X5LV90_CAEEL Loading...

Domain of unknown function WSN domain-containing protein

AlphaFold DB , UniProt , Accession X5LV90, Species CAEEL (Caenorhabditis elegans), Gene n/a, Length 917 aa.

						>X5LV90_CAEEL|X5LV90
MPTCLRAYIRETYSVKMWFHRTNIIWILISFSCMTSCHSTNQTVTAGAGSSSPVDKLADIVTKMQSLARLVNGISLEIGFIDGSIPSDDAIAELLYTDPSKLQEMMSVNSSVANRITNGFDTIYSDISSAPDNVKIMEKRLAVLEDISLILDTVSLEKVDSKDYGTKLRDVGEFVNKFTQIHEKYWTEMKKYLDDMHRIFTHLVTDSPTDSEIEQTVESFPDYVKTFENVQKAVPYFEQVVTVLRRAKEIDNMFLVFRPLIFESQLRSQLASTGKYDQESIDLLGKLFEDVLEFSQDSKSFLENLESIENLIWSKATTTNLPVQLMIGFTEGSKDIELLQESSGSILNSSRVSSSLETAFKSFGSFGKDISNFESSWKSTLKRANQSSLDEMKNMLKIMSSLSYFKSVSAHLEAITKCDASGSSSTESLTELPVIYANMKFLDQGLKMQSSFDYINQFKDLSLLITRFTIGPEKDKIQEARSVIAWFNVQNANRIQNARKFVSDFEKLQTSMTKLGDLLKIVGESFSKIEGYQKMITDPKHLSFYQCLTAAKDKEGGVRALLENFAVFRAIPSSTIANTKLVVDGITDSQHKLQALRSMALKMKSVDGREALALKTSFPDSQKIAFDLGLAVLGVSTIKKVIDNRSELAPLTKELKDIEEAAGNSTEDISTLQDLKSSVISMFKGIDDFLSSDFSSDGKIFEEAAKIPGIAGFNYKSLKAAVEAVDTTGKFSGIVNALEVITNLDLDFEKYDIKSASSSLKALDAFFNKYEATLFPPTTTIPPATPLSSPAPSNQSPPSQPQPGPRGSSPPAPSAPSAPETDTNSLALVDLTDSPADPTPEVSGFMWFILQNGKCNAFGRFSIKKFSTENAQQQIQDIIYFILCDGHCWYRVFREAVLEDGSKCEAKNSKEEDQWKL
					

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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	27.7	Very low	27.7	Very low	238 Å²	238	171.5 Å²	171.5	100%	1.172	86%	0.857	S	S	*	*				0	138.7	0	-137.7	172.9	176.3	0	0	107.7
2	P	41.9	Very low	27.5	Very low	111 Å²	111	168.3 Å²	168.3	72%	0.721	85%	0.853	S	S	*	*			trans	-90.4	147	-152.6	34.7	-30.1	0	0	0	113.2
3	T	33.1	Very low	27.5	Very low	146 Å²	146	171.9 Å²	171.9	90%	0.896	85%	0.853	S	S	*	*			trans	-117.4	38.6	168.8	-28.8	0	0	0	0	110.5
4	C	24.2	Very low	26.9	Very low	122 Å²	122	167.2 Å²	167.2	82%	0.824	85%	0.845	S	S	*	*			trans	-94	17.7	179.1	-128.9	0	0	0	0	113.9
5	L	24.1	Very low	26.8	Very low	159 Å²	159	163.9 Å²	163.9	83%	0.832	84%	0.836	S	S	*	*	S	Bend	trans	-144.2	54.5	-174	-151.8	78.6	0	0	0	115.2
6	R	22	Very low	26.5	Very low	247 Å²	247	166.6 Å²	166.6	93%	0.932	84%	0.84	S	S	*	*	S	Bend	trans	-138.3	9.3	167	-110.2	-172.5	-158.6	-172.6	6.3	119
7	A	31.2	Very low	26.2	Very low	91 Å²	91	166.1 Å²	166.1	75%	0.752	84%	0.836	S	S	*	*			trans	-147	30.4	173.6	0	0	0	0	0	114.9	I9	A7-I9 PolarHBondContact O-N 3.09Å
8	Y	26.5	Very low	26	Very low	224 Å²	224	168.8 Å²	168.8	88%	0.878	84%	0.835	S	S	*	*	S	Bend	trans	-73.7	19.7	155.5	-172.9	-103.7	0	0	0	111.9
9	I	23	Very low	25.8	Very low	157 Å²	157	170 Å²	170	81%	0.805	84%	0.835	S	S	*	*			trans	-136.7	75.4	171.9	-52.2	179.7	0	0	0	108.7	A7	A7-I9 PolarHBondContact O-N 3.09Å
10	R	26.5	Very low	25.7	Very low	242 Å²	242	167.3 Å²	167.3	91%	0.913	82%	0.82	S	S	*	*	S	Bend	trans	-147	84.7	146.9	-163.2	177	-101.9	-173.1	-5.4	107.9
11	E	25	Very low	25.7	Very low	150 Å²	150	167.9 Å²	167.9	70%	0.701	81%	0.814	S	S	*	*			trans	-3.2	127	159.1	-69.3	-178.8	146	0	0	117.7	Y13	E11-Y13 PolarHBondContact O-N 3.13Å
12	T	25.2	Very low	25.6	Very low	132 Å²	132	163 Å²	163	81%	0.81	80%	0.798	S	S	*	*				16.5	94.6	119.9	35.8	0	0	0	0	116.1
13	Y	26.6	Very low	24.8	Very low	216 Å²	216	162.9 Å²	162.9	85%	0.847	79%	0.791	S	S	*	*			trans	-134.7	108.1	151.4	-98.2	-84	0	0	0	110.9	E11	E11-Y13 PolarHBondContact O-N 3.13Å
14	S	20.2	Very low	24.4	Very low	106 Å²	106	162 Å²	162	74%	0.741	78%	0.779	S	S	*	*			trans	-17.3	139	157.3	-71.3	0	0	0	0	119.5
15	V	24.3	Very low	24.6	Very low	118 Å²	118	163.8 Å²	163.8	72%	0.715	78%	0.779	S	S	*	*			trans	62.6	103.4	135.2	-175.2	0	0	0	0	116.7
16	K	23.3	Very low	24.5	Very low	206 Å²	206	166.5 Å²	166.5	90%	0.896	78%	0.778	S	S	*	*			trans	-145.4	94.8	139.2	-109.2	171.8	-174.1	177.9	0	110.1	W18	K16-W18 PolarHBondContact O-N 2.89Å
17	M	21.5	Very low	24.7	Very low	159 Å²	159	160.9 Å²	160.9	78%	0.783	77%	0.765	S	S	*	*			trans	-41.7	125.8	152.5	-82.4	179.5	-92.7	0	0	109.8
18	W	22.2	Very low	24.6	Very low	215 Å²	215	164.2 Å²	164.2	81%	0.814	77%	0.769	S	S	*	*			trans	-135.3	73.6	151.1	-136.6	65.1	0	0	0	109.1	K16 H20	K16-W18 PolarHBondContact O-N 2.89Å; W18-H20 HydrophobicContact CD2-CB 4.34Å; W18-H20 HydrophobicContact CE3-CB 4.04Å; W18-H20 HydrophobicContact CH2-CB 4.17Å; W18-H20 AromaticContact CH2-CD2 3.81Å; W18-H20 HydrophobicContact CZ2-CB 4.45Å; W18-H20 AromaticContact CZ2-CD2 3.58Å; W18-H20 HydrophobicContact CZ3-CB 3.95Å; W18-H20 PolarHBondContact O-N 3.25Å
19	F	21	Very low	24.6	Very low	191 Å²	191	160 Å²	160	84%	0.838	76%	0.761	S	S	*	*			trans	-69.4	107.7	153.1	-111	-90.1	0	0	0	107.2
20	H	24.9	Very low	24.7	Very low	115 Å²	115	157.4 Å²	157.4	53%	0.532	76%	0.756	S	S	.	*			trans	-133.5	98	160.2	-109.9	10.5	0	0	0	112.1	W18	W18-H20 HydrophobicContact CD2-CB 4.34Å; W18-H20 HydrophobicContact CE3-CB 4.04Å; W18-H20 HydrophobicContact CH2-CB 4.17Å; W18-H20 AromaticContact CH2-CD2 3.81Å; W18-H20 HydrophobicContact CZ2-CB 4.45Å; W18-H20 AromaticContact CZ2-CD2 3.58Å; W18-H20 HydrophobicContact CZ3-CB 3.95Å; W18-H20 PolarHBondContact O-N 3.25Å
21	R	25.3	Very low	24.6	Very low	181 Å²	181	154.5 Å²	154.5	68%	0.683	75%	0.751	S	S	*	*			trans	75.1	82.4	131.5	-68.5	178	163.6	-159.8	-3.3	117.3
22	T	25.2	Very low	24.8	Very low	136 Å²	136	153.8 Å²	153.8	83%	0.834	76%	0.762	S	S	*	*				-46.3	122.8	116.6	37.7	0	0	0	0	110.8
23	N	25.1	Very low	24.7	Very low	107 Å²	107	151.8 Å²	151.8	57%	0.572	75%	0.753	S	S	*	*			trans	-148.9	106.7	158.4	-109.4	-16.4	0	0	0	110.9
24	I	25.8	Very low	24.5	Very low	129 Å²	129	149.5 Å²	149.5	66%	0.662	75%	0.752	S	S	*	*			trans	64.9	103	130.2	-55.1	165.1	0	0	0	116.5
25	I	27.2	Very low	25.1	Very low	158 Å²	158	151.2 Å²	151.2	81%	0.81	76%	0.758	S	S	*	*				-141.9	81.6	112.3	-55.4	-172.1	0	0	0	108
26	W	23.5	Very low	25.2	Very low	216 Å²	216	150.9 Å²	150.9	82%	0.818	76%	0.761	S	S	*	*			trans	-98.2	96.2	156.2	-107.2	91.5	0	0	0	105.7	I29	W26-I29 HydrophobicContact CH2-CD1 4.31Å; W26-I29 HydrophobicContact CZ3-CD1 4.11Å
27	I	25.9	Very low	25.3	Very low	130 Å²	130	147.2 Å²	147.2	67%	0.667	76%	0.76	S	S	*	*			trans	-141.5	128.7	164.5	-50.6	179.9	0	0	0	108
28	L	28	Very low	25.5	Very low	160 Å²	160	148.6 Å²	148.6	84%	0.838	76%	0.764	S	S	*	*			trans	95.8	51	165.1	-48.7	178.9	0	0	0	117.8
29	I	27	Very low	25.7	Very low	137 Å²	137	143.7 Å²	143.7	70%	0.703	76%	0.762	S	S	*	*			trans	-108.9	96.5	140.8	-61.5	176.1	0	0	0	106.9	W26	W26-I29 HydrophobicContact CH2-CD1 4.31Å; W26-I29 HydrophobicContact CZ3-CD1 4.11Å
30	S	25	Very low	26	Very low	101 Å²	101	140.7 Å²	140.7	71%	0.706	76%	0.76	S	S	*	*	S	Bend	trans	175.8	129.2	148.5	31.4	0	0	0	0	111.3
31	F	25	Very low	26.2	Very low	182 Å²	182	142.5 Å²	142.5	80%	0.798	77%	0.773	S	S	*	*			trans	68.6	91.3	154	-85.4	-102.6	0	0	0	119	C33	F31-C33 HydrophobicContact CD1-CB 4.18Å; F31-C33 HydrophobicContact CE1-CB 4.38Å
32	S	27.6	Very low	26.1	Very low	134 Å²	134	143.1 Å²	143.1	94%	0.937	78%	0.784	S	S	*	*			trans	-125.1	92.4	132.2	-76	0	0	0	0	108
33	C	23.2	Very low	26.1	Very low	91 Å²	91	142.1 Å²	142.1	62%	0.615	78%	0.778	S	S	*	*			trans	-82.2	148.3	168.9	-161.7	0	0	0	0	108.6	F31	F31-C33 HydrophobicContact CD1-CB 4.18Å; F31-C33 HydrophobicContact CE1-CB 4.38Å
34	M	23.9	Very low	26.1	Very low	168 Å²	168	143.6 Å²	143.6	83%	0.828	79%	0.791	S	S	*	*			trans	70.6	113	163.4	-70.2	180	153.4	0	0	118.3
35	T	31.4	Very low	26	Very low	142 Å²	142	143.5 Å²	143.5	87%	0.871	80%	0.796	S	S	*	*				-169.3	131.4	98.5	23.9	0	0	0	0	111.6
36	S	26.4	Very low	26	Very low	111 Å²	111	140.5 Å²	140.5	78%	0.776	80%	0.795	S	S	*	*			trans	-54.6	147.3	174.9	-50.1	0	0	0	0	113.9
37	C	26	Very low	26	Very low	128 Å²	128	133.8 Å²	133.8	87%	0.865	79%	0.793	S	S	*	*				160.9	143.1	107.9	-91.3	0	0	0	0	112.3
38	H	25.1	Very low	26.3	Very low	189 Å²	189	132.6 Å²	132.6	88%	0.875	80%	0.802	S	S	*	*			trans	-45.1	141.2	176.5	-76	13.2	0	0	0	115.5
39	S	27.8	Very low	26.4	Very low	112 Å²	112	128 Å²	128	78%	0.783	79%	0.794	S	S	*	*				-155.4	121.2	120.8	104.1	0	0	0	0	109.9	N41	S39-N41 PolarHBondContact O-N 2.98Å
40	T	26.6	Very low	26.9	Very low	128 Å²	128	127.3 Å²	127.3	79%	0.785	80%	0.801	S	S	*	*			trans	-54.1	120	168.1	37.5	0	0	0	0	111.4
41	N	28.3	Very low	27.9	Very low	152 Å²	152	124.8 Å²	124.8	81%	0.813	78%	0.783	S	S	*	*			trans	-160.2	101.5	140.6	-93.3	-24.8	0	0	0	107.6	S39 T43	S39-N41 PolarHBondContact O-N 2.98Å; N41-T43 VanDerWaalsContact C-N 3.29Å; N41-T43 PolarHBondContact O-N 2.88Å
42	Q	24.5	Very low	29.7	Very low	194 Å²	194	118.6 Å²	118.6	91%	0.907	76%	0.763	S	S	*	*			trans	-67.3	87	174.4	-73.5	177.5	-12.2	0	0	109.2
43	T	24	Very low	31.6	Very low	115 Å²	115	115.4 Å²	115.4	71%	0.706	74%	0.739	S	S	*	*			trans	-103.7	102.4	149.6	31.5	0	0	0	0	106	N41 T45	N41-T43 VanDerWaalsContact C-N 3.29Å; N41-T43 PolarHBondContact O-N 2.88Å; T43-T45 PolarHBondContact O-N 3.28Å
44	V	25.2	Very low	34	Very low	139 Å²	139	113.5 Å²	113.5	84%	0.842	72%	0.724	S	S	*	*			trans	-62.4	86.7	170.6	178.3	0	0	0	0	107.1	A46	V44-A46 PolarHBondContact O-N 2.91Å
45	T	24.7	Very low	36.3	Very low	127 Å²	127	109.7 Å²	109.7	78%	0.779	71%	0.707	S	S	*	*			trans	-75.3	106	163.4	35.7	0	0	0	0	106.6	T43 G47	T43-T45 PolarHBondContact O-N 3.28Å; T45-G47 PolarHBondContact O-N 2.72Å
46	A	26.2	Very low	38.3	Very low	94 Å²	94	108 Å²	108	78%	0.777	69%	0.688	S	S	*	*			trans	-49.1	105.4	168.7	0	0	0	0	0	109.3	V44 A48	V44-A46 PolarHBondContact O-N 2.91Å; A46-A48 PolarHBondContact O-N 3.2Å
47	G	25.1	Very low	40.9	Very low	76 Å²	76	102.8 Å²	102.8	78%	0.784	65%	0.651	S	S	*	*			trans	-66.3	101.9	168	0	0	0	0	0	108	T45 G49	T45-G47 PolarHBondContact O-N 2.72Å; G47-G49 PolarHBondContact O-N 3.32Å
48	A	30.7	Very low	43.6	Very low	104 Å²	104	98 Å²	98	86%	0.86	62%	0.62	S	S	*	*			trans	-69.2	71.1	166.5	0	0	0	0	0	109	A46 S50	A46-A48 PolarHBondContact O-N 3.2Å; A48-S50 PolarHBondContact O-N 2.96Å
49	G	31.1	Very low	46.2	Very low	64 Å²	64	93.8 Å²	93.8	66%	0.66	60%	0.604	S	S	*	*			trans	-69.4	118.4	158.8	0	0	0	0	0	106.8	G47 S51	G47-G49 PolarHBondContact O-N 3.32Å; G49-S51 VanDerWaalsContact C-N 3.27Å; G49-S51 PolarHBondContact O-N 2.74Å
50	S	36.2	Very low	48.7	Very low	122 Å²	122	89.9 Å²	89.9	85%	0.853	57%	0.574	S	S	*	*			trans	-66.6	85	177.5	57.5	0	0	0	0	109.7	A48 S52	A48-S50 PolarHBondContact O-N 2.96Å; S50-S52 PolarHBondContact O-N 3.44Å
51	S	46.2	Very low	51.5	Low	48 Å²	48	83.9 Å²	83.9	34%	0.336	54%	0.538	S	S	.	.			trans	-59.4	135.9	164.5	47.9	0	0	0	0	108.7	G49 K56	G49-S51 VanDerWaalsContact C-N 3.27Å; G49-S51 PolarHBondContact O-N 2.74Å; S51-K56 WeakPolarHBondContact OG-CE 3.48Å; S51-K56 VanDerWaalsContact OG-CG 3.24Å; S51-K56 WeakPolarHBondContact OG-CG 3.37Å
52	S	64.4	Low	54.2	Low	52 Å²	52	80.4 Å²	80.4	36%	0.364	52%	0.522	S	S	.	.			trans	-55.7	145.2	175.1	177.1	0	0	0	0	108.6	S50 V54 D55 K56	S50-S52 PolarHBondContact O-N 3.44Å; S52-V54 PolarHBondContact O-N 3.05Å; S52-V54 PolarHBondContact OG-N 3.08Å; S52-D55 WeakPolarHBondContact CB-OD2 3.43Å; S52-D55 PolarHBondContact N-OD2 2.83Å; S52-D55 VanDerWaalsContact N-OD2 3.14Å; S52-D55 WeakPolarHBondContact O-CB 3.22Å; S52-D55 PolarHBondContact O-N 3.48Å; S52-K56 PolarHBondContact O-N 3.18Å; S52-K56 VanDerWaalsContact O-N 3.1Å
53	P	67.5	Low	56.9	Low	68 Å²	68	77.9 Å²	77.9	44%	0.442	51%	0.508	S	S	.	.	H	α-helix	trans	-49.1	-31.5	171.9	-27.8	35	0	0	0	113.1	L57 L690	P53-L57 PolarHBondContact O-N 3.48Å; P53-L690 HydrophobicContact CB-CB 4.49Å
54	V	72.6	Confident	59.9	Low	50 Å²	50	73 Å²	73	30%	0.303	48%	0.478	S	S	.	.	H	α-helix	trans	-67.1	-42.7	175.4	-179.8	0	0	0	0	112.4	S52 K56 L57 A58 I642 L690	S52-V54 PolarHBondContact O-N 3.05Å; S52-V54 PolarHBondContact OG-N 3.08Å; V54-K56 VanDerWaalsContact C-N 3.33Å; V54-L57 PolarHBondContact O-N 2.68Å; V54-A58 PolarHBondContact O-N 3.11Å; V54-I642 HydrophobicContact CG1-CG2 4.24Å; V54-I642 HydrophobicContact CG2-CG2 4.41Å; V54-L690 HydrophobicContact CG2-CD1 4.34Å
55	D	73	Confident	62.9	Low	88 Å²	88	67.8 Å²	67.8	47%	0.471	44%	0.444	S	S	.	.	H	α-helix	trans	-64.8	-42.1	177.2	-57.9	-33.6	0	0	0	110.2	S52 L57 A58 D59	S52-D55 WeakPolarHBondContact CB-OD2 3.43Å; S52-D55 PolarHBondContact N-OD2 2.83Å; S52-D55 VanDerWaalsContact N-OD2 3.14Å; S52-D55 WeakPolarHBondContact O-CB 3.22Å; S52-D55 PolarHBondContact O-N 3.48Å; D55-L57 VanDerWaalsContact C-N 3.33Å; D55-L57 PolarHBondContact O-N 3.09Å; D55-A58 PolarHBondContact O-N 3.39Å; D55-D59 PolarHBondContact O-N 3.34Å
56	K	73.7	Confident	65.9	Low	107 Å²	107	62.5 Å²	62.5	47%	0.465	41%	0.412	S	S	.	.	H	α-helix	trans	-60.4	-42.8	174.5	-67.2	-175.4	-179.1	179.5	0	111.8	S51 S52 V54 D59 I60	S51-K56 WeakPolarHBondContact OG-CE 3.48Å; S51-K56 VanDerWaalsContact OG-CG 3.24Å; S51-K56 WeakPolarHBondContact OG-CG 3.37Å; S52-K56 PolarHBondContact O-N 3.18Å; S52-K56 VanDerWaalsContact O-N 3.1Å; V54-K56 VanDerWaalsContact C-N 3.33Å; K56-D59 PolarHBondContact O-N 3.44Å; K56-I60 WeakPolarHBondContact O-CB 3.14Å; K56-I60 WeakPolarHBondContact O-CD1 3.41Å; K56-I60 WeakPolarHBondContact O-CG1 3.33Å; K56-I60 PolarHBondContact O-N 3.43Å
57	L	80.7	Confident	68.9	Low	2 Å²	2	59.3 Å²	59.3	1%	0.01	38%	0.382	C	S	.	.	H	α-helix	trans	-62.4	-43.4	175.7	179.2	64.9	0	0	0	111.2	P53 V54 D55 D59 I60 V61 I642 F689 L690 I700	P53-L57 PolarHBondContact O-N 3.48Å; V54-L57 PolarHBondContact O-N 2.68Å; D55-L57 VanDerWaalsContact C-N 3.33Å; D55-L57 PolarHBondContact O-N 3.09Å; L57-D59 PolarHBondContact O-N 3.21Å; L57-I60 PolarHBondContact O-N 3.26Å; L57-V61 HydrophobicContact CD1-CG2 4Å; L57-V61 HydrophobicContact CG-CG2 4.16Å; L57-V61 WeakPolarHBondContact O-CB 3.45Å; L57-V61 VanDerWaalsContact O-CG2 3.28Å; L57-V61 WeakPolarHBondContact O-CG2 3.24Å; L57-V61 PolarHBondContact O-N 3.2Å; L57-I642 HydrophobicContact CD2-CD1 3.38Å; L57-F689 HydrophobicContact CD1-CE1 3.66Å; L57-F689 HydrophobicContact CD1-CZ 3.75Å; L57-F689 HydrophobicContact CD2-CE1 3.85Å; L57-F689 HydrophobicContact CG-CE1 4.41Å; L57-L690 HydrophobicContact CB-CD2 4.27Å; L57-L690 HydrophobicContact CD2-CD2 3.79Å; L57-I700 HydrophobicContact CD1-CD1 3.91Å
58	A	82.4	Confident	72	Confident	26 Å²	26	55.7 Å²	55.7	22%	0.215	35%	0.345	C	S	.	.	H	α-helix	trans	-60.1	-44.1	178.4	0	0	0	0	0	112.1	V54 D55 I60 V61 T62	V54-A58 PolarHBondContact O-N 3.11Å; D55-A58 PolarHBondContact O-N 3.39Å; A58-I60 VanDerWaalsContact C-N 3.34Å; A58-I60 PolarHBondContact O-N 3.38Å; A58-V61 PolarHBondContact O-N 2.66Å; A58-T62 WeakPolarHBondContact O-CB 3.43Å; A58-T62 PolarHBondContact O-N 3.18Å; A58-T62 PolarHBondContact O-OG1 2.86Å
59	D	79.8	Confident	74.9	Confident	101 Å²	101	51.6 Å²	51.6	54%	0.54	31%	0.307	S	S	.	.	H	α-helix	trans	-61.5	-43.2	175.4	-72.9	-19	0	0	0	111.7	D55 K56 L57 T62 K63	D55-D59 PolarHBondContact O-N 3.34Å; K56-D59 PolarHBondContact O-N 3.44Å; L57-D59 PolarHBondContact O-N 3.21Å; D59-T62 PolarHBondContact O-N 3.37Å; D59-K63 WeakPolarHBondContact O-CG 3.39Å; D59-K63 PolarHBondContact O-N 3.32Å; D59-K63 VanDerWaalsContact O-N 3.11Å
60	I	80.4	Confident	77.7	Confident	30 Å²	30	48.5 Å²	48.5	15%	0.154	28%	0.276	C	S	.	.	H	α-helix	trans	-68.4	-43.4	-179.8	-68.6	165.2	0	0	0	111.2	K56 L57 A58 T62 K63 M64 F694 I700	K56-I60 WeakPolarHBondContact O-CB 3.14Å; K56-I60 WeakPolarHBondContact O-CD1 3.41Å; K56-I60 WeakPolarHBondContact O-CG1 3.33Å; K56-I60 PolarHBondContact O-N 3.43Å; L57-I60 PolarHBondContact O-N 3.26Å; A58-I60 VanDerWaalsContact C-N 3.34Å; A58-I60 PolarHBondContact O-N 3.38Å; I60-T62 VanDerWaalsContact C-N 3.3Å; I60-T62 PolarHBondContact O-N 3.37Å; I60-K63 PolarHBondContact O-N 2.99Å; I60-M64 HydrophobicContact CG2-CE 3.29Å; I60-M64 PolarHBondContact O-N 3.43Å; I60-F694 HydrophobicContact CD1-CB 4.19Å; I60-F694 HydrophobicContact CD1-CD2 4.23Å; I60-F694 HydrophobicContact CD1-CG 4.43Å; I60-I700 HydrophobicContact CB-CD1 4.37Å; I60-I700 HydrophobicContact CD1-CD1 4.45Å; I60-I700 HydrophobicContact CG2-CD1 3.5Å; I60-I700 VanDerWaalsContact CG2-CD1 3.5Å
61	V	84.7	Confident	80.4	Confident	3 Å²	3	42.7 Å²	42.7	2%	0.018	24%	0.235	C	C	.	.	H	α-helix	trans	-59.2	-43.6	175.1	169.6	0	0	0	0	110.5	L57 A58 K63 M64 Q65 V635 K639	L57-V61 HydrophobicContact CD1-CG2 4Å; L57-V61 HydrophobicContact CG-CG2 4.16Å; L57-V61 WeakPolarHBondContact O-CB 3.45Å; L57-V61 VanDerWaalsContact O-CG2 3.28Å; L57-V61 WeakPolarHBondContact O-CG2 3.24Å; L57-V61 PolarHBondContact O-N 3.2Å; A58-V61 PolarHBondContact O-N 2.66Å; V61-K63 VanDerWaalsContact C-N 3.33Å; V61-K63 PolarHBondContact O-N 3.47Å; V61-M64 PolarHBondContact O-N 3.41Å; V61-Q65 HydrophobicContact CG1-CG 4.29Å; V61-Q65 WeakPolarHBondContact O-CG 3.46Å; V61-Q65 PolarHBondContact O-N 2.94Å; V61-V635 HydrophobicContact CG2-CG1 3.83Å; V61-K639 HydrophobicContact CG1-CD 4.3Å; V61-K639 HydrophobicContact CG2-CB 4.5Å
62	T	84	Confident	82.6	Confident	79 Å²	79	40.6 Å²	40.6	49%	0.485	22%	0.22	S	C	.	.	H	α-helix	trans	-60	-42.5	177.4	-56.9	0	0	0	0	111.9	A58 D59 I60 S66	A58-T62 WeakPolarHBondContact O-CB 3.43Å; A58-T62 PolarHBondContact O-N 3.18Å; A58-T62 PolarHBondContact O-OG1 2.86Å; D59-T62 PolarHBondContact O-N 3.37Å; I60-T62 VanDerWaalsContact C-N 3.3Å; I60-T62 PolarHBondContact O-N 3.37Å; T62-S66 PolarHBondContact O-N 3.03Å; T62-S66 PolarHBondContact O-OG 3.43Å
63	K	82.9	Confident	83.9	Confident	140 Å²	140	38.1 Å²	38.1	61%	0.609	20%	0.203	S	C	*	.	H	α-helix	trans	-65	-43.1	175.1	-72.1	175.4	-178.4	179	0	112	D59 I60 V61 S66 L67	D59-K63 WeakPolarHBondContact O-CG 3.39Å; D59-K63 PolarHBondContact O-N 3.32Å; D59-K63 VanDerWaalsContact O-N 3.11Å; I60-K63 PolarHBondContact O-N 2.99Å; V61-K63 VanDerWaalsContact C-N 3.33Å; V61-K63 PolarHBondContact O-N 3.47Å; K63-S66 WeakPolarHBondContact O-CB 3.35Å; K63-S66 PolarHBondContact O-N 2.78Å; K63-L67 PolarHBondContact O-N 3.32Å
64	M	86.8	Confident	85.1	Confident	13 Å²	13	34.9 Å²	34.9	6%	0.064	18%	0.182	C	C	.	.	H	α-helix	trans	-63.9	-41.8	177.1	-81.1	-163.9	-111.4	0	0	112.9	I60 V61 S66 L67 A68 V632 V635 I700 F701	I60-M64 HydrophobicContact CG2-CE 3.29Å; I60-M64 PolarHBondContact O-N 3.43Å; V61-M64 PolarHBondContact O-N 3.41Å; M64-S66 VanDerWaalsContact C-N 3.31Å; M64-S66 PolarHBondContact O-N 3.46Å; M64-L67 WeakPolarHBondContact O-CB 3.26Å; M64-L67 PolarHBondContact O-N 2.97Å; M64-A68 WeakPolarHBondContact O-CB 3.42Å; M64-A68 PolarHBondContact O-N 3.29Å; M64-V632 HydrophobicContact CB-CG1 4.08Å; M64-V632 HydrophobicContact CB-CG2 3.86Å; M64-V632 HydrophobicContact CG-CG2 4.47Å; M64-V632 HydrophobicContact SD-CG2 4.29Å; M64-V635 HydrophobicContact CE-CG1 4.2Å; M64-I700 HydrophobicContact CE-CB 4.25Å; M64-I700 HydrophobicContact CE-CD1 3.49Å; M64-I700 VanDerWaalsContact CE-CD1 3.49Å; M64-I700 HydrophobicContact CE-CG1 4.01Å; M64-I700 HydrophobicContact CE-CG2 3.35Å; M64-I700 HydrophobicContact SD-CG2 4.07Å; M64-F701 HydrophobicContact CG-CZ 4.2Å; M64-F701 HydrophobicContact SD-CE1 3.64Å; M64-F701 HydrophobicContact SD-CE2 3.67Å; M64-F701 HydrophobicContact SD-CZ 3.14Å; M64-F701 WeakPolarHBondContact SD-CZ 3.34Å
65	Q	88	Confident	86.2	Confident	30 Å²	30	32.8 Å²	32.8	14%	0.14	17%	0.169	C	C	.	.	H	α-helix	trans	-61.9	-41.9	173.8	-72.4	176.3	-63.2	0	0	111.1	V61 L67 A68 R69 T330 V632	V61-Q65 HydrophobicContact CG1-CG 4.29Å; V61-Q65 WeakPolarHBondContact O-CG 3.46Å; V61-Q65 PolarHBondContact O-N 2.94Å; Q65-L67 VanDerWaalsContact C-N 3.31Å; Q65-L67 PolarHBondContact O-N 3.19Å; Q65-A68 PolarHBondContact O-N 2.95Å; Q65-R69 VanDerWaalsContact O-CB 3.24Å; Q65-R69 WeakPolarHBondContact O-CB 3.33Å; Q65-R69 PolarHBondContact O-N 3.17Å; Q65-T330 HydrophobicContact CG-CG2 4.47Å; Q65-T330 PolarHBondContact NE2-OG1 3.37Å; Q65-V632 HydrophobicContact CB-CG1 4.46Å; Q65-V632 HydrophobicContact CG-CG1 3.8Å
66	S	87.3	Confident	87.1	Confident	15 Å²	15	28.9 Å²	28.9	11%	0.105	15%	0.148	C	C	.	.	H	α-helix	trans	-62.1	-39.9	174.6	-55.8	0	0	0	0	111.5	T62 K63 M64 L70 I346	T62-S66 PolarHBondContact O-N 3.03Å; T62-S66 PolarHBondContact O-OG 3.43Å; K63-S66 WeakPolarHBondContact O-CB 3.35Å; K63-S66 PolarHBondContact O-N 2.78Å; M64-S66 VanDerWaalsContact C-N 3.31Å; M64-S66 PolarHBondContact O-N 3.46Å; S66-L70 WeakPolarHBondContact O-CB 3.39Å; S66-L70 PolarHBondContact O-N 3.5Å; S66-I346 VanDerWaalsContact C-CD1 3.41Å; S66-I346 WeakPolarHBondContact O-CD1 3.36Å
67	L	88.9	Confident	87.9	Confident	27 Å²	27	23.8 Å²	23.8	14%	0.141	13%	0.126	C	C	.	.	H	α-helix	trans	-67	-48.1	176.8	-169.6	67.7	0	0	0	112.1	K63 M64 Q65 R69 L70 V71 I346 L628 L760 L763	K63-L67 PolarHBondContact O-N 3.32Å; M64-L67 WeakPolarHBondContact O-CB 3.26Å; M64-L67 PolarHBondContact O-N 2.97Å; Q65-L67 VanDerWaalsContact C-N 3.31Å; Q65-L67 PolarHBondContact O-N 3.19Å; L67-R69 VanDerWaalsContact C-N 3.31Å; L67-R69 PolarHBondContact O-N 3.12Å; L67-L70 WeakPolarHBondContact O-CB 3.37Å; L67-L70 PolarHBondContact O-N 3.43Å; L67-V71 VanDerWaalsContact O-CG2 3.28Å; L67-V71 WeakPolarHBondContact O-CG2 3.47Å; L67-V71 PolarHBondContact O-N 3.27Å; L67-I346 HydrophobicContact CB-CD1 4.26Å; L67-I346 HydrophobicContact CD1-CD1 4.19Å; L67-I346 HydrophobicContact CD1-CG2 3.65Å; L67-L628 HydrophobicContact CD2-CD2 4.3Å; L67-L628 HydrophobicContact CG-CD2 4.19Å; L67-L760 HydrophobicContact CD2-CD2 3.61Å; L67-L763 HydrophobicContact CD1-CD2 3.54Å; L67-L763 HydrophobicContact CD2-CD2 4.08Å; L67-L763 HydrophobicContact CG-CD2 3.95Å
68	A	90.8	Very high	88.5	Confident	1 Å²	1	24 Å²	24	1%	0.008	13%	0.127	C	C	.	.	H	α-helix	trans	-57.9	-46.1	176.3	0	0	0	0	0	110.8	M64 Q65 L70 V71 N72 G328 V632	M64-A68 WeakPolarHBondContact O-CB 3.42Å; M64-A68 PolarHBondContact O-N 3.29Å; Q65-A68 PolarHBondContact O-N 2.95Å; A68-L70 PolarHBondContact O-N 3.37Å; A68-V71 PolarHBondContact O-N 2.62Å; A68-N72 WeakPolarHBondContact O-CB 3.36Å; A68-N72 PolarHBondContact O-N 3.03Å; A68-G328 CarbonylContact C-O 3.47Å; A68-V632 HydrophobicContact CB-CB 4.14Å; A68-V632 HydrophobicContact CB-CG1 4.21Å; A68-V632 HydrophobicContact CB-CG2 4.08Å
69	R	91.2	Very high	89	Confident	17 Å²	17	22.9 Å²	22.9	6%	0.064	12%	0.118	C	C	.	.	H	α-helix	trans	-55.3	-51.4	173.4	176.8	-165.5	-59.3	148.6	1.7	111.4	Q65 L67 V71 N72 G73 G328 F329 D335 L339 S342	Q65-R69 VanDerWaalsContact O-CB 3.24Å; Q65-R69 WeakPolarHBondContact O-CB 3.33Å; Q65-R69 PolarHBondContact O-N 3.17Å; L67-R69 VanDerWaalsContact C-N 3.31Å; L67-R69 PolarHBondContact O-N 3.12Å; R69-V71 PolarHBondContact O-N 3.28Å; R69-N72 PolarHBondContact O-N 3.45Å; R69-G73 PolarHBondContact O-N 2.97Å; R69-G328 WeakPolarHBondContact CA-O 3.47Å; R69-G328 PolarHBondContact N-O 2.9Å; R69-F329 HydrophobicContact CG-CD1 4.14Å; R69-F329 HydrophobicContact CG-CE1 4.3Å; R69-D335 VanDerWaalsContact CD-O 3.23Å; R69-D335 WeakPolarHBondContact CD-O 3.27Å; R69-D335 HydrophobicContact CG-CB 3.98Å; R69-D335 WeakPolarHBondContact CG-O 3.35Å; R69-D335 IonicContact CZ-OD1 2.9Å; R69-D335 VanDerWaalsContact NE-CG 3.26Å; R69-D335 IonicContact NE-OD1 3.24Å; R69-D335 PolarHBondContact NE-OD1 2.91Å; R69-D335 IonicContact NE-OD2 3.53Å; R69-D335 IonicContact NH2-OD1 3.92Å; R69-D335 PolarHBondContact NH2-OD1 3.3Å; R69-L339 HydrophobicContact CG-CD2 3.85Å; R69-L339 HydrophobicContact CG-CG 4.4Å; R69-L339 VanDerWaalsContact O-CD2 3.31Å; R69-L339 WeakPolarHBondContact O-CD2 3.29Å; R69-S342 VanDerWaalsContact CD-OG 3.3Å; R69-S342 WeakPolarHBondContact CD-OG 3.24Å; R69-S342 PolarHBondContact NH1-OG 3.12Å
70	L	90.6	Very high	89.5	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-57.4	-49.8	179.8	178.7	64.9	0	0	0	111.4	S66 L67 A68 G73 I74 I346 L356 F360 F767	S66-L70 WeakPolarHBondContact O-CB 3.39Å; S66-L70 PolarHBondContact O-N 3.5Å; L67-L70 WeakPolarHBondContact O-CB 3.37Å; L67-L70 PolarHBondContact O-N 3.43Å; A68-L70 PolarHBondContact O-N 3.37Å; L70-G73 PolarHBondContact O-N 3.14Å; L70-I74 HydrophobicContact CG-CD1 4.35Å; L70-I74 WeakPolarHBondContact O-CG1 3.34Å; L70-I74 PolarHBondContact O-N 3.12Å; L70-I346 HydrophobicContact CB-CD1 4.14Å; L70-I346 HydrophobicContact CD2-CD1 3.95Å; L70-I346 HydrophobicContact CD2-CG2 4.48Å; L70-L356 HydrophobicContact CD1-CD1 4.4Å; L70-F360 HydrophobicContact CD1-CE2 3.43Å; L70-F360 VanDerWaalsContact CD1-CE2 3.43Å; L70-F360 HydrophobicContact CD1-CZ 3.92Å; L70-F767 HydrophobicContact CD2-CZ 4.03Å
71	V	92.1	Very high	90	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-65.1	-41.1	-178.5	178.5	0	0	0	0	111.4	L67 A68 R69 I74 S75 F618 I624 A625 L628 L763	L67-V71 VanDerWaalsContact O-CG2 3.28Å; L67-V71 WeakPolarHBondContact O-CG2 3.47Å; L67-V71 PolarHBondContact O-N 3.27Å; A68-V71 PolarHBondContact O-N 2.62Å; R69-V71 PolarHBondContact O-N 3.28Å; V71-I74 PolarHBondContact O-N 3.49Å; V71-S75 PolarHBondContact O-N 3.34Å; V71-F618 HydrophobicContact CG1-CE1 3.96Å; V71-F618 HydrophobicContact CG1-CZ 4.1Å; V71-I624 HydrophobicContact CG1-CG2 4.44Å; V71-A625 HydrophobicContact CG1-CB 3.84Å; V71-L628 HydrophobicContact CB-CD2 4.16Å; V71-L628 HydrophobicContact CG1-CD2 4.4Å; V71-L628 HydrophobicContact CG2-CD2 3.83Å; V71-L763 HydrophobicContact CG2-CD1 3.56Å; V71-L763 HydrophobicContact CG2-CD2 3.63Å; V71-L763 HydrophobicContact CG2-CG 4.25Å
72	N	92.4	Very high	90.2	Very high	4 Å²	4	20.5 Å²	20.5	2%	0.021	11%	0.105	C	C	.	.	H	α-helix	trans	-60.4	-44.4	172.2	-110.6	37.2	0	0	0	111.7	A68 R69 I74 S75 L76 L325 M326 I327 G328 F329 A625	A68-N72 WeakPolarHBondContact O-CB 3.36Å; A68-N72 PolarHBondContact O-N 3.03Å; R69-N72 PolarHBondContact O-N 3.45Å; N72-I74 VanDerWaalsContact C-N 3.35Å; N72-I74 PolarHBondContact O-N 3Å; N72-S75 PolarHBondContact O-N 3.21Å; N72-L76 WeakPolarHBondContact O-CB 3.24Å; N72-L76 PolarHBondContact O-N 3.25Å; N72-L325 PolarHBondContact ND2-O 3.26Å; N72-M326 VanDerWaalsContact ND2-C 3.29Å; N72-I327 PolarHBondContact ND2-N 3.5Å; N72-G328 PolarHBondContact ND2-N 2.9Å; N72-F329 HydrophobicContact CB-CD1 4.07Å; N72-F329 HydrophobicContact CB-CE1 3.62Å; N72-F329 HydrophobicContact CB-CE2 4.49Å; N72-F329 HydrophobicContact CB-CZ 3.85Å; N72-A625 WeakPolarHBondContact OD1-CB 3.44Å
73	G	92.4	Very high	90.4	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-60	-42.4	176.3	0	0	0	0	0	112.7	R69 L70 L76 E77	R69-G73 PolarHBondContact O-N 2.97Å; L70-G73 PolarHBondContact O-N 3.14Å; G73-L76 PolarHBondContact O-N 3.23Å; G73-E77 WeakPolarHBondContact O-CB 3.47Å; G73-E77 PolarHBondContact O-N 2.96Å
74	I	93.1	Very high	90.7	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-60.1	-49	173.2	-62.8	166.5	0	0	0	110.2	L70 V71 N72 L76 E77 I78 L356 F360 L614 F618 F766	L70-I74 HydrophobicContact CG-CD1 4.35Å; L70-I74 WeakPolarHBondContact O-CG1 3.34Å; L70-I74 PolarHBondContact O-N 3.12Å; V71-I74 PolarHBondContact O-N 3.49Å; N72-I74 VanDerWaalsContact C-N 3.35Å; N72-I74 PolarHBondContact O-N 3Å; I74-L76 VanDerWaalsContact C-N 3.31Å; I74-L76 PolarHBondContact O-N 2.85Å; I74-E77 PolarHBondContact O-N 3.02Å; I74-I78 HydrophobicContact CG2-CD1 3.72Å; I74-I78 HydrophobicContact CG2-CG1 4.35Å; I74-I78 VanDerWaalsContact O-CG1 3.29Å; I74-I78 WeakPolarHBondContact O-CG1 3.3Å; I74-I78 PolarHBondContact O-N 3.14Å; I74-L356 HydrophobicContact CD1-CD2 4.46Å; I74-L356 HydrophobicContact CG1-CD2 4.47Å; I74-F360 HydrophobicContact CG1-CE1 4.24Å; I74-F360 HydrophobicContact CG1-CZ 3.67Å; I74-L614 HydrophobicContact CG1-CD2 4.45Å; I74-L614 HydrophobicContact CG2-CB 4.26Å; I74-L614 HydrophobicContact CG2-CD1 4.38Å; I74-L614 HydrophobicContact CG2-CD2 4.04Å; I74-L614 HydrophobicContact CG2-CG 4.46Å; I74-F618 HydrophobicContact CG2-CD1 3.71Å; I74-F618 HydrophobicContact CG2-CE1 4.35Å; I74-F766 HydrophobicContact CD1-CD1 4.4Å; I74-F766 HydrophobicContact CD1-CE1 3.48Å; I74-F766 VanDerWaalsContact CD1-CE1 3.48Å; I74-F766 HydrophobicContact CD1-CZ 3.64Å; I74-F766 HydrophobicContact CG1-CZ 4.49Å; I74-F766 HydrophobicContact CG2-CE2 4.49Å; I74-F766 HydrophobicContact CG2-CZ 4.34Å
75	S	94	Very high	90.8	Very high	6 Å²	6	14.7 Å²	14.7	4%	0.042	9%	0.092	C	C	.	.	H	α-helix	trans	-63.2	-39.2	-178.5	-171.2	0	0	0	0	112.3	V71 N72 G79 S621 Q622	V71-S75 PolarHBondContact O-N 3.34Å; N72-S75 PolarHBondContact O-N 3.21Å; S75-G79 PolarHBondContact O-N 3.01Å; S75-S621 PolarHBondContact OG-OG 3.21Å; S75-Q622 WeakPolarHBondContact OG-CA 3.24Å; S75-Q622 PolarHBondContact OG-N 3.16Å; S75-Q622 VanDerWaalsContact OG-N 3.14Å
76	L	92.5	Very high	90.9	Very high	5 Å²	5	16.5 Å²	16.5	3%	0.026	11%	0.106	C	C	.	.	H	α-helix	trans	-68.1	-41	178.6	-171.9	60.6	0	0	0	111.2	N72 G73 I74 G79 F80 I85 A90 F329 F363	N72-L76 WeakPolarHBondContact O-CB 3.24Å; N72-L76 PolarHBondContact O-N 3.25Å; G73-L76 PolarHBondContact O-N 3.23Å; I74-L76 VanDerWaalsContact C-N 3.31Å; I74-L76 PolarHBondContact O-N 2.85Å; L76-G79 PolarHBondContact O-N 3.47Å; L76-F80 HydrophobicContact CD1-CD2 4.19Å; L76-F80 HydrophobicContact CD1-CE1 4.19Å; L76-F80 HydrophobicContact CD1-CE2 3.63Å; L76-F80 HydrophobicContact CD1-CZ 3.62Å; L76-F80 HydrophobicContact CD2-CE2 4Å; L76-F80 HydrophobicContact CD2-CZ 4.47Å; L76-F80 HydrophobicContact CG-CD2 3.97Å; L76-F80 HydrophobicContact CG-CE2 3.5Å; L76-F80 HydrophobicContact CG-CZ 4.03Å; L76-F80 WeakPolarHBondContact O-CD2 3.32Å; L76-F80 WeakPolarHBondContact O-CG 3.3Å; L76-F80 PolarHBondContact O-N 2.85Å; L76-I85 HydrophobicContact CD1-CD1 4.16Å; L76-I85 HydrophobicContact CD1-CG2 4.43Å; L76-A90 HydrophobicContact CD1-CB 4.17Å; L76-F329 HydrophobicContact CD2-CE2 3.98Å; L76-F329 HydrophobicContact CD2-CZ 4.18Å; L76-F363 HydrophobicContact CB-CE1 4.46Å; L76-F363 HydrophobicContact CB-CZ 4.02Å; L76-F363 HydrophobicContact CD2-CE1 3.64Å; L76-F363 HydrophobicContact CD2-CZ 4.05Å; L76-F363 HydrophobicContact CG-CE1 4.02Å; L76-F363 HydrophobicContact CG-CZ 4.02Å
77	E	91.3	Very high	91	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-60.6	-48.9	173.9	-169.5	67.6	-163.4	0	0	111.1	G73 I74 G79 F80 I81 F363 M603 L614	G73-E77 WeakPolarHBondContact O-CB 3.47Å; G73-E77 PolarHBondContact O-N 2.96Å; I74-E77 PolarHBondContact O-N 3.02Å; E77-G79 VanDerWaalsContact C-N 3.34Å; E77-G79 PolarHBondContact O-N 3.17Å; E77-F80 PolarHBondContact O-N 3.2Å; E77-I81 HydrophobicContact CG-CD1 3.89Å; E77-I81 WeakPolarHBondContact O-CB 3.39Å; E77-I81 VanDerWaalsContact O-CG1 3.24Å; E77-I81 WeakPolarHBondContact O-CG1 3.5Å; E77-I81 PolarHBondContact O-N 2.97Å; E77-F363 HydrophobicContact CB-CE2 3.97Å; E77-F363 HydrophobicContact CB-CZ 4.25Å; E77-F363 WeakPolarHBondContact OE2-CE2 3.44Å; E77-M603 WeakPolarHBondContact OE2-CE 3.46Å; E77-L614 HydrophobicContact CB-CD1 4.15Å; E77-L614 HydrophobicContact CG-CD1 3.86Å
78	I	92.9	Very high	91	Very high	8 Å²	8	17.6 Å²	17.6	4%	0.041	11%	0.113	C	C	.	.	H	α-helix	trans	-57.3	-49.6	177.2	-70	170.2	0	0	0	110.2	I74 F80 I81 D82 L614 K615 F618	I74-I78 HydrophobicContact CG2-CD1 3.72Å; I74-I78 HydrophobicContact CG2-CG1 4.35Å; I74-I78 VanDerWaalsContact O-CG1 3.29Å; I74-I78 WeakPolarHBondContact O-CG1 3.3Å; I74-I78 PolarHBondContact O-N 3.14Å; I78-F80 PolarHBondContact O-N 3.22Å; I78-I81 PolarHBondContact O-N 2.61Å; I78-D82 VanDerWaalsContact O-CG 3.3Å; I78-D82 PolarHBondContact O-N 2.96Å; I78-L614 HydrophobicContact CD1-CB 4.02Å; I78-L614 HydrophobicContact CG1-CB 3.77Å; I78-K615 HydrophobicContact CG2-CB 4.4Å; I78-K615 HydrophobicContact CG2-CG 4.38Å; I78-F618 HydrophobicContact CD1-CB 3.91Å; I78-F618 HydrophobicContact CD1-CD1 4.41Å
79	G	92.1	Very high	90.9	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.01	13%	0.13	C	C	.	.	H	α-helix	trans	-69.5	-30.5	-174.9	0	0	0	0	0	114.2	S75 L76 E77 G83 S84 I85	S75-G79 PolarHBondContact O-N 3.01Å; L76-G79 PolarHBondContact O-N 3.47Å; E77-G79 VanDerWaalsContact C-N 3.34Å; E77-G79 PolarHBondContact O-N 3.17Å; G79-G83 CarbonylContact O-C 3.43Å; G79-G83 VanDerWaalsContact O-CA 3.26Å; G79-G83 WeakPolarHBondContact O-CA 3.36Å; G79-G83 PolarHBondContact O-N 3.03Å; G79-S84 VanDerWaalsContact CA-OG 3.3Å; G79-S84 WeakPolarHBondContact CA-OG 3.26Å; G79-S84 PolarHBondContact O-N 3.39Å; G79-I85 PolarHBondContact O-N 3.46Å; G79-I85 VanDerWaalsContact O-N 3.17Å
80	F	91.8	Very high	90.8	Very high	3 Å²	3	20.1 Å²	20.1	1%	0.013	13%	0.127	C	C	.	.	H	α-helix	trans	-69.3	-43.1	169.5	-73.5	-37.7	0	0	0	112.3	L76 E77 I78 I85 A90 F363 F366 A600 M603 K604	L76-F80 HydrophobicContact CD1-CD2 4.19Å; L76-F80 HydrophobicContact CD1-CE1 4.19Å; L76-F80 HydrophobicContact CD1-CE2 3.63Å; L76-F80 HydrophobicContact CD1-CZ 3.62Å; L76-F80 HydrophobicContact CD2-CE2 4Å; L76-F80 HydrophobicContact CD2-CZ 4.47Å; L76-F80 HydrophobicContact CG-CD2 3.97Å; L76-F80 HydrophobicContact CG-CE2 3.5Å; L76-F80 HydrophobicContact CG-CZ 4.03Å; L76-F80 WeakPolarHBondContact O-CD2 3.32Å; L76-F80 WeakPolarHBondContact O-CG 3.3Å; L76-F80 PolarHBondContact O-N 2.85Å; E77-F80 PolarHBondContact O-N 3.2Å; I78-F80 PolarHBondContact O-N 3.22Å; F80-I85 HydrophobicContact CE1-CG2 4.48Å; F80-A90 HydrophobicContact CE1-CB 3.61Å; F80-A90 HydrophobicContact CZ-CB 3.66Å; F80-F363 HydrophobicContact CE2-CE1 4.44Å; F80-F366 HydrophobicContact CE2-CE1 4.26Å; F80-F366 HydrophobicContact CE2-CZ 4.35Å; F80-F366 HydrophobicContact CZ-CE1 4.39Å; F80-F366 HydrophobicContact CZ-CZ 4.13Å; F80-A600 HydrophobicContact CE1-CB 4.41Å; F80-A600 HydrophobicContact CZ-CB 4.43Å; F80-M603 HydrophobicContact CB-CB 3.98Å; F80-M603 HydrophobicContact CD2-CB 4.17Å; F80-M603 HydrophobicContact CD2-CE 3.67Å; F80-M603 HydrophobicContact CD2-SD 3.76Å; F80-M603 HydrophobicContact CE2-CE 4.14Å; F80-M603 HydrophobicContact CE2-SD 3.9Å; F80-M603 HydrophobicContact CG-CB 4.29Å; F80-K604 VanDerWaalsContact O-CA 3.32Å; F80-K604 WeakPolarHBondContact O-CA 3.17Å; F80-K604 WeakPolarHBondContact O-CB 3.36Å
81	I	89.6	Confident	90.7	Very high	21 Å²	21	20.1 Å²	20.1	11%	0.108	13%	0.127	C	C	.	.	H	α-helix	trans	-63.2	-47.6	-179.2	-72.3	169.1	0	0	0	111.3	E77 I78 V606 A611 L612	E77-I81 HydrophobicContact CG-CD1 3.89Å; E77-I81 WeakPolarHBondContact O-CB 3.39Å; E77-I81 VanDerWaalsContact O-CG1 3.24Å; E77-I81 WeakPolarHBondContact O-CG1 3.5Å; E77-I81 PolarHBondContact O-N 2.97Å; I78-I81 PolarHBondContact O-N 2.61Å; I81-V606 HydrophobicContact CD1-CB 4.48Å; I81-V606 HydrophobicContact CG1-CB 4.38Å; I81-A611 HydrophobicContact CD1-CB 3.8Å; I81-L612 HydrophobicContact CG2-CD2 4.08Å
82	D	89.5	Confident	90.5	Very high	60 Å²	60	20.1 Å²	20.1	32%	0.321	13%	0.128	S	C	.	.	H	α-helix	trans	-91.1	-9.8	-176.9	72.9	11.8	0	0	0	114.7	I78 S84 K615	I78-D82 VanDerWaalsContact O-CG 3.3Å; I78-D82 PolarHBondContact O-N 2.96Å; D82-S84 VanDerWaalsContact C-N 3.32Å; D82-S84 WeakPolarHBondContact OD1-CB 3.29Å; D82-S84 PolarHBondContact OD1-N 2.94Å; D82-S84 PolarHBondContact OD1-OG 3.22Å; D82-K615 HydrophobicContact CB-CD 4.12Å; D82-K615 IonicContact OD2-NZ 3.41Å
83	G	87.7	Confident	90.2	Very high	37 Å²	37	20.7 Å²	20.7	38%	0.381	13%	0.13	S	C	.	.	S	Bend	trans	77.1	13.6	179.7	0	0	0	0	0	114.3	G79 I85	G79-G83 CarbonylContact O-C 3.43Å; G79-G83 VanDerWaalsContact O-CA 3.26Å; G79-G83 WeakPolarHBondContact O-CA 3.36Å; G79-G83 PolarHBondContact O-N 3.03Å; G83-I85 PolarHBondContact O-N 3.43Å
84	S	89.7	Confident	90	Very high	68 Å²	68	20.8 Å²	20.8	48%	0.476	13%	0.131	S	C	.	.	S	Bend	trans	-68.1	-22.2	171.6	58	0	0	0	0	112.8	G79 D82	G79-S84 VanDerWaalsContact CA-OG 3.3Å; G79-S84 WeakPolarHBondContact CA-OG 3.26Å; G79-S84 PolarHBondContact O-N 3.39Å; D82-S84 VanDerWaalsContact C-N 3.32Å; D82-S84 WeakPolarHBondContact OD1-CB 3.29Å; D82-S84 PolarHBondContact OD1-N 2.94Å; D82-S84 PolarHBondContact OD1-OG 3.22Å
85	I	90	Very high	89.6	Confident	5 Å²	5	20.9 Å²	20.9	3%	0.026	13%	0.131	C	C	.	.	S	Bend	trans	-108.8	110.4	170.8	-61.8	171.8	0	0	0	108.5	L76 G79 F80 G83 S87 A90 L325	L76-I85 HydrophobicContact CD1-CD1 4.16Å; L76-I85 HydrophobicContact CD1-CG2 4.43Å; G79-I85 PolarHBondContact O-N 3.46Å; G79-I85 VanDerWaalsContact O-N 3.17Å; F80-I85 HydrophobicContact CE1-CG2 4.48Å; G83-I85 PolarHBondContact O-N 3.43Å; I85-S87 PolarHBondContact O-N 3.12Å; I85-A90 HydrophobicContact CG2-CB 3.82Å; I85-L325 HydrophobicContact CD1-CD2 3.73Å; I85-L325 HydrophobicContact CG1-CD2 3.99Å; I85-L325 HydrophobicContact CG2-CD1 3.6Å; I85-L325 HydrophobicContact CG2-CD2 4.25Å
86	P	89.4	Confident	88.9	Confident	68 Å²	68	25.6 Å²	25.6	44%	0.442	15%	0.149	S	C	.	.			trans	-61	134.5	172.9	-23.8	36.2	0	0	0	111.1	D88 D89 A90	P86-D88 VanDerWaalsContact C-N 3.29Å; P86-D88 PolarHBondContact O-N 2.96Å; P86-D89 HydrophobicContact CB-CB 4.18Å; P86-D89 WeakPolarHBondContact CB-OD2 3.43Å; P86-D89 VanDerWaalsContact CG-OD2 3.27Å; P86-D89 WeakPolarHBondContact CG-OD2 3.34Å; P86-D89 PolarHBondContact O-N 3.09Å; P86-D89 VanDerWaalsContact O-N 3.14Å; P86-A90 PolarHBondContact O-N 2.79Å; P86-A90 VanDerWaalsContact O-N 3.08Å
87	S	89	Confident	88.4	Confident	22 Å²	22	25.4 Å²	25.4	15%	0.154	15%	0.148	C	C	.	.	H	α-helix	trans	-59.6	-38.7	-175.8	-57	0	0	0	0	113.3	I85 I91	I85-S87 PolarHBondContact O-N 3.12Å; S87-I91 WeakPolarHBondContact O-CB 3.12Å; S87-I91 WeakPolarHBondContact O-CD1 3.11Å; S87-I91 WeakPolarHBondContact O-CG1 3.34Å; S87-I91 PolarHBondContact O-N 3.16Å
88	D	89.5	Confident	87.8	Confident	43 Å²	43	28.7 Å²	28.7	23%	0.23	17%	0.165	C	C	.	.	H	α-helix	trans	-68.7	-36.7	178.7	-71.8	-8.8	0	0	0	111.5	P86 I91 A92 L102 R597	P86-D88 VanDerWaalsContact C-N 3.29Å; P86-D88 PolarHBondContact O-N 2.96Å; D88-I91 PolarHBondContact O-N 3.4Å; D88-A92 WeakPolarHBondContact O-CB 3.25Å; D88-A92 PolarHBondContact O-N 3.34Å; D88-L102 HydrophobicContact CB-CD1 4.11Å; D88-L102 WeakPolarHBondContact O-CD1 3.49Å; D88-R597 IonicContact OD1-CZ 3.82Å; D88-R597 VanDerWaalsContact OD1-CZ 3.24Å; D88-R597 IonicContact OD1-NE 3.74Å; D88-R597 PolarHBondContact OD1-NE 3.43Å; D88-R597 IonicContact OD1-NH2 2.66Å; D88-R597 PolarHBondContact OD1-NH2 3.45Å; D88-R597 IonicContact OD2-CZ 2.67Å; D88-R597 IonicContact OD2-NE 2.75Å; D88-R597 IonicContact OD2-NH2 2.66Å; D88-R597 PolarHBondContact OD2-NH2 3.01Å
89	D	87.9	Confident	87.3	Confident	71 Å²	71	30.3 Å²	30.3	38%	0.38	18%	0.176	S	C	.	.	H	α-helix	trans	-65.8	-44.9	177.3	-63.6	-8.7	0	0	0	110.7	P86 A92 E93 P99	P86-D89 HydrophobicContact CB-CB 4.18Å; P86-D89 WeakPolarHBondContact CB-OD2 3.43Å; P86-D89 VanDerWaalsContact CG-OD2 3.27Å; P86-D89 WeakPolarHBondContact CG-OD2 3.34Å; P86-D89 PolarHBondContact O-N 3.09Å; P86-D89 VanDerWaalsContact O-N 3.14Å; D89-A92 PolarHBondContact O-N 3.42Å; D89-E93 WeakPolarHBondContact O-CB 3.46Å; D89-E93 PolarHBondContact O-N 3.48Å; D89-P99 WeakPolarHBondContact OD1-CG 3.45Å
90	A	88.5	Confident	86.9	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-60	-48	174.2	0	0	0	0	0	111.8	L76 F80 I85 P86 A92 E93 L94 L325	L76-A90 HydrophobicContact CD1-CB 4.17Å; F80-A90 HydrophobicContact CE1-CB 3.61Å; F80-A90 HydrophobicContact CZ-CB 3.66Å; I85-A90 HydrophobicContact CG2-CB 3.82Å; P86-A90 PolarHBondContact O-N 2.79Å; P86-A90 VanDerWaalsContact O-N 3.08Å; A90-A92 VanDerWaalsContact C-N 3.35Å; A90-A92 PolarHBondContact O-N 3.44Å; A90-E93 PolarHBondContact O-N 3.2Å; A90-L94 WeakPolarHBondContact O-CB 3.28Å; A90-L94 VanDerWaalsContact O-CD1 3.29Å; A90-L94 WeakPolarHBondContact O-CD1 3.29Å; A90-L94 WeakPolarHBondContact O-CG 3.42Å; A90-L94 PolarHBondContact O-N 3.17Å; A90-L325 HydrophobicContact CB-CD1 4.08Å
91	I	90.2	Very high	86.6	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-63.4	-42.2	179.6	-71.8	167.2	0	0	0	111.2	S87 D88 L94 L95 L102 F366 L593 L596 R597 A600	S87-I91 WeakPolarHBondContact O-CB 3.12Å; S87-I91 WeakPolarHBondContact O-CD1 3.11Å; S87-I91 WeakPolarHBondContact O-CG1 3.34Å; S87-I91 PolarHBondContact O-N 3.16Å; D88-I91 PolarHBondContact O-N 3.4Å; I91-L94 PolarHBondContact O-N 2.99Å; I91-L95 HydrophobicContact CG2-CD1 3.71Å; I91-L95 HydrophobicContact CG2-CG 4.36Å; I91-L95 WeakPolarHBondContact O-CB 3.4Å; I91-L95 VanDerWaalsContact O-CG 3.24Å; I91-L95 WeakPolarHBondContact O-CG 3.4Å; I91-L95 PolarHBondContact O-N 2.92Å; I91-L102 HydrophobicContact CB-CD1 4.11Å; I91-L102 HydrophobicContact CG2-CD1 3.8Å; I91-L102 HydrophobicContact CG2-CD2 4.2Å; I91-F366 HydrophobicContact CG1-CE2 4.46Å; I91-F366 HydrophobicContact CG1-CZ 4.35Å; I91-L593 HydrophobicContact CG2-CD1 3.82Å; I91-L596 HydrophobicContact CB-CD2 4.47Å; I91-L596 HydrophobicContact CD1-CD2 4.49Å; I91-L596 HydrophobicContact CD1-CG 4.02Å; I91-L596 HydrophobicContact CG1-CD2 4.15Å; I91-L596 HydrophobicContact CG1-CG 4.03Å; I91-L596 HydrophobicContact CG2-CD2 3.63Å; I91-L596 HydrophobicContact CG2-CG 4.32Å; I91-R597 HydrophobicContact CD1-CB 4.23Å; I91-R597 HydrophobicContact CD1-CG 3.65Å; I91-A600 HydrophobicContact CD1-CB 3.96Å
92	A	87.7	Confident	86.5	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.008	20%	0.202	C	C	.	.	H	α-helix	trans	-63.2	-46.8	-179.4	0	0	0	0	0	111	D88 D89 A90 L95 Y96 T97 P99 L102	D88-A92 WeakPolarHBondContact O-CB 3.25Å; D88-A92 PolarHBondContact O-N 3.34Å; D89-A92 PolarHBondContact O-N 3.42Å; A90-A92 VanDerWaalsContact C-N 3.35Å; A90-A92 PolarHBondContact O-N 3.44Å; A92-L95 CarbonylContact O-C 3.6Å; A92-L95 PolarHBondContact O-N 3.47Å; A92-Y96 PolarHBondContact O-N 3.32Å; A92-Y96 VanDerWaalsContact O-N 3.08Å; A92-T97 CarbonylContact C-O 3.58Å; A92-T97 VanDerWaalsContact C-O 3.29Å; A92-T97 HydrophobicContact CB-CG2 4.22Å; A92-T97 WeakPolarHBondContact CB-O 3.4Å; A92-T97 PolarHBondContact O-N 3.33Å; A92-T97 VanDerWaalsContact O-O 3.07Å; A92-P99 HydrophobicContact CB-CB 4.05Å; A92-P99 HydrophobicContact CB-CG 3.67Å; A92-L102 HydrophobicContact CB-CD1 4Å; A92-L102 HydrophobicContact CB-CG 4.24Å
93	E	86	Confident	86.4	Confident	16 Å²	16	36.3 Å²	36.3	8%	0.075	21%	0.208	C	C	.	.	H	α-helix	trans	-61.4	-47	175.2	-161.2	-176.3	134.9	0	0	111	D89 A90 L95 Y96 V323 Q324 L325 M326	D89-E93 WeakPolarHBondContact O-CB 3.46Å; D89-E93 PolarHBondContact O-N 3.48Å; A90-E93 PolarHBondContact O-N 3.2Å; E93-L95 PolarHBondContact O-N 3.14Å; E93-L95 VanDerWaalsContact O-N 3.14Å; E93-Y96 PolarHBondContact O-N 2.92Å; E93-V323 VanDerWaalsContact OE1-C 3.26Å; E93-V323 VanDerWaalsContact OE1-CA 3.29Å; E93-V323 WeakPolarHBondContact OE1-CA 3.4Å; E93-V323 VanDerWaalsContact OE1-CG1 3.25Å; E93-V323 WeakPolarHBondContact OE1-CG1 3.07Å; E93-Q324 VanDerWaalsContact CD-N 3.29Å; E93-Q324 PolarHBondContact OE1-N 2.82Å; E93-Q324 PolarHBondContact OE2-N 3.38Å; E93-L325 VanDerWaalsContact CD-N 3.25Å; E93-L325 WeakPolarHBondContact OE1-CA 3.28Å; E93-L325 PolarHBondContact OE1-N 3.04Å; E93-L325 WeakPolarHBondContact OE2-CB 3.35Å; E93-L325 WeakPolarHBondContact OE2-CG 3.48Å; E93-L325 PolarHBondContact OE2-N 3.14Å; E93-M326 HydrophobicContact CG-CG 4.09Å; E93-M326 HydrophobicContact CG-SD 4.22Å; E93-M326 PolarHBondContact OE1-N 3.47Å
94	L	87	Confident	86.4	Confident	2 Å²	2	37.7 Å²	37.7	1%	0.01	20%	0.204	C	C	.	.	H	α-helix	trans	-53.2	-31.9	174.7	-74.2	168.9	0	0	0	114.5	A90 I91 M326 F329 I336 F366 I370	A90-L94 WeakPolarHBondContact O-CB 3.28Å; A90-L94 VanDerWaalsContact O-CD1 3.29Å; A90-L94 WeakPolarHBondContact O-CD1 3.29Å; A90-L94 WeakPolarHBondContact O-CG 3.42Å; A90-L94 PolarHBondContact O-N 3.17Å; I91-L94 PolarHBondContact O-N 2.99Å; L94-M326 WeakPolarHBondContact CA-SD 3.39Å; L94-M326 HydrophobicContact CB-SD 4.32Å; L94-M326 HydrophobicContact CD2-CE 3.7Å; L94-M326 HydrophobicContact CD2-CG 3.65Å; L94-M326 HydrophobicContact CD2-SD 3.8Å; L94-M326 HydrophobicContact CG-CG 4.11Å; L94-M326 HydrophobicContact CG-SD 4.21Å; L94-M326 PolarHBondContact N-SD 2.96Å; L94-M326 VanDerWaalsContact N-SD 3.45Å; L94-F329 HydrophobicContact CD2-CD2 4.34Å; L94-I336 HydrophobicContact CD1-CD1 4.33Å; L94-I336 HydrophobicContact CD2-CD1 3.33Å; L94-I336 HydrophobicContact CG-CD1 4.47Å; L94-F366 HydrophobicContact CD1-CE1 3.54Å; L94-F366 HydrophobicContact CD1-CZ 3.68Å; L94-I370 HydrophobicContact CB-CD1 4.37Å; L94-I370 HydrophobicContact CD1-CD1 3.87Å; L94-I370 HydrophobicContact CD2-CD1 4.27Å; L94-I370 HydrophobicContact CG-CD1 4.42Å
95	L	84.9	Confident	86.3	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.005	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	7.9	-179.6	-63.2	178.8	0	0	0	112.9	I91 A92 E93 T97 L102 K315 I370 F373 E374 L593 L596	I91-L95 HydrophobicContact CG2-CD1 3.71Å; I91-L95 HydrophobicContact CG2-CG 4.36Å; I91-L95 WeakPolarHBondContact O-CB 3.4Å; I91-L95 VanDerWaalsContact O-CG 3.24Å; I91-L95 WeakPolarHBondContact O-CG 3.4Å; I91-L95 PolarHBondContact O-N 2.92Å; A92-L95 CarbonylContact O-C 3.6Å; A92-L95 PolarHBondContact O-N 3.47Å; E93-L95 PolarHBondContact O-N 3.14Å; E93-L95 VanDerWaalsContact O-N 3.14Å; L95-T97 VanDerWaalsContact C-N 3.34Å; L95-T97 HydrophobicContact CB-CG2 4.1Å; L95-T97 PolarHBondContact O-N 3.48Å; L95-L102 HydrophobicContact CD1-CD2 4.41Å; L95-K315 PolarHBondContact O-NZ 2.93Å; L95-I370 HydrophobicContact CD2-CG2 3.95Å; L95-F373 HydrophobicContact CB-CE1 4.36Å; L95-F373 HydrophobicContact CD1-CD1 3.71Å; L95-F373 HydrophobicContact CD1-CD2 4.45Å; L95-F373 HydrophobicContact CD1-CE1 3.56Å; L95-F373 HydrophobicContact CD1-CE2 4.31Å; L95-F373 HydrophobicContact CD1-CG 4.16Å; L95-F373 HydrophobicContact CD1-CZ 3.86Å; L95-F373 HydrophobicContact CD2-CD1 3.34Å; L95-F373 HydrophobicContact CD2-CE1 3.74Å; L95-F373 HydrophobicContact CD2-CG 4.16Å; L95-F373 HydrophobicContact CG-CD1 4.09Å; L95-F373 HydrophobicContact CG-CE1 4.08Å; L95-E374 HydrophobicContact CD2-CG 4.2Å; L95-L593 HydrophobicContact CD1-CD1 4.05Å; L95-L596 HydrophobicContact CD1-CD2 4.01Å
96	Y	80.7	Confident	86.1	Confident	106 Å²	106	36.5 Å²	36.5	42%	0.416	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.5	53.8	-174.1	-69.4	-88.4	0	0	0	112	A92 E93 V323 M326	A92-Y96 PolarHBondContact O-N 3.32Å; A92-Y96 VanDerWaalsContact O-N 3.08Å; E93-Y96 PolarHBondContact O-N 2.92Å; Y96-V323 HydrophobicContact CE1-CG2 4.34Å; Y96-M326 HydrophobicContact CE2-CE 4.22Å; Y96-M326 HydrophobicContact CE2-SD 4.49Å
97	T	80.4	Confident	86	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.006	20%	0.199	C	C	.	.	S	Bend	trans	-143	167.3	-179.9	-162.6	0	0	0	0	111.1	A92 L95 L102 M105 L321	A92-T97 CarbonylContact C-O 3.58Å; A92-T97 VanDerWaalsContact C-O 3.29Å; A92-T97 HydrophobicContact CB-CG2 4.22Å; A92-T97 WeakPolarHBondContact CB-O 3.4Å; A92-T97 PolarHBondContact O-N 3.33Å; A92-T97 VanDerWaalsContact O-O 3.07Å; L95-T97 VanDerWaalsContact C-N 3.34Å; L95-T97 HydrophobicContact CB-CG2 4.1Å; L95-T97 PolarHBondContact O-N 3.48Å; T97-L102 HydrophobicContact CG2-CD2 3.59Å; T97-L102 HydrophobicContact CG2-CG 4.47Å; T97-M105 HydrophobicContact CG2-CE 4.38Å; T97-L321 WeakPolarHBondContact O-CD2 3.21Å
98	D	79.7	Confident	86	Confident	68 Å²	68	36.5 Å²	36.5	36%	0.364	19%	0.194	S	C	.	.			trans	-82.5	140.2	176.6	-179.2	-74.7	0	0	0	110.6	S100 K101	D98-S100 PolarHBondContact O-N 3.32Å; D98-S100 VanDerWaalsContact O-N 3.15Å; D98-S100 WeakPolarHBondContact OD1-CB 3.48Å; D98-S100 PolarHBondContact OD1-N 2.69Å; D98-S100 PolarHBondContact OD1-OG 2.91Å; D98-K101 HydrophobicContact CB-CG 4.03Å; D98-K101 WeakPolarHBondContact O-CB 3.21Å; D98-K101 PolarHBondContact O-N 2.99Å
99	P	83	Confident	86	Confident	42 Å²	42	38 Å²	38	27%	0.273	20%	0.202	S	C	.	.	H	α-helix	trans	-54.6	-34.1	-179.6	-25.5	32.6	0	0	0	114.4	D89 A92 K101 L102	D89-P99 WeakPolarHBondContact OD1-CG 3.45Å; A92-P99 HydrophobicContact CB-CB 4.05Å; A92-P99 HydrophobicContact CB-CG 3.67Å; P99-K101 PolarHBondContact O-N 3Å; P99-L102 WeakPolarHBondContact O-CB 3.22Å; P99-L102 PolarHBondContact O-N 3.43Å
100	S	82.3	Confident	86	Confident	66 Å²	66	36.1 Å²	36.1	46%	0.462	19%	0.194	S	C	.	.	H	α-helix	trans	-64.2	-31.2	176.5	68	0	0	0	0	112.4	D98 L102 Q103	D98-S100 PolarHBondContact O-N 3.32Å; D98-S100 VanDerWaalsContact O-N 3.15Å; D98-S100 WeakPolarHBondContact OD1-CB 3.48Å; D98-S100 PolarHBondContact OD1-N 2.69Å; D98-S100 PolarHBondContact OD1-OG 2.91Å; S100-L102 VanDerWaalsContact C-N 3.3Å; S100-L102 PolarHBondContact O-N 3.17Å; S100-Q103 PolarHBondContact O-N 3.32Å
101	K	85.5	Confident	86.1	Confident	51 Å²	51	39.7 Å²	39.7	22%	0.222	22%	0.219	C	C	.	.	H	α-helix	trans	-72.5	-22.2	179.9	-60.1	-56	-176.5	-170.6	0	113.1	D98 P99 Q103 E104 M105 L311	D98-K101 HydrophobicContact CB-CG 4.03Å; D98-K101 WeakPolarHBondContact O-CB 3.21Å; D98-K101 PolarHBondContact O-N 2.99Å; P99-K101 PolarHBondContact O-N 3Å; K101-Q103 VanDerWaalsContact C-N 3.27Å; K101-Q103 PolarHBondContact O-N 3Å; K101-E104 VanDerWaalsContact CD-CD 3.48Å; K101-E104 HydrophobicContact CD-CG 4.46Å; K101-E104 WeakPolarHBondContact CD-OE2 3.39Å; K101-E104 IonicContact NZ-OE1 3.7Å; K101-E104 PolarHBondContact NZ-OE1 2.91Å; K101-E104 IonicContact NZ-OE2 3.52Å; K101-E104 PolarHBondContact NZ-OE2 3Å; K101-E104 PolarHBondContact O-N 3.33Å; K101-M105 HydrophobicContact CB-CE 4.4Å; K101-M105 VanDerWaalsContact O-CG 3.26Å; K101-M105 WeakPolarHBondContact O-CG 3.46Å; K101-M105 PolarHBondContact O-N 3.37Å; K101-L311 HydrophobicContact CD-CD2 4.48Å
102	L	88.3	Confident	86.1	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-59.8	-40.3	174.7	-59.8	-174.2	0	0	0	111.7	D88 I91 A92 L95 T97 P99 S100 M106 L593	D88-L102 HydrophobicContact CB-CD1 4.11Å; D88-L102 WeakPolarHBondContact O-CD1 3.49Å; I91-L102 HydrophobicContact CB-CD1 4.11Å; I91-L102 HydrophobicContact CG2-CD1 3.8Å; I91-L102 HydrophobicContact CG2-CD2 4.2Å; A92-L102 HydrophobicContact CB-CD1 4Å; A92-L102 HydrophobicContact CB-CG 4.24Å; L95-L102 HydrophobicContact CD1-CD2 4.41Å; T97-L102 HydrophobicContact CG2-CD2 3.59Å; T97-L102 HydrophobicContact CG2-CG 4.47Å; P99-L102 WeakPolarHBondContact O-CB 3.22Å; P99-L102 PolarHBondContact O-N 3.43Å; S100-L102 VanDerWaalsContact C-N 3.3Å; S100-L102 PolarHBondContact O-N 3.17Å; L102-M106 WeakPolarHBondContact O-CG 3.42Å; L102-M106 PolarHBondContact O-N 3.47Å; L102-L593 HydrophobicContact CB-CD2 4.31Å; L102-L593 HydrophobicContact CD2-CD1 4.1Å; L102-L593 HydrophobicContact CD2-CD2 4.25Å; L102-L593 WeakPolarHBondContact O-CD2 3.44Å
103	Q	87	Confident	86.1	Confident	95 Å²	95	40.1 Å²	40.1	44%	0.444	22%	0.221	S	C	.	.	H	α-helix	trans	-72.2	-39.7	177.4	-64.6	-69.2	-0.5	0	0	111.6	S100 K101 M105 M106 S107	S100-Q103 PolarHBondContact O-N 3.32Å; K101-Q103 VanDerWaalsContact C-N 3.27Å; K101-Q103 PolarHBondContact O-N 3Å; Q103-M105 VanDerWaalsContact C-N 3.33Å; Q103-M105 PolarHBondContact O-N 2.99Å; Q103-M106 PolarHBondContact O-N 3.33Å; Q103-S107 WeakPolarHBondContact O-CB 3.38Å; Q103-S107 PolarHBondContact O-N 3.19Å; Q103-S107 PolarHBondContact O-OG 3.25Å
104	E	86.9	Confident	86.2	Confident	65 Å²	65	41.7 Å²	41.7	30%	0.304	23%	0.23	S	C	.	.	H	α-helix	trans	-58.7	-45.2	174.5	-69.1	179.6	-152.1	0	0	111	K101 M106 S107 V108 L311	K101-E104 VanDerWaalsContact CD-CD 3.48Å; K101-E104 HydrophobicContact CD-CG 4.46Å; K101-E104 WeakPolarHBondContact CD-OE2 3.39Å; K101-E104 IonicContact NZ-OE1 3.7Å; K101-E104 PolarHBondContact NZ-OE1 2.91Å; K101-E104 IonicContact NZ-OE2 3.52Å; K101-E104 PolarHBondContact NZ-OE2 3Å; K101-E104 PolarHBondContact O-N 3.33Å; E104-M106 VanDerWaalsContact C-N 3.34Å; E104-M106 PolarHBondContact O-N 3.03Å; E104-S107 WeakPolarHBondContact CA-OG 3.32Å; E104-S107 PolarHBondContact O-N 3.38Å; E104-S107 PolarHBondContact O-OG 2.68Å; E104-V108 PolarHBondContact O-N 3.05Å; E104-L311 HydrophobicContact CB-CD2 3.78Å
105	M	88.5	Confident	86.5	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-57.7	-44.4	175.2	-69.2	174.8	-171	0	0	112	T97 K101 Q103 S107 L311 F373 W377 Q590 L593	T97-M105 HydrophobicContact CG2-CE 4.38Å; K101-M105 HydrophobicContact CB-CE 4.4Å; K101-M105 VanDerWaalsContact O-CG 3.26Å; K101-M105 WeakPolarHBondContact O-CG 3.46Å; K101-M105 PolarHBondContact O-N 3.37Å; Q103-M105 VanDerWaalsContact C-N 3.33Å; Q103-M105 PolarHBondContact O-N 2.99Å; M105-S107 VanDerWaalsContact C-N 3.27Å; M105-S107 PolarHBondContact O-N 3.21Å; M105-L311 HydrophobicContact CE-CD2 4.45Å; M105-L311 HydrophobicContact CG-CD1 4.07Å; M105-L311 HydrophobicContact CG-CD2 3.69Å; M105-L311 HydrophobicContact CG-CG 4.41Å; M105-F373 HydrophobicContact SD-CZ 4.02Å; M105-W377 HydrophobicContact CE-CH2 3.76Å; M105-W377 HydrophobicContact CE-CZ2 3.83Å; M105-W377 HydrophobicContact CG-CH2 4.36Å; M105-W377 HydrophobicContact CG-CZ2 4Å; M105-W377 HydrophobicContact SD-CH2 4.2Å; M105-W377 HydrophobicContact SD-CZ2 3.67Å; M105-Q590 WeakPolarHBondContact O-CG 3.35Å; M105-Q590 PolarHBondContact O-NE2 3.38Å; M105-L593 HydrophobicContact CB-CD2 4.06Å; M105-L593 HydrophobicContact SD-CD2 4.4Å
106	M	86.3	Confident	86.7	Confident	47 Å²	47	47.5 Å²	47.5	23%	0.232	25%	0.252	C	S	.	.	H	α-helix	trans	-69.7	-23.5	176.9	-68.7	-177	64	0	0	113.3	L102 Q103 E104 Q590 L593 Q594 R597	L102-M106 WeakPolarHBondContact O-CG 3.42Å; L102-M106 PolarHBondContact O-N 3.47Å; Q103-M106 PolarHBondContact O-N 3.33Å; E104-M106 VanDerWaalsContact C-N 3.34Å; E104-M106 PolarHBondContact O-N 3.03Å; M106-Q590 PolarHBondContact O-NE2 2.94Å; M106-L593 HydrophobicContact CG-CD2 3.8Å; M106-L593 HydrophobicContact CG-CG 4.25Å; M106-L593 HydrophobicContact SD-CD2 4.4Å; M106-L593 HydrophobicContact SD-CG 4.38Å; M106-Q594 HydrophobicContact CE-CB 4.09Å; M106-Q594 HydrophobicContact CE-CG 4.2Å; M106-R597 PolarHBondContact SD-NH1 2.92Å
107	S	87.6	Confident	87.1	Confident	84 Å²	84	42.5 Å²	42.5	59%	0.587	23%	0.232	S	C	*	.	H	α-helix	trans	-86.5	-9.9	-177.2	74.8	0	0	0	0	114.6	Q103 E104 M105 N109	Q103-S107 WeakPolarHBondContact O-CB 3.38Å; Q103-S107 PolarHBondContact O-N 3.19Å; Q103-S107 PolarHBondContact O-OG 3.25Å; E104-S107 WeakPolarHBondContact CA-OG 3.32Å; E104-S107 PolarHBondContact O-N 3.38Å; E104-S107 PolarHBondContact O-OG 2.68Å; M105-S107 VanDerWaalsContact C-N 3.27Å; M105-S107 PolarHBondContact O-N 3.21Å; S107-N109 PolarHBondContact O-N 3.23Å; S107-N109 VanDerWaalsContact O-N 3.16Å
108	V	87.1	Confident	87.6	Confident	7 Å²	7	46.4 Å²	46.4	4%	0.042	25%	0.253	C	S	.	.	S	Bend	trans	-54	123.8	176.4	175.3	0	0	0	0	109.3	E104 S110 I308 L311 I586 Q590	E104-V108 PolarHBondContact O-N 3.05Å; V108-S110 PolarHBondContact O-N 2.71Å; V108-I308 HydrophobicContact CG1-CD1 4.19Å; V108-I308 HydrophobicContact CG1-CG1 3.98Å; V108-L311 HydrophobicContact CG2-CD1 3.52Å; V108-I586 HydrophobicContact CB-CG2 4.26Å; V108-I586 HydrophobicContact CG1-CG2 4.07Å; V108-I586 HydrophobicContact CG2-CG2 4.03Å; V108-Q590 PolarHBondContact O-NE2 2.66Å
109	N	89.7	Confident	88.2	Confident	75 Å²	75	43.9 Å²	43.9	40%	0.401	24%	0.243	S	C	.	.			trans	-75.7	90.1	179.1	-173.1	-21	0	0	0	109.7	S107 S111 V112 A113 N304	S107-N109 PolarHBondContact O-N 3.23Å; S107-N109 VanDerWaalsContact O-N 3.16Å; N109-S111 PolarHBondContact O-N 2.86Å; N109-S111 PolarHBondContact OD1-N 3.5Å; N109-S111 PolarHBondContact OD1-OG 3.29Å; N109-V112 HydrophobicContact CB-CB 4.15Å; N109-V112 HydrophobicContact CB-CG2 4.18Å; N109-V112 VanDerWaalsContact CG-CG2 3.45Å; N109-V112 VanDerWaalsContact ND2-CG2 3.29Å; N109-V112 WeakPolarHBondContact ND2-CG2 3.35Å; N109-V112 WeakPolarHBondContact O-CB 3.35Å; N109-V112 PolarHBondContact O-N 3.08Å; N109-V112 VanDerWaalsContact O-N 3.08Å; N109-V112 PolarHBondContact OD1-N 3.3Å; N109-A113 PolarHBondContact O-N 3.22Å; N109-N304 PolarHBondContact N-ND2 2.97Å; N109-N304 PolarHBondContact O-ND2 3.07Å
110	S	88.4	Confident	88.5	Confident	31 Å²	31	42 Å²	42	22%	0.217	23%	0.231	C	C	.	.	H	α-helix	trans	-67.9	-22.4	-176.7	24.5	0	0	0	0	113.3	V108 N114 T587 Q590	V108-S110 PolarHBondContact O-N 2.71Å; S110-N114 VanDerWaalsContact O-CB 3.31Å; S110-N114 WeakPolarHBondContact O-CB 3.45Å; S110-N114 VanDerWaalsContact O-CG 3.25Å; S110-N114 PolarHBondContact O-N 3.33Å; S110-N114 PolarHBondContact O-ND2 3.4Å; S110-N114 VanDerWaalsContact O-ND2 3.1Å; S110-T587 WeakPolarHBondContact CB-OG1 3.43Å; S110-Q590 PolarHBondContact OG-OE1 3.33Å
111	S	90.7	Very high	88.9	Confident	75 Å²	75	43.1 Å²	43.1	52%	0.524	23%	0.232	S	C	.	.	H	α-helix	trans	-65	-42.1	170	76.9	0	0	0	0	111.4	N109 R115	N109-S111 PolarHBondContact O-N 2.86Å; N109-S111 PolarHBondContact OD1-N 3.5Å; N109-S111 PolarHBondContact OD1-OG 3.29Å; S111-R115 VanDerWaalsContact O-CG 3.22Å; S111-R115 WeakPolarHBondContact O-CG 3.45Å; S111-R115 PolarHBondContact O-N 3.45Å; S111-R115 VanDerWaalsContact O-N 3.16Å
112	V	91.4	Very high	89.2	Confident	10 Å²	10	44.2 Å²	44.2	6%	0.061	24%	0.243	C	C	.	.	H	α-helix	trans	-69.3	-47.5	175.8	174.3	0	0	0	0	109.9	N109 N114 R115 I116 F301 N304	N109-V112 HydrophobicContact CB-CB 4.15Å; N109-V112 HydrophobicContact CB-CG2 4.18Å; N109-V112 VanDerWaalsContact CG-CG2 3.45Å; N109-V112 VanDerWaalsContact ND2-CG2 3.29Å; N109-V112 WeakPolarHBondContact ND2-CG2 3.35Å; N109-V112 WeakPolarHBondContact O-CB 3.35Å; N109-V112 PolarHBondContact O-N 3.08Å; N109-V112 VanDerWaalsContact O-N 3.08Å; N109-V112 PolarHBondContact OD1-N 3.3Å; V112-N114 VanDerWaalsContact C-N 3.31Å; V112-N114 PolarHBondContact O-N 2.96Å; V112-R115 WeakPolarHBondContact O-CB 3.47Å; V112-R115 PolarHBondContact O-N 3.2Å; V112-I116 HydrophobicContact CG1-CD1 4.41Å; V112-I116 WeakPolarHBondContact O-CG1 3.49Å; V112-I116 PolarHBondContact O-N 3.14Å; V112-F301 HydrophobicContact CG1-CD1 3.68Å; V112-F301 HydrophobicContact CG1-CE1 4.08Å; V112-N304 HydrophobicContact CG1-CB 3.89Å
113	A	87.4	Confident	89.3	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-56.3	-44	179.9	0	0	0	0	0	112.4	N109 I116 T117 N304 I308 V583	N109-A113 PolarHBondContact O-N 3.22Å; A113-I116 WeakPolarHBondContact O-CB 3.12Å; A113-I116 PolarHBondContact O-N 2.97Å; A113-T117 PolarHBondContact O-N 3.41Å; A113-N304 WeakPolarHBondContact CB-OD1 3.38Å; A113-I308 HydrophobicContact CB-CD1 4.22Å; A113-V583 HydrophobicContact CB-CG1 3.61Å; A113-V583 HydrophobicContact CB-CG2 4.45Å
114	N	88.2	Confident	89.5	Confident	49 Å²	49	42.3 Å²	42.3	26%	0.262	23%	0.232	S	C	.	.	H	α-helix	trans	-66.8	-36.6	176	-74.2	-31.2	0	0	0	112.7	S110 V112 I116 T117 N118	S110-N114 VanDerWaalsContact O-CB 3.31Å; S110-N114 WeakPolarHBondContact O-CB 3.45Å; S110-N114 VanDerWaalsContact O-CG 3.25Å; S110-N114 PolarHBondContact O-N 3.33Å; S110-N114 PolarHBondContact O-ND2 3.4Å; S110-N114 VanDerWaalsContact O-ND2 3.1Å; V112-N114 VanDerWaalsContact C-N 3.31Å; V112-N114 PolarHBondContact O-N 2.96Å; N114-I116 VanDerWaalsContact C-N 3.3Å; N114-I116 PolarHBondContact O-N 3.31Å; N114-T117 PolarHBondContact O-OG1 2.88Å; N114-N118 WeakPolarHBondContact O-CB 3.27Å; N114-N118 PolarHBondContact O-N 2.9Å; N114-N118 PolarHBondContact O-ND2 3.47Å
115	R	91.7	Very high	89.7	Confident	124 Å²	124	41.9 Å²	41.9	47%	0.468	24%	0.237	S	C	.	.	H	α-helix	trans	-63.8	-35	175.4	-74.5	174.9	75.7	-150.2	-1.2	112.2	S111 V112 G119 D297 F301	S111-R115 VanDerWaalsContact O-CG 3.22Å; S111-R115 WeakPolarHBondContact O-CG 3.45Å; S111-R115 PolarHBondContact O-N 3.45Å; S111-R115 VanDerWaalsContact O-N 3.16Å; V112-R115 WeakPolarHBondContact O-CB 3.47Å; V112-R115 PolarHBondContact O-N 3.2Å; R115-G119 WeakPolarHBondContact O-CA 3.32Å; R115-G119 PolarHBondContact O-N 3.27Å; R115-D297 IonicContact CZ-OD2 3.32Å; R115-D297 IonicContact NH1-OD2 3.1Å; R115-D297 PolarHBondContact NH1-OD2 3.11Å; R115-D297 IonicContact NH2-OD2 3.73Å; R115-D297 PolarHBondContact NH2-OD2 3.46Å; R115-F301 HydrophobicContact CB-CE1 4.11Å; R115-F301 HydrophobicContact CB-CZ 4.24Å
116	I	89.9	Confident	89.8	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-58.8	-58.8	176.4	-61.8	169	0	0	0	109.8	V112 A113 N114 N118 G119 F120 F301 N304 L305 L396	V112-I116 HydrophobicContact CG1-CD1 4.41Å; V112-I116 WeakPolarHBondContact O-CG1 3.49Å; V112-I116 PolarHBondContact O-N 3.14Å; A113-I116 WeakPolarHBondContact O-CB 3.12Å; A113-I116 PolarHBondContact O-N 2.97Å; N114-I116 VanDerWaalsContact C-N 3.3Å; N114-I116 PolarHBondContact O-N 3.31Å; I116-N118 PolarHBondContact O-N 3.1Å; I116-G119 PolarHBondContact O-N 3.21Å; I116-F120 HydrophobicContact CG2-CD2 3.84Å; I116-F120 HydrophobicContact CG2-CE2 4.03Å; I116-F120 WeakPolarHBondContact O-CB 3.08Å; I116-F120 VanDerWaalsContact O-CD2 3.31Å; I116-F120 WeakPolarHBondContact O-CD2 3.33Å; I116-F120 PolarHBondContact O-N 3.37Å; I116-F301 HydrophobicContact CD1-CB 3.77Å; I116-F301 HydrophobicContact CD1-CD1 4.06Å; I116-F301 HydrophobicContact CD1-CG 4.14Å; I116-F301 WeakPolarHBondContact CD1-O 3.41Å; I116-F301 HydrophobicContact CG1-CB 3.62Å; I116-F301 HydrophobicContact CG1-CD1 3.4Å; I116-F301 VanDerWaalsContact CG1-CD1 3.4Å; I116-F301 HydrophobicContact CG1-CD2 4.19Å; I116-F301 HydrophobicContact CG1-CE1 4.05Å; I116-F301 HydrophobicContact CG1-CG 3.48Å; I116-F301 VanDerWaalsContact CG1-CG 3.48Å; I116-N304 HydrophobicContact CD1-CB 4.3Å; I116-L305 HydrophobicContact CD1-CD2 3.59Å; I116-L305 HydrophobicContact CD1-CG 3.82Å; I116-L305 HydrophobicContact CG2-CD1 4.3Å; I116-L305 HydrophobicContact CG2-CD2 4.36Å; I116-L396 HydrophobicContact CG2-CD1 4.28Å
117	T	89.2	Confident	90.1	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.006	24%	0.24	C	C	.	.	H	α-helix	trans	-66.9	-42.4	-173.3	53.8	0	0	0	0	111.9	A113 N114 D121 T579 K580 V583	A113-T117 PolarHBondContact O-N 3.41Å; N114-T117 PolarHBondContact O-OG1 2.88Å; T117-D121 VanDerWaalsContact O-CB 3.3Å; T117-D121 WeakPolarHBondContact O-CB 3.41Å; T117-D121 PolarHBondContact O-N 3.11Å; T117-T579 HydrophobicContact CG2-CG2 4.22Å; T117-K580 HydrophobicContact CG2-CB 4.12Å; T117-V583 HydrophobicContact CG2-CB 3.98Å; T117-V583 HydrophobicContact CG2-CG1 4.28Å; T117-V583 HydrophobicContact CG2-CG2 3.78Å
118	N	91.3	Very high	90.1	Very high	83 Å²	83	40.1 Å²	40.1	44%	0.444	23%	0.225	S	C	.	.	H	α-helix	trans	-67.7	-39.8	178	-66.5	-15.4	0	0	0	112.5	N114 I116 D121 T122	N114-N118 WeakPolarHBondContact O-CB 3.27Å; N114-N118 PolarHBondContact O-N 2.9Å; N114-N118 PolarHBondContact O-ND2 3.47Å; I116-N118 PolarHBondContact O-N 3.1Å; N118-D121 PolarHBondContact O-N 2.95Å; N118-T122 WeakPolarHBondContact O-CB 3.27Å; N118-T122 PolarHBondContact O-N 3.41Å; N118-T122 PolarHBondContact O-OG1 3.05Å
119	G	91.1	Very high	90.2	Very high	15 Å²	15	43.5 Å²	43.5	16%	0.155	25%	0.249	C	C	.	.	H	α-helix	trans	-72.3	-38.8	179.7	0	0	0	0	0	112.3	R115 I116 T122 I123 F294	R115-G119 WeakPolarHBondContact O-CA 3.32Å; R115-G119 PolarHBondContact O-N 3.27Å; I116-G119 PolarHBondContact O-N 3.21Å; G119-T122 PolarHBondContact O-N 3.19Å; G119-I123 WeakPolarHBondContact O-CB 3.5Å; G119-I123 WeakPolarHBondContact O-CG1 3.35Å; G119-I123 PolarHBondContact O-N 2.94Å; G119-F294 VanDerWaalsContact CA-CE2 3.48Å
120	F	89.6	Confident	90.3	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.009	23%	0.232	C	C	.	.	H	α-helix	trans	-61	-44	169.4	-93.4	-74.7	0	0	0	112.4	I116 T122 I123 Y124 F294 M392 M395 L396 M399 F568	I116-F120 HydrophobicContact CG2-CD2 3.84Å; I116-F120 HydrophobicContact CG2-CE2 4.03Å; I116-F120 WeakPolarHBondContact O-CB 3.08Å; I116-F120 VanDerWaalsContact O-CD2 3.31Å; I116-F120 WeakPolarHBondContact O-CD2 3.33Å; I116-F120 PolarHBondContact O-N 3.37Å; F120-T122 VanDerWaalsContact C-N 3.32Å; F120-T122 PolarHBondContact O-N 2.97Å; F120-I123 PolarHBondContact O-N 2.85Å; F120-Y124 WeakPolarHBondContact O-CB 3.28Å; F120-Y124 PolarHBondContact O-N 2.83Å; F120-F294 HydrophobicContact CD2-CE1 4.04Å; F120-F294 AromaticContact CD2-CZ 3.64Å; F120-F294 HydrophobicContact CD2-CZ 3.64Å; F120-F294 AromaticContact CE2-CE1 3.87Å; F120-F294 HydrophobicContact CE2-CE1 3.87Å; F120-F294 AromaticContact CE2-CZ 3.84Å; F120-F294 HydrophobicContact CE2-CZ 3.84Å; F120-F294 HydrophobicContact CG-CZ 4.22Å; F120-F294 HydrophobicContact CZ-CE1 4.16Å; F120-M392 HydrophobicContact CB-CE 4.28Å; F120-M392 HydrophobicContact CB-SD 4.09Å; F120-M392 HydrophobicContact CD1-SD 3.49Å; F120-M392 WeakPolarHBondContact CD1-SD 3.31Å; F120-M392 HydrophobicContact CD2-CE 4.35Å; F120-M392 HydrophobicContact CD2-CG 4.05Å; F120-M392 HydrophobicContact CD2-SD 3.28Å; F120-M392 WeakPolarHBondContact CD2-SD 3.45Å; F120-M392 HydrophobicContact CE1-SD 3.6Å; F120-M392 VanDerWaalsContact CE1-SD 3.6Å; F120-M392 HydrophobicContact CE2-CG 3.83Å; F120-M392 HydrophobicContact CE2-SD 3.38Å; F120-M392 WeakPolarHBondContact CE2-SD 3.39Å; F120-M392 HydrophobicContact CG-CE 4.15Å; F120-M392 HydrophobicContact CG-SD 3.34Å; F120-M392 WeakPolarHBondContact CG-SD 3.4Å; F120-M392 HydrophobicContact CZ-CG 4.26Å; F120-M392 HydrophobicContact CZ-SD 3.55Å; F120-M392 VanDerWaalsContact CZ-SD 3.55Å; F120-M395 HydrophobicContact CE1-CB 3.77Å; F120-M395 HydrophobicContact CZ-CB 3.87Å; F120-L396 HydrophobicContact CE2-CD1 4.18Å; F120-L396 HydrophobicContact CE2-CD2 3.35Å; F120-L396 HydrophobicContact CE2-CG 3.47Å; F120-L396 VanDerWaalsContact CE2-CG 3.47Å; F120-L396 HydrophobicContact CZ-CD2 3.63Å; F120-L396 HydrophobicContact CZ-CG 3.64Å; F120-M399 HydrophobicContact CE1-SD 3.96Å; F120-M399 HydrophobicContact CZ-SD 3.87Å; F120-F568 AromaticContact CD1-CE1 3.81Å; F120-F568 HydrophobicContact CD1-CE1 3.81Å; F120-F568 AromaticContact CE1-CE1 3.6Å; F120-F568 HydrophobicContact CE1-CE1 3.6Å; F120-F568 AromaticContact CE1-CZ 3.98Å; F120-F568 HydrophobicContact CE1-CZ 3.98Å
121	D	90.6	Very high	90.4	Very high	90 Å²	90	41.8 Å²	41.8	48%	0.481	24%	0.241	S	C	.	.	H	α-helix	trans	-60.4	-43.8	177.7	-166.9	49.7	0	0	0	111.2	T117 N118 S125 I576	T117-D121 VanDerWaalsContact O-CB 3.3Å; T117-D121 WeakPolarHBondContact O-CB 3.41Å; T117-D121 PolarHBondContact O-N 3.11Å; N118-D121 PolarHBondContact O-N 2.95Å; D121-S125 WeakPolarHBondContact O-CB 3.47Å; D121-S125 PolarHBondContact O-N 3.21Å; D121-I576 HydrophobicContact CB-CG2 3.97Å
122	T	91.9	Very high	90.3	Very high	75 Å²	75	44 Å²	44	46%	0.46	25%	0.247	S	C	.	.	H	α-helix	trans	-62.5	-54.1	176.6	-54.8	0	0	0	0	111.2	N118 G119 F120 Y124 S125 D126	N118-T122 WeakPolarHBondContact O-CB 3.27Å; N118-T122 PolarHBondContact O-N 3.41Å; N118-T122 PolarHBondContact O-OG1 3.05Å; G119-T122 PolarHBondContact O-N 3.19Å; F120-T122 VanDerWaalsContact C-N 3.32Å; F120-T122 PolarHBondContact O-N 2.97Å; T122-Y124 PolarHBondContact O-N 3.34Å; T122-S125 WeakPolarHBondContact O-CB 3.35Å; T122-S125 PolarHBondContact O-N 2.96Å; T122-D126 WeakPolarHBondContact O-CB 3.37Å; T122-D126 VanDerWaalsContact O-CG 3.24Å; T122-D126 PolarHBondContact O-N 3.46Å
123	I	91.4	Very high	90.1	Very high	9 Å²	9	45.8 Å²	45.8	5%	0.046	26%	0.257	C	S	.	.	H	α-helix	trans	-62.1	-45.6	-178.4	-72.2	170	0	0	0	111.5	G119 F120 S125 D126 I127 V291 F294 M399 F568	G119-I123 WeakPolarHBondContact O-CB 3.5Å; G119-I123 WeakPolarHBondContact O-CG1 3.35Å; G119-I123 PolarHBondContact O-N 2.94Å; F120-I123 PolarHBondContact O-N 2.85Å; I123-S125 VanDerWaalsContact C-N 3.33Å; I123-S125 PolarHBondContact O-N 3.28Å; I123-D126 PolarHBondContact O-N 2.87Å; I123-I127 HydrophobicContact CG2-CD1 3.54Å; I123-I127 HydrophobicContact CG2-CG1 4.28Å; I123-I127 WeakPolarHBondContact O-CB 3.46Å; I123-I127 VanDerWaalsContact O-CG1 3.23Å; I123-I127 WeakPolarHBondContact O-CG1 3.42Å; I123-I127 PolarHBondContact O-N 3.19Å; I123-V291 HydrophobicContact CG1-CG2 4.43Å; I123-V291 HydrophobicContact CG2-CG2 3.75Å; I123-F294 HydrophobicContact CD1-CB 3.3Å; I123-F294 HydrophobicContact CD1-CD1 3.56Å; I123-F294 HydrophobicContact CD1-CD2 3.87Å; I123-F294 HydrophobicContact CD1-CE1 4.27Å; I123-F294 HydrophobicContact CD1-CG 3.29Å; I123-M399 HydrophobicContact CD1-CE 3.87Å; I123-F568 HydrophobicContact CG2-CD1 4.26Å; I123-F568 HydrophobicContact CG2-CE1 4.1Å; I123-F568 HydrophobicContact CG2-CZ 4.48Å
124	Y	90.9	Very high	90.2	Very high	45 Å²	45	46 Å²	46	18%	0.176	26%	0.257	C	S	.	.	H	α-helix	trans	-61.1	-45.3	177.3	174.6	-92.2	0	0	0	110.9	F120 T122 S128 I571 I576	F120-Y124 WeakPolarHBondContact O-CB 3.28Å; F120-Y124 PolarHBondContact O-N 2.83Å; T122-Y124 PolarHBondContact O-N 3.34Å; Y124-S128 WeakPolarHBondContact O-CB 3.39Å; Y124-S128 PolarHBondContact O-N 2.74Å; Y124-S128 PolarHBondContact O-OG 3Å; Y124-I571 WeakPolarHBondContact CE2-O 3.49Å; Y124-I576 HydrophobicContact CD1-CD1 3.61Å; Y124-I576 HydrophobicContact CD2-CD1 3.85Å; Y124-I576 HydrophobicContact CE1-CD1 4.39Å; Y124-I576 HydrophobicContact CG-CD1 3.3Å
125	S	90.4	Very high	90.2	Very high	57 Å²	57	46.6 Å²	46.6	40%	0.399	26%	0.258	S	S	.	.	H	α-helix	trans	-59.4	-50	176.6	176.8	0	0	0	0	110.7	D121 T122 I123 I127 S128 S129	D121-S125 WeakPolarHBondContact O-CB 3.47Å; D121-S125 PolarHBondContact O-N 3.21Å; T122-S125 WeakPolarHBondContact O-CB 3.35Å; T122-S125 PolarHBondContact O-N 2.96Å; I123-S125 VanDerWaalsContact C-N 3.33Å; I123-S125 PolarHBondContact O-N 3.28Å; S125-I127 PolarHBondContact O-N 2.88Å; S125-S128 PolarHBondContact O-N 3.36Å; S125-S129 WeakPolarHBondContact O-CB 3.39Å; S125-S129 PolarHBondContact O-N 3.48Å; S125-S129 PolarHBondContact O-OG 3.19Å
126	D	91.7	Very high	90	Very high	58 Å²	58	43.9 Å²	43.9	31%	0.31	25%	0.252	S	S	.	.	H	α-helix	trans	-65.6	-42	-176.1	-67.9	-17	0	0	0	111.7	T122 I123 A130 L287	T122-D126 WeakPolarHBondContact O-CB 3.37Å; T122-D126 VanDerWaalsContact O-CG 3.24Å; T122-D126 PolarHBondContact O-N 3.46Å; I123-D126 PolarHBondContact O-N 2.87Å; D126-A130 PolarHBondContact O-N 3.37Å; D126-A130 VanDerWaalsContact O-N 3.09Å; D126-L287 HydrophobicContact CB-CD1 3.64Å
127	I	91.7	Very high	89.8	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-67.6	-41.3	176.3	-67.4	172.9	0	0	0	111.8	I123 S125 A130 L287 V291 F565 F568 R569	I123-I127 HydrophobicContact CG2-CD1 3.54Å; I123-I127 HydrophobicContact CG2-CG1 4.28Å; I123-I127 WeakPolarHBondContact O-CB 3.46Å; I123-I127 VanDerWaalsContact O-CG1 3.23Å; I123-I127 WeakPolarHBondContact O-CG1 3.42Å; I123-I127 PolarHBondContact O-N 3.19Å; S125-I127 PolarHBondContact O-N 2.88Å; I127-A130 WeakPolarHBondContact O-CB 3.29Å; I127-L287 HydrophobicContact CG1-CD1 3.91Å; I127-L287 HydrophobicContact CG1-CD2 4.09Å; I127-L287 HydrophobicContact CG1-CG 4.23Å; I127-V291 HydrophobicContact CD1-CG2 4.13Å; I127-F565 HydrophobicContact CD1-CD1 3.72Å; I127-F565 HydrophobicContact CD1-CE1 3.96Å; I127-F565 HydrophobicContact CD1-CG 4.22Å; I127-F565 HydrophobicContact CG1-CD1 4.24Å; I127-F565 HydrophobicContact CG1-CE1 4.3Å; I127-F565 HydrophobicContact CG1-CG 4.39Å; I127-F565 HydrophobicContact CG1-CZ 4.47Å; I127-F565 HydrophobicContact CG2-CB 4.21Å; I127-F565 HydrophobicContact CG2-CG 4.32Å; I127-F568 HydrophobicContact CD1-CB 3.82Å; I127-F568 HydrophobicContact CD1-CD1 4.4Å; I127-F568 HydrophobicContact CD1-CD2 4.07Å; I127-F568 HydrophobicContact CD1-CG 3.83Å; I127-F568 HydrophobicContact CG2-CB 4.34Å; I127-R569 HydrophobicContact CG2-CG 3.68Å; I127-R569 PolarHBondContact O-NE 3.46Å; I127-R569 VanDerWaalsContact O-NE 3.14Å; I127-R569 PolarHBondContact O-NH2 2.89Å
128	S	88.2	Confident	89.8	Confident	37 Å²	37	44.7 Å²	44.7	26%	0.259	26%	0.256	S	S	.	.	H	α-helix	trans	-76.2	-41.4	-175.3	-61.7	0	0	0	0	111.9	Y124 S125 A130 K135	Y124-S128 WeakPolarHBondContact O-CB 3.39Å; Y124-S128 PolarHBondContact O-N 2.74Å; Y124-S128 PolarHBondContact O-OG 3Å; S125-S128 PolarHBondContact O-N 3.36Å; S128-A130 VanDerWaalsContact C-N 3.28Å; S128-K135 PolarHBondContact O-NZ 2.92Å
129	S	89.5	Confident	89.8	Confident	78 Å²	78	47.5 Å²	47.5	55%	0.545	26%	0.264	S	S	.	.	H	α-helix	trans	-83	-2.5	179	71.5	0	0	0	0	113.6	S125	S125-S129 WeakPolarHBondContact O-CB 3.39Å; S125-S129 PolarHBondContact O-N 3.48Å; S125-S129 PolarHBondContact O-OG 3.19Å
130	A	91.3	Very high	89.7	Confident	6 Å²	6	47.5 Å²	47.5	5%	0.05	26%	0.259	C	S	.	.			trans	-47.2	126.7	175.1	0	0	0	0	0	111	D126 I127 S128 V134 K135	D126-A130 PolarHBondContact O-N 3.37Å; D126-A130 VanDerWaalsContact O-N 3.09Å; I127-A130 WeakPolarHBondContact O-CB 3.29Å; S128-A130 VanDerWaalsContact C-N 3.28Å; A130-V134 HydrophobicContact CB-CB 4.42Å; A130-V134 HydrophobicContact CB-CG1 4.18Å; A130-K135 WeakPolarHBondContact O-CE 3.48Å; A130-K135 PolarHBondContact O-NZ 2.94Å
131	P	90	Very high	89.7	Confident	63 Å²	63	47.4 Å²	47.4	41%	0.409	26%	0.259	S	S	.	.			trans	-65.4	158.2	-176.9	21.6	-27.7	0	0	0	111.8	N133 V134 K135 L283	P131-N133 VanDerWaalsContact CB-OD1 3.24Å; P131-N133 WeakPolarHBondContact CB-OD1 3.44Å; P131-N133 WeakPolarHBondContact CG-OD1 3.48Å; P131-N133 PolarHBondContact O-N 3.2Å; P131-N133 VanDerWaalsContact O-N 3.16Å; P131-V134 HydrophobicContact CG-CG2 3.93Å; P131-V134 WeakPolarHBondContact O-CB 3.44Å; P131-V134 PolarHBondContact O-N 3.24Å; P131-K135 PolarHBondContact O-N 2.87Å; P131-K135 VanDerWaalsContact O-N 3.17Å; P131-L283 HydrophobicContact CG-CD1 4.44Å
132	D	87.9	Confident	89.7	Confident	122 Å²	122	44.8 Å²	44.8	65%	0.652	25%	0.249	S	C	*	.	H	α-helix	trans	-59.7	-32	-170.9	-71.4	-23.4	0	0	0	113	K135 I136	D132-K135 PolarHBondContact O-N 3.35Å; D132-I136 WeakPolarHBondContact O-CD1 3.28Å; D132-I136 VanDerWaalsContact O-CG1 3.22Å; D132-I136 WeakPolarHBondContact O-CG1 3.38Å; D132-I136 PolarHBondContact O-N 2.81Å
133	N	88	Confident	89.6	Confident	48 Å²	48	41.8 Å²	41.8	26%	0.257	23%	0.231	S	C	.	.	H	α-helix	trans	-61.6	-44.8	173.5	58.7	-17.7	0	0	0	111.8	P131 K135 I136 M137 S280	P131-N133 VanDerWaalsContact CB-OD1 3.24Å; P131-N133 WeakPolarHBondContact CB-OD1 3.44Å; P131-N133 WeakPolarHBondContact CG-OD1 3.48Å; P131-N133 PolarHBondContact O-N 3.2Å; P131-N133 VanDerWaalsContact O-N 3.16Å; N133-K135 PolarHBondContact O-N 3.42Å; N133-I136 WeakPolarHBondContact O-CB 3.14Å; N133-I136 PolarHBondContact O-N 3.43Å; N133-M137 VanDerWaalsContact O-CG 3.29Å; N133-M137 WeakPolarHBondContact O-CG 3.46Å; N133-M137 PolarHBondContact O-N 2.89Å; N133-S280 WeakPolarHBondContact CB-OG 3.34Å; N133-S280 PolarHBondContact ND2-OG 2.71Å
134	V	90.1	Very high	89.5	Confident	3 Å²	3	41.3 Å²	41.3	2%	0.018	23%	0.229	C	C	.	.	H	α-helix	trans	-60.8	-44.3	174.7	174.7	0	0	0	0	110.9	A130 P131 I136 M137 E138 L283 L284	A130-V134 HydrophobicContact CB-CB 4.42Å; A130-V134 HydrophobicContact CB-CG1 4.18Å; P131-V134 HydrophobicContact CG-CG2 3.93Å; P131-V134 WeakPolarHBondContact O-CB 3.44Å; P131-V134 PolarHBondContact O-N 3.24Å; V134-I136 VanDerWaalsContact C-N 3.32Å; V134-I136 PolarHBondContact O-N 3.27Å; V134-M137 CarbonylContact O-C 3.5Å; V134-M137 WeakPolarHBondContact O-CA 3.3Å; V134-M137 WeakPolarHBondContact O-CB 3.43Å; V134-M137 PolarHBondContact O-N 2.86Å; V134-E138 PolarHBondContact O-N 3.2Å; V134-L283 HydrophobicContact CG2-CB 3.85Å; V134-L283 HydrophobicContact CG2-CD1 4.07Å; V134-L284 HydrophobicContact CG1-CB 4.3Å; V134-L284 HydrophobicContact CG1-CD1 4.26Å
135	K	88.6	Confident	89.4	Confident	63 Å²	63	39.8 Å²	39.8	27%	0.274	22%	0.223	S	C	.	.	H	α-helix	trans	-63.5	-35.4	176.7	-70.1	171.3	176.6	152.4	0	112.9	S128 A130 P131 D132 N133 M137 K139	S128-K135 PolarHBondContact O-NZ 2.92Å; A130-K135 WeakPolarHBondContact O-CE 3.48Å; A130-K135 PolarHBondContact O-NZ 2.94Å; P131-K135 PolarHBondContact O-N 2.87Å; P131-K135 VanDerWaalsContact O-N 3.17Å; D132-K135 PolarHBondContact O-N 3.35Å; N133-K135 PolarHBondContact O-N 3.42Å; K135-M137 VanDerWaalsContact C-N 3.33Å; K135-K139 WeakPolarHBondContact O-CG 3.23Å; K135-K139 PolarHBondContact O-N 3.36Å
136	I	86.4	Confident	89.2	Confident	67 Å²	67	39.2 Å²	39.2	34%	0.344	22%	0.216	S	C	.	.	H	α-helix	trans	-64.9	-40.3	172	-70.4	163.1	0	0	0	110	D132 N133 V134 K139 R140	D132-I136 WeakPolarHBondContact O-CD1 3.28Å; D132-I136 VanDerWaalsContact O-CG1 3.22Å; D132-I136 WeakPolarHBondContact O-CG1 3.38Å; D132-I136 PolarHBondContact O-N 2.81Å; N133-I136 WeakPolarHBondContact O-CB 3.14Å; N133-I136 PolarHBondContact O-N 3.43Å; V134-I136 VanDerWaalsContact C-N 3.32Å; V134-I136 PolarHBondContact O-N 3.27Å; I136-K139 PolarHBondContact O-N 3.34Å; I136-R140 PolarHBondContact O-N 3.5Å
137	M	85.5	Confident	88.9	Confident	4 Å²	4	36.7 Å²	36.7	2%	0.02	20%	0.202	C	C	.	.	H	α-helix	trans	-67.2	-39.2	177.8	-62.6	-37.3	132.3	0	0	112.9	N133 V134 K135 K139 R140 L141 K275 Y276 L284	N133-M137 VanDerWaalsContact O-CG 3.29Å; N133-M137 WeakPolarHBondContact O-CG 3.46Å; N133-M137 PolarHBondContact O-N 2.89Å; V134-M137 CarbonylContact O-C 3.5Å; V134-M137 WeakPolarHBondContact O-CA 3.3Å; V134-M137 WeakPolarHBondContact O-CB 3.43Å; V134-M137 PolarHBondContact O-N 2.86Å; K135-M137 VanDerWaalsContact C-N 3.33Å; M137-K139 VanDerWaalsContact C-N 3.32Å; M137-K139 PolarHBondContact O-N 3.04Å; M137-R140 PolarHBondContact O-N 2.89Å; M137-L141 VanDerWaalsContact O-CB 3.27Å; M137-L141 WeakPolarHBondContact O-CB 3.47Å; M137-L141 PolarHBondContact O-N 3.21Å; M137-K275 WeakPolarHBondContact CE-O 3.48Å; M137-Y276 HydrophobicContact CB-CD1 4.25Å; M137-Y276 HydrophobicContact CB-CE1 4.18Å; M137-Y276 HydrophobicContact CG-CD1 3.8Å; M137-Y276 HydrophobicContact CG-CE1 4.22Å; M137-Y276 VanDerWaalsContact SD-CA 3.55Å; M137-Y276 HydrophobicContact SD-CD1 3.18Å; M137-Y276 WeakPolarHBondContact SD-CD1 3.48Å; M137-Y276 HydrophobicContact SD-CE1 3.68Å; M137-Y276 HydrophobicContact SD-CG 3.94Å; M137-L284 HydrophobicContact CB-CD2 4.3Å
138	E	90.4	Very high	88.5	Confident	14 Å²	14	36.7 Å²	36.7	7%	0.065	20%	0.202	C	C	.	.	H	α-helix	trans	-56	-47.1	172.4	-71.4	172.3	-146.4	0	0	111.5	V134 L141 A142 L284 L562 R569	V134-E138 PolarHBondContact O-N 3.2Å; E138-L141 PolarHBondContact O-N 3.43Å; E138-A142 WeakPolarHBondContact O-CB 3.11Å; E138-A142 PolarHBondContact O-N 3.16Å; E138-L284 HydrophobicContact CG-CD1 3.7Å; E138-L284 HydrophobicContact CG-CD2 4.39Å; E138-L562 HydrophobicContact CB-CD2 3.76Å; E138-L562 HydrophobicContact CG-CD2 3.87Å; E138-R569 VanDerWaalsContact CD-NH2 3.27Å; E138-R569 IonicContact OE1-CZ 3.96Å; E138-R569 IonicContact OE1-NH1 2.93Å; E138-R569 IonicContact OE1-NH2 2.69Å; E138-R569 PolarHBondContact OE1-NH2 3.24Å; E138-R569 IonicContact OE2-CZ 3.76Å; E138-R569 VanDerWaalsContact OE2-CZ 3.28Å; E138-R569 IonicContact OE2-NH1 3.62Å; E138-R569 PolarHBondContact OE2-NH1 3.49Å; E138-R569 IonicContact OE2-NH2 2.74Å; E138-R569 PolarHBondContact OE2-NH2 3.31Å
139	K	89.4	Confident	88.1	Confident	141 Å²	141	39 Å²	39	61%	0.613	21%	0.211	S	C	*	.	H	α-helix	trans	-63.6	-43.2	177.2	-69.8	177.1	-178.2	-179.9	0	111.8	K135 I136 M137 A142 V143 T273	K135-K139 WeakPolarHBondContact O-CG 3.23Å; K135-K139 PolarHBondContact O-N 3.36Å; I136-K139 PolarHBondContact O-N 3.34Å; M137-K139 VanDerWaalsContact C-N 3.32Å; M137-K139 PolarHBondContact O-N 3.04Å; K139-A142 PolarHBondContact O-N 3.03Å; K139-V143 WeakPolarHBondContact O-CG2 3.46Å; K139-V143 PolarHBondContact O-N 3.29Å; K139-V143 VanDerWaalsContact O-N 3.16Å; K139-T273 HydrophobicContact CB-CG2 4.29Å
140	R	90	Very high	87.4	Confident	16 Å²	16	36.8 Å²	36.8	6%	0.06	19%	0.193	C	C	.	.	H	α-helix	trans	-62.7	-44.6	178	-172.7	173.6	-172.1	72.6	10.3	111.4	I136 M137 V143 L144 L270 T273 G274 Y276 D419	I136-R140 PolarHBondContact O-N 3.5Å; M137-R140 PolarHBondContact O-N 2.89Å; R140-V143 PolarHBondContact O-N 3.33Å; R140-L144 HydrophobicContact CG-CD1 4.48Å; R140-L144 WeakPolarHBondContact O-CG 3.28Å; R140-L144 PolarHBondContact O-N 3.35Å; R140-L144 VanDerWaalsContact O-N 3.09Å; R140-L270 HydrophobicContact CG-CD1 3.78Å; R140-L270 PolarHBondContact NH1-O 2.97Å; R140-T273 HydrophobicContact CB-CG2 4.41Å; R140-T273 WeakPolarHBondContact CG-OG1 3.14Å; R140-T273 PolarHBondContact NH1-O 3.37Å; R140-T273 PolarHBondContact NH1-OG1 2.55Å; R140-G274 VanDerWaalsContact CD-O 3.28Å; R140-G274 WeakPolarHBondContact CD-O 3.48Å; R140-Y276 HydrophobicContact CB-CE1 4.45Å; R140-Y276 HydrophobicContact CG-CE1 4.37Å; R140-Y276 HydrophobicContact CG-CE2 4.38Å; R140-Y276 WeakPolarHBondContact CG-OH 3.41Å; R140-D419 IonicContact CZ-OD1 3.12Å; R140-D419 IonicContact CZ-OD2 2.63Å; R140-D419 IonicContact NE-OD1 3.31Å; R140-D419 IonicContact NE-OD2 3.93Å; R140-D419 PolarHBondContact NE-OD2 3.32Å; R140-D419 IonicContact NH2-OD1 3.54Å; R140-D419 PolarHBondContact NH2-OD1 3.33Å; R140-D419 IonicContact NH2-OD2 2.76Å; R140-D419 PolarHBondContact NH2-OD2 3.02Å
141	L	90.5	Very high	86.7	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-63.8	-43.1	178.7	-174.3	58.6	0	0	0	111.4	M137 E138 V143 L144 E145 L284 F288 L412 I415 V558 L562	M137-L141 VanDerWaalsContact O-CB 3.27Å; M137-L141 WeakPolarHBondContact O-CB 3.47Å; M137-L141 PolarHBondContact O-N 3.21Å; E138-L141 PolarHBondContact O-N 3.43Å; L141-V143 VanDerWaalsContact C-N 3.3Å; L141-V143 PolarHBondContact O-N 3.17Å; L141-L144 PolarHBondContact O-N 3.27Å; L141-L144 VanDerWaalsContact O-N 3.12Å; L141-E145 PolarHBondContact O-N 2.81Å; L141-L284 HydrophobicContact CD2-CD2 4.02Å; L141-F288 HydrophobicContact CD2-CE2 3.94Å; L141-F288 HydrophobicContact CD2-CZ 4.09Å; L141-L412 HydrophobicContact CD1-CD1 4.31Å; L141-L412 HydrophobicContact CD2-CD1 3.65Å; L141-I415 HydrophobicContact CD1-CB 4.32Å; L141-I415 HydrophobicContact CD1-CD1 4.37Å; L141-I415 HydrophobicContact CD1-CG2 3.71Å; L141-V558 HydrophobicContact CD1-CG1 4.35Å; L141-V558 HydrophobicContact CD2-CG1 3.58Å; L141-V558 HydrophobicContact CG-CG1 3.85Å; L141-L562 HydrophobicContact CB-CD1 4.26Å; L141-L562 HydrophobicContact CD2-CD1 4.19Å; L141-L562 HydrophobicContact CG-CD1 4.04Å
142	A	90.2	Very high	85.8	Confident	34 Å²	34	38.9 Å²	38.9	28%	0.281	20%	0.2	S	C	.	.	H	α-helix	trans	-57	-42.7	174.4	0	0	0	0	0	112.3	E138 K139 L144 E145 D146 L562	E138-A142 WeakPolarHBondContact O-CB 3.11Å; E138-A142 PolarHBondContact O-N 3.16Å; K139-A142 PolarHBondContact O-N 3.03Å; A142-L144 PolarHBondContact O-N 3.36Å; A142-E145 WeakPolarHBondContact O-CB 3.45Å; A142-E145 PolarHBondContact O-N 3.48Å; A142-D146 PolarHBondContact O-N 3.45Å; A142-L562 HydrophobicContact CB-CD1 4.11Å
143	V	89.2	Confident	85.1	Confident	12 Å²	12	38.1 Å²	38.1	7%	0.073	20%	0.199	C	C	.	.	H	α-helix	trans	-66.3	-37.8	177.1	177	0	0	0	0	111.6	K139 R140 L141 D146 I147 L266 Q269 L270	K139-V143 WeakPolarHBondContact O-CG2 3.46Å; K139-V143 PolarHBondContact O-N 3.29Å; K139-V143 VanDerWaalsContact O-N 3.16Å; R140-V143 PolarHBondContact O-N 3.33Å; L141-V143 VanDerWaalsContact C-N 3.3Å; L141-V143 PolarHBondContact O-N 3.17Å; V143-D146 PolarHBondContact O-N 2.99Å; V143-I147 HydrophobicContact CG1-CD1 4.17Å; V143-I147 VanDerWaalsContact O-CG1 3.31Å; V143-I147 WeakPolarHBondContact O-CG1 3.48Å; V143-I147 PolarHBondContact O-N 3Å; V143-L266 HydrophobicContact CG1-CB 4.45Å; V143-L266 VanDerWaalsContact CG1-O 3.27Å; V143-L266 WeakPolarHBondContact CG1-O 3.23Å; V143-Q269 HydrophobicContact CG1-CB 4.23Å; V143-Q269 HydrophobicContact CG2-CB 4Å; V143-L270 HydrophobicContact CB-CD1 4.46Å; V143-L270 HydrophobicContact CG1-CB 3.8Å; V143-L270 HydrophobicContact CG1-CD1 4.23Å
144	L	89.5	Confident	84.3	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-66.4	-38.8	176.4	-69	169.6	0	0	0	112.1	R140 L141 A142 I147 S148 L270 Y276 I415 D419 F544 L548	R140-L144 HydrophobicContact CG-CD1 4.48Å; R140-L144 WeakPolarHBondContact O-CG 3.28Å; R140-L144 PolarHBondContact O-N 3.35Å; R140-L144 VanDerWaalsContact O-N 3.09Å; L141-L144 PolarHBondContact O-N 3.27Å; L141-L144 VanDerWaalsContact O-N 3.12Å; A142-L144 PolarHBondContact O-N 3.36Å; L144-I147 PolarHBondContact O-N 3.09Å; L144-S148 PolarHBondContact O-N 3.11Å; L144-L270 HydrophobicContact CD2-CD1 3.77Å; L144-L270 HydrophobicContact CD2-CD2 3.85Å; L144-L270 HydrophobicContact CD2-CG 4.5Å; L144-L270 HydrophobicContact CG-CD1 3.88Å; L144-Y276 HydrophobicContact CD1-CE2 4.37Å; L144-Y276 WeakPolarHBondContact CD1-OH 3.4Å; L144-I415 HydrophobicContact CB-CG2 3.89Å; L144-I415 HydrophobicContact CD1-CG2 3.5Å; L144-I415 VanDerWaalsContact CD1-CG2 3.5Å; L144-I415 HydrophobicContact CG-CG2 4.3Å; L144-D419 HydrophobicContact CD1-CB 3.84Å; L144-D419 HydrophobicContact CD2-CB 4.41Å; L144-F544 HydrophobicContact CD2-CE2 4.34Å; L144-F544 HydrophobicContact CD2-CZ 3.98Å; L144-L548 HydrophobicContact CD2-CD1 4.25Å; L144-L548 HydrophobicContact CD2-CD2 4.26Å
145	E	88.2	Confident	83.5	Confident	12 Å²	12	40.6 Å²	40.6	6%	0.056	22%	0.219	C	C	.	.	H	α-helix	trans	-60.1	-45.4	170.9	-73.1	-60.5	149.2	0	0	111.6	L141 A142 I147 S148 L149 H411 I415 V558	L141-E145 PolarHBondContact O-N 2.81Å; A142-E145 WeakPolarHBondContact O-CB 3.45Å; A142-E145 PolarHBondContact O-N 3.48Å; E145-I147 VanDerWaalsContact C-N 3.34Å; E145-I147 PolarHBondContact O-N 3.31Å; E145-S148 WeakPolarHBondContact O-CB 3.3Å; E145-S148 PolarHBondContact O-N 3.27Å; E145-L149 PolarHBondContact O-N 3.03Å; E145-H411 IonicContact OE1-CD2 2.54Å; E145-H411 IonicContact OE1-CE1 2.71Å; E145-H411 IonicContact OE1-NE2 3.83Å; E145-H411 PolarHBondContact OE1-NE2 3.31Å; E145-I415 WeakPolarHBondContact OE1-CD1 3.36Å; E145-V558 HydrophobicContact CG-CG1 4.27Å
146	D	86.6	Confident	82.9	Confident	46 Å²	46	38 Å²	38	25%	0.246	21%	0.208	C	C	.	.	H	α-helix	trans	-62.7	-39.8	177.3	-75.1	-22.3	0	0	0	111.9	A142 V143 L149 I150 L266 R559	A142-D146 PolarHBondContact O-N 3.45Å; V143-D146 PolarHBondContact O-N 2.99Å; D146-L149 PolarHBondContact O-N 3.4Å; D146-I150 WeakPolarHBondContact O-CG1 3.49Å; D146-I150 PolarHBondContact O-N 3.3Å; D146-I150 VanDerWaalsContact O-N 3.09Å; D146-L266 HydrophobicContact CB-CD1 4.04Å; D146-L266 HydrophobicContact CB-CD2 3.78Å; D146-R559 IonicContact OD1-CZ 3.33Å; D146-R559 IonicContact OD1-NH1 3.32Å; D146-R559 PolarHBondContact OD1-NH1 3.11Å; D146-R559 IonicContact OD1-NH2 3.26Å; D146-R559 PolarHBondContact OD1-NH2 3.22Å
147	I	85.3	Confident	82.2	Confident	4 Å²	4	40.7 Å²	40.7	2%	0.021	22%	0.219	C	C	.	.	H	α-helix	trans	-61.7	-47.1	174.2	-68.9	167.9	0	0	0	109.9	V143 L144 E145 L149 I150 L151 L266 L270 Y545 L548	V143-I147 HydrophobicContact CG1-CD1 4.17Å; V143-I147 VanDerWaalsContact O-CG1 3.31Å; V143-I147 WeakPolarHBondContact O-CG1 3.48Å; V143-I147 PolarHBondContact O-N 3Å; L144-I147 PolarHBondContact O-N 3.09Å; E145-I147 VanDerWaalsContact C-N 3.34Å; E145-I147 PolarHBondContact O-N 3.31Å; I147-L149 PolarHBondContact O-N 3.47Å; I147-I150 PolarHBondContact O-N 3.47Å; I147-L151 HydrophobicContact CG2-CD1 3.96Å; I147-L151 HydrophobicContact CG2-CG 4.46Å; I147-L151 VanDerWaalsContact O-CG 3.29Å; I147-L151 WeakPolarHBondContact O-CG 3.42Å; I147-L151 PolarHBondContact O-N 2.66Å; I147-L151 VanDerWaalsContact O-N 3.16Å; I147-L266 HydrophobicContact CB-CD1 4.4Å; I147-L266 HydrophobicContact CD1-CB 4.29Å; I147-L266 HydrophobicContact CG1-CB 3.7Å; I147-L266 HydrophobicContact CG1-CD1 3.73Å; I147-L266 HydrophobicContact CG1-CG 4.35Å; I147-L270 HydrophobicContact CD1-CD2 3.95Å; I147-Y545 HydrophobicContact CG2-CD1 4.38Å; I147-Y545 HydrophobicContact CG2-CE1 4.31Å; I147-L548 HydrophobicContact CB-CD1 4.28Å; I147-L548 HydrophobicContact CG2-CD1 3.73Å
148	S	83.5	Confident	81.6	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.007	25%	0.252	C	S	.	.	H	α-helix	trans	-59	-36.8	178.2	-169.8	0	0	0	0	112.3	L144 E145	L144-S148 PolarHBondContact O-N 3.11Å; E145-S148 WeakPolarHBondContact O-CB 3.3Å; E145-S148 PolarHBondContact O-N 3.27Å
149	L	79.2	Confident	81	Confident	84 Å²	84	48 Å²	48	44%	0.44	25%	0.251	S	S	.	.	H	α-helix	trans	-69.7	-40.6	178.9	-172.2	69.7	0	0	0	112.5	E145 D146 I147 L151 D152 T153	E145-L149 PolarHBondContact O-N 3.03Å; D146-L149 PolarHBondContact O-N 3.4Å; I147-L149 PolarHBondContact O-N 3.47Å; L149-L151 VanDerWaalsContact C-N 3.3Å; L149-L151 PolarHBondContact O-N 3.02Å; L149-D152 PolarHBondContact O-N 3.46Å; L149-T153 PolarHBondContact O-N 3.08Å; L149-T153 PolarHBondContact O-OG1 2.89Å
150	I	76.1	Confident	80.3	Confident	33 Å²	33	45 Å²	45	17%	0.169	24%	0.242	C	C	.	.	H	α-helix	trans	-63.8	-38.8	177.2	-67.9	-166.7	0	0	0	111.1	D146 I147 D152 T153 V154 F262 L266	D146-I150 WeakPolarHBondContact O-CG1 3.49Å; D146-I150 PolarHBondContact O-N 3.3Å; D146-I150 VanDerWaalsContact O-N 3.09Å; I147-I150 PolarHBondContact O-N 3.47Å; I150-D152 VanDerWaalsContact C-N 3.26Å; I150-D152 PolarHBondContact O-N 3.13Å; I150-T153 PolarHBondContact O-N 3.46Å; I150-T153 VanDerWaalsContact O-N 3.11Å; I150-T153 PolarHBondContact O-OG1 2.74Å; I150-V154 PolarHBondContact O-N 2.9Å; I150-F262 HydrophobicContact CD1-CB 3.72Å; I150-L266 HydrophobicContact CD1-CD1 3.37Å; I150-L266 HydrophobicContact CD1-CG 4.28Å; I150-L266 HydrophobicContact CG1-CD1 4.02Å
151	L	76.3	Confident	79.8	Confident	30 Å²	30	45 Å²	45	16%	0.157	25%	0.245	C	C	.	.	H	α-helix	trans	-63.9	-30.2	-179.2	-67.9	168.3	0	0	0	113.3	I147 L149 L156 Y545	I147-L151 HydrophobicContact CG2-CD1 3.96Å; I147-L151 HydrophobicContact CG2-CG 4.46Å; I147-L151 VanDerWaalsContact O-CG 3.29Å; I147-L151 WeakPolarHBondContact O-CG 3.42Å; I147-L151 PolarHBondContact O-N 2.66Å; I147-L151 VanDerWaalsContact O-N 3.16Å; L149-L151 VanDerWaalsContact C-N 3.3Å; L149-L151 PolarHBondContact O-N 3.02Å; L151-L156 HydrophobicContact CD2-CD1 3.59Å; L151-L156 HydrophobicContact CD2-CG 4.35Å; L151-Y545 HydrophobicContact CD1-CD1 3.64Å; L151-Y545 HydrophobicContact CD1-CG 3.87Å; L151-Y545 HydrophobicContact CD2-CD1 3.96Å; L151-Y545 HydrophobicContact CD2-CD2 4.1Å; L151-Y545 HydrophobicContact CD2-CE1 4.37Å; L151-Y545 HydrophobicContact CD2-CG 3.79Å; L151-Y545 HydrophobicContact CG-CD1 4.37Å; L151-Y545 HydrophobicContact CG-CG 4.5Å
152	D	72	Confident	79.5	Confident	83 Å²	83	52.4 Å²	52.4	44%	0.444	28%	0.277	S	S	.	.	H	α-helix	trans	-74	-31.1	174.8	-83.7	-5	0	0	0	113	L149 I150 K552	L149-D152 PolarHBondContact O-N 3.46Å; I150-D152 VanDerWaalsContact C-N 3.26Å; I150-D152 PolarHBondContact O-N 3.13Å; D152-K552 WeakPolarHBondContact OD2-CD 3.48Å; D152-K552 WeakPolarHBondContact OD2-CE 3.35Å; D152-K552 IonicContact OD2-NZ 3.97Å; D152-K552 PolarHBondContact OD2-NZ 3.24Å
153	T	71.9	Confident	79.4	Confident	105 Å²	105	55.3 Å²	55.3	64%	0.644	29%	0.287	S	S	*	.	H	α-helix	trans	-89.5	-23.4	-176.4	55.9	0	0	0	0	112.5	L149 I150	L149-T153 PolarHBondContact O-N 3.08Å; L149-T153 PolarHBondContact O-OG1 2.89Å; I150-T153 PolarHBondContact O-N 3.46Å; I150-T153 VanDerWaalsContact O-N 3.11Å; I150-T153 PolarHBondContact O-OG1 2.74Å
154	V	72	Confident	79.4	Confident	43 Å²	43	54.9 Å²	54.9	26%	0.261	29%	0.285	S	S	.	.			trans	-138.9	127.9	-174.3	-168.1	0	0	0	0	113.6	I150 L156 P259	I150-V154 PolarHBondContact O-N 2.9Å; V154-L156 PolarHBondContact O-N 2.97Å; V154-P259 HydrophobicContact CB-CB 4.07Å; V154-P259 HydrophobicContact CB-CG 4.28Å; V154-P259 HydrophobicContact CG1-CB 3.37Å; V154-P259 HydrophobicContact CG1-CG 3.32Å; V154-P259 HydrophobicContact CG2-CB 4.23Å; V154-P259 HydrophobicContact CG2-CG 4.2Å
155	S	73.6	Confident	79.5	Confident	61 Å²	61	55.7 Å²	55.7	43%	0.427	29%	0.293	S	S	.	.			trans	-79.5	97.8	167.1	-55.5	0	0	0	0	111.1	E157 K158	S155-E157 PolarHBondContact O-N 3.35Å; S155-K158 PolarHBondContact O-N 3.21Å
156	L	74.9	Confident	79.6	Confident	9 Å²	9	57.3 Å²	57.3	5%	0.047	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-56.9	-30.8	176.9	-63	173.5	0	0	0	113	L151 V154 K158 P259 E263 I536 Y545	L151-L156 HydrophobicContact CD2-CD1 3.59Å; L151-L156 HydrophobicContact CD2-CG 4.35Å; V154-L156 PolarHBondContact O-N 2.97Å; L156-K158 VanDerWaalsContact C-N 3.28Å; L156-K158 PolarHBondContact O-N 3.38Å; L156-P259 HydrophobicContact CD2-CB 3.99Å; L156-E263 HydrophobicContact CD1-CG 4.1Å; L156-E263 HydrophobicContact CD2-CB 4.39Å; L156-I536 HydrophobicContact CB-CD1 4Å; L156-I536 HydrophobicContact CD1-CD1 4.2Å; L156-I536 HydrophobicContact CD2-CD1 4.25Å; L156-I536 HydrophobicContact CG-CD1 4.37Å; L156-Y545 HydrophobicContact CD1-CD2 4.39Å; L156-Y545 HydrophobicContact CD1-CE2 3.77Å
157	E	72.9	Confident	79.9	Confident	123 Å²	123	57 Å²	57	58%	0.575	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-68.4	-23.3	176.6	-63.2	177.1	178.8	0	0	113.7	S155 T537 L542	S155-E157 PolarHBondContact O-N 3.35Å; E157-T537 HydrophobicContact CG-CG2 4.25Å; E157-L542 HydrophobicContact CG-CD2 4.21Å; E157-L542 WeakPolarHBondContact OE1-CD1 3.48Å; E157-L542 WeakPolarHBondContact OE1-CD2 3.33Å
158	K	72.8	Confident	80.3	Confident	164 Å²	164	57.5 Å²	57.5	71%	0.713	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-93.8	6.1	-174.8	-63.5	-176.3	-174.4	164.5	0	113.6	S155 L156 D160	S155-K158 PolarHBondContact O-N 3.21Å; L156-K158 VanDerWaalsContact C-N 3.28Å; L156-K158 PolarHBondContact O-N 3.38Å; K158-D160 PolarHBondContact O-N 2.96Å
159	V	76.9	Confident	80.8	Confident	7 Å²	7	65.4 Å²	65.4	4%	0.042	33%	0.333	C	S	.	.			trans	-68.1	100.1	175.7	176.2	0	0	0	0	108.5	S161 V256 F257 L260 Q533	V159-S161 PolarHBondContact O-N 3.41Å; V159-V256 HydrophobicContact CG1-CG1 4.41Å; V159-V256 HydrophobicContact CG1-CG2 4.25Å; V159-V256 WeakPolarHBondContact CG1-O 3.49Å; V159-F257 HydrophobicContact CG1-CD1 3.73Å; V159-F257 HydrophobicContact CG1-CE1 4.06Å; V159-L260 HydrophobicContact CG1-CD1 3.91Å; V159-L260 HydrophobicContact CG1-CG 4.18Å; V159-L260 HydrophobicContact CG2-CD2 4.16Å; V159-L260 HydrophobicContact CG2-CG 4.31Å; V159-Q533 PolarHBondContact O-NE2 3.16Å; V159-Q533 PolarHBondContact O-OE1 3.1Å
160	D	74.4	Confident	81.6	Confident	77 Å²	77	62.6 Å²	62.6	41%	0.412	32%	0.318	S	S	.	.			trans	-83.2	100.1	-179.3	-166.7	-9.7	0	0	0	111.3	K158 K162	K158-D160 PolarHBondContact O-N 2.96Å; D160-K162 VanDerWaalsContact C-N 3.34Å; D160-K162 WeakPolarHBondContact OD1-CA 3.42Å; D160-K162 WeakPolarHBondContact OD1-CB 3.48Å; D160-K162 PolarHBondContact OD1-N 3.37Å
161	S	80.9	Confident	82.5	Confident	18 Å²	18	61 Å²	61	13%	0.126	31%	0.31	C	S	.	.	H	α-helix	trans	-75.9	-19.8	174	42.8	0	0	0	0	113.2	V159 Y164 G165 F526 Q533	V159-S161 PolarHBondContact O-N 3.41Å; S161-Y164 PolarHBondContact O-N 2.97Å; S161-G165 PolarHBondContact O-N 3Å; S161-F526 WeakPolarHBondContact O-CZ 3.49Å; S161-Q533 PolarHBondContact OG-OE1 3.41Å; S161-Q533 VanDerWaalsContact OG-OE1 3.07Å
162	K	84	Confident	83.5	Confident	155 Å²	155	60.7 Å²	60.7	67%	0.674	31%	0.313	S	S	*	.	H	α-helix	trans	-69.7	-39.2	-172.2	-171.4	-176.2	176.1	-173.6	0	112.5	D160 G165 T166	D160-K162 VanDerWaalsContact C-N 3.34Å; D160-K162 WeakPolarHBondContact OD1-CA 3.42Å; D160-K162 WeakPolarHBondContact OD1-CB 3.48Å; D160-K162 PolarHBondContact OD1-N 3.37Å; K162-G165 PolarHBondContact O-N 3.39Å; K162-T166 PolarHBondContact O-N 2.92Å; K162-T166 PolarHBondContact O-OG1 3.28Å
163	D	86.9	Confident	84.6	Confident	94 Å²	94	60.8 Å²	60.8	50%	0.503	31%	0.311	S	S	.	.	H	α-helix	trans	-64.9	-45.2	177.5	-83.4	-0.6	0	0	0	110.8	G165 T166 K167	D163-G165 PolarHBondContact O-N 2.99Å; D163-T166 WeakPolarHBondContact O-CB 3.48Å; D163-T166 PolarHBondContact O-N 3.49Å; D163-T166 VanDerWaalsContact O-N 3.16Å; D163-K167 PolarHBondContact O-N 2.91Å
164	Y	90.4	Very high	85.8	Confident	4 Å²	4	55.8 Å²	55.8	2%	0.016	28%	0.28	C	S	.	.	H	α-helix	trans	-60.6	-46.7	174.5	-171.8	-87.3	0	0	0	111.7	S161 T166 K167 L168 I250 M253 F254 F257 M439 V522 F526	S161-Y164 PolarHBondContact O-N 2.97Å; Y164-T166 PolarHBondContact O-N 3.48Å; Y164-K167 PolarHBondContact O-N 3.42Å; Y164-K167 VanDerWaalsContact O-N 3.15Å; Y164-L168 HydrophobicContact CE1-CB 4.33Å; Y164-L168 HydrophobicContact CE1-CD1 4.32Å; Y164-L168 HydrophobicContact CE1-CD2 4.25Å; Y164-L168 WeakPolarHBondContact O-CB 3.42Å; Y164-L168 PolarHBondContact O-N 3.39Å; Y164-I250 HydrophobicContact CD2-CG1 4.24Å; Y164-I250 HydrophobicContact CE1-CD1 4.49Å; Y164-I250 HydrophobicContact CE2-CD1 3.91Å; Y164-I250 HydrophobicContact CE2-CG1 3.83Å; Y164-M253 HydrophobicContact CD2-CB 3.74Å; Y164-M253 HydrophobicContact CE2-CB 4.38Å; Y164-F254 HydrophobicContact CD2-CB 4.45Å; Y164-F254 HydrophobicContact CE2-CB 3.77Å; Y164-F257 AromaticContact CD1-CE2 3.91Å; Y164-F257 HydrophobicContact CD1-CE2 3.91Å; Y164-F257 HydrophobicContact CD1-CZ 4.2Å; Y164-F257 AromaticContact CD2-CE2 3.87Å; Y164-F257 HydrophobicContact CD2-CE2 3.87Å; Y164-F257 HydrophobicContact CE1-CE2 4.41Å; Y164-F257 HydrophobicContact CE2-CE2 4.39Å; Y164-F257 AromaticContact CG-CE2 3.62Å; Y164-F257 HydrophobicContact CG-CE2 3.62Å; Y164-F257 AromaticContact CG-CZ 3.9Å; Y164-F257 HydrophobicContact CG-CZ 3.9Å; Y164-M439 HydrophobicContact CD1-CE 4.31Å; Y164-M439 HydrophobicContact CE1-CE 3.63Å; Y164-M439 HydrophobicContact CE1-SD 4.25Å; Y164-M439 WeakPolarHBondContact OH-CB 3.45Å; Y164-M439 VanDerWaalsContact OH-CG 3.29Å; Y164-M439 WeakPolarHBondContact OH-CG 3.21Å; Y164-V522 HydrophobicContact CE1-CG1 4.33Å; Y164-F526 AromaticContact CD1-CD2 3.92Å; Y164-F526 HydrophobicContact CD1-CD2 3.92Å; Y164-F526 AromaticContact CD1-CE2 3.36Å; Y164-F526 HydrophobicContact CD1-CE2 3.36Å; Y164-F526 AromaticContact CD1-CZ 3.88Å; Y164-F526 HydrophobicContact CD1-CZ 3.88Å; Y164-F526 HydrophobicContact CE1-CD2 4.1Å; Y164-F526 AromaticContact CE1-CE2 3.99Å; Y164-F526 HydrophobicContact CE1-CE2 3.99Å; Y164-F526 HydrophobicContact CG-CE2 4.23Å
165	G	89.9	Confident	86.9	Confident	17 Å²	17	54.8 Å²	54.8	18%	0.175	27%	0.274	C	S	.	.	H	α-helix	trans	-61.8	-28.2	177.5	0	0	0	0	0	113.3	S161 K162 D163 R169	S161-G165 PolarHBondContact O-N 3Å; K162-G165 PolarHBondContact O-N 3.39Å; D163-G165 PolarHBondContact O-N 2.99Å; G165-R169 WeakPolarHBondContact O-CG 3.48Å; G165-R169 PolarHBondContact O-N 2.81Å; G165-R169 PolarHBondContact O-NE 3.4Å
166	T	91.3	Very high	87.9	Confident	46 Å²	46	56.3 Å²	56.3	28%	0.282	28%	0.278	S	S	.	.	H	α-helix	trans	-72.5	-46.5	172.7	-59.3	0	0	0	0	111.6	K162 D163 Y164 L168 R169 D170	K162-T166 PolarHBondContact O-N 2.92Å; K162-T166 PolarHBondContact O-OG1 3.28Å; D163-T166 WeakPolarHBondContact O-CB 3.48Å; D163-T166 PolarHBondContact O-N 3.49Å; D163-T166 VanDerWaalsContact O-N 3.16Å; Y164-T166 PolarHBondContact O-N 3.48Å; T166-L168 VanDerWaalsContact C-N 3.34Å; T166-L168 PolarHBondContact O-N 2.79Å; T166-R169 WeakPolarHBondContact O-CB 3.05Å; T166-R169 PolarHBondContact O-N 3.03Å; T166-R169 VanDerWaalsContact O-N 3.14Å; T166-R169 PolarHBondContact OG1-NH2 3.49Å; T166-D170 PolarHBondContact O-N 3.24Å
167	K	92.6	Very high	88.9	Confident	38 Å²	38	58.2 Å²	58.2	17%	0.165	29%	0.286	C	S	.	.	H	α-helix	trans	-67.8	-32.2	176.7	-65.5	-48.7	-179.1	-176.9	0	113.6	D163 Y164 R169 D170 V171 E249 I250 M253	D163-K167 PolarHBondContact O-N 2.91Å; Y164-K167 PolarHBondContact O-N 3.42Å; Y164-K167 VanDerWaalsContact O-N 3.15Å; K167-R169 PolarHBondContact O-N 3.22Å; K167-D170 VanDerWaalsContact CD-OD2 3.26Å; K167-D170 WeakPolarHBondContact CD-OD2 3.45Å; K167-D170 IonicContact NZ-OD2 2.68Å; K167-D170 PolarHBondContact NZ-OD2 3.05Å; K167-D170 VanDerWaalsContact NZ-OD2 3.12Å; K167-D170 WeakPolarHBondContact O-CB 3.31Å; K167-D170 PolarHBondContact O-N 3.28Å; K167-D170 VanDerWaalsContact O-N 3.1Å; K167-V171 WeakPolarHBondContact O-CG2 3.15Å; K167-V171 PolarHBondContact O-N 3.21Å; K167-E249 HydrophobicContact CD-CB 4.16Å; K167-E249 WeakPolarHBondContact CE-OE2 3.34Å; K167-E249 IonicContact NZ-OE2 2.69Å; K167-E249 PolarHBondContact NZ-OE2 3.27Å; K167-I250 HydrophobicContact CB-CB 3.85Å; K167-I250 HydrophobicContact CB-CD1 4.21Å; K167-I250 HydrophobicContact CB-CG1 3.78Å; K167-M253 HydrophobicContact CB-SD 4.03Å; K167-M253 HydrophobicContact CG-CE 3.84Å; K167-M253 HydrophobicContact CG-SD 3.44Å; K167-M253 WeakPolarHBondContact CG-SD 3.26Å
168	L	94.6	Very high	90	Very high	15 Å²	15	52.6 Å²	52.6	8%	0.079	26%	0.259	C	S	.	.	H	α-helix	trans	-61.5	-33.8	172.4	-168.2	65.5	0	0	0	112	Y164 T166 V171 G172 I250 L442 L519 V522 F526	Y164-L168 HydrophobicContact CE1-CB 4.33Å; Y164-L168 HydrophobicContact CE1-CD1 4.32Å; Y164-L168 HydrophobicContact CE1-CD2 4.25Å; Y164-L168 WeakPolarHBondContact O-CB 3.42Å; Y164-L168 PolarHBondContact O-N 3.39Å; T166-L168 VanDerWaalsContact C-N 3.34Å; T166-L168 PolarHBondContact O-N 2.79Å; L168-V171 WeakPolarHBondContact O-CB 3.29Å; L168-V171 PolarHBondContact O-N 2.87Å; L168-G172 PolarHBondContact O-N 2.76Å; L168-G172 VanDerWaalsContact O-N 3.14Å; L168-I250 HydrophobicContact CB-CD1 4.34Å; L168-I250 HydrophobicContact CD1-CD1 4.17Å; L168-L442 HydrophobicContact CD1-CD2 3.6Å; L168-L519 HydrophobicContact CD1-CD1 3.62Å; L168-L519 HydrophobicContact CG-CD1 4.02Å; L168-V522 HydrophobicContact CD1-CG1 3.81Å; L168-V522 HydrophobicContact CD2-CG1 4.02Å; L168-F526 HydrophobicContact CD2-CB 4.47Å; L168-F526 HydrophobicContact CD2-CG 4.46Å
169	R	94	Very high	91	Very high	168 Å²	168	48 Å²	48	63%	0.634	25%	0.245	S	C	*	.	H	α-helix	trans	-69.7	-38.5	172.5	-71.1	178.5	-69.6	147.5	-1.8	112.4	G165 T166 K167 V171 G172 E173	G165-R169 WeakPolarHBondContact O-CG 3.48Å; G165-R169 PolarHBondContact O-N 2.81Å; G165-R169 PolarHBondContact O-NE 3.4Å; T166-R169 WeakPolarHBondContact O-CB 3.05Å; T166-R169 PolarHBondContact O-N 3.03Å; T166-R169 VanDerWaalsContact O-N 3.14Å; T166-R169 PolarHBondContact OG1-NH2 3.49Å; K167-R169 PolarHBondContact O-N 3.22Å; R169-V171 VanDerWaalsContact C-N 3.25Å; R169-V171 PolarHBondContact O-N 3.46Å; R169-G172 WeakPolarHBondContact O-CA 3.21Å; R169-G172 PolarHBondContact O-N 2.73Å; R169-G172 VanDerWaalsContact O-N 3.08Å; R169-E173 PolarHBondContact O-N 2.98Å
170	D	95.3	Very high	91.8	Very high	25 Å²	25	52.3 Å²	52.3	13%	0.134	27%	0.265	C	S	.	.	H	α-helix	trans	-59.8	-38.4	173.7	-67.3	-20.9	0	0	0	110.9	T166 K167 E173 F174 R246	T166-D170 PolarHBondContact O-N 3.24Å; K167-D170 VanDerWaalsContact CD-OD2 3.26Å; K167-D170 WeakPolarHBondContact CD-OD2 3.45Å; K167-D170 IonicContact NZ-OD2 2.68Å; K167-D170 PolarHBondContact NZ-OD2 3.05Å; K167-D170 VanDerWaalsContact NZ-OD2 3.12Å; K167-D170 WeakPolarHBondContact O-CB 3.31Å; K167-D170 PolarHBondContact O-N 3.28Å; K167-D170 VanDerWaalsContact O-N 3.1Å; D170-E173 PolarHBondContact O-N 3.17Å; D170-F174 PolarHBondContact O-N 3.32Å; D170-R246 HydrophobicContact CB-CB 4.32Å
171	V	95.9	Very high	92.8	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62.3	-42.9	172.4	179.7	0	0	0	0	111.4	K167 L168 R169 F174 V175 A247 I250 L442 L446 L519	K167-V171 WeakPolarHBondContact O-CG2 3.15Å; K167-V171 PolarHBondContact O-N 3.21Å; L168-V171 WeakPolarHBondContact O-CB 3.29Å; L168-V171 PolarHBondContact O-N 2.87Å; R169-V171 VanDerWaalsContact C-N 3.25Å; R169-V171 PolarHBondContact O-N 3.46Å; V171-F174 WeakPolarHBondContact O-CB 3.25Å; V171-F174 PolarHBondContact O-N 2.89Å; V171-V175 WeakPolarHBondContact O-CG2 3.34Å; V171-V175 PolarHBondContact O-N 3.03Å; V171-A247 HydrophobicContact CB-CB 4.47Å; V171-A247 HydrophobicContact CG2-CB 4.05Å; V171-I250 HydrophobicContact CG2-CB 4.4Å; V171-I250 HydrophobicContact CG2-CD1 3.93Å; V171-I250 HydrophobicContact CG2-CG2 4.16Å; V171-L442 HydrophobicContact CG1-CD1 4.24Å; V171-L446 HydrophobicContact CB-CD1 4.45Å; V171-L446 HydrophobicContact CG1-CD1 4.01Å; V171-L446 HydrophobicContact CG1-CD2 4.39Å; V171-L446 HydrophobicContact CG2-CD1 3.52Å; V171-L519 HydrophobicContact CB-CD1 4.33Å; V171-L519 HydrophobicContact CG1-CD1 4.08Å
172	G	95.8	Very high	93.5	Very high	22 Å²	22	49.8 Å²	49.8	23%	0.227	25%	0.249	C	C	.	.	H	α-helix	trans	-65.2	-39.9	175.7	0	0	0	0	0	114	L168 R169 F174 V175 N176 L519	L168-G172 PolarHBondContact O-N 2.76Å; L168-G172 VanDerWaalsContact O-N 3.14Å; R169-G172 WeakPolarHBondContact O-CA 3.21Å; R169-G172 PolarHBondContact O-N 2.73Å; R169-G172 VanDerWaalsContact O-N 3.08Å; G172-F174 VanDerWaalsContact C-N 3.31Å; G172-F174 PolarHBondContact O-N 2.85Å; G172-V175 PolarHBondContact O-N 2.74Å; G172-N176 WeakPolarHBondContact O-CB 3.25Å; G172-N176 PolarHBondContact O-N 3.04Å; G172-L519 VanDerWaalsContact CA-CD2 3.44Å
173	E	96.3	Very high	93.9	Very high	85 Å²	85	50 Å²	50	40%	0.397	25%	0.252	S	S	.	.	H	α-helix	trans	-61.6	-42.2	172.9	-170.7	-173.9	172.6	0	0	110.9	R169 D170 N176 K177 V243 R246	R169-E173 PolarHBondContact O-N 2.98Å; D170-E173 PolarHBondContact O-N 3.17Å; E173-N176 PolarHBondContact O-N 3.18Å; E173-K177 WeakPolarHBondContact O-CB 3.49Å; E173-K177 PolarHBondContact O-N 3.11Å; E173-V243 HydrophobicContact CG-CG1 4.29Å; E173-R246 IonicContact OE1-NH2 3.75Å; E173-R246 PolarHBondContact OE1-NH2 3.5Å; E173-R246 IonicContact OE2-CZ 3Å; E173-R246 IonicContact OE2-NH2 2.72Å; E173-R246 PolarHBondContact OE2-NH2 2.84Å
174	F	96.2	Very high	94.3	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-59.3	-52.1	175.3	163.6	-121.5	0	0	0	112.5	D170 V171 G172 N176 K177 F178 V240 V243 L244 A247 L446 L508 M512	D170-F174 PolarHBondContact O-N 3.32Å; V171-F174 WeakPolarHBondContact O-CB 3.25Å; V171-F174 PolarHBondContact O-N 2.89Å; G172-F174 VanDerWaalsContact C-N 3.31Å; G172-F174 PolarHBondContact O-N 2.85Å; F174-N176 VanDerWaalsContact C-N 3.31Å; F174-N176 PolarHBondContact O-N 3.27Å; F174-K177 PolarHBondContact O-N 3.03Å; F174-F178 HydrophobicContact CE2-CB 4.28Å; F174-F178 WeakPolarHBondContact O-CB 3.29Å; F174-F178 PolarHBondContact O-N 3.49Å; F174-V240 HydrophobicContact CD2-CG1 4.48Å; F174-V240 HydrophobicContact CE2-CG1 4.03Å; F174-V243 HydrophobicContact CB-CB 4.33Å; F174-V243 HydrophobicContact CB-CG2 4.1Å; F174-V243 HydrophobicContact CD2-CG2 3.96Å; F174-L244 HydrophobicContact CD1-CD1 4.29Å; F174-L244 HydrophobicContact CD2-CB 3.84Å; F174-L244 HydrophobicContact CD2-CD1 4.42Å; F174-L244 HydrophobicContact CE1-CD1 3.81Å; F174-L244 HydrophobicContact CE2-CB 3.7Å; F174-L244 HydrophobicContact CE2-CD1 3.95Å; F174-L244 HydrophobicContact CE2-CG 4.25Å; F174-L244 HydrophobicContact CG-CB 4.49Å; F174-L244 HydrophobicContact CZ-CB 4.26Å; F174-L244 HydrophobicContact CZ-CD1 3.6Å; F174-L244 HydrophobicContact CZ-CG 4.33Å; F174-A247 HydrophobicContact CB-CB 3.77Å; F174-A247 HydrophobicContact CD1-CB 4.18Å; F174-A247 HydrophobicContact CG-CB 4.17Å; F174-L446 HydrophobicContact CD1-CD2 3.97Å; F174-L446 HydrophobicContact CE1-CD2 3.92Å; F174-L508 HydrophobicContact CE2-CD2 4.5Å; F174-L508 HydrophobicContact CZ-CD1 3.87Å; F174-L508 HydrophobicContact CZ-CD2 4.28Å; F174-M512 HydrophobicContact CE1-CE 4.14Å; F174-M512 HydrophobicContact CE1-SD 3.84Å; F174-M512 HydrophobicContact CZ-CE 4.27Å; F174-M512 HydrophobicContact CZ-SD 3.9Å
175	V	95.3	Very high	94.6	Very high	22 Å²	22	53.9 Å²	53.9	13%	0.133	26%	0.263	C	S	.	.	H	α-helix	trans	-57.8	-46	179.5	172	0	0	0	0	110.6	V171 G172 T179 L519	V171-V175 WeakPolarHBondContact O-CG2 3.34Å; V171-V175 PolarHBondContact O-N 3.03Å; G172-V175 PolarHBondContact O-N 2.74Å; V175-T179 PolarHBondContact O-N 3.5Å; V175-T179 VanDerWaalsContact O-N 3.11Å; V175-T179 PolarHBondContact O-OG1 2.83Å; V175-L519 HydrophobicContact CB-CD2 4.48Å; V175-L519 HydrophobicContact CG2-CD2 4.24Å
176	N	94.9	Very high	94.8	Very high	93 Å²	93	53.7 Å²	53.7	50%	0.497	26%	0.257	S	S	.	.	H	α-helix	trans	-65.1	-46.2	179.6	-173.3	17.6	0	0	0	112.2	G172 E173 F174 F178 T179 Q180	G172-N176 WeakPolarHBondContact O-CB 3.25Å; G172-N176 PolarHBondContact O-N 3.04Å; E173-N176 PolarHBondContact O-N 3.18Å; F174-N176 VanDerWaalsContact C-N 3.31Å; F174-N176 PolarHBondContact O-N 3.27Å; N176-F178 PolarHBondContact O-N 3.01Å; N176-T179 PolarHBondContact O-N 2.9Å; N176-Q180 VanDerWaalsContact CG-NE2 3.3Å; N176-Q180 PolarHBondContact ND2-NE2 3.22Å; N176-Q180 WeakPolarHBondContact O-CG 3.33Å; N176-Q180 PolarHBondContact O-N 3.39Å; N176-Q180 PolarHBondContact OD1-NE2 3.24Å
177	K	95.4	Very high	95	Very high	50 Å²	50	56.6 Å²	56.6	22%	0.217	28%	0.276	C	S	.	.	H	α-helix	trans	-65.2	-40.8	-179.7	-169.7	66	166.5	-172.2	0	111.7	E173 F174 Q180 I181 V243	E173-K177 WeakPolarHBondContact O-CB 3.49Å; E173-K177 PolarHBondContact O-N 3.11Å; F174-K177 PolarHBondContact O-N 3.03Å; K177-Q180 PolarHBondContact O-N 3.43Å; K177-I181 HydrophobicContact CD-CG1 4.47Å; K177-I181 HydrophobicContact CG-CG1 4.49Å; K177-I181 WeakPolarHBondContact O-CB 3.48Å; K177-I181 VanDerWaalsContact O-CG1 3.3Å; K177-I181 WeakPolarHBondContact O-CG1 3.23Å; K177-I181 PolarHBondContact O-N 3.45Å; K177-V243 HydrophobicContact CB-CG2 3.89Å; K177-V243 HydrophobicContact CG-CG2 4Å
178	F	95.6	Very high	95	Very high	5 Å²	5	59.1 Å²	59.1	2%	0.022	29%	0.288	C	S	.	.	H	α-helix	trans	-57.6	-52	174	175	-85.1	0	0	0	110.2	F174 N176 Q180 I181 H182 V240 F505 L508 Q509 M512	F174-F178 HydrophobicContact CE2-CB 4.28Å; F174-F178 WeakPolarHBondContact O-CB 3.29Å; F174-F178 PolarHBondContact O-N 3.49Å; N176-F178 PolarHBondContact O-N 3.01Å; F178-Q180 VanDerWaalsContact C-N 3.34Å; F178-Q180 PolarHBondContact O-N 2.53Å; F178-I181 PolarHBondContact O-N 3.25Å; F178-H182 HydrophobicContact CD1-CB 4.22Å; F178-H182 HydrophobicContact CE1-CB 3.86Å; F178-H182 HydrophobicContact CZ-CB 4.13Å; F178-H182 AromaticContact CZ-CD2 3.77Å; F178-H182 WeakPolarHBondContact O-CB 3.24Å; F178-H182 PolarHBondContact O-N 3.45Å; F178-V240 HydrophobicContact CB-CG1 4.23Å; F178-V240 HydrophobicContact CD2-CG1 3.92Å; F178-F505 HydrophobicContact CD2-CE2 4.12Å; F178-F505 AromaticContact CD2-CZ 3.99Å; F178-F505 HydrophobicContact CD2-CZ 3.99Å; F178-F505 HydrophobicContact CE2-CD1 4.23Å; F178-F505 HydrophobicContact CE2-CD2 4.19Å; F178-F505 AromaticContact CE2-CE1 3.76Å; F178-F505 HydrophobicContact CE2-CE1 3.76Å; F178-F505 AromaticContact CE2-CE2 3.66Å; F178-F505 HydrophobicContact CE2-CE2 3.66Å; F178-F505 HydrophobicContact CE2-CG 4.46Å; F178-F505 AromaticContact CE2-CZ 3.43Å; F178-F505 HydrophobicContact CE2-CZ 3.43Å; F178-F505 VanDerWaalsContact CE2-CZ 3.43Å; F178-F505 HydrophobicContact CZ-CD1 4.47Å; F178-F505 HydrophobicContact CZ-CE1 4.03Å; F178-F505 HydrophobicContact CZ-CZ 4.12Å; F178-L508 HydrophobicContact CD2-CD2 3.5Å; F178-L508 VanDerWaalsContact CD2-CD2 3.5Å; F178-L508 HydrophobicContact CD2-CG 3.91Å; F178-L508 HydrophobicContact CE2-CB 4.2Å; F178-L508 HydrophobicContact CE2-CD2 3.38Å; F178-L508 HydrophobicContact CE2-CG 3.53Å; F178-L508 HydrophobicContact CZ-CD2 4.42Å; F178-L508 HydrophobicContact CZ-CG 4.13Å; F178-Q509 HydrophobicContact CE1-CB 4.32Å; F178-Q509 HydrophobicContact CZ-CB 3.9Å; F178-M512 HydrophobicContact CD1-CB 4.24Å; F178-M512 HydrophobicContact CD1-CG 3.36Å; F178-M512 HydrophobicContact CD1-SD 4.33Å; F178-M512 HydrophobicContact CD2-CG 4.42Å; F178-M512 HydrophobicContact CE1-CB 4.18Å; F178-M512 HydrophobicContact CE1-CG 3.47Å; F178-M512 VanDerWaalsContact CE1-CG 3.47Å; F178-M512 HydrophobicContact CG-CG 3.86Å; F178-M512 HydrophobicContact CG-SD 4.31Å; F178-M512 HydrophobicContact CZ-CG 4.08Å
179	T	94	Very high	95	Very high	68 Å²	68	58.4 Å²	58.4	42%	0.417	28%	0.284	S	S	.	.	H	α-helix	trans	-57.7	-46	-178.3	-59.9	0	0	0	0	111.6	V175 N176 I181 H182 E183	V175-T179 PolarHBondContact O-N 3.5Å; V175-T179 VanDerWaalsContact O-N 3.11Å; V175-T179 PolarHBondContact O-OG1 2.83Å; N176-T179 PolarHBondContact O-N 2.9Å; T179-I181 PolarHBondContact O-N 2.84Å; T179-H182 PolarHBondContact O-N 2.91Å; T179-E183 VanDerWaalsContact O-CB 3.31Å; T179-E183 WeakPolarHBondContact O-CB 3.35Å; T179-E183 PolarHBondContact O-N 3.42Å
180	Q	95.1	Very high	95	Very high	96 Å²	96	53.7 Å²	53.7	45%	0.449	27%	0.268	S	S	.	.	H	α-helix	trans	-62	-43.9	178	-71	174.6	35.9	0	0	113.1	N176 K177 F178 K184	N176-Q180 VanDerWaalsContact CG-NE2 3.3Å; N176-Q180 PolarHBondContact ND2-NE2 3.22Å; N176-Q180 WeakPolarHBondContact O-CG 3.33Å; N176-Q180 PolarHBondContact O-N 3.39Å; N176-Q180 PolarHBondContact OD1-NE2 3.24Å; K177-Q180 PolarHBondContact O-N 3.43Å; F178-Q180 VanDerWaalsContact C-N 3.34Å; F178-Q180 PolarHBondContact O-N 2.53Å; Q180-K184 VanDerWaalsContact O-CB 3.29Å; Q180-K184 WeakPolarHBondContact O-CB 3.3Å; Q180-K184 PolarHBondContact O-N 2.67Å
181	I	95.4	Very high	95	Very high	9 Å²	9	58.5 Å²	58.5	5%	0.046	29%	0.288	C	S	.	.	H	α-helix	trans	-73.6	-38.9	-178.7	-64.8	-60.8	0	0	0	110.8	K177 F178 T179 Y185 F237 V240	K177-I181 HydrophobicContact CD-CG1 4.47Å; K177-I181 HydrophobicContact CG-CG1 4.49Å; K177-I181 WeakPolarHBondContact O-CB 3.48Å; K177-I181 VanDerWaalsContact O-CG1 3.3Å; K177-I181 WeakPolarHBondContact O-CG1 3.23Å; K177-I181 PolarHBondContact O-N 3.45Å; F178-I181 PolarHBondContact O-N 3.25Å; T179-I181 PolarHBondContact O-N 2.84Å; I181-Y185 HydrophobicContact CD1-CD2 3.86Å; I181-Y185 HydrophobicContact CD1-CE2 3.87Å; I181-Y185 HydrophobicContact CG2-CD2 4.29Å; I181-Y185 WeakPolarHBondContact O-CB 3.33Å; I181-Y185 PolarHBondContact O-N 2.98Å; I181-F237 HydrophobicContact CG2-CD1 3.97Å; I181-F237 HydrophobicContact CG2-CE1 3.93Å; I181-F237 HydrophobicContact CG2-CG 4.33Å; I181-F237 HydrophobicContact CG2-CZ 4.24Å; I181-V240 HydrophobicContact CB-CG2 3.64Å; I181-V240 HydrophobicContact CG1-CG2 3.7Å; I181-V240 HydrophobicContact CG2-CG2 3.76Å
182	H	94.1	Very high	94.9	Very high	33 Å²	33	61.2 Å²	61.2	15%	0.153	30%	0.299	C	S	.	.	H	α-helix	trans	-60	-55.1	176.2	179.4	-77.4	0	0	0	110.5	F178 T179 K184 W186 F505 Q509	F178-H182 HydrophobicContact CD1-CB 4.22Å; F178-H182 HydrophobicContact CE1-CB 3.86Å; F178-H182 HydrophobicContact CZ-CB 4.13Å; F178-H182 AromaticContact CZ-CD2 3.77Å; F178-H182 WeakPolarHBondContact O-CB 3.24Å; F178-H182 PolarHBondContact O-N 3.45Å; T179-H182 PolarHBondContact O-N 2.91Å; H182-K184 VanDerWaalsContact C-N 3.27Å; H182-K184 PolarHBondContact O-N 3.47Å; H182-W186 AromaticContact CD2-CD1 3.84Å; H182-W186 AromaticContact CD2-CG 3.84Å; H182-W186 AromaticContact CE1-CD1 3.92Å; H182-W186 AromaticContact NE2-CD1 3.31Å; H182-W186 VanDerWaalsContact NE2-CD1 3.31Å; H182-W186 AromaticContact NE2-CG 3.78Å; H182-W186 AromaticContact NE2-NE1 3.89Å; H182-W186 WeakPolarHBondContact O-CB 3.45Å; H182-W186 PolarHBondContact O-N 3.49Å; H182-W186 VanDerWaalsContact O-N 3.11Å; H182-F505 HydrophobicContact CB-CE1 4.34Å; H182-F505 AromaticContact CD2-CE1 3.64Å; H182-Q509 PolarHBondContact CE1-NE2 3.14Å; H182-Q509 VanDerWaalsContact CE1-NE2 3.31Å; H182-Q509 PolarHBondContact NE2-NE2 3.08Å; H182-Q509 PolarHBondContact NE2-OE1 3Å
183	E	93.6	Very high	94.7	Very high	159 Å²	159	60.2 Å²	60.2	74%	0.743	29%	0.288	S	S	*	.	H	α-helix	trans	-59.1	-38.7	-177.7	-174.2	178.5	-177.2	0	0	112.6	T179	T179-E183 VanDerWaalsContact O-CB 3.31Å; T179-E183 WeakPolarHBondContact O-CB 3.35Å; T179-E183 PolarHBondContact O-N 3.42Å
184	K	95.2	Very high	94.4	Very high	130 Å²	130	59.7 Å²	59.7	57%	0.565	29%	0.288	S	S	*	.	H	α-helix	trans	-91	-30.4	-171.4	-171.1	171.8	177.5	-167	0	115.2	Q180 H182	Q180-K184 VanDerWaalsContact O-CB 3.29Å; Q180-K184 WeakPolarHBondContact O-CB 3.3Å; Q180-K184 PolarHBondContact O-N 2.67Å; H182-K184 VanDerWaalsContact C-N 3.27Å; H182-K184 PolarHBondContact O-N 3.47Å
185	Y	95.5	Very high	94.2	Very high	50 Å²	50	61 Å²	61	20%	0.196	30%	0.295	C	S	.	.	H	α-helix	trans	-131	-9	-166.9	-57.1	-71.1	0	0	0	114.3	I181 M189 Y236	I181-Y185 HydrophobicContact CD1-CD2 3.86Å; I181-Y185 HydrophobicContact CD1-CE2 3.87Å; I181-Y185 HydrophobicContact CG2-CD2 4.29Å; I181-Y185 WeakPolarHBondContact O-CB 3.33Å; I181-Y185 PolarHBondContact O-N 2.98Å; Y185-M189 VanDerWaalsContact O-CB 3.3Å; Y185-M189 WeakPolarHBondContact O-CB 3.11Å; Y185-M189 PolarHBondContact O-N 3.2Å; Y185-Y236 HydrophobicContact CD1-CD2 4.09Å; Y185-Y236 HydrophobicContact CD1-CE2 4.27Å; Y185-Y236 HydrophobicContact CD1-CG 4.29Å; Y185-Y236 HydrophobicContact CD2-CD1 4.21Å; Y185-Y236 HydrophobicContact CD2-CG 4.07Å; Y185-Y236 HydrophobicContact CE1-CD1 4.14Å; Y185-Y236 HydrophobicContact CE1-CD2 4.16Å; Y185-Y236 AromaticContact CE1-CE1 3.97Å; Y185-Y236 HydrophobicContact CE1-CE1 3.97Å; Y185-Y236 HydrophobicContact CE1-CE2 4Å; Y185-Y236 HydrophobicContact CE1-CG 4.24Å; Y185-Y236 AromaticContact CE1-CZ 3.9Å; Y185-Y236 AromaticContact CE2-CD1 3.71Å; Y185-Y236 HydrophobicContact CE2-CD1 3.71Å; Y185-Y236 HydrophobicContact CE2-CE1 4.15Å; Y185-Y236 HydrophobicContact CE2-CG 4.04Å; Y185-Y236 HydrophobicContact CG-CD2 4.33Å; Y185-Y236 HydrophobicContact CG-CG 4.19Å; Y185-Y236 AromaticContact CZ-CD1 3.65Å; Y185-Y236 AromaticContact CZ-CE1 3.61Å; Y185-Y236 WeakPolarHBondContact OH-CE1 3.45Å
186	W	94.8	Very high	93.8	Very high	13 Å²	13	60 Å²	60	5%	0.049	29%	0.289	C	S	.	.	H	α-helix	trans	-66.9	-44.1	-173.7	179.1	-124.5	0	0	0	113.3	H182 E188 M189 K190 F237 F501 V502 F505 E506	H182-W186 AromaticContact CD2-CD1 3.84Å; H182-W186 AromaticContact CD2-CG 3.84Å; H182-W186 AromaticContact CE1-CD1 3.92Å; H182-W186 AromaticContact NE2-CD1 3.31Å; H182-W186 VanDerWaalsContact NE2-CD1 3.31Å; H182-W186 AromaticContact NE2-CG 3.78Å; H182-W186 AromaticContact NE2-NE1 3.89Å; H182-W186 WeakPolarHBondContact O-CB 3.45Å; H182-W186 PolarHBondContact O-N 3.49Å; H182-W186 VanDerWaalsContact O-N 3.11Å; W186-E188 VanDerWaalsContact C-N 3.33Å; W186-E188 PolarHBondContact O-N 3.06Å; W186-M189 HydrophobicContact CE3-CB 4.44Å; W186-M189 PolarHBondContact O-N 3.47Å; W186-K190 HydrophobicContact CD2-CB 4.43Å; W186-K190 HydrophobicContact CH2-CB 4.5Å; W186-K190 HydrophobicContact CZ2-CB 4.17Å; W186-K190 HydrophobicContact CZ2-CD 4.21Å; W186-K190 HydrophobicContact CZ2-CG 4.44Å; W186-K190 VanDerWaalsContact O-CB 3.27Å; W186-K190 WeakPolarHBondContact O-CB 3.37Å; W186-K190 PolarHBondContact O-N 2.99Å; W186-F237 AromaticContact CE3-CE1 3.76Å; W186-F237 HydrophobicContact CE3-CE1 3.76Å; W186-F237 HydrophobicContact CE3-CZ 4.09Å; W186-F237 HydrophobicContact CZ3-CE1 4.27Å; W186-F501 HydrophobicContact CZ3-CD1 4.39Å; W186-F501 AromaticContact CZ3-CE1 3.86Å; W186-F501 HydrophobicContact CZ3-CE1 3.86Å; W186-V502 HydrophobicContact CH2-CG1 4.47Å; W186-V502 HydrophobicContact CZ2-CG1 4.41Å; W186-F505 HydrophobicContact CB-CE1 4.44Å; W186-F505 AromaticContact CD2-CD1 3.52Å; W186-F505 HydrophobicContact CD2-CD1 3.52Å; W186-F505 AromaticContact CD2-CE1 3.65Å; W186-F505 HydrophobicContact CD2-CE1 3.65Å; W186-F505 AromaticContact CE2-CD1 3.8Å; W186-F505 AromaticContact CE3-CD1 3.21Å; W186-F505 HydrophobicContact CE3-CD1 3.21Å; W186-F505 AromaticContact CE3-CE1 3.36Å; W186-F505 HydrophobicContact CE3-CE1 3.36Å; W186-F505 HydrophobicContact CE3-CG 4.01Å; W186-F505 HydrophobicContact CE3-CZ 4.3Å; W186-F505 HydrophobicContact CG-CD1 4.36Å; W186-F505 HydrophobicContact CG-CE1 4.12Å; W186-F505 HydrophobicContact CH2-CB 3.53Å; W186-F505 AromaticContact CH2-CD1 3.52Å; W186-F505 HydrophobicContact CH2-CD1 3.52Å; W186-F505 HydrophobicContact CH2-CE1 4.49Å; W186-F505 AromaticContact CH2-CG 3.8Å; W186-F505 HydrophobicContact CH2-CG 3.8Å; W186-F505 HydrophobicContact CZ2-CB 4.23Å; W186-F505 AromaticContact CZ2-CD1 3.84Å; W186-F505 HydrophobicContact CZ2-CD1 3.84Å; W186-F505 HydrophobicContact CZ2-CG 4.46Å; W186-F505 HydrophobicContact CZ3-CB 3.76Å; W186-F505 AromaticContact CZ3-CD1 3.2Å; W186-F505 HydrophobicContact CZ3-CD1 3.2Å; W186-F505 HydrophobicContact CZ3-CD2 4.42Å; W186-F505 AromaticContact CZ3-CE1 3.81Å; W186-F505 HydrophobicContact CZ3-CE1 3.81Å; W186-F505 AromaticContact CZ3-CG 3.55Å; W186-F505 HydrophobicContact CZ3-CG 3.55Å; W186-E506 HydrophobicContact CZ2-CG 3.77Å
187	T	94.8	Very high	93.3	Very high	108 Å²	108	57 Å²	57	66%	0.663	27%	0.272	S	S	*	.	H	α-helix	trans	-59.1	-46.6	-177.5	-57.3	0	0	0	0	111	K191	T187-K191 WeakPolarHBondContact O-CB 3.34Å; T187-K191 PolarHBondContact O-N 3.31Å; T187-K191 VanDerWaalsContact O-N 3.08Å
188	E	94.1	Very high	92.9	Very high	91 Å²	91	62.3 Å²	62.3	43%	0.425	29%	0.29	S	S	.	.	H	α-helix	trans	-66.1	-47	176.1	-68	86.7	167.3	0	0	111.8	W186 K190 K191 Y192	W186-E188 VanDerWaalsContact C-N 3.33Å; W186-E188 PolarHBondContact O-N 3.06Å; E188-K190 PolarHBondContact O-N 3.31Å; E188-K191 WeakPolarHBondContact O-CB 3.42Å; E188-K191 PolarHBondContact O-N 2.81Å; E188-Y192 HydrophobicContact CB-CE2 3.84Å; E188-Y192 WeakPolarHBondContact O-CD2 3.36Å; E188-Y192 PolarHBondContact O-N 3.46Å
189	M	93.7	Very high	92.3	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-60.8	-45.5	-179.9	-176.2	63.9	175	0	0	112.1	Y185 W186 K191 Y192 L193 V230 A233 V234 F237 F501	Y185-M189 VanDerWaalsContact O-CB 3.3Å; Y185-M189 WeakPolarHBondContact O-CB 3.11Å; Y185-M189 PolarHBondContact O-N 3.2Å; W186-M189 HydrophobicContact CE3-CB 4.44Å; W186-M189 PolarHBondContact O-N 3.47Å; M189-K191 VanDerWaalsContact C-N 3.34Å; M189-K191 PolarHBondContact O-N 2.87Å; M189-Y192 PolarHBondContact O-N 3.45Å; M189-L193 HydrophobicContact CE-CD1 3.91Å; M189-L193 HydrophobicContact CE-CD2 4.17Å; M189-L193 HydrophobicContact CE-CG 4.07Å; M189-L193 HydrophobicContact CG-CD1 4.19Å; M189-L193 WeakPolarHBondContact O-CG 3.43Å; M189-L193 PolarHBondContact O-N 3.48Å; M189-L193 HydrophobicContact SD-CG 4.45Å; M189-V230 HydrophobicContact CE-CG1 4.5Å; M189-A233 HydrophobicContact SD-CB 3.55Å; M189-A233 VanDerWaalsContact SD-CB 3.55Å; M189-V234 HydrophobicContact CE-CG2 4.32Å; M189-F237 HydrophobicContact CB-CD2 4.43Å; M189-F237 HydrophobicContact CB-CE1 4.38Å; M189-F237 HydrophobicContact CB-CE2 3.4Å; M189-F237 HydrophobicContact CB-CZ 3.36Å; M189-F237 HydrophobicContact CE-CD2 4.43Å; M189-F237 HydrophobicContact CG-CD2 3.99Å; M189-F237 HydrophobicContact CG-CE1 4.31Å; M189-F237 HydrophobicContact CG-CE2 3.41Å; M189-F237 VanDerWaalsContact CG-CE2 3.41Å; M189-F237 HydrophobicContact CG-CZ 3.59Å; M189-F237 HydrophobicContact SD-CD2 4.2Å; M189-F237 HydrophobicContact SD-CE2 3.97Å; M189-F501 HydrophobicContact CE-CE1 4.09Å; M189-F501 HydrophobicContact CE-CZ 4.48Å; M189-F501 HydrophobicContact CG-CE1 4.24Å
190	K	94.2	Very high	91.6	Very high	69 Å²	69	59.3 Å²	59.3	30%	0.3	27%	0.272	S	S	.	.	H	α-helix	trans	-58.6	-48.4	176	179.6	174.4	176.3	174.3	0	110.2	W186 E188 Y192 L193 D194 V502 E506	W186-K190 HydrophobicContact CD2-CB 4.43Å; W186-K190 HydrophobicContact CH2-CB 4.5Å; W186-K190 HydrophobicContact CZ2-CB 4.17Å; W186-K190 HydrophobicContact CZ2-CD 4.21Å; W186-K190 HydrophobicContact CZ2-CG 4.44Å; W186-K190 VanDerWaalsContact O-CB 3.27Å; W186-K190 WeakPolarHBondContact O-CB 3.37Å; W186-K190 PolarHBondContact O-N 2.99Å; E188-K190 PolarHBondContact O-N 3.31Å; K190-Y192 VanDerWaalsContact C-N 3.33Å; K190-Y192 PolarHBondContact O-N 3.22Å; K190-L193 PolarHBondContact O-N 3.45Å; K190-D194 WeakPolarHBondContact O-CB 3.46Å; K190-D194 VanDerWaalsContact O-CG 3.27Å; K190-D194 PolarHBondContact O-N 3.05Å; K190-V502 HydrophobicContact CG-CG1 4.36Å; K190-E506 WeakPolarHBondContact CE-OE1 3.01Å; K190-E506 IonicContact NZ-OE1 2.78Å; K190-E506 PolarHBondContact NZ-OE1 2.9Å
191	K	94.2	Very high	90.7	Very high	126 Å²	126	58.6 Å²	58.6	55%	0.548	27%	0.274	S	S	.	.	H	α-helix	trans	-56.1	-46.3	175.3	-179.9	-177.9	176	-178.1	0	111.9	T187 E188 M189 L193 D194 D195	T187-K191 WeakPolarHBondContact O-CB 3.34Å; T187-K191 PolarHBondContact O-N 3.31Å; T187-K191 VanDerWaalsContact O-N 3.08Å; E188-K191 WeakPolarHBondContact O-CB 3.42Å; E188-K191 PolarHBondContact O-N 2.81Å; M189-K191 VanDerWaalsContact C-N 3.34Å; M189-K191 PolarHBondContact O-N 2.87Å; K191-L193 PolarHBondContact O-N 2.93Å; K191-D194 PolarHBondContact O-N 3.42Å; K191-D195 WeakPolarHBondContact O-CB 3.46Å; K191-D195 PolarHBondContact O-N 3.26Å
192	Y	93.9	Very high	90	Very high	57 Å²	57	62.7 Å²	62.7	22%	0.224	29%	0.293	C	S	.	.	H	α-helix	trans	-64.9	-40	-179.6	-57.8	-31.1	0	0	0	112.4	E188 M189 K190 M196 N229 A233	E188-Y192 HydrophobicContact CB-CE2 3.84Å; E188-Y192 WeakPolarHBondContact O-CD2 3.36Å; E188-Y192 PolarHBondContact O-N 3.46Å; M189-Y192 PolarHBondContact O-N 3.45Å; K190-Y192 VanDerWaalsContact C-N 3.33Å; K190-Y192 PolarHBondContact O-N 3.22Å; Y192-M196 WeakPolarHBondContact O-CB 3.31Å; Y192-M196 PolarHBondContact O-N 3.04Å; Y192-N229 HydrophobicContact CD1-CB 3.83Å; Y192-N229 HydrophobicContact CD2-CB 3.81Å; Y192-N229 HydrophobicContact CE1-CB 3.85Å; Y192-N229 HydrophobicContact CE2-CB 3.82Å; Y192-N229 HydrophobicContact CG-CB 3.83Å; Y192-A233 HydrophobicContact CD2-CB 4.37Å
193	L	91.7	Very high	89.2	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-69.4	-36.4	175.6	-69.2	176	0	0	0	112.4	M189 K190 K191 M196 H197 V230 A498 F501 V502	M189-L193 HydrophobicContact CE-CD1 3.91Å; M189-L193 HydrophobicContact CE-CD2 4.17Å; M189-L193 HydrophobicContact CE-CG 4.07Å; M189-L193 HydrophobicContact CG-CD1 4.19Å; M189-L193 WeakPolarHBondContact O-CG 3.43Å; M189-L193 PolarHBondContact O-N 3.48Å; M189-L193 HydrophobicContact SD-CG 4.45Å; K190-L193 PolarHBondContact O-N 3.45Å; K191-L193 PolarHBondContact O-N 2.93Å; L193-M196 HydrophobicContact CD2-CE 3.62Å; L193-M196 PolarHBondContact O-N 2.82Å; L193-H197 VanDerWaalsContact O-CB 3.27Å; L193-H197 WeakPolarHBondContact O-CB 3.41Å; L193-H197 PolarHBondContact O-N 2.79Å; L193-V230 HydrophobicContact CD2-CG1 4.1Å; L193-V230 HydrophobicContact CD2-CG2 4.35Å; L193-A498 HydrophobicContact CD2-CB 4.19Å; L193-F501 HydrophobicContact CD1-CB 4.48Å; L193-F501 HydrophobicContact CD1-CD1 3.35Å; L193-F501 HydrophobicContact CD1-CE1 3.9Å; L193-F501 HydrophobicContact CD1-CG 4.25Å; L193-V502 HydrophobicContact CB-CG2 3.91Å; L193-V502 HydrophobicContact CD1-CG2 3.72Å
194	D	91	Very high	88.1	Confident	74 Å²	74	57.8 Å²	57.8	40%	0.396	28%	0.276	S	S	.	.	H	α-helix	trans	-68.8	-42.5	175.1	-73.4	-22.1	0	0	0	111.5	K190 K191 H197 R198	K190-D194 WeakPolarHBondContact O-CB 3.46Å; K190-D194 VanDerWaalsContact O-CG 3.27Å; K190-D194 PolarHBondContact O-N 3.05Å; K191-D194 PolarHBondContact O-N 3.42Å; D194-H197 CarbonylContact O-C 3.54Å; D194-H197 WeakPolarHBondContact O-CB 3.28Å; D194-H197 PolarHBondContact O-N 3.49Å; D194-R198 PolarHBondContact O-N 2.97Å
195	D	91	Very high	86.7	Confident	26 Å²	26	54.8 Å²	54.8	14%	0.139	27%	0.268	C	S	.	.	H	α-helix	trans	-62.7	-45.1	173.5	-77.4	-31	0	0	0	110.2	K191 H197 R198 I199 T226	K191-D195 WeakPolarHBondContact O-CB 3.46Å; K191-D195 PolarHBondContact O-N 3.26Å; D195-H197 VanDerWaalsContact C-N 3.25Å; D195-H197 PolarHBondContact O-N 3.27Å; D195-R198 PolarHBondContact O-N 3.04Å; D195-R198 VanDerWaalsContact O-N 3.14Å; D195-R198 IonicContact OD1-CZ 2.86Å; D195-R198 IonicContact OD1-NH1 3.05Å; D195-R198 PolarHBondContact OD1-NH1 2.83Å; D195-R198 IonicContact OD1-NH2 3.19Å; D195-R198 PolarHBondContact OD1-NH2 2.88Å; D195-I199 VanDerWaalsContact O-CG1 3.27Å; D195-I199 WeakPolarHBondContact O-CG1 3.39Å; D195-I199 PolarHBondContact O-N 2.83Å; D195-T226 HydrophobicContact CB-CG2 3.82Å
196	M	88.2	Confident	85.3	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-57.8	-41.1	173.4	-166.4	179.8	63.6	0	0	111	Y192 L193 I199 F200 T226 F227 V230 F458 A498	Y192-M196 WeakPolarHBondContact O-CB 3.31Å; Y192-M196 PolarHBondContact O-N 3.04Å; L193-M196 HydrophobicContact CD2-CE 3.62Å; L193-M196 PolarHBondContact O-N 2.82Å; M196-I199 WeakPolarHBondContact O-CB 3.44Å; M196-I199 PolarHBondContact O-N 3.29Å; M196-F200 HydrophobicContact CB-CE2 4.42Å; M196-F200 HydrophobicContact CE-CE2 3.86Å; M196-F200 HydrophobicContact CE-CZ 4.47Å; M196-F200 HydrophobicContact CG-CD2 4.17Å; M196-F200 HydrophobicContact CG-CE2 3.46Å; M196-F200 VanDerWaalsContact CG-CE2 3.46Å; M196-F200 HydrophobicContact CG-CZ 3.84Å; M196-F200 WeakPolarHBondContact O-CD2 3.24Å; M196-F200 VanDerWaalsContact O-CG 3.31Å; M196-F200 WeakPolarHBondContact O-CG 3.09Å; M196-F200 PolarHBondContact O-N 3.43Å; M196-F200 HydrophobicContact SD-CE2 3.97Å; M196-F200 HydrophobicContact SD-CZ 4.15Å; M196-T226 HydrophobicContact CB-CG2 4.08Å; M196-F227 HydrophobicContact CG-CD1 4Å; M196-F227 HydrophobicContact CG-CE1 3.8Å; M196-F227 HydrophobicContact SD-CD1 4.19Å; M196-F227 HydrophobicContact SD-CE1 4.4Å; M196-V230 HydrophobicContact CB-CG2 4.49Å; M196-V230 HydrophobicContact SD-CG1 4.45Å; M196-V230 HydrophobicContact SD-CG2 4.12Å; M196-F458 HydrophobicContact CE-CD1 4.03Å; M196-F458 HydrophobicContact CE-CE1 3.59Å; M196-F458 HydrophobicContact CE-CZ 4.25Å; M196-A498 HydrophobicContact CE-CB 3.5Å
197	H	84.7	Confident	84.1	Confident	32 Å²	32	64.8 Å²	64.8	15%	0.148	34%	0.335	C	S	.	.	H	α-helix	trans	-66.7	-37.7	175.6	-176.4	58.1	0	0	0	114.1	L193 D194 D195 F200 T201 R499	L193-H197 VanDerWaalsContact O-CB 3.27Å; L193-H197 WeakPolarHBondContact O-CB 3.41Å; L193-H197 PolarHBondContact O-N 2.79Å; D194-H197 CarbonylContact O-C 3.54Å; D194-H197 WeakPolarHBondContact O-CB 3.28Å; D194-H197 PolarHBondContact O-N 3.49Å; D195-H197 VanDerWaalsContact C-N 3.25Å; D195-H197 PolarHBondContact O-N 3.27Å; H197-F200 WeakPolarHBondContact O-CB 3.45Å; H197-F200 PolarHBondContact O-N 3.39Å; H197-T201 PolarHBondContact CE1-OG1 2.87Å; H197-T201 PolarHBondContact NE2-OG1 2.9Å; H197-T201 PolarHBondContact O-N 2.93Å; H197-T201 PolarHBondContact O-OG1 2.97Å; H197-R499 PolarHBondContact CE1-NE 2.95Å; H197-R499 PolarHBondContact CE1-NH2 2.64Å; H197-R499 PolarHBondContact NE2-NE 3.09Å; H197-R499 PolarHBondContact NE2-NH2 3.36Å
198	R	85.3	Confident	83.2	Confident	161 Å²	161	61.2 Å²	61.2	61%	0.608	31%	0.313	S	S	*	.	H	α-helix	trans	-64	-42.3	173.5	-174.3	174.9	67.7	-122.5	-7.4	111.1	D194 D195 F200 T201 H202	D194-R198 PolarHBondContact O-N 2.97Å; D195-R198 PolarHBondContact O-N 3.04Å; D195-R198 VanDerWaalsContact O-N 3.14Å; D195-R198 IonicContact OD1-CZ 2.86Å; D195-R198 IonicContact OD1-NH1 3.05Å; D195-R198 PolarHBondContact OD1-NH1 2.83Å; D195-R198 IonicContact OD1-NH2 3.19Å; D195-R198 PolarHBondContact OD1-NH2 2.88Å; R198-F200 VanDerWaalsContact C-N 3.33Å; R198-F200 PolarHBondContact O-N 3.4Å; R198-T201 PolarHBondContact O-N 3.38Å; R198-H202 WeakPolarHBondContact O-CB 3.45Å; R198-H202 PolarHBondContact O-N 3.41Å
199	I	84.2	Confident	82.6	Confident	7 Å²	7	60.6 Å²	60.6	4%	0.036	32%	0.316	C	S	.	.	H	α-helix	trans	-57.8	-49.7	173.9	-63.9	165	0	0	0	109.6	D195 M196 T201 H202 L203 Y223 T226 F227	D195-I199 VanDerWaalsContact O-CG1 3.27Å; D195-I199 WeakPolarHBondContact O-CG1 3.39Å; D195-I199 PolarHBondContact O-N 2.83Å; M196-I199 WeakPolarHBondContact O-CB 3.44Å; M196-I199 PolarHBondContact O-N 3.29Å; I199-T201 VanDerWaalsContact C-N 3.31Å; I199-T201 PolarHBondContact O-N 3.31Å; I199-H202 PolarHBondContact O-N 2.88Å; I199-L203 HydrophobicContact CG2-CD1 3.75Å; I199-L203 HydrophobicContact CG2-CG 4.37Å; I199-L203 VanDerWaalsContact O-CG 3.3Å; I199-L203 WeakPolarHBondContact O-CG 3.18Å; I199-L203 PolarHBondContact O-N 3.14Å; I199-L203 VanDerWaalsContact O-N 3.07Å; I199-Y223 HydrophobicContact CB-CD1 4.32Å; I199-Y223 HydrophobicContact CB-CE1 4.44Å; I199-Y223 HydrophobicContact CD1-CD1 3.48Å; I199-Y223 VanDerWaalsContact CD1-CD1 3.48Å; I199-Y223 HydrophobicContact CD1-CE1 4.25Å; I199-Y223 HydrophobicContact CD1-CG 3.86Å; I199-Y223 HydrophobicContact CG1-CD1 3.42Å; I199-Y223 VanDerWaalsContact CG1-CD1 3.42Å; I199-Y223 HydrophobicContact CG1-CE1 3.67Å; I199-Y223 HydrophobicContact CG1-CG 4Å; I199-Y223 HydrophobicContact CG2-CD1 3.97Å; I199-Y223 HydrophobicContact CG2-CD2 3.71Å; I199-Y223 HydrophobicContact CG2-CE1 4.19Å; I199-Y223 HydrophobicContact CG2-CE2 3.92Å; I199-Y223 HydrophobicContact CG2-CG 3.73Å; I199-T226 HydrophobicContact CD1-CG2 3.89Å; I199-F227 HydrophobicContact CG2-CZ 4.4Å
200	F	78.2	Confident	82.1	Confident	2 Å²	2	64.8 Å²	64.8	1%	0.009	34%	0.338	C	S	.	.	H	α-helix	trans	-55.1	-46.7	177.1	-70.9	-53.3	0	0	0	112.4	M196 H197 R198 H202 L203 V204 F487 N491 I495	M196-F200 HydrophobicContact CB-CE2 4.42Å; M196-F200 HydrophobicContact CE-CE2 3.86Å; M196-F200 HydrophobicContact CE-CZ 4.47Å; M196-F200 HydrophobicContact CG-CD2 4.17Å; M196-F200 HydrophobicContact CG-CE2 3.46Å; M196-F200 VanDerWaalsContact CG-CE2 3.46Å; M196-F200 HydrophobicContact CG-CZ 3.84Å; M196-F200 WeakPolarHBondContact O-CD2 3.24Å; M196-F200 VanDerWaalsContact O-CG 3.31Å; M196-F200 WeakPolarHBondContact O-CG 3.09Å; M196-F200 PolarHBondContact O-N 3.43Å; M196-F200 HydrophobicContact SD-CE2 3.97Å; M196-F200 HydrophobicContact SD-CZ 4.15Å; H197-F200 WeakPolarHBondContact O-CB 3.45Å; H197-F200 PolarHBondContact O-N 3.39Å; R198-F200 VanDerWaalsContact C-N 3.33Å; R198-F200 PolarHBondContact O-N 3.4Å; F200-H202 VanDerWaalsContact C-N 3.34Å; F200-H202 PolarHBondContact O-N 2.93Å; F200-L203 PolarHBondContact O-N 3.34Å; F200-V204 WeakPolarHBondContact O-CG2 3.38Å; F200-V204 PolarHBondContact O-N 3.12Å; F200-F487 HydrophobicContact CD1-CD1 4.48Å; F200-F487 AromaticContact CD1-CE1 3.31Å; F200-F487 HydrophobicContact CD1-CE1 3.31Å; F200-F487 AromaticContact CD1-CE2 3.87Å; F200-F487 HydrophobicContact CD1-CE2 3.87Å; F200-F487 AromaticContact CD1-CZ 2.96Å; F200-F487 HydrophobicContact CD1-CZ 2.96Å; F200-F487 HydrophobicContact CE1-CD2 4.5Å; F200-F487 AromaticContact CE1-CE1 3.78Å; F200-F487 HydrophobicContact CE1-CE1 3.78Å; F200-F487 AromaticContact CE1-CE2 3.42Å; F200-F487 HydrophobicContact CE1-CE2 3.42Å; F200-F487 VanDerWaalsContact CE1-CE2 3.42Å; F200-F487 AromaticContact CE1-CZ 3.01Å; F200-F487 HydrophobicContact CE1-CZ 3.01Å; F200-F487 HydrophobicContact CG-CE1 4.41Å; F200-F487 HydrophobicContact CG-CZ 4.13Å; F200-F487 HydrophobicContact CZ-CE2 4.49Å; F200-F487 HydrophobicContact CZ-CZ 4.24Å; F200-N491 HydrophobicContact CE1-CB 4.19Å; F200-I495 HydrophobicContact CB-CD1 3.81Å; F200-I495 HydrophobicContact CB-CG1 4Å; F200-I495 HydrophobicContact CB-CG2 4.05Å; F200-I495 HydrophobicContact CD1-CD1 3.73Å; F200-I495 HydrophobicContact CD1-CG1 3.55Å; F200-I495 HydrophobicContact CD2-CB 4.06Å; F200-I495 HydrophobicContact CD2-CD1 4.41Å; F200-I495 HydrophobicContact CD2-CG1 3.65Å; F200-I495 HydrophobicContact CD2-CG2 3.89Å; F200-I495 HydrophobicContact CE1-CD1 4.47Å; F200-I495 HydrophobicContact CE1-CG1 3.93Å; F200-I495 HydrophobicContact CE2-CB 4.43Å; F200-I495 HydrophobicContact CE2-CG1 3.97Å; F200-I495 HydrophobicContact CG-CB 4.3Å; F200-I495 HydrophobicContact CG-CD1 3.79Å; F200-I495 HydrophobicContact CG-CG1 3.5Å; F200-I495 HydrophobicContact CG-CG2 4.12Å; F200-I495 HydrophobicContact CZ-CG1 4.17Å
201	T	78	Confident	81.6	Confident	82 Å²	82	64.9 Å²	64.9	50%	0.503	35%	0.348	S	S	.	.	H	α-helix	trans	-68.5	-34.9	-178.2	-51.8	0	0	0	0	112	H197 R198 I199 L203	H197-T201 PolarHBondContact CE1-OG1 2.87Å; H197-T201 PolarHBondContact NE2-OG1 2.9Å; H197-T201 PolarHBondContact O-N 2.93Å; H197-T201 PolarHBondContact O-OG1 2.97Å; R198-T201 PolarHBondContact O-N 3.38Å; I199-T201 VanDerWaalsContact C-N 3.31Å; I199-T201 PolarHBondContact O-N 3.31Å; T201-L203 VanDerWaalsContact C-N 3.34Å
202	H	78.9	Confident	81.1	Confident	94 Å²	94	63.2 Å²	63.2	44%	0.435	34%	0.342	S	S	.	.	H	α-helix	trans	-68.9	-31.9	177.4	-176.2	67.3	0	0	0	112.8	R198 I199 F200 T216 Y223	R198-H202 WeakPolarHBondContact O-CB 3.45Å; R198-H202 PolarHBondContact O-N 3.41Å; I199-H202 PolarHBondContact O-N 2.88Å; F200-H202 VanDerWaalsContact C-N 3.34Å; F200-H202 PolarHBondContact O-N 2.93Å; H202-T216 PolarHBondContact NE2-OG1 2.75Å; H202-Y223 PolarHBondContact CD2-OH 3.15Å
203	L	78.7	Confident	80.6	Confident	2 Å²	2	60.6 Å²	60.6	1%	0.01	33%	0.332	C	S	.	.	H	α-helix	trans	-84.3	-10.1	-177.9	-66.8	179	0	0	0	114.3	I199 F200 T201 T205 T216 Y223 F468 I484 F487 N488	I199-L203 HydrophobicContact CG2-CD1 3.75Å; I199-L203 HydrophobicContact CG2-CG 4.37Å; I199-L203 VanDerWaalsContact O-CG 3.3Å; I199-L203 WeakPolarHBondContact O-CG 3.18Å; I199-L203 PolarHBondContact O-N 3.14Å; I199-L203 VanDerWaalsContact O-N 3.07Å; F200-L203 PolarHBondContact O-N 3.34Å; T201-L203 VanDerWaalsContact C-N 3.34Å; L203-T205 PolarHBondContact O-N 3.36Å; L203-T216 HydrophobicContact CD2-CG2 3.38Å; L203-Y223 HydrophobicContact CD1-CE2 4.33Å; L203-Y223 HydrophobicContact CD2-CE2 4.25Å; L203-F468 HydrophobicContact CD1-CE1 3.76Å; L203-F468 HydrophobicContact CD1-CZ 3.64Å; L203-I484 HydrophobicContact CB-CG2 4.5Å; L203-I484 HydrophobicContact CD2-CD1 4.15Å; L203-I484 HydrophobicContact CD2-CG1 3.98Å; L203-I484 HydrophobicContact CD2-CG2 4.49Å; L203-F487 HydrophobicContact CB-CD1 4.12Å; L203-F487 HydrophobicContact CB-CE1 3.93Å; L203-F487 HydrophobicContact CD1-CD1 3.74Å; L203-F487 HydrophobicContact CD1-CE1 3.37Å; L203-F487 HydrophobicContact CD1-CG 4.39Å; L203-F487 HydrophobicContact CD1-CZ 3.74Å; L203-F487 HydrophobicContact CG-CE1 4.25Å; L203-N488 PolarHBondContact O-ND2 3.28Å; L203-N488 PolarHBondContact O-OD1 3.32Å
204	V	70.2	Confident	80.2	Confident	87 Å²	87	66 Å²	66	53%	0.527	36%	0.357	S	S	.	.			trans	-87.8	84.4	172.5	-179.9	0	0	0	0	108.6	F200	F200-V204 WeakPolarHBondContact O-CG2 3.38Å; F200-V204 PolarHBondContact O-N 3.12Å
205	T	65.3	Low	79.8	Confident	67 Å²	67	68.2 Å²	68.2	41%	0.411	37%	0.365	S	S	.	.			trans	-127	134.1	170.1	47.6	0	0	0	0	109.8	L203 S207	L203-T205 PolarHBondContact O-N 3.36Å; T205-S207 VanDerWaalsContact C-N 3.27Å; T205-S207 PolarHBondContact O-N 2.94Å
206	D	66	Low	79.5	Confident	168 Å²	168	67.5 Å²	67.5	90%	0.898	36%	0.361	S	S	*	.	S	Bend	trans	-68.2	-25.2	-172.9	-71.5	-30.4	0	0	0	112.9
207	S	70.1	Confident	79.3	Confident	106 Å²	106	68.7 Å²	68.7	74%	0.741	37%	0.369	S	S	*	.	S	Bend	trans	-165.5	81.6	178.5	-73.1	0	0	0	0	111.5	T205	T205-S207 VanDerWaalsContact C-N 3.27Å; T205-S207 PolarHBondContact O-N 2.94Å
208	P	75.3	Confident	79.3	Confident	33 Å²	33	74.4 Å²	74.4	21%	0.214	40%	0.396	C	S	.	.			trans	-69	137.8	178.3	29.2	-34.1	0	0	0	111.2	E212 I213	P208-E212 WeakPolarHBondContact CA-OE2 3.16Å; P208-E212 HydrophobicContact CB-CB 4.24Å; P208-I213 HydrophobicContact CB-CD1 4.47Å; P208-I213 HydrophobicContact CB-CG1 3.97Å; P208-I213 HydrophobicContact CG-CD1 4.2Å; P208-I213 HydrophobicContact CG-CG1 3.96Å
209	T	81.8	Confident	79.5	Confident	78 Å²	78	68.6 Å²	68.6	48%	0.479	38%	0.38	S	S	.	.			trans	-68.3	161.2	170.9	62.1	0	0	0	0	111.3	S211 E212 I213	T209-S211 VanDerWaalsContact C-N 3.25Å; T209-S211 PolarHBondContact O-N 3.49Å; T209-E212 WeakPolarHBondContact CB-OE2 3.39Å; T209-E212 WeakPolarHBondContact CG2-OE2 3.31Å; T209-E212 PolarHBondContact N-OE2 3.36Å; T209-E212 PolarHBondContact O-N 2.98Å; T209-E212 VanDerWaalsContact O-N 3.12Å; T209-E212 VanDerWaalsContact OG1-CD 3.28Å; T209-E212 VanDerWaalsContact OG1-CG 3.27Å; T209-E212 WeakPolarHBondContact OG1-CG 3.46Å; T209-E212 PolarHBondContact OG1-N 2.77Å; T209-E212 PolarHBondContact OG1-OE2 3.31Å; T209-I213 WeakPolarHBondContact O-CG1 3.42Å; T209-I213 PolarHBondContact O-N 3.23Å
210	D	83	Confident	79.8	Confident	87 Å²	87	68.5 Å²	68.5	47%	0.465	38%	0.379	S	S	.	.	H	α-helix	trans	-58	-38.5	178.1	-72.5	-19.8	0	0	0	112.6	I213 E214 I477 R481	D210-I213 PolarHBondContact O-N 2.86Å; D210-E214 WeakPolarHBondContact O-CB 3.49Å; D210-E214 PolarHBondContact O-N 3.17Å; D210-I477 HydrophobicContact CB-CD1 4.49Å; D210-R481 IonicContact OD1-CZ 3.55Å; D210-R481 IonicContact OD1-NE 3.69Å; D210-R481 IonicContact OD1-NH2 3.57Å; D210-R481 PolarHBondContact OD1-NH2 3.4Å
211	S	83.7	Confident	80.3	Confident	71 Å²	71	72.6 Å²	72.6	50%	0.497	41%	0.406	S	S	.	.	H	α-helix	trans	-63.4	-41.9	175.8	-176.8	0	0	0	0	112.3	T209 E214 Q215	T209-S211 VanDerWaalsContact C-N 3.25Å; T209-S211 PolarHBondContact O-N 3.49Å; S211-E214 PolarHBondContact O-N 2.97Å; S211-Q215 WeakPolarHBondContact O-CG 3.41Å; S211-Q215 PolarHBondContact O-N 3.47Å; S211-Q215 VanDerWaalsContact O-N 3.15Å
212	E	83.1	Confident	80.9	Confident	92 Å²	92	73.5 Å²	73.5	43%	0.43	41%	0.407	S	S	.	.	H	α-helix	trans	-65.4	-42.5	176	-73.1	164.6	142.7	0	0	111.2	P208 T209 E214 Q215 T216	P208-E212 WeakPolarHBondContact CA-OE2 3.16Å; P208-E212 HydrophobicContact CB-CB 4.24Å; T209-E212 WeakPolarHBondContact CB-OE2 3.39Å; T209-E212 WeakPolarHBondContact CG2-OE2 3.31Å; T209-E212 PolarHBondContact N-OE2 3.36Å; T209-E212 PolarHBondContact O-N 2.98Å; T209-E212 VanDerWaalsContact O-N 3.12Å; T209-E212 VanDerWaalsContact OG1-CD 3.28Å; T209-E212 VanDerWaalsContact OG1-CG 3.27Å; T209-E212 WeakPolarHBondContact OG1-CG 3.46Å; T209-E212 PolarHBondContact OG1-N 2.77Å; T209-E212 PolarHBondContact OG1-OE2 3.31Å; E212-E214 PolarHBondContact O-N 2.76Å; E212-Q215 PolarHBondContact O-N 2.93Å; E212-T216 PolarHBondContact O-N 3.42Å; E212-T216 PolarHBondContact O-OG1 3.36Å
213	I	83.6	Confident	81.5	Confident	1 Å²	1	70 Å²	70	1%	0.005	39%	0.39	C	S	.	.	H	α-helix	trans	-61.7	-45	176.9	-66.8	158.3	0	0	0	110.7	P208 T209 D210 Q215 T216 V217 I477 A480 R481	P208-I213 HydrophobicContact CB-CD1 4.47Å; P208-I213 HydrophobicContact CB-CG1 3.97Å; P208-I213 HydrophobicContact CG-CD1 4.2Å; P208-I213 HydrophobicContact CG-CG1 3.96Å; T209-I213 WeakPolarHBondContact O-CG1 3.42Å; T209-I213 PolarHBondContact O-N 3.23Å; D210-I213 PolarHBondContact O-N 2.86Å; I213-Q215 VanDerWaalsContact C-N 3.33Å; I213-Q215 PolarHBondContact O-N 3.11Å; I213-T216 WeakPolarHBondContact O-CB 3.4Å; I213-T216 PolarHBondContact O-N 3.48Å; I213-T216 VanDerWaalsContact O-N 3.13Å; I213-V217 HydrophobicContact CG2-CG2 4.08Å; I213-V217 WeakPolarHBondContact O-CG2 3.42Å; I213-V217 PolarHBondContact O-N 2.79Å; I213-I477 HydrophobicContact CB-CG2 4.44Å; I213-I477 HydrophobicContact CD1-CG2 4.23Å; I213-I477 HydrophobicContact CG2-CG2 4.02Å; I213-A480 HydrophobicContact CG2-CB 3.84Å; I213-R481 HydrophobicContact CD1-CG 3.42Å; I213-R481 VanDerWaalsContact CD1-CG 3.42Å; I213-R481 HydrophobicContact CG1-CG 4.32Å
214	E	83.7	Confident	82.1	Confident	116 Å²	116	70.7 Å²	70.7	54%	0.542	40%	0.395	S	S	.	.	H	α-helix	trans	-59	-44.5	179.8	-163.5	166.6	-154	0	0	111.2	D210 S211 E212 V217 E218	D210-E214 WeakPolarHBondContact O-CB 3.49Å; D210-E214 PolarHBondContact O-N 3.17Å; S211-E214 PolarHBondContact O-N 2.97Å; E212-E214 PolarHBondContact O-N 2.76Å; E214-V217 PolarHBondContact O-N 3.07Å; E214-E218 PolarHBondContact O-N 3.15Å
215	Q	82.4	Confident	83.2	Confident	120 Å²	120	72.5 Å²	72.5	56%	0.561	40%	0.396	S	S	*	.	H	α-helix	trans	-64	-39.8	173.2	-69.7	178.1	15.2	0	0	113	S211 E212 I213 V217 E218 S219	S211-Q215 WeakPolarHBondContact O-CG 3.41Å; S211-Q215 PolarHBondContact O-N 3.47Å; S211-Q215 VanDerWaalsContact O-N 3.15Å; E212-Q215 PolarHBondContact O-N 2.93Å; I213-Q215 VanDerWaalsContact C-N 3.33Å; I213-Q215 PolarHBondContact O-N 3.11Å; Q215-V217 VanDerWaalsContact C-N 3.34Å; Q215-E218 PolarHBondContact O-N 3.43Å; Q215-S219 PolarHBondContact O-N 3.2Å; Q215-S219 PolarHBondContact O-OG 3.33Å
216	T	84.8	Confident	84.6	Confident	10 Å²	10	70.1 Å²	70.1	6%	0.061	38%	0.381	C	S	.	.	H	α-helix	trans	-63.4	-42.3	175.7	-51.5	0	0	0	0	110.7	H202 L203 E212 I213 E218 S219 F220 Y223 I484	H202-T216 PolarHBondContact NE2-OG1 2.75Å; L203-T216 HydrophobicContact CD2-CG2 3.38Å; E212-T216 PolarHBondContact O-N 3.42Å; E212-T216 PolarHBondContact O-OG1 3.36Å; I213-T216 WeakPolarHBondContact O-CB 3.4Å; I213-T216 PolarHBondContact O-N 3.48Å; I213-T216 VanDerWaalsContact O-N 3.13Å; T216-E218 VanDerWaalsContact C-N 3.31Å; T216-E218 PolarHBondContact O-N 3.39Å; T216-S219 WeakPolarHBondContact O-CA 3.41Å; T216-S219 WeakPolarHBondContact O-CB 3.48Å; T216-S219 PolarHBondContact O-N 3.35Å; T216-F220 HydrophobicContact CG2-CD1 4.46Å; T216-F220 HydrophobicContact CG2-CE1 3.79Å; T216-F220 WeakPolarHBondContact O-CD1 3.41Å; T216-F220 PolarHBondContact O-N 3.29Å; T216-Y223 HydrophobicContact CG2-CE2 4.08Å; T216-I484 HydrophobicContact CG2-CD1 4.28Å
217	V	84.5	Confident	85.8	Confident	27 Å²	27	62.1 Å²	62.1	16%	0.164	34%	0.338	C	S	.	.	H	α-helix	trans	-59.6	-41.2	178.4	177.1	0	0	0	0	111.2	I213 E214 Q215 S219 F220 A480	I213-V217 HydrophobicContact CG2-CG2 4.08Å; I213-V217 WeakPolarHBondContact O-CG2 3.42Å; I213-V217 PolarHBondContact O-N 2.79Å; E214-V217 PolarHBondContact O-N 3.07Å; Q215-V217 VanDerWaalsContact C-N 3.34Å; V217-S219 PolarHBondContact O-N 3.19Å; V217-F220 VanDerWaalsContact O-CB 3.31Å; V217-F220 WeakPolarHBondContact O-CB 3.37Å; V217-F220 PolarHBondContact O-N 3.22Å; V217-A480 HydrophobicContact CG2-CB 3.34Å
218	E	85.2	Confident	87	Confident	152 Å²	152	60.3 Å²	60.3	71%	0.71	32%	0.318	S	S	*	.	H	α-helix	trans	-58.9	-27.9	176.2	-70.7	-177.4	170	0	0	112.7	E214 Q215 T216 P221	E214-E218 PolarHBondContact O-N 3.15Å; Q215-E218 PolarHBondContact O-N 3.43Å; T216-E218 VanDerWaalsContact C-N 3.31Å; T216-E218 PolarHBondContact O-N 3.39Å; E218-P221 WeakPolarHBondContact O-CD 3.45Å
219	S	88.2	Confident	88	Confident	39 Å²	39	60.6 Å²	60.6	27%	0.273	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-8	178.9	-57	0	0	0	0	114.1	Q215 T216 V217 D222 Y223	Q215-S219 PolarHBondContact O-N 3.2Å; Q215-S219 PolarHBondContact O-OG 3.33Å; T216-S219 WeakPolarHBondContact O-CA 3.41Å; T216-S219 WeakPolarHBondContact O-CB 3.48Å; T216-S219 PolarHBondContact O-N 3.35Å; V217-S219 PolarHBondContact O-N 3.19Å; S219-D222 WeakPolarHBondContact O-CB 3.35Å; S219-D222 PolarHBondContact O-N 3.33Å; S219-Y223 VanDerWaalsContact O-CD1 3.23Å; S219-Y223 WeakPolarHBondContact O-CD1 3.34Å; S219-Y223 PolarHBondContact O-N 2.54Å; S219-Y223 VanDerWaalsContact O-N 3.12Å
220	F	90.1	Very high	88.5	Confident	5 Å²	5	56.9 Å²	56.9	2%	0.022	30%	0.295	C	S	.	.	H	α-helix	trans	-57.7	-41.1	-176.3	-80.9	17.1	0	0	0	114.5	T216 V217 D222 Y223 V224 F468 I470 A480 V483 I484	T216-F220 HydrophobicContact CG2-CD1 4.46Å; T216-F220 HydrophobicContact CG2-CE1 3.79Å; T216-F220 WeakPolarHBondContact O-CD1 3.41Å; T216-F220 PolarHBondContact O-N 3.29Å; V217-F220 VanDerWaalsContact O-CB 3.31Å; V217-F220 WeakPolarHBondContact O-CB 3.37Å; V217-F220 PolarHBondContact O-N 3.22Å; F220-D222 PolarHBondContact O-N 2.9Å; F220-Y223 AromaticContact CD1-CD2 3.8Å; F220-Y223 HydrophobicContact CD1-CD2 3.8Å; F220-Y223 AromaticContact CD1-CE2 3.86Å; F220-Y223 HydrophobicContact CD1-CE2 3.86Å; F220-Y223 HydrophobicContact CE1-CD2 4.29Å; F220-Y223 HydrophobicContact CE1-CE2 4.13Å; F220-Y223 WeakPolarHBondContact O-CB 3.42Å; F220-Y223 PolarHBondContact O-N 2.8Å; F220-V224 WeakPolarHBondContact O-CG2 3.33Å; F220-V224 PolarHBondContact O-N 2.97Å; F220-F468 WeakPolarHBondContact CB-O 3.44Å; F220-F468 AromaticContact CD1-CD1 3.77Å; F220-F468 HydrophobicContact CD1-CD1 3.77Å; F220-F468 HydrophobicContact CD1-CE1 4.19Å; F220-F468 HydrophobicContact CD2-CB 4.35Å; F220-F468 AromaticContact CD2-CD1 3.9Å; F220-F468 HydrophobicContact CD2-CD1 3.9Å; F220-F468 WeakPolarHBondContact CD2-O 3.47Å; F220-F468 AromaticContact CE1-CD1 3.81Å; F220-F468 HydrophobicContact CE1-CD1 3.81Å; F220-F468 AromaticContact CE1-CE1 3.85Å; F220-F468 HydrophobicContact CE1-CE1 3.85Å; F220-F468 AromaticContact CE2-CD1 3.9Å; F220-F468 HydrophobicContact CE2-CD1 3.9Å; F220-F468 HydrophobicContact CE2-CE1 4.42Å; F220-F468 AromaticContact CG-CD1 3.82Å; F220-F468 HydrophobicContact CG-CD1 3.82Å; F220-F468 AromaticContact CZ-CD1 3.89Å; F220-F468 HydrophobicContact CZ-CD1 3.89Å; F220-F468 AromaticContact CZ-CE1 3.98Å; F220-F468 HydrophobicContact CZ-CE1 3.98Å; F220-I470 HydrophobicContact CD2-CD1 3.93Å; F220-I470 HydrophobicContact CD2-CG1 4.13Å; F220-I470 HydrophobicContact CE2-CD1 3.41Å; F220-I470 VanDerWaalsContact CE2-CD1 3.41Å; F220-I470 HydrophobicContact CE2-CG1 4.02Å; F220-I470 HydrophobicContact CZ-CD1 4.45Å; F220-A480 HydrophobicContact CE2-CB 4.43Å; F220-A480 HydrophobicContact CZ-CB 4.29Å; F220-V483 HydrophobicContact CE2-CG1 4.26Å; F220-V483 HydrophobicContact CZ-CG1 4.43Å; F220-I484 HydrophobicContact CZ-CG1 4.5Å
221	P	89.7	Confident	89.1	Confident	88 Å²	88	55.2 Å²	55.2	57%	0.571	29%	0.285	S	S	*	.	H	α-helix	trans	-57.6	-36.4	174.7	-26.5	36.6	0	0	0	113.1	E218 Y223 K225	E218-P221 WeakPolarHBondContact O-CD 3.45Å; P221-Y223 VanDerWaalsContact C-N 3.34Å; P221-K225 WeakPolarHBondContact O-CB 3.37Å; P221-K225 PolarHBondContact O-N 3.35Å
222	D	90.6	Very high	89.6	Confident	101 Å²	101	57.9 Å²	57.9	54%	0.54	29%	0.287	S	S	.	.	H	α-helix	trans	-71	-32.5	176	-71.6	-31.4	0	0	0	111.8	S219 F220 K225 T226	S219-D222 WeakPolarHBondContact O-CB 3.35Å; S219-D222 PolarHBondContact O-N 3.33Å; F220-D222 PolarHBondContact O-N 2.9Å; D222-K225 PolarHBondContact O-N 3.19Å; D222-T226 WeakPolarHBondContact O-CB 3.24Å; D222-T226 PolarHBondContact O-N 3.45Å; D222-T226 PolarHBondContact O-OG1 3.38Å
223	Y	90.9	Very high	90.1	Very high	19 Å²	19	54 Å²	54	8%	0.075	27%	0.271	C	S	.	.	H	α-helix	trans	-67.4	-46.3	174.7	-57.8	-7.7	0	0	0	111.1	I199 H202 L203 T216 S219 F220 P221 K225 T226 F227 F468	I199-Y223 HydrophobicContact CB-CD1 4.32Å; I199-Y223 HydrophobicContact CB-CE1 4.44Å; I199-Y223 HydrophobicContact CD1-CD1 3.48Å; I199-Y223 VanDerWaalsContact CD1-CD1 3.48Å; I199-Y223 HydrophobicContact CD1-CE1 4.25Å; I199-Y223 HydrophobicContact CD1-CG 3.86Å; I199-Y223 HydrophobicContact CG1-CD1 3.42Å; I199-Y223 VanDerWaalsContact CG1-CD1 3.42Å; I199-Y223 HydrophobicContact CG1-CE1 3.67Å; I199-Y223 HydrophobicContact CG1-CG 4Å; I199-Y223 HydrophobicContact CG2-CD1 3.97Å; I199-Y223 HydrophobicContact CG2-CD2 3.71Å; I199-Y223 HydrophobicContact CG2-CE1 4.19Å; I199-Y223 HydrophobicContact CG2-CE2 3.92Å; I199-Y223 HydrophobicContact CG2-CG 3.73Å; H202-Y223 PolarHBondContact CD2-OH 3.15Å; L203-Y223 HydrophobicContact CD1-CE2 4.33Å; L203-Y223 HydrophobicContact CD2-CE2 4.25Å; T216-Y223 HydrophobicContact CG2-CE2 4.08Å; S219-Y223 VanDerWaalsContact O-CD1 3.23Å; S219-Y223 WeakPolarHBondContact O-CD1 3.34Å; S219-Y223 PolarHBondContact O-N 2.54Å; S219-Y223 VanDerWaalsContact O-N 3.12Å; F220-Y223 AromaticContact CD1-CD2 3.8Å; F220-Y223 HydrophobicContact CD1-CD2 3.8Å; F220-Y223 AromaticContact CD1-CE2 3.86Å; F220-Y223 HydrophobicContact CD1-CE2 3.86Å; F220-Y223 HydrophobicContact CE1-CD2 4.29Å; F220-Y223 HydrophobicContact CE1-CE2 4.13Å; F220-Y223 WeakPolarHBondContact O-CB 3.42Å; F220-Y223 PolarHBondContact O-N 2.8Å; P221-Y223 VanDerWaalsContact C-N 3.34Å; Y223-K225 VanDerWaalsContact C-N 3.33Å; Y223-K225 PolarHBondContact O-N 3.36Å; Y223-T226 WeakPolarHBondContact O-CB 3.22Å; Y223-T226 PolarHBondContact O-N 3.44Å; Y223-T226 VanDerWaalsContact O-N 3.1Å; Y223-F227 WeakPolarHBondContact O-CD2 3.15Å; Y223-F227 WeakPolarHBondContact O-CG 3.32Å; Y223-F227 PolarHBondContact O-N 3.2Å; Y223-F468 AromaticContact CD2-CD1 3.81Å; Y223-F468 HydrophobicContact CD2-CD1 3.81Å; Y223-F468 AromaticContact CD2-CE1 3.73Å; Y223-F468 HydrophobicContact CD2-CE1 3.73Å; Y223-F468 HydrophobicContact CE2-CE1 4.39Å
224	V	91.8	Very high	90.6	Very high	18 Å²	18	54 Å²	54	11%	0.109	27%	0.271	C	S	.	.	H	α-helix	trans	-55.3	-49.7	173.8	169.4	0	0	0	0	110.4	F220 T226 F227 E228 I465 F468	F220-V224 WeakPolarHBondContact O-CG2 3.33Å; F220-V224 PolarHBondContact O-N 2.97Å; V224-T226 VanDerWaalsContact C-N 3.26Å; V224-T226 PolarHBondContact O-N 3.36Å; V224-F227 PolarHBondContact O-N 3.1Å; V224-E228 HydrophobicContact CG1-CG 4.48Å; V224-E228 WeakPolarHBondContact O-CG 3.39Å; V224-E228 PolarHBondContact O-N 3.44Å; V224-I465 HydrophobicContact CG1-CG2 3.93Å; V224-F468 HydrophobicContact CG2-CB 3.73Å
225	K	94.2	Very high	91.1	Very high	124 Å²	124	51.5 Å²	51.5	54%	0.539	27%	0.265	S	S	.	.	H	α-helix	trans	-58.5	-38.5	177.4	-173.7	177.9	-179.4	-179.7	0	112.4	P221 D222 Y223 E228 N229	P221-K225 WeakPolarHBondContact O-CB 3.37Å; P221-K225 PolarHBondContact O-N 3.35Å; D222-K225 PolarHBondContact O-N 3.19Å; Y223-K225 VanDerWaalsContact C-N 3.33Å; Y223-K225 PolarHBondContact O-N 3.36Å; K225-E228 PolarHBondContact O-N 2.92Å; K225-N229 WeakPolarHBondContact O-CB 3.43Å; K225-N229 PolarHBondContact O-N 3.14Å; K225-N229 PolarHBondContact O-ND2 3.19Å; K225-N229 VanDerWaalsContact O-ND2 3.15Å
226	T	93.4	Very high	91.6	Very high	17 Å²	17	50 Å²	50	10%	0.104	26%	0.255	C	S	.	.	H	α-helix	trans	-64.5	-47.4	176.7	-58.8	0	0	0	0	111.1	D195 M196 I199 D222 Y223 V224 E228 N229 V230	D195-T226 HydrophobicContact CB-CG2 3.82Å; M196-T226 HydrophobicContact CB-CG2 4.08Å; I199-T226 HydrophobicContact CD1-CG2 3.89Å; D222-T226 WeakPolarHBondContact O-CB 3.24Å; D222-T226 PolarHBondContact O-N 3.45Å; D222-T226 PolarHBondContact O-OG1 3.38Å; Y223-T226 WeakPolarHBondContact O-CB 3.22Å; Y223-T226 PolarHBondContact O-N 3.44Å; Y223-T226 VanDerWaalsContact O-N 3.1Å; V224-T226 VanDerWaalsContact C-N 3.26Å; V224-T226 PolarHBondContact O-N 3.36Å; T226-E228 PolarHBondContact O-N 3.08Å; T226-N229 PolarHBondContact O-N 3.21Å; T226-V230 WeakPolarHBondContact O-CG2 3.45Å; T226-V230 PolarHBondContact O-N 3.07Å
227	F	92.4	Very high	92	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-61.5	-43.7	176	-56.8	-39.6	0	0	0	111.8	M196 I199 Y223 V224 N229 V230 Q231 L461 L464 I465 F468 F487	M196-F227 HydrophobicContact CG-CD1 4Å; M196-F227 HydrophobicContact CG-CE1 3.8Å; M196-F227 HydrophobicContact SD-CD1 4.19Å; M196-F227 HydrophobicContact SD-CE1 4.4Å; I199-F227 HydrophobicContact CG2-CZ 4.4Å; Y223-F227 WeakPolarHBondContact O-CD2 3.15Å; Y223-F227 WeakPolarHBondContact O-CG 3.32Å; Y223-F227 PolarHBondContact O-N 3.2Å; V224-F227 PolarHBondContact O-N 3.1Å; F227-N229 VanDerWaalsContact C-N 3.29Å; F227-N229 PolarHBondContact O-N 3.45Å; F227-V230 PolarHBondContact O-N 2.86Å; F227-Q231 WeakPolarHBondContact O-CB 3.48Å; F227-Q231 PolarHBondContact O-N 3.27Å; F227-L461 HydrophobicContact CB-CB 4.29Å; F227-L461 HydrophobicContact CB-CD1 3.91Å; F227-L461 HydrophobicContact CD1-CD1 4.43Å; F227-L461 WeakPolarHBondContact O-CD1 3.47Å; F227-L464 HydrophobicContact CD1-CD1 4.37Å; F227-L464 HydrophobicContact CD2-CB 3.95Å; F227-L464 HydrophobicContact CE1-CD1 4.33Å; F227-L464 HydrophobicContact CE2-CB 4.11Å; F227-L464 HydrophobicContact CG-CB 4.4Å; F227-I465 HydrophobicContact CB-CD1 4.48Å; F227-I465 HydrophobicContact CB-CG1 3.96Å; F227-F468 AromaticContact CE2-CD2 3.86Å; F227-F468 HydrophobicContact CE2-CD2 3.86Å; F227-F468 HydrophobicContact CE2-CE2 4.1Å; F227-F468 HydrophobicContact CE2-CG 4.23Å; F227-F468 HydrophobicContact CZ-CE2 4.42Å; F227-F487 HydrophobicContact CZ-CE2 4.12Å
228	E	95	Very high	92.4	Very high	69 Å²	69	50.9 Å²	50.9	32%	0.322	26%	0.256	S	S	.	.	H	α-helix	trans	-58.7	-41.4	175	-74	-171.9	-178.9	0	0	112.6	V224 K225 T226 Q231 K232 I465	V224-E228 HydrophobicContact CG1-CG 4.48Å; V224-E228 WeakPolarHBondContact O-CG 3.39Å; V224-E228 PolarHBondContact O-N 3.44Å; K225-E228 PolarHBondContact O-N 2.92Å; T226-E228 PolarHBondContact O-N 3.08Å; E228-Q231 PolarHBondContact O-N 3.04Å; E228-K232 VanDerWaalsContact O-CB 3.31Å; E228-K232 WeakPolarHBondContact O-CB 3.47Å; E228-K232 WeakPolarHBondContact O-CD 3.27Å; E228-K232 WeakPolarHBondContact O-CG 3.35Å; E228-K232 PolarHBondContact O-N 2.82Å; E228-K232 IonicContact OE2-NZ 3.78Å; E228-K232 PolarHBondContact OE2-NZ 2.85Å; E228-I465 HydrophobicContact CG-CD1 3.9Å; E228-I465 HydrophobicContact CG-CG1 4.4Å
229	N	95.2	Very high	92.8	Very high	38 Å²	38	47.3 Å²	47.3	20%	0.203	24%	0.239	C	C	.	.	H	α-helix	trans	-66.6	-42.5	179.6	-71.3	-23.9	0	0	0	111.7	Y192 K225 T226 F227 K232 A233	Y192-N229 HydrophobicContact CD1-CB 3.83Å; Y192-N229 HydrophobicContact CD2-CB 3.81Å; Y192-N229 HydrophobicContact CE1-CB 3.85Å; Y192-N229 HydrophobicContact CE2-CB 3.82Å; Y192-N229 HydrophobicContact CG-CB 3.83Å; K225-N229 WeakPolarHBondContact O-CB 3.43Å; K225-N229 PolarHBondContact O-N 3.14Å; K225-N229 PolarHBondContact O-ND2 3.19Å; K225-N229 VanDerWaalsContact O-ND2 3.15Å; T226-N229 PolarHBondContact O-N 3.21Å; F227-N229 VanDerWaalsContact C-N 3.29Å; F227-N229 PolarHBondContact O-N 3.45Å; N229-K232 PolarHBondContact O-N 2.78Å; N229-A233 WeakPolarHBondContact O-CB 3.11Å; N229-A233 PolarHBondContact O-N 3.16Å
230	V	93.5	Very high	93.1	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-58.4	-52.1	172.5	174.3	0	0	0	0	109.8	M189 L193 M196 T226 F227 K232 A233 V234 F458 L461	M189-V230 HydrophobicContact CE-CG1 4.5Å; L193-V230 HydrophobicContact CD2-CG1 4.1Å; L193-V230 HydrophobicContact CD2-CG2 4.35Å; M196-V230 HydrophobicContact CB-CG2 4.49Å; M196-V230 HydrophobicContact SD-CG1 4.45Å; M196-V230 HydrophobicContact SD-CG2 4.12Å; T226-V230 WeakPolarHBondContact O-CG2 3.45Å; T226-V230 PolarHBondContact O-N 3.07Å; F227-V230 PolarHBondContact O-N 2.86Å; V230-K232 VanDerWaalsContact C-N 3.31Å; V230-K232 PolarHBondContact O-N 2.89Å; V230-A233 PolarHBondContact O-N 2.81Å; V230-V234 HydrophobicContact CG1-CG2 4.48Å; V230-V234 WeakPolarHBondContact O-CG2 3.5Å; V230-V234 PolarHBondContact O-N 2.65Å; V230-V234 VanDerWaalsContact O-N 3.09Å; V230-F458 HydrophobicContact CG1-CB 3.92Å; V230-F458 HydrophobicContact CG1-CD1 4.39Å; V230-F458 HydrophobicContact CG1-CG 4.21Å; V230-L461 HydrophobicContact CB-CD1 4.09Å; V230-L461 HydrophobicContact CG1-CD1 4.08Å
231	Q	94.3	Very high	93.3	Very high	53 Å²	53	45.9 Å²	45.9	25%	0.248	23%	0.23	C	C	.	.	H	α-helix	trans	-60	-39.8	-178.4	-176.7	170.1	-26.4	0	0	112.3	F227 E228 A233 P235 K459 L461	F227-Q231 WeakPolarHBondContact O-CB 3.48Å; F227-Q231 PolarHBondContact O-N 3.27Å; E228-Q231 PolarHBondContact O-N 3.04Å; Q231-A233 VanDerWaalsContact C-N 3.31Å; Q231-A233 PolarHBondContact O-N 3.23Å; Q231-P235 WeakPolarHBondContact O-CD 3.46Å; Q231-K459 WeakPolarHBondContact CG-O 3.26Å; Q231-L461 HydrophobicContact CB-CD1 4.43Å; Q231-L461 HydrophobicContact CB-CG 4.38Å
232	K	94.2	Very high	93.5	Very high	126 Å²	126	44.6 Å²	44.6	55%	0.548	22%	0.22	S	C	.	.	H	α-helix	trans	-68	-28.2	176.1	-74.9	166.4	-175.1	158.5	0	113	E228 N229 V230	E228-K232 VanDerWaalsContact O-CB 3.31Å; E228-K232 WeakPolarHBondContact O-CB 3.47Å; E228-K232 WeakPolarHBondContact O-CD 3.27Å; E228-K232 WeakPolarHBondContact O-CG 3.35Å; E228-K232 PolarHBondContact O-N 2.82Å; E228-K232 IonicContact OE2-NZ 3.78Å; E228-K232 PolarHBondContact OE2-NZ 2.85Å; N229-K232 PolarHBondContact O-N 2.78Å; V230-K232 VanDerWaalsContact C-N 3.31Å; V230-K232 PolarHBondContact O-N 2.89Å
233	A	93.9	Very high	93.7	Very high	11 Å²	11	40.2 Å²	40.2	9%	0.091	20%	0.197	C	C	.	.	H	α-helix	trans	-84.7	-29.7	-178.2	0	0	0	0	0	113.5	M189 Y192 N229 V230 Q231 P235 Y236 F237	M189-A233 HydrophobicContact SD-CB 3.55Å; M189-A233 VanDerWaalsContact SD-CB 3.55Å; Y192-A233 HydrophobicContact CD2-CB 4.37Å; N229-A233 WeakPolarHBondContact O-CB 3.11Å; N229-A233 PolarHBondContact O-N 3.16Å; V230-A233 PolarHBondContact O-N 2.81Å; Q231-A233 VanDerWaalsContact C-N 3.31Å; Q231-A233 PolarHBondContact O-N 3.23Å; A233-P235 VanDerWaalsContact C-CD 3.44Å; A233-Y236 WeakPolarHBondContact O-CB 3.45Å; A233-Y236 WeakPolarHBondContact O-CD2 3.43Å; A233-Y236 PolarHBondContact O-N 2.81Å; A233-F237 WeakPolarHBondContact O-CD2 3.37Å
234	V	93.9	Very high	93.9	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-48.1	-45	-177.6	165.5	0	0	0	0	114.5	M189 V230 Y236 F237 E238 I455 F458 K459	M189-V234 HydrophobicContact CE-CG2 4.32Å; V230-V234 HydrophobicContact CG1-CG2 4.48Å; V230-V234 WeakPolarHBondContact O-CG2 3.5Å; V230-V234 PolarHBondContact O-N 2.65Å; V230-V234 VanDerWaalsContact O-N 3.09Å; V234-Y236 PolarHBondContact O-N 2.92Å; V234-Y236 VanDerWaalsContact O-N 3.1Å; V234-F237 PolarHBondContact O-N 3.17Å; V234-E238 PolarHBondContact O-N 3.02Å; V234-I455 HydrophobicContact CG1-CD1 4.21Å; V234-I455 HydrophobicContact CG1-CG1 4.16Å; V234-I455 HydrophobicContact CG2-CG1 4.34Å; V234-F458 HydrophobicContact CG2-CB 3.47Å; V234-F458 VanDerWaalsContact CG2-CB 3.47Å; V234-K459 HydrophobicContact CG1-CB 4.33Å
235	P	94.2	Very high	94.1	Very high	64 Å²	64	44.3 Å²	44.3	42%	0.416	21%	0.21	S	C	.	.	H	α-helix	trans	-59.2	-24.4	-179.5	-26.8	36.1	0	0	0	115	Q231 A233 Q239	Q231-P235 WeakPolarHBondContact O-CD 3.46Å; A233-P235 VanDerWaalsContact C-CD 3.44Å; P235-Q239 WeakPolarHBondContact O-CG 3.49Å; P235-Q239 PolarHBondContact O-NE2 3.02Å; P235-Q239 VanDerWaalsContact O-NE2 3.09Å
236	Y	93.8	Very high	94.1	Very high	88 Å²	88	42.7 Å²	42.7	35%	0.345	20%	0.201	S	C	.	.	H	α-helix	trans	-70.6	-40	175.8	-61.6	-63.8	0	0	0	111.6	Y185 A233 V234 Q239	Y185-Y236 HydrophobicContact CD1-CD2 4.09Å; Y185-Y236 HydrophobicContact CD1-CE2 4.27Å; Y185-Y236 HydrophobicContact CD1-CG 4.29Å; Y185-Y236 HydrophobicContact CD2-CD1 4.21Å; Y185-Y236 HydrophobicContact CD2-CG 4.07Å; Y185-Y236 HydrophobicContact CE1-CD1 4.14Å; Y185-Y236 HydrophobicContact CE1-CD2 4.16Å; Y185-Y236 AromaticContact CE1-CE1 3.97Å; Y185-Y236 HydrophobicContact CE1-CE1 3.97Å; Y185-Y236 HydrophobicContact CE1-CE2 4Å; Y185-Y236 HydrophobicContact CE1-CG 4.24Å; Y185-Y236 AromaticContact CE1-CZ 3.9Å; Y185-Y236 AromaticContact CE2-CD1 3.71Å; Y185-Y236 HydrophobicContact CE2-CD1 3.71Å; Y185-Y236 HydrophobicContact CE2-CE1 4.15Å; Y185-Y236 HydrophobicContact CE2-CG 4.04Å; Y185-Y236 HydrophobicContact CG-CD2 4.33Å; Y185-Y236 HydrophobicContact CG-CG 4.19Å; Y185-Y236 AromaticContact CZ-CD1 3.65Å; Y185-Y236 AromaticContact CZ-CE1 3.61Å; Y185-Y236 WeakPolarHBondContact OH-CE1 3.45Å; A233-Y236 WeakPolarHBondContact O-CB 3.45Å; A233-Y236 WeakPolarHBondContact O-CD2 3.43Å; A233-Y236 PolarHBondContact O-N 2.81Å; V234-Y236 PolarHBondContact O-N 2.92Å; V234-Y236 VanDerWaalsContact O-N 3.1Å; Y236-Q239 WeakPolarHBondContact O-CB 3.33Å
237	F	93.7	Very high	94.2	Very high	1 Å²	1	41.9 Å²	41.9	0%	0.004	20%	0.196	C	C	.	.	H	α-helix	trans	-82.9	-28.9	-178.9	-66.2	-89.6	0	0	0	112.2	I181 W186 M189 A233 V234 Q239 V240 V241 I455 F501 F505	I181-F237 HydrophobicContact CG2-CD1 3.97Å; I181-F237 HydrophobicContact CG2-CE1 3.93Å; I181-F237 HydrophobicContact CG2-CG 4.33Å; I181-F237 HydrophobicContact CG2-CZ 4.24Å; W186-F237 AromaticContact CE3-CE1 3.76Å; W186-F237 HydrophobicContact CE3-CE1 3.76Å; W186-F237 HydrophobicContact CE3-CZ 4.09Å; W186-F237 HydrophobicContact CZ3-CE1 4.27Å; M189-F237 HydrophobicContact CB-CD2 4.43Å; M189-F237 HydrophobicContact CB-CE1 4.38Å; M189-F237 HydrophobicContact CB-CE2 3.4Å; M189-F237 HydrophobicContact CB-CZ 3.36Å; M189-F237 HydrophobicContact CE-CD2 4.43Å; M189-F237 HydrophobicContact CG-CD2 3.99Å; M189-F237 HydrophobicContact CG-CE1 4.31Å; M189-F237 HydrophobicContact CG-CE2 3.41Å; M189-F237 VanDerWaalsContact CG-CE2 3.41Å; M189-F237 HydrophobicContact CG-CZ 3.59Å; M189-F237 HydrophobicContact SD-CD2 4.2Å; M189-F237 HydrophobicContact SD-CE2 3.97Å; A233-F237 WeakPolarHBondContact O-CD2 3.37Å; V234-F237 PolarHBondContact O-N 3.17Å; F237-Q239 PolarHBondContact O-N 2.94Å; F237-V240 WeakPolarHBondContact O-CA 3.36Å; F237-V240 WeakPolarHBondContact O-CB 3.39Å; F237-V240 PolarHBondContact O-N 3.44Å; F237-V241 WeakPolarHBondContact O-CG2 3.39Å; F237-V241 PolarHBondContact O-N 3Å; F237-I455 HydrophobicContact CB-CD1 3.34Å; F237-I455 HydrophobicContact CG-CD1 4.42Å; F237-F501 HydrophobicContact CB-CZ 4.06Å; F237-F501 HydrophobicContact CD1-CE1 4.42Å; F237-F501 AromaticContact CD1-CZ 3.86Å; F237-F501 HydrophobicContact CD1-CZ 3.86Å; F237-F501 AromaticContact CG-CZ 4Å; F237-F501 HydrophobicContact CG-CZ 4Å; F237-F505 HydrophobicContact CD1-CD2 4.34Å; F237-F505 HydrophobicContact CD1-CE1 4.45Å; F237-F505 AromaticContact CD1-CE2 3.63Å; F237-F505 HydrophobicContact CD1-CE2 3.63Å; F237-F505 AromaticContact CD1-CZ 3.69Å; F237-F505 HydrophobicContact CD1-CZ 3.69Å; F237-F505 AromaticContact CE1-CE1 3.92Å; F237-F505 HydrophobicContact CE1-CE1 3.92Å; F237-F505 AromaticContact CE1-CE2 3.94Å; F237-F505 HydrophobicContact CE1-CE2 3.94Å; F237-F505 AromaticContact CE1-CZ 3.53Å; F237-F505 HydrophobicContact CE1-CZ 3.53Å
238	E	92.8	Very high	94.4	Very high	55 Å²	55	44.6 Å²	44.6	26%	0.257	21%	0.208	S	C	.	.	H	α-helix	trans	-56.6	-32.9	171.2	-171	174.2	-170	0	0	111.6	V234 V241 T242 K459	V234-E238 PolarHBondContact O-N 3.02Å; E238-V241 PolarHBondContact O-N 3.21Å; E238-T242 WeakPolarHBondContact O-CB 3.35Å; E238-T242 PolarHBondContact O-N 3.32Å; E238-T242 PolarHBondContact O-OG1 3.36Å; E238-K459 IonicContact OE1-NZ 2.58Å; E238-K459 PolarHBondContact OE1-NZ 3.39Å; E238-K459 IonicContact OE2-NZ 3.72Å; E238-K459 PolarHBondContact OE2-NZ 3.14Å
239	Q	93.5	Very high	94.3	Very high	76 Å²	76	45.9 Å²	45.9	36%	0.355	21%	0.214	S	C	.	.	H	α-helix	trans	-63.7	-41.4	173.5	-66.7	169.7	62.3	0	0	112.1	P235 Y236 F237 T242 V243	P235-Q239 WeakPolarHBondContact O-CG 3.49Å; P235-Q239 PolarHBondContact O-NE2 3.02Å; P235-Q239 VanDerWaalsContact O-NE2 3.09Å; Y236-Q239 WeakPolarHBondContact O-CB 3.33Å; F237-Q239 PolarHBondContact O-N 2.94Å; Q239-T242 PolarHBondContact O-N 3.2Å; Q239-V243 WeakPolarHBondContact O-CG2 3.32Å; Q239-V243 PolarHBondContact O-N 3.48Å; Q239-V243 VanDerWaalsContact O-N 3.17Å
240	V	94.1	Very high	94.2	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.024	21%	0.205	C	C	.	.	H	α-helix	trans	-63.7	-45.2	176	-179.4	0	0	0	0	110.5	F174 F178 I181 F237 T242 V243 L244	F174-V240 HydrophobicContact CD2-CG1 4.48Å; F174-V240 HydrophobicContact CE2-CG1 4.03Å; F178-V240 HydrophobicContact CB-CG1 4.23Å; F178-V240 HydrophobicContact CD2-CG1 3.92Å; I181-V240 HydrophobicContact CB-CG2 3.64Å; I181-V240 HydrophobicContact CG1-CG2 3.7Å; I181-V240 HydrophobicContact CG2-CG2 3.76Å; F237-V240 WeakPolarHBondContact O-CA 3.36Å; F237-V240 WeakPolarHBondContact O-CB 3.39Å; F237-V240 PolarHBondContact O-N 3.44Å; V240-T242 VanDerWaalsContact C-N 3.27Å; V240-T242 PolarHBondContact O-N 3.09Å; V240-V243 WeakPolarHBondContact O-CG2 3.44Å; V240-V243 PolarHBondContact O-N 2.91Å; V240-L244 WeakPolarHBondContact O-CB 3.49Å; V240-L244 PolarHBondContact O-N 3.07Å
241	V	93.8	Very high	94.2	Very high	11 Å²	11	47.7 Å²	47.7	7%	0.067	22%	0.223	C	C	.	.	H	α-helix	trans	-60.4	-39.5	177.6	179.5	0	0	0	0	111.3	F237 E238 L244 R245 F452 I455	F237-V241 WeakPolarHBondContact O-CG2 3.39Å; F237-V241 PolarHBondContact O-N 3Å; E238-V241 PolarHBondContact O-N 3.21Å; V241-L244 PolarHBondContact O-N 3.05Å; V241-R245 PolarHBondContact O-N 3.1Å; V241-F452 HydrophobicContact CG1-CB 4.47Å; V241-F452 HydrophobicContact CG2-CB 3.56Å; V241-F452 HydrophobicContact CG2-CG 4.41Å; V241-I455 HydrophobicContact CG2-CG2 4.31Å
242	T	94.8	Very high	94	Very high	60 Å²	60	48.8 Å²	48.8	37%	0.368	23%	0.231	S	C	.	.	H	α-helix	trans	-64.1	-47.3	179.7	-61	0	0	0	0	112	E238 Q239 V240 R245 R246	E238-T242 WeakPolarHBondContact O-CB 3.35Å; E238-T242 PolarHBondContact O-N 3.32Å; E238-T242 PolarHBondContact O-OG1 3.36Å; Q239-T242 PolarHBondContact O-N 3.2Å; V240-T242 VanDerWaalsContact C-N 3.27Å; V240-T242 PolarHBondContact O-N 3.09Å; T242-R245 PolarHBondContact O-N 2.92Å; T242-R246 PolarHBondContact O-N 2.83Å
243	V	95.3	Very high	93.8	Very high	9 Å²	9	45.8 Å²	45.8	6%	0.055	22%	0.22	C	C	.	.	H	α-helix	trans	-72.5	-32.2	178.7	-60.2	0	0	0	0	112.1	E173 F174 K177 Q239 V240 R245 R246 A247	E173-V243 HydrophobicContact CG-CG1 4.29Å; F174-V243 HydrophobicContact CB-CB 4.33Å; F174-V243 HydrophobicContact CB-CG2 4.1Å; F174-V243 HydrophobicContact CD2-CG2 3.96Å; K177-V243 HydrophobicContact CB-CG2 3.89Å; K177-V243 HydrophobicContact CG-CG2 4Å; Q239-V243 WeakPolarHBondContact O-CG2 3.32Å; Q239-V243 PolarHBondContact O-N 3.48Å; Q239-V243 VanDerWaalsContact O-N 3.17Å; V240-V243 WeakPolarHBondContact O-CG2 3.44Å; V240-V243 PolarHBondContact O-N 2.91Å; V243-R245 VanDerWaalsContact C-N 3.33Å; V243-R245 PolarHBondContact O-N 3.14Å; V243-R246 PolarHBondContact O-N 3.49Å; V243-A247 WeakPolarHBondContact O-CB 3.31Å; V243-A247 PolarHBondContact O-N 3.27Å
244	L	95.1	Very high	93.6	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.01	22%	0.217	C	C	.	.	H	α-helix	trans	-60	-43.8	171.7	173.2	58.5	0	0	0	111.3	F174 V240 V241 R246 A247 K248 Q449 S450 F452	F174-L244 HydrophobicContact CD1-CD1 4.29Å; F174-L244 HydrophobicContact CD2-CB 3.84Å; F174-L244 HydrophobicContact CD2-CD1 4.42Å; F174-L244 HydrophobicContact CE1-CD1 3.81Å; F174-L244 HydrophobicContact CE2-CB 3.7Å; F174-L244 HydrophobicContact CE2-CD1 3.95Å; F174-L244 HydrophobicContact CE2-CG 4.25Å; F174-L244 HydrophobicContact CG-CB 4.49Å; F174-L244 HydrophobicContact CZ-CB 4.26Å; F174-L244 HydrophobicContact CZ-CD1 3.6Å; F174-L244 HydrophobicContact CZ-CG 4.33Å; V240-L244 WeakPolarHBondContact O-CB 3.49Å; V240-L244 PolarHBondContact O-N 3.07Å; V241-L244 PolarHBondContact O-N 3.05Å; L244-R246 VanDerWaalsContact C-N 3.31Å; L244-R246 PolarHBondContact O-N 3.47Å; L244-A247 PolarHBondContact O-N 3.41Å; L244-K248 HydrophobicContact CD1-CD 4.37Å; L244-K248 HydrophobicContact CD1-CG 4.04Å; L244-K248 WeakPolarHBondContact O-CG 3.22Å; L244-K248 PolarHBondContact O-N 3.12Å; L244-Q449 HydrophobicContact CD1-CB 4.38Å; L244-Q449 HydrophobicContact CD2-CB 4.49Å; L244-S450 WeakPolarHBondContact CD2-O 3.45Å; L244-F452 HydrophobicContact CD2-CD2 3.79Å; L244-F452 HydrophobicContact CD2-CE2 4Å
245	R	94.8	Very high	93.3	Very high	121 Å²	121	49.3 Å²	49.3	46%	0.457	24%	0.236	S	C	.	.	H	α-helix	trans	-58.4	-44.9	178.6	-170.1	-179.6	-59.3	103.2	2.1	111.5	V241 T242 V243 K248 D453	V241-R245 PolarHBondContact O-N 3.1Å; T242-R245 PolarHBondContact O-N 2.92Å; V243-R245 VanDerWaalsContact C-N 3.33Å; V243-R245 PolarHBondContact O-N 3.14Å; R245-K248 PolarHBondContact O-N 3.03Å; R245-D453 IonicContact NH2-OD1 2.66Å
246	R	94.9	Very high	92.9	Very high	91 Å²	91	48.8 Å²	48.8	34%	0.343	23%	0.232	S	C	.	.	H	α-helix	trans	-65.4	-43	175.2	-64.2	-168	-58.7	-160.5	2.8	112.1	D170 E173 T242 V243 L244 K248 E249	D170-R246 HydrophobicContact CB-CB 4.32Å; E173-R246 IonicContact OE1-NH2 3.75Å; E173-R246 PolarHBondContact OE1-NH2 3.5Å; E173-R246 IonicContact OE2-CZ 3Å; E173-R246 IonicContact OE2-NH2 2.72Å; E173-R246 PolarHBondContact OE2-NH2 2.84Å; T242-R246 PolarHBondContact O-N 2.83Å; V243-R246 PolarHBondContact O-N 3.49Å; L244-R246 VanDerWaalsContact C-N 3.31Å; L244-R246 PolarHBondContact O-N 3.47Å; R246-K248 VanDerWaalsContact C-N 3.27Å; R246-K248 PolarHBondContact O-N 3.1Å; R246-E249 VanDerWaalsContact O-CB 3.28Å; R246-E249 WeakPolarHBondContact O-CB 3.41Å; R246-E249 PolarHBondContact O-N 2.63Å
247	A	95.6	Very high	92.6	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-59.6	-37.4	177.8	0	0	0	0	0	112.5	V171 F174 V243 L244 E249 I250 L446	V171-A247 HydrophobicContact CB-CB 4.47Å; V171-A247 HydrophobicContact CG2-CB 4.05Å; F174-A247 HydrophobicContact CB-CB 3.77Å; F174-A247 HydrophobicContact CD1-CB 4.18Å; F174-A247 HydrophobicContact CG-CB 4.17Å; V243-A247 WeakPolarHBondContact O-CB 3.31Å; V243-A247 PolarHBondContact O-N 3.27Å; L244-A247 PolarHBondContact O-N 3.41Å; A247-E249 PolarHBondContact O-N 3.25Å; A247-I250 VanDerWaalsContact O-CG2 3.22Å; A247-I250 WeakPolarHBondContact O-CG2 3.38Å; A247-I250 PolarHBondContact O-N 3.04Å; A247-L446 HydrophobicContact CB-CD2 4.36Å
248	K	95.3	Very high	92.1	Very high	57 Å²	57	51.2 Å²	51.2	25%	0.248	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-66.5	-15.7	175.9	-73.3	-172.8	179.7	-166.5	0	113.9	L244 R245 R246 I250 D251 L446 Q449	L244-K248 HydrophobicContact CD1-CD 4.37Å; L244-K248 HydrophobicContact CD1-CG 4.04Å; L244-K248 WeakPolarHBondContact O-CG 3.22Å; L244-K248 PolarHBondContact O-N 3.12Å; R245-K248 PolarHBondContact O-N 3.03Å; R246-K248 VanDerWaalsContact C-N 3.27Å; R246-K248 PolarHBondContact O-N 3.1Å; K248-I250 PolarHBondContact O-N 2.65Å; K248-D251 WeakPolarHBondContact O-CB 3.48Å; K248-D251 PolarHBondContact O-N 3.34Å; K248-L446 VanDerWaalsContact CE-O 3.27Å; K248-L446 WeakPolarHBondContact CE-O 3.28Å; K248-Q449 PolarHBondContact NZ-O 2.67Å
249	E	94.2	Very high	91.7	Very high	96 Å²	96	49.5 Å²	49.5	45%	0.449	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-70.3	-6.4	175.1	-61.9	171.7	-172.7	0	0	112.9	K167 R246 A247 D251 M253	K167-E249 HydrophobicContact CD-CB 4.16Å; K167-E249 WeakPolarHBondContact CE-OE2 3.34Å; K167-E249 IonicContact NZ-OE2 2.69Å; K167-E249 PolarHBondContact NZ-OE2 3.27Å; R246-E249 VanDerWaalsContact O-CB 3.28Å; R246-E249 WeakPolarHBondContact O-CB 3.41Å; R246-E249 PolarHBondContact O-N 2.63Å; A247-E249 PolarHBondContact O-N 3.25Å; E249-D251 PolarHBondContact O-N 3.49Å; E249-M253 WeakPolarHBondContact O-CE 3.23Å
250	I	93.6	Very high	91.3	Very high	3 Å²	3	45.9 Å²	45.9	2%	0.015	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-68.1	-8.6	169	-155.4	167.6	0	0	0	113.1	Y164 K167 L168 V171 A247 K248 N252 M253 L446	Y164-I250 HydrophobicContact CD2-CG1 4.24Å; Y164-I250 HydrophobicContact CE1-CD1 4.49Å; Y164-I250 HydrophobicContact CE2-CD1 3.91Å; Y164-I250 HydrophobicContact CE2-CG1 3.83Å; K167-I250 HydrophobicContact CB-CB 3.85Å; K167-I250 HydrophobicContact CB-CD1 4.21Å; K167-I250 HydrophobicContact CB-CG1 3.78Å; L168-I250 HydrophobicContact CB-CD1 4.34Å; L168-I250 HydrophobicContact CD1-CD1 4.17Å; V171-I250 HydrophobicContact CG2-CB 4.4Å; V171-I250 HydrophobicContact CG2-CD1 3.93Å; V171-I250 HydrophobicContact CG2-CG2 4.16Å; A247-I250 VanDerWaalsContact O-CG2 3.22Å; A247-I250 WeakPolarHBondContact O-CG2 3.38Å; A247-I250 PolarHBondContact O-N 3.04Å; K248-I250 PolarHBondContact O-N 2.65Å; I250-N252 PolarHBondContact O-N 3.34Å; I250-M253 WeakPolarHBondContact O-CB 3.5Å; I250-M253 PolarHBondContact O-N 2.96Å; I250-L446 HydrophobicContact CG2-CD1 3.59Å
251	D	91.5	Very high	90.7	Very high	72 Å²	72	46.5 Å²	46.5	39%	0.385	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-41	119.5	-178.7	-175.4	-14.7	0	0	0	112.5	K248 E249 M253 D443 K447	K248-D251 WeakPolarHBondContact O-CB 3.48Å; K248-D251 PolarHBondContact O-N 3.34Å; E249-D251 PolarHBondContact O-N 3.49Å; D251-M253 PolarHBondContact O-N 3.08Å; D251-D443 VanDerWaalsContact CA-OD1 3.31Å; D251-D443 WeakPolarHBondContact CA-OD1 3.45Å; D251-K447 WeakPolarHBondContact OD1-CE 3.3Å; D251-K447 IonicContact OD1-NZ 3.07Å; D251-K447 PolarHBondContact OD1-NZ 2.79Å; D251-K447 WeakPolarHBondContact OD2-CE 3.4Å; D251-K447 IonicContact OD2-NZ 2.63Å
252	N	90.2	Very high	90.2	Very high	77 Å²	77	50 Å²	50	41%	0.412	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	6	176.2	-66.8	-33.6	0	0	0	115.1	I250 F254 L255 D443 K447	I250-N252 PolarHBondContact O-N 3.34Å; N252-F254 PolarHBondContact O-N 2.93Å; N252-L255 HydrophobicContact CB-CD1 3.86Å; N252-L255 HydrophobicContact CB-CG 4.25Å; N252-L255 VanDerWaalsContact O-CB 3.24Å; N252-L255 WeakPolarHBondContact O-CB 3.42Å; N252-L255 WeakPolarHBondContact O-CG 3.38Å; N252-L255 PolarHBondContact O-N 3.21Å; N252-D443 PolarHBondContact N-OD2 3.48Å; N252-D443 VanDerWaalsContact N-OD2 3.11Å; N252-K447 PolarHBondContact OD1-NZ 3.03Å
253	M	90.7	Very high	89.7	Confident	63 Å²	63	47.3 Å²	47.3	31%	0.31	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-64.2	-27.4	180	-71.6	-165.2	166.3	0	0	112	Y164 K167 E249 I250 D251 L255 V256	Y164-M253 HydrophobicContact CD2-CB 3.74Å; Y164-M253 HydrophobicContact CE2-CB 4.38Å; K167-M253 HydrophobicContact CB-SD 4.03Å; K167-M253 HydrophobicContact CG-CE 3.84Å; K167-M253 HydrophobicContact CG-SD 3.44Å; K167-M253 WeakPolarHBondContact CG-SD 3.26Å; E249-M253 WeakPolarHBondContact O-CE 3.23Å; I250-M253 WeakPolarHBondContact O-CB 3.5Å; I250-M253 PolarHBondContact O-N 2.96Å; D251-M253 PolarHBondContact O-N 3.08Å; M253-L255 PolarHBondContact O-N 3.4Å; M253-L255 VanDerWaalsContact O-N 3.14Å; M253-V256 WeakPolarHBondContact O-CB 3.21Å; M253-V256 WeakPolarHBondContact O-CG1 3.47Å; M253-V256 PolarHBondContact O-N 3.35Å
254	F	89.1	Confident	89.1	Confident	7 Å²	7	47.1 Å²	47.1	3%	0.031	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-60.7	-21.2	175.4	71.9	-86.5	0	0	0	113.2	Y164 N252 V256 F257 Y436 M439 K440 D443	Y164-F254 HydrophobicContact CD2-CB 4.45Å; Y164-F254 HydrophobicContact CE2-CB 3.77Å; N252-F254 PolarHBondContact O-N 2.93Å; F254-V256 PolarHBondContact O-N 2.87Å; F254-V256 VanDerWaalsContact O-N 3.17Å; F254-F257 WeakPolarHBondContact O-CD2 3.46Å; F254-F257 PolarHBondContact O-N 2.94Å; F254-F257 VanDerWaalsContact O-N 3.09Å; F254-Y436 AromaticContact CD2-CD2 3.83Å; F254-Y436 HydrophobicContact CD2-CD2 3.83Å; F254-Y436 HydrophobicContact CD2-CE1 4.13Å; F254-Y436 AromaticContact CD2-CE2 3.44Å; F254-Y436 HydrophobicContact CD2-CE2 3.44Å; F254-Y436 VanDerWaalsContact CD2-CE2 3.44Å; F254-Y436 HydrophobicContact CD2-CG 4.4Å; F254-Y436 AromaticContact CD2-CZ 3.6Å; F254-Y436 AromaticContact CE2-CE1 3.86Å; F254-Y436 HydrophobicContact CE2-CE1 3.86Å; F254-Y436 AromaticContact CE2-CE2 3.93Å; F254-Y436 HydrophobicContact CE2-CE2 3.93Å; F254-Y436 AromaticContact CE2-CZ 3.55Å; F254-Y436 WeakPolarHBondContact O-CE2 3.42Å; F254-M439 HydrophobicContact CB-CB 3.69Å; F254-M439 HydrophobicContact CB-CG 4.44Å; F254-M439 HydrophobicContact CB-SD 4Å; F254-M439 HydrophobicContact CG-CB 4.15Å; F254-K440 HydrophobicContact CD2-CB 4.36Å; F254-K440 HydrophobicContact CE1-CB 4.38Å; F254-K440 HydrophobicContact CE2-CB 3.78Å; F254-K440 HydrophobicContact CE2-CG 4.15Å; F254-K440 HydrophobicContact CZ-CB 3.81Å; F254-K440 HydrophobicContact CZ-CD 4.44Å; F254-K440 HydrophobicContact CZ-CG 3.8Å; F254-D443 HydrophobicContact CD1-CB 4.26Å; F254-D443 HydrophobicContact CE1-CB 4.15Å
255	L	88	Confident	88.5	Confident	79 Å²	79	50.9 Å²	50.9	41%	0.414	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-60.2	-24.1	177.2	-64.3	-178.9	0	0	0	112.6	N252 M253 F257 R258 Y436	N252-L255 HydrophobicContact CB-CD1 3.86Å; N252-L255 HydrophobicContact CB-CG 4.25Å; N252-L255 VanDerWaalsContact O-CB 3.24Å; N252-L255 WeakPolarHBondContact O-CB 3.42Å; N252-L255 WeakPolarHBondContact O-CG 3.38Å; N252-L255 PolarHBondContact O-N 3.21Å; M253-L255 PolarHBondContact O-N 3.4Å; M253-L255 VanDerWaalsContact O-N 3.14Å; L255-F257 PolarHBondContact O-N 3.04Å; L255-F257 VanDerWaalsContact O-N 3.14Å; L255-R258 WeakPolarHBondContact O-CB 3.4Å; L255-R258 PolarHBondContact O-N 3.41Å; L255-Y436 WeakPolarHBondContact CD2-OH 3.31Å
256	V	86.4	Confident	88.1	Confident	53 Å²	53	45.9 Å²	45.9	32%	0.321	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-58.8	-25.1	176.1	79.7	0	0	0	0	112.3	V159 M253 F254 P259	V159-V256 HydrophobicContact CG1-CG1 4.41Å; V159-V256 HydrophobicContact CG1-CG2 4.25Å; V159-V256 WeakPolarHBondContact CG1-O 3.49Å; M253-V256 WeakPolarHBondContact O-CB 3.21Å; M253-V256 WeakPolarHBondContact O-CG1 3.47Å; M253-V256 PolarHBondContact O-N 3.35Å; F254-V256 PolarHBondContact O-N 2.87Å; F254-V256 VanDerWaalsContact O-N 3.17Å; V256-P259 VanDerWaalsContact O-CD 3.24Å; V256-P259 WeakPolarHBondContact O-CD 3.38Å
257	F	86.5	Confident	87.4	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.009	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-87.4	-7.2	179.6	-53.7	-55.7	0	0	0	114	V159 Y164 F254 L255 P259 L260 I261 M439 F526 I529	V159-F257 HydrophobicContact CG1-CD1 3.73Å; V159-F257 HydrophobicContact CG1-CE1 4.06Å; Y164-F257 AromaticContact CD1-CE2 3.91Å; Y164-F257 HydrophobicContact CD1-CE2 3.91Å; Y164-F257 HydrophobicContact CD1-CZ 4.2Å; Y164-F257 AromaticContact CD2-CE2 3.87Å; Y164-F257 HydrophobicContact CD2-CE2 3.87Å; Y164-F257 HydrophobicContact CE1-CE2 4.41Å; Y164-F257 HydrophobicContact CE2-CE2 4.39Å; Y164-F257 AromaticContact CG-CE2 3.62Å; Y164-F257 HydrophobicContact CG-CE2 3.62Å; Y164-F257 AromaticContact CG-CZ 3.9Å; Y164-F257 HydrophobicContact CG-CZ 3.9Å; F254-F257 WeakPolarHBondContact O-CD2 3.46Å; F254-F257 PolarHBondContact O-N 2.94Å; F254-F257 VanDerWaalsContact O-N 3.09Å; L255-F257 PolarHBondContact O-N 3.04Å; L255-F257 VanDerWaalsContact O-N 3.14Å; F257-P259 VanDerWaalsContact C-N 3.3Å; F257-L260 HydrophobicContact CD1-CD1 3.97Å; F257-L260 WeakPolarHBondContact O-CB 3.4Å; F257-L260 PolarHBondContact O-N 3.3Å; F257-I261 PolarHBondContact O-N 2.9Å; F257-M439 HydrophobicContact CD2-CE 4.23Å; F257-M439 HydrophobicContact CD2-SD 3.79Å; F257-M439 HydrophobicContact CE2-CE 4.02Å; F257-M439 HydrophobicContact CE2-SD 4.03Å; F257-F526 HydrophobicContact CE1-CE2 4.46Å; F257-F526 HydrophobicContact CE2-CE2 4.04Å; F257-F526 AromaticContact CZ-CE2 3.64Å; F257-F526 HydrophobicContact CZ-CE2 3.64Å; F257-F526 HydrophobicContact CZ-CZ 4.19Å; F257-I529 HydrophobicContact CD1-CG2 3.58Å; F257-I529 HydrophobicContact CD2-CD1 4.45Å; F257-I529 HydrophobicContact CE1-CG2 3.77Å; F257-I529 HydrophobicContact CG-CG2 4.1Å; F257-I529 HydrophobicContact CZ-CG2 4.43Å
258	R	84.9	Confident	86.7	Confident	137 Å²	137	45.2 Å²	45.2	52%	0.517	22%	0.222	S	C	.	.	H	α-helix	trans	-51.2	-41.4	178.7	-166	-177.4	-166.9	178	2.5	113.7	L255 L260 I261 F262 Y436	L255-R258 WeakPolarHBondContact O-CB 3.4Å; L255-R258 PolarHBondContact O-N 3.41Å; R258-L260 VanDerWaalsContact C-N 3.33Å; R258-L260 PolarHBondContact O-N 3.39Å; R258-I261 PolarHBondContact O-N 3.19Å; R258-F262 HydrophobicContact CG-CD2 3.82Å; R258-F262 HydrophobicContact CG-CE2 3.47Å; R258-F262 VanDerWaalsContact CG-CE2 3.47Å; R258-F262 HydrophobicContact CG-CZ 4.37Å; R258-F262 VanDerWaalsContact O-CD2 3.29Å; R258-F262 WeakPolarHBondContact O-CD2 3.19Å; R258-F262 PolarHBondContact O-N 2.98Å; R258-F262 VanDerWaalsContact O-N 3.09Å; R258-Y436 HydrophobicContact CB-CE2 4.44Å
259	P	83.4	Confident	86.1	Confident	19 Å²	19	47 Å²	47	12%	0.123	23%	0.231	C	C	.	.	H	α-helix	trans	-63	-37.9	176.9	-21.3	35	0	0	0	113.1	V154 L156 V256 F257 I261 F262 E263	V154-P259 HydrophobicContact CB-CB 4.07Å; V154-P259 HydrophobicContact CB-CG 4.28Å; V154-P259 HydrophobicContact CG1-CB 3.37Å; V154-P259 HydrophobicContact CG1-CG 3.32Å; V154-P259 HydrophobicContact CG2-CB 4.23Å; V154-P259 HydrophobicContact CG2-CG 4.2Å; L156-P259 HydrophobicContact CD2-CB 3.99Å; V256-P259 VanDerWaalsContact O-CD 3.24Å; V256-P259 WeakPolarHBondContact O-CD 3.38Å; F257-P259 VanDerWaalsContact C-N 3.3Å; P259-I261 VanDerWaalsContact C-N 3.28Å; P259-I261 PolarHBondContact O-N 3.46Å; P259-F262 PolarHBondContact O-N 3.41Å; P259-E263 WeakPolarHBondContact O-CB 3.48Å; P259-E263 PolarHBondContact O-N 3.43Å
260	L	84.4	Confident	85.7	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-62.9	-38.7	177.1	-56.6	-177.1	0	0	0	111.2	V159 F257 R258 S264 I529 Y532 Q533 I536	V159-L260 HydrophobicContact CG1-CD1 3.91Å; V159-L260 HydrophobicContact CG1-CG 4.18Å; V159-L260 HydrophobicContact CG2-CD2 4.16Å; V159-L260 HydrophobicContact CG2-CG 4.31Å; F257-L260 HydrophobicContact CD1-CD1 3.97Å; F257-L260 WeakPolarHBondContact O-CB 3.4Å; F257-L260 PolarHBondContact O-N 3.3Å; R258-L260 VanDerWaalsContact C-N 3.33Å; R258-L260 PolarHBondContact O-N 3.39Å; L260-S264 VanDerWaalsContact O-CB 3.31Å; L260-S264 WeakPolarHBondContact O-CB 3.41Å; L260-S264 PolarHBondContact O-N 3.45Å; L260-S264 PolarHBondContact O-OG 2.91Å; L260-I529 HydrophobicContact CD1-CG2 3.87Å; L260-Y532 HydrophobicContact CB-CD1 4.2Å; L260-Y532 HydrophobicContact CB-CE1 4.44Å; L260-Y532 WeakPolarHBondContact O-CE1 3.43Å; L260-Q533 HydrophobicContact CD1-CB 4.29Å; L260-I536 HydrophobicContact CD2-CD1 3.3Å; L260-I536 HydrophobicContact CD2-CG1 4.49Å
261	I	82.9	Confident	85	Confident	16 Å²	16	45.4 Å²	45.4	8%	0.082	23%	0.233	C	C	.	.	H	α-helix	trans	-69	-48.1	-179.8	-62.6	161.7	0	0	0	110.3	F257 R258 P259 E263 S264 Q265 L432 P433 Y436	F257-I261 PolarHBondContact O-N 2.9Å; R258-I261 PolarHBondContact O-N 3.19Å; P259-I261 VanDerWaalsContact C-N 3.28Å; P259-I261 PolarHBondContact O-N 3.46Å; I261-E263 PolarHBondContact O-N 3.39Å; I261-S264 PolarHBondContact O-N 3.45Å; I261-S264 PolarHBondContact O-OG 3.15Å; I261-Q265 WeakPolarHBondContact O-CG 3.48Å; I261-Q265 PolarHBondContact O-N 3.49Å; I261-L432 HydrophobicContact CG1-CB 4.5Å; I261-P433 HydrophobicContact CG2-CG 4.24Å; I261-Y436 HydrophobicContact CD1-CD1 3.95Å; I261-Y436 HydrophobicContact CD1-CD2 3.07Å; I261-Y436 HydrophobicContact CD1-CE1 4.49Å; I261-Y436 HydrophobicContact CD1-CE2 3.68Å; I261-Y436 HydrophobicContact CD1-CG 3.18Å
262	F	81.7	Confident	84.3	Confident	85 Å²	85	46.7 Å²	46.7	37%	0.373	25%	0.247	S	C	.	.	H	α-helix	trans	-60.6	-45.6	177.6	-76.1	-57.2	0	0	0	111.8	I150 R258 P259 S264 Q265 L266	I150-F262 HydrophobicContact CD1-CB 3.72Å; R258-F262 HydrophobicContact CG-CD2 3.82Å; R258-F262 HydrophobicContact CG-CE2 3.47Å; R258-F262 VanDerWaalsContact CG-CE2 3.47Å; R258-F262 HydrophobicContact CG-CZ 4.37Å; R258-F262 VanDerWaalsContact O-CD2 3.29Å; R258-F262 WeakPolarHBondContact O-CD2 3.19Å; R258-F262 PolarHBondContact O-N 2.98Å; R258-F262 VanDerWaalsContact O-N 3.09Å; P259-F262 PolarHBondContact O-N 3.41Å; F262-S264 VanDerWaalsContact C-N 3.31Å; F262-S264 PolarHBondContact O-N 3.28Å; F262-Q265 PolarHBondContact O-N 2.96Å; F262-L266 WeakPolarHBondContact O-CG 3.4Å; F262-L266 PolarHBondContact O-N 2.74Å
263	E	84.2	Confident	83.6	Confident	3 Å²	3	44.1 Å²	44.1	1%	0.014	24%	0.235	C	C	.	.	H	α-helix	trans	-62.6	-39.5	176.9	-168.4	-77.9	147.4	0	0	111.3	L156 P259 I261 Q265 L266 R267 Y532 I536 Y545	L156-E263 HydrophobicContact CD1-CG 4.1Å; L156-E263 HydrophobicContact CD2-CB 4.39Å; P259-E263 WeakPolarHBondContact O-CB 3.48Å; P259-E263 PolarHBondContact O-N 3.43Å; I261-E263 PolarHBondContact O-N 3.39Å; E263-Q265 VanDerWaalsContact C-N 3.33Å; E263-Q265 PolarHBondContact O-N 2.99Å; E263-L266 PolarHBondContact O-N 3.06Å; E263-R267 VanDerWaalsContact O-CB 3.31Å; E263-R267 WeakPolarHBondContact O-CB 3.42Å; E263-R267 PolarHBondContact O-N 2.87Å; E263-R267 IonicContact OE1-CZ 2.56Å; E263-R267 VanDerWaalsContact OE1-CZ 3.26Å; E263-R267 IonicContact OE1-NE 3.66Å; E263-R267 PolarHBondContact OE1-NE 3.23Å; E263-R267 IonicContact OE1-NH2 3.51Å; E263-R267 PolarHBondContact OE1-NH2 3.4Å; E263-R267 IonicContact OE2-NE 2.85Å; E263-Y532 WeakPolarHBondContact OE2-CE1 3.44Å; E263-Y532 PolarHBondContact OE2-OH 3.21Å; E263-I536 WeakPolarHBondContact OE2-CG2 3.43Å; E263-Y545 PolarHBondContact OE1-OH 3.33Å
264	S	83.4	Confident	82.7	Confident	5 Å²	5	42.9 Å²	42.9	4%	0.035	24%	0.237	C	C	.	.	H	α-helix	trans	-63.2	-35.5	174.8	77.5	0	0	0	0	113.9	L260 I261 F262 S268 Y532	L260-S264 VanDerWaalsContact O-CB 3.31Å; L260-S264 WeakPolarHBondContact O-CB 3.41Å; L260-S264 PolarHBondContact O-N 3.45Å; L260-S264 PolarHBondContact O-OG 2.91Å; I261-S264 PolarHBondContact O-N 3.45Å; I261-S264 PolarHBondContact O-OG 3.15Å; F262-S264 VanDerWaalsContact C-N 3.31Å; F262-S264 PolarHBondContact O-N 3.28Å; S264-S268 WeakPolarHBondContact O-CB 3.42Å; S264-S268 PolarHBondContact O-N 2.88Å; S264-S268 PolarHBondContact O-OG 2.81Å; S264-Y532 WeakPolarHBondContact CA-OH 3.33Å; S264-Y532 WeakPolarHBondContact CB-OH 3.4Å; S264-Y532 PolarHBondContact N-OH 3.18Å
265	Q	83.8	Confident	82	Confident	82 Å²	82	50.1 Å²	50.1	38%	0.383	27%	0.269	S	S	.	.	H	α-helix	trans	-68.8	-47.3	176.1	-73.8	175.1	-29.3	0	0	110.7	I261 F262 E263 R267 S268 Q269	I261-Q265 WeakPolarHBondContact O-CG 3.48Å; I261-Q265 PolarHBondContact O-N 3.49Å; F262-Q265 PolarHBondContact O-N 2.96Å; E263-Q265 VanDerWaalsContact C-N 3.33Å; E263-Q265 PolarHBondContact O-N 2.99Å; Q265-R267 VanDerWaalsContact C-N 3.32Å; Q265-R267 PolarHBondContact O-N 3.46Å; Q265-S268 WeakPolarHBondContact O-CB 3.24Å; Q265-S268 PolarHBondContact O-N 3.45Å; Q265-Q269 WeakPolarHBondContact O-CG 3.12Å; Q265-Q269 PolarHBondContact O-N 2.72Å
266	L	84.7	Confident	81.3	Confident	16 Å²	16	48.4 Å²	48.4	8%	0.084	26%	0.257	C	S	.	.	H	α-helix	trans	-61.6	-41.4	176.3	-68.9	-177.5	0	0	0	111.7	V143 D146 I147 I150 F262 E263 S268 Q269 L270	V143-L266 HydrophobicContact CG1-CB 4.45Å; V143-L266 VanDerWaalsContact CG1-O 3.27Å; V143-L266 WeakPolarHBondContact CG1-O 3.23Å; D146-L266 HydrophobicContact CB-CD1 4.04Å; D146-L266 HydrophobicContact CB-CD2 3.78Å; I147-L266 HydrophobicContact CB-CD1 4.4Å; I147-L266 HydrophobicContact CD1-CB 4.29Å; I147-L266 HydrophobicContact CG1-CB 3.7Å; I147-L266 HydrophobicContact CG1-CD1 3.73Å; I147-L266 HydrophobicContact CG1-CG 4.35Å; I150-L266 HydrophobicContact CD1-CD1 3.37Å; I150-L266 HydrophobicContact CD1-CG 4.28Å; I150-L266 HydrophobicContact CG1-CD1 4.02Å; F262-L266 WeakPolarHBondContact O-CG 3.4Å; F262-L266 PolarHBondContact O-N 2.74Å; E263-L266 PolarHBondContact O-N 3.06Å; L266-S268 VanDerWaalsContact C-N 3.34Å; L266-S268 PolarHBondContact O-N 3.35Å; L266-Q269 WeakPolarHBondContact O-CB 3.14Å; L266-Q269 PolarHBondContact O-N 3.12Å; L266-L270 WeakPolarHBondContact O-CB 3.19Å; L266-L270 PolarHBondContact O-N 3.27Å
267	R	81.7	Confident	81.2	Confident	28 Å²	28	48.8 Å²	48.8	11%	0.106	26%	0.258	C	S	.	.	H	α-helix	trans	-64.9	-38.1	175.9	-174.5	176	-68.9	-129	-3.6	112.5	E263 Q265 L270 A271 H541 Y545	E263-R267 VanDerWaalsContact O-CB 3.31Å; E263-R267 WeakPolarHBondContact O-CB 3.42Å; E263-R267 PolarHBondContact O-N 2.87Å; E263-R267 IonicContact OE1-CZ 2.56Å; E263-R267 VanDerWaalsContact OE1-CZ 3.26Å; E263-R267 IonicContact OE1-NE 3.66Å; E263-R267 PolarHBondContact OE1-NE 3.23Å; E263-R267 IonicContact OE1-NH2 3.51Å; E263-R267 PolarHBondContact OE1-NH2 3.4Å; E263-R267 IonicContact OE2-NE 2.85Å; Q265-R267 VanDerWaalsContact C-N 3.32Å; Q265-R267 PolarHBondContact O-N 3.46Å; R267-L270 PolarHBondContact O-N 3.29Å; R267-A271 WeakPolarHBondContact O-CB 3.36Å; R267-A271 PolarHBondContact O-N 2.94Å; R267-H541 PolarHBondContact NH1-CD2 3.38Å; R267-H541 PolarHBondContact NH1-NE2 3Å; R267-Y545 PolarHBondContact NH2-OH 3.3Å
268	S	81.2	Confident	81	Confident	49 Å²	49	54.6 Å²	54.6	34%	0.343	29%	0.285	S	S	.	.	H	α-helix	trans	-64.7	-41.8	174.2	-60.5	0	0	0	0	111.2	S264 Q265 L266 A271 S272	S264-S268 WeakPolarHBondContact O-CB 3.42Å; S264-S268 PolarHBondContact O-N 2.88Å; S264-S268 PolarHBondContact O-OG 2.81Å; Q265-S268 WeakPolarHBondContact O-CB 3.24Å; Q265-S268 PolarHBondContact O-N 3.45Å; L266-S268 VanDerWaalsContact C-N 3.34Å; L266-S268 PolarHBondContact O-N 3.35Å; S268-A271 PolarHBondContact O-N 3.49Å; S268-S272 PolarHBondContact O-N 3.26Å
269	Q	82.3	Confident	81.2	Confident	93 Å²	93	54.6 Å²	54.6	44%	0.435	29%	0.291	S	S	.	.	H	α-helix	trans	-61.5	-47.6	172.6	-71.2	172.9	-12.4	0	0	110.8	V143 Q265 L266 A271 S272 T273	V143-Q269 HydrophobicContact CG1-CB 4.23Å; V143-Q269 HydrophobicContact CG2-CB 4Å; Q265-Q269 WeakPolarHBondContact O-CG 3.12Å; Q265-Q269 PolarHBondContact O-N 2.72Å; L266-Q269 WeakPolarHBondContact O-CB 3.14Å; L266-Q269 PolarHBondContact O-N 3.12Å; Q269-A271 VanDerWaalsContact C-N 3.29Å; Q269-A271 PolarHBondContact O-N 2.74Å; Q269-S272 PolarHBondContact O-N 2.74Å; Q269-S272 PolarHBondContact O-OG 2.89Å; Q269-T273 WeakPolarHBondContact O-CG2 3.48Å; Q269-T273 PolarHBondContact O-N 3.15Å
270	L	84.8	Confident	81.5	Confident	15 Å²	15	53.7 Å²	53.7	8%	0.079	29%	0.285	C	S	.	.	H	α-helix	trans	-59.2	-40.5	177.7	-171.6	65.6	0	0	0	111.7	R140 V143 L144 I147 L266 R267 S272 T273 F544	R140-L270 HydrophobicContact CG-CD1 3.78Å; R140-L270 PolarHBondContact NH1-O 2.97Å; V143-L270 HydrophobicContact CB-CD1 4.46Å; V143-L270 HydrophobicContact CG1-CB 3.8Å; V143-L270 HydrophobicContact CG1-CD1 4.23Å; L144-L270 HydrophobicContact CD2-CD1 3.77Å; L144-L270 HydrophobicContact CD2-CD2 3.85Å; L144-L270 HydrophobicContact CD2-CG 4.5Å; L144-L270 HydrophobicContact CG-CD1 3.88Å; I147-L270 HydrophobicContact CD1-CD2 3.95Å; L266-L270 WeakPolarHBondContact O-CB 3.19Å; L266-L270 PolarHBondContact O-N 3.27Å; R267-L270 PolarHBondContact O-N 3.29Å; L270-S272 VanDerWaalsContact C-N 3.32Å; L270-S272 PolarHBondContact O-N 2.65Å; L270-T273 PolarHBondContact O-N 3.42Å; L270-T273 PolarHBondContact O-OG1 3.15Å; L270-F544 HydrophobicContact CD2-CZ 4.34Å
271	A	79.9	Confident	81.6	Confident	52 Å²	52	54.4 Å²	54.4	43%	0.43	29%	0.288	S	S	.	.	H	α-helix	trans	-67.5	-31.2	175.8	0	0	0	0	0	113.2	R267 S268 Q269 T426	R267-A271 WeakPolarHBondContact O-CB 3.36Å; R267-A271 PolarHBondContact O-N 2.94Å; S268-A271 PolarHBondContact O-N 3.49Å; Q269-A271 VanDerWaalsContact C-N 3.29Å; Q269-A271 PolarHBondContact O-N 2.74Å; A271-T426 HydrophobicContact CB-CG2 3.63Å
272	S	76	Confident	82	Confident	99 Å²	99	58.2 Å²	58.2	69%	0.692	31%	0.309	S	S	*	.	H	α-helix	trans	-77.9	-20.9	177.3	74.3	0	0	0	0	113.6	S268 Q269 L270	S268-S272 PolarHBondContact O-N 3.26Å; Q269-S272 PolarHBondContact O-N 2.74Å; Q269-S272 PolarHBondContact O-OG 2.89Å; L270-S272 VanDerWaalsContact C-N 3.32Å; L270-S272 PolarHBondContact O-N 2.65Å
273	T	75.6	Confident	82.5	Confident	23 Å²	23	57.7 Å²	57.7	14%	0.141	31%	0.31	C	S	.	.	S	Bend	trans	-77.4	142.2	173.4	61.4	0	0	0	0	111	K139 R140 Q269 L270	K139-T273 HydrophobicContact CB-CG2 4.29Å; R140-T273 HydrophobicContact CB-CG2 4.41Å; R140-T273 WeakPolarHBondContact CG-OG1 3.14Å; R140-T273 PolarHBondContact NH1-O 3.37Å; R140-T273 PolarHBondContact NH1-OG1 2.55Å; Q269-T273 WeakPolarHBondContact O-CG2 3.48Å; Q269-T273 PolarHBondContact O-N 3.15Å; L270-T273 PolarHBondContact O-N 3.42Å; L270-T273 PolarHBondContact O-OG1 3.15Å
274	G	72.3	Confident	82.8	Confident	36 Å²	36	57.7 Å²	57.7	37%	0.371	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-62	167.3	174.2	0	0	0	0	0	112.5	R140	R140-G274 VanDerWaalsContact CD-O 3.28Å; R140-G274 WeakPolarHBondContact CD-O 3.48Å
275	K	73.7	Confident	83.3	Confident	159 Å²	159	57.8 Å²	57.8	69%	0.691	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-89.8	153.2	178.5	-68	-170.4	177.2	-170.9	0	111.9	M137	M137-K275 WeakPolarHBondContact CE-O 3.48Å
276	Y	74.6	Confident	83.7	Confident	44 Å²	44	60 Å²	60	17%	0.173	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-58.2	138.2	173.2	-56.7	-68.8	0	0	0	112.9	M137 R140 L144 I281 T416 D419	M137-Y276 HydrophobicContact CB-CD1 4.25Å; M137-Y276 HydrophobicContact CB-CE1 4.18Å; M137-Y276 HydrophobicContact CG-CD1 3.8Å; M137-Y276 HydrophobicContact CG-CE1 4.22Å; M137-Y276 VanDerWaalsContact SD-CA 3.55Å; M137-Y276 HydrophobicContact SD-CD1 3.18Å; M137-Y276 WeakPolarHBondContact SD-CD1 3.48Å; M137-Y276 HydrophobicContact SD-CE1 3.68Å; M137-Y276 HydrophobicContact SD-CG 3.94Å; R140-Y276 HydrophobicContact CB-CE1 4.45Å; R140-Y276 HydrophobicContact CG-CE1 4.37Å; R140-Y276 HydrophobicContact CG-CE2 4.38Å; R140-Y276 WeakPolarHBondContact CG-OH 3.41Å; L144-Y276 HydrophobicContact CD1-CE2 4.37Å; L144-Y276 WeakPolarHBondContact CD1-OH 3.4Å; Y276-I281 HydrophobicContact CD1-CD1 4.06Å; Y276-I281 HydrophobicContact CD1-CG1 3.87Å; Y276-I281 HydrophobicContact CG-CD1 3.94Å; Y276-I281 HydrophobicContact CG-CG1 4.25Å; Y276-T416 HydrophobicContact CD1-CG2 4.36Å; Y276-T416 HydrophobicContact CD2-CG2 4.47Å; Y276-T416 HydrophobicContact CE1-CG2 4.16Å; Y276-T416 HydrophobicContact CE2-CG2 4.18Å; Y276-D419 WeakPolarHBondContact CD2-OD2 3.45Å; Y276-D419 HydrophobicContact CE2-CB 3.78Å; Y276-D419 WeakPolarHBondContact CE2-OD2 3.45Å
277	D	82.7	Confident	84.1	Confident	61 Å²	61	59.8 Å²	59.8	33%	0.326	32%	0.319	S	S	.	.			trans	-109.4	150.2	149.8	61	81.1	0	0	0	108.6	E279 S280 I281	D277-E279 VanDerWaalsContact C-N 3.26Å; D277-E279 PolarHBondContact O-N 3.42Å; D277-E279 PolarHBondContact OD1-N 2.7Å; D277-S280 PolarHBondContact O-N 2.65Å; D277-S280 WeakPolarHBondContact OD1-CB 3.41Å; D277-S280 PolarHBondContact OD1-N 3.16Å; D277-S280 PolarHBondContact OD1-OG 3.34Å; D277-S280 PolarHBondContact OD2-OG 2.96Å; D277-I281 PolarHBondContact O-N 2.74Å
278	Q	83.7	Confident	84.7	Confident	123 Å²	123	58.4 Å²	58.4	58%	0.575	31%	0.314	S	S	*	.	H	α-helix	trans	-62.3	-36.1	-173.9	-172.5	62.3	49.2	0	0	111.9	S280 I281 D282	Q278-S280 VanDerWaalsContact C-N 3.33Å; Q278-S280 PolarHBondContact O-N 3.18Å; Q278-I281 PolarHBondContact O-N 2.84Å; Q278-D282 PolarHBondContact NE2-OD1 3.3Å; Q278-D282 PolarHBondContact O-N 3.3Å
279	E	88.9	Confident	85.2	Confident	138 Å²	138	58.5 Å²	58.5	65%	0.645	31%	0.309	S	S	*	.	H	α-helix	trans	-59.9	-43	178.5	-177.7	177.8	-175.1	0	0	111.5	D277 I281 D282 L283	D277-E279 VanDerWaalsContact C-N 3.26Å; D277-E279 PolarHBondContact O-N 3.42Å; D277-E279 PolarHBondContact OD1-N 2.7Å; E279-I281 PolarHBondContact O-N 2.64Å; E279-D282 PolarHBondContact O-N 3.38Å; E279-L283 HydrophobicContact CG-CD1 4.35Å; E279-L283 WeakPolarHBondContact O-CB 3.26Å; E279-L283 VanDerWaalsContact O-CG 3.31Å; E279-L283 WeakPolarHBondContact O-CG 3.49Å; E279-L283 PolarHBondContact O-N 3.26Å
280	S	88.6	Confident	85.7	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-65.6	-36.8	175.9	-60	0	0	0	0	113.3	N133 D277 Q278 L284	N133-S280 WeakPolarHBondContact CB-OG 3.34Å; N133-S280 PolarHBondContact ND2-OG 2.71Å; D277-S280 PolarHBondContact O-N 2.65Å; D277-S280 WeakPolarHBondContact OD1-CB 3.41Å; D277-S280 PolarHBondContact OD1-N 3.16Å; D277-S280 PolarHBondContact OD1-OG 3.34Å; D277-S280 PolarHBondContact OD2-OG 2.96Å; Q278-S280 VanDerWaalsContact C-N 3.33Å; Q278-S280 PolarHBondContact O-N 3.18Å; S280-L284 WeakPolarHBondContact O-CB 3.41Å; S280-L284 PolarHBondContact O-N 3.23Å
281	I	87.8	Confident	86.1	Confident	15 Å²	15	55.6 Å²	55.6	8%	0.077	30%	0.296	C	S	.	.	H	α-helix	trans	-65.1	-46.5	175.9	-67.6	169.2	0	0	0	109.5	Y276 D277 Q278 E279 L283 L284 G285 L412 T416	Y276-I281 HydrophobicContact CD1-CD1 4.06Å; Y276-I281 HydrophobicContact CD1-CG1 3.87Å; Y276-I281 HydrophobicContact CG-CD1 3.94Å; Y276-I281 HydrophobicContact CG-CG1 4.25Å; D277-I281 PolarHBondContact O-N 2.74Å; Q278-I281 PolarHBondContact O-N 2.84Å; E279-I281 PolarHBondContact O-N 2.64Å; I281-L283 VanDerWaalsContact C-N 3.32Å; I281-L283 PolarHBondContact O-N 3.35Å; I281-L284 PolarHBondContact O-N 2.7Å; I281-G285 PolarHBondContact O-N 3.05Å; I281-L412 HydrophobicContact CG2-CD2 4.1Å; I281-L412 HydrophobicContact CG2-CG 4.17Å; I281-T416 HydrophobicContact CD1-CG2 3.65Å; I281-T416 HydrophobicContact CG1-CG2 4.01Å; I281-T416 HydrophobicContact CG2-CG2 4.36Å
282	D	90.7	Very high	86.8	Confident	97 Å²	97	53.3 Å²	53.3	52%	0.519	28%	0.277	S	S	.	.	H	α-helix	trans	-63.4	-40.6	-179	-63.3	-11.9	0	0	0	110.8	Q278 E279 K286	Q278-D282 PolarHBondContact NE2-OD1 3.3Å; Q278-D282 PolarHBondContact O-N 3.3Å; E279-D282 PolarHBondContact O-N 3.38Å; D282-K286 WeakPolarHBondContact O-CB 3.39Å; D282-K286 PolarHBondContact O-N 3.37Å
283	L	91.2	Very high	87.6	Confident	74 Å²	74	55.5 Å²	55.5	39%	0.387	28%	0.276	S	S	.	.	H	α-helix	trans	-64.8	-44.5	174.8	-73.8	172.5	0	0	0	112.6	P131 V134 E279 I281 K286 L287	P131-L283 HydrophobicContact CG-CD1 4.44Å; V134-L283 HydrophobicContact CG2-CB 3.85Å; V134-L283 HydrophobicContact CG2-CD1 4.07Å; E279-L283 HydrophobicContact CG-CD1 4.35Å; E279-L283 WeakPolarHBondContact O-CB 3.26Å; E279-L283 VanDerWaalsContact O-CG 3.31Å; E279-L283 WeakPolarHBondContact O-CG 3.49Å; E279-L283 PolarHBondContact O-N 3.26Å; I281-L283 VanDerWaalsContact C-N 3.32Å; I281-L283 PolarHBondContact O-N 3.35Å; L283-K286 PolarHBondContact O-N 2.98Å; L283-L287 WeakPolarHBondContact O-CB 3.38Å; L283-L287 PolarHBondContact O-N 3.44Å
284	L	92.2	Very high	88.4	Confident	2 Å²	2	55.5 Å²	55.5	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-65.1	-42.5	177.4	-179.4	58.9	0	0	0	111.4	V134 M137 E138 L141 S280 I281 L287 F288 L412 F565	V134-L284 HydrophobicContact CG1-CB 4.3Å; V134-L284 HydrophobicContact CG1-CD1 4.26Å; M137-L284 HydrophobicContact CB-CD2 4.3Å; E138-L284 HydrophobicContact CG-CD1 3.7Å; E138-L284 HydrophobicContact CG-CD2 4.39Å; L141-L284 HydrophobicContact CD2-CD2 4.02Å; S280-L284 WeakPolarHBondContact O-CB 3.41Å; S280-L284 PolarHBondContact O-N 3.23Å; I281-L284 PolarHBondContact O-N 2.7Å; L284-L287 PolarHBondContact O-N 3.05Å; L284-F288 HydrophobicContact CD1-CD1 4.27Å; L284-F288 HydrophobicContact CD1-CE1 3.76Å; L284-F288 HydrophobicContact CD1-CE2 4.35Å; L284-F288 HydrophobicContact CD1-CZ 3.81Å; L284-F288 HydrophobicContact CD2-CE2 4.4Å; L284-F288 HydrophobicContact CD2-CZ 4.28Å; L284-F288 HydrophobicContact CG-CD2 4.49Å; L284-F288 HydrophobicContact CG-CE1 4.37Å; L284-F288 HydrophobicContact CG-CE2 4.07Å; L284-F288 HydrophobicContact CG-CZ 4Å; L284-F288 WeakPolarHBondContact O-CG 3.31Å; L284-F288 PolarHBondContact O-N 3.27Å; L284-L412 HydrophobicContact CD2-CD1 4.47Å; L284-F565 HydrophobicContact CD1-CE2 4.12Å
285	G	92.6	Very high	89.4	Confident	8 Å²	8	53.8 Å²	53.8	8%	0.082	26%	0.256	C	S	.	.	H	α-helix	trans	-59.4	-46.8	175.8	0	0	0	0	0	111.4	I281 L287 F288 E289	I281-G285 PolarHBondContact O-N 3.05Å; G285-L287 VanDerWaalsContact C-N 3.35Å; G285-L287 PolarHBondContact O-N 3.27Å; G285-F288 WeakPolarHBondContact O-CB 3.35Å; G285-F288 PolarHBondContact O-N 2.81Å; G285-E289 WeakPolarHBondContact O-CG 3.38Å; G285-E289 PolarHBondContact O-N 3.27Å
286	K	92.3	Very high	90.3	Very high	127 Å²	127	50.7 Å²	50.7	55%	0.552	24%	0.244	S	C	*	.	H	α-helix	trans	-58.5	-46.3	174.6	-172.7	-172.7	171.8	-160.6	0	111.9	D282 L283 F288 E289 D290	D282-K286 WeakPolarHBondContact O-CB 3.39Å; D282-K286 PolarHBondContact O-N 3.37Å; L283-K286 PolarHBondContact O-N 2.98Å; K286-F288 VanDerWaalsContact C-N 3.29Å; K286-F288 PolarHBondContact O-N 3.04Å; K286-E289 PolarHBondContact O-N 2.86Å; K286-E289 VanDerWaalsContact O-N 3.12Å; K286-D290 VanDerWaalsContact O-CG 3.26Å; K286-D290 PolarHBondContact O-N 3.4Å
287	L	92.9	Very high	91.1	Very high	12 Å²	12	51 Å²	51	6%	0.063	25%	0.249	C	C	.	.	H	α-helix	trans	-61.6	-37.5	179.6	-171.4	60.8	0	0	0	112.2	D126 I127 L283 L284 G285 V291 F565	D126-L287 HydrophobicContact CB-CD1 3.64Å; I127-L287 HydrophobicContact CG1-CD1 3.91Å; I127-L287 HydrophobicContact CG1-CD2 4.09Å; I127-L287 HydrophobicContact CG1-CG 4.23Å; L283-L287 WeakPolarHBondContact O-CB 3.38Å; L283-L287 PolarHBondContact O-N 3.44Å; L284-L287 PolarHBondContact O-N 3.05Å; G285-L287 VanDerWaalsContact C-N 3.35Å; G285-L287 PolarHBondContact O-N 3.27Å; L287-V291 WeakPolarHBondContact O-CG2 3.38Å; L287-V291 PolarHBondContact O-N 3.07Å; L287-V291 VanDerWaalsContact O-N 3.17Å; L287-F565 HydrophobicContact CB-CE2 4.43Å; L287-F565 HydrophobicContact CB-CZ 4.3Å; L287-F565 HydrophobicContact CD2-CD2 4.17Å; L287-F565 HydrophobicContact CD2-CE2 3.39Å; L287-F565 HydrophobicContact CD2-CZ 3.81Å; L287-F565 HydrophobicContact CG-CE2 3.7Å; L287-F565 HydrophobicContact CG-CZ 3.55Å
288	F	94.5	Very high	91.5	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.1	-48.7	171.6	-73.7	-16.4	0	0	0	111.9	L141 L284 G285 K286 D290 V291 L292 V408 V558 L561 L562 F565	L141-F288 HydrophobicContact CD2-CE2 3.94Å; L141-F288 HydrophobicContact CD2-CZ 4.09Å; L284-F288 HydrophobicContact CD1-CD1 4.27Å; L284-F288 HydrophobicContact CD1-CE1 3.76Å; L284-F288 HydrophobicContact CD1-CE2 4.35Å; L284-F288 HydrophobicContact CD1-CZ 3.81Å; L284-F288 HydrophobicContact CD2-CE2 4.4Å; L284-F288 HydrophobicContact CD2-CZ 4.28Å; L284-F288 HydrophobicContact CG-CD2 4.49Å; L284-F288 HydrophobicContact CG-CE1 4.37Å; L284-F288 HydrophobicContact CG-CE2 4.07Å; L284-F288 HydrophobicContact CG-CZ 4Å; L284-F288 WeakPolarHBondContact O-CG 3.31Å; L284-F288 PolarHBondContact O-N 3.27Å; G285-F288 WeakPolarHBondContact O-CB 3.35Å; G285-F288 PolarHBondContact O-N 2.81Å; K286-F288 VanDerWaalsContact C-N 3.29Å; K286-F288 PolarHBondContact O-N 3.04Å; F288-D290 PolarHBondContact O-N 3.04Å; F288-V291 PolarHBondContact O-N 3.22Å; F288-L292 VanDerWaalsContact O-CG 3.3Å; F288-L292 WeakPolarHBondContact O-CG 3.47Å; F288-L292 PolarHBondContact O-N 3.24Å; F288-V408 HydrophobicContact CB-CG2 3.69Å; F288-V408 HydrophobicContact CD2-CG2 3.53Å; F288-V408 HydrophobicContact CE2-CG2 4.44Å; F288-V408 HydrophobicContact CG-CG2 3.93Å; F288-V558 HydrophobicContact CE2-CG1 4.25Å; F288-V558 HydrophobicContact CE2-CG2 4.18Å; F288-V558 HydrophobicContact CZ-CG1 4.45Å; F288-L561 HydrophobicContact CB-CD1 3.89Å; F288-L561 HydrophobicContact CD1-CB 3.79Å; F288-L561 HydrophobicContact CD1-CD1 3.89Å; F288-L561 HydrophobicContact CD1-CD2 4.3Å; F288-L561 HydrophobicContact CD1-CG 4.22Å; F288-L561 HydrophobicContact CD2-CD1 4.26Å; F288-L561 HydrophobicContact CE1-CB 3.73Å; F288-L561 HydrophobicContact CE1-CD1 4.48Å; F288-L561 HydrophobicContact CG-CB 4.49Å; F288-L561 HydrophobicContact CG-CD1 3.78Å; F288-L561 HydrophobicContact CZ-CB 4.35Å; F288-L562 HydrophobicContact CE1-CD2 4.19Å; F288-L562 HydrophobicContact CE1-CG 4.47Å; F288-L562 HydrophobicContact CZ-CD2 3.83Å; F288-L562 HydrophobicContact CZ-CG 4.02Å; F288-F565 HydrophobicContact CD1-CE1 4.16Å; F288-F565 AromaticContact CD1-CE2 3.77Å; F288-F565 HydrophobicContact CD1-CE2 3.77Å; F288-F565 AromaticContact CD1-CZ 3.39Å; F288-F565 HydrophobicContact CD1-CZ 3.39Å; F288-F565 HydrophobicContact CE1-CD2 4.32Å; F288-F565 HydrophobicContact CE1-CE1 4.4Å; F288-F565 AromaticContact CE1-CE2 3.59Å; F288-F565 HydrophobicContact CE1-CE2 3.59Å; F288-F565 AromaticContact CE1-CZ 3.66Å; F288-F565 HydrophobicContact CE1-CZ 3.66Å
289	E	93.1	Very high	91.7	Very high	50 Å²	50	49 Å²	49	23%	0.234	24%	0.236	C	C	.	.	H	α-helix	trans	-63.7	-40.3	179.5	-61.5	-59.4	160	0	0	112	G285 K286 V291 L292 E293 S407 V408 S409	G285-E289 WeakPolarHBondContact O-CG 3.38Å; G285-E289 PolarHBondContact O-N 3.27Å; K286-E289 PolarHBondContact O-N 2.86Å; K286-E289 VanDerWaalsContact O-N 3.12Å; E289-V291 VanDerWaalsContact C-N 3.33Å; E289-V291 PolarHBondContact O-N 3.49Å; E289-L292 PolarHBondContact O-N 3.01Å; E289-E293 WeakPolarHBondContact O-CB 3.42Å; E289-E293 PolarHBondContact O-N 3Å; E289-S407 WeakPolarHBondContact OE1-CB 3.44Å; E289-S407 PolarHBondContact OE1-OG 3.06Å; E289-V408 PolarHBondContact OE1-N 3.26Å; E289-S409 PolarHBondContact OE1-OG 2.9Å
290	D	92.2	Very high	91.7	Very high	48 Å²	48	45 Å²	45	26%	0.257	22%	0.223	S	C	.	.	H	α-helix	trans	-61.1	-41.1	177.6	-68.1	-22	0	0	0	111.3	K286 F288 F294	K286-D290 VanDerWaalsContact O-CG 3.26Å; K286-D290 PolarHBondContact O-N 3.4Å; F288-D290 PolarHBondContact O-N 3.04Å; D290-F294 PolarHBondContact O-N 3.42Å; D290-F294 VanDerWaalsContact O-N 3.14Å
291	V	93.3	Very high	91.9	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-70.2	-40.5	176.1	170.3	0	0	0	0	111.9	I123 I127 L287 F288 E289 S295 M399 L402 L561 F565	I123-V291 HydrophobicContact CG1-CG2 4.43Å; I123-V291 HydrophobicContact CG2-CG2 3.75Å; I127-V291 HydrophobicContact CD1-CG2 4.13Å; L287-V291 WeakPolarHBondContact O-CG2 3.38Å; L287-V291 PolarHBondContact O-N 3.07Å; L287-V291 VanDerWaalsContact O-N 3.17Å; F288-V291 PolarHBondContact O-N 3.22Å; E289-V291 VanDerWaalsContact C-N 3.33Å; E289-V291 PolarHBondContact O-N 3.49Å; V291-S295 WeakPolarHBondContact O-CB 3.36Å; V291-S295 PolarHBondContact O-N 3Å; V291-M399 HydrophobicContact CG1-CE 4.02Å; V291-L402 HydrophobicContact CG1-CD1 3.9Å; V291-L561 HydrophobicContact CB-CD2 4.1Å; V291-L561 HydrophobicContact CG1-CD2 3.7Å; V291-F565 HydrophobicContact CB-CE1 4.24Å; V291-F565 HydrophobicContact CG1-CE1 4.37Å; V291-F565 HydrophobicContact CG2-CE1 3.76Å; V291-F565 HydrophobicContact CG2-CZ 4.31Å
292	L	93.6	Very high	92.1	Very high	3 Å²	3	45.3 Å²	45.3	2%	0.016	23%	0.225	C	C	.	.	H	α-helix	trans	-64.9	-42.4	176.2	-70.9	-177.4	0	0	0	111.5	F288 E289 S295 Q296 L402 F405 V408 L561	F288-L292 VanDerWaalsContact O-CG 3.3Å; F288-L292 WeakPolarHBondContact O-CG 3.47Å; F288-L292 PolarHBondContact O-N 3.24Å; E289-L292 PolarHBondContact O-N 3.01Å; L292-S295 WeakPolarHBondContact O-CB 3.3Å; L292-S295 PolarHBondContact O-N 3.02Å; L292-S295 PolarHBondContact O-OG 3.26Å; L292-Q296 WeakPolarHBondContact O-CG 3.34Å; L292-Q296 PolarHBondContact O-N 3.31Å; L292-L402 HydrophobicContact CD2-CB 4.17Å; L292-F405 HydrophobicContact CD1-CB 4.27Å; L292-F405 HydrophobicContact CD2-CB 3.78Å; L292-F405 HydrophobicContact CD2-CD2 4.44Å; L292-V408 HydrophobicContact CD1-CG1 4.3Å; L292-V408 HydrophobicContact CD1-CG2 4.32Å; L292-L561 HydrophobicContact CD1-CD1 4.24Å; L292-L561 HydrophobicContact CD2-CD1 4.18Å; L292-L561 HydrophobicContact CD2-CD2 3.99Å; L292-L561 HydrophobicContact CD2-CG 4.34Å; L292-L561 HydrophobicContact CG-CD1 4.17Å; L292-L561 HydrophobicContact CG-CD2 4.2Å
293	E	92.7	Very high	92.1	Very high	146 Å²	146	45.9 Å²	45.9	68%	0.682	22%	0.224	S	C	*	.	H	α-helix	trans	-59.8	-49.4	176.9	-175.6	175.8	175.1	0	0	110.9	E289 S295 Q296	E289-E293 WeakPolarHBondContact O-CB 3.42Å; E289-E293 PolarHBondContact O-N 3Å; E293-S295 VanDerWaalsContact C-N 3.28Å; E293-S295 PolarHBondContact O-N 3.39Å; E293-Q296 WeakPolarHBondContact O-CB 3.49Å; E293-Q296 PolarHBondContact O-N 3.35Å
294	F	92.3	Very high	92.1	Very high	22 Å²	22	43.1 Å²	43.1	10%	0.096	21%	0.21	C	C	.	.	H	α-helix	trans	-64.3	-34	177	-176.4	-90.2	0	0	0	112.8	G119 F120 I123 D290 Q296 D297 F301 L396 M399	G119-F294 VanDerWaalsContact CA-CE2 3.48Å; F120-F294 HydrophobicContact CD2-CE1 4.04Å; F120-F294 AromaticContact CD2-CZ 3.64Å; F120-F294 HydrophobicContact CD2-CZ 3.64Å; F120-F294 AromaticContact CE2-CE1 3.87Å; F120-F294 HydrophobicContact CE2-CE1 3.87Å; F120-F294 AromaticContact CE2-CZ 3.84Å; F120-F294 HydrophobicContact CE2-CZ 3.84Å; F120-F294 HydrophobicContact CG-CZ 4.22Å; F120-F294 HydrophobicContact CZ-CE1 4.16Å; I123-F294 HydrophobicContact CD1-CB 3.3Å; I123-F294 HydrophobicContact CD1-CD1 3.56Å; I123-F294 HydrophobicContact CD1-CD2 3.87Å; I123-F294 HydrophobicContact CD1-CE1 4.27Å; I123-F294 HydrophobicContact CD1-CG 3.29Å; D290-F294 PolarHBondContact O-N 3.42Å; D290-F294 VanDerWaalsContact O-N 3.14Å; F294-Q296 PolarHBondContact O-N 3.24Å; F294-D297 PolarHBondContact O-N 3.1Å; F294-F301 HydrophobicContact CD1-CE2 4.29Å; F294-F301 AromaticContact CD2-CE2 3.8Å; F294-F301 HydrophobicContact CD2-CE2 3.8Å; F294-F301 HydrophobicContact CD2-CZ 4.44Å; F294-F301 HydrophobicContact CE1-CD2 4.08Å; F294-F301 AromaticContact CE1-CE2 3.99Å; F294-F301 HydrophobicContact CE1-CE2 3.99Å; F294-F301 HydrophobicContact CE2-CD2 4.13Å; F294-F301 AromaticContact CE2-CE2 3.38Å; F294-F301 HydrophobicContact CE2-CE2 3.38Å; F294-F301 HydrophobicContact CE2-CZ 4.06Å; F294-F301 HydrophobicContact CG-CE2 4.25Å; F294-F301 AromaticContact CZ-CD2 3.8Å; F294-F301 HydrophobicContact CZ-CD2 3.8Å; F294-F301 AromaticContact CZ-CE2 3.53Å; F294-F301 HydrophobicContact CZ-CE2 3.53Å; F294-L396 HydrophobicContact CE1-CD2 4.03Å; F294-L396 HydrophobicContact CZ-CD2 4.45Å; F294-M399 HydrophobicContact CB-CE 4.48Å; F294-M399 HydrophobicContact CD1-CE 3.32Å; F294-M399 HydrophobicContact CD1-SD 3.44Å; F294-M399 WeakPolarHBondContact CD1-SD 3.48Å; F294-M399 HydrophobicContact CE1-CE 3.9Å; F294-M399 HydrophobicContact CE1-SD 3.4Å; F294-M399 WeakPolarHBondContact CE1-SD 3.44Å; F294-M399 HydrophobicContact CG-CE 4.29Å
295	S	93.4	Very high	92.1	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-62.6	-26.2	177.4	82.2	0	0	0	0	113.1	V291 L292 E293 D297 S298 M399 S403	V291-S295 WeakPolarHBondContact O-CB 3.36Å; V291-S295 PolarHBondContact O-N 3Å; L292-S295 WeakPolarHBondContact O-CB 3.3Å; L292-S295 PolarHBondContact O-N 3.02Å; L292-S295 PolarHBondContact O-OG 3.26Å; E293-S295 VanDerWaalsContact C-N 3.28Å; E293-S295 PolarHBondContact O-N 3.39Å; S295-D297 PolarHBondContact O-N 3.33Å; S295-S298 WeakPolarHBondContact O-CB 3.36Å; S295-S298 PolarHBondContact O-N 3.16Å; S295-S298 PolarHBondContact O-OG 3.43Å; S295-M399 WeakPolarHBondContact CB-O 3.43Å; S295-S403 WeakPolarHBondContact O-CB 3.42Å; S295-S403 WeakPolarHBondContact OG-CA 3.39Å; S295-S403 PolarHBondContact OG-N 3.17Å
296	Q	92.9	Very high	92.1	Very high	94 Å²	94	46.3 Å²	46.3	44%	0.439	22%	0.223	S	C	.	.	H	α-helix	trans	-61.8	-32.8	178.4	-62.9	-56.6	-41	0	0	112.5	L292 E293 F294 S403 F405	L292-Q296 WeakPolarHBondContact O-CG 3.34Å; L292-Q296 PolarHBondContact O-N 3.31Å; E293-Q296 WeakPolarHBondContact O-CB 3.49Å; E293-Q296 PolarHBondContact O-N 3.35Å; F294-Q296 PolarHBondContact O-N 3.24Å; Q296-S403 PolarHBondContact NE2-O 3.07Å; Q296-S403 PolarHBondContact OE1-O 2.89Å; Q296-F405 PolarHBondContact NE2-O 3.37Å
297	D	91.9	Very high	92	Very high	51 Å²	51	42 Å²	42	27%	0.273	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-3.2	-178.8	-73.2	-35.7	0	0	0	113.4	R115 F294 S295 K299 S300 F301	R115-D297 IonicContact CZ-OD2 3.32Å; R115-D297 IonicContact NH1-OD2 3.1Å; R115-D297 PolarHBondContact NH1-OD2 3.11Å; R115-D297 IonicContact NH2-OD2 3.73Å; R115-D297 PolarHBondContact NH2-OD2 3.46Å; F294-D297 PolarHBondContact O-N 3.1Å; S295-D297 PolarHBondContact O-N 3.33Å; D297-K299 VanDerWaalsContact C-N 3.25Å; D297-K299 PolarHBondContact O-N 2.69Å; D297-K299 VanDerWaalsContact O-N 3.11Å; D297-S300 PolarHBondContact O-N 3.3Å; D297-F301 HydrophobicContact CB-CD1 4.24Å; D297-F301 HydrophobicContact CB-CD2 4.06Å; D297-F301 HydrophobicContact CB-CE1 3.72Å; D297-F301 HydrophobicContact CB-CE2 3.48Å; D297-F301 VanDerWaalsContact CB-CE2 3.48Å; D297-F301 HydrophobicContact CB-CG 4.41Å; D297-F301 HydrophobicContact CB-CZ 3.3Å; D297-F301 VanDerWaalsContact O-CG 3.24Å; D297-F301 WeakPolarHBondContact O-CG 3.38Å; D297-F301 PolarHBondContact O-N 2.9Å
298	S	90.6	Very high	91.9	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.007	21%	0.206	C	C	.	.	H	α-helix	trans	-52.2	-38	-174.7	59.4	0	0	0	0	114.1	S295 F301 L302 S400	S295-S298 WeakPolarHBondContact O-CB 3.36Å; S295-S298 PolarHBondContact O-N 3.16Å; S295-S298 PolarHBondContact O-OG 3.43Å; S298-F301 WeakPolarHBondContact O-CB 3.38Å; S298-F301 PolarHBondContact O-N 3.48Å; S298-L302 WeakPolarHBondContact O-CG 3.29Å; S298-L302 PolarHBondContact O-N 2.67Å; S298-S400 WeakPolarHBondContact OG-CA 3.44Å; S298-S400 VanDerWaalsContact OG-CB 3.25Å; S298-S400 WeakPolarHBondContact OG-CB 3.47Å
299	K	87.4	Confident	91.7	Very high	141 Å²	141	42.9 Å²	42.9	61%	0.613	21%	0.213	S	C	*	.	H	α-helix	trans	-64.9	-48.4	176.9	-176.8	-179.4	175.1	-176.2	0	111.8	D297 F301 L302 E303	D297-K299 VanDerWaalsContact C-N 3.25Å; D297-K299 PolarHBondContact O-N 2.69Å; D297-K299 VanDerWaalsContact O-N 3.11Å; K299-F301 PolarHBondContact O-N 2.92Å; K299-L302 PolarHBondContact O-N 2.78Å; K299-E303 WeakPolarHBondContact CE-OE1 3.44Å; K299-E303 WeakPolarHBondContact O-CG 3.21Å; K299-E303 PolarHBondContact O-N 3.01Å; K299-E303 VanDerWaalsContact O-N 3.1Å
300	S	89.3	Confident	91.4	Very high	54 Å²	54	45.1 Å²	45.1	38%	0.378	23%	0.226	S	C	.	.	H	α-helix	trans	-63.7	-32.8	176.6	-179.3	0	0	0	0	111.3	D297 N304	D297-S300 PolarHBondContact O-N 3.3Å; S300-N304 WeakPolarHBondContact O-CB 3.2Å; S300-N304 PolarHBondContact O-N 3.42Å
301	F	93.3	Very high	91.2	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.009	21%	0.214	C	C	.	.	H	α-helix	trans	-65.8	-45.7	174.8	-64.5	-19.6	0	0	0	112	V112 R115 I116 F294 D297 S298 K299 N304 L305 L396	V112-F301 HydrophobicContact CG1-CD1 3.68Å; V112-F301 HydrophobicContact CG1-CE1 4.08Å; R115-F301 HydrophobicContact CB-CE1 4.11Å; R115-F301 HydrophobicContact CB-CZ 4.24Å; I116-F301 HydrophobicContact CD1-CB 3.77Å; I116-F301 HydrophobicContact CD1-CD1 4.06Å; I116-F301 HydrophobicContact CD1-CG 4.14Å; I116-F301 WeakPolarHBondContact CD1-O 3.41Å; I116-F301 HydrophobicContact CG1-CB 3.62Å; I116-F301 HydrophobicContact CG1-CD1 3.4Å; I116-F301 VanDerWaalsContact CG1-CD1 3.4Å; I116-F301 HydrophobicContact CG1-CD2 4.19Å; I116-F301 HydrophobicContact CG1-CE1 4.05Å; I116-F301 HydrophobicContact CG1-CG 3.48Å; I116-F301 VanDerWaalsContact CG1-CG 3.48Å; F294-F301 HydrophobicContact CD1-CE2 4.29Å; F294-F301 AromaticContact CD2-CE2 3.8Å; F294-F301 HydrophobicContact CD2-CE2 3.8Å; F294-F301 HydrophobicContact CD2-CZ 4.44Å; F294-F301 HydrophobicContact CE1-CD2 4.08Å; F294-F301 AromaticContact CE1-CE2 3.99Å; F294-F301 HydrophobicContact CE1-CE2 3.99Å; F294-F301 HydrophobicContact CE2-CD2 4.13Å; F294-F301 AromaticContact CE2-CE2 3.38Å; F294-F301 HydrophobicContact CE2-CE2 3.38Å; F294-F301 HydrophobicContact CE2-CZ 4.06Å; F294-F301 HydrophobicContact CG-CE2 4.25Å; F294-F301 AromaticContact CZ-CD2 3.8Å; F294-F301 HydrophobicContact CZ-CD2 3.8Å; F294-F301 AromaticContact CZ-CE2 3.53Å; F294-F301 HydrophobicContact CZ-CE2 3.53Å; D297-F301 HydrophobicContact CB-CD1 4.24Å; D297-F301 HydrophobicContact CB-CD2 4.06Å; D297-F301 HydrophobicContact CB-CE1 3.72Å; D297-F301 HydrophobicContact CB-CE2 3.48Å; D297-F301 VanDerWaalsContact CB-CE2 3.48Å; D297-F301 HydrophobicContact CB-CG 4.41Å; D297-F301 HydrophobicContact CB-CZ 3.3Å; D297-F301 VanDerWaalsContact O-CG 3.24Å; D297-F301 WeakPolarHBondContact O-CG 3.38Å; D297-F301 PolarHBondContact O-N 2.9Å; S298-F301 WeakPolarHBondContact O-CB 3.38Å; S298-F301 PolarHBondContact O-N 3.48Å; K299-F301 PolarHBondContact O-N 2.92Å; F301-N304 PolarHBondContact O-N 3.48Å; F301-L305 PolarHBondContact O-N 3.36Å; F301-L396 HydrophobicContact CB-CD1 3.68Å; F301-L396 HydrophobicContact CB-CD2 3.76Å; F301-L396 HydrophobicContact CB-CG 4.37Å; F301-L396 HydrophobicContact CD2-CD2 3.83Å; F301-L396 HydrophobicContact CG-CD2 4.29Å
302	L	91.6	Very high	91	Very high	20 Å²	20	43 Å²	43	11%	0.105	22%	0.215	C	C	.	.	H	α-helix	trans	-58.9	-50.4	176.5	-77.2	168.8	0	0	0	112.1	S298 K299 N304 L305 E306 K393 L396 K397	S298-L302 WeakPolarHBondContact O-CG 3.29Å; S298-L302 PolarHBondContact O-N 2.67Å; K299-L302 PolarHBondContact O-N 2.78Å; L302-N304 PolarHBondContact O-N 3.45Å; L302-L305 PolarHBondContact O-N 3.13Å; L302-E306 WeakPolarHBondContact O-CB 3.4Å; L302-E306 WeakPolarHBondContact O-CG 3.24Å; L302-E306 PolarHBondContact O-N 3Å; L302-K393 HydrophobicContact CD2-CB 4.31Å; L302-K393 WeakPolarHBondContact CD2-O 3.45Å; L302-L396 HydrophobicContact CD1-CB 4.36Å; L302-L396 HydrophobicContact CD2-CB 3.46Å; L302-L396 VanDerWaalsContact CD2-CB 3.46Å; L302-L396 HydrophobicContact CD2-CD1 4.15Å; L302-L396 HydrophobicContact CD2-CG 4.47Å; L302-L396 HydrophobicContact CG-CB 3.69Å; L302-L396 HydrophobicContact CG-CD1 4.32Å; L302-K397 HydrophobicContact CD1-CG 3.97Å; L302-K397 HydrophobicContact CD2-CG 3.93Å
303	E	91.3	Very high	90.4	Very high	108 Å²	108	49.6 Å²	49.6	51%	0.505	24%	0.24	S	C	.	.	H	α-helix	trans	-57.8	-37.4	179.5	-70.1	172.5	-174	0	0	111.5	K299 S307	K299-E303 WeakPolarHBondContact CE-OE1 3.44Å; K299-E303 WeakPolarHBondContact O-CG 3.21Å; K299-E303 PolarHBondContact O-N 3.01Å; K299-E303 VanDerWaalsContact O-N 3.1Å; E303-S307 PolarHBondContact O-N 2.92Å
304	N	91.7	Very high	89.7	Confident	16 Å²	16	43.7 Å²	43.7	9%	0.086	21%	0.214	C	C	.	.	H	α-helix	trans	-70.2	-44.2	177.6	-164.5	-92.5	0	0	0	112.6	N109 V112 A113 I116 S300 F301 L302 E306 S307 I308	N109-N304 PolarHBondContact N-ND2 2.97Å; N109-N304 PolarHBondContact O-ND2 3.07Å; V112-N304 HydrophobicContact CG1-CB 3.89Å; A113-N304 WeakPolarHBondContact CB-OD1 3.38Å; I116-N304 HydrophobicContact CD1-CB 4.3Å; S300-N304 WeakPolarHBondContact O-CB 3.2Å; S300-N304 PolarHBondContact O-N 3.42Å; F301-N304 PolarHBondContact O-N 3.48Å; L302-N304 PolarHBondContact O-N 3.45Å; N304-E306 VanDerWaalsContact C-N 3.35Å; N304-S307 WeakPolarHBondContact O-CB 3.29Å; N304-S307 PolarHBondContact O-N 3.43Å; N304-I308 WeakPolarHBondContact O-CG1 3.06Å; N304-I308 PolarHBondContact O-N 2.66Å
305	L	92	Very high	88.9	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-66.4	-36.5	176.5	-64.7	-166.6	0	0	0	112.2	I116 F301 L302 S307 I308 E309 L389 M392 K393 L396 V583	I116-L305 HydrophobicContact CD1-CD2 3.59Å; I116-L305 HydrophobicContact CD1-CG 3.82Å; I116-L305 HydrophobicContact CG2-CD1 4.3Å; I116-L305 HydrophobicContact CG2-CD2 4.36Å; F301-L305 PolarHBondContact O-N 3.36Å; L302-L305 PolarHBondContact O-N 3.13Å; L305-S307 VanDerWaalsContact C-N 3.34Å; L305-I308 HydrophobicContact CD2-CD1 4.33Å; L305-I308 WeakPolarHBondContact O-CB 3.28Å; L305-I308 PolarHBondContact O-N 3.1Å; L305-E309 WeakPolarHBondContact O-CB 3.02Å; L305-E309 PolarHBondContact O-N 3.2Å; L305-L389 HydrophobicContact CB-CD1 4.41Å; L305-L389 HydrophobicContact CD1-CD1 4.14Å; L305-L389 HydrophobicContact CD2-CD1 3.91Å; L305-L389 HydrophobicContact CG-CD1 4.37Å; L305-M392 HydrophobicContact CD1-CB 4.4Å; L305-M392 HydrophobicContact CD1-CG 4.16Å; L305-K393 HydrophobicContact CB-CD 4.3Å; L305-K393 HydrophobicContact CB-CG 3.86Å; L305-K393 HydrophobicContact CD1-CG 3.82Å; L305-L396 HydrophobicContact CD1-CD1 3.6Å; L305-L396 HydrophobicContact CG-CD1 4.22Å; L305-V583 HydrophobicContact CD2-CG2 4.38Å
306	E	91.7	Very high	87.8	Confident	77 Å²	77	47.1 Å²	47.1	36%	0.36	24%	0.24	S	C	.	.	H	α-helix	trans	-64.2	-40.2	174.2	-73.6	176.5	172.3	0	0	111.5	L302 N304 I308 E309 N310	L302-E306 WeakPolarHBondContact O-CB 3.4Å; L302-E306 WeakPolarHBondContact O-CG 3.24Å; L302-E306 PolarHBondContact O-N 3Å; N304-E306 VanDerWaalsContact C-N 3.35Å; E306-I308 VanDerWaalsContact C-N 3.34Å; E306-I308 PolarHBondContact O-N 2.65Å; E306-E309 PolarHBondContact O-N 3.01Å; E306-N310 WeakPolarHBondContact O-CB 3.31Å; E306-N310 PolarHBondContact O-N 3.21Å; E306-N310 PolarHBondContact O-ND2 3.39Å
307	S	89.6	Confident	86.4	Confident	38 Å²	38	46.7 Å²	46.7	27%	0.266	24%	0.244	S	C	.	.	H	α-helix	trans	-61	-43.1	172.2	-174.4	0	0	0	0	111.9	E303 N304 L305 L311	E303-S307 PolarHBondContact O-N 2.92Å; N304-S307 WeakPolarHBondContact O-CB 3.29Å; N304-S307 PolarHBondContact O-N 3.43Å; L305-S307 VanDerWaalsContact C-N 3.34Å; S307-L311 WeakPolarHBondContact O-CG 3.18Å; S307-L311 PolarHBondContact O-N 3.49Å
308	I	91.1	Very high	84.8	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.2	-49.1	176.5	-74	170.5	0	0	0	110.5	V108 A113 N304 L305 E306 N310 L311 I312 L389 V582 V583 I586	V108-I308 HydrophobicContact CG1-CD1 4.19Å; V108-I308 HydrophobicContact CG1-CG1 3.98Å; A113-I308 HydrophobicContact CB-CD1 4.22Å; N304-I308 WeakPolarHBondContact O-CG1 3.06Å; N304-I308 PolarHBondContact O-N 2.66Å; L305-I308 HydrophobicContact CD2-CD1 4.33Å; L305-I308 WeakPolarHBondContact O-CB 3.28Å; L305-I308 PolarHBondContact O-N 3.1Å; E306-I308 VanDerWaalsContact C-N 3.34Å; E306-I308 PolarHBondContact O-N 2.65Å; I308-N310 PolarHBondContact O-N 3.44Å; I308-L311 WeakPolarHBondContact O-CB 3.41Å; I308-L311 PolarHBondContact O-N 2.92Å; I308-I312 HydrophobicContact CG2-CD1 3.88Å; I308-I312 HydrophobicContact CG2-CG1 4.47Å; I308-I312 VanDerWaalsContact O-CG1 3.31Å; I308-I312 WeakPolarHBondContact O-CG1 3.49Å; I308-I312 PolarHBondContact O-N 2.68Å; I308-L389 HydrophobicContact CG2-CD2 4.21Å; I308-V582 HydrophobicContact CG2-CG1 3.82Å; I308-V583 HydrophobicContact CD1-CG2 4.26Å; I308-I586 HydrophobicContact CG1-CG2 4.29Å; I308-I586 HydrophobicContact CG2-CG1 3.97Å
309	E	90.3	Very high	83	Confident	30 Å²	30	51.2 Å²	51.2	14%	0.14	27%	0.274	C	S	.	.	H	α-helix	trans	-58	-47.1	178.9	173.9	179.8	-161.8	0	0	111.5	L305 E306 L311 I312 W313 L389 K393	L305-E309 WeakPolarHBondContact O-CB 3.02Å; L305-E309 PolarHBondContact O-N 3.2Å; E306-E309 PolarHBondContact O-N 3.01Å; E309-L311 VanDerWaalsContact C-N 3.25Å; E309-L311 PolarHBondContact O-N 3.18Å; E309-I312 WeakPolarHBondContact O-CA 3.43Å; E309-I312 WeakPolarHBondContact O-CB 3.32Å; E309-I312 PolarHBondContact O-N 3.19Å; E309-W313 VanDerWaalsContact O-CD1 3.27Å; E309-W313 PolarHBondContact O-N 3.05Å; E309-W313 PolarHBondContact OE1-NE1 3.19Å; E309-L389 HydrophobicContact CB-CD2 4.1Å; E309-K393 IonicContact OE2-NZ 3.1Å; E309-K393 PolarHBondContact OE2-NZ 2.76Å
310	N	88.2	Confident	81.2	Confident	96 Å²	96	51.3 Å²	51.3	51%	0.513	28%	0.281	S	S	.	.	H	α-helix	trans	-58.3	-38.2	178.1	-74.3	-27.8	0	0	0	112.3	E306 I308 S314	E306-N310 WeakPolarHBondContact O-CB 3.31Å; E306-N310 PolarHBondContact O-N 3.21Å; E306-N310 PolarHBondContact O-ND2 3.39Å; I308-N310 PolarHBondContact O-N 3.44Å; N310-S314 WeakPolarHBondContact O-CB 3.46Å; N310-S314 PolarHBondContact O-N 3.3Å; N310-S314 PolarHBondContact O-OG 3.45Å
311	L	88.1	Confident	79.7	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-64.1	-42.7	173.9	-72.1	172.1	0	0	0	111.7	K101 E104 M105 V108 S307 I308 E309 S314 K315 W377	K101-L311 HydrophobicContact CD-CD2 4.48Å; E104-L311 HydrophobicContact CB-CD2 3.78Å; M105-L311 HydrophobicContact CE-CD2 4.45Å; M105-L311 HydrophobicContact CG-CD1 4.07Å; M105-L311 HydrophobicContact CG-CD2 3.69Å; M105-L311 HydrophobicContact CG-CG 4.41Å; V108-L311 HydrophobicContact CG2-CD1 3.52Å; S307-L311 WeakPolarHBondContact O-CG 3.18Å; S307-L311 PolarHBondContact O-N 3.49Å; I308-L311 WeakPolarHBondContact O-CB 3.41Å; I308-L311 PolarHBondContact O-N 2.92Å; E309-L311 VanDerWaalsContact C-N 3.25Å; E309-L311 PolarHBondContact O-N 3.18Å; L311-S314 PolarHBondContact O-N 2.96Å; L311-S314 PolarHBondContact O-OG 3.44Å; L311-K315 PolarHBondContact O-N 2.86Å; L311-K315 VanDerWaalsContact O-N 3.15Å; L311-W377 HydrophobicContact CB-CH2 4.19Å
312	I	87.6	Confident	78.1	Confident	4 Å²	4	55.2 Å²	55.2	2%	0.021	30%	0.303	C	S	.	.	H	α-helix	trans	-62.2	-49.8	177	-62.5	171.6	0	0	0	110.8	I308 E309 S314 K315 A316 T380 L381 Q386 L389 V582	I308-I312 HydrophobicContact CG2-CD1 3.88Å; I308-I312 HydrophobicContact CG2-CG1 4.47Å; I308-I312 VanDerWaalsContact O-CG1 3.31Å; I308-I312 WeakPolarHBondContact O-CG1 3.49Å; I308-I312 PolarHBondContact O-N 2.68Å; E309-I312 WeakPolarHBondContact O-CA 3.43Å; E309-I312 WeakPolarHBondContact O-CB 3.32Å; E309-I312 PolarHBondContact O-N 3.19Å; I312-S314 VanDerWaalsContact C-N 3.33Å; I312-S314 PolarHBondContact O-N 3.11Å; I312-K315 PolarHBondContact O-N 3Å; I312-A316 WeakPolarHBondContact O-CB 3.47Å; I312-A316 PolarHBondContact O-N 3.27Å; I312-T380 HydrophobicContact CD1-CG2 3.38Å; I312-T380 HydrophobicContact CG1-CG2 3.45Å; I312-T380 VanDerWaalsContact CG1-CG2 3.45Å; I312-L381 HydrophobicContact CG2-CD2 4.36Å; I312-Q386 HydrophobicContact CG2-CG 4.17Å; I312-Q386 VanDerWaalsContact CG2-NE2 3.29Å; I312-L389 HydrophobicContact CD1-CD2 4.13Å; I312-V582 HydrophobicContact CD1-CG1 3.76Å
313	W	81.7	Confident	77.2	Confident	142 Å²	142	56.4 Å²	56.4	54%	0.538	31%	0.31	S	S	.	.	H	α-helix	trans	-60.4	-42.9	178.3	-83.8	100.3	0	0	0	112	E309 K315 A316 T317	E309-W313 VanDerWaalsContact O-CD1 3.27Å; E309-W313 PolarHBondContact O-N 3.05Å; E309-W313 PolarHBondContact OE1-NE1 3.19Å; W313-K315 VanDerWaalsContact C-N 3.34Å; W313-K315 PolarHBondContact O-N 2.93Å; W313-A316 PolarHBondContact O-N 3.43Å; W313-T317 HydrophobicContact CE3-CG2 4.03Å; W313-T317 WeakPolarHBondContact O-CB 3.48Å; W313-T317 WeakPolarHBondContact O-CG2 3.37Å; W313-T317 PolarHBondContact O-N 3.22Å; W313-T317 PolarHBondContact O-OG1 3.49Å
314	S	78.2	Confident	76.7	Confident	21 Å²	21	56.1 Å²	56.1	15%	0.147	31%	0.309	C	S	.	.	H	α-helix	trans	-57	-49.9	177	74.1	0	0	0	0	110.3	N310 L311 I312 A316 T317 T318	N310-S314 WeakPolarHBondContact O-CB 3.46Å; N310-S314 PolarHBondContact O-N 3.3Å; N310-S314 PolarHBondContact O-OG 3.45Å; L311-S314 PolarHBondContact O-N 2.96Å; L311-S314 PolarHBondContact O-OG 3.44Å; I312-S314 VanDerWaalsContact C-N 3.33Å; I312-S314 PolarHBondContact O-N 3.11Å; S314-A316 PolarHBondContact O-N 3.36Å; S314-T317 PolarHBondContact O-N 3.34Å; S314-T317 PolarHBondContact O-OG1 3.45Å; S314-T318 PolarHBondContact O-N 3.12Å; S314-T318 VanDerWaalsContact O-N 3.15Å; S314-T318 PolarHBondContact O-OG1 2.93Å
315	K	75.8	Confident	76.2	Confident	35 Å²	35	56.5 Å²	56.5	15%	0.152	31%	0.311	C	S	.	.	H	α-helix	trans	-64.2	-37.2	178.7	-166.3	176.6	-179.2	73.8	0	113	L95 L311 I312 W313 W377 L381	L95-K315 PolarHBondContact O-NZ 2.93Å; L311-K315 PolarHBondContact O-N 2.86Å; L311-K315 VanDerWaalsContact O-N 3.15Å; I312-K315 PolarHBondContact O-N 3Å; W313-K315 VanDerWaalsContact C-N 3.34Å; W313-K315 PolarHBondContact O-N 2.93Å; K315-W377 HydrophobicContact CB-CZ3 4.33Å; K315-W377 HydrophobicContact CD-CD2 4.05Å; K315-W377 HydrophobicContact CD-CE3 3.46Å; K315-W377 VanDerWaalsContact CD-CE3 3.46Å; K315-W377 HydrophobicContact CD-CH2 4.49Å; K315-W377 HydrophobicContact CD-CZ3 3.71Å; K315-L381 HydrophobicContact CD-CD1 4.4Å; K315-L381 HydrophobicContact CD-CD2 4.4Å
316	A	70.5	Confident	75.7	Confident	60 Å²	60	56.7 Å²	56.7	50%	0.496	31%	0.312	S	S	.	.	H	α-helix	trans	-73.3	-27.1	-179.1	0	0	0	0	0	113.9	I312 W313 S314	I312-A316 WeakPolarHBondContact O-CB 3.47Å; I312-A316 PolarHBondContact O-N 3.27Å; W313-A316 PolarHBondContact O-N 3.43Å; S314-A316 PolarHBondContact O-N 3.36Å
317	T	63.7	Low	75.4	Confident	84 Å²	84	53.8 Å²	53.8	52%	0.515	30%	0.299	S	S	.	.	H	α-helix	trans	-102.8	-4.7	-174.9	56.3	0	0	0	0	114	W313 S314 T319	W313-T317 HydrophobicContact CE3-CG2 4.03Å; W313-T317 WeakPolarHBondContact O-CB 3.48Å; W313-T317 WeakPolarHBondContact O-CG2 3.37Å; W313-T317 PolarHBondContact O-N 3.22Å; W313-T317 PolarHBondContact O-OG1 3.49Å; S314-T317 PolarHBondContact O-N 3.34Å; S314-T317 PolarHBondContact O-OG1 3.45Å; T317-T319 PolarHBondContact O-N 3.16Å
318	T	57.4	Low	75.3	Confident	34 Å²	34	52 Å²	52	21%	0.209	29%	0.286	C	S	.	.			trans	-74.1	67	179.1	-53.1	0	0	0	0	110.6	S314 L321	S314-T318 PolarHBondContact O-N 3.12Å; S314-T318 VanDerWaalsContact O-N 3.15Å; S314-T318 PolarHBondContact O-OG1 2.93Å; T318-L321 HydrophobicContact CG2-CB 3.78Å; T318-L321 HydrophobicContact CG2-CD1 3.44Å; T318-L321 VanDerWaalsContact CG2-CD1 3.44Å; T318-L321 HydrophobicContact CG2-CG 4.07Å
319	T	52.5	Low	75.1	Confident	114 Å²	114	52.2 Å²	52.2	70%	0.699	29%	0.287	S	S	*	.			trans	-85.9	-14.6	174.5	58.3	0	0	0	0	112.7	T317	T317-T319 PolarHBondContact O-N 3.16Å
320	N	50.3	Low	74.2	Confident	143 Å²	143	52.8 Å²	52.8	77%	0.765	29%	0.293	S	S	*	.			trans	-117.4	17.6	-167.6	-61.8	-15	0	0	0	113.9
321	L	57	Low	73.5	Confident	46 Å²	46	52.5 Å²	52.5	24%	0.241	29%	0.288	C	S	.	.			trans	-66.8	129.9	176.3	-134.8	79.6	0	0	0	109.1	T97 T318 V323	T97-L321 WeakPolarHBondContact O-CD2 3.21Å; T318-L321 HydrophobicContact CG2-CB 3.78Å; T318-L321 HydrophobicContact CG2-CD1 3.44Å; T318-L321 VanDerWaalsContact CG2-CD1 3.44Å; T318-L321 HydrophobicContact CG2-CG 4.07Å; L321-V323 PolarHBondContact O-N 3.08Å
322	P	60.7	Low	72.8	Confident	92 Å²	92	53.1 Å²	53.1	60%	0.597	29%	0.294	S	S	*	.			trans	-63.6	109.7	173.4	23.8	-31.5	0	0	0	109.6	Q324	P322-Q324 HydrophobicContact CB-CG 4.48Å; P322-Q324 PolarHBondContact O-N 3.46Å
323	V	72.9	Confident	72.2	Confident	44 Å²	44	53.5 Å²	53.5	27%	0.267	30%	0.298	S	S	.	.			trans	-82.7	94	177.3	-171.4	0	0	0	0	108.4	E93 Y96 L321 M326 I327	E93-V323 VanDerWaalsContact OE1-C 3.26Å; E93-V323 VanDerWaalsContact OE1-CA 3.29Å; E93-V323 WeakPolarHBondContact OE1-CA 3.4Å; E93-V323 VanDerWaalsContact OE1-CG1 3.25Å; E93-V323 WeakPolarHBondContact OE1-CG1 3.07Å; Y96-V323 HydrophobicContact CE1-CG2 4.34Å; L321-V323 PolarHBondContact O-N 3.08Å; V323-M326 HydrophobicContact CG1-CB 3.74Å; V323-I327 HydrophobicContact CG1-CB 4.47Å
324	Q	80	Confident	72.1	Confident	103 Å²	103	51.8 Å²	51.8	48%	0.481	29%	0.294	S	S	.	.			trans	-101.3	-38.4	-178.3	-65.9	-173.6	3	0	0	113	E93 P322	E93-Q324 VanDerWaalsContact CD-N 3.29Å; E93-Q324 PolarHBondContact OE1-N 2.82Å; E93-Q324 PolarHBondContact OE2-N 3.38Å; P322-Q324 HydrophobicContact CB-CG 4.48Å; P322-Q324 PolarHBondContact O-N 3.46Å
325	L	81.3	Confident	72.5	Confident	23 Å²	23	50.8 Å²	50.8	12%	0.12	29%	0.287	C	S	.	.	S	Bend	trans	-92.6	-26.1	-173.4	-57.8	176.8	0	0	0	113	N72 I85 A90 E93 Q622	N72-L325 PolarHBondContact ND2-O 3.26Å; I85-L325 HydrophobicContact CD1-CD2 3.73Å; I85-L325 HydrophobicContact CG1-CD2 3.99Å; I85-L325 HydrophobicContact CG2-CD1 3.6Å; I85-L325 HydrophobicContact CG2-CD2 4.25Å; A90-L325 HydrophobicContact CB-CD1 4.08Å; E93-L325 VanDerWaalsContact CD-N 3.25Å; E93-L325 WeakPolarHBondContact OE1-CA 3.28Å; E93-L325 PolarHBondContact OE1-N 3.04Å; E93-L325 WeakPolarHBondContact OE2-CB 3.35Å; E93-L325 WeakPolarHBondContact OE2-CG 3.48Å; E93-L325 PolarHBondContact OE2-N 3.14Å; L325-Q622 HydrophobicContact CD2-CG 4.48Å
326	M	81.3	Confident	73	Confident	4 Å²	4	49.1 Å²	49.1	2%	0.02	28%	0.28	C	S	.	.	S	Bend	trans	-102.7	1.1	-175.9	-63.3	-175.6	72	0	0	114.8	N72 E93 L94 Y96 V323 G328 F329	N72-M326 VanDerWaalsContact ND2-C 3.29Å; E93-M326 HydrophobicContact CG-CG 4.09Å; E93-M326 HydrophobicContact CG-SD 4.22Å; E93-M326 PolarHBondContact OE1-N 3.47Å; L94-M326 WeakPolarHBondContact CA-SD 3.39Å; L94-M326 HydrophobicContact CB-SD 4.32Å; L94-M326 HydrophobicContact CD2-CE 3.7Å; L94-M326 HydrophobicContact CD2-CG 3.65Å; L94-M326 HydrophobicContact CD2-SD 3.8Å; L94-M326 HydrophobicContact CG-CG 4.11Å; L94-M326 HydrophobicContact CG-SD 4.21Å; L94-M326 PolarHBondContact N-SD 2.96Å; L94-M326 VanDerWaalsContact N-SD 3.45Å; Y96-M326 HydrophobicContact CE2-CE 4.22Å; Y96-M326 HydrophobicContact CE2-SD 4.49Å; V323-M326 HydrophobicContact CG1-CB 3.74Å; M326-G328 PolarHBondContact O-N 3.42Å; M326-F329 HydrophobicContact CB-CD2 4.15Å; M326-F329 HydrophobicContact CG-CD2 4.25Å; M326-F329 WeakPolarHBondContact O-CA 3.5Å; M326-F329 WeakPolarHBondContact O-CB 3.38Å; M326-F329 PolarHBondContact O-N 3.11Å
327	I	85.3	Confident	73.6	Confident	17 Å²	17	49.9 Å²	49.9	9%	0.087	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-23.9	-167.1	-161.4	154.1	0	0	0	114.2	N72 V323 F626 L630	N72-I327 PolarHBondContact ND2-N 3.5Å; V323-I327 HydrophobicContact CG1-CB 4.47Å; I327-F626 HydrophobicContact CD1-CD2 4.33Å; I327-F626 HydrophobicContact CD1-CE2 3.91Å; I327-F626 HydrophobicContact CD1-CZ 4.45Å; I327-F626 HydrophobicContact CG2-CB 4.44Å; I327-F626 HydrophobicContact CG2-CD2 3.88Å; I327-F626 HydrophobicContact CG2-CG 4.41Å; I327-L630 HydrophobicContact CD1-CB 3.78Å; I327-L630 HydrophobicContact CD1-CD1 3.46Å; I327-L630 VanDerWaalsContact CD1-CD1 3.46Å; I327-L630 HydrophobicContact CD1-CG 4.18Å; I327-L630 HydrophobicContact CG1-CB 4.38Å
328	G	86.8	Confident	74.5	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-8.6	170	0	0	0	0	0	115.3	A68 R69 N72 M326 T330	A68-G328 CarbonylContact C-O 3.47Å; R69-G328 WeakPolarHBondContact CA-O 3.47Å; R69-G328 PolarHBondContact N-O 2.9Å; N72-G328 PolarHBondContact ND2-N 2.9Å; M326-G328 PolarHBondContact O-N 3.42Å; G328-T330 PolarHBondContact O-N 3.22Å
329	F	86.9	Confident	75.9	Confident	5 Å²	5	46 Å²	46	2%	0.022	25%	0.247	C	C	.	.			trans	-91.9	65	173.9	-57.6	-34.1	0	0	0	110.8	R69 N72 L76 L94 M326 E331 G332 D335 I336 L339	R69-F329 HydrophobicContact CG-CD1 4.14Å; R69-F329 HydrophobicContact CG-CE1 4.3Å; N72-F329 HydrophobicContact CB-CD1 4.07Å; N72-F329 HydrophobicContact CB-CE1 3.62Å; N72-F329 HydrophobicContact CB-CE2 4.49Å; N72-F329 HydrophobicContact CB-CZ 3.85Å; L76-F329 HydrophobicContact CD2-CE2 3.98Å; L76-F329 HydrophobicContact CD2-CZ 4.18Å; L94-F329 HydrophobicContact CD2-CD2 4.34Å; M326-F329 HydrophobicContact CB-CD2 4.15Å; M326-F329 HydrophobicContact CG-CD2 4.25Å; M326-F329 WeakPolarHBondContact O-CA 3.5Å; M326-F329 WeakPolarHBondContact O-CB 3.38Å; M326-F329 PolarHBondContact O-N 3.11Å; F329-E331 PolarHBondContact O-N 3.25Å; F329-E331 VanDerWaalsContact O-N 3.16Å; F329-G332 PolarHBondContact O-N 2.93Å; F329-D335 WeakPolarHBondContact CA-OD2 3.44Å; F329-D335 HydrophobicContact CB-CB 3.84Å; F329-D335 HydrophobicContact CD1-CB 3.84Å; F329-D335 HydrophobicContact CG-CB 4.13Å; F329-I336 HydrophobicContact CD2-CD1 4.4Å; F329-I336 HydrophobicContact CD2-CG1 4.1Å; F329-I336 HydrophobicContact CE1-CG1 4.49Å; F329-I336 HydrophobicContact CE2-CD1 4.31Å; F329-I336 HydrophobicContact CE2-CG1 3.92Å; F329-I336 HydrophobicContact CG-CG1 4.48Å; F329-I336 HydrophobicContact CZ-CG1 4.13Å; F329-L339 HydrophobicContact CE1-CD1 4.4Å; F329-L339 HydrophobicContact CE1-CD2 4.39Å; F329-L339 HydrophobicContact CZ-CD1 4.46Å
330	T	72.5	Confident	77	Confident	42 Å²	42	43.8 Å²	43.8	26%	0.258	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-20.4	-175.5	63.9	0	0	0	0	115.1	Q65 G328 D335	Q65-T330 HydrophobicContact CG-CG2 4.47Å; Q65-T330 PolarHBondContact NE2-OG1 3.37Å; G328-T330 PolarHBondContact O-N 3.22Å; T330-D335 PolarHBondContact N-OD2 2.98Å
331	E	72.4	Confident	78.2	Confident	89 Å²	89	43.8 Å²	43.8	42%	0.416	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	14	171.7	-55.4	-171.9	-167.4	0	0	113.1	F329 K334 D335	F329-E331 PolarHBondContact O-N 3.25Å; F329-E331 VanDerWaalsContact O-N 3.16Å; E331-K334 IonicContact OE2-NZ 2.69Å; E331-K334 PolarHBondContact OE2-NZ 3.27Å; E331-D335 WeakPolarHBondContact CB-OD1 2.93Å; E331-D335 PolarHBondContact N-OD2 3.15Å
332	G	74	Confident	78.6	Confident	13 Å²	13	41.7 Å²	41.7	13%	0.134	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.3	-142.3	178.2	0	0	0	0	0	113.5	F329 K334 D335	F329-G332 PolarHBondContact O-N 2.93Å; G332-K334 PolarHBondContact O-N 3.34Å; G332-D335 WeakPolarHBondContact O-CB 3.49Å; G332-D335 PolarHBondContact O-N 2.94Å; G332-D335 VanDerWaalsContact O-N 3.07Å
333	S	75.2	Confident	78.9	Confident	12 Å²	12	37.3 Å²	37.3	8%	0.084	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-32.8	-176.8	56.2	0	0	0	0	114	D335 I336 E374	S333-D335 PolarHBondContact O-N 3.46Å; S333-I336 VanDerWaalsContact O-CB 3.32Å; S333-I336 WeakPolarHBondContact O-CB 3.41Å; S333-I336 PolarHBondContact O-N 3.47Å; S333-E374 WeakPolarHBondContact CB-OE2 3.44Å; S333-E374 PolarHBondContact OG-OE2 3Å
334	K	79.7	Confident	78.4	Confident	107 Å²	107	37.4 Å²	37.4	47%	0.465	20%	0.195	S	C	.	.	H	α-helix	trans	-57.9	-33.1	177	-175.4	-178.1	168.5	-143.4	0	112.8	E331 G332 I336 E337 L338	E331-K334 IonicContact OE2-NZ 2.69Å; E331-K334 PolarHBondContact OE2-NZ 3.27Å; G332-K334 PolarHBondContact O-N 3.34Å; K334-I336 PolarHBondContact O-N 3.44Å; K334-E337 PolarHBondContact O-N 3.21Å; K334-L338 HydrophobicContact CG-CD1 4.3Å; K334-L338 WeakPolarHBondContact O-CG 3.43Å; K334-L338 PolarHBondContact O-N 3.46Å
335	D	85.7	Confident	77.5	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-64.5	-26.9	178.5	-83.4	-16.8	0	0	0	112.6	R69 F329 T330 E331 G332 S333 L338 L339	R69-D335 VanDerWaalsContact CD-O 3.23Å; R69-D335 WeakPolarHBondContact CD-O 3.27Å; R69-D335 HydrophobicContact CG-CB 3.98Å; R69-D335 WeakPolarHBondContact CG-O 3.35Å; R69-D335 IonicContact CZ-OD1 2.9Å; R69-D335 VanDerWaalsContact NE-CG 3.26Å; R69-D335 IonicContact NE-OD1 3.24Å; R69-D335 PolarHBondContact NE-OD1 2.91Å; R69-D335 IonicContact NE-OD2 3.53Å; R69-D335 IonicContact NH2-OD1 3.92Å; R69-D335 PolarHBondContact NH2-OD1 3.3Å; F329-D335 WeakPolarHBondContact CA-OD2 3.44Å; F329-D335 HydrophobicContact CB-CB 3.84Å; F329-D335 HydrophobicContact CD1-CB 3.84Å; F329-D335 HydrophobicContact CG-CB 4.13Å; T330-D335 PolarHBondContact N-OD2 2.98Å; E331-D335 WeakPolarHBondContact CB-OD1 2.93Å; E331-D335 PolarHBondContact N-OD2 3.15Å; G332-D335 WeakPolarHBondContact O-CB 3.49Å; G332-D335 PolarHBondContact O-N 2.94Å; G332-D335 VanDerWaalsContact O-N 3.07Å; S333-D335 PolarHBondContact O-N 3.46Å; D335-L338 PolarHBondContact O-N 2.88Å; D335-L339 PolarHBondContact O-N 3.32Å
336	I	87.1	Confident	76.7	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-72.2	-38.3	177.5	-60.2	164.2	0	0	0	110.4	L94 F329 S333 K334 L338 L339 F363 F366 I370	L94-I336 HydrophobicContact CD1-CD1 4.33Å; L94-I336 HydrophobicContact CD2-CD1 3.33Å; L94-I336 HydrophobicContact CG-CD1 4.47Å; F329-I336 HydrophobicContact CD2-CD1 4.4Å; F329-I336 HydrophobicContact CD2-CG1 4.1Å; F329-I336 HydrophobicContact CE1-CG1 4.49Å; F329-I336 HydrophobicContact CE2-CD1 4.31Å; F329-I336 HydrophobicContact CE2-CG1 3.92Å; F329-I336 HydrophobicContact CG-CG1 4.48Å; F329-I336 HydrophobicContact CZ-CG1 4.13Å; S333-I336 VanDerWaalsContact O-CB 3.32Å; S333-I336 WeakPolarHBondContact O-CB 3.41Å; S333-I336 PolarHBondContact O-N 3.47Å; K334-I336 PolarHBondContact O-N 3.44Å; I336-L338 VanDerWaalsContact C-N 3.27Å; I336-L338 PolarHBondContact O-N 2.82Å; I336-L339 HydrophobicContact CG2-CD1 4.33Å; I336-L339 WeakPolarHBondContact O-CB 3.37Å; I336-L339 PolarHBondContact O-N 3.48Å; I336-F363 HydrophobicContact CG2-CB 4.11Å; I336-F363 HydrophobicContact CG2-CD1 3.69Å; I336-F363 HydrophobicContact CG2-CG 4.28Å; I336-F366 HydrophobicContact CG2-CD1 4.05Å; I336-I370 HydrophobicContact CD1-CD1 3.42Å; I336-I370 VanDerWaalsContact CD1-CD1 3.42Å
337	E	82.6	Confident	76	Confident	75 Å²	75	38.9 Å²	38.9	35%	0.35	21%	0.213	S	C	.	.	H	α-helix	trans	-65.6	-33.5	175.1	-61.9	-176.5	-171.4	0	0	111.4	K334 L339 S371	K334-E337 PolarHBondContact O-N 3.21Å; E337-L339 VanDerWaalsContact C-N 3.32Å; E337-L339 PolarHBondContact O-N 3.32Å; E337-S371 WeakPolarHBondContact OE1-CB 3.42Å; E337-S371 PolarHBondContact OE1-OG 2.97Å
338	L	83.7	Confident	75	Confident	36 Å²	36	46.5 Å²	46.5	19%	0.188	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-3.9	180	-65.2	174.9	0	0	0	114.4	K334 D335 I336 Q340 E341 S342	K334-L338 HydrophobicContact CG-CD1 4.3Å; K334-L338 WeakPolarHBondContact O-CG 3.43Å; K334-L338 PolarHBondContact O-N 3.46Å; D335-L338 PolarHBondContact O-N 2.88Å; I336-L338 VanDerWaalsContact C-N 3.27Å; I336-L338 PolarHBondContact O-N 2.82Å; L338-Q340 VanDerWaalsContact C-N 3.28Å; L338-Q340 PolarHBondContact O-N 3.33Å; L338-E341 PolarHBondContact O-N 3.17Å; L338-E341 VanDerWaalsContact O-N 3.1Å; L338-S342 WeakPolarHBondContact O-CB 3.34Å; L338-S342 PolarHBondContact O-N 3.39Å; L338-S342 PolarHBondContact O-OG 2.94Å
339	L	85.4	Confident	74.2	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-59.4	-37	-175.8	-83	170.4	0	0	0	113.3	R69 F329 D335 I336 E337 E341 F360 F363	R69-L339 HydrophobicContact CG-CD2 3.85Å; R69-L339 HydrophobicContact CG-CG 4.4Å; R69-L339 VanDerWaalsContact O-CD2 3.31Å; R69-L339 WeakPolarHBondContact O-CD2 3.29Å; F329-L339 HydrophobicContact CE1-CD1 4.4Å; F329-L339 HydrophobicContact CE1-CD2 4.39Å; F329-L339 HydrophobicContact CZ-CD1 4.46Å; D335-L339 PolarHBondContact O-N 3.32Å; I336-L339 HydrophobicContact CG2-CD1 4.33Å; I336-L339 WeakPolarHBondContact O-CB 3.37Å; I336-L339 PolarHBondContact O-N 3.48Å; E337-L339 VanDerWaalsContact C-N 3.32Å; E337-L339 PolarHBondContact O-N 3.32Å; L339-E341 VanDerWaalsContact C-N 3.32Å; L339-E341 PolarHBondContact O-N 3.2Å; L339-F360 HydrophobicContact CB-CB 4.44Å; L339-F360 HydrophobicContact CB-CD2 4.27Å; L339-F360 HydrophobicContact CB-CG 4.37Å; L339-F363 HydrophobicContact CD1-CB 4Å; L339-F363 HydrophobicContact CD1-CD1 3.97Å; L339-F363 HydrophobicContact CD1-CD2 3.64Å; L339-F363 HydrophobicContact CD1-CE1 4.34Å; L339-F363 HydrophobicContact CD1-CE2 4.03Å; L339-F363 HydrophobicContact CD1-CG 3.61Å; L339-F363 HydrophobicContact CD1-CZ 4.37Å
340	Q	77.4	Confident	73.6	Confident	69 Å²	69	52.9 Å²	52.9	32%	0.322	30%	0.299	S	S	.	.	H	α-helix	trans	-69.5	-30.3	178.5	-68.5	177	9.5	0	0	112.5	L338 S343 E357 F360 K361	L338-Q340 VanDerWaalsContact C-N 3.28Å; L338-Q340 PolarHBondContact O-N 3.33Å; Q340-S343 PolarHBondContact O-OG 2.71Å; Q340-E357 WeakPolarHBondContact O-CG 3.38Å; Q340-F360 HydrophobicContact CG-CB 4.08Å; Q340-F360 PolarHBondContact NE2-O 3.22Å; Q340-K361 VanDerWaalsContact NE2-CA 3.25Å; Q340-K361 PolarHBondContact NE2-O 2.89Å; Q340-K361 VanDerWaalsContact NE2-O 3.11Å
341	E	74.4	Confident	73.9	Confident	142 Å²	142	58.3 Å²	58.3	66%	0.664	32%	0.315	S	S	*	.	H	α-helix	trans	-84.8	-25.5	-179.6	-60.8	-179.2	179.1	0	0	112.1	L338 L339 S343	L338-E341 PolarHBondContact O-N 3.17Å; L338-E341 VanDerWaalsContact O-N 3.1Å; L339-E341 VanDerWaalsContact C-N 3.32Å; L339-E341 PolarHBondContact O-N 3.2Å; E341-S343 VanDerWaalsContact C-N 3.34Å; E341-S343 PolarHBondContact O-N 3.44Å
342	S	66.2	Low	74.5	Confident	3 Å²	3	54.3 Å²	54.3	2%	0.021	30%	0.296	C	S	.	.	H	α-helix	trans	-74.6	-19.6	-170.7	-59.3	0	0	0	0	114	R69 L338 S345 I346	R69-S342 VanDerWaalsContact CD-OG 3.3Å; R69-S342 WeakPolarHBondContact CD-OG 3.24Å; R69-S342 PolarHBondContact NH1-OG 3.12Å; L338-S342 WeakPolarHBondContact O-CB 3.34Å; L338-S342 PolarHBondContact O-N 3.39Å; L338-S342 PolarHBondContact O-OG 2.94Å; S342-S345 PolarHBondContact O-OG 3.27Å; S342-I346 WeakPolarHBondContact O-CD1 3.22Å; S342-I346 WeakPolarHBondContact O-CG1 3.31Å
343	S	66.5	Low	74.9	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-64.6	-41.2	177.4	48.1	0	0	0	0	112.7	Q340 E341 L347 S353 E357	Q340-S343 PolarHBondContact O-OG 2.71Å; E341-S343 VanDerWaalsContact C-N 3.34Å; E341-S343 PolarHBondContact O-N 3.44Å; S343-L347 WeakPolarHBondContact O-CB 3.37Å; S343-L347 PolarHBondContact O-N 2.63Å; S343-S353 VanDerWaalsContact C-OG 3.26Å; S343-S353 WeakPolarHBondContact CB-OG 3.43Å; S343-S353 PolarHBondContact OG-OG 2.98Å; S343-E357 VanDerWaalsContact OG-CG 3.25Å; S343-E357 WeakPolarHBondContact OG-CG 3.46Å; S343-E357 PolarHBondContact OG-OE1 3.23Å
344	G	61.3	Low	75.3	Confident	45 Å²	45	56.4 Å²	56.4	46%	0.464	31%	0.309	S	S	.	.	H	α-helix	trans	-75.1	-27.7	-172.6	0	0	0	0	0	114.3	I346 S353	G344-I346 VanDerWaalsContact C-N 3.35Å; G344-S353 VanDerWaalsContact CA-OG 3.27Å; G344-S353 WeakPolarHBondContact CA-OG 3.44Å; G344-S353 PolarHBondContact N-OG 3.2Å
345	S	62.6	Low	75.7	Confident	86 Å²	86	51.8 Å²	51.8	60%	0.601	29%	0.29	S	S	*	.	H	α-helix	trans	-78.7	-19.9	179.7	60.5	0	0	0	0	113.4	S342	S342-S345 PolarHBondContact O-OG 3.27Å
346	I	64.2	Low	75.9	Confident	48 Å²	48	51.8 Å²	51.8	25%	0.246	29%	0.29	C	S	.	.	H	α-helix	trans	-102	-38.2	-173.7	-62.7	171	0	0	0	111.5	S66 L67 L70 S342 G344	S66-I346 VanDerWaalsContact C-CD1 3.41Å; S66-I346 WeakPolarHBondContact O-CD1 3.36Å; L67-I346 HydrophobicContact CB-CD1 4.26Å; L67-I346 HydrophobicContact CD1-CD1 4.19Å; L67-I346 HydrophobicContact CD1-CG2 3.65Å; L70-I346 HydrophobicContact CB-CD1 4.14Å; L70-I346 HydrophobicContact CD2-CD1 3.95Å; L70-I346 HydrophobicContact CD2-CG2 4.48Å; S342-I346 WeakPolarHBondContact O-CD1 3.22Å; S342-I346 WeakPolarHBondContact O-CG1 3.31Å; G344-I346 VanDerWaalsContact C-N 3.35Å
347	L	65.5	Low	75.9	Confident	28 Å²	28	55.5 Å²	55.5	15%	0.147	31%	0.307	C	S	.	.			trans	-102.8	121.7	-168.7	-63.3	171.7	0	0	0	112.1	S343 S349 V352 L356 F767	S343-L347 WeakPolarHBondContact O-CB 3.37Å; S343-L347 PolarHBondContact O-N 2.63Å; L347-S349 PolarHBondContact O-N 3.25Å; L347-V352 HydrophobicContact CD1-CB 4.41Å; L347-V352 HydrophobicContact CD1-CG1 3.83Å; L347-L356 HydrophobicContact CD1-CD1 3.39Å; L347-F767 HydrophobicContact CD1-CD1 4.37Å; L347-F767 HydrophobicContact CD1-CE1 3.78Å; L347-F767 HydrophobicContact CD1-CZ 4.3Å; L347-F767 HydrophobicContact CD2-CD1 3.95Å; L347-F767 HydrophobicContact CD2-CD2 4.21Å; L347-F767 HydrophobicContact CD2-CE1 3.65Å; L347-F767 HydrophobicContact CD2-CE2 3.89Å; L347-F767 HydrophobicContact CD2-CG 4.25Å; L347-F767 HydrophobicContact CD2-CZ 3.65Å; L347-F767 HydrophobicContact CG-CE1 4.29Å; L347-F767 HydrophobicContact CG-CZ 4.41Å
348	N	64.4	Low	76.1	Confident	177 Å²	177	55.3 Å²	55.3	95%	0.947	31%	0.311	S	S	*	.	S	Bend	trans	-68.8	-18.5	171.2	-71.6	-28.9	0	0	0	112.9	S350	N348-S350 PolarHBondContact O-N 3.18Å
349	S	70.6	Confident	76.3	Confident	39 Å²	39	53.8 Å²	53.8	27%	0.273	30%	0.304	S	S	.	.			trans	-86.2	103.3	177.8	-179.1	0	0	0	0	110.8	L347 R351 V352 S353	L347-S349 PolarHBondContact O-N 3.25Å; S349-R351 PolarHBondContact O-N 3.32Å; S349-R351 VanDerWaalsContact O-N 3.17Å; S349-V352 PolarHBondContact O-N 2.94Å; S349-V352 PolarHBondContact OG-N 2.87Å; S349-S353 PolarHBondContact O-N 3.31Å
350	S	74.9	Confident	76.6	Confident	99 Å²	99	53.8 Å²	53.8	69%	0.692	30%	0.304	S	S	*	.	H	α-helix	trans	-57.5	-29.5	176.3	60	0	0	0	0	113.1	N348 S354	N348-S350 PolarHBondContact O-N 3.18Å; S350-S354 VanDerWaalsContact O-CB 3.31Å; S350-S354 WeakPolarHBondContact O-CB 3.28Å; S350-S354 PolarHBondContact O-N 2.9Å
351	R	79.2	Confident	76.9	Confident	157 Å²	157	58 Å²	58	59%	0.592	32%	0.322	S	S	*	.	H	α-helix	trans	-70.4	-46.5	177.3	-72.1	-174.4	176.8	-169.8	-0.5	112.5	S349 S355 F775	S349-R351 PolarHBondContact O-N 3.32Å; S349-R351 VanDerWaalsContact O-N 3.17Å; R351-S355 WeakPolarHBondContact O-CB 3.29Å; R351-S355 PolarHBondContact O-N 3.08Å; R351-S355 VanDerWaalsContact O-N 3.12Å; R351-S355 PolarHBondContact O-OG 3.36Å; R351-F775 HydrophobicContact CB-CE2 4.09Å; R351-F775 HydrophobicContact CB-CZ 4.16Å
352	V	83.6	Confident	77.4	Confident	4 Å²	4	52.7 Å²	52.7	2%	0.024	30%	0.3	C	S	.	.	H	α-helix	trans	-66.9	-43.4	178.2	179.6	0	0	0	0	109.8	L347 S349 S354 S355 L356 F767 Y770 E771	L347-V352 HydrophobicContact CD1-CB 4.41Å; L347-V352 HydrophobicContact CD1-CG1 3.83Å; S349-V352 PolarHBondContact O-N 2.94Å; S349-V352 PolarHBondContact OG-N 2.87Å; V352-S354 PolarHBondContact O-N 3.1Å; V352-S355 PolarHBondContact O-N 3.1Å; V352-L356 HydrophobicContact CG1-CD1 4.03Å; V352-L356 HydrophobicContact CG1-CG 4.43Å; V352-L356 WeakPolarHBondContact O-CG 3.42Å; V352-L356 PolarHBondContact O-N 3.01Å; V352-F767 HydrophobicContact CG1-CD1 4.05Å; V352-Y770 HydrophobicContact CG1-CD1 3.99Å; V352-Y770 HydrophobicContact CG1-CE1 4.27Å; V352-E771 HydrophobicContact CG2-CB 3.97Å; V352-E771 HydrophobicContact CG2-CG 4.09Å
353	S	82.5	Confident	78.4	Confident	7 Å²	7	52.6 Å²	52.6	5%	0.049	30%	0.299	C	S	.	.	H	α-helix	trans	-56.2	-52.1	176.3	-172.2	0	0	0	0	112.1	S343 G344 S349 S355 L356 E357	S343-S353 VanDerWaalsContact C-OG 3.26Å; S343-S353 WeakPolarHBondContact CB-OG 3.43Å; S343-S353 PolarHBondContact OG-OG 2.98Å; G344-S353 VanDerWaalsContact CA-OG 3.27Å; G344-S353 WeakPolarHBondContact CA-OG 3.44Å; G344-S353 PolarHBondContact N-OG 3.2Å; S349-S353 PolarHBondContact O-N 3.31Å; S353-S355 VanDerWaalsContact C-N 3.25Å; S353-S355 PolarHBondContact O-N 3.25Å; S353-L356 PolarHBondContact O-N 3.17Å; S353-L356 VanDerWaalsContact O-N 3.1Å; S353-E357 WeakPolarHBondContact O-CG 3.45Å; S353-E357 PolarHBondContact O-N 3.02Å; S353-E357 PolarHBondContact OG-OE1 3.32Å
354	S	85	Confident	79.2	Confident	63 Å²	63	53.9 Å²	53.9	44%	0.441	31%	0.312	S	S	.	.	H	α-helix	trans	-62.9	-32.2	-179.6	-177.7	0	0	0	0	112.9	S350 V352 T358	S350-S354 VanDerWaalsContact O-CB 3.31Å; S350-S354 WeakPolarHBondContact O-CB 3.28Å; S350-S354 PolarHBondContact O-N 2.9Å; V352-S354 PolarHBondContact O-N 3.1Å; S354-T358 PolarHBondContact O-N 3.27Å; S354-T358 VanDerWaalsContact O-N 3.11Å; S354-T358 PolarHBondContact O-OG1 2.91Å
355	S	87.7	Confident	80.3	Confident	10 Å²	10	54.9 Å²	54.9	7%	0.07	31%	0.312	C	S	.	.	H	α-helix	trans	-71.7	-37.9	175.5	-53.8	0	0	0	0	111.7	R351 V352 S353 T358 A359 E610 L774	R351-S355 WeakPolarHBondContact O-CB 3.29Å; R351-S355 PolarHBondContact O-N 3.08Å; R351-S355 VanDerWaalsContact O-N 3.12Å; R351-S355 PolarHBondContact O-OG 3.36Å; V352-S355 PolarHBondContact O-N 3.1Å; S353-S355 VanDerWaalsContact C-N 3.25Å; S353-S355 PolarHBondContact O-N 3.25Å; S355-T358 WeakPolarHBondContact O-CB 3.48Å; S355-T358 PolarHBondContact O-N 3.25Å; S355-A359 PolarHBondContact O-N 3.34Å; S355-E610 WeakPolarHBondContact O-CB 3.2Å; S355-L774 VanDerWaalsContact CB-CD1 3.48Å
356	L	89	Confident	81.6	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-68.2	-41.4	174.3	-70.5	169.6	0	0	0	112	L70 I74 L347 V352 S353 T358 A359 F360 L614 F767 Y770	L70-L356 HydrophobicContact CD1-CD1 4.4Å; I74-L356 HydrophobicContact CD1-CD2 4.46Å; I74-L356 HydrophobicContact CG1-CD2 4.47Å; L347-L356 HydrophobicContact CD1-CD1 3.39Å; V352-L356 HydrophobicContact CG1-CD1 4.03Å; V352-L356 HydrophobicContact CG1-CG 4.43Å; V352-L356 WeakPolarHBondContact O-CG 3.42Å; V352-L356 PolarHBondContact O-N 3.01Å; S353-L356 PolarHBondContact O-N 3.17Å; S353-L356 VanDerWaalsContact O-N 3.1Å; L356-T358 PolarHBondContact O-N 3.31Å; L356-A359 WeakPolarHBondContact O-CB 3.44Å; L356-A359 PolarHBondContact O-N 3.4Å; L356-A359 VanDerWaalsContact O-N 3.11Å; L356-F360 HydrophobicContact CB-CD2 4.5Å; L356-F360 HydrophobicContact CB-CE2 4.1Å; L356-F360 HydrophobicContact CD2-CE2 4.45Å; L356-F360 HydrophobicContact CD2-CZ 4.32Å; L356-F360 VanDerWaalsContact O-CD2 3.28Å; L356-F360 WeakPolarHBondContact O-CD2 3.41Å; L356-F360 WeakPolarHBondContact O-CG 3.32Å; L356-F360 PolarHBondContact O-N 3.42Å; L356-L614 HydrophobicContact CD2-CD2 3.74Å; L356-F767 HydrophobicContact CD1-CE1 4.03Å; L356-Y770 HydrophobicContact CD2-CE1 3.8Å; L356-Y770 HydrophobicContact CG-CE1 4.01Å
357	E	87	Confident	82.7	Confident	78 Å²	78	48.5 Å²	48.5	36%	0.364	27%	0.272	S	S	.	.	H	α-helix	trans	-54.6	-42.8	171.7	-75.9	158.3	-140.9	0	0	111.4	Q340 S343 S353 F360 K361	Q340-E357 WeakPolarHBondContact O-CG 3.38Å; S343-E357 VanDerWaalsContact OG-CG 3.25Å; S343-E357 WeakPolarHBondContact OG-CG 3.46Å; S343-E357 PolarHBondContact OG-OE1 3.23Å; S353-E357 WeakPolarHBondContact O-CG 3.45Å; S353-E357 PolarHBondContact O-N 3.02Å; S353-E357 PolarHBondContact OG-OE1 3.32Å; E357-F360 PolarHBondContact O-N 3Å; E357-K361 PolarHBondContact O-N 3.28Å
358	T	87.8	Confident	83.7	Confident	70 Å²	70	53.3 Å²	53.3	43%	0.429	29%	0.292	S	S	.	.	H	α-helix	trans	-66.2	-42.6	177.1	-58.9	0	0	0	0	111.5	S354 S355 L356 K361 E610	S354-T358 PolarHBondContact O-N 3.27Å; S354-T358 VanDerWaalsContact O-N 3.11Å; S354-T358 PolarHBondContact O-OG1 2.91Å; S355-T358 WeakPolarHBondContact O-CB 3.48Å; S355-T358 PolarHBondContact O-N 3.25Å; L356-T358 PolarHBondContact O-N 3.31Å; T358-K361 WeakPolarHBondContact O-CB 3.39Å; T358-K361 PolarHBondContact O-N 3.06Å; T358-E610 HydrophobicContact CG2-CB 4.47Å; T358-E610 HydrophobicContact CG2-CG 4.09Å
359	A	88.5	Confident	85	Confident	5 Å²	5	46.8 Å²	46.8	4%	0.041	26%	0.257	C	S	.	.	H	α-helix	trans	-62.4	-43	176.2	0	0	0	0	0	111.8	S355 L356 K361 E610 A611 L614	S355-A359 PolarHBondContact O-N 3.34Å; L356-A359 WeakPolarHBondContact O-CB 3.44Å; L356-A359 PolarHBondContact O-N 3.4Å; L356-A359 VanDerWaalsContact O-N 3.11Å; A359-K361 PolarHBondContact O-N 2.8Å; A359-E610 HydrophobicContact CB-CB 4.16Å; A359-A611 HydrophobicContact CB-CB 4.36Å; A359-L614 HydrophobicContact CB-CD1 4.06Å
360	F	89.6	Confident	85.9	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-81.6	11.1	-178.4	-59.2	-35.5	0	0	0	115.1	L70 I74 L339 Q340 L356 E357 S362 F363	L70-F360 HydrophobicContact CD1-CE2 3.43Å; L70-F360 VanDerWaalsContact CD1-CE2 3.43Å; L70-F360 HydrophobicContact CD1-CZ 3.92Å; I74-F360 HydrophobicContact CG1-CE1 4.24Å; I74-F360 HydrophobicContact CG1-CZ 3.67Å; L339-F360 HydrophobicContact CB-CB 4.44Å; L339-F360 HydrophobicContact CB-CD2 4.27Å; L339-F360 HydrophobicContact CB-CG 4.37Å; Q340-F360 HydrophobicContact CG-CB 4.08Å; Q340-F360 PolarHBondContact NE2-O 3.22Å; L356-F360 HydrophobicContact CB-CD2 4.5Å; L356-F360 HydrophobicContact CB-CE2 4.1Å; L356-F360 HydrophobicContact CD2-CE2 4.45Å; L356-F360 HydrophobicContact CD2-CZ 4.32Å; L356-F360 VanDerWaalsContact O-CD2 3.28Å; L356-F360 WeakPolarHBondContact O-CD2 3.41Å; L356-F360 WeakPolarHBondContact O-CG 3.32Å; L356-F360 PolarHBondContact O-N 3.42Å; E357-F360 PolarHBondContact O-N 3Å; F360-S362 PolarHBondContact O-N 2.84Å; F360-S362 VanDerWaalsContact O-N 3.1Å; F360-F363 HydrophobicContact CB-CD2 3.94Å; F360-F363 AromaticContact CD1-CD2 3.6Å; F360-F363 HydrophobicContact CD1-CD2 3.6Å; F360-F363 AromaticContact CD1-CE2 3.66Å; F360-F363 HydrophobicContact CD1-CE2 3.66Å; F360-F363 HydrophobicContact CE1-CD2 4.49Å; F360-F363 HydrophobicContact CE1-CE2 4.18Å; F360-F363 HydrophobicContact CG-CD2 4.07Å; F360-F363 PolarHBondContact O-N 3.25Å
361	K	85.5	Confident	86.6	Confident	158 Å²	158	41.9 Å²	41.9	69%	0.687	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-53.5	-37.1	-178	-170.6	174.6	-179.2	178.9	0	112.8	Q340 E357 T358 A359	Q340-K361 VanDerWaalsContact NE2-CA 3.25Å; Q340-K361 PolarHBondContact NE2-O 2.89Å; Q340-K361 VanDerWaalsContact NE2-O 3.11Å; E357-K361 PolarHBondContact O-N 3.28Å; T358-K361 WeakPolarHBondContact O-CB 3.39Å; T358-K361 PolarHBondContact O-N 3.06Å; A359-K361 PolarHBondContact O-N 2.8Å
362	S	83.2	Confident	87.1	Confident	30 Å²	30	37.4 Å²	37.4	21%	0.21	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-69.7	-30.3	180	-61.1	0	0	0	0	113.6	F360 G364 S365 F366	F360-S362 PolarHBondContact O-N 2.84Å; F360-S362 VanDerWaalsContact O-N 3.1Å; S362-G364 VanDerWaalsContact C-N 3.3Å; S362-G364 PolarHBondContact O-N 3.39Å; S362-S365 PolarHBondContact O-N 3.39Å; S362-F366 PolarHBondContact O-N 3.28Å
363	F	88.3	Confident	87.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-65.6	-29.7	-177.2	-79.8	-61.9	0	0	0	113.8	L76 E77 F80 I336 L339 F360 S365 F366 G367 M603	L76-F363 HydrophobicContact CB-CE1 4.46Å; L76-F363 HydrophobicContact CB-CZ 4.02Å; L76-F363 HydrophobicContact CD2-CE1 3.64Å; L76-F363 HydrophobicContact CD2-CZ 4.05Å; L76-F363 HydrophobicContact CG-CE1 4.02Å; L76-F363 HydrophobicContact CG-CZ 4.02Å; E77-F363 HydrophobicContact CB-CE2 3.97Å; E77-F363 HydrophobicContact CB-CZ 4.25Å; E77-F363 WeakPolarHBondContact OE2-CE2 3.44Å; F80-F363 HydrophobicContact CE2-CE1 4.44Å; I336-F363 HydrophobicContact CG2-CB 4.11Å; I336-F363 HydrophobicContact CG2-CD1 3.69Å; I336-F363 HydrophobicContact CG2-CG 4.28Å; L339-F363 HydrophobicContact CD1-CB 4Å; L339-F363 HydrophobicContact CD1-CD1 3.97Å; L339-F363 HydrophobicContact CD1-CD2 3.64Å; L339-F363 HydrophobicContact CD1-CE1 4.34Å; L339-F363 HydrophobicContact CD1-CE2 4.03Å; L339-F363 HydrophobicContact CD1-CG 3.61Å; L339-F363 HydrophobicContact CD1-CZ 4.37Å; F360-F363 HydrophobicContact CB-CD2 3.94Å; F360-F363 AromaticContact CD1-CD2 3.6Å; F360-F363 HydrophobicContact CD1-CD2 3.6Å; F360-F363 AromaticContact CD1-CE2 3.66Å; F360-F363 HydrophobicContact CD1-CE2 3.66Å; F360-F363 HydrophobicContact CE1-CD2 4.49Å; F360-F363 HydrophobicContact CE1-CE2 4.18Å; F360-F363 HydrophobicContact CG-CD2 4.07Å; F360-F363 PolarHBondContact O-N 3.25Å; F363-S365 VanDerWaalsContact C-N 3.27Å; F363-S365 PolarHBondContact O-N 2.54Å; F363-F366 HydrophobicContact CD1-CD1 4Å; F363-F366 HydrophobicContact CE1-CD1 4.29Å; F363-F366 PolarHBondContact O-N 3.44Å; F363-G367 PolarHBondContact O-N 3.08Å; F363-M603 HydrophobicContact CD1-CE 3.86Å; F363-M603 HydrophobicContact CD2-CE 4.35Å; F363-M603 HydrophobicContact CE1-CE 3.51Å; F363-M603 HydrophobicContact CE1-SD 4.46Å; F363-M603 HydrophobicContact CE2-CE 4.04Å; F363-M603 HydrophobicContact CG-CE 4.27Å; F363-M603 HydrophobicContact CZ-CE 3.61Å
364	G	83	Confident	87.8	Confident	27 Å²	27	40 Å²	40	28%	0.278	22%	0.221	S	C	.	.	H	α-helix	trans	-60.8	-37.4	176.4	0	0	0	0	0	112.6	S362 K368	S362-G364 VanDerWaalsContact C-N 3.3Å; S362-G364 PolarHBondContact O-N 3.39Å; G364-K368 PolarHBondContact O-N 3.29Å
365	S	85.1	Confident	88.1	Confident	67 Å²	67	40.2 Å²	40.2	47%	0.469	22%	0.223	S	C	.	.	H	α-helix	trans	-75.5	-41	174.5	-58.9	0	0	0	0	111.5	S362 F363 K368 D369	S362-S365 PolarHBondContact O-N 3.39Å; F363-S365 VanDerWaalsContact C-N 3.27Å; F363-S365 PolarHBondContact O-N 2.54Å; S365-K368 PolarHBondContact O-N 3.19Å; S365-D369 PolarHBondContact O-N 3.03Å
366	F	89.1	Confident	88.2	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.7	-47.5	179.6	-173.6	-116.4	0	0	0	112.7	F80 I91 L94 I336 S362 F363 K368 D369 I370 L596 M599 A600 M603	F80-F366 HydrophobicContact CE2-CE1 4.26Å; F80-F366 HydrophobicContact CE2-CZ 4.35Å; F80-F366 HydrophobicContact CZ-CE1 4.39Å; F80-F366 HydrophobicContact CZ-CZ 4.13Å; I91-F366 HydrophobicContact CG1-CE2 4.46Å; I91-F366 HydrophobicContact CG1-CZ 4.35Å; L94-F366 HydrophobicContact CD1-CE1 3.54Å; L94-F366 HydrophobicContact CD1-CZ 3.68Å; I336-F366 HydrophobicContact CG2-CD1 4.05Å; S362-F366 PolarHBondContact O-N 3.28Å; F363-F366 HydrophobicContact CD1-CD1 4Å; F363-F366 HydrophobicContact CE1-CD1 4.29Å; F363-F366 PolarHBondContact O-N 3.44Å; F366-K368 VanDerWaalsContact C-N 3.34Å; F366-K368 PolarHBondContact O-N 3.18Å; F366-D369 PolarHBondContact O-N 3.12Å; F366-D369 VanDerWaalsContact O-N 3.15Å; F366-I370 HydrophobicContact CD1-CD1 3.93Å; F366-I370 HydrophobicContact CE1-CD1 3.68Å; F366-I370 HydrophobicContact CZ-CD1 4.09Å; F366-I370 WeakPolarHBondContact O-CG1 3.3Å; F366-I370 PolarHBondContact O-N 3.34Å; F366-L596 HydrophobicContact CD2-CD1 3.54Å; F366-L596 HydrophobicContact CE2-CD1 3.27Å; F366-L596 HydrophobicContact CE2-CG 4.06Å; F366-L596 HydrophobicContact CG-CD1 4.45Å; F366-L596 HydrophobicContact CZ-CD1 4.01Å; F366-M599 HydrophobicContact CB-CG 4.11Å; F366-M599 HydrophobicContact CD2-CB 4.23Å; F366-M599 HydrophobicContact CD2-CG 4.04Å; F366-A600 HydrophobicContact CE2-CB 3.95Å; F366-M603 HydrophobicContact CB-SD 4.39Å; F366-M603 HydrophobicContact CD2-SD 4.48Å; F366-M603 HydrophobicContact CG-SD 4.26Å
367	G	87.4	Confident	88.3	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-59.1	-44	176.1	0	0	0	0	0	112.1	F363 D369 I370 S371	F363-G367 PolarHBondContact O-N 3.08Å; G367-D369 VanDerWaalsContact C-N 3.31Å; G367-D369 PolarHBondContact O-N 3.37Å; G367-I370 WeakPolarHBondContact O-CB 3.42Å; G367-I370 PolarHBondContact O-N 3.32Å; G367-I370 VanDerWaalsContact O-N 3.15Å; G367-S371 PolarHBondContact O-N 2.95Å; G367-S371 PolarHBondContact O-OG 3.12Å
368	K	86.8	Confident	88.4	Confident	128 Å²	128	44.2 Å²	44.2	56%	0.557	24%	0.239	S	C	*	.	H	α-helix	trans	-60.2	-39.4	175.4	-170.1	177.3	-176.8	177.7	0	112.5	G364 S365 F366 S371 N372	G364-K368 PolarHBondContact O-N 3.29Å; S365-K368 PolarHBondContact O-N 3.19Å; F366-K368 VanDerWaalsContact C-N 3.34Å; F366-K368 PolarHBondContact O-N 3.18Å; K368-S371 PolarHBondContact O-N 2.78Å; K368-N372 VanDerWaalsContact O-CB 3.31Å; K368-N372 WeakPolarHBondContact O-CB 3.45Å; K368-N372 PolarHBondContact O-N 3.17Å; K368-N372 PolarHBondContact O-ND2 2.74Å; K368-N372 VanDerWaalsContact O-ND2 3.12Å
369	D	91	Very high	88.5	Confident	40 Å²	40	42.2 Å²	42.2	21%	0.214	23%	0.228	C	C	.	.	H	α-helix	trans	-67.6	-35.3	177.2	-75	-16.4	0	0	0	112.2	S365 F366 G367 N372 F373 L596	S365-D369 PolarHBondContact O-N 3.03Å; F366-D369 PolarHBondContact O-N 3.12Å; F366-D369 VanDerWaalsContact O-N 3.15Å; G367-D369 VanDerWaalsContact C-N 3.31Å; G367-D369 PolarHBondContact O-N 3.37Å; D369-N372 PolarHBondContact O-N 3.47Å; D369-F373 PolarHBondContact O-N 3.3Å; D369-L596 HydrophobicContact CB-CB 4.47Å; D369-L596 HydrophobicContact CB-CD1 3.9Å
370	I	90.8	Very high	88.6	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-64	-52.8	172.2	-62	166.4	0	0	0	110	L94 L95 I336 F366 G367 N372 F373 E374 L596	L94-I370 HydrophobicContact CB-CD1 4.37Å; L94-I370 HydrophobicContact CD1-CD1 3.87Å; L94-I370 HydrophobicContact CD2-CD1 4.27Å; L94-I370 HydrophobicContact CG-CD1 4.42Å; L95-I370 HydrophobicContact CD2-CG2 3.95Å; I336-I370 HydrophobicContact CD1-CD1 3.42Å; I336-I370 VanDerWaalsContact CD1-CD1 3.42Å; F366-I370 HydrophobicContact CD1-CD1 3.93Å; F366-I370 HydrophobicContact CE1-CD1 3.68Å; F366-I370 HydrophobicContact CZ-CD1 4.09Å; F366-I370 WeakPolarHBondContact O-CG1 3.3Å; F366-I370 PolarHBondContact O-N 3.34Å; G367-I370 WeakPolarHBondContact O-CB 3.42Å; G367-I370 PolarHBondContact O-N 3.32Å; G367-I370 VanDerWaalsContact O-N 3.15Å; I370-N372 PolarHBondContact O-N 2.93Å; I370-F373 WeakPolarHBondContact O-CA 3.06Å; I370-F373 WeakPolarHBondContact O-CB 3.39Å; I370-F373 PolarHBondContact O-N 2.94Å; I370-E374 HydrophobicContact CG2-CG 4.34Å; I370-E374 WeakPolarHBondContact O-CG 3.26Å; I370-E374 PolarHBondContact O-N 3.07Å; I370-L596 HydrophobicContact CD1-CD1 4.39Å; I370-L596 HydrophobicContact CG1-CD1 3.48Å; I370-L596 VanDerWaalsContact CG1-CD1 3.48Å; I370-L596 HydrophobicContact CG1-CD2 4.07Å; I370-L596 HydrophobicContact CG1-CG 4.44Å
371	S	88.9	Confident	88.5	Confident	36 Å²	36	45.4 Å²	45.4	25%	0.252	24%	0.244	S	C	.	.	H	α-helix	trans	-56.1	-40.6	177.3	-66.1	0	0	0	0	111.9	E337 G367 K368 E374 S375	E337-S371 WeakPolarHBondContact OE1-CB 3.42Å; E337-S371 PolarHBondContact OE1-OG 2.97Å; G367-S371 PolarHBondContact O-N 2.95Å; G367-S371 PolarHBondContact O-OG 3.12Å; K368-S371 PolarHBondContact O-N 2.78Å; S371-E374 PolarHBondContact O-N 3.16Å; S371-S375 WeakPolarHBondContact O-CB 3.03Å; S371-S375 PolarHBondContact O-N 3.11Å
372	N	90.4	Very high	88.7	Confident	63 Å²	63	43.7 Å²	43.7	34%	0.337	24%	0.237	S	C	.	.	H	α-helix	trans	-62.8	-43.5	175.2	-73.4	-26.3	0	0	0	111.7	K368 D369 I370 S375 S376 K592	K368-N372 VanDerWaalsContact O-CB 3.31Å; K368-N372 WeakPolarHBondContact O-CB 3.45Å; K368-N372 PolarHBondContact O-N 3.17Å; K368-N372 PolarHBondContact O-ND2 2.74Å; K368-N372 VanDerWaalsContact O-ND2 3.12Å; D369-N372 PolarHBondContact O-N 3.47Å; I370-N372 PolarHBondContact O-N 2.93Å; N372-S375 PolarHBondContact O-OG 3Å; N372-S376 PolarHBondContact O-N 3.01Å; N372-S376 PolarHBondContact O-OG 3.29Å; N372-K592 HydrophobicContact CB-CD 4.47Å; N372-K592 WeakPolarHBondContact O-CD 3.49Å; N372-K592 PolarHBondContact O-NZ 3.36Å
373	F	91.9	Very high	88.9	Confident	1 Å²	1	52.1 Å²	52.1	0%	0.004	26%	0.264	C	S	.	.	H	α-helix	trans	-63	-49.5	175.5	175.2	-83.9	0	0	0	111.4	L95 M105 D369 I370 S375 S376 W377 K592 L593	L95-F373 HydrophobicContact CB-CE1 4.36Å; L95-F373 HydrophobicContact CD1-CD1 3.71Å; L95-F373 HydrophobicContact CD1-CD2 4.45Å; L95-F373 HydrophobicContact CD1-CE1 3.56Å; L95-F373 HydrophobicContact CD1-CE2 4.31Å; L95-F373 HydrophobicContact CD1-CG 4.16Å; L95-F373 HydrophobicContact CD1-CZ 3.86Å; L95-F373 HydrophobicContact CD2-CD1 3.34Å; L95-F373 HydrophobicContact CD2-CE1 3.74Å; L95-F373 HydrophobicContact CD2-CG 4.16Å; L95-F373 HydrophobicContact CG-CD1 4.09Å; L95-F373 HydrophobicContact CG-CE1 4.08Å; M105-F373 HydrophobicContact SD-CZ 4.02Å; D369-F373 PolarHBondContact O-N 3.3Å; I370-F373 WeakPolarHBondContact O-CA 3.06Å; I370-F373 WeakPolarHBondContact O-CB 3.39Å; I370-F373 PolarHBondContact O-N 2.94Å; F373-S375 VanDerWaalsContact C-N 3.26Å; F373-S375 PolarHBondContact O-N 2.92Å; F373-S376 PolarHBondContact O-N 3.36Å; F373-S376 VanDerWaalsContact O-N 3.12Å; F373-S376 PolarHBondContact O-OG 3.04Å; F373-W377 AromaticContact CE1-CD1 3.64Å; F373-W377 HydrophobicContact CE1-CG 4.33Å; F373-W377 AromaticContact CE1-NE1 3.6Å; F373-W377 AromaticContact CE2-NE1 3.51Å; F373-W377 AromaticContact CZ-CD1 3.65Å; F373-W377 AromaticContact CZ-CE2 3.78Å; F373-W377 HydrophobicContact CZ-CZ2 4.28Å; F373-W377 AromaticContact CZ-NE1 3.11Å; F373-K592 HydrophobicContact CB-CB 4.32Å; F373-K592 HydrophobicContact CD2-CB 4.45Å; F373-L593 HydrophobicContact CD2-CB 3.93Å; F373-L593 HydrophobicContact CE2-CB 3.84Å; F373-L593 HydrophobicContact CE2-CD1 4.38Å; F373-L593 HydrophobicContact CE2-CD2 4.32Å; F373-L593 HydrophobicContact CE2-CG 4.41Å
374	E	88.8	Confident	89	Confident	63 Å²	63	55.1 Å²	55.1	29%	0.294	29%	0.289	S	S	.	.	H	α-helix	trans	-59.1	-39	180	-69.8	-179.5	140.9	0	0	111.7	L95 S333 I370 S371 S376 W377 K378	L95-E374 HydrophobicContact CD2-CG 4.2Å; S333-E374 WeakPolarHBondContact CB-OE2 3.44Å; S333-E374 PolarHBondContact OG-OE2 3Å; I370-E374 HydrophobicContact CG2-CG 4.34Å; I370-E374 WeakPolarHBondContact O-CG 3.26Å; I370-E374 PolarHBondContact O-N 3.07Å; S371-E374 PolarHBondContact O-N 3.16Å; E374-S376 VanDerWaalsContact C-N 3.32Å; E374-S376 PolarHBondContact O-N 2.69Å; E374-W377 PolarHBondContact O-N 3.32Å; E374-W377 VanDerWaalsContact O-N 3.11Å; E374-K378 PolarHBondContact O-N 3.16Å
375	S	90.1	Very high	89.5	Confident	69 Å²	69	54.1 Å²	54.1	48%	0.483	28%	0.277	S	S	.	.	H	α-helix	trans	-60.8	-36.5	177.5	75.7	0	0	0	0	113.3	S371 N372 F373 W377 K378	S371-S375 WeakPolarHBondContact O-CB 3.03Å; S371-S375 PolarHBondContact O-N 3.11Å; N372-S375 PolarHBondContact O-OG 3Å; F373-S375 VanDerWaalsContact C-N 3.26Å; F373-S375 PolarHBondContact O-N 2.92Å; S375-W377 VanDerWaalsContact C-N 3.27Å; S375-W377 PolarHBondContact O-N 3.32Å; S375-K378 WeakPolarHBondContact O-CB 3.46Å; S375-K378 PolarHBondContact O-N 3.02Å
376	S	91.1	Very high	89.7	Confident	10 Å²	10	53.1 Å²	53.1	7%	0.07	27%	0.265	C	S	.	.	H	α-helix	trans	-64.7	-30.8	175.8	7.1	0	0	0	0	112.9	N372 F373 E374 G585 K592	N372-S376 PolarHBondContact O-N 3.01Å; N372-S376 PolarHBondContact O-OG 3.29Å; F373-S376 PolarHBondContact O-N 3.36Å; F373-S376 VanDerWaalsContact O-N 3.12Å; F373-S376 PolarHBondContact O-OG 3.04Å; E374-S376 VanDerWaalsContact C-N 3.32Å; E374-S376 PolarHBondContact O-N 2.69Å; S376-G585 VanDerWaalsContact O-CA 3.28Å; S376-G585 WeakPolarHBondContact O-CA 3.39Å; S376-K592 VanDerWaalsContact OG-CD 3.26Å; S376-K592 WeakPolarHBondContact OG-CD 3.43Å; S376-K592 PolarHBondContact OG-NZ 2.88Å
377	W	90.1	Very high	89.8	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.008	29%	0.287	C	S	.	.	H	α-helix	trans	-85.6	-12.6	-176.7	-81.3	74.3	0	0	0	113.3	M105 L311 K315 F373 E374 S375 S379 T380 L381 I586 S589	M105-W377 HydrophobicContact CE-CH2 3.76Å; M105-W377 HydrophobicContact CE-CZ2 3.83Å; M105-W377 HydrophobicContact CG-CH2 4.36Å; M105-W377 HydrophobicContact CG-CZ2 4Å; M105-W377 HydrophobicContact SD-CH2 4.2Å; M105-W377 HydrophobicContact SD-CZ2 3.67Å; L311-W377 HydrophobicContact CB-CH2 4.19Å; K315-W377 HydrophobicContact CB-CZ3 4.33Å; K315-W377 HydrophobicContact CD-CD2 4.05Å; K315-W377 HydrophobicContact CD-CE3 3.46Å; K315-W377 VanDerWaalsContact CD-CE3 3.46Å; K315-W377 HydrophobicContact CD-CH2 4.49Å; K315-W377 HydrophobicContact CD-CZ3 3.71Å; F373-W377 AromaticContact CE1-CD1 3.64Å; F373-W377 HydrophobicContact CE1-CG 4.33Å; F373-W377 AromaticContact CE1-NE1 3.6Å; F373-W377 AromaticContact CE2-NE1 3.51Å; F373-W377 AromaticContact CZ-CD1 3.65Å; F373-W377 AromaticContact CZ-CE2 3.78Å; F373-W377 HydrophobicContact CZ-CZ2 4.28Å; F373-W377 AromaticContact CZ-NE1 3.11Å; E374-W377 PolarHBondContact O-N 3.32Å; E374-W377 VanDerWaalsContact O-N 3.11Å; S375-W377 VanDerWaalsContact C-N 3.27Å; S375-W377 PolarHBondContact O-N 3.32Å; W377-S379 VanDerWaalsContact C-N 3.32Å; W377-S379 PolarHBondContact O-N 3.44Å; W377-T380 HydrophobicContact CE3-CG2 4.3Å; W377-T380 WeakPolarHBondContact O-CB 3.39Å; W377-T380 PolarHBondContact O-N 2.82Å; W377-T380 VanDerWaalsContact O-N 3.08Å; W377-L381 WeakPolarHBondContact O-CG 3.38Å; W377-L381 PolarHBondContact O-N 3.03Å; W377-L381 VanDerWaalsContact O-N 3.12Å; W377-I586 HydrophobicContact CD2-CD1 4.25Å; W377-I586 HydrophobicContact CE3-CD1 4.13Å; W377-I586 HydrophobicContact CH2-CD1 3.35Å; W377-I586 HydrophobicContact CZ2-CD1 3.46Å; W377-I586 VanDerWaalsContact CZ2-CD1 3.46Å; W377-I586 HydrophobicContact CZ3-CD1 3.71Å; W377-S589 PolarHBondContact NE1-OG 2.76Å; W377-S589 VanDerWaalsContact NE1-OG 3.13Å
378	K	89.4	Confident	90.1	Very high	159 Å²	159	56.7 Å²	56.7	69%	0.691	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-37.4	-173.9	-170.9	175.2	-177.5	174.4	0	113.3	E374 S375	E374-K378 PolarHBondContact O-N 3.16Å; S375-K378 WeakPolarHBondContact O-CB 3.46Å; S375-K378 PolarHBondContact O-N 3.02Å
379	S	90.2	Very high	90.4	Very high	29 Å²	29	50.7 Å²	50.7	20%	0.203	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-40.4	174.5	49.5	0	0	0	0	111.5	W377 L381 K382 N385 L581	W377-S379 VanDerWaalsContact C-N 3.32Å; W377-S379 PolarHBondContact O-N 3.44Å; S379-L381 VanDerWaalsContact C-N 3.28Å; S379-L381 PolarHBondContact O-N 3.1Å; S379-K382 WeakPolarHBondContact O-CB 3.35Å; S379-K382 PolarHBondContact O-N 3.28Å; S379-N385 PolarHBondContact O-ND2 3.06Å; S379-L581 PolarHBondContact OG-O 3.39Å
380	T	91	Very high	90.4	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-33	-177.7	-56.8	0	0	0	0	113.3	I312 W377 K382 Q386 V582 I586	I312-T380 HydrophobicContact CD1-CG2 3.38Å; I312-T380 HydrophobicContact CG1-CG2 3.45Å; I312-T380 VanDerWaalsContact CG1-CG2 3.45Å; W377-T380 HydrophobicContact CE3-CG2 4.3Å; W377-T380 WeakPolarHBondContact O-CB 3.39Å; W377-T380 PolarHBondContact O-N 2.82Å; W377-T380 VanDerWaalsContact O-N 3.08Å; T380-K382 VanDerWaalsContact C-N 3.3Å; T380-K382 PolarHBondContact O-N 3.26Å; T380-Q386 PolarHBondContact O-NE2 3.26Å; T380-V582 HydrophobicContact CG2-CG1 4.03Å; T380-I586 HydrophobicContact CG2-CD1 4.04Å; T380-I586 HydrophobicContact CG2-CG1 4.26Å
381	L	87.1	Confident	90.4	Very high	72 Å²	72	55.1 Å²	55.1	38%	0.377	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-1.4	-179.9	-62.8	175.5	0	0	0	114	I312 K315 W377 S379	I312-L381 HydrophobicContact CG2-CD2 4.36Å; K315-L381 HydrophobicContact CD-CD1 4.4Å; K315-L381 HydrophobicContact CD-CD2 4.4Å; W377-L381 WeakPolarHBondContact O-CG 3.38Å; W377-L381 PolarHBondContact O-N 3.03Å; W377-L381 VanDerWaalsContact O-N 3.12Å; S379-L381 VanDerWaalsContact C-N 3.28Å; S379-L381 PolarHBondContact O-N 3.1Å
382	K	90	Very high	90.5	Very high	121 Å²	121	53.6 Å²	53.6	53%	0.526	27%	0.274	S	S	.	.			trans	-75	128.3	176	-67.4	-177	178.3	-178.7	0	110.5	S379 T380 A384 N385 Q386	S379-K382 WeakPolarHBondContact O-CB 3.35Å; S379-K382 PolarHBondContact O-N 3.28Å; T380-K382 VanDerWaalsContact C-N 3.3Å; T380-K382 PolarHBondContact O-N 3.26Å; K382-A384 VanDerWaalsContact C-N 3.31Å; K382-A384 PolarHBondContact O-N 3.42Å; K382-N385 HydrophobicContact CB-CB 4.3Å; K382-N385 WeakPolarHBondContact O-CB 3.41Å; K382-N385 PolarHBondContact O-N 3.19Å; K382-Q386 PolarHBondContact O-N 3.32Å; K382-Q386 VanDerWaalsContact O-N 3.13Å
383	R	86.8	Confident	90.6	Very high	207 Å²	207	51.6 Å²	51.6	78%	0.781	26%	0.263	S	S	*	.	H	α-helix	trans	-52.5	-44.5	178.8	-171.4	178.4	-63.7	168	1.4	113.5	N385 Q386 S387	R383-N385 VanDerWaalsContact C-N 3.25Å; R383-N385 PolarHBondContact O-N 3.1Å; R383-Q386 PolarHBondContact O-N 3.3Å; R383-S387 PolarHBondContact O-N 3.04Å; R383-S387 PolarHBondContact O-OG 3.36Å
384	A	89.6	Confident	90.4	Very high	63 Å²	63	55.7 Å²	55.7	52%	0.521	28%	0.284	S	S	.	.	H	α-helix	trans	-59	-37.9	178.6	0	0	0	0	0	112.6	K382 S388	K382-A384 VanDerWaalsContact C-N 3.31Å; K382-A384 PolarHBondContact O-N 3.42Å; A384-S388 PolarHBondContact O-N 3.18Å; A384-S388 VanDerWaalsContact O-N 3.1Å; A384-S388 PolarHBondContact O-OG 3.13Å
385	N	93.8	Very high	90.3	Very high	7 Å²	7	53.1 Å²	53.1	4%	0.037	27%	0.273	C	S	.	.	H	α-helix	trans	-73.1	-35.2	179.5	-67.7	-2.6	0	0	0	111.9	S379 K382 R383 S388 L389 N578 V582	S379-N385 PolarHBondContact O-ND2 3.06Å; K382-N385 HydrophobicContact CB-CB 4.3Å; K382-N385 WeakPolarHBondContact O-CB 3.41Å; K382-N385 PolarHBondContact O-N 3.19Å; R383-N385 VanDerWaalsContact C-N 3.25Å; R383-N385 PolarHBondContact O-N 3.1Å; N385-S388 PolarHBondContact O-N 3.21Å; N385-L389 PolarHBondContact O-N 3.41Å; N385-N578 WeakPolarHBondContact OD1-CB 3.31Å; N385-N578 PolarHBondContact OD1-OD1 2.96Å; N385-V582 HydrophobicContact CB-CG2 3.71Å
386	Q	89.7	Confident	90.3	Very high	46 Å²	46	49.8 Å²	49.8	22%	0.215	25%	0.25	C	C	.	.	H	α-helix	trans	-65.9	-44	173.3	-65.9	173	7.8	0	0	111.3	I312 T380 K382 R383 S388 L389 D390	I312-Q386 HydrophobicContact CG2-CG 4.17Å; I312-Q386 VanDerWaalsContact CG2-NE2 3.29Å; T380-Q386 PolarHBondContact O-NE2 3.26Å; K382-Q386 PolarHBondContact O-N 3.32Å; K382-Q386 VanDerWaalsContact O-N 3.13Å; R383-Q386 PolarHBondContact O-N 3.3Å; Q386-S388 VanDerWaalsContact C-N 3.29Å; Q386-S388 PolarHBondContact O-N 3.08Å; Q386-L389 VanDerWaalsContact O-CB 3.3Å; Q386-L389 WeakPolarHBondContact O-CB 3.19Å; Q386-L389 PolarHBondContact O-N 3.3Å; Q386-L389 VanDerWaalsContact O-N 3.08Å; Q386-D390 PolarHBondContact O-N 2.8Å
387	S	91.6	Very high	90.3	Very high	65 Å²	65	54 Å²	54	46%	0.455	27%	0.267	S	S	.	.	H	α-helix	trans	-61	-38.1	174.8	-58.6	0	0	0	0	112.4	R383 L389 D390 E391	R383-S387 PolarHBondContact O-N 3.04Å; R383-S387 PolarHBondContact O-OG 3.36Å; S387-L389 VanDerWaalsContact C-N 3.35Å; S387-D390 PolarHBondContact O-N 3.2Å; S387-E391 PolarHBondContact O-N 2.93Å
388	S	93.4	Very high	90.1	Very high	9 Å²	9	57 Å²	57	6%	0.063	28%	0.282	C	S	.	.	H	α-helix	trans	-65.7	-36	173.6	-64.3	0	0	0	0	112.9	A384 N385 Q386 D390 E391 M392 N578 T579	A384-S388 PolarHBondContact O-N 3.18Å; A384-S388 VanDerWaalsContact O-N 3.1Å; A384-S388 PolarHBondContact O-OG 3.13Å; N385-S388 PolarHBondContact O-N 3.21Å; Q386-S388 VanDerWaalsContact C-N 3.29Å; Q386-S388 PolarHBondContact O-N 3.08Å; S388-D390 VanDerWaalsContact C-N 3.34Å; S388-E391 PolarHBondContact O-N 3.24Å; S388-M392 WeakPolarHBondContact O-CB 3.49Å; S388-M392 PolarHBondContact O-N 3.33Å; S388-N578 WeakPolarHBondContact OG-CB 3.41Å; S388-N578 PolarHBondContact OG-ND2 3.3Å; S388-T579 PolarHBondContact O-OG1 3.13Å
389	L	92.7	Very high	90	Very high	3 Å²	3	49.4 Å²	49.4	2%	0.016	25%	0.249	C	C	.	.	H	α-helix	trans	-61.2	-42.8	173.3	-175.9	72	0	0	0	111.3	L305 I308 E309 I312 N385 Q386 S387 M392 K393 T579 V582	L305-L389 HydrophobicContact CB-CD1 4.41Å; L305-L389 HydrophobicContact CD1-CD1 4.14Å; L305-L389 HydrophobicContact CD2-CD1 3.91Å; L305-L389 HydrophobicContact CG-CD1 4.37Å; I308-L389 HydrophobicContact CG2-CD2 4.21Å; E309-L389 HydrophobicContact CB-CD2 4.1Å; I312-L389 HydrophobicContact CD1-CD2 4.13Å; N385-L389 PolarHBondContact O-N 3.41Å; Q386-L389 VanDerWaalsContact O-CB 3.3Å; Q386-L389 WeakPolarHBondContact O-CB 3.19Å; Q386-L389 PolarHBondContact O-N 3.3Å; Q386-L389 VanDerWaalsContact O-N 3.08Å; S387-L389 VanDerWaalsContact C-N 3.35Å; L389-M392 WeakPolarHBondContact O-CB 3.33Å; L389-M392 PolarHBondContact O-N 2.99Å; L389-K393 WeakPolarHBondContact O-CG 3.15Å; L389-K393 PolarHBondContact O-N 2.03Å; L389-T579 HydrophobicContact CD1-CG2 3.95Å; L389-V582 HydrophobicContact CD1-CG1 4.39Å; L389-V582 HydrophobicContact CD2-CG1 4.24Å
390	D	91.7	Very high	89.9	Confident	62 Å²	62	50 Å²	50	33%	0.332	25%	0.253	S	S	.	.	H	α-helix	trans	-64	-43.2	177.3	-69.8	-30.6	0	0	0	112.5	Q386 S387 S388 M392 K393 N394	Q386-D390 PolarHBondContact O-N 2.8Å; S387-D390 PolarHBondContact O-N 3.2Å; S388-D390 VanDerWaalsContact C-N 3.34Å; D390-M392 VanDerWaalsContact C-N 3.31Å; D390-M392 PolarHBondContact O-N 3.19Å; D390-K393 WeakPolarHBondContact O-CB 3.25Å; D390-K393 PolarHBondContact O-N 3.45Å; D390-N394 PolarHBondContact O-N 3.45Å; D390-N394 PolarHBondContact O-ND2 3.34Å
391	E	89.9	Confident	89.7	Confident	70 Å²	70	53.4 Å²	53.4	33%	0.327	28%	0.277	S	S	.	.	H	α-helix	trans	-61.2	-42.4	175	-169.3	174.3	-163.5	0	0	110.9	S387 S388 K393 N394 M395 T575	S387-E391 PolarHBondContact O-N 2.93Å; S388-E391 PolarHBondContact O-N 3.24Å; E391-K393 PolarHBondContact O-N 2.82Å; E391-N394 PolarHBondContact O-N 3Å; E391-M395 PolarHBondContact O-N 2.63Å; E391-T575 HydrophobicContact CB-CG2 3.88Å; E391-T575 HydrophobicContact CG-CG2 3.96Å; E391-T575 WeakPolarHBondContact OE2-CG2 3.37Å; E391-T575 PolarHBondContact OE2-OG1 3.36Å
392	M	90.3	Very high	89.9	Confident	4 Å²	4	50 Å²	50	2%	0.02	26%	0.259	C	S	.	.	H	α-helix	trans	-61.8	-40.9	175.1	-166.1	67.1	73.9	0	0	112.6	F120 L305 S388 L389 D390 N394 M395 L396 I576 T579	F120-M392 HydrophobicContact CB-CE 4.28Å; F120-M392 HydrophobicContact CB-SD 4.09Å; F120-M392 HydrophobicContact CD1-SD 3.49Å; F120-M392 WeakPolarHBondContact CD1-SD 3.31Å; F120-M392 HydrophobicContact CD2-CE 4.35Å; F120-M392 HydrophobicContact CD2-CG 4.05Å; F120-M392 HydrophobicContact CD2-SD 3.28Å; F120-M392 WeakPolarHBondContact CD2-SD 3.45Å; F120-M392 HydrophobicContact CE1-SD 3.6Å; F120-M392 VanDerWaalsContact CE1-SD 3.6Å; F120-M392 HydrophobicContact CE2-CG 3.83Å; F120-M392 HydrophobicContact CE2-SD 3.38Å; F120-M392 WeakPolarHBondContact CE2-SD 3.39Å; F120-M392 HydrophobicContact CG-CE 4.15Å; F120-M392 HydrophobicContact CG-SD 3.34Å; F120-M392 WeakPolarHBondContact CG-SD 3.4Å; F120-M392 HydrophobicContact CZ-CG 4.26Å; F120-M392 HydrophobicContact CZ-SD 3.55Å; F120-M392 VanDerWaalsContact CZ-SD 3.55Å; L305-M392 HydrophobicContact CD1-CB 4.4Å; L305-M392 HydrophobicContact CD1-CG 4.16Å; S388-M392 WeakPolarHBondContact O-CB 3.49Å; S388-M392 PolarHBondContact O-N 3.33Å; L389-M392 WeakPolarHBondContact O-CB 3.33Å; L389-M392 PolarHBondContact O-N 2.99Å; D390-M392 VanDerWaalsContact C-N 3.31Å; D390-M392 PolarHBondContact O-N 3.19Å; M392-N394 VanDerWaalsContact C-N 3.34Å; M392-N394 PolarHBondContact O-N 2.97Å; M392-M395 WeakPolarHBondContact O-CB 3.41Å; M392-M395 PolarHBondContact O-N 3.35Å; M392-L396 PolarHBondContact O-N 3.02Å; M392-I576 HydrophobicContact CE-CB 4.34Å; M392-I576 HydrophobicContact CE-CG1 4.04Å; M392-T579 HydrophobicContact CB-CG2 4.09Å; M392-T579 HydrophobicContact CE-CG2 4.13Å; M392-T579 HydrophobicContact CG-CG2 4.08Å
393	K	92.3	Very high	89.9	Confident	21 Å²	21	46.2 Å²	46.2	9%	0.091	25%	0.248	C	C	.	.	H	α-helix	trans	-62	-42.6	174.5	-74.2	175	62.4	-168.7	0	111.6	L302 L305 E309 L389 D390 E391 M395 L396 K397	L302-K393 HydrophobicContact CD2-CB 4.31Å; L302-K393 WeakPolarHBondContact CD2-O 3.45Å; L305-K393 HydrophobicContact CB-CD 4.3Å; L305-K393 HydrophobicContact CB-CG 3.86Å; L305-K393 HydrophobicContact CD1-CG 3.82Å; E309-K393 IonicContact OE2-NZ 3.1Å; E309-K393 PolarHBondContact OE2-NZ 2.76Å; L389-K393 WeakPolarHBondContact O-CG 3.15Å; L389-K393 PolarHBondContact O-N 2.03Å; D390-K393 WeakPolarHBondContact O-CB 3.25Å; D390-K393 PolarHBondContact O-N 3.45Å; E391-K393 PolarHBondContact O-N 2.82Å; K393-M395 VanDerWaalsContact C-N 3.25Å; K393-M395 PolarHBondContact O-N 3.13Å; K393-L396 PolarHBondContact O-N 3.49Å; K393-K397 WeakPolarHBondContact O-CG 3.4Å; K393-K397 PolarHBondContact O-N 2.66Å
394	N	89.4	Confident	89.9	Confident	87 Å²	87	44 Å²	44	47%	0.465	24%	0.241	S	C	.	.	H	α-helix	trans	-61.4	-39.1	176.9	-70.4	-27.3	0	0	0	110.9	D390 E391 M392 K397 I398	D390-N394 PolarHBondContact O-N 3.45Å; D390-N394 PolarHBondContact O-ND2 3.34Å; E391-N394 PolarHBondContact O-N 3Å; M392-N394 VanDerWaalsContact C-N 3.34Å; M392-N394 PolarHBondContact O-N 2.97Å; N394-K397 WeakPolarHBondContact O-CB 3.44Å; N394-K397 PolarHBondContact O-N 3.44Å; N394-I398 WeakPolarHBondContact O-CG1 3.29Å; N394-I398 PolarHBondContact O-N 3.3Å; N394-I398 VanDerWaalsContact O-N 3.11Å
395	M	86.5	Confident	89.9	Confident	9 Å²	9	41.9 Å²	41.9	4%	0.044	22%	0.22	C	C	.	.	H	α-helix	trans	-62.7	-45.6	173.3	-71.2	-58.5	-56.6	0	0	113.1	F120 E391 M392 K393 K397 I398 M399 V567 F568 I571	F120-M395 HydrophobicContact CE1-CB 3.77Å; F120-M395 HydrophobicContact CZ-CB 3.87Å; E391-M395 PolarHBondContact O-N 2.63Å; M392-M395 WeakPolarHBondContact O-CB 3.41Å; M392-M395 PolarHBondContact O-N 3.35Å; K393-M395 VanDerWaalsContact C-N 3.25Å; K393-M395 PolarHBondContact O-N 3.13Å; M395-K397 PolarHBondContact O-N 3.18Å; M395-I398 PolarHBondContact O-N 3.25Å; M395-I398 VanDerWaalsContact O-N 3.09Å; M395-I398 HydrophobicContact SD-CD1 4.18Å; M395-M399 WeakPolarHBondContact O-CG 3.3Å; M395-M399 PolarHBondContact O-N 3.18Å; M395-V567 HydrophobicContact CE-CG1 4.04Å; M395-V567 HydrophobicContact SD-CG1 3.66Å; M395-F568 HydrophobicContact CE-CD1 3.73Å; M395-F568 HydrophobicContact CE-CD2 3.74Å; M395-F568 HydrophobicContact CE-CE1 3.52Å; M395-F568 HydrophobicContact CE-CE2 3.49Å; M395-F568 VanDerWaalsContact CE-CE2 3.49Å; M395-F568 HydrophobicContact CE-CG 3.82Å; M395-F568 HydrophobicContact CE-CZ 3.34Å; M395-I571 HydrophobicContact CE-CD1 3.51Å; M395-I571 HydrophobicContact CG-CD1 3.58Å; M395-I571 HydrophobicContact CG-CG1 4.39Å; M395-I571 HydrophobicContact SD-CD1 3.48Å; M395-I571 WeakPolarHBondContact SD-CD1 3.49Å; M395-I571 HydrophobicContact SD-CG1 4.12Å
396	L	90.4	Very high	89.3	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60.3	-34.7	175.3	-77.7	173.4	0	0	0	112.6	I116 F120 F294 F301 L302 L305 M392 K393 M399 S400	I116-L396 HydrophobicContact CG2-CD1 4.28Å; F120-L396 HydrophobicContact CE2-CD1 4.18Å; F120-L396 HydrophobicContact CE2-CD2 3.35Å; F120-L396 HydrophobicContact CE2-CG 3.47Å; F120-L396 VanDerWaalsContact CE2-CG 3.47Å; F120-L396 HydrophobicContact CZ-CD2 3.63Å; F120-L396 HydrophobicContact CZ-CG 3.64Å; F294-L396 HydrophobicContact CE1-CD2 4.03Å; F294-L396 HydrophobicContact CZ-CD2 4.45Å; F301-L396 HydrophobicContact CB-CD1 3.68Å; F301-L396 HydrophobicContact CB-CD2 3.76Å; F301-L396 HydrophobicContact CB-CG 4.37Å; F301-L396 HydrophobicContact CD2-CD2 3.83Å; F301-L396 HydrophobicContact CG-CD2 4.29Å; L302-L396 HydrophobicContact CD1-CB 4.36Å; L302-L396 HydrophobicContact CD2-CB 3.46Å; L302-L396 VanDerWaalsContact CD2-CB 3.46Å; L302-L396 HydrophobicContact CD2-CD1 4.15Å; L302-L396 HydrophobicContact CD2-CG 4.47Å; L302-L396 HydrophobicContact CG-CB 3.69Å; L302-L396 HydrophobicContact CG-CD1 4.32Å; L305-L396 HydrophobicContact CD1-CD1 3.6Å; L305-L396 HydrophobicContact CG-CD1 4.22Å; M392-L396 PolarHBondContact O-N 3.02Å; K393-L396 PolarHBondContact O-N 3.49Å; L396-M399 PolarHBondContact O-N 2.86Å; L396-S400 WeakPolarHBondContact O-CB 3.44Å; L396-S400 PolarHBondContact O-N 3.28Å
397	K	90.4	Very high	89.2	Confident	98 Å²	98	51.7 Å²	51.7	43%	0.426	27%	0.27	S	S	.	.	H	α-helix	trans	-63.3	-44.3	173.4	-70.3	172.2	-174.1	169.4	0	111.2	L302 K393 N394 M395 S400	L302-K397 HydrophobicContact CD1-CG 3.97Å; L302-K397 HydrophobicContact CD2-CG 3.93Å; K393-K397 WeakPolarHBondContact O-CG 3.4Å; K393-K397 PolarHBondContact O-N 2.66Å; N394-K397 WeakPolarHBondContact O-CB 3.44Å; N394-K397 PolarHBondContact O-N 3.44Å; M395-K397 PolarHBondContact O-N 3.18Å; K397-S400 PolarHBondContact O-N 2.63Å; K397-S400 PolarHBondContact O-OG 3.06Å
398	I	86.1	Confident	89.1	Confident	64 Å²	64	49 Å²	49	33%	0.328	25%	0.25	S	S	.	.	H	α-helix	trans	-63.7	-46.6	176.5	-54.9	168.9	0	0	0	109.7	N394 M395 S400 S401 N564 V567	N394-I398 WeakPolarHBondContact O-CG1 3.29Å; N394-I398 PolarHBondContact O-N 3.3Å; N394-I398 VanDerWaalsContact O-N 3.11Å; M395-I398 PolarHBondContact O-N 3.25Å; M395-I398 VanDerWaalsContact O-N 3.09Å; M395-I398 HydrophobicContact SD-CD1 4.18Å; I398-S400 VanDerWaalsContact C-N 3.25Å; I398-S400 PolarHBondContact O-N 2.88Å; I398-S401 WeakPolarHBondContact O-CB 3.34Å; I398-S401 PolarHBondContact O-N 3.5Å; I398-S401 PolarHBondContact O-OG 3.32Å; I398-N564 WeakPolarHBondContact CG2-OD1 3.38Å; I398-V567 HydrophobicContact CD1-CG1 4.08Å
399	M	87.5	Confident	88.8	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-59.9	-34.8	176	-66.1	-169.4	99	0	0	112.9	F120 I123 V291 F294 S295 M395 L396 S401 L402 S403 F568	F120-M399 HydrophobicContact CE1-SD 3.96Å; F120-M399 HydrophobicContact CZ-SD 3.87Å; I123-M399 HydrophobicContact CD1-CE 3.87Å; V291-M399 HydrophobicContact CG1-CE 4.02Å; F294-M399 HydrophobicContact CB-CE 4.48Å; F294-M399 HydrophobicContact CD1-CE 3.32Å; F294-M399 HydrophobicContact CD1-SD 3.44Å; F294-M399 WeakPolarHBondContact CD1-SD 3.48Å; F294-M399 HydrophobicContact CE1-CE 3.9Å; F294-M399 HydrophobicContact CE1-SD 3.4Å; F294-M399 WeakPolarHBondContact CE1-SD 3.44Å; F294-M399 HydrophobicContact CG-CE 4.29Å; S295-M399 WeakPolarHBondContact CB-O 3.43Å; M395-M399 WeakPolarHBondContact O-CG 3.3Å; M395-M399 PolarHBondContact O-N 3.18Å; L396-M399 PolarHBondContact O-N 2.86Å; M399-S401 PolarHBondContact O-N 3.45Å; M399-S401 VanDerWaalsContact O-N 3.15Å; M399-L402 WeakPolarHBondContact O-CA 3.28Å; M399-L402 VanDerWaalsContact O-CB 3.29Å; M399-L402 WeakPolarHBondContact O-CB 3.31Å; M399-L402 PolarHBondContact O-N 3.25Å; M399-S403 PolarHBondContact O-N 3.28Å; M399-F568 HydrophobicContact CE-CE2 4.13Å; M399-F568 HydrophobicContact CE-CZ 3.63Å; M399-F568 HydrophobicContact CG-CE2 3.98Å; M399-F568 HydrophobicContact CG-CZ 3.62Å; M399-F568 HydrophobicContact SD-CE1 4.36Å; M399-F568 HydrophobicContact SD-CE2 4.34Å; M399-F568 HydrophobicContact SD-CZ 3.5Å; M399-F568 VanDerWaalsContact SD-CZ 3.5Å
400	S	88.3	Confident	88.6	Confident	42 Å²	42	53.9 Å²	53.9	29%	0.294	29%	0.29	S	S	.	.	H	α-helix	trans	-61.3	-25.4	178.3	77.4	0	0	0	0	113.1	S298 L396 K397 I398 L402 S403	S298-S400 WeakPolarHBondContact OG-CA 3.44Å; S298-S400 VanDerWaalsContact OG-CB 3.25Å; S298-S400 WeakPolarHBondContact OG-CB 3.47Å; L396-S400 WeakPolarHBondContact O-CB 3.44Å; L396-S400 PolarHBondContact O-N 3.28Å; K397-S400 PolarHBondContact O-N 2.63Å; K397-S400 PolarHBondContact O-OG 3.06Å; I398-S400 VanDerWaalsContact C-N 3.25Å; I398-S400 PolarHBondContact O-N 2.88Å; S400-L402 PolarHBondContact O-N 3.41Å; S400-S403 WeakPolarHBondContact O-CB 3.29Å; S400-S403 PolarHBondContact O-N 3.32Å; S400-S403 PolarHBondContact O-OG 3.29Å
401	S	86.9	Confident	88.4	Confident	71 Å²	71	51.9 Å²	51.9	50%	0.497	28%	0.278	S	S	.	.	H	α-helix	trans	-67.5	-24.1	171.7	75.9	0	0	0	0	113.2	I398 M399	I398-S401 WeakPolarHBondContact O-CB 3.34Å; I398-S401 PolarHBondContact O-N 3.5Å; I398-S401 PolarHBondContact O-OG 3.32Å; M399-S401 PolarHBondContact O-N 3.45Å; M399-S401 VanDerWaalsContact O-N 3.15Å
402	L	91	Very high	88.4	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-82.5	-17.3	177.2	-57	178	0	0	0	113	V291 L292 M399 S400 Y404 F405 A560 L561 N564	V291-L402 HydrophobicContact CG1-CD1 3.9Å; L292-L402 HydrophobicContact CD2-CB 4.17Å; M399-L402 WeakPolarHBondContact O-CA 3.28Å; M399-L402 VanDerWaalsContact O-CB 3.29Å; M399-L402 WeakPolarHBondContact O-CB 3.31Å; M399-L402 PolarHBondContact O-N 3.25Å; S400-L402 PolarHBondContact O-N 3.41Å; L402-Y404 PolarHBondContact O-N 3.49Å; L402-F405 HydrophobicContact CB-CD2 4.37Å; L402-F405 HydrophobicContact CD2-CD2 4.16Å; L402-F405 HydrophobicContact CD2-CE2 4.03Å; L402-F405 WeakPolarHBondContact O-CD2 3.42Å; L402-F405 PolarHBondContact O-N 3.15Å; L402-A560 HydrophobicContact CD2-CB 3.64Å; L402-L561 HydrophobicContact CD1-CD2 4.02Å; L402-N564 HydrophobicContact CD1-CB 4.14Å
403	S	88.8	Confident	88.3	Confident	43 Å²	43	55.2 Å²	55.2	30%	0.301	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-20.4	-177.7	68.6	0	0	0	0	114	S295 Q296 M399 S400 F405	S295-S403 WeakPolarHBondContact O-CB 3.42Å; S295-S403 WeakPolarHBondContact OG-CA 3.39Å; S295-S403 PolarHBondContact OG-N 3.17Å; Q296-S403 PolarHBondContact NE2-O 3.07Å; Q296-S403 PolarHBondContact OE1-O 2.89Å; M399-S403 PolarHBondContact O-N 3.28Å; S400-S403 WeakPolarHBondContact O-CB 3.29Å; S400-S403 PolarHBondContact O-N 3.32Å; S400-S403 PolarHBondContact O-OG 3.29Å; S403-F405 VanDerWaalsContact C-N 3.31Å; S403-F405 PolarHBondContact O-N 2.91Å
404	Y	87.3	Confident	88.2	Confident	159 Å²	159	55.7 Å²	55.7	62%	0.624	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-29.8	174.9	-178.5	-94.1	0	0	0	112.7	L402	L402-Y404 PolarHBondContact O-N 3.49Å
405	F	88.9	Confident	88.2	Confident	20 Å²	20	51.6 Å²	51.6	9%	0.088	28%	0.28	C	S	.	.			trans	-84.5	124.5	-178.1	-50.4	-67.2	0	0	0	110.5	L292 Q296 L402 S403 E555 G557 A560	L292-F405 HydrophobicContact CD1-CB 4.27Å; L292-F405 HydrophobicContact CD2-CB 3.78Å; L292-F405 HydrophobicContact CD2-CD2 4.44Å; Q296-F405 PolarHBondContact NE2-O 3.37Å; L402-F405 HydrophobicContact CB-CD2 4.37Å; L402-F405 HydrophobicContact CD2-CD2 4.16Å; L402-F405 HydrophobicContact CD2-CE2 4.03Å; L402-F405 WeakPolarHBondContact O-CD2 3.42Å; L402-F405 PolarHBondContact O-N 3.15Å; S403-F405 VanDerWaalsContact C-N 3.31Å; S403-F405 PolarHBondContact O-N 2.91Å; F405-E555 HydrophobicContact CD1-CB 4.12Å; F405-E555 HydrophobicContact CE1-CB 3.7Å; F405-E555 WeakPolarHBondContact CE1-O 3.48Å; F405-G557 VanDerWaalsContact CE1-CA 3.46Å; F405-A560 HydrophobicContact CE2-CB 4.02Å; F405-A560 HydrophobicContact CZ-CB 4.42Å
406	K	83.2	Confident	88.3	Confident	193 Å²	193	51.9 Å²	51.9	84%	0.839	28%	0.283	S	S	*	.			trans	-85.1	-35.8	179.6	-69.8	-175.3	178.9	179.4	0	113.8
407	S	87.4	Confident	88.2	Confident	66 Å²	66	59.6 Å²	59.6	46%	0.462	32%	0.316	S	S	.	.			trans	-169.5	149.7	-179.9	172.1	0	0	0	0	108.1	E289 S409	E289-S407 WeakPolarHBondContact OE1-CB 3.44Å; E289-S407 PolarHBondContact OE1-OG 3.06Å; S407-S409 PolarHBondContact OG-N 3.39Å
408	V	88.6	Confident	88.1	Confident	7 Å²	7	55 Å²	55	4%	0.042	30%	0.296	C	S	.	.			trans	-121	6.3	175	-67.5	0	0	0	0	112.5	F288 E289 L292 A410 H411 L412 V558 L561	F288-V408 HydrophobicContact CB-CG2 3.69Å; F288-V408 HydrophobicContact CD2-CG2 3.53Å; F288-V408 HydrophobicContact CE2-CG2 4.44Å; F288-V408 HydrophobicContact CG-CG2 3.93Å; E289-V408 PolarHBondContact OE1-N 3.26Å; L292-V408 HydrophobicContact CD1-CG1 4.3Å; L292-V408 HydrophobicContact CD1-CG2 4.32Å; V408-A410 PolarHBondContact O-N 2.97Å; V408-H411 WeakPolarHBondContact O-CB 3.48Å; V408-H411 PolarHBondContact O-N 2.92Å; V408-H411 VanDerWaalsContact O-N 3.14Å; V408-L412 PolarHBondContact O-N 3.27Å; V408-V558 HydrophobicContact CB-CG2 3.59Å; V408-V558 HydrophobicContact CG1-CG2 3.97Å; V408-V558 HydrophobicContact CG2-CG2 4.02Å; V408-L561 HydrophobicContact CB-CD1 4.39Å; V408-L561 HydrophobicContact CG1-CD1 3.94Å; V408-L561 HydrophobicContact CG2-CD1 3.61Å
409	S	87	Confident	88.1	Confident	40 Å²	40	52.7 Å²	52.7	28%	0.28	29%	0.285	S	S	.	.	H	α-helix	trans	-60.4	-44.8	-173.3	-71.2	0	0	0	0	113.2	E289 S407 H411 L412 E413	E289-S409 PolarHBondContact OE1-OG 2.9Å; S407-S409 PolarHBondContact OG-N 3.39Å; S409-H411 PolarHBondContact O-N 2.65Å; S409-L412 PolarHBondContact O-N 2.83Å; S409-E413 WeakPolarHBondContact O-CG 3.45Å; S409-E413 PolarHBondContact O-N 2.84Å
410	A	88	Confident	87.8	Confident	76 Å²	76	56.9 Å²	56.9	63%	0.628	32%	0.319	S	S	*	.	H	α-helix	trans	-62.7	-33.2	178.7	0	0	0	0	0	112.7	V408 A414	V408-A410 PolarHBondContact O-N 2.97Å; A410-A414 WeakPolarHBondContact O-CB 3.39Å; A410-A414 PolarHBondContact O-N 2.86Å
411	H	88.9	Confident	87	Confident	20 Å²	20	58.9 Å²	58.9	9%	0.093	33%	0.333	C	S	.	.	H	α-helix	trans	-71.6	-45.6	177.1	179.4	71.7	0	0	0	111.5	E145 V408 S409 E413 A414 I415 A551 D553 V558	E145-H411 IonicContact OE1-CD2 2.54Å; E145-H411 IonicContact OE1-CE1 2.71Å; E145-H411 IonicContact OE1-NE2 3.83Å; E145-H411 PolarHBondContact OE1-NE2 3.31Å; V408-H411 WeakPolarHBondContact O-CB 3.48Å; V408-H411 PolarHBondContact O-N 2.92Å; V408-H411 VanDerWaalsContact O-N 3.14Å; S409-H411 PolarHBondContact O-N 2.65Å; H411-E413 VanDerWaalsContact C-N 3.33Å; H411-E413 PolarHBondContact O-N 3.42Å; H411-A414 PolarHBondContact O-N 3.4Å; H411-A414 VanDerWaalsContact O-N 3.14Å; H411-I415 WeakPolarHBondContact CE1-CD1 3.43Å; H411-I415 WeakPolarHBondContact NE2-CD1 3.17Å; H411-I415 PolarHBondContact O-N 3.26Å; H411-A551 PolarHBondContact CE1-O 3.11Å; H411-A551 PolarHBondContact ND1-O 3.09Å; H411-D553 VanDerWaalsContact CE1-CB 3.42Å; H411-D553 WeakPolarHBondContact CE1-CB 3.41Å; H411-D553 PolarHBondContact CE1-N 3.16Å; H411-D553 WeakPolarHBondContact ND1-CB 3.14Å; H411-D553 PolarHBondContact ND1-N 2.94Å; H411-D553 VanDerWaalsContact ND1-N 3.15Å; H411-V558 WeakPolarHBondContact CD2-CG2 3.18Å
412	L	89.6	Confident	86	Confident	7 Å²	7	56.6 Å²	56.6	4%	0.037	32%	0.321	C	S	.	.	H	α-helix	trans	-56.8	-46	174.5	-178.4	62.5	0	0	0	111.4	L141 I281 L284 V408 S409 A414 T416	L141-L412 HydrophobicContact CD1-CD1 4.31Å; L141-L412 HydrophobicContact CD2-CD1 3.65Å; I281-L412 HydrophobicContact CG2-CD2 4.1Å; I281-L412 HydrophobicContact CG2-CG 4.17Å; L284-L412 HydrophobicContact CD2-CD1 4.47Å; V408-L412 PolarHBondContact O-N 3.27Å; S409-L412 PolarHBondContact O-N 2.83Å; L412-A414 PolarHBondContact O-N 3.24Å; L412-T416 HydrophobicContact CD1-CG2 4.19Å; L412-T416 WeakPolarHBondContact O-CB 3.47Å; L412-T416 WeakPolarHBondContact O-CG2 3.39Å; L412-T416 PolarHBondContact O-N 3.24Å; L412-T416 PolarHBondContact O-OG1 2.96Å
413	E	88.1	Confident	84.3	Confident	136 Å²	136	59.5 Å²	59.5	64%	0.636	34%	0.341	S	S	*	.	H	α-helix	trans	-61.8	-41.4	174.9	-73.3	-179.4	-174.9	0	0	112.6	S409 H411 T416 K417	S409-E413 WeakPolarHBondContact O-CG 3.45Å; S409-E413 PolarHBondContact O-N 2.84Å; H411-E413 VanDerWaalsContact C-N 3.33Å; H411-E413 PolarHBondContact O-N 3.42Å; E413-T416 WeakPolarHBondContact CA-OG1 3.49Å; E413-T416 PolarHBondContact O-OG1 3.24Å; E413-K417 VanDerWaalsContact O-CB 3.29Å; E413-K417 WeakPolarHBondContact O-CB 3.41Å; E413-K417 PolarHBondContact O-N 2.94Å; E413-K417 VanDerWaalsContact O-N 3.08Å
414	A	90.3	Very high	82.6	Confident	32 Å²	32	61.3 Å²	61.3	26%	0.264	35%	0.354	S	S	.	.	H	α-helix	trans	-66.3	-48.1	-179.1	0	0	0	0	0	111.8	A410 H411 L412 K417 C418 A551	A410-A414 WeakPolarHBondContact O-CB 3.39Å; A410-A414 PolarHBondContact O-N 2.86Å; H411-A414 PolarHBondContact O-N 3.4Å; H411-A414 VanDerWaalsContact O-N 3.14Å; L412-A414 PolarHBondContact O-N 3.24Å; A414-K417 PolarHBondContact O-N 3.03Å; A414-C418 PolarHBondContact O-N 2.7Å; A414-C418 PolarHBondContact O-SG 3.44Å; A414-A551 HydrophobicContact CB-CB 3.63Å
415	I	89.6	Confident	81	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-65.3	-44.1	179.1	-73.1	-163.2	0	0	0	111.8	L141 L144 E145 H411 K417 C418 D419 L548 A551	L141-I415 HydrophobicContact CD1-CB 4.32Å; L141-I415 HydrophobicContact CD1-CD1 4.37Å; L141-I415 HydrophobicContact CD1-CG2 3.71Å; L144-I415 HydrophobicContact CB-CG2 3.89Å; L144-I415 HydrophobicContact CD1-CG2 3.5Å; L144-I415 VanDerWaalsContact CD1-CG2 3.5Å; L144-I415 HydrophobicContact CG-CG2 4.3Å; E145-I415 WeakPolarHBondContact OE1-CD1 3.36Å; H411-I415 WeakPolarHBondContact CE1-CD1 3.43Å; H411-I415 WeakPolarHBondContact NE2-CD1 3.17Å; H411-I415 PolarHBondContact O-N 3.26Å; I415-K417 VanDerWaalsContact C-N 3.28Å; I415-K417 PolarHBondContact O-N 3.15Å; I415-C418 WeakPolarHBondContact O-CB 3.46Å; I415-C418 PolarHBondContact O-N 3.47Å; I415-C418 VanDerWaalsContact O-N 3.1Å; I415-D419 PolarHBondContact O-N 2.92Å; I415-L548 HydrophobicContact CG1-CD2 4.49Å; I415-L548 HydrophobicContact CG2-CD2 4.27Å; I415-A551 HydrophobicContact CG1-CB 4.05Å
416	T	87.2	Confident	79.3	Confident	16 Å²	16	58.8 Å²	58.8	10%	0.098	36%	0.358	C	S	.	.	H	α-helix	trans	-62.5	-38	179.6	51.7	0	0	0	0	111.4	Y276 I281 L412 E413 D419 A420	Y276-T416 HydrophobicContact CD1-CG2 4.36Å; Y276-T416 HydrophobicContact CD2-CG2 4.47Å; Y276-T416 HydrophobicContact CE1-CG2 4.16Å; Y276-T416 HydrophobicContact CE2-CG2 4.18Å; I281-T416 HydrophobicContact CD1-CG2 3.65Å; I281-T416 HydrophobicContact CG1-CG2 4.01Å; I281-T416 HydrophobicContact CG2-CG2 4.36Å; L412-T416 HydrophobicContact CD1-CG2 4.19Å; L412-T416 WeakPolarHBondContact O-CB 3.47Å; L412-T416 WeakPolarHBondContact O-CG2 3.39Å; L412-T416 PolarHBondContact O-N 3.24Å; L412-T416 PolarHBondContact O-OG1 2.96Å; E413-T416 WeakPolarHBondContact CA-OG1 3.49Å; E413-T416 PolarHBondContact O-OG1 3.24Å; T416-D419 PolarHBondContact O-N 2.97Å; T416-A420 PolarHBondContact O-N 3.49Å
417	K	88.1	Confident	78	Confident	161 Å²	161	55.4 Å²	55.4	70%	0.7	35%	0.345	S	S	*	.	H	α-helix	trans	-64	-40.7	172.2	-173.8	178.3	-179.3	179	0	112.7	E413 A414 I415 S421	E413-K417 VanDerWaalsContact O-CB 3.29Å; E413-K417 WeakPolarHBondContact O-CB 3.41Å; E413-K417 PolarHBondContact O-N 2.94Å; E413-K417 VanDerWaalsContact O-N 3.08Å; A414-K417 PolarHBondContact O-N 3.03Å; I415-K417 VanDerWaalsContact C-N 3.28Å; I415-K417 PolarHBondContact O-N 3.15Å; K417-S421 PolarHBondContact O-N 3.42Å
418	C	88.7	Confident	76.4	Confident	2 Å²	2	56 Å²	56	1%	0.014	35%	0.349	C	S	.	.	H	α-helix	trans	-61.4	-45.9	175.3	-65.4	0	0	0	0	111.5	A414 I415 S421 G422 C547 L548	A414-C418 PolarHBondContact O-N 2.7Å; A414-C418 PolarHBondContact O-SG 3.44Å; I415-C418 WeakPolarHBondContact O-CB 3.46Å; I415-C418 PolarHBondContact O-N 3.47Å; I415-C418 VanDerWaalsContact O-N 3.1Å; C418-S421 PolarHBondContact O-N 2.84Å; C418-S421 PolarHBondContact O-OG 3.19Å; C418-G422 PolarHBondContact O-N 3.01Å; C418-C547 WeakPolarHBondContact CA-SG 3.24Å; C418-C547 HydrophobicContact CB-CB 3.74Å; C418-C547 WeakPolarHBondContact CB-SG 3.21Å; C418-C547 WeakPolarHBondContact SG-CB 3.19Å; C418-C547 PolarHBondContact SG-O 2.94Å; C418-C547 CovalentContact SG-SG 2.04Å; C418-C547 PolarHBondContact SG-SG 2.86Å; C418-L548 HydrophobicContact CB-CD2 3.83Å; C418-L548 HydrophobicContact CB-CG 4.3Å
419	D	86.4	Confident	75	Confident	16 Å²	16	56.9 Å²	56.9	9%	0.086	35%	0.354	C	S	.	.	H	α-helix	trans	-64.6	-40.8	179.3	-173.1	57.1	0	0	0	113.1	R140 L144 Y276 I415 T416 S421 G422	R140-D419 IonicContact CZ-OD1 3.12Å; R140-D419 IonicContact CZ-OD2 2.63Å; R140-D419 IonicContact NE-OD1 3.31Å; R140-D419 IonicContact NE-OD2 3.93Å; R140-D419 PolarHBondContact NE-OD2 3.32Å; R140-D419 IonicContact NH2-OD1 3.54Å; R140-D419 PolarHBondContact NH2-OD1 3.33Å; R140-D419 IonicContact NH2-OD2 2.76Å; R140-D419 PolarHBondContact NH2-OD2 3.02Å; L144-D419 HydrophobicContact CD1-CB 3.84Å; L144-D419 HydrophobicContact CD2-CB 4.41Å; Y276-D419 WeakPolarHBondContact CD2-OD2 3.45Å; Y276-D419 HydrophobicContact CE2-CB 3.78Å; Y276-D419 WeakPolarHBondContact CE2-OD2 3.45Å; I415-D419 PolarHBondContact O-N 2.92Å; T416-D419 PolarHBondContact O-N 2.97Å; D419-S421 PolarHBondContact O-N 3.44Å; D419-G422 PolarHBondContact O-N 3.48Å
420	A	81.7	Confident	74	Confident	88 Å²	88	59.8 Å²	59.8	73%	0.727	37%	0.37	S	S	*	.	H	α-helix	trans	-60.6	-29.8	176.8	0	0	0	0	0	113.2	T416	T416-A420 PolarHBondContact O-N 3.49Å
421	S	71.7	Confident	73.5	Confident	83 Å²	83	60 Å²	60	58%	0.58	36%	0.358	S	S	*	.	H	α-helix	trans	-83.5	-17.1	177.4	74.1	0	0	0	0	114	K417 C418 D419	K417-S421 PolarHBondContact O-N 3.42Å; C418-S421 PolarHBondContact O-N 2.84Å; C418-S421 PolarHBondContact O-OG 3.19Å; D419-S421 PolarHBondContact O-N 3.44Å
422	G	65.2	Low	73.2	Confident	23 Å²	23	59.1 Å²	59.1	24%	0.237	35%	0.354	C	S	.	.	S	Bend	trans	-70.7	131.1	-173.6	0	0	0	0	0	112.7	C418 D419 S424	C418-G422 PolarHBondContact O-N 3.01Å; D419-G422 PolarHBondContact O-N 3.48Å; G422-S424 PolarHBondContact O-N 2.96Å; G422-S424 VanDerWaalsContact O-N 3.15Å
423	S	55.9	Low	72.9	Confident	62 Å²	62	61.1 Å²	61.1	43%	0.434	37%	0.367	S	S	.	.			trans	-70.3	109.8	166.4	63	0	0	0	0	108.8	S425 H541	S423-S425 PolarHBondContact O-N 3.07Å; S423-H541 PolarHBondContact OG-NE2 3.39Å
424	S	53	Low	72.8	Confident	80 Å²	80	58.7 Å²	58.7	56%	0.559	36%	0.362	S	S	*	.			trans	-69.9	52.3	173.5	62.4	0	0	0	0	111.7	G422 T426	G422-S424 PolarHBondContact O-N 2.96Å; G422-S424 VanDerWaalsContact O-N 3.15Å; S424-T426 WeakPolarHBondContact O-CG2 3.32Å; S424-T426 PolarHBondContact O-N 3.42Å
425	S	53.7	Low	72.7	Confident	37 Å²	37	57.3 Å²	57.3	26%	0.259	35%	0.35	S	S	.	.			trans	-63.3	102.1	173.7	176.3	0	0	0	0	108.1	S423 E427 M535	S423-S425 PolarHBondContact O-N 3.07Å; S425-E427 VanDerWaalsContact C-N 3.28Å; S425-E427 PolarHBondContact O-N 3.1Å; S425-M535 PolarHBondContact OG-SD 3.44Å
426	T	53	Low	72.6	Confident	90 Å²	90	59.4 Å²	59.4	55%	0.552	36%	0.358	S	S	*	.			trans	-92.1	42.8	179.7	60.1	0	0	0	0	110.8	A271 S424 S428	A271-T426 HydrophobicContact CB-CG2 3.63Å; S424-T426 WeakPolarHBondContact O-CG2 3.32Å; S424-T426 PolarHBondContact O-N 3.42Å; T426-S428 PolarHBondContact O-N 3.41Å
427	E	55.1	Low	72.8	Confident	121 Å²	121	60.2 Å²	60.2	57%	0.565	37%	0.367	S	S	*	.			trans	-60.5	93	165.2	-81.5	-170.1	171.8	0	0	107.2	S425 L429 M535	S425-E427 VanDerWaalsContact C-N 3.28Å; S425-E427 PolarHBondContact O-N 3.1Å; E427-L429 VanDerWaalsContact C-N 3.29Å; E427-L429 PolarHBondContact O-N 3.19Å; E427-M535 HydrophobicContact CB-SD 4.39Å
428	S	54.1	Low	73.1	Confident	78 Å²	78	54 Å²	54	55%	0.545	34%	0.341	S	S	.	.			trans	-76.5	85.4	-171.3	153.8	0	0	0	0	106.8	T426 T430	T426-S428 PolarHBondContact O-N 3.41Å; S428-T430 PolarHBondContact O-N 3.28Å
429	L	58.8	Low	73.3	Confident	26 Å²	26	54 Å²	54	14%	0.136	34%	0.341	C	S	.	.			trans	-83.5	52.9	178	-65.7	171.9	0	0	0	111.1	E427 E431 L432 Y532	E427-L429 VanDerWaalsContact C-N 3.29Å; E427-L429 PolarHBondContact O-N 3.19Å; L429-E431 PolarHBondContact O-N 3.5Å; L429-L432 HydrophobicContact CB-CB 4.31Å; L429-L432 HydrophobicContact CB-CD1 3.86Å; L429-L432 HydrophobicContact CB-CG 3.81Å; L429-L432 HydrophobicContact CD1-CD1 3.55Å; L429-L432 HydrophobicContact CD1-CG 3.96Å; L429-L432 HydrophobicContact CG-CD1 4.38Å; L429-L432 HydrophobicContact CG-CG 4.46Å; L429-L432 PolarHBondContact O-N 3.15Å; L429-Y532 HydrophobicContact CD1-CD1 4.28Å; L429-Y532 HydrophobicContact CD1-CD2 2.98Å; L429-Y532 HydrophobicContact CD1-CE2 3.56Å; L429-Y532 HydrophobicContact CD1-CG 3.34Å; L429-Y532 HydrophobicContact CG-CD2 4.29Å
430	T	67.1	Low	73.6	Confident	102 Å²	102	57.7 Å²	57.7	63%	0.626	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-18.2	167.9	48.5	0	0	0	0	112.1	S428	S428-T430 PolarHBondContact O-N 3.28Å
431	E	76.4	Confident	74.2	Confident	80 Å²	80	58.7 Å²	58.7	37%	0.374	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-28.4	173.1	-55.9	-176.1	-179.8	0	0	115.2	L429 V434 I435 K528	L429-E431 PolarHBondContact O-N 3.5Å; E431-V434 CarbonylContact O-C 3.56Å; E431-V434 WeakPolarHBondContact O-CA 3.41Å; E431-V434 VanDerWaalsContact O-CB 3.29Å; E431-V434 WeakPolarHBondContact O-CB 3.42Å; E431-V434 PolarHBondContact O-N 3.42Å; E431-I435 HydrophobicContact CB-CD1 4.28Å; E431-I435 WeakPolarHBondContact O-CG1 3.38Å; E431-I435 PolarHBondContact O-N 2.89Å; E431-K528 VanDerWaalsContact CD-NZ 3.27Å; E431-K528 IonicContact OE1-NZ 2.9Å; E431-K528 PolarHBondContact OE1-NZ 2.98Å; E431-K528 WeakPolarHBondContact OE2-CD 3.44Å; E431-K528 WeakPolarHBondContact OE2-CE 3.32Å; E431-K528 IonicContact OE2-NZ 3.18Å; E431-K528 PolarHBondContact OE2-NZ 3.38Å
432	L	82.7	Confident	75.4	Confident	2 Å²	2	54.7 Å²	54.7	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-55.1	-46.4	-174.7	-89.1	177.6	0	0	0	113.6	I261 L429 V434 I435 Y436 I529 Y532	I261-L432 HydrophobicContact CG1-CB 4.5Å; L429-L432 HydrophobicContact CB-CB 4.31Å; L429-L432 HydrophobicContact CB-CD1 3.86Å; L429-L432 HydrophobicContact CB-CG 3.81Å; L429-L432 HydrophobicContact CD1-CD1 3.55Å; L429-L432 HydrophobicContact CD1-CG 3.96Å; L429-L432 HydrophobicContact CG-CD1 4.38Å; L429-L432 HydrophobicContact CG-CG 4.46Å; L429-L432 PolarHBondContact O-N 3.15Å; L432-V434 VanDerWaalsContact C-N 3.26Å; L432-V434 PolarHBondContact O-N 3.28Å; L432-I435 HydrophobicContact CD2-CD1 4.46Å; L432-I435 PolarHBondContact O-N 3.46Å; L432-Y436 WeakPolarHBondContact O-CB 3.38Å; L432-Y436 PolarHBondContact O-N 2.8Å; L432-I529 HydrophobicContact CD2-CB 4.4Å; L432-I529 HydrophobicContact CD2-CD1 4.38Å; L432-I529 HydrophobicContact CD2-CG1 3.39Å; L432-Y532 HydrophobicContact CD1-CD1 3.82Å; L432-Y532 HydrophobicContact CD1-CE1 4.16Å; L432-Y532 HydrophobicContact CD1-CG 4.05Å
433	P	83.7	Confident	76.7	Confident	48 Å²	48	53.8 Å²	53.8	31%	0.312	31%	0.306	S	S	.	.	H	α-helix	trans	-57.9	-37	172.7	-26	34.9	0	0	0	113.5	I261 A437	I261-P433 HydrophobicContact CG2-CG 4.24Å; P433-A437 WeakPolarHBondContact O-CB 3.44Å; P433-A437 PolarHBondContact O-N 3.39Å
434	V	86.3	Confident	78.5	Confident	85 Å²	85	54.6 Å²	54.6	52%	0.515	30%	0.303	S	S	.	.	H	α-helix	trans	-68.6	-43.6	177.8	-177.9	0	0	0	0	110.6	E431 L432 Y436 A437 N438	E431-V434 CarbonylContact O-C 3.56Å; E431-V434 WeakPolarHBondContact O-CA 3.41Å; E431-V434 VanDerWaalsContact O-CB 3.29Å; E431-V434 WeakPolarHBondContact O-CB 3.42Å; E431-V434 PolarHBondContact O-N 3.42Å; L432-V434 VanDerWaalsContact C-N 3.26Å; L432-V434 PolarHBondContact O-N 3.28Å; V434-Y436 VanDerWaalsContact C-N 3.34Å; V434-Y436 PolarHBondContact O-N 2.69Å; V434-A437 PolarHBondContact O-N 2.93Å; V434-N438 PolarHBondContact O-N 3.21Å; V434-N438 PolarHBondContact O-ND2 2.9Å
435	I	88.6	Confident	80.4	Confident	4 Å²	4	51.2 Å²	51.2	2%	0.021	28%	0.281	C	S	.	.	H	α-helix	trans	-60.5	-47	176.9	-59.3	167.9	0	0	0	109.8	E431 L432 A437 N438 M439 K528 I529	E431-I435 HydrophobicContact CB-CD1 4.28Å; E431-I435 WeakPolarHBondContact O-CG1 3.38Å; E431-I435 PolarHBondContact O-N 2.89Å; L432-I435 HydrophobicContact CD2-CD1 4.46Å; L432-I435 PolarHBondContact O-N 3.46Å; I435-A437 VanDerWaalsContact C-N 3.34Å; I435-A437 PolarHBondContact O-N 3.4Å; I435-N438 WeakPolarHBondContact O-CB 3.07Å; I435-N438 PolarHBondContact O-N 2.93Å; I435-N438 VanDerWaalsContact O-N 3.15Å; I435-M439 HydrophobicContact CG2-CE 4.05Å; I435-M439 HydrophobicContact CG2-SD 4.48Å; I435-M439 WeakPolarHBondContact O-CG 3.21Å; I435-M439 PolarHBondContact O-N 2.78Å; I435-K528 HydrophobicContact CD1-CB 4.19Å; I435-K528 HydrophobicContact CD1-CD 4.41Å; I435-I529 HydrophobicContact CB-CD1 4.39Å; I435-I529 HydrophobicContact CG2-CD1 3.52Å; I435-I529 HydrophobicContact CG2-CG1 4.28Å
436	Y	88.3	Confident	82.3	Confident	43 Å²	43	49.5 Å²	49.5	17%	0.169	27%	0.269	C	S	.	.	H	α-helix	trans	-61.7	-40.1	177.2	-175.5	-96.1	0	0	0	112.9	F254 L255 R258 I261 L432 V434 N438 M439 K440	F254-Y436 AromaticContact CD2-CD2 3.83Å; F254-Y436 HydrophobicContact CD2-CD2 3.83Å; F254-Y436 HydrophobicContact CD2-CE1 4.13Å; F254-Y436 AromaticContact CD2-CE2 3.44Å; F254-Y436 HydrophobicContact CD2-CE2 3.44Å; F254-Y436 VanDerWaalsContact CD2-CE2 3.44Å; F254-Y436 HydrophobicContact CD2-CG 4.4Å; F254-Y436 AromaticContact CD2-CZ 3.6Å; F254-Y436 AromaticContact CE2-CE1 3.86Å; F254-Y436 HydrophobicContact CE2-CE1 3.86Å; F254-Y436 AromaticContact CE2-CE2 3.93Å; F254-Y436 HydrophobicContact CE2-CE2 3.93Å; F254-Y436 AromaticContact CE2-CZ 3.55Å; F254-Y436 WeakPolarHBondContact O-CE2 3.42Å; L255-Y436 WeakPolarHBondContact CD2-OH 3.31Å; R258-Y436 HydrophobicContact CB-CE2 4.44Å; I261-Y436 HydrophobicContact CD1-CD1 3.95Å; I261-Y436 HydrophobicContact CD1-CD2 3.07Å; I261-Y436 HydrophobicContact CD1-CE1 4.49Å; I261-Y436 HydrophobicContact CD1-CE2 3.68Å; I261-Y436 HydrophobicContact CD1-CG 3.18Å; L432-Y436 WeakPolarHBondContact O-CB 3.38Å; L432-Y436 PolarHBondContact O-N 2.8Å; V434-Y436 VanDerWaalsContact C-N 3.34Å; V434-Y436 PolarHBondContact O-N 2.69Å; Y436-N438 VanDerWaalsContact C-N 3.34Å; Y436-N438 PolarHBondContact O-N 2.94Å; Y436-M439 PolarHBondContact O-N 2.8Å; Y436-K440 WeakPolarHBondContact O-CB 3.25Å; Y436-K440 PolarHBondContact O-N 2.89Å
437	A	90.6	Very high	84.2	Confident	34 Å²	34	49.1 Å²	49.1	28%	0.281	26%	0.259	S	S	.	.	H	α-helix	trans	-61.1	-43.4	173.5	0	0	0	0	0	111.4	P433 V434 I435 K440 F441	P433-A437 WeakPolarHBondContact O-CB 3.44Å; P433-A437 PolarHBondContact O-N 3.39Å; V434-A437 PolarHBondContact O-N 2.93Å; I435-A437 VanDerWaalsContact C-N 3.34Å; I435-A437 PolarHBondContact O-N 3.4Å; A437-K440 WeakPolarHBondContact O-CB 3.39Å; A437-K440 PolarHBondContact O-N 3.45Å; A437-F441 HydrophobicContact CB-CE2 4.28Å; A437-F441 WeakPolarHBondContact O-CD2 3.34Å; A437-F441 WeakPolarHBondContact O-CG 3.49Å; A437-F441 PolarHBondContact O-N 2.63Å
438	N	93.5	Very high	85.8	Confident	31 Å²	31	50.4 Å²	50.4	17%	0.166	27%	0.267	C	S	.	.	H	α-helix	trans	-65	-38.9	176.6	-69.5	-30.6	0	0	0	112.6	V434 I435 Y436 K440 F441 L442 I521 V522	V434-N438 PolarHBondContact O-N 3.21Å; V434-N438 PolarHBondContact O-ND2 2.9Å; I435-N438 WeakPolarHBondContact O-CB 3.07Å; I435-N438 PolarHBondContact O-N 2.93Å; I435-N438 VanDerWaalsContact O-N 3.15Å; Y436-N438 VanDerWaalsContact C-N 3.34Å; Y436-N438 PolarHBondContact O-N 2.94Å; N438-K440 VanDerWaalsContact C-N 3.35Å; N438-F441 PolarHBondContact O-N 3.14Å; N438-L442 WeakPolarHBondContact O-CB 2.97Å; N438-L442 PolarHBondContact O-N 2.93Å; N438-I521 HydrophobicContact CB-CG2 4.41Å; N438-I521 WeakPolarHBondContact ND2-CG2 3.04Å; N438-V522 HydrophobicContact CB-CG2 3.86Å
439	M	93.7	Very high	87.5	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60.8	-44.4	172.5	-67.5	178.7	162.1	0	0	111.7	Y164 F254 F257 I435 Y436 F441 L442 D443 V522 F526 I529	Y164-M439 HydrophobicContact CD1-CE 4.31Å; Y164-M439 HydrophobicContact CE1-CE 3.63Å; Y164-M439 HydrophobicContact CE1-SD 4.25Å; Y164-M439 WeakPolarHBondContact OH-CB 3.45Å; Y164-M439 VanDerWaalsContact OH-CG 3.29Å; Y164-M439 WeakPolarHBondContact OH-CG 3.21Å; F254-M439 HydrophobicContact CB-CB 3.69Å; F254-M439 HydrophobicContact CB-CG 4.44Å; F254-M439 HydrophobicContact CB-SD 4Å; F254-M439 HydrophobicContact CG-CB 4.15Å; F257-M439 HydrophobicContact CD2-CE 4.23Å; F257-M439 HydrophobicContact CD2-SD 3.79Å; F257-M439 HydrophobicContact CE2-CE 4.02Å; F257-M439 HydrophobicContact CE2-SD 4.03Å; I435-M439 HydrophobicContact CG2-CE 4.05Å; I435-M439 HydrophobicContact CG2-SD 4.48Å; I435-M439 WeakPolarHBondContact O-CG 3.21Å; I435-M439 PolarHBondContact O-N 2.78Å; Y436-M439 PolarHBondContact O-N 2.8Å; M439-F441 VanDerWaalsContact C-N 3.35Å; M439-F441 PolarHBondContact O-N 3.36Å; M439-L442 WeakPolarHBondContact O-CB 3.48Å; M439-L442 PolarHBondContact O-N 2.95Å; M439-D443 PolarHBondContact O-N 3.47Å; M439-V522 HydrophobicContact CE-CG1 4.11Å; M439-V522 HydrophobicContact CG-CG1 3.83Å; M439-V522 HydrophobicContact CG-CG2 4.18Å; M439-F526 HydrophobicContact CE-CD2 3.58Å; M439-F526 HydrophobicContact CE-CE2 4.06Å; M439-I529 HydrophobicContact CE-CD1 3.25Å; M439-I529 HydrophobicContact SD-CD1 3.92Å
440	K	93.5	Very high	89.1	Confident	94 Å²	94	47.8 Å²	47.8	41%	0.409	25%	0.249	S	C	.	.	H	α-helix	trans	-61.1	-42.9	174.9	-178.1	-179.3	178	-176.5	0	111.6	F254 Y436 A437 N438 D443 Q444	F254-K440 HydrophobicContact CD2-CB 4.36Å; F254-K440 HydrophobicContact CE1-CB 4.38Å; F254-K440 HydrophobicContact CE2-CB 3.78Å; F254-K440 HydrophobicContact CE2-CG 4.15Å; F254-K440 HydrophobicContact CZ-CB 3.81Å; F254-K440 HydrophobicContact CZ-CD 4.44Å; F254-K440 HydrophobicContact CZ-CG 3.8Å; Y436-K440 WeakPolarHBondContact O-CB 3.25Å; Y436-K440 PolarHBondContact O-N 2.89Å; A437-K440 WeakPolarHBondContact O-CB 3.39Å; A437-K440 PolarHBondContact O-N 3.45Å; N438-K440 VanDerWaalsContact C-N 3.35Å; K440-D443 PolarHBondContact O-N 3.42Å; K440-Q444 WeakPolarHBondContact O-CB 3.22Å; K440-Q444 VanDerWaalsContact O-CG 3.29Å; K440-Q444 WeakPolarHBondContact O-CG 3.22Å; K440-Q444 PolarHBondContact O-N 3.38Å
441	F	94	Very high	90.2	Very high	109 Å²	109	45.6 Å²	45.6	48%	0.478	24%	0.238	S	C	.	.	H	α-helix	trans	-67	-36.6	177.3	-68.7	-46.7	0	0	0	112.7	A437 N438 M439 G445 L518	A437-F441 HydrophobicContact CB-CE2 4.28Å; A437-F441 WeakPolarHBondContact O-CD2 3.34Å; A437-F441 WeakPolarHBondContact O-CG 3.49Å; A437-F441 PolarHBondContact O-N 2.63Å; N438-F441 PolarHBondContact O-N 3.14Å; M439-F441 VanDerWaalsContact C-N 3.35Å; M439-F441 PolarHBondContact O-N 3.36Å; F441-G445 PolarHBondContact O-N 2.82Å; F441-L518 HydrophobicContact CB-CD1 4.15Å; F441-L518 HydrophobicContact CB-CD2 4.22Å
442	L	95.3	Very high	90.9	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-60.5	-48.9	173.1	-177.1	70.1	0	0	0	110.8	L168 V171 N438 M439 G445 L446 L515 L518 L519 V522	L168-L442 HydrophobicContact CD1-CD2 3.6Å; V171-L442 HydrophobicContact CG1-CD1 4.24Å; N438-L442 WeakPolarHBondContact O-CB 2.97Å; N438-L442 PolarHBondContact O-N 2.93Å; M439-L442 WeakPolarHBondContact O-CB 3.48Å; M439-L442 PolarHBondContact O-N 2.95Å; L442-G445 PolarHBondContact O-N 2.61Å; L442-L446 HydrophobicContact CG-CD1 4.46Å; L442-L446 WeakPolarHBondContact O-CG 3.42Å; L442-L446 PolarHBondContact O-N 3.35Å; L442-L515 HydrophobicContact CD1-CD2 3.76Å; L442-L518 HydrophobicContact CD1-CB 3.97Å; L442-L519 HydrophobicContact CD1-CB 4.36Å; L442-V522 HydrophobicContact CD2-CB 4.45Å; L442-V522 HydrophobicContact CD2-CG1 4.41Å; L442-V522 HydrophobicContact CD2-CG2 4.38Å
443	D	94.2	Very high	91.2	Very high	4 Å²	4	45.7 Å²	45.7	2%	0.021	24%	0.241	C	C	.	.	H	α-helix	trans	-60.8	-49.5	177.6	179.1	29.9	0	0	0	111.9	D251 N252 F254 M439 K440 G445 L446 K447	D251-D443 VanDerWaalsContact CA-OD1 3.31Å; D251-D443 WeakPolarHBondContact CA-OD1 3.45Å; N252-D443 PolarHBondContact N-OD2 3.48Å; N252-D443 VanDerWaalsContact N-OD2 3.11Å; F254-D443 HydrophobicContact CD1-CB 4.26Å; F254-D443 HydrophobicContact CE1-CB 4.15Å; M439-D443 PolarHBondContact O-N 3.47Å; K440-D443 PolarHBondContact O-N 3.42Å; D443-G445 VanDerWaalsContact C-N 3.28Å; D443-G445 PolarHBondContact O-N 3.33Å; D443-L446 PolarHBondContact O-N 3.49Å; D443-L446 VanDerWaalsContact O-N 3.09Å; D443-K447 WeakPolarHBondContact O-CG 3.33Å; D443-K447 PolarHBondContact O-N 3.3Å; D443-K447 WeakPolarHBondContact OD1-CE 3.45Å; D443-K447 IonicContact OD1-NZ 2.69Å; D443-K447 WeakPolarHBondContact OD2-CE 3.48Å; D443-K447 IonicContact OD2-NZ 2.91Å; D443-K447 PolarHBondContact OD2-NZ 3.09Å
444	Q	93.3	Very high	91.2	Very high	78 Å²	78	44.4 Å²	44.4	36%	0.364	23%	0.23	S	C	.	.	H	α-helix	trans	-57.6	-42.1	175.1	-73.5	178.8	-16.4	0	0	112	K440 L446 K447 M448	K440-Q444 WeakPolarHBondContact O-CB 3.22Å; K440-Q444 VanDerWaalsContact O-CG 3.29Å; K440-Q444 WeakPolarHBondContact O-CG 3.22Å; K440-Q444 PolarHBondContact O-N 3.38Å; Q444-L446 VanDerWaalsContact C-N 3.3Å; Q444-L446 PolarHBondContact O-N 2.69Å; Q444-K447 PolarHBondContact O-N 3.3Å; Q444-M448 VanDerWaalsContact O-CG 3.31Å; Q444-M448 WeakPolarHBondContact O-CG 3.36Å; Q444-M448 PolarHBondContact O-N 3Å
445	G	92.7	Very high	91.4	Very high	9 Å²	9	40.4 Å²	40.4	9%	0.093	21%	0.205	C	C	.	.	H	α-helix	trans	-59	-39.1	176	0	0	0	0	0	112.8	F441 L442 D443 Q449	F441-G445 PolarHBondContact O-N 2.82Å; L442-G445 PolarHBondContact O-N 2.61Å; D443-G445 VanDerWaalsContact C-N 3.28Å; D443-G445 PolarHBondContact O-N 3.33Å; G445-Q449 WeakPolarHBondContact O-CG 3.35Å; G445-Q449 PolarHBondContact O-NE2 2.84Å
446	L	94.4	Very high	91.3	Very high	1 Å²	1	44 Å²	44	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-73.8	-41.9	176.4	-70.9	164.6	0	0	0	112.4	V171 F174 A247 K248 I250 L442 D443 Q444 M448 Q449 L515	V171-L446 HydrophobicContact CB-CD1 4.45Å; V171-L446 HydrophobicContact CG1-CD1 4.01Å; V171-L446 HydrophobicContact CG1-CD2 4.39Å; V171-L446 HydrophobicContact CG2-CD1 3.52Å; F174-L446 HydrophobicContact CD1-CD2 3.97Å; F174-L446 HydrophobicContact CE1-CD2 3.92Å; A247-L446 HydrophobicContact CB-CD2 4.36Å; K248-L446 VanDerWaalsContact CE-O 3.27Å; K248-L446 WeakPolarHBondContact CE-O 3.28Å; I250-L446 HydrophobicContact CG2-CD1 3.59Å; L442-L446 HydrophobicContact CG-CD1 4.46Å; L442-L446 WeakPolarHBondContact O-CG 3.42Å; L442-L446 PolarHBondContact O-N 3.35Å; D443-L446 PolarHBondContact O-N 3.49Å; D443-L446 VanDerWaalsContact O-N 3.09Å; Q444-L446 VanDerWaalsContact C-N 3.3Å; Q444-L446 PolarHBondContact O-N 2.69Å; L446-M448 VanDerWaalsContact C-N 3.3Å; L446-M448 PolarHBondContact O-N 2.77Å; L446-Q449 WeakPolarHBondContact O-CB 3.13Å; L446-Q449 WeakPolarHBondContact O-CG 3.39Å; L446-Q449 PolarHBondContact O-N 3.04Å; L446-Q449 VanDerWaalsContact O-N 3.15Å; L446-L515 HydrophobicContact CD2-CD1 4.27Å; L446-L515 HydrophobicContact CD2-CD2 4.49Å; L446-L515 HydrophobicContact CG-CD2 4.19Å
447	K	91	Very high	91.3	Very high	82 Å²	82	45.3 Å²	45.3	36%	0.357	23%	0.233	S	C	.	.	H	α-helix	trans	-58.4	-40.3	177.1	-79.7	172.6	173.8	161.2	0	113	D251 N252 D443 Q444 Q449	D251-K447 WeakPolarHBondContact OD1-CE 3.3Å; D251-K447 IonicContact OD1-NZ 3.07Å; D251-K447 PolarHBondContact OD1-NZ 2.79Å; D251-K447 WeakPolarHBondContact OD2-CE 3.4Å; D251-K447 IonicContact OD2-NZ 2.63Å; N252-K447 PolarHBondContact OD1-NZ 3.03Å; D443-K447 WeakPolarHBondContact O-CG 3.33Å; D443-K447 PolarHBondContact O-N 3.3Å; D443-K447 WeakPolarHBondContact OD1-CE 3.45Å; D443-K447 IonicContact OD1-NZ 2.69Å; D443-K447 WeakPolarHBondContact OD2-CE 3.48Å; D443-K447 IonicContact OD2-NZ 2.91Å; D443-K447 PolarHBondContact OD2-NZ 3.09Å; Q444-K447 PolarHBondContact O-N 3.3Å; K447-Q449 PolarHBondContact O-N 3.29Å
448	M	89.7	Confident	91.3	Very high	149 Å²	149	43.8 Å²	43.8	73%	0.734	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	-12.9	-180	-71.9	-172.5	-61.5	0	0	114	Q444 L446	Q444-M448 VanDerWaalsContact O-CG 3.31Å; Q444-M448 WeakPolarHBondContact O-CG 3.36Å; Q444-M448 PolarHBondContact O-N 3Å; L446-M448 VanDerWaalsContact C-N 3.3Å; L446-M448 PolarHBondContact O-N 2.77Å
449	Q	90.3	Very high	91.1	Very high	18 Å²	18	47.3 Å²	47.3	8%	0.084	23%	0.233	C	C	.	.	S	Bend	trans	-73.6	143.2	179.8	-54.1	-49.4	-41.2	0	0	111.3	L244 K248 G445 L446 K447 L508 L515	L244-Q449 HydrophobicContact CD1-CB 4.38Å; L244-Q449 HydrophobicContact CD2-CB 4.49Å; K248-Q449 PolarHBondContact NZ-O 2.67Å; G445-Q449 WeakPolarHBondContact O-CG 3.35Å; G445-Q449 PolarHBondContact O-NE2 2.84Å; L446-Q449 WeakPolarHBondContact O-CB 3.13Å; L446-Q449 WeakPolarHBondContact O-CG 3.39Å; L446-Q449 PolarHBondContact O-N 3.04Å; L446-Q449 VanDerWaalsContact O-N 3.15Å; K447-Q449 PolarHBondContact O-N 3.29Å; Q449-L508 HydrophobicContact CB-CD1 4.38Å; Q449-L508 HydrophobicContact CG-CD1 3.87Å; Q449-L515 HydrophobicContact CG-CD1 4.48Å
450	S	91.7	Very high	90.9	Very high	30 Å²	30	52 Å²	52	21%	0.21	26%	0.258	C	S	.	.			trans	-57.1	153.5	172.7	-166.9	0	0	0	0	110.9	L244 F452 Y454 D504	L244-S450 WeakPolarHBondContact CD2-O 3.45Å; S450-F452 VanDerWaalsContact C-N 3.25Å; S450-F452 WeakPolarHBondContact O-CD2 3.39Å; S450-F452 WeakPolarHBondContact O-CE2 3.48Å; S450-Y454 PolarHBondContact OG-OH 2.75Å; S450-D504 WeakPolarHBondContact CB-OD2 3.49Å; S450-D504 PolarHBondContact OG-OD2 2.9Å
451	S	89.6	Confident	90.7	Very high	56 Å²	56	47.6 Å²	47.6	39%	0.392	24%	0.239	S	C	.	.			trans	-75	-19.9	173.2	68	0	0	0	0	112.4	D453	S451-D453 WeakPolarHBondContact CB-OD2 3.14Å; S451-D453 PolarHBondContact O-N 2.89Å; S451-D453 VanDerWaalsContact OG-CG 3.24Å; S451-D453 PolarHBondContact OG-N 2.87Å; S451-D453 PolarHBondContact OG-OD2 3.37Å
452	F	92.5	Very high	90.5	Very high	5 Å²	5	45 Å²	45	2%	0.022	24%	0.235	C	C	.	.			trans	58.9	16	-175	-62.2	-89.5	0	0	0	114.8	V241 L244 S450 Y454 I455 F501 D504 F505 L508	V241-F452 HydrophobicContact CG1-CB 4.47Å; V241-F452 HydrophobicContact CG2-CB 3.56Å; V241-F452 HydrophobicContact CG2-CG 4.41Å; L244-F452 HydrophobicContact CD2-CD2 3.79Å; L244-F452 HydrophobicContact CD2-CE2 4Å; S450-F452 VanDerWaalsContact C-N 3.25Å; S450-F452 WeakPolarHBondContact O-CD2 3.39Å; S450-F452 WeakPolarHBondContact O-CE2 3.48Å; F452-Y454 HydrophobicContact CD1-CE2 4.26Å; F452-Y454 VanDerWaalsContact CD1-OH 3.23Å; F452-Y454 WeakPolarHBondContact CD1-OH 3.23Å; F452-Y454 PolarHBondContact O-N 3.21Å; F452-I455 WeakPolarHBondContact O-CB 3.48Å; F452-I455 VanDerWaalsContact O-CG2 3.3Å; F452-I455 WeakPolarHBondContact O-CG2 3.47Å; F452-I455 PolarHBondContact O-N 3.4Å; F452-F501 HydrophobicContact CD1-CD2 4.18Å; F452-F501 HydrophobicContact CD1-CE2 4.12Å; F452-D504 HydrophobicContact CE1-CB 3.8Å; F452-D504 HydrophobicContact CZ-CB 4.07Å; F452-F505 HydrophobicContact CE1-CB 4.07Å; F452-F505 HydrophobicContact CE1-CD2 4.08Å; F452-L508 HydrophobicContact CE2-CD2 3.76Å; F452-L508 HydrophobicContact CZ-CB 4Å; F452-L508 HydrophobicContact CZ-CD2 3.7Å; F452-L508 HydrophobicContact CZ-CG 4.43Å
453	D	88	Confident	90.1	Very high	79 Å²	79	50.1 Å²	50.1	42%	0.422	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-61.1	-23.5	-175.9	-65.8	-43.5	0	0	0	113.6	R245 S451 I455 N456	R245-D453 IonicContact NH2-OD1 2.66Å; S451-D453 WeakPolarHBondContact CB-OD2 3.14Å; S451-D453 PolarHBondContact O-N 2.89Å; S451-D453 VanDerWaalsContact OG-CG 3.24Å; S451-D453 PolarHBondContact OG-N 2.87Å; S451-D453 PolarHBondContact OG-OD2 3.37Å; D453-I455 PolarHBondContact O-N 2.85Å; D453-N456 WeakPolarHBondContact O-CB 3.36Å; D453-N456 PolarHBondContact O-N 3.28Å; D453-N456 PolarHBondContact O-ND2 3.48Å; D453-N456 VanDerWaalsContact O-ND2 3.07Å
454	Y	84.7	Confident	89.8	Confident	21 Å²	21	50 Å²	50	8%	0.082	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-64.2	-16.6	176	44.7	-99.3	0	0	0	113.4	S450 F452 N456 Q457 N497 K500 F501 D504	S450-Y454 PolarHBondContact OG-OH 2.75Å; F452-Y454 HydrophobicContact CD1-CE2 4.26Å; F452-Y454 VanDerWaalsContact CD1-OH 3.23Å; F452-Y454 WeakPolarHBondContact CD1-OH 3.23Å; F452-Y454 PolarHBondContact O-N 3.21Å; Y454-N456 PolarHBondContact O-N 2.6Å; Y454-N456 VanDerWaalsContact O-N 3.16Å; Y454-Q457 WeakPolarHBondContact O-CB 3.12Å; Y454-Q457 PolarHBondContact O-N 3.4Å; Y454-Q457 VanDerWaalsContact O-N 3.1Å; Y454-N497 HydrophobicContact CG-CB 4.48Å; Y454-K500 HydrophobicContact CD1-CD 4.44Å; Y454-K500 HydrophobicContact CE1-CD 4.2Å; Y454-K500 HydrophobicContact CE1-CG 4.31Å; Y454-F501 HydrophobicContact CD2-CB 3.85Å; Y454-F501 AromaticContact CD2-CD2 3.99Å; Y454-F501 HydrophobicContact CD2-CD2 3.99Å; Y454-F501 HydrophobicContact CD2-CG 4.41Å; Y454-F501 HydrophobicContact CE2-CB 3.39Å; Y454-F501 AromaticContact CE2-CD2 3.48Å; Y454-F501 HydrophobicContact CE2-CD2 3.48Å; Y454-F501 VanDerWaalsContact CE2-CD2 3.48Å; Y454-F501 AromaticContact CE2-CG 3.87Å; Y454-F501 HydrophobicContact CE2-CG 3.87Å; Y454-D504 VanDerWaalsContact OH-CB 3.25Å; Y454-D504 WeakPolarHBondContact OH-CB 3.16Å; Y454-D504 PolarHBondContact OH-OD2 2.72Å
455	I	89.2	Confident	89.6	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.005	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-58.5	-27.9	173.9	-157.5	-176.5	0	0	0	112.2	V234 F237 V241 F452 D453 Q457 F458 F501	V234-I455 HydrophobicContact CG1-CD1 4.21Å; V234-I455 HydrophobicContact CG1-CG1 4.16Å; V234-I455 HydrophobicContact CG2-CG1 4.34Å; F237-I455 HydrophobicContact CB-CD1 3.34Å; F237-I455 HydrophobicContact CG-CD1 4.42Å; V241-I455 HydrophobicContact CG2-CG2 4.31Å; F452-I455 WeakPolarHBondContact O-CB 3.48Å; F452-I455 VanDerWaalsContact O-CG2 3.3Å; F452-I455 WeakPolarHBondContact O-CG2 3.47Å; F452-I455 PolarHBondContact O-N 3.4Å; D453-I455 PolarHBondContact O-N 2.85Å; I455-Q457 PolarHBondContact O-N 3.23Å; I455-Q457 VanDerWaalsContact O-N 3.15Å; I455-F458 HydrophobicContact CG1-CD2 4.38Å; I455-F458 WeakPolarHBondContact O-CB 3.1Å; I455-F458 PolarHBondContact O-N 2.93Å; I455-F501 HydrophobicContact CB-CD2 4.15Å; I455-F501 HydrophobicContact CB-CE2 3.98Å; I455-F501 HydrophobicContact CD1-CD2 4.49Å; I455-F501 HydrophobicContact CD1-CE2 3.61Å; I455-F501 HydrophobicContact CD1-CZ 3.93Å; I455-F501 HydrophobicContact CG1-CD2 4.15Å; I455-F501 HydrophobicContact CG1-CE2 3.74Å; I455-F501 HydrophobicContact CG1-CZ 4.36Å
456	N	87.6	Confident	89.4	Confident	80 Å²	80	52 Å²	52	43%	0.428	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-61	-25.3	179	-68.1	-38.3	0	0	0	112.8	D453 Y454 F458 K459	D453-N456 WeakPolarHBondContact O-CB 3.36Å; D453-N456 PolarHBondContact O-N 3.28Å; D453-N456 PolarHBondContact O-ND2 3.48Å; D453-N456 VanDerWaalsContact O-ND2 3.07Å; Y454-N456 PolarHBondContact O-N 2.6Å; Y454-N456 VanDerWaalsContact O-N 3.16Å; N456-F458 PolarHBondContact O-N 2.72Å; N456-K459 WeakPolarHBondContact O-CB 3.38Å; N456-K459 PolarHBondContact O-N 2.86Å
457	Q	87.2	Confident	89	Confident	71 Å²	71	57.3 Å²	57.3	33%	0.332	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-69	-17.7	176.5	-60.3	-175.8	3.4	0	0	112.9	Y454 I455 R494 N497	Y454-Q457 WeakPolarHBondContact O-CB 3.12Å; Y454-Q457 PolarHBondContact O-N 3.4Å; Y454-Q457 VanDerWaalsContact O-N 3.1Å; I455-Q457 PolarHBondContact O-N 3.23Å; I455-Q457 VanDerWaalsContact O-N 3.15Å; Q457-R494 HydrophobicContact CB-CG 4.49Å; Q457-R494 PolarHBondContact O-NH1 3.12Å; Q457-N497 VanDerWaalsContact CD-ND2 3.27Å; Q457-N497 PolarHBondContact NE2-ND2 3.02Å; Q457-N497 VanDerWaalsContact NE2-ND2 3.12Å; Q457-N497 PolarHBondContact OE1-ND2 3.36Å
458	F	90.2	Very high	88.8	Confident	1 Å²	1	53.5 Å²	53.5	0%	0.004	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-96.7	-5.3	178.9	-53.4	-54	0	0	0	113.2	M196 V230 V234 I455 N456 D460 L461 R494 N497 A498	M196-F458 HydrophobicContact CE-CD1 4.03Å; M196-F458 HydrophobicContact CE-CE1 3.59Å; M196-F458 HydrophobicContact CE-CZ 4.25Å; V230-F458 HydrophobicContact CG1-CB 3.92Å; V230-F458 HydrophobicContact CG1-CD1 4.39Å; V230-F458 HydrophobicContact CG1-CG 4.21Å; V234-F458 HydrophobicContact CG2-CB 3.47Å; V234-F458 VanDerWaalsContact CG2-CB 3.47Å; I455-F458 HydrophobicContact CG1-CD2 4.38Å; I455-F458 WeakPolarHBondContact O-CB 3.1Å; I455-F458 PolarHBondContact O-N 2.93Å; N456-F458 PolarHBondContact O-N 2.72Å; F458-D460 VanDerWaalsContact C-N 3.3Å; F458-D460 PolarHBondContact O-N 2.94Å; F458-L461 HydrophobicContact CD1-CD2 4.45Å; F458-R494 HydrophobicContact CE1-CB 4.39Å; F458-N497 HydrophobicContact CZ-CB 4.36Å; F458-A498 HydrophobicContact CE1-CB 4.26Å; F458-A498 HydrophobicContact CZ-CB 3.81Å
459	K	89.6	Confident	88.6	Confident	106 Å²	106	50.8 Å²	50.8	46%	0.461	27%	0.271	S	S	.	.	S	Bend	trans	-67	-33.9	180	-170.5	168.7	-173	155.2	0	112.5	Q231 V234 E238 N456	Q231-K459 WeakPolarHBondContact CG-O 3.26Å; V234-K459 HydrophobicContact CG1-CB 4.33Å; E238-K459 IonicContact OE1-NZ 2.58Å; E238-K459 PolarHBondContact OE1-NZ 3.39Å; E238-K459 IonicContact OE2-NZ 3.72Å; E238-K459 PolarHBondContact OE2-NZ 3.14Å; N456-K459 WeakPolarHBondContact O-CB 3.38Å; N456-K459 PolarHBondContact O-N 2.86Å
460	D	89.7	Confident	88	Confident	97 Å²	97	51.5 Å²	51.5	52%	0.519	28%	0.275	S	S	.	.			trans	-127.8	104.2	176.3	-174.7	0.5	0	0	0	110.4	F458 S462 R494	F458-D460 VanDerWaalsContact C-N 3.3Å; F458-D460 PolarHBondContact O-N 2.94Å; D460-S462 WeakPolarHBondContact OD1-CB 3.42Å; D460-S462 PolarHBondContact OD1-N 3.02Å; D460-S462 PolarHBondContact OD1-OG 2.71Å; D460-R494 PolarHBondContact O-NH1 3.25Å; D460-R494 VanDerWaalsContact O-NH1 3.07Å
461	L	90.2	Very high	86.9	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.01	28%	0.279	C	S	.	.			trans	-109.4	13.8	171.7	-53.5	-172.1	0	0	0	111.1	F227 V230 Q231 F458 L463 L464 I465	F227-L461 HydrophobicContact CB-CB 4.29Å; F227-L461 HydrophobicContact CB-CD1 3.91Å; F227-L461 HydrophobicContact CD1-CD1 4.43Å; F227-L461 WeakPolarHBondContact O-CD1 3.47Å; V230-L461 HydrophobicContact CB-CD1 4.09Å; V230-L461 HydrophobicContact CG1-CD1 4.08Å; Q231-L461 HydrophobicContact CB-CD1 4.43Å; Q231-L461 HydrophobicContact CB-CG 4.38Å; F458-L461 HydrophobicContact CD1-CD2 4.45Å; L461-L463 VanDerWaalsContact C-N 3.27Å; L461-L463 PolarHBondContact O-N 3.46Å; L461-L464 HydrophobicContact CB-CD1 4.46Å; L461-L464 HydrophobicContact CD2-CD1 4.13Å; L461-L464 WeakPolarHBondContact O-CB 3.47Å; L461-L464 PolarHBondContact O-N 3.32Å; L461-I465 HydrophobicContact CB-CD1 4.4Å; L461-I465 WeakPolarHBondContact O-CG1 3.44Å; L461-I465 PolarHBondContact O-N 3.17Å
462	S	90.4	Very high	85.7	Confident	56 Å²	56	54.7 Å²	54.7	39%	0.392	30%	0.299	S	S	.	.	H	α-helix	trans	-58.8	-37.9	-175	-68.9	0	0	0	0	112.5	D460 L464 I465 T466	D460-S462 WeakPolarHBondContact OD1-CB 3.42Å; D460-S462 PolarHBondContact OD1-N 3.02Å; D460-S462 PolarHBondContact OD1-OG 2.71Å; S462-L464 VanDerWaalsContact C-N 3.34Å; S462-L464 PolarHBondContact O-N 2.84Å; S462-I465 PolarHBondContact O-N 3.44Å; S462-T466 PolarHBondContact O-N 3Å; S462-T466 PolarHBondContact O-OG1 2.9Å; S462-T466 VanDerWaalsContact O-OG1 3.04Å
463	L	87	Confident	84.3	Confident	106 Å²	106	61.1 Å²	61.1	56%	0.555	33%	0.329	S	S	*	.	H	α-helix	trans	-63.7	-38.5	176.1	-174.5	62.4	0	0	0	112.6	L461 R467 W486	L461-L463 VanDerWaalsContact C-N 3.27Å; L461-L463 PolarHBondContact O-N 3.46Å; L463-R467 HydrophobicContact CD1-CG 4.43Å; L463-R467 WeakPolarHBondContact O-CB 3.36Å; L463-R467 VanDerWaalsContact O-CG 3.24Å; L463-R467 WeakPolarHBondContact O-CG 3.37Å; L463-R467 PolarHBondContact O-N 3.4Å; L463-R467 VanDerWaalsContact O-N 3.14Å; L463-W486 HydrophobicContact CD2-CH2 4.32Å; L463-W486 HydrophobicContact CD2-CZ2 3.67Å; L463-W486 HydrophobicContact CG-CH2 4.04Å; L463-W486 HydrophobicContact CG-CZ2 3.8Å
464	L	86.2	Confident	82.9	Confident	3 Å²	3	68.1 Å²	68.1	2%	0.016	36%	0.355	C	S	.	.	H	α-helix	trans	-65.1	-49.6	173.5	-74.1	172.7	0	0	0	110	F227 L461 S462 T466 R467 F468 W486 F487	F227-L464 HydrophobicContact CD1-CD1 4.37Å; F227-L464 HydrophobicContact CD2-CB 3.95Å; F227-L464 HydrophobicContact CE1-CD1 4.33Å; F227-L464 HydrophobicContact CE2-CB 4.11Å; F227-L464 HydrophobicContact CG-CB 4.4Å; L461-L464 HydrophobicContact CB-CD1 4.46Å; L461-L464 HydrophobicContact CD2-CD1 4.13Å; L461-L464 WeakPolarHBondContact O-CB 3.47Å; L461-L464 PolarHBondContact O-N 3.32Å; S462-L464 VanDerWaalsContact C-N 3.34Å; S462-L464 PolarHBondContact O-N 2.84Å; L464-T466 VanDerWaalsContact C-N 3.33Å; L464-T466 PolarHBondContact O-N 3.46Å; L464-R467 PolarHBondContact O-N 3.44Å; L464-F468 HydrophobicContact CD2-CE2 4.23Å; L464-F468 WeakPolarHBondContact O-CD2 3.44Å; L464-F468 PolarHBondContact O-N 3.21Å; L464-W486 HydrophobicContact CD2-CH2 3.77Å; L464-W486 HydrophobicContact CD2-CZ3 3.76Å; L464-W486 HydrophobicContact CG-CH2 4.46Å; L464-F487 HydrophobicContact CD2-CD2 3.55Å; L464-F487 HydrophobicContact CD2-CE2 3.66Å
465	I	89.7	Confident	82.6	Confident	29 Å²	29	71 Å²	71	15%	0.149	37%	0.372	C	S	.	.	H	α-helix	trans	-55.3	-48.9	-179.8	-69.9	162.9	0	0	0	111	V224 F227 E228 L461 S462 R467 T469	V224-I465 HydrophobicContact CG1-CG2 3.93Å; F227-I465 HydrophobicContact CB-CD1 4.48Å; F227-I465 HydrophobicContact CB-CG1 3.96Å; E228-I465 HydrophobicContact CG-CD1 3.9Å; E228-I465 HydrophobicContact CG-CG1 4.4Å; L461-I465 HydrophobicContact CB-CD1 4.4Å; L461-I465 WeakPolarHBondContact O-CG1 3.44Å; L461-I465 PolarHBondContact O-N 3.17Å; S462-I465 PolarHBondContact O-N 3.44Å; I465-R467 PolarHBondContact O-N 3.18Å; I465-T469 PolarHBondContact O-N 3.41Å; I465-T469 PolarHBondContact O-OG1 3.28Å
466	T	88.7	Confident	82	Confident	98 Å²	98	75.7 Å²	75.7	60%	0.601	39%	0.393	S	S	*	.	H	α-helix	trans	-63.6	-42	179.2	-57.3	0	0	0	0	112.1	S462 L464 T469	S462-T466 PolarHBondContact O-N 3Å; S462-T466 PolarHBondContact O-OG1 2.9Å; S462-T466 VanDerWaalsContact O-OG1 3.04Å; L464-T466 VanDerWaalsContact C-N 3.33Å; L464-T466 PolarHBondContact O-N 3.46Å; T466-T469 PolarHBondContact O-N 3.33Å
467	R	85.4	Confident	81.7	Confident	113 Å²	113	74.3 Å²	74.3	43%	0.426	39%	0.385	S	S	.	.	H	α-helix	trans	-70.2	-32.9	-177.2	-74.9	-70.3	-175.1	163.3	0.3	113.8	L463 L464 I465 T469 V483 W486	L463-R467 HydrophobicContact CD1-CG 4.43Å; L463-R467 WeakPolarHBondContact O-CB 3.36Å; L463-R467 VanDerWaalsContact O-CG 3.24Å; L463-R467 WeakPolarHBondContact O-CG 3.37Å; L463-R467 PolarHBondContact O-N 3.4Å; L463-R467 VanDerWaalsContact O-N 3.14Å; L464-R467 PolarHBondContact O-N 3.44Å; I465-R467 PolarHBondContact O-N 3.18Å; R467-T469 VanDerWaalsContact C-N 3.26Å; R467-V483 HydrophobicContact CB-CG1 4.37Å; R467-V483 VanDerWaalsContact O-CG2 3.28Å; R467-V483 WeakPolarHBondContact O-CG2 3.29Å; R467-W486 HydrophobicContact CB-CE3 4.3Å; R467-W486 HydrophobicContact CB-CH2 4.43Å; R467-W486 HydrophobicContact CB-CZ3 3.92Å; R467-W486 HydrophobicContact CG-CE3 4.22Å; R467-W486 HydrophobicContact CG-CH2 4.1Å; R467-W486 HydrophobicContact CG-CZ2 4.46Å; R467-W486 HydrophobicContact CG-CZ3 3.97Å
468	F	87.5	Confident	81.5	Confident	3 Å²	3	77.2 Å²	77.2	1%	0.013	40%	0.398	C	S	.	.	H	α-helix	trans	-82.7	-2.8	175.1	-78	-94	0	0	0	113	L203 F220 Y223 V224 F227 L464 I470 V483 F487	L203-F468 HydrophobicContact CD1-CE1 3.76Å; L203-F468 HydrophobicContact CD1-CZ 3.64Å; F220-F468 WeakPolarHBondContact CB-O 3.44Å; F220-F468 AromaticContact CD1-CD1 3.77Å; F220-F468 HydrophobicContact CD1-CD1 3.77Å; F220-F468 HydrophobicContact CD1-CE1 4.19Å; F220-F468 HydrophobicContact CD2-CB 4.35Å; F220-F468 AromaticContact CD2-CD1 3.9Å; F220-F468 HydrophobicContact CD2-CD1 3.9Å; F220-F468 WeakPolarHBondContact CD2-O 3.47Å; F220-F468 AromaticContact CE1-CD1 3.81Å; F220-F468 HydrophobicContact CE1-CD1 3.81Å; F220-F468 AromaticContact CE1-CE1 3.85Å; F220-F468 HydrophobicContact CE1-CE1 3.85Å; F220-F468 AromaticContact CE2-CD1 3.9Å; F220-F468 HydrophobicContact CE2-CD1 3.9Å; F220-F468 HydrophobicContact CE2-CE1 4.42Å; F220-F468 AromaticContact CG-CD1 3.82Å; F220-F468 HydrophobicContact CG-CD1 3.82Å; F220-F468 AromaticContact CZ-CD1 3.89Å; F220-F468 HydrophobicContact CZ-CD1 3.89Å; F220-F468 AromaticContact CZ-CE1 3.98Å; F220-F468 HydrophobicContact CZ-CE1 3.98Å; Y223-F468 AromaticContact CD2-CD1 3.81Å; Y223-F468 HydrophobicContact CD2-CD1 3.81Å; Y223-F468 AromaticContact CD2-CE1 3.73Å; Y223-F468 HydrophobicContact CD2-CE1 3.73Å; Y223-F468 HydrophobicContact CE2-CE1 4.39Å; V224-F468 HydrophobicContact CG2-CB 3.73Å; F227-F468 AromaticContact CE2-CD2 3.86Å; F227-F468 HydrophobicContact CE2-CD2 3.86Å; F227-F468 HydrophobicContact CE2-CE2 4.1Å; F227-F468 HydrophobicContact CE2-CG 4.23Å; F227-F468 HydrophobicContact CZ-CE2 4.42Å; L464-F468 HydrophobicContact CD2-CE2 4.23Å; L464-F468 WeakPolarHBondContact O-CD2 3.44Å; L464-F468 PolarHBondContact O-N 3.21Å; F468-I470 PolarHBondContact O-N 2.91Å; F468-V483 HydrophobicContact CD1-CG1 4.26Å; F468-V483 HydrophobicContact CD2-CG1 4.14Å; F468-V483 HydrophobicContact CE1-CG1 4.16Å; F468-V483 HydrophobicContact CE2-CG1 4.05Å; F468-V483 HydrophobicContact CG-CG1 4.26Å; F468-V483 HydrophobicContact CZ-CG1 4.06Å; F468-F487 HydrophobicContact CE2-CB 4.49Å; F468-F487 AromaticContact CE2-CD2 3.54Å; F468-F487 HydrophobicContact CE2-CD2 3.54Å; F468-F487 AromaticContact CE2-CE2 3.8Å; F468-F487 HydrophobicContact CE2-CE2 3.8Å; F468-F487 HydrophobicContact CE2-CG 4.21Å; F468-F487 HydrophobicContact CZ-CB 4.33Å; F468-F487 AromaticContact CZ-CD2 3.68Å; F468-F487 HydrophobicContact CZ-CD2 3.68Å; F468-F487 AromaticContact CZ-CE2 3.85Å; F468-F487 HydrophobicContact CZ-CE2 3.85Å; F468-F487 AromaticContact CZ-CG 3.99Å; F468-F487 HydrophobicContact CZ-CG 3.99Å; F468-F487 HydrophobicContact CZ-CZ 4.3Å
469	T	85.5	Confident	81.1	Confident	92 Å²	92	80.2 Å²	80.2	56%	0.564	41%	0.413	S	S	*	.			trans	-92.3	76.8	173.3	-53.1	0	0	0	0	109.6	I465 T466 R467	I465-T469 PolarHBondContact O-N 3.41Å; I465-T469 PolarHBondContact O-OG1 3.28Å; T466-T469 PolarHBondContact O-N 3.33Å; R467-T469 VanDerWaalsContact C-N 3.26Å
470	I	77.9	Confident	80.9	Confident	32 Å²	32	75.2 Å²	75.2	16%	0.164	39%	0.391	C	S	.	.			trans	-76.4	136.8	179	-67.6	-175.9	0	0	0	110.9	F220 F468 K476 E479 A480 V483	F220-I470 HydrophobicContact CD2-CD1 3.93Å; F220-I470 HydrophobicContact CD2-CG1 4.13Å; F220-I470 HydrophobicContact CE2-CD1 3.41Å; F220-I470 VanDerWaalsContact CE2-CD1 3.41Å; F220-I470 HydrophobicContact CE2-CG1 4.02Å; F220-I470 HydrophobicContact CZ-CD1 4.45Å; F468-I470 PolarHBondContact O-N 2.91Å; I470-K476 HydrophobicContact CG2-CG 4.5Å; I470-E479 HydrophobicContact CD1-CB 4.36Å; I470-E479 HydrophobicContact CD1-CG 4.11Å; I470-E479 HydrophobicContact CG1-CG 4.29Å; I470-E479 HydrophobicContact CG2-CG 4.4Å; I470-E479 WeakPolarHBondContact CG2-OE2 3.47Å; I470-A480 HydrophobicContact CD1-CB 3.83Å; I470-V483 HydrophobicContact CD1-CG2 4.19Å; I470-V483 HydrophobicContact CG1-CG2 4.45Å
471	G	68.6	Low	80.7	Confident	29 Å²	29	76.4 Å²	76.4	30%	0.299	39%	0.388	S	S	.	.			trans	-75.7	172.9	178.5	0	0	0	0	0	114	E473	G471-E473 PolarHBondContact O-N 3.36Å
472	P	63.7	Low	80.4	Confident	125 Å²	125	79.2 Å²	79.2	81%	0.812	41%	0.408	S	S	*	.	S	Bend	trans	-74.1	24.5	177.7	32.2	-35.5	0	0	0	114
473	E	62.5	Low	80.2	Confident	139 Å²	139	76.7 Å²	76.7	65%	0.65	39%	0.39	S	S	*	.			trans	-64.7	162	-172.6	-70.3	-161.2	171.7	0	0	113.8	G471 D475 K476	G471-E473 PolarHBondContact O-N 3.36Å; E473-D475 PolarHBondContact O-N 2.91Å; E473-K476 WeakPolarHBondContact O-CG 3.37Å
474	K	59.6	Low	80	Confident	226 Å²	226	72.2 Å²	72.2	98%	0.983	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-20.5	-173.7	-86	-175.5	175.2	-179.7	0	114.5
475	D	77.3	Confident	79.8	Confident	82 Å²	82	74.8 Å²	74.8	44%	0.439	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.7	57.1	-176.9	-155.8	-19.5	0	0	0	112.6	E473 I477 Q478 E479	E473-D475 PolarHBondContact O-N 2.91Å; D475-I477 PolarHBondContact O-N 3.48Å; D475-Q478 HydrophobicContact CB-CB 4.34Å; D475-Q478 VanDerWaalsContact CG-CB 3.41Å; D475-Q478 PolarHBondContact O-N 2.89Å; D475-Q478 WeakPolarHBondContact OD1-CB 3.44Å; D475-Q478 PolarHBondContact OD1-N 2.8Å; D475-Q478 PolarHBondContact OD2-OE1 3Å; D475-Q478 VanDerWaalsContact OD2-OE1 3.13Å; D475-E479 PolarHBondContact O-N 2.9Å; D475-E479 VanDerWaalsContact O-N 3.11Å
476	K	77.6	Confident	79.5	Confident	100 Å²	100	76 Å²	76	44%	0.435	39%	0.391	S	S	.	.	H	α-helix	trans	-53.2	-34.8	177.2	-68.8	-175.1	177.1	-178.6	0	113.1	I470 E473 A480	I470-K476 HydrophobicContact CG2-CG 4.5Å; E473-K476 WeakPolarHBondContact O-CG 3.37Å; K476-A480 WeakPolarHBondContact O-CB 3.26Å; K476-A480 PolarHBondContact O-N 3.27Å
477	I	81.6	Confident	79.3	Confident	51 Å²	51	71.5 Å²	71.5	26%	0.262	36%	0.363	S	S	.	.	H	α-helix	trans	-68.3	-48.3	-177.9	-62.4	177.9	0	0	0	109.8	D210 I213 D475 E479 A480 R481	D210-I477 HydrophobicContact CB-CD1 4.49Å; I213-I477 HydrophobicContact CB-CG2 4.44Å; I213-I477 HydrophobicContact CD1-CG2 4.23Å; I213-I477 HydrophobicContact CG2-CG2 4.02Å; D475-I477 PolarHBondContact O-N 3.48Å; I477-E479 PolarHBondContact O-N 3.42Å; I477-A480 PolarHBondContact O-N 2.89Å; I477-R481 WeakPolarHBondContact O-CG 3.47Å; I477-R481 PolarHBondContact O-N 2.77Å
478	Q	82.3	Confident	78.8	Confident	131 Å²	131	68.7 Å²	68.7	61%	0.612	36%	0.356	S	S	*	.	H	α-helix	trans	-65.2	-40.4	178.9	-169.9	179.7	4.4	0	0	111.8	D475 R481 S482	D475-Q478 HydrophobicContact CB-CB 4.34Å; D475-Q478 VanDerWaalsContact CG-CB 3.41Å; D475-Q478 PolarHBondContact O-N 2.89Å; D475-Q478 WeakPolarHBondContact OD1-CB 3.44Å; D475-Q478 PolarHBondContact OD1-N 2.8Å; D475-Q478 PolarHBondContact OD2-OE1 3Å; D475-Q478 VanDerWaalsContact OD2-OE1 3.13Å; Q478-R481 PolarHBondContact O-N 2.99Å; Q478-S482 PolarHBondContact O-N 3.1Å
479	E	83.2	Confident	78.4	Confident	65 Å²	65	73.8 Å²	73.8	30%	0.304	39%	0.387	S	S	.	.	H	α-helix	trans	-62	-46.7	176.9	-169.9	177.5	171.7	0	0	111.3	I470 D475 I477 R481 S482 V483	I470-E479 HydrophobicContact CD1-CB 4.36Å; I470-E479 HydrophobicContact CD1-CG 4.11Å; I470-E479 HydrophobicContact CG1-CG 4.29Å; I470-E479 HydrophobicContact CG2-CG 4.4Å; I470-E479 WeakPolarHBondContact CG2-OE2 3.47Å; D475-E479 PolarHBondContact O-N 2.9Å; D475-E479 VanDerWaalsContact O-N 3.11Å; I477-E479 PolarHBondContact O-N 3.42Å; E479-R481 PolarHBondContact O-N 3.36Å; E479-S482 WeakPolarHBondContact O-CA 3.33Å; E479-S482 WeakPolarHBondContact O-CB 3.42Å; E479-S482 PolarHBondContact O-N 3.42Å; E479-S482 PolarHBondContact O-OG 3.4Å; E479-V483 WeakPolarHBondContact O-CG2 3.3Å; E479-V483 PolarHBondContact O-N 3.39Å
480	A	85.3	Confident	78.1	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-60.1	-42.4	177.2	0	0	0	0	0	112.6	I213 V217 F220 I470 K476 I477 S482 V483 I484	I213-A480 HydrophobicContact CG2-CB 3.84Å; V217-A480 HydrophobicContact CG2-CB 3.34Å; F220-A480 HydrophobicContact CE2-CB 4.43Å; F220-A480 HydrophobicContact CZ-CB 4.29Å; I470-A480 HydrophobicContact CD1-CB 3.83Å; K476-A480 WeakPolarHBondContact O-CB 3.26Å; K476-A480 PolarHBondContact O-N 3.27Å; I477-A480 PolarHBondContact O-N 2.89Å; A480-S482 PolarHBondContact O-N 3.33Å; A480-V483 PolarHBondContact O-N 3.4Å; A480-V483 VanDerWaalsContact O-N 3.12Å; A480-I484 VanDerWaalsContact O-CG1 3.28Å; A480-I484 WeakPolarHBondContact O-CG1 3.06Å; A480-I484 PolarHBondContact O-N 3.07Å
481	R	84.5	Confident	78.1	Confident	122 Å²	122	74.1 Å²	74.1	46%	0.46	38%	0.382	S	S	.	.	H	α-helix	trans	-55.5	-41.8	172.5	-73.7	177.1	179.5	-145.3	-0.8	111.7	D210 I213 I477 Q478 E479 A485	D210-R481 IonicContact OD1-CZ 3.55Å; D210-R481 IonicContact OD1-NE 3.69Å; D210-R481 IonicContact OD1-NH2 3.57Å; D210-R481 PolarHBondContact OD1-NH2 3.4Å; I213-R481 HydrophobicContact CD1-CG 3.42Å; I213-R481 VanDerWaalsContact CD1-CG 3.42Å; I213-R481 HydrophobicContact CG1-CG 4.32Å; I477-R481 WeakPolarHBondContact O-CG 3.47Å; I477-R481 PolarHBondContact O-N 2.77Å; Q478-R481 PolarHBondContact O-N 2.99Å; E479-R481 PolarHBondContact O-N 3.36Å; R481-A485 WeakPolarHBondContact O-CB 3.5Å; R481-A485 PolarHBondContact O-N 3.33Å
482	S	84.7	Confident	78.2	Confident	61 Å²	61	75.3 Å²	75.3	43%	0.427	39%	0.389	S	S	.	.	H	α-helix	trans	-67.1	-38.7	178.5	95.7	0	0	0	0	112.3	Q478 E479 A480 W486	Q478-S482 PolarHBondContact O-N 3.1Å; E479-S482 WeakPolarHBondContact O-CA 3.33Å; E479-S482 WeakPolarHBondContact O-CB 3.42Å; E479-S482 PolarHBondContact O-N 3.42Å; E479-S482 PolarHBondContact O-OG 3.4Å; A480-S482 PolarHBondContact O-N 3.33Å; S482-W486 VanDerWaalsContact O-CB 3.26Å; S482-W486 WeakPolarHBondContact O-CB 3.47Å; S482-W486 PolarHBondContact O-N 2.81Å
483	V	86	Confident	79	Confident	3 Å²	3	74.6 Å²	74.6	2%	0.018	38%	0.378	C	S	.	.	H	α-helix	trans	-64.6	-45.8	177.5	172.8	0	0	0	0	110.4	F220 R467 F468 I470 E479 A480 W486 F487	F220-V483 HydrophobicContact CE2-CG1 4.26Å; F220-V483 HydrophobicContact CZ-CG1 4.43Å; R467-V483 HydrophobicContact CB-CG1 4.37Å; R467-V483 VanDerWaalsContact O-CG2 3.28Å; R467-V483 WeakPolarHBondContact O-CG2 3.29Å; F468-V483 HydrophobicContact CD1-CG1 4.26Å; F468-V483 HydrophobicContact CD2-CG1 4.14Å; F468-V483 HydrophobicContact CE1-CG1 4.16Å; F468-V483 HydrophobicContact CE2-CG1 4.05Å; F468-V483 HydrophobicContact CG-CG1 4.26Å; F468-V483 HydrophobicContact CZ-CG1 4.06Å; I470-V483 HydrophobicContact CD1-CG2 4.19Å; I470-V483 HydrophobicContact CG1-CG2 4.45Å; E479-V483 WeakPolarHBondContact O-CG2 3.3Å; E479-V483 PolarHBondContact O-N 3.39Å; A480-V483 PolarHBondContact O-N 3.4Å; A480-V483 VanDerWaalsContact O-N 3.12Å; V483-W486 PolarHBondContact O-N 2.79Å; V483-F487 WeakPolarHBondContact O-CB 3.47Å; V483-F487 PolarHBondContact O-N 2.96Å
484	I	82.4	Confident	79.9	Confident	13 Å²	13	71.3 Å²	71.3	7%	0.067	36%	0.36	C	S	.	.	H	α-helix	trans	-63.4	-46.7	178.2	-63	173.1	0	0	0	110.7	L203 T216 F220 A480 W486 F487 N488	L203-I484 HydrophobicContact CB-CG2 4.5Å; L203-I484 HydrophobicContact CD2-CD1 4.15Å; L203-I484 HydrophobicContact CD2-CG1 3.98Å; L203-I484 HydrophobicContact CD2-CG2 4.49Å; T216-I484 HydrophobicContact CG2-CD1 4.28Å; F220-I484 HydrophobicContact CZ-CG1 4.5Å; A480-I484 VanDerWaalsContact O-CG1 3.28Å; A480-I484 WeakPolarHBondContact O-CG1 3.06Å; A480-I484 PolarHBondContact O-N 3.07Å; I484-W486 PolarHBondContact O-N 2.76Å; I484-F487 WeakPolarHBondContact O-CB 3.33Å; I484-F487 PolarHBondContact O-N 3.46Å; I484-N488 PolarHBondContact O-N 3.31Å
485	A	82.6	Confident	80.6	Confident	56 Å²	56	62.2 Å²	62.2	46%	0.463	32%	0.322	S	S	.	.	H	α-helix	trans	-61.7	-46.1	178.2	0	0	0	0	0	112.1	R481 F487 N488 V489	R481-A485 WeakPolarHBondContact O-CB 3.5Å; R481-A485 PolarHBondContact O-N 3.33Å; A485-F487 VanDerWaalsContact C-N 3.3Å; A485-F487 PolarHBondContact O-N 3.23Å; A485-N488 PolarHBondContact O-N 3.43Å; A485-V489 WeakPolarHBondContact O-CG2 3.43Å; A485-V489 PolarHBondContact O-N 2.83Å
486	W	83.6	Confident	80.9	Confident	56 Å²	56	64.7 Å²	64.7	21%	0.212	33%	0.331	C	S	.	.	H	α-helix	trans	-58.9	-44.3	174.9	166.8	83.5	0	0	0	111.6	L463 L464 R467 S482 V483 I484 N488 V489 Q490	L463-W486 HydrophobicContact CD2-CH2 4.32Å; L463-W486 HydrophobicContact CD2-CZ2 3.67Å; L463-W486 HydrophobicContact CG-CH2 4.04Å; L463-W486 HydrophobicContact CG-CZ2 3.8Å; L464-W486 HydrophobicContact CD2-CH2 3.77Å; L464-W486 HydrophobicContact CD2-CZ3 3.76Å; L464-W486 HydrophobicContact CG-CH2 4.46Å; R467-W486 HydrophobicContact CB-CE3 4.3Å; R467-W486 HydrophobicContact CB-CH2 4.43Å; R467-W486 HydrophobicContact CB-CZ3 3.92Å; R467-W486 HydrophobicContact CG-CE3 4.22Å; R467-W486 HydrophobicContact CG-CH2 4.1Å; R467-W486 HydrophobicContact CG-CZ2 4.46Å; R467-W486 HydrophobicContact CG-CZ3 3.97Å; S482-W486 VanDerWaalsContact O-CB 3.26Å; S482-W486 WeakPolarHBondContact O-CB 3.47Å; S482-W486 PolarHBondContact O-N 2.81Å; V483-W486 PolarHBondContact O-N 2.79Å; I484-W486 PolarHBondContact O-N 2.76Å; W486-N488 PolarHBondContact O-N 2.94Å; W486-V489 PolarHBondContact O-N 3.15Å; W486-Q490 HydrophobicContact CG-CG 4.46Å; W486-Q490 HydrophobicContact CZ2-CB 4.45Å; W486-Q490 WeakPolarHBondContact O-CG 3.35Å; W486-Q490 PolarHBondContact O-N 3.41Å
487	F	82.6	Confident	81.3	Confident	3 Å²	3	61.2 Å²	61.2	1%	0.013	32%	0.317	C	S	.	.	H	α-helix	trans	-61.5	-45.9	-177.8	177.2	-99.1	0	0	0	112	F200 L203 F227 L464 F468 V483 I484 A485 V489 Q490 N491	F200-F487 HydrophobicContact CD1-CD1 4.48Å; F200-F487 AromaticContact CD1-CE1 3.31Å; F200-F487 HydrophobicContact CD1-CE1 3.31Å; F200-F487 AromaticContact CD1-CE2 3.87Å; F200-F487 HydrophobicContact CD1-CE2 3.87Å; F200-F487 AromaticContact CD1-CZ 2.96Å; F200-F487 HydrophobicContact CD1-CZ 2.96Å; F200-F487 HydrophobicContact CE1-CD2 4.5Å; F200-F487 AromaticContact CE1-CE1 3.78Å; F200-F487 HydrophobicContact CE1-CE1 3.78Å; F200-F487 AromaticContact CE1-CE2 3.42Å; F200-F487 HydrophobicContact CE1-CE2 3.42Å; F200-F487 VanDerWaalsContact CE1-CE2 3.42Å; F200-F487 AromaticContact CE1-CZ 3.01Å; F200-F487 HydrophobicContact CE1-CZ 3.01Å; F200-F487 HydrophobicContact CG-CE1 4.41Å; F200-F487 HydrophobicContact CG-CZ 4.13Å; F200-F487 HydrophobicContact CZ-CE2 4.49Å; F200-F487 HydrophobicContact CZ-CZ 4.24Å; L203-F487 HydrophobicContact CB-CD1 4.12Å; L203-F487 HydrophobicContact CB-CE1 3.93Å; L203-F487 HydrophobicContact CD1-CD1 3.74Å; L203-F487 HydrophobicContact CD1-CE1 3.37Å; L203-F487 HydrophobicContact CD1-CG 4.39Å; L203-F487 HydrophobicContact CD1-CZ 3.74Å; L203-F487 HydrophobicContact CG-CE1 4.25Å; F227-F487 HydrophobicContact CZ-CE2 4.12Å; L464-F487 HydrophobicContact CD2-CD2 3.55Å; L464-F487 HydrophobicContact CD2-CE2 3.66Å; F468-F487 HydrophobicContact CE2-CB 4.49Å; F468-F487 AromaticContact CE2-CD2 3.54Å; F468-F487 HydrophobicContact CE2-CD2 3.54Å; F468-F487 AromaticContact CE2-CE2 3.8Å; F468-F487 HydrophobicContact CE2-CE2 3.8Å; F468-F487 HydrophobicContact CE2-CG 4.21Å; F468-F487 HydrophobicContact CZ-CB 4.33Å; F468-F487 AromaticContact CZ-CD2 3.68Å; F468-F487 HydrophobicContact CZ-CD2 3.68Å; F468-F487 AromaticContact CZ-CE2 3.85Å; F468-F487 HydrophobicContact CZ-CE2 3.85Å; F468-F487 AromaticContact CZ-CG 3.99Å; F468-F487 HydrophobicContact CZ-CG 3.99Å; F468-F487 HydrophobicContact CZ-CZ 4.3Å; V483-F487 WeakPolarHBondContact O-CB 3.47Å; V483-F487 PolarHBondContact O-N 2.96Å; I484-F487 WeakPolarHBondContact O-CB 3.33Å; I484-F487 PolarHBondContact O-N 3.46Å; A485-F487 VanDerWaalsContact C-N 3.3Å; A485-F487 PolarHBondContact O-N 3.23Å; F487-V489 VanDerWaalsContact C-N 3.29Å; F487-V489 PolarHBondContact O-N 3.16Å; F487-Q490 PolarHBondContact O-N 2.55Å; F487-N491 HydrophobicContact CD2-CB 4.34Å; F487-N491 WeakPolarHBondContact O-CB 3.42Å; F487-N491 PolarHBondContact O-N 2.87Å; F487-N491 VanDerWaalsContact O-N 3.09Å; F487-N491 PolarHBondContact O-ND2 2.97Å; F487-N491 VanDerWaalsContact O-ND2 3.15Å
488	N	76.1	Confident	81.6	Confident	54 Å²	54	58.8 Å²	58.8	29%	0.289	31%	0.305	S	S	.	.	H	α-helix	trans	-61.5	-35	179.3	-74.7	-16.2	0	0	0	112.6	L203 I484 A485 W486	L203-N488 PolarHBondContact O-ND2 3.28Å; L203-N488 PolarHBondContact O-OD1 3.32Å; I484-N488 PolarHBondContact O-N 3.31Å; A485-N488 PolarHBondContact O-N 3.43Å; W486-N488 PolarHBondContact O-N 2.94Å
489	V	78.5	Confident	81.9	Confident	110 Å²	110	59.8 Å²	59.8	67%	0.667	30%	0.303	S	S	*	.	H	α-helix	trans	-76.9	-43.8	178.2	177.2	0	0	0	0	112.1	A485 W486 F487	A485-V489 WeakPolarHBondContact O-CG2 3.43Å; A485-V489 PolarHBondContact O-N 2.83Å; W486-V489 PolarHBondContact O-N 3.15Å; F487-V489 VanDerWaalsContact C-N 3.29Å; F487-V489 PolarHBondContact O-N 3.16Å
490	Q	79.1	Confident	82.2	Confident	124 Å²	124	61.5 Å²	61.5	58%	0.579	31%	0.309	S	S	*	.	H	α-helix	trans	-90.7	-20.1	-166.1	-63.5	-62.1	-41.3	0	0	114.4	W486 F487	W486-Q490 HydrophobicContact CG-CG 4.46Å; W486-Q490 HydrophobicContact CZ2-CB 4.45Å; W486-Q490 WeakPolarHBondContact O-CG 3.35Å; W486-Q490 PolarHBondContact O-N 3.41Å; F487-Q490 PolarHBondContact O-N 2.55Å
491	N	78.2	Confident	82.5	Confident	7 Å²	7	61.5 Å²	61.5	4%	0.037	31%	0.309	C	S	.	.	S	Bend	trans	-112.4	-0	-167	-62.8	-79.9	0	0	0	115	F200 F487 N493 R494 I495	F200-N491 HydrophobicContact CE1-CB 4.19Å; F487-N491 HydrophobicContact CD2-CB 4.34Å; F487-N491 WeakPolarHBondContact O-CB 3.42Å; F487-N491 PolarHBondContact O-N 2.87Å; F487-N491 VanDerWaalsContact O-N 3.09Å; F487-N491 PolarHBondContact O-ND2 2.97Å; F487-N491 VanDerWaalsContact O-ND2 3.15Å; N491-N493 VanDerWaalsContact C-N 3.27Å; N491-N493 PolarHBondContact O-N 3.27Å; N491-N493 VanDerWaalsContact O-N 3.13Å; N491-R494 WeakPolarHBondContact O-CA 3.4Å; N491-R494 WeakPolarHBondContact O-CB 3.37Å; N491-R494 PolarHBondContact O-N 3.4Å; N491-I495 WeakPolarHBondContact O-CG1 3.16Å; N491-I495 PolarHBondContact O-N 2.99Å
492	A	71.9	Confident	82.9	Confident	53 Å²	53	56.3 Å²	56.3	44%	0.438	29%	0.291	S	S	.	.	H	α-helix	trans	-49.8	-43.3	-177.7	0	0	0	0	0	113.7	R494 I495 Q496	A492-R494 PolarHBondContact O-N 2.96Å; A492-I495 WeakPolarHBondContact O-CB 3.43Å; A492-I495 PolarHBondContact O-N 3.44Å; A492-Q496 PolarHBondContact O-N 3.25Å
493	N	79.8	Confident	83.3	Confident	111 Å²	111	55.7 Å²	55.7	59%	0.594	29%	0.286	S	S	*	.	H	α-helix	trans	-64.8	-37.7	177.4	-70.8	-20.3	0	0	0	112.9	N491 I495 Q496 N497	N491-N493 VanDerWaalsContact C-N 3.27Å; N491-N493 PolarHBondContact O-N 3.27Å; N491-N493 VanDerWaalsContact O-N 3.13Å; N493-I495 PolarHBondContact O-N 3.39Å; N493-Q496 PolarHBondContact O-N 3.28Å; N493-N497 VanDerWaalsContact O-CB 3.3Å; N493-N497 WeakPolarHBondContact O-CB 3.33Å; N493-N497 VanDerWaalsContact O-CG 3.22Å; N493-N497 PolarHBondContact O-N 3.14Å; N493-N497 PolarHBondContact O-ND2 2.95Å
494	R	81.3	Confident	83.6	Confident	69 Å²	69	56.5 Å²	56.5	26%	0.26	29%	0.291	S	S	.	.	H	α-helix	trans	-63.8	-33.8	177.5	-64.5	-173.3	-178.9	-142.6	-0.6	111	Q457 F458 D460 N491 A492 N497 A498	Q457-R494 HydrophobicContact CB-CG 4.49Å; Q457-R494 PolarHBondContact O-NH1 3.12Å; F458-R494 HydrophobicContact CE1-CB 4.39Å; D460-R494 PolarHBondContact O-NH1 3.25Å; D460-R494 VanDerWaalsContact O-NH1 3.07Å; N491-R494 WeakPolarHBondContact O-CA 3.4Å; N491-R494 WeakPolarHBondContact O-CB 3.37Å; N491-R494 PolarHBondContact O-N 3.4Å; A492-R494 PolarHBondContact O-N 2.96Å; R494-N497 PolarHBondContact O-N 3.43Å; R494-A498 WeakPolarHBondContact O-CB 3.37Å; R494-A498 PolarHBondContact O-N 3.15Å
495	I	74.8	Confident	84.1	Confident	36 Å²	36	56.1 Å²	56.1	19%	0.185	29%	0.289	C	S	.	.	H	α-helix	trans	-62.8	-53.6	176.2	-46.9	178.6	0	0	0	110.6	F200 N491 A492 N493 N497 A498 R499	F200-I495 HydrophobicContact CB-CD1 3.81Å; F200-I495 HydrophobicContact CB-CG1 4Å; F200-I495 HydrophobicContact CB-CG2 4.05Å; F200-I495 HydrophobicContact CD1-CD1 3.73Å; F200-I495 HydrophobicContact CD1-CG1 3.55Å; F200-I495 HydrophobicContact CD2-CB 4.06Å; F200-I495 HydrophobicContact CD2-CD1 4.41Å; F200-I495 HydrophobicContact CD2-CG1 3.65Å; F200-I495 HydrophobicContact CD2-CG2 3.89Å; F200-I495 HydrophobicContact CE1-CD1 4.47Å; F200-I495 HydrophobicContact CE1-CG1 3.93Å; F200-I495 HydrophobicContact CE2-CB 4.43Å; F200-I495 HydrophobicContact CE2-CG1 3.97Å; F200-I495 HydrophobicContact CG-CB 4.3Å; F200-I495 HydrophobicContact CG-CD1 3.79Å; F200-I495 HydrophobicContact CG-CG1 3.5Å; F200-I495 HydrophobicContact CG-CG2 4.12Å; F200-I495 HydrophobicContact CZ-CG1 4.17Å; N491-I495 WeakPolarHBondContact O-CG1 3.16Å; N491-I495 PolarHBondContact O-N 2.99Å; A492-I495 WeakPolarHBondContact O-CB 3.43Å; A492-I495 PolarHBondContact O-N 3.44Å; N493-I495 PolarHBondContact O-N 3.39Å; I495-N497 VanDerWaalsContact C-N 3.26Å; I495-N497 PolarHBondContact O-N 2.96Å; I495-A498 PolarHBondContact O-N 2.96Å; I495-R499 PolarHBondContact O-N 2.99Å
496	Q	82.6	Confident	84.6	Confident	134 Å²	134	56.6 Å²	56.6	63%	0.626	28%	0.281	S	S	*	.	H	α-helix	trans	-61.4	-40.7	-179.3	-171.8	178.8	11.2	0	0	110.6	A492 N493 A498 R499 K500	A492-Q496 PolarHBondContact O-N 3.25Å; N493-Q496 PolarHBondContact O-N 3.28Å; Q496-A498 PolarHBondContact O-N 2.74Å; Q496-R499 PolarHBondContact O-N 2.66Å; Q496-K500 VanDerWaalsContact O-CB 3.27Å; Q496-K500 WeakPolarHBondContact O-CB 3.29Å; Q496-K500 PolarHBondContact O-N 2.58Å
497	N	87.2	Confident	85	Confident	26 Å²	26	59.5 Å²	59.5	14%	0.139	30%	0.296	C	S	.	.	H	α-helix	trans	-68.6	-31.2	178.2	-73.9	-22.6	0	0	0	113.4	Y454 Q457 F458 N493 R494 I495 K500 F501	Y454-N497 HydrophobicContact CG-CB 4.48Å; Q457-N497 VanDerWaalsContact CD-ND2 3.27Å; Q457-N497 PolarHBondContact NE2-ND2 3.02Å; Q457-N497 VanDerWaalsContact NE2-ND2 3.12Å; Q457-N497 PolarHBondContact OE1-ND2 3.36Å; F458-N497 HydrophobicContact CZ-CB 4.36Å; N493-N497 VanDerWaalsContact O-CB 3.3Å; N493-N497 WeakPolarHBondContact O-CB 3.33Å; N493-N497 VanDerWaalsContact O-CG 3.22Å; N493-N497 PolarHBondContact O-N 3.14Å; N493-N497 PolarHBondContact O-ND2 2.95Å; R494-N497 PolarHBondContact O-N 3.43Å; I495-N497 VanDerWaalsContact C-N 3.26Å; I495-N497 PolarHBondContact O-N 2.96Å; N497-K500 PolarHBondContact O-N 3.25Å; N497-F501 WeakPolarHBondContact O-CB 3.47Å; N497-F501 PolarHBondContact O-N 2.83Å
498	A	87.3	Confident	85.5	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.008	30%	0.295	C	S	.	.	H	α-helix	trans	-66.1	-49.6	175	0	0	0	0	0	110.9	L193 M196 F458 R494 I495 Q496 K500 F501 V502	L193-A498 HydrophobicContact CD2-CB 4.19Å; M196-A498 HydrophobicContact CE-CB 3.5Å; F458-A498 HydrophobicContact CE1-CB 4.26Å; F458-A498 HydrophobicContact CZ-CB 3.81Å; R494-A498 WeakPolarHBondContact O-CB 3.37Å; R494-A498 PolarHBondContact O-N 3.15Å; I495-A498 PolarHBondContact O-N 2.96Å; Q496-A498 PolarHBondContact O-N 2.74Å; A498-K500 VanDerWaalsContact C-N 3.31Å; A498-K500 PolarHBondContact O-N 3.02Å; A498-F501 WeakPolarHBondContact O-CB 3.36Å; A498-F501 PolarHBondContact O-N 2.72Å; A498-V502 WeakPolarHBondContact O-CG2 3.4Å; A498-V502 PolarHBondContact O-N 3.14Å
499	R	88.1	Confident	86.3	Confident	152 Å²	152	60.6 Å²	60.6	57%	0.574	30%	0.299	S	S	*	.	H	α-helix	trans	-60.9	-41.3	173.9	-77.5	-173.5	175.9	179.3	-1.4	111.9	H197 I495 Q496 F501 V502 S503	H197-R499 PolarHBondContact CE1-NE 2.95Å; H197-R499 PolarHBondContact CE1-NH2 2.64Å; H197-R499 PolarHBondContact NE2-NE 3.09Å; H197-R499 PolarHBondContact NE2-NH2 3.36Å; I495-R499 PolarHBondContact O-N 2.99Å; Q496-R499 PolarHBondContact O-N 2.66Å; R499-F501 VanDerWaalsContact C-N 3.35Å; R499-V502 PolarHBondContact O-N 3.49Å; R499-S503 WeakPolarHBondContact O-CB 3.36Å; R499-S503 PolarHBondContact O-N 2.81Å
500	K	90.1	Very high	86.8	Confident	100 Å²	100	60.4 Å²	60.4	44%	0.435	30%	0.298	S	S	.	.	H	α-helix	trans	-62.9	-41.7	176.9	-170.8	175.5	-178.7	-179.2	0	111.3	Y454 Q496 N497 A498 V502 S503 D504	Y454-K500 HydrophobicContact CD1-CD 4.44Å; Y454-K500 HydrophobicContact CE1-CD 4.2Å; Y454-K500 HydrophobicContact CE1-CG 4.31Å; Q496-K500 VanDerWaalsContact O-CB 3.27Å; Q496-K500 WeakPolarHBondContact O-CB 3.29Å; Q496-K500 PolarHBondContact O-N 2.58Å; N497-K500 PolarHBondContact O-N 3.25Å; A498-K500 VanDerWaalsContact C-N 3.31Å; A498-K500 PolarHBondContact O-N 3.02Å; K500-V502 PolarHBondContact O-N 3.27Å; K500-S503 PolarHBondContact O-N 3.19Å; K500-D504 VanDerWaalsContact O-CB 3.28Å; K500-D504 WeakPolarHBondContact O-CB 3.31Å; K500-D504 PolarHBondContact O-N 3Å
501	F	91.6	Very high	87.4	Confident	1 Å²	1	56.1 Å²	56.1	0%	0.004	28%	0.282	C	S	.	.	H	α-helix	trans	-58.9	-47.7	173.7	-175.5	-87.6	0	0	0	111.5	W186 M189 L193 F237 F452 Y454 I455 N497 A498 R499 F505	W186-F501 HydrophobicContact CZ3-CD1 4.39Å; W186-F501 AromaticContact CZ3-CE1 3.86Å; W186-F501 HydrophobicContact CZ3-CE1 3.86Å; M189-F501 HydrophobicContact CE-CE1 4.09Å; M189-F501 HydrophobicContact CE-CZ 4.48Å; M189-F501 HydrophobicContact CG-CE1 4.24Å; L193-F501 HydrophobicContact CD1-CB 4.48Å; L193-F501 HydrophobicContact CD1-CD1 3.35Å; L193-F501 HydrophobicContact CD1-CE1 3.9Å; L193-F501 HydrophobicContact CD1-CG 4.25Å; F237-F501 HydrophobicContact CB-CZ 4.06Å; F237-F501 HydrophobicContact CD1-CE1 4.42Å; F237-F501 AromaticContact CD1-CZ 3.86Å; F237-F501 HydrophobicContact CD1-CZ 3.86Å; F237-F501 AromaticContact CG-CZ 4Å; F237-F501 HydrophobicContact CG-CZ 4Å; F452-F501 HydrophobicContact CD1-CD2 4.18Å; F452-F501 HydrophobicContact CD1-CE2 4.12Å; Y454-F501 HydrophobicContact CD2-CB 3.85Å; Y454-F501 AromaticContact CD2-CD2 3.99Å; Y454-F501 HydrophobicContact CD2-CD2 3.99Å; Y454-F501 HydrophobicContact CD2-CG 4.41Å; Y454-F501 HydrophobicContact CE2-CB 3.39Å; Y454-F501 AromaticContact CE2-CD2 3.48Å; Y454-F501 HydrophobicContact CE2-CD2 3.48Å; Y454-F501 VanDerWaalsContact CE2-CD2 3.48Å; Y454-F501 AromaticContact CE2-CG 3.87Å; Y454-F501 HydrophobicContact CE2-CG 3.87Å; I455-F501 HydrophobicContact CB-CD2 4.15Å; I455-F501 HydrophobicContact CB-CE2 3.98Å; I455-F501 HydrophobicContact CD1-CD2 4.49Å; I455-F501 HydrophobicContact CD1-CE2 3.61Å; I455-F501 HydrophobicContact CD1-CZ 3.93Å; I455-F501 HydrophobicContact CG1-CD2 4.15Å; I455-F501 HydrophobicContact CG1-CE2 3.74Å; I455-F501 HydrophobicContact CG1-CZ 4.36Å; N497-F501 WeakPolarHBondContact O-CB 3.47Å; N497-F501 PolarHBondContact O-N 2.83Å; A498-F501 WeakPolarHBondContact O-CB 3.36Å; A498-F501 PolarHBondContact O-N 2.72Å; R499-F501 VanDerWaalsContact C-N 3.35Å; F501-F505 HydrophobicContact CZ-CD2 4.27Å; F501-F505 VanDerWaalsContact O-CB 3.25Å; F501-F505 WeakPolarHBondContact O-CB 3.26Å; F501-F505 PolarHBondContact O-N 2.97Å
502	V	91.9	Very high	88	Confident	13 Å²	13	56.4 Å²	56.4	8%	0.079	28%	0.283	C	S	.	.	H	α-helix	trans	-57.4	-54.1	177.1	176.4	0	0	0	0	110.9	W186 K190 L193 A498 R499 K500 D504 F505 E506	W186-V502 HydrophobicContact CH2-CG1 4.47Å; W186-V502 HydrophobicContact CZ2-CG1 4.41Å; K190-V502 HydrophobicContact CG-CG1 4.36Å; L193-V502 HydrophobicContact CB-CG2 3.91Å; L193-V502 HydrophobicContact CD1-CG2 3.72Å; A498-V502 WeakPolarHBondContact O-CG2 3.4Å; A498-V502 PolarHBondContact O-N 3.14Å; R499-V502 PolarHBondContact O-N 3.49Å; K500-V502 PolarHBondContact O-N 3.27Å; V502-D504 PolarHBondContact O-N 3.34Å; V502-F505 PolarHBondContact O-N 3.43Å; V502-E506 WeakPolarHBondContact O-CG 3.29Å; V502-E506 PolarHBondContact O-N 2.84Å; V502-E506 VanDerWaalsContact O-N 3.08Å
503	S	93.2	Very high	88.8	Confident	47 Å²	47	58.5 Å²	58.5	33%	0.329	29%	0.29	S	S	.	.	H	α-helix	trans	-61.2	-46.3	-178	-174.7	0	0	0	0	113.2	R499 K500 F505 E506 K507	R499-S503 WeakPolarHBondContact O-CB 3.36Å; R499-S503 PolarHBondContact O-N 2.81Å; K500-S503 PolarHBondContact O-N 3.19Å; S503-F505 VanDerWaalsContact C-N 3.34Å; S503-F505 PolarHBondContact O-N 3.31Å; S503-E506 PolarHBondContact O-N 2.71Å; S503-K507 WeakPolarHBondContact O-CG 3.36Å; S503-K507 PolarHBondContact O-N 2.93Å
504	D	93.7	Very high	89.3	Confident	21 Å²	21	60.3 Å²	60.3	11%	0.112	29%	0.293	C	S	.	.	H	α-helix	trans	-69.7	-33	-177.6	-73.7	-6.7	0	0	0	111.4	S450 F452 Y454 K500 V502 K507 L508	S450-D504 WeakPolarHBondContact CB-OD2 3.49Å; S450-D504 PolarHBondContact OG-OD2 2.9Å; F452-D504 HydrophobicContact CE1-CB 3.8Å; F452-D504 HydrophobicContact CZ-CB 4.07Å; Y454-D504 VanDerWaalsContact OH-CB 3.25Å; Y454-D504 WeakPolarHBondContact OH-CB 3.16Å; Y454-D504 PolarHBondContact OH-OD2 2.72Å; K500-D504 VanDerWaalsContact O-CB 3.28Å; K500-D504 WeakPolarHBondContact O-CB 3.31Å; K500-D504 PolarHBondContact O-N 3Å; V502-D504 PolarHBondContact O-N 3.34Å; D504-K507 PolarHBondContact O-N 3.44Å; D504-K507 IonicContact OD1-NZ 2.85Å; D504-L508 WeakPolarHBondContact O-CB 3.45Å; D504-L508 PolarHBondContact O-N 2.98Å
505	F	92.8	Very high	89.9	Confident	4 Å²	4	57.2 Å²	57.2	2%	0.018	28%	0.282	C	S	.	.	H	α-helix	trans	-73.3	-34.3	177.4	-160.3	-92	0	0	0	112.1	F178 H182 W186 F237 F452 F501 V502 S503 L508 Q509	F178-F505 HydrophobicContact CD2-CE2 4.12Å; F178-F505 AromaticContact CD2-CZ 3.99Å; F178-F505 HydrophobicContact CD2-CZ 3.99Å; F178-F505 HydrophobicContact CE2-CD1 4.23Å; F178-F505 HydrophobicContact CE2-CD2 4.19Å; F178-F505 AromaticContact CE2-CE1 3.76Å; F178-F505 HydrophobicContact CE2-CE1 3.76Å; F178-F505 AromaticContact CE2-CE2 3.66Å; F178-F505 HydrophobicContact CE2-CE2 3.66Å; F178-F505 HydrophobicContact CE2-CG 4.46Å; F178-F505 AromaticContact CE2-CZ 3.43Å; F178-F505 HydrophobicContact CE2-CZ 3.43Å; F178-F505 VanDerWaalsContact CE2-CZ 3.43Å; F178-F505 HydrophobicContact CZ-CD1 4.47Å; F178-F505 HydrophobicContact CZ-CE1 4.03Å; F178-F505 HydrophobicContact CZ-CZ 4.12Å; H182-F505 HydrophobicContact CB-CE1 4.34Å; H182-F505 AromaticContact CD2-CE1 3.64Å; W186-F505 HydrophobicContact CB-CE1 4.44Å; W186-F505 AromaticContact CD2-CD1 3.52Å; W186-F505 HydrophobicContact CD2-CD1 3.52Å; W186-F505 AromaticContact CD2-CE1 3.65Å; W186-F505 HydrophobicContact CD2-CE1 3.65Å; W186-F505 AromaticContact CE2-CD1 3.8Å; W186-F505 AromaticContact CE3-CD1 3.21Å; W186-F505 HydrophobicContact CE3-CD1 3.21Å; W186-F505 AromaticContact CE3-CE1 3.36Å; W186-F505 HydrophobicContact CE3-CE1 3.36Å; W186-F505 HydrophobicContact CE3-CG 4.01Å; W186-F505 HydrophobicContact CE3-CZ 4.3Å; W186-F505 HydrophobicContact CG-CD1 4.36Å; W186-F505 HydrophobicContact CG-CE1 4.12Å; W186-F505 HydrophobicContact CH2-CB 3.53Å; W186-F505 AromaticContact CH2-CD1 3.52Å; W186-F505 HydrophobicContact CH2-CD1 3.52Å; W186-F505 HydrophobicContact CH2-CE1 4.49Å; W186-F505 AromaticContact CH2-CG 3.8Å; W186-F505 HydrophobicContact CH2-CG 3.8Å; W186-F505 HydrophobicContact CZ2-CB 4.23Å; W186-F505 AromaticContact CZ2-CD1 3.84Å; W186-F505 HydrophobicContact CZ2-CD1 3.84Å; W186-F505 HydrophobicContact CZ2-CG 4.46Å; W186-F505 HydrophobicContact CZ3-CB 3.76Å; W186-F505 AromaticContact CZ3-CD1 3.2Å; W186-F505 HydrophobicContact CZ3-CD1 3.2Å; W186-F505 HydrophobicContact CZ3-CD2 4.42Å; W186-F505 AromaticContact CZ3-CE1 3.81Å; W186-F505 HydrophobicContact CZ3-CE1 3.81Å; W186-F505 AromaticContact CZ3-CG 3.55Å; W186-F505 HydrophobicContact CZ3-CG 3.55Å; F237-F505 HydrophobicContact CD1-CD2 4.34Å; F237-F505 HydrophobicContact CD1-CE1 4.45Å; F237-F505 AromaticContact CD1-CE2 3.63Å; F237-F505 HydrophobicContact CD1-CE2 3.63Å; F237-F505 AromaticContact CD1-CZ 3.69Å; F237-F505 HydrophobicContact CD1-CZ 3.69Å; F237-F505 AromaticContact CE1-CE1 3.92Å; F237-F505 HydrophobicContact CE1-CE1 3.92Å; F237-F505 AromaticContact CE1-CE2 3.94Å; F237-F505 HydrophobicContact CE1-CE2 3.94Å; F237-F505 AromaticContact CE1-CZ 3.53Å; F237-F505 HydrophobicContact CE1-CZ 3.53Å; F452-F505 HydrophobicContact CE1-CB 4.07Å; F452-F505 HydrophobicContact CE1-CD2 4.08Å; F501-F505 HydrophobicContact CZ-CD2 4.27Å; F501-F505 VanDerWaalsContact O-CB 3.25Å; F501-F505 WeakPolarHBondContact O-CB 3.26Å; F501-F505 PolarHBondContact O-N 2.97Å; V502-F505 PolarHBondContact O-N 3.43Å; S503-F505 VanDerWaalsContact C-N 3.34Å; S503-F505 PolarHBondContact O-N 3.31Å; F505-L508 WeakPolarHBondContact O-CB 3.35Å; F505-L508 PolarHBondContact O-N 3.09Å; F505-Q509 PolarHBondContact O-N 3.49Å
506	E	92.6	Very high	90.8	Very high	67 Å²	67	56.4 Å²	56.4	31%	0.313	28%	0.282	S	S	.	.	H	α-helix	trans	-68.1	-40	171.5	-69.2	179.5	150.2	0	0	112.2	W186 K190 V502 S503 L508 Q509 T510	W186-E506 HydrophobicContact CZ2-CG 3.77Å; K190-E506 WeakPolarHBondContact CE-OE1 3.01Å; K190-E506 IonicContact NZ-OE1 2.78Å; K190-E506 PolarHBondContact NZ-OE1 2.9Å; V502-E506 WeakPolarHBondContact O-CG 3.29Å; V502-E506 PolarHBondContact O-N 2.84Å; V502-E506 VanDerWaalsContact O-N 3.08Å; S503-E506 PolarHBondContact O-N 2.71Å; E506-L508 VanDerWaalsContact C-N 3.28Å; E506-L508 PolarHBondContact O-N 3.49Å; E506-Q509 WeakPolarHBondContact O-CB 3.5Å; E506-Q509 PolarHBondContact O-N 3.06Å; E506-T510 PolarHBondContact O-N 3.46Å; E506-T510 PolarHBondContact O-OG1 3.01Å
507	K	92.4	Very high	91.3	Very high	117 Å²	117	54.5 Å²	54.5	51%	0.509	28%	0.276	S	S	.	.	H	α-helix	trans	-61.7	-40.8	170.9	-72	172.2	-168.2	162.5	0	111.1	S503 D504 T510 S511	S503-K507 WeakPolarHBondContact O-CG 3.36Å; S503-K507 PolarHBondContact O-N 2.93Å; D504-K507 PolarHBondContact O-N 3.44Å; D504-K507 IonicContact OD1-NZ 2.85Å; K507-T510 PolarHBondContact O-N 3.03Å; K507-S511 WeakPolarHBondContact O-CB 3.47Å; K507-S511 PolarHBondContact O-N 3.42Å; K507-S511 PolarHBondContact O-OG 3.05Å
508	L	92.8	Very high	91.7	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-61.8	-46.3	176.4	179	62.2	0	0	0	110.6	F174 F178 Q449 F452 D504 F505 E506 T510 S511 M512	F174-L508 HydrophobicContact CE2-CD2 4.5Å; F174-L508 HydrophobicContact CZ-CD1 3.87Å; F174-L508 HydrophobicContact CZ-CD2 4.28Å; F178-L508 HydrophobicContact CD2-CD2 3.5Å; F178-L508 VanDerWaalsContact CD2-CD2 3.5Å; F178-L508 HydrophobicContact CD2-CG 3.91Å; F178-L508 HydrophobicContact CE2-CB 4.2Å; F178-L508 HydrophobicContact CE2-CD2 3.38Å; F178-L508 HydrophobicContact CE2-CG 3.53Å; F178-L508 HydrophobicContact CZ-CD2 4.42Å; F178-L508 HydrophobicContact CZ-CG 4.13Å; Q449-L508 HydrophobicContact CB-CD1 4.38Å; Q449-L508 HydrophobicContact CG-CD1 3.87Å; F452-L508 HydrophobicContact CE2-CD2 3.76Å; F452-L508 HydrophobicContact CZ-CB 4Å; F452-L508 HydrophobicContact CZ-CD2 3.7Å; F452-L508 HydrophobicContact CZ-CG 4.43Å; D504-L508 WeakPolarHBondContact O-CB 3.45Å; D504-L508 PolarHBondContact O-N 2.98Å; F505-L508 WeakPolarHBondContact O-CB 3.35Å; F505-L508 PolarHBondContact O-N 3.09Å; E506-L508 VanDerWaalsContact C-N 3.28Å; E506-L508 PolarHBondContact O-N 3.49Å; L508-T510 VanDerWaalsContact C-N 3.3Å; L508-T510 PolarHBondContact O-N 2.79Å; L508-S511 CarbonylContact O-C 3.5Å; L508-S511 WeakPolarHBondContact O-CA 3.38Å; L508-S511 WeakPolarHBondContact O-CB 3.27Å; L508-S511 PolarHBondContact O-N 3.35Å; L508-M512 HydrophobicContact CD1-CE 3.24Å; L508-M512 HydrophobicContact CD1-CG 4.49Å; L508-M512 HydrophobicContact CD1-SD 4.02Å; L508-M512 HydrophobicContact CG-CE 4.15Å; L508-M512 HydrophobicContact CG-CG 4.47Å; L508-M512 WeakPolarHBondContact O-CG 3.44Å; L508-M512 PolarHBondContact O-N 2.83Å
509	Q	91.9	Very high	92	Very high	80 Å²	80	56.2 Å²	56.2	37%	0.374	29%	0.285	S	S	.	.	H	α-helix	trans	-53.2	-47.4	174.2	-177.3	-172.2	-9.2	0	0	111.9	F178 H182 F505 E506 S511 M512	F178-Q509 HydrophobicContact CE1-CB 4.32Å; F178-Q509 HydrophobicContact CZ-CB 3.9Å; H182-Q509 PolarHBondContact CE1-NE2 3.14Å; H182-Q509 VanDerWaalsContact CE1-NE2 3.31Å; H182-Q509 PolarHBondContact NE2-NE2 3.08Å; H182-Q509 PolarHBondContact NE2-OE1 3Å; F505-Q509 PolarHBondContact O-N 3.49Å; E506-Q509 WeakPolarHBondContact O-CB 3.5Å; E506-Q509 PolarHBondContact O-N 3.06Å; Q509-S511 PolarHBondContact O-N 2.76Å; Q509-M512 PolarHBondContact O-N 3.44Å
510	T	89.5	Confident	92.3	Very high	105 Å²	105	55.1 Å²	55.1	64%	0.644	29%	0.285	S	S	*	.	H	α-helix	trans	-63.3	-33.6	178.9	-53.7	0	0	0	0	111.9	E506 K507 L508	E506-T510 PolarHBondContact O-N 3.46Å; E506-T510 PolarHBondContact O-OG1 3.01Å; K507-T510 PolarHBondContact O-N 3.03Å; L508-T510 VanDerWaalsContact C-N 3.3Å; L508-T510 PolarHBondContact O-N 2.79Å
511	S	91.2	Very high	92.4	Very high	34 Å²	34	53.7 Å²	53.7	24%	0.238	28%	0.281	C	S	.	.	H	α-helix	trans	-76.8	-24.3	178.5	-52.3	0	0	0	0	112.8	K507 L508 Q509 T513 K514 L515	K507-S511 WeakPolarHBondContact O-CB 3.47Å; K507-S511 PolarHBondContact O-N 3.42Å; K507-S511 PolarHBondContact O-OG 3.05Å; L508-S511 CarbonylContact O-C 3.5Å; L508-S511 WeakPolarHBondContact O-CA 3.38Å; L508-S511 WeakPolarHBondContact O-CB 3.27Å; L508-S511 PolarHBondContact O-N 3.35Å; Q509-S511 PolarHBondContact O-N 2.76Å; S511-T513 PolarHBondContact O-N 2.97Å; S511-K514 PolarHBondContact O-N 3.36Å; S511-L515 PolarHBondContact O-N 3.28Å
512	M	91.6	Very high	92.5	Very high	13 Å²	13	53.6 Å²	53.6	6%	0.064	28%	0.281	C	S	.	.	H	α-helix	trans	-67.1	-34.3	-174	-76.9	-45.3	81.7	0	0	114.6	F174 F178 L508 Q509 K514 L515 G516	F174-M512 HydrophobicContact CE1-CE 4.14Å; F174-M512 HydrophobicContact CE1-SD 3.84Å; F174-M512 HydrophobicContact CZ-CE 4.27Å; F174-M512 HydrophobicContact CZ-SD 3.9Å; F178-M512 HydrophobicContact CD1-CB 4.24Å; F178-M512 HydrophobicContact CD1-CG 3.36Å; F178-M512 HydrophobicContact CD1-SD 4.33Å; F178-M512 HydrophobicContact CD2-CG 4.42Å; F178-M512 HydrophobicContact CE1-CB 4.18Å; F178-M512 HydrophobicContact CE1-CG 3.47Å; F178-M512 VanDerWaalsContact CE1-CG 3.47Å; F178-M512 HydrophobicContact CG-CG 3.86Å; F178-M512 HydrophobicContact CG-SD 4.31Å; F178-M512 HydrophobicContact CZ-CG 4.08Å; L508-M512 HydrophobicContact CD1-CE 3.24Å; L508-M512 HydrophobicContact CD1-CG 4.49Å; L508-M512 HydrophobicContact CD1-SD 4.02Å; L508-M512 HydrophobicContact CG-CE 4.15Å; L508-M512 HydrophobicContact CG-CG 4.47Å; L508-M512 WeakPolarHBondContact O-CG 3.44Å; L508-M512 PolarHBondContact O-N 2.83Å; Q509-M512 PolarHBondContact O-N 3.44Å; M512-K514 VanDerWaalsContact C-N 3.35Å; M512-K514 PolarHBondContact O-N 2.96Å; M512-L515 HydrophobicContact CE-CB 4.04Å; M512-L515 HydrophobicContact CE-CD1 3.19Å; M512-L515 HydrophobicContact CE-CG 4.12Å; M512-L515 PolarHBondContact O-N 3.44Å; M512-L515 HydrophobicContact SD-CD1 4.49Å; M512-G516 PolarHBondContact O-N 3.19Å
513	T	88.4	Confident	92.5	Very high	97 Å²	97	54.8 Å²	54.8	60%	0.595	30%	0.295	S	S	*	.	H	α-helix	trans	-60.2	-49	174	-49.9	0	0	0	0	110.3	S511 L515 G516 D517	S511-T513 PolarHBondContact O-N 2.97Å; T513-L515 PolarHBondContact O-N 2.95Å; T513-G516 PolarHBondContact O-N 2.81Å; T513-D517 VanDerWaalsContact O-CG 3.29Å; T513-D517 PolarHBondContact O-N 3.42Å
514	K	90.6	Very high	92.3	Very high	149 Å²	149	58.3 Å²	58.3	65%	0.648	31%	0.306	S	S	*	.	H	α-helix	trans	-64.2	-42	179.3	-63.9	-177.5	-179.7	-179.3	0	112.4	S511 M512 G516 D517 L518	S511-K514 PolarHBondContact O-N 3.36Å; M512-K514 VanDerWaalsContact C-N 3.35Å; M512-K514 PolarHBondContact O-N 2.96Å; K514-G516 VanDerWaalsContact C-N 3.35Å; K514-D517 PolarHBondContact O-N 3.17Å; K514-L518 WeakPolarHBondContact O-CB 3.44Å; K514-L518 WeakPolarHBondContact O-CG 3.14Å; K514-L518 PolarHBondContact O-N 2.97Å
515	L	93.8	Very high	91.9	Very high	4 Å²	4	58.2 Å²	58.2	2%	0.021	31%	0.307	C	S	.	.	H	α-helix	trans	-67.1	-36.6	177.5	-84.1	172.4	0	0	0	111.9	L442 L446 Q449 S511 M512 T513 L519	L442-L515 HydrophobicContact CD1-CD2 3.76Å; L446-L515 HydrophobicContact CD2-CD1 4.27Å; L446-L515 HydrophobicContact CD2-CD2 4.49Å; L446-L515 HydrophobicContact CG-CD2 4.19Å; Q449-L515 HydrophobicContact CG-CD1 4.48Å; S511-L515 PolarHBondContact O-N 3.28Å; M512-L515 HydrophobicContact CE-CB 4.04Å; M512-L515 HydrophobicContact CE-CD1 3.19Å; M512-L515 HydrophobicContact CE-CG 4.12Å; M512-L515 PolarHBondContact O-N 3.44Å; M512-L515 HydrophobicContact SD-CD1 4.49Å; T513-L515 PolarHBondContact O-N 2.95Å; L515-L519 WeakPolarHBondContact O-CB 3.47Å; L515-L519 PolarHBondContact O-N 2.94Å
516	G	93.9	Very high	91.7	Very high	19 Å²	19	58.8 Å²	58.8	20%	0.196	31%	0.31	C	S	.	.	H	α-helix	trans	-64.7	-44.6	173.2	0	0	0	0	0	112.8	M512 T513 K514 L519 K520	M512-G516 PolarHBondContact O-N 3.19Å; T513-G516 PolarHBondContact O-N 2.81Å; K514-G516 VanDerWaalsContact C-N 3.35Å; G516-L519 PolarHBondContact O-N 2.96Å; G516-K520 PolarHBondContact O-N 3.36Å
517	D	93.6	Very high	91.3	Very high	94 Å²	94	59 Å²	59	50%	0.503	32%	0.319	S	S	.	.	H	α-helix	trans	-63.3	-46.4	176.7	-67.3	-25.9	0	0	0	111.4	T513 K514 L519 K520 I521	T513-D517 VanDerWaalsContact O-CG 3.29Å; T513-D517 PolarHBondContact O-N 3.42Å; K514-D517 PolarHBondContact O-N 3.17Å; D517-L519 PolarHBondContact O-N 2.75Å; D517-K520 PolarHBondContact O-N 2.97Å; D517-I521 WeakPolarHBondContact O-CG1 3.49Å; D517-I521 PolarHBondContact O-N 2.96Å
518	L	94.2	Very high	91	Very high	34 Å²	34	57.4 Å²	57.4	18%	0.178	31%	0.312	C	S	.	.	H	α-helix	trans	-61.6	-42.8	175.6	-76.8	170.1	0	0	0	111.8	F441 L442 K514 K520 I521 V522	F441-L518 HydrophobicContact CB-CD1 4.15Å; F441-L518 HydrophobicContact CB-CD2 4.22Å; L442-L518 HydrophobicContact CD1-CB 3.97Å; K514-L518 WeakPolarHBondContact O-CB 3.44Å; K514-L518 WeakPolarHBondContact O-CG 3.14Å; K514-L518 PolarHBondContact O-N 2.97Å; L518-K520 VanDerWaalsContact C-N 3.3Å; L518-K520 PolarHBondContact O-N 3.39Å; L518-I521 PolarHBondContact O-N 2.88Å; L518-V522 WeakPolarHBondContact O-CB 3.35Å; L518-V522 VanDerWaalsContact O-CG2 3.3Å; L518-V522 WeakPolarHBondContact O-CG2 3.36Å; L518-V522 PolarHBondContact O-N 3.36Å
519	L	95.2	Very high	90.6	Very high	30 Å²	30	57.5 Å²	57.5	16%	0.157	31%	0.312	C	S	.	.	H	α-helix	trans	-60	-41.9	176.7	174.9	65.9	0	0	0	111.3	L168 V171 G172 V175 L442 L515 G516 D517 G523	L168-L519 HydrophobicContact CD1-CD1 3.62Å; L168-L519 HydrophobicContact CG-CD1 4.02Å; V171-L519 HydrophobicContact CB-CD1 4.33Å; V171-L519 HydrophobicContact CG1-CD1 4.08Å; G172-L519 VanDerWaalsContact CA-CD2 3.44Å; V175-L519 HydrophobicContact CB-CD2 4.48Å; V175-L519 HydrophobicContact CG2-CD2 4.24Å; L442-L519 HydrophobicContact CD1-CB 4.36Å; L515-L519 WeakPolarHBondContact O-CB 3.47Å; L515-L519 PolarHBondContact O-N 2.94Å; G516-L519 PolarHBondContact O-N 2.96Å; D517-L519 PolarHBondContact O-N 2.75Å; L519-G523 PolarHBondContact O-N 3.36Å
520	K	93.8	Very high	90.2	Very high	129 Å²	129	56.8 Å²	56.8	56%	0.561	31%	0.309	S	S	*	.	H	α-helix	trans	-62.7	-49.1	176.6	-177	179.7	174.2	-176.1	0	111.2	G516 D517 L518 G523 E524	G516-K520 PolarHBondContact O-N 3.36Å; D517-K520 PolarHBondContact O-N 2.97Å; L518-K520 VanDerWaalsContact C-N 3.3Å; L518-K520 PolarHBondContact O-N 3.39Å; K520-G523 PolarHBondContact O-N 2.93Å; K520-E524 WeakPolarHBondContact CE-OE1 3.36Å; K520-E524 HydrophobicContact CG-CG 4.46Å; K520-E524 WeakPolarHBondContact CG-OE1 3.42Å; K520-E524 IonicContact NZ-OE1 3.99Å; K520-E524 WeakPolarHBondContact O-CB 3.23Å; K520-E524 WeakPolarHBondContact O-CG 3.4Å; K520-E524 PolarHBondContact O-N 3.42Å
521	I	92.8	Very high	90	Very high	69 Å²	69	53.4 Å²	53.4	35%	0.354	30%	0.295	S	S	.	.	H	α-helix	trans	-59.6	-51	178.8	-66.2	164.4	0	0	0	110.6	N438 D517 L518 G523 E524 S525	N438-I521 HydrophobicContact CB-CG2 4.41Å; N438-I521 WeakPolarHBondContact ND2-CG2 3.04Å; D517-I521 WeakPolarHBondContact O-CG1 3.49Å; D517-I521 PolarHBondContact O-N 2.96Å; L518-I521 PolarHBondContact O-N 2.88Å; I521-G523 VanDerWaalsContact C-N 3.33Å; I521-G523 PolarHBondContact O-N 3.45Å; I521-E524 PolarHBondContact O-N 3.35Å; I521-S525 VanDerWaalsContact O-CB 3.32Å; I521-S525 WeakPolarHBondContact O-CB 3.37Å; I521-S525 PolarHBondContact O-N 3.29Å; I521-S525 PolarHBondContact O-OG 2.69Å; I521-S525 VanDerWaalsContact O-OG 3.1Å
522	V	93	Very high	89.7	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-62.3	-42.3	179.5	172.8	0	0	0	0	110.6	Y164 L168 N438 M439 L442 L518 S525 F526	Y164-V522 HydrophobicContact CE1-CG1 4.33Å; L168-V522 HydrophobicContact CD1-CG1 3.81Å; L168-V522 HydrophobicContact CD2-CG1 4.02Å; N438-V522 HydrophobicContact CB-CG2 3.86Å; M439-V522 HydrophobicContact CE-CG1 4.11Å; M439-V522 HydrophobicContact CG-CG1 3.83Å; M439-V522 HydrophobicContact CG-CG2 4.18Å; L442-V522 HydrophobicContact CD2-CB 4.45Å; L442-V522 HydrophobicContact CD2-CG1 4.41Å; L442-V522 HydrophobicContact CD2-CG2 4.38Å; L518-V522 WeakPolarHBondContact O-CB 3.35Å; L518-V522 VanDerWaalsContact O-CG2 3.3Å; L518-V522 WeakPolarHBondContact O-CG2 3.36Å; L518-V522 PolarHBondContact O-N 3.36Å; V522-S525 PolarHBondContact O-N 3.12Å; V522-F526 WeakPolarHBondContact O-CA 3.08Å; V522-F526 VanDerWaalsContact O-CB 3.27Å; V522-F526 WeakPolarHBondContact O-CB 3.4Å; V522-F526 PolarHBondContact O-N 2.89Å
523	G	90.9	Very high	89.3	Confident	37 Å²	37	52.4 Å²	52.4	38%	0.381	29%	0.286	S	S	.	.	H	α-helix	trans	-63.7	-45.4	178.9	0	0	0	0	0	113.5	L519 K520 I521 S525 F526	L519-G523 PolarHBondContact O-N 3.36Å; K520-G523 PolarHBondContact O-N 2.93Å; I521-G523 VanDerWaalsContact C-N 3.33Å; I521-G523 PolarHBondContact O-N 3.45Å; G523-S525 VanDerWaalsContact C-N 3.33Å; G523-S525 PolarHBondContact O-N 3.41Å; G523-F526 PolarHBondContact O-N 3.02Å
524	E	89.1	Confident	89.1	Confident	122 Å²	122	54.6 Å²	54.6	57%	0.57	29%	0.288	S	S	*	.	H	α-helix	trans	-64	-40	176.5	-73.2	173.3	-180	0	0	111.4	K520 I521 S527	K520-E524 WeakPolarHBondContact CE-OE1 3.36Å; K520-E524 HydrophobicContact CG-CG 4.46Å; K520-E524 WeakPolarHBondContact CG-OE1 3.42Å; K520-E524 IonicContact NZ-OE1 3.99Å; K520-E524 WeakPolarHBondContact O-CB 3.23Å; K520-E524 WeakPolarHBondContact O-CG 3.4Å; K520-E524 PolarHBondContact O-N 3.42Å; I521-E524 PolarHBondContact O-N 3.35Å; E524-S527 PolarHBondContact O-OG 3.34Å
525	S	87	Confident	88.8	Confident	19 Å²	19	48.8 Å²	48.8	13%	0.133	26%	0.263	C	S	.	.	H	α-helix	trans	-82.3	-18	-179.1	-61.5	0	0	0	0	114.8	I521 V522 G523 S527 K528	I521-S525 VanDerWaalsContact O-CB 3.32Å; I521-S525 WeakPolarHBondContact O-CB 3.37Å; I521-S525 PolarHBondContact O-N 3.29Å; I521-S525 PolarHBondContact O-OG 2.69Å; I521-S525 VanDerWaalsContact O-OG 3.1Å; V522-S525 PolarHBondContact O-N 3.12Å; G523-S525 VanDerWaalsContact C-N 3.33Å; G523-S525 PolarHBondContact O-N 3.41Å; S525-S527 VanDerWaalsContact C-N 3.25Å; S525-S527 PolarHBondContact O-N 3.38Å; S525-K528 VanDerWaalsContact O-CB 3.28Å; S525-K528 WeakPolarHBondContact O-CB 3.05Å; S525-K528 PolarHBondContact O-N 3.17Å
526	F	87	Confident	88.2	Confident	15 Å²	15	48.7 Å²	48.7	7%	0.066	26%	0.262	C	S	.	.	H	α-helix	trans	-59.2	-38.5	-174.9	-172.7	-116.8	0	0	0	112.4	S161 Y164 L168 F257 M439 V522 G523 K528 I529 E530	S161-F526 WeakPolarHBondContact O-CZ 3.49Å; Y164-F526 AromaticContact CD1-CD2 3.92Å; Y164-F526 HydrophobicContact CD1-CD2 3.92Å; Y164-F526 AromaticContact CD1-CE2 3.36Å; Y164-F526 HydrophobicContact CD1-CE2 3.36Å; Y164-F526 AromaticContact CD1-CZ 3.88Å; Y164-F526 HydrophobicContact CD1-CZ 3.88Å; Y164-F526 HydrophobicContact CE1-CD2 4.1Å; Y164-F526 AromaticContact CE1-CE2 3.99Å; Y164-F526 HydrophobicContact CE1-CE2 3.99Å; Y164-F526 HydrophobicContact CG-CE2 4.23Å; L168-F526 HydrophobicContact CD2-CB 4.47Å; L168-F526 HydrophobicContact CD2-CG 4.46Å; F257-F526 HydrophobicContact CE1-CE2 4.46Å; F257-F526 HydrophobicContact CE2-CE2 4.04Å; F257-F526 AromaticContact CZ-CE2 3.64Å; F257-F526 HydrophobicContact CZ-CE2 3.64Å; F257-F526 HydrophobicContact CZ-CZ 4.19Å; M439-F526 HydrophobicContact CE-CD2 3.58Å; M439-F526 HydrophobicContact CE-CE2 4.06Å; V522-F526 WeakPolarHBondContact O-CA 3.08Å; V522-F526 VanDerWaalsContact O-CB 3.27Å; V522-F526 WeakPolarHBondContact O-CB 3.4Å; V522-F526 PolarHBondContact O-N 2.89Å; G523-F526 PolarHBondContact O-N 3.02Å; F526-K528 PolarHBondContact O-N 3.46Å; F526-K528 VanDerWaalsContact O-N 3.14Å; F526-I529 WeakPolarHBondContact O-CB 2.99Å; F526-I529 PolarHBondContact O-N 3.2Å; F526-E530 HydrophobicContact CD1-CG 4.32Å; F526-E530 HydrophobicContact CE1-CG 3.98Å; F526-E530 WeakPolarHBondContact CE1-OE1 3.41Å; F526-E530 HydrophobicContact CZ-CG 4.31Å; F526-E530 PolarHBondContact O-N 3.32Å
527	S	85.3	Confident	87.7	Confident	72 Å²	72	49.8 Å²	49.8	50%	0.503	27%	0.265	S	S	.	.	H	α-helix	trans	-57.3	-27.5	175.2	63.8	0	0	0	0	113.7	E524 S525 G531	E524-S527 PolarHBondContact O-OG 3.34Å; S525-S527 VanDerWaalsContact C-N 3.25Å; S525-S527 PolarHBondContact O-N 3.38Å; S527-G531 PolarHBondContact O-N 3.38Å
528	K	85.6	Confident	87.2	Confident	83 Å²	83	48.4 Å²	48.4	36%	0.361	26%	0.258	S	S	.	.	H	α-helix	trans	-72.2	-36	176.7	-56.4	-172.5	-178.5	-173.4	0	111.9	E431 I435 S525 F526 G531 Y532	E431-K528 VanDerWaalsContact CD-NZ 3.27Å; E431-K528 IonicContact OE1-NZ 2.9Å; E431-K528 PolarHBondContact OE1-NZ 2.98Å; E431-K528 WeakPolarHBondContact OE2-CD 3.44Å; E431-K528 WeakPolarHBondContact OE2-CE 3.32Å; E431-K528 IonicContact OE2-NZ 3.18Å; E431-K528 PolarHBondContact OE2-NZ 3.38Å; I435-K528 HydrophobicContact CD1-CB 4.19Å; I435-K528 HydrophobicContact CD1-CD 4.41Å; S525-K528 VanDerWaalsContact O-CB 3.28Å; S525-K528 WeakPolarHBondContact O-CB 3.05Å; S525-K528 PolarHBondContact O-N 3.17Å; F526-K528 PolarHBondContact O-N 3.46Å; F526-K528 VanDerWaalsContact O-N 3.14Å; K528-G531 PolarHBondContact O-N 3.46Å; K528-Y532 PolarHBondContact O-N 3.16Å
529	I	85.1	Confident	86.6	Confident	3 Å²	3	51.6 Å²	51.6	2%	0.015	28%	0.281	C	S	.	.	H	α-helix	trans	-65.1	-46.5	173	-73.1	166.6	0	0	0	110.1	F257 L260 L432 I435 M439 F526 G531 Y532 Q533	F257-I529 HydrophobicContact CD1-CG2 3.58Å; F257-I529 HydrophobicContact CD2-CD1 4.45Å; F257-I529 HydrophobicContact CE1-CG2 3.77Å; F257-I529 HydrophobicContact CG-CG2 4.1Å; F257-I529 HydrophobicContact CZ-CG2 4.43Å; L260-I529 HydrophobicContact CD1-CG2 3.87Å; L432-I529 HydrophobicContact CD2-CB 4.4Å; L432-I529 HydrophobicContact CD2-CD1 4.38Å; L432-I529 HydrophobicContact CD2-CG1 3.39Å; I435-I529 HydrophobicContact CB-CD1 4.39Å; I435-I529 HydrophobicContact CG2-CD1 3.52Å; I435-I529 HydrophobicContact CG2-CG1 4.28Å; M439-I529 HydrophobicContact CE-CD1 3.25Å; M439-I529 HydrophobicContact SD-CD1 3.92Å; F526-I529 WeakPolarHBondContact O-CB 2.99Å; F526-I529 PolarHBondContact O-N 3.2Å; I529-G531 VanDerWaalsContact C-N 3.31Å; I529-G531 PolarHBondContact O-N 3.11Å; I529-Y532 PolarHBondContact O-N 3.44Å; I529-Q533 PolarHBondContact O-N 2.94Å
530	E	83.6	Confident	85.9	Confident	64 Å²	64	57.5 Å²	57.5	30%	0.299	31%	0.305	S	S	.	.	H	α-helix	trans	-63	-39.5	177.3	-64	-177.9	140.5	0	0	111.8	F526 Q533 K534	F526-E530 HydrophobicContact CD1-CG 4.32Å; F526-E530 HydrophobicContact CE1-CG 3.98Å; F526-E530 WeakPolarHBondContact CE1-OE1 3.41Å; F526-E530 HydrophobicContact CZ-CG 4.31Å; F526-E530 PolarHBondContact O-N 3.32Å; E530-Q533 PolarHBondContact O-N 3.26Å; E530-K534 WeakPolarHBondContact O-CG 3.4Å; E530-K534 PolarHBondContact O-N 3.3Å
531	G	84.2	Confident	85.3	Confident	34 Å²	34	52 Å²	52	35%	0.351	28%	0.281	S	S	.	.	H	α-helix	trans	-60.1	-46.2	174	0	0	0	0	0	111.9	S527 K528 I529 K534 M535	S527-G531 PolarHBondContact O-N 3.38Å; K528-G531 PolarHBondContact O-N 3.46Å; I529-G531 VanDerWaalsContact C-N 3.31Å; I529-G531 PolarHBondContact O-N 3.11Å; G531-K534 PolarHBondContact O-N 3.29Å; G531-M535 PolarHBondContact O-N 3.21Å
532	Y	84.2	Confident	84.7	Confident	3 Å²	3	50.1 Å²	50.1	1%	0.012	27%	0.272	C	S	.	.	H	α-helix	trans	-63.8	-45	177.3	-170.8	-115.1	0	0	0	112.7	L260 E263 S264 L429 L432 K528 I529 K534 M535 I536	L260-Y532 HydrophobicContact CB-CD1 4.2Å; L260-Y532 HydrophobicContact CB-CE1 4.44Å; L260-Y532 WeakPolarHBondContact O-CE1 3.43Å; E263-Y532 WeakPolarHBondContact OE2-CE1 3.44Å; E263-Y532 PolarHBondContact OE2-OH 3.21Å; S264-Y532 WeakPolarHBondContact CA-OH 3.33Å; S264-Y532 WeakPolarHBondContact CB-OH 3.4Å; S264-Y532 PolarHBondContact N-OH 3.18Å; L429-Y532 HydrophobicContact CD1-CD1 4.28Å; L429-Y532 HydrophobicContact CD1-CD2 2.98Å; L429-Y532 HydrophobicContact CD1-CE2 3.56Å; L429-Y532 HydrophobicContact CD1-CG 3.34Å; L429-Y532 HydrophobicContact CG-CD2 4.29Å; L432-Y532 HydrophobicContact CD1-CD1 3.82Å; L432-Y532 HydrophobicContact CD1-CE1 4.16Å; L432-Y532 HydrophobicContact CD1-CG 4.05Å; K528-Y532 PolarHBondContact O-N 3.16Å; I529-Y532 PolarHBondContact O-N 3.44Å; Y532-K534 VanDerWaalsContact C-N 3.28Å; Y532-K534 PolarHBondContact O-N 2.97Å; Y532-M535 HydrophobicContact CD2-CE 3.69Å; Y532-M535 HydrophobicContact CD2-SD 4.42Å; Y532-M535 HydrophobicContact CE2-CE 3.32Å; Y532-M535 HydrophobicContact CE2-SD 4.41Å; Y532-M535 WeakPolarHBondContact O-CB 3.18Å; Y532-M535 PolarHBondContact O-N 3Å; Y532-M535 VanDerWaalsContact O-N 3.09Å; Y532-I536 HydrophobicContact CD1-CG2 4.21Å; Y532-I536 HydrophobicContact CD2-CG2 4.38Å; Y532-I536 HydrophobicContact CE1-CD1 4.38Å; Y532-I536 HydrophobicContact CE1-CG2 3.72Å; Y532-I536 HydrophobicContact CE2-CG2 4.02Å; Y532-I536 PolarHBondContact O-N 3.23Å
533	Q	84.6	Confident	84.3	Confident	24 Å²	24	53.1 Å²	53.1	11%	0.112	29%	0.293	C	S	.	.	H	α-helix	trans	-55	-47.9	175.8	-175.5	-178.2	0.5	0	0	110.4	V159 S161 L260 I529 E530 M535 I536 T537	V159-Q533 PolarHBondContact O-NE2 3.16Å; V159-Q533 PolarHBondContact O-OE1 3.1Å; S161-Q533 PolarHBondContact OG-OE1 3.41Å; S161-Q533 VanDerWaalsContact OG-OE1 3.07Å; L260-Q533 HydrophobicContact CD1-CB 4.29Å; I529-Q533 PolarHBondContact O-N 2.94Å; E530-Q533 PolarHBondContact O-N 3.26Å; Q533-M535 VanDerWaalsContact C-N 3.33Å; Q533-M535 PolarHBondContact O-N 3.09Å; Q533-I536 WeakPolarHBondContact O-CG1 3.29Å; Q533-I536 PolarHBondContact O-N 3.33Å; Q533-T537 HydrophobicContact CG-CG2 4.48Å; Q533-T537 WeakPolarHBondContact O-CB 3.42Å; Q533-T537 VanDerWaalsContact O-CG2 3.31Å; Q533-T537 WeakPolarHBondContact O-CG2 3.24Å; Q533-T537 PolarHBondContact O-N 2.75Å; Q533-T537 PolarHBondContact O-OG1 3.48Å
534	K	84.4	Confident	84.1	Confident	143 Å²	143	52 Å²	52	62%	0.622	28%	0.278	S	S	*	.	H	α-helix	trans	-59	-43.4	176.5	-73.2	170.3	-174.8	169.2	0	112.1	E530 G531 Y532 T537 D538	E530-K534 WeakPolarHBondContact O-CG 3.4Å; E530-K534 PolarHBondContact O-N 3.3Å; G531-K534 PolarHBondContact O-N 3.29Å; Y532-K534 VanDerWaalsContact C-N 3.28Å; Y532-K534 PolarHBondContact O-N 2.97Å; K534-T537 WeakPolarHBondContact CA-OG1 3.46Å; K534-T537 CarbonylContact O-C 3.57Å; K534-T537 PolarHBondContact O-N 3.05Å; K534-T537 PolarHBondContact O-OG1 3.23Å; K534-D538 PolarHBondContact O-N 2.04Å; K534-D538 VanDerWaalsContact O-N 3.08Å
535	M	83.1	Confident	83.9	Confident	27 Å²	27	46.7 Å²	46.7	13%	0.133	25%	0.252	C	S	.	.	H	α-helix	trans	-58.7	-50.8	178	-172.9	-154.2	70.5	0	0	111.5	S425 E427 G531 Y532 Q533 T537 D538 H541	S425-M535 PolarHBondContact OG-SD 3.44Å; E427-M535 HydrophobicContact CB-SD 4.39Å; G531-M535 PolarHBondContact O-N 3.21Å; Y532-M535 HydrophobicContact CD2-CE 3.69Å; Y532-M535 HydrophobicContact CD2-SD 4.42Å; Y532-M535 HydrophobicContact CE2-CE 3.32Å; Y532-M535 HydrophobicContact CE2-SD 4.41Å; Y532-M535 WeakPolarHBondContact O-CB 3.18Å; Y532-M535 PolarHBondContact O-N 3Å; Y532-M535 VanDerWaalsContact O-N 3.09Å; Q533-M535 VanDerWaalsContact C-N 3.33Å; Q533-M535 PolarHBondContact O-N 3.09Å; M535-T537 VanDerWaalsContact C-N 3.27Å; M535-T537 PolarHBondContact O-N 3.31Å; M535-D538 VanDerWaalsContact O-CB 3.24Å; M535-D538 WeakPolarHBondContact O-CB 3.48Å; M535-D538 PolarHBondContact O-N 3.04Å; M535-D538 VanDerWaalsContact O-N 3.15Å; M535-H541 PolarHBondContact O-ND1 2.98Å
536	I	82.3	Confident	83.8	Confident	1 Å²	1	52 Å²	52	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-72.3	-21.7	-177.6	66	171.2	0	0	0	113	L156 L260 E263 Y532 Q533 Y545	L156-I536 HydrophobicContact CB-CD1 4Å; L156-I536 HydrophobicContact CD1-CD1 4.2Å; L156-I536 HydrophobicContact CD2-CD1 4.25Å; L156-I536 HydrophobicContact CG-CD1 4.37Å; L260-I536 HydrophobicContact CD2-CD1 3.3Å; L260-I536 HydrophobicContact CD2-CG1 4.49Å; E263-I536 WeakPolarHBondContact OE2-CG2 3.43Å; Y532-I536 HydrophobicContact CD1-CG2 4.21Å; Y532-I536 HydrophobicContact CD2-CG2 4.38Å; Y532-I536 HydrophobicContact CE1-CD1 4.38Å; Y532-I536 HydrophobicContact CE1-CG2 3.72Å; Y532-I536 HydrophobicContact CE2-CG2 4.02Å; Y532-I536 PolarHBondContact O-N 3.23Å; Q533-I536 WeakPolarHBondContact O-CG1 3.29Å; Q533-I536 PolarHBondContact O-N 3.33Å; I536-Y545 HydrophobicContact CB-CE2 4.38Å
537	T	81.7	Confident	84	Confident	42 Å²	42	53.3 Å²	53.3	26%	0.258	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	0.8	172.5	60.7	0	0	0	0	113.6	E157 Q533 K534 M535 L542	E157-T537 HydrophobicContact CG-CG2 4.25Å; Q533-T537 HydrophobicContact CG-CG2 4.48Å; Q533-T537 WeakPolarHBondContact O-CB 3.42Å; Q533-T537 VanDerWaalsContact O-CG2 3.31Å; Q533-T537 WeakPolarHBondContact O-CG2 3.24Å; Q533-T537 PolarHBondContact O-N 2.75Å; Q533-T537 PolarHBondContact O-OG1 3.48Å; K534-T537 WeakPolarHBondContact CA-OG1 3.46Å; K534-T537 CarbonylContact O-C 3.57Å; K534-T537 PolarHBondContact O-N 3.05Å; K534-T537 PolarHBondContact O-OG1 3.23Å; M535-T537 VanDerWaalsContact C-N 3.27Å; M535-T537 PolarHBondContact O-N 3.31Å; T537-L542 WeakPolarHBondContact O-CD1 3.29Å
538	D	84.2	Confident	84.1	Confident	66 Å²	66	49.9 Å²	49.9	35%	0.353	26%	0.261	S	S	.	.	S	Bend	trans	-60.5	136.8	172.7	-178.3	-91.1	0	0	0	109.5	K534 M535 K540 H541 L542	K534-D538 PolarHBondContact O-N 2.04Å; K534-D538 VanDerWaalsContact O-N 3.08Å; M535-D538 VanDerWaalsContact O-CB 3.24Å; M535-D538 WeakPolarHBondContact O-CB 3.48Å; M535-D538 PolarHBondContact O-N 3.04Å; M535-D538 VanDerWaalsContact O-N 3.15Å; D538-K540 PolarHBondContact O-N 3.2Å; D538-K540 VanDerWaalsContact OD1-CB 3.24Å; D538-K540 WeakPolarHBondContact OD1-CB 3.47Å; D538-K540 WeakPolarHBondContact OD1-CG 3.48Å; D538-K540 PolarHBondContact OD1-N 3.4Å; D538-H541 WeakPolarHBondContact O-CA 3.22Å; D538-H541 PolarHBondContact O-N 3.1Å; D538-L542 PolarHBondContact O-N 3.5Å
539	P	82.4	Confident	84.1	Confident	100 Å²	100	48.8 Å²	48.8	65%	0.649	26%	0.262	S	S	*	.	H	α-helix	trans	-51.8	-31.4	-178.1	-29.9	35.8	0	0	0	114.5	S543	P539-S543 WeakPolarHBondContact O-CB 3.31Å; P539-S543 PolarHBondContact O-N 3.41Å
540	K	78.8	Confident	84.2	Confident	155 Å²	155	52.9 Å²	52.9	67%	0.674	30%	0.297	S	S	*	.	H	α-helix	trans	-68.3	-42.8	175.9	-62.6	179.9	179.2	178	0	111.6	D538 S543 F544	D538-K540 PolarHBondContact O-N 3.2Å; D538-K540 VanDerWaalsContact OD1-CB 3.24Å; D538-K540 WeakPolarHBondContact OD1-CB 3.47Å; D538-K540 WeakPolarHBondContact OD1-CG 3.48Å; D538-K540 PolarHBondContact OD1-N 3.4Å; K540-S543 PolarHBondContact O-N 2.81Å; K540-S543 PolarHBondContact O-OG 3.47Å; K540-F544 PolarHBondContact O-N 3.33Å
541	H	81.6	Confident	84.4	Confident	12 Å²	12	50.4 Å²	50.4	6%	0.056	29%	0.287	C	S	.	.	H	α-helix	trans	-68.2	-40.3	175.7	-77	111	0	0	0	112.2	R267 S423 M535 D538 S543 F544 Y545	R267-H541 PolarHBondContact NH1-CD2 3.38Å; R267-H541 PolarHBondContact NH1-NE2 3Å; S423-H541 PolarHBondContact OG-NE2 3.39Å; M535-H541 PolarHBondContact O-ND1 2.98Å; D538-H541 WeakPolarHBondContact O-CA 3.22Å; D538-H541 PolarHBondContact O-N 3.1Å; H541-S543 VanDerWaalsContact C-N 3.26Å; H541-S543 PolarHBondContact O-N 3.25Å; H541-F544 WeakPolarHBondContact O-CB 3.36Å; H541-F544 PolarHBondContact O-N 2.75Å; H541-F544 VanDerWaalsContact O-N 3.16Å; H541-Y545 WeakPolarHBondContact O-CD2 3.27Å; H541-Y545 PolarHBondContact O-N 2.95Å
542	L	81.3	Confident	84.2	Confident	31 Å²	31	51.8 Å²	51.8	16%	0.162	28%	0.283	C	S	.	.	H	α-helix	trans	-60.7	-37.1	174.7	-66.9	178	0	0	0	111.8	E157 T537 D538 F544 Y545 Q546	E157-L542 HydrophobicContact CG-CD2 4.21Å; E157-L542 WeakPolarHBondContact OE1-CD1 3.48Å; E157-L542 WeakPolarHBondContact OE1-CD2 3.33Å; T537-L542 WeakPolarHBondContact O-CD1 3.29Å; D538-L542 PolarHBondContact O-N 3.5Å; L542-F544 VanDerWaalsContact C-N 3.31Å; L542-F544 PolarHBondContact O-N 3.18Å; L542-Y545 HydrophobicContact CD2-CD2 4.22Å; L542-Y545 PolarHBondContact O-N 3.28Å; L542-Q546 WeakPolarHBondContact O-CB 3.49Å; L542-Q546 VanDerWaalsContact O-CG 3.23Å; L542-Q546 WeakPolarHBondContact O-CG 3.24Å; L542-Q546 PolarHBondContact O-N 3.21Å
543	S	83.9	Confident	84	Confident	62 Å²	62	52.7 Å²	52.7	43%	0.434	29%	0.288	S	S	.	.	H	α-helix	trans	-63.4	-35.1	176.7	76.1	0	0	0	0	113.1	P539 K540 H541 C547	P539-S543 WeakPolarHBondContact O-CB 3.31Å; P539-S543 PolarHBondContact O-N 3.41Å; K540-S543 PolarHBondContact O-N 2.81Å; K540-S543 PolarHBondContact O-OG 3.47Å; H541-S543 VanDerWaalsContact C-N 3.26Å; H541-S543 PolarHBondContact O-N 3.25Å; S543-C547 WeakPolarHBondContact O-CB 3.29Å; S543-C547 PolarHBondContact O-N 3.46Å
544	F	86	Confident	83.5	Confident	15 Å²	15	61.1 Å²	61.1	7%	0.066	32%	0.324	C	S	.	.	H	α-helix	trans	-65	-46.6	173.2	163.9	-103.1	0	0	0	111.4	L144 L270 K540 H541 L542 Q546 C547 L548	L144-F544 HydrophobicContact CD2-CE2 4.34Å; L144-F544 HydrophobicContact CD2-CZ 3.98Å; L270-F544 HydrophobicContact CD2-CZ 4.34Å; K540-F544 PolarHBondContact O-N 3.33Å; H541-F544 WeakPolarHBondContact O-CB 3.36Å; H541-F544 PolarHBondContact O-N 2.75Å; H541-F544 VanDerWaalsContact O-N 3.16Å; L542-F544 VanDerWaalsContact C-N 3.31Å; L542-F544 PolarHBondContact O-N 3.18Å; F544-Q546 PolarHBondContact O-N 2.94Å; F544-C547 WeakPolarHBondContact O-CB 3.21Å; F544-C547 PolarHBondContact O-N 3.5Å; F544-L548 HydrophobicContact CD1-CD1 4.37Å; F544-L548 HydrophobicContact CE1-CD1 3.63Å; F544-L548 HydrophobicContact CE2-CD1 3.85Å; F544-L548 HydrophobicContact CE2-CD2 4.49Å; F544-L548 HydrophobicContact CE2-CG 4.08Å; F544-L548 HydrophobicContact CZ-CD1 3.35Å; F544-L548 HydrophobicContact CZ-CG 4.09Å; F544-L548 PolarHBondContact O-N 2.84Å
545	Y	85.5	Confident	83.3	Confident	10 Å²	10	59.7 Å²	59.7	4%	0.039	32%	0.32	C	S	.	.	H	α-helix	trans	-64.2	-40.8	176.7	-62	-35.2	0	0	0	113	I147 L151 L156 E263 R267 I536 H541 L542 C547 L548 T549	I147-Y545 HydrophobicContact CG2-CD1 4.38Å; I147-Y545 HydrophobicContact CG2-CE1 4.31Å; L151-Y545 HydrophobicContact CD1-CD1 3.64Å; L151-Y545 HydrophobicContact CD1-CG 3.87Å; L151-Y545 HydrophobicContact CD2-CD1 3.96Å; L151-Y545 HydrophobicContact CD2-CD2 4.1Å; L151-Y545 HydrophobicContact CD2-CE1 4.37Å; L151-Y545 HydrophobicContact CD2-CG 3.79Å; L151-Y545 HydrophobicContact CG-CD1 4.37Å; L151-Y545 HydrophobicContact CG-CG 4.5Å; L156-Y545 HydrophobicContact CD1-CD2 4.39Å; L156-Y545 HydrophobicContact CD1-CE2 3.77Å; E263-Y545 PolarHBondContact OE1-OH 3.33Å; R267-Y545 PolarHBondContact NH2-OH 3.3Å; I536-Y545 HydrophobicContact CB-CE2 4.38Å; H541-Y545 WeakPolarHBondContact O-CD2 3.27Å; H541-Y545 PolarHBondContact O-N 2.95Å; L542-Y545 HydrophobicContact CD2-CD2 4.22Å; L542-Y545 PolarHBondContact O-N 3.28Å; Y545-C547 VanDerWaalsContact C-N 3.28Å; Y545-C547 PolarHBondContact O-N 2.85Å; Y545-L548 PolarHBondContact O-N 2.98Å; Y545-T549 WeakPolarHBondContact O-CB 3.09Å; Y545-T549 PolarHBondContact O-N 3.09Å; Y545-T549 PolarHBondContact O-OG1 3.28Å
546	Q	85.6	Confident	83.5	Confident	130 Å²	130	59.6 Å²	59.6	61%	0.607	33%	0.326	S	S	*	.	H	α-helix	trans	-62	-39.4	174.4	-73.8	170.5	-3.5	0	0	111	L542 F544 A550	L542-Q546 WeakPolarHBondContact O-CB 3.49Å; L542-Q546 VanDerWaalsContact O-CG 3.23Å; L542-Q546 WeakPolarHBondContact O-CG 3.24Å; L542-Q546 PolarHBondContact O-N 3.21Å; F544-Q546 PolarHBondContact O-N 2.94Å; Q546-A550 VanDerWaalsContact O-CB 3.29Å; Q546-A550 WeakPolarHBondContact O-CB 2.83Å; Q546-A550 PolarHBondContact O-N 2.83Å
547	C	89.6	Confident	83.8	Confident	42 Å²	42	59.5 Å²	59.5	28%	0.284	33%	0.326	S	S	.	.	H	α-helix	trans	-61.6	-52.2	173.7	-167.6	0	0	0	0	111.2	C418 S543 F544 Y545 T549 A550 A551	C418-C547 WeakPolarHBondContact CA-SG 3.24Å; C418-C547 HydrophobicContact CB-CB 3.74Å; C418-C547 WeakPolarHBondContact CB-SG 3.21Å; C418-C547 WeakPolarHBondContact SG-CB 3.19Å; C418-C547 PolarHBondContact SG-O 2.94Å; C418-C547 CovalentContact SG-SG 2.04Å; C418-C547 PolarHBondContact SG-SG 2.86Å; S543-C547 WeakPolarHBondContact O-CB 3.29Å; S543-C547 PolarHBondContact O-N 3.46Å; F544-C547 WeakPolarHBondContact O-CB 3.21Å; F544-C547 PolarHBondContact O-N 3.5Å; Y545-C547 VanDerWaalsContact C-N 3.28Å; Y545-C547 PolarHBondContact O-N 2.85Å; C547-T549 VanDerWaalsContact C-N 3.34Å; C547-T549 PolarHBondContact O-N 3.5Å; C547-A550 PolarHBondContact O-N 3.23Å; C547-A551 VanDerWaalsContact O-CB 3.26Å; C547-A551 WeakPolarHBondContact O-CB 3.4Å; C547-A551 PolarHBondContact O-N 2.96Å
548	L	89	Confident	84.2	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-59.4	-43.2	178.8	-73.3	-179.4	0	0	0	112.5	L144 I147 I415 C418 F544 Y545 A550 A551 K552	L144-L548 HydrophobicContact CD2-CD1 4.25Å; L144-L548 HydrophobicContact CD2-CD2 4.26Å; I147-L548 HydrophobicContact CB-CD1 4.28Å; I147-L548 HydrophobicContact CG2-CD1 3.73Å; I415-L548 HydrophobicContact CG1-CD2 4.49Å; I415-L548 HydrophobicContact CG2-CD2 4.27Å; C418-L548 HydrophobicContact CB-CD2 3.83Å; C418-L548 HydrophobicContact CB-CG 4.3Å; F544-L548 HydrophobicContact CD1-CD1 4.37Å; F544-L548 HydrophobicContact CE1-CD1 3.63Å; F544-L548 HydrophobicContact CE2-CD1 3.85Å; F544-L548 HydrophobicContact CE2-CD2 4.49Å; F544-L548 HydrophobicContact CE2-CG 4.08Å; F544-L548 HydrophobicContact CZ-CD1 3.35Å; F544-L548 HydrophobicContact CZ-CG 4.09Å; F544-L548 PolarHBondContact O-N 2.84Å; Y545-L548 PolarHBondContact O-N 2.98Å; L548-A550 VanDerWaalsContact C-N 3.32Å; L548-A550 PolarHBondContact O-N 2.96Å; L548-A551 CarbonylContact O-C 3.29Å; L548-A551 PolarHBondContact O-N 3.22Å; L548-K552 PolarHBondContact O-N 2.9Å
549	T	85.4	Confident	84.4	Confident	60 Å²	60	58.4 Å²	58.4	37%	0.368	31%	0.312	S	S	.	.	H	α-helix	trans	-62.1	-40.9	177.5	-53.5	0	0	0	0	111.4	Y545 C547 K552	Y545-T549 WeakPolarHBondContact O-CB 3.09Å; Y545-T549 PolarHBondContact O-N 3.09Å; Y545-T549 PolarHBondContact O-OG1 3.28Å; C547-T549 VanDerWaalsContact C-N 3.34Å; C547-T549 PolarHBondContact O-N 3.5Å; T549-K552 WeakPolarHBondContact O-CB 3.37Å; T549-K552 PolarHBondContact O-N 3.16Å
550	A	86.4	Confident	84.8	Confident	90 Å²	90	54.6 Å²	54.6	74%	0.744	29%	0.289	S	S	*	.	H	α-helix	trans	-71.8	-32.4	176.6	0	0	0	0	0	112.6	Q546 C547 L548 K552	Q546-A550 VanDerWaalsContact O-CB 3.29Å; Q546-A550 WeakPolarHBondContact O-CB 2.83Å; Q546-A550 PolarHBondContact O-N 2.83Å; C547-A550 PolarHBondContact O-N 3.23Å; L548-A550 VanDerWaalsContact C-N 3.32Å; L548-A550 PolarHBondContact O-N 2.96Å; A550-K552 VanDerWaalsContact C-N 3.29Å
551	A	87.2	Confident	85.5	Confident	12 Å²	12	47.2 Å²	47.2	10%	0.099	26%	0.257	C	S	.	.	H	α-helix	trans	-78.7	-9.3	176.7	0	0	0	0	0	112.9	H411 A414 I415 C547 L548	H411-A551 PolarHBondContact CE1-O 3.11Å; H411-A551 PolarHBondContact ND1-O 3.09Å; A414-A551 HydrophobicContact CB-CB 3.63Å; I415-A551 HydrophobicContact CG1-CB 4.05Å; C547-A551 VanDerWaalsContact O-CB 3.26Å; C547-A551 WeakPolarHBondContact O-CB 3.4Å; C547-A551 PolarHBondContact O-N 2.96Å; L548-A551 CarbonylContact O-C 3.29Å; L548-A551 PolarHBondContact O-N 3.22Å
552	K	81	Confident	86	Confident	62 Å²	62	47.6 Å²	47.6	27%	0.27	26%	0.259	S	S	.	.			trans	-54.4	135.5	-171.3	-174.9	-177.1	177.9	-170.8	0	113.8	D152 L548 T549 A550 K554	D152-K552 WeakPolarHBondContact OD2-CD 3.48Å; D152-K552 WeakPolarHBondContact OD2-CE 3.35Å; D152-K552 IonicContact OD2-NZ 3.97Å; D152-K552 PolarHBondContact OD2-NZ 3.24Å; L548-K552 PolarHBondContact O-N 2.9Å; T549-K552 WeakPolarHBondContact O-CB 3.37Å; T549-K552 PolarHBondContact O-N 3.16Å; A550-K552 VanDerWaalsContact C-N 3.29Å; K552-K554 PolarHBondContact O-N 3.09Å; K552-K554 VanDerWaalsContact O-N 3.14Å
553	D	79	Confident	86.3	Confident	22 Å²	22	51 Å²	51	12%	0.118	27%	0.274	C	S	.	.			trans	-74.5	103.3	168.7	-171.2	-14.2	0	0	0	108	H411 E555 G556 G557 V558	H411-D553 VanDerWaalsContact CE1-CB 3.42Å; H411-D553 WeakPolarHBondContact CE1-CB 3.41Å; H411-D553 PolarHBondContact CE1-N 3.16Å; H411-D553 WeakPolarHBondContact ND1-CB 3.14Å; H411-D553 PolarHBondContact ND1-N 2.94Å; H411-D553 VanDerWaalsContact ND1-N 3.15Å; D553-E555 PolarHBondContact O-N 3.25Å; D553-E555 PolarHBondContact OD1-N 3.19Å; D553-G556 VanDerWaalsContact CG-N 3.25Å; D553-G556 PolarHBondContact O-N 3.17Å; D553-G556 PolarHBondContact OD1-N 2.99Å; D553-G557 WeakPolarHBondContact OD2-CA 3.4Å; D553-G557 PolarHBondContact OD2-N 3.19Å; D553-V558 PolarHBondContact OD2-N 3.41Å
554	K	74.8	Confident	86.5	Confident	201 Å²	201	48.6 Å²	48.6	87%	0.874	26%	0.257	S	S	*	.	S	Bend	trans	-69	-24.4	179.7	-67.6	-177.2	-178.6	176.3	0	112.4	K552	K552-K554 PolarHBondContact O-N 3.09Å; K552-K554 VanDerWaalsContact O-N 3.14Å
555	E	81.3	Confident	86.8	Confident	113 Å²	113	47.9 Å²	47.9	53%	0.528	25%	0.254	S	S	.	.	S	Bend	trans	-92	-19.5	-179.3	-51.7	-168.5	152.7	0	0	111.2	F405 D553	F405-E555 HydrophobicContact CD1-CB 4.12Å; F405-E555 HydrophobicContact CE1-CB 3.7Å; F405-E555 WeakPolarHBondContact CE1-O 3.48Å; D553-E555 PolarHBondContact O-N 3.25Å; D553-E555 PolarHBondContact OD1-N 3.19Å
556	G	85.8	Confident	86.7	Confident	25 Å²	25	50.3 Å²	50.3	26%	0.258	28%	0.275	S	S	.	.			trans	78.2	20.4	175.4	0	0	0	0	0	114.2	D553 R559 A560	D553-G556 VanDerWaalsContact CG-N 3.25Å; D553-G556 PolarHBondContact O-N 3.17Å; D553-G556 PolarHBondContact OD1-N 2.99Å; G556-R559 PolarHBondContact O-N 3.21Å; G556-A560 WeakPolarHBondContact O-CB 3.46Å; G556-A560 PolarHBondContact O-N 2.84Å
557	G	89.1	Confident	86.6	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-60.1	-43.3	-179.2	0	0	0	0	0	113.8	F405 D553 R559 A560 L561	F405-G557 VanDerWaalsContact CE1-CA 3.46Å; D553-G557 WeakPolarHBondContact OD2-CA 3.4Å; D553-G557 PolarHBondContact OD2-N 3.19Å; G557-R559 PolarHBondContact O-N 3.05Å; G557-A560 PolarHBondContact O-N 3.04Å; G557-L561 WeakPolarHBondContact O-CB 3.34Å; G557-L561 WeakPolarHBondContact O-CG 3.26Å; G557-L561 PolarHBondContact O-N 3.19Å
558	V	90.1	Very high	86.4	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.8	-43.9	177.9	164.1	0	0	0	0	112.2	L141 E145 F288 V408 H411 D553 L561 L562	L141-V558 HydrophobicContact CD1-CG1 4.35Å; L141-V558 HydrophobicContact CD2-CG1 3.58Å; L141-V558 HydrophobicContact CG-CG1 3.85Å; E145-V558 HydrophobicContact CG-CG1 4.27Å; F288-V558 HydrophobicContact CE2-CG1 4.25Å; F288-V558 HydrophobicContact CE2-CG2 4.18Å; F288-V558 HydrophobicContact CZ-CG1 4.45Å; V408-V558 HydrophobicContact CB-CG2 3.59Å; V408-V558 HydrophobicContact CG1-CG2 3.97Å; V408-V558 HydrophobicContact CG2-CG2 4.02Å; H411-V558 WeakPolarHBondContact CD2-CG2 3.18Å; D553-V558 PolarHBondContact OD2-N 3.41Å; V558-L561 PolarHBondContact O-N 3.06Å; V558-L562 HydrophobicContact CG1-CD1 3.98Å; V558-L562 HydrophobicContact CG1-CG 4.48Å; V558-L562 WeakPolarHBondContact O-CG 3.22Å; V558-L562 PolarHBondContact O-N 2.63Å
559	R	88.8	Confident	86.3	Confident	84 Å²	84	48.7 Å²	48.7	32%	0.317	26%	0.264	S	S	.	.	H	α-helix	trans	-61.5	-46.8	176	-173.7	180	-172.1	109	8.3	111	D146 G556 G557 L561 L562 E563	D146-R559 IonicContact OD1-CZ 3.33Å; D146-R559 IonicContact OD1-NH1 3.32Å; D146-R559 PolarHBondContact OD1-NH1 3.11Å; D146-R559 IonicContact OD1-NH2 3.26Å; D146-R559 PolarHBondContact OD1-NH2 3.22Å; G556-R559 PolarHBondContact O-N 3.21Å; G557-R559 PolarHBondContact O-N 3.05Å; R559-L561 VanDerWaalsContact C-N 3.29Å; R559-L561 PolarHBondContact O-N 2.6Å; R559-L562 PolarHBondContact O-N 3.46Å; R559-E563 HydrophobicContact CG-CG 4.44Å; R559-E563 WeakPolarHBondContact CG-OE1 3.49Å; R559-E563 IonicContact CZ-OE1 2.6Å; R559-E563 IonicContact NE-OE1 2.74Å; R559-E563 PolarHBondContact NE-OE1 3.12Å; R559-E563 IonicContact NH2-OE1 3.66Å; R559-E563 WeakPolarHBondContact O-CG 3.38Å; R559-E563 PolarHBondContact O-N 2.95Å
560	A	90.7	Very high	86.4	Confident	21 Å²	21	49.7 Å²	49.7	17%	0.174	28%	0.279	C	S	.	.	H	α-helix	trans	-59.2	-40.5	178.8	0	0	0	0	0	112	L402 F405 G556 G557 N564	L402-A560 HydrophobicContact CD2-CB 3.64Å; F405-A560 HydrophobicContact CE2-CB 4.02Å; F405-A560 HydrophobicContact CZ-CB 4.42Å; G556-A560 WeakPolarHBondContact O-CB 3.46Å; G556-A560 PolarHBondContact O-N 2.84Å; G557-A560 PolarHBondContact O-N 3.04Å; A560-N564 WeakPolarHBondContact O-CB 3.41Å; A560-N564 PolarHBondContact O-N 3.21Å; A560-N564 PolarHBondContact O-ND2 2.97Å
561	L	92.9	Very high	86.2	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-64.1	-47.6	175.9	-78.3	160.2	0	0	0	112.3	F288 V291 L292 L402 V408 G557 V558 R559 E563 N564 F565	F288-L561 HydrophobicContact CB-CD1 3.89Å; F288-L561 HydrophobicContact CD1-CB 3.79Å; F288-L561 HydrophobicContact CD1-CD1 3.89Å; F288-L561 HydrophobicContact CD1-CD2 4.3Å; F288-L561 HydrophobicContact CD1-CG 4.22Å; F288-L561 HydrophobicContact CD2-CD1 4.26Å; F288-L561 HydrophobicContact CE1-CB 3.73Å; F288-L561 HydrophobicContact CE1-CD1 4.48Å; F288-L561 HydrophobicContact CG-CB 4.49Å; F288-L561 HydrophobicContact CG-CD1 3.78Å; F288-L561 HydrophobicContact CZ-CB 4.35Å; V291-L561 HydrophobicContact CB-CD2 4.1Å; V291-L561 HydrophobicContact CG1-CD2 3.7Å; L292-L561 HydrophobicContact CD1-CD1 4.24Å; L292-L561 HydrophobicContact CD2-CD1 4.18Å; L292-L561 HydrophobicContact CD2-CD2 3.99Å; L292-L561 HydrophobicContact CD2-CG 4.34Å; L292-L561 HydrophobicContact CG-CD1 4.17Å; L292-L561 HydrophobicContact CG-CD2 4.2Å; L402-L561 HydrophobicContact CD1-CD2 4.02Å; V408-L561 HydrophobicContact CB-CD1 4.39Å; V408-L561 HydrophobicContact CG1-CD1 3.94Å; V408-L561 HydrophobicContact CG2-CD1 3.61Å; G557-L561 WeakPolarHBondContact O-CB 3.34Å; G557-L561 WeakPolarHBondContact O-CG 3.26Å; G557-L561 PolarHBondContact O-N 3.19Å; V558-L561 PolarHBondContact O-N 3.06Å; R559-L561 VanDerWaalsContact C-N 3.29Å; R559-L561 PolarHBondContact O-N 2.6Å; L561-E563 VanDerWaalsContact C-N 3.34Å; L561-E563 PolarHBondContact O-N 2.74Å; L561-N564 WeakPolarHBondContact O-CB 3.42Å; L561-N564 PolarHBondContact O-N 3.41Å; L561-F565 HydrophobicContact CD2-CE1 4.36Å; L561-F565 WeakPolarHBondContact O-CD1 3.33Å; L561-F565 WeakPolarHBondContact O-CG 3.49Å; L561-F565 PolarHBondContact O-N 3.22Å
562	L	91.5	Very high	86.2	Confident	20 Å²	20	48.6 Å²	48.6	11%	0.105	26%	0.262	C	S	.	.	H	α-helix	trans	-60.9	-42.8	178.3	-70.4	170.9	0	0	0	112.1	E138 L141 A142 F288 V558 R559 N564 F565 A566	E138-L562 HydrophobicContact CB-CD2 3.76Å; E138-L562 HydrophobicContact CG-CD2 3.87Å; L141-L562 HydrophobicContact CB-CD1 4.26Å; L141-L562 HydrophobicContact CD2-CD1 4.19Å; L141-L562 HydrophobicContact CG-CD1 4.04Å; A142-L562 HydrophobicContact CB-CD1 4.11Å; F288-L562 HydrophobicContact CE1-CD2 4.19Å; F288-L562 HydrophobicContact CE1-CG 4.47Å; F288-L562 HydrophobicContact CZ-CD2 3.83Å; F288-L562 HydrophobicContact CZ-CG 4.02Å; V558-L562 HydrophobicContact CG1-CD1 3.98Å; V558-L562 HydrophobicContact CG1-CG 4.48Å; V558-L562 WeakPolarHBondContact O-CG 3.22Å; V558-L562 PolarHBondContact O-N 2.63Å; R559-L562 PolarHBondContact O-N 3.46Å; L562-N564 VanDerWaalsContact C-N 3.34Å; L562-F565 PolarHBondContact O-N 3.37Å; L562-A566 PolarHBondContact O-N 3.48Å
563	E	88.7	Confident	86.3	Confident	103 Å²	103	49.3 Å²	49.3	48%	0.481	28%	0.275	S	S	.	.	H	α-helix	trans	-63.7	-40.7	175.8	-71.8	175	-177.1	0	0	111.1	R559 L561 A566 V567	R559-E563 HydrophobicContact CG-CG 4.44Å; R559-E563 WeakPolarHBondContact CG-OE1 3.49Å; R559-E563 IonicContact CZ-OE1 2.6Å; R559-E563 IonicContact NE-OE1 2.74Å; R559-E563 PolarHBondContact NE-OE1 3.12Å; R559-E563 IonicContact NH2-OE1 3.66Å; R559-E563 WeakPolarHBondContact O-CG 3.38Å; R559-E563 PolarHBondContact O-N 2.95Å; L561-E563 VanDerWaalsContact C-N 3.34Å; L561-E563 PolarHBondContact O-N 2.74Å; E563-A566 PolarHBondContact O-N 2.83Å; E563-V567 PolarHBondContact O-N 3.38Å
564	N	88	Confident	86.9	Confident	11 Å²	11	51 Å²	51	6%	0.059	29%	0.288	C	S	.	.	H	α-helix	trans	-64.2	-40.4	175.5	-90.4	-93.7	0	0	0	112.6	I398 L402 A560 L561 L562 A566 V567 F568	I398-N564 WeakPolarHBondContact CG2-OD1 3.38Å; L402-N564 HydrophobicContact CD1-CB 4.14Å; A560-N564 WeakPolarHBondContact O-CB 3.41Å; A560-N564 PolarHBondContact O-N 3.21Å; A560-N564 PolarHBondContact O-ND2 2.97Å; L561-N564 WeakPolarHBondContact O-CB 3.42Å; L561-N564 PolarHBondContact O-N 3.41Å; L562-N564 VanDerWaalsContact C-N 3.34Å; N564-A566 PolarHBondContact O-N 3.46Å; N564-V567 WeakPolarHBondContact O-CA 3.42Å; N564-V567 WeakPolarHBondContact O-CB 3.06Å; N564-V567 PolarHBondContact O-N 3.13Å; N564-F568 HydrophobicContact CB-CD2 4.48Å; N564-F568 VanDerWaalsContact O-CD2 3.26Å; N564-F568 WeakPolarHBondContact O-CD2 3.37Å; N564-F568 PolarHBondContact O-N 2.89Å
565	F	91.3	Very high	87.7	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59.2	-37.3	179.6	-76.5	15.3	0	0	0	112	I127 L284 L287 F288 V291 L561 L562 F568 R569	I127-F565 HydrophobicContact CD1-CD1 3.72Å; I127-F565 HydrophobicContact CD1-CE1 3.96Å; I127-F565 HydrophobicContact CD1-CG 4.22Å; I127-F565 HydrophobicContact CG1-CD1 4.24Å; I127-F565 HydrophobicContact CG1-CE1 4.3Å; I127-F565 HydrophobicContact CG1-CG 4.39Å; I127-F565 HydrophobicContact CG1-CZ 4.47Å; I127-F565 HydrophobicContact CG2-CB 4.21Å; I127-F565 HydrophobicContact CG2-CG 4.32Å; L284-F565 HydrophobicContact CD1-CE2 4.12Å; L287-F565 HydrophobicContact CB-CE2 4.43Å; L287-F565 HydrophobicContact CB-CZ 4.3Å; L287-F565 HydrophobicContact CD2-CD2 4.17Å; L287-F565 HydrophobicContact CD2-CE2 3.39Å; L287-F565 HydrophobicContact CD2-CZ 3.81Å; L287-F565 HydrophobicContact CG-CE2 3.7Å; L287-F565 HydrophobicContact CG-CZ 3.55Å; F288-F565 HydrophobicContact CD1-CE1 4.16Å; F288-F565 AromaticContact CD1-CE2 3.77Å; F288-F565 HydrophobicContact CD1-CE2 3.77Å; F288-F565 AromaticContact CD1-CZ 3.39Å; F288-F565 HydrophobicContact CD1-CZ 3.39Å; F288-F565 HydrophobicContact CE1-CD2 4.32Å; F288-F565 HydrophobicContact CE1-CE1 4.4Å; F288-F565 AromaticContact CE1-CE2 3.59Å; F288-F565 HydrophobicContact CE1-CE2 3.59Å; F288-F565 AromaticContact CE1-CZ 3.66Å; F288-F565 HydrophobicContact CE1-CZ 3.66Å; V291-F565 HydrophobicContact CB-CE1 4.24Å; V291-F565 HydrophobicContact CG1-CE1 4.37Å; V291-F565 HydrophobicContact CG2-CE1 3.76Å; V291-F565 HydrophobicContact CG2-CZ 4.31Å; L561-F565 HydrophobicContact CD2-CE1 4.36Å; L561-F565 WeakPolarHBondContact O-CD1 3.33Å; L561-F565 WeakPolarHBondContact O-CG 3.49Å; L561-F565 PolarHBondContact O-N 3.22Å; L562-F565 PolarHBondContact O-N 3.37Å; F565-F568 PolarHBondContact O-N 3.28Å; F565-R569 WeakPolarHBondContact O-CG 3.33Å; F565-R569 PolarHBondContact O-N 3.38Å; F565-R569 VanDerWaalsContact O-N 3.1Å
566	A	83.7	Confident	88.1	Confident	60 Å²	60	36.7 Å²	36.7	50%	0.496	23%	0.225	S	C	.	.	H	α-helix	trans	-63.1	-42.1	174.4	0	0	0	0	0	111.8	L562 E563 N564 R569 A570	L562-A566 PolarHBondContact O-N 3.48Å; E563-A566 PolarHBondContact O-N 2.83Å; N564-A566 PolarHBondContact O-N 3.46Å; A566-R569 PolarHBondContact O-N 3.04Å; A566-A570 PolarHBondContact O-N 3.49Å
567	V	84.8	Confident	88.4	Confident	61 Å²	61	38.1 Å²	38.1	37%	0.37	23%	0.234	S	C	.	.	H	α-helix	trans	-63.6	-45.1	175.5	-178.6	0	0	0	0	110.8	M395 I398 E563 N564 R569 A570	M395-V567 HydrophobicContact CE-CG1 4.04Å; M395-V567 HydrophobicContact SD-CG1 3.66Å; I398-V567 HydrophobicContact CD1-CG1 4.08Å; E563-V567 PolarHBondContact O-N 3.38Å; N564-V567 WeakPolarHBondContact O-CA 3.42Å; N564-V567 WeakPolarHBondContact O-CB 3.06Å; N564-V567 PolarHBondContact O-N 3.13Å; V567-R569 VanDerWaalsContact C-N 3.31Å; V567-R569 PolarHBondContact O-N 3.44Å; V567-A570 WeakPolarHBondContact O-CB 3.41Å; V567-A570 PolarHBondContact O-N 3.46Å; V567-A570 VanDerWaalsContact O-N 3.07Å
568	F	85.5	Confident	88.7	Confident	1 Å²	1	40 Å²	40	0%	0.004	24%	0.244	C	C	.	.	H	α-helix	trans	-57.2	-41.3	177.4	-89.7	-79.5	0	0	0	113.2	F120 I123 I127 M395 M399 N564 F565 A570 I571	F120-F568 AromaticContact CD1-CE1 3.81Å; F120-F568 HydrophobicContact CD1-CE1 3.81Å; F120-F568 AromaticContact CE1-CE1 3.6Å; F120-F568 HydrophobicContact CE1-CE1 3.6Å; F120-F568 AromaticContact CE1-CZ 3.98Å; F120-F568 HydrophobicContact CE1-CZ 3.98Å; I123-F568 HydrophobicContact CG2-CD1 4.26Å; I123-F568 HydrophobicContact CG2-CE1 4.1Å; I123-F568 HydrophobicContact CG2-CZ 4.48Å; I127-F568 HydrophobicContact CD1-CB 3.82Å; I127-F568 HydrophobicContact CD1-CD1 4.4Å; I127-F568 HydrophobicContact CD1-CD2 4.07Å; I127-F568 HydrophobicContact CD1-CG 3.83Å; I127-F568 HydrophobicContact CG2-CB 4.34Å; M395-F568 HydrophobicContact CE-CD1 3.73Å; M395-F568 HydrophobicContact CE-CD2 3.74Å; M395-F568 HydrophobicContact CE-CE1 3.52Å; M395-F568 HydrophobicContact CE-CE2 3.49Å; M395-F568 VanDerWaalsContact CE-CE2 3.49Å; M395-F568 HydrophobicContact CE-CG 3.82Å; M395-F568 HydrophobicContact CE-CZ 3.34Å; M399-F568 HydrophobicContact CE-CE2 4.13Å; M399-F568 HydrophobicContact CE-CZ 3.63Å; M399-F568 HydrophobicContact CG-CE2 3.98Å; M399-F568 HydrophobicContact CG-CZ 3.62Å; M399-F568 HydrophobicContact SD-CE1 4.36Å; M399-F568 HydrophobicContact SD-CE2 4.34Å; M399-F568 HydrophobicContact SD-CZ 3.5Å; M399-F568 VanDerWaalsContact SD-CZ 3.5Å; N564-F568 HydrophobicContact CB-CD2 4.48Å; N564-F568 VanDerWaalsContact O-CD2 3.26Å; N564-F568 WeakPolarHBondContact O-CD2 3.37Å; N564-F568 PolarHBondContact O-N 2.89Å; F565-F568 PolarHBondContact O-N 3.28Å; F568-A570 VanDerWaalsContact C-N 3.26Å; F568-A570 PolarHBondContact O-N 3.15Å; F568-I571 HydrophobicContact CD1-CD1 4.2Å; F568-I571 PolarHBondContact O-N 3.09Å
569	R	86.7	Confident	88.9	Confident	77 Å²	77	40 Å²	40	29%	0.291	24%	0.244	S	C	.	.	H	α-helix	trans	-70.2	-20.8	178.4	-70.2	179	-174.5	125.4	-1.1	113.8	I127 E138 F565 A566 V567 I571	I127-R569 HydrophobicContact CG2-CG 3.68Å; I127-R569 PolarHBondContact O-NE 3.46Å; I127-R569 VanDerWaalsContact O-NE 3.14Å; I127-R569 PolarHBondContact O-NH2 2.89Å; E138-R569 VanDerWaalsContact CD-NH2 3.27Å; E138-R569 IonicContact OE1-CZ 3.96Å; E138-R569 IonicContact OE1-NH1 2.93Å; E138-R569 IonicContact OE1-NH2 2.69Å; E138-R569 PolarHBondContact OE1-NH2 3.24Å; E138-R569 IonicContact OE2-CZ 3.76Å; E138-R569 VanDerWaalsContact OE2-CZ 3.28Å; E138-R569 IonicContact OE2-NH1 3.62Å; E138-R569 PolarHBondContact OE2-NH1 3.49Å; E138-R569 IonicContact OE2-NH2 2.74Å; E138-R569 PolarHBondContact OE2-NH2 3.31Å; F565-R569 WeakPolarHBondContact O-CG 3.33Å; F565-R569 PolarHBondContact O-N 3.38Å; F565-R569 VanDerWaalsContact O-N 3.1Å; A566-R569 PolarHBondContact O-N 3.04Å; V567-R569 VanDerWaalsContact C-N 3.31Å; V567-R569 PolarHBondContact O-N 3.44Å; R569-I571 VanDerWaalsContact C-N 3.32Å
570	A	86.1	Confident	89.1	Confident	81 Å²	81	39.4 Å²	39.4	67%	0.669	24%	0.244	S	C	*	.	H	α-helix	trans	-81.5	-13	179.8	0	0	0	0	0	113	A566 V567 F568	A566-A570 PolarHBondContact O-N 3.49Å; V567-A570 WeakPolarHBondContact O-CB 3.41Å; V567-A570 PolarHBondContact O-N 3.46Å; V567-A570 VanDerWaalsContact O-N 3.07Å; F568-A570 VanDerWaalsContact C-N 3.26Å; F568-A570 PolarHBondContact O-N 3.15Å
571	I	83.8	Confident	89.3	Confident	16 Å²	16	42.1 Å²	42.1	8%	0.082	26%	0.255	C	S	.	.	S	Bend	trans	-76.5	133.5	-177.2	-58	160.2	0	0	0	110	Y124 M395 F568 R569 S573 T575	Y124-I571 WeakPolarHBondContact CE2-O 3.49Å; M395-I571 HydrophobicContact CE-CD1 3.51Å; M395-I571 HydrophobicContact CG-CD1 3.58Å; M395-I571 HydrophobicContact CG-CG1 4.39Å; M395-I571 HydrophobicContact SD-CD1 3.48Å; M395-I571 WeakPolarHBondContact SD-CD1 3.49Å; M395-I571 HydrophobicContact SD-CG1 4.12Å; F568-I571 HydrophobicContact CD1-CD1 4.2Å; F568-I571 PolarHBondContact O-N 3.09Å; R569-I571 VanDerWaalsContact C-N 3.32Å; I571-S573 PolarHBondContact O-N 2.92Å; I571-T575 HydrophobicContact CG2-CG2 4.02Å
572	P	85.8	Confident	89.3	Confident	62 Å²	62	42.1 Å²	42.1	40%	0.403	26%	0.255	S	S	.	.			trans	-61.9	132.7	170.5	-22	34.1	0	0	0	111.5	S574 T575	P572-S574 WeakPolarHBondContact CB-OG 3.28Å; P572-S574 PolarHBondContact O-N 3.5Å; P572-T575 VanDerWaalsContact O-CB 3.25Å; P572-T575 WeakPolarHBondContact O-CB 3.49Å; P572-T575 PolarHBondContact O-N 3.35Å; P572-T575 PolarHBondContact O-OG1 3.4Å
573	S	84.1	Confident	89.4	Confident	78 Å²	78	41.2 Å²	41.2	55%	0.545	25%	0.25	S	S	.	.	H	α-helix	trans	-56.7	-25.8	174.9	59.4	0	0	0	0	113.4	I571 T575 I576 A577	I571-S573 PolarHBondContact O-N 2.92Å; S573-T575 PolarHBondContact O-N 3.46Å; S573-I576 PolarHBondContact O-N 3.01Å; S573-A577 PolarHBondContact O-N 3.12Å
574	S	91	Very high	89.6	Confident	57 Å²	57	38.5 Å²	38.5	40%	0.399	24%	0.239	S	C	.	.	H	α-helix	trans	-59.9	-29.2	172.3	52.3	0	0	0	0	113.2	P572 I576 A577 N578	P572-S574 WeakPolarHBondContact CB-OG 3.28Å; P572-S574 PolarHBondContact O-N 3.5Å; S574-I576 PolarHBondContact O-N 3.02Å; S574-A577 PolarHBondContact O-N 2.91Å; S574-N578 WeakPolarHBondContact O-CB 3.34Å; S574-N578 PolarHBondContact O-N 3.03Å; S574-N578 PolarHBondContact O-ND2 2.97Å
575	T	91.6	Very high	89.8	Confident	4 Å²	4	38.2 Å²	38.2	3%	0.025	24%	0.239	C	C	.	.	H	α-helix	trans	-63.8	-41.7	179.7	-62	0	0	0	0	111.1	E391 I571 P572 S573 T579	E391-T575 HydrophobicContact CB-CG2 3.88Å; E391-T575 HydrophobicContact CG-CG2 3.96Å; E391-T575 WeakPolarHBondContact OE2-CG2 3.37Å; E391-T575 PolarHBondContact OE2-OG1 3.36Å; I571-T575 HydrophobicContact CG2-CG2 4.02Å; P572-T575 VanDerWaalsContact O-CB 3.25Å; P572-T575 WeakPolarHBondContact O-CB 3.49Å; P572-T575 PolarHBondContact O-N 3.35Å; P572-T575 PolarHBondContact O-OG1 3.4Å; S573-T575 PolarHBondContact O-N 3.46Å; T575-T579 VanDerWaalsContact O-CB 3.29Å; T575-T579 WeakPolarHBondContact O-CB 3.45Å; T575-T579 PolarHBondContact O-N 3.26Å; T575-T579 PolarHBondContact O-OG1 2.62Å
576	I	90.2	Very high	89.7	Confident	10 Å²	10	38.2 Å²	38.2	5%	0.051	24%	0.239	C	C	.	.	H	α-helix	trans	-67.4	-49.7	176.7	-55.6	174.9	0	0	0	110.1	D121 Y124 M392 S573 S574 N578 T579 K580	D121-I576 HydrophobicContact CB-CG2 3.97Å; Y124-I576 HydrophobicContact CD1-CD1 3.61Å; Y124-I576 HydrophobicContact CD2-CD1 3.85Å; Y124-I576 HydrophobicContact CE1-CD1 4.39Å; Y124-I576 HydrophobicContact CG-CD1 3.3Å; M392-I576 HydrophobicContact CE-CB 4.34Å; M392-I576 HydrophobicContact CE-CG1 4.04Å; S573-I576 PolarHBondContact O-N 3.01Å; S574-I576 PolarHBondContact O-N 3.02Å; I576-N578 PolarHBondContact O-N 3.18Å; I576-T579 PolarHBondContact O-N 3.39Å; I576-K580 WeakPolarHBondContact O-CB 3.47Å; I576-K580 PolarHBondContact O-N 2.74Å
577	A	92.3	Very high	90	Very high	55 Å²	55	36.4 Å²	36.4	46%	0.455	22%	0.222	S	C	.	.	H	α-helix	trans	-60.6	-44	-179.2	0	0	0	0	0	112.5	S573 S574 K580 L581	S573-A577 PolarHBondContact O-N 3.12Å; S574-A577 PolarHBondContact O-N 2.91Å; A577-K580 WeakPolarHBondContact O-CB 3.34Å; A577-K580 PolarHBondContact O-N 3.34Å; A577-L581 WeakPolarHBondContact O-CG 3.31Å; A577-L581 PolarHBondContact O-N 3.25Å; A577-L581 VanDerWaalsContact O-N 3.1Å
578	N	95.1	Very high	90.2	Very high	39 Å²	39	37 Å²	37	21%	0.209	22%	0.223	C	C	.	.	H	α-helix	trans	-69.8	-38.8	179.4	-71.4	-15	0	0	0	112.1	N385 S388 S574 I576 K580 L581 V582	N385-N578 WeakPolarHBondContact OD1-CB 3.31Å; N385-N578 PolarHBondContact OD1-OD1 2.96Å; S388-N578 WeakPolarHBondContact OG-CB 3.41Å; S388-N578 PolarHBondContact OG-ND2 3.3Å; S574-N578 WeakPolarHBondContact O-CB 3.34Å; S574-N578 PolarHBondContact O-N 3.03Å; S574-N578 PolarHBondContact O-ND2 2.97Å; I576-N578 PolarHBondContact O-N 3.18Å; N578-K580 VanDerWaalsContact C-N 3.28Å; N578-K580 PolarHBondContact O-N 3.25Å; N578-L581 WeakPolarHBondContact O-CB 3.48Å; N578-L581 PolarHBondContact O-N 3.4Å; N578-V582 PolarHBondContact O-N 3.16Å
579	T	93.4	Very high	90.5	Very high	0 Å²	0	37 Å²	37	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.3	-39.9	173.5	-58.7	0	0	0	0	110.8	T117 S388 L389 M392 T575 I576 L581 V582 V583	T117-T579 HydrophobicContact CG2-CG2 4.22Å; S388-T579 PolarHBondContact O-OG1 3.13Å; L389-T579 HydrophobicContact CD1-CG2 3.95Å; M392-T579 HydrophobicContact CB-CG2 4.09Å; M392-T579 HydrophobicContact CE-CG2 4.13Å; M392-T579 HydrophobicContact CG-CG2 4.08Å; T575-T579 VanDerWaalsContact O-CB 3.29Å; T575-T579 WeakPolarHBondContact O-CB 3.45Å; T575-T579 PolarHBondContact O-N 3.26Å; T575-T579 PolarHBondContact O-OG1 2.62Å; I576-T579 PolarHBondContact O-N 3.39Å; T579-L581 VanDerWaalsContact C-N 3.33Å; T579-L581 PolarHBondContact O-N 3.32Å; T579-V582 WeakPolarHBondContact O-CB 3.36Å; T579-V582 PolarHBondContact O-N 2.67Å; T579-V582 VanDerWaalsContact O-N 3.1Å; T579-V583 PolarHBondContact O-N 3.28Å
580	K	94	Very high	90.7	Very high	71 Å²	71	34.4 Å²	34.4	31%	0.309	21%	0.214	S	C	.	.	H	α-helix	trans	-59.3	-41.9	173.9	-178.2	166.8	178.2	53.5	0	112.5	T117 I576 A577 N578 V582 V583 D584	T117-K580 HydrophobicContact CG2-CB 4.12Å; I576-K580 WeakPolarHBondContact O-CB 3.47Å; I576-K580 PolarHBondContact O-N 2.74Å; A577-K580 WeakPolarHBondContact O-CB 3.34Å; A577-K580 PolarHBondContact O-N 3.34Å; N578-K580 VanDerWaalsContact C-N 3.28Å; N578-K580 PolarHBondContact O-N 3.25Å; K580-V582 PolarHBondContact O-N 3.22Å; K580-V583 PolarHBondContact O-N 3Å; K580-D584 VanDerWaalsContact CE-OD2 3.29Å; K580-D584 WeakPolarHBondContact CE-OD2 3.17Å; K580-D584 VanDerWaalsContact CG-OD2 3.32Å; K580-D584 WeakPolarHBondContact CG-OD2 3.43Å; K580-D584 IonicContact NZ-OD1 2.72Å; K580-D584 PolarHBondContact NZ-OD1 3.37Å; K580-D584 IonicContact NZ-OD2 2.67Å; K580-D584 PolarHBondContact NZ-OD2 3.35Å; K580-D584 VanDerWaalsContact O-CB 3.28Å; K580-D584 WeakPolarHBondContact O-CB 3.41Å; K580-D584 PolarHBondContact O-N 2.83Å
581	L	94.5	Very high	90.8	Very high	79 Å²	79	35.7 Å²	35.7	41%	0.414	21%	0.206	S	C	.	.	H	α-helix	trans	-61.3	-29.7	175.4	-67.5	175.4	0	0	0	113.7	S379 A577 N578 T579 G585	S379-L581 PolarHBondContact OG-O 3.39Å; A577-L581 WeakPolarHBondContact O-CG 3.31Å; A577-L581 PolarHBondContact O-N 3.25Å; A577-L581 VanDerWaalsContact O-N 3.1Å; N578-L581 WeakPolarHBondContact O-CB 3.48Å; N578-L581 PolarHBondContact O-N 3.4Å; T579-L581 VanDerWaalsContact C-N 3.33Å; T579-L581 PolarHBondContact O-N 3.32Å; L581-G585 PolarHBondContact O-N 2.71Å
582	V	94.2	Very high	91.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-72.4	-52	174.4	172	0	0	0	0	110.4	I308 I312 T380 N385 L389 N578 T579 K580 G585 I586	I308-V582 HydrophobicContact CG2-CG1 3.82Å; I312-V582 HydrophobicContact CD1-CG1 3.76Å; T380-V582 HydrophobicContact CG2-CG1 4.03Å; N385-V582 HydrophobicContact CB-CG2 3.71Å; L389-V582 HydrophobicContact CD1-CG1 4.39Å; L389-V582 HydrophobicContact CD2-CG1 4.24Å; N578-V582 PolarHBondContact O-N 3.16Å; T579-V582 WeakPolarHBondContact O-CB 3.36Å; T579-V582 PolarHBondContact O-N 2.67Å; T579-V582 VanDerWaalsContact O-N 3.1Å; K580-V582 PolarHBondContact O-N 3.22Å; V582-G585 PolarHBondContact O-N 2.94Å; V582-I586 WeakPolarHBondContact O-CG1 3.22Å; V582-I586 PolarHBondContact O-N 3.19Å
583	V	92.4	Very high	91.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.7	-46.9	-179.1	163.2	0	0	0	0	111.7	A113 T117 L305 I308 T579 K580 G585 I586 T587	A113-V583 HydrophobicContact CB-CG1 3.61Å; A113-V583 HydrophobicContact CB-CG2 4.45Å; T117-V583 HydrophobicContact CG2-CB 3.98Å; T117-V583 HydrophobicContact CG2-CG1 4.28Å; T117-V583 HydrophobicContact CG2-CG2 3.78Å; L305-V583 HydrophobicContact CD2-CG2 4.38Å; I308-V583 HydrophobicContact CD1-CG2 4.26Å; T579-V583 PolarHBondContact O-N 3.28Å; K580-V583 PolarHBondContact O-N 3Å; V583-G585 VanDerWaalsContact C-N 3.34Å; V583-I586 PolarHBondContact O-N 3.06Å; V583-T587 VanDerWaalsContact O-CB 3.32Å; V583-T587 WeakPolarHBondContact O-CB 3.48Å; V583-T587 PolarHBondContact O-N 3.4Å; V583-T587 PolarHBondContact O-OG1 2.79Å
584	D	92.3	Very high	92	Very high	46 Å²	46	35.5 Å²	35.5	25%	0.246	19%	0.19	C	C	.	.	H	α-helix	trans	-63.1	-43.6	178.3	-69	-6.7	0	0	0	109.6	K580 I586 T587 D588	K580-D584 VanDerWaalsContact CE-OD2 3.29Å; K580-D584 WeakPolarHBondContact CE-OD2 3.17Å; K580-D584 VanDerWaalsContact CG-OD2 3.32Å; K580-D584 WeakPolarHBondContact CG-OD2 3.43Å; K580-D584 IonicContact NZ-OD1 2.72Å; K580-D584 PolarHBondContact NZ-OD1 3.37Å; K580-D584 IonicContact NZ-OD2 2.67Å; K580-D584 PolarHBondContact NZ-OD2 3.35Å; K580-D584 VanDerWaalsContact O-CB 3.28Å; K580-D584 WeakPolarHBondContact O-CB 3.41Å; K580-D584 PolarHBondContact O-N 2.83Å; D584-I586 PolarHBondContact O-N 2.76Å; D584-T587 PolarHBondContact O-N 2.99Å; D584-D588 WeakPolarHBondContact O-CB 3.39Å; D584-D588 VanDerWaalsContact O-CG 3.27Å; D584-D588 PolarHBondContact O-N 2.93Å
585	G	92.5	Very high	92	Very high	5 Å²	5	34.8 Å²	34.8	5%	0.052	19%	0.188	C	C	.	.	H	α-helix	trans	-60	-42.9	177.7	0	0	0	0	0	113.6	S376 L581 V582 V583 S589	S376-G585 VanDerWaalsContact O-CA 3.28Å; S376-G585 WeakPolarHBondContact O-CA 3.39Å; L581-G585 PolarHBondContact O-N 2.71Å; V582-G585 PolarHBondContact O-N 2.94Å; V583-G585 VanDerWaalsContact C-N 3.34Å; G585-S589 WeakPolarHBondContact O-CB 3.37Å; G585-S589 PolarHBondContact O-N 2.47Å; G585-S589 VanDerWaalsContact O-N 3.1Å
586	I	90	Very high	92	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-69.1	-47	176.3	-65.9	-65.4	0	0	0	111.1	V108 I308 W377 T380 V582 V583 D584 D588 S589 Q590	V108-I586 HydrophobicContact CB-CG2 4.26Å; V108-I586 HydrophobicContact CG1-CG2 4.07Å; V108-I586 HydrophobicContact CG2-CG2 4.03Å; I308-I586 HydrophobicContact CG1-CG2 4.29Å; I308-I586 HydrophobicContact CG2-CG1 3.97Å; W377-I586 HydrophobicContact CD2-CD1 4.25Å; W377-I586 HydrophobicContact CE3-CD1 4.13Å; W377-I586 HydrophobicContact CH2-CD1 3.35Å; W377-I586 HydrophobicContact CZ2-CD1 3.46Å; W377-I586 VanDerWaalsContact CZ2-CD1 3.46Å; W377-I586 HydrophobicContact CZ3-CD1 3.71Å; T380-I586 HydrophobicContact CG2-CD1 4.04Å; T380-I586 HydrophobicContact CG2-CG1 4.26Å; V582-I586 WeakPolarHBondContact O-CG1 3.22Å; V582-I586 PolarHBondContact O-N 3.19Å; V583-I586 PolarHBondContact O-N 3.06Å; D584-I586 PolarHBondContact O-N 2.76Å; I586-D588 VanDerWaalsContact C-N 3.34Å; I586-D588 PolarHBondContact O-N 2.88Å; I586-S589 WeakPolarHBondContact O-CB 3.46Å; I586-S589 PolarHBondContact O-N 2.75Å; I586-S589 VanDerWaalsContact O-N 3.07Å; I586-S589 PolarHBondContact O-OG 3.41Å; I586-Q590 WeakPolarHBondContact O-CG 3.47Å; I586-Q590 PolarHBondContact O-N 2.8Å
587	T	89.6	Confident	92	Very high	22 Å²	22	36.2 Å²	36.2	14%	0.135	19%	0.192	C	C	.	.	H	α-helix	trans	-60.6	-44.6	179.5	-61.6	0	0	0	0	111.3	S110 V583 D584 S589 Q590	S110-T587 WeakPolarHBondContact CB-OG1 3.43Å; V583-T587 VanDerWaalsContact O-CB 3.32Å; V583-T587 WeakPolarHBondContact O-CB 3.48Å; V583-T587 PolarHBondContact O-N 3.4Å; V583-T587 PolarHBondContact O-OG1 2.79Å; D584-T587 PolarHBondContact O-N 2.99Å; T587-S589 PolarHBondContact O-N 3.2Å; T587-Q590 WeakPolarHBondContact O-CB 3.36Å; T587-Q590 WeakPolarHBondContact O-CG 3.4Å; T587-Q590 PolarHBondContact O-N 2.74Å
588	D	89.7	Confident	92	Very high	74 Å²	74	36.1 Å²	36.1	40%	0.396	19%	0.188	S	C	.	.	H	α-helix	trans	-64.8	-29.8	176.4	-78.1	-10.5	0	0	0	112.1	D584 I586 Q590 H591 K592	D584-D588 WeakPolarHBondContact O-CB 3.39Å; D584-D588 VanDerWaalsContact O-CG 3.27Å; D584-D588 PolarHBondContact O-N 2.93Å; I586-D588 VanDerWaalsContact C-N 3.34Å; I586-D588 PolarHBondContact O-N 2.88Å; D588-Q590 VanDerWaalsContact C-N 3.25Å; D588-Q590 PolarHBondContact O-N 2.85Å; D588-H591 VanDerWaalsContact CA-CE1 3.41Å; D588-H591 WeakPolarHBondContact CA-CE1 3.28Å; D588-H591 PolarHBondContact O-CE1 2.79Å; D588-H591 PolarHBondContact O-ND1 3.35Å; D588-H591 PolarHBondContact O-NE2 3.25Å; D588-H591 IonicContact OD1-CE1 3.91Å; D588-K592 WeakPolarHBondContact O-CD 3.44Å; D588-K592 WeakPolarHBondContact O-CG 3.33Å
589	S	91.1	Very high	91.7	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-69.7	-23.4	178.6	82.1	0	0	0	0	113.5	W377 G585 I586 T587 K592 L593	W377-S589 PolarHBondContact NE1-OG 2.76Å; W377-S589 VanDerWaalsContact NE1-OG 3.13Å; G585-S589 WeakPolarHBondContact O-CB 3.37Å; G585-S589 PolarHBondContact O-N 2.47Å; G585-S589 VanDerWaalsContact O-N 3.1Å; I586-S589 WeakPolarHBondContact O-CB 3.46Å; I586-S589 PolarHBondContact O-N 2.75Å; I586-S589 VanDerWaalsContact O-N 3.07Å; I586-S589 PolarHBondContact O-OG 3.41Å; T587-S589 PolarHBondContact O-N 3.2Å; S589-K592 PolarHBondContact O-N 3.46Å; S589-L593 VanDerWaalsContact O-CB 3.23Å; S589-L593 WeakPolarHBondContact O-CB 3.22Å; S589-L593 PolarHBondContact O-N 3.39Å
590	Q	91.3	Very high	91.5	Very high	23 Å²	23	35.5 Å²	35.5	11%	0.107	18%	0.184	C	C	.	.	H	α-helix	trans	-65	-50.4	-176.5	-55.6	-173.4	-63.9	0	0	111.9	M105 M106 V108 S110 I586 T587 D588 K592 L593 Q594	M105-Q590 WeakPolarHBondContact O-CG 3.35Å; M105-Q590 PolarHBondContact O-NE2 3.38Å; M106-Q590 PolarHBondContact O-NE2 2.94Å; V108-Q590 PolarHBondContact O-NE2 2.66Å; S110-Q590 PolarHBondContact OG-OE1 3.33Å; I586-Q590 WeakPolarHBondContact O-CG 3.47Å; I586-Q590 PolarHBondContact O-N 2.8Å; T587-Q590 WeakPolarHBondContact O-CB 3.36Å; T587-Q590 WeakPolarHBondContact O-CG 3.4Å; T587-Q590 PolarHBondContact O-N 2.74Å; D588-Q590 VanDerWaalsContact C-N 3.25Å; D588-Q590 PolarHBondContact O-N 2.85Å; Q590-K592 VanDerWaalsContact C-N 3.3Å; Q590-K592 PolarHBondContact O-N 3.45Å; Q590-L593 PolarHBondContact O-N 2.86Å; Q590-Q594 PolarHBondContact O-N 3.5Å
591	H	89	Confident	91.1	Very high	109 Å²	109	37.1 Å²	37.1	51%	0.505	20%	0.195	S	C	.	.	H	α-helix	trans	-67.9	-34.2	-179.7	67.3	-95.8	0	0	0	111.6	D588 Q594 A595	D588-H591 VanDerWaalsContact CA-CE1 3.41Å; D588-H591 WeakPolarHBondContact CA-CE1 3.28Å; D588-H591 PolarHBondContact O-CE1 2.79Å; D588-H591 PolarHBondContact O-ND1 3.35Å; D588-H591 PolarHBondContact O-NE2 3.25Å; D588-H591 IonicContact OD1-CE1 3.91Å; H591-Q594 PolarHBondContact O-N 3.02Å; H591-A595 PolarHBondContact O-N 3.44Å
592	K	93	Very high	90.8	Very high	40 Å²	40	39.8 Å²	39.8	17%	0.174	20%	0.204	C	C	.	.	H	α-helix	trans	-69.6	-41.4	176.3	-63.8	172.6	-175.4	179.8	0	112	N372 F373 S376 D588 S589 Q590 Q594 A595 L596	N372-K592 HydrophobicContact CB-CD 4.47Å; N372-K592 WeakPolarHBondContact O-CD 3.49Å; N372-K592 PolarHBondContact O-NZ 3.36Å; F373-K592 HydrophobicContact CB-CB 4.32Å; F373-K592 HydrophobicContact CD2-CB 4.45Å; S376-K592 VanDerWaalsContact OG-CD 3.26Å; S376-K592 WeakPolarHBondContact OG-CD 3.43Å; S376-K592 PolarHBondContact OG-NZ 2.88Å; D588-K592 WeakPolarHBondContact O-CD 3.44Å; D588-K592 WeakPolarHBondContact O-CG 3.33Å; S589-K592 PolarHBondContact O-N 3.46Å; Q590-K592 VanDerWaalsContact C-N 3.3Å; Q590-K592 PolarHBondContact O-N 3.45Å; K592-Q594 VanDerWaalsContact C-N 3.3Å; K592-Q594 PolarHBondContact O-N 2.68Å; K592-A595 WeakPolarHBondContact O-CB 3.45Å; K592-A595 PolarHBondContact O-N 2.68Å; K592-L596 WeakPolarHBondContact O-CB 3.31Å; K592-L596 PolarHBondContact O-N 3.22Å
593	L	93.5	Very high	90.4	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-63.3	-39.1	173.8	-178.1	55	0	0	0	111.1	I91 L95 L102 M105 M106 F373 S589 Q590 L596 R597	I91-L593 HydrophobicContact CG2-CD1 3.82Å; L95-L593 HydrophobicContact CD1-CD1 4.05Å; L102-L593 HydrophobicContact CB-CD2 4.31Å; L102-L593 HydrophobicContact CD2-CD1 4.1Å; L102-L593 HydrophobicContact CD2-CD2 4.25Å; L102-L593 WeakPolarHBondContact O-CD2 3.44Å; M105-L593 HydrophobicContact CB-CD2 4.06Å; M105-L593 HydrophobicContact SD-CD2 4.4Å; M106-L593 HydrophobicContact CG-CD2 3.8Å; M106-L593 HydrophobicContact CG-CG 4.25Å; M106-L593 HydrophobicContact SD-CD2 4.4Å; M106-L593 HydrophobicContact SD-CG 4.38Å; F373-L593 HydrophobicContact CD2-CB 3.93Å; F373-L593 HydrophobicContact CE2-CB 3.84Å; F373-L593 HydrophobicContact CE2-CD1 4.38Å; F373-L593 HydrophobicContact CE2-CD2 4.32Å; F373-L593 HydrophobicContact CE2-CG 4.41Å; S589-L593 VanDerWaalsContact O-CB 3.23Å; S589-L593 WeakPolarHBondContact O-CB 3.22Å; S589-L593 PolarHBondContact O-N 3.39Å; Q590-L593 PolarHBondContact O-N 2.86Å; L593-L596 HydrophobicContact CD1-CD2 4.43Å; L593-L596 WeakPolarHBondContact O-CB 3.29Å; L593-L596 PolarHBondContact O-N 3.06Å; L593-R597 WeakPolarHBondContact O-CG 3.27Å; L593-R597 PolarHBondContact O-N 3Å
594	Q	91.2	Very high	90.1	Very high	112 Å²	112	45.8 Å²	45.8	52%	0.523	23%	0.23	S	C	.	.	H	α-helix	trans	-67.5	-37.5	175.6	-171.7	154.9	12	0	0	112.9	M106 Q590 H591 K592 L596 S598	M106-Q594 HydrophobicContact CE-CB 4.09Å; M106-Q594 HydrophobicContact CE-CG 4.2Å; Q590-Q594 PolarHBondContact O-N 3.5Å; H591-Q594 PolarHBondContact O-N 3.02Å; K592-Q594 VanDerWaalsContact C-N 3.3Å; K592-Q594 PolarHBondContact O-N 2.68Å; Q594-L596 VanDerWaalsContact C-N 3.35Å; Q594-S598 WeakPolarHBondContact O-CB 3.42Å; Q594-S598 PolarHBondContact O-N 3.44Å; Q594-S598 PolarHBondContact O-OG 3.39Å
595	A	90.8	Very high	89.7	Confident	41 Å²	41	48.1 Å²	48.1	34%	0.339	25%	0.25	S	C	.	.	H	α-helix	trans	-61.2	-45.5	171.2	0	0	0	0	0	110.9	H591 K592 R597 S598 M599	H591-A595 PolarHBondContact O-N 3.44Å; K592-A595 WeakPolarHBondContact O-CB 3.45Å; K592-A595 PolarHBondContact O-N 2.68Å; A595-R597 PolarHBondContact O-N 2.96Å; A595-S598 WeakPolarHBondContact O-CB 3.5Å; A595-S598 PolarHBondContact O-N 3.42Å; A595-S598 VanDerWaalsContact O-N 3.17Å; A595-M599 PolarHBondContact O-N 2.96Å
596	L	91.8	Very high	89.3	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59.6	-46.7	178.1	-174.9	63.1	0	0	0	112.3	I91 L95 F366 D369 I370 K592 L593 Q594 S598 M599 A600	I91-L596 HydrophobicContact CB-CD2 4.47Å; I91-L596 HydrophobicContact CD1-CD2 4.49Å; I91-L596 HydrophobicContact CD1-CG 4.02Å; I91-L596 HydrophobicContact CG1-CD2 4.15Å; I91-L596 HydrophobicContact CG1-CG 4.03Å; I91-L596 HydrophobicContact CG2-CD2 3.63Å; I91-L596 HydrophobicContact CG2-CG 4.32Å; L95-L596 HydrophobicContact CD1-CD2 4.01Å; F366-L596 HydrophobicContact CD2-CD1 3.54Å; F366-L596 HydrophobicContact CE2-CD1 3.27Å; F366-L596 HydrophobicContact CE2-CG 4.06Å; F366-L596 HydrophobicContact CG-CD1 4.45Å; F366-L596 HydrophobicContact CZ-CD1 4.01Å; D369-L596 HydrophobicContact CB-CB 4.47Å; D369-L596 HydrophobicContact CB-CD1 3.9Å; I370-L596 HydrophobicContact CD1-CD1 4.39Å; I370-L596 HydrophobicContact CG1-CD1 3.48Å; I370-L596 VanDerWaalsContact CG1-CD1 3.48Å; I370-L596 HydrophobicContact CG1-CD2 4.07Å; I370-L596 HydrophobicContact CG1-CG 4.44Å; K592-L596 WeakPolarHBondContact O-CB 3.31Å; K592-L596 PolarHBondContact O-N 3.22Å; L593-L596 HydrophobicContact CD1-CD2 4.43Å; L593-L596 WeakPolarHBondContact O-CB 3.29Å; L593-L596 PolarHBondContact O-N 3.06Å; Q594-L596 VanDerWaalsContact C-N 3.35Å; L596-S598 PolarHBondContact O-N 3.33Å; L596-M599 PolarHBondContact O-N 2.69Å; L596-A600 PolarHBondContact O-N 2.75Å
597	R	91.5	Very high	89	Confident	44 Å²	44	55.9 Å²	55.9	17%	0.166	29%	0.291	C	S	.	.	H	α-helix	trans	-61.7	-42.6	174.4	-69.7	-179.3	81.5	-174.1	5	112.1	D88 I91 M106 L593 A595 M599 A600 L601	D88-R597 IonicContact OD1-CZ 3.82Å; D88-R597 VanDerWaalsContact OD1-CZ 3.24Å; D88-R597 IonicContact OD1-NE 3.74Å; D88-R597 PolarHBondContact OD1-NE 3.43Å; D88-R597 IonicContact OD1-NH2 2.66Å; D88-R597 PolarHBondContact OD1-NH2 3.45Å; D88-R597 IonicContact OD2-CZ 2.67Å; D88-R597 IonicContact OD2-NE 2.75Å; D88-R597 IonicContact OD2-NH2 2.66Å; D88-R597 PolarHBondContact OD2-NH2 3.01Å; I91-R597 HydrophobicContact CD1-CB 4.23Å; I91-R597 HydrophobicContact CD1-CG 3.65Å; M106-R597 PolarHBondContact SD-NH1 2.92Å; L593-R597 WeakPolarHBondContact O-CG 3.27Å; L593-R597 PolarHBondContact O-N 3Å; A595-R597 PolarHBondContact O-N 2.96Å; R597-M599 VanDerWaalsContact C-N 3.27Å; R597-M599 PolarHBondContact O-N 3.48Å; R597-A600 PolarHBondContact O-N 2.95Å; R597-L601 WeakPolarHBondContact O-CB 3.31Å; R597-L601 WeakPolarHBondContact O-CG 3.37Å; R597-L601 PolarHBondContact O-N 3.45Å
598	S	90.8	Very high	88.8	Confident	53 Å²	53	56.1 Å²	56.1	37%	0.371	30%	0.298	S	S	.	.	H	α-helix	trans	-62.8	-37.1	177.3	-59	0	0	0	0	111.7	Q594 A595 L596 K602	Q594-S598 WeakPolarHBondContact O-CB 3.42Å; Q594-S598 PolarHBondContact O-N 3.44Å; Q594-S598 PolarHBondContact O-OG 3.39Å; A595-S598 WeakPolarHBondContact O-CB 3.5Å; A595-S598 PolarHBondContact O-N 3.42Å; A595-S598 VanDerWaalsContact O-N 3.17Å; L596-S598 PolarHBondContact O-N 3.33Å; S598-K602 VanDerWaalsContact O-CG 3.3Å; S598-K602 WeakPolarHBondContact O-CG 3.49Å; S598-K602 PolarHBondContact O-N 3.04Å; S598-K602 VanDerWaalsContact O-N 3.13Å
599	M	88.5	Confident	88.8	Confident	26 Å²	26	59 Å²	59	13%	0.128	30%	0.304	C	S	.	.	H	α-helix	trans	-69.5	-46.7	176.9	-170.9	59.2	-138.5	0	0	111.4	F366 A595 L596 R597 L601 K602 M603	F366-M599 HydrophobicContact CB-CG 4.11Å; F366-M599 HydrophobicContact CD2-CB 4.23Å; F366-M599 HydrophobicContact CD2-CG 4.04Å; A595-M599 PolarHBondContact O-N 2.96Å; L596-M599 PolarHBondContact O-N 2.69Å; R597-M599 VanDerWaalsContact C-N 3.27Å; R597-M599 PolarHBondContact O-N 3.48Å; M599-L601 VanDerWaalsContact C-N 3.3Å; M599-L601 PolarHBondContact O-N 2.9Å; M599-K602 WeakPolarHBondContact O-CB 3.12Å; M599-K602 PolarHBondContact O-N 3.22Å; M599-K602 VanDerWaalsContact O-N 3.08Å; M599-K602 HydrophobicContact SD-CD 4.39Å; M599-M603 HydrophobicContact CE-CG 4.01Å; M599-M603 WeakPolarHBondContact O-CG 3.3Å; M599-M603 PolarHBondContact O-N 3.14Å; M599-M603 VanDerWaalsContact O-N 3.16Å
600	A	89.3	Confident	88.8	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-58.2	-40.8	175.2	0	0	0	0	0	112.3	F80 I91 F366 L596 R597 K602 M603	F80-A600 HydrophobicContact CE1-CB 4.41Å; F80-A600 HydrophobicContact CZ-CB 4.43Å; I91-A600 HydrophobicContact CD1-CB 3.96Å; F366-A600 HydrophobicContact CE2-CB 3.95Å; L596-A600 PolarHBondContact O-N 2.75Å; R597-A600 PolarHBondContact O-N 2.95Å; A600-K602 PolarHBondContact O-N 3.09Å; A600-M603 WeakPolarHBondContact O-CB 3.43Å; A600-M603 PolarHBondContact O-N 3.23Å
601	L	87.3	Confident	88.7	Confident	105 Å²	105	60.7 Å²	60.7	55%	0.55	31%	0.312	S	S	.	.	H	α-helix	trans	-65.6	-34.7	175.4	-72.9	172	0	0	0	113.1	R597 M599 M603 K604	R597-L601 WeakPolarHBondContact O-CB 3.31Å; R597-L601 WeakPolarHBondContact O-CG 3.37Å; R597-L601 PolarHBondContact O-N 3.45Å; M599-L601 VanDerWaalsContact C-N 3.3Å; M599-L601 PolarHBondContact O-N 2.9Å; L601-M603 VanDerWaalsContact C-N 3.27Å; L601-M603 PolarHBondContact O-N 3.2Å; L601-K604 WeakPolarHBondContact O-CB 3.25Å; L601-K604 PolarHBondContact O-N 2.63Å
602	K	87.6	Confident	88.7	Confident	136 Å²	136	59.3 Å²	59.3	59%	0.591	31%	0.307	S	S	*	.	H	α-helix	trans	-65.6	-32.1	174.5	-74.7	169.4	-175.1	174.3	0	111.9	S598 M599 A600 K604 S605	S598-K602 VanDerWaalsContact O-CG 3.3Å; S598-K602 WeakPolarHBondContact O-CG 3.49Å; S598-K602 PolarHBondContact O-N 3.04Å; S598-K602 VanDerWaalsContact O-N 3.13Å; M599-K602 WeakPolarHBondContact O-CB 3.12Å; M599-K602 PolarHBondContact O-N 3.22Å; M599-K602 VanDerWaalsContact O-N 3.08Å; M599-K602 HydrophobicContact SD-CD 4.39Å; A600-K602 PolarHBondContact O-N 3.09Å; K602-K604 PolarHBondContact O-N 3.14Å; K602-S605 PolarHBondContact O-N 3.26Å
603	M	86.4	Confident	88.6	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-63.2	-28.6	177.9	-65.3	-179.4	72.5	0	0	112.6	E77 F80 F363 F366 M599 A600 L601 S605 V606	E77-M603 WeakPolarHBondContact OE2-CE 3.46Å; F80-M603 HydrophobicContact CB-CB 3.98Å; F80-M603 HydrophobicContact CD2-CB 4.17Å; F80-M603 HydrophobicContact CD2-CE 3.67Å; F80-M603 HydrophobicContact CD2-SD 3.76Å; F80-M603 HydrophobicContact CE2-CE 4.14Å; F80-M603 HydrophobicContact CE2-SD 3.9Å; F80-M603 HydrophobicContact CG-CB 4.29Å; F363-M603 HydrophobicContact CD1-CE 3.86Å; F363-M603 HydrophobicContact CD2-CE 4.35Å; F363-M603 HydrophobicContact CE1-CE 3.51Å; F363-M603 HydrophobicContact CE1-SD 4.46Å; F363-M603 HydrophobicContact CE2-CE 4.04Å; F363-M603 HydrophobicContact CG-CE 4.27Å; F363-M603 HydrophobicContact CZ-CE 3.61Å; F366-M603 HydrophobicContact CB-SD 4.39Å; F366-M603 HydrophobicContact CD2-SD 4.48Å; F366-M603 HydrophobicContact CG-SD 4.26Å; M599-M603 HydrophobicContact CE-CG 4.01Å; M599-M603 WeakPolarHBondContact O-CG 3.3Å; M599-M603 PolarHBondContact O-N 3.14Å; M599-M603 VanDerWaalsContact O-N 3.16Å; A600-M603 WeakPolarHBondContact O-CB 3.43Å; A600-M603 PolarHBondContact O-N 3.23Å; L601-M603 VanDerWaalsContact C-N 3.27Å; L601-M603 PolarHBondContact O-N 3.2Å; M603-S605 PolarHBondContact O-N 3.2Å; M603-V606 WeakPolarHBondContact O-CB 3.37Å; M603-V606 WeakPolarHBondContact O-CG2 3.44Å; M603-V606 PolarHBondContact O-N 3.25Å
604	K	85.1	Confident	88.6	Confident	125 Å²	125	57.7 Å²	57.7	54%	0.543	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-24.8	171.3	-173.2	173	-178.8	173.1	0	113.9	F80 L601 K602	F80-K604 VanDerWaalsContact O-CA 3.32Å; F80-K604 WeakPolarHBondContact O-CA 3.17Å; F80-K604 WeakPolarHBondContact O-CB 3.36Å; L601-K604 WeakPolarHBondContact O-CB 3.25Å; L601-K604 PolarHBondContact O-N 2.63Å; K602-K604 PolarHBondContact O-N 3.14Å
605	S	84.3	Confident	88.5	Confident	95 Å²	95	57 Å²	57	66%	0.664	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	8.3	-177.6	-53.2	0	0	0	0	113	K602 M603 D607	K602-S605 PolarHBondContact O-N 3.26Å; M603-S605 PolarHBondContact O-N 3.2Å; S605-D607 PolarHBondContact O-N 3Å
606	V	84.3	Confident	88.3	Confident	31 Å²	31	58.7 Å²	58.7	19%	0.188	30%	0.303	C	S	.	.			trans	-68.3	116.4	176.3	174.9	0	0	0	0	108.9	I81 M603 A611	I81-V606 HydrophobicContact CD1-CB 4.48Å; I81-V606 HydrophobicContact CG1-CB 4.38Å; M603-V606 WeakPolarHBondContact O-CB 3.37Å; M603-V606 WeakPolarHBondContact O-CG2 3.44Å; M603-V606 PolarHBondContact O-N 3.25Å; V606-A611 HydrophobicContact CG1-CB 3.5Å
607	D	82.9	Confident	88.3	Confident	138 Å²	138	59 Å²	59	74%	0.738	31%	0.305	S	S	*	.			trans	-113.6	7.8	-178.7	65.8	-12.5	0	0	0	112.9	S605 L612	S605-D607 PolarHBondContact O-N 3Å; D607-L612 WeakPolarHBondContact O-CD1 3.28Å
608	G	86.1	Confident	88.5	Confident	27 Å²	27	57.1 Å²	57.1	28%	0.278	30%	0.298	S	S	.	.			trans	-58	136.3	176.3	0	0	0	0	0	111.5	E610 A611 L612	G608-E610 PolarHBondContact O-N 2.96Å; G608-A611 PolarHBondContact O-N 3.5Å; G608-A611 VanDerWaalsContact O-N 3.14Å; G608-L612 WeakPolarHBondContact O-CG 3.43Å; G608-L612 PolarHBondContact O-N 3.34Å
609	R	88.8	Confident	88.3	Confident	135 Å²	135	59.4 Å²	59.4	51%	0.509	31%	0.312	S	S	.	.	H	α-helix	trans	-54.9	-41.8	-176.5	-177.5	-178.6	-177.7	-157.7	-4.5	112	A613 T773 L774	R609-A613 VanDerWaalsContact O-CB 3.3Å; R609-A613 WeakPolarHBondContact O-CB 3.23Å; R609-A613 PolarHBondContact O-N 3.18Å; R609-T773 PolarHBondContact NH2-O 3.25Å; R609-L774 HydrophobicContact CG-CD2 4.32Å; R609-L774 PolarHBondContact NH1-O 3.01Å; R609-L774 VanDerWaalsContact NH2-C 3.33Å; R609-L774 PolarHBondContact NH2-O 3.21Å
610	E	90.6	Very high	88.4	Confident	56 Å²	56	63.4 Å²	63.4	26%	0.262	33%	0.334	S	S	.	.	H	α-helix	trans	-60.1	-51	179.1	-65.2	75.7	-168	0	0	110.9	S355 T358 A359 G608 A613 Y770 L774	S355-E610 WeakPolarHBondContact O-CB 3.2Å; T358-E610 HydrophobicContact CG2-CB 4.47Å; T358-E610 HydrophobicContact CG2-CG 4.09Å; A359-E610 HydrophobicContact CB-CB 4.16Å; G608-E610 PolarHBondContact O-N 2.96Å; E610-A613 PolarHBondContact O-N 3.44Å; E610-Y770 WeakPolarHBondContact O-CE2 3.36Å; E610-Y770 PolarHBondContact O-OH 3.41Å; E610-Y770 VanDerWaalsContact O-OH 3.09Å; E610-L774 HydrophobicContact CG-CD2 4.41Å
611	A	89.3	Confident	88.6	Confident	2 Å²	2	63.8 Å²	63.8	2%	0.017	34%	0.337	C	S	.	.	H	α-helix	trans	-65.6	-43.2	179.3	0	0	0	0	0	112.4	I81 A359 V606 G608 A613 L614	I81-A611 HydrophobicContact CD1-CB 3.8Å; A359-A611 HydrophobicContact CB-CB 4.36Å; V606-A611 HydrophobicContact CG1-CB 3.5Å; G608-A611 PolarHBondContact O-N 3.5Å; G608-A611 VanDerWaalsContact O-N 3.14Å; A611-A613 VanDerWaalsContact C-N 3.3Å; A611-A613 PolarHBondContact O-N 3.26Å; A611-L614 VanDerWaalsContact O-CB 3.32Å; A611-L614 WeakPolarHBondContact O-CB 3.3Å; A611-L614 PolarHBondContact O-N 3.34Å
612	L	89	Confident	88.7	Confident	79 Å²	79	62.4 Å²	62.4	41%	0.414	33%	0.327	S	S	.	.	H	α-helix	trans	-65	-33	178.3	-67.1	-179.2	0	0	0	113	I81 D607 G608 L614 K615	I81-L612 HydrophobicContact CG2-CD2 4.08Å; D607-L612 WeakPolarHBondContact O-CD1 3.28Å; G608-L612 WeakPolarHBondContact O-CG 3.43Å; G608-L612 PolarHBondContact O-N 3.34Å; L612-L614 PolarHBondContact O-N 3.09Å; L612-K615 PolarHBondContact O-N 2.88Å
613	A	92.1	Very high	88.9	Confident	6 Å²	6	62.4 Å²	62.4	5%	0.05	33%	0.327	C	S	.	.	H	α-helix	trans	-68.2	-23	178	0	0	0	0	0	112.9	R609 E610 A611 T616 S617 Y770 T773 L774	R609-A613 VanDerWaalsContact O-CB 3.3Å; R609-A613 WeakPolarHBondContact O-CB 3.23Å; R609-A613 PolarHBondContact O-N 3.18Å; E610-A613 PolarHBondContact O-N 3.44Å; A611-A613 VanDerWaalsContact C-N 3.3Å; A611-A613 PolarHBondContact O-N 3.26Å; A613-T616 PolarHBondContact O-OG1 3.41Å; A613-T616 VanDerWaalsContact O-OG1 3.11Å; A613-S617 VanDerWaalsContact O-CB 3.24Å; A613-S617 WeakPolarHBondContact O-CB 3.35Å; A613-S617 PolarHBondContact O-N 3.03Å; A613-S617 PolarHBondContact O-OG 2.93Å; A613-Y770 HydrophobicContact CB-CD2 3.89Å; A613-Y770 HydrophobicContact CB-CE2 3.6Å; A613-T773 HydrophobicContact CB-CG2 3.81Å; A613-L774 HydrophobicContact CB-CD2 3.75Å; A613-L774 HydrophobicContact CB-CG 4.2Å
614	L	93.1	Very high	89.2	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-59.5	-48.7	175.4	-62.2	174.6	0	0	0	110.6	I74 E77 I78 L356 A359 A611 L612 T616 S617 F618 F766 Y770	I74-L614 HydrophobicContact CG1-CD2 4.45Å; I74-L614 HydrophobicContact CG2-CB 4.26Å; I74-L614 HydrophobicContact CG2-CD1 4.38Å; I74-L614 HydrophobicContact CG2-CD2 4.04Å; I74-L614 HydrophobicContact CG2-CG 4.46Å; E77-L614 HydrophobicContact CB-CD1 4.15Å; E77-L614 HydrophobicContact CG-CD1 3.86Å; I78-L614 HydrophobicContact CD1-CB 4.02Å; I78-L614 HydrophobicContact CG1-CB 3.77Å; L356-L614 HydrophobicContact CD2-CD2 3.74Å; A359-L614 HydrophobicContact CB-CD1 4.06Å; A611-L614 VanDerWaalsContact O-CB 3.32Å; A611-L614 WeakPolarHBondContact O-CB 3.3Å; A611-L614 PolarHBondContact O-N 3.34Å; L612-L614 PolarHBondContact O-N 3.09Å; L614-T616 PolarHBondContact O-N 2.92Å; L614-S617 CarbonylContact O-C 3.49Å; L614-S617 PolarHBondContact O-N 2.69Å; L614-F618 PolarHBondContact O-N 3.38Å; L614-F766 HydrophobicContact CD2-CE2 4.15Å; L614-F766 HydrophobicContact CD2-CZ 3.88Å; L614-Y770 HydrophobicContact CD2-CD2 3.95Å; L614-Y770 HydrophobicContact CD2-CE1 4.32Å; L614-Y770 HydrophobicContact CD2-CE2 3.42Å; L614-Y770 VanDerWaalsContact CD2-CE2 3.42Å; L614-Y770 HydrophobicContact CG-CE2 3.93Å
615	K	88.5	Confident	89.6	Confident	97 Å²	97	57.4 Å²	57.4	42%	0.422	31%	0.307	S	S	.	.	H	α-helix	trans	-57	-48.9	-177.9	-178.7	179	-176.1	175.5	0	112.5	I78 D82 L612 S617	I78-K615 HydrophobicContact CG2-CB 4.4Å; I78-K615 HydrophobicContact CG2-CG 4.38Å; D82-K615 HydrophobicContact CB-CD 4.12Å; D82-K615 IonicContact OD2-NZ 3.41Å; L612-K615 PolarHBondContact O-N 2.88Å; K615-S617 PolarHBondContact O-N 3.32Å
616	T	87.5	Confident	90	Very high	78 Å²	78	56.1 Å²	56.1	48%	0.479	29%	0.289	S	S	.	.	H	α-helix	trans	-69	-25.2	-179.7	51.1	0	0	0	0	112.3	A613 L614 K769	A613-T616 PolarHBondContact O-OG1 3.41Å; A613-T616 VanDerWaalsContact O-OG1 3.11Å; L614-T616 PolarHBondContact O-N 2.92Å; T616-K769 WeakPolarHBondContact O-CE 3.27Å; T616-K769 PolarHBondContact O-NZ 3.08Å
617	S	92.5	Very high	90.4	Very high	5 Å²	5	55.7 Å²	55.7	4%	0.035	29%	0.286	C	S	.	.	H	α-helix	trans	-89.1	-21	-175.3	-54.4	0	0	0	0	113	A613 L614 K615 Y770	A613-S617 VanDerWaalsContact O-CB 3.24Å; A613-S617 WeakPolarHBondContact O-CB 3.35Å; A613-S617 PolarHBondContact O-N 3.03Å; A613-S617 PolarHBondContact O-OG 2.93Å; L614-S617 CarbonylContact O-C 3.49Å; L614-S617 PolarHBondContact O-N 2.69Å; K615-S617 PolarHBondContact O-N 3.32Å; S617-Y770 VanDerWaalsContact OG-CA 3.26Å; S617-Y770 WeakPolarHBondContact OG-CA 3.48Å; S617-Y770 PolarHBondContact OG-N 2.87Å
618	F	94	Very high	90.8	Very high	5 Å²	5	49.1 Å²	49.1	2%	0.022	25%	0.251	C	S	.	.			trans	-138.9	71.9	-171.4	-151	-159.3	0	0	0	114.1	V71 I74 I78 L614 D620 S621 I624 L763 F766	V71-F618 HydrophobicContact CG1-CE1 3.96Å; V71-F618 HydrophobicContact CG1-CZ 4.1Å; I74-F618 HydrophobicContact CG2-CD1 3.71Å; I74-F618 HydrophobicContact CG2-CE1 4.35Å; I78-F618 HydrophobicContact CD1-CB 3.91Å; I78-F618 HydrophobicContact CD1-CD1 4.41Å; L614-F618 PolarHBondContact O-N 3.38Å; F618-D620 PolarHBondContact O-N 3.07Å; F618-S621 WeakPolarHBondContact O-CB 3.4Å; F618-S621 PolarHBondContact O-N 3.21Å; F618-I624 HydrophobicContact CD2-CD1 4.15Å; F618-I624 HydrophobicContact CE2-CB 4.24Å; F618-I624 HydrophobicContact CE2-CD1 3.41Å; F618-I624 VanDerWaalsContact CE2-CD1 3.41Å; F618-I624 HydrophobicContact CE2-CG1 4.42Å; F618-I624 HydrophobicContact CE2-CG2 4.03Å; F618-I624 HydrophobicContact CZ-CB 3.95Å; F618-I624 HydrophobicContact CZ-CD1 4.02Å; F618-I624 HydrophobicContact CZ-CG2 3.6Å; F618-L763 HydrophobicContact CZ-CD1 4.16Å; F618-F766 HydrophobicContact CB-CD2 3.53Å; F618-F766 HydrophobicContact CB-CE2 3.98Å; F618-F766 HydrophobicContact CB-CG 4.29Å; F618-F766 HydrophobicContact CD1-CD2 4.23Å; F618-F766 HydrophobicContact CD1-CG 4.38Å; F618-F766 HydrophobicContact CD2-CB 3.74Å; F618-F766 HydrophobicContact CD2-CD2 4.19Å; F618-F766 HydrophobicContact CD2-CG 4.11Å; F618-F766 HydrophobicContact CE2-CB 4Å; F618-F766 HydrophobicContact CE2-CG 4.49Å; F618-F766 HydrophobicContact CG-CB 4.19Å; F618-F766 AromaticContact CG-CD2 3.77Å; F618-F766 HydrophobicContact CG-CD2 3.77Å; F618-F766 HydrophobicContact CG-CE2 4.39Å; F618-F766 HydrophobicContact CG-CG 4.04Å
619	P	87.6	Confident	91.1	Very high	102 Å²	102	47.9 Å²	47.9	66%	0.662	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-32.9	-172.7	25.6	-34.4	0	0	0	114.9
620	D	90.1	Very high	91.2	Very high	110 Å²	110	42.7 Å²	42.7	59%	0.588	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.9	28.6	-178.3	-60.2	-49.5	0	0	0	112.2	F618 Q622 K623 I624	F618-D620 PolarHBondContact O-N 3.07Å; D620-Q622 VanDerWaalsContact C-N 3.29Å; D620-Q622 PolarHBondContact O-N 3.33Å; D620-K623 PolarHBondContact O-N 3.15Å; D620-I624 HydrophobicContact CB-CD1 3.88Å; D620-I624 HydrophobicContact CB-CG1 4.36Å; D620-I624 WeakPolarHBondContact O-CD1 3.49Å; D620-I624 WeakPolarHBondContact O-CG1 3.4Å; D620-I624 PolarHBondContact O-N 3.39Å; D620-I624 VanDerWaalsContact O-N 3.12Å
621	S	93	Very high	91.2	Very high	8 Å²	8	40 Å²	40	6%	0.056	21%	0.207	C	C	.	.	H	α-helix	trans	-54.4	-42	-168.5	64.7	0	0	0	0	113.3	S75 F618 I624 A625	S75-S621 PolarHBondContact OG-OG 3.21Å; F618-S621 WeakPolarHBondContact O-CB 3.4Å; F618-S621 PolarHBondContact O-N 3.21Å; S621-I624 PolarHBondContact O-N 3.17Å; S621-A625 WeakPolarHBondContact O-CB 3.28Å; S621-A625 PolarHBondContact O-N 3.07Å
622	Q	91.1	Very high	91.3	Very high	75 Å²	75	40 Å²	40	35%	0.35	21%	0.207	S	C	.	.	H	α-helix	trans	-65.9	-46.2	-175.4	-172.2	-179.6	3.7	0	0	112.2	S75 L325 D620 I624 A625 F626	S75-Q622 WeakPolarHBondContact OG-CA 3.24Å; S75-Q622 PolarHBondContact OG-N 3.16Å; S75-Q622 VanDerWaalsContact OG-N 3.14Å; L325-Q622 HydrophobicContact CD2-CG 4.48Å; D620-Q622 VanDerWaalsContact C-N 3.29Å; D620-Q622 PolarHBondContact O-N 3.33Å; Q622-I624 VanDerWaalsContact C-N 3.35Å; Q622-A625 PolarHBondContact O-N 3.2Å; Q622-F626 WeakPolarHBondContact O-CB 3.39Å; Q622-F626 PolarHBondContact O-N 3.01Å
623	K	91.5	Very high	91.3	Very high	136 Å²	136	38.7 Å²	38.7	59%	0.591	20%	0.2	S	C	*	.	H	α-helix	trans	-63.6	-44.4	177	-174.8	-176.3	-176.4	-60	0	110.8	D620 A625 F626 D627	D620-K623 PolarHBondContact O-N 3.15Å; K623-A625 VanDerWaalsContact C-N 3.35Å; K623-F626 PolarHBondContact O-N 3.23Å; K623-D627 IonicContact NZ-OD1 3.93Å; K623-D627 IonicContact NZ-OD2 3.83Å; K623-D627 PolarHBondContact NZ-OD2 3.07Å; K623-D627 WeakPolarHBondContact O-CB 3Å; K623-D627 PolarHBondContact O-N 3.27Å
624	I	93.1	Very high	91.2	Very high	18 Å²	18	38.4 Å²	38.4	9%	0.092	20%	0.198	C	C	.	.	H	α-helix	trans	-65.4	-41.6	-178.4	-66.3	164.9	0	0	0	110.9	V71 F618 D620 S621 Q622 L628 S759 A762	V71-I624 HydrophobicContact CG1-CG2 4.44Å; F618-I624 HydrophobicContact CD2-CD1 4.15Å; F618-I624 HydrophobicContact CE2-CB 4.24Å; F618-I624 HydrophobicContact CE2-CD1 3.41Å; F618-I624 VanDerWaalsContact CE2-CD1 3.41Å; F618-I624 HydrophobicContact CE2-CG1 4.42Å; F618-I624 HydrophobicContact CE2-CG2 4.03Å; F618-I624 HydrophobicContact CZ-CB 3.95Å; F618-I624 HydrophobicContact CZ-CD1 4.02Å; F618-I624 HydrophobicContact CZ-CG2 3.6Å; D620-I624 HydrophobicContact CB-CD1 3.88Å; D620-I624 HydrophobicContact CB-CG1 4.36Å; D620-I624 WeakPolarHBondContact O-CD1 3.49Å; D620-I624 WeakPolarHBondContact O-CG1 3.4Å; D620-I624 PolarHBondContact O-N 3.39Å; D620-I624 VanDerWaalsContact O-N 3.12Å; S621-I624 PolarHBondContact O-N 3.17Å; Q622-I624 VanDerWaalsContact C-N 3.35Å; I624-L628 VanDerWaalsContact O-CB 3.25Å; I624-L628 WeakPolarHBondContact O-CB 3.31Å; I624-L628 PolarHBondContact O-N 3.01Å; I624-S759 PolarHBondContact O-OG 2.91Å; I624-A762 HydrophobicContact CD1-CB 3.54Å; I624-A762 HydrophobicContact CG1-CB 4.18Å; I624-A762 HydrophobicContact CG2-CB 4.46Å
625	A	93.1	Very high	91	Very high	3 Å²	3	38.4 Å²	38.4	3%	0.025	20%	0.198	C	C	.	.	H	α-helix	trans	-63.5	-43.8	175.9	0	0	0	0	0	111.5	V71 N72 S621 Q622 K623 G629	V71-A625 HydrophobicContact CG1-CB 3.84Å; N72-A625 WeakPolarHBondContact OD1-CB 3.44Å; S621-A625 WeakPolarHBondContact O-CB 3.28Å; S621-A625 PolarHBondContact O-N 3.07Å; Q622-A625 PolarHBondContact O-N 3.2Å; K623-A625 VanDerWaalsContact C-N 3.35Å; A625-G629 PolarHBondContact O-N 2.97Å
626	F	91.9	Very high	91	Very high	68 Å²	68	34.4 Å²	34.4	30%	0.298	18%	0.182	S	C	.	.	H	α-helix	trans	-59.9	-56.1	175.4	179.7	-93.9	0	0	0	112.2	I327 Q622 K623 L628 G629 L630	I327-F626 HydrophobicContact CD1-CD2 4.33Å; I327-F626 HydrophobicContact CD1-CE2 3.91Å; I327-F626 HydrophobicContact CD1-CZ 4.45Å; I327-F626 HydrophobicContact CG2-CB 4.44Å; I327-F626 HydrophobicContact CG2-CD2 3.88Å; I327-F626 HydrophobicContact CG2-CG 4.41Å; Q622-F626 WeakPolarHBondContact O-CB 3.39Å; Q622-F626 PolarHBondContact O-N 3.01Å; K623-F626 PolarHBondContact O-N 3.23Å; F626-L628 VanDerWaalsContact C-N 3.31Å; F626-L628 PolarHBondContact O-N 3.26Å; F626-G629 PolarHBondContact O-N 2.96Å; F626-L630 HydrophobicContact CE1-CD2 4.02Å; F626-L630 HydrophobicContact CZ-CD2 4.23Å; F626-L630 VanDerWaalsContact O-CB 3.29Å; F626-L630 WeakPolarHBondContact O-CB 3.4Å; F626-L630 PolarHBondContact O-N 2.86Å
627	D	92.2	Very high	91.1	Very high	21 Å²	21	31 Å²	31	11%	0.112	16%	0.161	C	C	.	.	H	α-helix	trans	-59	-43.2	-177.8	-67.5	-10.4	0	0	0	111	K623 A631 S759	K623-D627 IonicContact NZ-OD1 3.93Å; K623-D627 IonicContact NZ-OD2 3.83Å; K623-D627 PolarHBondContact NZ-OD2 3.07Å; K623-D627 WeakPolarHBondContact O-CB 3Å; K623-D627 PolarHBondContact O-N 3.27Å; D627-A631 WeakPolarHBondContact O-CB 3.49Å; D627-A631 PolarHBondContact O-N 3.28Å; D627-A631 VanDerWaalsContact O-N 3.17Å; D627-S759 WeakPolarHBondContact CB-OG 3.46Å
628	L	92.9	Very high	91	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-67.7	-47.5	177.9	-176.8	62.5	0	0	0	111.8	L67 V71 I624 F626 L630 A631 V632 F701 A756 L760	L67-L628 HydrophobicContact CD2-CD2 4.3Å; L67-L628 HydrophobicContact CG-CD2 4.19Å; V71-L628 HydrophobicContact CB-CD2 4.16Å; V71-L628 HydrophobicContact CG1-CD2 4.4Å; V71-L628 HydrophobicContact CG2-CD2 3.83Å; I624-L628 VanDerWaalsContact O-CB 3.25Å; I624-L628 WeakPolarHBondContact O-CB 3.31Å; I624-L628 PolarHBondContact O-N 3.01Å; F626-L628 VanDerWaalsContact C-N 3.31Å; F626-L628 PolarHBondContact O-N 3.26Å; L628-L630 PolarHBondContact O-N 3.46Å; L628-A631 PolarHBondContact O-N 3.5Å; L628-V632 HydrophobicContact CD1-CG2 4.31Å; L628-V632 VanDerWaalsContact O-CG2 3.3Å; L628-V632 WeakPolarHBondContact O-CG2 3.27Å; L628-V632 PolarHBondContact O-N 3.07Å; L628-F701 HydrophobicContact CD1-CZ 4.18Å; L628-A756 HydrophobicContact CD1-CB 4.17Å; L628-L760 HydrophobicContact CD1-CD2 4.15Å
629	G	91.6	Very high	90.8	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63.3	-41.4	-179.4	0	0	0	0	0	112.3	A625 F626 A631 V632 L633	A625-G629 PolarHBondContact O-N 2.97Å; F626-G629 PolarHBondContact O-N 2.96Å; G629-A631 PolarHBondContact O-N 2.84Å; G629-V632 PolarHBondContact O-N 3.1Å; G629-L633 WeakPolarHBondContact O-CB 3.28Å; G629-L633 PolarHBondContact O-N 3.15Å
630	L	90.1	Very high	90.9	Very high	26 Å²	26	32.6 Å²	32.6	14%	0.136	16%	0.157	C	C	.	.	H	α-helix	trans	-61.1	-45	176.2	-173.8	67.9	0	0	0	111.5	I327 F626 L628 L633 G634 Y751 D752	I327-L630 HydrophobicContact CD1-CB 3.78Å; I327-L630 HydrophobicContact CD1-CD1 3.46Å; I327-L630 VanDerWaalsContact CD1-CD1 3.46Å; I327-L630 HydrophobicContact CD1-CG 4.18Å; I327-L630 HydrophobicContact CG1-CB 4.38Å; F626-L630 HydrophobicContact CE1-CD2 4.02Å; F626-L630 HydrophobicContact CZ-CD2 4.23Å; F626-L630 VanDerWaalsContact O-CB 3.29Å; F626-L630 WeakPolarHBondContact O-CB 3.4Å; F626-L630 PolarHBondContact O-N 2.86Å; L628-L630 PolarHBondContact O-N 3.46Å; L630-L633 WeakPolarHBondContact O-CB 3.19Å; L630-L633 PolarHBondContact O-N 2.81Å; L630-G634 PolarHBondContact O-N 3.23Å; L630-Y751 HydrophobicContact CD1-CD1 4.12Å; L630-Y751 VanDerWaalsContact CG-O 3.28Å; L630-Y751 WeakPolarHBondContact CG-O 3.45Å; L630-D752 HydrophobicContact CD2-CB 4.31Å
631	A	91.7	Very high	91	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-65.1	-42	177.3	0	0	0	0	0	112.5	D627 L628 G629 L633 G634 V635 F701 A756	D627-A631 WeakPolarHBondContact O-CB 3.49Å; D627-A631 PolarHBondContact O-N 3.28Å; D627-A631 VanDerWaalsContact O-N 3.17Å; L628-A631 PolarHBondContact O-N 3.5Å; G629-A631 PolarHBondContact O-N 2.84Å; A631-L633 VanDerWaalsContact C-N 3.32Å; A631-L633 PolarHBondContact O-N 3.2Å; A631-G634 PolarHBondContact O-N 3.39Å; A631-G634 VanDerWaalsContact O-N 3.16Å; A631-V635 WeakPolarHBondContact O-CG2 3.45Å; A631-V635 PolarHBondContact O-N 3.24Å; A631-F701 HydrophobicContact CB-CD1 3.95Å; A631-F701 HydrophobicContact CB-CE1 3.78Å; A631-A756 HydrophobicContact CB-CB 3.6Å
632	V	91.2	Very high	90.9	Very high	2 Å²	2	28 Å²	28	1%	0.012	13%	0.132	C	C	.	.	H	α-helix	trans	-64.7	-37.8	176.5	171	0	0	0	0	111.4	M64 Q65 A68 L628 G629 G634 V635 S636 F701	M64-V632 HydrophobicContact CB-CG1 4.08Å; M64-V632 HydrophobicContact CB-CG2 3.86Å; M64-V632 HydrophobicContact CG-CG2 4.47Å; M64-V632 HydrophobicContact SD-CG2 4.29Å; Q65-V632 HydrophobicContact CB-CG1 4.46Å; Q65-V632 HydrophobicContact CG-CG1 3.8Å; A68-V632 HydrophobicContact CB-CB 4.14Å; A68-V632 HydrophobicContact CB-CG1 4.21Å; A68-V632 HydrophobicContact CB-CG2 4.08Å; L628-V632 HydrophobicContact CD1-CG2 4.31Å; L628-V632 VanDerWaalsContact O-CG2 3.3Å; L628-V632 WeakPolarHBondContact O-CG2 3.27Å; L628-V632 PolarHBondContact O-N 3.07Å; G629-V632 PolarHBondContact O-N 3.1Å; V632-G634 VanDerWaalsContact C-N 3.31Å; V632-G634 PolarHBondContact O-N 3.49Å; V632-V635 PolarHBondContact O-N 3.24Å; V632-S636 WeakPolarHBondContact O-CB 3.24Å; V632-S636 PolarHBondContact O-N 3.43Å; V632-F701 HydrophobicContact CG2-CE1 4.11Å; V632-F701 HydrophobicContact CG2-CZ 3.93Å
633	L	87.8	Confident	90.8	Very high	51 Å²	51	28.4 Å²	28.4	27%	0.267	14%	0.136	S	C	.	.	H	α-helix	trans	-59.4	-44.2	171.6	-176.5	64	0	0	0	110.8	G629 L630 A631 V635 S636 T637 Y751	G629-L633 WeakPolarHBondContact O-CB 3.28Å; G629-L633 PolarHBondContact O-N 3.15Å; L630-L633 WeakPolarHBondContact O-CB 3.19Å; L630-L633 PolarHBondContact O-N 2.81Å; A631-L633 VanDerWaalsContact C-N 3.32Å; A631-L633 PolarHBondContact O-N 3.2Å; L633-V635 PolarHBondContact O-N 2.9Å; L633-S636 WeakPolarHBondContact O-CB 3.49Å; L633-S636 PolarHBondContact O-N 3.5Å; L633-T637 PolarHBondContact O-N 3.48Å; L633-T637 PolarHBondContact O-OG1 3.38Å; L633-T637 VanDerWaalsContact O-OG1 3.06Å; L633-Y751 HydrophobicContact CB-CD1 4.43Å; L633-Y751 HydrophobicContact CD2-CD1 4.26Å; L633-Y751 HydrophobicContact CD2-CE1 3.9Å; L633-Y751 HydrophobicContact CG-CD1 4.25Å; L633-Y751 HydrophobicContact CG-CE1 3.91Å
634	G	89.9	Confident	90.9	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-57.4	-47.1	174.5	0	0	0	0	0	113.3	L630 A631 V632 S636 T637 I638	L630-G634 PolarHBondContact O-N 3.23Å; A631-G634 PolarHBondContact O-N 3.39Å; A631-G634 VanDerWaalsContact O-N 3.16Å; V632-G634 VanDerWaalsContact C-N 3.31Å; V632-G634 PolarHBondContact O-N 3.49Å; G634-S636 VanDerWaalsContact C-N 3.34Å; G634-S636 PolarHBondContact O-N 3.3Å; G634-T637 PolarHBondContact O-N 3.17Å; G634-I638 WeakPolarHBondContact O-CG1 3.43Å; G634-I638 PolarHBondContact O-N 3.23Å
635	V	90.5	Very high	90.9	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.006	13%	0.127	C	C	.	.	H	α-helix	trans	-65.6	-36.6	176.5	-175	0	0	0	0	111.7	V61 M64 A631 V632 L633 I638 K639 F701 A704 I753	V61-V635 HydrophobicContact CG2-CG1 3.83Å; M64-V635 HydrophobicContact CE-CG1 4.2Å; A631-V635 WeakPolarHBondContact O-CG2 3.45Å; A631-V635 PolarHBondContact O-N 3.24Å; V632-V635 PolarHBondContact O-N 3.24Å; L633-V635 PolarHBondContact O-N 2.9Å; V635-I638 WeakPolarHBondContact O-CB 3.47Å; V635-I638 PolarHBondContact O-N 3.25Å; V635-K639 PolarHBondContact O-N 2.89Å; V635-F701 HydrophobicContact CG2-CD1 4.04Å; V635-F701 HydrophobicContact CG2-CE1 4.05Å; V635-A704 HydrophobicContact CG2-CB 4.11Å; V635-I753 HydrophobicContact CG2-CG2 4.21Å
636	S	88.6	Confident	90.9	Very high	13 Å²	13	30.7 Å²	30.7	9%	0.091	16%	0.157	C	C	.	.	H	α-helix	trans	-65.3	-39.4	174.3	-171.4	0	0	0	0	111.8	V632 L633 G634 K639 K640	V632-S636 WeakPolarHBondContact O-CB 3.24Å; V632-S636 PolarHBondContact O-N 3.43Å; L633-S636 WeakPolarHBondContact O-CB 3.49Å; L633-S636 PolarHBondContact O-N 3.5Å; G634-S636 VanDerWaalsContact C-N 3.34Å; G634-S636 PolarHBondContact O-N 3.3Å; S636-K639 WeakPolarHBondContact O-CB 3.49Å; S636-K639 PolarHBondContact O-N 3.48Å; S636-K640 WeakPolarHBondContact O-CG 3.16Å; S636-K640 PolarHBondContact O-N 3.14Å
637	T	88.5	Confident	91	Very high	5 Å²	5	32.3 Å²	32.3	3%	0.031	17%	0.165	C	C	.	.	H	α-helix	trans	-62.9	-42.5	172.9	-58.2	0	0	0	0	111.3	L633 G634 K639 K640 V641 L744 F748 Y751	L633-T637 PolarHBondContact O-N 3.48Å; L633-T637 PolarHBondContact O-OG1 3.38Å; L633-T637 VanDerWaalsContact O-OG1 3.06Å; G634-T637 PolarHBondContact O-N 3.17Å; T637-K639 VanDerWaalsContact C-N 3.28Å; T637-K639 PolarHBondContact O-N 3.44Å; T637-K640 WeakPolarHBondContact O-CB 3.22Å; T637-K640 PolarHBondContact O-N 3.11Å; T637-K640 VanDerWaalsContact O-N 3.09Å; T637-V641 WeakPolarHBondContact O-CG2 3.5Å; T637-V641 PolarHBondContact O-N 3.49Å; T637-L744 WeakPolarHBondContact CG2-O 3.44Å; T637-F748 HydrophobicContact CG2-CE1 3.93Å; T637-Y751 PolarHBondContact OG1-OH 2.69Å
638	I	90.7	Very high	91	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-56.7	-43.8	172.2	-69.2	156.2	0	0	0	110.9	G634 V635 K640 V641 I642 I686 F689 A704 I707 F748 I753	G634-I638 WeakPolarHBondContact O-CG1 3.43Å; G634-I638 PolarHBondContact O-N 3.23Å; V635-I638 WeakPolarHBondContact O-CB 3.47Å; V635-I638 PolarHBondContact O-N 3.25Å; I638-K640 PolarHBondContact O-N 3.26Å; I638-V641 WeakPolarHBondContact O-CB 3.24Å; I638-V641 PolarHBondContact O-N 3.42Å; I638-I642 HydrophobicContact CG2-CD1 4.23Å; I638-I642 WeakPolarHBondContact O-CG1 3.38Å; I638-I642 PolarHBondContact O-N 2.73Å; I638-I686 HydrophobicContact CG2-CG1 4.35Å; I638-F689 HydrophobicContact CG2-CD1 4.48Å; I638-F689 HydrophobicContact CG2-CE1 4.36Å; I638-A704 HydrophobicContact CD1-CB 3.92Å; I638-I707 HydrophobicContact CD1-CD1 3.63Å; I638-I707 HydrophobicContact CG1-CD1 3.98Å; I638-I707 HydrophobicContact CG2-CD1 3.76Å; I638-F748 HydrophobicContact CG1-CD1 4.12Å; I638-F748 HydrophobicContact CG1-CE1 3.73Å; I638-F748 HydrophobicContact CG1-CE2 4.28Å; I638-F748 HydrophobicContact CG1-CZ 3.83Å; I638-I753 HydrophobicContact CD1-CD1 4Å
639	K	89.5	Confident	91.1	Very high	47 Å²	47	32.7 Å²	32.7	20%	0.204	17%	0.171	C	C	.	.	H	α-helix	trans	-60.4	-44.2	174.8	-167.8	-156.6	174.4	-53.8	0	111.9	V61 V635 S636 T637 V641 I642 D643	V61-K639 HydrophobicContact CG1-CD 4.3Å; V61-K639 HydrophobicContact CG2-CB 4.5Å; V635-K639 PolarHBondContact O-N 2.89Å; S636-K639 WeakPolarHBondContact O-CB 3.49Å; S636-K639 PolarHBondContact O-N 3.48Å; T637-K639 VanDerWaalsContact C-N 3.28Å; T637-K639 PolarHBondContact O-N 3.44Å; K639-V641 PolarHBondContact O-N 3.36Å; K639-I642 WeakPolarHBondContact O-CA 3.31Å; K639-I642 WeakPolarHBondContact O-CB 3.48Å; K639-I642 PolarHBondContact O-N 3Å; K639-D643 IonicContact NZ-OD1 3.95Å; K639-D643 PolarHBondContact NZ-OD1 3.39Å; K639-D643 IonicContact NZ-OD2 2.82Å; K639-D643 PolarHBondContact NZ-OD2 3.34Å; K639-D643 VanDerWaalsContact O-CG 3.3Å; K639-D643 PolarHBondContact O-N 3.04Å
640	K	89.3	Confident	91.2	Very high	99 Å²	99	33.9 Å²	33.9	43%	0.43	18%	0.179	S	C	.	.	H	α-helix	trans	-59.2	-37.1	176.1	-68.4	174.8	-175.9	174	0	111.8	S636 T637 I638 D643 N644 L744	S636-K640 WeakPolarHBondContact O-CG 3.16Å; S636-K640 PolarHBondContact O-N 3.14Å; T637-K640 WeakPolarHBondContact O-CB 3.22Å; T637-K640 PolarHBondContact O-N 3.11Å; T637-K640 VanDerWaalsContact O-N 3.09Å; I638-K640 PolarHBondContact O-N 3.26Å; K640-D643 PolarHBondContact O-N 2.94Å; K640-N644 WeakPolarHBondContact O-CB 3.37Å; K640-N644 PolarHBondContact O-N 2.96Å; K640-N644 PolarHBondContact O-ND2 3.41Å; K640-L744 HydrophobicContact CB-CD2 3.79Å
641	V	92	Very high	91.3	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-65.1	-41.1	174.4	177.4	0	0	0	0	111.6	T637 I638 K639 D643 N644 R645 L648 M682 F683 I686 L744 L746 F748	T637-V641 WeakPolarHBondContact O-CG2 3.5Å; T637-V641 PolarHBondContact O-N 3.49Å; I638-V641 WeakPolarHBondContact O-CB 3.24Å; I638-V641 PolarHBondContact O-N 3.42Å; K639-V641 PolarHBondContact O-N 3.36Å; V641-D643 VanDerWaalsContact C-N 3.35Å; V641-N644 CarbonylContact O-C 3.5Å; V641-N644 PolarHBondContact O-N 3.44Å; V641-R645 WeakPolarHBondContact O-CA 3.38Å; V641-R645 PolarHBondContact O-N 2.96Å; V641-L648 HydrophobicContact CG1-CD1 4.21Å; V641-M682 HydrophobicContact CG1-CE 3.63Å; V641-M682 HydrophobicContact CG1-SD 4.12Å; V641-F683 HydrophobicContact CG1-CE1 4.13Å; V641-I686 HydrophobicContact CB-CD1 4.1Å; V641-I686 HydrophobicContact CG1-CD1 3.52Å; V641-L744 HydrophobicContact CG2-CD1 4.49Å; V641-L746 HydrophobicContact CG2-CD2 3.33Å; V641-F748 HydrophobicContact CG2-CZ 4.21Å
642	I	91.2	Very high	91.3	Very high	22 Å²	22	34.8 Å²	34.8	11%	0.113	19%	0.186	C	C	.	.	H	α-helix	trans	-60.4	-46.7	174.4	-67	163.4	0	0	0	110.4	V54 L57 I638 K639 N644 R645 I686 L690	V54-I642 HydrophobicContact CG1-CG2 4.24Å; V54-I642 HydrophobicContact CG2-CG2 4.41Å; L57-I642 HydrophobicContact CD2-CD1 3.38Å; I638-I642 HydrophobicContact CG2-CD1 4.23Å; I638-I642 WeakPolarHBondContact O-CG1 3.38Å; I638-I642 PolarHBondContact O-N 2.73Å; K639-I642 WeakPolarHBondContact O-CA 3.31Å; K639-I642 WeakPolarHBondContact O-CB 3.48Å; K639-I642 PolarHBondContact O-N 3Å; I642-N644 VanDerWaalsContact C-N 3.29Å; I642-N644 PolarHBondContact O-N 2.93Å; I642-R645 VanDerWaalsContact O-CB 3.24Å; I642-R645 WeakPolarHBondContact O-CB 3.46Å; I642-R645 PolarHBondContact O-N 3.5Å; I642-I686 HydrophobicContact CD1-CG2 3.87Å; I642-I686 HydrophobicContact CG1-CG2 3.49Å; I642-I686 VanDerWaalsContact CG1-CG2 3.49Å; I642-L690 HydrophobicContact CD1-CD1 4.22Å; I642-L690 HydrophobicContact CD1-CD2 4.19Å; I642-L690 HydrophobicContact CD1-CG 4.4Å
643	D	90.5	Very high	91.2	Very high	84 Å²	84	41.2 Å²	41.2	45%	0.449	21%	0.213	S	C	.	.	H	α-helix	trans	-64.1	-34.4	-179.5	-63	-20.9	0	0	0	111.9	K639 K640 V641	K639-D643 IonicContact NZ-OD1 3.95Å; K639-D643 PolarHBondContact NZ-OD1 3.39Å; K639-D643 IonicContact NZ-OD2 2.82Å; K639-D643 PolarHBondContact NZ-OD2 3.34Å; K639-D643 VanDerWaalsContact O-CG 3.3Å; K639-D643 PolarHBondContact O-N 3.04Å; K640-D643 PolarHBondContact O-N 2.94Å; V641-D643 VanDerWaalsContact C-N 3.35Å
644	N	92.1	Very high	91.1	Very high	39 Å²	39	46.9 Å²	46.9	21%	0.209	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	11.5	179.5	-69.9	-86.3	0	0	0	113.5	K640 V641 I642 S646 E647 L648 V740 L744	K640-N644 WeakPolarHBondContact O-CB 3.37Å; K640-N644 PolarHBondContact O-N 2.96Å; K640-N644 PolarHBondContact O-ND2 3.41Å; V641-N644 CarbonylContact O-C 3.5Å; V641-N644 PolarHBondContact O-N 3.44Å; I642-N644 VanDerWaalsContact C-N 3.29Å; I642-N644 PolarHBondContact O-N 2.93Å; N644-S646 VanDerWaalsContact C-N 3.28Å; N644-S646 PolarHBondContact O-N 3.11Å; N644-E647 PolarHBondContact O-N 3.25Å; N644-L648 PolarHBondContact O-N 3.18Å; N644-V740 HydrophobicContact CB-CG1 4.06Å; N644-L744 HydrophobicContact CB-CD1 4.02Å
645	R	93.1	Very high	90.8	Very high	74 Å²	74	47.1 Å²	47.1	28%	0.279	24%	0.24	S	C	.	.	H	α-helix	trans	-59.2	-37.4	-172.7	-171.4	173.9	-171.2	177.4	1.9	113.1	V641 I642 L648 A649 F683 D687	V641-R645 WeakPolarHBondContact O-CA 3.38Å; V641-R645 PolarHBondContact O-N 2.96Å; I642-R645 VanDerWaalsContact O-CB 3.24Å; I642-R645 WeakPolarHBondContact O-CB 3.46Å; I642-R645 PolarHBondContact O-N 3.5Å; R645-L648 PolarHBondContact O-N 3Å; R645-A649 PolarHBondContact O-N 2.8Å; R645-F683 HydrophobicContact CB-CZ 4.5Å; R645-F683 HydrophobicContact CG-CD1 4.35Å; R645-F683 HydrophobicContact CG-CD2 4.44Å; R645-F683 HydrophobicContact CG-CE1 3.88Å; R645-F683 HydrophobicContact CG-CE2 3.99Å; R645-F683 HydrophobicContact CG-CZ 3.69Å; R645-D687 IonicContact CZ-OD1 2.76Å; R645-D687 VanDerWaalsContact CZ-OD1 3.32Å; R645-D687 IonicContact CZ-OD2 3.61Å; R645-D687 IonicContact NH1-OD1 2.79Å; R645-D687 PolarHBondContact NH1-OD1 3.33Å; R645-D687 IonicContact NH1-OD2 2.72Å; R645-D687 VanDerWaalsContact NH2-CG 3.28Å; R645-D687 IonicContact NH2-OD1 3.86Å; R645-D687 PolarHBondContact NH2-OD1 3.05Å; R645-D687 VanDerWaalsContact NH2-OD1 3.1Å; R645-D687 IonicContact NH2-OD2 3.84Å; R645-D687 PolarHBondContact NH2-OD2 3.38Å
646	S	93.2	Very high	90.5	Very high	92 Å²	92	52.6 Å²	52.6	64%	0.643	26%	0.264	S	S	*	.	H	α-helix	trans	-66.8	-36.5	176.7	46.3	0	0	0	0	112.8	N644 L648 A649	N644-S646 VanDerWaalsContact C-N 3.28Å; N644-S646 PolarHBondContact O-N 3.11Å; S646-L648 VanDerWaalsContact C-N 3.33Å; S646-A649 WeakPolarHBondContact O-CB 3.47Å; S646-A649 PolarHBondContact O-N 3.12Å
647	E	93.7	Very high	90.4	Very high	101 Å²	101	55.8 Å²	55.8	47%	0.472	28%	0.279	S	S	.	.	H	α-helix	trans	-72.8	-29.4	178.5	-60.1	-174.4	-161.3	0	0	111.7	N644 P650 A737 V740	N644-E647 PolarHBondContact O-N 3.25Å; E647-P650 WeakPolarHBondContact O-CD 3.38Å; E647-A737 VanDerWaalsContact O-CB 3.29Å; E647-A737 WeakPolarHBondContact O-CB 3.43Å; E647-V740 HydrophobicContact CB-CG2 4.27Å; E647-V740 VanDerWaalsContact OE2-CG2 3.3Å; E647-V740 WeakPolarHBondContact OE2-CG2 3.38Å
648	L	93.7	Very high	90.4	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-84.9	-16.8	174.8	-66.4	178	0	0	0	113.7	V641 N644 R645 S646 P650 L651 F683 V740 I741 L744	V641-L648 HydrophobicContact CG1-CD1 4.21Å; N644-L648 PolarHBondContact O-N 3.18Å; R645-L648 PolarHBondContact O-N 3Å; S646-L648 VanDerWaalsContact C-N 3.33Å; L648-P650 VanDerWaalsContact C-N 3.31Å; L648-L651 HydrophobicContact CD2-CD1 4.44Å; L648-L651 WeakPolarHBondContact O-CB 3.29Å; L648-L651 PolarHBondContact O-N 3.35Å; L648-F683 HydrophobicContact CB-CE1 4.46Å; L648-F683 HydrophobicContact CB-CZ 3.75Å; L648-F683 HydrophobicContact CD1-CE1 4.33Å; L648-F683 HydrophobicContact CD1-CZ 4.41Å; L648-V740 HydrophobicContact CD2-CB 4.26Å; L648-V740 HydrophobicContact CD2-CG1 3.96Å; L648-V740 HydrophobicContact CG-CG1 4.33Å; L648-I741 HydrophobicContact CD2-CB 3.99Å; L648-I741 HydrophobicContact CD2-CG1 4.25Å; L648-L744 HydrophobicContact CD1-CD1 3.87Å; L648-L744 HydrophobicContact CD2-CD1 4.47Å; L648-L744 HydrophobicContact CG-CD1 4.45Å
649	A	93.2	Very high	90	Very high	31 Å²	31	59.1 Å²	59.1	26%	0.256	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-55.8	-29.6	-179.2	0	0	0	0	0	115.9	R645 S646 L651 T652	R645-A649 PolarHBondContact O-N 2.8Å; S646-A649 WeakPolarHBondContact O-CB 3.47Å; S646-A649 PolarHBondContact O-N 3.12Å; A649-L651 PolarHBondContact O-N 3.29Å; A649-T652 PolarHBondContact O-N 2.72Å; A649-T652 VanDerWaalsContact O-N 3.1Å; A649-T652 PolarHBondContact O-OG1 3Å
650	P	93.9	Very high	89.8	Confident	25 Å²	25	62.7 Å²	62.7	16%	0.162	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-55.8	-31.9	172.1	-28.1	38	0	0	0	113.8	E647 L648 T652 K653 G733 I734 A737	E647-P650 WeakPolarHBondContact O-CD 3.38Å; L648-P650 VanDerWaalsContact C-N 3.31Å; P650-T652 PolarHBondContact O-N 2.91Å; P650-K653 PolarHBondContact O-N 3.15Å; P650-G733 WeakPolarHBondContact CB-O 3.3Å; P650-G733 WeakPolarHBondContact CG-O 3.4Å; P650-I734 HydrophobicContact CB-CG1 4.39Å; P650-A737 HydrophobicContact CB-CB 4.38Å
651	L	92.9	Very high	89.5	Confident	2 Å²	2	60.8 Å²	60.8	1%	0.01	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-72.1	-14.6	178.7	-64.1	171.5	0	0	0	113.4	L648 A649 L672 L675 K676 V679 I734 A737 L738 I741	L648-L651 HydrophobicContact CD2-CD1 4.44Å; L648-L651 WeakPolarHBondContact O-CB 3.29Å; L648-L651 PolarHBondContact O-N 3.35Å; A649-L651 PolarHBondContact O-N 3.29Å; L651-L672 HydrophobicContact CD2-CD1 4.24Å; L651-L675 HydrophobicContact CD2-CD2 4.47Å; L651-K676 VanDerWaalsContact O-CB 3.31Å; L651-K676 WeakPolarHBondContact O-CB 3.37Å; L651-K676 WeakPolarHBondContact O-CG 3.48Å; L651-V679 HydrophobicContact CB-CG2 4.42Å; L651-V679 HydrophobicContact CD1-CG2 4.38Å; L651-I734 HydrophobicContact CD2-CG2 3.98Å; L651-A737 HydrophobicContact CD1-CB 3.85Å; L651-A737 HydrophobicContact CD2-CB 4.3Å; L651-A737 HydrophobicContact CG-CB 3.67Å; L651-L738 HydrophobicContact CD2-CD2 4.25Å; L651-L738 HydrophobicContact CD2-CG 4.29Å; L651-I741 HydrophobicContact CD1-CD1 4.12Å
652	T	91.5	Very high	89.1	Confident	43 Å²	43	61.4 Å²	61.4	26%	0.264	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-94.1	-6.8	178.6	67.7	0	0	0	0	113.3	A649 P650 V679 I680 F683	A649-T652 PolarHBondContact O-N 2.72Å; A649-T652 VanDerWaalsContact O-N 3.1Å; A649-T652 PolarHBondContact O-OG1 3Å; P650-T652 PolarHBondContact O-N 2.91Å; T652-V679 HydrophobicContact CG2-CB 4.4Å; T652-V679 HydrophobicContact CG2-CG1 3.63Å; T652-I680 HydrophobicContact CG2-CG1 3.97Å; T652-F683 HydrophobicContact CG2-CD2 3.82Å; T652-F683 HydrophobicContact CG2-CE2 3.63Å
653	K	89.9	Confident	88.4	Confident	136 Å²	136	62.9 Å²	62.9	59%	0.591	34%	0.341	S	S	*	.	S	Bend	trans	-76.1	174.9	-178.3	-66.2	-176.4	-178.3	176.7	0	111.7	P650 L655 K676	P650-K653 PolarHBondContact O-N 3.15Å; K653-L655 PolarHBondContact O-N 2.89Å; K653-K676 WeakPolarHBondContact O-CD 3.44Å; K653-K676 VanDerWaalsContact O-CE 3.28Å; K653-K676 WeakPolarHBondContact O-CE 3.22Å; K653-K676 PolarHBondContact O-NZ 2.95Å
654	E	84.6	Confident	87.3	Confident	170 Å²	170	67.5 Å²	67.5	79%	0.794	37%	0.365	S	S	*	.			trans	-67.4	128.7	171.3	-65.8	-173.8	174.3	0	0	110.2
655	L	84.9	Confident	85.5	Confident	5 Å²	5	69.6 Å²	69.6	3%	0.026	38%	0.383	C	S	.	.			trans	-101.4	11.4	-177.1	-60.5	172.1	0	0	0	112.3	K653 D657 I658 E659 L672 K676 I734	K653-L655 PolarHBondContact O-N 2.89Å; L655-D657 VanDerWaalsContact C-N 3.28Å; L655-D657 PolarHBondContact O-N 3.15Å; L655-I658 HydrophobicContact CB-CG2 3.9Å; L655-I658 HydrophobicContact CD2-CG2 4.35Å; L655-I658 WeakPolarHBondContact O-CG2 3.37Å; L655-I658 PolarHBondContact O-N 3.4Å; L655-I658 VanDerWaalsContact O-N 3.17Å; L655-E659 WeakPolarHBondContact O-CG 3.44Å; L655-E659 PolarHBondContact O-N 3.33Å; L655-L672 HydrophobicContact CD1-CB 4.25Å; L655-L672 HydrophobicContact CD1-CD2 3.83Å; L655-L672 HydrophobicContact CD1-CG 3.67Å; L655-L672 HydrophobicContact CD2-CD2 3.94Å; L655-L672 HydrophobicContact CG-CD2 4.38Å; L655-K676 HydrophobicContact CD1-CB 3.93Å; L655-K676 HydrophobicContact CD1-CD 3.95Å; L655-K676 HydrophobicContact CG-CD 4.23Å; L655-I734 HydrophobicContact CD2-CD1 3.7Å
656	K	84.4	Confident	84.1	Confident	117 Å²	117	68.8 Å²	68.8	51%	0.509	39%	0.386	S	S	.	.	H	α-helix	trans	-59	-39.3	-175.8	-164.8	-175.2	-177.6	-118.1	0	112.6	I658 E659 E660	K656-I658 VanDerWaalsContact C-N 3.31Å; K656-I658 PolarHBondContact O-N 2.84Å; K656-E659 PolarHBondContact O-N 3.07Å; K656-E660 VanDerWaalsContact CE-OE1 3.24Å; K656-E660 WeakPolarHBondContact CE-OE1 3.26Å; K656-E660 IonicContact NZ-OE1 3.28Å; K656-E660 PolarHBondContact NZ-OE1 2.93Å; K656-E660 WeakPolarHBondContact O-CG 3.33Å; K656-E660 PolarHBondContact O-N 3.03Å
657	D	86.6	Confident	83.1	Confident	79 Å²	79	72.5 Å²	72.5	42%	0.422	39%	0.394	S	S	.	.	H	α-helix	trans	-64.5	-34.1	-179.4	-75.4	5.4	0	0	0	113	L655 A661 K730 F731	L655-D657 VanDerWaalsContact C-N 3.28Å; L655-D657 PolarHBondContact O-N 3.15Å; D657-A661 WeakPolarHBondContact O-CB 3.4Å; D657-A661 PolarHBondContact O-N 3.08Å; D657-A661 VanDerWaalsContact O-N 3.16Å; D657-K730 VanDerWaalsContact CG-NZ 3.35Å; D657-K730 VanDerWaalsContact OD2-CE 3.31Å; D657-K730 WeakPolarHBondContact OD2-CE 3.49Å; D657-K730 IonicContact OD2-NZ 2.65Å; D657-K730 PolarHBondContact OD2-NZ 3.37Å; D657-F731 HydrophobicContact CB-CE1 4.03Å; D657-F731 HydrophobicContact CB-CZ 4.33Å
658	I	86.9	Confident	82.4	Confident	2 Å²	2	71 Å²	71	1%	0.01	39%	0.389	C	S	.	.	H	α-helix	trans	-78.5	-35	178.5	-168.7	163	0	0	0	111.1	L655 K656 A661 A662 I669 L672 V722 V725 F731 I734	L655-I658 HydrophobicContact CB-CG2 3.9Å; L655-I658 HydrophobicContact CD2-CG2 4.35Å; L655-I658 WeakPolarHBondContact O-CG2 3.37Å; L655-I658 PolarHBondContact O-N 3.4Å; L655-I658 VanDerWaalsContact O-N 3.17Å; K656-I658 VanDerWaalsContact C-N 3.31Å; K656-I658 PolarHBondContact O-N 2.84Å; I658-A661 PolarHBondContact O-N 2.92Å; I658-A662 VanDerWaalsContact O-CB 3.28Å; I658-A662 WeakPolarHBondContact O-CB 3.42Å; I658-A662 PolarHBondContact O-N 3.35Å; I658-I669 HydrophobicContact CG1-CD1 4.43Å; I658-L672 HydrophobicContact CD1-CD2 4.46Å; I658-L672 HydrophobicContact CG2-CD2 4.12Å; I658-V722 HydrophobicContact CD1-CB 4.1Å; I658-V722 HydrophobicContact CD1-CG1 3.7Å; I658-V722 HydrophobicContact CD1-CG2 3.75Å; I658-V725 HydrophobicContact CG1-CG1 4.42Å; I658-F731 HydrophobicContact CB-CD1 4.13Å; I658-F731 HydrophobicContact CB-CE1 3.79Å; I658-F731 HydrophobicContact CB-CE2 4.3Å; I658-F731 HydrophobicContact CB-CZ 3.88Å; I658-F731 HydrophobicContact CD1-CB 4.32Å; I658-F731 HydrophobicContact CD1-CD1 4.33Å; I658-F731 HydrophobicContact CD1-CD2 4.13Å; I658-F731 HydrophobicContact CD1-CG 4.01Å; I658-F731 HydrophobicContact CG1-CD1 4.49Å; I658-F731 HydrophobicContact CG1-CD2 4.22Å; I658-F731 HydrophobicContact CG1-CE1 4.42Å; I658-F731 HydrophobicContact CG1-CE2 4.15Å; I658-F731 HydrophobicContact CG1-CG 4.4Å; I658-F731 HydrophobicContact CG1-CZ 4.25Å; I658-I734 HydrophobicContact CD1-CD1 4.42Å
659	E	82.8	Confident	81.9	Confident	74 Å²	74	71.3 Å²	71.3	35%	0.346	39%	0.39	S	S	.	.	H	α-helix	trans	-63	-44.8	172.4	-66.8	171.8	162.6	0	0	111.5	L655 K656 A661 A662 G663 I669 Q673	L655-E659 WeakPolarHBondContact O-CG 3.44Å; L655-E659 PolarHBondContact O-N 3.33Å; K656-E659 PolarHBondContact O-N 3.07Å; E659-A661 VanDerWaalsContact C-N 3.31Å; E659-A661 PolarHBondContact O-N 2.77Å; E659-A662 PolarHBondContact O-N 3.02Å; E659-G663 PolarHBondContact O-N 2.97Å; E659-G663 VanDerWaalsContact O-N 3.12Å; E659-I669 HydrophobicContact CG-CG2 4.48Å; E659-Q673 WeakPolarHBondContact OE1-CG 3.1Å; E659-Q673 PolarHBondContact OE1-NE2 2.94Å
660	E	84.9	Confident	81.3	Confident	122 Å²	122	73.4 Å²	73.4	57%	0.57	40%	0.403	S	S	*	.	H	α-helix	trans	-63.2	-37.6	175.9	-74.2	-179.1	-171.1	0	0	112	K656	K656-E660 VanDerWaalsContact CE-OE1 3.24Å; K656-E660 WeakPolarHBondContact CE-OE1 3.26Å; K656-E660 IonicContact NZ-OE1 3.28Å; K656-E660 PolarHBondContact NZ-OE1 2.93Å; K656-E660 WeakPolarHBondContact O-CG 3.33Å; K656-E660 PolarHBondContact O-N 3.03Å
661	A	84.7	Confident	81	Confident	58 Å²	58	74.1 Å²	74.1	48%	0.479	41%	0.407	S	S	.	.	H	α-helix	trans	-73.3	-32	177.8	0	0	0	0	0	112.9	D657 I658 E659 V725 F731	D657-A661 WeakPolarHBondContact O-CB 3.4Å; D657-A661 PolarHBondContact O-N 3.08Å; D657-A661 VanDerWaalsContact O-N 3.16Å; I658-A661 PolarHBondContact O-N 2.92Å; E659-A661 VanDerWaalsContact C-N 3.31Å; E659-A661 PolarHBondContact O-N 2.77Å; A661-V725 HydrophobicContact CB-CG1 3.3Å; A661-F731 HydrophobicContact CB-CE2 4.14Å; A661-F731 HydrophobicContact CB-CZ 4.23Å
662	A	82.1	Confident	80.8	Confident	14 Å²	14	74.1 Å²	74.1	12%	0.116	41%	0.407	C	S	.	.	H	α-helix	trans	-72.9	-29.7	177.2	0	0	0	0	0	113.2	I658 E659 N664 S665 I669 V725	I658-A662 VanDerWaalsContact O-CB 3.28Å; I658-A662 WeakPolarHBondContact O-CB 3.42Å; I658-A662 PolarHBondContact O-N 3.35Å; E659-A662 PolarHBondContact O-N 3.02Å; A662-N664 PolarHBondContact O-N 3.35Å; A662-S665 PolarHBondContact O-N 3.36Å; A662-I669 HydrophobicContact CB-CD1 3.47Å; A662-I669 VanDerWaalsContact CB-CD1 3.47Å; A662-I669 HydrophobicContact CB-CG2 4.32Å; A662-V725 HydrophobicContact CB-CG2 4.08Å
663	G	76.2	Confident	80.7	Confident	53 Å²	53	74.6 Å²	74.6	55%	0.546	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	-131.3	-176.1	0	0	0	0	0	112	E659 S665	E659-G663 PolarHBondContact O-N 2.97Å; E659-G663 VanDerWaalsContact O-N 3.12Å; G663-S665 VanDerWaalsContact C-N 3.3Å
664	N	67.1	Low	80.7	Confident	181 Å²	181	72.7 Å²	72.7	97%	0.968	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-1.3	177.9	-70.9	-11.3	0	0	0	113.7	A662	A662-N664 PolarHBondContact O-N 3.35Å
665	S	56.2	Low	81.1	Confident	83 Å²	83	64.6 Å²	64.6	58%	0.58	37%	0.365	S	S	*	.			trans	-94.2	133.6	-175.7	-62.2	0	0	0	0	110.3	A662 G663	A662-S665 PolarHBondContact O-N 3.36Å; G663-S665 VanDerWaalsContact C-N 3.3Å
666	T	62.8	Low	81.5	Confident	56 Å²	56	66.1 Å²	66.1	34%	0.344	37%	0.371	S	S	.	.			trans	94.7	97.6	167.3	72	0	0	0	0	116.5	D668 I669 A721	T666-D668 PolarHBondContact O-N 3.39Å; T666-I669 PolarHBondContact O-N 3.3Å; T666-I669 VanDerWaalsContact O-N 3.17Å; T666-I669 WeakPolarHBondContact OG1-CB 3.47Å; T666-I669 WeakPolarHBondContact OG1-CD1 3.48Å; T666-I669 WeakPolarHBondContact OG1-CG1 3.29Å; T666-A721 HydrophobicContact CG2-CB 4.48Å
667	E	72.7	Confident	81.9	Confident	171 Å²	171	64 Å²	64	80%	0.799	37%	0.371	S	S	*	.	H	α-helix	trans	-50.3	-35.4	159.8	-165.1	166.1	-169.4	0	0	110.6	I669 S670	E667-I669 PolarHBondContact O-N 3.02Å; E667-S670 WeakPolarHBondContact O-CB 3.34Å; E667-S670 PolarHBondContact O-N 3.4Å; E667-S670 PolarHBondContact O-OG 3.09Å
668	D	78.2	Confident	82.3	Confident	69 Å²	69	61.9 Å²	61.9	37%	0.369	36%	0.363	S	S	.	.	H	α-helix	trans	-60.5	-43.8	175.5	-65	-43.6	0	0	0	113.6	T666 S670 T671 L718 A721	T666-D668 PolarHBondContact O-N 3.39Å; D668-S670 PolarHBondContact O-N 3.01Å; D668-T671 PolarHBondContact O-N 2.91Å; D668-T671 VanDerWaalsContact O-N 3.08Å; D668-T671 PolarHBondContact O-OG1 3.26Å; D668-L718 WeakPolarHBondContact O-CD2 3.46Å; D668-A721 HydrophobicContact CB-CB 3.93Å
669	I	82.7	Confident	82.7	Confident	7 Å²	7	61.8 Å²	61.8	4%	0.036	36%	0.362	C	S	.	.	H	α-helix	trans	-66	-30	179.7	-72.5	177.7	0	0	0	111.5	I658 E659 A662 T666 E667 T671 L672 A721 V725	I658-I669 HydrophobicContact CG1-CD1 4.43Å; E659-I669 HydrophobicContact CG-CG2 4.48Å; A662-I669 HydrophobicContact CB-CD1 3.47Å; A662-I669 VanDerWaalsContact CB-CD1 3.47Å; A662-I669 HydrophobicContact CB-CG2 4.32Å; T666-I669 PolarHBondContact O-N 3.3Å; T666-I669 VanDerWaalsContact O-N 3.17Å; T666-I669 WeakPolarHBondContact OG1-CB 3.47Å; T666-I669 WeakPolarHBondContact OG1-CD1 3.48Å; T666-I669 WeakPolarHBondContact OG1-CG1 3.29Å; E667-I669 PolarHBondContact O-N 3.02Å; I669-T671 PolarHBondContact O-N 3.47Å; I669-L672 WeakPolarHBondContact O-CB 3.46Å; I669-L672 PolarHBondContact O-N 3.45Å; I669-A721 HydrophobicContact CG1-CB 4.11Å; I669-V725 HydrophobicContact CD1-CG2 3.67Å
670	S	81.1	Confident	83.3	Confident	74 Å²	74	62 Å²	62	52%	0.517	36%	0.364	S	S	.	.	H	α-helix	trans	-62.3	-34.1	174.7	77.6	0	0	0	0	112.3	E667 D668 L672 Q673	E667-S670 WeakPolarHBondContact O-CB 3.34Å; E667-S670 PolarHBondContact O-N 3.4Å; E667-S670 PolarHBondContact O-OG 3.09Å; D668-S670 PolarHBondContact O-N 3.01Å; S670-L672 PolarHBondContact O-N 2.84Å; S670-Q673 PolarHBondContact O-N 3.07Å
671	T	88.2	Confident	83.8	Confident	41 Å²	41	59 Å²	59	25%	0.252	36%	0.357	S	S	.	.	H	α-helix	trans	-70.8	-14.3	176	72.2	0	0	0	0	113.3	D668 I669 Q673 D674 L675 L718	D668-T671 PolarHBondContact O-N 2.91Å; D668-T671 VanDerWaalsContact O-N 3.08Å; D668-T671 PolarHBondContact O-OG1 3.26Å; I669-T671 PolarHBondContact O-N 3.47Å; T671-Q673 PolarHBondContact O-N 3.41Å; T671-D674 PolarHBondContact O-N 3.25Å; T671-L675 PolarHBondContact O-N 3.47Å; T671-L718 WeakPolarHBondContact OG1-CD2 3.44Å
672	L	89.4	Confident	84.3	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.01	33%	0.334	C	S	.	.	H	α-helix	trans	-65.3	-28.9	175.7	-163.9	69.6	0	0	0	111.9	L651 L655 I658 I669 S670 L675 K676 L718 V722 I734	L651-L672 HydrophobicContact CD2-CD1 4.24Å; L655-L672 HydrophobicContact CD1-CB 4.25Å; L655-L672 HydrophobicContact CD1-CD2 3.83Å; L655-L672 HydrophobicContact CD1-CG 3.67Å; L655-L672 HydrophobicContact CD2-CD2 3.94Å; L655-L672 HydrophobicContact CG-CD2 4.38Å; I658-L672 HydrophobicContact CD1-CD2 4.46Å; I658-L672 HydrophobicContact CG2-CD2 4.12Å; I669-L672 WeakPolarHBondContact O-CB 3.46Å; I669-L672 PolarHBondContact O-N 3.45Å; S670-L672 PolarHBondContact O-N 2.84Å; L672-L675 HydrophobicContact CD1-CD2 4.25Å; L672-L675 PolarHBondContact O-N 3.42Å; L672-K676 WeakPolarHBondContact O-CB 3.5Å; L672-K676 PolarHBondContact O-N 2.95Å; L672-L718 HydrophobicContact CB-CD2 4.35Å; L672-L718 HydrophobicContact CD1-CD2 4.23Å; L672-V722 HydrophobicContact CD2-CG2 4.43Å; L672-I734 HydrophobicContact CD2-CG2 4.44Å
673	Q	87.8	Confident	84.9	Confident	53 Å²	53	56.3 Å²	56.3	25%	0.248	33%	0.332	C	S	.	.	H	α-helix	trans	-70.2	-38.8	173.7	-72.9	-70.2	-6.1	0	0	112.3	E659 S670 T671 L675 K676 S677	E659-Q673 WeakPolarHBondContact OE1-CG 3.1Å; E659-Q673 PolarHBondContact OE1-NE2 2.94Å; S670-Q673 PolarHBondContact O-N 3.07Å; T671-Q673 PolarHBondContact O-N 3.41Å; Q673-L675 VanDerWaalsContact C-N 3.33Å; Q673-K676 PolarHBondContact O-N 2.86Å; Q673-S677 PolarHBondContact O-N 2.88Å; Q673-S677 PolarHBondContact O-OG 2.92Å
674	D	90.3	Very high	85.8	Confident	96 Å²	96	60.1 Å²	60.1	51%	0.513	33%	0.334	S	S	.	.	H	α-helix	trans	-66.9	-39.9	174.2	-65.2	-25.9	0	0	0	110.4	T671 S677 S678 F713	T671-D674 PolarHBondContact O-N 3.25Å; D674-S677 PolarHBondContact O-N 3.16Å; D674-S678 WeakPolarHBondContact O-CB 3.39Å; D674-S678 PolarHBondContact O-N 2.99Å; D674-S678 PolarHBondContact O-OG 3.12Å; D674-F713 HydrophobicContact CB-CE1 4Å; D674-F713 HydrophobicContact CB-CZ 3.99Å
675	L	93.2	Very high	87.1	Confident	0 Å²	0	52 Å²	52	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-61.9	-47.5	173.7	-179.4	58.3	0	0	0	111	L651 T671 L672 Q673 S677 S678 V679 I710 F713 Y715 L718 L738 I741	L651-L675 HydrophobicContact CD2-CD2 4.47Å; T671-L675 PolarHBondContact O-N 3.47Å; L672-L675 HydrophobicContact CD1-CD2 4.25Å; L672-L675 PolarHBondContact O-N 3.42Å; Q673-L675 VanDerWaalsContact C-N 3.33Å; L675-S677 VanDerWaalsContact C-N 3.34Å; L675-S677 PolarHBondContact O-N 2.8Å; L675-S678 WeakPolarHBondContact O-CB 3.49Å; L675-S678 PolarHBondContact O-N 3.15Å; L675-S678 VanDerWaalsContact O-N 3.12Å; L675-V679 HydrophobicContact CD1-CG2 4.12Å; L675-V679 HydrophobicContact CG-CG2 4.34Å; L675-V679 WeakPolarHBondContact O-CG2 3.48Å; L675-V679 PolarHBondContact O-N 3.46Å; L675-I710 HydrophobicContact CD1-CG2 3.85Å; L675-F713 HydrophobicContact CB-CD1 4Å; L675-F713 HydrophobicContact CB-CE1 3.73Å; L675-F713 HydrophobicContact CB-CZ 4.16Å; L675-F713 HydrophobicContact CD1-CD1 4.35Å; L675-F713 HydrophobicContact CD1-CD2 4.14Å; L675-F713 HydrophobicContact CD1-CE2 4.31Å; L675-F713 HydrophobicContact CD1-CG 4.16Å; L675-F713 HydrophobicContact CD1-CZ 4.49Å; L675-Y715 HydrophobicContact CD1-CE1 4.06Å; L675-Y715 HydrophobicContact CD2-CD1 4.47Å; L675-Y715 HydrophobicContact CD2-CE1 4.37Å; L675-L718 HydrophobicContact CD2-CD1 3.9Å; L675-L738 HydrophobicContact CD2-CD2 3.74Å; L675-I741 HydrophobicContact CD1-CD1 4.02Å
676	K	93	Very high	88.8	Confident	37 Å²	37	48 Å²	48	16%	0.161	27%	0.265	C	S	.	.	H	α-helix	trans	-54.2	-50	174.9	165.9	178.2	172.6	178.3	0	111.7	L651 K653 L655 L672 Q673 S678 V679 I680	L651-K676 VanDerWaalsContact O-CB 3.31Å; L651-K676 WeakPolarHBondContact O-CB 3.37Å; L651-K676 WeakPolarHBondContact O-CG 3.48Å; K653-K676 WeakPolarHBondContact O-CD 3.44Å; K653-K676 VanDerWaalsContact O-CE 3.28Å; K653-K676 WeakPolarHBondContact O-CE 3.22Å; K653-K676 PolarHBondContact O-NZ 2.95Å; L655-K676 HydrophobicContact CD1-CB 3.93Å; L655-K676 HydrophobicContact CD1-CD 3.95Å; L655-K676 HydrophobicContact CG-CD 4.23Å; L672-K676 WeakPolarHBondContact O-CB 3.5Å; L672-K676 PolarHBondContact O-N 2.95Å; Q673-K676 PolarHBondContact O-N 2.86Å; K676-S678 PolarHBondContact O-N 2.87Å; K676-V679 PolarHBondContact O-N 3.1Å; K676-I680 HydrophobicContact CD-CD1 4.5Å; K676-I680 HydrophobicContact CG-CD1 3.8Å; K676-I680 WeakPolarHBondContact O-CG1 3.4Å; K676-I680 PolarHBondContact O-N 3.01Å
677	S	93.9	Very high	90.2	Very high	71 Å²	71	48.6 Å²	48.6	50%	0.497	27%	0.266	S	S	.	.	H	α-helix	trans	-57.8	-41.5	178.4	-64.3	0	0	0	0	111.1	Q673 D674 L675 I680 S681	Q673-S677 PolarHBondContact O-N 2.88Å; Q673-S677 PolarHBondContact O-OG 2.92Å; D674-S677 PolarHBondContact O-N 3.16Å; L675-S677 VanDerWaalsContact C-N 3.34Å; L675-S677 PolarHBondContact O-N 2.8Å; S677-I680 PolarHBondContact O-N 3.47Å; S677-S681 WeakPolarHBondContact O-CB 3.34Å; S677-S681 PolarHBondContact O-N 3.25Å
678	S	94.5	Very high	91.1	Very high	36 Å²	36	44.5 Å²	44.5	25%	0.252	25%	0.249	S	C	.	.	H	α-helix	trans	-65.9	-44.8	177.7	-56.2	0	0	0	0	112.3	D674 L675 K676 I680 S681 M682	D674-S678 WeakPolarHBondContact O-CB 3.39Å; D674-S678 PolarHBondContact O-N 2.99Å; D674-S678 PolarHBondContact O-OG 3.12Å; L675-S678 WeakPolarHBondContact O-CB 3.49Å; L675-S678 PolarHBondContact O-N 3.15Å; L675-S678 VanDerWaalsContact O-N 3.12Å; K676-S678 PolarHBondContact O-N 2.87Å; S678-I680 PolarHBondContact O-N 3.34Å; S678-S681 PolarHBondContact O-N 2.9Å; S678-M682 WeakPolarHBondContact O-CB 3.45Å; S678-M682 PolarHBondContact O-N 2.96Å
679	V	94.9	Very high	91.6	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-63.4	-41.9	176.8	176.2	0	0	0	0	111.4	L651 T652 L675 K676 M682 F683 I710 I741	L651-V679 HydrophobicContact CB-CG2 4.42Å; L651-V679 HydrophobicContact CD1-CG2 4.38Å; T652-V679 HydrophobicContact CG2-CB 4.4Å; T652-V679 HydrophobicContact CG2-CG1 3.63Å; L675-V679 HydrophobicContact CD1-CG2 4.12Å; L675-V679 HydrophobicContact CG-CG2 4.34Å; L675-V679 WeakPolarHBondContact O-CG2 3.48Å; L675-V679 PolarHBondContact O-N 3.46Å; K676-V679 PolarHBondContact O-N 3.1Å; V679-M682 PolarHBondContact O-N 3.3Å; V679-F683 HydrophobicContact CG1-CD1 4.49Å; V679-F683 HydrophobicContact CG1-CD2 4.18Å; V679-F683 HydrophobicContact CG1-CE1 4.17Å; V679-F683 HydrophobicContact CG1-CE2 3.83Å; V679-F683 HydrophobicContact CG1-CG 4.5Å; V679-F683 HydrophobicContact CG1-CZ 3.82Å; V679-F683 WeakPolarHBondContact O-CB 3.32Å; V679-F683 WeakPolarHBondContact O-CG 3.34Å; V679-F683 PolarHBondContact O-N 2.89Å; V679-I710 HydrophobicContact CB-CD1 4.28Å; V679-I710 HydrophobicContact CG2-CD1 3.62Å; V679-I741 HydrophobicContact CG2-CD1 4.25Å
680	I	95.2	Very high	91.8	Very high	77 Å²	77	42.1 Å²	42.1	40%	0.395	24%	0.237	S	C	.	.	H	α-helix	trans	-62.1	-45.4	175.7	-69.5	169.3	0	0	0	110.6	T652 K676 S677 S678 F683 K684	T652-I680 HydrophobicContact CG2-CG1 3.97Å; K676-I680 HydrophobicContact CD-CD1 4.5Å; K676-I680 HydrophobicContact CG-CD1 3.8Å; K676-I680 WeakPolarHBondContact O-CG1 3.4Å; K676-I680 PolarHBondContact O-N 3.01Å; S677-I680 PolarHBondContact O-N 3.47Å; S678-I680 PolarHBondContact O-N 3.34Å; I680-F683 PolarHBondContact O-N 3.28Å; I680-K684 WeakPolarHBondContact O-CB 3.4Å; I680-K684 PolarHBondContact O-N 3.15Å
681	S	95.4	Very high	92	Very high	60 Å²	60	43.1 Å²	43.1	42%	0.42	24%	0.243	S	C	.	.	H	α-helix	trans	-61.6	-44.9	177.7	-171.1	0	0	0	0	111.7	S677 S678 K684 G685 P708	S677-S681 WeakPolarHBondContact O-CB 3.34Å; S677-S681 PolarHBondContact O-N 3.25Å; S678-S681 PolarHBondContact O-N 2.9Å; S681-K684 PolarHBondContact O-N 3.32Å; S681-G685 PolarHBondContact O-N 3.03Å; S681-P708 WeakPolarHBondContact O-CG 3.5Å; S681-P708 WeakPolarHBondContact OG-CG 3.37Å
682	M	95.4	Very high	91.8	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60	-48.9	175.6	-178.9	-176.5	64.8	0	0	111.6	V641 S678 V679 K684 G685 I686 I707 I710 L746 F748	V641-M682 HydrophobicContact CG1-CE 3.63Å; V641-M682 HydrophobicContact CG1-SD 4.12Å; S678-M682 WeakPolarHBondContact O-CB 3.45Å; S678-M682 PolarHBondContact O-N 2.96Å; V679-M682 PolarHBondContact O-N 3.3Å; M682-K684 VanDerWaalsContact C-N 3.31Å; M682-K684 PolarHBondContact O-N 3Å; M682-G685 PolarHBondContact O-N 3.48Å; M682-G685 VanDerWaalsContact O-N 3.14Å; M682-I686 HydrophobicContact CG-CD1 4.11Å; M682-I686 WeakPolarHBondContact O-CG1 3.43Å; M682-I686 PolarHBondContact O-N 2.91Å; M682-I707 HydrophobicContact CG-CG2 4.4Å; M682-I710 HydrophobicContact CB-CD1 4.28Å; M682-I710 HydrophobicContact CB-CG1 4.38Å; M682-I710 HydrophobicContact CE-CD1 3.95Å; M682-I710 HydrophobicContact SD-CD1 3.98Å; M682-I710 HydrophobicContact SD-CG1 4.13Å; M682-L746 HydrophobicContact CE-CD1 3.87Å; M682-L746 HydrophobicContact SD-CB 4.46Å; M682-L746 HydrophobicContact SD-CD1 3.89Å; M682-L746 HydrophobicContact SD-CD2 4.22Å; M682-L746 HydrophobicContact SD-CG 4.45Å; M682-F748 HydrophobicContact CG-CE2 4.03Å; M682-F748 HydrophobicContact SD-CE2 3.9Å; M682-F748 HydrophobicContact SD-CZ 4.15Å
683	F	95	Very high	91	Very high	15 Å²	15	48 Å²	48	7%	0.066	27%	0.271	C	S	.	.	H	α-helix	trans	-60.1	-40.7	177.7	-78.1	-4.3	0	0	0	112.8	V641 R645 L648 T652 V679 I680 I686 D687	V641-F683 HydrophobicContact CG1-CE1 4.13Å; R645-F683 HydrophobicContact CB-CZ 4.5Å; R645-F683 HydrophobicContact CG-CD1 4.35Å; R645-F683 HydrophobicContact CG-CD2 4.44Å; R645-F683 HydrophobicContact CG-CE1 3.88Å; R645-F683 HydrophobicContact CG-CE2 3.99Å; R645-F683 HydrophobicContact CG-CZ 3.69Å; L648-F683 HydrophobicContact CB-CE1 4.46Å; L648-F683 HydrophobicContact CB-CZ 3.75Å; L648-F683 HydrophobicContact CD1-CE1 4.33Å; L648-F683 HydrophobicContact CD1-CZ 4.41Å; T652-F683 HydrophobicContact CG2-CD2 3.82Å; T652-F683 HydrophobicContact CG2-CE2 3.63Å; V679-F683 HydrophobicContact CG1-CD1 4.49Å; V679-F683 HydrophobicContact CG1-CD2 4.18Å; V679-F683 HydrophobicContact CG1-CE1 4.17Å; V679-F683 HydrophobicContact CG1-CE2 3.83Å; V679-F683 HydrophobicContact CG1-CG 4.5Å; V679-F683 HydrophobicContact CG1-CZ 3.82Å; V679-F683 WeakPolarHBondContact O-CB 3.32Å; V679-F683 WeakPolarHBondContact O-CG 3.34Å; V679-F683 PolarHBondContact O-N 2.89Å; I680-F683 PolarHBondContact O-N 3.28Å; F683-I686 PolarHBondContact O-N 2.89Å; F683-D687 VanDerWaalsContact O-CG 3.31Å; F683-D687 PolarHBondContact O-N 3.26Å
684	K	94.3	Very high	90.2	Very high	133 Å²	133	47.2 Å²	47.2	58%	0.578	27%	0.266	S	S	*	.	H	α-helix	trans	-62.9	-44.5	174.1	-175.8	-177.3	174.7	-172.6	0	111.4	I680 S681 M682 I686 D687 D688	I680-K684 WeakPolarHBondContact O-CB 3.4Å; I680-K684 PolarHBondContact O-N 3.15Å; S681-K684 PolarHBondContact O-N 3.32Å; M682-K684 VanDerWaalsContact C-N 3.31Å; M682-K684 PolarHBondContact O-N 3Å; K684-I686 VanDerWaalsContact C-N 3.28Å; K684-I686 PolarHBondContact O-N 3.43Å; K684-D687 WeakPolarHBondContact O-CB 3.33Å; K684-D687 PolarHBondContact O-N 3.3Å; K684-D687 VanDerWaalsContact O-N 3.12Å; K684-D688 PolarHBondContact O-N 3.41Å
685	G	94.3	Very high	88.8	Confident	10 Å²	10	46.3 Å²	46.3	10%	0.103	27%	0.268	C	S	.	.	H	α-helix	trans	-60	-38.3	175.5	0	0	0	0	0	112.7	S681 M682 D688 F689	S681-G685 PolarHBondContact O-N 3.03Å; M682-G685 PolarHBondContact O-N 3.48Å; M682-G685 VanDerWaalsContact O-N 3.14Å; G685-D688 PolarHBondContact O-N 2.96Å; G685-F689 VanDerWaalsContact O-CB 3.28Å; G685-F689 WeakPolarHBondContact O-CB 3.48Å; G685-F689 PolarHBondContact O-N 3.21Å
686	I	92.8	Very high	87.5	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-64.7	-41.2	173.4	-72	172.1	0	0	0	111.4	I638 V641 I642 M682 F683 K684 F689 L690 I707	I638-I686 HydrophobicContact CG2-CG1 4.35Å; V641-I686 HydrophobicContact CB-CD1 4.1Å; V641-I686 HydrophobicContact CG1-CD1 3.52Å; I642-I686 HydrophobicContact CD1-CG2 3.87Å; I642-I686 HydrophobicContact CG1-CG2 3.49Å; I642-I686 VanDerWaalsContact CG1-CG2 3.49Å; M682-I686 HydrophobicContact CG-CD1 4.11Å; M682-I686 WeakPolarHBondContact O-CG1 3.43Å; M682-I686 PolarHBondContact O-N 2.91Å; F683-I686 PolarHBondContact O-N 2.89Å; K684-I686 VanDerWaalsContact C-N 3.28Å; K684-I686 PolarHBondContact O-N 3.43Å; I686-F689 WeakPolarHBondContact O-CB 3.34Å; I686-F689 PolarHBondContact O-N 2.9Å; I686-L690 HydrophobicContact CG2-CD1 4.05Å; I686-L690 HydrophobicContact CG2-CG 4.46Å; I686-L690 WeakPolarHBondContact O-CB 3.48Å; I686-L690 VanDerWaalsContact O-CG 3.31Å; I686-L690 WeakPolarHBondContact O-CG 3.48Å; I686-L690 PolarHBondContact O-N 2.87Å; I686-I707 HydrophobicContact CG1-CD1 4.29Å; I686-I707 HydrophobicContact CG1-CG2 4.02Å
687	D	91.7	Very high	86.3	Confident	67 Å²	67	52.7 Å²	52.7	36%	0.358	31%	0.308	S	S	.	.	H	α-helix	trans	-64.6	-44.5	176.4	-69.4	-31.2	0	0	0	111.6	R645 F683 K684 F689 L690 S691	R645-D687 IonicContact CZ-OD1 2.76Å; R645-D687 VanDerWaalsContact CZ-OD1 3.32Å; R645-D687 IonicContact CZ-OD2 3.61Å; R645-D687 IonicContact NH1-OD1 2.79Å; R645-D687 PolarHBondContact NH1-OD1 3.33Å; R645-D687 IonicContact NH1-OD2 2.72Å; R645-D687 VanDerWaalsContact NH2-CG 3.28Å; R645-D687 IonicContact NH2-OD1 3.86Å; R645-D687 PolarHBondContact NH2-OD1 3.05Å; R645-D687 VanDerWaalsContact NH2-OD1 3.1Å; R645-D687 IonicContact NH2-OD2 3.84Å; R645-D687 PolarHBondContact NH2-OD2 3.38Å; F683-D687 VanDerWaalsContact O-CG 3.31Å; F683-D687 PolarHBondContact O-N 3.26Å; K684-D687 WeakPolarHBondContact O-CB 3.33Å; K684-D687 PolarHBondContact O-N 3.3Å; K684-D687 VanDerWaalsContact O-N 3.12Å; D687-F689 VanDerWaalsContact C-N 3.33Å; D687-F689 PolarHBondContact O-N 3.25Å; D687-L690 PolarHBondContact O-N 2.82Å; D687-S691 WeakPolarHBondContact O-CB 3.39Å; D687-S691 PolarHBondContact O-N 3.47Å
688	D	91.1	Very high	85.3	Confident	86 Å²	86	50.2 Å²	50.2	46%	0.46	29%	0.293	S	S	.	.	H	α-helix	trans	-61	-43.4	175.9	-68.8	-20.5	0	0	0	110.4	K684 G685 S691 S692	K684-D688 PolarHBondContact O-N 3.41Å; G685-D688 PolarHBondContact O-N 2.96Å; D688-S691 PolarHBondContact O-N 3.39Å; D688-S691 PolarHBondContact O-OG 3.46Å; D688-S692 PolarHBondContact O-N 2.91Å; D688-S692 PolarHBondContact O-OG 3.37Å
689	F	89.9	Confident	84.7	Confident	3 Å²	3	52.5 Å²	52.5	1%	0.013	30%	0.299	C	S	.	.	H	α-helix	trans	-58.4	-51.2	173.1	169	-107.6	0	0	0	112.1	L57 I638 G685 I686 D687 S691 S692 F694 I700 E703 A704 I707	L57-F689 HydrophobicContact CD1-CE1 3.66Å; L57-F689 HydrophobicContact CD1-CZ 3.75Å; L57-F689 HydrophobicContact CD2-CE1 3.85Å; L57-F689 HydrophobicContact CG-CE1 4.41Å; I638-F689 HydrophobicContact CG2-CD1 4.48Å; I638-F689 HydrophobicContact CG2-CE1 4.36Å; G685-F689 VanDerWaalsContact O-CB 3.28Å; G685-F689 WeakPolarHBondContact O-CB 3.48Å; G685-F689 PolarHBondContact O-N 3.21Å; I686-F689 WeakPolarHBondContact O-CB 3.34Å; I686-F689 PolarHBondContact O-N 2.9Å; D687-F689 VanDerWaalsContact C-N 3.33Å; D687-F689 PolarHBondContact O-N 3.25Å; F689-S691 PolarHBondContact O-N 3Å; F689-S692 VanDerWaalsContact O-CB 3.23Å; F689-S692 WeakPolarHBondContact O-CB 3.43Å; F689-S692 PolarHBondContact O-N 3.04Å; F689-S692 PolarHBondContact O-OG 3.17Å; F689-F694 HydrophobicContact CD1-CZ 4.49Å; F689-F694 AromaticContact CD2-CE1 3.99Å; F689-F694 HydrophobicContact CD2-CE1 3.99Å; F689-F694 HydrophobicContact CD2-CZ 4.1Å; F689-F694 HydrophobicContact CE1-CZ 4.22Å; F689-F694 AromaticContact CE2-CE1 3.56Å; F689-F694 HydrophobicContact CE2-CE1 3.56Å; F689-F694 AromaticContact CE2-CZ 3.8Å; F689-F694 HydrophobicContact CE2-CZ 3.8Å; F689-F694 HydrophobicContact CG-CZ 4.43Å; F689-F694 AromaticContact CZ-CE1 3.99Å; F689-F694 HydrophobicContact CZ-CE1 3.99Å; F689-F694 AromaticContact CZ-CZ 3.86Å; F689-F694 HydrophobicContact CZ-CZ 3.86Å; F689-F694 WeakPolarHBondContact O-CZ 3.38Å; F689-I700 HydrophobicContact CE2-CD1 4.49Å; F689-I700 HydrophobicContact CE2-CG1 3.68Å; F689-I700 HydrophobicContact CZ-CD1 4.05Å; F689-I700 HydrophobicContact CZ-CG1 3.68Å; F689-E703 HydrophobicContact CD2-CB 3.84Å; F689-E703 HydrophobicContact CE2-CB 4.3Å; F689-A704 HydrophobicContact CD2-CB 4.2Å; F689-A704 HydrophobicContact CE2-CB 3.7Å; F689-A704 HydrophobicContact CZ-CB 4.26Å; F689-I707 HydrophobicContact CB-CD1 3.8Å; F689-I707 HydrophobicContact CB-CG1 4.04Å; F689-I707 HydrophobicContact CD1-CD1 4.05Å; F689-I707 HydrophobicContact CD2-CD1 4.25Å; F689-I707 HydrophobicContact CG-CD1 3.79Å; F689-I707 HydrophobicContact CG-CG1 4.48Å
690	L	87.1	Confident	84.2	Confident	23 Å²	23	52.6 Å²	52.6	12%	0.12	30%	0.299	C	S	.	.	H	α-helix	trans	-63.6	-24.5	179.2	-73.4	172.7	0	0	0	113.4	P53 V54 L57 I642 I686 D687 S692	P53-L690 HydrophobicContact CB-CB 4.49Å; V54-L690 HydrophobicContact CG2-CD1 4.34Å; L57-L690 HydrophobicContact CB-CD2 4.27Å; L57-L690 HydrophobicContact CD2-CD2 3.79Å; I642-L690 HydrophobicContact CD1-CD1 4.22Å; I642-L690 HydrophobicContact CD1-CD2 4.19Å; I642-L690 HydrophobicContact CD1-CG 4.4Å; I686-L690 HydrophobicContact CG2-CD1 4.05Å; I686-L690 HydrophobicContact CG2-CG 4.46Å; I686-L690 WeakPolarHBondContact O-CB 3.48Å; I686-L690 VanDerWaalsContact O-CG 3.31Å; I686-L690 WeakPolarHBondContact O-CG 3.48Å; I686-L690 PolarHBondContact O-N 2.87Å; D687-L690 PolarHBondContact O-N 2.82Å; L690-S692 VanDerWaalsContact C-N 3.34Å
691	S	84.9	Confident	83.9	Confident	94 Å²	94	49 Å²	49	66%	0.657	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-9.3	175.9	78.1	0	0	0	0	114.1	D687 D688 F689	D687-S691 WeakPolarHBondContact O-CB 3.39Å; D687-S691 PolarHBondContact O-N 3.47Å; D688-S691 PolarHBondContact O-N 3.39Å; D688-S691 PolarHBondContact O-OG 3.46Å; F689-S691 PolarHBondContact O-N 3Å
692	S	83.2	Confident	83.6	Confident	33 Å²	33	50.7 Å²	50.7	23%	0.231	28%	0.282	C	S	.	.	S	Bend	trans	-76	152.4	-177.1	-63.7	0	0	0	0	112.5	D688 F689 L690 F694	D688-S692 PolarHBondContact O-N 2.91Å; D688-S692 PolarHBondContact O-OG 3.37Å; F689-S692 VanDerWaalsContact O-CB 3.23Å; F689-S692 WeakPolarHBondContact O-CB 3.43Å; F689-S692 PolarHBondContact O-N 3.04Å; F689-S692 PolarHBondContact O-OG 3.17Å; L690-S692 VanDerWaalsContact C-N 3.34Å; S692-F694 PolarHBondContact O-N 3.36Å
693	D	73.9	Confident	83.3	Confident	113 Å²	113	53 Å²	53	60%	0.604	29%	0.293	S	S	*	.			trans	-85.2	110.1	175.5	174.7	35.8	0	0	0	111.4	S695	D693-S695 PolarHBondContact O-N 3.35Å; D693-S695 PolarHBondContact OD1-N 2.94Å; D693-S695 VanDerWaalsContact OD2-CB 3.22Å; D693-S695 WeakPolarHBondContact OD2-CB 3.41Å; D693-S695 PolarHBondContact OD2-OG 2.82Å
694	F	69.4	Low	83	Confident	36 Å²	36	52.2 Å²	52.2	16%	0.158	29%	0.289	C	S	.	.			trans	-86.1	35.9	177.2	-51.4	-60	0	0	0	113.3	I60 F689 S692 S696 I700	I60-F694 HydrophobicContact CD1-CB 4.19Å; I60-F694 HydrophobicContact CD1-CD2 4.23Å; I60-F694 HydrophobicContact CD1-CG 4.43Å; F689-F694 HydrophobicContact CD1-CZ 4.49Å; F689-F694 AromaticContact CD2-CE1 3.99Å; F689-F694 HydrophobicContact CD2-CE1 3.99Å; F689-F694 HydrophobicContact CD2-CZ 4.1Å; F689-F694 HydrophobicContact CE1-CZ 4.22Å; F689-F694 AromaticContact CE2-CE1 3.56Å; F689-F694 HydrophobicContact CE2-CE1 3.56Å; F689-F694 AromaticContact CE2-CZ 3.8Å; F689-F694 HydrophobicContact CE2-CZ 3.8Å; F689-F694 HydrophobicContact CG-CZ 4.43Å; F689-F694 AromaticContact CZ-CE1 3.99Å; F689-F694 HydrophobicContact CZ-CE1 3.99Å; F689-F694 AromaticContact CZ-CZ 3.86Å; F689-F694 HydrophobicContact CZ-CZ 3.86Å; F689-F694 WeakPolarHBondContact O-CZ 3.38Å; S692-F694 PolarHBondContact O-N 3.36Å; F694-S696 PolarHBondContact O-N 3.31Å; F694-I700 HydrophobicContact CD1-CB 3.82Å; F694-I700 HydrophobicContact CD1-CD1 4Å; F694-I700 HydrophobicContact CD1-CG1 3.74Å; F694-I700 HydrophobicContact CE1-CB 4.24Å; F694-I700 HydrophobicContact CE1-CD1 4.09Å; F694-I700 HydrophobicContact CE1-CG1 3.71Å; F694-I700 HydrophobicContact CG-CD1 4.32Å; F694-I700 HydrophobicContact CZ-CD1 4.47Å; F694-I700 HydrophobicContact CZ-CG1 4.46Å
695	S	60.7	Low	82.9	Confident	78 Å²	78	48 Å²	48	55%	0.545	28%	0.28	S	S	.	.	S	Bend	trans	-56.7	-14.4	-176.2	42.6	0	0	0	0	115.5	D693 K699	D693-S695 PolarHBondContact O-N 3.35Å; D693-S695 PolarHBondContact OD1-N 2.94Å; D693-S695 VanDerWaalsContact OD2-CB 3.22Å; D693-S695 WeakPolarHBondContact OD2-CB 3.41Å; D693-S695 PolarHBondContact OD2-OG 2.82Å; S695-K699 PolarHBondContact OG-NZ 2.99Å
696	S	66.9	Low	82.8	Confident	54 Å²	54	54 Å²	54	38%	0.378	30%	0.303	S	S	.	.	S	Bend	trans	-140.7	141.2	170.5	60.3	0	0	0	0	110.5	F694 G698 K699	F694-S696 PolarHBondContact O-N 3.31Å; S696-G698 PolarHBondContact O-N 2.85Å; S696-K699 PolarHBondContact O-N 2.77Å; S696-K699 WeakPolarHBondContact OG-CG 3.49Å
697	D	67.7	Low	82.8	Confident	116 Å²	116	54.3 Å²	54.3	62%	0.62	30%	0.304	S	S	*	.	H	α-helix	trans	-57	-24.7	-177.1	-61.7	-23.9	0	0	0	113.9	I700	D697-I700 WeakPolarHBondContact O-CG2 3.32Å
698	G	72.5	Confident	82.9	Confident	19 Å²	19	53.5 Å²	53.5	20%	0.196	30%	0.303	C	S	.	.	H	α-helix	trans	-74.1	-31.1	175.9	0	0	0	0	0	114.7	S696 I700 F701	S696-G698 PolarHBondContact O-N 2.85Å; G698-I700 VanDerWaalsContact C-N 3.26Å; G698-I700 PolarHBondContact O-N 3.39Å; G698-F701 PolarHBondContact O-N 3.06Å
699	K	81.8	Confident	82.8	Confident	85 Å²	85	50.7 Å²	50.7	37%	0.37	29%	0.294	S	S	.	.	H	α-helix	trans	-67.8	-27.8	-176.7	-79.6	179.1	-177.4	177.7	0	112.5	S695 S696 F701 E702 E703	S695-K699 PolarHBondContact OG-NZ 2.99Å; S696-K699 PolarHBondContact O-N 2.77Å; S696-K699 WeakPolarHBondContact OG-CG 3.49Å; K699-F701 VanDerWaalsContact C-N 3.28Å; K699-F701 PolarHBondContact O-N 3.49Å; K699-E702 PolarHBondContact O-N 3.35Å; K699-E703 WeakPolarHBondContact O-CG 3.21Å; K699-E703 PolarHBondContact O-N 2.89Å
700	I	85.8	Confident	82.8	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-62.1	-37.9	179	-165.3	160.2	0	0	0	111.8	L57 I60 M64 F689 F694 D697 G698 E703 A704	L57-I700 HydrophobicContact CD1-CD1 3.91Å; I60-I700 HydrophobicContact CB-CD1 4.37Å; I60-I700 HydrophobicContact CD1-CD1 4.45Å; I60-I700 HydrophobicContact CG2-CD1 3.5Å; I60-I700 VanDerWaalsContact CG2-CD1 3.5Å; M64-I700 HydrophobicContact CE-CB 4.25Å; M64-I700 HydrophobicContact CE-CD1 3.49Å; M64-I700 VanDerWaalsContact CE-CD1 3.49Å; M64-I700 HydrophobicContact CE-CG1 4.01Å; M64-I700 HydrophobicContact CE-CG2 3.35Å; M64-I700 HydrophobicContact SD-CG2 4.07Å; F689-I700 HydrophobicContact CE2-CD1 4.49Å; F689-I700 HydrophobicContact CE2-CG1 3.68Å; F689-I700 HydrophobicContact CZ-CD1 4.05Å; F689-I700 HydrophobicContact CZ-CG1 3.68Å; F694-I700 HydrophobicContact CD1-CB 3.82Å; F694-I700 HydrophobicContact CD1-CD1 4Å; F694-I700 HydrophobicContact CD1-CG1 3.74Å; F694-I700 HydrophobicContact CE1-CB 4.24Å; F694-I700 HydrophobicContact CE1-CD1 4.09Å; F694-I700 HydrophobicContact CE1-CG1 3.71Å; F694-I700 HydrophobicContact CG-CD1 4.32Å; F694-I700 HydrophobicContact CZ-CD1 4.47Å; F694-I700 HydrophobicContact CZ-CG1 4.46Å; D697-I700 WeakPolarHBondContact O-CG2 3.32Å; G698-I700 VanDerWaalsContact C-N 3.26Å; G698-I700 PolarHBondContact O-N 3.39Å; I700-E703 PolarHBondContact O-N 3.48Å; I700-A704 WeakPolarHBondContact O-CB 3.44Å; I700-A704 PolarHBondContact O-N 3.33Å
701	F	89	Confident	82.7	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.009	31%	0.312	C	S	.	.	H	α-helix	trans	-69.6	-37.6	176.8	-67.1	-72.2	0	0	0	111.3	M64 L628 A631 V632 V635 G698 K699 A705 I753 A756 L760	M64-F701 HydrophobicContact CG-CZ 4.2Å; M64-F701 HydrophobicContact SD-CE1 3.64Å; M64-F701 HydrophobicContact SD-CE2 3.67Å; M64-F701 HydrophobicContact SD-CZ 3.14Å; M64-F701 WeakPolarHBondContact SD-CZ 3.34Å; L628-F701 HydrophobicContact CD1-CZ 4.18Å; A631-F701 HydrophobicContact CB-CD1 3.95Å; A631-F701 HydrophobicContact CB-CE1 3.78Å; V632-F701 HydrophobicContact CG2-CE1 4.11Å; V632-F701 HydrophobicContact CG2-CZ 3.93Å; V635-F701 HydrophobicContact CG2-CD1 4.04Å; V635-F701 HydrophobicContact CG2-CE1 4.05Å; G698-F701 PolarHBondContact O-N 3.06Å; K699-F701 VanDerWaalsContact C-N 3.28Å; K699-F701 PolarHBondContact O-N 3.49Å; F701-A705 WeakPolarHBondContact O-CB 3.4Å; F701-A705 PolarHBondContact O-N 3.28Å; F701-I753 HydrophobicContact CB-CG2 4.21Å; F701-I753 HydrophobicContact CD1-CG2 3.83Å; F701-A756 HydrophobicContact CB-CB 4.17Å; F701-A756 HydrophobicContact CD1-CB 3.53Å; F701-A756 HydrophobicContact CD2-CB 3.68Å; F701-A756 HydrophobicContact CE1-CB 3.66Å; F701-A756 HydrophobicContact CE2-CB 3.81Å; F701-A756 HydrophobicContact CG-CB 3.52Å; F701-A756 HydrophobicContact CZ-CB 3.77Å; F701-L760 HydrophobicContact CD2-CD1 4.09Å; F701-L760 HydrophobicContact CE2-CD1 3.92Å
702	E	87.5	Confident	82.6	Confident	95 Å²	95	52.2 Å²	52.2	44%	0.444	32%	0.324	S	S	.	.	H	α-helix	trans	-65.3	-39.9	175.6	-65.1	-178.6	179.4	0	0	112.5	K699 K706	K699-E702 PolarHBondContact O-N 3.35Å; E702-K706 WeakPolarHBondContact O-CE 3.27Å; E702-K706 WeakPolarHBondContact O-CG 3.47Å
703	E	89	Confident	82.8	Confident	48 Å²	48	52.8 Å²	52.8	22%	0.224	32%	0.323	C	S	.	.	H	α-helix	trans	-76.5	-41.5	176.6	-63.7	-54.8	141.6	0	0	112.1	F689 K699 I700 A705 K706	F689-E703 HydrophobicContact CD2-CB 3.84Å; F689-E703 HydrophobicContact CE2-CB 4.3Å; K699-E703 WeakPolarHBondContact O-CG 3.21Å; K699-E703 PolarHBondContact O-N 2.89Å; I700-E703 PolarHBondContact O-N 3.48Å; E703-A705 VanDerWaalsContact C-N 3.29Å; E703-A705 PolarHBondContact O-N 3.48Å; E703-K706 WeakPolarHBondContact O-CB 3.3Å; E703-K706 PolarHBondContact O-N 3.29Å; E703-K706 IonicContact OE1-NZ 2.71Å; E703-K706 PolarHBondContact OE1-NZ 3.01Å; E703-K706 WeakPolarHBondContact OE2-CD 3.08Å; E703-K706 WeakPolarHBondContact OE2-CE 3.31Å; E703-K706 IonicContact OE2-NZ 2.62Å; E703-K706 PolarHBondContact OE2-NZ 3.46Å
704	A	90.4	Very high	83.5	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-61.4	-37.7	177.1	0	0	0	0	0	111.9	V635 I638 F689 I700 K706 I707 I753	V635-A704 HydrophobicContact CG2-CB 4.11Å; I638-A704 HydrophobicContact CD1-CB 3.92Å; F689-A704 HydrophobicContact CD2-CB 4.2Å; F689-A704 HydrophobicContact CE2-CB 3.7Å; F689-A704 HydrophobicContact CZ-CB 4.26Å; I700-A704 WeakPolarHBondContact O-CB 3.44Å; I700-A704 PolarHBondContact O-N 3.33Å; A704-K706 PolarHBondContact O-N 3.5Å; A704-K706 VanDerWaalsContact O-N 3.11Å; A704-I707 WeakPolarHBondContact O-CB 3.33Å; A704-I707 WeakPolarHBondContact O-CG1 3.47Å; A704-I707 PolarHBondContact O-N 3.01Å; A704-I707 VanDerWaalsContact O-N 3.09Å; A704-I753 HydrophobicContact CB-CG2 3.96Å
705	A	91.1	Very high	84.4	Confident	45 Å²	45	51.8 Å²	51.8	37%	0.372	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-11.1	176.1	0	0	0	0	0	114.2	F701 E703 I753 K754	F701-A705 WeakPolarHBondContact O-CB 3.4Å; F701-A705 PolarHBondContact O-N 3.28Å; E703-A705 VanDerWaalsContact C-N 3.29Å; E703-A705 PolarHBondContact O-N 3.48Å; A705-I753 HydrophobicContact CB-CB 4.17Å; A705-I753 HydrophobicContact CB-CG2 4.38Å; A705-K754 HydrophobicContact CB-CB 4.16Å
706	K	92.4	Very high	85.7	Confident	134 Å²	134	56.3 Å²	56.3	58%	0.583	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-10.6	175.4	-58.9	173.4	-164.7	168.6	0	112.9	E702 E703 A704 P708	E702-K706 WeakPolarHBondContact O-CE 3.27Å; E702-K706 WeakPolarHBondContact O-CG 3.47Å; E703-K706 WeakPolarHBondContact O-CB 3.3Å; E703-K706 PolarHBondContact O-N 3.29Å; E703-K706 IonicContact OE1-NZ 2.71Å; E703-K706 PolarHBondContact OE1-NZ 3.01Å; E703-K706 WeakPolarHBondContact OE2-CD 3.08Å; E703-K706 WeakPolarHBondContact OE2-CE 3.31Å; E703-K706 IonicContact OE2-NZ 2.62Å; E703-K706 PolarHBondContact OE2-NZ 3.46Å; A704-K706 PolarHBondContact O-N 3.5Å; A704-K706 VanDerWaalsContact O-N 3.11Å; K706-P708 WeakPolarHBondContact O-CD 3.4Å
707	I	93.2	Very high	86.7	Confident	9 Å²	9	55.7 Å²	55.7	5%	0.046	32%	0.323	C	S	.	.	S	Bend	trans	-68.9	122.5	-179.9	-62.1	168.6	0	0	0	108.1	I638 M682 I686 F689 A704 G709 F748	I638-I707 HydrophobicContact CD1-CD1 3.63Å; I638-I707 HydrophobicContact CG1-CD1 3.98Å; I638-I707 HydrophobicContact CG2-CD1 3.76Å; M682-I707 HydrophobicContact CG-CG2 4.4Å; I686-I707 HydrophobicContact CG1-CD1 4.29Å; I686-I707 HydrophobicContact CG1-CG2 4.02Å; F689-I707 HydrophobicContact CB-CD1 3.8Å; F689-I707 HydrophobicContact CB-CG1 4.04Å; F689-I707 HydrophobicContact CD1-CD1 4.05Å; F689-I707 HydrophobicContact CD2-CD1 4.25Å; F689-I707 HydrophobicContact CG-CD1 3.79Å; F689-I707 HydrophobicContact CG-CG1 4.48Å; A704-I707 WeakPolarHBondContact O-CB 3.33Å; A704-I707 WeakPolarHBondContact O-CG1 3.47Å; A704-I707 PolarHBondContact O-N 3.01Å; A704-I707 VanDerWaalsContact O-N 3.09Å; I707-G709 PolarHBondContact O-N 2.92Å; I707-F748 HydrophobicContact CB-CD2 4.42Å; I707-F748 HydrophobicContact CG2-CD2 3.88Å; I707-F748 HydrophobicContact CG2-CE2 3.71Å
708	P	92.6	Very high	87.7	Confident	49 Å²	49	50.3 Å²	50.3	32%	0.318	29%	0.294	S	S	.	.			trans	-68.8	125.5	177.7	26.6	-29.3	0	0	0	109.6	S681 K706	S681-P708 WeakPolarHBondContact O-CG 3.5Å; S681-P708 WeakPolarHBondContact OG-CG 3.37Å; K706-P708 WeakPolarHBondContact O-CD 3.4Å
709	G	89.1	Confident	88.5	Confident	28 Å²	28	51.6 Å²	51.6	29%	0.289	29%	0.294	S	S	.	.			trans	-79.1	175	172.1	0	0	0	0	0	112.8	I707 L746	I707-G709 PolarHBondContact O-N 2.92Å; G709-L746 CarbonylContact C-O 3.59Å; G709-L746 WeakPolarHBondContact CA-O 3.48Å
710	I	90.2	Very high	88.9	Confident	3 Å²	3	50.2 Å²	50.2	2%	0.015	30%	0.298	C	S	.	.			trans	-123.9	111.1	175.8	-51.7	-174.3	0	0	0	108.5	L675 V679 M682 F713 L746	L675-I710 HydrophobicContact CD1-CG2 3.85Å; V679-I710 HydrophobicContact CB-CD1 4.28Å; V679-I710 HydrophobicContact CG2-CD1 3.62Å; M682-I710 HydrophobicContact CB-CD1 4.28Å; M682-I710 HydrophobicContact CB-CG1 4.38Å; M682-I710 HydrophobicContact CE-CD1 3.95Å; M682-I710 HydrophobicContact SD-CD1 3.98Å; M682-I710 HydrophobicContact SD-CG1 4.13Å; I710-F713 HydrophobicContact CG2-CD2 3.57Å; I710-F713 HydrophobicContact CG2-CE2 3.71Å; I710-L746 HydrophobicContact CB-CB 3.92Å; I710-L746 HydrophobicContact CB-CD1 4.25Å; I710-L746 HydrophobicContact CD1-CD1 3.81Å; I710-L746 HydrophobicContact CG1-CB 4.39Å; I710-L746 HydrophobicContact CG1-CD1 4.25Å; I710-L746 PolarHBondContact N-O 3.14Å; I710-L746 CarbonylContact O-C 3.59Å
711	A	85.6	Confident	89	Confident	59 Å²	59	50.5 Å²	50.5	49%	0.488	30%	0.301	S	S	.	.			trans	-128.7	160.6	179.2	0	0	0	0	0	110.9	F713 D747	A711-F713 WeakPolarHBondContact O-CD2 3.43Å; A711-D747 HydrophobicContact CB-CB 4.19Å
712	G	83.4	Confident	89.1	Confident	89 Å²	89	50.4 Å²	50.4	92%	0.918	30%	0.301	S	S	*	.	S	Bend	trans	85.9	6.4	172.1	0	0	0	0	0	116.5
713	F	87.2	Confident	89.2	Confident	45 Å²	45	50.5 Å²	50.5	20%	0.197	30%	0.301	C	S	.	.			trans	-99.1	139.1	177.8	-66.8	-87.1	0	0	0	112.3	D674 L675 I710 A711 Y715 L718	D674-F713 HydrophobicContact CB-CE1 4Å; D674-F713 HydrophobicContact CB-CZ 3.99Å; L675-F713 HydrophobicContact CB-CD1 4Å; L675-F713 HydrophobicContact CB-CE1 3.73Å; L675-F713 HydrophobicContact CB-CZ 4.16Å; L675-F713 HydrophobicContact CD1-CD1 4.35Å; L675-F713 HydrophobicContact CD1-CD2 4.14Å; L675-F713 HydrophobicContact CD1-CE2 4.31Å; L675-F713 HydrophobicContact CD1-CG 4.16Å; L675-F713 HydrophobicContact CD1-CZ 4.49Å; I710-F713 HydrophobicContact CG2-CD2 3.57Å; I710-F713 HydrophobicContact CG2-CE2 3.71Å; A711-F713 WeakPolarHBondContact O-CD2 3.43Å; F713-Y715 HydrophobicContact CB-CD1 4.09Å; F713-Y715 HydrophobicContact CB-CE1 3.62Å; F713-Y715 HydrophobicContact CG-CE1 4.42Å; F713-Y715 PolarHBondContact O-N 2.95Å; F713-L718 HydrophobicContact CD1-CD1 4.33Å
714	N	87.9	Confident	89.1	Confident	95 Å²	95	52 Å²	52	51%	0.508	32%	0.321	S	S	.	.			trans	-94.9	89.5	169.6	-173.7	-21.6	0	0	0	110.1	K716 S717 L718	N714-K716 PolarHBondContact O-N 2.88Å; N714-K716 PolarHBondContact OD1-N 2.76Å; N714-S717 VanDerWaalsContact CG-OG 3.26Å; N714-S717 PolarHBondContact ND2-OG 3.34Å; N714-S717 PolarHBondContact O-N 3.04Å; N714-S717 PolarHBondContact OD1-N 2.86Å; N714-S717 PolarHBondContact OD1-OG 3.19Å; N714-L718 PolarHBondContact O-N 3.01Å
715	Y	89.5	Confident	89	Confident	33 Å²	33	53.3 Å²	53.3	13%	0.129	33%	0.329	C	S	.	.	H	α-helix	trans	-62.1	-30.3	-177	-54	-58.9	0	0	0	113.5	L675 F713 L718 K719 I741 T742	L675-Y715 HydrophobicContact CD1-CE1 4.06Å; L675-Y715 HydrophobicContact CD2-CD1 4.47Å; L675-Y715 HydrophobicContact CD2-CE1 4.37Å; F713-Y715 HydrophobicContact CB-CD1 4.09Å; F713-Y715 HydrophobicContact CB-CE1 3.62Å; F713-Y715 HydrophobicContact CG-CE1 4.42Å; F713-Y715 PolarHBondContact O-N 2.95Å; Y715-L718 PolarHBondContact O-N 3.04Å; Y715-K719 WeakPolarHBondContact O-CB 3.11Å; Y715-K719 PolarHBondContact O-N 3.35Å; Y715-I741 HydrophobicContact CD1-CG2 3.42Å; Y715-I741 VanDerWaalsContact CD1-CG2 3.42Å; Y715-I741 HydrophobicContact CD2-CG2 4.26Å; Y715-I741 HydrophobicContact CE1-CD1 3.91Å; Y715-I741 HydrophobicContact CE1-CG1 4.26Å; Y715-I741 HydrophobicContact CE1-CG2 3.68Å; Y715-I741 HydrophobicContact CE2-CG2 4.47Å; Y715-I741 HydrophobicContact CG-CG2 3.74Å; Y715-T742 WeakPolarHBondContact CB-OG1 3.34Å
716	K	87.3	Confident	88.7	Confident	173 Å²	173	52.3 Å²	52.3	75%	0.752	32%	0.318	S	S	*	.	H	α-helix	trans	-69.2	-44.1	178.1	-169.5	178.4	-178.8	-179.4	0	111.4	N714 K719 A720	N714-K716 PolarHBondContact O-N 2.88Å; N714-K716 PolarHBondContact OD1-N 2.76Å; K716-K719 PolarHBondContact O-N 3.3Å; K716-A720 PolarHBondContact O-N 3.27Å; K716-A720 VanDerWaalsContact O-N 3.08Å
717	S	86.9	Confident	88.2	Confident	42 Å²	42	52.1 Å²	52.1	29%	0.294	33%	0.328	S	S	.	.	H	α-helix	trans	-63.8	-43.9	173.6	-65.9	0	0	0	0	111.5	N714 K719 A720 A721	N714-S717 VanDerWaalsContact CG-OG 3.26Å; N714-S717 PolarHBondContact ND2-OG 3.34Å; N714-S717 PolarHBondContact O-N 3.04Å; N714-S717 PolarHBondContact OD1-N 2.86Å; N714-S717 PolarHBondContact OD1-OG 3.19Å; S717-K719 PolarHBondContact O-N 3Å; S717-A720 PolarHBondContact O-N 3.5Å; S717-A721 WeakPolarHBondContact O-CB 3.28Å; S717-A721 PolarHBondContact O-N 3.32Å
718	L	89.1	Confident	87.7	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.01	36%	0.359	C	S	.	.	H	α-helix	trans	-59.3	-45.6	175.4	-82.1	171.5	0	0	0	112.4	D668 T671 L672 L675 F713 N714 Y715 A721 V722 L738	D668-L718 WeakPolarHBondContact O-CD2 3.46Å; T671-L718 WeakPolarHBondContact OG1-CD2 3.44Å; L672-L718 HydrophobicContact CB-CD2 4.35Å; L672-L718 HydrophobicContact CD1-CD2 4.23Å; L675-L718 HydrophobicContact CD2-CD1 3.9Å; F713-L718 HydrophobicContact CD1-CD1 4.33Å; N714-L718 PolarHBondContact O-N 3.01Å; Y715-L718 PolarHBondContact O-N 3.04Å; L718-A721 PolarHBondContact O-N 3.22Å; L718-V722 WeakPolarHBondContact O-CG2 3.5Å; L718-V722 PolarHBondContact O-N 3.32Å; L718-L738 HydrophobicContact CB-CD1 4.13Å; L718-L738 HydrophobicContact CB-CD2 4.12Å; L718-L738 HydrophobicContact CD1-CD2 4.38Å
719	K	90.6	Very high	87.4	Confident	47 Å²	47	56.6 Å²	56.6	20%	0.204	36%	0.363	C	S	.	.	H	α-helix	trans	-59.7	-49	177.8	179.3	172.3	172.2	173.2	0	110.8	Y715 K716 S717 A721 V722 E723 V735 L738 E739	Y715-K719 WeakPolarHBondContact O-CB 3.11Å; Y715-K719 PolarHBondContact O-N 3.35Å; K716-K719 PolarHBondContact O-N 3.3Å; S717-K719 PolarHBondContact O-N 3Å; K719-A721 VanDerWaalsContact C-N 3.3Å; K719-A721 PolarHBondContact O-N 3.29Å; K719-V722 PolarHBondContact O-N 3.21Å; K719-E723 WeakPolarHBondContact CE-OE1 3.14Å; K719-E723 HydrophobicContact CG-CG 4.42Å; K719-E723 IonicContact NZ-OE1 3.74Å; K719-E723 WeakPolarHBondContact O-CB 3.41Å; K719-E723 WeakPolarHBondContact O-CG 3.34Å; K719-E723 PolarHBondContact O-N 3.39Å; K719-V735 HydrophobicContact CD-CG1 4.38Å; K719-V735 HydrophobicContact CG-CG1 4.2Å; K719-L738 HydrophobicContact CB-CB 4.27Å; K719-L738 HydrophobicContact CB-CD1 4.37Å; K719-E739 IonicContact NZ-OE2 3.23Å; K719-E739 PolarHBondContact NZ-OE2 3.25Å
720	A	89	Confident	87.3	Confident	55 Å²	55	61.1 Å²	61.1	46%	0.455	37%	0.374	S	S	.	.	H	α-helix	trans	-60.6	-39.2	178	0	0	0	0	0	112.4	K716 S717 A724	K716-A720 PolarHBondContact O-N 3.27Å; K716-A720 VanDerWaalsContact O-N 3.08Å; S717-A720 PolarHBondContact O-N 3.5Å; A720-A724 WeakPolarHBondContact O-CB 3.35Å; A720-A724 PolarHBondContact O-N 2.94Å
721	A	88.8	Confident	87.3	Confident	8 Å²	8	61.8 Å²	61.8	7%	0.066	38%	0.377	C	S	.	.	H	α-helix	trans	-66	-41.8	177.4	0	0	0	0	0	112.3	T666 D668 I669 S717 L718 K719 A724 V725	T666-A721 HydrophobicContact CG2-CB 4.48Å; D668-A721 HydrophobicContact CB-CB 3.93Å; I669-A721 HydrophobicContact CG1-CB 4.11Å; S717-A721 WeakPolarHBondContact O-CB 3.28Å; S717-A721 PolarHBondContact O-N 3.32Å; L718-A721 PolarHBondContact O-N 3.22Å; K719-A721 VanDerWaalsContact C-N 3.3Å; K719-A721 PolarHBondContact O-N 3.29Å; A721-A724 PolarHBondContact O-N 3.42Å; A721-V725 PolarHBondContact O-N 3.5Å
722	V	90.1	Very high	87.5	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-65.8	-45.5	176	173	0	0	0	0	111.1	I658 L672 L718 K719 A724 V725 D726 F731 I734 V735 L738	I658-V722 HydrophobicContact CD1-CB 4.1Å; I658-V722 HydrophobicContact CD1-CG1 3.7Å; I658-V722 HydrophobicContact CD1-CG2 3.75Å; L672-V722 HydrophobicContact CD2-CG2 4.43Å; L718-V722 WeakPolarHBondContact O-CG2 3.5Å; L718-V722 PolarHBondContact O-N 3.32Å; K719-V722 PolarHBondContact O-N 3.21Å; V722-A724 VanDerWaalsContact C-N 3.28Å; V722-A724 PolarHBondContact O-N 3.01Å; V722-V725 PolarHBondContact O-N 3.39Å; V722-V725 VanDerWaalsContact O-N 3.12Å; V722-D726 WeakPolarHBondContact O-CB 3.39Å; V722-D726 PolarHBondContact O-N 3.49Å; V722-F731 HydrophobicContact CG1-CB 3.98Å; V722-I734 HydrophobicContact CG1-CB 4.31Å; V722-I734 HydrophobicContact CG1-CG2 4.06Å; V722-I734 HydrophobicContact CG2-CG2 4.03Å; V722-V735 HydrophobicContact CB-CG2 4.36Å; V722-V735 HydrophobicContact CG1-CG2 3.58Å; V722-L738 HydrophobicContact CB-CD1 4.46Å; V722-L738 HydrophobicContact CG2-CD1 3.9Å
723	E	90.5	Very high	87.9	Confident	97 Å²	97	58.8 Å²	58.8	45%	0.453	34%	0.343	S	S	.	.	H	α-helix	trans	-61	-36.6	178.2	-74	174.1	163.2	0	0	112.2	K719 V725 D726 V735	K719-E723 WeakPolarHBondContact CE-OE1 3.14Å; K719-E723 HydrophobicContact CG-CG 4.42Å; K719-E723 IonicContact NZ-OE1 3.74Å; K719-E723 WeakPolarHBondContact O-CB 3.41Å; K719-E723 WeakPolarHBondContact O-CG 3.34Å; K719-E723 PolarHBondContact O-N 3.39Å; E723-V725 PolarHBondContact O-N 3.07Å; E723-D726 PolarHBondContact O-N 2.92Å; E723-V735 HydrophobicContact CG-CG1 3.99Å; E723-V735 HydrophobicContact CG-CG2 3.88Å; E723-V735 WeakPolarHBondContact OE1-CG1 3.44Å
724	A	87.4	Confident	88.2	Confident	79 Å²	79	57.5 Å²	57.5	65%	0.653	34%	0.338	S	S	*	.	H	α-helix	trans	-64.1	-28.4	176.8	0	0	0	0	0	113.3	A720 A721 V722	A720-A724 WeakPolarHBondContact O-CB 3.35Å; A720-A724 PolarHBondContact O-N 2.94Å; A721-A724 PolarHBondContact O-N 3.42Å; V722-A724 VanDerWaalsContact C-N 3.28Å; V722-A724 PolarHBondContact O-N 3.01Å
725	V	87	Confident	88.3	Confident	27 Å²	27	53.6 Å²	53.6	16%	0.164	32%	0.318	C	S	.	.	H	α-helix	trans	-92.7	-24.1	178.3	-178.2	0	0	0	0	111.6	I658 A661 A662 I669 A721 V722 E723 T727 F731	I658-V725 HydrophobicContact CG1-CG1 4.42Å; A661-V725 HydrophobicContact CB-CG1 3.3Å; A662-V725 HydrophobicContact CB-CG2 4.08Å; I669-V725 HydrophobicContact CD1-CG2 3.67Å; A721-V725 PolarHBondContact O-N 3.5Å; V722-V725 PolarHBondContact O-N 3.39Å; V722-V725 VanDerWaalsContact O-N 3.12Å; E723-V725 PolarHBondContact O-N 3.07Å; V725-T727 VanDerWaalsContact C-N 3.31Å; V725-T727 PolarHBondContact O-N 3.2Å; V725-F731 HydrophobicContact CG1-CE2 4.21Å
726	D	85.5	Confident	88.4	Confident	24 Å²	24	56.6 Å²	56.6	13%	0.128	34%	0.336	C	S	.	.			trans	-82	59.8	-175.7	-163	18.4	0	0	0	115.1	V722 E723 T728 G729 K730 F731 S732	V722-D726 WeakPolarHBondContact O-CB 3.39Å; V722-D726 PolarHBondContact O-N 3.49Å; E723-D726 PolarHBondContact O-N 2.92Å; D726-T728 PolarHBondContact O-N 3.22Å; D726-T728 VanDerWaalsContact O-N 3.13Å; D726-G729 VanDerWaalsContact OD1-CA 3.26Å; D726-G729 WeakPolarHBondContact OD1-CA 3.48Å; D726-G729 PolarHBondContact OD1-N 3.3Å; D726-G729 VanDerWaalsContact OD2-CA 3.29Å; D726-G729 WeakPolarHBondContact OD2-CA 3.27Å; D726-K730 PolarHBondContact OD1-N 3.43Å; D726-F731 HydrophobicContact CB-CB 4.02Å; D726-F731 HydrophobicContact CB-CD2 3.84Å; D726-F731 HydrophobicContact CB-CG 4.43Å; D726-F731 PolarHBondContact OD1-N 3.13Å; D726-F731 WeakPolarHBondContact OD2-CA 3.4Å; D726-F731 PolarHBondContact OD2-N 2.9Å; D726-S732 PolarHBondContact OD2-N 2.84Å
727	T	81.5	Confident	88.7	Confident	131 Å²	131	48.4 Å²	48.4	80%	0.804	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-12.7	178.8	55.7	0	0	0	0	115	V725	V725-T727 VanDerWaalsContact C-N 3.31Å; V725-T727 PolarHBondContact O-N 3.2Å
728	T	83	Confident	89	Confident	113 Å²	113	46.4 Å²	46.4	69%	0.693	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.1	-2.5	-174.1	59.7	0	0	0	0	113.8	D726 K730	D726-T728 PolarHBondContact O-N 3.22Å; D726-T728 VanDerWaalsContact O-N 3.13Å; T728-K730 PolarHBondContact O-N 3.15Å; T728-K730 WeakPolarHBondContact OG1-CB 3.32Å
729	G	85.4	Confident	89	Confident	39 Å²	39	50.9 Å²	50.9	40%	0.402	31%	0.307	S	S	.	.	S	Bend	trans	74	9.1	-172.5	0	0	0	0	0	114.4	D726 F731 S732	D726-G729 VanDerWaalsContact OD1-CA 3.26Å; D726-G729 WeakPolarHBondContact OD1-CA 3.48Å; D726-G729 PolarHBondContact OD1-N 3.3Å; D726-G729 VanDerWaalsContact OD2-CA 3.29Å; D726-G729 WeakPolarHBondContact OD2-CA 3.27Å; G729-F731 PolarHBondContact O-N 2.92Å; G729-S732 WeakPolarHBondContact O-CB 3.48Å; G729-S732 PolarHBondContact O-N 2.99Å; G729-S732 PolarHBondContact O-OG 3.35Å
730	K	87.4	Confident	89	Confident	122 Å²	122	49.7 Å²	49.7	53%	0.53	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-30.9	179.3	-177.7	-178.5	176	-172.7	0	111.8	D657 D726 T728	D657-K730 VanDerWaalsContact CG-NZ 3.35Å; D657-K730 VanDerWaalsContact OD2-CE 3.31Å; D657-K730 WeakPolarHBondContact OD2-CE 3.49Å; D657-K730 IonicContact OD2-NZ 2.65Å; D657-K730 PolarHBondContact OD2-NZ 3.37Å; D726-K730 PolarHBondContact OD1-N 3.43Å; T728-K730 PolarHBondContact O-N 3.15Å; T728-K730 WeakPolarHBondContact OG1-CB 3.32Å
731	F	90.3	Very high	89	Confident	17 Å²	17	47.1 Å²	47.1	8%	0.075	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	9.7	-177.4	-49.4	-60.5	0	0	0	113.8	D657 I658 A661 V722 V725 D726 G729 G733 I734 V735	D657-F731 HydrophobicContact CB-CE1 4.03Å; D657-F731 HydrophobicContact CB-CZ 4.33Å; I658-F731 HydrophobicContact CB-CD1 4.13Å; I658-F731 HydrophobicContact CB-CE1 3.79Å; I658-F731 HydrophobicContact CB-CE2 4.3Å; I658-F731 HydrophobicContact CB-CZ 3.88Å; I658-F731 HydrophobicContact CD1-CB 4.32Å; I658-F731 HydrophobicContact CD1-CD1 4.33Å; I658-F731 HydrophobicContact CD1-CD2 4.13Å; I658-F731 HydrophobicContact CD1-CG 4.01Å; I658-F731 HydrophobicContact CG1-CD1 4.49Å; I658-F731 HydrophobicContact CG1-CD2 4.22Å; I658-F731 HydrophobicContact CG1-CE1 4.42Å; I658-F731 HydrophobicContact CG1-CE2 4.15Å; I658-F731 HydrophobicContact CG1-CG 4.4Å; I658-F731 HydrophobicContact CG1-CZ 4.25Å; A661-F731 HydrophobicContact CB-CE2 4.14Å; A661-F731 HydrophobicContact CB-CZ 4.23Å; V722-F731 HydrophobicContact CG1-CB 3.98Å; V725-F731 HydrophobicContact CG1-CE2 4.21Å; D726-F731 HydrophobicContact CB-CB 4.02Å; D726-F731 HydrophobicContact CB-CD2 3.84Å; D726-F731 HydrophobicContact CB-CG 4.43Å; D726-F731 PolarHBondContact OD1-N 3.13Å; D726-F731 WeakPolarHBondContact OD2-CA 3.4Å; D726-F731 PolarHBondContact OD2-N 2.9Å; G729-F731 PolarHBondContact O-N 2.92Å; F731-G733 PolarHBondContact O-N 3.48Å; F731-I734 HydrophobicContact CB-CD1 4.48Å; F731-I734 HydrophobicContact CD1-CD1 4.36Å; F731-I734 WeakPolarHBondContact O-CA 3.36Å; F731-I734 WeakPolarHBondContact O-CB 3.44Å; F731-I734 PolarHBondContact O-N 2.94Å; F731-V735 PolarHBondContact O-N 2.99Å; F731-V735 VanDerWaalsContact O-N 3.15Å
732	S	89.7	Confident	88.8	Confident	58 Å²	58	50.1 Å²	50.1	41%	0.406	30%	0.3	S	S	.	.	H	α-helix	trans	-49.8	-35.1	176.9	53.2	0	0	0	0	114.1	D726 G729 I734 V735 N736	D726-S732 PolarHBondContact OD2-N 2.84Å; G729-S732 WeakPolarHBondContact O-CB 3.48Å; G729-S732 PolarHBondContact O-N 2.99Å; G729-S732 PolarHBondContact O-OG 3.35Å; S732-I734 VanDerWaalsContact C-N 3.33Å; S732-I734 PolarHBondContact O-N 3.44Å; S732-V735 PolarHBondContact O-N 3.46Å; S732-N736 VanDerWaalsContact O-CG 3.27Å; S732-N736 PolarHBondContact O-N 2.88Å
733	G	91.8	Very high	88.3	Confident	28 Å²	28	56.2 Å²	56.2	29%	0.289	33%	0.333	S	S	.	.	H	α-helix	trans	-62.7	-35.9	174	0	0	0	0	0	113.8	P650 F731 A737	P650-G733 WeakPolarHBondContact CB-O 3.3Å; P650-G733 WeakPolarHBondContact CG-O 3.4Å; F731-G733 PolarHBondContact O-N 3.48Å; G733-A737 WeakPolarHBondContact O-CB 3.2Å; G733-A737 PolarHBondContact O-N 3.45Å; G733-A737 VanDerWaalsContact O-N 3.11Å
734	I	92.7	Very high	88	Confident	17 Å²	17	52.2 Å²	52.2	9%	0.087	32%	0.315	C	S	.	.	H	α-helix	trans	-72	-42.2	175	-63.2	173.6	0	0	0	109.9	P650 L651 L655 I658 L672 V722 F731 S732 N736 A737 L738	P650-I734 HydrophobicContact CB-CG1 4.39Å; L651-I734 HydrophobicContact CD2-CG2 3.98Å; L655-I734 HydrophobicContact CD2-CD1 3.7Å; I658-I734 HydrophobicContact CD1-CD1 4.42Å; L672-I734 HydrophobicContact CD2-CG2 4.44Å; V722-I734 HydrophobicContact CG1-CB 4.31Å; V722-I734 HydrophobicContact CG1-CG2 4.06Å; V722-I734 HydrophobicContact CG2-CG2 4.03Å; F731-I734 HydrophobicContact CB-CD1 4.48Å; F731-I734 HydrophobicContact CD1-CD1 4.36Å; F731-I734 WeakPolarHBondContact O-CA 3.36Å; F731-I734 WeakPolarHBondContact O-CB 3.44Å; F731-I734 PolarHBondContact O-N 2.94Å; S732-I734 VanDerWaalsContact C-N 3.33Å; S732-I734 PolarHBondContact O-N 3.44Å; I734-N736 PolarHBondContact O-N 2.93Å; I734-A737 PolarHBondContact O-N 2.92Å; I734-L738 HydrophobicContact CG2-CD1 4.02Å; I734-L738 HydrophobicContact CG2-CG 4.41Å; I734-L738 WeakPolarHBondContact O-CG 3.41Å; I734-L738 PolarHBondContact O-N 3.21Å
735	V	91.6	Very high	87.5	Confident	14 Å²	14	52.1 Å²	52.1	9%	0.085	30%	0.303	C	S	.	.	H	α-helix	trans	-57.8	-48.6	176.5	176.8	0	0	0	0	111	K719 V722 E723 F731 S732 A737 L738 E739	K719-V735 HydrophobicContact CD-CG1 4.38Å; K719-V735 HydrophobicContact CG-CG1 4.2Å; V722-V735 HydrophobicContact CB-CG2 4.36Å; V722-V735 HydrophobicContact CG1-CG2 3.58Å; E723-V735 HydrophobicContact CG-CG1 3.99Å; E723-V735 HydrophobicContact CG-CG2 3.88Å; E723-V735 WeakPolarHBondContact OE1-CG1 3.44Å; F731-V735 PolarHBondContact O-N 2.99Å; F731-V735 VanDerWaalsContact O-N 3.15Å; S732-V735 PolarHBondContact O-N 3.46Å; V735-A737 VanDerWaalsContact C-N 3.35Å; V735-A737 PolarHBondContact O-N 2.65Å; V735-L738 PolarHBondContact O-N 2.94Å; V735-E739 PolarHBondContact O-N 3.14Å
736	N	91.9	Very high	87.5	Confident	96 Å²	96	50.9 Å²	50.9	51%	0.513	30%	0.296	S	S	.	.	H	α-helix	trans	-62.4	-42.5	177.1	-68.7	-11.6	0	0	0	111.5	S732 I734 L738 E739 V740	S732-N736 VanDerWaalsContact O-CG 3.27Å; S732-N736 PolarHBondContact O-N 2.88Å; I734-N736 PolarHBondContact O-N 2.93Å; N736-L738 VanDerWaalsContact C-N 3.33Å; N736-L738 PolarHBondContact O-N 3.03Å; N736-E739 WeakPolarHBondContact O-CB 3.36Å; N736-E739 PolarHBondContact O-N 2.95Å; N736-E739 VanDerWaalsContact O-N 3.14Å; N736-V740 WeakPolarHBondContact O-CG2 3.46Å; N736-V740 PolarHBondContact O-N 2.56Å
737	A	93.4	Very high	87.7	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-63	-37.8	177.4	0	0	0	0	0	112.5	E647 P650 L651 G733 I734 V735 E739 V740 I741	E647-A737 VanDerWaalsContact O-CB 3.29Å; E647-A737 WeakPolarHBondContact O-CB 3.43Å; P650-A737 HydrophobicContact CB-CB 4.38Å; L651-A737 HydrophobicContact CD1-CB 3.85Å; L651-A737 HydrophobicContact CD2-CB 4.3Å; L651-A737 HydrophobicContact CG-CB 3.67Å; G733-A737 WeakPolarHBondContact O-CB 3.2Å; G733-A737 PolarHBondContact O-N 3.45Å; G733-A737 VanDerWaalsContact O-N 3.11Å; I734-A737 PolarHBondContact O-N 2.92Å; V735-A737 VanDerWaalsContact C-N 3.35Å; V735-A737 PolarHBondContact O-N 2.65Å; A737-E739 VanDerWaalsContact C-N 3.31Å; A737-V740 PolarHBondContact O-N 3.03Å; A737-I741 WeakPolarHBondContact O-CB 3.49Å; A737-I741 PolarHBondContact O-N 3.32Å
738	L	92.6	Very high	88	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-68.8	-28.2	174.5	-72.2	170.5	0	0	0	112.6	L651 L675 L718 K719 V722 I734 V735 N736 I741 T742	L651-L738 HydrophobicContact CD2-CD2 4.25Å; L651-L738 HydrophobicContact CD2-CG 4.29Å; L675-L738 HydrophobicContact CD2-CD2 3.74Å; L718-L738 HydrophobicContact CB-CD1 4.13Å; L718-L738 HydrophobicContact CB-CD2 4.12Å; L718-L738 HydrophobicContact CD1-CD2 4.38Å; K719-L738 HydrophobicContact CB-CB 4.27Å; K719-L738 HydrophobicContact CB-CD1 4.37Å; V722-L738 HydrophobicContact CB-CD1 4.46Å; V722-L738 HydrophobicContact CG2-CD1 3.9Å; I734-L738 HydrophobicContact CG2-CD1 4.02Å; I734-L738 HydrophobicContact CG2-CG 4.41Å; I734-L738 WeakPolarHBondContact O-CG 3.41Å; I734-L738 PolarHBondContact O-N 3.21Å; V735-L738 PolarHBondContact O-N 2.94Å; N736-L738 VanDerWaalsContact C-N 3.33Å; N736-L738 PolarHBondContact O-N 3.03Å; L738-I741 HydrophobicContact CD2-CG2 4.38Å; L738-I741 WeakPolarHBondContact O-CG2 3.36Å; L738-T742 PolarHBondContact O-N 3.41Å; L738-T742 PolarHBondContact O-OG1 3.41Å
739	E	89.9	Confident	88.2	Confident	96 Å²	96	49.1 Å²	49.1	45%	0.449	27%	0.271	S	S	.	.	H	α-helix	trans	-72.8	-43.6	172.1	-175	162.8	177.1	0	0	111.7	K719 V735 N736 A737 T742 N743	K719-E739 IonicContact NZ-OE2 3.23Å; K719-E739 PolarHBondContact NZ-OE2 3.25Å; V735-E739 PolarHBondContact O-N 3.14Å; N736-E739 WeakPolarHBondContact O-CB 3.36Å; N736-E739 PolarHBondContact O-N 2.95Å; N736-E739 VanDerWaalsContact O-N 3.14Å; A737-E739 VanDerWaalsContact C-N 3.31Å; E739-T742 WeakPolarHBondContact O-CB 3.49Å; E739-T742 PolarHBondContact O-N 2.81Å; E739-N743 PolarHBondContact O-ND2 2.86Å; E739-N743 VanDerWaalsContact O-ND2 3.16Å
740	V	89.3	Confident	88.3	Confident	23 Å²	23	51.7 Å²	51.7	14%	0.139	27%	0.271	C	S	.	.	H	α-helix	trans	-62	-47.2	175.7	173.8	0	0	0	0	110.8	N644 E647 L648 N736 A737 T742 N743 L744	N644-V740 HydrophobicContact CB-CG1 4.06Å; E647-V740 HydrophobicContact CB-CG2 4.27Å; E647-V740 VanDerWaalsContact OE2-CG2 3.3Å; E647-V740 WeakPolarHBondContact OE2-CG2 3.38Å; L648-V740 HydrophobicContact CD2-CB 4.26Å; L648-V740 HydrophobicContact CD2-CG1 3.96Å; L648-V740 HydrophobicContact CG-CG1 4.33Å; N736-V740 WeakPolarHBondContact O-CG2 3.46Å; N736-V740 PolarHBondContact O-N 2.56Å; A737-V740 PolarHBondContact O-N 3.03Å; V740-T742 VanDerWaalsContact C-N 3.26Å; V740-T742 PolarHBondContact O-N 3.48Å; V740-N743 PolarHBondContact O-N 3.1Å; V740-L744 HydrophobicContact CG1-CD1 3.68Å; V740-L744 HydrophobicContact CG1-CG 4.27Å; V740-L744 WeakPolarHBondContact O-CG 3.44Å; V740-L744 PolarHBondContact O-N 3.08Å
741	I	90	Very high	88.4	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-63	-33.1	-178.7	-149.2	175.2	0	0	0	112.4	L648 L651 L675 V679 Y715 A737 L738 N743 L744 L746	L648-I741 HydrophobicContact CD2-CB 3.99Å; L648-I741 HydrophobicContact CD2-CG1 4.25Å; L651-I741 HydrophobicContact CD1-CD1 4.12Å; L675-I741 HydrophobicContact CD1-CD1 4.02Å; V679-I741 HydrophobicContact CG2-CD1 4.25Å; Y715-I741 HydrophobicContact CD1-CG2 3.42Å; Y715-I741 VanDerWaalsContact CD1-CG2 3.42Å; Y715-I741 HydrophobicContact CD2-CG2 4.26Å; Y715-I741 HydrophobicContact CE1-CD1 3.91Å; Y715-I741 HydrophobicContact CE1-CG1 4.26Å; Y715-I741 HydrophobicContact CE1-CG2 3.68Å; Y715-I741 HydrophobicContact CE2-CG2 4.47Å; Y715-I741 HydrophobicContact CG-CG2 3.74Å; A737-I741 WeakPolarHBondContact O-CB 3.49Å; A737-I741 PolarHBondContact O-N 3.32Å; L738-I741 HydrophobicContact CD2-CG2 4.38Å; L738-I741 WeakPolarHBondContact O-CG2 3.36Å; I741-N743 PolarHBondContact O-N 3.21Å; I741-L744 PolarHBondContact O-N 3.39Å; I741-L746 HydrophobicContact CD1-CD1 3.61Å; I741-L746 HydrophobicContact CG1-CD1 3.34Å; I741-L746 HydrophobicContact CG1-CG 4.11Å
742	T	84	Confident	88.3	Confident	70 Å²	70	49.7 Å²	49.7	43%	0.429	27%	0.266	S	S	.	.	H	α-helix	trans	-60.6	-29.3	176.5	-61.4	0	0	0	0	111.7	Y715 L738 E739 V740	Y715-T742 WeakPolarHBondContact CB-OG1 3.34Å; L738-T742 PolarHBondContact O-N 3.41Å; L738-T742 PolarHBondContact O-OG1 3.41Å; E739-T742 WeakPolarHBondContact O-CB 3.49Å; E739-T742 PolarHBondContact O-N 2.81Å; V740-T742 VanDerWaalsContact C-N 3.26Å; V740-T742 PolarHBondContact O-N 3.48Å
743	N	80.3	Confident	88.3	Confident	128 Å²	128	47.2 Å²	47.2	68%	0.684	25%	0.249	S	C	*	.	H	α-helix	trans	-95.2	-11	-177.3	-62.7	-39.6	0	0	0	114.1	E739 V740 I741	E739-N743 PolarHBondContact O-ND2 2.86Å; E739-N743 VanDerWaalsContact O-ND2 3.16Å; V740-N743 PolarHBondContact O-N 3.1Å; I741-N743 PolarHBondContact O-N 3.21Å
744	L	83.3	Confident	88.2	Confident	14 Å²	14	52.9 Å²	52.9	7%	0.073	27%	0.265	C	S	.	.	H	α-helix	trans	-95.2	-14.9	-172.1	-74.4	175.9	0	0	0	115	T637 K640 V641 N644 L648 V740 I741 L746	T637-L744 WeakPolarHBondContact CG2-O 3.44Å; K640-L744 HydrophobicContact CB-CD2 3.79Å; V641-L744 HydrophobicContact CG2-CD1 4.49Å; N644-L744 HydrophobicContact CB-CD1 4.02Å; L648-L744 HydrophobicContact CD1-CD1 3.87Å; L648-L744 HydrophobicContact CD2-CD1 4.47Å; L648-L744 HydrophobicContact CG-CD1 4.45Å; V740-L744 HydrophobicContact CG1-CD1 3.68Å; V740-L744 HydrophobicContact CG1-CG 4.27Å; V740-L744 WeakPolarHBondContact O-CG 3.44Å; V740-L744 PolarHBondContact O-N 3.08Å; I741-L744 PolarHBondContact O-N 3.39Å; L744-L746 HydrophobicContact CB-CD2 3.71Å; L744-L746 HydrophobicContact CB-CG 4.39Å
745	D	78.2	Confident	87.8	Confident	76 Å²	76	52.9 Å²	52.9	41%	0.406	27%	0.266	S	S	.	.			trans	49.5	74.9	173.8	-163.3	-5	0	0	0	114.7	D747 K750 Y751	D745-D747 PolarHBondContact O-N 3.14Å; D745-K750 WeakPolarHBondContact OD1-CE 3.49Å; D745-K750 IonicContact OD1-NZ 2.53Å; D745-K750 PolarHBondContact OD1-NZ 3.31Å; D745-K750 IonicContact OD2-NZ 3.02Å; D745-K750 PolarHBondContact OD2-NZ 2.85Å; D745-Y751 PolarHBondContact O-OH 2.85Å
746	L	87	Confident	87.7	Confident	2 Å²	2	52.2 Å²	52.2	1%	0.01	26%	0.262	C	S	.	.			trans	-87.4	5.6	-165.6	-57.3	-171.5	0	0	0	115.3	V641 M682 G709 I710 I741 L744 F748	V641-L746 HydrophobicContact CG2-CD2 3.33Å; M682-L746 HydrophobicContact CE-CD1 3.87Å; M682-L746 HydrophobicContact SD-CB 4.46Å; M682-L746 HydrophobicContact SD-CD1 3.89Å; M682-L746 HydrophobicContact SD-CD2 4.22Å; M682-L746 HydrophobicContact SD-CG 4.45Å; G709-L746 CarbonylContact C-O 3.59Å; G709-L746 WeakPolarHBondContact CA-O 3.48Å; I710-L746 HydrophobicContact CB-CB 3.92Å; I710-L746 HydrophobicContact CB-CD1 4.25Å; I710-L746 HydrophobicContact CD1-CD1 3.81Å; I710-L746 HydrophobicContact CG1-CB 4.39Å; I710-L746 HydrophobicContact CG1-CD1 4.25Å; I710-L746 PolarHBondContact N-O 3.14Å; I710-L746 CarbonylContact O-C 3.59Å; I741-L746 HydrophobicContact CD1-CD1 3.61Å; I741-L746 HydrophobicContact CG1-CD1 3.34Å; I741-L746 HydrophobicContact CG1-CG 4.11Å; L744-L746 HydrophobicContact CB-CD2 3.71Å; L744-L746 HydrophobicContact CB-CG 4.39Å; L746-F748 PolarHBondContact O-N 3.43Å
747	D	88.1	Confident	87.4	Confident	49 Å²	49	48.5 Å²	48.5	26%	0.262	24%	0.244	S	C	.	.			trans	-77.4	91.7	174.1	179.1	7	0	0	0	109.2	A711 D745 E749 K750 Y751	A711-D747 HydrophobicContact CB-CB 4.19Å; D745-D747 PolarHBondContact O-N 3.14Å; D747-E749 VanDerWaalsContact C-N 3.33Å; D747-E749 PolarHBondContact OD1-N 3.42Å; D747-K750 HydrophobicContact CB-CD 4.11Å; D747-K750 VanDerWaalsContact O-CD 3.31Å; D747-K750 WeakPolarHBondContact O-CD 3.45Å; D747-K750 VanDerWaalsContact O-CG 3.23Å; D747-K750 WeakPolarHBondContact O-CG 3.33Å; D747-Y751 WeakPolarHBondContact O-CE2 3.25Å
748	F	89.2	Confident	87.2	Confident	8 Å²	8	52.5 Å²	52.5	4%	0.035	27%	0.272	C	S	.	.			trans	-74.9	-21.3	-175.4	-62	-47.3	0	0	0	114.1	T637 I638 V641 M682 I707 L746 K750 Y751	T637-F748 HydrophobicContact CG2-CE1 3.93Å; I638-F748 HydrophobicContact CG1-CD1 4.12Å; I638-F748 HydrophobicContact CG1-CE1 3.73Å; I638-F748 HydrophobicContact CG1-CE2 4.28Å; I638-F748 HydrophobicContact CG1-CZ 3.83Å; V641-F748 HydrophobicContact CG2-CZ 4.21Å; M682-F748 HydrophobicContact CG-CE2 4.03Å; M682-F748 HydrophobicContact SD-CE2 3.9Å; M682-F748 HydrophobicContact SD-CZ 4.15Å; I707-F748 HydrophobicContact CB-CD2 4.42Å; I707-F748 HydrophobicContact CG2-CD2 3.88Å; I707-F748 HydrophobicContact CG2-CE2 3.71Å; L746-F748 PolarHBondContact O-N 3.43Å; F748-K750 VanDerWaalsContact C-N 3.26Å; F748-K750 PolarHBondContact O-N 2.82Å; F748-Y751 HydrophobicContact CD1-CD2 4.26Å; F748-Y751 HydrophobicContact CD1-CE2 4.06Å; F748-Y751 PolarHBondContact O-N 3.32Å
749	E	87	Confident	87.1	Confident	174 Å²	174	52.6 Å²	52.6	81%	0.813	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-64.7	-34.7	-176.4	-67.5	-171.2	171.2	0	0	111.4	D747 Y751 D752	D747-E749 VanDerWaalsContact C-N 3.33Å; D747-E749 PolarHBondContact OD1-N 3.42Å; E749-Y751 PolarHBondContact O-N 3.43Å; E749-Y751 VanDerWaalsContact O-N 3.17Å; E749-D752 PolarHBondContact O-N 3.29Å
750	K	86.9	Confident	87.1	Confident	92 Å²	92	49.3 Å²	49.3	40%	0.4	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-65.5	-17.8	-179.5	81.6	-164.9	-172.1	161.3	0	114.7	D745 D747 F748 D752	D745-K750 WeakPolarHBondContact OD1-CE 3.49Å; D745-K750 IonicContact OD1-NZ 2.53Å; D745-K750 PolarHBondContact OD1-NZ 3.31Å; D745-K750 IonicContact OD2-NZ 3.02Å; D745-K750 PolarHBondContact OD2-NZ 2.85Å; D747-K750 HydrophobicContact CB-CD 4.11Å; D747-K750 VanDerWaalsContact O-CD 3.31Å; D747-K750 WeakPolarHBondContact O-CD 3.45Å; D747-K750 VanDerWaalsContact O-CG 3.23Å; D747-K750 WeakPolarHBondContact O-CG 3.33Å; F748-K750 VanDerWaalsContact C-N 3.26Å; F748-K750 PolarHBondContact O-N 2.82Å; K750-D752 VanDerWaalsContact C-N 3.28Å
751	Y	88.9	Confident	87	Confident	11 Å²	11	55.4 Å²	55.4	4%	0.043	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-84.1	-3.2	-180	-59.3	-73.6	0	0	0	112.9	L630 L633 T637 D745 D747 F748 E749 I753	L630-Y751 HydrophobicContact CD1-CD1 4.12Å; L630-Y751 VanDerWaalsContact CG-O 3.28Å; L630-Y751 WeakPolarHBondContact CG-O 3.45Å; L633-Y751 HydrophobicContact CB-CD1 4.43Å; L633-Y751 HydrophobicContact CD2-CD1 4.26Å; L633-Y751 HydrophobicContact CD2-CE1 3.9Å; L633-Y751 HydrophobicContact CG-CD1 4.25Å; L633-Y751 HydrophobicContact CG-CE1 3.91Å; T637-Y751 PolarHBondContact OG1-OH 2.69Å; D745-Y751 PolarHBondContact O-OH 2.85Å; D747-Y751 WeakPolarHBondContact O-CE2 3.25Å; F748-Y751 HydrophobicContact CD1-CD2 4.26Å; F748-Y751 HydrophobicContact CD1-CE2 4.06Å; F748-Y751 PolarHBondContact O-N 3.32Å; E749-Y751 PolarHBondContact O-N 3.43Å; E749-Y751 VanDerWaalsContact O-N 3.17Å; Y751-I753 PolarHBondContact O-N 2.96Å
752	D	89	Confident	87.1	Confident	87 Å²	87	56.9 Å²	56.9	47%	0.465	30%	0.295	S	S	.	.			trans	41	47	-179.5	-167.2	15	0	0	0	113.2	L630 E749 K750 K754 S755	L630-D752 HydrophobicContact CD2-CB 4.31Å; E749-D752 PolarHBondContact O-N 3.29Å; K750-D752 VanDerWaalsContact C-N 3.28Å; D752-K754 PolarHBondContact O-N 3.49Å; D752-S755 VanDerWaalsContact O-CB 3.29Å; D752-S755 WeakPolarHBondContact O-CB 3.43Å; D752-S755 PolarHBondContact O-N 3.41Å; D752-S755 PolarHBondContact O-OG 2.96Å; D752-S755 WeakPolarHBondContact OD2-CB 3.42Å
753	I	90.7	Very high	87.4	Confident	6 Å²	6	53.9 Å²	53.9	3%	0.031	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-54.7	-32.7	-168	-60.2	179.8	0	0	0	111.6	V635 I638 F701 A704 A705 Y751 S755 A756	V635-I753 HydrophobicContact CG2-CG2 4.21Å; I638-I753 HydrophobicContact CD1-CD1 4Å; F701-I753 HydrophobicContact CB-CG2 4.21Å; F701-I753 HydrophobicContact CD1-CG2 3.83Å; A704-I753 HydrophobicContact CB-CG2 3.96Å; A705-I753 HydrophobicContact CB-CB 4.17Å; A705-I753 HydrophobicContact CB-CG2 4.38Å; Y751-I753 PolarHBondContact O-N 2.96Å; I753-S755 VanDerWaalsContact C-N 3.26Å; I753-S755 PolarHBondContact O-N 3Å; I753-A756 PolarHBondContact O-N 2.85Å
754	K	88	Confident	87.6	Confident	147 Å²	147	52.8 Å²	52.8	64%	0.639	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-67.4	-22.6	-178.9	-167.6	175.5	-179.4	179.2	0	113.6	A705 D752 A756	A705-K754 HydrophobicContact CB-CB 4.16Å; D752-K754 PolarHBondContact O-N 3.49Å; K754-A756 PolarHBondContact O-N 3.3Å
755	S	85.7	Confident	88	Confident	16 Å²	16	54.9 Å²	54.9	11%	0.112	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-62.6	-29.3	179.3	66.6	0	0	0	0	112.8	D752 I753 S757 S758 S759	D752-S755 VanDerWaalsContact O-CB 3.29Å; D752-S755 WeakPolarHBondContact O-CB 3.43Å; D752-S755 PolarHBondContact O-N 3.41Å; D752-S755 PolarHBondContact O-OG 2.96Å; D752-S755 WeakPolarHBondContact OD2-CB 3.42Å; I753-S755 VanDerWaalsContact C-N 3.26Å; I753-S755 PolarHBondContact O-N 3Å; S755-S757 PolarHBondContact O-N 2.89Å; S755-S757 VanDerWaalsContact O-N 3.12Å; S755-S758 PolarHBondContact O-N 3.48Å; S755-S759 PolarHBondContact O-N 3.36Å
756	A	88.9	Confident	88.6	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-55.7	-32.8	-177.6	0	0	0	0	0	114.2	L628 A631 F701 I753 K754 S758 S759 L760	L628-A756 HydrophobicContact CD1-CB 4.17Å; A631-A756 HydrophobicContact CB-CB 3.6Å; F701-A756 HydrophobicContact CB-CB 4.17Å; F701-A756 HydrophobicContact CD1-CB 3.53Å; F701-A756 HydrophobicContact CD2-CB 3.68Å; F701-A756 HydrophobicContact CE1-CB 3.66Å; F701-A756 HydrophobicContact CE2-CB 3.81Å; F701-A756 HydrophobicContact CG-CB 3.52Å; F701-A756 HydrophobicContact CZ-CB 3.77Å; I753-A756 PolarHBondContact O-N 2.85Å; K754-A756 PolarHBondContact O-N 3.3Å; A756-S758 PolarHBondContact O-N 3.38Å; A756-S759 CarbonylContact O-C 3.47Å; A756-S759 WeakPolarHBondContact O-CA 3.3Å; A756-S759 WeakPolarHBondContact O-CB 3.47Å; A756-S759 PolarHBondContact O-N 3.27Å; A756-L760 WeakPolarHBondContact O-CG 3.36Å; A756-L760 PolarHBondContact O-N 2.95Å
757	S	86.3	Confident	88.7	Confident	19 Å²	19	52.7 Å²	52.7	13%	0.133	28%	0.277	C	S	.	.	H	α-helix	trans	-59.7	-31.4	178.3	-66.5	0	0	0	0	112.9	S755 K761	S755-S757 PolarHBondContact O-N 2.89Å; S755-S757 VanDerWaalsContact O-N 3.12Å; S757-K761 WeakPolarHBondContact O-CG 3.4Å
758	S	87.6	Confident	88.6	Confident	84 Å²	84	55.5 Å²	55.5	59%	0.587	29%	0.292	S	S	*	.	H	α-helix	trans	-76.8	-39	174.1	-59.6	0	0	0	0	111.1	S755 A756 K761 A762	S755-S758 PolarHBondContact O-N 3.48Å; A756-S758 PolarHBondContact O-N 3.38Å; S758-K761 PolarHBondContact O-N 2.83Å; S758-A762 PolarHBondContact O-N 2.96Å
759	S	91.3	Very high	88.7	Confident	2 Å²	2	60 Å²	60	1%	0.014	31%	0.312	C	S	.	.	H	α-helix	trans	-61.8	-42.4	176.5	-58.1	0	0	0	0	112.5	I624 D627 S755 A756 K761 A762 L763	I624-S759 PolarHBondContact O-OG 2.91Å; D627-S759 WeakPolarHBondContact CB-OG 3.46Å; S755-S759 PolarHBondContact O-N 3.36Å; A756-S759 CarbonylContact O-C 3.47Å; A756-S759 WeakPolarHBondContact O-CA 3.3Å; A756-S759 WeakPolarHBondContact O-CB 3.47Å; A756-S759 PolarHBondContact O-N 3.27Å; S759-K761 PolarHBondContact O-N 3.43Å; S759-A762 PolarHBondContact O-N 3.09Å; S759-L763 WeakPolarHBondContact O-CB 3.48Å; S759-L763 PolarHBondContact O-N 3.47Å
760	L	89.4	Confident	88.9	Confident	27 Å²	27	51.7 Å²	51.7	14%	0.141	27%	0.273	C	S	.	.	H	α-helix	trans	-61.7	-43.9	176.3	-68	177.8	0	0	0	112	L67 L628 F701 A756 A762 L763 D764	L67-L760 HydrophobicContact CD2-CD2 3.61Å; L628-L760 HydrophobicContact CD1-CD2 4.15Å; F701-L760 HydrophobicContact CD2-CD1 4.09Å; F701-L760 HydrophobicContact CE2-CD1 3.92Å; A756-L760 WeakPolarHBondContact O-CG 3.36Å; A756-L760 PolarHBondContact O-N 2.95Å; L760-A762 VanDerWaalsContact C-N 3.34Å; L760-A762 PolarHBondContact O-N 2.96Å; L760-L763 WeakPolarHBondContact O-CB 3.48Å; L760-L763 PolarHBondContact O-N 2.93Å; L760-L763 VanDerWaalsContact O-N 3.14Å; L760-D764 PolarHBondContact O-N 3.46Å
761	K	88.3	Confident	88.9	Confident	151 Å²	151	51 Å²	51	66%	0.657	27%	0.271	S	S	*	.	H	α-helix	trans	-63.5	-40	176	-71.2	174.5	-176	173.7	0	112.4	S757 S758 S759 L763 D764 A765	S757-K761 WeakPolarHBondContact O-CG 3.4Å; S758-K761 PolarHBondContact O-N 2.83Å; S759-K761 PolarHBondContact O-N 3.43Å; K761-L763 PolarHBondContact O-N 3.5Å; K761-D764 PolarHBondContact O-N 3.28Å; K761-A765 PolarHBondContact O-N 3.22Å
762	A	90.8	Very high	88.8	Confident	32 Å²	32	53.2 Å²	53.2	26%	0.264	29%	0.291	S	S	.	.	H	α-helix	trans	-66.4	-32.8	176.3	0	0	0	0	0	111.3	I624 S758 S759 L760 A765 F766	I624-A762 HydrophobicContact CD1-CB 3.54Å; I624-A762 HydrophobicContact CG1-CB 4.18Å; I624-A762 HydrophobicContact CG2-CB 4.46Å; S758-A762 PolarHBondContact O-N 2.96Å; S759-A762 PolarHBondContact O-N 3.09Å; L760-A762 VanDerWaalsContact C-N 3.34Å; L760-A762 PolarHBondContact O-N 2.96Å; A762-A765 PolarHBondContact O-N 3.32Å; A762-F766 PolarHBondContact O-N 3.18Å
763	L	90.1	Very high	88.7	Confident	6 Å²	6	51.6 Å²	51.6	3%	0.031	29%	0.285	C	S	.	.	H	α-helix	trans	-69.8	-39.9	176.1	-167.8	65.4	0	0	0	112.7	L67 V71 F618 S759 L760 K761 A765 F766 F767	L67-L763 HydrophobicContact CD1-CD2 3.54Å; L67-L763 HydrophobicContact CD2-CD2 4.08Å; L67-L763 HydrophobicContact CG-CD2 3.95Å; V71-L763 HydrophobicContact CG2-CD1 3.56Å; V71-L763 HydrophobicContact CG2-CD2 3.63Å; V71-L763 HydrophobicContact CG2-CG 4.25Å; F618-L763 HydrophobicContact CZ-CD1 4.16Å; S759-L763 WeakPolarHBondContact O-CB 3.48Å; S759-L763 PolarHBondContact O-N 3.47Å; L760-L763 WeakPolarHBondContact O-CB 3.48Å; L760-L763 PolarHBondContact O-N 2.93Å; L760-L763 VanDerWaalsContact O-N 3.14Å; K761-L763 PolarHBondContact O-N 3.5Å; L763-A765 VanDerWaalsContact C-N 3.3Å; L763-A765 PolarHBondContact O-N 3Å; L763-F766 HydrophobicContact CD1-CD1 3.72Å; L763-F766 HydrophobicContact CD1-CE1 4.45Å; L763-F766 HydrophobicContact CD1-CG 4.46Å; L763-F766 WeakPolarHBondContact O-CB 3.37Å; L763-F766 PolarHBondContact O-N 3.34Å; L763-F767 HydrophobicContact CD1-CD2 4.35Å; L763-F767 HydrophobicContact CD1-CE2 3.79Å; L763-F767 HydrophobicContact CD1-CZ 4.1Å; L763-F767 HydrophobicContact CD2-CE2 3.76Å; L763-F767 HydrophobicContact CD2-CZ 4.42Å; L763-F767 HydrophobicContact CG-CD2 3.9Å; L763-F767 HydrophobicContact CG-CE2 3.42Å; L763-F767 VanDerWaalsContact CG-CE2 3.42Å; L763-F767 HydrophobicContact CG-CZ 4.2Å; L763-F767 VanDerWaalsContact O-CD2 3.27Å; L763-F767 WeakPolarHBondContact O-CD2 3.21Å; L763-F767 PolarHBondContact O-N 3.1Å
764	D	86.3	Confident	88.5	Confident	105 Å²	105	51.4 Å²	51.4	56%	0.561	28%	0.284	S	S	*	.	H	α-helix	trans	-58.4	-43.9	171	-72.1	-30.8	0	0	0	111.2	L760 K761 F766 N768	L760-D764 PolarHBondContact O-N 3.46Å; K761-D764 PolarHBondContact O-N 3.28Å; D764-F766 VanDerWaalsContact C-N 3.33Å; D764-F766 PolarHBondContact O-N 2.98Å; D764-N768 PolarHBondContact O-N 3.05Å; D764-N768 PolarHBondContact O-ND2 3.32Å
765	A	90.1	Very high	88.3	Confident	59 Å²	59	48.1 Å²	48.1	49%	0.488	27%	0.27	S	S	.	.	H	α-helix	trans	-64.1	-39.1	176.1	0	0	0	0	0	111.9	K761 A762 L763 K769	K761-A765 PolarHBondContact O-N 3.22Å; A762-A765 PolarHBondContact O-N 3.32Å; L763-A765 VanDerWaalsContact C-N 3.3Å; L763-A765 PolarHBondContact O-N 3Å; A765-K769 WeakPolarHBondContact O-CB 3.38Å; A765-K769 PolarHBondContact O-N 2.9Å; A765-K769 VanDerWaalsContact O-N 3.08Å
766	F	91.7	Very high	87.7	Confident	3 Å²	3	51.2 Å²	51.2	1%	0.013	29%	0.29	C	S	.	.	H	α-helix	trans	-59.2	-55.1	174.4	157.5	-105.3	0	0	0	111.8	I74 L614 F618 A762 L763 D764 N768 K769 Y770	I74-F766 HydrophobicContact CD1-CD1 4.4Å; I74-F766 HydrophobicContact CD1-CE1 3.48Å; I74-F766 VanDerWaalsContact CD1-CE1 3.48Å; I74-F766 HydrophobicContact CD1-CZ 3.64Å; I74-F766 HydrophobicContact CG1-CZ 4.49Å; I74-F766 HydrophobicContact CG2-CE2 4.49Å; I74-F766 HydrophobicContact CG2-CZ 4.34Å; L614-F766 HydrophobicContact CD2-CE2 4.15Å; L614-F766 HydrophobicContact CD2-CZ 3.88Å; F618-F766 HydrophobicContact CB-CD2 3.53Å; F618-F766 HydrophobicContact CB-CE2 3.98Å; F618-F766 HydrophobicContact CB-CG 4.29Å; F618-F766 HydrophobicContact CD1-CD2 4.23Å; F618-F766 HydrophobicContact CD1-CG 4.38Å; F618-F766 HydrophobicContact CD2-CB 3.74Å; F618-F766 HydrophobicContact CD2-CD2 4.19Å; F618-F766 HydrophobicContact CD2-CG 4.11Å; F618-F766 HydrophobicContact CE2-CB 4Å; F618-F766 HydrophobicContact CE2-CG 4.49Å; F618-F766 HydrophobicContact CG-CB 4.19Å; F618-F766 AromaticContact CG-CD2 3.77Å; F618-F766 HydrophobicContact CG-CD2 3.77Å; F618-F766 HydrophobicContact CG-CE2 4.39Å; F618-F766 HydrophobicContact CG-CG 4.04Å; A762-F766 PolarHBondContact O-N 3.18Å; L763-F766 HydrophobicContact CD1-CD1 3.72Å; L763-F766 HydrophobicContact CD1-CE1 4.45Å; L763-F766 HydrophobicContact CD1-CG 4.46Å; L763-F766 WeakPolarHBondContact O-CB 3.37Å; L763-F766 PolarHBondContact O-N 3.34Å; D764-F766 VanDerWaalsContact C-N 3.33Å; D764-F766 PolarHBondContact O-N 2.98Å; F766-N768 VanDerWaalsContact C-N 3.29Å; F766-N768 PolarHBondContact O-N 3.05Å; F766-K769 PolarHBondContact O-N 3.04Å; F766-Y770 HydrophobicContact CE2-CD2 4.24Å; F766-Y770 HydrophobicContact CE2-CG 4.07Å; F766-Y770 HydrophobicContact CZ-CD1 4.33Å; F766-Y770 HydrophobicContact CZ-CD2 4.46Å; F766-Y770 HydrophobicContact CZ-CG 4.05Å; F766-Y770 WeakPolarHBondContact O-CB 3.27Å; F766-Y770 PolarHBondContact O-N 3.43Å
767	F	88.7	Confident	86.7	Confident	29 Å²	29	56.7 Å²	56.7	13%	0.127	33%	0.325	C	S	.	.	H	α-helix	trans	-60.8	-41	-174.5	-75.3	-58.5	0	0	0	111.8	L70 L347 V352 L356 L763 K769 Y770 E771	L70-F767 HydrophobicContact CD2-CZ 4.03Å; L347-F767 HydrophobicContact CD1-CD1 4.37Å; L347-F767 HydrophobicContact CD1-CE1 3.78Å; L347-F767 HydrophobicContact CD1-CZ 4.3Å; L347-F767 HydrophobicContact CD2-CD1 3.95Å; L347-F767 HydrophobicContact CD2-CD2 4.21Å; L347-F767 HydrophobicContact CD2-CE1 3.65Å; L347-F767 HydrophobicContact CD2-CE2 3.89Å; L347-F767 HydrophobicContact CD2-CG 4.25Å; L347-F767 HydrophobicContact CD2-CZ 3.65Å; L347-F767 HydrophobicContact CG-CE1 4.29Å; L347-F767 HydrophobicContact CG-CZ 4.41Å; V352-F767 HydrophobicContact CG1-CD1 4.05Å; L356-F767 HydrophobicContact CD1-CE1 4.03Å; L763-F767 HydrophobicContact CD1-CD2 4.35Å; L763-F767 HydrophobicContact CD1-CE2 3.79Å; L763-F767 HydrophobicContact CD1-CZ 4.1Å; L763-F767 HydrophobicContact CD2-CE2 3.76Å; L763-F767 HydrophobicContact CD2-CZ 4.42Å; L763-F767 HydrophobicContact CG-CD2 3.9Å; L763-F767 HydrophobicContact CG-CE2 3.42Å; L763-F767 VanDerWaalsContact CG-CE2 3.42Å; L763-F767 HydrophobicContact CG-CZ 4.2Å; L763-F767 VanDerWaalsContact O-CD2 3.27Å; L763-F767 WeakPolarHBondContact O-CD2 3.21Å; L763-F767 PolarHBondContact O-N 3.1Å; F767-K769 PolarHBondContact O-N 3.06Å; F767-Y770 PolarHBondContact O-N 3.33Å; F767-E771 WeakPolarHBondContact O-CB 3.5Å; F767-E771 PolarHBondContact O-N 2.91Å
768	N	87	Confident	85.1	Confident	108 Å²	108	62.4 Å²	62.4	58%	0.578	36%	0.359	S	S	*	.	H	α-helix	trans	-60.8	-43.8	174.4	-73.8	-50.5	0	0	0	112.2	D764 F766 A772	D764-N768 PolarHBondContact O-N 3.05Å; D764-N768 PolarHBondContact O-ND2 3.32Å; F766-N768 VanDerWaalsContact C-N 3.29Å; F766-N768 PolarHBondContact O-N 3.05Å; N768-A772 WeakPolarHBondContact O-CB 3.48Å; N768-A772 PolarHBondContact O-N 3.09Å; N768-A772 VanDerWaalsContact O-N 3.09Å
769	K	89.9	Confident	83.2	Confident	102 Å²	102	64.7 Å²	64.7	44%	0.443	37%	0.37	S	S	.	.	H	α-helix	trans	-71.2	-37.8	-179.8	-170.6	172.6	-179.7	-163.7	0	112.3	T616 A765 F766 F767 A772 T773	T616-K769 WeakPolarHBondContact O-CE 3.27Å; T616-K769 PolarHBondContact O-NZ 3.08Å; A765-K769 WeakPolarHBondContact O-CB 3.38Å; A765-K769 PolarHBondContact O-N 2.9Å; A765-K769 VanDerWaalsContact O-N 3.08Å; F766-K769 PolarHBondContact O-N 3.04Å; F767-K769 PolarHBondContact O-N 3.06Å; K769-A772 PolarHBondContact O-N 3.43Å; K769-T773 WeakPolarHBondContact O-CB 3.33Å; K769-T773 PolarHBondContact O-N 3.04Å; K769-T773 PolarHBondContact O-OG1 2.81Å
770	Y	91	Very high	80.9	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	41%	0.407	C	S	.	.	H	α-helix	trans	-65.2	-46.4	177.3	-175.1	-117.1	0	0	0	111	V352 L356 E610 A613 L614 S617 F766 F767 A772 T773 L774	V352-Y770 HydrophobicContact CG1-CD1 3.99Å; V352-Y770 HydrophobicContact CG1-CE1 4.27Å; L356-Y770 HydrophobicContact CD2-CE1 3.8Å; L356-Y770 HydrophobicContact CG-CE1 4.01Å; E610-Y770 WeakPolarHBondContact O-CE2 3.36Å; E610-Y770 PolarHBondContact O-OH 3.41Å; E610-Y770 VanDerWaalsContact O-OH 3.09Å; A613-Y770 HydrophobicContact CB-CD2 3.89Å; A613-Y770 HydrophobicContact CB-CE2 3.6Å; L614-Y770 HydrophobicContact CD2-CD2 3.95Å; L614-Y770 HydrophobicContact CD2-CE1 4.32Å; L614-Y770 HydrophobicContact CD2-CE2 3.42Å; L614-Y770 VanDerWaalsContact CD2-CE2 3.42Å; L614-Y770 HydrophobicContact CG-CE2 3.93Å; S617-Y770 VanDerWaalsContact OG-CA 3.26Å; S617-Y770 WeakPolarHBondContact OG-CA 3.48Å; S617-Y770 PolarHBondContact OG-N 2.87Å; F766-Y770 HydrophobicContact CE2-CD2 4.24Å; F766-Y770 HydrophobicContact CE2-CG 4.07Å; F766-Y770 HydrophobicContact CZ-CD1 4.33Å; F766-Y770 HydrophobicContact CZ-CD2 4.46Å; F766-Y770 HydrophobicContact CZ-CG 4.05Å; F766-Y770 WeakPolarHBondContact O-CB 3.27Å; F766-Y770 PolarHBondContact O-N 3.43Å; F767-Y770 PolarHBondContact O-N 3.33Å; Y770-A772 PolarHBondContact O-N 3.47Å; Y770-T773 PolarHBondContact O-N 3.05Å; Y770-L774 HydrophobicContact CD1-CD1 3.88Å; Y770-L774 HydrophobicContact CD2-CD1 4.33Å; Y770-L774 HydrophobicContact CD2-CG 4.47Å; Y770-L774 HydrophobicContact CE1-CD1 3.41Å; Y770-L774 VanDerWaalsContact CE1-CD1 3.41Å; Y770-L774 HydrophobicContact CE1-CG 4.47Å; Y770-L774 HydrophobicContact CE2-CD1 3.9Å; Y770-L774 HydrophobicContact CE2-CD2 4.49Å; Y770-L774 HydrophobicContact CE2-CG 4.19Å; Y770-L774 HydrophobicContact CG-CD1 4.32Å; Y770-L774 VanDerWaalsContact CZ-CD1 3.42Å; Y770-L774 WeakPolarHBondContact O-CG 3.43Å; Y770-L774 PolarHBondContact O-N 2.68Å
771	E	86.9	Confident	78.7	Confident	77 Å²	77	76.9 Å²	76.9	36%	0.36	44%	0.438	S	S	.	.	H	α-helix	trans	-59.5	-47.1	174.3	-171.7	172	-158.4	0	0	111.7	V352 F767 T773 L774 F775	V352-E771 HydrophobicContact CG2-CB 3.97Å; V352-E771 HydrophobicContact CG2-CG 4.09Å; F767-E771 WeakPolarHBondContact O-CB 3.5Å; F767-E771 PolarHBondContact O-N 2.91Å; E771-T773 VanDerWaalsContact C-N 3.27Å; E771-T773 PolarHBondContact O-N 3.44Å; E771-L774 PolarHBondContact O-N 3.35Å; E771-F775 HydrophobicContact CG-CD2 3.98Å; E771-F775 WeakPolarHBondContact O-CD2 3.23Å; E771-F775 PolarHBondContact O-N 3.5Å
772	A	87.1	Confident	76.9	Confident	57 Å²	57	74.6 Å²	74.6	47%	0.471	44%	0.439	S	S	.	.	H	α-helix	trans	-62.5	-32.3	177.7	0	0	0	0	0	113.3	N768 K769 Y770 F775 P776	N768-A772 WeakPolarHBondContact O-CB 3.48Å; N768-A772 PolarHBondContact O-N 3.09Å; N768-A772 VanDerWaalsContact O-N 3.09Å; K769-A772 PolarHBondContact O-N 3.43Å; Y770-A772 PolarHBondContact O-N 3.47Å; A772-F775 CarbonylContact O-C 3.56Å; A772-P776 WeakPolarHBondContact O-CA 3.44Å
773	T	87.5	Confident	74.8	Confident	53 Å²	53	78.7 Å²	78.7	33%	0.325	46%	0.463	S	S	.	.	H	α-helix	trans	-74.6	-39.6	178.7	-57.9	0	0	0	0	111.8	R609 A613 K769 Y770 E771	R609-T773 PolarHBondContact NH2-O 3.25Å; A613-T773 HydrophobicContact CB-CG2 3.81Å; K769-T773 WeakPolarHBondContact O-CB 3.33Å; K769-T773 PolarHBondContact O-N 3.04Å; K769-T773 PolarHBondContact O-OG1 2.81Å; Y770-T773 PolarHBondContact O-N 3.05Å; E771-T773 VanDerWaalsContact C-N 3.27Å; E771-T773 PolarHBondContact O-N 3.44Å
774	L	86	Confident	72.5	Confident	3 Å²	3	83.2 Å²	83.2	2%	0.016	50%	0.501	C	S	.	.	H	α-helix	trans	-76	-33.3	177.2	-69.7	177.3	0	0	0	113	S355 R609 E610 A613 Y770 E771 P776	S355-L774 VanDerWaalsContact CB-CD1 3.48Å; R609-L774 HydrophobicContact CG-CD2 4.32Å; R609-L774 PolarHBondContact NH1-O 3.01Å; R609-L774 VanDerWaalsContact NH2-C 3.33Å; R609-L774 PolarHBondContact NH2-O 3.21Å; E610-L774 HydrophobicContact CG-CD2 4.41Å; A613-L774 HydrophobicContact CB-CD2 3.75Å; A613-L774 HydrophobicContact CB-CG 4.2Å; Y770-L774 HydrophobicContact CD1-CD1 3.88Å; Y770-L774 HydrophobicContact CD2-CD1 4.33Å; Y770-L774 HydrophobicContact CD2-CG 4.47Å; Y770-L774 HydrophobicContact CE1-CD1 3.41Å; Y770-L774 VanDerWaalsContact CE1-CD1 3.41Å; Y770-L774 HydrophobicContact CE1-CG 4.47Å; Y770-L774 HydrophobicContact CE2-CD1 3.9Å; Y770-L774 HydrophobicContact CE2-CD2 4.49Å; Y770-L774 HydrophobicContact CE2-CG 4.19Å; Y770-L774 HydrophobicContact CG-CD1 4.32Å; Y770-L774 VanDerWaalsContact CZ-CD1 3.42Å; Y770-L774 WeakPolarHBondContact O-CG 3.43Å; Y770-L774 PolarHBondContact O-N 2.68Å; E771-L774 PolarHBondContact O-N 3.35Å; L774-P776 VanDerWaalsContact C-CD 3.49Å; L774-P776 WeakPolarHBondContact O-CD 3.34Å
775	F	84.2	Confident	70.3	Confident	77 Å²	77	84.1 Å²	84.1	34%	0.338	51%	0.511	S	S	.	.	S	Bend	trans	-128.8	67.9	-174.5	-48.8	-70.4	0	0	0	109.9	R351 E771 A772	R351-F775 HydrophobicContact CB-CE2 4.09Å; R351-F775 HydrophobicContact CB-CZ 4.16Å; E771-F775 HydrophobicContact CG-CD2 3.98Å; E771-F775 WeakPolarHBondContact O-CD2 3.23Å; E771-F775 PolarHBondContact O-N 3.5Å; A772-F775 CarbonylContact O-C 3.56Å
776	P	73.1	Confident	67.9	Low	82 Å²	82	86.9 Å²	86.9	53%	0.532	52%	0.524	S	S	.	.			trans	-57.9	137.3	176.9	24.7	-32.9	0	0	0	108.9	A772 L774 T778	A772-P776 WeakPolarHBondContact O-CA 3.44Å; L774-P776 VanDerWaalsContact C-CD 3.49Å; L774-P776 WeakPolarHBondContact O-CD 3.34Å; P776-T778 PolarHBondContact O-N 2.9Å
777	P	67	Low	65.3	Low	115 Å²	115	95.1 Å²	95.1	75%	0.747	57%	0.567	S	S	*	*			trans	-55.9	133.1	179	20.6	-30.1	0	0	0	109.2	T779	P777-T779 PolarHBondContact O-N 3.48Å
778	T	54.1	Low	62.9	Low	138 Å²	138	99.2 Å²	99.2	85%	0.847	60%	0.599	S	S	*	*			trans	-49.9	111.2	177.7	1	0	0	0	0	108.8	P776 T780	P776-T778 PolarHBondContact O-N 2.9Å; T778-T780 PolarHBondContact O-N 3.31Å
779	T	47.2	Very low	60.2	Low	132 Å²	132	99.4 Å²	99.4	81%	0.81	61%	0.609	S	S	*	*			trans	-55.5	107.2	172.3	-7.1	0	0	0	0	106.8	P777 I781	P777-T779 PolarHBondContact O-N 3.48Å; T779-I781 PolarHBondContact O-N 3.02Å
780	T	42.4	Very low	58.2	Low	129 Å²	129	100.1 Å²	100.1	79%	0.791	62%	0.624	S	S	*	*			trans	-60.2	109.4	170.3	4.2	0	0	0	0	105.4	T778 P782	T778-T780 PolarHBondContact O-N 3.31Å; T780-P782 VanDerWaalsContact O-CD 3.22Å; T780-P782 WeakPolarHBondContact O-CD 3.4Å
781	I	43	Very low	55.5	Low	156 Å²	156	104.5 Å²	104.5	80%	0.8	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-54.4	116.3	175.6	-60.1	172.1	0	0	0	106.1	T779	T779-I781 PolarHBondContact O-N 3.02Å
782	P	50.9	Low	53.4	Low	104 Å²	104	106.5 Å²	106.5	68%	0.675	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-60.9	140.5	175	-16.1	29.1	0	0	0	108.2	T780 A784	T780-P782 VanDerWaalsContact O-CD 3.22Å; T780-P782 WeakPolarHBondContact O-CD 3.4Å; P782-A784 PolarHBondContact O-N 3.32Å
783	P	47.4	Very low	50.7	Low	117 Å²	117	109 Å²	109	76%	0.76	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-57	130.2	-173.8	21.4	-30.5	0	0	0	110.3	T785	P783-T785 PolarHBondContact O-N 2.83Å
784	A	41	Very low	48	Very low	102 Å²	102	114.2 Å²	114.2	84%	0.843	72%	0.72	S	S	*	*			trans	-47.3	104.4	-179.5	0	0	0	0	0	110.5	P782	P782-A784 PolarHBondContact O-N 3.32Å
785	T	40	Very low	45.3	Very low	124 Å²	124	122.2 Å²	122.2	76%	0.761	76%	0.757	S	S	*	*			trans	-79.1	126.7	168.5	-10	0	0	0	0	106.5	P783 L787	P783-T785 PolarHBondContact O-N 2.83Å; T785-L787 PolarHBondContact O-N 2.92Å; T785-L787 VanDerWaalsContact O-N 3.13Å
786	P	40.5	Very low	42.6	Very low	117 Å²	117	124 Å²	124	76%	0.76	78%	0.779	S	S	*	*			trans	-66.3	117	-170	24.7	-32.2	0	0	0	110.3	S788	P786-S788 PolarHBondContact O-N 3.49Å; P786-S788 VanDerWaalsContact O-N 3.09Å
787	L	37.2	Very low	40.7	Very low	176 Å²	176	125.9 Å²	125.9	92%	0.921	79%	0.791	S	S	*	*			trans	-67.6	101	172.3	-91.2	144.2	0	0	0	109.8	T785	T785-L787 PolarHBondContact O-N 2.92Å; T785-L787 VanDerWaalsContact O-N 3.13Å
788	S	37.7	Very low	39.1	Very low	114 Å²	114	126.3 Å²	126.3	80%	0.797	79%	0.794	S	S	*	*			trans	-70.5	128.7	154.1	30.1	0	0	0	0	109.7	P786	P786-S788 PolarHBondContact O-N 3.49Å; P786-S788 VanDerWaalsContact O-N 3.09Å
789	S	30.8	Very low	37.8	Very low	112 Å²	112	125.6 Å²	125.6	78%	0.783	80%	0.795	S	S	*	*			trans	-89.5	177.7	178.7	-161	0	0	0	0	110.5
790	P	47	Very low	36.9	Very low	117 Å²	117	128.4 Å²	128.4	76%	0.76	80%	0.799	S	S	*	*				-126.1	169.2	-66.1	37.5	-23.8	0	0	0	112.6
791	A	33.6	Very low	36.5	Very low	93 Å²	93	128.2 Å²	128.2	77%	0.769	80%	0.8	S	S	*	*			trans	141.2	159.5	145.5	0	0	0	0	0	113.8
792	P	44.6	Very low	35.9	Very low	118 Å²	118	130 Å²	130	77%	0.766	81%	0.805	S	S	*	*			cis	-123.9	154	-39.8	33.2	-17.7	0	0	0	113.2
793	S	28.8	Very low	35	Very low	110 Å²	110	130.6 Å²	130.6	77%	0.769	81%	0.809	S	S	*	*			trans	-28.3	123.2	163.1	-179.3	0	0	0	0	115
794	N	32.5	Very low	33.9	Very low	162 Å²	162	128.6 Å²	128.6	87%	0.866	81%	0.809	S	S	*	*			trans	-125.8	128.7	160.4	-136.1	0.2	0	0	0	109.6
795	Q	29.4	Very low	33.6	Very low	172 Å²	172	130 Å²	130	80%	0.804	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-75.1	143.3	-160.9	-70.3	168.8	-21.8	0	0	113.1
796	S	26.4	Very low	33.1	Very low	115 Å²	115	135.5 Å²	135.5	80%	0.804	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-67.7	141.3	169.6	-44.4	0	0	0	0	112.2
797	P	32.7	Very low	32.3	Very low	120 Å²	120	133.6 Å²	133.6	78%	0.779	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-94.7	147.3	158.1	4.7	14.9	0	0	0	111
798	P	33.2	Very low	32	Very low	125 Å²	125	131 Å²	131	81%	0.812	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-93.5	147.3	-165.3	14.4	4.1	0	0	0	114.3
799	S	28.5	Very low	31.6	Very low	123 Å²	123	131.1 Å²	131.1	86%	0.86	82%	0.815	S	S	*	*			trans	-31.6	128.2	166	-43.9	0	0	0	0	116.4
800	Q	28	Very low	31.9	Very low	191 Å²	191	131.3 Å²	131.3	89%	0.893	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-95.2	143.5	161	-105.7	-179	-34.3	0	0	110.5
801	P	32.9	Very low	31.4	Very low	125 Å²	125	132 Å²	132	81%	0.812	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-88.9	138.9	-169.2	1.4	19.3	0	0	0	112.5
802	Q	30.3	Very low	31.3	Very low	193 Å²	193	131.9 Å²	131.9	90%	0.902	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-76.8	131.2	-178.9	-153.3	167.6	-54.4	0	0	111.1
803	P	32.3	Very low	30.9	Very low	117 Å²	117	132.2 Å²	132.2	76%	0.76	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-85.9	136.7	-179.5	32.1	-31	0	0	0	112
804	G	25.2	Very low	31.2	Very low	74 Å²	74	132.7 Å²	132.7	76%	0.763	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-70.3	142.8	176.9	0	0	0	0	0	113.2
805	P	34.8	Very low	31	Very low	132 Å²	132	129.3 Å²	129.3	86%	0.857	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-93.2	131.6	169.4	15.6	1.1	0	0	0	112
806	R	28	Very low	31.2	Very low	240 Å²	240	127.1 Å²	127.1	91%	0.906	82%	0.818	S	S	*	*			trans	-42.3	145.8	169.8	-90.8	167.6	168.5	172.9	-3.9	115.1
807	G	23.8	Very low	31.4	Very low	77 Å²	77	127.2 Å²	127.2	79%	0.794	82%	0.819	S	S	*	*			trans	-64.8	156.2	166	0	0	0	0	0	114.4
808	S	30.8	Very low	31.2	Very low	120 Å²	120	125.8 Å²	125.8	84%	0.839	82%	0.817	S	S	*	*			trans	-121.3	117.8	172.5	-45.8	0	0	0	0	106.6
809	S	30.8	Very low	31	Very low	118 Å²	118	125.5 Å²	125.5	83%	0.825	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-64	152.5	176.5	-61.8	0	0	0	0	112.1
810	P	36.6	Very low	31	Very low	116 Å²	116	128.8 Å²	128.8	75%	0.753	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-85.7	153.8	-169.5	34.2	-34.1	0	0	0	112.8
811	P	35.5	Very low	30.9	Very low	131 Å²	131	125.7 Å²	125.7	85%	0.851	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-78.4	137.1	173.1	26.5	-21.5	0	0	0	111.5
812	A	31.6	Very low	30.6	Very low	90 Å²	90	127.8 Å²	127.8	74%	0.744	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-68.6	156.6	-179.1	0	0	0	0	0	113
813	P	37.7	Very low	30.5	Very low	126 Å²	126	123.7 Å²	123.7	82%	0.818	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-88.5	134.8	-164.5	33.7	-31.6	0	0	0	112.9	A815	P813-A815 PolarHBondContact O-N 3.24Å
814	S	33.8	Very low	30.2	Very low	120 Å²	120	125 Å²	125	84%	0.839	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-73.1	120.5	168.7	-45.9	0	0	0	0	109.5
815	A	29.5	Very low	30.2	Very low	91 Å²	91	127.4 Å²	127.4	75%	0.752	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-62.3	136.7	177.3	0	0	0	0	0	111.6	P813	P813-A815 PolarHBondContact O-N 3.24Å
816	P	33.1	Very low	29.6	Very low	125 Å²	125	129.1 Å²	129.1	81%	0.812	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-80.9	132.4	176.5	11.2	2.3	0	0	0	111.3	A818	P816-A818 PolarHBondContact O-N 2.89Å
817	S	31.4	Very low	29.4	Very low	118 Å²	118	121.9 Å²	121.9	83%	0.825	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-60.1	124.2	168.4	-39.2	0	0	0	0	109.9
818	A	27	Very low	29.3	Very low	90 Å²	90	125.8 Å²	125.8	74%	0.744	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-59.2	129.6	176.2	0	0	0	0	0	110.8	P816	P816-A818 PolarHBondContact O-N 2.89Å
819	P	30.6	Very low	29	Very low	119 Å²	119	125.8 Å²	125.8	77%	0.773	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-74.3	127.9	167.9	11.8	0	0	0	0	109.1	T821	P819-T821 PolarHBondContact O-N 3.21Å
820	E	27.8	Very low	28.8	Very low	191 Å²	191	124.6 Å²	124.6	89%	0.893	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-56.9	116	169.3	-70	176.3	152.9	0	0	109.1	D822	E820-D822 PolarHBondContact O-N 2.86Å; E820-D822 VanDerWaalsContact O-N 3.16Å
821	T	26.4	Very low	28.2	Very low	127 Å²	127	126.9 Å²	126.9	78%	0.779	79%	0.788	S	S	*	*			trans	-72.9	98.1	173.6	15.9	0	0	0	0	109.2	P819 T823	P819-T821 PolarHBondContact O-N 3.21Å; T821-T823 PolarHBondContact O-N 3.49Å
822	D	26.4	Very low	27.8	Very low	168 Å²	168	125.4 Å²	125.4	90%	0.898	78%	0.777	S	S	*	*			trans	-70.8	79.9	160.2	-89.8	-28.8	0	0	0	109.1	E820 N824	E820-D822 PolarHBondContact O-N 2.86Å; E820-D822 VanDerWaalsContact O-N 3.16Å; D822-N824 PolarHBondContact O-N 3.37Å
823	T	27.3	Very low	27.6	Very low	107 Å²	107	129.1 Å²	129.1	66%	0.656	78%	0.784	S	S	*	*			trans	-74.2	114.8	159.4	46.8	0	0	0	0	108.1	T821	T821-T823 PolarHBondContact O-N 3.49Å
824	N	26.1	Very low	27.1	Very low	146 Å²	146	128.8 Å²	128.8	78%	0.781	79%	0.785	S	S	*	*			trans	170.5	87.5	137.7	-83.7	-22.6	0	0	0	111.2	D822	D822-N824 PolarHBondContact O-N 3.37Å
825	S	24.6	Very low	27	Very low	124 Å²	124	128.9 Å²	128.9	87%	0.867	78%	0.783	S	S	*	*			trans	-129.8	80.1	161.9	-54.1	0	0	0	0	107.9	A827	S825-A827 PolarHBondContact O-N 3.18Å; S825-A827 VanDerWaalsContact O-N 3.17Å
826	L	23.4	Very low	27	Very low	168 Å²	168	129.3 Å²	129.3	88%	0.88	79%	0.786	S	S	*	*			trans	-68.3	106	171.6	-89.2	154.3	0	0	0	108.7	L828	L826-L828 PolarHBondContact O-N 2.96Å
827	A	22.7	Very low	26.7	Very low	88 Å²	88	129.7 Å²	129.7	73%	0.727	78%	0.782	S	S	*	*			trans	-75	117.8	169.8	0	0	0	0	0	109.4	S825 V829	S825-A827 PolarHBondContact O-N 3.18Å; S825-A827 VanDerWaalsContact O-N 3.17Å; A827-V829 PolarHBondContact O-N 3.3Å
828	L	23.4	Very low	26.7	Very low	158 Å²	158	129.3 Å²	129.3	83%	0.827	78%	0.776	S	S	*	*			trans	-68.7	110.5	173.1	-133.3	89.8	0	0	0	108.5	L826	L826-L828 PolarHBondContact O-N 2.96Å
829	V	23.5	Very low	26.6	Very low	120 Å²	120	129.2 Å²	129.2	73%	0.727	77%	0.767	S	S	*	*			trans	-94.8	108.8	170.8	-179.5	0	0	0	0	107.8	A827 L831	A827-V829 PolarHBondContact O-N 3.3Å; V829-L831 PolarHBondContact O-N 2.97Å
830	D	25.8	Very low	26.5	Very low	94 Å²	94	129 Å²	129	50%	0.503	77%	0.765	S	S	.	*			trans	-77.2	104.4	176.7	-142.7	4.6	0	0	0	108.1	T832 R860	D830-T832 PolarHBondContact O-N 3.1Å; D830-R860 IonicContact OD1-NH1 2.74Å
831	L	25.1	Very low	26.5	Very low	163 Å²	163	127.1 Å²	127.1	85%	0.853	76%	0.756	S	S	*	*			trans	-86	84.8	173.4	-73.9	166.5	0	0	0	108.8	V829	V829-L831 PolarHBondContact O-N 2.97Å
832	T	26.5	Very low	26.5	Very low	100 Å²	100	125.5 Å²	125.5	61%	0.613	75%	0.746	S	S	*	*			trans	-119.5	102.1	165.3	57.2	0	0	0	0	108.7	D830	D830-T832 PolarHBondContact O-N 3.1Å
833	D	26.9	Very low	26.6	Very low	168 Å²	168	121.6 Å²	121.6	90%	0.898	73%	0.732	S	S	*	*			trans	-175.2	99.1	143.5	-91.5	-22.1	0	0	0	109
834	S	28	Very low	26.7	Very low	120 Å²	120	119.1 Å²	119.1	84%	0.839	73%	0.728	S	S	*	*			trans	-151.7	128.8	153.9	-145.1	0	0	0	0	110.3
835	P	32.7	Very low	26.6	Very low	121 Å²	121	119.4 Å²	119.4	79%	0.786	72%	0.722	S	S	*	*			trans	-91.3	141.3	-170.9	34	-32.2	0	0	0	113.6
836	A	29	Very low	26.6	Very low	100 Å²	100	120.4 Å²	120.4	83%	0.826	72%	0.715	S	S	*	*			trans	53.1	87.8	148.8	0	0	0	0	0	119.1
837	D	27.2	Very low	26.7	Very low	134 Å²	134	122.6 Å²	122.6	72%	0.717	71%	0.712	S	S	*	*			trans	-146.3	136.4	141.7	-138.1	-4.5	0	0	0	110.1	T839	D837-T839 VanDerWaalsContact C-N 3.28Å; D837-T839 PolarHBondContact O-N 3.42Å
838	P	29.5	Very low	26.9	Very low	109 Å²	109	124 Å²	124	71%	0.708	70%	0.702	S	S	*	*			trans	-89.8	65.8	-173.7	36.1	-28.1	0	0	0	110
839	T	25.6	Very low	27.1	Very low	89 Å²	89	124.5 Å²	124.5	55%	0.546	70%	0.703	S	S	.	*	S	Bend	trans	-123	144	153.3	53.2	0	0	0	0	107.8	D837 E841	D837-T839 VanDerWaalsContact C-N 3.28Å; D837-T839 PolarHBondContact O-N 3.42Å; T839-E841 PolarHBondContact O-N 3.49Å
840	P	27.8	Very low	27.3	Very low	114 Å²	114	122.8 Å²	122.8	74%	0.74	69%	0.69	S	S	*	*			trans	-66.3	86.8	175.7	25.8	-30.8	0	0	0	108.8	V842	P840-V842 PolarHBondContact O-N 3.01Å
841	E	27.9	Very low	27.5	Very low	151 Å²	151	126.1 Å²	126.1	71%	0.706	70%	0.702	S	S	*	*			trans	-68.8	118.1	171.3	-78.8	-171.5	152.8	0	0	108.9	T839 S843	T839-E841 PolarHBondContact O-N 3.49Å; E841-S843 PolarHBondContact O-N 2.81Å
842	V	27.2	Very low	28	Very low	94 Å²	94	124.9 Å²	124.9	57%	0.57	70%	0.697	S	S	*	*			trans	-79.6	98.2	164.8	179.5	0	0	0	0	106.2	P840 F845 F861	P840-V842 PolarHBondContact O-N 3.01Å; V842-F845 HydrophobicContact CG1-CE2 4.19Å; V842-F845 HydrophobicContact CG1-CZ 4.48Å; V842-F861 HydrophobicContact CG1-CD1 4.05Å; V842-F861 HydrophobicContact CG1-CE1 4.03Å
843	S	29.2	Very low	28.3	Very low	85 Å²	85	123.4 Å²	123.4	59%	0.594	70%	0.701	S	S	*	*			trans	-82.8	123.7	175.6	55.2	0	0	0	0	111.2	E841	E841-S843 PolarHBondContact O-N 2.81Å
844	G	27.9	Very low	29.1	Very low	56 Å²	56	122.9 Å²	122.9	58%	0.577	69%	0.691	S	S	*	*			trans	93.9	110.3	162.8	0	0	0	0	0	116.5
845	F	25.4	Very low	29.8	Very low	151 Å²	151	120.7 Å²	120.7	66%	0.662	67%	0.674	S	S	*	*			trans	-115.4	127.4	162.2	-77.7	-90.6	0	0	0	108.6	V842 F861	V842-F845 HydrophobicContact CG1-CE2 4.19Å; V842-F845 HydrophobicContact CG1-CZ 4.48Å; F845-F861 HydrophobicContact CE1-CE1 4.48Å; F845-F861 HydrophobicContact CE1-CZ 4.43Å
846	M	24.9	Very low	30.4	Very low	146 Å²	146	119.3 Å²	119.3	72%	0.719	66%	0.661	S	S	*	*			trans	-137	109.6	165.5	-164.8	167.6	54.6	0	0	108.5	F848	M846-F848 HydrophobicContact CE-CE2 3.42Å; M846-F848 VanDerWaalsContact CE-CE2 3.42Å; M846-F848 HydrophobicContact CE-CZ 3.37Å; M846-F848 HydrophobicContact CG-CE2 4.23Å; M846-F848 HydrophobicContact CG-CZ 4.24Å; M846-F848 HydrophobicContact SD-CE2 4.24Å; M846-F848 HydrophobicContact SD-CZ 3.84Å
847	W	25.4	Very low	31.2	Very low	213 Å²	213	115.4 Å²	115.4	81%	0.807	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-87.9	124.1	173.5	-77.7	92.5	0	0	0	109.1
848	F	26.2	Very low	31.8	Very low	117 Å²	117	114.8 Å²	114.8	51%	0.513	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-99.9	121.8	163.2	-68.6	-76.3	0	0	0	108.9	M846 L850	M846-F848 HydrophobicContact CE-CE2 3.42Å; M846-F848 VanDerWaalsContact CE-CE2 3.42Å; M846-F848 HydrophobicContact CE-CZ 3.37Å; M846-F848 HydrophobicContact CG-CE2 4.23Å; M846-F848 HydrophobicContact CG-CZ 4.24Å; M846-F848 HydrophobicContact SD-CE2 4.24Å; M846-F848 HydrophobicContact SD-CZ 3.84Å; F848-L850 PolarHBondContact O-N 2.78Å
849	I	27	Very low	32.4	Very low	169 Å²	169	110.8 Å²	110.8	87%	0.867	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-75.8	116	171.7	-62.8	178.1	0	0	0	108
850	L	28.8	Very low	33.3	Very low	85 Å²	85	111.1 Å²	111.1	45%	0.445	59%	0.589	S	S	.	*	P	Polyproline II helix	trans	-78.5	120.4	-175.8	-69.2	163.6	0	0	0	111.4	F848 N856 L883	F848-L850 PolarHBondContact O-N 2.78Å; L850-N856 HydrophobicContact CD2-CB 3.71Å; L850-L883 HydrophobicContact CD1-CB 4.33Å
851	Q	29.5	Very low	34.1	Very low	163 Å²	163	108.5 Å²	108.5	76%	0.762	57%	0.566	S	S	*	*			trans	-107.6	131.1	153	-73.2	-162.6	-11.8	0	0	109.3
852	N	34.8	Very low	34.8	Very low	138 Å²	138	102.6 Å²	102.6	74%	0.738	54%	0.542	S	S	*	.	S	Bend	trans	73.1	80	167.7	-54.1	-26	0	0	0	117.9	K854	N852-K854 VanDerWaalsContact C-N 3.25Å; N852-K854 PolarHBondContact O-N 2.86Å
853	G	34.2	Very low	35.4	Very low	68 Å²	68	101.7 Å²	101.7	70%	0.701	53%	0.533	S	S	*	.	S	Bend	trans	45.5	29	137.6	0	0	0	0	0	119.8
854	K	43.7	Very low	35.9	Very low	158 Å²	158	103.1 Å²	103.1	69%	0.687	53%	0.528	S	S	*	.	S	Bend	trans	-136.7	144.4	175.6	-70.2	-174.4	177.9	-178.8	0	108.7	N852 N856	N852-K854 VanDerWaalsContact C-N 3.25Å; N852-K854 PolarHBondContact O-N 2.86Å; K854-N856 PolarHBondContact O-N 2.96Å; K854-N856 PolarHBondContact O-ND2 3.14Å; K854-N856 PolarHBondContact O-OD1 2.81Å
855	C	42.2	Very low	36.4	Very low	73 Å²	73	106.5 Å²	106.5	49%	0.493	53%	0.527	S	S	.	.			trans	-61.7	99.1	179.3	-59.8	0	0	0	0	110.2	I882 C884	C855-I882 HydrophobicContact CB-CG2 4.38Å; C855-C884 HydrophobicContact CB-CB 4.27Å; C855-C884 WeakPolarHBondContact CB-SG 3.46Å; C855-C884 WeakPolarHBondContact SG-CB 3.19Å; C855-C884 CovalentContact SG-SG 2.03Å; C855-C884 PolarHBondContact SG-SG 3.26Å
856	N	44.7	Very low	36.8	Very low	93 Å²	93	105.8 Å²	105.8	50%	0.497	52%	0.524	S	S	.	.			trans	-124.9	2	-166.8	-65.5	-21.8	0	0	0	114.4	L850 K854	L850-N856 HydrophobicContact CD2-CB 3.71Å; K854-N856 PolarHBondContact O-N 2.96Å; K854-N856 PolarHBondContact O-ND2 3.14Å; K854-N856 PolarHBondContact O-OD1 2.81Å
857	A	46.7	Very low	37.3	Very low	18 Å²	18	101.5 Å²	101.5	15%	0.149	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	124.4	-179.9	0	0	0	0	0	111.5	I882 L883	A857-I882 WeakPolarHBondContact O-CA 3.27Å; A857-L883 PolarHBondContact O-N 3.43Å
858	F	39.7	Very low	38	Very low	121 Å²	121	98.5 Å²	98.5	53%	0.531	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	117.6	173.4	-177	-96.6	0	0	0	108.4	Y880 F881 I882	F858-Y880 AromaticContact CE1-CD1 3.52Å; F858-Y880 HydrophobicContact CE1-CD1 3.52Å; F858-Y880 AromaticContact CE1-CE1 3.75Å; F858-Y880 HydrophobicContact CE1-CE1 3.75Å; F858-Y880 AromaticContact CE2-CD1 3.78Å; F858-Y880 HydrophobicContact CE2-CD1 3.78Å; F858-Y880 HydrophobicContact CE2-CG 4.23Å; F858-Y880 AromaticContact CZ-CD1 3.03Å; F858-Y880 HydrophobicContact CZ-CD1 3.03Å; F858-Y880 AromaticContact CZ-CE1 3.46Å; F858-Y880 HydrophobicContact CZ-CE1 3.46Å; F858-Y880 VanDerWaalsContact CZ-CE1 3.46Å; F858-Y880 AromaticContact CZ-CG 3.86Å; F858-Y880 HydrophobicContact CZ-CG 3.86Å; F858-F881 WeakPolarHBondContact CA-O 3.39Å; F858-I882 HydrophobicContact CD2-CD1 4.15Å; F858-I882 HydrophobicContact CD2-CG1 3.84Å; F858-I882 HydrophobicContact CE2-CG1 4.5Å
859	G	41.4	Very low	38.6	Very low	25 Å²	25	101 Å²	101	26%	0.258	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	139.7	175	0	0	0	0	0	110.7	Y880 F881	G859-Y880 WeakPolarHBondContact O-CA 3.3Å; G859-F881 PolarHBondContact N-O 3.44Å; G859-F881 VanDerWaalsContact N-O 3.09Å; G859-F881 PolarHBondContact O-N 2.89Å
860	R	44.9	Very low	39	Very low	95 Å²	95	98.1 Å²	98.1	36%	0.358	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	123	171.7	-179.4	-175.6	-180	-161.4	0.9	108.4	D830 I878 Y880	D830-R860 IonicContact OD1-NH1 2.74Å; R860-I878 HydrophobicContact CG-CG2 3.75Å; R860-Y880 HydrophobicContact CB-CD1 4.06Å; R860-Y880 HydrophobicContact CB-CE1 3.91Å; R860-Y880 HydrophobicContact CG-CD1 4.16Å; R860-Y880 HydrophobicContact CG-CE1 3.66Å
861	F	45.1	Very low	39.7	Very low	59 Å²	59	99 Å²	99	26%	0.259	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	139.9	170.2	-74.9	-106.7	0	0	0	109.1	V842 F845 I878 I879 F881	V842-F861 HydrophobicContact CG1-CD1 4.05Å; V842-F861 HydrophobicContact CG1-CE1 4.03Å; F845-F861 HydrophobicContact CE1-CE1 4.48Å; F845-F861 HydrophobicContact CE1-CZ 4.43Å; F861-I878 CarbonylContact O-C 3.58Å; F861-I878 VanDerWaalsContact O-CA 3.29Å; F861-I878 WeakPolarHBondContact O-CA 3.44Å; F861-I879 HydrophobicContact CB-CB 4.46Å; F861-I879 PolarHBondContact N-O 3.5Å; F861-I879 PolarHBondContact O-N 3.19Å; F861-F881 HydrophobicContact CB-CE2 3.91Å; F861-F881 AromaticContact CD2-CD2 3.57Å; F861-F881 HydrophobicContact CD2-CD2 3.57Å; F861-F881 AromaticContact CD2-CE2 3.09Å; F861-F881 HydrophobicContact CD2-CE2 3.09Å; F861-F881 HydrophobicContact CD2-CZ 4.04Å; F861-F881 AromaticContact CE2-CD2 3.94Å; F861-F881 HydrophobicContact CE2-CD2 3.94Å; F861-F881 AromaticContact CE2-CE2 3.74Å; F861-F881 HydrophobicContact CE2-CE2 3.74Å; F861-F881 AromaticContact CG-CE2 3.71Å; F861-F881 HydrophobicContact CG-CE2 3.71Å; F861-F881 HydrophobicContact CG-CZ 4.39Å
862	S	41.5	Very low	40.3	Very low	27 Å²	27	97.4 Å²	97.4	19%	0.189	53%	0.526	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	116.1	174.3	156.8	0	0	0	0	109	Q876	S862-Q876 WeakPolarHBondContact OG-CG 3.5Å; S862-Q876 PolarHBondContact OG-NE2 3.49Å
863	I	41	Very low	40.6	Very low	76 Å²	76	95.6 Å²	95.6	39%	0.39	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	107	173.2	-54.9	177.9	0	0	0	107.7	K865 D877 I879	I863-K865 PolarHBondContact O-N 2.82Å; I863-D877 HydrophobicContact CB-CB 4.42Å; I863-D877 PolarHBondContact N-O 3.39Å; I863-D877 PolarHBondContact O-N 2.92Å; I863-I879 HydrophobicContact CD1-CD1 3.74Å
864	K	39.6	Very low	41.2	Very low	114 Å²	114	96.1 Å²	96.1	50%	0.496	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	114	171.6	-69.5	-177.4	-179.7	178.1	0	109	Q876	K864-Q876 HydrophobicContact CG-CG 4.28Å
865	K	38.4	Very low	41.3	Very low	127 Å²	127	91.6 Å²	91.6	55%	0.552	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	121.4	168.6	-87.2	177.9	-176.9	155.9	0	109.5	I863 S867 I875 D877	I863-K865 PolarHBondContact O-N 2.82Å; K865-S867 PolarHBondContact O-N 3.12Å; K865-I875 PolarHBondContact N-O 3.03Å; K865-D877 IonicContact NZ-OD2 3.59Å
866	F	33.7	Very low	41.7	Very low	136 Å²	136	89.6 Å²	89.6	60%	0.596	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.3	115.7	166.4	-69.1	-85.2	0	0	0	108.6	T868 Q874	F866-T868 PolarHBondContact O-N 3.06Å; F866-Q874 HydrophobicContact CE1-CG 4.43Å
867	S	35.7	Very low	42	Very low	57 Å²	57	85.8 Å²	85.8	40%	0.399	44%	0.443	S	S	.	.			trans	-68.5	122.9	169.2	174.5	0	0	0	0	108.7	K865 E869	K865-S867 PolarHBondContact O-N 3.12Å; S867-E869 PolarHBondContact O-N 3.29Å; S867-E869 PolarHBondContact OG-N 3.06Å
868	T	38.8	Very low	42.3	Very low	149 Å²	149	84.9 Å²	84.9	91%	0.914	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-9.9	178.7	45	0	0	0	0	113.6	F866	F866-T868 PolarHBondContact O-N 3.06Å
869	E	38.6	Very low	43	Very low	171 Å²	171	80.5 Å²	80.5	80%	0.799	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.4	-14	-174.7	-78.4	-174.1	156.8	0	0	115.3	S867	S867-E869 PolarHBondContact O-N 3.29Å; S867-E869 PolarHBondContact OG-N 3.06Å
870	N	36.5	Very low	43.8	Very low	108 Å²	108	81.4 Å²	81.4	58%	0.578	41%	0.413	S	S	*	.			trans	-152.4	107.6	173.3	-85.6	-38.9	0	0	0	110.1	Q872	N870-Q872 PolarHBondContact O-N 3.17Å
871	A	42.7	Very low	44.6	Very low	103 Å²	103	79.6 Å²	79.6	85%	0.851	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-5.2	179	0	0	0	0	0	114.5
872	Q	43	Very low	45.4	Very low	129 Å²	129	78.7 Å²	78.7	60%	0.603	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-4.8	-174.6	-64.8	-166.9	-53.1	0	0	115.3	N870	N870-Q872 PolarHBondContact O-N 3.17Å
873	Q	39.7	Very low	45.8	Very low	101 Å²	101	80.3 Å²	80.3	47%	0.472	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	115.1	178.1	-88.7	178.5	-17.3	0	0	111.2	L898	Q873-L898 HydrophobicContact CG-CD2 4.08Å
874	Q	47.9	Very low	46.2	Very low	78 Å²	78	77.9 Å²	77.9	36%	0.364	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	120.2	166.7	-72.4	-173.7	9.7	0	0	108.6	F866 V897	F866-Q874 HydrophobicContact CE1-CG 4.43Å; Q874-V897 PolarHBondContact N-O 3.48Å; Q874-V897 PolarHBondContact O-N 3.22Å
875	I	44.5	Very low	47.2	Very low	63 Å²	63	78.2 Å²	78.2	32%	0.323	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	122.1	170.6	-60.5	177	0	0	0	107.1	K865 R894	K865-I875 PolarHBondContact N-O 3.03Å; I875-R894 HydrophobicContact CG2-CG 3.59Å
876	Q	51.4	Low	48	Very low	31 Å²	31	75.9 Å²	75.9	15%	0.145	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	112.8	-179.3	-162.4	169.8	-10.7	0	0	108	S862 K864 I878 E895	S862-Q876 WeakPolarHBondContact OG-CG 3.5Å; S862-Q876 PolarHBondContact OG-NE2 3.49Å; K864-Q876 HydrophobicContact CG-CG 4.28Å; Q876-I878 HydrophobicContact CG-CG1 4.35Å; Q876-E895 PolarHBondContact N-O 3.48Å; Q876-E895 PolarHBondContact O-N 3.04Å
877	D	52.1	Low	48.9	Very low	13 Å²	13	74.3 Å²	74.3	7%	0.07	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	112.9	169.8	-70.2	-37.3	0	0	0	106.9	I863 K865 V892 F893 R894	I863-D877 HydrophobicContact CB-CB 4.42Å; I863-D877 PolarHBondContact N-O 3.39Å; I863-D877 PolarHBondContact O-N 2.92Å; K865-D877 IonicContact NZ-OD2 3.59Å; D877-V892 HydrophobicContact CB-CG1 4.32Å; D877-F893 CarbonylContact C-O 3.57Å; D877-F893 WeakPolarHBondContact CA-O 3.43Å; D877-R894 WeakPolarHBondContact OD1-CG 3.17Å; D877-R894 IonicContact OD1-CZ 2.62Å; D877-R894 IonicContact OD1-NE 3.9Å; D877-R894 PolarHBondContact OD1-NE 3.17Å; D877-R894 IonicContact OD1-NH2 2.83Å
878	I	51.8	Low	50.2	Low	0 Å²	0	74.1 Å²	74.1	0%	0	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	118.8	174.8	-57.8	171.6	0	0	0	108.2	R860 F861 Q876 Y880 V892 F893 E895	R860-I878 HydrophobicContact CG-CG2 3.75Å; F861-I878 CarbonylContact O-C 3.58Å; F861-I878 VanDerWaalsContact O-CA 3.29Å; F861-I878 WeakPolarHBondContact O-CA 3.44Å; Q876-I878 HydrophobicContact CG-CG1 4.35Å; I878-Y880 HydrophobicContact CB-CE2 4.46Å; I878-Y880 HydrophobicContact CG2-CD2 4.2Å; I878-Y880 HydrophobicContact CG2-CE1 4.2Å; I878-Y880 HydrophobicContact CG2-CE2 3.58Å; I878-V892 CarbonylContact O-C 3.48Å; I878-V892 WeakPolarHBondContact O-CA 3.47Å; I878-F893 HydrophobicContact CB-CB 4.5Å; I878-F893 PolarHBondContact N-O 3.41Å; I878-F893 PolarHBondContact O-N 3.27Å; I878-E895 VanDerWaalsContact CD1-CD 3.5Å; I878-E895 HydrophobicContact CD1-CG 4.15Å; I878-E895 WeakPolarHBondContact CD1-OE2 2.98Å
879	I	55	Low	51.4	Low	28 Å²	28	71.7 Å²	71.7	14%	0.144	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	122.6	178.6	-43.7	-179.2	0	0	0	108.9	F861 I863 F881 Y890 R891 V892	F861-I879 HydrophobicContact CB-CB 4.46Å; F861-I879 PolarHBondContact N-O 3.5Å; F861-I879 PolarHBondContact O-N 3.19Å; I863-I879 HydrophobicContact CD1-CD1 3.74Å; I879-F881 HydrophobicContact CB-CE1 4.45Å; I879-F881 HydrophobicContact CB-CE2 3.69Å; I879-F881 HydrophobicContact CB-CZ 3.59Å; I879-F881 HydrophobicContact CD1-CZ 4.42Å; I879-F881 HydrophobicContact CG2-CD1 4.25Å; I879-F881 HydrophobicContact CG2-CD2 4.31Å; I879-F881 HydrophobicContact CG2-CE1 3.52Å; I879-F881 HydrophobicContact CG2-CE2 3.54Å; I879-F881 HydrophobicContact CG2-CZ 3.13Å; I879-F881 WeakPolarHBondContact O-CE2 3.31Å; I879-Y890 HydrophobicContact CG2-CD2 4.18Å; I879-R891 CarbonylContact C-O 3.51Å; I879-R891 WeakPolarHBondContact CA-O 3.44Å; I879-V892 HydrophobicContact CD1-CG2 4.47Å; I879-V892 HydrophobicContact CG1-CG1 4.34Å; I879-V892 HydrophobicContact CG1-CG2 4.12Å; I879-V892 HydrophobicContact CG2-CG2 4.12Å
880	Y	57.8	Low	52.9	Low	45 Å²	45	67.7 Å²	67.7	18%	0.176	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	140.3	171.7	-63.9	-76.6	0	0	0	109.7	F858 G859 R860 I878 Y890 R891 F893	F858-Y880 AromaticContact CE1-CD1 3.52Å; F858-Y880 HydrophobicContact CE1-CD1 3.52Å; F858-Y880 AromaticContact CE1-CE1 3.75Å; F858-Y880 HydrophobicContact CE1-CE1 3.75Å; F858-Y880 AromaticContact CE2-CD1 3.78Å; F858-Y880 HydrophobicContact CE2-CD1 3.78Å; F858-Y880 HydrophobicContact CE2-CG 4.23Å; F858-Y880 AromaticContact CZ-CD1 3.03Å; F858-Y880 HydrophobicContact CZ-CD1 3.03Å; F858-Y880 AromaticContact CZ-CE1 3.46Å; F858-Y880 HydrophobicContact CZ-CE1 3.46Å; F858-Y880 VanDerWaalsContact CZ-CE1 3.46Å; F858-Y880 AromaticContact CZ-CG 3.86Å; F858-Y880 HydrophobicContact CZ-CG 3.86Å; G859-Y880 WeakPolarHBondContact O-CA 3.3Å; R860-Y880 HydrophobicContact CB-CD1 4.06Å; R860-Y880 HydrophobicContact CB-CE1 3.91Å; R860-Y880 HydrophobicContact CG-CD1 4.16Å; R860-Y880 HydrophobicContact CG-CE1 3.66Å; I878-Y880 HydrophobicContact CB-CE2 4.46Å; I878-Y880 HydrophobicContact CG2-CD2 4.2Å; I878-Y880 HydrophobicContact CG2-CE1 4.2Å; I878-Y880 HydrophobicContact CG2-CE2 3.58Å; Y880-Y890 CarbonylContact O-C 3.49Å; Y880-Y890 WeakPolarHBondContact O-CA 3.41Å; Y880-R891 PolarHBondContact N-O 3Å; Y880-R891 PolarHBondContact O-N 3.31Å; Y880-F893 AromaticContact CD2-CD2 3.52Å; Y880-F893 HydrophobicContact CD2-CD2 3.52Å; Y880-F893 AromaticContact CD2-CE2 3.7Å; Y880-F893 HydrophobicContact CD2-CE2 3.7Å; Y880-F893 AromaticContact CE2-CD2 3.5Å; Y880-F893 HydrophobicContact CE2-CD2 3.5Å; Y880-F893 VanDerWaalsContact CE2-CD2 3.5Å; Y880-F893 AromaticContact CE2-CE2 3.83Å; Y880-F893 HydrophobicContact CE2-CE2 3.83Å; Y880-F893 HydrophobicContact CE2-CG 4.39Å
881	F	61.9	Low	54.3	Low	57 Å²	57	65.3 Å²	65.3	25%	0.25	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	140.3	177.1	-46.1	-98.3	0	0	0	109.7	F858 G859 F861 I879 W889	F858-F881 WeakPolarHBondContact CA-O 3.39Å; G859-F881 PolarHBondContact N-O 3.44Å; G859-F881 VanDerWaalsContact N-O 3.09Å; G859-F881 PolarHBondContact O-N 2.89Å; F861-F881 HydrophobicContact CB-CE2 3.91Å; F861-F881 AromaticContact CD2-CD2 3.57Å; F861-F881 HydrophobicContact CD2-CD2 3.57Å; F861-F881 AromaticContact CD2-CE2 3.09Å; F861-F881 HydrophobicContact CD2-CE2 3.09Å; F861-F881 HydrophobicContact CD2-CZ 4.04Å; F861-F881 AromaticContact CE2-CD2 3.94Å; F861-F881 HydrophobicContact CE2-CD2 3.94Å; F861-F881 AromaticContact CE2-CE2 3.74Å; F861-F881 HydrophobicContact CE2-CE2 3.74Å; F861-F881 AromaticContact CG-CE2 3.71Å; F861-F881 HydrophobicContact CG-CE2 3.71Å; F861-F881 HydrophobicContact CG-CZ 4.39Å; I879-F881 HydrophobicContact CB-CE1 4.45Å; I879-F881 HydrophobicContact CB-CE2 3.69Å; I879-F881 HydrophobicContact CB-CZ 3.59Å; I879-F881 HydrophobicContact CD1-CZ 4.42Å; I879-F881 HydrophobicContact CG2-CD1 4.25Å; I879-F881 HydrophobicContact CG2-CD2 4.31Å; I879-F881 HydrophobicContact CG2-CE1 3.52Å; I879-F881 HydrophobicContact CG2-CE2 3.54Å; I879-F881 HydrophobicContact CG2-CZ 3.13Å; I879-F881 WeakPolarHBondContact O-CE2 3.31Å; F881-W889 CarbonylContact C-O 3.55Å; F881-W889 VanDerWaalsContact CA-O 3.22Å; F881-W889 WeakPolarHBondContact CA-O 3.2Å
882	I	61	Low	55	Low	40 Å²	40	62 Å²	62	21%	0.205	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	127.5	173.2	-62.7	174.9	0	0	0	108.7	C855 A857 F858 C884 W889 W915	C855-I882 HydrophobicContact CB-CG2 4.38Å; A857-I882 WeakPolarHBondContact O-CA 3.27Å; F858-I882 HydrophobicContact CD2-CD1 4.15Å; F858-I882 HydrophobicContact CD2-CG1 3.84Å; F858-I882 HydrophobicContact CE2-CG1 4.5Å; I882-C884 VanDerWaalsContact CG2-SG 3.5Å; I882-W889 PolarHBondContact N-O 3.02Å; I882-W889 PolarHBondContact O-N 3.03Å; I882-W915 HydrophobicContact CB-CH2 4.39Å; I882-W915 HydrophobicContact CB-CZ3 4.23Å; I882-W915 HydrophobicContact CD1-CH2 3.32Å; I882-W915 HydrophobicContact CD1-CZ2 3.53Å; I882-W915 HydrophobicContact CD1-CZ3 3.94Å; I882-W915 HydrophobicContact CG1-CH2 3.53Å; I882-W915 HydrophobicContact CG1-CZ2 4.26Å; I882-W915 HydrophobicContact CG1-CZ3 3.85Å
883	L	49.9	Very low	55.7	Low	61 Å²	61	58.5 Å²	58.5	32%	0.319	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	114.7	169.9	-77.2	157.5	0	0	0	109.5	L850 A857 H887 C888	L850-L883 HydrophobicContact CD1-CB 4.33Å; A857-L883 PolarHBondContact O-N 3.43Å; L883-H887 WeakPolarHBondContact CA-O 3.45Å; L883-C888 HydrophobicContact CD2-CB 3.81Å
884	C	50.1	Low	56.2	Low	24 Å²	24	58.7 Å²	58.7	16%	0.162	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	124.1	175.7	-73.2	0	0	0	0	109.3	C855 I882 G886 H887	C855-C884 HydrophobicContact CB-CB 4.27Å; C855-C884 WeakPolarHBondContact CB-SG 3.46Å; C855-C884 WeakPolarHBondContact SG-CB 3.19Å; C855-C884 CovalentContact SG-SG 2.03Å; C855-C884 PolarHBondContact SG-SG 3.26Å; I882-C884 VanDerWaalsContact CG2-SG 3.5Å; C884-G886 VanDerWaalsContact C-N 3.27Å; C884-G886 PolarHBondContact O-N 2.95Å; C884-G886 VanDerWaalsContact O-N 3.15Å; C884-H887 PolarHBondContact N-O 3.5Å; C884-H887 WeakPolarHBondContact O-CB 3.21Å; C884-H887 PolarHBondContact O-N 3.45Å
885	D	61.2	Low	56.5	Low	122 Å²	122	57.3 Å²	57.3	65%	0.652	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	41.5	173.6	-62	-24.2	0	0	0	115	H887	D885-H887 VanDerWaalsContact C-N 3.27Å; D885-H887 PolarHBondContact O-CD2 2.85Å; D885-H887 PolarHBondContact O-N 2.98Å
886	G	55.5	Low	56.6	Low	78 Å²	78	55.2 Å²	55.2	80%	0.804	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.8	4.3	179.9	0	0	0	0	0	114.7	C884	C884-G886 VanDerWaalsContact C-N 3.27Å; C884-G886 PolarHBondContact O-N 2.95Å; C884-G886 VanDerWaalsContact O-N 3.15Å
887	H	52.6	Low	56.4	Low	102 Å²	102	55.2 Å²	55.2	47%	0.472	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	141	175	-60.8	-77.2	0	0	0	112.1	L883 C884 D885 L917	L883-H887 WeakPolarHBondContact CA-O 3.45Å; C884-H887 PolarHBondContact N-O 3.5Å; C884-H887 WeakPolarHBondContact O-CB 3.21Å; C884-H887 PolarHBondContact O-N 3.45Å; D885-H887 VanDerWaalsContact C-N 3.27Å; D885-H887 PolarHBondContact O-CD2 2.85Å; D885-H887 PolarHBondContact O-N 2.98Å; H887-L917 HydrophobicContact CB-CD1 3.42Å; H887-L917 VanDerWaalsContact CB-CD1 3.42Å; H887-L917 HydrophobicContact CB-CG 4.29Å
888	C	61.9	Low	55.9	Low	54 Å²	54	57.3 Å²	57.3	37%	0.365	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	102.8	-179.1	-173.1	0	0	0	0	110	L883 L917	L883-C888 HydrophobicContact CD2-CB 3.81Å; C888-L917 CarbonylContact O-C 3.47Å
889	W	65.3	Low	55.5	Low	98 Å²	98	64.4 Å²	64.4	37%	0.371	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	139.3	174.4	-63.1	81.6	0	0	0	110	F881 I882 W915 K916 L917	F881-W889 CarbonylContact C-O 3.55Å; F881-W889 VanDerWaalsContact CA-O 3.22Å; F881-W889 WeakPolarHBondContact CA-O 3.2Å; I882-W889 PolarHBondContact N-O 3.02Å; I882-W889 PolarHBondContact O-N 3.03Å; W889-W915 HydrophobicContact CB-CE3 3.79Å; W889-W915 HydrophobicContact CB-CZ3 4.4Å; W889-W915 HydrophobicContact CE3-CB 3.98Å; W889-K916 CarbonylContact C-O 3.58Å; W889-K916 WeakPolarHBondContact CA-O 3.29Å; W889-L917 HydrophobicContact CD2-CB 4.38Å; W889-L917 HydrophobicContact CD2-CD1 3.66Å; W889-L917 HydrophobicContact CE3-CB 4.15Å; W889-L917 HydrophobicContact CE3-CD1 4.2Å; W889-L917 HydrophobicContact CG-CD1 4.19Å; W889-L917 HydrophobicContact CH2-CB 4.33Å; W889-L917 HydrophobicContact CH2-CD1 3.95Å; W889-L917 HydrophobicContact CZ2-CD1 3.37Å; W889-L917 HydrophobicContact CZ3-CB 4.12Å; W889-L917 HydrophobicContact CZ3-CD1 4.33Å
890	Y	68.9	Low	55.2	Low	86 Å²	86	69 Å²	69	34%	0.337	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	154.5	174.7	77.1	-82.7	0	0	0	113.3	I879 Y880 V892 K916	I879-Y890 HydrophobicContact CG2-CD2 4.18Å; Y880-Y890 CarbonylContact O-C 3.49Å; Y880-Y890 WeakPolarHBondContact O-CA 3.41Å; Y890-V892 HydrophobicContact CD2-CG2 4.09Å; Y890-V892 HydrophobicContact CE2-CG2 4.12Å; Y890-K916 HydrophobicContact CD1-CB 4.09Å; Y890-K916 WeakPolarHBondContact CD1-O 3.31Å; Y890-K916 HydrophobicContact CE1-CB 3.59Å; Y890-K916 HydrophobicContact CE2-CB 4.5Å; Y890-K916 PolarHBondContact N-O 3.45Å; Y890-K916 PolarHBondContact O-N 3.04Å
891	R	67	Low	54.3	Low	59 Å²	59	69.3 Å²	69.3	22%	0.223	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	138.3	175.3	-172.7	175.6	-179.2	176	8.8	109.9	I879 Y880 F893 D913 W915	I879-R891 CarbonylContact C-O 3.51Å; I879-R891 WeakPolarHBondContact CA-O 3.44Å; Y880-R891 PolarHBondContact N-O 3Å; Y880-R891 PolarHBondContact O-N 3.31Å; R891-F893 HydrophobicContact CG-CD2 4.31Å; R891-F893 HydrophobicContact CG-CE2 3.82Å; R891-F893 HydrophobicContact CG-CZ 4.38Å; R891-D913 IonicContact CZ-OD1 2.84Å; R891-D913 PolarHBondContact NE-O 3.45Å; R891-D913 IonicContact NE-OD1 2.64Å; R891-D913 VanDerWaalsContact NH2-CG 3.35Å; R891-D913 PolarHBondContact NH2-O 3.11Å; R891-D913 IonicContact NH2-OD1 2.74Å; R891-D913 PolarHBondContact NH2-OD1 3.02Å; R891-W915 HydrophobicContact CB-CD2 3.98Å; R891-W915 HydrophobicContact CB-CE3 3.93Å; R891-W915 HydrophobicContact CB-CH2 4.3Å; R891-W915 HydrophobicContact CB-CZ2 4.36Å; R891-W915 HydrophobicContact CB-CZ3 4.1Å
892	V	57.4	Low	53.1	Low	34 Å²	34	68.9 Å²	68.9	21%	0.206	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	124.5	-178.2	-174.4	0	0	0	0	109.3	D877 I878 I879 Y890	D877-V892 HydrophobicContact CB-CG1 4.32Å; I878-V892 CarbonylContact O-C 3.48Å; I878-V892 WeakPolarHBondContact O-CA 3.47Å; I879-V892 HydrophobicContact CD1-CG2 4.47Å; I879-V892 HydrophobicContact CG1-CG1 4.34Å; I879-V892 HydrophobicContact CG1-CG2 4.12Å; I879-V892 HydrophobicContact CG2-CG2 4.12Å; Y890-V892 HydrophobicContact CD2-CG2 4.09Å; Y890-V892 HydrophobicContact CE2-CG2 4.12Å
893	F	56.7	Low	52	Low	55 Å²	55	73.3 Å²	73.3	24%	0.241	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	139	169.3	-71.1	-92.9	0	0	0	109.4	D877 I878 Y880 R891	D877-F893 CarbonylContact C-O 3.57Å; D877-F893 WeakPolarHBondContact CA-O 3.43Å; I878-F893 HydrophobicContact CB-CB 4.5Å; I878-F893 PolarHBondContact N-O 3.41Å; I878-F893 PolarHBondContact O-N 3.27Å; Y880-F893 AromaticContact CD2-CD2 3.52Å; Y880-F893 HydrophobicContact CD2-CD2 3.52Å; Y880-F893 AromaticContact CD2-CE2 3.7Å; Y880-F893 HydrophobicContact CD2-CE2 3.7Å; Y880-F893 AromaticContact CE2-CD2 3.5Å; Y880-F893 HydrophobicContact CE2-CD2 3.5Å; Y880-F893 VanDerWaalsContact CE2-CD2 3.5Å; Y880-F893 AromaticContact CE2-CE2 3.83Å; Y880-F893 HydrophobicContact CE2-CE2 3.83Å; Y880-F893 HydrophobicContact CE2-CG 4.39Å; R891-F893 HydrophobicContact CG-CD2 4.31Å; R891-F893 HydrophobicContact CG-CE2 3.82Å; R891-F893 HydrophobicContact CG-CZ 4.38Å
894	R	50.6	Low	51.2	Low	105 Å²	105	73.7 Å²	73.7	40%	0.396	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	109.5	177.2	-166.1	174.8	-69.7	145.2	13.4	109.1	I875 D877 E912	I875-R894 HydrophobicContact CG2-CG 3.59Å; D877-R894 WeakPolarHBondContact OD1-CG 3.17Å; D877-R894 IonicContact OD1-CZ 2.62Å; D877-R894 IonicContact OD1-NE 3.9Å; D877-R894 PolarHBondContact OD1-NE 3.17Å; D877-R894 IonicContact OD1-NH2 2.83Å; R894-E912 IonicContact CZ-OE1 2.71Å; R894-E912 IonicContact NH1-OE1 2.76Å; R894-E912 IonicContact NH2-OE1 3.18Å; R894-E912 PolarHBondContact NH2-OE1 2.86Å
895	E	54.6	Low	50.6	Low	48 Å²	48	80.1 Å²	80.1	22%	0.224	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	137.7	175.7	-72.4	-177.6	-178.1	0	0	109.8	Q876 I878	Q876-E895 PolarHBondContact N-O 3.48Å; Q876-E895 PolarHBondContact O-N 3.04Å; I878-E895 VanDerWaalsContact CD1-CD 3.5Å; I878-E895 HydrophobicContact CD1-CG 4.15Å; I878-E895 WeakPolarHBondContact CD1-OE2 2.98Å
896	A	45.2	Very low	49.5	Very low	19 Å²	19	76.3 Å²	76.3	16%	0.157	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	118.9	168	0	0	0	0	0	108.5	C904	A896-C904 PolarHBondContact N-O 3.26Å; A896-C904 PolarHBondContact O-N 3.01Å; A896-C904 VanDerWaalsContact O-N 3.16Å
897	V	47.2	Very low	48.7	Very low	31 Å²	31	82.8 Å²	82.8	19%	0.188	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	121.8	176	-174.9	0	0	0	0	108.1	Q874	Q874-V897 PolarHBondContact N-O 3.48Å; Q874-V897 PolarHBondContact O-N 3.22Å
898	L	43	Very low	47.9	Very low	58 Å²	58	82.1 Å²	82.1	30%	0.304	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	159.5	176.3	-60.8	177.2	0	0	0	110.6	Q873 D900 G901 S902	Q873-L898 HydrophobicContact CG-CD2 4.08Å; L898-D900 PolarHBondContact O-N 3.36Å; L898-D900 VanDerWaalsContact O-N 3.09Å; L898-G901 PolarHBondContact O-N 2.78Å; L898-S902 PolarHBondContact N-O 2.82Å; L898-S902 VanDerWaalsContact N-O 3.15Å
899	E	43.3	Very low	46.7	Very low	148 Å²	148	82.5 Å²	82.5	69%	0.692	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-24	-177.4	-81	-178.2	162	0	0	114.5	G901	E899-G901 VanDerWaalsContact C-N 3.29Å; E899-G901 PolarHBondContact O-N 2.95Å
900	D	47.9	Very low	45.5	Very low	126 Å²	126	87.3 Å²	87.3	67%	0.674	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	5.1	177.9	68	-2.6	0	0	0	113.9	L898 S902	L898-D900 PolarHBondContact O-N 3.36Å; L898-D900 VanDerWaalsContact O-N 3.09Å; D900-S902 VanDerWaalsContact C-N 3.28Å; D900-S902 PolarHBondContact O-N 3.25Å; D900-S902 VanDerWaalsContact OD1-CB 3.26Å; D900-S902 WeakPolarHBondContact OD1-CB 2.87Å; D900-S902 PolarHBondContact OD1-N 3.11Å; D900-S902 PolarHBondContact OD1-OG 3.39Å; D900-S902 PolarHBondContact OD2-OG 3.31Å
901	G	39.3	Very low	44.1	Very low	51 Å²	51	90.8 Å²	90.8	53%	0.526	46%	0.464	S	S	.	.	S	Bend	trans	81.3	-0.1	-178.3	0	0	0	0	0	114.4	L898 E899	L898-G901 PolarHBondContact O-N 2.78Å; E899-G901 VanDerWaalsContact C-N 3.29Å; E899-G901 PolarHBondContact O-N 2.95Å
902	S	37.1	Very low	43.1	Very low	48 Å²	48	91.1 Å²	91.1	34%	0.336	47%	0.468	S	S	.	.			trans	-74.5	136.3	175.7	65.3	0	0	0	0	111.6	L898 D900	L898-S902 PolarHBondContact N-O 2.82Å; L898-S902 VanDerWaalsContact N-O 3.15Å; D900-S902 VanDerWaalsContact C-N 3.28Å; D900-S902 PolarHBondContact O-N 3.25Å; D900-S902 VanDerWaalsContact OD1-CB 3.26Å; D900-S902 WeakPolarHBondContact OD1-CB 2.87Å; D900-S902 PolarHBondContact OD1-N 3.11Å; D900-S902 PolarHBondContact OD1-OG 3.39Å; D900-S902 PolarHBondContact OD2-OG 3.31Å
903	K	37.3	Very low	42.6	Very low	133 Å²	133	92 Å²	92	58%	0.578	47%	0.471	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.8	127.2	-175.9	-61.2	-178.5	-177	179.5	0	109.7
904	C	33	Very low	42.6	Very low	68 Å²	68	96.3 Å²	96.3	46%	0.459	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	128.4	170.9	-73.3	0	0	0	0	110.3	A896 A906	A896-C904 PolarHBondContact N-O 3.26Å; A896-C904 PolarHBondContact O-N 3.01Å; A896-C904 VanDerWaalsContact O-N 3.16Å; C904-A906 PolarHBondContact O-N 3.41Å
905	E	37.1	Very low	43.1	Very low	159 Å²	159	95.6 Å²	95.6	74%	0.743	49%	0.49	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.7	119.2	165.8	-88.4	-174.9	150.3	0	0	109.5	K907	E905-K907 PolarHBondContact O-N 3.05Å
906	A	39.5	Very low	43.6	Very low	43 Å²	43	98 Å²	98	36%	0.355	50%	0.499	S	S	.	.			trans	-70.8	116.3	172.3	0	0	0	0	0	108.5	C904 N908	C904-A906 PolarHBondContact O-N 3.41Å; A906-N908 PolarHBondContact O-N 3.15Å; A906-N908 PolarHBondContact O-OD1 3.23Å
907	K	37.2	Very low	44.1	Very low	214 Å²	214	102.9 Å²	102.9	93%	0.93	52%	0.522	S	S	*	.			trans	-45.7	110.5	-177.9	-90.4	-179.1	173.8	175.9	0	112.4	E905	E905-K907 PolarHBondContact O-N 3.05Å
908	N	35.9	Very low	43.9	Very low	88 Å²	88	106.5 Å²	106.5	47%	0.471	54%	0.539	S	S	.	.			trans	-50.7	129.7	-172.8	-65.9	-15.4	0	0	0	114.3	A906 D913	A906-N908 PolarHBondContact O-N 3.15Å; A906-N908 PolarHBondContact O-OD1 3.23Å; N908-D913 PolarHBondContact ND2-OD2 3.27Å
909	S	37	Very low	44	Very low	61 Å²	61	109 Å²	109	43%	0.427	55%	0.551	S	S	.	*			trans	-73.4	131.5	150.6	82.9	0	0	0	0	107.3	E911 E912	S909-E911 PolarHBondContact O-N 3.08Å; S909-E912 PolarHBondContact O-N 3.35Å
910	K	39.6	Very low	44	Very low	200 Å²	200	106.8 Å²	106.8	87%	0.87	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-11.4	-173.6	-79.8	-176.7	173.9	-178.3	0	115.1
911	E	40.2	Very low	43.8	Very low	158 Å²	158	105.7 Å²	105.7	74%	0.738	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-12.7	-175.8	-70.9	-176.8	161	0	0	114.7	S909	S909-E911 PolarHBondContact O-N 3.08Å
912	E	45.6	Very low	44.1	Very low	66 Å²	66	109.1 Å²	109.1	31%	0.308	54%	0.536	S	S	.	.	S	Bend	trans	-89.3	-11.2	-179.6	-75.8	175.7	152.3	0	0	113.2	R894 S909	R894-E912 IonicContact CZ-OE1 2.71Å; R894-E912 IonicContact NH1-OE1 2.76Å; R894-E912 IonicContact NH2-OE1 3.18Å; R894-E912 PolarHBondContact NH2-OE1 2.86Å; S909-E912 PolarHBondContact O-N 3.35Å
913	D	46.7	Very low	44.5	Very low	53 Å²	53	113.2 Å²	113.2	28%	0.283	55%	0.55	S	S	.	.	S	Bend	trans	-91.6	5.3	-170.9	-108.9	-20.8	0	0	0	116.3	R891 N908	R891-D913 IonicContact CZ-OD1 2.84Å; R891-D913 PolarHBondContact NE-O 3.45Å; R891-D913 IonicContact NE-OD1 2.64Å; R891-D913 VanDerWaalsContact NH2-CG 3.35Å; R891-D913 PolarHBondContact NH2-O 3.11Å; R891-D913 IonicContact NH2-OD1 2.74Å; R891-D913 PolarHBondContact NH2-OD1 3.02Å; N908-D913 PolarHBondContact ND2-OD2 3.27Å
914	Q	58	Low	45.1	Very low	145 Å²	145	111.8 Å²	111.8	68%	0.678	55%	0.548	S	S	*	.	S	Bend	trans	-106.6	140.8	-179.4	-67.1	-170.9	-14.1	0	0	112.1	K916	Q914-K916 PolarHBondContact O-N 2.93Å
915	W	60.9	Low	46	Very low	91 Å²	91	115.2 Å²	115.2	35%	0.345	55%	0.554	S	S	.	*			trans	-63.3	124	168.9	-74.6	99.5	0	0	0	109.8	I882 W889 R891	I882-W915 HydrophobicContact CB-CH2 4.39Å; I882-W915 HydrophobicContact CB-CZ3 4.23Å; I882-W915 HydrophobicContact CD1-CH2 3.32Å; I882-W915 HydrophobicContact CD1-CZ2 3.53Å; I882-W915 HydrophobicContact CD1-CZ3 3.94Å; I882-W915 HydrophobicContact CG1-CH2 3.53Å; I882-W915 HydrophobicContact CG1-CZ2 4.26Å; I882-W915 HydrophobicContact CG1-CZ3 3.85Å; W889-W915 HydrophobicContact CB-CE3 3.79Å; W889-W915 HydrophobicContact CB-CZ3 4.4Å; W889-W915 HydrophobicContact CE3-CB 3.98Å; R891-W915 HydrophobicContact CB-CD2 3.98Å; R891-W915 HydrophobicContact CB-CE3 3.93Å; R891-W915 HydrophobicContact CB-CH2 4.3Å; R891-W915 HydrophobicContact CB-CZ2 4.36Å; R891-W915 HydrophobicContact CB-CZ3 4.1Å
916	K	64.1	Low	46.7	Very low	98 Å²	98	111.5 Å²	111.5	43%	0.426	54%	0.539	S	S	.	.	B	Isolated β-bridge	trans	-106.9	131.6	176.4	-67.9	-179.9	-177.4	176	0	109	W889 Y890 Q914	W889-K916 CarbonylContact C-O 3.58Å; W889-K916 WeakPolarHBondContact CA-O 3.29Å; Y890-K916 HydrophobicContact CD1-CB 4.09Å; Y890-K916 WeakPolarHBondContact CD1-O 3.31Å; Y890-K916 HydrophobicContact CE1-CB 3.59Å; Y890-K916 HydrophobicContact CE2-CB 4.5Å; Y890-K916 PolarHBondContact N-O 3.45Å; Y890-K916 PolarHBondContact O-N 3.04Å; Q914-K916 PolarHBondContact O-N 2.93Å
917	L	56.1	Low	47.4	Very low	121 Å²	121	117.7 Å²	117.7	63%	0.634	56%	0.555	S	S	*	*			trans	-65.5	0	172	-163.9	80.5	0	0	0	111.4	H887 C888 W889	H887-L917 HydrophobicContact CB-CD1 3.42Å; H887-L917 VanDerWaalsContact CB-CD1 3.42Å; H887-L917 HydrophobicContact CB-CG 4.29Å; C888-L917 CarbonylContact O-C 3.47Å; W889-L917 HydrophobicContact CD2-CB 4.38Å; W889-L917 HydrophobicContact CD2-CD1 3.66Å; W889-L917 HydrophobicContact CE3-CB 4.15Å; W889-L917 HydrophobicContact CE3-CD1 4.2Å; W889-L917 HydrophobicContact CG-CD1 4.19Å; W889-L917 HydrophobicContact CH2-CB 4.33Å; W889-L917 HydrophobicContact CH2-CD1 3.95Å; W889-L917 HydrophobicContact CZ2-CD1 3.37Å; W889-L917 HydrophobicContact CZ3-CB 4.12Å; W889-L917 HydrophobicContact CZ3-CD1 4.33Å

Retrieved 917 of 917 residues in 554.2 ms (Link to these results)

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