.8	0	0	0	113.5	L119 N410 K413	L119-D402 HydrophobicContact CD2-CB 3.55Å; L119-D402 WeakPolarHBondContact CD2-OD1 3.39Å; D402-N410 WeakPolarHBondContact O-CB 3.29Å; D402-N410 PolarHBondContact O-N 3.07Å; D402-K413 VanDerWaalsContact CG-NZ 3.32Å; D402-K413 WeakPolarHBondContact OD1-CD 3.09Å; D402-K413 WeakPolarHBondContact OD1-CE 3.36Å; D402-K413 IonicContact OD1-NZ 2.71Å; D402-K413 PolarHBondContact OD1-NZ 2.92Å; D402-K413 IonicContact OD2-NZ 3.45Å; D402-K413 PolarHBondContact OD2-NZ 3.07Å
403	Y	88.6	Confident	88.3	Confident	88 Å²	88	59 Å²	59	35%	0.345	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	148.1	179.4	-61.4	-85.7	0	0	0	110.4	P401 N407 K408 V409	P401-Y403 VanDerWaalsContact C-N 3.34Å; P401-Y403 WeakPolarHBondContact CB-O 3.24Å; Y403-N407 WeakPolarHBondContact CD1-O 3.26Å; Y403-K408 CarbonylContact C-O 3.59Å; Y403-K408 VanDerWaalsContact CA-O 3.32Å; Y403-K408 WeakPolarHBondContact CA-O 3.41Å; Y403-V409 HydrophobicContact CD1-CG2 4.45Å; Y403-V409 HydrophobicContact CE1-CG2 4.07Å
404	V	85.7	Confident	88.2	Confident	47 Å²	47	59.2 Å²	59.2	29%	0.285	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	179.2	178.7	-159.4	0	0	0	0	107.6	K81 D406 N407 K408 N410	K81-V404 HydrophobicContact CD-CB 4.37Å; K81-V404 HydrophobicContact CD-CG1 4.32Å; V404-D406 PolarHBondContact O-N 2.88Å; V404-N407 PolarHBondContact O-N 2.92Å; V404-N407 VanDerWaalsContact O-N 3.15Å; V404-K408 PolarHBondContact N-O 3.4Å; V404-K408 PolarHBondContact O-N 2.71Å; V404-N410 HydrophobicContact CG2-CB 3.66Å
405	D	77.6	Confident	88.2	Confident	101 Å²	101	60.1 Å²	60.1	54%	0.54	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-36.8	136	-177.8	-15.5	-56.7	0	0	0	114	K81 N407	K81-D405 IonicContact NZ-OD2 2.66Å; K81-D405 PolarHBondContact NZ-OD2 2.8Å; D405-N407 VanDerWaalsContact C-N 3.32Å
406	D	73.6	Confident	88.2	Confident	145 Å²	145	59.3 Å²	59.3	78%	0.775	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	62.5	31.9	-175.7	-47.5	-46.4	0	0	0	114.5	V404 K408	V404-D406 PolarHBondContact O-N 2.88Å; D406-K408 PolarHBondContact O-N 2.92Å
407	N	80.1	Confident	88.2	Confident	125 Å²	125	57.4 Å²	57.4	67%	0.668	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	58.2	27.8	179.4	-162.4	48	0	0	0	113.5	Y403 V404 D405	Y403-N407 WeakPolarHBondContact CD1-O 3.26Å; V404-N407 PolarHBondContact O-N 2.92Å; V404-N407 VanDerWaalsContact O-N 3.15Å; D405-N407 VanDerWaalsContact C-N 3.32Å
408	K	86.3	Confident	88.3	Confident	50 Å²	50	56.5 Å²	56.5	22%	0.217	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	142.7	177.7	-68.6	-162.5	169.3	-152.5	0	111.2	K81 A82 E86 Y403 V404 D406	K81-K408 HydrophobicContact CB-CB 4.26Å; A82-K408 CarbonylContact O-C 3.53Å; E86-K408 IonicContact OE1-NZ 2.64Å; E86-K408 PolarHBondContact OE1-NZ 2.88Å; E86-K408 IonicContact OE2-NZ 2.74Å; E86-K408 PolarHBondContact OE2-NZ 3.35Å; Y403-K408 CarbonylContact C-O 3.59Å; Y403-K408 VanDerWaalsContact CA-O 3.32Å; Y403-K408 WeakPolarHBondContact CA-O 3.41Å; V404-K408 PolarHBondContact N-O 3.4Å; V404-K408 PolarHBondContact O-N 2.71Å; D406-K408 PolarHBondContact O-N 2.92Å
409	V	88.4	Confident	88.3	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.006	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	135.6	-179.8	177.4	0	0	0	0	110.7	K81 A82 W84 L87 L119 Y403 V411 L414	K81-V409 WeakPolarHBondContact CA-O 3.23Å; A82-V409 PolarHBondContact N-O 3.14Å; A82-V409 WeakPolarHBondContact O-CB 3.2Å; A82-V409 PolarHBondContact O-N 3.1Å; W84-V409 HydrophobicContact CD2-CG2 4.21Å; W84-V409 HydrophobicContact CG-CG2 4.22Å; W84-V409 HydrophobicContact CZ2-CG1 4.44Å; W84-V409 HydrophobicContact CZ2-CG2 4.12Å; W84-V409 VanDerWaalsContact NE1-CG2 3.34Å; L87-V409 HydrophobicContact CD1-CB 4.25Å; L87-V409 HydrophobicContact CD1-CG1 4.32Å; L87-V409 HydrophobicContact CD1-CG2 4.46Å; L119-V409 HydrophobicContact CD1-CG1 3.78Å; L119-V409 HydrophobicContact CD1-CG2 4.47Å; Y403-V409 HydrophobicContact CD1-CG2 4.45Å; Y403-V409 HydrophobicContact CE1-CG2 4.07Å; V409-V411 PolarHBondContact O-N 2.96Å; V409-L414 HydrophobicContact CG1-CD1 3.58Å; V409-L414 HydrophobicContact CG1-CG 4.25Å
410	N	90.5	Very high	88.4	Confident	12 Å²	12	51.6 Å²	51.6	6%	0.064	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	84.3	172.4	-171.4	-14	0	0	0	111	P401 D402 V404 Q412 K413 L414	P401-N410 WeakPolarHBondContact O-CB 3.27Å; P401-N410 PolarHBondContact O-ND2 3.31Å; D402-N410 WeakPolarHBondContact O-CB 3.29Å; D402-N410 PolarHBondContact O-N 3.07Å; V404-N410 HydrophobicContact CG2-CB 3.66Å; N410-Q412 PolarHBondContact O-N 3.15Å; N410-Q412 WeakPolarHBondContact OD1-CB 3.26Å; N410-Q412 PolarHBondContact OD1-N 3.33Å; N410-K413 HydrophobicContact CB-CB 3.97Å; N410-K413 WeakPolarHBondContact O-CB 3.36Å; N410-K413 PolarHBondContact O-N 3.05Å; N410-K413 VanDerWaalsContact O-N 3.1Å; N410-K413 PolarHBondContact OD1-N 3.33Å; N410-L414 PolarHBondContact O-N 3.32Å
411	V	88.9	Confident	88.6	Confident	5 Å²	5	49.1 Å²	49.1	3%	0.03	26%	0.259	C	S	.	.	H	α-helix	trans	-62.9	-28.9	-178.8	-164.8	0	0	0	0	111.5	L76 L79 T80 A82 L87 V409 L414 Q415	L76-V411 HydrophobicContact CD2-CB 4.45Å; L76-V411 HydrophobicContact CD2-CG1 3.7Å; L79-V411 WeakPolarHBondContact O-CB 3.44Å; T80-V411 PolarHBondContact O-N 3.28Å; A82-V411 HydrophobicContact CB-CG2 4.08Å; L87-V411 HydrophobicContact CD1-CG2 4.41Å; L87-V411 HydrophobicContact CD2-CG1 4.5Å; L87-V411 HydrophobicContact CD2-CG2 4.08Å; V409-V411 PolarHBondContact O-N 2.96Å; V411-L414 PolarHBondContact O-N 2.86Å; V411-Q415 VanDerWaalsContact O-CB 3.31Å; V411-Q415 WeakPolarHBondContact O-CB 3.49Å; V411-Q415 PolarHBondContact O-N 3.49Å
412	Q	89.6	Confident	88.6	Confident	104 Å²	104	46.8 Å²	46.8	49%	0.486	24%	0.242	S	C	.	.	H	α-helix	trans	-64.4	-40.6	174.1	-62.6	-176.3	-14.4	0	0	112.3	N410 Q415 A416	N410-Q412 PolarHBondContact O-N 3.15Å; N410-Q412 WeakPolarHBondContact OD1-CB 3.26Å; N410-Q412 PolarHBondContact OD1-N 3.33Å; Q412-Q415 PolarHBondContact O-N 3.01Å; Q412-A416 WeakPolarHBondContact O-CB 3.35Å; Q412-A416 PolarHBondContact O-N 3.24Å
413	K	91.4	Very high	88.8	Confident	3 Å²	3	47.3 Å²	47.3	1%	0.013	24%	0.243	C	C	.	.	H	α-helix	trans	-61	-49.3	172.8	-177.4	-179.4	-172.3	175	0	111.2	N397 M400 D402 N410 Q415 A416 L417	N397-K413 WeakPolarHBondContact O-CE 3.46Å; N397-K413 PolarHBondContact O-NZ 2.97Å; N397-K413 WeakPolarHBondContact OD1-CE 3.34Å; N397-K413 PolarHBondContact OD1-NZ 3.48Å; M400-K413 HydrophobicContact CB-CB 4.04Å; M400-K413 HydrophobicContact CB-CD 4Å; M400-K413 HydrophobicContact CB-CG 3.98Å; M400-K413 HydrophobicContact CE-CB 4.2Å; M400-K413 HydrophobicContact CE-CG 4.26Å; M400-K413 WeakPolarHBondContact O-CD 3.49Å; M400-K413 VanDerWaalsContact O-CE 3.24Å; M400-K413 WeakPolarHBondContact O-CE 3.17Å; M400-K413 PolarHBondContact O-NZ 3.48Å; M400-K413 HydrophobicContact SD-CB 4.16Å; D402-K413 VanDerWaalsContact CG-NZ 3.32Å; D402-K413 WeakPolarHBondContact OD1-CD 3.09Å; D402-K413 WeakPolarHBondContact OD1-CE 3.36Å; D402-K413 IonicContact OD1-NZ 2.71Å; D402-K413 PolarHBondContact OD1-NZ 2.92Å; D402-K413 IonicContact OD2-NZ 3.45Å; D402-K413 PolarHBondContact OD2-NZ 3.07Å; N410-K413 HydrophobicContact CB-CB 3.97Å; N410-K413 WeakPolarHBondContact O-CB 3.36Å; N410-K413 PolarHBondContact O-N 3.05Å; N410-K413 VanDerWaalsContact O-N 3.1Å; N410-K413 PolarHBondContact OD1-N 3.33Å; K413-Q415 VanDerWaalsContact C-N 3.34Å; K413-Q415 PolarHBondContact O-N 2.99Å; K413-A416 PolarHBondContact O-N 3.4Å; K413-L417 HydrophobicContact CG-CD1 4.1Å; K413-L417 WeakPolarHBondContact O-CG 3.44Å; K413-L417 PolarHBondContact O-N 3.29Å
414	L	91.1	Very high	89	Confident	4 Å²	4	43.1 Å²	43.1	2%	0.021	23%	0.226	C	C	.	.	H	α-helix	trans	-61.9	-41.8	179.3	-56.5	-171.5	0	0	0	111.4	W84 I111 M115 L118 L119 V409 N410 V411 Y418	W84-L414 HydrophobicContact CH2-CD1 4.46Å; I111-L414 HydrophobicContact CG2-CB 3.74Å; M115-L414 HydrophobicContact CB-CB 4.04Å; M115-L414 HydrophobicContact CB-CD1 4.32Å; M115-L414 HydrophobicContact CB-CD2 4.06Å; M115-L414 HydrophobicContact CB-CG 4.36Å; M115-L414 HydrophobicContact CG-CB 4.31Å; L118-L414 HydrophobicContact CD1-CD2 4.17Å; L119-L414 HydrophobicContact CD1-CD1 4.5Å; L119-L414 HydrophobicContact CD1-CD2 4.22Å; V409-L414 HydrophobicContact CG1-CD1 3.58Å; V409-L414 HydrophobicContact CG1-CG 4.25Å; N410-L414 PolarHBondContact O-N 3.32Å; V411-L414 PolarHBondContact O-N 2.86Å; L414-Y418 WeakPolarHBondContact O-CB 3.4Å; L414-Y418 PolarHBondContact O-N 3.21Å
415	Q	91.1	Very high	89.2	Confident	41 Å²	41	42.2 Å²	42.2	19%	0.192	22%	0.219	C	C	.	.	H	α-helix	trans	-64.6	-42.7	176.3	-174.9	177.1	24.8	0	0	112.4	I111 V411 Q412 K413 Y418 N419	I111-Q415 HydrophobicContact CD1-CB 3.96Å; I111-Q415 HydrophobicContact CD1-CG 3.84Å; V411-Q415 VanDerWaalsContact O-CB 3.31Å; V411-Q415 WeakPolarHBondContact O-CB 3.49Å; V411-Q415 PolarHBondContact O-N 3.49Å; Q412-Q415 PolarHBondContact O-N 3.01Å; K413-Q415 VanDerWaalsContact C-N 3.34Å; K413-Q415 PolarHBondContact O-N 2.99Å; Q415-Y418 PolarHBondContact O-N 2.79Å; Q415-N419 WeakPolarHBondContact O-CB 3.14Å; Q415-N419 PolarHBondContact O-N 3.37Å; Q415-N419 PolarHBondContact O-ND2 3.08Å
416	A	92	Very high	89.7	Confident	38 Å²	38	42.2 Å²	42.2	31%	0.314	22%	0.216	S	C	.	.	H	α-helix	trans	-63.7	-46.9	179.3	0	0	0	0	0	112	V396 M400 Q412 K413 H420	V396-A416 HydrophobicContact CG1-CB 3.93Å; M400-A416 HydrophobicContact CE-CB 3.98Å; Q412-A416 WeakPolarHBondContact O-CB 3.35Å; Q412-A416 PolarHBondContact O-N 3.24Å; K413-A416 PolarHBondContact O-N 3.4Å; A416-H420 PolarHBondContact O-N 2.89Å
417	L	93.6	Very high	90.4	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-65.8	-45.6	175.9	-67.9	173.5	0	0	0	111.4	M115 L118 I264 L393 V396 K413 N419 H420 I421	M115-L417 HydrophobicContact CE-CB 3.6Å; M115-L417 HydrophobicContact CE-CD1 4.41Å; L118-L417 HydrophobicContact CD1-CD1 3.73Å; I264-L417 HydrophobicContact CD1-CD2 4.26Å; L393-L417 HydrophobicContact CD2-CD2 3.97Å; L393-L417 WeakPolarHBondContact O-CD2 3.49Å; V396-L417 HydrophobicContact CB-CD2 3.84Å; V396-L417 HydrophobicContact CG1-CD2 3.53Å; V396-L417 HydrophobicContact CG1-CG 3.84Å; K413-L417 HydrophobicContact CG-CD1 4.1Å; K413-L417 WeakPolarHBondContact O-CG 3.44Å; K413-L417 PolarHBondContact O-N 3.29Å; L417-N419 PolarHBondContact O-N 2.91Å; L417-H420 PolarHBondContact O-N 2.95Å; L417-I421 WeakPolarHBondContact O-CG1 3.35Å; L417-I421 PolarHBondContact O-N 2.58Å
418	Y	93.1	Very high	90.8	Very high	9 Å²	9	31.5 Å²	31.5	4%	0.035	16%	0.158	C	C	.	.	H	α-helix	trans	-55	-50.1	175.8	174.6	-96.6	0	0	0	111.7	N110 I111 T114 M115 F257 L414 Q415 H420 I421 N422	N110-Y418 HydrophobicContact CB-CE2 3.92Å; N110-Y418 WeakPolarHBondContact CB-OH 3.18Å; N110-Y418 PolarHBondContact ND2-OH 3.2Å; N110-Y418 VanDerWaalsContact ND2-OH 3.15Å; I111-Y418 HydrophobicContact CD1-CD1 4.29Å; I111-Y418 HydrophobicContact CG1-CD1 3.57Å; I111-Y418 HydrophobicContact CG1-CD2 4.15Å; I111-Y418 HydrophobicContact CG1-CE1 4.18Å; I111-Y418 HydrophobicContact CG1-CG 3.57Å; T114-Y418 WeakPolarHBondContact OG1-CD2 3.35Å; M115-Y418 HydrophobicContact CG-CD2 4.36Å; M115-Y418 HydrophobicContact SD-CD2 4.31Å; F257-Y418 HydrophobicContact CE2-CD2 4.03Å; F257-Y418 HydrophobicContact CE2-CE2 4.11Å; F257-Y418 AromaticContact CZ-CD2 3.68Å; F257-Y418 HydrophobicContact CZ-CD2 3.68Å; F257-Y418 HydrophobicContact CZ-CE2 4.17Å; L414-Y418 WeakPolarHBondContact O-CB 3.4Å; L414-Y418 PolarHBondContact O-N 3.21Å; Q415-Y418 PolarHBondContact O-N 2.79Å; Y418-H420 VanDerWaalsContact C-N 3.32Å; Y418-H420 PolarHBondContact O-N 2.87Å; Y418-I421 PolarHBondContact O-N 3.15Å; Y418-N422 HydrophobicContact CE1-CB 4.21Å; Y418-N422 WeakPolarHBondContact O-CB 3.14Å; Y418-N422 PolarHBondContact O-N 3.48Å; Y418-N422 PolarHBondContact OH-ND2 2.99Å
419	N	92.9	Very high	90.5	Very high	81 Å²	81	36.1 Å²	36.1	43%	0.433	18%	0.18	S	C	.	.	H	α-helix	trans	-59.7	-42.1	-178.2	-74.8	-18.6	0	0	0	111.9	Q415 L417 E423	Q415-N419 WeakPolarHBondContact O-CB 3.14Å; Q415-N419 PolarHBondContact O-N 3.37Å; Q415-N419 PolarHBondContact O-ND2 3.08Å; L417-N419 PolarHBondContact O-N 2.91Å; N419-E423 PolarHBondContact O-N 3.36Å
420	H	93.6	Very high	90.1	Very high	40 Å²	40	38.4 Å²	38.4	19%	0.185	19%	0.192	C	C	.	.	H	α-helix	trans	-71	-42.6	-179.7	-162.1	116.3	0	0	0	112.2	H389 D392 L393 A416 L417 Y418 E423 L424	H389-H420 WeakPolarHBondContact CB-NE2 3.4Å; H389-H420 AromaticContact CG-NE2 3.62Å; H389-H420 AromaticContact ND1-CE1 3.59Å; H389-H420 AromaticContact ND1-NE2 3Å; H389-H420 PolarHBondContact ND1-NE2 3.09Å; D392-H420 IonicContact OD2-CE1 3.8Å; L393-H420 HydrophobicContact CD2-CB 3.8Å; A416-H420 PolarHBondContact O-N 2.89Å; L417-H420 PolarHBondContact O-N 2.95Å; Y418-H420 VanDerWaalsContact C-N 3.32Å; Y418-H420 PolarHBondContact O-N 2.87Å; H420-E423 PolarHBondContact O-N 3.37Å; H420-L424 PolarHBondContact O-N 3.42Å
421	I	93.4	Very high	88.9	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-65.8	-40.6	175.2	-59	166.7	0	0	0	110.3	M115 F257 Y260 I264 L393 L417 Y418 E423 L424 I425	M115-I421 HydrophobicContact CE-CD1 4.34Å; M115-I421 HydrophobicContact SD-CD1 4.48Å; F257-I421 HydrophobicContact CD1-CG2 4.2Å; F257-I421 HydrophobicContact CD2-CB 4.34Å; F257-I421 HydrophobicContact CD2-CG2 3.47Å; F257-I421 VanDerWaalsContact CD2-CG2 3.47Å; F257-I421 HydrophobicContact CE1-CD1 4.1Å; F257-I421 HydrophobicContact CE1-CG2 4.16Å; F257-I421 HydrophobicContact CE2-CB 3.8Å; F257-I421 HydrophobicContact CE2-CG2 3.45Å; F257-I421 VanDerWaalsContact CE2-CG2 3.45Å; F257-I421 HydrophobicContact CG-CG2 3.85Å; F257-I421 HydrophobicContact CZ-CB 3.9Å; F257-I421 HydrophobicContact CZ-CD1 4.12Å; F257-I421 HydrophobicContact CZ-CG2 3.8Å; Y260-I421 HydrophobicContact CD2-CG2 3.73Å; Y260-I421 HydrophobicContact CE2-CG2 4.46Å; Y260-I421 HydrophobicContact CG-CG1 4.48Å; Y260-I421 HydrophobicContact CG-CG2 4Å; I264-I421 HydrophobicContact CD1-CD1 3.92Å; L393-I421 HydrophobicContact CD1-CG1 4.12Å; L393-I421 HydrophobicContact CD2-CD1 4.49Å; L393-I421 HydrophobicContact CD2-CG1 3.8Å; L417-I421 WeakPolarHBondContact O-CG1 3.35Å; L417-I421 PolarHBondContact O-N 2.58Å; Y418-I421 PolarHBondContact O-N 3.15Å; I421-E423 PolarHBondContact O-N 3.06Å; I421-L424 WeakPolarHBondContact O-CB 3.37Å; I421-L424 PolarHBondContact O-N 2.86Å; I421-L424 VanDerWaalsContact O-N 3.12Å; I421-I425 HydrophobicContact CG2-CG1 4.26Å; I421-I425 WeakPolarHBondContact O-CG1 3.43Å; I421-I425 PolarHBondContact O-N 2.78Å
422	N	91.3	Very high	87.8	Confident	33 Å²	33	44.3 Å²	44.3	18%	0.176	23%	0.232	C	C	.	.	H	α-helix	trans	-64.3	-37.2	178.9	-171.5	21	0	0	0	112.1	Y418 L424 I425 Q426	Y418-N422 HydrophobicContact CE1-CB 4.21Å; Y418-N422 WeakPolarHBondContact O-CB 3.14Å; Y418-N422 PolarHBondContact O-N 3.48Å; Y418-N422 PolarHBondContact OH-ND2 2.99Å; N422-L424 VanDerWaalsContact C-N 3.34Å; N422-L424 PolarHBondContact O-N 3.38Å; N422-I425 PolarHBondContact O-N 2.88Å; N422-Q426 VanDerWaalsContact CG-NE2 3.25Å; N422-Q426 PolarHBondContact ND2-NE2 2.81Å; N422-Q426 WeakPolarHBondContact O-CB 3.42Å; N422-Q426 VanDerWaalsContact O-CG 3.24Å; N422-Q426 WeakPolarHBondContact O-CG 3.34Å; N422-Q426 PolarHBondContact O-N 3.44Å; N422-Q426 PolarHBondContact OD1-NE2 3.36Å
423	E	91.7	Very high	86.6	Confident	67 Å²	67	48.9 Å²	48.9	31%	0.313	25%	0.253	S	S	.	.	H	α-helix	trans	-59.7	-43.9	170.4	-176.5	170.1	-175.7	0	0	111.2	N419 H420 I421 Q426 L427	N419-E423 PolarHBondContact O-N 3.36Å; H420-E423 PolarHBondContact O-N 3.37Å; I421-E423 PolarHBondContact O-N 3.06Å; E423-Q426 PolarHBondContact O-N 3.44Å; E423-L427 WeakPolarHBondContact O-CG 3.4Å; E423-L427 PolarHBondContact O-N 3.24Å
424	L	92.4	Very high	85.5	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63.3	-42.6	176.8	-63.4	175.2	0	0	0	112.6	F252 Y260 P384 H389 H420 I421 N422 L427	F252-L424 HydrophobicContact CZ-CB 4.49Å; F252-L424 VanDerWaalsContact CZ-O 3.31Å; F252-L424 WeakPolarHBondContact CZ-O 3.25Å; Y260-L424 HydrophobicContact CD1-CD1 4.41Å; Y260-L424 HydrophobicContact CE1-CD1 3.69Å; P384-L424 HydrophobicContact CB-CD2 4.43Å; P384-L424 HydrophobicContact CG-CD2 3.83Å; H389-L424 HydrophobicContact CB-CD1 4.16Å; H389-L424 HydrophobicContact CB-CD2 4.16Å; H420-L424 PolarHBondContact O-N 3.42Å; I421-L424 WeakPolarHBondContact O-CB 3.37Å; I421-L424 PolarHBondContact O-N 2.86Å; I421-L424 VanDerWaalsContact O-N 3.12Å; N422-L424 VanDerWaalsContact C-N 3.34Å; N422-L424 PolarHBondContact O-N 3.38Å; L424-L427 HydrophobicContact CD2-CD1 4.45Å; L424-L427 PolarHBondContact O-N 2.88Å
425	I	89.8	Confident	84.3	Confident	27 Å²	27	53 Å²	53	14%	0.138	28%	0.275	C	S	.	.	H	α-helix	trans	-68.7	-34.7	178.1	-62.7	-60	0	0	0	111.8	F257 Y260 I421 N422 L427 Q428	F257-I425 HydrophobicContact CD2-CG1 4.15Å; Y260-I425 HydrophobicContact CD2-CD1 4.47Å; Y260-I425 HydrophobicContact CE2-CD1 4.02Å; I421-I425 HydrophobicContact CG2-CG1 4.26Å; I421-I425 WeakPolarHBondContact O-CG1 3.43Å; I421-I425 PolarHBondContact O-N 2.78Å; N422-I425 PolarHBondContact O-N 2.88Å; I425-L427 VanDerWaalsContact C-N 3.3Å; I425-L427 PolarHBondContact O-N 3.25Å; I425-Q428 WeakPolarHBondContact O-CB 3.43Å; I425-Q428 PolarHBondContact O-N 2.57Å; I425-Q428 VanDerWaalsContact O-N 3.16Å
426	Q	88.8	Confident	83.2	Confident	102 Å²	102	51.1 Å²	51.1	48%	0.477	27%	0.267	S	S	.	.	H	α-helix	trans	-62.7	-35.1	176.1	-76.6	168.4	31.4	0	0	112.5	N422 E423 Q428 Q429	N422-Q426 VanDerWaalsContact CG-NE2 3.25Å; N422-Q426 PolarHBondContact ND2-NE2 2.81Å; N422-Q426 WeakPolarHBondContact O-CB 3.42Å; N422-Q426 VanDerWaalsContact O-CG 3.24Å; N422-Q426 WeakPolarHBondContact O-CG 3.34Å; N422-Q426 PolarHBondContact O-N 3.44Å; N422-Q426 PolarHBondContact OD1-NE2 3.36Å; E423-Q426 PolarHBondContact O-N 3.44Å; Q426-Q428 PolarHBondContact O-N 2.82Å; Q426-Q429 WeakPolarHBondContact O-CB 3.35Å; Q426-Q429 PolarHBondContact O-N 3.49Å; Q426-Q429 VanDerWaalsContact O-N 3.09Å
427	L	89.3	Confident	82.4	Confident	12 Å²	12	51.1 Å²	51.1	6%	0.063	26%	0.262	C	S	.	.	H	α-helix	trans	-62.9	-30.2	176.2	-62.7	162.4	0	0	0	112.5	F252 Y375 K382 P384 E423 L424 I425 Q429 I430	F252-L427 HydrophobicContact CE1-CB 3.97Å; F252-L427 HydrophobicContact CZ-CB 4.3Å; Y375-L427 WeakPolarHBondContact OH-CD1 3.35Å; K382-L427 HydrophobicContact CG-CD2 3.88Å; P384-L427 HydrophobicContact CG-CD1 3.98Å; E423-L427 WeakPolarHBondContact O-CG 3.4Å; E423-L427 PolarHBondContact O-N 3.24Å; L424-L427 HydrophobicContact CD2-CD1 4.45Å; L424-L427 PolarHBondContact O-N 2.88Å; I425-L427 VanDerWaalsContact C-N 3.3Å; I425-L427 PolarHBondContact O-N 3.25Å; L427-Q429 PolarHBondContact O-N 2.79Å; L427-I430 HydrophobicContact CD2-CD1 4.08Å; L427-I430 PolarHBondContact O-N 3.39Å
428	Q	86.7	Confident	81.6	Confident	33 Å²	33	56 Å²	56	15%	0.154	28%	0.283	C	S	.	.	H	α-helix	trans	-68.5	-21.1	176.5	-56.9	175.9	-14	0	0	113	F252 C253 I255 I425 Q426	F252-Q428 HydrophobicContact CD1-CG 3.83Å; F252-Q428 HydrophobicContact CE1-CG 3.5Å; F252-Q428 HydrophobicContact CZ-CG 4.04Å; F252-Q428 PolarHBondContact O-NE2 2.9Å; C253-Q428 HydrophobicContact CB-CB 4.3Å; C253-Q428 HydrophobicContact CB-CG 4.45Å; I255-Q428 PolarHBondContact O-NE2 2.86Å; I425-Q428 WeakPolarHBondContact O-CB 3.43Å; I425-Q428 PolarHBondContact O-N 2.57Å; I425-Q428 VanDerWaalsContact O-N 3.16Å; Q426-Q428 PolarHBondContact O-N 2.82Å
429	Q	81.5	Confident	80.8	Confident	146 Å²	146	56 Å²	56	68%	0.682	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-10.3	-178.3	-57.2	-177.6	7.4	0	0	112.9	Q426 L427 P431	Q426-Q429 WeakPolarHBondContact O-CB 3.35Å; Q426-Q429 PolarHBondContact O-N 3.49Å; Q426-Q429 VanDerWaalsContact O-N 3.09Å; L427-Q429 PolarHBondContact O-N 2.79Å; Q429-P431 WeakPolarHBondContact O-CD 3.5Å
430	I	79.4	Confident	80.1	Confident	49 Å²	49	52.3 Å²	52.3	25%	0.251	26%	0.264	S	S	.	.	S	Bend	trans	-72.6	121.6	-179.5	-56.5	-179.9	0	0	0	109.1	G380 F381 L427 S432	G380-I430 WeakPolarHBondContact O-CD1 3.41Å; F381-I430 HydrophobicContact CB-CG2 4.14Å; F381-I430 HydrophobicContact CD2-CG2 4.49Å; L427-I430 HydrophobicContact CD2-CD1 4.08Å; L427-I430 PolarHBondContact O-N 3.39Å; I430-S432 PolarHBondContact O-N 3.11Å; I430-S432 VanDerWaalsContact O-N 3.12Å
431	P	65.4	Low	79.5	Confident	115 Å²	115	50.7 Å²	50.7	75%	0.747	26%	0.256	S	S	*	.			trans	-67.6	113.7	-176.1	26.1	-33.9	0	0	0	111.4	Q429	Q429-P431 WeakPolarHBondContact O-CD 3.5Å
432	S	65.8	Low	78.9	Confident	26 Å²	26	53 Å²	53	18%	0.182	27%	0.268	C	S	.	.			trans	-75.7	123.7	179.1	62.4	0	0	0	0	111.7	I430 L434	I430-S432 PolarHBondContact O-N 3.11Å; I430-S432 VanDerWaalsContact O-N 3.12Å; S432-L434 PolarHBondContact O-N 3.49Å; S432-L434 VanDerWaalsContact O-N 3.1Å
433	Q	65.3	Low	78.4	Confident	200 Å²	200	52 Å²	52	94%	0.935	26%	0.262	S	S	*	.			trans	-79.8	23.5	175.5	-60.5	-175.2	0.5	0	0	113.6	D435	Q433-D435 PolarHBondContact O-N 2.81Å
434	L	68.3	Low	77.9	Confident	19 Å²	19	49 Å²	49	10%	0.099	25%	0.248	C	C	.	.			trans	-79.6	109.2	-169.4	-62.2	168.5	0	0	0	112	T245 F246 M319 F381 S432 A436	T245-L434 HydrophobicContact CG2-CD1 3.94Å; T245-L434 HydrophobicContact CG2-CD2 4.08Å; F246-L434 HydrophobicContact CB-CD1 4.36Å; F246-L434 HydrophobicContact CD2-CB 4.47Å; M319-L434 HydrophobicContact CE-CD2 3.38Å; F381-L434 HydrophobicContact CZ-CD1 4.09Å; S432-L434 PolarHBondContact O-N 3.49Å; S432-L434 VanDerWaalsContact O-N 3.1Å; L434-A436 PolarHBondContact O-N 3.4Å
435	D	64.1	Low	77.4	Confident	74 Å²	74	50.5 Å²	50.5	40%	0.396	26%	0.257	S	S	.	.			trans	-89.8	75.7	177.1	-165.3	15.3	0	0	0	112	N221 S223 Q433	N221-D435 VanDerWaalsContact CB-OD1 3.28Å; N221-D435 WeakPolarHBondContact CB-OD1 3.32Å; S223-D435 VanDerWaalsContact CB-OD2 3.23Å; S223-D435 WeakPolarHBondContact CB-OD2 3.49Å; S223-D435 PolarHBondContact OG-OD2 2.89Å; Q433-D435 PolarHBondContact O-N 2.81Å
436	A	68.1	Low	76.9	Confident	3 Å²	3	49.4 Å²	49.4	3%	0.025	25%	0.252	C	S	.	.			trans	-89.6	124.6	-178.2	0	0	0	0	0	113	F246 L434 K438 V441	F246-A436 HydrophobicContact CB-CB 3.68Å; F246-A436 HydrophobicContact CD1-CB 3.87Å; F246-A436 HydrophobicContact CD2-CB 3.38Å; F246-A436 HydrophobicContact CE1-CB 4.32Å; F246-A436 HydrophobicContact CE2-CB 3.85Å; F246-A436 HydrophobicContact CG-CB 3.38Å; F246-A436 HydrophobicContact CZ-CB 4.31Å; L434-A436 PolarHBondContact O-N 3.4Å; A436-K438 PolarHBondContact O-N 2.8Å; A436-V441 HydrophobicContact CB-CG2 4.03Å
437	N	75.1	Confident	76.3	Confident	38 Å²	38	44.6 Å²	44.6	20%	0.203	23%	0.229	C	C	.	.			trans	-68.9	115.5	171.5	-178.1	-1.6	0	0	0	110.5	H243 D439 L440 V441	H243-N437 WeakPolarHBondContact NE2-CB 3.41Å; H243-N437 PolarHBondContact NE2-N 2.62Å; N437-D439 PolarHBondContact O-N 2.81Å; N437-D439 VanDerWaalsContact O-N 3.11Å; N437-D439 PolarHBondContact OD1-N 2.76Å; N437-L440 HydrophobicContact CB-CB 4.47Å; N437-L440 PolarHBondContact O-N 2.97Å; N437-L440 VanDerWaalsContact O-N 3.08Å; N437-V441 WeakPolarHBondContact O-CG2 3.34Å; N437-V441 PolarHBondContact O-N 3.46Å
438	K	76.8	Confident	75.9	Confident	101 Å²	101	44.5 Å²	44.5	44%	0.439	23%	0.228	S	C	.	.	H	α-helix	trans	-50	-35.8	176.6	-71.3	171	176.4	155.1	0	113.4	A220 A436 V441 H442	A220-K438 HydrophobicContact CB-CD 4.26Å; A220-K438 VanDerWaalsContact CB-CE 3.44Å; A220-K438 HydrophobicContact CB-CG 4.3Å; A436-K438 PolarHBondContact O-N 2.8Å; K438-V441 PolarHBondContact O-N 2.82Å; K438-H442 PolarHBondContact O-CD2 3.08Å; K438-H442 PolarHBondContact O-N 3.2Å; K438-H442 PolarHBondContact O-ND1 3.03Å
439	D	76.5	Confident	75.2	Confident	9 Å²	9	45.4 Å²	45.4	5%	0.048	24%	0.235	C	C	.	.	H	α-helix	trans	-68.3	-40.6	-178.5	-63.9	-30	0	0	0	112.3	L230 N437 H442 L443 S508 K511 N512	L230-D439 HydrophobicContact CD1-CB 4.5Å; L230-D439 HydrophobicContact CD2-CB 4.1Å; N437-D439 PolarHBondContact O-N 2.81Å; N437-D439 VanDerWaalsContact O-N 3.11Å; N437-D439 PolarHBondContact OD1-N 2.76Å; D439-H442 PolarHBondContact O-N 2.89Å; D439-L443 PolarHBondContact O-N 3.43Å; D439-S508 WeakPolarHBondContact CA-OG 3.45Å; D439-S508 WeakPolarHBondContact OD1-CB 3.46Å; D439-S508 PolarHBondContact OD1-OG 3.44Å; D439-K511 IonicContact OD1-NZ 2.66Å; D439-K511 PolarHBondContact OD1-NZ 3.21Å; D439-K511 IonicContact OD2-NZ 2.77Å; D439-K511 PolarHBondContact OD2-NZ 3.36Å; D439-N512 PolarHBondContact OD2-ND2 2.96Å
440	L	79.1	Confident	74.5	Confident	4 Å²	4	39.1 Å²	39.1	2%	0.021	21%	0.205	C	C	.	.	H	α-helix	trans	-76.5	-32.2	177	-162.9	141.6	0	0	0	111.3	V228 L230 L235 H243 N437 H442 L443 L444	V228-L440 HydrophobicContact CG1-CD1 3.74Å; L230-L440 HydrophobicContact CD2-CB 3.86Å; L230-L440 HydrophobicContact CD2-CD1 4.22Å; L230-L440 HydrophobicContact CD2-CG 4.31Å; L235-L440 HydrophobicContact CD1-CD1 3.58Å; L235-L440 HydrophobicContact CD2-CD1 3.91Å; L235-L440 HydrophobicContact CD2-CD2 4.11Å; L235-L440 HydrophobicContact CG-CD1 4.35Å; H243-L440 HydrophobicContact CB-CD2 3.85Å; N437-L440 HydrophobicContact CB-CB 4.47Å; N437-L440 PolarHBondContact O-N 2.97Å; N437-L440 VanDerWaalsContact O-N 3.08Å; L440-H442 VanDerWaalsContact C-N 3.32Å; L440-H442 PolarHBondContact O-N 2.96Å; L440-L443 PolarHBondContact O-N 3.17Å; L440-L444 HydrophobicContact CD2-CD1 3.56Å; L440-L444 HydrophobicContact CD2-CG 3.86Å; L440-L444 WeakPolarHBondContact O-CB 3.34Å; L440-L444 WeakPolarHBondContact O-CG 3.39Å; L440-L444 PolarHBondContact O-N 3.37Å
441	V	81.1	Confident	74	Confident	6 Å²	6	41 Å²	41	4%	0.036	21%	0.21	C	C	.	.	H	α-helix	trans	-59.6	-40.6	168	172.7	0	0	0	0	111.5	F246 L247 A436 N437 K438 T445	F246-V441 HydrophobicContact CD1-CG1 4.4Å; F246-V441 HydrophobicContact CD1-CG2 3.8Å; F246-V441 HydrophobicContact CE1-CG1 4.07Å; F246-V441 HydrophobicContact CE1-CG2 3.87Å; L247-V441 HydrophobicContact CD2-CG1 3.91Å; L247-V441 HydrophobicContact CG-CG1 4.4Å; A436-V441 HydrophobicContact CB-CG2 4.03Å; N437-V441 WeakPolarHBondContact O-CG2 3.34Å; N437-V441 PolarHBondContact O-N 3.46Å; K438-V441 PolarHBondContact O-N 2.82Å; V441-T445 WeakPolarHBondContact O-CB 3.13Å; V441-T445 PolarHBondContact O-N 2.92Å; V441-T445 PolarHBondContact O-OG1 2.94Å
442	H	80.3	Confident	74.3	Confident	50 Å²	50	36.7 Å²	36.7	23%	0.231	18%	0.179	C	C	.	.	H	α-helix	trans	-64.9	-43.3	176.1	-66.2	161.5	0	0	0	112.3	K438 D439 L440 T445 L446 R504 S508	K438-H442 PolarHBondContact O-CD2 3.08Å; K438-H442 PolarHBondContact O-N 3.2Å; K438-H442 PolarHBondContact O-ND1 3.03Å; D439-H442 PolarHBondContact O-N 2.89Å; L440-H442 VanDerWaalsContact C-N 3.32Å; L440-H442 PolarHBondContact O-N 2.96Å; H442-T445 PolarHBondContact O-N 2.92Å; H442-L446 PolarHBondContact O-N 3.22Å; H442-R504 HydrophobicContact CB-CB 4.33Å; H442-R504 PolarHBondContact ND1-O 2.79Å; H442-S508 PolarHBondContact ND1-OG 3.08Å
443	L	80.1	Confident	75	Confident	10 Å²	10	37.6 Å²	37.6	5%	0.052	18%	0.183	C	C	.	.	H	α-helix	trans	-61.4	-51.4	175.8	-168.6	159.2	0	0	0	111.2	L230 D439 L440 T445 L446 S447 F533	L230-L443 HydrophobicContact CB-CD1 3.86Å; L230-L443 VanDerWaalsContact O-CD1 3.24Å; L230-L443 WeakPolarHBondContact O-CD1 3.47Å; D439-L443 PolarHBondContact O-N 3.43Å; L440-L443 PolarHBondContact O-N 3.17Å; L443-T445 VanDerWaalsContact C-N 3.34Å; L443-T445 PolarHBondContact O-N 2.83Å; L443-L446 PolarHBondContact O-N 3.41Å; L443-S447 PolarHBondContact O-N 3.02Å; L443-F533 HydrophobicContact CD1-CE2 4.41Å; L443-F533 HydrophobicContact CD2-CE2 3.92Å; L443-F533 HydrophobicContact CD2-CZ 3.87Å; L443-F533 HydrophobicContact CG-CE2 3.91Å; L443-F533 HydrophobicContact CG-CZ 3.79Å
444	L	81.8	Confident	75.7	Confident	5 Å²	5	32 Å²	32	3%	0.026	16%	0.157	C	C	.	.	H	α-helix	trans	-61.7	-38.5	178	-73.8	180	0	0	0	112.7	L240 H243 L244 L247 W288 L440 L446 S447 L448	L240-L444 HydrophobicContact CD1-CD1 4.04Å; L240-L444 HydrophobicContact CD1-CD2 4.04Å; H243-L444 HydrophobicContact CB-CD1 3.72Å; L244-L444 HydrophobicContact CD2-CD1 4.32Å; L247-L444 HydrophobicContact CD1-CB 3.84Å; L247-L444 HydrophobicContact CD1-CD1 4.28Å; W288-L444 HydrophobicContact CH2-CD2 4.09Å; W288-L444 HydrophobicContact CZ2-CD2 4.05Å; L440-L444 HydrophobicContact CD2-CD1 3.56Å; L440-L444 HydrophobicContact CD2-CG 3.86Å; L440-L444 WeakPolarHBondContact O-CB 3.34Å; L440-L444 WeakPolarHBondContact O-CG 3.39Å; L440-L444 PolarHBondContact O-N 3.37Å; L444-L446 VanDerWaalsContact C-N 3.31Å; L444-L446 PolarHBondContact O-N 2.87Å; L444-S447 WeakPolarHBondContact CA-OG 3.05Å; L444-S447 CarbonylContact O-C 3.5Å; L444-S447 PolarHBondContact O-N 3.49Å; L444-S447 PolarHBondContact O-OG 2.65Å; L444-L448 WeakPolarHBondContact O-CB 3.42Å; L444-L448 WeakPolarHBondContact O-CD1 3.48Å; L444-L448 WeakPolarHBondContact O-CG 3.47Å; L444-L448 PolarHBondContact O-N 3.27Å; L444-L448 VanDerWaalsContact O-N 3.11Å
445	T	81.3	Confident	76.1	Confident	32 Å²	32	36.9 Å²	36.9	20%	0.196	18%	0.183	C	C	.	.	H	α-helix	trans	-58.4	-47.9	177.6	-53.6	0	0	0	0	110.1	V441 H442 L443 S447 L448 D449 H501	V441-T445 WeakPolarHBondContact O-CB 3.13Å; V441-T445 PolarHBondContact O-N 2.92Å; V441-T445 PolarHBondContact O-OG1 2.94Å; H442-T445 PolarHBondContact O-N 2.92Å; L443-T445 VanDerWaalsContact C-N 3.34Å; L443-T445 PolarHBondContact O-N 2.83Å; T445-S447 VanDerWaalsContact C-N 3.34Å; T445-S447 PolarHBondContact O-N 3.28Å; T445-L448 PolarHBondContact O-N 2.66Å; T445-D449 PolarHBondContact O-N 2.89Å; T445-H501 VanDerWaalsContact CG2-CE1 3.49Å; T445-H501 WeakPolarHBondContact CG2-CE1 3.36Å; T445-H501 WeakPolarHBondContact CG2-ND1 3.47Å
446	L	79.5	Confident	76.8	Confident	4 Å²	4	36.7 Å²	36.7	2%	0.021	18%	0.18	C	C	.	.	H	α-helix	trans	-67.6	-32.5	178.3	-173.9	67.2	0	0	0	112.7	H442 L443 L444 L448 L450 H501 V502 M505 F533 F557	H442-L446 PolarHBondContact O-N 3.22Å; L443-L446 PolarHBondContact O-N 3.41Å; L444-L446 VanDerWaalsContact C-N 3.31Å; L444-L446 PolarHBondContact O-N 2.87Å; L446-L448 PolarHBondContact O-N 2.75Å; L446-L450 WeakPolarHBondContact O-CD2 3.47Å; L446-H501 HydrophobicContact CD1-CB 4.17Å; L446-V502 HydrophobicContact CD1-CG2 3.56Å; L446-V502 HydrophobicContact CD2-CG2 4.04Å; L446-V502 HydrophobicContact CG-CG2 4.47Å; L446-M505 HydrophobicContact CB-CB 4.46Å; L446-M505 HydrophobicContact CD2-CB 3.86Å; L446-M505 HydrophobicContact CD2-CG 3.75Å; L446-M505 HydrophobicContact CD2-SD 4.27Å; L446-F533 HydrophobicContact CB-CE1 4.16Å; L446-F533 HydrophobicContact CD2-CE1 4.06Å; L446-F533 HydrophobicContact CD2-CZ 4.27Å; L446-F533 HydrophobicContact CG-CE1 4.04Å; L446-F557 HydrophobicContact CD2-CB 4.14Å; L446-F557 HydrophobicContact CD2-CD1 4.01Å; L446-F557 HydrophobicContact CD2-CG 4.17Å
447	S	77.9	Confident	77.4	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	0	176.2	80.7	0	0	0	0	113.9	W288 L443 L444 T445 L450	W288-S447 PolarHBondContact NE1-OG 3.01Å; L443-S447 PolarHBondContact O-N 3.02Å; L444-S447 WeakPolarHBondContact CA-OG 3.05Å; L444-S447 CarbonylContact O-C 3.5Å; L444-S447 PolarHBondContact O-N 3.49Å; L444-S447 PolarHBondContact O-OG 2.65Å; T445-S447 VanDerWaalsContact C-N 3.34Å; T445-S447 PolarHBondContact O-N 3.28Å; S447-L450 WeakPolarHBondContact O-CD1 3.48Å; S447-L450 WeakPolarHBondContact O-CG 3.45Å
448	L	79.9	Confident	77.8	Confident	10 Å²	10	38.2 Å²	38.2	5%	0.052	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.2	-15.3	179.3	-67.5	171.8	0	0	0	113.5	L244 L247 L281 I285 W288 L444 T445 L446 L450	L244-L448 HydrophobicContact CD2-CD1 4.26Å; L247-L448 HydrophobicContact CD1-CD1 4.01Å; L281-L448 HydrophobicContact CD1-CD1 3.93Å; I285-L448 HydrophobicContact CB-CD2 4.24Å; I285-L448 HydrophobicContact CG1-CD1 3.9Å; I285-L448 HydrophobicContact CG1-CD2 3.6Å; I285-L448 HydrophobicContact CG1-CG 4.4Å; W288-L448 HydrophobicContact CB-CD2 3.64Å; W288-L448 HydrophobicContact CD2-CD2 4.05Å; W288-L448 HydrophobicContact CE3-CD2 4.2Å; W288-L448 HydrophobicContact CG-CD2 3.83Å; L444-L448 WeakPolarHBondContact O-CB 3.42Å; L444-L448 WeakPolarHBondContact O-CD1 3.48Å; L444-L448 WeakPolarHBondContact O-CG 3.47Å; L444-L448 PolarHBondContact O-N 3.27Å; L444-L448 VanDerWaalsContact O-N 3.11Å; T445-L448 PolarHBondContact O-N 2.66Å; L446-L448 PolarHBondContact O-N 2.75Å; L448-L450 PolarHBondContact O-N 3.22Å
449	D	71.3	Confident	77.8	Confident	53 Å²	53	38.9 Å²	38.9	28%	0.283	19%	0.188	S	C	.	.	S	Bend	trans	-72.9	32.5	176.2	-72.2	-36.4	0	0	0	113.6	T445 H501 S565	T445-D449 PolarHBondContact O-N 2.89Å; D449-H501 IonicContact OD2-CE1 2.64Å; D449-H501 IonicContact OD2-CG 3.91Å; D449-H501 IonicContact OD2-ND1 3.74Å; D449-H501 PolarHBondContact OD2-ND1 3.09Å; D449-S565 PolarHBondContact O-OG 3.01Å
450	L	67.3	Low	77.9	Confident	13 Å²	13	41 Å²	41	7%	0.068	20%	0.199	C	C	.	.			trans	-104.3	138.9	-163.6	-45.6	-172.3	0	0	0	110.9	L446 S447 L448 P534 F535	L446-L450 WeakPolarHBondContact O-CD2 3.47Å; S447-L450 WeakPolarHBondContact O-CD1 3.48Å; S447-L450 WeakPolarHBondContact O-CG 3.45Å; L448-L450 PolarHBondContact O-N 3.22Å; L450-P534 HydrophobicContact CD1-CG 3.49Å; L450-P534 VanDerWaalsContact CD1-CG 3.49Å; L450-F535 HydrophobicContact CB-CZ 4.14Å; L450-F535 HydrophobicContact CD1-CE1 4.48Å; L450-F535 HydrophobicContact CD1-CE2 3.67Å; L450-F535 HydrophobicContact CD1-CZ 3.46Å; L450-F535 VanDerWaalsContact CD1-CZ 3.46Å; L450-F535 HydrophobicContact CD2-CE2 3.41Å; L450-F535 VanDerWaalsContact CD2-CE2 3.41Å; L450-F535 HydrophobicContact CD2-CZ 3.57Å; L450-F535 HydrophobicContact CG-CE2 4.08Å; L450-F535 HydrophobicContact CG-CZ 3.88Å
451	Y	69.6	Low	78.1	Confident	90 Å²	90	40.8 Å²	40.8	35%	0.353	20%	0.198	S	C	.	.			trans	-132.9	96.2	-177.8	-173.9	-103.6	0	0	0	113.1	T453 A490 C564 K566	Y451-T453 HydrophobicContact CE1-CG2 4.43Å; Y451-A490 HydrophobicContact CD2-CB 4.21Å; Y451-A490 HydrophobicContact CE2-CB 3.44Å; Y451-A490 VanDerWaalsContact CE2-CB 3.44Å; Y451-C564 CarbonylContact C-O 3.59Å; Y451-C564 WeakPolarHBondContact CA-O 3.48Å; Y451-C564 PolarHBondContact N-O 3.32Å; Y451-C564 VanDerWaalsContact O-O 3.08Å; Y451-K566 HydrophobicContact CD1-CD 4.48Å; Y451-K566 WeakPolarHBondContact O-CE 3.41Å
452	Y	71.9	Confident	78	Confident	24 Å²	24	44.7 Å²	44.7	9%	0.094	21%	0.212	C	C	.	.			trans	-99.4	153.3	163.6	-75.6	-88.8	0	0	0	110.8	Q287 L291 E456 I457 L460 F535	Q287-Y452 PolarHBondContact NE2-O 2.95Å; Q287-Y452 PolarHBondContact OE1-O 3.24Å; L291-Y452 HydrophobicContact CD1-CD2 3.42Å; L291-Y452 VanDerWaalsContact CD1-CD2 3.42Å; L291-Y452 HydrophobicContact CD1-CE2 3.54Å; L291-Y452 HydrophobicContact CD2-CD2 3.59Å; L291-Y452 HydrophobicContact CD2-CE2 3.4Å; L291-Y452 VanDerWaalsContact CD2-CE2 3.4Å; L291-Y452 HydrophobicContact CD2-CG 4.17Å; L291-Y452 HydrophobicContact CG-CD2 4.12Å; L291-Y452 HydrophobicContact CG-CE2 4.1Å; Y452-E456 WeakPolarHBondContact CA-OE2 3.48Å; Y452-E456 HydrophobicContact CD1-CB 3.77Å; Y452-E456 WeakPolarHBondContact CD1-OE2 3.42Å; Y452-I457 HydrophobicContact CG-CG1 4.26Å; Y452-L460 HydrophobicContact CE1-CD1 4.06Å; Y452-F535 AromaticContact CE2-CE1 3.64Å; Y452-F535 HydrophobicContact CE2-CE1 3.64Å; Y452-F535 HydrophobicContact CE2-CZ 4.35Å; Y452-F535 AromaticContact CZ-CE1 3.92Å; Y452-F535 WeakPolarHBondContact OH-CE1 3.45Å
453	T	80	Confident	77.7	Confident	44 Å²	44	45.8 Å²	45.8	27%	0.27	23%	0.23	S	C	.	.			trans	-82.8	150.6	160.2	51.2	0	0	0	0	109.5	Y451 D455 E456 I457	Y451-T453 HydrophobicContact CE1-CG2 4.43Å; T453-D455 PolarHBondContact O-N 2.92Å; T453-D455 VanDerWaalsContact O-N 3.15Å; T453-E456 PolarHBondContact N-OE2 3.06Å; T453-E456 WeakPolarHBondContact O-CB 3.49Å; T453-E456 PolarHBondContact O-N 2.8Å; T453-E456 VanDerWaalsContact OG1-CD 3.3Å; T453-E456 WeakPolarHBondContact OG1-CG 3.17Å; T453-E456 PolarHBondContact OG1-OE2 2.87Å; T453-I457 PolarHBondContact O-N 3.17Å
454	E	79	Confident	77.7	Confident	82 Å²	82	49.7 Å²	49.7	38%	0.383	24%	0.244	S	C	.	.	H	α-helix	trans	-57.8	-32.1	-178.8	-61.6	-53.3	129.7	0	0	112.5	Q287 H334 E456 I457 Y458	Q287-E454 PolarHBondContact NE2-OE1 3Å; H334-E454 IonicContact CE1-OE2 3.96Å; H334-E454 PolarHBondContact CE1-OE2 3.01Å; H334-E454 IonicContact ND1-OE2 2.65Å; H334-E454 IonicContact NE2-OE2 3.29Å; E454-E456 VanDerWaalsContact C-N 3.33Å; E454-E456 PolarHBondContact O-N 2.83Å; E454-I457 PolarHBondContact O-N 3.3Å; E454-Y458 WeakPolarHBondContact O-CB 3.29Å; E454-Y458 PolarHBondContact O-N 3.23Å
455	D	76.7	Confident	77.7	Confident	122 Å²	122	50 Å²	50	65%	0.652	25%	0.245	S	C	*	.	H	α-helix	trans	-57.5	-41.2	171.5	-55	-56.4	0	0	0	112.7	T453 Y458 E459	T453-D455 PolarHBondContact O-N 2.92Å; T453-D455 VanDerWaalsContact O-N 3.15Å; D455-Y458 PolarHBondContact O-N 3.14Å; D455-E459 WeakPolarHBondContact O-CB 3.49Å; D455-E459 WeakPolarHBondContact O-CG 3.12Å; D455-E459 PolarHBondContact O-N 2.95Å
456	E	79	Confident	77.6	Confident	70 Å²	70	52.4 Å²	52.4	33%	0.327	26%	0.262	S	S	.	.	H	α-helix	trans	-72.3	-37.2	-179.3	-68.3	165	156.6	0	0	111.4	Y452 T453 E454 Y458 L460 K566	Y452-E456 WeakPolarHBondContact CA-OE2 3.48Å; Y452-E456 HydrophobicContact CD1-CB 3.77Å; Y452-E456 WeakPolarHBondContact CD1-OE2 3.42Å; T453-E456 PolarHBondContact N-OE2 3.06Å; T453-E456 WeakPolarHBondContact O-CB 3.49Å; T453-E456 PolarHBondContact O-N 2.8Å; T453-E456 VanDerWaalsContact OG1-CD 3.3Å; T453-E456 WeakPolarHBondContact OG1-CG 3.17Å; T453-E456 PolarHBondContact OG1-OE2 2.87Å; E454-E456 VanDerWaalsContact C-N 3.33Å; E454-E456 PolarHBondContact O-N 2.83Å; E456-Y458 VanDerWaalsContact C-N 3.32Å; E456-L460 WeakPolarHBondContact O-CB 3.26Å; E456-L460 VanDerWaalsContact O-CG 3.22Å; E456-L460 WeakPolarHBondContact O-CG 3.4Å; E456-L460 PolarHBondContact O-N 3.16Å; E456-K566 WeakPolarHBondContact OE1-CE 3.49Å; E456-K566 IonicContact OE1-NZ 2.7Å; E456-K566 PolarHBondContact OE1-NZ 2.8Å; E456-K566 VanDerWaalsContact OE2-CE 3.32Å; E456-K566 WeakPolarHBondContact OE2-CE 3.27Å; E456-K566 IonicContact OE2-NZ 2.84Å; E456-K566 PolarHBondContact OE2-NZ 3.45Å
457	I	81.3	Confident	77.2	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-68.5	-36.1	174.3	-45.5	179.2	0	0	0	110.1	Q287 Q290 L291 L294 Y452 T453 E454 S461	Q287-I457 HydrophobicContact CB-CD1 4.29Å; Q287-I457 HydrophobicContact CG-CD1 3.81Å; Q290-I457 HydrophobicContact CB-CG2 4.09Å; L291-I457 HydrophobicContact CD2-CG1 4.36Å; L294-I457 HydrophobicContact CD1-CG2 3.58Å; Y452-I457 HydrophobicContact CG-CG1 4.26Å; T453-I457 PolarHBondContact O-N 3.17Å; E454-I457 PolarHBondContact O-N 3.3Å; I457-S461 PolarHBondContact O-N 2.97Å
458	Y	83.8	Confident	76.2	Confident	74 Å²	74	64.3 Å²	64.3	29%	0.29	32%	0.319	S	S	.	.	H	α-helix	trans	-67.8	-44.5	175	-170.3	-88.8	0	0	0	112.5	E454 D455 E456 S461 Y462	E454-Y458 WeakPolarHBondContact O-CB 3.29Å; E454-Y458 PolarHBondContact O-N 3.23Å; D455-Y458 PolarHBondContact O-N 3.14Å; E456-Y458 VanDerWaalsContact C-N 3.32Å; Y458-S461 CarbonylContact O-C 3.56Å; Y458-S461 WeakPolarHBondContact O-CB 3.45Å; Y458-S461 PolarHBondContact O-N 3.27Å; Y458-S461 VanDerWaalsContact O-N 3.17Å; Y458-Y462 PolarHBondContact O-N 3.07Å
459	E	77.2	Confident	74.6	Confident	114 Å²	114	70.2 Å²	70.2	53%	0.533	36%	0.36	S	S	.	.	H	α-helix	trans	-66.2	-38	175.3	-75.6	-58.6	129.8	0	0	112	D455 S461 Y462 A463	D455-E459 WeakPolarHBondContact O-CB 3.49Å; D455-E459 WeakPolarHBondContact O-CG 3.12Å; D455-E459 PolarHBondContact O-N 2.95Å; E459-S461 VanDerWaalsContact C-N 3.3Å; E459-S461 PolarHBondContact O-N 2.7Å; E459-Y462 PolarHBondContact O-N 2.77Å; E459-A463 WeakPolarHBondContact O-CB 3.49Å; E459-A463 PolarHBondContact O-N 2.93Å
460	L	78.8	Confident	73.2	Confident	53 Å²	53	77.4 Å²	77.4	28%	0.277	39%	0.388	S	S	.	.	H	α-helix	trans	-59	-41.3	169.9	-77.3	170.3	0	0	0	111.6	L291 L294 Y452 E456 R464	L291-L460 HydrophobicContact CD2-CD1 4.2Å; L294-L460 HydrophobicContact CD1-CB 4.22Å; Y452-L460 HydrophobicContact CE1-CD1 4.06Å; E456-L460 WeakPolarHBondContact O-CB 3.26Å; E456-L460 VanDerWaalsContact O-CG 3.22Å; E456-L460 WeakPolarHBondContact O-CG 3.4Å; E456-L460 PolarHBondContact O-N 3.16Å; L460-R464 VanDerWaalsContact O-CG 3.26Å; L460-R464 WeakPolarHBondContact O-CG 3.44Å; L460-R464 PolarHBondContact O-N 3.5Å
461	S	82.8	Confident	71.8	Confident	0 Å²	0	80.2 Å²	80.2	0%	0	41%	0.414	C	S	.	.	H	α-helix	trans	-65.1	-43.3	173.1	178.9	0	0	0	0	112.8	S336 R339 L340 I457 Y458 E459 A463 R464 E465	S336-S461 WeakPolarHBondContact O-CB 3.35Å; S336-S461 PolarHBondContact O-OG 3.26Å; R339-S461 VanDerWaalsContact CD-OG 3.27Å; R339-S461 WeakPolarHBondContact CD-OG 3.42Å; R339-S461 WeakPolarHBondContact CG-OG 3.38Å; R339-S461 VanDerWaalsContact NH1-C 3.26Å; R339-S461 PolarHBondContact NH1-O 3.17Å; R339-S461 PolarHBondContact NH1-OG 3.08Å; L340-S461 WeakPolarHBondContact CD2-OG 3.41Å; I457-S461 PolarHBondContact O-N 2.97Å; Y458-S461 CarbonylContact O-C 3.56Å; Y458-S461 WeakPolarHBondContact O-CB 3.45Å; Y458-S461 PolarHBondContact O-N 3.27Å; Y458-S461 VanDerWaalsContact O-N 3.17Å; E459-S461 VanDerWaalsContact C-N 3.3Å; E459-S461 PolarHBondContact O-N 2.7Å; S461-A463 VanDerWaalsContact C-N 3.31Å; S461-A463 PolarHBondContact O-N 3.43Å; S461-R464 PolarHBondContact O-N 3.24Å; S461-R464 VanDerWaalsContact O-N 3.08Å; S461-E465 PolarHBondContact O-N 2.92Å
462	Y	78.6	Confident	70.3	Confident	88 Å²	88	81.2 Å²	81.2	35%	0.345	43%	0.431	S	S	.	.	H	α-helix	trans	-63.7	-37.2	178.3	-167.8	-98.3	0	0	0	112	Y458 E459 R464 E465 P466 K467	Y458-Y462 PolarHBondContact O-N 3.07Å; E459-Y462 PolarHBondContact O-N 2.77Å; Y462-R464 VanDerWaalsContact C-N 3.3Å; Y462-R464 PolarHBondContact O-N 3.31Å; Y462-E465 CarbonylContact O-C 3.44Å; Y462-P466 WeakPolarHBondContact O-CA 3.47Å; Y462-K467 HydrophobicContact CE2-CB 3.96Å; Y462-K467 HydrophobicContact CE2-CD 4.18Å; Y462-K467 HydrophobicContact CE2-CG 3.85Å
463	A	74.3	Confident	68.7	Low	73 Å²	73	86.3 Å²	86.3	60%	0.603	47%	0.467	S	S	*	.	H	α-helix	trans	-71.1	-18.8	173.2	0	0	0	0	0	114.2	E459 S461	E459-A463 WeakPolarHBondContact O-CB 3.49Å; E459-A463 PolarHBondContact O-N 2.93Å; S461-A463 VanDerWaalsContact C-N 3.31Å; S461-A463 PolarHBondContact O-N 3.43Å
464	R	79.1	Confident	66.7	Low	92 Å²	92	88.7 Å²	88.7	35%	0.347	49%	0.492	S	S	.	.	H	α-helix	trans	-88.5	-40.2	174.6	-70.8	-71	-174.5	-90.5	-7.3	113.1	L294 L460 S461 Y462	L294-R464 HydrophobicContact CD2-CG 4.2Å; L294-R464 PolarHBondContact O-NE 2.99Å; L294-R464 PolarHBondContact O-NH2 3.22Å; L460-R464 VanDerWaalsContact O-CG 3.26Å; L460-R464 WeakPolarHBondContact O-CG 3.44Å; L460-R464 PolarHBondContact O-N 3.5Å; S461-R464 PolarHBondContact O-N 3.24Å; S461-R464 VanDerWaalsContact O-N 3.08Å; Y462-R464 VanDerWaalsContact C-N 3.3Å; Y462-R464 PolarHBondContact O-N 3.31Å
465	E	81.6	Confident	64.6	Low	12 Å²	12	91 Å²	91	6%	0.056	51%	0.511	C	S	.	.	S	Bend	trans	-138.6	92.4	176.1	-69.6	179.1	-148.6	0	0	109	R302 R339 L340 K341 D342 T343 S461 Y462	R302-E465 IonicContact CZ-OE1 2.71Å; R302-E465 IonicContact NE-OE1 3.76Å; R302-E465 IonicContact NH2-OE1 3.61Å; R302-E465 PolarHBondContact NH2-OE1 2.87Å; R339-E465 VanDerWaalsContact CZ-O 3.31Å; R339-E465 PolarHBondContact NH1-O 3.27Å; R339-E465 PolarHBondContact NH2-O 3.09Å; L340-E465 WeakPolarHBondContact CA-OE2 3.45Å; L340-E465 HydrophobicContact CD2-CB 3.86Å; L340-E465 HydrophobicContact CD2-CG 3.91Å; K341-E465 PolarHBondContact N-OE2 3.45Å; D342-E465 HydrophobicContact CB-CG 4.45Å; D342-E465 PolarHBondContact N-OE2 3.27Å; T343-E465 WeakPolarHBondContact CB-OE1 3.26Å; T343-E465 PolarHBondContact N-OE1 3.38Å; T343-E465 VanDerWaalsContact N-OE1 3.08Å; T343-E465 PolarHBondContact OG1-OE1 3.44Å; S461-E465 PolarHBondContact O-N 2.92Å; Y462-E465 CarbonylContact O-C 3.44Å
466	P	79.3	Confident	62.6	Low	83 Å²	83	91.3 Å²	91.3	54%	0.539	52%	0.52	S	S	.	.			trans	-63.1	157	177.4	-24.2	34.9	0	0	0	112.8	Y462 N468	Y462-P466 WeakPolarHBondContact O-CA 3.47Å; P466-N468 PolarHBondContact O-N 3.36Å; P466-N468 VanDerWaalsContact O-N 3.09Å
467	K	71.8	Confident	60.6	Low	131 Å²	131	92.7 Å²	92.7	57%	0.57	54%	0.537	S	S	*	.			trans	-68.6	108.9	174.9	-82	176.7	-178	174.3	0	110.6	Y462 C469	Y462-K467 HydrophobicContact CE2-CB 3.96Å; Y462-K467 HydrophobicContact CE2-CD 4.18Å; Y462-K467 HydrophobicContact CE2-CG 3.85Å; K467-C469 PolarHBondContact O-N 3.26Å
468	N	57.2	Low	58.6	Low	122 Å²	122	101.1 Å²	101.1	65%	0.652	57%	0.574	S	S	*	*			trans	-59.5	117.1	171.4	-95.7	-44.6	0	0	0	111.4	P466 K470 A471	P466-N468 PolarHBondContact O-N 3.36Å; P466-N468 VanDerWaalsContact O-N 3.09Å; N468-K470 PolarHBondContact O-N 3.04Å; N468-A471 PolarHBondContact O-N 2.93Å
469	C	46.9	Very low	56.2	Low	135 Å²	135	103 Å²	103	91%	0.912	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	16.5	-179	-55.8	0	0	0	0	115.5	K467	K467-C469 PolarHBondContact O-N 3.26Å
470	K	40.9	Very low	54.7	Low	203 Å²	203	101.4 Å²	101.4	88%	0.883	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.4	0	179.8	-67.5	-172.6	175.9	-177.2	0	113.7	N468	N468-K470 PolarHBondContact O-N 3.04Å
471	A	38.9	Very low	53.2	Low	73 Å²	73	99.5 Å²	99.5	60%	0.603	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-83.2	132.1	175.9	0	0	0	0	0	110.8	N468	N468-A471 PolarHBondContact O-N 2.93Å
472	P	37.3	Very low	51.4	Low	111 Å²	111	106.2 Å²	106.2	72%	0.721	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-66	156.6	169.2	29.4	-34.3	0	0	0	110.7	A474	P472-A474 PolarHBondContact O-N 3.04Å
473	P	37.9	Very low	49.9	Very low	130 Å²	130	103.7 Å²	103.7	84%	0.844	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-61.2	128.4	177.9	26	-34.1	0	0	0	110.5	T475	P473-T475 PolarHBondContact O-N 3.36Å
474	A	37.7	Very low	48.5	Very low	95 Å²	95	102.5 Å²	102.5	79%	0.785	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-67.7	133.3	-178.6	0	0	0	0	0	111.3	P472	P472-A474 PolarHBondContact O-N 3.04Å
475	T	36.2	Very low	47	Very low	129 Å²	129	101.1 Å²	101.1	79%	0.791	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-57.3	142.5	164.4	45.7	0	0	0	0	110.2	P473 S477	P473-T475 PolarHBondContact O-N 3.36Å; T475-S477 PolarHBondContact O-N 3.28Å; T475-S477 VanDerWaalsContact O-N 3.09Å
476	P	34.5	Very low	45.3	Very low	130 Å²	130	101.1 Å²	101.1	84%	0.844	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-62.2	116.3	-179.1	25.8	-34	0	0	0	110.6
477	S	37	Very low	43.7	Very low	98 Å²	98	102.2 Å²	102.2	69%	0.685	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-62.9	159.7	162.6	51.5	0	0	0	0	109.9	T475	T475-S477 PolarHBondContact O-N 3.28Å; T475-S477 VanDerWaalsContact O-N 3.09Å
478	K	39.7	Very low	42.6	Very low	177 Å²	177	99.5 Å²	99.5	77%	0.77	61%	0.605	S	S	*	*	S	Bend	trans	-45.7	146.3	171.7	-68.9	-177.9	177.7	-177.7	0	110.8
479	P	33.1	Very low	42.3	Very low	113 Å²	113	95 Å²	95	73%	0.734	58%	0.582	S	S	*	*			trans	-53.9	133.3	179.7	22.9	-34	0	0	0	110.2
480	P	46	Very low	42.5	Very low	82 Å²	82	90.7 Å²	90.7	53%	0.532	56%	0.556	S	S	.	*			trans	-65	155.3	-179.1	28.2	-34.9	0	0	0	110.7	Y482	P480-Y482 VanDerWaalsContact C-N 3.32Å; P480-Y482 PolarHBondContact O-N 2.67Å
481	V	47.6	Very low	43	Very low	13 Å²	13	83.9 Å²	83.9	8%	0.079	53%	0.532	C	S	.	.			trans	-66.9	97	165.7	165.7	0	0	0	0	107.6	M326 T359 L362 V483	M326-V481 HydrophobicContact CE-CG1 3.74Å; M326-V481 HydrophobicContact SD-CG1 3.59Å; M326-V481 VanDerWaalsContact SD-CG1 3.59Å; T359-V481 HydrophobicContact CG2-CB 4.49Å; T359-V481 HydrophobicContact CG2-CG2 3.61Å; T359-V481 WeakPolarHBondContact O-CG2 3.49Å; L362-V481 HydrophobicContact CB-CG1 4.3Å; L362-V481 HydrophobicContact CB-CG2 4.44Å; V481-V483 HydrophobicContact CG1-CG2 4.49Å; V481-V483 PolarHBondContact O-N 3.21Å
482	Y	43.3	Very low	43.9	Very low	141 Å²	141	90 Å²	90	55%	0.553	55%	0.545	S	S	*	.			trans	-86.7	108.2	-172.8	-175.1	-123.4	0	0	0	109.8	P480 D484	P480-Y482 VanDerWaalsContact C-N 3.32Å; P480-Y482 PolarHBondContact O-N 2.67Å; Y482-D484 HydrophobicContact CD1-CB 4.27Å; Y482-D484 HydrophobicContact CE1-CB 3.62Å; Y482-D484 HydrophobicContact CE2-CB 4.01Å; Y482-D484 VanDerWaalsContact CZ-CB 3.46Å; Y482-D484 PolarHBondContact O-N 3.45Å; Y482-D484 PolarHBondContact OH-OD2 3.36Å
483	V	46.7	Very low	45	Very low	34 Å²	34	86.2 Å²	86.2	21%	0.206	52%	0.521	C	S	.	.			trans	-95.6	72.3	173.4	-173.6	0	0	0	0	108.7	M326 V481	M326-V483 HydrophobicContact CE-CG2 4.01Å; M326-V483 HydrophobicContact CG-CG2 3.86Å; M326-V483 WeakPolarHBondContact O-CG2 3.26Å; M326-V483 HydrophobicContact SD-CG2 4.09Å; V481-V483 HydrophobicContact CG1-CG2 4.49Å; V481-V483 PolarHBondContact O-N 3.21Å
484	D	45.5	Very low	46.3	Very low	48 Å²	48	83.2 Å²	83.2	26%	0.257	50%	0.497	S	S	.	.			trans	-130.1	111.7	157.1	-179.5	21.5	0	0	0	108.7	Y482 A486 S487	Y482-D484 HydrophobicContact CD1-CB 4.27Å; Y482-D484 HydrophobicContact CE1-CB 3.62Å; Y482-D484 HydrophobicContact CE2-CB 4.01Å; Y482-D484 VanDerWaalsContact CZ-CB 3.46Å; Y482-D484 PolarHBondContact O-N 3.45Å; Y482-D484 PolarHBondContact OH-OD2 3.36Å; D484-A486 PolarHBondContact OD1-N 3.42Å; D484-S487 PolarHBondContact OD1-N 3.19Å; D484-S487 WeakPolarHBondContact OD2-CB 3.36Å; D484-S487 PolarHBondContact OD2-OG 2.66Å
485	W	47.9	Very low	47.7	Very low	63 Å²	63	81.2 Å²	81.2	24%	0.239	48%	0.476	C	S	.	.	S	Bend	trans	-119.8	4.5	177.7	55.2	-73.4	0	0	0	111.6	M269 I279 C282 L390	M269-W485 HydrophobicContact CE-CE3 4.29Å; M269-W485 HydrophobicContact SD-CZ3 4.21Å; I279-W485 HydrophobicContact CB-CH2 3.84Å; I279-W485 HydrophobicContact CB-CZ2 3.97Å; I279-W485 HydrophobicContact CB-CZ3 4.33Å; I279-W485 HydrophobicContact CD1-CH2 4.36Å; I279-W485 HydrophobicContact CD1-CZ3 4.03Å; I279-W485 HydrophobicContact CG1-CH2 3.58Å; I279-W485 HydrophobicContact CG1-CZ2 4.23Å; I279-W485 HydrophobicContact CG1-CZ3 3.75Å; I279-W485 HydrophobicContact CG2-CD2 4.13Å; I279-W485 HydrophobicContact CG2-CE3 4.26Å; I279-W485 HydrophobicContact CG2-CH2 3.83Å; I279-W485 HydrophobicContact CG2-CZ2 3.62Å; I279-W485 HydrophobicContact CG2-CZ3 4.12Å; C282-W485 HydrophobicContact CB-CZ2 4.12Å; L390-W485 HydrophobicContact CD1-CE3 4.37Å; L390-W485 HydrophobicContact CD1-CZ3 3.78Å
486	A	45.6	Very low	49.4	Very low	13 Å²	13	84 Å²	84	11%	0.107	47%	0.472	C	S	.	.			trans	-168.2	44.1	-169.4	0	0	0	0	0	114.2	M269 I279 D484 G488 V489	M269-A486 HydrophobicContact CE-CB 3.67Å; I279-A486 HydrophobicContact CD1-CB 3.91Å; I279-A486 HydrophobicContact CG2-CB 3.63Å; D484-A486 PolarHBondContact OD1-N 3.42Å; A486-G488 PolarHBondContact O-N 2.9Å; A486-V489 HydrophobicContact CB-CB 4.22Å; A486-V489 HydrophobicContact CB-CG2 4.02Å; A486-V489 PolarHBondContact O-N 3.42Å
487	S	45.4	Very low	51.5	Low	105 Å²	105	80.5 Å²	80.5	73%	0.734	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	112.4	173.9	23.2	0	0	0	0	110.4	D484	D484-S487 PolarHBondContact OD1-N 3.19Å; D484-S487 WeakPolarHBondContact OD2-CB 3.36Å; D484-S487 PolarHBondContact OD2-OG 2.66Å
488	G	49.3	Very low	53.3	Low	75 Å²	75	76.1 Å²	76.1	77%	0.773	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	119.3	-18.8	-173.2	0	0	0	0	0	115	A486 A490	A486-G488 PolarHBondContact O-N 2.9Å; G488-A490 PolarHBondContact O-N 3.46Å
489	V	50.9	Low	55	Low	27 Å²	27	70.4 Å²	70.4	16%	0.164	40%	0.4	C	S	.	.			trans	-87.6	58.4	171.8	-165.9	0	0	0	0	110.6	M269 E276 I279 A486 P491	M269-V489 HydrophobicContact CB-CG2 4.4Å; E276-V489 HydrophobicContact CB-CG1 3.88Å; E276-V489 HydrophobicContact CG-CG1 3.79Å; I279-V489 HydrophobicContact CD1-CB 4.02Å; I279-V489 HydrophobicContact CD1-CG1 3.88Å; I279-V489 HydrophobicContact CD1-CG2 4.06Å; A486-V489 HydrophobicContact CB-CB 4.22Å; A486-V489 HydrophobicContact CB-CG2 4.02Å; A486-V489 PolarHBondContact O-N 3.42Å; V489-P491 VanDerWaalsContact O-CD 3.29Å; V489-P491 WeakPolarHBondContact O-CD 3.12Å
490	A	51.8	Low	57.3	Low	44 Å²	44	70.6 Å²	70.6	36%	0.364	39%	0.39	S	S	.	.			trans	-83.3	103.8	161	0	0	0	0	0	107.3	Y451 G488 K492	Y451-A490 HydrophobicContact CD2-CB 4.21Å; Y451-A490 HydrophobicContact CE2-CB 3.44Å; Y451-A490 VanDerWaalsContact CE2-CB 3.44Å; G488-A490 PolarHBondContact O-N 3.46Å; A490-K492 PolarHBondContact O-N 3.15Å
491	P	51.3	Low	58.9	Low	60 Å²	60	68.1 Å²	68.1	39%	0.39	37%	0.371	S	S	.	.			trans	-61.9	130.7	175.3	29.5	-36.5	0	0	0	108	A280 V489 P493	A280-P491 HydrophobicContact CB-CG 3.6Å; V489-P491 VanDerWaalsContact O-CD 3.29Å; V489-P491 WeakPolarHBondContact O-CD 3.12Å; P491-P493 WeakPolarHBondContact O-CD 3.39Å; P491-P493 VanDerWaalsContact O-N 3.09Å
492	K	56.3	Low	60.5	Low	201 Å²	201	67.5 Å²	67.5	87%	0.874	37%	0.367	S	S	*	.			trans	-65.3	112.3	168.5	-68.7	-179.9	-176.1	174.6	0	106.7	A490 D494	A490-K492 PolarHBondContact O-N 3.15Å; K492-D494 PolarHBondContact O-N 2.83Å
493	P	61	Low	62.4	Low	32 Å²	32	66 Å²	66	21%	0.208	37%	0.365	C	S	.	.			trans	-67.1	125.5	-168.8	21.3	-27.9	0	0	0	110.1	P491 P495 I498 L567	P491-P493 WeakPolarHBondContact O-CD 3.39Å; P491-P493 VanDerWaalsContact O-N 3.09Å; P493-P495 WeakPolarHBondContact O-CD 3.06Å; P493-I498 HydrophobicContact CB-CD1 3.77Å; P493-L567 HydrophobicContact CB-CD1 4.27Å; P493-L567 HydrophobicContact CG-CD1 3.99Å; P493-L567 HydrophobicContact CG-CD2 4.15Å; P493-L567 HydrophobicContact CG-CG 3.94Å; P493-L567 WeakPolarHBondContact O-CD1 3.39Å; P493-L567 WeakPolarHBondContact O-CD2 3.47Å
494	D	65.6	Low	64.1	Low	67 Å²	67	69 Å²	69	36%	0.358	37%	0.372	S	S	.	.			trans	-71.3	122.8	-176.4	160.5	39.3	0	0	0	110.9	K492 R496 T497 I498	K492-D494 PolarHBondContact O-N 2.83Å; D494-R496 PolarHBondContact O-N 2.85Å; D494-R496 VanDerWaalsContact O-N 3.13Å; D494-R496 WeakPolarHBondContact OD1-CB 3.49Å; D494-R496 PolarHBondContact OD1-N 2.78Å; D494-R496 WeakPolarHBondContact OD2-CB 3.22Å; D494-T497 PolarHBondContact O-N 3.24Å; D494-T497 VanDerWaalsContact O-N 3.1Å; D494-T497 VanDerWaalsContact OD2-CB 3.26Å; D494-T497 WeakPolarHBondContact OD2-CB 3.41Å; D494-T497 PolarHBondContact OD2-N 3.42Å; D494-T497 PolarHBondContact OD2-OG1 3.35Å; D494-I498 PolarHBondContact O-N 2.82Å
495	P	67.8	Low	65.9	Low	53 Å²	53	66.7 Å²	66.7	34%	0.344	36%	0.36	S	S	.	.	H	α-helix	trans	-51.4	-35.2	175.6	-28.2	35.4	0	0	0	114.1	P493 S499 L569	P493-P495 WeakPolarHBondContact O-CD 3.06Å; P495-S499 VanDerWaalsContact O-CB 3.29Å; P495-S499 WeakPolarHBondContact O-CB 3.34Å; P495-S499 PolarHBondContact O-N 3.19Å; P495-S499 VanDerWaalsContact O-N 3.08Å; P495-L569 HydrophobicContact CB-CD1 3.7Å; P495-L569 HydrophobicContact CB-CD2 4.16Å; P495-L569 HydrophobicContact CG-CD1 3.91Å; P495-L569 HydrophobicContact CG-CD2 4.07Å; P495-L569 HydrophobicContact CG-CG 4.47Å
496	R	72.1	Confident	67.6	Low	187 Å²	187	63.7 Å²	63.7	71%	0.706	35%	0.349	S	S	*	.	H	α-helix	trans	-74	-40.1	-178.4	-55.6	175.9	174.1	-166.8	-2.3	111	D494 K500	D494-R496 PolarHBondContact O-N 2.85Å; D494-R496 VanDerWaalsContact O-N 3.13Å; D494-R496 WeakPolarHBondContact OD1-CB 3.49Å; D494-R496 PolarHBondContact OD1-N 2.78Å; D494-R496 WeakPolarHBondContact OD2-CB 3.22Å; R496-K500 VanDerWaalsContact O-CB 3.32Å; R496-K500 WeakPolarHBondContact O-CB 3.45Å; R496-K500 PolarHBondContact O-N 3.19Å
497	T	77.4	Confident	69.4	Low	58 Å²	58	66.1 Å²	66.1	36%	0.356	36%	0.36	S	S	.	.	H	α-helix	trans	-65	-48.2	175.9	-66.1	0	0	0	0	111.3	D494 K500 H501	D494-T497 PolarHBondContact O-N 3.24Å; D494-T497 VanDerWaalsContact O-N 3.1Å; D494-T497 VanDerWaalsContact OD2-CB 3.26Å; D494-T497 WeakPolarHBondContact OD2-CB 3.41Å; D494-T497 PolarHBondContact OD2-N 3.42Å; D494-T497 PolarHBondContact OD2-OG1 3.35Å; T497-K500 WeakPolarHBondContact O-CB 3.26Å; T497-K500 PolarHBondContact O-N 3.01Å; T497-H501 VanDerWaalsContact CG2-CE1 3.45Å; T497-H501 WeakPolarHBondContact CG2-CE1 3.16Å; T497-H501 PolarHBondContact O-CD2 2.85Å; T497-H501 VanDerWaalsContact O-CG 3.28Å; T497-H501 PolarHBondContact O-N 3.41Å
498	I	74.1	Confident	71.3	Confident	6 Å²	6	61.4 Å²	61.4	3%	0.031	33%	0.327	C	S	.	.	H	α-helix	trans	-60.6	-48.1	176	-76.8	-179	0	0	0	111.5	P493 D494 K500 H501 V502 S565 L567	P493-I498 HydrophobicContact CB-CD1 3.77Å; D494-I498 PolarHBondContact O-N 2.82Å; I498-K500 PolarHBondContact O-N 2.88Å; I498-H501 WeakPolarHBondContact O-CA 3.45Å; I498-H501 PolarHBondContact O-N 3.11Å; I498-V502 HydrophobicContact CG2-CG2 4.34Å; I498-V502 PolarHBondContact O-N 3.36Å; I498-S565 WeakPolarHBondContact CD1-OG 3.35Å; I498-L567 HydrophobicContact CD1-CD1 3.91Å
499	S	75.8	Confident	72.8	Confident	57 Å²	57	57.9 Å²	57.9	40%	0.399	29%	0.29	S	S	.	.	H	α-helix	trans	-54.9	-42.2	176.5	178.1	0	0	0	0	112	P495 H501 V502 Q503	P495-S499 VanDerWaalsContact O-CB 3.29Å; P495-S499 WeakPolarHBondContact O-CB 3.34Å; P495-S499 PolarHBondContact O-N 3.19Å; P495-S499 VanDerWaalsContact O-N 3.08Å; S499-H501 VanDerWaalsContact C-N 3.33Å; S499-H501 PolarHBondContact O-N 3.45Å; S499-V502 PolarHBondContact O-N 2.87Å; S499-Q503 WeakPolarHBondContact O-CB 3.46Å; S499-Q503 PolarHBondContact O-N 2.63Å
500	K	81.5	Confident	74.2	Confident	117 Å²	117	57.5 Å²	57.5	51%	0.509	29%	0.287	S	S	.	.	H	α-helix	trans	-68.8	-26.4	176.1	-163.9	170.7	-163.5	162.5	0	113.7	R496 T497 I498 R504	R496-K500 VanDerWaalsContact O-CB 3.32Å; R496-K500 WeakPolarHBondContact O-CB 3.45Å; R496-K500 PolarHBondContact O-N 3.19Å; T497-K500 WeakPolarHBondContact O-CB 3.26Å; T497-K500 PolarHBondContact O-N 3.01Å; I498-K500 PolarHBondContact O-N 2.88Å; K500-R504 WeakPolarHBondContact O-CD 3.36Å; K500-R504 VanDerWaalsContact O-CG 3.25Å; K500-R504 WeakPolarHBondContact O-CG 3.34Å; K500-R504 PolarHBondContact O-N 3.07Å
501	H	80.8	Confident	75.6	Confident	30 Å²	30	62.2 Å²	62.2	14%	0.139	30%	0.299	C	S	.	.	H	α-helix	trans	-80.3	-42.7	175	-67.5	177	0	0	0	111.4	T445 L446 D449 T497 I498 S499 Q503 R504 M505	T445-H501 VanDerWaalsContact CG2-CE1 3.49Å; T445-H501 WeakPolarHBondContact CG2-CE1 3.36Å; T445-H501 WeakPolarHBondContact CG2-ND1 3.47Å; L446-H501 HydrophobicContact CD1-CB 4.17Å; D449-H501 IonicContact OD2-CE1 2.64Å; D449-H501 IonicContact OD2-CG 3.91Å; D449-H501 IonicContact OD2-ND1 3.74Å; D449-H501 PolarHBondContact OD2-ND1 3.09Å; T497-H501 VanDerWaalsContact CG2-CE1 3.45Å; T497-H501 WeakPolarHBondContact CG2-CE1 3.16Å; T497-H501 PolarHBondContact O-CD2 2.85Å; T497-H501 VanDerWaalsContact O-CG 3.28Å; T497-H501 PolarHBondContact O-N 3.41Å; I498-H501 WeakPolarHBondContact O-CA 3.45Å; I498-H501 PolarHBondContact O-N 3.11Å; S499-H501 VanDerWaalsContact C-N 3.33Å; S499-H501 PolarHBondContact O-N 3.45Å; H501-Q503 PolarHBondContact O-N 3.29Å; H501-R504 PolarHBondContact O-N 3.18Å; H501-M505 WeakPolarHBondContact O-CB 3.45Å; H501-M505 PolarHBondContact O-N 3.13Å
502	V	80.8	Confident	76.8	Confident	0 Å²	0	62 Å²	62	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-57.9	-49	171.3	176.2	0	0	0	0	110.9	L446 I498 S499 R504 M505 V506 T554 F557 M558	L446-V502 HydrophobicContact CD1-CG2 3.56Å; L446-V502 HydrophobicContact CD2-CG2 4.04Å; L446-V502 HydrophobicContact CG-CG2 4.47Å; I498-V502 HydrophobicContact CG2-CG2 4.34Å; I498-V502 PolarHBondContact O-N 3.36Å; S499-V502 PolarHBondContact O-N 2.87Å; V502-R504 PolarHBondContact O-N 3.33Å; V502-M505 PolarHBondContact O-N 2.83Å; V502-V506 HydrophobicContact CG1-CG2 4.24Å; V502-V506 WeakPolarHBondContact O-CG2 3.12Å; V502-V506 PolarHBondContact O-N 2.71Å; V502-T554 HydrophobicContact CG1-CG2 4.27Å; V502-F557 HydrophobicContact CG1-CB 3.8Å; V502-F557 HydrophobicContact CG2-CB 4.21Å; V502-M558 HydrophobicContact CB-SD 3.99Å; V502-M558 HydrophobicContact CG1-CG 4.12Å; V502-M558 HydrophobicContact CG1-SD 4.19Å; V502-M558 HydrophobicContact CG2-SD 3.79Å
503	Q	82.3	Confident	77.9	Confident	108 Å²	108	54.7 Å²	54.7	51%	0.505	26%	0.262	S	S	.	.	H	α-helix	trans	-55.7	-49.3	179.1	-175	-179.7	6.3	0	0	112.1	S499 H501 M505 V506 D507	S499-Q503 WeakPolarHBondContact O-CB 3.46Å; S499-Q503 PolarHBondContact O-N 2.63Å; H501-Q503 PolarHBondContact O-N 3.29Å; Q503-M505 PolarHBondContact O-N 2.91Å; Q503-V506 PolarHBondContact O-N 3.11Å; Q503-D507 VanDerWaalsContact O-CG 3.27Å; Q503-D507 PolarHBondContact O-N 3.26Å
504	R	82.9	Confident	78.7	Confident	97 Å²	97	54.4 Å²	54.4	37%	0.366	26%	0.258	S	S	.	.	H	α-helix	trans	-64.2	-38.4	178.4	-74.8	170.5	176.5	159.3	-4.5	113.4	H442 K500 H501 V502 S508	H442-R504 HydrophobicContact CB-CB 4.33Å; H442-R504 PolarHBondContact ND1-O 2.79Å; K500-R504 WeakPolarHBondContact O-CD 3.36Å; K500-R504 VanDerWaalsContact O-CG 3.25Å; K500-R504 WeakPolarHBondContact O-CG 3.34Å; K500-R504 PolarHBondContact O-N 3.07Å; H501-R504 PolarHBondContact O-N 3.18Å; V502-R504 PolarHBondContact O-N 3.33Å; R504-S508 WeakPolarHBondContact O-CB 3.27Å; R504-S508 PolarHBondContact O-N 3.1Å; R504-S508 PolarHBondContact O-OG 2.95Å
505	M	83.7	Confident	79	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-64.2	-46.4	176.3	177.7	-79.9	-175.9	0	0	110	L446 H501 V502 Q503 S508 V509 I529 F533 F557	L446-M505 HydrophobicContact CB-CB 4.46Å; L446-M505 HydrophobicContact CD2-CB 3.86Å; L446-M505 HydrophobicContact CD2-CG 3.75Å; L446-M505 HydrophobicContact CD2-SD 4.27Å; H501-M505 WeakPolarHBondContact O-CB 3.45Å; H501-M505 PolarHBondContact O-N 3.13Å; V502-M505 PolarHBondContact O-N 2.83Å; Q503-M505 PolarHBondContact O-N 2.91Å; M505-S508 CarbonylContact O-C 3.55Å; M505-S508 PolarHBondContact O-N 3.28Å; M505-V509 HydrophobicContact CE-CG2 3.69Å; M505-V509 WeakPolarHBondContact O-CG2 3.43Å; M505-V509 PolarHBondContact O-N 3.15Å; M505-V509 HydrophobicContact SD-CG2 3.85Å; M505-I529 HydrophobicContact CE-CG2 3.82Å; M505-F533 HydrophobicContact CE-CE2 3.56Å; M505-F533 HydrophobicContact CE-CZ 3.61Å; M505-F533 HydrophobicContact CG-CZ 4.37Å; M505-F557 HydrophobicContact CE-CD1 4.35Å; M505-F557 HydrophobicContact CE-CD2 3.87Å; M505-F557 HydrophobicContact CE-CE1 3.9Å; M505-F557 HydrophobicContact CE-CE2 3.37Å; M505-F557 HydrophobicContact CE-CG 4.36Å; M505-F557 HydrophobicContact CE-CZ 3.4Å; M505-F557 HydrophobicContact SD-CD2 3.89Å; M505-F557 HydrophobicContact SD-CE2 3.98Å; M505-F557 HydrophobicContact SD-CG 4.32Å; M505-F557 HydrophobicContact SD-CZ 4.47Å
506	V	83.3	Confident	79.2	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-62.6	-44.3	176.5	172.5	0	0	0	0	111.3	V502 Q503 S508 V509 F510 R550 I553	V502-V506 HydrophobicContact CG1-CG2 4.24Å; V502-V506 WeakPolarHBondContact O-CG2 3.12Å; V502-V506 PolarHBondContact O-N 2.71Å; Q503-V506 PolarHBondContact O-N 3.11Å; V506-S508 VanDerWaalsContact C-N 3.29Å; V506-S508 PolarHBondContact O-N 3.49Å; V506-V509 PolarHBondContact O-N 3.44Å; V506-F510 HydrophobicContact CG1-CD2 3.73Å; V506-F510 HydrophobicContact CG1-CE2 3.81Å; V506-F510 WeakPolarHBondContact O-CD2 3.47Å; V506-F510 PolarHBondContact O-N 2.92Å; V506-R550 HydrophobicContact CG1-CG 3.96Å; V506-I553 HydrophobicContact CG1-CG2 4Å; V506-I553 HydrophobicContact CG2-CG2 4.25Å
507	D	83.8	Confident	79.1	Confident	64 Å²	64	61 Å²	61	34%	0.342	30%	0.298	S	S	.	.	H	α-helix	trans	-55.5	-44.3	173.5	-71.6	-32.5	0	0	0	112.1	Q503 K511 R550	Q503-D507 VanDerWaalsContact O-CG 3.27Å; Q503-D507 PolarHBondContact O-N 3.26Å; D507-K511 WeakPolarHBondContact O-CB 3.29Å; D507-K511 PolarHBondContact O-N 3.2Å; D507-K511 VanDerWaalsContact O-N 3.09Å; D507-R550 IonicContact OD1-CZ 2.68Å; D507-R550 IonicContact OD1-NH1 3.23Å; D507-R550 PolarHBondContact OD1-NH1 3.05Å; D507-R550 IonicContact OD1-NH2 2.92Å; D507-R550 PolarHBondContact OD1-NH2 3.39Å
508	S	83.9	Confident	78.9	Confident	5 Å²	5	61.4 Å²	61.4	4%	0.035	30%	0.298	C	S	.	.	H	α-helix	trans	-72.1	-29	177.9	-76.3	0	0	0	0	113.9	D439 H442 R504 M505 V506 N512	D439-S508 WeakPolarHBondContact CA-OG 3.45Å; D439-S508 WeakPolarHBondContact OD1-CB 3.46Å; D439-S508 PolarHBondContact OD1-OG 3.44Å; H442-S508 PolarHBondContact ND1-OG 3.08Å; R504-S508 WeakPolarHBondContact O-CB 3.27Å; R504-S508 PolarHBondContact O-N 3.1Å; R504-S508 PolarHBondContact O-OG 2.95Å; M505-S508 CarbonylContact O-C 3.55Å; M505-S508 PolarHBondContact O-N 3.28Å; V506-S508 VanDerWaalsContact C-N 3.29Å; V506-S508 PolarHBondContact O-N 3.49Å; S508-N512 PolarHBondContact O-ND2 3.36Å
509	V	80.9	Confident	78.9	Confident	1 Å²	1	62.6 Å²	62.6	1%	0.006	31%	0.312	C	S	.	.	H	α-helix	trans	-68.1	-54.1	171.7	164.5	0	0	0	0	110.8	M505 V506 K511 N512 Y513 I521 I529 I553	M505-V509 HydrophobicContact CE-CG2 3.69Å; M505-V509 WeakPolarHBondContact O-CG2 3.43Å; M505-V509 PolarHBondContact O-N 3.15Å; M505-V509 HydrophobicContact SD-CG2 3.85Å; V506-V509 PolarHBondContact O-N 3.44Å; V509-K511 VanDerWaalsContact C-N 3.3Å; V509-K511 PolarHBondContact O-N 3.35Å; V509-N512 PolarHBondContact O-N 3.06Å; V509-Y513 HydrophobicContact CG1-CD2 4.16Å; V509-Y513 WeakPolarHBondContact O-CD2 3.34Å; V509-Y513 PolarHBondContact O-N 2.97Å; V509-I521 HydrophobicContact CG1-CD1 4.18Å; V509-I529 HydrophobicContact CG1-CD1 3.82Å; V509-I529 HydrophobicContact CG2-CD1 4.38Å; V509-I529 HydrophobicContact CG2-CG2 4.31Å; V509-I553 HydrophobicContact CG1-CD1 3.82Å
510	F	81.7	Confident	79	Confident	19 Å²	19	63.9 Å²	63.9	8%	0.083	31%	0.311	C	S	.	.	H	α-helix	trans	-57.6	-45	179.4	-85.9	-81	0	0	0	111.7	V506 N512 Y513 D514 G519 I521 R550 I553	V506-F510 HydrophobicContact CG1-CD2 3.73Å; V506-F510 HydrophobicContact CG1-CE2 3.81Å; V506-F510 WeakPolarHBondContact O-CD2 3.47Å; V506-F510 PolarHBondContact O-N 2.92Å; F510-N512 PolarHBondContact O-N 3.4Å; F510-Y513 PolarHBondContact O-N 3.34Å; F510-D514 HydrophobicContact CD1-CB 3.7Å; F510-D514 HydrophobicContact CE1-CB 4.4Å; F510-D514 WeakPolarHBondContact O-CB 3.48Å; F510-D514 PolarHBondContact O-N 2.87Å; F510-G519 VanDerWaalsContact CE1-C 3.49Å; F510-G519 WeakPolarHBondContact CE1-O 3.22Å; F510-I521 HydrophobicContact CD1-CG2 4.35Å; F510-I521 HydrophobicContact CE1-CG2 4Å; F510-I521 HydrophobicContact CZ-CG2 4.38Å; F510-R550 HydrophobicContact CD2-CB 4.41Å; F510-R550 HydrophobicContact CD2-CG 4.12Å; F510-R550 HydrophobicContact CE1-CB 4.36Å; F510-R550 HydrophobicContact CE2-CB 3.61Å; F510-R550 HydrophobicContact CE2-CG 3.67Å; F510-R550 VanDerWaalsContact CZ-CA 3.45Å; F510-R550 HydrophobicContact CZ-CB 3.61Å; F510-R550 HydrophobicContact CZ-CG 4.2Å; F510-I553 HydrophobicContact CE2-CG2 3.65Å; F510-I553 HydrophobicContact CZ-CG2 4.21Å
511	K	81.4	Confident	79	Confident	143 Å²	143	58.5 Å²	58.5	62%	0.622	29%	0.287	S	S	*	.	H	α-helix	trans	-57.9	-17.1	177.3	174.2	166.1	161.9	-81	0	115.4	D439 D507 V509	D439-K511 IonicContact OD1-NZ 2.66Å; D439-K511 PolarHBondContact OD1-NZ 3.21Å; D439-K511 IonicContact OD2-NZ 2.77Å; D439-K511 PolarHBondContact OD2-NZ 3.36Å; D507-K511 WeakPolarHBondContact O-CB 3.29Å; D507-K511 PolarHBondContact O-N 3.2Å; D507-K511 VanDerWaalsContact O-N 3.09Å; V509-K511 VanDerWaalsContact C-N 3.3Å; V509-K511 PolarHBondContact O-N 3.35Å
512	N	76.8	Confident	79.1	Confident	57 Å²	57	59 Å²	59	31%	0.305	30%	0.295	S	S	.	.	H	α-helix	trans	-115.2	-24.9	179.6	-72.6	-81.8	0	0	0	114.5	L230 D439 S508 V509 F510	L230-N512 HydrophobicContact CD1-CB 4.04Å; D439-N512 PolarHBondContact OD2-ND2 2.96Å; S508-N512 PolarHBondContact O-ND2 3.36Å; V509-N512 PolarHBondContact O-N 3.06Å; F510-N512 PolarHBondContact O-N 3.4Å
513	Y	78	Confident	79	Confident	47 Å²	47	61.7 Å²	61.7	18%	0.184	31%	0.307	C	S	.	.	H	α-helix	trans	-116.1	-21.2	-175.4	-65.5	-75.6	0	0	0	115.4	L230 L231 V509 F510 L515 D525 I529	L230-Y513 HydrophobicContact CB-CE2 3.97Å; L230-Y513 HydrophobicContact CD1-CE2 3.96Å; L230-Y513 HydrophobicContact CG-CE2 4.27Å; L230-Y513 PolarHBondContact N-OH 3.21Å; L231-Y513 WeakPolarHBondContact CG-OH 3.43Å; V509-Y513 HydrophobicContact CG1-CD2 4.16Å; V509-Y513 WeakPolarHBondContact O-CD2 3.34Å; V509-Y513 PolarHBondContact O-N 2.97Å; F510-Y513 PolarHBondContact O-N 3.34Å; Y513-L515 VanDerWaalsContact C-N 3.31Å; Y513-L515 PolarHBondContact O-N 3.49Å; Y513-D525 HydrophobicContact CD1-CB 4.41Å; Y513-I529 HydrophobicContact CD2-CD1 3.67Å; Y513-I529 HydrophobicContact CE2-CD1 3.6Å; Y513-I529 HydrophobicContact CE2-CG1 3.95Å; Y513-I529 HydrophobicContact CG-CD1 4.3Å
514	D	78.1	Confident	78.6	Confident	25 Å²	25	61.8 Å²	61.8	13%	0.134	31%	0.311	C	S	.	.			trans	-83.6	80.7	170.2	-177.2	4.7	0	0	0	109.2	F510 D516 Q517 N518 G519	F510-D514 HydrophobicContact CD1-CB 3.7Å; F510-D514 HydrophobicContact CE1-CB 4.4Å; F510-D514 WeakPolarHBondContact O-CB 3.48Å; F510-D514 PolarHBondContact O-N 2.87Å; D514-D516 VanDerWaalsContact C-N 3.25Å; D514-D516 PolarHBondContact O-N 3.07Å; D514-D516 PolarHBondContact OD1-N 2.67Å; D514-Q517 VanDerWaalsContact OD1-CA 3.27Å; D514-Q517 WeakPolarHBondContact OD1-CA 3.45Å; D514-Q517 PolarHBondContact OD1-N 2.84Å; D514-Q517 WeakPolarHBondContact OD2-CA 3.34Å; D514-N518 PolarHBondContact OD1-N 2.56Å; D514-N518 PolarHBondContact OD2-N 2.92Å; D514-G519 WeakPolarHBondContact OD2-CA 3.43Å; D514-G519 PolarHBondContact OD2-N 2.71Å
515	L	71.4	Confident	78.4	Confident	137 Å²	137	59.4 Å²	59.4	72%	0.717	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-26.8	-178.2	-62	177.6	0	0	0	112.7	Y513	Y513-L515 VanDerWaalsContact C-N 3.31Å; Y513-L515 PolarHBondContact O-N 3.49Å
516	D	71.9	Confident	78.3	Confident	132 Å²	132	59.7 Å²	59.7	71%	0.706	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-7	-175	-61	-25.6	0	0	0	112.9	D514 N518	D514-D516 VanDerWaalsContact C-N 3.25Å; D514-D516 PolarHBondContact O-N 3.07Å; D514-D516 PolarHBondContact OD1-N 2.67Å; D516-N518 HydrophobicContact CB-CB 4.25Å; D516-N518 PolarHBondContact O-N 3.1Å
517	Q	71.6	Confident	78	Confident	176 Å²	176	65.2 Å²	65.2	82%	0.822	33%	0.332	S	S	*	.			trans	56.4	35	-172.2	-57.1	177	31.7	0	0	112.8	D514	D514-Q517 VanDerWaalsContact OD1-CA 3.27Å; D514-Q517 WeakPolarHBondContact OD1-CA 3.45Å; D514-Q517 PolarHBondContact OD1-N 2.84Å; D514-Q517 WeakPolarHBondContact OD2-CA 3.34Å
518	N	73	Confident	77.7	Confident	67 Å²	67	66.2 Å²	66.2	36%	0.358	33%	0.334	S	S	.	.	S	Bend	trans	-88.7	-8.8	-174.2	69.8	38.6	0	0	0	113.5	D514 D516 F520	D514-N518 PolarHBondContact OD1-N 2.56Å; D514-N518 PolarHBondContact OD2-N 2.92Å; D516-N518 HydrophobicContact CB-CB 4.25Å; D516-N518 PolarHBondContact O-N 3.1Å; N518-F520 VanDerWaalsContact O-CD2 3.26Å; N518-F520 WeakPolarHBondContact O-CD2 3.5Å; N518-F520 WeakPolarHBondContact O-CE2 3.23Å; N518-F520 WeakPolarHBondContact OD1-CA 3.3Å; N518-F520 WeakPolarHBondContact OD1-CB 3.22Å; N518-F520 WeakPolarHBondContact OD1-CD2 3.37Å; N518-F520 PolarHBondContact OD1-N 2.82Å; N518-F520 PolarHBondContact OD1-O 2.7Å
519	G	72.7	Confident	77.5	Confident	31 Å²	31	66 Å²	66	32%	0.32	33%	0.332	S	S	.	.	S	Bend	trans	89.7	7.6	-179.6	0	0	0	0	0	114.7	F510 D514	F510-G519 VanDerWaalsContact CE1-C 3.49Å; F510-G519 WeakPolarHBondContact CE1-O 3.22Å; D514-G519 WeakPolarHBondContact OD2-CA 3.43Å; D514-G519 PolarHBondContact OD2-N 2.71Å
520	F	79.4	Confident	77.2	Confident	85 Å²	85	66.1 Å²	66.1	37%	0.373	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	163.3	-179.4	-53.4	-97.3	0	0	0	113	N518 L547 V548	N518-F520 VanDerWaalsContact O-CD2 3.26Å; N518-F520 WeakPolarHBondContact O-CD2 3.5Å; N518-F520 WeakPolarHBondContact O-CE2 3.23Å; N518-F520 WeakPolarHBondContact OD1-CA 3.3Å; N518-F520 WeakPolarHBondContact OD1-CB 3.22Å; N518-F520 WeakPolarHBondContact OD1-CD2 3.37Å; N518-F520 PolarHBondContact OD1-N 2.82Å; N518-F520 PolarHBondContact OD1-O 2.7Å; F520-L547 HydrophobicContact CB-CB 3.76Å; F520-L547 HydrophobicContact CB-CD1 4.24Å; F520-L547 HydrophobicContact CB-CD2 4.05Å; F520-L547 HydrophobicContact CB-CG 4.23Å; F520-L547 HydrophobicContact CD1-CB 3.97Å; F520-L547 HydrophobicContact CG-CB 4.01Å; F520-L547 HydrophobicContact CG-CD1 4.4Å; F520-V548 VanDerWaalsContact CA-O 3.29Å; F520-V548 WeakPolarHBondContact CA-O 3.29Å
521	I	81.7	Confident	76.9	Confident	3 Å²	3	66.5 Å²	66.5	2%	0.015	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	161	169.8	62.5	172.1	0	0	0	111.3	V509 F510 F526 I529 L547 V548 I553	V509-I521 HydrophobicContact CG1-CD1 4.18Å; F510-I521 HydrophobicContact CD1-CG2 4.35Å; F510-I521 HydrophobicContact CE1-CG2 4Å; F510-I521 HydrophobicContact CZ-CG2 4.38Å; I521-F526 HydrophobicContact CD1-CB 3.82Å; I521-F526 HydrophobicContact CD1-CD2 4.3Å; I521-F526 HydrophobicContact CG1-CB 4.36Å; I521-I529 HydrophobicContact CD1-CD1 4.39Å; I521-L547 WeakPolarHBondContact O-CA 3.28Å; I521-V548 HydrophobicContact CG1-CB 4.09Å; I521-V548 PolarHBondContact N-O 3.07Å; I521-V548 PolarHBondContact O-N 3.48Å; I521-I553 HydrophobicContact CD1-CD1 3.79Å
522	S	81.2	Confident	76.6	Confident	41 Å²	41	59.8 Å²	59.8	29%	0.287	31%	0.311	S	S	.	.			trans	-67.2	148.6	174.4	93.2	0	0	0	0	111.2	D524 D525 F526	S522-D524 VanDerWaalsContact C-N 3.31Å; S522-D524 PolarHBondContact O-N 3.25Å; S522-D525 PolarHBondContact O-N 2.77Å; S522-D525 WeakPolarHBondContact OG-CB 3.43Å; S522-D525 PolarHBondContact OG-N 3.27Å; S522-D525 PolarHBondContact OG-OD2 2.76Å; S522-F526 WeakPolarHBondContact O-CB 3.46Å; S522-F526 PolarHBondContact O-N 3.2Å
523	H	79.1	Confident	76.3	Confident	57 Å²	57	57.3 Å²	57.3	26%	0.264	30%	0.298	S	S	.	.	H	α-helix	trans	-65.6	-36.6	177.1	-165.9	-75.4	0	0	0	111.5	F526 E527	H523-F526 WeakPolarHBondContact O-CB 3.42Å; H523-F526 PolarHBondContact O-N 2.9Å; H523-E527 IonicContact CE1-OE1 4Å; H523-E527 PolarHBondContact CE1-OE1 3.08Å; H523-E527 VanDerWaalsContact CE1-OE1 3.23Å; H523-E527 IonicContact ND1-OE1 2.6Å; H523-E527 PolarHBondContact O-N 2.92Å
524	D	74.9	Confident	75.4	Confident	109 Å²	109	55.4 Å²	55.4	58%	0.583	29%	0.291	S	S	*	.	H	α-helix	trans	-65.4	-40.6	179	-61.9	7.9	0	0	0	111.5	S522 E527 K528	S522-D524 VanDerWaalsContact C-N 3.31Å; S522-D524 PolarHBondContact O-N 3.25Å; D524-E527 PolarHBondContact O-N 2.97Å; D524-K528 WeakPolarHBondContact O-CD 3.45Å; D524-K528 WeakPolarHBondContact O-CE 3.42Å; D524-K528 VanDerWaalsContact O-CG 3.24Å; D524-K528 WeakPolarHBondContact O-CG 3.29Å; D524-K528 PolarHBondContact O-N 3.11Å
525	D	78.9	Confident	74.7	Confident	48 Å²	48	54.5 Å²	54.5	26%	0.257	29%	0.286	S	S	.	.	H	α-helix	trans	-73.4	-35.4	176.3	-60.6	-47.5	0	0	0	111.5	Y513 S522 K528 I529	Y513-D525 HydrophobicContact CD1-CB 4.41Å; S522-D525 PolarHBondContact O-N 2.77Å; S522-D525 WeakPolarHBondContact OG-CB 3.43Å; S522-D525 PolarHBondContact OG-N 3.27Å; S522-D525 PolarHBondContact OG-OD2 2.76Å; D525-K528 PolarHBondContact O-N 3.33Å; D525-K528 IonicContact OD1-NZ 3.98Å; D525-K528 PolarHBondContact OD1-NZ 2.97Å; D525-I529 WeakPolarHBondContact O-CD1 3.43Å; D525-I529 WeakPolarHBondContact O-CG1 3.34Å; D525-I529 PolarHBondContact O-N 3.26Å
526	F	81.3	Confident	73.8	Confident	6 Å²	6	51.1 Å²	51.1	3%	0.026	27%	0.274	C	S	.	.	H	α-helix	trans	-59	-45.3	169.4	172.1	-107.4	0	0	0	112.3	I521 S522 H523 K528 I529 A530 M540 V548 I553 Y556 F557	I521-F526 HydrophobicContact CD1-CB 3.82Å; I521-F526 HydrophobicContact CD1-CD2 4.3Å; I521-F526 HydrophobicContact CG1-CB 4.36Å; S522-F526 WeakPolarHBondContact O-CB 3.46Å; S522-F526 PolarHBondContact O-N 3.2Å; H523-F526 WeakPolarHBondContact O-CB 3.42Å; H523-F526 PolarHBondContact O-N 2.9Å; F526-K528 PolarHBondContact O-N 2.86Å; F526-I529 PolarHBondContact O-N 3.33Å; F526-A530 HydrophobicContact CZ-CB 4.43Å; F526-A530 WeakPolarHBondContact O-CB 3.13Å; F526-A530 PolarHBondContact O-N 3.2Å; F526-M540 HydrophobicContact CE1-CE 4.39Å; F526-M540 HydrophobicContact CE1-CG 4.04Å; F526-M540 HydrophobicContact CZ-CG 4.37Å; F526-V548 HydrophobicContact CB-CG2 4.21Å; F526-V548 HydrophobicContact CD1-CG2 4.26Å; F526-V548 HydrophobicContact CG-CG2 4.24Å; F526-I553 HydrophobicContact CD2-CD1 4.05Å; F526-I553 HydrophobicContact CD2-CG1 4.06Å; F526-I553 HydrophobicContact CE2-CD1 4.37Å; F526-I553 HydrophobicContact CE2-CG1 3.94Å; F526-Y556 HydrophobicContact CE1-CD2 4.46Å; F526-Y556 HydrophobicContact CE1-CE2 4.44Å; F526-Y556 HydrophobicContact CE2-CD1 4Å; F526-Y556 HydrophobicContact CE2-CD2 4.5Å; F526-Y556 HydrophobicContact CE2-CE1 4.37Å; F526-Y556 HydrophobicContact CE2-CG 4.08Å; F526-Y556 AromaticContact CZ-CD1 3.85Å; F526-Y556 HydrophobicContact CZ-CD1 3.85Å; F526-Y556 AromaticContact CZ-CD2 3.62Å; F526-Y556 HydrophobicContact CZ-CD2 3.62Å; F526-Y556 HydrophobicContact CZ-CE1 4.05Å; F526-Y556 AromaticContact CZ-CE2 3.78Å; F526-Y556 HydrophobicContact CZ-CE2 3.78Å; F526-Y556 AromaticContact CZ-CG 3.64Å; F526-Y556 HydrophobicContact CZ-CG 3.64Å; F526-F557 HydrophobicContact CE2-CE2 4.38Å
527	E	77.1	Confident	72.6	Confident	116 Å²	116	50.3 Å²	50.3	54%	0.542	27%	0.265	S	S	.	.	H	α-helix	trans	-62	-40.7	176.6	-77.9	-167.1	173	0	0	112.3	H523 D524 A530 A531	H523-E527 IonicContact CE1-OE1 4Å; H523-E527 PolarHBondContact CE1-OE1 3.08Å; H523-E527 VanDerWaalsContact CE1-OE1 3.23Å; H523-E527 IonicContact ND1-OE1 2.6Å; H523-E527 PolarHBondContact O-N 2.92Å; D524-E527 PolarHBondContact O-N 2.97Å; E527-A530 PolarHBondContact O-N 3.44Å; E527-A531 WeakPolarHBondContact O-CB 3.26Å; E527-A531 PolarHBondContact O-N 3.47Å
528	K	77.1	Confident	71.6	Confident	85 Å²	85	42.7 Å²	42.7	37%	0.37	23%	0.231	S	C	.	.	H	α-helix	trans	-63.4	-42	175.2	-63	160.3	-149.5	159.3	0	111.7	L231 D524 D525 F526 A531 S532	L231-K528 HydrophobicContact CD1-CB 3.69Å; L231-K528 HydrophobicContact CD1-CD 3.9Å; L231-K528 HydrophobicContact CD1-CG 4.25Å; L231-K528 VanDerWaalsContact CD2-C 3.5Å; L231-K528 HydrophobicContact CD2-CB 3.58Å; L231-K528 HydrophobicContact CG-CB 4.24Å; D524-K528 WeakPolarHBondContact O-CD 3.45Å; D524-K528 WeakPolarHBondContact O-CE 3.42Å; D524-K528 VanDerWaalsContact O-CG 3.24Å; D524-K528 WeakPolarHBondContact O-CG 3.29Å; D524-K528 PolarHBondContact O-N 3.11Å; D525-K528 PolarHBondContact O-N 3.33Å; D525-K528 IonicContact OD1-NZ 3.98Å; D525-K528 PolarHBondContact OD1-NZ 2.97Å; F526-K528 PolarHBondContact O-N 2.86Å; K528-A531 PolarHBondContact O-N 3.38Å; K528-S532 PolarHBondContact O-N 3.02Å; K528-S532 PolarHBondContact O-OG 2.88Å; K528-S532 VanDerWaalsContact O-OG 3.09Å
529	I	78.8	Confident	70.5	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-63.7	-46.7	175.7	-65.2	161.2	0	0	0	109.5	L231 M505 V509 Y513 I521 D525 F526 A531 S532 F533 F557	L231-I529 HydrophobicContact CD2-CB 4.41Å; L231-I529 HydrophobicContact CD2-CG1 3.73Å; M505-I529 HydrophobicContact CE-CG2 3.82Å; V509-I529 HydrophobicContact CG1-CD1 3.82Å; V509-I529 HydrophobicContact CG2-CD1 4.38Å; V509-I529 HydrophobicContact CG2-CG2 4.31Å; Y513-I529 HydrophobicContact CD2-CD1 3.67Å; Y513-I529 HydrophobicContact CE2-CD1 3.6Å; Y513-I529 HydrophobicContact CE2-CG1 3.95Å; Y513-I529 HydrophobicContact CG-CD1 4.3Å; I521-I529 HydrophobicContact CD1-CD1 4.39Å; D525-I529 WeakPolarHBondContact O-CD1 3.43Å; D525-I529 WeakPolarHBondContact O-CG1 3.34Å; D525-I529 PolarHBondContact O-N 3.26Å; F526-I529 PolarHBondContact O-N 3.33Å; I529-A531 VanDerWaalsContact C-N 3.31Å; I529-A531 PolarHBondContact O-N 2.96Å; I529-S532 VanDerWaalsContact O-CB 3.23Å; I529-S532 WeakPolarHBondContact O-CB 3.48Å; I529-S532 PolarHBondContact O-N 3.04Å; I529-F533 HydrophobicContact CG2-CE2 4.42Å; I529-F533 WeakPolarHBondContact O-CD2 3.44Å; I529-F557 HydrophobicContact CG2-CZ 4.24Å
530	A	76.3	Confident	69.5	Low	5 Å²	5	44.6 Å²	44.6	4%	0.041	24%	0.236	C	C	.	.	H	α-helix	trans	-61.5	-35.9	176.9	0	0	0	0	0	112.8	F526 E527 S532 F533 Y556	F526-A530 HydrophobicContact CZ-CB 4.43Å; F526-A530 WeakPolarHBondContact O-CB 3.13Å; F526-A530 PolarHBondContact O-N 3.2Å; E527-A530 PolarHBondContact O-N 3.44Å; A530-S532 PolarHBondContact O-N 3.27Å; A530-F533 PolarHBondContact O-N 3.41Å; A530-F533 VanDerWaalsContact O-O 3.08Å; A530-Y556 HydrophobicContact CB-CE1 4.2Å
531	A	74.9	Confident	68.1	Low	27 Å²	27	46.2 Å²	46.2	22%	0.223	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-10.2	174.1	0	0	0	0	0	114.3	R296 E527 K528 I529 F533	R296-A531 PolarHBondContact NH1-O 3.47Å; R296-A531 PolarHBondContact NH2-O 3.47Å; E527-A531 WeakPolarHBondContact O-CB 3.26Å; E527-A531 PolarHBondContact O-N 3.47Å; K528-A531 PolarHBondContact O-N 3.38Å; I529-A531 VanDerWaalsContact C-N 3.31Å; I529-A531 PolarHBondContact O-N 2.96Å; A531-F533 VanDerWaalsContact C-N 3.33Å
532	S	73.9	Confident	66.5	Low	2 Å²	2	54.6 Å²	54.6	1%	0.014	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-2.7	170.5	-51.8	0	0	0	0	113	F232 K528 I529 A530	F232-S532 PolarHBondContact N-OG 3.19Å; K528-S532 PolarHBondContact O-N 3.02Å; K528-S532 PolarHBondContact O-OG 2.88Å; K528-S532 VanDerWaalsContact O-OG 3.09Å; I529-S532 VanDerWaalsContact O-CB 3.23Å; I529-S532 WeakPolarHBondContact O-CB 3.48Å; I529-S532 PolarHBondContact O-N 3.04Å; A530-S532 PolarHBondContact O-N 3.27Å
533	F	70.8	Confident	64.9	Low	4 Å²	4	61.6 Å²	61.6	2%	0.018	31%	0.313	C	S	.	.	S	Bend	trans	-113.7	151.2	170.2	-68.1	-101.7	0	0	0	109.7	L443 L446 M505 I529 A530 A531 F535 F557	L443-F533 HydrophobicContact CD1-CE2 4.41Å; L443-F533 HydrophobicContact CD2-CE2 3.92Å; L443-F533 HydrophobicContact CD2-CZ 3.87Å; L443-F533 HydrophobicContact CG-CE2 3.91Å; L443-F533 HydrophobicContact CG-CZ 3.79Å; L446-F533 HydrophobicContact CB-CE1 4.16Å; L446-F533 HydrophobicContact CD2-CE1 4.06Å; L446-F533 HydrophobicContact CD2-CZ 4.27Å; L446-F533 HydrophobicContact CG-CE1 4.04Å; M505-F533 HydrophobicContact CE-CE2 3.56Å; M505-F533 HydrophobicContact CE-CZ 3.61Å; M505-F533 HydrophobicContact CG-CZ 4.37Å; I529-F533 HydrophobicContact CG2-CE2 4.42Å; I529-F533 WeakPolarHBondContact O-CD2 3.44Å; A530-F533 PolarHBondContact O-N 3.41Å; A530-F533 VanDerWaalsContact O-O 3.08Å; A531-F533 VanDerWaalsContact C-N 3.33Å; F533-F535 HydrophobicContact CB-CD2 4.43Å; F533-F535 PolarHBondContact O-N 2.72Å; F533-F557 HydrophobicContact CD1-CE1 4.11Å; F533-F557 AromaticContact CD2-CE1 3.59Å; F533-F557 HydrophobicContact CD2-CE1 3.59Å; F533-F557 HydrophobicContact CD2-CZ 4.02Å; F533-F557 HydrophobicContact CE1-CD1 4.38Å; F533-F557 HydrophobicContact CE1-CE1 4.09Å; F533-F557 AromaticContact CE2-CE1 3.58Å; F533-F557 HydrophobicContact CE2-CE1 3.58Å; F533-F557 AromaticContact CE2-CZ 3.86Å; F533-F557 HydrophobicContact CE2-CZ 3.86Å; F533-F557 AromaticContact CG-CE1 3.88Å; F533-F557 HydrophobicContact CG-CE1 3.88Å; F533-F557 HydrophobicContact CZ-CD1 4.37Å; F533-F557 AromaticContact CZ-CE1 3.84Å; F533-F557 HydrophobicContact CZ-CE1 3.84Å; F533-F557 HydrophobicContact CZ-CZ 4.4Å
534	P	59	Low	63.7	Low	8 Å²	8	65.6 Å²	65.6	5%	0.052	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	5.1	178.6	27	-33.2	0	0	0	115	L291 M292 L450 F537	L291-P534 HydrophobicContact CB-CB 3.61Å; L291-P534 HydrophobicContact CB-CG 4.12Å; M292-P534 HydrophobicContact CE-CB 4.35Å; L450-P534 HydrophobicContact CD1-CG 3.49Å; L450-P534 VanDerWaalsContact CD1-CG 3.49Å; P534-F537 WeakPolarHBondContact O-CE1 3.36Å
535	F	63.1	Low	62.5	Low	6 Å²	6	70.1 Å²	70.1	3%	0.026	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.4	23.4	-170.2	-44.5	-56.9	0	0	0	115.1	L450 Y452 F533 F537 C538 Y556 A560 C564	L450-F535 HydrophobicContact CB-CZ 4.14Å; L450-F535 HydrophobicContact CD1-CE1 4.48Å; L450-F535 HydrophobicContact CD1-CE2 3.67Å; L450-F535 HydrophobicContact CD1-CZ 3.46Å; L450-F535 VanDerWaalsContact CD1-CZ 3.46Å; L450-F535 HydrophobicContact CD2-CE2 3.41Å; L450-F535 VanDerWaalsContact CD2-CE2 3.41Å; L450-F535 HydrophobicContact CD2-CZ 3.57Å; L450-F535 HydrophobicContact CG-CE2 4.08Å; L450-F535 HydrophobicContact CG-CZ 3.88Å; Y452-F535 AromaticContact CE2-CE1 3.64Å; Y452-F535 HydrophobicContact CE2-CE1 3.64Å; Y452-F535 HydrophobicContact CE2-CZ 4.35Å; Y452-F535 AromaticContact CZ-CE1 3.92Å; Y452-F535 WeakPolarHBondContact OH-CE1 3.45Å; F533-F535 HydrophobicContact CB-CD2 4.43Å; F533-F535 PolarHBondContact O-N 2.72Å; F535-F537 HydrophobicContact CB-CE1 4.34Å; F535-F537 HydrophobicContact CB-CZ 4.3Å; F535-F537 HydrophobicContact CD1-CE1 4.03Å; F535-F537 AromaticContact CD1-CZ 3.86Å; F535-F537 HydrophobicContact CD1-CZ 3.86Å; F535-F537 PolarHBondContact O-N 2.86Å; F535-C538 PolarHBondContact O-N 2.95Å; F535-Y556 PolarHBondContact O-OH 2.98Å; F535-A560 HydrophobicContact CB-CB 4.13Å; F535-A560 HydrophobicContact CD2-CB 4.07Å; F535-A560 HydrophobicContact CG-CB 4.39Å; F535-C564 HydrophobicContact CD1-CB 4.07Å; F535-C564 WeakPolarHBondContact CD1-SG 3.46Å; F535-C564 HydrophobicContact CE1-CB 3.3Å; F535-C564 WeakPolarHBondContact CE1-SG 3.32Å; F535-C564 HydrophobicContact CE2-CB 4.01Å; F535-C564 HydrophobicContact CZ-CB 3.23Å
536	S	52.4	Low	62.1	Low	66 Å²	66	69.8 Å²	69.8	46%	0.462	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-10.6	177.7	55.5	0	0	0	0	114.6
537	F	46.6	Very low	61.5	Low	115 Å²	115	74.3 Å²	74.3	50%	0.504	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-9.5	171	60.4	-102.8	0	0	0	115.5	P534 F535 V539	P534-F537 WeakPolarHBondContact O-CE1 3.36Å; F535-F537 HydrophobicContact CB-CE1 4.34Å; F535-F537 HydrophobicContact CB-CZ 4.3Å; F535-F537 HydrophobicContact CD1-CE1 4.03Å; F535-F537 AromaticContact CD1-CZ 3.86Å; F535-F537 HydrophobicContact CD1-CZ 3.86Å; F535-F537 PolarHBondContact O-N 2.86Å; F537-V539 PolarHBondContact O-N 3.26Å; F537-V539 VanDerWaalsContact O-N 3.16Å
538	C	51.2	Low	61.5	Low	16 Å²	16	69 Å²	69	11%	0.108	35%	0.351	C	S	.	.	S	Bend	trans	-66.7	115.1	174.7	-169.2	0	0	0	0	109.6	F535 Y556	F535-C538 PolarHBondContact O-N 2.95Å; C538-Y556 HydrophobicContact CB-CD2 4.4Å; C538-Y556 HydrophobicContact CB-CE2 3.74Å; C538-Y556 VanDerWaalsContact O-CE2 3.31Å; C538-Y556 WeakPolarHBondContact O-CE2 3.24Å
539	V	49.3	Very low	61.6	Low	99 Å²	99	65.5 Å²	65.5	60%	0.6	34%	0.338	S	S	*	.			trans	-72.7	135.8	-174.4	-178.7	0	0	0	0	110.8	F537 R559	F537-V539 PolarHBondContact O-N 3.26Å; F537-V539 VanDerWaalsContact O-N 3.16Å; V539-R559 PolarHBondContact O-NH2 3.01Å
540	M	53	Low	61.6	Low	39 Å²	39	69.4 Å²	69.4	19%	0.192	35%	0.352	C	S	.	.			trans	-103.3	145.1	161	-71.5	-81.5	-78.5	0	0	108	F526 K542 V548 E552 Y556 R559	F526-M540 HydrophobicContact CE1-CE 4.39Å; F526-M540 HydrophobicContact CE1-CG 4.04Å; F526-M540 HydrophobicContact CZ-CG 4.37Å; M540-K542 PolarHBondContact O-N 3.43Å; M540-V548 HydrophobicContact CE-CG1 4.15Å; M540-E552 HydrophobicContact CE-CB 4.35Å; M540-Y556 HydrophobicContact CG-CD2 3.84Å; M540-Y556 HydrophobicContact CG-CE2 4.21Å; M540-Y556 HydrophobicContact SD-CD2 3.94Å; M540-R559 PolarHBondContact SD-NH2 2.95Å
541	D	49.6	Very low	61.5	Low	119 Å²	119	75.2 Å²	75.2	64%	0.636	38%	0.379	S	S	*	.			trans	-66.7	106.6	178.5	-71.6	-46.7	0	0	0	111	E543 K544	D541-E543 PolarHBondContact O-N 3.21Å; D541-K544 PolarHBondContact O-N 3.14Å
542	K	49.2	Very low	61.7	Low	179 Å²	179	76.2 Å²	76.2	78%	0.778	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-1.2	-175.9	-61.5	-173.8	176	-173.6	0	114.7	M540	M540-K542 PolarHBondContact O-N 3.43Å
543	E	47.5	Very low	61.9	Low	187 Å²	187	76.1 Å²	76.1	87%	0.874	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-26.8	177.9	-55.4	-165.3	161.8	0	0	111.9	D541 K545	D541-E543 PolarHBondContact O-N 3.21Å; E543-K545 PolarHBondContact O-N 3.04Å
544	K	52.8	Low	62.3	Low	141 Å²	141	78 Å²	78	61%	0.613	39%	0.39	S	S	*	.			trans	-84.9	79.2	169.8	-70.8	-167.3	-178.1	-173.8	0	111.6	D541 G546 E552	D541-K544 PolarHBondContact O-N 3.14Å; K544-G546 VanDerWaalsContact C-N 3.35Å; K544-G546 PolarHBondContact O-N 3.22Å; K544-E552 IonicContact NZ-OE1 3.33Å; K544-E552 PolarHBondContact NZ-OE1 3.45Å
545	K	49.4	Very low	63	Low	205 Å²	205	79.4 Å²	79.4	89%	0.891	40%	0.402	S	S	*	.			trans	-72.5	86.6	168.1	-70	-174.6	176.6	-177.8	0	110.7	E543	E543-K545 PolarHBondContact O-N 3.04Å
546	G	71.2	Confident	63.7	Low	40 Å²	40	79.3 Å²	79.3	41%	0.412	40%	0.401	S	S	.	.	S	Bend	trans	176.6	-167.4	178.8	0	0	0	0	0	115	K544	K544-G546 VanDerWaalsContact C-N 3.35Å; K544-G546 PolarHBondContact O-N 3.22Å
547	L	69.1	Low	64.9	Low	101 Å²	101	76.3 Å²	76.3	53%	0.529	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-52.2	132.1	176.9	-75.5	172.8	0	0	0	112.9	F520 I521	F520-L547 HydrophobicContact CB-CB 3.76Å; F520-L547 HydrophobicContact CB-CD1 4.24Å; F520-L547 HydrophobicContact CB-CD2 4.05Å; F520-L547 HydrophobicContact CB-CG 4.23Å; F520-L547 HydrophobicContact CD1-CB 3.97Å; F520-L547 HydrophobicContact CG-CB 4.01Å; F520-L547 HydrophobicContact CG-CD1 4.4Å; I521-L547 WeakPolarHBondContact O-CA 3.28Å
548	V	76.6	Confident	66.3	Low	4 Å²	4	72.8 Å²	72.8	2%	0.024	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	127.1	179.7	-178.2	0	0	0	0	109.9	F520 I521 F526 M540 E552 I553	F520-V548 VanDerWaalsContact CA-O 3.29Å; F520-V548 WeakPolarHBondContact CA-O 3.29Å; I521-V548 HydrophobicContact CG1-CB 4.09Å; I521-V548 PolarHBondContact N-O 3.07Å; I521-V548 PolarHBondContact O-N 3.48Å; F526-V548 HydrophobicContact CB-CG2 4.21Å; F526-V548 HydrophobicContact CD1-CG2 4.26Å; F526-V548 HydrophobicContact CG-CG2 4.24Å; M540-V548 HydrophobicContact CE-CG1 4.15Å; V548-E552 HydrophobicContact CG1-CB 3.95Å; V548-I553 HydrophobicContact CG1-CB 4.35Å
549	S	79.7	Confident	67.2	Low	13 Å²	13	73.1 Å²	73.1	9%	0.091	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	163.5	-178.3	100.6	0	0	0	0	113.7	E551 E552 I553	S549-E551 VanDerWaalsContact C-N 3.28Å; S549-E551 WeakPolarHBondContact CB-OE2 3.5Å; S549-E551 PolarHBondContact O-N 3.49Å; S549-E551 PolarHBondContact OG-N 2.89Å; S549-E551 PolarHBondContact OG-OE2 3.05Å; S549-E552 PolarHBondContact N-OE2 3.22Å; S549-E552 PolarHBondContact O-N 3.34Å; S549-E552 VanDerWaalsContact O-N 3.14Å; S549-E552 PolarHBondContact OG-N 3.46Å; S549-I553 PolarHBondContact O-N 3.08Å
550	R	78.3	Confident	68.3	Low	82 Å²	82	68.6 Å²	68.6	31%	0.309	34%	0.337	S	S	.	.	H	α-helix	trans	-59.1	-36.3	174.7	-176.2	172.6	164.8	103.4	4.2	113.4	V506 D507 F510 I553 T554	V506-R550 HydrophobicContact CG1-CG 3.96Å; D507-R550 IonicContact OD1-CZ 2.68Å; D507-R550 IonicContact OD1-NH1 3.23Å; D507-R550 PolarHBondContact OD1-NH1 3.05Å; D507-R550 IonicContact OD1-NH2 2.92Å; D507-R550 PolarHBondContact OD1-NH2 3.39Å; F510-R550 HydrophobicContact CD2-CB 4.41Å; F510-R550 HydrophobicContact CD2-CG 4.12Å; F510-R550 HydrophobicContact CE1-CB 4.36Å; F510-R550 HydrophobicContact CE2-CB 3.61Å; F510-R550 HydrophobicContact CE2-CG 3.67Å; F510-R550 VanDerWaalsContact CZ-CA 3.45Å; F510-R550 HydrophobicContact CZ-CB 3.61Å; F510-R550 HydrophobicContact CZ-CG 4.2Å; R550-I553 WeakPolarHBondContact O-CG2 3.4Å; R550-T554 VanDerWaalsContact O-CB 3.28Å; R550-T554 WeakPolarHBondContact O-CB 3.43Å; R550-T554 PolarHBondContact O-N 3.09Å; R550-T554 VanDerWaalsContact O-N 3.08Å; R550-T554 PolarHBondContact O-OG1 2.87Å
551	E	74.4	Confident	69.1	Low	127 Å²	127	67 Å²	67	59%	0.593	33%	0.331	S	S	*	.	H	α-helix	trans	-70.7	-37.1	176.3	-57.4	65.6	-137.8	0	0	110.9	S549 A555	S549-E551 VanDerWaalsContact C-N 3.28Å; S549-E551 WeakPolarHBondContact CB-OE2 3.5Å; S549-E551 PolarHBondContact O-N 3.49Å; S549-E551 PolarHBondContact OG-N 2.89Å; S549-E551 PolarHBondContact OG-OE2 3.05Å; E551-A555 VanDerWaalsContact O-CB 3.23Å; E551-A555 WeakPolarHBondContact O-CB 3.34Å; E551-A555 PolarHBondContact O-N 2.79Å
552	E	77.8	Confident	69.9	Low	47 Å²	47	62.2 Å²	62.2	22%	0.22	31%	0.305	C	S	.	.	H	α-helix	trans	-70.7	-42.9	-178.6	-69.1	176.8	148.3	0	0	112.3	M540 K544 V548 S549 A555 Y556	M540-E552 HydrophobicContact CE-CB 4.35Å; K544-E552 IonicContact NZ-OE1 3.33Å; K544-E552 PolarHBondContact NZ-OE1 3.45Å; V548-E552 HydrophobicContact CG1-CB 3.95Å; S549-E552 PolarHBondContact N-OE2 3.22Å; S549-E552 PolarHBondContact O-N 3.34Å; S549-E552 VanDerWaalsContact O-N 3.14Å; S549-E552 PolarHBondContact OG-N 3.46Å; E552-A555 PolarHBondContact O-N 3.13Å; E552-Y556 WeakPolarHBondContact O-CB 3.42Å; E552-Y556 PolarHBondContact O-N 2.95Å
553	I	79.5	Confident	70.7	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-70.4	-37.2	173.9	-167	177.6	0	0	0	111.9	V506 V509 F510 I521 F526 V548 S549 R550 A555 Y556 F557	V506-I553 HydrophobicContact CG1-CG2 4Å; V506-I553 HydrophobicContact CG2-CG2 4.25Å; V509-I553 HydrophobicContact CG1-CD1 3.82Å; F510-I553 HydrophobicContact CE2-CG2 3.65Å; F510-I553 HydrophobicContact CZ-CG2 4.21Å; I521-I553 HydrophobicContact CD1-CD1 3.79Å; F526-I553 HydrophobicContact CD2-CD1 4.05Å; F526-I553 HydrophobicContact CD2-CG1 4.06Å; F526-I553 HydrophobicContact CE2-CD1 4.37Å; F526-I553 HydrophobicContact CE2-CG1 3.94Å; V548-I553 HydrophobicContact CG1-CB 4.35Å; S549-I553 PolarHBondContact O-N 3.08Å; R550-I553 WeakPolarHBondContact O-CG2 3.4Å; I553-A555 VanDerWaalsContact C-N 3.34Å; I553-A555 PolarHBondContact O-N 2.64Å; I553-Y556 WeakPolarHBondContact O-CB 3.24Å; I553-Y556 PolarHBondContact O-N 3.31Å; I553-F557 HydrophobicContact CD1-CD2 4.44Å; I553-F557 HydrophobicContact CD1-CE2 3.96Å; I553-F557 HydrophobicContact CG1-CD2 3.72Å; I553-F557 HydrophobicContact CG1-CE2 3.58Å; I553-F557 WeakPolarHBondContact O-CD2 3.34Å; I553-F557 PolarHBondContact O-N 3.44Å
554	T	78.6	Confident	71.3	Confident	45 Å²	45	49.6 Å²	49.6	28%	0.276	25%	0.252	S	S	.	.	H	α-helix	trans	-61.4	-45.3	172.6	-58.2	0	0	0	0	110.4	V502 R550 M558	V502-T554 HydrophobicContact CG1-CG2 4.27Å; R550-T554 VanDerWaalsContact O-CB 3.28Å; R550-T554 WeakPolarHBondContact O-CB 3.43Å; R550-T554 PolarHBondContact O-N 3.09Å; R550-T554 VanDerWaalsContact O-N 3.08Å; R550-T554 PolarHBondContact O-OG1 2.87Å; T554-M558 HydrophobicContact CG2-CG 4.49Å; T554-M558 WeakPolarHBondContact O-CB 3.48Å; T554-M558 VanDerWaalsContact O-CG 3.3Å; T554-M558 WeakPolarHBondContact O-CG 3.44Å; T554-M558 PolarHBondContact O-N 2.93Å
555	A	73.6	Confident	71.7	Confident	36 Å²	36	43.2 Å²	43.2	30%	0.298	23%	0.225	S	C	.	.	H	α-helix	trans	-60.2	-47.2	174.1	0	0	0	0	0	110.8	E551 E552 I553 F557 M558 R559	E551-A555 VanDerWaalsContact O-CB 3.23Å; E551-A555 WeakPolarHBondContact O-CB 3.34Å; E551-A555 PolarHBondContact O-N 2.79Å; E552-A555 PolarHBondContact O-N 3.13Å; I553-A555 VanDerWaalsContact C-N 3.34Å; I553-A555 PolarHBondContact O-N 2.64Å; A555-F557 PolarHBondContact O-N 3.41Å; A555-M558 PolarHBondContact O-N 3.11Å; A555-R559 VanDerWaalsContact O-CG 3.26Å; A555-R559 WeakPolarHBondContact O-CG 3.4Å; A555-R559 PolarHBondContact O-N 3.5Å
556	Y	78.3	Confident	72.2	Confident	5 Å²	5	37.8 Å²	37.8	2%	0.02	20%	0.201	C	C	.	.	H	α-helix	trans	-54	-51.7	178.4	-179.1	-89.7	0	0	0	112.6	F526 A530 F535 C538 M540 E552 I553 R559 A560	F526-Y556 HydrophobicContact CE1-CD2 4.46Å; F526-Y556 HydrophobicContact CE1-CE2 4.44Å; F526-Y556 HydrophobicContact CE2-CD1 4Å; F526-Y556 HydrophobicContact CE2-CD2 4.5Å; F526-Y556 HydrophobicContact CE2-CE1 4.37Å; F526-Y556 HydrophobicContact CE2-CG 4.08Å; F526-Y556 AromaticContact CZ-CD1 3.85Å; F526-Y556 HydrophobicContact CZ-CD1 3.85Å; F526-Y556 AromaticContact CZ-CD2 3.62Å; F526-Y556 HydrophobicContact CZ-CD2 3.62Å; F526-Y556 HydrophobicContact CZ-CE1 4.05Å; F526-Y556 AromaticContact CZ-CE2 3.78Å; F526-Y556 HydrophobicContact CZ-CE2 3.78Å; F526-Y556 AromaticContact CZ-CG 3.64Å; F526-Y556 HydrophobicContact CZ-CG 3.64Å; A530-Y556 HydrophobicContact CB-CE1 4.2Å; F535-Y556 PolarHBondContact O-OH 2.98Å; C538-Y556 HydrophobicContact CB-CD2 4.4Å; C538-Y556 HydrophobicContact CB-CE2 3.74Å; C538-Y556 VanDerWaalsContact O-CE2 3.31Å; C538-Y556 WeakPolarHBondContact O-CE2 3.24Å; M540-Y556 HydrophobicContact CG-CD2 3.84Å; M540-Y556 HydrophobicContact CG-CE2 4.21Å; M540-Y556 HydrophobicContact SD-CD2 3.94Å; E552-Y556 WeakPolarHBondContact O-CB 3.42Å; E552-Y556 PolarHBondContact O-N 2.95Å; I553-Y556 WeakPolarHBondContact O-CB 3.24Å; I553-Y556 PolarHBondContact O-N 3.31Å; Y556-R559 WeakPolarHBondContact O-CB 3.37Å; Y556-R559 PolarHBondContact O-N 3.45Å; Y556-A560 PolarHBondContact O-N 3.35Å
557	F	77.3	Confident	71.1	Confident	2 Å²	2	38 Å²	38	1%	0.009	19%	0.193	C	C	.	.	H	α-helix	trans	-72.6	-30.1	-178.7	-75.9	-67.5	0	0	0	113.3	L446 V502 M505 F526 I529 F533 I553 A555 S561	L446-F557 HydrophobicContact CD2-CB 4.14Å; L446-F557 HydrophobicContact CD2-CD1 4.01Å; L446-F557 HydrophobicContact CD2-CG 4.17Å; V502-F557 HydrophobicContact CG1-CB 3.8Å; V502-F557 HydrophobicContact CG2-CB 4.21Å; M505-F557 HydrophobicContact CE-CD1 4.35Å; M505-F557 HydrophobicContact CE-CD2 3.87Å; M505-F557 HydrophobicContact CE-CE1 3.9Å; M505-F557 HydrophobicContact CE-CE2 3.37Å; M505-F557 HydrophobicContact CE-CG 4.36Å; M505-F557 HydrophobicContact CE-CZ 3.4Å; M505-F557 HydrophobicContact SD-CD2 3.89Å; M505-F557 HydrophobicContact SD-CE2 3.98Å; M505-F557 HydrophobicContact SD-CG 4.32Å; M505-F557 HydrophobicContact SD-CZ 4.47Å; F526-F557 HydrophobicContact CE2-CE2 4.38Å; I529-F557 HydrophobicContact CG2-CZ 4.24Å; F533-F557 HydrophobicContact CD1-CE1 4.11Å; F533-F557 AromaticContact CD2-CE1 3.59Å; F533-F557 HydrophobicContact CD2-CE1 3.59Å; F533-F557 HydrophobicContact CD2-CZ 4.02Å; F533-F557 HydrophobicContact CE1-CD1 4.38Å; F533-F557 HydrophobicContact CE1-CE1 4.09Å; F533-F557 AromaticContact CE2-CE1 3.58Å; F533-F557 HydrophobicContact CE2-CE1 3.58Å; F533-F557 AromaticContact CE2-CZ 3.86Å; F533-F557 HydrophobicContact CE2-CZ 3.86Å; F533-F557 AromaticContact CG-CE1 3.88Å; F533-F557 HydrophobicContact CG-CE1 3.88Å; F533-F557 HydrophobicContact CZ-CD1 4.37Å; F533-F557 AromaticContact CZ-CE1 3.84Å; F533-F557 HydrophobicContact CZ-CE1 3.84Å; F533-F557 HydrophobicContact CZ-CZ 4.4Å; I553-F557 HydrophobicContact CD1-CD2 4.44Å; I553-F557 HydrophobicContact CD1-CE2 3.96Å; I553-F557 HydrophobicContact CG1-CD2 3.72Å; I553-F557 HydrophobicContact CG1-CE2 3.58Å; I553-F557 WeakPolarHBondContact O-CD2 3.34Å; I553-F557 PolarHBondContact O-N 3.44Å; A555-F557 PolarHBondContact O-N 3.41Å; F557-S561 WeakPolarHBondContact O-CB 3.38Å; F557-S561 PolarHBondContact O-N 3.16Å; F557-S561 PolarHBondContact O-OG 3.29Å
558	M	75.7	Confident	69.9	Low	42 Å²	42	35.9 Å²	35.9	21%	0.207	20%	0.195	C	C	.	.	H	α-helix	trans	-63.8	-43.3	166.6	-72.3	-59.3	-63.3	0	0	111.7	V502 T554 A555 S561 V562	V502-M558 HydrophobicContact CB-SD 3.99Å; V502-M558 HydrophobicContact CG1-CG 4.12Å; V502-M558 HydrophobicContact CG1-SD 4.19Å; V502-M558 HydrophobicContact CG2-SD 3.79Å; T554-M558 HydrophobicContact CG2-CG 4.49Å; T554-M558 WeakPolarHBondContact O-CB 3.48Å; T554-M558 VanDerWaalsContact O-CG 3.3Å; T554-M558 WeakPolarHBondContact O-CG 3.44Å; T554-M558 PolarHBondContact O-N 2.93Å; A555-M558 PolarHBondContact O-N 3.11Å; M558-S561 PolarHBondContact O-N 2.95Å; M558-V562 WeakPolarHBondContact O-CB 3.23Å; M558-V562 VanDerWaalsContact O-CG2 3.24Å; M558-V562 WeakPolarHBondContact O-CG2 3.38Å; M558-V562 PolarHBondContact O-N 2.83Å
559	R	71.5	Confident	68.4	Low	23 Å²	23	39 Å²	39	9%	0.087	21%	0.211	C	C	.	.	H	α-helix	trans	-59.1	-52	175.4	-66.4	-159.9	-61.2	-79.3	9.1	110.8	V539 M540 A555 Y556 S561 V562 I563 A619	V539-R559 PolarHBondContact O-NH2 3.01Å; M540-R559 PolarHBondContact SD-NH2 2.95Å; A555-R559 VanDerWaalsContact O-CG 3.26Å; A555-R559 WeakPolarHBondContact O-CG 3.4Å; A555-R559 PolarHBondContact O-N 3.5Å; Y556-R559 WeakPolarHBondContact O-CB 3.37Å; Y556-R559 PolarHBondContact O-N 3.45Å; R559-S561 PolarHBondContact O-N 3.02Å; R559-V562 PolarHBondContact O-N 2.84Å; R559-I563 WeakPolarHBondContact O-CD1 3.38Å; R559-I563 VanDerWaalsContact O-CG1 3.24Å; R559-I563 WeakPolarHBondContact O-CG1 3.44Å; R559-I563 PolarHBondContact O-N 2.76Å; R559-A619 HydrophobicContact CB-CB 4.34Å; R559-A619 HydrophobicContact CG-CB 3.65Å
560	A	70.7	Confident	67	Low	3 Å²	3	39.4 Å²	39.4	3%	0.025	22%	0.217	C	C	.	.	H	α-helix	trans	-57.7	-48.2	179.6	0	0	0	0	0	111.7	F535 Y556 I563 C564	F535-A560 HydrophobicContact CB-CB 4.13Å; F535-A560 HydrophobicContact CD2-CB 4.07Å; F535-A560 HydrophobicContact CG-CB 4.39Å; Y556-A560 PolarHBondContact O-N 3.35Å; A560-I563 PolarHBondContact O-N 3.29Å; A560-C564 WeakPolarHBondContact O-CB 3.37Å; A560-C564 PolarHBondContact O-N 3.44Å; A560-C564 PolarHBondContact O-SG 3.4Å
561	S	70.3	Confident	65.9	Low	7 Å²	7	39.7 Å²	39.7	5%	0.049	22%	0.221	C	C	.	.	H	α-helix	trans	-63.8	-45.3	178.3	-51.7	0	0	0	0	112	F557 M558 R559 I563 C564 S565	F557-S561 WeakPolarHBondContact O-CB 3.38Å; F557-S561 PolarHBondContact O-N 3.16Å; F557-S561 PolarHBondContact O-OG 3.29Å; M558-S561 PolarHBondContact O-N 2.95Å; R559-S561 PolarHBondContact O-N 3.02Å; S561-I563 PolarHBondContact O-N 2.95Å; S561-C564 PolarHBondContact O-N 3.35Å; S561-S565 WeakPolarHBondContact O-CB 3.33Å; S561-S565 PolarHBondContact O-N 3.48Å; S561-S565 PolarHBondContact O-OG 2.88Å; S561-S565 VanDerWaalsContact O-OG 3.07Å
562	V	67	Low	65.2	Low	18 Å²	18	40.3 Å²	40.3	11%	0.109	23%	0.233	C	C	.	.	H	α-helix	trans	-63.3	-40	-179.3	171.3	0	0	0	0	112.3	M558 R559 K566 L567 L569	M558-V562 WeakPolarHBondContact O-CB 3.23Å; M558-V562 VanDerWaalsContact O-CG2 3.24Å; M558-V562 WeakPolarHBondContact O-CG2 3.38Å; M558-V562 PolarHBondContact O-N 2.83Å; R559-V562 PolarHBondContact O-N 2.84Å; V562-K566 PolarHBondContact O-N 3.3Å; V562-L567 PolarHBondContact O-N 2.59Å; V562-L567 VanDerWaalsContact O-N 3.11Å; V562-L569 HydrophobicContact CG1-CB 4.03Å; V562-L569 HydrophobicContact CG2-CB 3.86Å; V562-L569 HydrophobicContact CG2-CD1 4.14Å
563	I	64.6	Low	65.1	Low	95 Å²	95	39 Å²	39	49%	0.487	23%	0.227	S	C	.	.	H	α-helix	trans	-61.8	-49.1	174.5	-66.1	163.5	0	0	0	110.1	R559 A560 S561 K566	R559-I563 WeakPolarHBondContact O-CD1 3.38Å; R559-I563 VanDerWaalsContact O-CG1 3.24Å; R559-I563 WeakPolarHBondContact O-CG1 3.44Å; R559-I563 PolarHBondContact O-N 2.76Å; A560-I563 PolarHBondContact O-N 3.29Å; S561-I563 PolarHBondContact O-N 2.95Å; I563-K566 PolarHBondContact O-N 3.16Å
564	C	60.8	Low	65.2	Low	5 Å²	5	42.7 Å²	42.7	3%	0.034	25%	0.247	C	C	.	.	H	α-helix	trans	-97.3	-2.5	-164.2	-49.1	0	0	0	0	114.1	Y451 F535 A560 S561	Y451-C564 CarbonylContact C-O 3.59Å; Y451-C564 WeakPolarHBondContact CA-O 3.48Å; Y451-C564 PolarHBondContact N-O 3.32Å; Y451-C564 VanDerWaalsContact O-O 3.08Å; F535-C564 HydrophobicContact CD1-CB 4.07Å; F535-C564 WeakPolarHBondContact CD1-SG 3.46Å; F535-C564 HydrophobicContact CE1-CB 3.3Å; F535-C564 WeakPolarHBondContact CE1-SG 3.32Å; F535-C564 HydrophobicContact CE2-CB 4.01Å; F535-C564 HydrophobicContact CZ-CB 3.23Å; A560-C564 WeakPolarHBondContact O-CB 3.37Å; A560-C564 PolarHBondContact O-N 3.44Å; A560-C564 PolarHBondContact O-SG 3.4Å; S561-C564 PolarHBondContact O-N 3.35Å
565	S	60.6	Low	65.6	Low	7 Å²	7	42.2 Å²	42.2	5%	0.049	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	0.7	161	-57.7	0	0	0	0	111.5	D449 I498 S561 L567	D449-S565 PolarHBondContact O-OG 3.01Å; I498-S565 WeakPolarHBondContact CD1-OG 3.35Å; S561-S565 WeakPolarHBondContact O-CB 3.33Å; S561-S565 PolarHBondContact O-N 3.48Å; S561-S565 PolarHBondContact O-OG 2.88Å; S561-S565 VanDerWaalsContact O-OG 3.07Å; S565-L567 PolarHBondContact O-N 2.99Å; S565-L567 VanDerWaalsContact O-N 3.15Å
566	K	60.8	Low	66.3	Low	92 Å²	92	44.3 Å²	44.3	40%	0.4	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	30.5	-179.1	-51.4	-172.7	-167.6	-172.2	0	114.7	Y451 E456 V562 I563 G568	Y451-K566 HydrophobicContact CD1-CD 4.48Å; Y451-K566 WeakPolarHBondContact O-CE 3.41Å; E456-K566 WeakPolarHBondContact OE1-CE 3.49Å; E456-K566 IonicContact OE1-NZ 2.7Å; E456-K566 PolarHBondContact OE1-NZ 2.8Å; E456-K566 VanDerWaalsContact OE2-CE 3.32Å; E456-K566 WeakPolarHBondContact OE2-CE 3.27Å; E456-K566 IonicContact OE2-NZ 2.84Å; E456-K566 PolarHBondContact OE2-NZ 3.45Å; V562-K566 PolarHBondContact O-N 3.3Å; I563-K566 PolarHBondContact O-N 3.16Å; K566-G568 VanDerWaalsContact C-N 3.35Å; K566-G568 PolarHBondContact O-N 3.42Å
567	L	49.1	Very low	67	Low	44 Å²	44	48.1 Å²	48.1	23%	0.23	26%	0.263	C	S	.	.			trans	-79.4	-8.3	-158.7	-94.8	175.5	0	0	0	116.2	P493 I498 V562 S565 L569	P493-L567 HydrophobicContact CB-CD1 4.27Å; P493-L567 HydrophobicContact CG-CD1 3.99Å; P493-L567 HydrophobicContact CG-CD2 4.15Å; P493-L567 HydrophobicContact CG-CG 3.94Å; P493-L567 WeakPolarHBondContact O-CD1 3.39Å; P493-L567 WeakPolarHBondContact O-CD2 3.47Å; I498-L567 HydrophobicContact CD1-CD1 3.91Å; V562-L567 PolarHBondContact O-N 2.59Å; V562-L567 VanDerWaalsContact O-N 3.11Å; S565-L567 PolarHBondContact O-N 2.99Å; S565-L567 VanDerWaalsContact O-N 3.15Å; L567-L569 HydrophobicContact CB-CD1 3.83Å; L567-L569 HydrophobicContact CB-CG 3.97Å; L567-L569 HydrophobicContact CD1-CD1 3.85Å; L567-L569 HydrophobicContact CG-CD1 4.38Å; L567-L569 PolarHBondContact O-N 2.68Å; L567-L569 VanDerWaalsContact O-N 3.09Å
568	G	43.6	Very low	67.6	Low	56 Å²	56	49.8 Å²	49.8	58%	0.577	27%	0.273	S	S	*	.			trans	63.3	14.7	-179.9	0	0	0	0	0	114.6	K566 G570	K566-G568 VanDerWaalsContact C-N 3.35Å; K566-G568 PolarHBondContact O-N 3.42Å; G568-G570 PolarHBondContact O-N 2.81Å
569	L	44.8	Very low	68.3	Low	69 Å²	69	50.2 Å²	50.2	36%	0.361	28%	0.278	S	S	.	.			trans	-77.3	55	179.3	-65	165.6	0	0	0	111.6	P495 V562 L567	P495-L569 HydrophobicContact CB-CD1 3.7Å; P495-L569 HydrophobicContact CB-CD2 4.16Å; P495-L569 HydrophobicContact CG-CD1 3.91Å; P495-L569 HydrophobicContact CG-CD2 4.07Å; P495-L569 HydrophobicContact CG-CG 4.47Å; V562-L569 HydrophobicContact CG1-CB 4.03Å; V562-L569 HydrophobicContact CG2-CB 3.86Å; V562-L569 HydrophobicContact CG2-CD1 4.14Å; L567-L569 HydrophobicContact CB-CD1 3.83Å; L567-L569 HydrophobicContact CB-CG 3.97Å; L567-L569 HydrophobicContact CD1-CD1 3.85Å; L567-L569 HydrophobicContact CG-CD1 4.38Å; L567-L569 PolarHBondContact O-N 2.68Å; L567-L569 VanDerWaalsContact O-N 3.09Å
570	G	50.1	Low	69.2	Low	22 Å²	22	50.3 Å²	50.3	23%	0.227	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-61.7	136.9	162.2	0	0	0	0	0	109.6	G568 V618	G568-G570 PolarHBondContact O-N 2.81Å; G570-V618 CarbonylContact C-O 3.52Å; G570-V618 VanDerWaalsContact CA-O 3.28Å; G570-V618 WeakPolarHBondContact CA-O 3.25Å
571	F	55.7	Low	70	Confident	89 Å²	89	58.2 Å²	58.2	39%	0.39	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-62.5	143.6	166.7	-68.7	-96	0	0	0	108.6	H573 V618 F620 E621	F571-H573 PolarHBondContact O-CD2 3.38Å; F571-H573 PolarHBondContact O-N 3.24Å; F571-V618 PolarHBondContact N-O 3.34Å; F571-F620 VanDerWaalsContact CB-O 3.27Å; F571-F620 WeakPolarHBondContact CB-O 3.42Å; F571-E621 HydrophobicContact CD1-CB 3.97Å; F571-E621 HydrophobicContact CD1-CG 4.21Å; F571-E621 HydrophobicContact CE1-CB 4.04Å; F571-E621 HydrophobicContact CE1-CG 4.4Å; F571-E621 HydrophobicContact CG-CB 4.46Å
572	V	59.6	Low	70.8	Confident	139 Å²	139	65.9 Å²	65.9	84%	0.842	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-75.8	118.8	-176.5	-176.9	0	0	0	0	110.2
573	H	74.3	Confident	71.8	Confident	21 Å²	21	70.2 Å²	70.2	10%	0.097	38%	0.378	C	S	.	.			trans	-121.2	143.7	175.8	-80.6	-104.3	0	0	0	110.7	F571 F575 C603 C606 V618 F620	F571-H573 PolarHBondContact O-CD2 3.38Å; F571-H573 PolarHBondContact O-N 3.24Å; H573-F575 HydrophobicContact CB-CD2 3.5Å; H573-F575 HydrophobicContact CB-CE2 3.31Å; H573-F575 HydrophobicContact CB-CG 4.27Å; H573-F575 HydrophobicContact CB-CZ 3.92Å; H573-F575 AromaticContact CG-CE2 3.88Å; H573-F575 PolarHBondContact O-N 3.02Å; H573-C603 HydrophobicContact CB-CB 4.19Å; H573-C603 PolarHBondContact ND1-SG 2.84Å; H573-C603 VanDerWaalsContact ND1-SG 3.37Å; H573-C606 PolarHBondContact CE1-SG 2.89Å; H573-C606 PolarHBondContact ND1-SG 3.28Å; H573-V618 WeakPolarHBondContact NE2-CG1 3.25Å; H573-F620 PolarHBondContact NE2-O 3.33Å
574	N	82.4	Confident	72.9	Confident	77 Å²	77	67.1 Å²	67.1	41%	0.412	36%	0.363	S	S	.	.			trans	-81.6	65.8	178.6	-169	2.4	0	0	0	111.3	C603 R604 D605	N574-C603 PolarHBondContact N-SG 3.38Å; N574-C603 WeakPolarHBondContact O-CA 3.31Å; N574-R604 HydrophobicContact CB-CB 4.41Å; N574-R604 PolarHBondContact O-N 2.8Å; N574-D605 WeakPolarHBondContact CB-OD2 3.46Å; N574-D605 PolarHBondContact ND2-OD2 3.09Å
575	F	87.6	Confident	74.2	Confident	34 Å²	34	72.2 Å²	72.2	15%	0.149	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	130.4	-175.2	-84.5	-61	0	0	0	113.4	H573 Y601 C603 M608 C610 K615 V618	H573-F575 HydrophobicContact CB-CD2 3.5Å; H573-F575 HydrophobicContact CB-CE2 3.31Å; H573-F575 HydrophobicContact CB-CG 4.27Å; H573-F575 HydrophobicContact CB-CZ 3.92Å; H573-F575 AromaticContact CG-CE2 3.88Å; H573-F575 PolarHBondContact O-N 3.02Å; F575-Y601 HydrophobicContact CB-CD1 4.23Å; F575-C603 HydrophobicContact CD1-CB 3.98Å; F575-C603 HydrophobicContact CE1-CB 3.82Å; F575-C603 HydrophobicContact CZ-CB 4.3Å; F575-M608 WeakPolarHBondContact CE1-O 3.32Å; F575-M608 HydrophobicContact CZ-SD 4.34Å; F575-C610 HydrophobicContact CE1-CB 3.95Å; F575-C610 HydrophobicContact CZ-CB 4.05Å; F575-K615 HydrophobicContact CD2-CB 3.84Å; F575-K615 HydrophobicContact CE2-CB 4.17Å; F575-K615 WeakPolarHBondContact CE2-O 3.46Å; F575-K615 HydrophobicContact CG-CB 4.16Å; F575-V618 HydrophobicContact CE2-CB 4.2Å; F575-V618 HydrophobicContact CE2-CG1 4.49Å; F575-V618 HydrophobicContact CE2-CG2 3.69Å; F575-V618 HydrophobicContact CZ-CG2 3.77Å
576	Q	88.2	Confident	75.4	Confident	80 Å²	80	72 Å²	72	37%	0.374	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	134.4	173.4	-64	-159.8	-22.7	0	0	112.2	T578 Y601 R602 R604	Q576-T578 PolarHBondContact O-N 3.34Å; Q576-T578 PolarHBondContact O-OG1 2.85Å; Q576-Y601 CarbonylContact O-C 3.49Å; Q576-Y601 VanDerWaalsContact O-CA 3.27Å; Q576-Y601 WeakPolarHBondContact O-CA 3.38Å; Q576-R602 PolarHBondContact N-O 3.09Å; Q576-R602 PolarHBondContact O-N 3.07Å; Q576-R604 HydrophobicContact CG-CG 4.33Å
577	E	92.4	Very high	76.3	Confident	86 Å²	86	71 Å²	71	40%	0.402	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	123.4	177	-169.2	179.3	-127.5	0	0	110	K598 Y601	E577-K598 HydrophobicContact CG-CB 3.97Å; E577-K598 HydrophobicContact CG-CD 4.24Å; E577-K598 HydrophobicContact CG-CG 4.05Å; E577-K598 WeakPolarHBondContact OE2-CD 3.2Å; E577-K598 WeakPolarHBondContact OE2-CE 3.45Å; E577-K598 IonicContact OE2-NZ 3.61Å; E577-K598 PolarHBondContact OE2-NZ 2.91Å; E577-Y601 HydrophobicContact CB-CD1 4.19Å; E577-Y601 HydrophobicContact CB-CE1 3.85Å
578	T	89.3	Confident	77.4	Confident	37 Å²	37	71 Å²	71	23%	0.227	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	132.2	-167	-65.9	0	0	0	0	110.1	Q576 Y580 Q599 G600 R602	Q576-T578 PolarHBondContact O-N 3.34Å; Q576-T578 PolarHBondContact O-OG1 2.85Å; T578-Y580 HydrophobicContact CG2-CD1 4.32Å; T578-Y580 HydrophobicContact CG2-CD2 4.15Å; T578-Y580 HydrophobicContact CG2-CE1 4.01Å; T578-Y580 HydrophobicContact CG2-CE2 3.84Å; T578-Y580 HydrophobicContact CG2-CG 4.39Å; T578-Y580 WeakPolarHBondContact O-CD2 3.24Å; T578-Y580 WeakPolarHBondContact O-CE2 3.41Å; T578-Q599 PolarHBondContact O-N 3.19Å; T578-G600 PolarHBondContact N-O 2.95Å; T578-R602 HydrophobicContact CG2-CB 4.29Å; T578-R602 VanDerWaalsContact OG1-CB 3.31Å; T578-R602 WeakPolarHBondContact OG1-CB 3.42Å
579	T	91.6	Very high	78.8	Confident	51 Å²	51	71.1 Å²	71.1	31%	0.313	37%	0.374	S	S	.	.			trans	-86.4	119.6	166.5	-68.2	0	0	0	0	109	M581 I597 K598	T579-M581 HydrophobicContact CG2-CE 3.68Å; T579-M581 HydrophobicContact CG2-SD 3.94Å; T579-I597 HydrophobicContact CG2-CB 4.14Å; T579-I597 HydrophobicContact CG2-CG2 4.01Å; T579-K598 PolarHBondContact OG1-N 2.91Å
580	Y	88.8	Confident	80.3	Confident	24 Å²	24	72.3 Å²	72.3	9%	0.094	39%	0.388	C	S	.	.			trans	-94.1	120.4	178.4	-64.3	-91.4	0	0	0	109.8	T578 K582 T584 L593 Q599 Y601 R602 N609	T578-Y580 HydrophobicContact CG2-CD1 4.32Å; T578-Y580 HydrophobicContact CG2-CD2 4.15Å; T578-Y580 HydrophobicContact CG2-CE1 4.01Å; T578-Y580 HydrophobicContact CG2-CE2 3.84Å; T578-Y580 HydrophobicContact CG2-CG 4.39Å; T578-Y580 WeakPolarHBondContact O-CD2 3.24Å; T578-Y580 WeakPolarHBondContact O-CE2 3.41Å; Y580-K582 PolarHBondContact O-N 3.2Å; Y580-T584 HydrophobicContact CD1-CG2 3.68Å; Y580-T584 WeakPolarHBondContact CD1-OG1 3.45Å; Y580-T584 HydrophobicContact CE1-CG2 3.77Å; Y580-T584 HydrophobicContact CG-CG2 4.34Å; Y580-L593 HydrophobicContact CD2-CD1 3.89Å; Y580-L593 HydrophobicContact CE1-CD1 4.41Å; Y580-L593 HydrophobicContact CE2-CD1 3.54Å; Y580-L593 HydrophobicContact CG-CD1 4.45Å; Y580-Q599 HydrophobicContact CD2-CB 4.28Å; Y580-Q599 PolarHBondContact O-NE2 3.28Å; Y580-Q599 VanDerWaalsContact O-NE2 3.07Å; Y580-Y601 PolarHBondContact OH-O 3.46Å; Y580-R602 WeakPolarHBondContact OH-CB 3.5Å; Y580-N609 HydrophobicContact CE1-CB 4.4Å; Y580-N609 VanDerWaalsContact CE1-OD1 3.32Å; Y580-N609 WeakPolarHBondContact CE1-OD1 3.26Å; Y580-N609 WeakPolarHBondContact OH-CB 3.28Å; Y580-N609 PolarHBondContact OH-OD1 3.05Å; Y580-N609 VanDerWaalsContact OH-OD1 3.1Å
581	M	88.4	Confident	81.5	Confident	170 Å²	170	72.5 Å²	72.5	84%	0.837	39%	0.391	S	S	*	.	S	Bend	trans	-85.6	6.1	178	-55.6	-57.1	-178.5	0	0	113.1	T579	T579-M581 HydrophobicContact CG2-CE 3.68Å; T579-M581 HydrophobicContact CG2-SD 3.94Å
582	K	87.7	Confident	83	Confident	168 Å²	168	71.5 Å²	71.5	73%	0.73	39%	0.386	S	S	*	.	S	Bend	trans	-139.1	149.9	176.7	-66.9	-174.1	179	-177.7	0	109.2	Y580 T584	Y580-K582 PolarHBondContact O-N 3.2Å; K582-T584 PolarHBondContact O-N 3.02Å; K582-T584 VanDerWaalsContact O-N 3.13Å; K582-T584 PolarHBondContact O-OG1 3.4Å
583	P	87.8	Confident	84.4	Confident	108 Å²	108	65 Å²	65	70%	0.701	35%	0.347	S	S	*	.			trans	-49.2	119.9	169.7	-27.4	36.3	0	0	0	110.5	F592	P583-F592 HydrophobicContact CB-CE2 3.73Å; P583-F592 HydrophobicContact CB-CZ 4.15Å
584	T	87.2	Confident	84.9	Confident	30 Å²	30	74.1 Å²	74.1	18%	0.184	38%	0.38	C	S	.	.			trans	-135.8	147.7	-173.8	-54.3	0	0	0	0	109.5	Y580 K582 F592 L593 N609	Y580-T584 HydrophobicContact CD1-CG2 3.68Å; Y580-T584 WeakPolarHBondContact CD1-OG1 3.45Å; Y580-T584 HydrophobicContact CE1-CG2 3.77Å; Y580-T584 HydrophobicContact CG-CG2 4.34Å; K582-T584 PolarHBondContact O-N 3.02Å; K582-T584 VanDerWaalsContact O-N 3.13Å; K582-T584 PolarHBondContact O-OG1 3.4Å; T584-F592 VanDerWaalsContact O-CD2 3.29Å; T584-F592 WeakPolarHBondContact O-CD2 3.17Å; T584-F592 WeakPolarHBondContact O-CE2 3.43Å; T584-L593 HydrophobicContact CG2-CD1 3.89Å; T584-L593 WeakPolarHBondContact O-CB 3.24Å; T584-L593 WeakPolarHBondContact O-CG 3.15Å; T584-L593 PolarHBondContact O-N 2.94Å; T584-N609 HydrophobicContact CG2-CB 4.34Å
585	F	88.1	Confident	84.8	Confident	113 Å²	113	72.7 Å²	72.7	50%	0.496	38%	0.384	S	S	.	.	B	Isolated β-bridge	trans	-112.6	165.5	-177.4	-62.5	-97.8	0	0	0	110.4	S590 F592	F585-S590 WeakPolarHBondContact CD1-O 3.36Å; F585-F592 HydrophobicContact CD1-CB 4.03Å; F585-F592 HydrophobicContact CD1-CD2 4.04Å; F585-F592 HydrophobicContact CD2-CD2 4.45Å; F585-F592 HydrophobicContact CE1-CB 3.94Å; F585-F592 AromaticContact CE1-CD2 3.74Å; F585-F592 HydrophobicContact CE1-CD2 3.74Å; F585-F592 HydrophobicContact CE1-CG 4.31Å; F585-F592 HydrophobicContact CE2-CD2 4.17Å; F585-F592 HydrophobicContact CG-CD2 4.38Å; F585-F592 AromaticContact CZ-CD2 3.8Å; F585-F592 HydrophobicContact CZ-CD2 3.8Å; F585-F592 HydrophobicContact CZ-CE2 4.47Å
586	C	86.6	Confident	84.3	Confident	1 Å²	1	77.6 Å²	77.6	1%	0.007	42%	0.417	C	S	.	.			trans	-90.5	120	175.1	171.3	0	0	0	0	110.5	N588 C589 S590 G591 L593 N609 C610 H611	C586-N588 PolarHBondContact O-N 2.93Å; C586-N588 PolarHBondContact SG-N 3.49Å; C586-N588 VanDerWaalsContact SG-N 3.42Å; C586-C589 PolarHBondContact O-N 2.9Å; C586-C589 VanDerWaalsContact SG-SG 3.62Å; C586-S590 VanDerWaalsContact O-CA 3.25Å; C586-S590 WeakPolarHBondContact O-CA 3.38Å; C586-S590 PolarHBondContact O-N 3.5Å; C586-G591 PolarHBondContact N-O 3.42Å; C586-L593 HydrophobicContact CB-CD2 3.87Å; C586-N609 WeakPolarHBondContact CA-O 3.41Å; C586-C610 VanDerWaalsContact SG-CA 3.58Å; C586-H611 VanDerWaalsContact CB-CE1 3.42Å; C586-H611 WeakPolarHBondContact CB-CE1 3.46Å; C586-H611 VanDerWaalsContact CB-ND1 3.25Å; C586-H611 WeakPolarHBondContact CB-ND1 3.25Å
587	D	78.6	Confident	84.2	Confident	73 Å²	73	79.1 Å²	79.1	39%	0.39	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-3.5	-177.6	-51.2	-24	0	0	0	113	M608 N609 F620	D587-M608 HydrophobicContact CB-CE 3.68Å; D587-M608 HydrophobicContact CB-CG 3.7Å; D587-M608 WeakPolarHBondContact OD2-CA 3.28Å; D587-M608 WeakPolarHBondContact OD2-CG 3.48Å; D587-N609 PolarHBondContact N-O 3.41Å; D587-N609 PolarHBondContact OD2-N 2.84Å; D587-N609 PolarHBondContact OD2-ND2 3.21Å; D587-F620 WeakPolarHBondContact O-CE2 3.38Å
588	N	72.8	Confident	83.9	Confident	44 Å²	44	80.7 Å²	80.7	24%	0.235	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-24.5	177.5	-170.8	80.5	0	0	0	113.9	C586 M608 C614 V618	C586-N588 PolarHBondContact O-N 2.93Å; C586-N588 PolarHBondContact SG-N 3.49Å; C586-N588 VanDerWaalsContact SG-N 3.42Å; N588-M608 HydrophobicContact CB-CE 3.97Å; N588-C614 HydrophobicContact CB-CB 4.11Å; N588-V618 HydrophobicContact CB-CG2 4.34Å; N588-V618 WeakPolarHBondContact OD1-CA 3.5Å
589	C	73.4	Confident	83.9	Confident	57 Å²	57	80.1 Å²	80.1	39%	0.385	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.9	2.3	-177.4	73.1	0	0	0	0	113.9	C586 G591 H611	C586-C589 PolarHBondContact O-N 2.9Å; C586-C589 VanDerWaalsContact SG-SG 3.62Å; C589-G591 PolarHBondContact O-N 3.37Å; C589-G591 PolarHBondContact SG-N 3.39Å; C589-H611 PolarHBondContact SG-CE1 3.29Å; C589-H611 PolarHBondContact SG-ND1 3.42Å
590	S	75.3	Confident	83.9	Confident	94 Å²	94	77.8 Å²	77.8	66%	0.657	41%	0.412	S	S	*	.			trans	56.7	-1.3	-171.6	69.7	0	0	0	0	116.4	F585 C586	F585-S590 WeakPolarHBondContact CD1-O 3.36Å; C586-S590 VanDerWaalsContact O-CA 3.25Å; C586-S590 WeakPolarHBondContact O-CA 3.38Å; C586-S590 PolarHBondContact O-N 3.5Å
591	G	75.6	Confident	84.1	Confident	27 Å²	27	78.3 Å²	78.3	28%	0.278	42%	0.415	S	S	.	.			trans	-74.9	150	-179.5	0	0	0	0	0	113.6	C586 C589 H611	C586-G591 PolarHBondContact N-O 3.42Å; C589-G591 PolarHBondContact O-N 3.37Å; C589-G591 PolarHBondContact SG-N 3.39Å; G591-H611 PolarHBondContact O-CE1 3.22Å
592	F	88.1	Confident	84.2	Confident	67 Å²	67	76.4 Å²	76.4	29%	0.294	40%	0.398	S	S	.	.	B	Isolated β-bridge	trans	-65.8	140	-178.9	-172.8	-113.1	0	0	0	113.3	P583 T584 F585 W594 H611	P583-F592 HydrophobicContact CB-CE2 3.73Å; P583-F592 HydrophobicContact CB-CZ 4.15Å; T584-F592 VanDerWaalsContact O-CD2 3.29Å; T584-F592 WeakPolarHBondContact O-CD2 3.17Å; T584-F592 WeakPolarHBondContact O-CE2 3.43Å; F585-F592 HydrophobicContact CD1-CB 4.03Å; F585-F592 HydrophobicContact CD1-CD2 4.04Å; F585-F592 HydrophobicContact CD2-CD2 4.45Å; F585-F592 HydrophobicContact CE1-CB 3.94Å; F585-F592 AromaticContact CE1-CD2 3.74Å; F585-F592 HydrophobicContact CE1-CD2 3.74Å; F585-F592 HydrophobicContact CE1-CG 4.31Å; F585-F592 HydrophobicContact CE2-CD2 4.17Å; F585-F592 HydrophobicContact CG-CD2 4.38Å; F585-F592 AromaticContact CZ-CD2 3.8Å; F585-F592 HydrophobicContact CZ-CD2 3.8Å; F585-F592 HydrophobicContact CZ-CE2 4.47Å; F592-W594 AromaticContact CD1-CD1 4Å; F592-W594 HydrophobicContact CD1-CD2 4.07Å; F592-W594 HydrophobicContact CD1-CG 4.06Å; F592-W594 AromaticContact CD1-NE1 3.98Å; F592-W594 VanDerWaalsContact O-CD1 3.32Å; F592-W594 PolarHBondContact O-N 2.84Å; F592-H611 PolarHBondContact O-NE2 3.33Å
593	L	87.6	Confident	84.3	Confident	4 Å²	4	68.5 Å²	68.5	2%	0.021	36%	0.364	C	S	.	.			trans	-80.4	95	174.1	-60.9	-176.8	0	0	0	109.9	Y580 T584 C586 Q599 N609	Y580-L593 HydrophobicContact CD2-CD1 3.89Å; Y580-L593 HydrophobicContact CE1-CD1 4.41Å; Y580-L593 HydrophobicContact CE2-CD1 3.54Å; Y580-L593 HydrophobicContact CG-CD1 4.45Å; T584-L593 HydrophobicContact CG2-CD1 3.89Å; T584-L593 WeakPolarHBondContact O-CB 3.24Å; T584-L593 WeakPolarHBondContact O-CG 3.15Å; T584-L593 PolarHBondContact O-N 2.94Å; C586-L593 HydrophobicContact CB-CD2 3.87Å; L593-Q599 HydrophobicContact CB-CB 3.82Å; L593-Q599 WeakPolarHBondContact O-CB 3.49Å; L593-N609 HydrophobicContact CD1-CB 4.43Å
594	W	84.8	Confident	84.2	Confident	211 Å²	211	71.5 Å²	71.5	80%	0.799	36%	0.361	S	S	*	.			trans	-75.2	131.8	-177.8	-76.2	88.4	0	0	0	113.3	F592	F592-W594 AromaticContact CD1-CD1 4Å; F592-W594 HydrophobicContact CD1-CD2 4.07Å; F592-W594 HydrophobicContact CD1-CG 4.06Å; F592-W594 AromaticContact CD1-NE1 3.98Å; F592-W594 VanDerWaalsContact O-CD1 3.32Å; F592-W594 PolarHBondContact O-N 2.84Å
595	G	80.3	Confident	83.9	Confident	48 Å²	48	72.3 Å²	72.3	50%	0.495	37%	0.365	S	S	.	.	S	Bend	trans	145.9	168.3	168.8	0	0	0	0	0	113.5	Q599	G595-Q599 VanDerWaalsContact C-CG 3.45Å; G595-Q599 WeakPolarHBondContact O-CG 3.41Å; G595-Q599 PolarHBondContact O-NE2 2.95Å; G595-Q599 VanDerWaalsContact O-NE2 3.1Å
596	V	77.2	Confident	83.4	Confident	137 Å²	137	68.6 Å²	68.6	83%	0.83	35%	0.352	S	S	*	.	S	Bend	trans	-86.8	-34	174.6	-176.5	0	0	0	0	111.4	Q599	V596-Q599 PolarHBondContact O-NE2 3.02Å
597	I	86.1	Confident	83.3	Confident	112 Å²	112	69.4 Å²	69.4	57%	0.574	36%	0.361	S	S	*	.	S	Bend	trans	-140.8	162.8	174.5	59.7	173.3	0	0	0	109.4	T579 Q599	T579-I597 HydrophobicContact CG2-CB 4.14Å; T579-I597 HydrophobicContact CG2-CG2 4.01Å; I597-Q599 PolarHBondContact O-N 2.97Å; I597-Q599 VanDerWaalsContact O-N 3.17Å
598	K	86.9	Confident	83.6	Confident	118 Å²	118	66.9 Å²	66.9	51%	0.513	35%	0.347	S	S	.	.			trans	51	37.7	175.6	-62.5	-179	161.9	-146.7	0	114.1	E577 T579 G600	E577-K598 HydrophobicContact CG-CB 3.97Å; E577-K598 HydrophobicContact CG-CD 4.24Å; E577-K598 HydrophobicContact CG-CG 4.05Å; E577-K598 WeakPolarHBondContact OE2-CD 3.2Å; E577-K598 WeakPolarHBondContact OE2-CE 3.45Å; E577-K598 IonicContact OE2-NZ 3.61Å; E577-K598 PolarHBondContact OE2-NZ 2.91Å; T579-K598 PolarHBondContact OG1-N 2.91Å; K598-G600 PolarHBondContact O-N 3.42Å; K598-G600 VanDerWaalsContact O-N 3.16Å
599	Q	89.4	Confident	84.4	Confident	25 Å²	25	66.1 Å²	66.1	12%	0.117	34%	0.343	C	S	.	.			trans	-67.6	-17.3	-170.5	-56	94.3	-32.3	0	0	114	T578 Y580 L593 G595 V596 I597	T578-Q599 PolarHBondContact O-N 3.19Å; Y580-Q599 HydrophobicContact CD2-CB 4.28Å; Y580-Q599 PolarHBondContact O-NE2 3.28Å; Y580-Q599 VanDerWaalsContact O-NE2 3.07Å; L593-Q599 HydrophobicContact CB-CB 3.82Å; L593-Q599 WeakPolarHBondContact O-CB 3.49Å; G595-Q599 VanDerWaalsContact C-CG 3.45Å; G595-Q599 WeakPolarHBondContact O-CG 3.41Å; G595-Q599 PolarHBondContact O-NE2 2.95Å; G595-Q599 VanDerWaalsContact O-NE2 3.1Å; V596-Q599 PolarHBondContact O-NE2 3.02Å; I597-Q599 PolarHBondContact O-N 2.97Å; I597-Q599 VanDerWaalsContact O-N 3.17Å
600	G	90.9	Very high	85.1	Confident	2 Å²	2	63.4 Å²	63.4	2%	0.021	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.4	-165.9	177.1	0	0	0	0	0	112.7	T578 K598 C610	T578-G600 PolarHBondContact N-O 2.95Å; K598-G600 PolarHBondContact O-N 3.42Å; K598-G600 VanDerWaalsContact O-N 3.16Å; G600-C610 CarbonylContact C-O 3.55Å; G600-C610 VanDerWaalsContact CA-O 3.25Å; G600-C610 WeakPolarHBondContact CA-O 3.44Å
601	Y	92.9	Very high	85.8	Confident	36 Å²	36	61 Å²	61	14%	0.141	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	141.9	178.8	-71	-104.5	0	0	0	109.5	F575 Q576 E577 Y580 N609 C610 K612 K615	F575-Y601 HydrophobicContact CB-CD1 4.23Å; Q576-Y601 CarbonylContact O-C 3.49Å; Q576-Y601 VanDerWaalsContact O-CA 3.27Å; Q576-Y601 WeakPolarHBondContact O-CA 3.38Å; E577-Y601 HydrophobicContact CB-CD1 4.19Å; E577-Y601 HydrophobicContact CB-CE1 3.85Å; Y580-Y601 PolarHBondContact OH-O 3.46Å; Y601-N609 CarbonylContact O-C 3.48Å; Y601-N609 WeakPolarHBondContact O-CA 3.3Å; Y601-C610 PolarHBondContact N-O 3.07Å; Y601-C610 PolarHBondContact O-N 3.05Å; Y601-K612 HydrophobicContact CD2-CB 4.3Å; Y601-K612 HydrophobicContact CE2-CB 3.69Å; Y601-K612 HydrophobicContact CE2-CD 4.26Å; Y601-K612 HydrophobicContact CE2-CG 3.7Å; Y601-K615 HydrophobicContact CD1-CD 4.04Å; Y601-K615 HydrophobicContact CD2-CD 4.12Å; Y601-K615 HydrophobicContact CE1-CD 4.09Å; Y601-K615 HydrophobicContact CE2-CD 4.19Å; Y601-K615 HydrophobicContact CG-CD 4.06Å
602	R	91.6	Very high	86.2	Confident	129 Å²	129	66.3 Å²	66.3	49%	0.487	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	131.4	174.1	-164.8	170.5	174	-128.7	-3	110.4	Q576 T578 Y580 G607 M608	Q576-R602 PolarHBondContact N-O 3.09Å; Q576-R602 PolarHBondContact O-N 3.07Å; T578-R602 HydrophobicContact CG2-CB 4.29Å; T578-R602 VanDerWaalsContact OG1-CB 3.31Å; T578-R602 WeakPolarHBondContact OG1-CB 3.42Å; Y580-R602 WeakPolarHBondContact OH-CB 3.5Å; R602-G607 WeakPolarHBondContact CG-O 3.49Å; R602-G607 PolarHBondContact NE-O 2.84Å; R602-M608 CarbonylContact C-O 3.54Å; R602-M608 VanDerWaalsContact CA-O 3.26Å; R602-M608 WeakPolarHBondContact CA-O 3.41Å
603	C	89.2	Confident	85.6	Confident	2 Å²	2	69.9 Å²	69.9	1%	0.014	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	128.8	174.8	-179.4	0	0	0	0	110.1	H573 N574 F575 D605 C606 G607 M608	H573-C603 HydrophobicContact CB-CB 4.19Å; H573-C603 PolarHBondContact ND1-SG 2.84Å; H573-C603 VanDerWaalsContact ND1-SG 3.37Å; N574-C603 PolarHBondContact N-SG 3.38Å; N574-C603 WeakPolarHBondContact O-CA 3.31Å; F575-C603 HydrophobicContact CD1-CB 3.98Å; F575-C603 HydrophobicContact CE1-CB 3.82Å; F575-C603 HydrophobicContact CZ-CB 4.3Å; C603-D605 VanDerWaalsContact C-N 3.32Å; C603-D605 PolarHBondContact O-N 3.16Å; C603-C606 VanDerWaalsContact CB-SG 3.54Å; C603-G607 WeakPolarHBondContact O-CA 3.48Å; C603-G607 PolarHBondContact O-N 3.11Å; C603-M608 HydrophobicContact CB-CB 4.4Å; C603-M608 PolarHBondContact N-O 2.83Å
604	R	85.5	Confident	85.1	Confident	172 Å²	172	70.5 Å²	70.5	65%	0.649	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-35.1	178.4	-80.2	-162.1	172.1	-162.3	4	113.8	N574 Q576	N574-R604 HydrophobicContact CB-CB 4.41Å; N574-R604 PolarHBondContact O-N 2.8Å; Q576-R604 HydrophobicContact CG-CG 4.33Å
605	D	80.3	Confident	84.7	Confident	47 Å²	47	62.9 Å²	62.9	25%	0.251	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-32.7	-165.3	-67.3	-85.5	0	0	0	113.4	N574 C603 K624 N625	N574-D605 WeakPolarHBondContact CB-OD2 3.46Å; N574-D605 PolarHBondContact ND2-OD2 3.09Å; C603-D605 VanDerWaalsContact C-N 3.32Å; C603-D605 PolarHBondContact O-N 3.16Å; D605-K624 HydrophobicContact CB-CG 4.02Å; D605-K624 WeakPolarHBondContact O-CA 3.34Å; D605-K624 WeakPolarHBondContact OD1-CE 3.49Å; D605-K624 IonicContact OD1-NZ 3.3Å; D605-K624 PolarHBondContact OD1-NZ 3.26Å; D605-N625 PolarHBondContact O-N 3.34Å
606	C	78.1	Confident	84.1	Confident	34 Å²	34	65.2 Å²	65.2	23%	0.23	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.9	-16.6	177	71	0	0	0	0	114.2	H573 C603 M608 K623	H573-C606 PolarHBondContact CE1-SG 2.89Å; H573-C606 PolarHBondContact ND1-SG 3.28Å; C603-C606 VanDerWaalsContact CB-SG 3.54Å; C606-M608 VanDerWaalsContact SG-CB 3.54Å; C606-K623 VanDerWaalsContact CB-O 3.27Å; C606-K623 WeakPolarHBondContact CB-O 3.45Å
607	G	84.2	Confident	83.5	Confident	19 Å²	19	64.5 Å²	64.5	20%	0.196	31%	0.305	C	S	.	.			trans	86.4	-2.5	179.7	0	0	0	0	0	116.6	R602 C603 N609	R602-G607 WeakPolarHBondContact CG-O 3.49Å; R602-G607 PolarHBondContact NE-O 2.84Å; C603-G607 WeakPolarHBondContact O-CA 3.48Å; C603-G607 PolarHBondContact O-N 3.11Å; G607-N609 PolarHBondContact O-OD1 3.18Å
608	M	85.4	Confident	82.4	Confident	19 Å²	19	59.1 Å²	59.1	9%	0.094	28%	0.278	C	S	.	.			trans	-58.9	146.4	-178.5	-170.9	-171.8	-178.9	0	0	113.1	F575 D587 N588 R602 C603 C606 V618 F620	F575-M608 WeakPolarHBondContact CE1-O 3.32Å; F575-M608 HydrophobicContact CZ-SD 4.34Å; D587-M608 HydrophobicContact CB-CE 3.68Å; D587-M608 HydrophobicContact CB-CG 3.7Å; D587-M608 WeakPolarHBondContact OD2-CA 3.28Å; D587-M608 WeakPolarHBondContact OD2-CG 3.48Å; N588-M608 HydrophobicContact CB-CE 3.97Å; R602-M608 CarbonylContact C-O 3.54Å; R602-M608 VanDerWaalsContact CA-O 3.26Å; R602-M608 WeakPolarHBondContact CA-O 3.41Å; C603-M608 HydrophobicContact CB-CB 4.4Å; C603-M608 PolarHBondContact N-O 2.83Å; C606-M608 VanDerWaalsContact SG-CB 3.54Å; M608-V618 HydrophobicContact CE-CG1 3.89Å; M608-V618 HydrophobicContact CE-CG2 4.21Å; M608-V618 HydrophobicContact SD-CG1 3.57Å; M608-V618 VanDerWaalsContact SD-CG1 3.57Å; M608-V618 HydrophobicContact SD-CG2 4.4Å; M608-F620 HydrophobicContact CE-CD2 3.65Å; M608-F620 HydrophobicContact CE-CE2 4.14Å
609	N	90	Very high	80.8	Confident	28 Å²	28	54.1 Å²	54.1	15%	0.15	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	132	-171.9	-45	-80.8	0	0	0	110.8	Y580 T584 C586 D587 L593 Y601 G607	Y580-N609 HydrophobicContact CE1-CB 4.4Å; Y580-N609 VanDerWaalsContact CE1-OD1 3.32Å; Y580-N609 WeakPolarHBondContact CE1-OD1 3.26Å; Y580-N609 WeakPolarHBondContact OH-CB 3.28Å; Y580-N609 PolarHBondContact OH-OD1 3.05Å; Y580-N609 VanDerWaalsContact OH-OD1 3.1Å; T584-N609 HydrophobicContact CG2-CB 4.34Å; C586-N609 WeakPolarHBondContact CA-O 3.41Å; D587-N609 PolarHBondContact N-O 3.41Å; D587-N609 PolarHBondContact OD2-N 2.84Å; D587-N609 PolarHBondContact OD2-ND2 3.21Å; L593-N609 HydrophobicContact CD1-CB 4.43Å; Y601-N609 CarbonylContact O-C 3.48Å; Y601-N609 WeakPolarHBondContact O-CA 3.3Å; G607-N609 PolarHBondContact O-OD1 3.18Å
610	C	88.6	Confident	79.5	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	148.9	-173.9	-83.3	0	0	0	0	114.9	F575 C586 G600 Y601 C614 K615 V618	F575-C610 HydrophobicContact CE1-CB 3.95Å; F575-C610 HydrophobicContact CZ-CB 4.05Å; C586-C610 VanDerWaalsContact SG-CA 3.58Å; G600-C610 CarbonylContact C-O 3.55Å; G600-C610 VanDerWaalsContact CA-O 3.25Å; G600-C610 WeakPolarHBondContact CA-O 3.44Å; Y601-C610 PolarHBondContact N-O 3.07Å; Y601-C610 PolarHBondContact O-N 3.05Å; C610-C614 HydrophobicContact CB-CB 4.39Å; C610-K615 HydrophobicContact CB-CB 4.34Å; C610-V618 WeakPolarHBondContact SG-CG2 3.48Å
611	H	88.3	Confident	78	Confident	44 Å²	44	62.1 Å²	62.1	20%	0.204	29%	0.294	C	S	.	.			trans	-64.8	158.5	162.8	-61	104.5	0	0	0	111.1	C586 C589 G591 F592 L613 C614 K615	C586-H611 VanDerWaalsContact CB-CE1 3.42Å; C586-H611 WeakPolarHBondContact CB-CE1 3.46Å; C586-H611 VanDerWaalsContact CB-ND1 3.25Å; C586-H611 WeakPolarHBondContact CB-ND1 3.25Å; C589-H611 PolarHBondContact SG-CE1 3.29Å; C589-H611 PolarHBondContact SG-ND1 3.42Å; G591-H611 PolarHBondContact O-CE1 3.22Å; F592-H611 PolarHBondContact O-NE2 3.33Å; H611-L613 PolarHBondContact O-N 3.1Å; H611-C614 HydrophobicContact CB-CB 4.29Å; H611-C614 PolarHBondContact O-N 2.81Å; H611-K615 PolarHBondContact O-N 3.05Å
612	K	84.3	Confident	77	Confident	138 Å²	138	62.1 Å²	62.1	60%	0.6	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-35.2	175.9	-171.6	167.7	-178.2	174.8	0	114	Y601 K615	Y601-K612 HydrophobicContact CD2-CB 4.3Å; Y601-K612 HydrophobicContact CE2-CB 3.69Å; Y601-K612 HydrophobicContact CE2-CD 4.26Å; Y601-K612 HydrophobicContact CE2-CG 3.7Å; K612-K615 WeakPolarHBondContact O-CG 3.42Å
613	L	76.6	Confident	75.8	Confident	143 Å²	143	62.8 Å²	62.8	75%	0.749	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-32.3	177.8	-62.1	175.1	0	0	0	112.5	H611	H611-L613 PolarHBondContact O-N 3.1Å
614	C	77.3	Confident	74.2	Confident	16 Å²	16	69.9 Å²	69.9	11%	0.108	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-28.6	-178.5	-61.9	0	0	0	0	113	N588 C610 H611 D616 Q617 V618	N588-C614 HydrophobicContact CB-CB 4.11Å; C610-C614 HydrophobicContact CB-CB 4.39Å; H611-C614 HydrophobicContact CB-CB 4.29Å; H611-C614 PolarHBondContact O-N 2.81Å; C614-D616 PolarHBondContact O-N 3.02Å; C614-D616 VanDerWaalsContact O-N 3.11Å; C614-Q617 CarbonylContact O-C 3.48Å; C614-Q617 WeakPolarHBondContact O-CA 3.42Å; C614-Q617 PolarHBondContact O-N 3.05Å; C614-V618 WeakPolarHBondContact O-CG2 3.48Å; C614-V618 PolarHBondContact O-N 3.17Å
615	K	76.6	Confident	72.2	Confident	52 Å²	52	67.1 Å²	67.1	23%	0.226	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-53.3	-35.4	-173.1	82.1	-173.7	176.2	67	0	114.1	F575 Y601 C610 H611 K612 Q617	F575-K615 HydrophobicContact CD2-CB 3.84Å; F575-K615 HydrophobicContact CE2-CB 4.17Å; F575-K615 WeakPolarHBondContact CE2-O 3.46Å; F575-K615 HydrophobicContact CG-CB 4.16Å; Y601-K615 HydrophobicContact CD1-CD 4.04Å; Y601-K615 HydrophobicContact CD2-CD 4.12Å; Y601-K615 HydrophobicContact CE1-CD 4.09Å; Y601-K615 HydrophobicContact CE2-CD 4.19Å; Y601-K615 HydrophobicContact CG-CD 4.06Å; C610-K615 HydrophobicContact CB-CB 4.34Å; H611-K615 PolarHBondContact O-N 3.05Å; K612-K615 WeakPolarHBondContact O-CG 3.42Å; K615-Q617 VanDerWaalsContact C-N 3.35Å
616	D	66.9	Low	70.2	Confident	97 Å²	97	71.5 Å²	71.5	52%	0.519	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-91.1	-1.2	-177.8	-57.8	-48.5	0	0	0	112.5	C614	C614-D616 PolarHBondContact O-N 3.02Å; C614-D616 VanDerWaalsContact O-N 3.11Å
617	Q	63.4	Low	68.1	Low	121 Å²	121	80.8 Å²	80.8	57%	0.565	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-116.1	11.6	179	-59.2	-179.8	-11.6	0	0	111.7	C614 K615 A619	C614-Q617 CarbonylContact O-C 3.48Å; C614-Q617 WeakPolarHBondContact O-CA 3.42Å; C614-Q617 PolarHBondContact O-N 3.05Å; K615-Q617 VanDerWaalsContact C-N 3.35Å; Q617-A619 PolarHBondContact O-N 3.46Å; Q617-A619 VanDerWaalsContact O-N 3.1Å
618	V	63	Low	65.6	Low	0 Å²	0	85.3 Å²	85.3	0%	0	42%	0.422	C	S	.	.			trans	-66.5	109.8	-173	165.9	0	0	0	0	111.7	G570 F571 H573 F575 N588 M608 C610 C614 F620	G570-V618 CarbonylContact C-O 3.52Å; G570-V618 VanDerWaalsContact CA-O 3.28Å; G570-V618 WeakPolarHBondContact CA-O 3.25Å; F571-V618 PolarHBondContact N-O 3.34Å; H573-V618 WeakPolarHBondContact NE2-CG1 3.25Å; F575-V618 HydrophobicContact CE2-CB 4.2Å; F575-V618 HydrophobicContact CE2-CG1 4.49Å; F575-V618 HydrophobicContact CE2-CG2 3.69Å; F575-V618 HydrophobicContact CZ-CG2 3.77Å; N588-V618 HydrophobicContact CB-CG2 4.34Å; N588-V618 WeakPolarHBondContact OD1-CA 3.5Å; M608-V618 HydrophobicContact CE-CG1 3.89Å; M608-V618 HydrophobicContact CE-CG2 4.21Å; M608-V618 HydrophobicContact SD-CG1 3.57Å; M608-V618 VanDerWaalsContact SD-CG1 3.57Å; M608-V618 HydrophobicContact SD-CG2 4.4Å; C610-V618 WeakPolarHBondContact SG-CG2 3.48Å; C614-V618 WeakPolarHBondContact O-CG2 3.48Å; C614-V618 PolarHBondContact O-N 3.17Å; V618-F620 VanDerWaalsContact C-N 3.34Å; V618-F620 HydrophobicContact CG1-CB 4.5Å; V618-F620 PolarHBondContact O-N 3.35Å
619	A	55	Low	63.1	Low	13 Å²	13	90.5 Å²	90.5	11%	0.107	46%	0.455	C	S	.	.			trans	-97.9	28.5	-172.5	0	0	0	0	0	113.6	R559 Q617	R559-A619 HydrophobicContact CB-CB 4.34Å; R559-A619 HydrophobicContact CG-CB 3.65Å; Q617-A619 PolarHBondContact O-N 3.46Å; Q617-A619 VanDerWaalsContact O-N 3.1Å
620	F	60.5	Low	60.2	Low	74 Å²	74	97 Å²	97	33%	0.325	49%	0.489	S	S	.	.	S	Bend	trans	-120.4	141.1	172.8	-63.6	-86.8	0	0	0	110.4	F571 H573 D587 M608 V618	F571-F620 VanDerWaalsContact CB-O 3.27Å; F571-F620 WeakPolarHBondContact CB-O 3.42Å; H573-F620 PolarHBondContact NE2-O 3.33Å; D587-F620 WeakPolarHBondContact O-CE2 3.38Å; M608-F620 HydrophobicContact CE-CD2 3.65Å; M608-F620 HydrophobicContact CE-CE2 4.14Å; V618-F620 VanDerWaalsContact C-N 3.34Å; V618-F620 HydrophobicContact CG1-CB 4.5Å; V618-F620 PolarHBondContact O-N 3.35Å
621	E	60.9	Low	57.4	Low	121 Å²	121	101.1 Å²	101.1	57%	0.565	52%	0.523	S	S	*	.			trans	-71.3	141.5	178	-173.1	-178.5	-138.6	0	0	112.9	F571 K623	F571-E621 HydrophobicContact CD1-CB 3.97Å; F571-E621 HydrophobicContact CD1-CG 4.21Å; F571-E621 HydrophobicContact CE1-CB 4.04Å; F571-E621 HydrophobicContact CE1-CG 4.4Å; F571-E621 HydrophobicContact CG-CB 4.46Å; E621-K623 VanDerWaalsContact C-N 3.34Å; E621-K623 PolarHBondContact O-N 3.48Å; E621-K623 WeakPolarHBondContact OE2-CE 3.27Å; E621-K623 IonicContact OE2-NZ 2.62Å
622	C	71	Confident	54.7	Low	36 Å²	36	105 Å²	105	24%	0.243	55%	0.55	C	S	.	.			trans	-76.8	74.7	-179	-174.6	0	0	0	0	113.2	K624	C622-K624 PolarHBondContact O-N 2.87Å
623	K	66.2	Low	52	Low	143 Å²	143	105.6 Å²	105.6	62%	0.622	56%	0.56	S	S	*	*			trans	-73.8	114.4	177.7	-63.3	-176.4	-179.5	-177.5	0	111.1	C606 E621 N625	C606-K623 VanDerWaalsContact CB-O 3.27Å; C606-K623 WeakPolarHBondContact CB-O 3.45Å; E621-K623 VanDerWaalsContact C-N 3.34Å; E621-K623 PolarHBondContact O-N 3.48Å; E621-K623 WeakPolarHBondContact OE2-CE 3.27Å; E621-K623 IonicContact OE2-NZ 2.62Å; K623-N625 PolarHBondContact O-N 2.96Å
624	K	55.4	Low	49.5	Very low	150 Å²	150	104.3 Å²	104.3	65%	0.652	56%	0.563	S	S	*	*			trans	-63.6	128.2	176.9	-100.8	-173.6	174.8	179.5	0	111.5	D605 C622 T626	D605-K624 HydrophobicContact CB-CG 4.02Å; D605-K624 WeakPolarHBondContact O-CA 3.34Å; D605-K624 WeakPolarHBondContact OD1-CE 3.49Å; D605-K624 IonicContact OD1-NZ 3.3Å; D605-K624 PolarHBondContact OD1-NZ 3.26Å; C622-K624 PolarHBondContact O-N 2.87Å; K624-T626 PolarHBondContact O-N 3.09Å
625	N	43.8	Very low	47.6	Very low	115 Å²	115	109.5 Å²	109.5	62%	0.615	60%	0.596	S	S	*	*			trans	-88.2	93	-174.7	-171.4	5.1	0	0	0	112.4	D605 K623 R627	D605-N625 PolarHBondContact O-N 3.34Å; K623-N625 PolarHBondContact O-N 2.96Å; N625-R627 PolarHBondContact O-N 2.99Å; N625-R627 VanDerWaalsContact O-N 3.1Å
626	T	39.4	Very low	45.2	Very low	139 Å²	139	113.4 Å²	113.4	85%	0.853	63%	0.625	S	S	*	*			trans	-80.3	78.4	170.9	45.7	0	0	0	0	111.6	K624	K624-T626 PolarHBondContact O-N 3.09Å
627	R	33.6	Very low	43.8	Very low	228 Å²	228	114.3 Å²	114.3	86%	0.86	64%	0.636	S	S	*	*			trans	-126.6	133.1	162.1	-89.2	-172.8	164.4	-176.8	-4.5	110.9	N625	N625-R627 PolarHBondContact O-N 2.99Å; N625-R627 VanDerWaalsContact O-N 3.1Å
628	S	30.6	Very low	41.8	Very low	114 Å²	114	113.1 Å²	113.1	80%	0.797	64%	0.641	S	S	*	*			trans	-89.8	160.4	-166.5	45.5	0	0	0	0	114.1
629	T	34.5	Very low	40	Very low	129 Å²	129	118.9 Å²	118.9	79%	0.791	68%	0.681	S	S	*	*			trans	-64	146.6	170	45.6	0	0	0	0	113.5
630	N	28.7	Very low	38.6	Very low	164 Å²	164	124.8 Å²	124.8	88%	0.877	72%	0.716	S	S	*	*			trans	-166.8	134.1	151.4	-87.1	-33.9	0	0	0	106.1
631	A	29.1	Very low	37.3	Very low	86 Å²	86	126.2 Å²	126.2	71%	0.711	73%	0.733	S	S	*	*			cis	-145	-158.6	-8.4	0	0	0	0	0	106.5
632	V	31.6	Very low	35.5	Very low	126 Å²	126	128.4 Å²	128.4	76%	0.764	75%	0.747	S	S	*	*			cis	-151.3	179.8	15	-153.1	0	0	0	0	108.4
633	D	27.5	Very low	33.3	Very low	150 Å²	150	131.5 Å²	131.5	80%	0.802	78%	0.775	S	S	*	*			trans	72	160.4	163.5	-65.7	-29.6	0	0	0	119.9
634	S	25.3	Very low	31.4	Very low	117 Å²	117	130.7 Å²	130.7	82%	0.818	79%	0.787	S	S	*	*			trans	-165.7	167.5	-148.1	-79.9	0	0	0	0	109.1
635	P	36.8	Very low	30	Very low	125 Å²	125	128.6 Å²	128.6	81%	0.812	79%	0.792	S	S	*	*			cis	-138.7	-178.4	30.2	40.2	-19.6	0	0	0	118.2
636	T	25.9	Very low	29.4	Very low	133 Å²	133	130.3 Å²	130.3	82%	0.816	81%	0.806	S	S	*	*			trans	-73.5	176.8	178	21	0	0	0	0	114.5
637	P	37.3	Very low	29.2	Very low	116 Å²	116	127.5 Å²	127.5	75%	0.753	79%	0.792	S	S	*	*			cis	-122.8	-168	17.1	34.7	-11.6	0	0	0	113.6
638	S	22.6	Very low	29.2	Very low	97 Å²	97	122.8 Å²	122.8	68%	0.678	78%	0.78	S	S	*	*			cis	-157.7	178.9	21.5	-41.4	0	0	0	0	114
639	S	25.2	Very low	29.4	Very low	121 Å²	121	122.6 Å²	122.6	85%	0.846	77%	0.774	S	S	*	*			trans	84.9	139.9	151.9	-56.6	0	0	0	0	121
640	T	24.7	Very low	29.3	Very low	137 Å²	137	125.8 Å²	125.8	84%	0.84	77%	0.773	S	S	*	*			trans	-124.5	-179.7	-169.1	27.1	0	0	0	0	111.2
641	P	33.4	Very low	29.6	Very low	103 Å²	103	123.3 Å²	123.3	67%	0.669	76%	0.759	S	S	*	*			cis	-134.9	168.7	-14.2	25.6	-2.5	0	0	0	116.5
642	I	24	Very low	29.9	Very low	168 Å²	168	125 Å²	125	86%	0.862	75%	0.75	S	S	*	*			trans	44.6	116.9	140.6	-58	163.4	0	0	0	120.6
643	A	24.2	Very low	29.9	Very low	101 Å²	101	126.4 Å²	126.4	84%	0.835	75%	0.746	S	S	*	*				-172	128.5	116.7	0	0	0	0	0	110.6
644	S	25.3	Very low	30.2	Very low	126 Å²	126	124 Å²	124	88%	0.881	73%	0.733	S	S	*	*			trans	-127.2	155.3	179.8	62	0	0	0	0	112.5
645	S	27.2	Very low	30.8	Very low	106 Å²	106	123 Å²	123	74%	0.741	72%	0.717	S	S	*	*			trans	-92.8	136.8	-156.5	49.4	0	0	0	0	115.7	S647	S645-S647 PolarHBondContact O-N 3.18Å
646	T	29.9	Very low	30.8	Very low	150 Å²	150	122.2 Å²	122.2	92%	0.92	71%	0.705	S	S	*	*			trans	-82.9	88.5	175	37.3	0	0	0	0	111.8
647	S	35.3	Very low	31	Very low	81 Å²	81	124.6 Å²	124.6	57%	0.566	70%	0.699	S	S	*	*			trans	-131.1	-34.1	174.1	60.5	0	0	0	0	114.9	S645 V649 Y650	S645-S647 PolarHBondContact O-N 3.18Å; S647-V649 VanDerWaalsContact C-N 3.33Å; S647-V649 PolarHBondContact O-N 3.36Å; S647-Y650 PolarHBondContact O-N 2.9Å
648	E	34.3	Very low	30.9	Very low	128 Å²	128	128.3 Å²	128.3	60%	0.598	70%	0.698	S	S	*	*	H	α-helix	trans	-67.8	-28.2	-170.9	-153.4	-173.4	138.2	0	0	114.3	K652	E648-K652 PolarHBondContact O-N 3.33Å; E648-K652 WeakPolarHBondContact OE1-CE 3.34Å; E648-K652 IonicContact OE1-NZ 2.79Å; E648-K652 PolarHBondContact OE1-NZ 2.69Å
649	V	34.3	Very low	31.5	Very low	110 Å²	110	130.3 Å²	130.3	67%	0.667	70%	0.7	S	S	*	*	H	α-helix	trans	-70.5	-35.4	-176.9	-177.9	0	0	0	0	112.3	S647 K653	S647-V649 VanDerWaalsContact C-N 3.33Å; S647-V649 PolarHBondContact O-N 3.36Å; V649-K653 PolarHBondContact O-N 2.77Å
650	Y	33.3	Very low	31.8	Very low	196 Å²	196	128.5 Å²	128.5	77%	0.769	69%	0.688	S	S	*	*	H	α-helix	trans	-70.2	-41.6	-177.6	-117.2	-86.2	0	0	0	111.9	S647 K653 L654	S647-Y650 PolarHBondContact O-N 2.9Å; Y650-K653 PolarHBondContact O-N 3.25Å; Y650-L654 PolarHBondContact O-N 2.86Å
651	L	35.2	Very low	32.1	Very low	113 Å²	113	127.4 Å²	127.4	59%	0.592	68%	0.677	S	S	*	*	H	α-helix	trans	-67	-40.6	179.7	-116.4	163.8	0	0	0	112.2	L654 I655	L651-L654 PolarHBondContact O-N 3.5Å; L651-I655 HydrophobicContact CD2-CD1 4.22Å; L651-I655 WeakPolarHBondContact O-CG1 3.25Å; L651-I655 PolarHBondContact O-N 3.43Å
652	K	34.6	Very low	32	Very low	120 Å²	120	126 Å²	126	52%	0.522	68%	0.681	S	S	.	*	H	α-helix	trans	-62	-41.1	172.9	-78.4	171.2	169.8	168.8	0	112.2	E648 I656	E648-K652 PolarHBondContact O-N 3.33Å; E648-K652 WeakPolarHBondContact OE1-CE 3.34Å; E648-K652 IonicContact OE1-NZ 2.79Å; E648-K652 PolarHBondContact OE1-NZ 2.69Å; K652-I656 WeakPolarHBondContact O-CG1 3.5Å; K652-I656 PolarHBondContact O-N 2.84Å; K652-I656 VanDerWaalsContact O-N 3.11Å
653	K	32.1	Very low	32.4	Very low	157 Å²	157	123.1 Å²	123.1	68%	0.683	68%	0.675	S	S	*	*	H	α-helix	trans	-62.6	-39.2	172.6	-99.7	-174.2	172.9	-178	0	112.9	V649 Y650 R657	V649-K653 PolarHBondContact O-N 2.77Å; Y650-K653 PolarHBondContact O-N 3.25Å; K653-R657 WeakPolarHBondContact O-CB 3.27Å; K653-R657 PolarHBondContact O-N 3.08Å
654	L	34.1	Very low	32.3	Very low	100 Å²	100	126.3 Å²	126.3	52%	0.524	67%	0.673	S	S	.	*	H	α-helix	trans	-66.8	-42	-179.8	-123.3	161.6	0	0	0	112.2	Y650 L651 R657 W658	Y650-L654 PolarHBondContact O-N 2.86Å; L651-L654 PolarHBondContact O-N 3.5Å; L654-R657 PolarHBondContact O-N 2.66Å; L654-W658 PolarHBondContact O-N 2.81Å
655	I	37.5	Very low	32.2	Very low	95 Å²	95	129.4 Å²	129.4	49%	0.487	67%	0.674	S	S	.	*	H	α-helix	trans	-68.5	-43.6	177.8	-66.4	166.9	0	0	0	111.4	L651 R657 W658 L659	L651-I655 HydrophobicContact CD2-CD1 4.22Å; L651-I655 WeakPolarHBondContact O-CG1 3.25Å; L651-I655 PolarHBondContact O-N 3.43Å; I655-R657 VanDerWaalsContact C-N 3.34Å; I655-R657 PolarHBondContact O-N 3.26Å; I655-W658 WeakPolarHBondContact O-CB 3.38Å; I655-W658 PolarHBondContact O-N 2.94Å; I655-L659 HydrophobicContact CG2-CD1 4.13Å; I655-L659 WeakPolarHBondContact O-CG 3.2Å; I655-L659 PolarHBondContact O-N 3.1Å
656	I	36.9	Very low	32.1	Very low	109 Å²	109	129.3 Å²	129.3	56%	0.559	67%	0.672	S	S	*	*	H	α-helix	trans	-62.2	-42.5	175.3	-67.8	170.2	0	0	0	110.5	K652 W658 L659 S660	K652-I656 WeakPolarHBondContact O-CG1 3.5Å; K652-I656 PolarHBondContact O-N 2.84Å; K652-I656 VanDerWaalsContact O-N 3.11Å; I656-W658 VanDerWaalsContact C-N 3.31Å; I656-W658 PolarHBondContact O-N 3.26Å; I656-L659 PolarHBondContact O-N 3.42Å; I656-L659 VanDerWaalsContact O-N 3.15Å; I656-S660 PolarHBondContact O-N 2.95Å; I656-S660 PolarHBondContact O-OG 3.15Å
657	R	30.8	Very low	31.8	Very low	183 Å²	183	128 Å²	128	69%	0.691	67%	0.666	S	S	*	*	H	α-helix	trans	-63.5	-34	175.9	-171.4	167.4	-177.9	160.3	1.6	112.8	K653 L654 I655 L661	K653-R657 WeakPolarHBondContact O-CB 3.27Å; K653-R657 PolarHBondContact O-N 3.08Å; L654-R657 PolarHBondContact O-N 2.66Å; I655-R657 VanDerWaalsContact C-N 3.34Å; I655-R657 PolarHBondContact O-N 3.26Å; R657-L661 HydrophobicContact CG-CD1 4.11Å; R657-L661 WeakPolarHBondContact O-CB 3.48Å; R657-L661 PolarHBondContact O-N 3.03Å
658	W	34.4	Very low	31.2	Very low	193 Å²	193	133.3 Å²	133.3	73%	0.731	68%	0.679	S	S	*	*	H	α-helix	trans	-66.7	-37.2	172.2	-106.9	65.6	0	0	0	113.1	L654 I655 I656	L654-W658 PolarHBondContact O-N 2.81Å; I655-W658 WeakPolarHBondContact O-CB 3.38Å; I655-W658 PolarHBondContact O-N 2.94Å; I656-W658 VanDerWaalsContact C-N 3.31Å; I656-W658 PolarHBondContact O-N 3.26Å
659	L	36.1	Very low	30.7	Very low	139 Å²	139	132.6 Å²	132.6	73%	0.728	69%	0.686	S	S	*	*	H	α-helix	trans	-77.3	-29.6	179	-69.6	168.2	0	0	0	113	I655 I656	I655-L659 HydrophobicContact CG2-CD1 4.13Å; I655-L659 WeakPolarHBondContact O-CG 3.2Å; I655-L659 PolarHBondContact O-N 3.1Å; I656-L659 PolarHBondContact O-N 3.42Å; I656-L659 VanDerWaalsContact O-N 3.15Å
660	S	31.1	Very low	30.2	Very low	84 Å²	84	138.4 Å²	138.4	59%	0.587	70%	0.697	S	S	*	*	H	α-helix	trans	-82.2	-20	178	-62.9	0	0	0	0	114.8	I656 G662	I656-S660 PolarHBondContact O-N 2.95Å; I656-S660 PolarHBondContact O-OG 3.15Å; S660-G662 PolarHBondContact O-N 3.38Å; S660-G662 VanDerWaalsContact O-N 3.09Å
661	L	30.4	Very low	29.9	Very low	114 Å²	114	134.7 Å²	134.7	60%	0.597	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	16.5	-179.6	-96.4	162.7	0	0	0	114.7	R657	R657-L661 HydrophobicContact CG-CD1 4.11Å; R657-L661 WeakPolarHBondContact O-CB 3.48Å; R657-L661 PolarHBondContact O-N 3.03Å
662	G	31.1	Very low	29.3	Very low	74 Å²	74	135 Å²	135	76%	0.763	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	5.9	176.2	0	0	0	0	0	115.3	S660	S660-G662 PolarHBondContact O-N 3.38Å; S660-G662 VanDerWaalsContact O-N 3.09Å
663	S	31.9	Very low	28.9	Very low	106 Å²	106	136.8 Å²	136.8	74%	0.741	72%	0.724	S	S	*	*			trans	-147.3	71.6	-168.9	-178.6	0	0	0	0	113.4
664	E	22.5	Very low	28.5	Very low	168 Å²	168	132.8 Å²	132.8	79%	0.785	73%	0.727	S	S	*	*			trans	-109.8	89.5	162.3	-72.9	-172.6	163.5	0	0	110.4
665	E	24.5	Very low	27.9	Very low	192 Å²	192	137.8 Å²	137.8	90%	0.897	74%	0.739	S	S	*	*			trans	-112	103.9	149.9	-74.5	-169.8	155.8	0	0	106.6
666	C	23.3	Very low	27.3	Very low	104 Å²	104	144 Å²	144	70%	0.703	76%	0.757	S	S	*	*			trans	-74.6	140.4	179.3	-67.8	0	0	0	0	111.2
667	P	24.8	Very low	26.7	Very low	122 Å²	122	144 Å²	144	79%	0.792	76%	0.758	S	S	*	*			trans	-79.6	142.3	-177.9	32.4	-34.8	0	0	0	111.9
668	F	21.6	Very low	26.2	Very low	192 Å²	192	147.1 Å²	147.1	84%	0.842	77%	0.77	S	S	*	*			trans	-123.2	147.6	161.2	-95.8	-97.1	0	0	0	110.2
669	P	25.4	Very low	25.7	Very low	114 Å²	114	143 Å²	143	74%	0.74	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-86.6	150	-166.4	34.3	-35.4	0	0	0	113.2
670	Y	23.8	Very low	25.7	Very low	231 Å²	231	141.8 Å²	141.8	91%	0.906	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-93.3	137.6	160.9	-89.6	-96.2	0	0	0	110.1
671	P	25.5	Very low	25.2	Very low	119 Å²	119	146.8 Å²	146.8	77%	0.773	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-79.4	152.2	172.6	32.9	-34.4	0	0	0	112.2
672	S	24	Very low	24.9	Very low	119 Å²	119	146.7 Å²	146.7	83%	0.832	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-77.8	145.3	170.5	-52.6	0	0	0	0	111.8
673	D	24.8	Very low	25.3	Very low	158 Å²	158	148.7 Å²	148.7	85%	0.845	79%	0.793	S	S	*	*				176.6	168.1	92.8	-159.5	-4.4	0	0	0	109.9
674	G	23.4	Very low	24.9	Very low	73 Å²	73	151 Å²	151	75%	0.753	80%	0.796	S	S	*	*			trans	150.2	79.1	171	0	0	0	0	0	116.5
675	R	23.1	Very low	24.9	Very low	204 Å²	204	149 Å²	149	77%	0.77	80%	0.795	S	S	*	*			trans	-73.3	138.5	174.7	-66.8	175.8	174.4	-114.8	5.6	114.7
676	R	25	Very low	25.1	Very low	226 Å²	226	145.5 Å²	145.5	85%	0.853	79%	0.789	S	S	*	*				-177.3	114.5	119.8	-101.7	171	-86.2	-155.1	-2.4	109
677	D	22.5	Very low	25.1	Very low	109 Å²	109	146.3 Å²	146.3	58%	0.583	79%	0.786	S	S	*	*				90.4	97.4	69	-72.5	-3.5	0	0	0	111.6
678	W	21.2	Very low	25.1	Very low	248 Å²	248	151.7 Å²	151.7	94%	0.939	79%	0.791	S	S	*	*				174.8	155.1	111.2	-95.2	95.4	0	0	0	110.6
679	S	23.6	Very low	25.1	Very low	106 Å²	106	153.5 Å²	153.5	74%	0.741	79%	0.792	S	S	*	*			trans	-120.6	-157.2	-166.2	-57.6	0	0	0	0	111.7
680	P	36.6	Very low	25.8	Very low	114 Å²	114	154 Å²	154	74%	0.74	80%	0.796	S	S	*	*				-123.9	-179	-91	39.9	-25.3	0	0	0	112.8
681	E	21.3	Very low	25.7	Very low	190 Å²	190	148 Å²	148	89%	0.888	79%	0.794	S	S	*	*			trans	-161.2	154.1	135.2	-117.6	167.2	-146.9	0	0	114.6
682	S	24.1	Very low	25.7	Very low	112 Å²	112	153 Å²	153	78%	0.783	80%	0.797	S	S	*	*			trans	-177	162.2	-175.6	-77	0	0	0	0	106.2
683	P	37.6	Very low	25.7	Very low	116 Å²	116	154.2 Å²	154.2	75%	0.753	80%	0.799	S	S	*	*			cis	-128.2	-159.6	22.1	37.3	-15.4	0	0	0	112.5
684	I	24.9	Very low	25.7	Very low	154 Å²	154	153.7 Å²	153.7	79%	0.79	79%	0.792	S	S	*	*				-162.3	145.4	70.9	-78.7	168.7	0	0	0	109.4
685	T	23.1	Very low	25.7	Very low	126 Å²	126	154.7 Å²	154.7	77%	0.773	79%	0.787	S	S	*	*			trans	-109.9	164.5	163.5	58.1	0	0	0	0	110.4
686	P	28.7	Very low	25.7	Very low	119 Å²	119	155.1 Å²	155.1	77%	0.773	79%	0.79	S	S	*	*				-145.6	167.7	105.2	37.1	-21.9	0	0	0	116.3
687	N	22.8	Very low	25.7	Very low	121 Å²	121	149.7 Å²	149.7	65%	0.647	78%	0.783	S	S	*	*			trans	-60.2	164.7	166.7	-67.7	-34.4	0	0	0	111.6
688	W	23.5	Very low	25.8	Very low	235 Å²	235	152.9 Å²	152.9	89%	0.89	79%	0.794	S	S	*	*				-165.2	-176.6	66.4	-89.5	101.9	0	0	0	115.6
689	R	22.5	Very low	26.1	Very low	229 Å²	229	146.5 Å²	146.5	86%	0.864	78%	0.783	S	S	*	*			trans	-92.8	172.2	-166.1	-94.8	-171.6	-177	-148.4	2.4	114.2
690	P	40.1	Very low	26.2	Very low	125 Å²	125	150.7 Å²	150.7	81%	0.812	79%	0.79	S	S	*	*			trans	-95.6	172.9	-154.8	38.5	-38.6	0	0	0	115.8
691	A	22.7	Very low	25.6	Very low	106 Å²	106	148.5 Å²	148.5	88%	0.876	79%	0.789	S	S	*	*			trans	-131.5	159.8	170.2	0	0	0	0	0	112.4
692	R	25.3	Very low	26.3	Very low	222 Å²	222	145 Å²	145	84%	0.838	78%	0.783	S	S	*	*			trans	-137.5	118.6	-169.6	170.3	-151.1	-165.4	-177	8.3	109.6
693	V	23.4	Very low	26.4	Very low	145 Å²	145	147.8 Å²	147.8	88%	0.879	78%	0.783	S	S	*	*			trans	-142.3	163	171.8	173.9	0	0	0	0	110.4
694	H	24.2	Very low	25.8	Very low	147 Å²	147	149.2 Å²	149.2	68%	0.681	78%	0.784	S	S	*	*			trans	-104.6	145.4	-165.1	-66.1	-117.6	0	0	0	115.1
695	S	23.6	Very low	25.7	Very low	95 Å²	95	146.3 Å²	146.3	66%	0.664	78%	0.777	S	S	*	*				62.7	137.8	127.6	74.7	0	0	0	0	125.5
696	Y	23.8	Very low	25.8	Very low	212 Å²	212	145.1 Å²	145.1	83%	0.831	77%	0.774	S	S	*	*			trans	89.1	145.8	140.5	-76.7	-55.8	0	0	0	123.3
697	T	24.7	Very low	25.5	Very low	113 Å²	113	147.5 Å²	147.5	69%	0.693	78%	0.777	S	S	*	*			trans	70.8	114.6	157.3	36.2	0	0	0	0	121.6
698	Q	24.6	Very low	25.7	Very low	175 Å²	175	147.9 Å²	147.9	82%	0.818	78%	0.784	S	S	*	*				40.5	138.5	125.8	-60.9	173.2	-28.2	0	0	119
699	T	26.2	Very low	26.4	Very low	115 Å²	115	142 Å²	142	71%	0.706	78%	0.776	S	S	*	*				-156.1	164.7	51.4	38	0	0	0	0	115.6
700	E	25.6	Very low	26.4	Very low	193 Å²	193	139.8 Å²	139.8	90%	0.902	78%	0.775	S	S	*	*			trans	69	159.6	146	-79.3	170.8	-142.1	0	0	123.3
701	G	25.2	Very low	25.8	Very low	68 Å²	68	138.5 Å²	138.5	70%	0.701	78%	0.775	S	S	*	*			trans	170.9	170.9	179.5	0	0	0	0	0	109.8
702	P	34.8	Very low	26	Very low	118 Å²	118	139.4 Å²	139.4	77%	0.766	78%	0.775	S	S	*	*			trans	-135.1	132.9	174.3	35.7	-18.9	0	0	0	116.9
703	Q	27	Very low	26.1	Very low	170 Å²	170	140.3 Å²	140.3	79%	0.794	78%	0.778	S	S	*	*			trans	63.6	145.2	142.9	-57	-63.7	-14.4	0	0	118.9
704	L	24.6	Very low	26.3	Very low	146 Å²	146	141.9 Å²	141.9	76%	0.764	78%	0.781	S	S	*	*			cis	-158.6	146	40.3	-159.8	79.3	0	0	0	112.6
705	S	23.7	Very low	26.3	Very low	92 Å²	92	143.1 Å²	143.1	64%	0.643	79%	0.787	S	S	*	*			trans	30	144.1	149.9	65.7	0	0	0	0	123.3
706	S	24.4	Very low	26.3	Very low	102 Å²	102	143.5 Å²	143.5	71%	0.713	79%	0.79	S	S	*	*			cis	-176	-177.4	-6.5	54.6	0	0	0	0	111.9
707	M	23.7	Very low	26.4	Very low	168 Å²	168	138.5 Å²	138.5	83%	0.828	79%	0.786	S	S	*	*			trans	98.3	98.4	165.5	-57.2	-85.8	75.8	0	0	119
708	T	25.5	Very low	26.5	Very low	130 Å²	130	140.9 Å²	140.9	80%	0.798	79%	0.794	S	S	*	*			trans	-140.5	168.6	152.8	65.9	0	0	0	0	106.1
709	P	38.6	Very low	26.7	Very low	112 Å²	112	140.8 Å²	140.8	73%	0.727	80%	0.797	S	S	*	*				-136.3	-159.5	56.2	32.2	-6.4	0	0	0	111
710	E	23.7	Very low	26.8	Very low	182 Å²	182	142 Å²	142	85%	0.85	80%	0.798	S	S	*	*			cis	-136.4	152.1	8.1	-66.5	177.1	126.2	0	0	108.6
711	A	27.4	Very low	27.1	Very low	97 Å²	97	138.6 Å²	138.6	80%	0.802	79%	0.793	S	S	*	*			cis	100.3	94.8	22	0	0	0	0	0	115.8
712	S	26.7	Very low	27.4	Very low	126 Å²	126	141.1 Å²	141.1	88%	0.881	79%	0.794	S	S	*	*			trans	-153.5	142	147.7	64.9	0	0	0	0	111.2
713	R	27.5	Very low	27.3	Very low	240 Å²	240	140.3 Å²	140.3	91%	0.906	79%	0.789	S	S	*	*			trans	-110.9	157.4	176.1	-63.5	171.4	172.7	162.6	-4.6	109.8
714	L	26	Very low	27.5	Very low	178 Å²	178	138.5 Å²	138.5	93%	0.932	79%	0.792	S	S	*	*				-175.2	169.6	121	-100.5	162.5	0	0	0	112.1
715	Q	25.1	Very low	27.8	Very low	174 Å²	174	139.1 Å²	139.1	81%	0.813	80%	0.795	S	S	*	*			trans	-115.8	154.3	-174.4	-72.7	177.9	-88.7	0	0	112.7
716	S	23.9	Very low	28.1	Very low	102 Å²	102	142.4 Å²	142.4	71%	0.713	80%	0.804	S	S	*	*			trans	44.2	115.3	145.5	-55.1	0	0	0	0	120.1
717	S	25	Very low	28.4	Very low	107 Å²	107	143.2 Å²	143.2	75%	0.748	81%	0.807	S	S	*	*				174.8	144.5	98	-74.6	0	0	0	0	113.8
718	L	28.1	Very low	28.5	Very low	164 Å²	164	140.8 Å²	140.8	86%	0.859	81%	0.806	S	S	*	*			trans	47.2	109.8	151.7	-61.4	170.1	0	0	0	120
719	L	27.8	Very low	28.6	Very low	172 Å²	172	140 Å²	140	90%	0.901	81%	0.805	S	S	*	*				-161.6	157.7	126.1	-108.9	169.6	0	0	0	111.2
720	I	29	Very low	28.2	Very low	140 Å²	140	140.5 Å²	140.5	72%	0.718	81%	0.808	S	S	*	*			trans	-109.1	129.4	-167.1	-61.9	165.2	0	0	0	111.2
721	P	32.1	Very low	28.4	Very low	122 Å²	122	137 Å²	137	79%	0.792	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-87.5	126.7	159.1	-8.9	27.7	0	0	0	111.2
722	V	30.1	Very low	28.5	Very low	121 Å²	121	138.3 Å²	138.3	73%	0.733	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-84	139.6	177.9	173.8	0	0	0	0	110.3
723	P	32.8	Very low	28.6	Very low	102 Å²	102	138 Å²	138	66%	0.662	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-72.1	149.5	177.4	29.9	-36.1	0	0	0	112.7
724	P	32.8	Very low	28.6	Very low	131 Å²	131	132.5 Å²	132.5	85%	0.851	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-67.4	145.6	177.1	28.3	-34.6	0	0	0	112.4
725	I	30.3	Very low	28.6	Very low	160 Å²	160	131.5 Å²	131.5	82%	0.821	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-87.5	139.9	-168.8	-66.7	168.7	0	0	0	112
726	L	29.5	Very low	28.8	Very low	160 Å²	160	134.9 Å²	134.9	84%	0.838	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-75	131.6	171.7	-76.3	161	0	0	0	112.2
727	P	30.6	Very low	28.9	Very low	120 Å²	120	139.5 Å²	139.5	78%	0.779	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-69.2	146.7	157	-15.3	31.1	0	0	0	111
728	S	26.9	Very low	29	Very low	116 Å²	116	141.8 Å²	141.8	81%	0.811	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-78	143.7	-172	46	0	0	0	0	114.8
729	C	26.3	Very low	28.9	Very low	115 Å²	115	145.6 Å²	145.6	78%	0.777	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-71.4	155.8	168.8	-52.8	0	0	0	0	112.2
730	P	31.3	Very low	28.8	Very low	121 Å²	121	146.7 Å²	146.7	79%	0.786	80%	0.795	S	S	*	*			trans	-105.6	126.5	138.5	32.8	-28.3	0	0	0	110.6
731	S	26.7	Very low	28.7	Very low	109 Å²	109	146 Å²	146	76%	0.762	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-74	131.9	-178.8	-57.2	0	0	0	0	112.6	V733	S731-V733 PolarHBondContact O-N 3.21Å
732	P	29.8	Very low	28.4	Very low	124 Å²	124	144.2 Å²	144.2	81%	0.805	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-70	123.3	165.9	-15.1	29.9	0	0	0	110.5
733	V	29.5	Very low	28.4	Very low	121 Å²	121	146.7 Å²	146.7	73%	0.733	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-66.6	132.8	174.2	176	0	0	0	0	109.7	S731 L735	S731-V733 PolarHBondContact O-N 3.21Å; V733-L735 VanDerWaalsContact C-N 3.3Å; V733-L735 PolarHBondContact O-N 2.99Å
734	P	26.7	Very low	27.9	Very low	123 Å²	123	153.1 Å²	153.1	80%	0.799	81%	0.809	S	S	*	*			trans	-71.9	83.5	176	29.6	-35	0	0	0	111.1	R736	P734-R736 PolarHBondContact O-N 3.46Å; P734-R736 VanDerWaalsContact O-N 3.13Å
735	L	27.2	Very low	27.7	Very low	158 Å²	158	153.9 Å²	153.9	83%	0.827	80%	0.801	S	S	*	*			trans	-61	113.2	173.8	-107.3	162.4	0	0	0	110.2	V733 K737	V733-L735 VanDerWaalsContact C-N 3.3Å; V733-L735 PolarHBondContact O-N 2.99Å; L735-K737 VanDerWaalsContact C-N 3.26Å; L735-K737 PolarHBondContact O-N 2.98Å
736	R	28.7	Very low	27.6	Very low	245 Å²	245	153.9 Å²	153.9	93%	0.925	80%	0.803	S	S	*	*			trans	-69.2	71	-174.2	-169.7	-176.6	-174.1	174.5	2	112.1	P734 Q738	P734-R736 PolarHBondContact O-N 3.46Å; P734-R736 VanDerWaalsContact O-N 3.13Å; R736-Q738 PolarHBondContact O-N 3.31Å; R736-Q738 VanDerWaalsContact O-N 3.08Å
737	K	26.4	Very low	27.6	Very low	199 Å²	199	158 Å²	158	87%	0.865	81%	0.807	S	S	*	*			trans	-61.7	111.7	173.1	-81.5	-170.5	172.6	-177.6	0	110.1	L735 R739	L735-K737 VanDerWaalsContact C-N 3.26Å; L735-K737 PolarHBondContact O-N 2.98Å; K737-R739 PolarHBondContact O-N 3.44Å
738	Q	26.7	Very low	27.4	Very low	155 Å²	155	156.9 Å²	156.9	72%	0.724	81%	0.808	S	S	*	*			trans	-52.9	134.4	170.2	-101.1	167.6	-38.8	0	0	110.5	R736 Y740	R736-Q738 PolarHBondContact O-N 3.31Å; R736-Q738 VanDerWaalsContact O-N 3.08Å; Q738-Y740 HydrophobicContact CB-CD2 4.13Å; Q738-Y740 HydrophobicContact CB-CE2 4.29Å; Q738-Y740 PolarHBondContact O-N 3.35Å
739	R	26.2	Very low	27.6	Very low	244 Å²	244	157 Å²	157	92%	0.921	81%	0.809	S	S	*	*			trans	-73	92.3	163.5	-72.4	-176.7	177.1	177.3	-2.1	108.6	K737	K737-R739 PolarHBondContact O-N 3.44Å
740	Y	26.2	Very low	27.7	Very low	194 Å²	194	158.6 Å²	158.6	76%	0.761	81%	0.814	S	S	*	*			trans	-75.6	123.2	159.2	-92.7	-90.4	0	0	0	108.7	Q738 A742	Q738-Y740 HydrophobicContact CB-CD2 4.13Å; Q738-Y740 HydrophobicContact CB-CE2 4.29Å; Q738-Y740 PolarHBondContact O-N 3.35Å; Y740-A742 PolarHBondContact O-N 3.47Å
741	C	26.7	Very low	27.6	Very low	125 Å²	125	161.1 Å²	161.1	85%	0.845	82%	0.82	S	S	*	*			trans	-72.5	105.6	175.5	-63.2	0	0	0	0	109.5	K743	C741-K743 PolarHBondContact O-N 3.33Å; C741-K743 VanDerWaalsContact O-N 3.14Å
742	A	26.3	Very low	27.8	Very low	85 Å²	85	164.8 Å²	164.8	70%	0.702	83%	0.826	S	S	*	*			trans	-69.6	105.8	169	0	0	0	0	0	109.3	Y740 W744	Y740-A742 PolarHBondContact O-N 3.47Å; A742-W744 PolarHBondContact O-N 2.82Å
743	K	28.3	Very low	27.6	Very low	174 Å²	174	168.8 Å²	168.8	76%	0.757	83%	0.83	S	S	*	*			trans	-59.1	130.5	165.3	-70.7	-177.8	174.7	-175.2	0	108.7	C741	C741-K743 PolarHBondContact O-N 3.33Å; C741-K743 VanDerWaalsContact O-N 3.14Å
744	W	24	Very low	27.6	Very low	236 Å²	236	168.3 Å²	168.3	89%	0.894	83%	0.83	S	S	*	*			trans	-90.3	101	163.5	-88.7	68.4	0	0	0	108.7	A742	A742-W744 PolarHBondContact O-N 2.82Å
745	E	28.4	Very low	27.6	Very low	148 Å²	148	170.8 Å²	170.8	69%	0.692	83%	0.828	S	S	*	*			trans	-92.7	119.6	167.8	-71.5	176.2	-175.2	0	0	108.4	R747	E745-R747 PolarHBondContact O-N 3.47Å
746	N	27.9	Very low	27.7	Very low	160 Å²	160	170.4 Å²	170.4	86%	0.856	82%	0.822	S	S	*	*			trans	-68.3	113.5	179.1	-82.5	-29	0	0	0	110.3
747	R	27.8	Very low	28	Very low	247 Å²	247	163.9 Å²	163.9	93%	0.932	81%	0.811	S	S	*	*			trans	-132.3	54.3	178.6	-143.8	177.4	-164.3	-163.4	4.4	113.7	E745	E745-R747 PolarHBondContact O-N 3.47Å
748	A	27.9	Very low	28.2	Very low	96 Å²	96	161.2 Å²	161.2	79%	0.793	81%	0.812	S	S	*	*			trans	-91.6	108.1	167.2	0	0	0	0	0	110.3
749	S	30.8	Very low	28.8	Very low	118 Å²	118	162.8 Å²	162.8	83%	0.825	82%	0.819	S	S	*	*			trans	166.1	110.4	148.1	-79.9	0	0	0	0	111.3
750	V	29.2	Very low	29.1	Very low	148 Å²	148	160.1 Å²	160.1	90%	0.897	82%	0.817	S	S	*	*			trans	-140.2	92.2	158.4	-178.6	0	0	0	0	108.8
751	L	27.9	Very low	29.9	Very low	174 Å²	174	156.9 Å²	156.9	91%	0.911	82%	0.822	S	S	*	*			trans	-163.7	124.6	150.2	-112.2	163.5	0	0	0	108.1
752	Q	32.1	Very low	30.5	Very low	187 Å²	187	160.4 Å²	160.4	87%	0.874	82%	0.823	S	S	*	*			trans	-90.9	143.9	-176.1	-65.1	170.2	-33.9	0	0	111.2
753	K	25	Very low	31.4	Very low	207 Å²	207	160.4 Å²	160.4	90%	0.9	82%	0.818	S	S	*	*			trans	-153	163.4	144.6	-106.9	179.6	-178.8	-174.2	0	109.1
754	P	29	Very low	33.3	Very low	112 Å²	112	156.3 Å²	156.3	73%	0.727	81%	0.807	S	S	*	*			trans	-95.9	170	-145.4	37	-40.1	0	0	0	117.1
755	K	26.4	Very low	35.3	Very low	175 Å²	175	153 Å²	153	76%	0.761	80%	0.795	S	S	*	*			trans	-2.3	147.5	142.8	-71.2	170.7	160.9	-112.4	0	117.1
756	E	28.9	Very low	37.3	Very low	149 Å²	149	153 Å²	153	70%	0.696	80%	0.795	S	S	*	*			cis	-151.3	-167	15.9	-131.9	157.7	-133.6	0	0	112.4
757	P	36.3	Very low	39.3	Very low	109 Å²	109	147.9 Å²	147.9	71%	0.708	77%	0.773	S	S	*	*				-112.8	163.6	-121.8	41.2	-26.7	0	0	0	116.7
758	V	30	Very low	41.3	Very low	143 Å²	143	140.8 Å²	140.8	87%	0.867	75%	0.753	S	S	*	*			trans	-134.9	142.2	152.6	-179.5	0	0	0	0	107.2
759	E	39.4	Very low	43.7	Very low	188 Å²	188	141.3 Å²	141.3	88%	0.879	74%	0.739	S	S	*	*			trans	-91.3	123.7	-173.2	-61.8	-178.2	121.5	0	0	112.6
760	E	32.9	Very low	46.2	Very low	187 Å²	187	143.4 Å²	143.4	87%	0.874	73%	0.73	S	S	*	*			trans	-133	128.8	159	-75	-167.9	148	0	0	109.7	K762	E760-K762 PolarHBondContact O-N 3.42Å
761	S	42.2	Very low	48.6	Very low	126 Å²	126	140.1 Å²	140.1	88%	0.881	71%	0.705	S	S	*	*			trans	-80	109.2	-172.3	44.2	0	0	0	0	112.1	C763	S761-C763 PolarHBondContact O-N 3.03Å
762	K	40.7	Very low	51.1	Low	199 Å²	199	136.3 Å²	136.3	87%	0.865	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-75.3	121.3	173.4	-72.8	-178.5	177.7	174.9	0	110.9	E760 T764	E760-K762 PolarHBondContact O-N 3.42Å; K762-T764 PolarHBondContact O-N 2.75Å
763	C	44	Very low	53.6	Low	86 Å²	86	131.8 Å²	131.8	58%	0.581	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-55.2	127.9	174.8	-171.6	0	0	0	0	111.3	S761 S767	S761-C763 PolarHBondContact O-N 3.03Å; C763-S767 VanDerWaalsContact SG-CB 3.57Å
764	T	69.1	Low	56.7	Low	88 Å²	88	126.6 Å²	126.6	54%	0.54	64%	0.641	S	S	.	*	P	Polyproline II helix	trans	-79.3	153.8	-179.8	34.8	0	0	0	0	112.4	K762 E766 S767 L768	K762-T764 PolarHBondContact O-N 2.75Å; T764-E766 VanDerWaalsContact C-N 3.25Å; T764-E766 PolarHBondContact O-N 3.37Å; T764-S767 WeakPolarHBondContact O-CB 3.36Å; T764-S767 PolarHBondContact O-N 3.28Å; T764-L768 PolarHBondContact O-N 3.06Å
765	Y	66.3	Low	59.1	Low	165 Å²	165	125.1 Å²	125.1	65%	0.647	63%	0.627	S	S	*	*	H	α-helix	trans	-53.7	-39.1	-179.7	-179.8	-100.2	0	0	0	113.3	S767 L768 E769	Y765-S767 VanDerWaalsContact C-N 3.27Å; Y765-S767 PolarHBondContact O-N 3.21Å; Y765-L768 WeakPolarHBondContact O-CB 3.43Å; Y765-L768 PolarHBondContact O-N 2.77Å; Y765-E769 HydrophobicContact CD1-CG 4.28Å; Y765-E769 HydrophobicContact CE1-CG 3.83Å; Y765-E769 WeakPolarHBondContact CE1-OE1 3.39Å; Y765-E769 PolarHBondContact O-N 2.82Å; Y765-E769 PolarHBondContact OH-OE1 3.17Å; Y765-E769 VanDerWaalsContact OH-OE1 3.14Å
766	E	68.8	Low	61.9	Low	148 Å²	148	122.2 Å²	122.2	69%	0.692	62%	0.616	S	S	*	*	H	α-helix	trans	-60.8	-34	177.6	-60.7	170.9	145.3	0	0	112.7	T764 L768 E769 Y770	T764-E766 VanDerWaalsContact C-N 3.25Å; T764-E766 PolarHBondContact O-N 3.37Å; E766-L768 VanDerWaalsContact C-N 3.34Å; E766-E769 PolarHBondContact O-N 3.47Å; E766-Y770 WeakPolarHBondContact O-CB 3.38Å; E766-Y770 PolarHBondContact O-N 3.43Å
767	S	71.3	Confident	64.7	Low	54 Å²	54	121 Å²	121	38%	0.378	61%	0.61	S	S	.	*	H	α-helix	trans	-69.6	-33.2	175.8	-172.5	0	0	0	0	111.8	C763 T764 Y765 E771	C763-S767 VanDerWaalsContact SG-CB 3.57Å; T764-S767 WeakPolarHBondContact O-CB 3.36Å; T764-S767 PolarHBondContact O-N 3.28Å; Y765-S767 VanDerWaalsContact C-N 3.27Å; Y765-S767 PolarHBondContact O-N 3.21Å; S767-E771 WeakPolarHBondContact O-CB 3.23Å; S767-E771 PolarHBondContact O-N 2.92Å
768	L	68.4	Low	67.1	Low	97 Å²	97	119.7 Å²	119.7	51%	0.508	60%	0.597	S	S	.	*	H	α-helix	trans	-72.5	-35	174.8	-66	171.4	0	0	0	111.7	T764 Y765 E766 N772	T764-L768 PolarHBondContact O-N 3.06Å; Y765-L768 WeakPolarHBondContact O-CB 3.43Å; Y765-L768 PolarHBondContact O-N 2.77Å; E766-L768 VanDerWaalsContact C-N 3.34Å; L768-N772 WeakPolarHBondContact O-CB 3.42Å; L768-N772 PolarHBondContact O-N 2.81Å
769	E	79.1	Confident	69.7	Low	107 Å²	107	117 Å²	117	50%	0.5	58%	0.578	S	S	.	*	H	α-helix	trans	-68.9	-41.2	172.9	-68	-163.7	133.5	0	0	112	Y765 E766 E771 N772 L773	Y765-E769 HydrophobicContact CD1-CG 4.28Å; Y765-E769 HydrophobicContact CE1-CG 3.83Å; Y765-E769 WeakPolarHBondContact CE1-OE1 3.39Å; Y765-E769 PolarHBondContact O-N 2.82Å; Y765-E769 PolarHBondContact OH-OE1 3.17Å; Y765-E769 VanDerWaalsContact OH-OE1 3.14Å; E766-E769 PolarHBondContact O-N 3.47Å; E769-E771 PolarHBondContact O-N 2.83Å; E769-N772 PolarHBondContact O-N 2.94Å; E769-L773 PolarHBondContact O-N 3.16Å
770	Y	82.4	Confident	72.1	Confident	162 Å²	162	114 Å²	114	64%	0.635	56%	0.564	S	S	*	*	H	α-helix	trans	-60.6	-43.6	173.3	-177	-100.1	0	0	0	112.2	E766 L773 R774	E766-Y770 WeakPolarHBondContact O-CB 3.38Å; E766-Y770 PolarHBondContact O-N 3.43Å; Y770-L773 PolarHBondContact O-N 2.6Å; Y770-R774 PolarHBondContact O-N 3.38Å
771	E	80.8	Confident	74.7	Confident	80 Å²	80	107.7 Å²	107.7	37%	0.374	54%	0.544	S	S	.	.	H	α-helix	trans	-65.2	-38	174.9	-178.2	141.3	-96.9	0	0	112.6	S767 E769 R774 L775	S767-E771 WeakPolarHBondContact O-CB 3.23Å; S767-E771 PolarHBondContact O-N 2.92Å; E769-E771 PolarHBondContact O-N 2.83Å; E771-R774 PolarHBondContact O-N 2.95Å; E771-R774 IonicContact OE1-CZ 2.63Å; E771-R774 IonicContact OE1-NH1 3.11Å; E771-R774 PolarHBondContact OE1-NH1 2.99Å; E771-R774 IonicContact OE1-NH2 2.68Å; E771-R774 PolarHBondContact OE1-NH2 2.66Å; E771-L775 HydrophobicContact CG-CD1 4.09Å; E771-L775 WeakPolarHBondContact O-CB 3.37Å; E771-L775 VanDerWaalsContact O-CG 3.3Å; E771-L775 WeakPolarHBondContact O-CG 3.44Å; E771-L775 PolarHBondContact O-N 2.84Å
772	N	79.9	Confident	76.8	Confident	93 Å²	93	107 Å²	107	50%	0.497	53%	0.53	S	S	.	.	H	α-helix	trans	-63.3	-43.3	174.9	-147.6	-71	0	0	0	111.6	L768 E769 L775 Q776	L768-N772 WeakPolarHBondContact O-CB 3.42Å; L768-N772 PolarHBondContact O-N 2.81Å; E769-N772 PolarHBondContact O-N 2.94Å; N772-L775 PolarHBondContact O-N 3Å; N772-Q776 WeakPolarHBondContact O-CG 3.49Å; N772-Q776 PolarHBondContact O-N 3.47Å; N772-Q776 PolarHBondContact OD1-NE2 2.68Å
773	L	84.6	Confident	78.9	Confident	93 Å²	93	105.1 Å²	105.1	49%	0.487	52%	0.517	S	S	.	.	H	α-helix	trans	-62.9	-42.6	176.9	-174.8	64.5	0	0	0	111.8	E769 Y770 Q776 Q777	E769-L773 PolarHBondContact O-N 3.16Å; Y770-L773 PolarHBondContact O-N 2.6Å; L773-Q776 PolarHBondContact O-N 2.96Å; L773-Q777 PolarHBondContact O-N 3.07Å; L773-Q777 VanDerWaalsContact O-N 3.15Å
774	R	90.2	Very high	81.1	Confident	97 Å²	97	105.4 Å²	105.4	37%	0.366	51%	0.51	S	S	.	.	H	α-helix	trans	-59.6	-48.3	174.9	-164	-175.7	76.6	-123.9	-0.9	111.4	Y770 E771 Q776 Q777 D778	Y770-R774 PolarHBondContact O-N 3.38Å; E771-R774 PolarHBondContact O-N 2.95Å; E771-R774 IonicContact OE1-CZ 2.63Å; E771-R774 IonicContact OE1-NH1 3.11Å; E771-R774 PolarHBondContact OE1-NH1 2.99Å; E771-R774 IonicContact OE1-NH2 2.68Å; E771-R774 PolarHBondContact OE1-NH2 2.66Å; R774-Q776 VanDerWaalsContact C-N 3.27Å; R774-Q776 PolarHBondContact O-N 3.49Å; R774-Q777 WeakPolarHBondContact O-CB 3.11Å; R774-Q777 PolarHBondContact O-N 3.33Å; R774-Q777 VanDerWaalsContact O-N 3.14Å; R774-D778 PolarHBondContact O-N 3Å
775	L	80.5	Confident	82	Confident	82 Å²	82	107.6 Å²	107.6	43%	0.429	51%	0.512	S	S	.	.	H	α-helix	trans	-64	-28.3	177.6	-71.8	169.3	0	0	0	113.4	E771 N772 N779	E771-L775 HydrophobicContact CG-CD1 4.09Å; E771-L775 WeakPolarHBondContact O-CB 3.37Å; E771-L775 VanDerWaalsContact O-CG 3.3Å; E771-L775 WeakPolarHBondContact O-CG 3.44Å; E771-L775 PolarHBondContact O-N 2.84Å; N772-L775 PolarHBondContact O-N 3Å; L775-N779 WeakPolarHBondContact O-CB 3.38Å; L775-N779 PolarHBondContact O-N 3.36Å; L775-N779 VanDerWaalsContact O-N 3.15Å; L775-N779 PolarHBondContact O-ND2 2.86Å
776	Q	84.3	Confident	82.9	Confident	114 Å²	114	104.1 Å²	104.1	53%	0.533	50%	0.504	S	S	.	.	H	α-helix	trans	-70.1	-42	172.9	-72.5	173.7	39.5	0	0	111.6	N772 L773 R774 N779 E780	N772-Q776 WeakPolarHBondContact O-CG 3.49Å; N772-Q776 PolarHBondContact O-N 3.47Å; N772-Q776 PolarHBondContact OD1-NE2 2.68Å; L773-Q776 PolarHBondContact O-N 2.96Å; R774-Q776 VanDerWaalsContact C-N 3.27Å; R774-Q776 PolarHBondContact O-N 3.49Å; Q776-N779 PolarHBondContact O-N 3.21Å; Q776-E780 PolarHBondContact O-N 3.23Å
777	Q	87.1	Confident	83.9	Confident	122 Å²	122	103.6 Å²	103.6	57%	0.57	50%	0.496	S	S	*	.	H	α-helix	trans	-63.2	-44.4	175	-67.5	174.5	-9.5	0	0	111.9	L773 R774 N779 E780 A781	L773-Q777 PolarHBondContact O-N 3.07Å; L773-Q777 VanDerWaalsContact O-N 3.15Å; R774-Q777 WeakPolarHBondContact O-CB 3.11Å; R774-Q777 PolarHBondContact O-N 3.33Å; R774-Q777 VanDerWaalsContact O-N 3.14Å; Q777-N779 VanDerWaalsContact C-N 3.31Å; Q777-N779 PolarHBondContact O-N 3.3Å; Q777-E780 PolarHBondContact O-N 3.03Å; Q777-E780 VanDerWaalsContact O-N 3.12Å; Q777-A781 PolarHBondContact O-N 3.25Å
778	D	87.8	Confident	84.8	Confident	82 Å²	82	106.7 Å²	106.7	44%	0.439	50%	0.504	S	S	.	.	H	α-helix	trans	-58.7	-41.7	174.9	-71.4	-36.6	0	0	0	111.9	R774 E780 A781 L782	R774-D778 PolarHBondContact O-N 3Å; D778-E780 VanDerWaalsContact C-N 3.34Å; D778-E780 PolarHBondContact O-N 3.03Å; D778-A781 PolarHBondContact O-N 3.14Å; D778-L782 WeakPolarHBondContact O-CB 3.49Å; D778-L782 VanDerWaalsContact O-CG 3.29Å; D778-L782 WeakPolarHBondContact O-CG 3.32Å; D778-L782 PolarHBondContact O-N 3.28Å
779	N	83.1	Confident	85.6	Confident	86 Å²	86	105.9 Å²	105.9	46%	0.46	50%	0.504	S	S	.	.	H	α-helix	trans	-65.3	-33.9	176.1	-91.1	-87.5	0	0	0	113	L775 Q776 Q777 R783	L775-N779 WeakPolarHBondContact O-CB 3.38Å; L775-N779 PolarHBondContact O-N 3.36Å; L775-N779 VanDerWaalsContact O-N 3.15Å; L775-N779 PolarHBondContact O-ND2 2.86Å; Q776-N779 PolarHBondContact O-N 3.21Å; Q777-N779 VanDerWaalsContact C-N 3.31Å; Q777-N779 PolarHBondContact O-N 3.3Å; N779-R783 WeakPolarHBondContact O-CD 3.29Å; N779-R783 VanDerWaalsContact O-CG 3.24Å; N779-R783 WeakPolarHBondContact O-CG 3.36Å; N779-R783 PolarHBondContact O-N 2.74Å; N779-R783 VanDerWaalsContact O-N 3.09Å
780	E	89.9	Confident	85.9	Confident	125 Å²	125	106.9 Å²	106.9	58%	0.584	51%	0.506	S	S	*	.	H	α-helix	trans	-71.6	-44.3	177.3	-167.6	132.9	-111.5	0	0	111.5	Q776 Q777 D778 L782 R783 E784	Q776-E780 PolarHBondContact O-N 3.23Å; Q777-E780 PolarHBondContact O-N 3.03Å; Q777-E780 VanDerWaalsContact O-N 3.12Å; D778-E780 VanDerWaalsContact C-N 3.34Å; D778-E780 PolarHBondContact O-N 3.03Å; E780-L782 VanDerWaalsContact C-N 3.32Å; E780-L782 PolarHBondContact O-N 2.92Å; E780-R783 WeakPolarHBondContact O-CB 3.47Å; E780-R783 PolarHBondContact O-N 2.91Å; E780-R783 VanDerWaalsContact O-N 3.09Å; E780-E784 PolarHBondContact O-N 3.24Å
781	A	89.3	Confident	86.2	Confident	55 Å²	55	105 Å²	105	46%	0.455	51%	0.506	S	S	.	.	H	α-helix	trans	-60.6	-38.4	173.5	0	0	0	0	0	112.7	Q777 D778 E784 K785	Q777-A781 PolarHBondContact O-N 3.25Å; D778-A781 PolarHBondContact O-N 3.14Å; A781-E784 PolarHBondContact O-N 3.37Å; A781-K785 PolarHBondContact O-N 3.22Å; A781-K785 VanDerWaalsContact O-N 3.08Å
782	L	84.3	Confident	86.6	Confident	113 Å²	113	105.4 Å²	105.4	59%	0.592	51%	0.508	S	S	*	.	H	α-helix	trans	-66.8	-35.3	173.5	-73.1	170	0	0	0	112.6	D778 E780 E784 L786	D778-L782 WeakPolarHBondContact O-CB 3.49Å; D778-L782 VanDerWaalsContact O-CG 3.29Å; D778-L782 WeakPolarHBondContact O-CG 3.32Å; D778-L782 PolarHBondContact O-N 3.28Å; E780-L782 VanDerWaalsContact C-N 3.32Å; E780-L782 PolarHBondContact O-N 2.92Å; L782-E784 VanDerWaalsContact C-N 3.32Å; L782-L786 WeakPolarHBondContact O-CB 3.45Å; L782-L786 PolarHBondContact O-N 3.18Å
783	R	85.9	Confident	87	Confident	159 Å²	159	104.4 Å²	104.4	60%	0.6	51%	0.506	S	S	*	.	H	α-helix	trans	-68.3	-29.7	173	-73.4	166.1	178.7	-175.1	1.8	112.7	N779 E780 R787	N779-R783 WeakPolarHBondContact O-CD 3.29Å; N779-R783 VanDerWaalsContact O-CG 3.24Å; N779-R783 WeakPolarHBondContact O-CG 3.36Å; N779-R783 PolarHBondContact O-N 2.74Å; N779-R783 VanDerWaalsContact O-N 3.09Å; E780-R783 WeakPolarHBondContact O-CB 3.47Å; E780-R783 PolarHBondContact O-N 2.91Å; E780-R783 VanDerWaalsContact O-N 3.09Å; R783-R787 PolarHBondContact O-N 3.45Å
784	E	90.1	Very high	87.1	Confident	92 Å²	92	105.1 Å²	105.1	43%	0.43	51%	0.506	S	S	.	.	H	α-helix	trans	-70.4	-51.6	174	-165	125.6	-105.2	0	0	111.3	E780 A781 L782 L786 R787 E788	E780-E784 PolarHBondContact O-N 3.24Å; A781-E784 PolarHBondContact O-N 3.37Å; L782-E784 VanDerWaalsContact C-N 3.32Å; E784-L786 PolarHBondContact O-N 3.31Å; E784-L786 VanDerWaalsContact O-N 3.15Å; E784-R787 VanDerWaalsContact CD-NH2 3.31Å; E784-R787 WeakPolarHBondContact O-CA 3.26Å; E784-R787 WeakPolarHBondContact O-CB 3.41Å; E784-R787 PolarHBondContact O-N 3.13Å; E784-R787 IonicContact OE1-CZ 2.66Å; E784-R787 IonicContact OE1-NH1 3.06Å; E784-R787 PolarHBondContact OE1-NH1 3.33Å; E784-R787 IonicContact OE1-NH2 2.8Å; E784-R787 PolarHBondContact OE1-NH2 3.11Å; E784-E788 PolarHBondContact O-N 3.18Å
785	K	88.5	Confident	87	Confident	134 Å²	134	104.7 Å²	104.7	58%	0.583	51%	0.507	S	S	*	.	H	α-helix	trans	-56.5	-32.9	173.4	-72.4	-179.9	176.1	176.9	0	113.1	A781 T789	A781-K785 PolarHBondContact O-N 3.22Å; A781-K785 VanDerWaalsContact O-N 3.08Å; K785-T789 PolarHBondContact O-N 3Å; K785-T789 PolarHBondContact O-OG1 3.1Å
786	L	84.6	Confident	87.2	Confident	92 Å²	92	105.8 Å²	105.8	48%	0.482	51%	0.513	S	S	.	.	H	α-helix	trans	-72.5	-23.7	174	-174.1	62.3	0	0	0	113.5	L782 E784 K790	L782-L786 WeakPolarHBondContact O-CB 3.45Å; L782-L786 PolarHBondContact O-N 3.18Å; E784-L786 PolarHBondContact O-N 3.31Å; E784-L786 VanDerWaalsContact O-N 3.15Å; L786-K790 VanDerWaalsContact O-CD 3.27Å; L786-K790 WeakPolarHBondContact O-CD 3.31Å; L786-K790 VanDerWaalsContact O-CG 3.22Å; L786-K790 WeakPolarHBondContact O-CG 3.44Å
787	R	89.9	Confident	87	Confident	137 Å²	137	105.5 Å²	105.5	52%	0.517	51%	0.51	S	S	.	.	H	α-helix	trans	-76.1	-46.3	169.2	-77.2	-179.8	-82.9	120.9	-9.1	110.6	R783 E784 K790 L791	R783-R787 PolarHBondContact O-N 3.45Å; E784-R787 VanDerWaalsContact CD-NH2 3.31Å; E784-R787 WeakPolarHBondContact O-CA 3.26Å; E784-R787 WeakPolarHBondContact O-CB 3.41Å; E784-R787 PolarHBondContact O-N 3.13Å; E784-R787 IonicContact OE1-CZ 2.66Å; E784-R787 IonicContact OE1-NH1 3.06Å; E784-R787 PolarHBondContact OE1-NH1 3.33Å; E784-R787 IonicContact OE1-NH2 2.8Å; E784-R787 PolarHBondContact OE1-NH2 3.11Å; R787-K790 PolarHBondContact O-N 3.1Å; R787-L791 PolarHBondContact O-N 3.45Å; R787-L791 VanDerWaalsContact O-N 3.09Å
788	E	89.4	Confident	86.8	Confident	118 Å²	118	102.3 Å²	102.3	55%	0.551	50%	0.501	S	S	*	.	H	α-helix	trans	-59	-51.7	179.1	-64.7	175.6	141.5	0	0	112	E784 K790 L791 E792	E784-E788 PolarHBondContact O-N 3.18Å; E788-K790 VanDerWaalsContact C-N 3.3Å; E788-K790 PolarHBondContact O-N 3.25Å; E788-L791 WeakPolarHBondContact O-CA 3.15Å; E788-L791 WeakPolarHBondContact O-CB 3.34Å; E788-L791 PolarHBondContact O-N 2.81Å; E788-E792 PolarHBondContact O-N 3.4Å
789	T	85.9	Confident	86.4	Confident	81 Å²	81	104.3 Å²	104.3	50%	0.497	50%	0.504	S	S	.	.	H	α-helix	trans	-62	-32.9	178.8	44.3	0	0	0	0	113.5	K785 V793	K785-T789 PolarHBondContact O-N 3Å; K785-T789 PolarHBondContact O-OG1 3.1Å; T789-V793 WeakPolarHBondContact O-CB 3.36Å; T789-V793 VanDerWaalsContact O-CG2 3.29Å; T789-V793 WeakPolarHBondContact O-CG2 3.44Å; T789-V793 PolarHBondContact O-N 3.45Å
790	K	86.1	Confident	86	Confident	127 Å²	127	106.5 Å²	106.5	55%	0.552	52%	0.515	S	S	*	.	H	α-helix	trans	-66.6	-38.1	171.7	-75.8	172.7	-174.6	173	0	112.2	L786 R787 E788 V793 E794	L786-K790 VanDerWaalsContact O-CD 3.27Å; L786-K790 WeakPolarHBondContact O-CD 3.31Å; L786-K790 VanDerWaalsContact O-CG 3.22Å; L786-K790 WeakPolarHBondContact O-CG 3.44Å; R787-K790 PolarHBondContact O-N 3.1Å; E788-K790 VanDerWaalsContact C-N 3.3Å; E788-K790 PolarHBondContact O-N 3.25Å; K790-V793 PolarHBondContact O-N 3.07Å; K790-E794 PolarHBondContact O-N 2.9Å
791	L	88.8	Confident	85.4	Confident	122 Å²	122	107.9 Å²	107.9	64%	0.639	52%	0.518	S	S	*	.	H	α-helix	trans	-68.1	-41.9	178.6	-146.3	159	0	0	0	110.5	R787 E788 V793 E794 K795	R787-L791 PolarHBondContact O-N 3.45Å; R787-L791 VanDerWaalsContact O-N 3.09Å; E788-L791 WeakPolarHBondContact O-CA 3.15Å; E788-L791 WeakPolarHBondContact O-CB 3.34Å; E788-L791 PolarHBondContact O-N 2.81Å; L791-V793 PolarHBondContact O-N 2.95Å; L791-E794 PolarHBondContact O-N 3.44Å; L791-K795 WeakPolarHBondContact O-CB 3.27Å; L791-K795 PolarHBondContact O-N 2.94Å
792	E	88	Confident	84.6	Confident	89 Å²	89	111.9 Å²	111.9	42%	0.416	53%	0.526	S	S	.	.	H	α-helix	trans	-65.4	-36.9	174.4	-153.7	62.3	-154.7	0	0	112	E788 K795 L796	E788-E792 PolarHBondContact O-N 3.4Å; E792-K795 WeakPolarHBondContact O-CB 3.48Å; E792-K795 PolarHBondContact O-N 3.07Å; E792-K795 WeakPolarHBondContact OE1-CD 3.47Å; E792-K795 IonicContact OE1-NZ 2.76Å; E792-K795 PolarHBondContact OE1-NZ 3.26Å; E792-K795 WeakPolarHBondContact OE2-CD 3.49Å; E792-K795 IonicContact OE2-NZ 2.61Å; E792-K795 PolarHBondContact OE2-NZ 3.18Å; E792-L796 WeakPolarHBondContact O-CB 3.4Å; E792-L796 VanDerWaalsContact O-CG 3.3Å; E792-L796 WeakPolarHBondContact O-CG 3.06Å; E792-L796 PolarHBondContact O-N 2.8Å
793	V	88.6	Confident	83.8	Confident	72 Å²	72	113.6 Å²	113.6	44%	0.436	53%	0.53	S	S	.	.	H	α-helix	trans	-64.2	-42.5	173.2	164.5	0	0	0	0	112.6	T789 K790 L791 L796 K797	T789-V793 WeakPolarHBondContact O-CB 3.36Å; T789-V793 VanDerWaalsContact O-CG2 3.29Å; T789-V793 WeakPolarHBondContact O-CG2 3.44Å; T789-V793 PolarHBondContact O-N 3.45Å; K790-V793 PolarHBondContact O-N 3.07Å; L791-V793 PolarHBondContact O-N 2.95Å; V793-L796 PolarHBondContact O-N 2.97Å; V793-K797 HydrophobicContact CG1-CD 4.48Å; V793-K797 WeakPolarHBondContact O-CG 3.45Å; V793-K797 PolarHBondContact O-N 2.85Å
794	E	87.1	Confident	82.5	Confident	108 Å²	108	110 Å²	110	51%	0.505	54%	0.535	S	S	.	.	H	α-helix	trans	-67.1	-37	174.6	-70.9	-53.4	136.5	0	0	112.3	K790 L791 K797 S798	K790-E794 PolarHBondContact O-N 2.9Å; L791-E794 PolarHBondContact O-N 3.44Å; E794-K797 WeakPolarHBondContact O-CB 3.27Å; E794-K797 PolarHBondContact O-N 2.91Å; E794-K797 IonicContact OE1-NZ 3.58Å; E794-K797 PolarHBondContact OE1-NZ 3.18Å; E794-K797 IonicContact OE2-NZ 3.9Å; E794-S798 PolarHBondContact O-N 3.49Å
795	K	88.6	Confident	80.9	Confident	88 Å²	88	112 Å²	112	38%	0.383	55%	0.547	S	S	.	.	H	α-helix	trans	-61.9	-46.2	174	-169.5	-171.8	176.2	-161.6	0	111	L791 E792 S798 Y799	L791-K795 WeakPolarHBondContact O-CB 3.27Å; L791-K795 PolarHBondContact O-N 2.94Å; E792-K795 WeakPolarHBondContact O-CB 3.48Å; E792-K795 PolarHBondContact O-N 3.07Å; E792-K795 WeakPolarHBondContact OE1-CD 3.47Å; E792-K795 IonicContact OE1-NZ 2.76Å; E792-K795 PolarHBondContact OE1-NZ 3.26Å; E792-K795 WeakPolarHBondContact OE2-CD 3.49Å; E792-K795 IonicContact OE2-NZ 2.61Å; E792-K795 PolarHBondContact OE2-NZ 3.18Å; K795-S798 WeakPolarHBondContact O-CA 3.29Å; K795-S798 WeakPolarHBondContact O-CB 3.26Å; K795-S798 PolarHBondContact O-N 3.34Å; K795-S798 VanDerWaalsContact O-N 3.1Å; K795-S798 PolarHBondContact O-OG 2.87Å; K795-Y799 HydrophobicContact CG-CD2 4.44Å; K795-Y799 HydrophobicContact CG-CE2 3.99Å; K795-Y799 WeakPolarHBondContact O-CD2 3.43Å; K795-Y799 PolarHBondContact O-N 2.86Å; K795-Y799 VanDerWaalsContact O-N 3.07Å
796	L	83	Confident	79.1	Confident	105 Å²	105	113.1 Å²	113.1	55%	0.55	56%	0.555	S	S	.	*	H	α-helix	trans	-62.1	-41.9	173.8	-73.3	167.9	0	0	0	112.7	E792 V793 S798 Y799 L800	E792-L796 WeakPolarHBondContact O-CB 3.4Å; E792-L796 VanDerWaalsContact O-CG 3.3Å; E792-L796 WeakPolarHBondContact O-CG 3.06Å; E792-L796 PolarHBondContact O-N 2.8Å; V793-L796 PolarHBondContact O-N 2.97Å; L796-S798 VanDerWaalsContact C-N 3.25Å; L796-S798 PolarHBondContact O-N 2.92Å; L796-Y799 PolarHBondContact O-N 2.97Å; L796-L800 PolarHBondContact O-N 2.94Å
797	K	82.1	Confident	77.2	Confident	108 Å²	108	114.2 Å²	114.2	47%	0.47	57%	0.567	S	S	.	*	H	α-helix	trans	-58.5	-37.8	171	-73.2	171.2	-174	173.7	0	112	V793 E794 L800 K801	V793-K797 HydrophobicContact CG1-CD 4.48Å; V793-K797 WeakPolarHBondContact O-CG 3.45Å; V793-K797 PolarHBondContact O-N 2.85Å; E794-K797 WeakPolarHBondContact O-CB 3.27Å; E794-K797 PolarHBondContact O-N 2.91Å; E794-K797 IonicContact OE1-NZ 3.58Å; E794-K797 PolarHBondContact OE1-NZ 3.18Å; E794-K797 IonicContact OE2-NZ 3.9Å; K797-L800 PolarHBondContact O-N 2.61Å; K797-K801 WeakPolarHBondContact O-CB 3.44Å; K797-K801 PolarHBondContact O-N 3.26Å
798	S	81.6	Confident	75.1	Confident	55 Å²	55	113.6 Å²	113.6	39%	0.385	58%	0.578	S	S	.	*	H	α-helix	trans	-66.9	-37.6	177.5	87.9	0	0	0	0	112.5	E794 K795 L796 K802	E794-S798 PolarHBondContact O-N 3.49Å; K795-S798 WeakPolarHBondContact O-CA 3.29Å; K795-S798 WeakPolarHBondContact O-CB 3.26Å; K795-S798 PolarHBondContact O-N 3.34Å; K795-S798 VanDerWaalsContact O-N 3.1Å; K795-S798 PolarHBondContact O-OG 2.87Å; L796-S798 VanDerWaalsContact C-N 3.25Å; L796-S798 PolarHBondContact O-N 2.92Å; S798-K802 WeakPolarHBondContact O-CG 3.42Å; S798-K802 PolarHBondContact O-N 3.27Å; S798-K802 VanDerWaalsContact O-N 3.11Å
799	Y	79.1	Confident	73	Confident	125 Å²	125	116.6 Å²	116.6	49%	0.49	59%	0.592	S	S	.	*	H	α-helix	trans	-67.4	-45.9	172.4	-76.4	-70.7	0	0	0	111.8	K795 L796 K801 K802 H803	K795-Y799 HydrophobicContact CG-CD2 4.44Å; K795-Y799 HydrophobicContact CG-CE2 3.99Å; K795-Y799 WeakPolarHBondContact O-CD2 3.43Å; K795-Y799 PolarHBondContact O-N 2.86Å; K795-Y799 VanDerWaalsContact O-N 3.07Å; L796-Y799 PolarHBondContact O-N 2.97Å; Y799-K801 VanDerWaalsContact C-N 3.26Å; Y799-K801 PolarHBondContact O-N 3Å; Y799-K802 WeakPolarHBondContact O-CB 3.46Å; Y799-K802 PolarHBondContact O-N 2.6Å; Y799-H803 PolarHBondContact O-CD2 3.28Å; Y799-H803 PolarHBondContact O-N 3.45Å
800	L	76.4	Confident	71	Confident	132 Å²	132	121.4 Å²	121.4	69%	0.691	61%	0.609	S	S	*	*	H	α-helix	trans	-55.9	-43	175.6	-165.5	81.8	0	0	0	111.2	L796 K797 K802 H803 A804	L796-L800 PolarHBondContact O-N 2.94Å; K797-L800 PolarHBondContact O-N 2.61Å; L800-K802 VanDerWaalsContact C-N 3.32Å; L800-K802 PolarHBondContact O-N 3.46Å; L800-H803 PolarHBondContact O-N 2.62Å; L800-A804 WeakPolarHBondContact O-CB 3.45Å; L800-A804 PolarHBondContact O-N 2.82Å
801	K	76.6	Confident	68.8	Low	153 Å²	153	122.9 Å²	122.9	67%	0.665	62%	0.623	S	S	*	*	H	α-helix	trans	-69.4	-24.6	177.6	-165.9	174.9	-178.1	-177.1	0	113.5	K797 Y799 L805	K797-K801 WeakPolarHBondContact O-CB 3.44Å; K797-K801 PolarHBondContact O-N 3.26Å; Y799-K801 VanDerWaalsContact C-N 3.26Å; Y799-K801 PolarHBondContact O-N 3Å; K801-L805 WeakPolarHBondContact O-CD1 2.75Å; K801-L805 WeakPolarHBondContact O-CG 3.19Å
802	K	72.3	Confident	66.6	Low	139 Å²	139	122.7 Å²	122.7	60%	0.604	63%	0.632	S	S	*	*	H	α-helix	trans	-77	-44.2	171.4	-75.7	177.2	177.4	-176.5	0	111.9	S798 Y799 L800 A804 L805	S798-K802 WeakPolarHBondContact O-CG 3.42Å; S798-K802 PolarHBondContact O-N 3.27Å; S798-K802 VanDerWaalsContact O-N 3.11Å; Y799-K802 WeakPolarHBondContact O-CB 3.46Å; Y799-K802 PolarHBondContact O-N 2.6Å; L800-K802 VanDerWaalsContact C-N 3.32Å; L800-K802 PolarHBondContact O-N 3.46Å; K802-A804 VanDerWaalsContact C-N 3.3Å; K802-A804 PolarHBondContact O-N 3.45Å; K802-L805 PolarHBondContact O-N 3.23Å; K802-L805 VanDerWaalsContact O-N 3.07Å
803	H	66.6	Low	64.4	Low	150 Å²	150	123.2 Å²	123.2	69%	0.694	65%	0.646	S	S	*	*	H	α-helix	trans	-61.6	-38.1	174.4	-83.9	-81.8	0	0	0	112	Y799 L800 L805 H806	Y799-H803 PolarHBondContact O-CD2 3.28Å; Y799-H803 PolarHBondContact O-N 3.45Å; L800-H803 PolarHBondContact O-N 2.62Å; H803-L805 PolarHBondContact O-N 3.38Å; H803-H806 PolarHBondContact O-N 3.33Å
804	A	59.3	Low	61.8	Low	83 Å²	83	129.6 Å²	129.6	69%	0.686	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	1	174.5	0	0	0	0	0	115.2	L800 K802	L800-A804 WeakPolarHBondContact O-CB 3.45Å; L800-A804 PolarHBondContact O-N 2.82Å; K802-A804 VanDerWaalsContact C-N 3.3Å; K802-A804 PolarHBondContact O-N 3.45Å
805	L	57.2	Low	60.6	Low	133 Å²	133	130.7 Å²	130.7	70%	0.696	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.5	-2.6	177.7	-71.4	171.7	0	0	0	113.8	K801 K802 H803	K801-L805 WeakPolarHBondContact O-CD1 2.75Å; K801-L805 WeakPolarHBondContact O-CG 3.19Å; K802-L805 PolarHBondContact O-N 3.23Å; K802-L805 VanDerWaalsContact O-N 3.07Å; H803-L805 PolarHBondContact O-N 3.38Å
806	H	50.5	Low	59.1	Low	159 Å²	159	132.9 Å²	132.9	74%	0.736	72%	0.719	S	S	*	*			trans	-111.2	106.6	167.5	-91.8	-83.9	0	0	0	109.4	H803	H803-H806 PolarHBondContact O-N 3.33Å
807	P	45.3	Very low	57.8	Low	114 Å²	114	134.4 Å²	134.4	74%	0.74	73%	0.729	S	S	*	*			trans	-58.2	142.3	157.5	-16.3	30.9	0	0	0	109
808	V	45.8	Very low	56.3	Low	124 Å²	124	136 Å²	136	75%	0.752	74%	0.744	S	S	*	*			trans	-80	118.8	165.2	176.4	0	0	0	0	106.9	E810	V808-E810 HydrophobicContact CG1-CG 4.29Å
809	E	44.4	Very low	54.8	Low	182 Å²	182	141.1 Å²	141.1	85%	0.85	77%	0.766	S	S	*	*			trans	-79.5	114.5	162	-68.8	-179.3	134.2	0	0	107	D811	E809-D811 PolarHBondContact O-N 3.47Å
810	E	42.8	Very low	53.1	Low	181 Å²	181	142.1 Å²	142.1	85%	0.846	79%	0.785	S	S	*	*			trans	-80.1	95.1	176.1	-70	-174.3	135	0	0	109.4	V808 S812	V808-E810 HydrophobicContact CG1-CG 4.29Å; E810-S812 PolarHBondContact O-N 3.1Å; E810-S812 VanDerWaalsContact O-N 3.1Å
811	D	41.1	Very low	51.5	Low	158 Å²	158	142.9 Å²	142.9	85%	0.845	79%	0.791	S	S	*	*			trans	-66.9	104.9	176.1	-109	-29.9	0	0	0	110.9	E809 S813	E809-D811 PolarHBondContact O-N 3.47Å; D811-S813 PolarHBondContact O-N 3.27Å; D811-S813 VanDerWaalsContact O-N 3.16Å
812	S	42.1	Very low	49.6	Very low	118 Å²	118	142.1 Å²	142.1	83%	0.825	80%	0.801	S	S	*	*			trans	-83.6	85.9	-176.9	62	0	0	0	0	112.3	E810	E810-S812 PolarHBondContact O-N 3.1Å; E810-S812 VanDerWaalsContact O-N 3.1Å
813	S	41.6	Very low	47.7	Very low	101 Å²	101	142.3 Å²	142.3	71%	0.706	82%	0.818	S	S	*	*			trans	-160.3	100.9	164.7	51.5	0	0	0	0	115.4	D811	D811-S813 PolarHBondContact O-N 3.27Å; D811-S813 VanDerWaalsContact O-N 3.16Å
814	S	35.3	Very low	45.9	Very low	205 Å²	205	141.6 Å²	141.6	100%	1.434	83%	0.829	S	S	*	*			trans	175.7	0	144.5	-78	0	0	0	0	110.2

Retrieved 814 of 814 residues in 1157.5 ms (Link to these results)

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