A0A2K5NN95_CERAT Loading...

Exosome RNA helicase MTR4

AlphaFold DB , UniProt , Accession A0A2K5NN95, Species CERAT (Cercocebus atys, Sooty mangabey), Gene MTREX, Length 1,042 aa.

						>A0A2K5NN95_CERAT|A0A2K5NN95|MTREX
MADAFGDELFSVFESDSTNEAGTKKDKEKDKGKWKGPPGSADKAGKRFDGKLQSESTNNGKNKRDVDFEGTDEPVFGKKPRIEESITEDLSLADLMPRVKVQSVETVEGCTHEVALPADEDYLPLKPRVGKAAKEYPFILDAFQREAIQCVDNNQSVLVSAHTSAGKTVCAEYAIALALREKQRVIFTSPIKALSNQKYREMYEEFQDVGLMTGDVTINPTASCLVMTTEILRSMLYRGSEVMREVAWVIFDEIHYMRDSERGVVWEETIILLPDNVHYVFLSATIPNARQFAEWICHLHKQPCHVIYTDYRPTPLQHYIFPAGGDGLHLVVDENGDFREDNFNTAMQVLRDAGDLAKGDQKGRKGGTKGPSNVFKIVKMIMERNFQPVIIFSFSKKDCEAYALQMTKLDFNTDEEKKMVEEVFSNAIDCLSDEDKKLPQVEHVLPLLKRGIGIHHGGLLPILKETIEILFSEGLIKALFATETFAMGINMPARTVLFTNARKFDGKDFRWISSGEYIQMSGRAGRRGMDDRGIVILMVDEKMSPTIGKQLLKGSADPLNSAFHLTYNMVLNLLRVEEINPEYMLEKSFYQFQHYRAIPGVVEKVKNSEEQYNKIVIPNEESVVIYYKIRQQLAKLGKEIEEYIHKPKYCLPFLQPGRLVKVKNEGDDFGWGVVVNFSKKSNVKPNSGELDPLYVVEVLLRCSKESLKNSATEAAKPAKPDEKGEMQVVPVLVHLLSAISSVRLYIPKDLRPVDNRQSVLKSIQEVQKRFPDGIPLLDPIDDMGIQDQGLKKVIQKVEAFEHRMYSHPLHNDPNLETVYTLCEKKAQIAIDIKSAKRELKKARTVLQMDELKCRKRVLRRLGFATSSDVIEMKGRVACEISSADELLLTEMMFNGLFNDLSAEQATALLSCFVFQENSSEMPKLTEQLAGPLRQMQECAKRIAKVSAEAKLEIDEETYLSSFKPHLMDVVYTWATGATFAHICKMTDVFEGSIIRCMRRLEELLRQMCQAAKAIGNTELENKFAEGITKIKRDIVFAASLYL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32	Very low	31.3	Very low	253 Å²	253	155.5 Å²	155.5	100%	1.246	87%	0.87	S	S	*	*				0	104.6	0	-76.6	179.7	-80.9	0	0	107.4
2	A	25.8	Very low	31.6	Very low	93 Å²	93	152.3 Å²	152.3	77%	0.769	86%	0.857	S	S	*	*			trans	-119.6	136	160	0	0	0	0	0	105
3	D	35.4	Very low	31.5	Very low	171 Å²	171	156.6 Å²	156.6	91%	0.914	86%	0.861	S	S	*	*			trans	131.1	75.9	-178.3	-74	-10.4	0	0	0	110.9
4	A	29.8	Very low	31.4	Very low	80 Å²	80	159.9 Å²	159.9	66%	0.661	87%	0.868	S	S	*	*	S	Bend	trans	-162.1	138.6	157.7	0	0	0	0	0	108.6
5	F	30.5	Very low	31.2	Very low	216 Å²	216	156.4 Å²	156.4	95%	0.947	86%	0.86	S	S	*	*	S	Bend	trans	64.5	83.5	177.2	-52.8	-74.8	0	0	0	116.3
6	G	29.9	Very low	31.1	Very low	75 Å²	75	156.6 Å²	156.6	77%	0.773	86%	0.859	S	S	*	*			trans	-179.1	35.1	171.5	0	0	0	0	0	118.6
7	D	31.8	Very low	30.9	Very low	170 Å²	170	153.8 Å²	153.8	91%	0.909	85%	0.854	S	S	*	*	S	Bend	trans	-150.9	18	177.6	-119.1	-12.1	0	0	0	117.1
8	E	31.1	Very low	30.8	Very low	190 Å²	190	151.9 Å²	151.9	89%	0.888	85%	0.847	S	S	*	*	S	Bend	trans	-131.1	80.7	174.7	-72.4	-168.8	158	0	0	112.2
9	L	33.3	Very low	30.7	Very low	153 Å²	153	151.7 Å²	151.7	80%	0.801	84%	0.844	S	S	*	*	S	Bend	trans	-162.4	4.3	159.6	-139.6	74.4	0	0	0	117.4
10	F	33.6	Very low	30.5	Very low	191 Å²	191	153.7 Å²	153.7	84%	0.838	85%	0.847	S	S	*	*			trans	-130.9	38.7	-170.7	-71.9	-73	0	0	0	114.8
11	S	31.5	Very low	30.4	Very low	118 Å²	118	151.2 Å²	151.2	83%	0.825	85%	0.846	S	S	*	*			trans	-110	30	176.7	65.5	0	0	0	0	113.7
12	V	34.4	Very low	30.1	Very low	117 Å²	117	142.5 Å²	142.5	71%	0.709	82%	0.822	S	S	*	*			trans	-137.8	88.5	177.2	-176.3	0	0	0	0	108.8
13	F	31.1	Very low	30.1	Very low	209 Å²	209	144.8 Å²	144.8	92%	0.917	83%	0.826	S	S	*	*	S	Bend	trans	172.7	64	150.5	-86.2	-51	0	0	0	110.9
14	E	30	Very low	29.7	Very low	203 Å²	203	146.2 Å²	146.2	95%	0.949	82%	0.824	S	S	*	*			trans	-157	110.8	160.5	-125.1	171.4	-134.6	0	0	110.1
15	S	28	Very low	29.6	Very low	107 Å²	107	151.4 Å²	151.4	75%	0.748	83%	0.832	S	S	*	*			trans	-157.5	136.3	175.5	59.5	0	0	0	0	112.2
16	D	29.7	Very low	29.4	Very low	159 Å²	159	146.6 Å²	146.6	85%	0.85	82%	0.816	S	S	*	*			trans	70	103.4	160.9	-61.4	-14.5	0	0	0	120.9
17	S	27.7	Very low	29.2	Very low	110 Å²	110	151.6 Å²	151.6	77%	0.769	82%	0.816	S	S	*	*			trans	-144.5	69.9	143.9	73.1	0	0	0	0	113.2
18	T	29.6	Very low	29.1	Very low	119 Å²	119	150.4 Å²	150.4	73%	0.73	81%	0.805	S	S	*	*			trans	46.9	127.6	144.3	58.5	0	0	0	0	123.2
19	N	27.7	Very low	28.9	Very low	149 Å²	149	149.3 Å²	149.3	80%	0.797	80%	0.797	S	S	*	*			trans	68.7	156	146.4	-59.2	-8	0	0	0	118.1
20	E	27.8	Very low	28.7	Very low	191 Å²	191	148.2 Å²	148.2	89%	0.893	79%	0.793	S	S	*	*			cis	-140.6	-159.1	17.3	-150.3	164.3	-123.6	0	0	113.1
21	A	27.9	Very low	28.7	Very low	102 Å²	102	148 Å²	148	84%	0.843	79%	0.791	S	S	*	*			trans	-114.4	160	-158.5	0	0	0	0	0	117.2
22	G	25.6	Very low	28.5	Very low	70 Å²	70	145.9 Å²	145.9	72%	0.722	79%	0.788	S	S	*	*			trans	175.4	83.8	171.6	0	0	0	0	0	120.8
23	T	26.8	Very low	28.2	Very low	140 Å²	140	150.8 Å²	150.8	86%	0.859	80%	0.8	S	S	*	*			trans	32.2	108.2	145.5	52.2	0	0	0	0	124.6
24	K	27.1	Very low	28	Very low	202 Å²	202	152.6 Å²	152.6	88%	0.878	80%	0.801	S	S	*	*				39.6	144.2	122.6	-75.5	-178	174.9	174	0	124
25	K	26.3	Very low	28	Very low	189 Å²	189	152.9 Å²	152.9	82%	0.822	80%	0.799	S	S	*	*			trans	103.5	146.1	160.1	-71.3	-175.6	160.8	-164.6	0	115.5
26	D	26	Very low	28	Very low	114 Å²	114	151.2 Å²	151.2	61%	0.61	80%	0.798	S	S	*	*			cis	-146.6	-177	-2	-131.9	-50.6	0	0	0	112.7
27	K	26.8	Very low	29.4	Very low	181 Å²	181	149.6 Å²	149.6	79%	0.787	80%	0.796	S	S	*	*			trans	-49	166.5	175.6	-64.3	158.1	-178	173.7	0	115.3
28	E	28.4	Very low	30.3	Very low	145 Å²	145	150.7 Å²	150.7	68%	0.678	80%	0.801	S	S	*	*			cis	-153.7	-164	14.7	-136.7	-176.1	152.2	0	0	108.1
29	K	27.9	Very low	30.2	Very low	166 Å²	166	148.7 Å²	148.7	72%	0.722	80%	0.804	S	S	*	*			cis	-158.7	178.4	8.5	-149.1	157.7	-170.2	113.3	0	110.5
30	D	29.1	Very low	30.2	Very low	131 Å²	131	147.8 Å²	147.8	70%	0.701	81%	0.809	S	S	*	*			trans	-151.3	162.1	-177.9	-172.2	18.9	0	0	0	114.3
31	K	33.5	Very low	30.3	Very low	186 Å²	186	143.8 Å²	143.8	81%	0.809	81%	0.809	S	S	*	*			trans	80.4	124.4	160.5	-48.5	-160.1	180	-174.7	0	123.8
32	G	26.9	Very low	30.4	Very low	73 Å²	73	144.9 Å²	144.9	75%	0.753	80%	0.801	S	S	*	*			trans	161.7	137.8	149.2	0	0	0	0	0	112.1
33	K	29.1	Very low	30.6	Very low	221 Å²	221	150.1 Å²	150.1	96%	0.961	80%	0.803	S	S	*	*			cis	-160.3	171.1	-3.8	-139.3	171.5	-172	171.3	0	109.4
34	W	25.8	Very low	30.6	Very low	247 Å²	247	148.5 Å²	148.5	94%	0.936	81%	0.805	S	S	*	*			trans	-134.7	148.9	-171.6	-170.8	46.3	0	0	0	112.2
35	K	30.1	Very low	30.5	Very low	209 Å²	209	142.1 Å²	142.1	91%	0.909	80%	0.796	S	S	*	*			trans	-170.9	164.7	160.1	-111.5	175.7	-176.6	-169.1	0	112.7
36	G	28.1	Very low	30.6	Very low	71 Å²	71	142.6 Å²	142.6	73%	0.732	80%	0.798	S	S	*	*			trans	-126.5	-162.6	-162.8	0	0	0	0	0	118.1
37	P	59.9	Low	30.6	Very low	126 Å²	126	147.4 Å²	147.4	82%	0.818	81%	0.808	S	S	*	*			trans	-101.8	-176.3	-155.4	42.5	-39.8	0	0	0	115.3
38	P	46.5	Very low	30.4	Very low	132 Å²	132	147 Å²	147	86%	0.857	81%	0.806	S	S	*	*				-153.3	-178.7	96.6	41.9	-24.6	0	0	0	116
39	G	27.8	Very low	30.3	Very low	78 Å²	78	147 Å²	147	80%	0.804	81%	0.81	S	S	*	*			trans	152.4	142.1	158.4	0	0	0	0	0	117.1
40	S	27.9	Very low	30.2	Very low	129 Å²	129	142.7 Å²	142.7	90%	0.902	81%	0.813	S	S	*	*			trans	-150.9	147.5	-179.1	59.7	0	0	0	0	113.6
41	A	29.5	Very low	29.9	Very low	107 Å²	107	145.6 Å²	145.6	88%	0.884	82%	0.82	S	S	*	*			trans	-152.8	170.2	170.1	0	0	0	0	0	111.8
42	D	29.3	Very low	29.5	Very low	126 Å²	126	144.1 Å²	144.1	67%	0.674	82%	0.82	S	S	*	*			trans	-152.9	158.6	-150.9	-171.2	21.5	0	0	0	115.8
43	K	29	Very low	29.4	Very low	179 Å²	179	149.1 Å²	149.1	78%	0.778	82%	0.824	S	S	*	*			trans	78.3	147.6	157.3	-86	156.6	-172.1	126.1	0	125.7
44	A	27.4	Very low	29.1	Very low	107 Å²	107	143 Å²	143	88%	0.884	81%	0.809	S	S	*	*			trans	81.6	139.1	155.6	0	0	0	0	0	120.6
45	G	25.9	Very low	29	Very low	67 Å²	67	140 Å²	140	69%	0.691	81%	0.805	S	S	*	*			cis	150.1	138	-19.9	0	0	0	0	0	117
46	K	28.1	Very low	28.7	Very low	199 Å²	199	135.2 Å²	135.2	87%	0.865	80%	0.798	S	S	*	*			trans	75	155.1	174.4	-57.1	174	-179.4	170.2	0	115.4
47	R	24.8	Very low	28.5	Very low	216 Å²	216	138.3 Å²	138.3	82%	0.815	80%	0.803	S	S	*	*			cis	-160.7	144.2	-6.7	-126.8	-179	177.2	176.4	-3.3	112.4
48	F	23.7	Very low	26.9	Very low	171 Å²	171	140.5 Å²	140.5	75%	0.75	81%	0.808	S	S	*	*			trans	41.7	126.2	136.9	-93.6	-107	0	0	0	124.7
49	D	25.5	Very low	25.8	Very low	145 Å²	145	140.9 Å²	140.9	78%	0.775	80%	0.803	S	S	*	*			trans	51.8	135.2	136.5	-61.7	6.6	0	0	0	123.9
50	G	25.5	Very low	25.7	Very low	76 Å²	76	140.3 Å²	140.3	78%	0.784	80%	0.797	S	S	*	*			trans	-169.4	-6.7	177.5	0	0	0	0	0	123
51	K	24.8	Very low	25.5	Very low	193 Å²	193	143.5 Å²	143.5	84%	0.839	79%	0.794	S	S	*	*			trans	49.1	129.8	171.7	-85.6	-173.8	175.9	-179.9	0	121.1
52	L	24.8	Very low	25.3	Very low	154 Å²	154	145.9 Å²	145.9	81%	0.806	79%	0.792	S	S	*	*			trans	64.3	123.7	151.3	-62.4	162.5	0	0	0	116.6
53	Q	24.3	Very low	25.1	Very low	179 Å²	179	149.1 Å²	149.1	84%	0.836	80%	0.8	S	S	*	*			cis	-128.9	-150.6	-1	-58	-169.6	4.4	0	0	108.4
54	S	22.9	Very low	25	Very low	93 Å²	93	151.6 Å²	151.6	65%	0.65	81%	0.805	S	S	*	*			cis	-159.3	160.8	-0.2	46.3	0	0	0	0	110.4
55	E	23.9	Very low	24.9	Very low	183 Å²	183	153.9 Å²	153.9	86%	0.855	80%	0.802	S	S	*	*			trans	61.9	158.5	163	-67.7	-163.3	143.2	0	0	121.5
56	S	22.9	Very low	24.9	Very low	109 Å²	109	156.6 Å²	156.6	76%	0.762	81%	0.805	S	S	*	*			trans	90.4	129	158.3	76.7	0	0	0	0	121.3
57	T	24.7	Very low	24.8	Very low	136 Å²	136	154.2 Å²	154.2	83%	0.834	80%	0.802	S	S	*	*			trans	49.3	103.3	153	53.7	0	0	0	0	120.8
58	N	24.9	Very low	24.8	Very low	172 Å²	172	153.2 Å²	153.2	92%	0.92	80%	0.804	S	S	*	*			trans	-107.2	133.7	148.8	-166.9	0.7	0	0	0	109.1
59	N	24.3	Very low	25.3	Very low	139 Å²	139	154.6 Å²	154.6	74%	0.743	81%	0.813	S	S	*	*			trans	-110.6	78.6	-160	-165	-8	0	0	0	112.8	K61	N59-K61 PolarHBondContact O-N 3.21Å
60	G	25.3	Very low	25.5	Very low	66 Å²	66	150.7 Å²	150.7	68%	0.68	81%	0.806	S	S	*	*			trans	-79.8	106.1	-179.6	0	0	0	0	0	113.6	N62	G60-N62 PolarHBondContact O-N 3.33Å
61	K	24.8	Very low	26.1	Very low	196 Å²	196	152.7 Å²	152.7	85%	0.852	80%	0.804	S	S	*	*			trans	-74.8	81.9	174.9	-75.6	-176.2	175.5	177.3	0	112.5	N59 K63	N59-K61 PolarHBondContact O-N 3.21Å; K61-K63 PolarHBondContact O-N 2.79Å; K61-K63 VanDerWaalsContact O-N 3.13Å
62	N	24.9	Very low	26.8	Very low	157 Å²	157	147.5 Å²	147.5	84%	0.84	79%	0.785	S	S	*	*			trans	-68.8	106.7	165.3	-80.8	-3.7	0	0	0	110.2	G60 R64	G60-N62 PolarHBondContact O-N 3.33Å; N62-R64 PolarHBondContact O-N 3.24Å
63	K	24.7	Very low	27.8	Very low	195 Å²	195	144 Å²	144	85%	0.848	76%	0.764	S	S	*	*			trans	-73.4	114	169.7	-146.1	-177.9	-174.3	-170.7	0	107.3	K61	K61-K63 PolarHBondContact O-N 2.79Å; K61-K63 VanDerWaalsContact O-N 3.13Å
64	R	26	Very low	28.8	Very low	231 Å²	231	136.4 Å²	136.4	87%	0.872	73%	0.73	S	S	*	*			trans	-82.2	125.9	171.3	-68.4	-179.6	179.1	165.8	-0.7	108.2	N62	N62-R64 PolarHBondContact O-N 3.24Å
65	D	25.2	Very low	30.3	Very low	155 Å²	155	137 Å²	137	83%	0.829	73%	0.73	S	S	*	*			trans	-67.7	145.7	165.9	-70.3	-53.3	0	0	0	109.8
66	V	26	Very low	31.7	Very low	123 Å²	123	129.8 Å²	129.8	75%	0.745	70%	0.696	S	S	*	*			trans	-113.2	105.7	175.9	177.9	0	0	0	0	105.7	F68	V66-F68 PolarHBondContact O-N 2.72Å; V66-F68 VanDerWaalsContact O-N 3.16Å
67	D	27.5	Very low	32.7	Very low	149 Å²	149	128.1 Å²	128.1	80%	0.797	70%	0.696	S	S	*	*			trans	-58.4	119.7	174.4	-83.5	-35.6	0	0	0	108.8
68	F	24.4	Very low	33.4	Very low	195 Å²	195	130.4 Å²	130.4	86%	0.855	69%	0.694	S	S	*	*			trans	-101.3	127.8	174.4	-137.9	-85.3	0	0	0	107	V66 G70	V66-F68 PolarHBondContact O-N 2.72Å; V66-F68 VanDerWaalsContact O-N 3.16Å; F68-G70 PolarHBondContact O-N 2.93Å
69	E	32.9	Very low	34	Very low	201 Å²	201	131.6 Å²	131.6	94%	0.939	69%	0.691	S	S	*	*			trans	-65.7	108.3	-177.2	-65.4	-173.1	118.2	0	0	110.4
70	G	29.9	Very low	34.5	Very low	62 Å²	62	128.7 Å²	128.7	64%	0.639	68%	0.68	S	S	*	*			trans	-105.5	134.2	-176.8	0	0	0	0	0	111.6	F68	F68-G70 PolarHBondContact O-N 2.93Å
71	T	38.5	Very low	34.8	Very low	119 Å²	119	136 Å²	136	73%	0.73	69%	0.687	S	S	*	*			trans	-46.6	145.6	-177	45	0	0	0	0	114.4	E73	T71-E73 PolarHBondContact O-N 2.71Å
72	D	38.9	Very low	35.2	Very low	83 Å²	83	133.6 Å²	133.6	44%	0.444	68%	0.682	S	S	.	*			trans	-78.4	56	-179.1	-104.1	-41.1	0	0	0	113.7	K833 R837	D72-K833 WeakPolarHBondContact OD1-CD 3.36Å; D72-K833 VanDerWaalsContact OD1-CE 3.24Å; D72-K833 WeakPolarHBondContact OD1-CE 3.38Å; D72-K833 IonicContact OD1-NZ 2.74Å; D72-K833 PolarHBondContact OD1-NZ 2.95Å; D72-R837 VanDerWaalsContact CG-NH2 3.31Å; D72-R837 IonicContact OD1-CZ 3.91Å; D72-R837 IonicContact OD1-NH1 3.48Å; D72-R837 PolarHBondContact OD1-NH1 2.88Å; D72-R837 IonicContact OD1-NH2 2.94Å; D72-R837 PolarHBondContact OD1-NH2 3.47Å; D72-R837 IonicContact OD2-CZ 2.69Å; D72-R837 IonicContact OD2-NH1 3.57Å; D72-R837 PolarHBondContact OD2-NH1 2.82Å; D72-R837 IonicContact OD2-NH2 2.66Å; D72-R837 PolarHBondContact OD2-NH2 3.34Å; D72-R837 VanDerWaalsContact OD2-NH2 3.09Å
73	E	46.7	Very low	35.6	Very low	81 Å²	81	133.6 Å²	133.6	38%	0.379	68%	0.677	S	S	.	*			trans	-71.9	140.7	169.1	-70.6	-151	172.3	0	0	112.1	T71 V75 K628 Q632	T71-E73 PolarHBondContact O-N 2.71Å; E73-V75 PolarHBondContact O-N 2.98Å; E73-K628 IonicContact OE2-NZ 2.74Å; E73-Q632 PolarHBondContact OE1-NE2 2.69Å
74	P	46.1	Very low	36.1	Very low	19 Å²	19	131.5 Å²	131.5	12%	0.123	67%	0.67	C	S	.	*			trans	-73.4	121.3	171.7	28.9	-33.4	0	0	0	111.3	F76 Y627 A826 I830	P74-F76 HydrophobicContact CB-CD2 4.38Å; P74-F76 HydrophobicContact CB-CE2 3.85Å; P74-F76 HydrophobicContact CB-CZ 4.36Å; P74-F76 HydrophobicContact CG-CE2 3.79Å; P74-F76 HydrophobicContact CG-CZ 4.46Å; P74-F76 WeakPolarHBondContact O-CD2 3.28Å; P74-F76 PolarHBondContact O-N 3.19Å; P74-Y627 HydrophobicContact CG-CE1 4.42Å; P74-A826 HydrophobicContact CB-CB 4.36Å; P74-A826 HydrophobicContact CG-CB 4.4Å; P74-I830 HydrophobicContact CB-CG1 4.47Å
75	V	53.3	Low	36.6	Very low	105 Å²	105	123.9 Å²	123.9	64%	0.636	65%	0.652	S	S	*	*			trans	-92.1	96.6	177.9	-177.8	0	0	0	0	109.7	E73	E73-V75 PolarHBondContact O-N 2.98Å
76	F	53	Low	37.1	Very low	33 Å²	33	123.5 Å²	123.5	15%	0.145	65%	0.648	C	S	.	*			trans	-77.8	158.3	171.6	-61.3	-94.4	0	0	0	111.8	P74 K78 V624 A826	P74-F76 HydrophobicContact CB-CD2 4.38Å; P74-F76 HydrophobicContact CB-CE2 3.85Å; P74-F76 HydrophobicContact CB-CZ 4.36Å; P74-F76 HydrophobicContact CG-CE2 3.79Å; P74-F76 HydrophobicContact CG-CZ 4.46Å; P74-F76 WeakPolarHBondContact O-CD2 3.28Å; P74-F76 PolarHBondContact O-N 3.19Å; F76-K78 PolarHBondContact O-N 3.37Å; F76-V624 HydrophobicContact CB-CG1 4.25Å; F76-V624 HydrophobicContact CB-CG2 4.27Å; F76-V624 HydrophobicContact CD1-CG2 3.56Å; F76-V624 HydrophobicContact CD2-CB 4.38Å; F76-V624 HydrophobicContact CD2-CG1 3.46Å; F76-V624 VanDerWaalsContact CD2-CG1 3.46Å; F76-V624 HydrophobicContact CD2-CG2 3.92Å; F76-V624 HydrophobicContact CE1-CG2 3.71Å; F76-V624 HydrophobicContact CE2-CG1 3.82Å; F76-V624 HydrophobicContact CE2-CG2 4.05Å; F76-V624 HydrophobicContact CG-CB 4.46Å; F76-V624 HydrophobicContact CG-CG1 3.88Å; F76-V624 HydrophobicContact CG-CG2 3.67Å; F76-V624 HydrophobicContact CZ-CG2 3.93Å; F76-A826 HydrophobicContact CZ-CB 3.8Å
77	G	44.6	Very low	37.7	Very low	74 Å²	74	122.9 Å²	122.9	76%	0.763	65%	0.645	S	S	*	*	S	Bend	trans	85.9	-15.5	159.6	0	0	0	0	0	118.2
78	K	39.1	Very low	38.6	Very low	183 Å²	183	119.3 Å²	119.3	80%	0.796	62%	0.624	S	S	*	*			trans	-88.2	110	170.1	-76.8	-174.4	177.3	178.1	0	110.7	F76	F76-K78 PolarHBondContact O-N 3.37Å
79	K	38	Very low	39.8	Very low	198 Å²	198	115.3 Å²	115.3	86%	0.861	61%	0.611	S	S	*	*			trans	-53.2	129.8	160.8	-75.1	-174	175.9	-176.7	0	108.5	R81	K79-R81 PolarHBondContact O-N 3.29Å
80	P	34.8	Very low	40.3	Very low	77 Å²	77	112.4 Å²	112.4	50%	0.5	60%	0.601	S	S	.	*			trans	-60.8	139	168.7	26.5	-32.8	0	0	0	109	I82	P80-I82 PolarHBondContact O-N 2.67Å
81	R	30.9	Very low	41.5	Very low	219 Å²	219	112.2 Å²	112.2	83%	0.826	59%	0.59	S	S	*	*			trans	-72.2	108.3	169.5	-87.1	-173	171.2	167.6	-5.9	108.3	K79 E83	K79-R81 PolarHBondContact O-N 3.29Å; R81-E83 PolarHBondContact O-N 3.06Å
82	I	34.5	Very low	42.4	Very low	146 Å²	146	107.7 Å²	107.7	75%	0.749	56%	0.561	S	S	*	*			trans	-81.4	75.4	174.3	-52.5	172	0	0	0	107.3	P80	P80-I82 PolarHBondContact O-N 2.67Å
83	E	31.7	Very low	43.4	Very low	158 Å²	158	106.7 Å²	106.7	74%	0.738	57%	0.565	S	S	*	*			trans	-145.3	1.4	-172.2	-124.1	162.2	-157.1	0	0	115	R81	R81-E83 PolarHBondContact O-N 3.06Å
84	E	36.7	Very low	44.2	Very low	150 Å²	150	108.6 Å²	108.6	70%	0.701	58%	0.578	S	S	*	*	S	Bend	trans	-119.4	-7.3	176.5	-67.3	-178.8	142.3	0	0	113.7	I86 T87	E84-I86 PolarHBondContact O-N 3Å; E84-T87 PolarHBondContact O-N 3.26Å; E84-T87 PolarHBondContact O-OG1 3.25Å; E84-T87 VanDerWaalsContact O-OG1 3.13Å
85	S	36.3	Very low	45	Very low	71 Å²	71	110.7 Å²	110.7	50%	0.497	59%	0.588	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.2	15.4	-166.9	71.3	0	0	0	0	116.5
86	I	34.5	Very low	45.8	Very low	147 Å²	147	109.5 Å²	109.5	75%	0.754	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.5	-24.8	-179.5	-59.7	177.6	0	0	0	111.1	E84	E84-I86 PolarHBondContact O-N 3Å
87	T	38.8	Very low	46.9	Very low	110 Å²	110	108.4 Å²	108.4	68%	0.675	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-13.8	175.1	34.5	0	0	0	0	113.8	E84	E84-T87 PolarHBondContact O-N 3.26Å; E84-T87 PolarHBondContact O-OG1 3.25Å; E84-T87 VanDerWaalsContact O-OG1 3.13Å
88	E	47.4	Very low	48.7	Very low	74 Å²	74	112.7 Å²	112.7	35%	0.346	57%	0.565	S	S	.	*	S	Bend	trans	-82.1	-36.4	-175.5	-58.5	-155.7	126.2	0	0	113.9	L90 S91 R843	E88-L90 VanDerWaalsContact C-N 3.29Å; E88-L90 PolarHBondContact O-N 3.1Å; E88-S91 WeakPolarHBondContact O-CB 3.45Å; E88-S91 PolarHBondContact O-N 2.6Å; E88-S91 PolarHBondContact O-OG 3.41Å; E88-R843 VanDerWaalsContact CD-NH1 3.28Å; E88-R843 IonicContact OE1-CZ 3.6Å; E88-R843 IonicContact OE1-NH1 2.65Å; E88-R843 PolarHBondContact OE1-NH1 3.23Å; E88-R843 IonicContact OE1-NH2 2.75Å; E88-R843 PolarHBondContact OE1-NH2 2.91Å; E88-R843 IonicContact OE2-CZ 2.79Å; E88-R843 IonicContact OE2-NH1 3.86Å; E88-R843 IonicContact OE2-NH2 3.22Å; E88-R843 PolarHBondContact OE2-NH2 2.98Å
89	D	48.4	Very low	51.1	Low	111 Å²	111	104.8 Å²	104.8	59%	0.594	53%	0.532	S	S	*	.	H	α-helix	trans	-60.7	-36.5	-174.2	-70.5	-21.4	0	0	0	112.9	S91 L92 A93	D89-S91 PolarHBondContact O-N 3.02Å; D89-L92 PolarHBondContact O-N 3.47Å; D89-L92 VanDerWaalsContact O-N 3.11Å; D89-A93 PolarHBondContact O-N 3.01Å
90	L	43.6	Very low	53.7	Low	140 Å²	140	98.6 Å²	98.6	73%	0.733	51%	0.505	S	S	*	.	H	α-helix	trans	-60.8	-30.1	175.7	-82.7	160.2	0	0	0	113	E88	E88-L90 VanDerWaalsContact C-N 3.29Å; E88-L90 PolarHBondContact O-N 3.1Å
91	S	54.9	Low	56.5	Low	58 Å²	58	97.3 Å²	97.3	41%	0.406	50%	0.496	S	S	.	.	H	α-helix	trans	-78.5	-22	177.5	73.1	0	0	0	0	113.5	E88 D89	E88-S91 WeakPolarHBondContact O-CB 3.45Å; E88-S91 PolarHBondContact O-N 2.6Å; E88-S91 PolarHBondContact O-OG 3.41Å; D89-S91 PolarHBondContact O-N 3.02Å
92	L	57.6	Low	59.5	Low	24 Å²	24	91 Å²	91	13%	0.126	48%	0.476	C	S	.	.	H	α-helix	trans	-82.8	-35.7	-178.2	-70.5	172.1	0	0	0	111.7	D89 D94 L95 M96 I598 R843	D89-L92 PolarHBondContact O-N 3.47Å; D89-L92 VanDerWaalsContact O-N 3.11Å; L92-D94 VanDerWaalsContact C-N 3.29Å; L92-D94 PolarHBondContact O-N 3.16Å; L92-L95 PolarHBondContact O-N 3.04Å; L92-L95 VanDerWaalsContact O-N 3.09Å; L92-M96 WeakPolarHBondContact O-CG 3.31Å; L92-M96 PolarHBondContact O-N 3.46Å; L92-I598 HydrophobicContact CD2-CG2 4.11Å; L92-R843 HydrophobicContact CD2-CG 4.35Å
93	A	60.7	Low	62.3	Low	63 Å²	63	87.6 Å²	87.6	52%	0.521	47%	0.465	S	S	.	.	H	α-helix	trans	-60.4	-35.7	-178.6	0	0	0	0	0	113.4	D89	D89-A93 PolarHBondContact O-N 3.01Å
94	D	62.5	Low	65.2	Low	120 Å²	120	81.5 Å²	81.5	64%	0.642	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-18.8	177.3	-80.1	-38.4	0	0	0	114	L92 R98	L92-D94 VanDerWaalsContact C-N 3.29Å; L92-D94 PolarHBondContact O-N 3.16Å; D94-R98 IonicContact OD1-NH2 3.29Å; D94-R98 PolarHBondContact OD1-NH2 3.07Å
95	L	63.7	Low	67.5	Low	64 Å²	64	83.9 Å²	83.9	34%	0.335	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-11.2	174.5	-69.2	170.3	0	0	0	113.1	L92 Y595	L92-L95 PolarHBondContact O-N 3.04Å; L92-L95 VanDerWaalsContact O-N 3.09Å; L95-Y595 HydrophobicContact CD2-CE1 4.45Å
96	M	70.1	Confident	69.8	Low	80 Å²	80	82.5 Å²	82.5	39%	0.394	44%	0.438	S	S	.	.	S	Bend	trans	-82.6	138.2	-176.8	-76.3	-174.7	74.1	0	0	112.5	L92 R98 P599	L92-M96 WeakPolarHBondContact O-CG 3.31Å; L92-M96 PolarHBondContact O-N 3.46Å; M96-R98 PolarHBondContact O-N 3.3Å; M96-P599 HydrophobicContact CE-CG 4.36Å
97	P	75.8	Confident	71.7	Confident	9 Å²	9	80.3 Å²	80.3	6%	0.058	43%	0.432	C	S	.	.			trans	-58.4	120.4	174.8	-25.6	34.2	0	0	0	112.7	V99 H298 F592 R596	P97-V99 PolarHBondContact O-N 3.27Å; P97-H298 HydrophobicContact CB-CB 4.49Å; P97-F592 HydrophobicContact CB-CD2 4.17Å; P97-F592 HydrophobicContact CB-CE2 3.48Å; P97-F592 VanDerWaalsContact CB-CE2 3.48Å; P97-F592 HydrophobicContact CB-CZ 4.15Å; P97-F592 HydrophobicContact CG-CD2 3.7Å; P97-F592 HydrophobicContact CG-CE2 3.41Å; P97-F592 VanDerWaalsContact CG-CE2 3.41Å; P97-F592 HydrophobicContact CG-CZ 4.06Å; P97-R596 PolarHBondContact O-NH1 3.18Å
98	R	83.8	Confident	73.1	Confident	165 Å²	165	81.4 Å²	81.4	62%	0.623	43%	0.429	S	S	*	.			trans	-78.5	62.9	179.4	-61.8	-175.3	-178.8	-174	0.1	111.7	D94 M96 A118	D94-R98 IonicContact OD1-NH2 3.29Å; D94-R98 PolarHBondContact OD1-NH2 3.07Å; M96-R98 PolarHBondContact O-N 3.3Å; R98-A118 HydrophobicContact CB-CB 4.2Å; R98-A118 VanDerWaalsContact O-CB 3.32Å; R98-A118 WeakPolarHBondContact O-CB 3.26Å; R98-A118 PolarHBondContact O-N 2.79Å
99	V	89.6	Confident	74.5	Confident	17 Å²	17	81.1 Å²	81.1	10%	0.103	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	134.4	180	174.9	0	0	0	0	109.4	P97 A115 L116 E294 C297 H298	P97-V99 PolarHBondContact O-N 3.27Å; V99-A115 HydrophobicContact CG1-CB 3.98Å; V99-L116 WeakPolarHBondContact CA-O 3.45Å; V99-L116 WeakPolarHBondContact CG1-O 3.28Å; V99-E294 HydrophobicContact CG1-CB 4.1Å; V99-E294 HydrophobicContact CG1-CG 4.06Å; V99-C297 HydrophobicContact CG1-CB 4.26Å; V99-C297 HydrophobicContact CG2-CB 4.39Å; V99-H298 HydrophobicContact CG2-CB 3.77Å
100	K	92.1	Very high	76.4	Confident	68 Å²	68	76.3 Å²	76.3	30%	0.296	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	150.4	171.7	63.9	-167.9	174.9	-161.7	0	109.8	L116 P117 A118 E120	K100-L116 HydrophobicContact CG-CB 4.03Å; K100-L116 PolarHBondContact N-O 2.77Å; K100-L116 PolarHBondContact O-N 2.98Å; K100-P117 VanDerWaalsContact CE-O 3.29Å; K100-P117 WeakPolarHBondContact CE-O 3.46Å; K100-A118 WeakPolarHBondContact CE-O 3.25Å; K100-A118 PolarHBondContact NZ-O 2.93Å; K100-E120 WeakPolarHBondContact CE-O 3.48Å; K100-E120 PolarHBondContact NZ-O 3.05Å
101	V	93.6	Very high	78.7	Confident	50 Å²	50	73.5 Å²	73.5	30%	0.303	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	132.5	176.9	-179.2	0	0	0	0	109.4	E113 V114 A115 R290 E294	V101-E113 HydrophobicContact CG1-CB 4Å; V101-V114 WeakPolarHBondContact CA-O 3.48Å; V101-A115 HydrophobicContact CG2-CB 4.32Å; V101-R290 HydrophobicContact CG1-CG 4.22Å; V101-R290 HydrophobicContact CG2-CG 4.07Å; V101-E294 HydrophobicContact CG2-CG 3.59Å
102	Q	94.5	Very high	80.6	Confident	87 Å²	87	70.9 Å²	70.9	41%	0.407	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	124.7	176.3	178.7	59.5	55.7	0	0	109.1	E113 V114 L116 Y122	Q102-E113 CarbonylContact O-C 3.6Å; Q102-E113 WeakPolarHBondContact O-CA 3.37Å; Q102-V114 HydrophobicContact CB-CG1 4Å; Q102-V114 PolarHBondContact N-O 3.11Å; Q102-V114 PolarHBondContact O-N 2.93Å; Q102-L116 HydrophobicContact CB-CD1 4.31Å; Q102-Y122 HydrophobicContact CB-CG 4.44Å; Q102-Y122 HydrophobicContact CG-CD1 3.81Å; Q102-Y122 HydrophobicContact CG-CD2 4.26Å; Q102-Y122 HydrophobicContact CG-CE1 4.07Å; Q102-Y122 HydrophobicContact CG-CE2 4.5Å; Q102-Y122 HydrophobicContact CG-CG 3.9Å
103	S	92.7	Very high	82.5	Confident	74 Å²	74	71.6 Å²	71.6	52%	0.517	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	141.1	168.9	-49.4	0	0	0	0	109.9
104	V	91.3	Very high	84.2	Confident	29 Å²	29	68.6 Å²	68.6	18%	0.176	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	134	-179.6	-174.2	0	0	0	0	108	T106 H112 V114 Y122	V104-T106 PolarHBondContact O-N 3.12Å; V104-H112 HydrophobicContact CB-CB 4Å; V104-H112 PolarHBondContact N-O 3.1Å; V104-V114 HydrophobicContact CG2-CG1 4.32Å; V104-Y122 HydrophobicContact CG2-CE2 4.47Å; V104-Y122 WeakPolarHBondContact CG2-OH 3.43Å
105	E	86.4	Confident	85.8	Confident	200 Å²	200	63 Å²	63	94%	0.935	34%	0.339	S	S	*	.			trans	-70.7	125.5	179.5	-68.1	-170.6	167.5	0	0	110.9
106	T	84.2	Confident	87.3	Confident	43 Å²	43	60.4 Å²	60.4	26%	0.264	33%	0.326	S	S	.	.			trans	-127.6	159.6	-178.1	34.8	0	0	0	0	112.6	V104 C110 H112 E146	V104-T106 PolarHBondContact O-N 3.12Å; T106-C110 PolarHBondContact OG1-O 2.97Å; T106-H112 HydrophobicContact CG2-CB 3.47Å; T106-H112 VanDerWaalsContact CG2-CB 3.47Å; T106-E146 HydrophobicContact CG2-CG 3.85Å; T106-E146 WeakPolarHBondContact CG2-OE2 3.28Å
107	V	73.8	Confident	88.3	Confident	101 Å²	101	57.1 Å²	57.1	61%	0.612	31%	0.311	S	S	*	.	S	Bend	trans	-99.6	163.9	177.1	-143.3	0	0	0	0	110.5	G109	V107-G109 PolarHBondContact O-N 2.99Å
108	E	68.4	Low	88.9	Confident	132 Å²	132	59 Å²	59	62%	0.617	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	48.2	159.6	-62.2	171.9	147.8	0	0	116.2	C110 A142 R145	E108-C110 PolarHBondContact O-N 3.27Å; E108-A142 HydrophobicContact CB-CB 3.77Å; E108-R145 IonicContact OE2-CZ 3.63Å; E108-R145 IonicContact OE2-NH1 3.64Å; E108-R145 IonicContact OE2-NH2 2.72Å; E108-R145 PolarHBondContact OE2-NH2 3.35Å
109	G	76.2	Confident	89.1	Confident	69 Å²	69	58 Å²	58	71%	0.711	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	18.3	166.9	0	0	0	0	0	115.2	V107 T309	V107-G109 PolarHBondContact O-N 2.99Å; G109-T309 PolarHBondContact O-OG1 3.04Å
110	C	88.2	Confident	89	Confident	9 Å²	9	61.4 Å²	61.4	6%	0.061	35%	0.348	C	S	.	.			trans	-104.4	146	170.1	-170.6	0	0	0	0	109.7	T106 E108 F143	T106-C110 PolarHBondContact OG1-O 2.97Å; E108-C110 PolarHBondContact O-N 3.27Å; C110-F143 HydrophobicContact CB-CB 4.33Å; C110-F143 VanDerWaalsContact SG-CB 3.52Å
111	T	92.4	Very high	88.8	Confident	81 Å²	81	64.9 Å²	64.9	50%	0.497	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	139.7	166.5	50.7	0	0	0	0	110.4	Y308	T111-Y308 PolarHBondContact N-O 2.89Å; T111-Y308 PolarHBondContact O-N 3.33Å; T111-Y308 PolarHBondContact OG1-O 3.39Å
112	H	95.6	Very high	88.7	Confident	3 Å²	3	65.7 Å²	65.7	1%	0.014	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	118.6	179	-171.8	158.6	0	0	0	108.4	V104 T106 L125 E146 H305 V306 I307	V104-H112 HydrophobicContact CB-CB 4Å; V104-H112 PolarHBondContact N-O 3.1Å; T106-H112 HydrophobicContact CG2-CB 3.47Å; T106-H112 VanDerWaalsContact CG2-CB 3.47Å; H112-L125 VanDerWaalsContact CE1-CD1 3.48Å; H112-L125 WeakPolarHBondContact CE1-CD1 3.47Å; H112-E146 IonicContact CE1-OE2 3.84Å; H112-E146 IonicContact CG-OE2 3.74Å; H112-E146 IonicContact ND1-OE2 2.7Å; H112-E146 PolarHBondContact ND1-OE2 2.96Å; H112-H305 AromaticContact CD2-ND1 3.97Å; H112-H305 AromaticContact CE1-ND1 3.89Å; H112-H305 AromaticContact NE2-CE1 3.91Å; H112-H305 AromaticContact NE2-CG 3.9Å; H112-H305 AromaticContact NE2-ND1 2.95Å; H112-H305 PolarHBondContact NE2-ND1 2.78Å; H112-V306 WeakPolarHBondContact CA-O 3.5Å; H112-I307 HydrophobicContact CB-CD1 3.96Å; H112-I307 VanDerWaalsContact CG-CD1 3.43Å; H112-I307 WeakPolarHBondContact ND1-CD1 3.34Å
113	E	96.4	Very high	88.5	Confident	39 Å²	39	67.7 Å²	67.7	18%	0.182	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	153.3	167.9	-62.2	-174.3	128.2	0	0	109.1	V101 Q102 R290 H305 V306	V101-E113 HydrophobicContact CG1-CB 4Å; Q102-E113 CarbonylContact O-C 3.6Å; Q102-E113 WeakPolarHBondContact O-CA 3.37Å; E113-R290 IonicContact OE1-CZ 3.35Å; E113-R290 IonicContact OE1-NH1 2.65Å; E113-R290 PolarHBondContact OE1-NH1 3.43Å; E113-R290 WeakPolarHBondContact OE2-CB 3.36Å; E113-R290 WeakPolarHBondContact OE2-CD 3.48Å; E113-R290 IonicContact OE2-NH1 2.73Å; E113-R290 PolarHBondContact OE2-NH1 3.01Å; E113-H305 CarbonylContact O-C 3.54Å; E113-H305 WeakPolarHBondContact O-CA 3.46Å; E113-V306 HydrophobicContact CB-CB 4.44Å; E113-V306 PolarHBondContact N-O 3.44Å; E113-V306 PolarHBondContact O-N 3.29Å
114	V	96.9	Very high	88.4	Confident	1 Å²	1	68.5 Å²	68.5	1%	0.006	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	128.1	170.5	61.6	0	0	0	0	110.6	V101 Q102 V104 L116 Y122 P303	V101-V114 WeakPolarHBondContact CA-O 3.48Å; Q102-V114 HydrophobicContact CB-CG1 4Å; Q102-V114 PolarHBondContact N-O 3.11Å; Q102-V114 PolarHBondContact O-N 2.93Å; V104-V114 HydrophobicContact CG2-CG1 4.32Å; V114-L116 HydrophobicContact CG1-CD1 4.23Å; V114-L116 HydrophobicContact CG1-CD2 4.31Å; V114-L116 HydrophobicContact CG1-CG 4.18Å; V114-L116 HydrophobicContact CG2-CD2 3.76Å; V114-L116 HydrophobicContact CG2-CG 4.16Å; V114-Y122 HydrophobicContact CG1-CD2 3.98Å; V114-Y122 HydrophobicContact CG1-CE2 3.79Å; V114-P303 HydrophobicContact CG2-CB 4.28Å
115	A	96.7	Very high	88.5	Confident	2 Å²	2	68.1 Å²	68.1	2%	0.017	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	129.8	167.8	0	0	0	0	0	109.4	V99 V101 A293 E294 C297 P303 C304	V99-A115 HydrophobicContact CG1-CB 3.98Å; V101-A115 HydrophobicContact CG2-CB 4.32Å; A115-A293 HydrophobicContact CB-CB 4.24Å; A115-E294 HydrophobicContact CB-CG 4.24Å; A115-C297 HydrophobicContact CB-CB 3.9Å; A115-P303 WeakPolarHBondContact O-CA 3.3Å; A115-C304 PolarHBondContact N-O 2.95Å; A115-C304 PolarHBondContact O-N 3.35Å
116	L	94.3	Very high	88.7	Confident	9 Å²	9	65.4 Å²	65.4	5%	0.047	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	146.6	-174.1	-59.7	167.3	0	0	0	110.2	V99 K100 Q102 V114 A118 Y122 P303	V99-L116 WeakPolarHBondContact CA-O 3.45Å; V99-L116 WeakPolarHBondContact CG1-O 3.28Å; K100-L116 HydrophobicContact CG-CB 4.03Å; K100-L116 PolarHBondContact N-O 2.77Å; K100-L116 PolarHBondContact O-N 2.98Å; Q102-L116 HydrophobicContact CB-CD1 4.31Å; V114-L116 HydrophobicContact CG1-CD1 4.23Å; V114-L116 HydrophobicContact CG1-CD2 4.31Å; V114-L116 HydrophobicContact CG1-CG 4.18Å; V114-L116 HydrophobicContact CG2-CD2 3.76Å; V114-L116 HydrophobicContact CG2-CG 4.16Å; L116-A118 PolarHBondContact O-N 2.79Å; L116-Y122 HydrophobicContact CD1-CD2 3.88Å; L116-Y122 HydrophobicContact CD1-CG 4.19Å; L116-P303 HydrophobicContact CD2-CB 3.91Å; L116-P303 HydrophobicContact CD2-CG 3.95Å
117	P	92.1	Very high	89	Confident	12 Å²	12	68.3 Å²	68.3	8%	0.078	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.5	137.9	165.5	-23.8	34.9	0	0	0	109.9	K100 D119 E120 C297	K100-P117 VanDerWaalsContact CE-O 3.29Å; K100-P117 WeakPolarHBondContact CE-O 3.46Å; P117-D119 WeakPolarHBondContact CB-OD1 3.39Å; P117-D119 PolarHBondContact O-N 3.36Å; P117-D119 VanDerWaalsContact O-N 3.07Å; P117-E120 HydrophobicContact CB-CB 4.31Å; P117-E120 HydrophobicContact CB-CG 4.06Å; P117-E120 WeakPolarHBondContact CD-OE2 3.48Å; P117-E120 HydrophobicContact CG-CB 4.5Å; P117-E120 HydrophobicContact CG-CG 4.14Å; P117-E120 WeakPolarHBondContact CG-OE2 3.36Å; P117-E120 PolarHBondContact O-N 3.41Å; P117-E120 VanDerWaalsContact O-N 3.13Å; P117-C297 VanDerWaalsContact CD-SG 3.57Å; P117-C297 VanDerWaalsContact N-SG 3.36Å
118	A	87.4	Confident	89.7	Confident	47 Å²	47	68.7 Å²	68.7	39%	0.388	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-26.9	-174.2	0	0	0	0	0	113.1	R98 K100 L116	R98-A118 HydrophobicContact CB-CB 4.2Å; R98-A118 VanDerWaalsContact O-CB 3.32Å; R98-A118 WeakPolarHBondContact O-CB 3.26Å; R98-A118 PolarHBondContact O-N 2.79Å; K100-A118 WeakPolarHBondContact CE-O 3.25Å; K100-A118 PolarHBondContact NZ-O 2.93Å; L116-A118 PolarHBondContact O-N 2.79Å
119	D	88.3	Confident	90.5	Very high	144 Å²	144	69.2 Å²	69.2	77%	0.77	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-15	-179.3	49.8	-39.1	0	0	0	115.3	P117	P117-D119 WeakPolarHBondContact CB-OD1 3.39Å; P117-D119 PolarHBondContact O-N 3.36Å; P117-D119 VanDerWaalsContact O-N 3.07Å
120	E	88.1	Confident	91	Very high	90 Å²	90	69 Å²	69	42%	0.421	39%	0.386	S	S	.	.	S	Bend	trans	-93.5	124.6	177.4	-70.9	-166.8	146.3	0	0	112.3	K100 P117	K100-E120 WeakPolarHBondContact CE-O 3.48Å; K100-E120 PolarHBondContact NZ-O 3.05Å; P117-E120 HydrophobicContact CB-CB 4.31Å; P117-E120 HydrophobicContact CB-CG 4.06Å; P117-E120 WeakPolarHBondContact CD-OE2 3.48Å; P117-E120 HydrophobicContact CG-CB 4.5Å; P117-E120 HydrophobicContact CG-CG 4.14Å; P117-E120 WeakPolarHBondContact CG-OE2 3.36Å; P117-E120 PolarHBondContact O-N 3.41Å; P117-E120 VanDerWaalsContact O-N 3.13Å
121	D	88.3	Confident	91.1	Very high	140 Å²	140	76.6 Å²	76.6	75%	0.749	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-70.3	140.9	175.9	-78	-35.7	0	0	0	112.6	L123	D121-L123 PolarHBondContact O-N 2.83Å
122	Y	90.2	Very high	91.1	Very high	68 Å²	68	73.8 Å²	73.8	27%	0.267	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-67.2	120.6	179.1	173.7	-116.3	0	0	0	111.3	Q102 V104 V114 L116 P124	Q102-Y122 HydrophobicContact CB-CG 4.44Å; Q102-Y122 HydrophobicContact CG-CD1 3.81Å; Q102-Y122 HydrophobicContact CG-CD2 4.26Å; Q102-Y122 HydrophobicContact CG-CE1 4.07Å; Q102-Y122 HydrophobicContact CG-CE2 4.5Å; Q102-Y122 HydrophobicContact CG-CG 3.9Å; V104-Y122 HydrophobicContact CG2-CE2 4.47Å; V104-Y122 WeakPolarHBondContact CG2-OH 3.43Å; V114-Y122 HydrophobicContact CG1-CD2 3.98Å; V114-Y122 HydrophobicContact CG1-CE2 3.79Å; L116-Y122 HydrophobicContact CD1-CD2 3.88Å; L116-Y122 HydrophobicContact CD1-CG 4.19Å; Y122-P124 HydrophobicContact CE1-CG 4.05Å
123	L	90.3	Very high	91	Very high	128 Å²	128	74.7 Å²	74.7	67%	0.67	41%	0.411	S	S	*	.			trans	-107.7	127.1	168.4	-61.2	-179.8	0	0	0	109.1	D121	D121-L123 PolarHBondContact O-N 2.83Å
124	P	91.4	Very high	90.9	Very high	92 Å²	92	74.1 Å²	74.1	60%	0.597	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-57.4	143.3	173.2	-26.4	35.3	0	0	0	112.7	Y122 K126	Y122-P124 HydrophobicContact CE1-CG 4.05Å; P124-K126 PolarHBondContact O-N 2.97Å
125	L	92.2	Very high	90.7	Very high	21 Å²	21	80.8 Å²	80.8	11%	0.11	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-54.8	129.8	176.1	-76.7	164.2	0	0	0	110.8	H112 Q149 N153	H112-L125 VanDerWaalsContact CE1-CD1 3.48Å; H112-L125 WeakPolarHBondContact CE1-CD1 3.47Å; L125-Q149 HydrophobicContact CB-CG 4.12Å; L125-Q149 HydrophobicContact CD1-CG 4.45Å; L125-Q149 PolarHBondContact O-NE2 2.99Å; L125-N153 HydrophobicContact CD2-CB 3.61Å
126	K	91.6	Very high	90.5	Very high	143 Å²	143	82.4 Å²	82.4	62%	0.622	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-74.1	140.8	179.4	-62.2	160.2	-171.6	158.7	0	109.2	P124 Q149 N153	P124-K126 PolarHBondContact O-N 2.97Å; K126-Q149 PolarHBondContact O-NE2 3.48Å; K126-N153 WeakPolarHBondContact CB-OD1 3.27Å; K126-N153 PolarHBondContact N-OD1 3.36Å; K126-N153 PolarHBondContact O-ND2 3.03Å
127	P	90.1	Very high	90.4	Very high	104 Å²	104	88.2 Å²	88.2	68%	0.675	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-58.8	142.7	167.4	-22.9	33.9	0	0	0	110.6	V129	P127-V129 PolarHBondContact O-N 2.8Å
128	R	88.9	Confident	90.3	Very high	109 Å²	109	92.5 Å²	92.5	41%	0.411	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-54.6	131.2	-179.8	174.7	174.2	53.6	-119.8	5.4	111.4	D152 Y173	R128-D152 HydrophobicContact CB-CB 4.5Å; R128-D152 VanDerWaalsContact CD-OD2 3.28Å; R128-D152 WeakPolarHBondContact CD-OD2 3.5Å; R128-D152 IonicContact CZ-OD2 3.71Å; R128-D152 IonicContact NE-OD2 3.89Å; R128-D152 IonicContact NH1-OD2 2.79Å; R128-D152 PolarHBondContact NH1-OD2 3.19Å; R128-Y173 PolarHBondContact NH1-OH 3.41Å
129	V	85.2	Confident	90.5	Very high	143 Å²	143	97.6 Å²	97.6	87%	0.867	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-96.2	118.7	171.3	-177.2	0	0	0	0	109.1	P127	P127-V129 PolarHBondContact O-N 2.8Å
130	G	87.2	Confident	90.7	Very high	63 Å²	63	92.6 Å²	92.6	65%	0.649	49%	0.493	S	S	*	.	S	Bend	trans	92.1	-159.3	179.7	0	0	0	0	0	114.3
131	K	89.9	Confident	90.8	Very high	170 Å²	170	89.7 Å²	89.7	74%	0.739	48%	0.48	S	S	*	.	S	Bend	trans	-77.9	154.3	-179.8	-72	-165.6	172.3	-160.5	0	111.9
132	A	92.3	Very high	91	Very high	21 Å²	21	83.6 Å²	83.6	17%	0.174	45%	0.45	C	S	.	.			trans	-56.3	148.1	167.7	0	0	0	0	0	110.9	K134 E135 Y173	A132-K134 WeakPolarHBondContact CB-O 3.44Å; A132-E135 HydrophobicContact CB-CG 4.19Å; A132-Y173 HydrophobicContact CB-CE2 4.15Å
133	A	92.7	Very high	91.1	Very high	23 Å²	23	80.6 Å²	80.6	19%	0.19	44%	0.438	C	S	.	.	S	Bend	trans	-68.4	-38.9	172.5	0	0	0	0	0	111.8	Y173 A176 L177	A133-Y173 HydrophobicContact CB-CD1 4.47Å; A133-Y173 HydrophobicContact CB-CD2 4.38Å; A133-Y173 HydrophobicContact CB-CE1 3.98Å; A133-Y173 HydrophobicContact CB-CE2 3.89Å; A133-Y173 PolarHBondContact N-OH 3.28Å; A133-A176 HydrophobicContact CB-CB 4.04Å; A133-L177 HydrophobicContact CB-CB 4.01Å; A133-L177 HydrophobicContact CB-CD1 4.49Å
134	K	94.4	Very high	91.3	Very high	27 Å²	27	74.6 Å²	74.6	12%	0.117	41%	0.406	C	S	.	.	S	Bend	trans	-134.4	141.4	170.9	179.5	163.4	165.5	55.1	0	110.1	A132 Y136 E172 Y173 A176 E205 F206	A132-K134 WeakPolarHBondContact CB-O 3.44Å; K134-Y136 HydrophobicContact CB-CE2 4.27Å; K134-Y136 HydrophobicContact CD-CE1 4.06Å; K134-Y136 HydrophobicContact CG-CE1 4.12Å; K134-Y136 HydrophobicContact CG-CE2 4.07Å; K134-E172 HydrophobicContact CD-CB 4.11Å; K134-E172 VanDerWaalsContact CE-OE2 3.27Å; K134-E172 WeakPolarHBondContact CE-OE2 3.34Å; K134-Y173 HydrophobicContact CB-CD2 4.3Å; K134-A176 HydrophobicContact CB-CB 3.71Å; K134-E205 IonicContact NZ-OE1 2.69Å; K134-E205 PolarHBondContact NZ-OE1 3.47Å; K134-E205 IonicContact NZ-OE2 2.71Å; K134-E205 PolarHBondContact NZ-OE2 2.81Å; K134-F206 HydrophobicContact CD-CE1 4.37Å; K134-F206 HydrophobicContact CD-CZ 4.05Å
135	E	93.1	Very high	91.4	Very high	141 Å²	141	75.3 Å²	75.3	66%	0.659	40%	0.397	S	S	*	.			trans	-105.1	152.7	172	-67	179.6	-172.5	0	0	109.3	A132	A132-E135 HydrophobicContact CB-CG 4.19Å
136	Y	93.4	Very high	91.5	Very high	35 Å²	35	76.1 Å²	76.1	14%	0.137	40%	0.4	C	S	.	.			trans	-126.7	145.5	-172.7	-63.7	-87	0	0	0	110.8	K134 F138 L140 I148 V169 E172 Y173	K134-Y136 HydrophobicContact CB-CE2 4.27Å; K134-Y136 HydrophobicContact CD-CE1 4.06Å; K134-Y136 HydrophobicContact CG-CE1 4.12Å; K134-Y136 HydrophobicContact CG-CE2 4.07Å; Y136-F138 HydrophobicContact CD1-CE1 4.4Å; Y136-F138 HydrophobicContact CD1-CE2 4.35Å; Y136-F138 AromaticContact CD1-CZ 3.82Å; Y136-F138 HydrophobicContact CD1-CZ 3.82Å; Y136-F138 HydrophobicContact CG-CE2 4.4Å; Y136-F138 HydrophobicContact CG-CZ 4.27Å; Y136-F138 PolarHBondContact O-N 2.75Å; Y136-L140 HydrophobicContact CD2-CD1 4.36Å; Y136-L140 HydrophobicContact CD2-CD2 3.88Å; Y136-L140 HydrophobicContact CD2-CG 4.48Å; Y136-L140 HydrophobicContact CE2-CD2 4.42Å; Y136-L140 HydrophobicContact CG-CD2 4.16Å; Y136-I148 HydrophobicContact CE2-CD1 4.46Å; Y136-V169 HydrophobicContact CD1-CG1 4.35Å; Y136-V169 HydrophobicContact CE1-CB 4.41Å; Y136-V169 HydrophobicContact CE1-CG1 3.88Å; Y136-V169 HydrophobicContact CE1-CG2 4.31Å; Y136-V169 HydrophobicContact CE2-CG1 4.06Å; Y136-V169 PolarHBondContact OH-O 3.15Å; Y136-E172 WeakPolarHBondContact CE1-OE2 3.37Å; Y136-Y173 HydrophobicContact CE2-CD2 4.31Å; Y136-Y173 PolarHBondContact OH-N 2.83Å
137	P	91.6	Very high	91.8	Very high	132 Å²	132	69.3 Å²	69.3	86%	0.857	37%	0.371	S	S	*	.	S	Bend	trans	-76.5	1.7	-179.1	31.7	-35.2	0	0	0	113.9
138	F	90.4	Very high	92.1	Very high	101 Å²	101	64.6 Å²	64.6	44%	0.443	34%	0.34	S	S	.	.	S	Bend	trans	-129.2	158.2	179.6	50.2	-98.9	0	0	0	110.9	Y136 L140 V169	Y136-F138 HydrophobicContact CD1-CE1 4.4Å; Y136-F138 HydrophobicContact CD1-CE2 4.35Å; Y136-F138 AromaticContact CD1-CZ 3.82Å; Y136-F138 HydrophobicContact CD1-CZ 3.82Å; Y136-F138 HydrophobicContact CG-CE2 4.4Å; Y136-F138 HydrophobicContact CG-CZ 4.27Å; Y136-F138 PolarHBondContact O-N 2.75Å; F138-L140 HydrophobicContact CE2-CD2 4.05Å; F138-V169 HydrophobicContact CE2-CG2 4.12Å; F138-V169 HydrophobicContact CZ-CG2 3.84Å
139	I	91.1	Very high	92.4	Very high	154 Å²	154	62 Å²	62	79%	0.79	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-70.2	132.2	174.2	-58.3	174.3	0	0	0	108.7
140	L	91.8	Very high	92.9	Very high	39 Å²	39	55.2 Å²	55.2	20%	0.204	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-74.3	129.2	179.3	-65.9	175	0	0	0	111.7	Y136 F138 Q144 R145 I148 V169	Y136-L140 HydrophobicContact CD2-CD1 4.36Å; Y136-L140 HydrophobicContact CD2-CD2 3.88Å; Y136-L140 HydrophobicContact CD2-CG 4.48Å; Y136-L140 HydrophobicContact CE2-CD2 4.42Å; Y136-L140 HydrophobicContact CG-CD2 4.16Å; F138-L140 HydrophobicContact CE2-CD2 4.05Å; L140-Q144 HydrophobicContact CB-CB 4.32Å; L140-Q144 HydrophobicContact CD2-CB 4.33Å; L140-R145 HydrophobicContact CB-CG 3.74Å; L140-R145 HydrophobicContact CD1-CG 4.46Å; L140-R145 PolarHBondContact O-NE 3.15Å; L140-I148 HydrophobicContact CD1-CD1 3.89Å; L140-V169 HydrophobicContact CD2-CG1 3.64Å
141	D	91.3	Very high	93.3	Very high	29 Å²	29	52.2 Å²	52.2	16%	0.155	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-60.2	154	172.8	-61.1	-43.8	0	0	0	109.9	F143 Q144 R145 R527	D141-F143 VanDerWaalsContact C-N 3.34Å; D141-F143 HydrophobicContact CB-CD1 3.76Å; D141-F143 HydrophobicContact CB-CE1 3.67Å; D141-F143 PolarHBondContact O-N 2.86Å; D141-Q144 HydrophobicContact CB-CG 4.2Å; D141-Q144 WeakPolarHBondContact O-CB 3.43Å; D141-Q144 PolarHBondContact O-N 3.29Å; D141-R145 PolarHBondContact O-N 3.02Å; D141-R145 VanDerWaalsContact O-N 3.12Å; D141-R527 VanDerWaalsContact CG-NH2 3.35Å; D141-R527 IonicContact OD1-NH2 2.7Å; D141-R527 PolarHBondContact OD1-NH2 3.4Å; D141-R527 VanDerWaalsContact OD1-NH2 3.11Å; D141-R527 IonicContact OD2-CZ 3.12Å; D141-R527 VanDerWaalsContact OD2-CZ 3.27Å; D141-R527 IonicContact OD2-NH1 2.75Å; D141-R527 PolarHBondContact OD2-NH1 2.86Å; D141-R527 IonicContact OD2-NH2 3.76Å; D141-R527 PolarHBondContact OD2-NH2 3.31Å
142	A	91.4	Very high	93.6	Very high	13 Å²	13	45.7 Å²	45.7	11%	0.107	23%	0.234	C	C	.	.	H	α-helix	trans	-54.4	-47.5	-174	0	0	0	0	0	113.1	E108 Q144 R145 E146	E108-A142 HydrophobicContact CB-CB 3.77Å; A142-Q144 VanDerWaalsContact C-N 3.25Å; A142-Q144 PolarHBondContact O-N 3.15Å; A142-R145 WeakPolarHBondContact O-CB 3.21Å; A142-R145 PolarHBondContact O-N 2.99Å; A142-R145 VanDerWaalsContact O-N 3.1Å; A142-E146 WeakPolarHBondContact O-CG 3.27Å; A142-E146 PolarHBondContact O-N 3.49Å
143	F	93.4	Very high	93.7	Very high	5 Å²	5	46.5 Å²	46.5	2%	0.022	24%	0.235	C	C	.	.	H	α-helix	trans	-61.4	-31.5	178.2	85.3	-88.8	0	0	0	113.1	C110 D141 A147 V159 A161 A165 I307 T309	C110-F143 HydrophobicContact CB-CB 4.33Å; C110-F143 VanDerWaalsContact SG-CB 3.52Å; D141-F143 VanDerWaalsContact C-N 3.34Å; D141-F143 HydrophobicContact CB-CD1 3.76Å; D141-F143 HydrophobicContact CB-CE1 3.67Å; D141-F143 PolarHBondContact O-N 2.86Å; F143-A147 WeakPolarHBondContact O-CB 3.26Å; F143-A147 PolarHBondContact O-N 3.09Å; F143-A147 VanDerWaalsContact O-N 3.08Å; F143-V159 HydrophobicContact CD2-CG1 3.89Å; F143-V159 HydrophobicContact CE2-CG1 3.92Å; F143-A161 HydrophobicContact CE2-CB 4.43Å; F143-A165 HydrophobicContact CE1-CB 4.18Å; F143-A165 HydrophobicContact CZ-CB 3.87Å; F143-A165 WeakPolarHBondContact CZ-O 3.49Å; F143-I307 HydrophobicContact CB-CG2 3.76Å; F143-I307 WeakPolarHBondContact O-CG2 3.48Å; F143-T309 HydrophobicContact CB-CG2 3.94Å; F143-T309 HydrophobicContact CD1-CG2 3.86Å; F143-T309 HydrophobicContact CD2-CG2 4.46Å; F143-T309 HydrophobicContact CG-CG2 3.82Å
144	Q	94.4	Very high	93.9	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.009	25%	0.248	C	C	.	.	H	α-helix	trans	-70.8	-39.7	176	-62.7	174.2	-34.5	0	0	110.9	L140 D141 A142 I148 G166	L140-Q144 HydrophobicContact CB-CB 4.32Å; L140-Q144 HydrophobicContact CD2-CB 4.33Å; D141-Q144 HydrophobicContact CB-CG 4.2Å; D141-Q144 WeakPolarHBondContact O-CB 3.43Å; D141-Q144 PolarHBondContact O-N 3.29Å; A142-Q144 VanDerWaalsContact C-N 3.25Å; A142-Q144 PolarHBondContact O-N 3.15Å; Q144-I148 VanDerWaalsContact O-CB 3.25Å; Q144-I148 WeakPolarHBondContact O-CB 3.43Å; Q144-I148 VanDerWaalsContact O-CG1 3.26Å; Q144-I148 WeakPolarHBondContact O-CG1 3.48Å; Q144-I148 PolarHBondContact O-N 2.76Å; Q144-G166 PolarHBondContact NE2-O 3.08Å
145	R	93.5	Very high	94	Very high	107 Å²	107	50.2 Å²	50.2	40%	0.404	25%	0.251	S	S	.	.	H	α-helix	trans	-62.7	-46.5	176.3	-70.8	-178.9	-94.6	131.3	-6.7	111.6	E108 L140 D141 A142 I148 Q149	E108-R145 IonicContact OE2-CZ 3.63Å; E108-R145 IonicContact OE2-NH1 3.64Å; E108-R145 IonicContact OE2-NH2 2.72Å; E108-R145 PolarHBondContact OE2-NH2 3.35Å; L140-R145 HydrophobicContact CB-CG 3.74Å; L140-R145 HydrophobicContact CD1-CG 4.46Å; L140-R145 PolarHBondContact O-NE 3.15Å; D141-R145 PolarHBondContact O-N 3.02Å; D141-R145 VanDerWaalsContact O-N 3.12Å; A142-R145 WeakPolarHBondContact O-CB 3.21Å; A142-R145 PolarHBondContact O-N 2.99Å; A142-R145 VanDerWaalsContact O-N 3.1Å; R145-I148 PolarHBondContact O-N 3.01Å; R145-Q149 PolarHBondContact O-N 3.21Å
146	E	94.5	Very high	94.2	Very high	37 Å²	37	43.5 Å²	43.5	17%	0.173	22%	0.22	C	C	.	.	H	α-helix	trans	-60.6	-51.1	176.7	-65.5	-63.9	128.4	0	0	111.7	T106 H112 A142 I148 Q149 C150 I307	T106-E146 HydrophobicContact CG2-CG 3.85Å; T106-E146 WeakPolarHBondContact CG2-OE2 3.28Å; H112-E146 IonicContact CE1-OE2 3.84Å; H112-E146 IonicContact CG-OE2 3.74Å; H112-E146 IonicContact ND1-OE2 2.7Å; H112-E146 PolarHBondContact ND1-OE2 2.96Å; A142-E146 WeakPolarHBondContact O-CG 3.27Å; A142-E146 PolarHBondContact O-N 3.49Å; E146-I148 VanDerWaalsContact C-N 3.34Å; E146-I148 PolarHBondContact O-N 3.08Å; E146-Q149 WeakPolarHBondContact O-CB 3.44Å; E146-Q149 PolarHBondContact O-N 2.67Å; E146-C150 PolarHBondContact O-N 2.88Å; E146-C150 VanDerWaalsContact O-N 3.12Å; E146-C150 PolarHBondContact O-SG 3.34Å; E146-C150 VanDerWaalsContact O-SG 3.36Å; E146-I307 HydrophobicContact CB-CD1 3.8Å; E146-I307 HydrophobicContact CB-CG1 4.42Å
147	A	96.1	Very high	94.5	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-62.2	-39.5	179.9	0	0	0	0	0	112.7	F143 Q149 C150 V151 V157 V159 C170 I307	F143-A147 WeakPolarHBondContact O-CB 3.26Å; F143-A147 PolarHBondContact O-N 3.09Å; F143-A147 VanDerWaalsContact O-N 3.08Å; A147-Q149 VanDerWaalsContact C-N 3.32Å; A147-Q149 PolarHBondContact O-N 3.4Å; A147-C150 WeakPolarHBondContact O-CB 3.35Å; A147-C150 PolarHBondContact O-N 2.78Å; A147-V151 WeakPolarHBondContact O-CG2 3.36Å; A147-V151 PolarHBondContact O-N 2.96Å; A147-V157 HydrophobicContact CB-CG2 4.31Å; A147-V159 HydrophobicContact CB-CG2 3.7Å; A147-C170 HydrophobicContact CB-CB 4.44Å; A147-I307 HydrophobicContact CB-CG1 4.14Å
148	I	96.4	Very high	94.8	Very high	6 Å²	6	35.5 Å²	35.5	3%	0.031	17%	0.173	C	C	.	.	H	α-helix	trans	-64.5	-35.7	173.9	-77.2	170.1	0	0	0	111.3	Y136 L140 Q144 R145 E146 V151 D152 V169 Y173	Y136-I148 HydrophobicContact CE2-CD1 4.46Å; L140-I148 HydrophobicContact CD1-CD1 3.89Å; Q144-I148 VanDerWaalsContact O-CB 3.25Å; Q144-I148 WeakPolarHBondContact O-CB 3.43Å; Q144-I148 VanDerWaalsContact O-CG1 3.26Å; Q144-I148 WeakPolarHBondContact O-CG1 3.48Å; Q144-I148 PolarHBondContact O-N 2.76Å; R145-I148 PolarHBondContact O-N 3.01Å; E146-I148 VanDerWaalsContact C-N 3.34Å; E146-I148 PolarHBondContact O-N 3.08Å; I148-V151 PolarHBondContact O-N 3.39Å; I148-D152 WeakPolarHBondContact O-CB 3.19Å; I148-D152 PolarHBondContact O-N 2.92Å; I148-V169 HydrophobicContact CD1-CG1 4.2Å; I148-Y173 HydrophobicContact CB-CD1 4.43Å; I148-Y173 HydrophobicContact CB-CG 4.49Å; I148-Y173 HydrophobicContact CD1-CD2 4.06Å; I148-Y173 HydrophobicContact CD1-CG 4.1Å; I148-Y173 HydrophobicContact CG1-CD1 4.16Å; I148-Y173 HydrophobicContact CG1-CD2 4.22Å; I148-Y173 HydrophobicContact CG1-CG 3.82Å; I148-Y173 HydrophobicContact CG2-CD1 3.87Å; I148-Y173 HydrophobicContact CG2-CD2 4.03Å; I148-Y173 HydrophobicContact CG2-CE1 3.71Å; I148-Y173 HydrophobicContact CG2-CE2 3.86Å; I148-Y173 HydrophobicContact CG2-CG 4.03Å
149	Q	95.4	Very high	95.1	Very high	54 Å²	54	30.7 Å²	30.7	25%	0.252	15%	0.152	S	C	.	.	H	α-helix	trans	-67.5	-34.9	176.3	-170.8	172.5	-15.4	0	0	112.4	L125 K126 R145 E146 A147 D152 N153	L125-Q149 HydrophobicContact CB-CG 4.12Å; L125-Q149 HydrophobicContact CD1-CG 4.45Å; L125-Q149 PolarHBondContact O-NE2 2.99Å; K126-Q149 PolarHBondContact O-NE2 3.48Å; R145-Q149 PolarHBondContact O-N 3.21Å; E146-Q149 WeakPolarHBondContact O-CB 3.44Å; E146-Q149 PolarHBondContact O-N 2.67Å; A147-Q149 VanDerWaalsContact C-N 3.32Å; A147-Q149 PolarHBondContact O-N 3.4Å; Q149-D152 PolarHBondContact O-N 3.5Å; Q149-N153 PolarHBondContact O-N 3.35Å; Q149-N153 PolarHBondContact O-ND2 2.79Å
150	C	96.3	Very high	95.3	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-61.3	-44.6	170.8	-55.8	0	0	0	0	111.5	E146 A147 N153 N154 Q155 V157 H305	E146-C150 PolarHBondContact O-N 2.88Å; E146-C150 VanDerWaalsContact O-N 3.12Å; E146-C150 PolarHBondContact O-SG 3.34Å; E146-C150 VanDerWaalsContact O-SG 3.36Å; A147-C150 WeakPolarHBondContact O-CB 3.35Å; A147-C150 PolarHBondContact O-N 2.78Å; C150-N153 CarbonylContact O-C 3.6Å; C150-N153 PolarHBondContact O-N 3.41Å; C150-N153 VanDerWaalsContact O-N 3.11Å; C150-N154 PolarHBondContact O-N 3.02Å; C150-Q155 PolarHBondContact O-N 2.74Å; C150-V157 HydrophobicContact CB-CB 4.07Å; C150-V157 HydrophobicContact CB-CG1 4.43Å; C150-V157 HydrophobicContact CB-CG2 4.4Å; C150-H305 VanDerWaalsContact SG-CG 3.56Å; C150-H305 PolarHBondContact SG-ND1 2.82Å
151	V	96.6	Very high	95.3	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-65.7	-43.1	177.7	174.5	0	0	0	0	111.7	A147 I148 N153 N154 V157 Y173 A174 L177 W248 V280	A147-V151 WeakPolarHBondContact O-CG2 3.36Å; A147-V151 PolarHBondContact O-N 2.96Å; I148-V151 PolarHBondContact O-N 3.39Å; V151-N153 PolarHBondContact O-N 3.07Å; V151-N153 VanDerWaalsContact O-N 3.13Å; V151-N154 PolarHBondContact O-N 2.8Å; V151-V157 HydrophobicContact CG2-CG1 3.99Å; V151-Y173 HydrophobicContact CB-CD1 4.39Å; V151-Y173 HydrophobicContact CG1-CD1 3.92Å; V151-Y173 HydrophobicContact CG1-CE1 4.39Å; V151-A174 HydrophobicContact CG1-CB 4Å; V151-L177 HydrophobicContact CG1-CD2 3.61Å; V151-L177 WeakPolarHBondContact O-CD2 3.2Å; V151-W248 HydrophobicContact CB-CH2 4.26Å; V151-W248 HydrophobicContact CG1-CH2 4.1Å; V151-W248 HydrophobicContact CG1-CZ2 4.06Å; V151-W248 HydrophobicContact CG2-CH2 4.11Å; V151-W248 HydrophobicContact CG2-CZ3 4.28Å; V151-V280 HydrophobicContact CG2-CG2 4.02Å
152	D	95.7	Very high	95.1	Very high	34 Å²	34	21.5 Å²	21.5	18%	0.182	10%	0.103	C	C	.	.	H	α-helix	trans	-60.6	-17.5	171.9	-85.3	-36.4	0	0	0	113.5	R128 I148 Q149 Y173	R128-D152 HydrophobicContact CB-CB 4.5Å; R128-D152 VanDerWaalsContact CD-OD2 3.28Å; R128-D152 WeakPolarHBondContact CD-OD2 3.5Å; R128-D152 IonicContact CZ-OD2 3.71Å; R128-D152 IonicContact NE-OD2 3.89Å; R128-D152 IonicContact NH1-OD2 2.79Å; R128-D152 PolarHBondContact NH1-OD2 3.19Å; I148-D152 WeakPolarHBondContact O-CB 3.19Å; I148-D152 PolarHBondContact O-N 2.92Å; Q149-D152 PolarHBondContact O-N 3.5Å; D152-Y173 VanDerWaalsContact OD1-CE1 3.3Å; D152-Y173 WeakPolarHBondContact OD1-CE1 3.28Å; D152-Y173 PolarHBondContact OD1-OH 3.14Å; D152-Y173 PolarHBondContact OD2-OH 2.92Å; D152-Y173 VanDerWaalsContact OD2-OH 3.1Å
153	N	95.1	Very high	94.6	Very high	37 Å²	37	23.1 Å²	23.1	20%	0.198	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	3.5	176.5	-81.3	-98	0	0	0	113.8	L125 K126 Q149 C150 V151 Q155	L125-N153 HydrophobicContact CD2-CB 3.61Å; K126-N153 WeakPolarHBondContact CB-OD1 3.27Å; K126-N153 PolarHBondContact N-OD1 3.36Å; K126-N153 PolarHBondContact O-ND2 3.03Å; Q149-N153 PolarHBondContact O-N 3.35Å; Q149-N153 PolarHBondContact O-ND2 2.79Å; C150-N153 CarbonylContact O-C 3.6Å; C150-N153 PolarHBondContact O-N 3.41Å; C150-N153 VanDerWaalsContact O-N 3.11Å; V151-N153 PolarHBondContact O-N 3.07Å; V151-N153 VanDerWaalsContact O-N 3.13Å; N153-Q155 HydrophobicContact CB-CG 4.48Å
154	N	95.7	Very high	93.9	Very high	86 Å²	86	24.1 Å²	24.1	46%	0.46	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	55	47.3	-172.2	-64.1	-16.1	0	0	0	113.2	C150 V151 H278	C150-N154 PolarHBondContact O-N 3.02Å; V151-N154 PolarHBondContact O-N 2.8Å; N154-H278 PolarHBondContact O-CE1 3.41Å
155	Q	96.6	Very high	93.3	Very high	42 Å²	42	24 Å²	24	20%	0.196	12%	0.119	C	C	.	.			trans	-122	137.6	174.7	-63.9	-178.6	-62.6	0	0	110.5	C150 N153 P303 H305	C150-Q155 PolarHBondContact O-N 2.74Å; N153-Q155 HydrophobicContact CB-CG 4.48Å; Q155-P303 HydrophobicContact CG-CB 4.43Å; Q155-H305 PolarHBondContact OE1-NE2 2.7Å
156	S	98.3	Very high	92.9	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	145.1	-176.5	-72	0	0	0	0	111.6	Y279 Q302 P303 C304 H305	S156-Y279 CarbonylContact C-O 3.49Å; S156-Y279 VanDerWaalsContact CA-O 3.32Å; S156-Y279 WeakPolarHBondContact CA-O 3.46Å; S156-Y279 WeakPolarHBondContact OG-CD2 3.36Å; S156-Y279 PolarHBondContact OG-N 3.15Å; S156-Q302 PolarHBondContact OG-OE1 2.99Å; S156-P303 PolarHBondContact N-O 2.88Å; S156-C304 WeakPolarHBondContact O-CA 3.23Å; S156-H305 PolarHBondContact O-CD2 3.11Å; S156-H305 PolarHBondContact O-N 3.44Å
157	V	98.3	Very high	92.7	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	133.3	-174.1	61.3	0	0	0	0	113.8	A147 C150 V151 V159 Y279 V280 F281 H305 I307	A147-V157 HydrophobicContact CB-CG2 4.31Å; C150-V157 HydrophobicContact CB-CB 4.07Å; C150-V157 HydrophobicContact CB-CG1 4.43Å; C150-V157 HydrophobicContact CB-CG2 4.4Å; V151-V157 HydrophobicContact CG2-CG1 3.99Å; V157-V159 HydrophobicContact CG2-CG2 4.17Å; V157-Y279 PolarHBondContact N-O 2.69Å; V157-V280 HydrophobicContact CG1-CG1 4.41Å; V157-V280 HydrophobicContact CG1-CG2 4.19Å; V157-V280 WeakPolarHBondContact O-CA 3.37Å; V157-F281 PolarHBondContact O-N 3.01Å; V157-H305 HydrophobicContact CB-CB 4.21Å; V157-H305 HydrophobicContact CG2-CB 4.04Å; V157-I307 HydrophobicContact CG2-CG1 3.74Å
158	L	98.3	Very high	92.5	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	119.4	165.8	170.6	64.6	0	0	0	109.6	I254 F281 A289 F292 H305 V306 I307	L158-I254 HydrophobicContact CD1-CG2 4.16Å; L158-F281 WeakPolarHBondContact CA-O 3.46Å; L158-F281 HydrophobicContact CB-CB 4.35Å; L158-F281 HydrophobicContact CD1-CB 3.7Å; L158-A289 HydrophobicContact CD2-CB 3.81Å; L158-A289 WeakPolarHBondContact CD2-O 3.49Å; L158-F292 HydrophobicContact CD2-CB 4.43Å; L158-F292 HydrophobicContact CD2-CD1 4Å; L158-H305 PolarHBondContact N-O 2.87Å; L158-V306 HydrophobicContact CD2-CG2 4.36Å; L158-I307 PolarHBondContact O-N 3.31Å
159	V	97.5	Very high	92.3	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	103.7	173.3	-175.9	0	0	0	0	108.9	F143 A147 V157 K167 C170 F281 L282 S283	F143-V159 HydrophobicContact CD2-CG1 3.89Å; F143-V159 HydrophobicContact CE2-CG1 3.92Å; A147-V159 HydrophobicContact CB-CG2 3.7Å; V157-V159 HydrophobicContact CG2-CG2 4.17Å; V159-K167 HydrophobicContact CG1-CG 4.37Å; V159-C170 HydrophobicContact CG2-CB 4.33Å; V159-F281 PolarHBondContact N-O 3.37Å; V159-L282 HydrophobicContact CB-CD2 4.14Å; V159-L282 HydrophobicContact CG2-CD2 4.33Å; V159-S283 PolarHBondContact O-N 2.93Å
160	S	95.6	Very high	92.3	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	99.6	-179.7	-173.7	0	0	0	0	110.1	A284 T285 I286 I307 Y308 T309	S160-A284 PolarHBondContact OG-O 2.81Å; S160-T285 WeakPolarHBondContact OG-CA 3.36Å; S160-I286 WeakPolarHBondContact OG-CG1 3.38Å; S160-I286 PolarHBondContact OG-N 2.99Å; S160-I307 PolarHBondContact N-O 3.36Å; S160-Y308 WeakPolarHBondContact O-CA 3.35Å; S160-Y308 WeakPolarHBondContact OG-CD2 3.41Å; S160-T309 PolarHBondContact O-N 3.16Å; S160-T309 VanDerWaalsContact O-N 3.17Å
161	A	91.8	Very high	92.2	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.102	C	C	.	.			trans	-151.5	163.7	-176.5	0	0	0	0	0	111.1	F143 A165 K167 S283 A284 T309	F143-A161 HydrophobicContact CE2-CB 4.43Å; A161-A165 HydrophobicContact CB-CB 3.91Å; A161-K167 HydrophobicContact CB-CD 4.32Å; A161-K167 HydrophobicContact CB-CG 4.29Å; A161-K167 PolarHBondContact O-NZ 3.06Å; A161-S283 PolarHBondContact N-O 3.11Å; A161-S283 VanDerWaalsContact N-O 3.16Å; A161-A284 CarbonylContact O-C 3.56Å; A161-A284 WeakPolarHBondContact O-CA 3.23Å; A161-T309 HydrophobicContact CB-CG2 4.06Å
162	H	86.7	Confident	92.2	Very high	29 Å²	29	19.2 Å²	19.2	13%	0.134	11%	0.11	C	C	.	.			trans	-59.4	149.7	174.9	-66.2	-34.3	0	0	0	112.4	S164 A165 T285 R312	H162-S164 VanDerWaalsContact C-N 3.26Å; H162-S164 PolarHBondContact O-N 3.18Å; H162-A165 WeakPolarHBondContact O-CB 3.34Å; H162-A165 PolarHBondContact O-N 2.78Å; H162-T285 PolarHBondContact ND1-OG1 3.31Å; H162-R312 PolarHBondContact CD2-NE 3.13Å; H162-R312 VanDerWaalsContact CD2-NE 3.33Å; H162-R312 PolarHBondContact CD2-NH2 3.06Å; H162-R312 VanDerWaalsContact CD2-NH2 3.29Å; H162-R312 VanDerWaalsContact CG-NH2 3.29Å; H162-R312 PolarHBondContact NE2-NH2 2.76Å
163	T	80.3	Confident	92.2	Very high	46 Å²	46	17.7 Å²	17.7	28%	0.282	10%	0.101	S	C	.	.	G	3₁₀ helix	trans	-57.4	-35.6	-177.1	-50.8	0	0	0	0	113.1	A165 E253	T163-A165 VanDerWaalsContact C-N 3.32Å; T163-A165 PolarHBondContact O-N 3.36Å; T163-E253 PolarHBondContact OG1-OE1 3.41Å
164	S	78	Confident	92.3	Very high	26 Å²	26	16 Å²	16	18%	0.182	9%	0.092	C	C	.	.	G	3₁₀ helix	trans	-80.6	-0.3	175.8	54.1	0	0	0	0	115.3	H162 G166	H162-S164 VanDerWaalsContact C-N 3.26Å; H162-S164 PolarHBondContact O-N 3.18Å; S164-G166 VanDerWaalsContact C-N 3.25Å; S164-G166 PolarHBondContact O-N 3.39Å
165	A	83.3	Confident	92.3	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	7%	0.07	C	C	.	.	G	3₁₀ helix	trans	-69.7	-20.4	177.6	0	0	0	0	0	113.1	F143 A161 H162 T163 R527	F143-A165 HydrophobicContact CE1-CB 4.18Å; F143-A165 HydrophobicContact CZ-CB 3.87Å; F143-A165 WeakPolarHBondContact CZ-O 3.49Å; A161-A165 HydrophobicContact CB-CB 3.91Å; H162-A165 WeakPolarHBondContact O-CB 3.34Å; H162-A165 PolarHBondContact O-N 2.78Å; T163-A165 VanDerWaalsContact C-N 3.32Å; T163-A165 PolarHBondContact O-N 3.36Å; A165-R527 PolarHBondContact O-NH1 2.83Å
166	G	85.6	Confident	92.3	Very high	22 Å²	22	10.3 Å²	10.3	23%	0.227	7%	0.065	C	C	.	.			trans	92.6	45.6	-178.8	0	0	0	0	0	113.6	Q144 S164 T168	Q144-G166 PolarHBondContact NE2-O 3.08Å; S164-G166 VanDerWaalsContact C-N 3.25Å; S164-G166 PolarHBondContact O-N 3.39Å; G166-T168 VanDerWaalsContact C-N 3.28Å; G166-T168 PolarHBondContact O-N 3.12Å
167	K	90.4	Very high	92.2	Very high	7 Å²	7	10.6 Å²	10.6	3%	0.03	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-32.3	178.4	-58.7	-164.9	-58.8	-115.7	0	113.5	V159 A161 V169 C170 E253 L282 S283	V159-K167 HydrophobicContact CG1-CG 4.37Å; A161-K167 HydrophobicContact CB-CD 4.32Å; A161-K167 HydrophobicContact CB-CG 4.29Å; A161-K167 PolarHBondContact O-NZ 3.06Å; K167-V169 PolarHBondContact O-N 3.32Å; K167-V169 VanDerWaalsContact O-N 3.17Å; K167-C170 WeakPolarHBondContact O-CB 3.36Å; K167-C170 PolarHBondContact O-N 2.83Å; K167-E253 IonicContact NZ-OE1 3.47Å; K167-E253 IonicContact NZ-OE2 2.8Å; K167-E253 PolarHBondContact NZ-OE2 3.27Å; K167-L282 HydrophobicContact CB-CB 4.38Å; K167-L282 HydrophobicContact CB-CD1 4.11Å; K167-L282 HydrophobicContact CB-CD2 4.25Å; K167-L282 HydrophobicContact CB-CG 4.49Å; K167-L282 HydrophobicContact CD-CB 4.33Å; K167-S283 WeakPolarHBondContact CD-O 3.29Å; K167-S283 WeakPolarHBondContact CE-O 3.37Å; K167-S283 PolarHBondContact NZ-O 3.2Å
168	T	89.8	Confident	92	Very high	31 Å²	31	10.6 Å²	10.6	19%	0.19	7%	0.066	C	C	.	.	H	α-helix	trans	-56.2	-33.2	-175.2	-42.1	0	0	0	0	113.1	G166 C170 A171 E172 M202	G166-T168 VanDerWaalsContact C-N 3.28Å; G166-T168 PolarHBondContact O-N 3.12Å; T168-C170 PolarHBondContact O-N 3.48Å; T168-C170 VanDerWaalsContact O-N 3.12Å; T168-A171 WeakPolarHBondContact O-CA 3.33Å; T168-A171 WeakPolarHBondContact O-CB 3.03Å; T168-A171 PolarHBondContact O-N 2.86Å; T168-E172 HydrophobicContact CG2-CG 4.35Å; T168-E172 WeakPolarHBondContact CG2-OE1 3.5Å; T168-E172 WeakPolarHBondContact O-CG 3.32Å; T168-E172 PolarHBondContact O-N 3.43Å; T168-M202 HydrophobicContact CG2-CE 3.77Å
169	V	93.3	Very high	91.9	Very high	8 Å²	8	12.8 Å²	12.8	5%	0.048	8%	0.077	C	C	.	.	H	α-helix	trans	-51.1	-36.2	173.5	172.6	0	0	0	0	113	Y136 F138 L140 I148 K167 E172 Y173	Y136-V169 HydrophobicContact CD1-CG1 4.35Å; Y136-V169 HydrophobicContact CE1-CB 4.41Å; Y136-V169 HydrophobicContact CE1-CG1 3.88Å; Y136-V169 HydrophobicContact CE1-CG2 4.31Å; Y136-V169 HydrophobicContact CE2-CG1 4.06Å; Y136-V169 PolarHBondContact OH-O 3.15Å; F138-V169 HydrophobicContact CE2-CG2 4.12Å; F138-V169 HydrophobicContact CZ-CG2 3.84Å; L140-V169 HydrophobicContact CD2-CG1 3.64Å; I148-V169 HydrophobicContact CD1-CG1 4.2Å; K167-V169 PolarHBondContact O-N 3.32Å; K167-V169 VanDerWaalsContact O-N 3.17Å; V169-E172 PolarHBondContact N-OE1 3.5Å; V169-Y173 WeakPolarHBondContact O-CB 3.38Å; V169-Y173 PolarHBondContact O-N 3.49Å; V169-Y173 VanDerWaalsContact O-N 3.11Å
170	C	94.8	Very high	91.7	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.007	10%	0.098	C	C	.	.	H	α-helix	trans	-73	-34.6	179.1	-54.4	0	0	0	0	111.7	A147 V159 K167 T168 A174 L282	A147-C170 HydrophobicContact CB-CB 4.44Å; V159-C170 HydrophobicContact CG2-CB 4.33Å; K167-C170 WeakPolarHBondContact O-CB 3.36Å; K167-C170 PolarHBondContact O-N 2.83Å; T168-C170 PolarHBondContact O-N 3.48Å; T168-C170 VanDerWaalsContact O-N 3.12Å; C170-A174 PolarHBondContact O-N 3.24Å; C170-L282 HydrophobicContact CB-CD2 4.35Å
171	A	94.9	Very high	91.6	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-72.9	-44.9	174.8	0	0	0	0	0	112	T168 Y173 A174 I175 F187 I250 L282	T168-A171 WeakPolarHBondContact O-CA 3.33Å; T168-A171 WeakPolarHBondContact O-CB 3.03Å; T168-A171 PolarHBondContact O-N 2.86Å; A171-Y173 VanDerWaalsContact C-N 3.25Å; A171-Y173 PolarHBondContact O-N 3.21Å; A171-A174 PolarHBondContact O-N 2.98Å; A171-A174 VanDerWaalsContact O-N 3.14Å; A171-I175 WeakPolarHBondContact O-CG1 3.46Å; A171-I175 PolarHBondContact O-N 2.95Å; A171-F187 HydrophobicContact CB-CD2 4.38Å; A171-F187 HydrophobicContact CB-CE2 4Å; A171-I250 HydrophobicContact CB-CD1 3.97Å; A171-I250 HydrophobicContact CB-CG2 3.72Å; A171-L282 HydrophobicContact CB-CD1 4.03Å
172	E	95.8	Very high	91.7	Very high	35 Å²	35	32.1 Å²	32.1	16%	0.164	16%	0.16	C	C	.	.	H	α-helix	trans	-56.9	-39.4	174.6	-69	162.5	-128	0	0	111.7	K134 Y136 T168 V169 I175 A176 M202 F206	K134-E172 HydrophobicContact CD-CB 4.11Å; K134-E172 VanDerWaalsContact CE-OE2 3.27Å; K134-E172 WeakPolarHBondContact CE-OE2 3.34Å; Y136-E172 WeakPolarHBondContact CE1-OE2 3.37Å; T168-E172 HydrophobicContact CG2-CG 4.35Å; T168-E172 WeakPolarHBondContact CG2-OE1 3.5Å; T168-E172 WeakPolarHBondContact O-CG 3.32Å; T168-E172 PolarHBondContact O-N 3.43Å; V169-E172 PolarHBondContact N-OE1 3.5Å; E172-I175 PolarHBondContact O-N 2.9Å; E172-A176 WeakPolarHBondContact O-CB 3.49Å; E172-A176 PolarHBondContact O-N 2.58Å; E172-M202 HydrophobicContact CG-CE 3.94Å; E172-M202 HydrophobicContact CG-SD 4.22Å; E172-F206 HydrophobicContact CB-CZ 4.33Å; E172-F206 WeakPolarHBondContact O-CZ 3.42Å
173	Y	96.8	Very high	92.1	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.008	17%	0.171	C	C	.	.	H	α-helix	trans	-66.8	-41.2	176	-164.7	-88.9	0	0	0	112.6	R128 A132 A133 K134 Y136 I148 V151 D152 V169 A171 A176 L177	R128-Y173 PolarHBondContact NH1-OH 3.41Å; A132-Y173 HydrophobicContact CB-CE2 4.15Å; A133-Y173 HydrophobicContact CB-CD1 4.47Å; A133-Y173 HydrophobicContact CB-CD2 4.38Å; A133-Y173 HydrophobicContact CB-CE1 3.98Å; A133-Y173 HydrophobicContact CB-CE2 3.89Å; A133-Y173 PolarHBondContact N-OH 3.28Å; K134-Y173 HydrophobicContact CB-CD2 4.3Å; Y136-Y173 HydrophobicContact CE2-CD2 4.31Å; Y136-Y173 PolarHBondContact OH-N 2.83Å; I148-Y173 HydrophobicContact CB-CD1 4.43Å; I148-Y173 HydrophobicContact CB-CG 4.49Å; I148-Y173 HydrophobicContact CD1-CD2 4.06Å; I148-Y173 HydrophobicContact CD1-CG 4.1Å; I148-Y173 HydrophobicContact CG1-CD1 4.16Å; I148-Y173 HydrophobicContact CG1-CD2 4.22Å; I148-Y173 HydrophobicContact CG1-CG 3.82Å; I148-Y173 HydrophobicContact CG2-CD1 3.87Å; I148-Y173 HydrophobicContact CG2-CD2 4.03Å; I148-Y173 HydrophobicContact CG2-CE1 3.71Å; I148-Y173 HydrophobicContact CG2-CE2 3.86Å; I148-Y173 HydrophobicContact CG2-CG 4.03Å; V151-Y173 HydrophobicContact CB-CD1 4.39Å; V151-Y173 HydrophobicContact CG1-CD1 3.92Å; V151-Y173 HydrophobicContact CG1-CE1 4.39Å; D152-Y173 VanDerWaalsContact OD1-CE1 3.3Å; D152-Y173 WeakPolarHBondContact OD1-CE1 3.28Å; D152-Y173 PolarHBondContact OD1-OH 3.14Å; D152-Y173 PolarHBondContact OD2-OH 2.92Å; D152-Y173 VanDerWaalsContact OD2-OH 3.1Å; V169-Y173 WeakPolarHBondContact O-CB 3.38Å; V169-Y173 PolarHBondContact O-N 3.49Å; V169-Y173 VanDerWaalsContact O-N 3.11Å; A171-Y173 VanDerWaalsContact C-N 3.25Å; A171-Y173 PolarHBondContact O-N 3.21Å; Y173-A176 PolarHBondContact O-N 3.45Å; Y173-L177 WeakPolarHBondContact O-CB 3.21Å; Y173-L177 PolarHBondContact O-N 3.08Å
174	A	96.7	Very high	92.8	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-66.3	-37.6	176	0	0	0	0	0	112.4	V151 C170 A171 L177 A178 I250 V280	V151-A174 HydrophobicContact CG1-CB 4Å; C170-A174 PolarHBondContact O-N 3.24Å; A171-A174 PolarHBondContact O-N 2.98Å; A171-A174 VanDerWaalsContact O-N 3.14Å; A174-L177 PolarHBondContact O-N 3.07Å; A174-A178 WeakPolarHBondContact O-CB 3.34Å; A174-A178 PolarHBondContact O-N 3.48Å; A174-I250 HydrophobicContact CB-CD1 4.2Å; A174-V280 HydrophobicContact CB-CG2 3.91Å
175	I	96.6	Very high	93.8	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-61.6	-52.2	171.7	-67.7	164.6	0	0	0	109.9	A171 E172 L177 A178 L179 V185 F187 M202 F206 C224 I250	A171-I175 WeakPolarHBondContact O-CG1 3.46Å; A171-I175 PolarHBondContact O-N 2.95Å; E172-I175 PolarHBondContact O-N 2.9Å; I175-L177 VanDerWaalsContact C-N 3.27Å; I175-L177 PolarHBondContact O-N 2.99Å; I175-A178 PolarHBondContact O-N 3.33Å; I175-L179 HydrophobicContact CG2-CD1 3.75Å; I175-L179 HydrophobicContact CG2-CG 4.24Å; I175-L179 WeakPolarHBondContact O-CB 3.18Å; I175-L179 VanDerWaalsContact O-CG 3.27Å; I175-L179 WeakPolarHBondContact O-CG 3.45Å; I175-L179 PolarHBondContact O-N 3.47Å; I175-V185 HydrophobicContact CB-CG1 4.31Å; I175-V185 HydrophobicContact CG1-CG1 4.05Å; I175-V185 HydrophobicContact CG1-CG2 3.94Å; I175-V185 HydrophobicContact CG2-CG1 4.12Å; I175-F187 HydrophobicContact CD1-CD2 4.46Å; I175-M202 HydrophobicContact CD1-CG 4.38Å; I175-M202 HydrophobicContact CD1-SD 3.63Å; I175-F206 HydrophobicContact CB-CE2 4.06Å; I175-F206 HydrophobicContact CB-CZ 4.09Å; I175-F206 HydrophobicContact CD1-CE2 4.34Å; I175-F206 HydrophobicContact CG2-CD1 4.11Å; I175-F206 HydrophobicContact CG2-CD2 3.69Å; I175-F206 HydrophobicContact CG2-CE1 4.04Å; I175-F206 HydrophobicContact CG2-CE2 3.61Å; I175-F206 HydrophobicContact CG2-CG 3.95Å; I175-F206 HydrophobicContact CG2-CZ 3.8Å; I175-C224 HydrophobicContact CG2-CB 4.32Å; I175-I250 HydrophobicContact CD1-CD1 4.08Å; I175-I250 HydrophobicContact CG1-CD1 3.66Å
176	A	96.1	Very high	94.5	Very high	10 Å²	10	33 Å²	33	8%	0.083	16%	0.156	C	C	.	.	H	α-helix	trans	-58.7	-37.4	178.7	0	0	0	0	0	112.8	A133 K134 E172 Y173 R180 F206	A133-A176 HydrophobicContact CB-CB 4.04Å; K134-A176 HydrophobicContact CB-CB 3.71Å; E172-A176 WeakPolarHBondContact O-CB 3.49Å; E172-A176 PolarHBondContact O-N 2.58Å; Y173-A176 PolarHBondContact O-N 3.45Å; A176-R180 VanDerWaalsContact O-CB 3.28Å; A176-R180 WeakPolarHBondContact O-CB 3.48Å; A176-R180 PolarHBondContact O-N 2.89Å; A176-F206 HydrophobicContact CB-CE1 3.94Å; A176-F206 HydrophobicContact CB-CZ 4.37Å
177	L	95.4	Very high	95	Very high	6 Å²	6	32 Å²	32	3%	0.031	15%	0.145	C	C	.	.	H	α-helix	trans	-65.4	-51.8	175.8	178.9	61.1	0	0	0	111.3	A133 V151 Y173 A174 I175 L179 R180 E181 W248	A133-L177 HydrophobicContact CB-CB 4.01Å; A133-L177 HydrophobicContact CB-CD1 4.49Å; V151-L177 HydrophobicContact CG1-CD2 3.61Å; V151-L177 WeakPolarHBondContact O-CD2 3.2Å; Y173-L177 WeakPolarHBondContact O-CB 3.21Å; Y173-L177 PolarHBondContact O-N 3.08Å; A174-L177 PolarHBondContact O-N 3.07Å; I175-L177 VanDerWaalsContact C-N 3.27Å; I175-L177 PolarHBondContact O-N 2.99Å; L177-L179 VanDerWaalsContact C-N 3.34Å; L177-L179 PolarHBondContact O-N 3.12Å; L177-R180 WeakPolarHBondContact O-CB 3.41Å; L177-R180 PolarHBondContact O-N 3.11Å; L177-R180 VanDerWaalsContact O-N 3.16Å; L177-E181 HydrophobicContact CD1-CG 4.25Å; L177-E181 PolarHBondContact O-N 3.17Å; L177-W248 HydrophobicContact CD2-CZ2 4.36Å
178	A	95.3	Very high	95.3	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-58.3	-45.7	178.8	0	0	0	0	0	111.8	A174 I175 R180 E181 K182 Q183 V185	A174-A178 WeakPolarHBondContact O-CB 3.34Å; A174-A178 PolarHBondContact O-N 3.48Å; I175-A178 PolarHBondContact O-N 3.33Å; A178-R180 VanDerWaalsContact C-N 3.34Å; A178-R180 PolarHBondContact O-N 2.89Å; A178-E181 CarbonylContact O-C 3.6Å; A178-E181 PolarHBondContact O-N 2.92Å; A178-K182 PolarHBondContact O-N 3.21Å; A178-Q183 CarbonylContact C-O 3.53Å; A178-Q183 HydrophobicContact CB-CB 4.47Å; A178-Q183 PolarHBondContact O-N 3.3Å; A178-V185 HydrophobicContact CB-CB 3.84Å; A178-V185 HydrophobicContact CB-CG1 4.21Å
179	L	94.9	Very high	95.4	Very high	45 Å²	45	30.1 Å²	30.1	24%	0.236	14%	0.135	C	C	.	.	H	α-helix	trans	-61.9	-39.3	176.6	-65.9	177.1	0	0	0	112.3	I175 L177 K182 F206	I175-L179 HydrophobicContact CG2-CD1 3.75Å; I175-L179 HydrophobicContact CG2-CG 4.24Å; I175-L179 WeakPolarHBondContact O-CB 3.18Å; I175-L179 VanDerWaalsContact O-CG 3.27Å; I175-L179 WeakPolarHBondContact O-CG 3.45Å; I175-L179 PolarHBondContact O-N 3.47Å; L177-L179 VanDerWaalsContact C-N 3.34Å; L177-L179 PolarHBondContact O-N 3.12Å; L179-K182 PolarHBondContact O-N 2.97Å; L179-F206 HydrophobicContact CD1-CB 4.07Å; L179-F206 HydrophobicContact CD1-CD1 3.72Å; L179-F206 HydrophobicContact CD1-CE1 4.45Å; L179-F206 HydrophobicContact CD1-CG 4.04Å
180	R	94.2	Very high	95.1	Very high	115 Å²	115	29.8 Å²	29.8	43%	0.434	13%	0.133	S	C	.	.	H	α-helix	trans	-63.2	-42.3	176.7	-169.9	-174.1	76.6	-164	0	112.1	A176 L177 A178 K182	A176-R180 VanDerWaalsContact O-CB 3.28Å; A176-R180 WeakPolarHBondContact O-CB 3.48Å; A176-R180 PolarHBondContact O-N 2.89Å; L177-R180 WeakPolarHBondContact O-CB 3.41Å; L177-R180 PolarHBondContact O-N 3.11Å; L177-R180 VanDerWaalsContact O-N 3.16Å; A178-R180 VanDerWaalsContact C-N 3.34Å; A178-R180 PolarHBondContact O-N 2.89Å; R180-K182 VanDerWaalsContact C-N 3.25Å; R180-K182 PolarHBondContact O-N 3.49Å
181	E	93.3	Very high	94.6	Very high	99 Å²	99	32.2 Å²	32.2	46%	0.463	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	3.1	176.8	-52	-47.1	142.5	0	0	113.4	L177 A178 Q183	L177-E181 HydrophobicContact CD1-CG 4.25Å; L177-E181 PolarHBondContact O-N 3.17Å; A178-E181 CarbonylContact O-C 3.6Å; A178-E181 PolarHBondContact O-N 2.92Å; E181-Q183 VanDerWaalsContact C-N 3.34Å; E181-Q183 HydrophobicContact CB-CG 4.29Å; E181-Q183 PolarHBondContact O-N 3.38Å
182	K	94.1	Very high	94.2	Very high	193 Å²	193	34.8 Å²	34.8	84%	0.839	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.6	35.9	-179.1	-53.5	179.4	-179.5	179	0	114.4	A178 L179 R180	A178-K182 PolarHBondContact O-N 3.21Å; L179-K182 PolarHBondContact O-N 2.97Å; R180-K182 VanDerWaalsContact C-N 3.25Å; R180-K182 PolarHBondContact O-N 3.49Å
183	Q	94.7	Very high	93.4	Very high	77 Å²	77	34.3 Å²	34.3	36%	0.36	16%	0.158	S	C	.	.			trans	-102.4	155.8	174.8	-61	176.6	-46.1	0	0	110.1	A178 E181 A247	A178-Q183 CarbonylContact C-O 3.53Å; A178-Q183 HydrophobicContact CB-CB 4.47Å; A178-Q183 PolarHBondContact O-N 3.3Å; E181-Q183 VanDerWaalsContact C-N 3.34Å; E181-Q183 HydrophobicContact CB-CG 4.29Å; E181-Q183 PolarHBondContact O-N 3.38Å; Q183-A247 HydrophobicContact CB-CB 3.74Å; Q183-A247 HydrophobicContact CG-CB 4.04Å; Q183-A247 VanDerWaalsContact OE1-CB 3.23Å
184	R	95.6	Very high	92.8	Very high	41 Å²	41	34.9 Å²	34.9	16%	0.155	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	150.4	171.1	-77.3	-169.5	156	132.2	-1.2	111.7	T221 A222 S223 E245 V246 A247	R184-T221 VanDerWaalsContact NH2-C 3.26Å; R184-T221 PolarHBondContact NH2-O 2.93Å; R184-A222 PolarHBondContact NE-O 3.38Å; R184-A222 PolarHBondContact NH2-O 3.44Å; R184-S223 WeakPolarHBondContact CA-O 3.37Å; R184-E245 HydrophobicContact CB-CB 4.29Å; R184-E245 HydrophobicContact CG-CB 4.13Å; R184-E245 IonicContact CZ-OE2 3.33Å; R184-E245 PolarHBondContact N-O 2.82Å; R184-E245 IonicContact NE-OE2 3.82Å; R184-E245 IonicContact NH1-OE2 2.71Å; R184-E245 PolarHBondContact NH1-OE2 2.85Å; R184-V246 HydrophobicContact CB-CG2 3.9Å; R184-V246 WeakPolarHBondContact O-CA 3.36Å; R184-A247 PolarHBondContact O-N 3.19Å
185	V	97.5	Very high	92.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	136.7	173.9	58	0	0	0	0	109.8	I175 A178 S223 C224 L225 W248 I250	I175-V185 HydrophobicContact CB-CG1 4.31Å; I175-V185 HydrophobicContact CG1-CG1 4.05Å; I175-V185 HydrophobicContact CG1-CG2 3.94Å; I175-V185 HydrophobicContact CG2-CG1 4.12Å; A178-V185 HydrophobicContact CB-CB 3.84Å; A178-V185 HydrophobicContact CB-CG1 4.21Å; V185-S223 PolarHBondContact N-O 2.95Å; V185-C224 HydrophobicContact CG1-CB 3.79Å; V185-C224 WeakPolarHBondContact O-CA 3.33Å; V185-L225 PolarHBondContact O-N 2.86Å; V185-W248 WeakPolarHBondContact CA-O 3.37Å; V185-W248 HydrophobicContact CB-CB 4.48Å; V185-W248 HydrophobicContact CG2-CB 3.99Å; V185-I250 HydrophobicContact CG2-CD1 3.84Å; V185-I250 HydrophobicContact CG2-CG1 4.23Å
186	I	97.8	Very high	92	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	129.4	174.6	-63.9	-177.4	0	0	0	109	T188 L225 M227 L232 M243 V246 W248 V249 I250	I186-T188 HydrophobicContact CG2-CG2 3.86Å; I186-L225 CarbonylContact C-O 3.49Å; I186-L225 WeakPolarHBondContact CA-O 3.49Å; I186-L225 HydrophobicContact CG1-CB 4.42Å; I186-M227 HydrophobicContact CD1-CE 4.01Å; I186-M227 HydrophobicContact CD1-SD 4.44Å; I186-M227 HydrophobicContact CG1-CE 4.26Å; I186-M227 HydrophobicContact CG2-CE 3.86Å; I186-M227 HydrophobicContact CG2-CG 3.76Å; I186-M227 HydrophobicContact CG2-SD 3.68Å; I186-L232 HydrophobicContact CD1-CD1 3.8Å; I186-L232 HydrophobicContact CG2-CD2 4.38Å; I186-M243 HydrophobicContact CD1-SD 3.77Å; I186-V246 HydrophobicContact CD1-CG1 4.44Å; I186-V246 HydrophobicContact CD1-CG2 3.74Å; I186-V246 HydrophobicContact CG1-CG1 4.29Å; I186-V246 HydrophobicContact CG1-CG2 3.87Å; I186-W248 PolarHBondContact N-O 2.86Å; I186-V249 HydrophobicContact CB-CG2 4.34Å; I186-V249 WeakPolarHBondContact O-CA 3.46Å; I186-I250 PolarHBondContact O-N 2.82Å
187	F	97.6	Very high	91.5	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	112.1	170.7	-174.8	-78.8	0	0	0	109.4	A171 I175 K198 L225 V226 M227 I250 D252	A171-F187 HydrophobicContact CB-CD2 4.38Å; A171-F187 HydrophobicContact CB-CE2 4Å; I175-F187 HydrophobicContact CD1-CD2 4.46Å; F187-K198 HydrophobicContact CD1-CB 4.32Å; F187-K198 HydrophobicContact CE1-CB 3.82Å; F187-K198 HydrophobicContact CE1-CD 4.02Å; F187-K198 HydrophobicContact CE1-CG 3.72Å; F187-K198 HydrophobicContact CZ-CB 4.44Å; F187-K198 HydrophobicContact CZ-CD 3.81Å; F187-K198 HydrophobicContact CZ-CG 4.03Å; F187-L225 PolarHBondContact N-O 3.21Å; F187-V226 HydrophobicContact CB-CG2 4.22Å; F187-V226 HydrophobicContact CD1-CG1 4.25Å; F187-V226 CarbonylContact O-C 3.51Å; F187-V226 WeakPolarHBondContact O-CA 3.28Å; F187-M227 PolarHBondContact O-N 3.37Å; F187-I250 HydrophobicContact CD2-CB 3.97Å; F187-I250 HydrophobicContact CD2-CD1 4.21Å; F187-I250 HydrophobicContact CD2-CG2 3.69Å; F187-I250 HydrophobicContact CE2-CG2 3.86Å; F187-D252 HydrophobicContact CE1-CB 3.98Å; F187-D252 HydrophobicContact CE2-CB 4.34Å; F187-D252 HydrophobicContact CZ-CB 3.58Å
188	T	96.2	Very high	91.2	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	145.9	177.9	63.6	0	0	0	0	111.4	I186 M227 L232 V249 I250 F251 D252	I186-T188 HydrophobicContact CG2-CG2 3.86Å; T188-M227 WeakPolarHBondContact CA-O 3.45Å; T188-M227 HydrophobicContact CG2-CG 4.27Å; T188-L232 HydrophobicContact CG2-CB 4.31Å; T188-L232 HydrophobicContact CG2-CD2 3.57Å; T188-V249 HydrophobicContact CG2-CG1 4.33Å; T188-I250 PolarHBondContact N-O 2.67Å; T188-I250 PolarHBondContact OG1-O 3.29Å; T188-F251 HydrophobicContact CG2-CE1 4.47Å; T188-F251 WeakPolarHBondContact OG1-CA 3.41Å; T188-F251 WeakPolarHBondContact OG1-CD1 3.48Å; T188-D252 PolarHBondContact O-N 3.46Å; T188-D252 VanDerWaalsContact O-N 3.11Å
189	S	91.6	Very high	91.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	148.2	-178	52.6	0	0	0	0	112.1	I191 S195 M227 T228	S189-I191 PolarHBondContact O-N 3.13Å; S189-S195 WeakPolarHBondContact OG-CA 3.5Å; S189-S195 WeakPolarHBondContact OG-CB 3.49Å; S189-S195 PolarHBondContact OG-OG 3.26Å; S189-M227 PolarHBondContact N-O 2.66Å; S189-M227 PolarHBondContact OG-O 3.25Å; S189-T228 WeakPolarHBondContact O-CA 3.49Å
190	P	87.3	Confident	90.7	Very high	1 Å²	1	41 Å²	41	1%	0.006	18%	0.181	C	C	.	.	S	Bend	trans	-71.9	-15.4	-173.3	24.4	-35	0	0	0	116.2	L194 D252 E253 Y256 R262 W266	P190-L194 HydrophobicContact CG-CD2 4.14Å; P190-D252 WeakPolarHBondContact CD-O 3.09Å; P190-E253 HydrophobicContact CG-CB 4.48Å; P190-Y256 HydrophobicContact CB-CD1 3.61Å; P190-Y256 HydrophobicContact CB-CE1 4.01Å; P190-Y256 HydrophobicContact CB-CG 4Å; P190-Y256 HydrophobicContact CG-CD1 4.19Å; P190-Y256 HydrophobicContact CG-CE1 4.26Å; P190-Y256 HydrophobicContact CG-CG 4.36Å; P190-R262 PolarHBondContact O-NH1 3.13Å; P190-R262 PolarHBondContact O-NH2 2.66Å; P190-W266 HydrophobicContact CB-CZ2 3.81Å
191	I	84.9	Confident	90.5	Very high	51 Å²	51	39 Å²	39	26%	0.262	18%	0.177	S	C	.	.	S	Bend	trans	-145	133.9	-170.9	-54.7	179.4	0	0	0	110.1	S189 A193 L194 S195 M487	S189-I191 PolarHBondContact O-N 3.13Å; I191-A193 HydrophobicContact CG2-CB 4.27Å; I191-A193 PolarHBondContact O-N 2.73Å; I191-A193 VanDerWaalsContact O-N 3.08Å; I191-L194 HydrophobicContact CB-CB 4.44Å; I191-L194 WeakPolarHBondContact O-CA 3.5Å; I191-L194 WeakPolarHBondContact O-CB 3.33Å; I191-L194 PolarHBondContact O-N 3.34Å; I191-S195 PolarHBondContact O-N 3.25Å; I191-S195 PolarHBondContact O-OG 2.67Å; I191-S195 VanDerWaalsContact O-OG 3.1Å; I191-M487 VanDerWaalsContact CD1-O 3.3Å; I191-M487 WeakPolarHBondContact CD1-O 3.26Å
192	K	85.1	Confident	90.4	Very high	54 Å²	54	34.4 Å²	34.4	24%	0.235	16%	0.155	C	C	.	.	H	α-helix	trans	-47.4	-40	178.6	-62.2	-178.6	179.3	-179.6	0	112.8	S195 N196 D215 T228 E1002	K192-S195 WeakPolarHBondContact O-CB 3.37Å; K192-S195 PolarHBondContact O-N 3.14Å; K192-N196 VanDerWaalsContact O-CG 3.32Å; K192-N196 PolarHBondContact O-N 2.93Å; K192-N196 PolarHBondContact O-OD1 2.98Å; K192-N196 VanDerWaalsContact O-OD1 3.1Å; K192-D215 WeakPolarHBondContact CD-OD1 3.16Å; K192-D215 WeakPolarHBondContact CE-OD1 3.44Å; K192-D215 IonicContact NZ-OD1 3.53Å; K192-D215 PolarHBondContact NZ-OD1 3.28Å; K192-T228 HydrophobicContact CG-CG2 4Å; K192-E1002 IonicContact NZ-OE1 3.38Å; K192-E1002 PolarHBondContact NZ-OE1 3.2Å; K192-E1002 IonicContact NZ-OE2 3.44Å; K192-E1002 PolarHBondContact NZ-OE2 3.41Å
193	A	80.1	Confident	90.4	Very high	25 Å²	25	30.5 Å²	30.5	21%	0.207	14%	0.136	C	C	.	.	H	α-helix	trans	-65	-41.9	175.9	0	0	0	0	0	113.7	I191 S195 N196 Q197	I191-A193 HydrophobicContact CG2-CB 4.27Å; I191-A193 PolarHBondContact O-N 2.73Å; I191-A193 VanDerWaalsContact O-N 3.08Å; A193-S195 VanDerWaalsContact C-N 3.32Å; A193-N196 PolarHBondContact O-N 2.83Å; A193-Q197 PolarHBondContact O-N 2.79Å
194	L	84.4	Confident	90.2	Very high	15 Å²	15	32.9 Å²	32.9	8%	0.079	15%	0.147	C	C	.	.	H	α-helix	trans	-69.2	-32.8	174.6	-176.1	60.8	0	0	0	111	P190 I191 Q197 K198	P190-L194 HydrophobicContact CG-CD2 4.14Å; I191-L194 HydrophobicContact CB-CB 4.44Å; I191-L194 WeakPolarHBondContact O-CA 3.5Å; I191-L194 WeakPolarHBondContact O-CB 3.33Å; I191-L194 PolarHBondContact O-N 3.34Å; L194-Q197 PolarHBondContact O-N 2.98Å; L194-K198 HydrophobicContact CD1-CG 4.1Å; L194-K198 HydrophobicContact CG-CG 4.29Å; L194-K198 VanDerWaalsContact O-CB 3.3Å; L194-K198 WeakPolarHBondContact O-CB 3.27Å; L194-K198 VanDerWaalsContact O-CG 3.25Å; L194-K198 WeakPolarHBondContact O-CG 3.08Å; L194-K198 PolarHBondContact O-N 3.02Å
195	S	89.6	Confident	90	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-61.1	-43.3	170.5	-42.2	0	0	0	0	111.8	S189 I191 K192 A193 K198 Y199 V226 T228	S189-S195 WeakPolarHBondContact OG-CA 3.5Å; S189-S195 WeakPolarHBondContact OG-CB 3.49Å; S189-S195 PolarHBondContact OG-OG 3.26Å; I191-S195 PolarHBondContact O-N 3.25Å; I191-S195 PolarHBondContact O-OG 2.67Å; I191-S195 VanDerWaalsContact O-OG 3.1Å; K192-S195 WeakPolarHBondContact O-CB 3.37Å; K192-S195 PolarHBondContact O-N 3.14Å; A193-S195 VanDerWaalsContact C-N 3.32Å; S195-K198 PolarHBondContact O-N 3.1Å; S195-Y199 VanDerWaalsContact O-CB 3.27Å; S195-Y199 WeakPolarHBondContact O-CB 3.36Å; S195-Y199 PolarHBondContact O-N 3.13Å; S195-V226 WeakPolarHBondContact O-CG1 3.44Å; S195-T228 WeakPolarHBondContact OG-CG2 3.49Å
196	N	86.6	Confident	89.8	Confident	13 Å²	13	37.2 Å²	37.2	7%	0.07	17%	0.169	C	C	.	.	H	α-helix	trans	-64.9	-46	176.4	-63.2	0.3	0	0	0	111.4	K192 A193 K198 Y199 R200 S1039 Y1041 L1042	K192-N196 VanDerWaalsContact O-CG 3.32Å; K192-N196 PolarHBondContact O-N 2.93Å; K192-N196 PolarHBondContact O-OD1 2.98Å; K192-N196 VanDerWaalsContact O-OD1 3.1Å; A193-N196 PolarHBondContact O-N 2.83Å; N196-K198 PolarHBondContact O-N 3Å; N196-Y199 PolarHBondContact O-N 3.05Å; N196-R200 PolarHBondContact O-N 2.91Å; N196-R200 VanDerWaalsContact O-N 3.14Å; N196-S1039 WeakPolarHBondContact ND2-CB 3.47Å; N196-S1039 PolarHBondContact ND2-OG 2.93Å; N196-S1039 VanDerWaalsContact ND2-OG 3.11Å; N196-Y1041 HydrophobicContact CB-CG 4.42Å; N196-L1042 HydrophobicContact CB-CD2 3.99Å; N196-L1042 HydrophobicContact CB-CG 4.44Å
197	Q	85.3	Confident	89.3	Confident	22 Å²	22	44.1 Å²	44.1	10%	0.103	20%	0.201	C	C	.	.	H	α-helix	trans	-56.2	-50.9	174.1	178.5	-178.8	2.4	0	0	111	A193 L194 R200 E201	A193-Q197 PolarHBondContact O-N 2.79Å; L194-Q197 PolarHBondContact O-N 2.98Å; Q197-R200 PolarHBondContact O-N 2.69Å; Q197-E201 HydrophobicContact CG-CG 4.45Å; Q197-E201 WeakPolarHBondContact CG-OE1 3.38Å; Q197-E201 PolarHBondContact NE2-OE1 2.69Å; Q197-E201 WeakPolarHBondContact O-CG 3.31Å; Q197-E201 PolarHBondContact O-N 3.21Å
198	K	89.6	Confident	89.1	Confident	6 Å²	6	47.1 Å²	47.1	3%	0.026	22%	0.217	C	C	.	.	H	α-helix	trans	-69.4	-33.3	-176.9	-70.3	-73.2	168.8	-155.6	0	112.9	F187 L194 S195 N196 E201 M202 V226	F187-K198 HydrophobicContact CD1-CB 4.32Å; F187-K198 HydrophobicContact CE1-CB 3.82Å; F187-K198 HydrophobicContact CE1-CD 4.02Å; F187-K198 HydrophobicContact CE1-CG 3.72Å; F187-K198 HydrophobicContact CZ-CB 4.44Å; F187-K198 HydrophobicContact CZ-CD 3.81Å; F187-K198 HydrophobicContact CZ-CG 4.03Å; L194-K198 HydrophobicContact CD1-CG 4.1Å; L194-K198 HydrophobicContact CG-CG 4.29Å; L194-K198 VanDerWaalsContact O-CB 3.3Å; L194-K198 WeakPolarHBondContact O-CB 3.27Å; L194-K198 VanDerWaalsContact O-CG 3.25Å; L194-K198 WeakPolarHBondContact O-CG 3.08Å; L194-K198 PolarHBondContact O-N 3.02Å; S195-K198 PolarHBondContact O-N 3.1Å; N196-K198 PolarHBondContact O-N 3Å; K198-E201 WeakPolarHBondContact CD-OE2 3.42Å; K198-E201 WeakPolarHBondContact CE-OE2 3.38Å; K198-E201 IonicContact NZ-OE2 2.72Å; K198-E201 PolarHBondContact NZ-OE2 2.9Å; K198-M202 VanDerWaalsContact O-CB 3.32Å; K198-M202 WeakPolarHBondContact O-CB 3.37Å; K198-M202 WeakPolarHBondContact O-CG 3.48Å; K198-M202 PolarHBondContact O-N 3.06Å; K198-V226 HydrophobicContact CB-CG1 4.27Å
199	Y	92.1	Very high	89.1	Confident	22 Å²	22	47.1 Å²	47.1	9%	0.086	22%	0.217	C	C	.	.	H	α-helix	trans	-57.3	-50.2	169.8	165.5	-104.5	0	0	0	110.8	S195 N196 M202 Y203 V209 L211 L1042	S195-Y199 VanDerWaalsContact O-CB 3.27Å; S195-Y199 WeakPolarHBondContact O-CB 3.36Å; S195-Y199 PolarHBondContact O-N 3.13Å; N196-Y199 PolarHBondContact O-N 3.05Å; Y199-M202 PolarHBondContact O-N 3.14Å; Y199-Y203 HydrophobicContact CE2-CD2 4.07Å; Y199-Y203 WeakPolarHBondContact O-CB 3.45Å; Y199-Y203 PolarHBondContact O-N 2.9Å; Y199-V209 HydrophobicContact CD2-CG1 3.95Å; Y199-V209 HydrophobicContact CE2-CG1 4.37Å; Y199-L211 HydrophobicContact CD1-CB 4.46Å; Y199-L211 HydrophobicContact CD1-CD2 4.28Å; Y199-L211 HydrophobicContact CD2-CB 3.65Å; Y199-L211 HydrophobicContact CE2-CB 4.1Å; Y199-L211 HydrophobicContact CG-CB 3.85Å; Y199-L211 HydrophobicContact CG-CD2 4.22Å; Y199-L211 HydrophobicContact CG-CG 4.44Å; Y199-L1042 HydrophobicContact CD1-CD2 4.11Å; Y199-L1042 HydrophobicContact CE1-CD2 4.47Å
200	R	88.3	Confident	89.3	Confident	125 Å²	125	47.1 Å²	47.1	47%	0.472	22%	0.217	S	C	.	.	H	α-helix	trans	-63.9	-48.9	179.6	-177.2	170.3	173	172.2	-4.4	112.7	N196 Q197 M202 Y203 E204	N196-R200 PolarHBondContact O-N 2.91Å; N196-R200 VanDerWaalsContact O-N 3.14Å; Q197-R200 PolarHBondContact O-N 2.69Å; R200-M202 VanDerWaalsContact C-N 3.3Å; R200-M202 PolarHBondContact O-N 2.99Å; R200-Y203 PolarHBondContact O-N 3.47Å; R200-E204 HydrophobicContact CG-CG 4.45Å; R200-E204 WeakPolarHBondContact CG-OE1 3.45Å; R200-E204 IonicContact CZ-OE1 3.42Å; R200-E204 IonicContact NE-OE1 3.02Å; R200-E204 PolarHBondContact NE-OE1 3.09Å; R200-E204 IonicContact NH2-OE1 2.66Å; R200-E204 PolarHBondContact NH2-OE1 3.28Å; R200-E204 WeakPolarHBondContact O-CG 3.4Å; R200-E204 PolarHBondContact O-N 2.94Å
201	E	89	Confident	89.7	Confident	73 Å²	73	47 Å²	47	34%	0.341	22%	0.217	S	C	.	.	H	α-helix	trans	-55.7	-43.3	176.9	-72.5	175	-174	0	0	112.1	Q197 K198	Q197-E201 HydrophobicContact CG-CG 4.45Å; Q197-E201 WeakPolarHBondContact CG-OE1 3.38Å; Q197-E201 PolarHBondContact NE2-OE1 2.69Å; Q197-E201 WeakPolarHBondContact O-CG 3.31Å; Q197-E201 PolarHBondContact O-N 3.21Å; K198-E201 WeakPolarHBondContact CD-OE2 3.42Å; K198-E201 WeakPolarHBondContact CE-OE2 3.38Å; K198-E201 IonicContact NZ-OE2 2.72Å; K198-E201 PolarHBondContact NZ-OE2 2.9Å
202	M	91.8	Very high	90.1	Very high	4 Å²	4	46 Å²	46	2%	0.02	21%	0.211	C	C	.	.	H	α-helix	trans	-77.7	-31.4	179.6	-61.9	-65	154.7	0	0	112.6	T168 E172 I175 K198 Y199 R200 E205 F206 V209	T168-M202 HydrophobicContact CG2-CE 3.77Å; E172-M202 HydrophobicContact CG-CE 3.94Å; E172-M202 HydrophobicContact CG-SD 4.22Å; I175-M202 HydrophobicContact CD1-CG 4.38Å; I175-M202 HydrophobicContact CD1-SD 3.63Å; K198-M202 VanDerWaalsContact O-CB 3.32Å; K198-M202 WeakPolarHBondContact O-CB 3.37Å; K198-M202 WeakPolarHBondContact O-CG 3.48Å; K198-M202 PolarHBondContact O-N 3.06Å; Y199-M202 PolarHBondContact O-N 3.14Å; R200-M202 VanDerWaalsContact C-N 3.3Å; R200-M202 PolarHBondContact O-N 2.99Å; M202-E205 PolarHBondContact O-N 3.26Å; M202-F206 HydrophobicContact CB-CD2 4.34Å; M202-F206 WeakPolarHBondContact O-CB 3.35Å; M202-F206 WeakPolarHBondContact O-CD2 3.32Å; M202-F206 PolarHBondContact O-N 3.45Å; M202-F206 HydrophobicContact SD-CD2 4.13Å; M202-F206 HydrophobicContact SD-CE2 3.8Å; M202-V209 HydrophobicContact CB-CG1 4.22Å; M202-V209 HydrophobicContact CB-CG2 4.17Å; M202-V209 WeakPolarHBondContact O-CG2 3.44Å
203	Y	92.6	Very high	90.3	Very high	110 Å²	110	43.7 Å²	43.7	43%	0.431	20%	0.202	S	C	.	.	H	α-helix	trans	-69.3	-39.8	178.1	-172.9	-87.6	0	0	0	111.7	Y199 R200 E205 Q207 V209	Y199-Y203 HydrophobicContact CE2-CD2 4.07Å; Y199-Y203 WeakPolarHBondContact O-CB 3.45Å; Y199-Y203 PolarHBondContact O-N 2.9Å; R200-Y203 PolarHBondContact O-N 3.47Å; Y203-E205 PolarHBondContact O-N 2.85Å; Y203-Q207 WeakPolarHBondContact CD2-O 3.14Å; Y203-Q207 WeakPolarHBondContact CE2-O 3.32Å; Y203-Q207 WeakPolarHBondContact O-CA 3.15Å; Y203-Q207 PolarHBondContact O-N 2.89Å; Y203-V209 HydrophobicContact CD2-CB 4.16Å
204	E	90.4	Very high	90.2	Very high	127 Å²	127	43.5 Å²	43.5	59%	0.593	20%	0.202	S	C	*	.	H	α-helix	trans	-63	-29.5	175.2	-71.4	178	-166.3	0	0	112.4	R200	R200-E204 HydrophobicContact CG-CG 4.45Å; R200-E204 WeakPolarHBondContact CG-OE1 3.45Å; R200-E204 IonicContact CZ-OE1 3.42Å; R200-E204 IonicContact NE-OE1 3.02Å; R200-E204 PolarHBondContact NE-OE1 3.09Å; R200-E204 IonicContact NH2-OE1 2.66Å; R200-E204 PolarHBondContact NH2-OE1 3.28Å; R200-E204 WeakPolarHBondContact O-CG 3.4Å; R200-E204 PolarHBondContact O-N 2.94Å
205	E	91.5	Very high	89.8	Confident	98 Å²	98	45.8 Å²	45.8	46%	0.458	21%	0.214	S	C	.	.	H	α-helix	trans	-89.1	-50.6	177.2	175.3	72.5	-139.5	0	0	113.7	K134 M202 Y203	K134-E205 IonicContact NZ-OE1 2.69Å; K134-E205 PolarHBondContact NZ-OE1 3.47Å; K134-E205 IonicContact NZ-OE2 2.71Å; K134-E205 PolarHBondContact NZ-OE2 2.81Å; M202-E205 PolarHBondContact O-N 3.26Å; Y203-E205 PolarHBondContact O-N 2.85Å
206	F	93.5	Very high	89.5	Confident	34 Å²	34	48.1 Å²	48.1	15%	0.149	23%	0.228	C	C	.	.	H	α-helix	trans	-105.7	-16.3	-166.6	-62.9	-68.6	0	0	0	115.3	K134 E172 I175 A176 L179 M202 D208 V209	K134-F206 HydrophobicContact CD-CE1 4.37Å; K134-F206 HydrophobicContact CD-CZ 4.05Å; E172-F206 HydrophobicContact CB-CZ 4.33Å; E172-F206 WeakPolarHBondContact O-CZ 3.42Å; I175-F206 HydrophobicContact CB-CE2 4.06Å; I175-F206 HydrophobicContact CB-CZ 4.09Å; I175-F206 HydrophobicContact CD1-CE2 4.34Å; I175-F206 HydrophobicContact CG2-CD1 4.11Å; I175-F206 HydrophobicContact CG2-CD2 3.69Å; I175-F206 HydrophobicContact CG2-CE1 4.04Å; I175-F206 HydrophobicContact CG2-CE2 3.61Å; I175-F206 HydrophobicContact CG2-CG 3.95Å; I175-F206 HydrophobicContact CG2-CZ 3.8Å; A176-F206 HydrophobicContact CB-CE1 3.94Å; A176-F206 HydrophobicContact CB-CZ 4.37Å; L179-F206 HydrophobicContact CD1-CB 4.07Å; L179-F206 HydrophobicContact CD1-CD1 3.72Å; L179-F206 HydrophobicContact CD1-CE1 4.45Å; L179-F206 HydrophobicContact CD1-CG 4.04Å; M202-F206 HydrophobicContact CB-CD2 4.34Å; M202-F206 WeakPolarHBondContact O-CB 3.35Å; M202-F206 WeakPolarHBondContact O-CD2 3.32Å; M202-F206 PolarHBondContact O-N 3.45Å; M202-F206 HydrophobicContact SD-CD2 4.13Å; M202-F206 HydrophobicContact SD-CE2 3.8Å; F206-D208 PolarHBondContact O-N 3.03Å; F206-V209 HydrophobicContact CB-CG2 3.97Å
207	Q	88.5	Confident	89.7	Confident	147 Å²	147	51.5 Å²	51.5	69%	0.687	25%	0.249	S	C	*	.	S	Bend	trans	61.5	-46.4	-179.6	-54.9	-179.1	2.1	0	0	116.8	Y203 V209	Y203-Q207 WeakPolarHBondContact CD2-O 3.14Å; Y203-Q207 WeakPolarHBondContact CE2-O 3.32Å; Y203-Q207 WeakPolarHBondContact O-CA 3.15Å; Y203-Q207 PolarHBondContact O-N 2.89Å; Q207-V209 PolarHBondContact O-N 3.27Å
208	D	93.4	Very high	90	Very high	62 Å²	62	52.9 Å²	52.9	33%	0.332	26%	0.257	S	S	.	.			trans	-83	65.4	175.2	-172.9	25.9	0	0	0	111.6	F206 A222 S223 C224	F206-D208 PolarHBondContact O-N 3.03Å; D208-A222 VanDerWaalsContact OD1-CA 3.32Å; D208-A222 WeakPolarHBondContact OD1-CA 3.14Å; D208-S223 PolarHBondContact OD1-N 3.47Å; D208-S223 WeakPolarHBondContact OD2-CB 3.3Å; D208-S223 PolarHBondContact OD2-N 3.15Å; D208-S223 PolarHBondContact OD2-OG 2.94Å; D208-C224 PolarHBondContact O-N 3.36Å
209	V	95.9	Very high	90.2	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	142.3	179.2	-169.7	0	0	0	0	110.4	Y199 M202 Y203 F206 Q207 N219 C224 V226	Y199-V209 HydrophobicContact CD2-CG1 3.95Å; Y199-V209 HydrophobicContact CE2-CG1 4.37Å; M202-V209 HydrophobicContact CB-CG1 4.22Å; M202-V209 HydrophobicContact CB-CG2 4.17Å; M202-V209 WeakPolarHBondContact O-CG2 3.44Å; Y203-V209 HydrophobicContact CD2-CB 4.16Å; F206-V209 HydrophobicContact CB-CG2 3.97Å; Q207-V209 PolarHBondContact O-N 3.27Å; V209-N219 PolarHBondContact O-ND2 2.87Å; V209-C224 CarbonylContact C-O 3.57Å; V209-C224 VanDerWaalsContact CA-O 3.28Å; V209-C224 WeakPolarHBondContact CA-O 3.16Å; V209-C224 HydrophobicContact CG2-CB 4.18Å; V209-V226 HydrophobicContact CG1-CG2 3.92Å
210	G	95.9	Very high	90.2	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	164.2	171.1	0	0	0	0	0	112.2	I218 N219 A222 C224 V226	G210-I218 CarbonylContact C-O 3.55Å; G210-I218 VanDerWaalsContact CA-O 3.28Å; G210-I218 WeakPolarHBondContact CA-O 3.35Å; G210-N219 WeakPolarHBondContact CA-O 3.45Å; G210-A222 VanDerWaalsContact N-CB 3.28Å; G210-C224 PolarHBondContact N-O 2.64Å; G210-V226 PolarHBondContact O-N 2.71Å
211	L	95.2	Very high	90.4	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	129.8	177.8	177.3	61.4	0	0	0	110	Y199 T213 T217 I218 V226 L1042	Y199-L211 HydrophobicContact CD1-CB 4.46Å; Y199-L211 HydrophobicContact CD1-CD2 4.28Å; Y199-L211 HydrophobicContact CD2-CB 3.65Å; Y199-L211 HydrophobicContact CE2-CB 4.1Å; Y199-L211 HydrophobicContact CG-CB 3.85Å; Y199-L211 HydrophobicContact CG-CD2 4.22Å; Y199-L211 HydrophobicContact CG-CG 4.44Å; L211-T213 HydrophobicContact CD1-CG2 3.69Å; L211-T213 HydrophobicContact CG-CG2 4.11Å; L211-T217 CarbonylContact O-C 3.47Å; L211-T217 VanDerWaalsContact O-CA 3.31Å; L211-T217 WeakPolarHBondContact O-CA 3.43Å; L211-I218 HydrophobicContact CB-CB 4.36Å; L211-I218 PolarHBondContact N-O 2.92Å; L211-I218 PolarHBondContact O-N 2.88Å; L211-V226 CarbonylContact C-O 3.57Å; L211-V226 VanDerWaalsContact CA-O 3.28Å; L211-V226 WeakPolarHBondContact CA-O 3.5Å; L211-V226 HydrophobicContact CD1-CB 4.39Å; L211-V226 HydrophobicContact CD1-CG1 4.15Å; L211-L1042 HydrophobicContact CD2-CD2 3.46Å; L211-L1042 VanDerWaalsContact CD2-CD2 3.46Å
212	M	92.5	Very high	90.7	Very high	29 Å²	29	52.6 Å²	52.6	14%	0.143	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	107	173.1	-56.6	-176	63.6	0	0	110.9	T217 P220 L225 V226 M227 T228 I231 M235	M212-T217 HydrophobicContact CG-CG2 4.33Å; M212-P220 HydrophobicContact SD-CB 4.13Å; M212-L225 HydrophobicContact SD-CD1 4.5Å; M212-L225 HydrophobicContact SD-CD2 4.45Å; M212-V226 PolarHBondContact N-O 2.58Å; M212-M227 HydrophobicContact CB-CB 4.06Å; M212-M227 WeakPolarHBondContact O-CA 3.37Å; M212-M227 WeakPolarHBondContact O-CB 3.3Å; M212-M227 HydrophobicContact SD-CE 4.14Å; M212-T228 PolarHBondContact O-N 2.84Å; M212-I231 HydrophobicContact CB-CG2 3.93Å; M212-I231 HydrophobicContact CE-CG2 4.37Å; M212-M235 HydrophobicContact CE-CE 4.44Å; M212-M235 HydrophobicContact CE-SD 3.75Å; M212-M235 HydrophobicContact SD-CE 4.47Å; M212-M235 HydrophobicContact SD-SD 4.07Å
213	T	89.2	Confident	90.8	Very high	6 Å²	6	54.4 Å²	54.4	4%	0.037	29%	0.289	C	S	.	.			trans	-126.8	168.7	174.3	67.9	0	0	0	0	109.6	L211 D215 V216 T228	L211-T213 HydrophobicContact CD1-CG2 3.69Å; L211-T213 HydrophobicContact CG-CG2 4.11Å; T213-D215 PolarHBondContact O-N 2.9Å; T213-D215 PolarHBondContact OG1-N 2.98Å; T213-V216 PolarHBondContact N-O 2.86Å; T213-V216 PolarHBondContact OG1-N 3.48Å; T213-V216 PolarHBondContact OG1-O 3.41Å; T213-T228 HydrophobicContact CG2-CG2 4.36Å
214	G	78.5	Confident	91.1	Very high	20 Å²	20	49.1 Å²	49.1	21%	0.206	27%	0.268	C	S	.	.	S	Bend	trans	-63	-21.1	172.5	0	0	0	0	0	114.5	E1002	G214-E1002 WeakPolarHBondContact CA-OE1 3.23Å
215	D	77.1	Confident	91.4	Very high	63 Å²	63	43.1 Å²	43.1	34%	0.337	24%	0.24	S	C	.	.	S	Bend	trans	-94.2	-37.5	-178.1	-66.3	20.3	0	0	0	112	K192 T213 R998	K192-D215 WeakPolarHBondContact CD-OD1 3.16Å; K192-D215 WeakPolarHBondContact CE-OD1 3.44Å; K192-D215 IonicContact NZ-OD1 3.53Å; K192-D215 PolarHBondContact NZ-OD1 3.28Å; T213-D215 PolarHBondContact O-N 2.9Å; T213-D215 PolarHBondContact OG1-N 2.98Å; D215-R998 IonicContact OD2-NH1 2.7Å
216	V	83.3	Confident	91.6	Very high	50 Å²	50	38.5 Å²	38.5	30%	0.303	22%	0.219	S	C	.	.			trans	-144.2	139.2	-167	176.8	0	0	0	0	111.1	T213 I218 L1042	T213-V216 PolarHBondContact N-O 2.86Å; T213-V216 PolarHBondContact OG1-N 3.48Å; T213-V216 PolarHBondContact OG1-O 3.41Å; V216-I218 HydrophobicContact CG1-CD1 3.75Å; V216-I218 HydrophobicContact CG1-CG1 3.78Å; V216-L1042 HydrophobicContact CB-CD1 4.38Å; V216-L1042 HydrophobicContact CG1-CD1 4.2Å; V216-L1042 HydrophobicContact CG2-CD1 4.02Å
217	T	89.9	Confident	91.7	Very high	84 Å²	84	36.9 Å²	36.9	52%	0.515	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	122.3	170.9	-65.4	0	0	0	0	110	L211 M212 P220	L211-T217 CarbonylContact O-C 3.47Å; L211-T217 VanDerWaalsContact O-CA 3.31Å; L211-T217 WeakPolarHBondContact O-CA 3.43Å; M212-T217 HydrophobicContact CG-CG2 4.33Å; T217-P220 HydrophobicContact CG2-CB 4.01Å; T217-P220 HydrophobicContact CG2-CG 4.08Å
218	I	92.1	Very high	92	Very high	51 Å²	51	30 Å²	30	26%	0.262	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	135.1	-179.3	-63	164.1	0	0	0	108.3	G210 L211 V216 L1042	G210-I218 CarbonylContact C-O 3.55Å; G210-I218 VanDerWaalsContact CA-O 3.28Å; G210-I218 WeakPolarHBondContact CA-O 3.35Å; L211-I218 HydrophobicContact CB-CB 4.36Å; L211-I218 PolarHBondContact N-O 2.92Å; L211-I218 PolarHBondContact O-N 2.88Å; V216-I218 HydrophobicContact CG1-CD1 3.75Å; V216-I218 HydrophobicContact CG1-CG1 3.78Å; I218-L1042 HydrophobicContact CD1-CD2 4.5Å
219	N	93.3	Very high	92	Very high	57 Å²	57	27.1 Å²	27.1	31%	0.305	16%	0.164	S	C	.	.			trans	39.4	59	-179.7	-169.7	18.1	0	0	0	114.4	V209 G210 T221 A222	V209-N219 PolarHBondContact O-ND2 2.87Å; G210-N219 WeakPolarHBondContact CA-O 3.45Å; N219-T221 PolarHBondContact O-N 2.95Å; N219-T221 PolarHBondContact OD1-OG1 3.03Å; N219-A222 WeakPolarHBondContact ND2-CB 3.41Å; N219-A222 WeakPolarHBondContact O-CB 3.01Å; N219-A222 PolarHBondContact O-N 2.96Å; N219-A222 PolarHBondContact OD1-N 2.92Å
220	P	92.8	Very high	91.8	Very high	61 Å²	61	29.7 Å²	29.7	40%	0.396	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-5	178.6	30.5	-37.1	0	0	0	113.4	M212 T217	M212-P220 HydrophobicContact SD-CB 4.13Å; T217-P220 HydrophobicContact CG2-CB 4.01Å; T217-P220 HydrophobicContact CG2-CG 4.08Å
221	T	91.6	Very high	91.7	Very high	102 Å²	102	31.3 Å²	31.3	63%	0.626	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.9	0.1	175.5	40.1	0	0	0	0	114.2	R184 N219	R184-T221 VanDerWaalsContact NH2-C 3.26Å; R184-T221 PolarHBondContact NH2-O 2.93Å; N219-T221 PolarHBondContact O-N 2.95Å; N219-T221 PolarHBondContact OD1-OG1 3.03Å
222	A	95.1	Very high	91.7	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.185	C	C	.	.			trans	-58.7	161.3	-179.6	0	0	0	0	0	113.8	R184 D208 G210 N219 C224 L225	R184-A222 PolarHBondContact NE-O 3.38Å; R184-A222 PolarHBondContact NH2-O 3.44Å; D208-A222 VanDerWaalsContact OD1-CA 3.32Å; D208-A222 WeakPolarHBondContact OD1-CA 3.14Å; G210-A222 VanDerWaalsContact N-CB 3.28Å; N219-A222 WeakPolarHBondContact ND2-CB 3.41Å; N219-A222 WeakPolarHBondContact O-CB 3.01Å; N219-A222 PolarHBondContact O-N 2.96Å; N219-A222 PolarHBondContact OD1-N 2.92Å; A222-C224 WeakPolarHBondContact CB-O 3.38Å; A222-L225 HydrophobicContact CB-CD2 3.93Å
223	S	95.4	Very high	91.8	Very high	41 Å²	41	31.5 Å²	31.5	29%	0.287	18%	0.184	S	C	.	.	S	Bend	trans	-76.9	-33.8	168.4	-54.6	0	0	0	0	112.3	R184 V185 D208	R184-S223 WeakPolarHBondContact CA-O 3.37Å; V185-S223 PolarHBondContact N-O 2.95Å; D208-S223 PolarHBondContact OD1-N 3.47Å; D208-S223 WeakPolarHBondContact OD2-CB 3.3Å; D208-S223 PolarHBondContact OD2-N 3.15Å; D208-S223 PolarHBondContact OD2-OG 2.94Å
224	C	97.1	Very high	91.8	Very high	0 Å²	0	33 Å²	33	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	122.1	172.2	178	0	0	0	0	110.7	I175 V185 D208 V209 G210 A222	I175-C224 HydrophobicContact CG2-CB 4.32Å; V185-C224 HydrophobicContact CG1-CB 3.79Å; V185-C224 WeakPolarHBondContact O-CA 3.33Å; D208-C224 PolarHBondContact O-N 3.36Å; V209-C224 CarbonylContact C-O 3.57Å; V209-C224 VanDerWaalsContact CA-O 3.28Å; V209-C224 WeakPolarHBondContact CA-O 3.16Å; V209-C224 HydrophobicContact CG2-CB 4.18Å; G210-C224 PolarHBondContact N-O 2.64Å; A222-C224 WeakPolarHBondContact CB-O 3.38Å
225	L	97.1	Very high	92.4	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	113.4	-179.3	-67.9	171.1	0	0	0	111.5	V185 I186 F187 M212 A222 M227 V242	V185-L225 PolarHBondContact O-N 2.86Å; I186-L225 CarbonylContact C-O 3.49Å; I186-L225 WeakPolarHBondContact CA-O 3.49Å; I186-L225 HydrophobicContact CG1-CB 4.42Å; F187-L225 PolarHBondContact N-O 3.21Å; M212-L225 HydrophobicContact SD-CD1 4.5Å; M212-L225 HydrophobicContact SD-CD2 4.45Å; A222-L225 HydrophobicContact CB-CD2 3.93Å; L225-M227 HydrophobicContact CB-CE 3.81Å; L225-M227 HydrophobicContact CD1-CE 4.3Å; L225-V242 HydrophobicContact CD1-CG1 3.68Å
226	V	96.8	Very high	93.2	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	129.5	169.8	178.9	0	0	0	0	109.3	F187 S195 K198 V209 G210 L211 M212	F187-V226 HydrophobicContact CB-CG2 4.22Å; F187-V226 HydrophobicContact CD1-CG1 4.25Å; F187-V226 CarbonylContact O-C 3.51Å; F187-V226 WeakPolarHBondContact O-CA 3.28Å; S195-V226 WeakPolarHBondContact O-CG1 3.44Å; K198-V226 HydrophobicContact CB-CG1 4.27Å; V209-V226 HydrophobicContact CG1-CG2 3.92Å; G210-V226 PolarHBondContact O-N 2.71Å; L211-V226 CarbonylContact C-O 3.57Å; L211-V226 VanDerWaalsContact CA-O 3.28Å; L211-V226 WeakPolarHBondContact CA-O 3.5Å; L211-V226 HydrophobicContact CD1-CB 4.39Å; L211-V226 HydrophobicContact CD1-CG1 4.15Å; M212-V226 PolarHBondContact N-O 2.58Å
227	M	95.8	Very high	93.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	172.3	-179.5	61.3	-179.1	70	0	0	113.6	I186 F187 T188 S189 M212 L225 I231 L232 M235	I186-M227 HydrophobicContact CD1-CE 4.01Å; I186-M227 HydrophobicContact CD1-SD 4.44Å; I186-M227 HydrophobicContact CG1-CE 4.26Å; I186-M227 HydrophobicContact CG2-CE 3.86Å; I186-M227 HydrophobicContact CG2-CG 3.76Å; I186-M227 HydrophobicContact CG2-SD 3.68Å; F187-M227 PolarHBondContact O-N 3.37Å; T188-M227 WeakPolarHBondContact CA-O 3.45Å; T188-M227 HydrophobicContact CG2-CG 4.27Å; S189-M227 PolarHBondContact N-O 2.66Å; S189-M227 PolarHBondContact OG-O 3.25Å; M212-M227 HydrophobicContact CB-CB 4.06Å; M212-M227 WeakPolarHBondContact O-CA 3.37Å; M212-M227 WeakPolarHBondContact O-CB 3.3Å; M212-M227 HydrophobicContact SD-CE 4.14Å; L225-M227 HydrophobicContact CB-CE 3.81Å; L225-M227 HydrophobicContact CD1-CE 4.3Å; M227-I231 HydrophobicContact CB-CB 4.42Å; M227-I231 HydrophobicContact CB-CG2 4.44Å; M227-I231 HydrophobicContact SD-CG2 4.32Å; M227-L232 HydrophobicContact SD-CB 3.8Å; M227-L232 HydrophobicContact SD-CD1 4.18Å; M227-M235 HydrophobicContact CE-SD 4.01Å; M227-M235 HydrophobicContact SD-SD 4.27Å
228	T	94.1	Very high	93.5	Very high	4 Å²	4	31.9 Å²	31.9	3%	0.025	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	154.4	164.6	80.4	0	0	0	0	110.9	S189 K192 S195 M212 T213 E230 I231 L232	S189-T228 WeakPolarHBondContact O-CA 3.49Å; K192-T228 HydrophobicContact CG-CG2 4Å; S195-T228 WeakPolarHBondContact OG-CG2 3.49Å; M212-T228 PolarHBondContact O-N 2.84Å; T213-T228 HydrophobicContact CG2-CG2 4.36Å; T228-E230 VanDerWaalsContact CB-OE2 3.32Å; T228-E230 WeakPolarHBondContact CB-OE2 3.43Å; T228-E230 PolarHBondContact O-N 3.36Å; T228-E230 PolarHBondContact OG1-OE2 3.45Å; T228-I231 PolarHBondContact O-N 2.91Å; T228-L232 PolarHBondContact O-N 3.02Å
229	T	94.1	Very high	93.2	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-60.3	-31.8	-178.5	-39.9	0	0	0	0	112.4	I231 L232 R233 F251 V265 W266 T269	T229-I231 VanDerWaalsContact C-N 3.32Å; T229-I231 PolarHBondContact O-N 2.95Å; T229-L232 PolarHBondContact O-N 3.41Å; T229-R233 PolarHBondContact O-N 3.33Å; T229-F251 HydrophobicContact CG2-CE1 4.36Å; T229-V265 HydrophobicContact CG2-CG1 4.21Å; T229-W266 HydrophobicContact CG2-CD2 3.95Å; T229-W266 HydrophobicContact CG2-CE3 4.2Å; T229-W266 HydrophobicContact CG2-CG 4.2Å; T229-W266 WeakPolarHBondContact OG1-CH2 3.41Å; T229-W266 WeakPolarHBondContact OG1-CZ2 3.28Å; T229-T269 HydrophobicContact CG2-CG2 4.15Å
230	E	92	Very high	93	Very high	54 Å²	54	31.1 Å²	31.1	25%	0.252	18%	0.18	S	C	.	.	H	α-helix	trans	-61.7	-35.7	173.1	-64.2	77	-170.2	0	0	113.4	T228 S234 R262 V265	T228-E230 VanDerWaalsContact CB-OE2 3.32Å; T228-E230 WeakPolarHBondContact CB-OE2 3.43Å; T228-E230 PolarHBondContact O-N 3.36Å; T228-E230 PolarHBondContact OG1-OE2 3.45Å; E230-S234 WeakPolarHBondContact O-CB 3.46Å; E230-S234 PolarHBondContact O-N 2.92Å; E230-R262 VanDerWaalsContact CD-NH2 3.35Å; E230-R262 IonicContact OE1-CZ 2.68Å; E230-R262 IonicContact OE1-NE 2.82Å; E230-R262 PolarHBondContact OE1-NE 3.02Å; E230-R262 IonicContact OE1-NH2 2.88Å; E230-R262 PolarHBondContact OE1-NH2 3.05Å; E230-R262 IonicContact OE2-NH2 2.67Å; E230-R262 PolarHBondContact OE2-NH2 3Å; E230-V265 HydrophobicContact CG-CG1 4.11Å
231	I	92.4	Very high	92.7	Very high	35 Å²	35	34.3 Å²	34.3	18%	0.179	19%	0.189	C	C	.	.	H	α-helix	trans	-71.8	-41.5	178.3	-63.1	-61.2	0	0	0	110	M212 M227 T228 T229 S234 M235	M212-I231 HydrophobicContact CB-CG2 3.93Å; M212-I231 HydrophobicContact CE-CG2 4.37Å; M227-I231 HydrophobicContact CB-CB 4.42Å; M227-I231 HydrophobicContact CB-CG2 4.44Å; M227-I231 HydrophobicContact SD-CG2 4.32Å; T228-I231 PolarHBondContact O-N 2.91Å; T229-I231 VanDerWaalsContact C-N 3.32Å; T229-I231 PolarHBondContact O-N 2.95Å; I231-S234 PolarHBondContact O-N 2.83Å; I231-M235 HydrophobicContact CG2-CG 4.45Å; I231-M235 HydrophobicContact CG2-SD 4.05Å; I231-M235 WeakPolarHBondContact O-CG 3.4Å; I231-M235 PolarHBondContact O-N 2.88Å
232	L	95.3	Very high	92.6	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60.6	-46.9	174.3	-174.2	55	0	0	0	111.3	I186 T188 M227 T228 T229 S234 M235 L236 M243 V249 T269	I186-L232 HydrophobicContact CD1-CD1 3.8Å; I186-L232 HydrophobicContact CG2-CD2 4.38Å; T188-L232 HydrophobicContact CG2-CB 4.31Å; T188-L232 HydrophobicContact CG2-CD2 3.57Å; M227-L232 HydrophobicContact SD-CB 3.8Å; M227-L232 HydrophobicContact SD-CD1 4.18Å; T228-L232 PolarHBondContact O-N 3.02Å; T229-L232 PolarHBondContact O-N 3.41Å; L232-S234 VanDerWaalsContact C-N 3.32Å; L232-S234 PolarHBondContact O-N 2.91Å; L232-M235 PolarHBondContact O-N 3.39Å; L232-M235 VanDerWaalsContact O-N 3.15Å; L232-L236 HydrophobicContact CD1-CD1 4.42Å; L232-L236 HydrophobicContact CD1-CG 4.42Å; L232-L236 HydrophobicContact CG-CD1 4.1Å; L232-L236 WeakPolarHBondContact O-CG 3.49Å; L232-L236 PolarHBondContact O-N 2.98Å; L232-M243 HydrophobicContact CD1-SD 3.65Å; L232-V249 HydrophobicContact CD2-CG1 3.97Å; L232-T269 HydrophobicContact CB-CG2 4.11Å; L232-T269 HydrophobicContact CD2-CG2 3.62Å; L232-T269 HydrophobicContact CG-CG2 3.71Å
233	R	94.3	Very high	92.3	Very high	32 Å²	32	31.3 Å²	31.3	12%	0.121	17%	0.17	C	C	.	.	H	α-helix	trans	-52.2	-47.6	171.7	-177	-175.7	173.7	-150.1	9.6	112.2	T229 L236 Y237 V265 E268	T229-R233 PolarHBondContact O-N 3.33Å; R233-L236 PolarHBondContact O-N 2.86Å; R233-Y237 HydrophobicContact CG-CD2 4.25Å; R233-Y237 HydrophobicContact CG-CE2 4.33Å; R233-Y237 PolarHBondContact O-N 2.87Å; R233-V265 HydrophobicContact CB-CG1 4.43Å; R233-E268 IonicContact CZ-OE1 3.51Å; R233-E268 IonicContact CZ-OE2 3.58Å; R233-E268 VanDerWaalsContact CZ-OE2 3.3Å; R233-E268 IonicContact NE-OE1 2.69Å; R233-E268 PolarHBondContact NE-OE1 3.35Å; R233-E268 IonicContact NE-OE2 3.52Å; R233-E268 PolarHBondContact NE-OE2 2.84Å; R233-E268 IonicContact NH2-OE1 3.45Å; R233-E268 PolarHBondContact NH2-OE1 3.05Å; R233-E268 IonicContact NH2-OE2 2.74Å; R233-E268 PolarHBondContact NH2-OE2 3.42Å
234	S	90.8	Very high	92	Very high	39 Å²	39	38.4 Å²	38.4	27%	0.273	19%	0.191	S	C	.	.	H	α-helix	trans	-66	-36.6	179.2	-170.6	0	0	0	0	112.8	E230 I231 L232 R238	E230-S234 WeakPolarHBondContact O-CB 3.46Å; E230-S234 PolarHBondContact O-N 2.92Å; I231-S234 PolarHBondContact O-N 2.83Å; L232-S234 VanDerWaalsContact C-N 3.32Å; L232-S234 PolarHBondContact O-N 2.91Å; S234-R238 WeakPolarHBondContact O-CB 3.3Å; S234-R238 WeakPolarHBondContact O-CG 3.5Å; S234-R238 PolarHBondContact O-N 2.62Å; S234-R238 VanDerWaalsContact O-N 3.13Å; S234-R238 PolarHBondContact OG-NH1 3.17Å
235	M	91.4	Very high	91.6	Very high	17 Å²	17	43.7 Å²	43.7	8%	0.084	22%	0.215	C	C	.	.	H	α-helix	trans	-68.5	-39	175.8	-73.5	176.6	66.4	0	0	112.2	M212 M227 I231 L232 R238 G239 S240 V242	M212-M235 HydrophobicContact CE-CE 4.44Å; M212-M235 HydrophobicContact CE-SD 3.75Å; M212-M235 HydrophobicContact SD-CE 4.47Å; M212-M235 HydrophobicContact SD-SD 4.07Å; M227-M235 HydrophobicContact CE-SD 4.01Å; M227-M235 HydrophobicContact SD-SD 4.27Å; I231-M235 HydrophobicContact CG2-CG 4.45Å; I231-M235 HydrophobicContact CG2-SD 4.05Å; I231-M235 WeakPolarHBondContact O-CG 3.4Å; I231-M235 PolarHBondContact O-N 2.88Å; L232-M235 PolarHBondContact O-N 3.39Å; L232-M235 VanDerWaalsContact O-N 3.15Å; M235-R238 PolarHBondContact O-N 2.9Å; M235-G239 PolarHBondContact O-N 2.87Å; M235-G239 VanDerWaalsContact O-N 3.16Å; M235-S240 WeakPolarHBondContact O-CB 3.42Å; M235-S240 PolarHBondContact O-N 2.8Å; M235-V242 HydrophobicContact CE-CB 3.79Å; M235-V242 HydrophobicContact CE-CG1 4.02Å; M235-V242 HydrophobicContact CE-CG2 3.94Å
236	L	93.1	Very high	91.5	Very high	26 Å²	26	43.9 Å²	43.9	14%	0.136	22%	0.216	C	C	.	.	H	α-helix	trans	-63.7	-50.4	174.3	-69.6	165.4	0	0	0	110.9	L232 R233 R238 G239 M243 T269 L272 L273	L232-L236 HydrophobicContact CD1-CD1 4.42Å; L232-L236 HydrophobicContact CD1-CG 4.42Å; L232-L236 HydrophobicContact CG-CD1 4.1Å; L232-L236 WeakPolarHBondContact O-CG 3.49Å; L232-L236 PolarHBondContact O-N 2.98Å; R233-L236 PolarHBondContact O-N 2.86Å; L236-R238 PolarHBondContact O-N 2.76Å; L236-R238 VanDerWaalsContact O-N 3.15Å; L236-G239 PolarHBondContact O-N 2.84Å; L236-M243 HydrophobicContact CD2-CE 4.14Å; L236-M243 HydrophobicContact CD2-CG 3.96Å; L236-M243 HydrophobicContact CD2-SD 4.22Å; L236-T269 HydrophobicContact CD1-CG2 3.97Å; L236-L272 HydrophobicContact CB-CB 4.18Å; L236-L272 HydrophobicContact CB-CD1 4.33Å; L236-L272 HydrophobicContact CD1-CB 3.86Å; L236-L272 HydrophobicContact CG-CB 4.47Å; L236-L273 HydrophobicContact CD1-CD2 4.28Å; L236-L273 HydrophobicContact CD1-CG 4.23Å; L236-L273 HydrophobicContact CD2-CD2 4.2Å
237	Y	91.3	Very high	91.5	Very high	14 Å²	14	44.4 Å²	44.4	6%	0.055	22%	0.221	C	C	.	.	H	α-helix	trans	-65.6	-14.8	176.4	-83.9	-34	0	0	0	115.6	R233 E268 L272 M569 N572 L573 R575	R233-Y237 HydrophobicContact CG-CD2 4.25Å; R233-Y237 HydrophobicContact CG-CE2 4.33Å; R233-Y237 PolarHBondContact O-N 2.87Å; Y237-E268 WeakPolarHBondContact CE2-OE1 3.38Å; Y237-E268 PolarHBondContact OH-OE1 3.04Å; Y237-L272 HydrophobicContact CD1-CD1 3.89Å; Y237-L272 HydrophobicContact CE1-CD1 3.68Å; Y237-L272 HydrophobicContact CE1-CD2 4.26Å; Y237-L272 HydrophobicContact CE2-CD1 4.44Å; Y237-L272 HydrophobicContact CG-CD1 4.36Å; Y237-M569 WeakPolarHBondContact OH-CA 3.28Å; Y237-M569 PolarHBondContact OH-O 3.04Å; Y237-N572 HydrophobicContact CD1-CB 3.69Å; Y237-N572 HydrophobicContact CD2-CB 3.75Å; Y237-N572 HydrophobicContact CE1-CB 3.55Å; Y237-N572 HydrophobicContact CE2-CB 3.58Å; Y237-N572 HydrophobicContact CG-CB 3.78Å; Y237-N572 VanDerWaalsContact CZ-CB 3.48Å; Y237-L573 HydrophobicContact CE1-CD2 3.97Å; Y237-L573 HydrophobicContact CE1-CG 4.17Å; Y237-L573 WeakPolarHBondContact OH-CG 3.06Å; Y237-R575 PolarHBondContact O-NH2 2.83Å
238	R	88.1	Confident	91.6	Very high	135 Å²	135	44.5 Å²	44.5	51%	0.509	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-0.9	172.8	-73.3	175.5	171.9	152.4	-4.8	113.2	S234 M235 L236 S240 E879	S234-R238 WeakPolarHBondContact O-CB 3.3Å; S234-R238 WeakPolarHBondContact O-CG 3.5Å; S234-R238 PolarHBondContact O-N 2.62Å; S234-R238 VanDerWaalsContact O-N 3.13Å; S234-R238 PolarHBondContact OG-NH1 3.17Å; M235-R238 PolarHBondContact O-N 2.9Å; L236-R238 PolarHBondContact O-N 2.76Å; L236-R238 VanDerWaalsContact O-N 3.15Å; R238-S240 VanDerWaalsContact C-N 3.33Å; R238-S240 PolarHBondContact O-N 2.95Å; R238-E879 IonicContact CZ-OE2 2.58Å; R238-E879 IonicContact NE-OE2 2.71Å; R238-E879 PolarHBondContact NE-OE2 3.37Å; R238-E879 IonicContact NH2-OE2 2.66Å; R238-E879 PolarHBondContact NH2-OE2 3.16Å
239	G	86.9	Confident	91.8	Very high	55 Å²	55	44.3 Å²	44.3	57%	0.567	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.9	37	-178.7	0	0	0	0	0	113.4	M235 L236 E241	M235-G239 PolarHBondContact O-N 2.87Å; M235-G239 VanDerWaalsContact O-N 3.16Å; L236-G239 PolarHBondContact O-N 2.84Å; G239-E241 PolarHBondContact O-N 2.88Å
240	S	87.9	Confident	92	Very high	38 Å²	38	44.3 Å²	44.3	27%	0.266	22%	0.22	S	C	.	.			trans	-59	129.3	-173.1	-172.2	0	0	0	0	112.4	M235 R238 V242 M243	M235-S240 WeakPolarHBondContact O-CB 3.42Å; M235-S240 PolarHBondContact O-N 2.8Å; R238-S240 VanDerWaalsContact C-N 3.33Å; R238-S240 PolarHBondContact O-N 2.95Å; S240-V242 PolarHBondContact O-N 3.34Å; S240-V242 VanDerWaalsContact O-N 3.09Å; S240-M243 WeakPolarHBondContact O-CB 3.24Å; S240-M243 PolarHBondContact O-N 2.94Å
241	E	87.6	Confident	92.2	Very high	127 Å²	127	41.7 Å²	41.7	59%	0.593	21%	0.208	S	C	*	.	G	3₁₀ helix	trans	-61.2	-23.4	-176	-56.5	-160.4	121.1	0	0	113.6	G239 M243 R244	G239-E241 PolarHBondContact O-N 2.88Å; E241-M243 PolarHBondContact O-N 3.05Å; E241-M243 VanDerWaalsContact O-N 3.15Å; E241-R244 WeakPolarHBondContact O-CB 3.24Å; E241-R244 PolarHBondContact O-N 3.44Å; E241-R244 IonicContact OE1-CZ 2.67Å; E241-R244 IonicContact OE1-NH1 2.74Å; E241-R244 PolarHBondContact OE1-NH1 3.29Å; E241-R244 IonicContact OE1-NH2 2.8Å; E241-R244 PolarHBondContact OE1-NH2 3.33Å
242	V	88.7	Confident	92.4	Very high	23 Å²	23	40.6 Å²	40.6	14%	0.139	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-49.9	-39	173.1	179.1	0	0	0	0	111.4	L225 M235 S240 R244 E245 V246	L225-V242 HydrophobicContact CD1-CG1 3.68Å; M235-V242 HydrophobicContact CE-CB 3.79Å; M235-V242 HydrophobicContact CE-CG1 4.02Å; M235-V242 HydrophobicContact CE-CG2 3.94Å; S240-V242 PolarHBondContact O-N 3.34Å; S240-V242 VanDerWaalsContact O-N 3.09Å; V242-R244 PolarHBondContact O-N 3.47Å; V242-R244 VanDerWaalsContact O-N 3.16Å; V242-E245 PolarHBondContact O-N 3.32Å; V242-V246 WeakPolarHBondContact O-CG2 3.4Å
243	M	88.8	Confident	92.2	Very high	17 Å²	17	41.5 Å²	41.5	8%	0.084	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-65.7	-16.6	-178.1	-70.1	-55.1	-46.1	0	0	114.4	I186 L232 L236 S240 E241 E245 V246 L273	I186-M243 HydrophobicContact CD1-SD 3.77Å; L232-M243 HydrophobicContact CD1-SD 3.65Å; L236-M243 HydrophobicContact CD2-CE 4.14Å; L236-M243 HydrophobicContact CD2-CG 3.96Å; L236-M243 HydrophobicContact CD2-SD 4.22Å; S240-M243 WeakPolarHBondContact O-CB 3.24Å; S240-M243 PolarHBondContact O-N 2.94Å; E241-M243 PolarHBondContact O-N 3.05Å; E241-M243 VanDerWaalsContact O-N 3.15Å; M243-E245 VanDerWaalsContact C-N 3.27Å; M243-E245 PolarHBondContact O-N 2.97Å; M243-V246 HydrophobicContact CE-CB 4.21Å; M243-V246 HydrophobicContact CE-CG1 4.37Å; M243-V246 HydrophobicContact CE-CG2 4.44Å; M243-V246 HydrophobicContact SD-CG2 4.38Å; M243-L273 HydrophobicContact CE-CD2 3.46Å; M243-L273 VanDerWaalsContact CE-CD2 3.46Å
244	R	87.9	Confident	92.2	Very high	189 Å²	189	40 Å²	40	71%	0.713	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-74	-18.7	177.9	-61.6	-176	-175.5	141.5	6.6	113.5	E241 V242	E241-R244 WeakPolarHBondContact O-CB 3.24Å; E241-R244 PolarHBondContact O-N 3.44Å; E241-R244 IonicContact OE1-CZ 2.67Å; E241-R244 IonicContact OE1-NH1 2.74Å; E241-R244 PolarHBondContact OE1-NH1 3.29Å; E241-R244 IonicContact OE1-NH2 2.8Å; E241-R244 PolarHBondContact OE1-NH2 3.33Å; V242-R244 PolarHBondContact O-N 3.47Å; V242-R244 VanDerWaalsContact O-N 3.16Å
245	E	90	Very high	92.2	Very high	112 Å²	112	38.4 Å²	38.4	52%	0.523	19%	0.189	S	C	.	.	S	Bend	trans	-107.5	-6.9	-175.8	-63.9	174.2	174.9	0	0	112.7	R184 V242 M243	R184-E245 HydrophobicContact CB-CB 4.29Å; R184-E245 HydrophobicContact CG-CB 4.13Å; R184-E245 IonicContact CZ-OE2 3.33Å; R184-E245 PolarHBondContact N-O 2.82Å; R184-E245 IonicContact NE-OE2 3.82Å; R184-E245 IonicContact NH1-OE2 2.71Å; R184-E245 PolarHBondContact NH1-OE2 2.85Å; V242-E245 PolarHBondContact O-N 3.32Å; M243-E245 VanDerWaalsContact C-N 3.27Å; M243-E245 PolarHBondContact O-N 2.97Å
246	V	95.4	Very high	92.1	Very high	4 Å²	4	38.7 Å²	38.7	2%	0.024	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	120.5	-178.4	175.1	0	0	0	0	109.8	R184 I186 V242 M243 W248 V249 V277	R184-V246 HydrophobicContact CB-CG2 3.9Å; R184-V246 WeakPolarHBondContact O-CA 3.36Å; I186-V246 HydrophobicContact CD1-CG1 4.44Å; I186-V246 HydrophobicContact CD1-CG2 3.74Å; I186-V246 HydrophobicContact CG1-CG1 4.29Å; I186-V246 HydrophobicContact CG1-CG2 3.87Å; V242-V246 WeakPolarHBondContact O-CG2 3.4Å; M243-V246 HydrophobicContact CE-CB 4.21Å; M243-V246 HydrophobicContact CE-CG1 4.37Å; M243-V246 HydrophobicContact CE-CG2 4.44Å; M243-V246 HydrophobicContact SD-CG2 4.38Å; V246-W248 WeakPolarHBondContact CG1-O 3.44Å; V246-V249 HydrophobicContact CG1-CG2 3.74Å; V246-V277 HydrophobicContact CG1-CG1 4.42Å
247	A	95.8	Very high	92.1	Very high	12 Å²	12	37.5 Å²	37.5	10%	0.099	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	-29.2	172.6	0	0	0	0	0	112.6	Q183 R184 H278	Q183-A247 HydrophobicContact CB-CB 3.74Å; Q183-A247 HydrophobicContact CG-CB 4.04Å; Q183-A247 VanDerWaalsContact OE1-CB 3.23Å; R184-A247 PolarHBondContact O-N 3.19Å; A247-H278 PolarHBondContact O-N 2.86Å
248	W	97.9	Very high	92.1	Very high	1 Å²	1	40.3 Å²	40.3	0%	0.004	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	132.5	-176.7	-72.5	93.6	0	0	0	112	V151 L177 V185 I186 V246 H278 V280	V151-W248 HydrophobicContact CB-CH2 4.26Å; V151-W248 HydrophobicContact CG1-CH2 4.1Å; V151-W248 HydrophobicContact CG1-CZ2 4.06Å; V151-W248 HydrophobicContact CG2-CH2 4.11Å; V151-W248 HydrophobicContact CG2-CZ3 4.28Å; L177-W248 HydrophobicContact CD2-CZ2 4.36Å; V185-W248 WeakPolarHBondContact CA-O 3.37Å; V185-W248 HydrophobicContact CB-CB 4.48Å; V185-W248 HydrophobicContact CG2-CB 3.99Å; I186-W248 PolarHBondContact N-O 2.86Å; V246-W248 WeakPolarHBondContact CG1-O 3.44Å; W248-H278 WeakPolarHBondContact CA-O 3.27Å; W248-H278 HydrophobicContact CD2-CB 3.83Å; W248-H278 HydrophobicContact CE3-CB 3.53Å; W248-H278 HydrophobicContact CH2-CB 3.69Å; W248-H278 HydrophobicContact CZ2-CB 3.98Å; W248-H278 HydrophobicContact CZ3-CB 3.46Å; W248-H278 VanDerWaalsContact CZ3-CB 3.46Å; W248-V280 HydrophobicContact CE3-CG2 3.86Å; W248-V280 HydrophobicContact CZ3-CG2 3.78Å
249	V	98.3	Very high	92.2	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	127.1	167.6	179.4	0	0	0	0	109.4	I186 T188 L232 V246 F251 L273 V277 H278 Y279 V280	I186-V249 HydrophobicContact CB-CG2 4.34Å; I186-V249 WeakPolarHBondContact O-CA 3.46Å; T188-V249 HydrophobicContact CG2-CG1 4.33Å; L232-V249 HydrophobicContact CD2-CG1 3.97Å; V246-V249 HydrophobicContact CG1-CG2 3.74Å; V249-F251 HydrophobicContact CB-CE2 4.28Å; V249-F251 HydrophobicContact CG1-CD2 3.99Å; V249-F251 HydrophobicContact CG1-CE1 4.36Å; V249-F251 HydrophobicContact CG1-CE2 3.57Å; V249-F251 HydrophobicContact CG1-CZ 3.79Å; V249-L273 HydrophobicContact CB-CD1 4.3Å; V249-L273 HydrophobicContact CG1-CD1 4.18Å; V249-L273 HydrophobicContact CG2-CD1 4.22Å; V249-L273 HydrophobicContact CG2-CD2 4.03Å; V249-V277 HydrophobicContact CB-CG1 4.28Å; V249-V277 HydrophobicContact CG2-CG1 3.71Å; V249-H278 PolarHBondContact N-O 3.47Å; V249-Y279 HydrophobicContact CB-CD1 4.35Å; V249-Y279 VanDerWaalsContact O-CA 3.32Å; V249-Y279 WeakPolarHBondContact O-CA 3.39Å; V249-V280 PolarHBondContact O-N 3.28Å
250	I	98.3	Very high	92.1	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	130.7	-179.6	-53.4	173.5	0	0	0	107.4	A171 A174 I175 V185 I186 F187 T188 V280	A171-I250 HydrophobicContact CB-CD1 3.97Å; A171-I250 HydrophobicContact CB-CG2 3.72Å; A174-I250 HydrophobicContact CB-CD1 4.2Å; I175-I250 HydrophobicContact CD1-CD1 4.08Å; I175-I250 HydrophobicContact CG1-CD1 3.66Å; V185-I250 HydrophobicContact CG2-CD1 3.84Å; V185-I250 HydrophobicContact CG2-CG1 4.23Å; I186-I250 PolarHBondContact O-N 2.82Å; F187-I250 HydrophobicContact CD2-CB 3.97Å; F187-I250 HydrophobicContact CD2-CD1 4.21Å; F187-I250 HydrophobicContact CD2-CG2 3.69Å; F187-I250 HydrophobicContact CE2-CG2 3.86Å; T188-I250 PolarHBondContact N-O 2.67Å; T188-I250 PolarHBondContact OG1-O 3.29Å; I250-V280 CarbonylContact C-O 3.54Å; I250-V280 WeakPolarHBondContact CA-O 3.48Å; I250-V280 HydrophobicContact CG1-CB 4.25Å; I250-V280 HydrophobicContact CG2-CB 4.35Å
251	F	97.4	Very high	91.8	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	95.3	-178.5	-76	-75.9	0	0	0	109.2	T188 T229 V249 I254 W266 T269 I270 L273 Y279 V280 F281 L282	T188-F251 HydrophobicContact CG2-CE1 4.47Å; T188-F251 WeakPolarHBondContact OG1-CA 3.41Å; T188-F251 WeakPolarHBondContact OG1-CD1 3.48Å; T229-F251 HydrophobicContact CG2-CE1 4.36Å; V249-F251 HydrophobicContact CB-CE2 4.28Å; V249-F251 HydrophobicContact CG1-CD2 3.99Å; V249-F251 HydrophobicContact CG1-CE1 4.36Å; V249-F251 HydrophobicContact CG1-CE2 3.57Å; V249-F251 HydrophobicContact CG1-CZ 3.79Å; F251-I254 HydrophobicContact CB-CD1 4.35Å; F251-W266 HydrophobicContact CB-CZ3 4.05Å; F251-W266 AromaticContact CD1-CE3 3.74Å; F251-W266 HydrophobicContact CD1-CE3 3.74Å; F251-W266 AromaticContact CD1-CZ3 3.59Å; F251-W266 HydrophobicContact CD1-CZ3 3.59Å; F251-W266 HydrophobicContact CE1-CE3 4.34Å; F251-W266 HydrophobicContact CG-CZ3 4.29Å; F251-T269 HydrophobicContact CE1-CG2 4.25Å; F251-T269 HydrophobicContact CZ-CG2 4.28Å; F251-I270 HydrophobicContact CE1-CG1 4.15Å; F251-I270 HydrophobicContact CE2-CG1 3.94Å; F251-I270 HydrophobicContact CZ-CD1 4.44Å; F251-I270 HydrophobicContact CZ-CG1 3.6Å; F251-L273 HydrophobicContact CE2-CD1 3.85Å; F251-L273 HydrophobicContact CZ-CD1 3.62Å; F251-Y279 HydrophobicContact CE2-CD1 4.35Å; F251-V280 PolarHBondContact N-O 3.26Å; F251-F281 HydrophobicContact CB-CD1 3.66Å; F251-F281 HydrophobicContact CB-CE1 4.21Å; F251-F281 AromaticContact CD2-CD1 3.63Å; F251-F281 HydrophobicContact CD2-CD1 3.63Å; F251-F281 AromaticContact CD2-CE1 3.29Å; F251-F281 HydrophobicContact CD2-CE1 3.29Å; F251-F281 HydrophobicContact CD2-CZ 4.13Å; F251-F281 AromaticContact CE2-CE1 3.8Å; F251-F281 HydrophobicContact CE2-CE1 3.8Å; F251-F281 HydrophobicContact CE2-CZ 4.39Å; F251-F281 AromaticContact CG-CD1 3.92Å; F251-F281 HydrophobicContact CG-CD1 3.92Å; F251-F281 AromaticContact CG-CE1 3.95Å; F251-F281 HydrophobicContact CG-CE1 3.95Å; F251-L282 PolarHBondContact O-N 3.16Å
252	D	94.7	Very high	91.8	Very high	11 Å²	11	39.6 Å²	39.6	6%	0.059	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	139.2	179.9	-162.3	16.8	0	0	0	112.1	F187 T188 P190 I254 W266	F187-D252 HydrophobicContact CE1-CB 3.98Å; F187-D252 HydrophobicContact CE2-CB 4.34Å; F187-D252 HydrophobicContact CZ-CB 3.58Å; T188-D252 PolarHBondContact O-N 3.46Å; T188-D252 VanDerWaalsContact O-N 3.11Å; P190-D252 WeakPolarHBondContact CD-O 3.09Å; D252-I254 VanDerWaalsContact C-N 3.32Å; D252-I254 PolarHBondContact O-N 3.09Å; D252-W266 VanDerWaalsContact O-CH2 3.3Å; D252-W266 WeakPolarHBondContact O-CH2 3.43Å
253	E	91.5	Very high	92	Very high	19 Å²	19	38.5 Å²	38.5	9%	0.089	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	42.8	49.2	-170.7	-57.3	-68.9	-146.6	0	0	114.6	T163 K167 P190 H255 Y256 L282	T163-E253 PolarHBondContact OG1-OE1 3.41Å; K167-E253 IonicContact NZ-OE1 3.47Å; K167-E253 IonicContact NZ-OE2 2.8Å; K167-E253 PolarHBondContact NZ-OE2 3.27Å; P190-E253 HydrophobicContact CG-CB 4.48Å; E253-H255 PolarHBondContact O-N 3.26Å; E253-H255 IonicContact OE2-CE1 3.58Å; E253-H255 PolarHBondContact OE2-CE1 3.48Å; E253-H255 VanDerWaalsContact OE2-CE1 3.31Å; E253-H255 IonicContact OE2-ND1 3.56Å; E253-H255 PolarHBondContact OE2-ND1 2.83Å; E253-Y256 HydrophobicContact CB-CD2 4.05Å; E253-Y256 HydrophobicContact CB-CE2 4.13Å; E253-Y256 VanDerWaalsContact O-CD2 3.28Å; E253-Y256 WeakPolarHBondContact O-CD2 3.16Å; E253-Y256 PolarHBondContact O-N 3.45Å; E253-L282 CarbonylContact C-O 3.57Å; E253-L282 WeakPolarHBondContact CA-O 3.13Å; E253-L282 PolarHBondContact N-O 2.84Å
254	I	94.4	Very high	92.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-47.7	-22.7	178.3	-173.5	56	0	0	0	114.7	L158 F251 D252 Y256 M257 W266 I270 F281 L282 F292	L158-I254 HydrophobicContact CD1-CG2 4.16Å; F251-I254 HydrophobicContact CB-CD1 4.35Å; D252-I254 VanDerWaalsContact C-N 3.32Å; D252-I254 PolarHBondContact O-N 3.09Å; I254-Y256 PolarHBondContact O-N 2.86Å; I254-M257 VanDerWaalsContact O-CB 3.32Å; I254-M257 WeakPolarHBondContact O-CB 3.35Å; I254-M257 PolarHBondContact O-N 3.36Å; I254-W266 HydrophobicContact CD1-CD2 4.42Å; I254-W266 HydrophobicContact CD1-CE3 3.49Å; I254-W266 VanDerWaalsContact CD1-CE3 3.49Å; I254-W266 HydrophobicContact CD1-CZ3 4Å; I254-I270 HydrophobicContact CD1-CD1 4.09Å; I254-F281 HydrophobicContact CB-CB 4.44Å; I254-F281 HydrophobicContact CB-CD1 4.42Å; I254-F281 HydrophobicContact CD1-CD1 4.04Å; I254-F281 HydrophobicContact CD1-CE1 4.43Å; I254-F281 HydrophobicContact CG1-CD1 3.87Å; I254-F281 HydrophobicContact CG2-CB 4.17Å; I254-L282 WeakPolarHBondContact CG2-O 3.26Å; I254-L282 PolarHBondContact N-O 3.02Å; I254-F292 HydrophobicContact CD1-CE2 4.37Å; I254-F292 HydrophobicContact CD1-CZ 4.11Å; I254-F292 HydrophobicContact CG1-CE1 4.47Å; I254-F292 HydrophobicContact CG1-CE2 4.02Å; I254-F292 HydrophobicContact CG1-CZ 3.72Å
255	H	91.4	Very high	92.5	Very high	7 Å²	7	29.4 Å²	29.4	3%	0.032	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-60.7	-9.1	175.6	73.3	-90.3	0	0	0	114.3	E253 M257 R258 A284 I286	E253-H255 PolarHBondContact O-N 3.26Å; E253-H255 IonicContact OE2-CE1 3.58Å; E253-H255 PolarHBondContact OE2-CE1 3.48Å; E253-H255 VanDerWaalsContact OE2-CE1 3.31Å; E253-H255 IonicContact OE2-ND1 3.56Å; E253-H255 PolarHBondContact OE2-ND1 2.83Å; H255-M257 PolarHBondContact O-N 3.15Å; H255-R258 WeakPolarHBondContact O-CD 3.46Å; H255-R258 WeakPolarHBondContact O-CG 3.47Å; H255-R258 PolarHBondContact O-NE 3.42Å; H255-A284 PolarHBondContact ND1-N 3.25Å; H255-I286 HydrophobicContact CB-CG2 4.23Å
256	Y	89.4	Confident	92.8	Very high	23 Å²	23	24.2 Å²	24.2	9%	0.09	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-71.4	-11.7	169.8	-82.3	-123.7	0	0	0	113.5	P190 E253 I254 R258 D259 M487 Q519	P190-Y256 HydrophobicContact CB-CD1 3.61Å; P190-Y256 HydrophobicContact CB-CE1 4.01Å; P190-Y256 HydrophobicContact CB-CG 4Å; P190-Y256 HydrophobicContact CG-CD1 4.19Å; P190-Y256 HydrophobicContact CG-CE1 4.26Å; P190-Y256 HydrophobicContact CG-CG 4.36Å; E253-Y256 HydrophobicContact CB-CD2 4.05Å; E253-Y256 HydrophobicContact CB-CE2 4.13Å; E253-Y256 VanDerWaalsContact O-CD2 3.28Å; E253-Y256 WeakPolarHBondContact O-CD2 3.16Å; E253-Y256 PolarHBondContact O-N 3.45Å; I254-Y256 PolarHBondContact O-N 2.86Å; Y256-R258 PolarHBondContact O-N 3.29Å; Y256-D259 WeakPolarHBondContact O-CB 3.35Å; Y256-D259 PolarHBondContact O-N 2.99Å; Y256-M487 HydrophobicContact CE1-CE 3.95Å; Y256-M487 WeakPolarHBondContact OH-CA 3.43Å; Y256-M487 VanDerWaalsContact OH-CB 3.28Å; Y256-M487 WeakPolarHBondContact OH-CB 3.32Å; Y256-M487 PolarHBondContact OH-O 2.87Å; Y256-Q519 PolarHBondContact OH-NE2 3.02Å
257	M	93.6	Very high	92.8	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.121	C	C	.	.	G	3₁₀ helix	trans	-60.6	-14.6	174.8	-173.2	179.9	82	0	0	113.8	I254 H255 G263 W266 E267 F292 W295 L559 F589	I254-M257 VanDerWaalsContact O-CB 3.32Å; I254-M257 WeakPolarHBondContact O-CB 3.35Å; I254-M257 PolarHBondContact O-N 3.36Å; H255-M257 PolarHBondContact O-N 3.15Å; M257-G263 WeakPolarHBondContact O-CA 3.4Å; M257-W266 HydrophobicContact CB-CB 3.98Å; M257-W266 HydrophobicContact CB-CG 4.38Å; M257-W266 HydrophobicContact CG-CB 3.85Å; M257-W266 HydrophobicContact SD-CB 4.47Å; M257-E267 HydrophobicContact CE-CG 4.32Å; M257-E267 HydrophobicContact CG-CG 3.69Å; M257-E267 HydrophobicContact SD-CG 3.45Å; M257-E267 WeakPolarHBondContact SD-CG 3.12Å; M257-F292 HydrophobicContact CE-CD2 3.82Å; M257-F292 HydrophobicContact CE-CE2 3.69Å; M257-F292 HydrophobicContact SD-CE2 3.9Å; M257-W295 HydrophobicContact SD-CZ3 4.3Å; M257-L559 HydrophobicContact CB-CD1 4.04Å; M257-L559 HydrophobicContact CE-CD1 4.18Å; M257-L559 HydrophobicContact CE-CD2 4.12Å; M257-L559 HydrophobicContact CE-CG 3.98Å; M257-F589 HydrophobicContact CE-CB 4.41Å; M257-F589 HydrophobicContact CE-CD1 3.35Å; M257-F589 HydrophobicContact CE-CE1 3.77Å; M257-F589 HydrophobicContact CE-CG 4.07Å
258	R	90.6	Very high	92.8	Very high	74 Å²	74	23.5 Å²	23.5	28%	0.279	12%	0.116	S	C	.	.	G	3₁₀ helix	trans	-84.2	-1.5	172.1	76.5	-164	174.1	-172.4	-1.9	115.1	H255 Y256 D557 L559 N560	H255-R258 WeakPolarHBondContact O-CD 3.46Å; H255-R258 WeakPolarHBondContact O-CG 3.47Å; H255-R258 PolarHBondContact O-NE 3.42Å; Y256-R258 PolarHBondContact O-N 3.29Å; R258-D557 PolarHBondContact NH1-O 2.83Å; R258-L559 HydrophobicContact CB-CD1 4.2Å; R258-N560 VanDerWaalsContact CA-O 3.31Å; R258-N560 WeakPolarHBondContact CA-O 3.45Å; R258-N560 VanDerWaalsContact CB-O 3.28Å; R258-N560 WeakPolarHBondContact CB-O 3.31Å
259	D	89.1	Confident	92.7	Very high	57 Å²	57	23.4 Å²	23.4	31%	0.305	12%	0.116	S	C	.	.			trans	-68.6	131.9	177.6	-178.2	-83	0	0	0	111	Y256 E261 R262 G263 A562	Y256-D259 WeakPolarHBondContact O-CB 3.35Å; Y256-D259 PolarHBondContact O-N 2.99Å; D259-E261 PolarHBondContact O-N 3.44Å; D259-E261 PolarHBondContact OD1-N 2.77Å; D259-R262 PolarHBondContact OD1-N 2.86Å; D259-G263 WeakPolarHBondContact O-CA 3.43Å; D259-G263 PolarHBondContact O-N 2.84Å; D259-A562 WeakPolarHBondContact O-CB 3.49Å
260	S	84.6	Confident	92.6	Very high	98 Å²	98	23.4 Å²	23.4	69%	0.685	12%	0.116	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-24.7	-173	51.3	0	0	0	0	115.1	H564	S260-H564 PolarHBondContact O-NE2 2.95Å
261	E	83.1	Confident	92.5	Very high	110 Å²	110	23.8 Å²	23.8	51%	0.514	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94	-42.3	178.9	-171.5	175.8	-164.4	0	0	110.7	D259 Q915	D259-E261 PolarHBondContact O-N 3.44Å; D259-E261 PolarHBondContact OD1-N 2.77Å; E261-Q915 PolarHBondContact OE1-NE2 2.83Å
262	R	87.2	Confident	92.4	Very high	75 Å²	75	24.8 Å²	24.8	28%	0.283	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	-11.7	-169	-64.4	178.2	66.3	-145.2	2.6	114.9	P190 E230 D259 V264 V265	P190-R262 PolarHBondContact O-NH1 3.13Å; P190-R262 PolarHBondContact O-NH2 2.66Å; E230-R262 VanDerWaalsContact CD-NH2 3.35Å; E230-R262 IonicContact OE1-CZ 2.68Å; E230-R262 IonicContact OE1-NE 2.82Å; E230-R262 PolarHBondContact OE1-NE 3.02Å; E230-R262 IonicContact OE1-NH2 2.88Å; E230-R262 PolarHBondContact OE1-NH2 3.05Å; E230-R262 IonicContact OE2-NH2 2.67Å; E230-R262 PolarHBondContact OE2-NH2 3Å; D259-R262 PolarHBondContact OD1-N 2.86Å; R262-V264 VanDerWaalsContact C-N 3.28Å; R262-V264 PolarHBondContact O-N 3.08Å; R262-V265 VanDerWaalsContact O-CB 3.32Å; R262-V265 WeakPolarHBondContact O-CB 3.42Å; R262-V265 PolarHBondContact O-N 3.39Å
263	G	92.3	Very high	92.4	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-58.6	-38.4	-178.3	0	0	0	0	0	113.6	M257 D259 V265 W266 E267	M257-G263 WeakPolarHBondContact O-CA 3.4Å; D259-G263 WeakPolarHBondContact O-CA 3.43Å; D259-G263 PolarHBondContact O-N 2.84Å; G263-V265 PolarHBondContact O-N 3.29Å; G263-W266 WeakPolarHBondContact O-CB 3.33Å; G263-W266 PolarHBondContact O-N 3.01Å; G263-E267 PolarHBondContact O-N 3.2Å
264	V	94.3	Very high	92.5	Very high	4 Å²	4	25.9 Å²	25.9	2%	0.024	13%	0.132	C	C	.	.	H	α-helix	trans	-52.3	-38.2	173.4	63.5	0	0	0	0	113.2	R262 W266 E267 E268 F563 H564 M569	R262-V264 VanDerWaalsContact C-N 3.28Å; R262-V264 PolarHBondContact O-N 3.08Å; V264-W266 PolarHBondContact O-N 3.37Å; V264-E267 PolarHBondContact O-N 2.8Å; V264-E268 WeakPolarHBondContact O-CB 3.43Å; V264-E268 PolarHBondContact O-N 2.82Å; V264-F563 HydrophobicContact CG2-CD2 4.03Å; V264-F563 HydrophobicContact CG2-CE2 4.21Å; V264-F563 HydrophobicContact CG2-CG 4.44Å; V264-H564 WeakPolarHBondContact CG2-O 3.39Å; V264-M569 HydrophobicContact CG2-CE 3.38Å
265	V	94.1	Very high	92.5	Very high	11 Å²	11	29 Å²	29	7%	0.067	15%	0.149	C	C	.	.	H	α-helix	trans	-61.6	-34.1	-179.8	175.9	0	0	0	0	111.2	T229 E230 R233 R262 G263 T269	T229-V265 HydrophobicContact CG2-CG1 4.21Å; E230-V265 HydrophobicContact CG-CG1 4.11Å; R233-V265 HydrophobicContact CB-CG1 4.43Å; R262-V265 VanDerWaalsContact O-CB 3.32Å; R262-V265 WeakPolarHBondContact O-CB 3.42Å; R262-V265 PolarHBondContact O-N 3.39Å; G263-V265 PolarHBondContact O-N 3.29Å; V265-T269 VanDerWaalsContact O-CB 3.23Å; V265-T269 WeakPolarHBondContact O-CB 3.38Å; V265-T269 PolarHBondContact O-N 2.63Å; V265-T269 PolarHBondContact O-OG1 2.95Å
266	W	95.4	Very high	92.6	Very high	3 Å²	3	34.1 Å²	34.1	1%	0.011	18%	0.176	C	C	.	.	H	α-helix	trans	-72.9	-50	-179.7	-69.1	76.8	0	0	0	111.6	P190 T229 F251 D252 I254 M257 G263 V264 E268 T269 I270	P190-W266 HydrophobicContact CB-CZ2 3.81Å; T229-W266 HydrophobicContact CG2-CD2 3.95Å; T229-W266 HydrophobicContact CG2-CE3 4.2Å; T229-W266 HydrophobicContact CG2-CG 4.2Å; T229-W266 WeakPolarHBondContact OG1-CH2 3.41Å; T229-W266 WeakPolarHBondContact OG1-CZ2 3.28Å; F251-W266 HydrophobicContact CB-CZ3 4.05Å; F251-W266 AromaticContact CD1-CE3 3.74Å; F251-W266 HydrophobicContact CD1-CE3 3.74Å; F251-W266 AromaticContact CD1-CZ3 3.59Å; F251-W266 HydrophobicContact CD1-CZ3 3.59Å; F251-W266 HydrophobicContact CE1-CE3 4.34Å; F251-W266 HydrophobicContact CG-CZ3 4.29Å; D252-W266 VanDerWaalsContact O-CH2 3.3Å; D252-W266 WeakPolarHBondContact O-CH2 3.43Å; I254-W266 HydrophobicContact CD1-CD2 4.42Å; I254-W266 HydrophobicContact CD1-CE3 3.49Å; I254-W266 VanDerWaalsContact CD1-CE3 3.49Å; I254-W266 HydrophobicContact CD1-CZ3 4Å; M257-W266 HydrophobicContact CB-CB 3.98Å; M257-W266 HydrophobicContact CB-CG 4.38Å; M257-W266 HydrophobicContact CG-CB 3.85Å; M257-W266 HydrophobicContact SD-CB 4.47Å; G263-W266 WeakPolarHBondContact O-CB 3.33Å; G263-W266 PolarHBondContact O-N 3.01Å; V264-W266 PolarHBondContact O-N 3.37Å; W266-E268 PolarHBondContact O-N 2.99Å; W266-T269 PolarHBondContact O-N 3.02Å; W266-I270 WeakPolarHBondContact O-CD1 3.28Å; W266-I270 VanDerWaalsContact O-CG1 3.28Å; W266-I270 WeakPolarHBondContact O-CG1 3.42Å; W266-I270 PolarHBondContact O-N 2.9Å
267	E	95.9	Very high	92.9	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-59.2	-47.6	176.5	-71.1	-177.3	-129.1	0	0	111.5	M257 G263 V264 T269 I270 I271 W295 S561 A562 F563 F589 Y590	M257-E267 HydrophobicContact CE-CG 4.32Å; M257-E267 HydrophobicContact CG-CG 3.69Å; M257-E267 HydrophobicContact SD-CG 3.45Å; M257-E267 WeakPolarHBondContact SD-CG 3.12Å; G263-E267 PolarHBondContact O-N 3.2Å; V264-E267 PolarHBondContact O-N 2.8Å; E267-T269 VanDerWaalsContact C-N 3.34Å; E267-T269 PolarHBondContact O-N 2.78Å; E267-I270 PolarHBondContact O-N 2.82Å; E267-I271 HydrophobicContact CB-CD1 4.45Å; E267-I271 WeakPolarHBondContact O-CD1 3.21Å; E267-I271 VanDerWaalsContact O-CG1 3.24Å; E267-I271 WeakPolarHBondContact O-CG1 3.28Å; E267-I271 PolarHBondContact O-N 2.86Å; E267-W295 HydrophobicContact CB-CH2 4.45Å; E267-W295 HydrophobicContact CG-CH2 4.27Å; E267-S561 VanDerWaalsContact CD-OG 3.23Å; E267-S561 VanDerWaalsContact OE1-CA 3.31Å; E267-S561 WeakPolarHBondContact OE1-CA 3.38Å; E267-S561 WeakPolarHBondContact OE1-CB 3.29Å; E267-S561 PolarHBondContact OE1-OG 2.84Å; E267-S561 PolarHBondContact OE2-OG 2.86Å; E267-A562 PolarHBondContact OE1-N 3.46Å; E267-F563 HydrophobicContact CB-CD2 4.14Å; E267-F589 HydrophobicContact CG-CB 4.14Å; E267-F589 WeakPolarHBondContact OE2-CA 3.16Å; E267-F589 VanDerWaalsContact OE2-CB 3.27Å; E267-F589 WeakPolarHBondContact OE2-CB 3.31Å; E267-F589 PolarHBondContact OE2-N 2.53Å; E267-Y590 PolarHBondContact OE2-N 2.91Å
268	E	95	Very high	93.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-62.5	-39.5	180	-168.3	-175.1	148.7	0	0	111.9	R233 Y237 V264 W266 L272 M569 M584	R233-E268 IonicContact CZ-OE1 3.51Å; R233-E268 IonicContact CZ-OE2 3.58Å; R233-E268 VanDerWaalsContact CZ-OE2 3.3Å; R233-E268 IonicContact NE-OE1 2.69Å; R233-E268 PolarHBondContact NE-OE1 3.35Å; R233-E268 IonicContact NE-OE2 3.52Å; R233-E268 PolarHBondContact NE-OE2 2.84Å; R233-E268 IonicContact NH2-OE1 3.45Å; R233-E268 PolarHBondContact NH2-OE1 3.05Å; R233-E268 IonicContact NH2-OE2 2.74Å; R233-E268 PolarHBondContact NH2-OE2 3.42Å; Y237-E268 WeakPolarHBondContact CE2-OE1 3.38Å; Y237-E268 PolarHBondContact OH-OE1 3.04Å; V264-E268 WeakPolarHBondContact O-CB 3.43Å; V264-E268 PolarHBondContact O-N 2.82Å; W266-E268 PolarHBondContact O-N 2.99Å; E268-L272 HydrophobicContact CG-CD1 4.34Å; E268-L272 WeakPolarHBondContact O-CB 3.34Å; E268-L272 WeakPolarHBondContact O-CG 3.12Å; E268-L272 PolarHBondContact O-N 3.33Å; E268-L272 VanDerWaalsContact O-N 3.08Å; E268-M569 HydrophobicContact CG-CE 4.28Å; E268-M569 HydrophobicContact CG-CG 4.48Å; E268-M569 WeakPolarHBondContact OE2-CE 3.39Å; E268-M584 HydrophobicContact CB-SD 4.47Å; E268-M584 HydrophobicContact CG-CE 4.02Å; E268-M584 HydrophobicContact CG-SD 4.16Å
269	T	96.1	Very high	93.4	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64.2	-42.6	174.2	-61.1	0	0	0	0	111.7	T229 L232 L236 F251 V265 W266 E267 L272 L273	T229-T269 HydrophobicContact CG2-CG2 4.15Å; L232-T269 HydrophobicContact CB-CG2 4.11Å; L232-T269 HydrophobicContact CD2-CG2 3.62Å; L232-T269 HydrophobicContact CG-CG2 3.71Å; L236-T269 HydrophobicContact CD1-CG2 3.97Å; F251-T269 HydrophobicContact CE1-CG2 4.25Å; F251-T269 HydrophobicContact CZ-CG2 4.28Å; V265-T269 VanDerWaalsContact O-CB 3.23Å; V265-T269 WeakPolarHBondContact O-CB 3.38Å; V265-T269 PolarHBondContact O-N 2.63Å; V265-T269 PolarHBondContact O-OG1 2.95Å; W266-T269 PolarHBondContact O-N 3.02Å; E267-T269 VanDerWaalsContact C-N 3.34Å; E267-T269 PolarHBondContact O-N 2.78Å; T269-L272 PolarHBondContact O-N 3.11Å; T269-L273 WeakPolarHBondContact O-CG 3.38Å; T269-L273 PolarHBondContact O-N 2.96Å
270	I	97.1	Very high	93.9	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-65.8	-45.7	178.9	-67.6	164.2	0	0	0	110.4	F251 I254 W266 E267 L272 L273 F281 F292 W295 I296 L299 H300	F251-I270 HydrophobicContact CE1-CG1 4.15Å; F251-I270 HydrophobicContact CE2-CG1 3.94Å; F251-I270 HydrophobicContact CZ-CD1 4.44Å; F251-I270 HydrophobicContact CZ-CG1 3.6Å; I254-I270 HydrophobicContact CD1-CD1 4.09Å; W266-I270 WeakPolarHBondContact O-CD1 3.28Å; W266-I270 VanDerWaalsContact O-CG1 3.28Å; W266-I270 WeakPolarHBondContact O-CG1 3.42Å; W266-I270 PolarHBondContact O-N 2.9Å; E267-I270 PolarHBondContact O-N 2.82Å; I270-L272 PolarHBondContact O-N 2.77Å; I270-L273 WeakPolarHBondContact O-CB 3.16Å; I270-L273 PolarHBondContact O-N 3.43Å; I270-F281 HydrophobicContact CD1-CE1 3.89Å; I270-F281 HydrophobicContact CG1-CE1 4.37Å; I270-F292 HydrophobicContact CD1-CZ 4.35Å; I270-W295 HydrophobicContact CB-CH2 3.96Å; I270-W295 HydrophobicContact CD1-CH2 4.08Å; I270-W295 HydrophobicContact CD1-CZ3 4.02Å; I270-W295 HydrophobicContact CG2-CH2 3.68Å; I270-W295 HydrophobicContact CG2-CZ2 4.38Å; I270-W295 HydrophobicContact CG2-CZ3 4.05Å; I270-I296 HydrophobicContact CG2-CD1 3.64Å; I270-L299 HydrophobicContact CG2-CD2 3.77Å; I270-H300 PolarHBondContact O-CE1 3.15Å; I270-H300 PolarHBondContact O-NE2 3.06Å
271	I	95.8	Very high	94.5	Very high	8 Å²	8	24.3 Å²	24.3	4%	0.041	12%	0.122	C	C	.	.	H	α-helix	trans	-66.5	-26.1	179.9	-62.4	157.1	0	0	0	112.6	E267 W295 L299 Y583 M584 K587	E267-I271 HydrophobicContact CB-CD1 4.45Å; E267-I271 WeakPolarHBondContact O-CD1 3.21Å; E267-I271 VanDerWaalsContact O-CG1 3.24Å; E267-I271 WeakPolarHBondContact O-CG1 3.28Å; E267-I271 PolarHBondContact O-N 2.86Å; I271-W295 HydrophobicContact CD1-CZ2 4.12Å; I271-W295 HydrophobicContact CG1-CZ2 3.92Å; I271-L299 HydrophobicContact CG1-CD1 4.24Å; I271-L299 HydrophobicContact CG1-CD2 3.87Å; I271-L299 HydrophobicContact CG2-CD1 4.4Å; I271-Y583 HydrophobicContact CG2-CD1 4.46Å; I271-Y583 HydrophobicContact CG2-CE1 4Å; I271-M584 HydrophobicContact CB-CE 4.07Å; I271-M584 HydrophobicContact CB-SD 3.73Å; I271-M584 HydrophobicContact CD1-SD 3.59Å; I271-M584 VanDerWaalsContact CD1-SD 3.59Å; I271-M584 HydrophobicContact CG1-SD 4.28Å; I271-M584 HydrophobicContact CG2-CE 3.75Å; I271-M584 HydrophobicContact CG2-SD 3.58Å; I271-M584 VanDerWaalsContact CG2-SD 3.58Å; I271-K587 HydrophobicContact CG1-CB 4.36Å; I271-K587 HydrophobicContact CG2-CB 3.86Å
272	L	94.4	Very high	95.1	Very high	20 Å²	20	19 Å²	19	11%	0.105	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-9.6	173.4	-69.8	174.4	0	0	0	113.9	L236 Y237 E268 T269 I270 L573 I579 M584	L236-L272 HydrophobicContact CB-CB 4.18Å; L236-L272 HydrophobicContact CB-CD1 4.33Å; L236-L272 HydrophobicContact CD1-CB 3.86Å; L236-L272 HydrophobicContact CG-CB 4.47Å; Y237-L272 HydrophobicContact CD1-CD1 3.89Å; Y237-L272 HydrophobicContact CE1-CD1 3.68Å; Y237-L272 HydrophobicContact CE1-CD2 4.26Å; Y237-L272 HydrophobicContact CE2-CD1 4.44Å; Y237-L272 HydrophobicContact CG-CD1 4.36Å; E268-L272 HydrophobicContact CG-CD1 4.34Å; E268-L272 WeakPolarHBondContact O-CB 3.34Å; E268-L272 WeakPolarHBondContact O-CG 3.12Å; E268-L272 PolarHBondContact O-N 3.33Å; E268-L272 VanDerWaalsContact O-N 3.08Å; T269-L272 PolarHBondContact O-N 3.11Å; I270-L272 PolarHBondContact O-N 2.77Å; L272-L573 HydrophobicContact CD2-CD2 4.36Å; L272-I579 HydrophobicContact CD2-CD1 3.76Å; L272-M584 HydrophobicContact CD2-CE 3.95Å; L272-M584 HydrophobicContact CG-CE 3.92Å
273	L	95.4	Very high	95.4	Very high	5 Å²	5	15.5 Å²	15.5	3%	0.026	8%	0.084	C	C	.	.	S	Bend	trans	-76.3	137.9	178.4	-82.1	168.1	0	0	0	111.5	L236 M243 V249 F251 T269 I270 Y279 H300	L236-L273 HydrophobicContact CD1-CD2 4.28Å; L236-L273 HydrophobicContact CD1-CG 4.23Å; L236-L273 HydrophobicContact CD2-CD2 4.2Å; M243-L273 HydrophobicContact CE-CD2 3.46Å; M243-L273 VanDerWaalsContact CE-CD2 3.46Å; V249-L273 HydrophobicContact CB-CD1 4.3Å; V249-L273 HydrophobicContact CG1-CD1 4.18Å; V249-L273 HydrophobicContact CG2-CD1 4.22Å; V249-L273 HydrophobicContact CG2-CD2 4.03Å; F251-L273 HydrophobicContact CE2-CD1 3.85Å; F251-L273 HydrophobicContact CZ-CD1 3.62Å; T269-L273 WeakPolarHBondContact O-CG 3.38Å; T269-L273 PolarHBondContact O-N 2.96Å; I270-L273 WeakPolarHBondContact O-CB 3.16Å; I270-L273 PolarHBondContact O-N 3.43Å; L273-Y279 HydrophobicContact CB-CE1 4.19Å; L273-Y279 HydrophobicContact CD1-CD1 4.38Å; L273-Y279 HydrophobicContact CD1-CE1 3.92Å; L273-H300 PolarHBondContact O-CE1 2.87Å
274	P	93.4	Very high	95.3	Very high	49 Å²	49	16.5 Å²	16.5	32%	0.318	9%	0.092	S	C	.	.			trans	-63.5	143.3	176.8	-23.8	34.5	0	0	0	113.5	N276 V277 Y279	P274-N276 VanDerWaalsContact CB-OD1 3.26Å; P274-N276 WeakPolarHBondContact CB-OD1 3.25Å; P274-N276 PolarHBondContact O-N 2.91Å; P274-V277 HydrophobicContact CB-CG2 4.29Å; P274-V277 WeakPolarHBondContact O-CB 3.3Å; P274-V277 PolarHBondContact O-N 3.46Å; P274-V277 VanDerWaalsContact O-N 3.07Å; P274-Y279 PolarHBondContact O-OH 2.86Å; P274-Y279 VanDerWaalsContact O-OH 3.12Å
275	D	93.8	Very high	95.1	Very high	64 Å²	64	16.6 Å²	16.6	34%	0.342	9%	0.093	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-18.6	179	-70.2	-3.5	0	0	0	114.3	V277 H300 K301 Q302	D275-V277 VanDerWaalsContact C-N 3.29Å; D275-V277 PolarHBondContact O-N 3.48Å; D275-H300 WeakPolarHBondContact OD1-CA 3.47Å; D275-H300 IonicContact OD1-CG 3.34Å; D275-H300 IonicContact OD1-ND1 2.78Å; D275-H300 PolarHBondContact OD1-ND1 2.76Å; D275-K301 IonicContact OD2-NZ 3.5Å; D275-K301 PolarHBondContact OD2-NZ 3.09Å; D275-Q302 PolarHBondContact O-NE2 2.67Å; D275-Q302 VanDerWaalsContact O-NE2 3.16Å
276	N	93.6	Very high	95	Very high	115 Å²	115	16.1 Å²	16.1	62%	0.615	9%	0.09	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.5	1.1	178	75.4	-93.3	0	0	0	114.3	P274	P274-N276 VanDerWaalsContact CB-OD1 3.26Å; P274-N276 WeakPolarHBondContact CB-OD1 3.25Å; P274-N276 PolarHBondContact O-N 2.91Å
277	V	96.1	Very high	94.9	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.112	C	C	.	.			trans	-95.8	140.6	178.1	179.8	0	0	0	0	108.9	V246 V249 P274 D275 Y279 Q302	V246-V277 HydrophobicContact CG1-CG1 4.42Å; V249-V277 HydrophobicContact CB-CG1 4.28Å; V249-V277 HydrophobicContact CG2-CG1 3.71Å; P274-V277 HydrophobicContact CB-CG2 4.29Å; P274-V277 WeakPolarHBondContact O-CB 3.3Å; P274-V277 PolarHBondContact O-N 3.46Å; P274-V277 VanDerWaalsContact O-N 3.07Å; D275-V277 VanDerWaalsContact C-N 3.29Å; D275-V277 PolarHBondContact O-N 3.48Å; V277-Y279 HydrophobicContact CB-CE1 3.89Å; V277-Y279 HydrophobicContact CG1-CD1 4.16Å; V277-Y279 HydrophobicContact CG1-CE1 3.68Å; V277-Y279 WeakPolarHBondContact O-CE2 3.27Å; V277-Y279 PolarHBondContact O-OH 3.46Å; V277-Q302 PolarHBondContact O-NE2 2.96Å
278	H	97.7	Very high	94.8	Very high	46 Å²	46	20.5 Å²	20.5	21%	0.213	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	154	172.6	-58.5	-54.3	0	0	0	111.4	N154 A247 W248 V249 Q302	N154-H278 PolarHBondContact O-CE1 3.41Å; A247-H278 PolarHBondContact O-N 2.86Å; W248-H278 WeakPolarHBondContact CA-O 3.27Å; W248-H278 HydrophobicContact CD2-CB 3.83Å; W248-H278 HydrophobicContact CE3-CB 3.53Å; W248-H278 HydrophobicContact CH2-CB 3.69Å; W248-H278 HydrophobicContact CZ2-CB 3.98Å; W248-H278 HydrophobicContact CZ3-CB 3.46Å; W248-H278 VanDerWaalsContact CZ3-CB 3.46Å; V249-H278 PolarHBondContact N-O 3.47Å; H278-Q302 PolarHBondContact ND1-OE1 2.88Å
279	Y	98.1	Very high	94.9	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	138.4	-168.4	-42.8	-64.8	0	0	0	112.4	S156 V157 V249 F251 L273 P274 V277 F281 I296 H300	S156-Y279 CarbonylContact C-O 3.49Å; S156-Y279 VanDerWaalsContact CA-O 3.32Å; S156-Y279 WeakPolarHBondContact CA-O 3.46Å; S156-Y279 WeakPolarHBondContact OG-CD2 3.36Å; S156-Y279 PolarHBondContact OG-N 3.15Å; V157-Y279 PolarHBondContact N-O 2.69Å; V249-Y279 HydrophobicContact CB-CD1 4.35Å; V249-Y279 VanDerWaalsContact O-CA 3.32Å; V249-Y279 WeakPolarHBondContact O-CA 3.39Å; F251-Y279 HydrophobicContact CE2-CD1 4.35Å; L273-Y279 HydrophobicContact CB-CE1 4.19Å; L273-Y279 HydrophobicContact CD1-CD1 4.38Å; L273-Y279 HydrophobicContact CD1-CE1 3.92Å; P274-Y279 PolarHBondContact O-OH 2.86Å; P274-Y279 VanDerWaalsContact O-OH 3.12Å; V277-Y279 HydrophobicContact CB-CE1 3.89Å; V277-Y279 HydrophobicContact CG1-CD1 4.16Å; V277-Y279 HydrophobicContact CG1-CE1 3.68Å; V277-Y279 WeakPolarHBondContact O-CE2 3.27Å; V277-Y279 PolarHBondContact O-OH 3.46Å; Y279-F281 HydrophobicContact CD2-CE2 4.17Å; Y279-F281 HydrophobicContact CD2-CZ 4.17Å; Y279-F281 AromaticContact CG-CE2 3.98Å; Y279-F281 HydrophobicContact CG-CE2 3.98Å; Y279-F281 AromaticContact CG-CZ 3.85Å; Y279-F281 HydrophobicContact CG-CZ 3.85Å; Y279-I296 HydrophobicContact CD2-CG2 3.97Å; Y279-I296 HydrophobicContact CE2-CG2 4.31Å; Y279-H300 HydrophobicContact CE2-CB 4.26Å; Y279-H300 AromaticContact CE2-CD2 3.42Å; Y279-H300 VanDerWaalsContact CE2-CD2 3.42Å; Y279-H300 WeakPolarHBondContact CE2-CD2 3.49Å; Y279-H300 AromaticContact CE2-CG 3.87Å; Y279-H300 AromaticContact CE2-NE2 3.99Å; Y279-H300 AromaticContact CZ-CD2 3.71Å; Y279-H300 AromaticContact CZ-NE2 3.86Å; Y279-H300 PolarHBondContact OH-CD2 3Å; Y279-H300 PolarHBondContact OH-CE1 3.05Å; Y279-H300 PolarHBondContact OH-ND1 3.16Å; Y279-H300 PolarHBondContact OH-NE2 3.09Å
280	V	98.4	Very high	94.9	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	106.5	166.2	180	0	0	0	0	108.5	V151 V157 A174 W248 V249 I250 F251 L282	V151-V280 HydrophobicContact CG2-CG2 4.02Å; V157-V280 HydrophobicContact CG1-CG1 4.41Å; V157-V280 HydrophobicContact CG1-CG2 4.19Å; V157-V280 WeakPolarHBondContact O-CA 3.37Å; A174-V280 HydrophobicContact CB-CG2 3.91Å; W248-V280 HydrophobicContact CE3-CG2 3.86Å; W248-V280 HydrophobicContact CZ3-CG2 3.78Å; V249-V280 PolarHBondContact O-N 3.28Å; I250-V280 CarbonylContact C-O 3.54Å; I250-V280 WeakPolarHBondContact CA-O 3.48Å; I250-V280 HydrophobicContact CG1-CB 4.25Å; I250-V280 HydrophobicContact CG2-CB 4.35Å; F251-V280 PolarHBondContact N-O 3.26Å; V280-L282 HydrophobicContact CG1-CD2 3.76Å
281	F	98.3	Very high	94.8	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	117.8	177.7	-56.7	-84.1	0	0	0	109.5	V157 L158 V159 F251 I254 I270 Y279 F292 I296	V157-F281 PolarHBondContact O-N 3.01Å; L158-F281 WeakPolarHBondContact CA-O 3.46Å; L158-F281 HydrophobicContact CB-CB 4.35Å; L158-F281 HydrophobicContact CD1-CB 3.7Å; V159-F281 PolarHBondContact N-O 3.37Å; F251-F281 HydrophobicContact CB-CD1 3.66Å; F251-F281 HydrophobicContact CB-CE1 4.21Å; F251-F281 AromaticContact CD2-CD1 3.63Å; F251-F281 HydrophobicContact CD2-CD1 3.63Å; F251-F281 AromaticContact CD2-CE1 3.29Å; F251-F281 HydrophobicContact CD2-CE1 3.29Å; F251-F281 HydrophobicContact CD2-CZ 4.13Å; F251-F281 AromaticContact CE2-CE1 3.8Å; F251-F281 HydrophobicContact CE2-CE1 3.8Å; F251-F281 HydrophobicContact CE2-CZ 4.39Å; F251-F281 AromaticContact CG-CD1 3.92Å; F251-F281 HydrophobicContact CG-CD1 3.92Å; F251-F281 AromaticContact CG-CE1 3.95Å; F251-F281 HydrophobicContact CG-CE1 3.95Å; I254-F281 HydrophobicContact CB-CB 4.44Å; I254-F281 HydrophobicContact CB-CD1 4.42Å; I254-F281 HydrophobicContact CD1-CD1 4.04Å; I254-F281 HydrophobicContact CD1-CE1 4.43Å; I254-F281 HydrophobicContact CG1-CD1 3.87Å; I254-F281 HydrophobicContact CG2-CB 4.17Å; I270-F281 HydrophobicContact CD1-CE1 3.89Å; I270-F281 HydrophobicContact CG1-CE1 4.37Å; Y279-F281 HydrophobicContact CD2-CE2 4.17Å; Y279-F281 HydrophobicContact CD2-CZ 4.17Å; Y279-F281 AromaticContact CG-CE2 3.98Å; Y279-F281 HydrophobicContact CG-CE2 3.98Å; Y279-F281 AromaticContact CG-CZ 3.85Å; Y279-F281 HydrophobicContact CG-CZ 3.85Å; F281-F292 HydrophobicContact CB-CE1 4.39Å; F281-F292 AromaticContact CD1-CE1 3.82Å; F281-F292 HydrophobicContact CD1-CE1 3.82Å; F281-F292 AromaticContact CD1-CZ 3.76Å; F281-F292 HydrophobicContact CD1-CZ 3.76Å; F281-F292 AromaticContact CD2-CE1 3.82Å; F281-F292 HydrophobicContact CD2-CE1 3.82Å; F281-F292 AromaticContact CE1-CE1 3.96Å; F281-F292 HydrophobicContact CE1-CE1 3.96Å; F281-F292 AromaticContact CE1-CZ 3.73Å; F281-F292 HydrophobicContact CE1-CZ 3.73Å; F281-F292 AromaticContact CE2-CE1 3.94Å; F281-F292 HydrophobicContact CE2-CE1 3.94Å; F281-F292 HydrophobicContact CE2-CZ 4.49Å; F281-F292 AromaticContact CG-CE1 3.75Å; F281-F292 HydrophobicContact CG-CE1 3.75Å; F281-F292 HydrophobicContact CG-CZ 4.19Å; F281-F292 HydrophobicContact CZ-CE1 4.03Å; F281-F292 HydrophobicContact CZ-CZ 4.12Å; F281-I296 HydrophobicContact CE1-CD1 4.29Å; F281-I296 HydrophobicContact CE2-CD1 4.03Å; F281-I296 HydrophobicContact CE2-CG1 3.85Å; F281-I296 HydrophobicContact CE2-CG2 4.16Å; F281-I296 HydrophobicContact CZ-CD1 3.53Å; F281-I296 HydrophobicContact CZ-CG1 3.89Å; F281-I296 HydrophobicContact CZ-CG2 4.49Å
282	L	95.9	Very high	94.9	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	123.7	173.7	-51.8	-173	0	0	0	108.9	V159 K167 C170 A171 F251 E253 I254 V280	V159-L282 HydrophobicContact CB-CD2 4.14Å; V159-L282 HydrophobicContact CG2-CD2 4.33Å; K167-L282 HydrophobicContact CB-CB 4.38Å; K167-L282 HydrophobicContact CB-CD1 4.11Å; K167-L282 HydrophobicContact CB-CD2 4.25Å; K167-L282 HydrophobicContact CB-CG 4.49Å; K167-L282 HydrophobicContact CD-CB 4.33Å; C170-L282 HydrophobicContact CB-CD2 4.35Å; A171-L282 HydrophobicContact CB-CD1 4.03Å; F251-L282 PolarHBondContact O-N 3.16Å; E253-L282 CarbonylContact C-O 3.57Å; E253-L282 WeakPolarHBondContact CA-O 3.13Å; E253-L282 PolarHBondContact N-O 2.84Å; I254-L282 WeakPolarHBondContact CG2-O 3.26Å; I254-L282 PolarHBondContact N-O 3.02Å; V280-L282 HydrophobicContact CG1-CD2 3.76Å
283	S	93.3	Very high	95	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	157.5	-173.6	-163.1	0	0	0	0	112.1	V159 A161 K167	V159-S283 PolarHBondContact O-N 2.93Å; A161-S283 PolarHBondContact N-O 3.11Å; A161-S283 VanDerWaalsContact N-O 3.16Å; K167-S283 WeakPolarHBondContact CD-O 3.29Å; K167-S283 WeakPolarHBondContact CE-O 3.37Å; K167-S283 PolarHBondContact NZ-O 3.2Å
284	A	89.4	Confident	95.1	Very high	21 Å²	21	27.8 Å²	27.8	17%	0.174	15%	0.147	C	C	.	.			trans	-61.2	171.1	158.4	0	0	0	0	0	110.2	S160 A161 H255 I286	S160-A284 PolarHBondContact OG-O 2.81Å; A161-A284 CarbonylContact O-C 3.56Å; A161-A284 WeakPolarHBondContact O-CA 3.23Å; H255-A284 PolarHBondContact ND1-N 3.25Å; A284-I286 PolarHBondContact O-N 3.35Å; A284-I286 VanDerWaalsContact O-N 3.14Å
285	T	89.8	Confident	95.3	Very high	6 Å²	6	25.6 Å²	25.6	4%	0.037	13%	0.132	C	C	.	.			trans	-57.5	113.5	163.8	44	0	0	0	0	109	S160 H162 A556	S160-T285 WeakPolarHBondContact OG-CA 3.36Å; H162-T285 PolarHBondContact ND1-OG1 3.31Å; T285-A556 WeakPolarHBondContact O-CB 3.43Å
286	I	93.1	Very high	95.4	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.01	12%	0.116	C	C	.	.			trans	-126.6	132.7	179.1	52.4	166.8	0	0	0	111	S160 H255 A284 N288 A289 L559	S160-I286 WeakPolarHBondContact OG-CG1 3.38Å; S160-I286 PolarHBondContact OG-N 2.99Å; H255-I286 HydrophobicContact CB-CG2 4.23Å; A284-I286 PolarHBondContact O-N 3.35Å; A284-I286 VanDerWaalsContact O-N 3.14Å; I286-N288 VanDerWaalsContact C-N 3.28Å; I286-N288 PolarHBondContact O-N 3.04Å; I286-A289 HydrophobicContact CD1-CB 4.42Å; I286-A289 HydrophobicContact CG1-CB 4.09Å; I286-A289 PolarHBondContact O-N 3.17Å; I286-L559 HydrophobicContact CD1-CB 3.77Å; I286-L559 HydrophobicContact CD1-CD2 3.65Å; I286-L559 HydrophobicContact CD1-CG 4.37Å; I286-L559 HydrophobicContact CG2-CB 4.43Å
287	P	92.3	Very high	95.6	Very high	71 Å²	71	17.1 Å²	17.1	46%	0.461	9%	0.087	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-19.5	-170.2	28.2	-37.1	0	0	0	114.4	A556 P558	P287-A556 WeakPolarHBondContact CD-O 3.44Å; P287-A556 WeakPolarHBondContact CG-O 3.25Å; P287-P558 HydrophobicContact CG-CB 4.21Å; P287-P558 HydrophobicContact CG-CG 3.94Å
288	N	94.8	Very high	95.5	Very high	24 Å²	24	20.1 Å²	20.1	13%	0.128	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	28.2	-179.1	67.5	-40.6	0	0	0	113.2	I286 R290 Q291 F292 L559	I286-N288 VanDerWaalsContact C-N 3.28Å; I286-N288 PolarHBondContact O-N 3.04Å; N288-R290 PolarHBondContact O-N 2.86Å; N288-R290 VanDerWaalsContact O-N 3.16Å; N288-Q291 HydrophobicContact CB-CB 4.19Å; N288-Q291 PolarHBondContact ND2-OE1 2.73Å; N288-Q291 VanDerWaalsContact O-CB 3.32Å; N288-Q291 WeakPolarHBondContact O-CB 3.3Å; N288-Q291 PolarHBondContact O-N 2.85Å; N288-F292 PolarHBondContact O-N 3.16Å; N288-L559 PolarHBondContact ND2-O 3.12Å; N288-L559 PolarHBondContact OD1-N 2.77Å
289	A	95.7	Very high	95.3	Very high	5 Å²	5	18 Å²	18	4%	0.041	9%	0.091	C	C	.	.	H	α-helix	trans	-47.7	-43.2	178.3	0	0	0	0	0	113.6	L158 I286 Q291 F292 A293 V306	L158-A289 HydrophobicContact CD2-CB 3.81Å; L158-A289 WeakPolarHBondContact CD2-O 3.49Å; I286-A289 HydrophobicContact CD1-CB 4.42Å; I286-A289 HydrophobicContact CG1-CB 4.09Å; I286-A289 PolarHBondContact O-N 3.17Å; A289-Q291 PolarHBondContact O-N 3.26Å; A289-F292 PolarHBondContact O-N 2.69Å; A289-A293 PolarHBondContact O-N 2.98Å; A289-V306 HydrophobicContact CB-CG1 3.63Å
290	R	96.1	Very high	95.2	Very high	119 Å²	119	18.2 Å²	18.2	45%	0.449	9%	0.092	S	C	.	.	H	α-helix	trans	-55.6	-45	174	-178.8	172.6	56.6	-131.8	3.3	113.2	V101 E113 N288 F292 A293 E294	V101-R290 HydrophobicContact CG1-CG 4.22Å; V101-R290 HydrophobicContact CG2-CG 4.07Å; E113-R290 IonicContact OE1-CZ 3.35Å; E113-R290 IonicContact OE1-NH1 2.65Å; E113-R290 PolarHBondContact OE1-NH1 3.43Å; E113-R290 WeakPolarHBondContact OE2-CB 3.36Å; E113-R290 WeakPolarHBondContact OE2-CD 3.48Å; E113-R290 IonicContact OE2-NH1 2.73Å; E113-R290 PolarHBondContact OE2-NH1 3.01Å; N288-R290 PolarHBondContact O-N 2.86Å; N288-R290 VanDerWaalsContact O-N 3.16Å; R290-F292 VanDerWaalsContact C-N 3.26Å; R290-F292 PolarHBondContact O-N 2.83Å; R290-A293 PolarHBondContact O-N 2.85Å; R290-E294 HydrophobicContact CG-CG 4.3Å; R290-E294 WeakPolarHBondContact CG-OE1 3.38Å; R290-E294 WeakPolarHBondContact O-CG 3.11Å; R290-E294 PolarHBondContact O-N 2.83Å
291	Q	96.1	Very high	95	Very high	42 Å²	42	24.1 Å²	24.1	20%	0.196	12%	0.118	C	C	.	.	H	α-helix	trans	-61.7	-35.5	-179.2	-168.9	-174	35	0	0	111.8	N288 A289 W295 F589 F592	N288-Q291 HydrophobicContact CB-CB 4.19Å; N288-Q291 PolarHBondContact ND2-OE1 2.73Å; N288-Q291 VanDerWaalsContact O-CB 3.32Å; N288-Q291 WeakPolarHBondContact O-CB 3.3Å; N288-Q291 PolarHBondContact O-N 2.85Å; A289-Q291 PolarHBondContact O-N 3.26Å; Q291-W295 PolarHBondContact O-N 3.5Å; Q291-F589 HydrophobicContact CG-CE2 4.2Å; Q291-F589 HydrophobicContact CG-CZ 4.3Å; Q291-F592 HydrophobicContact CG-CD1 4.47Å; Q291-F592 HydrophobicContact CG-CE1 4.03Å; Q291-F592 WeakPolarHBondContact O-CE1 3.19Å
292	F	97.3	Very high	94.9	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-69	-46.7	175.4	-179	-88.1	0	0	0	111.7	L158 I254 M257 I270 F281 N288 A289 R290 E294 W295 I296 L559 F589	L158-F292 HydrophobicContact CD2-CB 4.43Å; L158-F292 HydrophobicContact CD2-CD1 4Å; I254-F292 HydrophobicContact CD1-CE2 4.37Å; I254-F292 HydrophobicContact CD1-CZ 4.11Å; I254-F292 HydrophobicContact CG1-CE1 4.47Å; I254-F292 HydrophobicContact CG1-CE2 4.02Å; I254-F292 HydrophobicContact CG1-CZ 3.72Å; M257-F292 HydrophobicContact CE-CD2 3.82Å; M257-F292 HydrophobicContact CE-CE2 3.69Å; M257-F292 HydrophobicContact SD-CE2 3.9Å; I270-F292 HydrophobicContact CD1-CZ 4.35Å; F281-F292 HydrophobicContact CB-CE1 4.39Å; F281-F292 AromaticContact CD1-CE1 3.82Å; F281-F292 HydrophobicContact CD1-CE1 3.82Å; F281-F292 AromaticContact CD1-CZ 3.76Å; F281-F292 HydrophobicContact CD1-CZ 3.76Å; F281-F292 AromaticContact CD2-CE1 3.82Å; F281-F292 HydrophobicContact CD2-CE1 3.82Å; F281-F292 AromaticContact CE1-CE1 3.96Å; F281-F292 HydrophobicContact CE1-CE1 3.96Å; F281-F292 AromaticContact CE1-CZ 3.73Å; F281-F292 HydrophobicContact CE1-CZ 3.73Å; F281-F292 AromaticContact CE2-CE1 3.94Å; F281-F292 HydrophobicContact CE2-CE1 3.94Å; F281-F292 HydrophobicContact CE2-CZ 4.49Å; F281-F292 AromaticContact CG-CE1 3.75Å; F281-F292 HydrophobicContact CG-CE1 3.75Å; F281-F292 HydrophobicContact CG-CZ 4.19Å; F281-F292 HydrophobicContact CZ-CE1 4.03Å; F281-F292 HydrophobicContact CZ-CZ 4.12Å; N288-F292 PolarHBondContact O-N 3.16Å; A289-F292 PolarHBondContact O-N 2.69Å; R290-F292 VanDerWaalsContact C-N 3.26Å; R290-F292 PolarHBondContact O-N 2.83Å; F292-E294 VanDerWaalsContact C-N 3.32Å; F292-E294 PolarHBondContact O-N 3.16Å; F292-W295 HydrophobicContact CD2-CE3 4.05Å; F292-W295 HydrophobicContact CD2-CZ3 4.27Å; F292-W295 AromaticContact CE2-CE3 3.89Å; F292-W295 HydrophobicContact CE2-CE3 3.89Å; F292-W295 AromaticContact CE2-CZ3 3.66Å; F292-W295 HydrophobicContact CE2-CZ3 3.66Å; F292-W295 HydrophobicContact CZ-CE3 4.41Å; F292-W295 HydrophobicContact CZ-CZ3 4.13Å; F292-W295 WeakPolarHBondContact O-CB 3.37Å; F292-W295 PolarHBondContact O-N 2.92Å; F292-W295 VanDerWaalsContact O-N 3.08Å; F292-I296 HydrophobicContact CD1-CG1 4.01Å; F292-I296 HydrophobicContact CE1-CD1 4.03Å; F292-I296 HydrophobicContact CE1-CG1 3.59Å; F292-I296 HydrophobicContact CZ-CD1 3.94Å; F292-I296 HydrophobicContact CZ-CG1 4.03Å; F292-I296 WeakPolarHBondContact O-CG1 3.23Å; F292-I296 PolarHBondContact O-N 2.84Å; F292-L559 HydrophobicContact CD2-CD2 3.77Å; F292-L559 HydrophobicContact CE2-CD2 4.25Å; F292-L559 HydrophobicContact CG-CD2 4.31Å; F292-F589 HydrophobicContact CB-CZ 4.46Å
293	A	97.3	Very high	94.9	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.008	13%	0.127	C	C	.	.	H	α-helix	trans	-64	-36.3	177.4	0	0	0	0	0	112.8	A115 A289 R290 W295 I296 C297 C304 V306	A115-A293 HydrophobicContact CB-CB 4.24Å; A289-A293 PolarHBondContact O-N 2.98Å; R290-A293 PolarHBondContact O-N 2.85Å; A293-W295 VanDerWaalsContact C-N 3.3Å; A293-W295 PolarHBondContact O-N 3.45Å; A293-I296 PolarHBondContact O-N 3.37Å; A293-C297 VanDerWaalsContact O-CB 3.3Å; A293-C297 WeakPolarHBondContact O-CB 3.49Å; A293-C297 PolarHBondContact O-N 2.68Å; A293-C304 HydrophobicContact CB-CB 4.12Å; A293-V306 HydrophobicContact CB-CG2 3.3Å
294	E	96.6	Very high	95.1	Very high	19 Å²	19	25.8 Å²	25.8	9%	0.089	13%	0.127	C	C	.	.	H	α-helix	trans	-61.6	-36.5	171.5	-68.2	173.2	-159.1	0	0	112.6	V99 V101 A115 R290 F292 H298 F592 R596	V99-E294 HydrophobicContact CG1-CB 4.1Å; V99-E294 HydrophobicContact CG1-CG 4.06Å; V101-E294 HydrophobicContact CG2-CG 3.59Å; A115-E294 HydrophobicContact CB-CG 4.24Å; R290-E294 HydrophobicContact CG-CG 4.3Å; R290-E294 WeakPolarHBondContact CG-OE1 3.38Å; R290-E294 WeakPolarHBondContact O-CG 3.11Å; R290-E294 PolarHBondContact O-N 2.83Å; F292-E294 VanDerWaalsContact C-N 3.32Å; F292-E294 PolarHBondContact O-N 3.16Å; E294-H298 WeakPolarHBondContact O-CB 3.36Å; E294-H298 PolarHBondContact O-N 3.06Å; E294-F592 HydrophobicContact CB-CE1 4.27Å; E294-F592 HydrophobicContact CB-CZ 3.65Å; E294-R596 IonicContact OE2-CZ 2.66Å; E294-R596 IonicContact OE2-NE 2.87Å; E294-R596 PolarHBondContact OE2-NE 2.8Å; E294-R596 IonicContact OE2-NH2 3.73Å; E294-R596 PolarHBondContact OE2-NH2 2.85Å
295	W	96.9	Very high	95.5	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.008	12%	0.119	C	C	.	.	H	α-helix	trans	-68.1	-48.3	175.4	169.8	63.9	0	0	0	112	M257 E267 I270 I271 Q291 F292 A293 C297 H298 L299 K587 F589 F592	M257-W295 HydrophobicContact SD-CZ3 4.3Å; E267-W295 HydrophobicContact CB-CH2 4.45Å; E267-W295 HydrophobicContact CG-CH2 4.27Å; I270-W295 HydrophobicContact CB-CH2 3.96Å; I270-W295 HydrophobicContact CD1-CH2 4.08Å; I270-W295 HydrophobicContact CD1-CZ3 4.02Å; I270-W295 HydrophobicContact CG2-CH2 3.68Å; I270-W295 HydrophobicContact CG2-CZ2 4.38Å; I270-W295 HydrophobicContact CG2-CZ3 4.05Å; I271-W295 HydrophobicContact CD1-CZ2 4.12Å; I271-W295 HydrophobicContact CG1-CZ2 3.92Å; Q291-W295 PolarHBondContact O-N 3.5Å; F292-W295 HydrophobicContact CD2-CE3 4.05Å; F292-W295 HydrophobicContact CD2-CZ3 4.27Å; F292-W295 AromaticContact CE2-CE3 3.89Å; F292-W295 HydrophobicContact CE2-CE3 3.89Å; F292-W295 AromaticContact CE2-CZ3 3.66Å; F292-W295 HydrophobicContact CE2-CZ3 3.66Å; F292-W295 HydrophobicContact CZ-CE3 4.41Å; F292-W295 HydrophobicContact CZ-CZ3 4.13Å; F292-W295 WeakPolarHBondContact O-CB 3.37Å; F292-W295 PolarHBondContact O-N 2.92Å; F292-W295 VanDerWaalsContact O-N 3.08Å; A293-W295 VanDerWaalsContact C-N 3.3Å; A293-W295 PolarHBondContact O-N 3.45Å; W295-C297 VanDerWaalsContact C-N 3.26Å; W295-C297 PolarHBondContact O-N 3.29Å; W295-H298 PolarHBondContact O-N 2.89Å; W295-H298 VanDerWaalsContact O-N 3.13Å; W295-L299 HydrophobicContact CH2-CD2 4.41Å; W295-L299 HydrophobicContact CZ2-CD2 3.84Å; W295-L299 VanDerWaalsContact O-CB 3.23Å; W295-L299 WeakPolarHBondContact O-CB 3.23Å; W295-L299 PolarHBondContact O-N 3.07Å; W295-K587 PolarHBondContact NE1-O 2.78Å; W295-F589 HydrophobicContact CB-CD2 3.59Å; W295-F589 HydrophobicContact CB-CE2 3.88Å; W295-F589 HydrophobicContact CD2-CB 3.79Å; W295-F589 AromaticContact CD2-CD2 3.64Å; W295-F589 HydrophobicContact CD2-CD2 3.64Å; W295-F589 HydrophobicContact CD2-CG 4.04Å; W295-F589 HydrophobicContact CE3-CB 4.07Å; W295-F589 AromaticContact CE3-CD2 3.92Å; W295-F589 HydrophobicContact CE3-CD2 3.92Å; W295-F589 HydrophobicContact CE3-CG 4.14Å; W295-F589 HydrophobicContact CG-CB 4.3Å; W295-F589 AromaticContact CG-CD2 3.5Å; W295-F589 HydrophobicContact CG-CD2 3.5Å; W295-F589 VanDerWaalsContact CG-CD2 3.5Å; W295-F589 HydrophobicContact CG-CE2 4.28Å; W295-F589 HydrophobicContact CG-CG 4.32Å; W295-F589 HydrophobicContact CH2-CB 4.2Å; W295-F589 HydrophobicContact CZ2-CB 3.92Å; W295-F589 HydrophobicContact CZ3-CB 4.27Å; W295-F592 HydrophobicContact CB-CD1 3.8Å; W295-F592 HydrophobicContact CB-CD2 4.02Å; W295-F592 HydrophobicContact CB-CE1 3.94Å; W295-F592 HydrophobicContact CB-CE2 4.13Å; W295-F592 HydrophobicContact CB-CG 3.86Å; W295-F592 HydrophobicContact CB-CZ 4.13Å; W295-F592 AromaticContact CD1-CD2 3.88Å; W295-F592 AromaticContact CD1-CG 3.78Å; W295-F592 HydrophobicContact CG-CB 4.35Å; W295-F592 HydrophobicContact CG-CD1 4.45Å; W295-F592 HydrophobicContact CG-CD2 4.37Å; W295-F592 HydrophobicContact CG-CG 4.15Å
296	I	97.3	Very high	95.9	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-55.6	-43.7	174.9	-63.5	-57.7	0	0	0	111.1	I270 Y279 F281 F292 A293 L299 H300 C304	I270-I296 HydrophobicContact CG2-CD1 3.64Å; Y279-I296 HydrophobicContact CD2-CG2 3.97Å; Y279-I296 HydrophobicContact CE2-CG2 4.31Å; F281-I296 HydrophobicContact CE1-CD1 4.29Å; F281-I296 HydrophobicContact CE2-CD1 4.03Å; F281-I296 HydrophobicContact CE2-CG1 3.85Å; F281-I296 HydrophobicContact CE2-CG2 4.16Å; F281-I296 HydrophobicContact CZ-CD1 3.53Å; F281-I296 HydrophobicContact CZ-CG1 3.89Å; F281-I296 HydrophobicContact CZ-CG2 4.49Å; F292-I296 HydrophobicContact CD1-CG1 4.01Å; F292-I296 HydrophobicContact CE1-CD1 4.03Å; F292-I296 HydrophobicContact CE1-CG1 3.59Å; F292-I296 HydrophobicContact CZ-CD1 3.94Å; F292-I296 HydrophobicContact CZ-CG1 4.03Å; F292-I296 WeakPolarHBondContact O-CG1 3.23Å; F292-I296 PolarHBondContact O-N 2.84Å; A293-I296 PolarHBondContact O-N 3.37Å; I296-L299 PolarHBondContact O-N 3.46Å; I296-H300 PolarHBondContact O-N 3.24Å; I296-C304 HydrophobicContact CB-CB 4.24Å; I296-C304 HydrophobicContact CG2-CB 4.03Å
297	C	96.4	Very high	96.1	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.014	12%	0.119	C	C	.	.	H	α-helix	trans	-65	-43.5	176.3	179.3	0	0	0	0	112.6	V99 A115 P117 A293 W295 L299 K301 Q302 C304	V99-C297 HydrophobicContact CG1-CB 4.26Å; V99-C297 HydrophobicContact CG2-CB 4.39Å; A115-C297 HydrophobicContact CB-CB 3.9Å; P117-C297 VanDerWaalsContact CD-SG 3.57Å; P117-C297 VanDerWaalsContact N-SG 3.36Å; A293-C297 VanDerWaalsContact O-CB 3.3Å; A293-C297 WeakPolarHBondContact O-CB 3.49Å; A293-C297 PolarHBondContact O-N 2.68Å; W295-C297 VanDerWaalsContact C-N 3.26Å; W295-C297 PolarHBondContact O-N 3.29Å; C297-L299 VanDerWaalsContact C-N 3.31Å; C297-L299 PolarHBondContact O-N 2.75Å; C297-K301 VanDerWaalsContact O-CA 3.22Å; C297-K301 WeakPolarHBondContact O-CA 3.31Å; C297-K301 PolarHBondContact O-N 2.78Å; C297-Q302 WeakPolarHBondContact CA-O 3.21Å; C297-Q302 WeakPolarHBondContact CB-O 3.37Å; C297-Q302 PolarHBondContact SG-O 3.14Å; C297-Q302 VanDerWaalsContact SG-O 3.37Å; C297-C304 HydrophobicContact CB-CB 4.38Å
298	H	94.5	Very high	96.2	Very high	63 Å²	63	24 Å²	24	29%	0.292	11%	0.107	S	C	.	.	H	α-helix	trans	-65.9	-31.7	175.3	176.9	65.4	0	0	0	113.6	P97 V99 E294 W295 K587 F592	P97-H298 HydrophobicContact CB-CB 4.49Å; V99-H298 HydrophobicContact CG2-CB 3.77Å; E294-H298 WeakPolarHBondContact O-CB 3.36Å; E294-H298 PolarHBondContact O-N 3.06Å; W295-H298 PolarHBondContact O-N 2.89Å; W295-H298 VanDerWaalsContact O-N 3.13Å; H298-K587 PolarHBondContact NE2-NZ 3.31Å; H298-K587 PolarHBondContact O-NZ 2.95Å; H298-F592 HydrophobicContact CB-CD2 4.35Å; H298-F592 HydrophobicContact CB-CE2 3.88Å
299	L	94.8	Very high	96.1	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.005	10%	0.103	C	C	.	.	H	α-helix	trans	-74.3	-62.5	-179	-179.7	57.1	0	0	0	110.4	I270 I271 W295 I296 C297 K587	I270-L299 HydrophobicContact CG2-CD2 3.77Å; I271-L299 HydrophobicContact CG1-CD1 4.24Å; I271-L299 HydrophobicContact CG1-CD2 3.87Å; I271-L299 HydrophobicContact CG2-CD1 4.4Å; W295-L299 HydrophobicContact CH2-CD2 4.41Å; W295-L299 HydrophobicContact CZ2-CD2 3.84Å; W295-L299 VanDerWaalsContact O-CB 3.23Å; W295-L299 WeakPolarHBondContact O-CB 3.23Å; W295-L299 PolarHBondContact O-N 3.07Å; I296-L299 PolarHBondContact O-N 3.46Å; C297-L299 VanDerWaalsContact C-N 3.31Å; C297-L299 PolarHBondContact O-N 2.75Å; L299-K587 HydrophobicContact CD1-CB 3.82Å; L299-K587 HydrophobicContact CD1-CD 3.77Å; L299-K587 HydrophobicContact CD1-CG 3.91Å
300	H	95.2	Very high	95.7	Very high	5 Å²	5	28 Å²	28	2%	0.023	13%	0.128	C	C	.	.	H	α-helix	trans	-96.8	2.1	-170.8	-59.4	-63.2	0	0	0	114.9	I270 L273 D275 Y279 I296 Q302	I270-H300 PolarHBondContact O-CE1 3.15Å; I270-H300 PolarHBondContact O-NE2 3.06Å; L273-H300 PolarHBondContact O-CE1 2.87Å; D275-H300 WeakPolarHBondContact OD1-CA 3.47Å; D275-H300 IonicContact OD1-CG 3.34Å; D275-H300 IonicContact OD1-ND1 2.78Å; D275-H300 PolarHBondContact OD1-ND1 2.76Å; Y279-H300 HydrophobicContact CE2-CB 4.26Å; Y279-H300 AromaticContact CE2-CD2 3.42Å; Y279-H300 VanDerWaalsContact CE2-CD2 3.42Å; Y279-H300 WeakPolarHBondContact CE2-CD2 3.49Å; Y279-H300 AromaticContact CE2-CG 3.87Å; Y279-H300 AromaticContact CE2-NE2 3.99Å; Y279-H300 AromaticContact CZ-CD2 3.71Å; Y279-H300 AromaticContact CZ-NE2 3.86Å; Y279-H300 PolarHBondContact OH-CD2 3Å; Y279-H300 PolarHBondContact OH-CE1 3.05Å; Y279-H300 PolarHBondContact OH-ND1 3.16Å; Y279-H300 PolarHBondContact OH-NE2 3.09Å; I296-H300 PolarHBondContact O-N 3.24Å; H300-Q302 HydrophobicContact CB-CG 4.07Å; H300-Q302 PolarHBondContact O-N 3.05Å; H300-Q302 VanDerWaalsContact O-N 3.14Å
301	K	94.6	Very high	95.1	Very high	123 Å²	123	27.9 Å²	27.9	54%	0.535	13%	0.128	S	C	.	.	S	Bend	trans	58.8	27.4	173.5	-45.9	169.5	-155.7	64.2	0	113.8	D275 C297	D275-K301 IonicContact OD2-NZ 3.5Å; D275-K301 PolarHBondContact OD2-NZ 3.09Å; C297-K301 VanDerWaalsContact O-CA 3.22Å; C297-K301 WeakPolarHBondContact O-CA 3.31Å; C297-K301 PolarHBondContact O-N 2.78Å
302	Q	94.9	Very high	94.6	Very high	16 Å²	16	27.7 Å²	27.7	8%	0.075	13%	0.126	C	C	.	.	S	Bend	trans	-122.6	155.7	179.2	62.6	174.3	-81.5	0	0	111	S156 D275 V277 H278 C297 H300	S156-Q302 PolarHBondContact OG-OE1 2.99Å; D275-Q302 PolarHBondContact O-NE2 2.67Å; D275-Q302 VanDerWaalsContact O-NE2 3.16Å; V277-Q302 PolarHBondContact O-NE2 2.96Å; H278-Q302 PolarHBondContact ND1-OE1 2.88Å; C297-Q302 WeakPolarHBondContact CA-O 3.21Å; C297-Q302 WeakPolarHBondContact CB-O 3.37Å; C297-Q302 PolarHBondContact SG-O 3.14Å; C297-Q302 VanDerWaalsContact SG-O 3.37Å; H300-Q302 HydrophobicContact CB-CG 4.07Å; H300-Q302 PolarHBondContact O-N 3.05Å; H300-Q302 VanDerWaalsContact O-N 3.14Å
303	P	96.6	Very high	94	Very high	19 Å²	19	28.9 Å²	28.9	12%	0.123	13%	0.134	C	C	.	.			trans	-56.7	135.3	171.8	-29.7	38.5	0	0	0	113.1	V114 A115 L116 Q155 S156	V114-P303 HydrophobicContact CG2-CB 4.28Å; A115-P303 WeakPolarHBondContact O-CA 3.3Å; L116-P303 HydrophobicContact CD2-CB 3.91Å; L116-P303 HydrophobicContact CD2-CG 3.95Å; Q155-P303 HydrophobicContact CG-CB 4.43Å; S156-P303 PolarHBondContact N-O 2.88Å
304	C	97.7	Very high	93.6	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	116.9	174.9	-168.8	0	0	0	0	110.5	A115 S156 A293 I296 C297	A115-C304 PolarHBondContact N-O 2.95Å; A115-C304 PolarHBondContact O-N 3.35Å; S156-C304 WeakPolarHBondContact O-CA 3.23Å; A293-C304 HydrophobicContact CB-CB 4.12Å; I296-C304 HydrophobicContact CB-CB 4.24Å; I296-C304 HydrophobicContact CG2-CB 4.03Å; C297-C304 HydrophobicContact CB-CB 4.38Å
305	H	98.1	Very high	93.4	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.009	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	147	-176.3	-65	-111.2	0	0	0	111.1	H112 E113 C150 Q155 S156 V157 L158	H112-H305 AromaticContact CD2-ND1 3.97Å; H112-H305 AromaticContact CE1-ND1 3.89Å; H112-H305 AromaticContact NE2-CE1 3.91Å; H112-H305 AromaticContact NE2-CG 3.9Å; H112-H305 AromaticContact NE2-ND1 2.95Å; H112-H305 PolarHBondContact NE2-ND1 2.78Å; E113-H305 CarbonylContact O-C 3.54Å; E113-H305 WeakPolarHBondContact O-CA 3.46Å; C150-H305 VanDerWaalsContact SG-CG 3.56Å; C150-H305 PolarHBondContact SG-ND1 2.82Å; Q155-H305 PolarHBondContact OE1-NE2 2.7Å; S156-H305 PolarHBondContact O-CD2 3.11Å; S156-H305 PolarHBondContact O-N 3.44Å; V157-H305 HydrophobicContact CB-CB 4.21Å; V157-H305 HydrophobicContact CG2-CB 4.04Å; L158-H305 PolarHBondContact N-O 2.87Å
306	V	97.9	Very high	93.3	Very high	7 Å²	7	30.8 Å²	30.8	4%	0.042	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	112.6	170.9	179.9	0	0	0	0	108.1	H112 E113 L158 A289 A293	H112-V306 WeakPolarHBondContact CA-O 3.5Å; E113-V306 HydrophobicContact CB-CB 4.44Å; E113-V306 PolarHBondContact N-O 3.44Å; E113-V306 PolarHBondContact O-N 3.29Å; L158-V306 HydrophobicContact CD2-CG2 4.36Å; A289-V306 HydrophobicContact CB-CG1 3.63Å; A293-V306 HydrophobicContact CB-CG2 3.3Å
307	I	96.8	Very high	93.2	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	110.9	170.4	-56.4	-52.8	0	0	0	107	H112 F143 E146 A147 V157 L158 S160	H112-I307 HydrophobicContact CB-CD1 3.96Å; H112-I307 VanDerWaalsContact CG-CD1 3.43Å; H112-I307 WeakPolarHBondContact ND1-CD1 3.34Å; F143-I307 HydrophobicContact CB-CG2 3.76Å; F143-I307 WeakPolarHBondContact O-CG2 3.48Å; E146-I307 HydrophobicContact CB-CD1 3.8Å; E146-I307 HydrophobicContact CB-CG1 4.42Å; A147-I307 HydrophobicContact CB-CG1 4.14Å; V157-I307 HydrophobicContact CG2-CG1 3.74Å; L158-I307 PolarHBondContact O-N 3.31Å; S160-I307 PolarHBondContact N-O 3.36Å
308	Y	95	Very high	93.2	Very high	54 Å²	54	32.5 Å²	32.5	21%	0.212	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	138.2	-178.1	-178.4	-77.4	0	0	0	111	T111 S160 D310	T111-Y308 PolarHBondContact N-O 2.89Å; T111-Y308 PolarHBondContact O-N 3.33Å; T111-Y308 PolarHBondContact OG1-O 3.39Å; S160-Y308 WeakPolarHBondContact O-CA 3.35Å; S160-Y308 WeakPolarHBondContact OG-CD2 3.41Å; Y308-D310 PolarHBondContact OH-OD1 2.88Å; Y308-D310 VanDerWaalsContact OH-OD1 3.09Å
309	T	92	Very high	93.3	Very high	5 Å²	5	31.8 Å²	31.8	3%	0.031	15%	0.149	C	C	.	.			trans	-152.7	138.3	167.9	-171.4	0	0	0	0	112.6	G109 F143 S160 A161 Y311	G109-T309 PolarHBondContact O-OG1 3.04Å; F143-T309 HydrophobicContact CB-CG2 3.94Å; F143-T309 HydrophobicContact CD1-CG2 3.86Å; F143-T309 HydrophobicContact CD2-CG2 4.46Å; F143-T309 HydrophobicContact CG-CG2 3.82Å; S160-T309 PolarHBondContact O-N 3.16Å; S160-T309 VanDerWaalsContact O-N 3.17Å; A161-T309 HydrophobicContact CB-CG2 4.06Å; T309-Y311 VanDerWaalsContact OG1-CB 3.31Å; T309-Y311 WeakPolarHBondContact OG1-CB 3.44Å; T309-Y311 PolarHBondContact OG1-N 2.74Å
310	D	87.2	Confident	93.2	Very high	106 Å²	106	31.8 Å²	31.8	57%	0.567	15%	0.149	S	C	*	.			trans	-82.2	0.4	167.5	-68.2	-56.4	0	0	0	112.5	Y308 R312	Y308-D310 PolarHBondContact OH-OD1 2.88Å; Y308-D310 VanDerWaalsContact OH-OD1 3.09Å; D310-R312 PolarHBondContact O-N 3.49Å
311	Y	85.2	Confident	93.1	Very high	117 Å²	117	32 Å²	32	46%	0.459	15%	0.15	S	C	.	.			trans	-61.7	128.1	-178.1	179.3	-113.4	0	0	0	111.9	T309 P313	T309-Y311 VanDerWaalsContact OG1-CB 3.31Å; T309-Y311 WeakPolarHBondContact OG1-CB 3.44Å; T309-Y311 PolarHBondContact OG1-N 2.74Å; Y311-P313 HydrophobicContact CD1-CG 4.42Å; Y311-P313 HydrophobicContact CE1-CB 4.43Å; Y311-P313 HydrophobicContact CE1-CG 3.93Å
312	R	83.8	Confident	92.7	Very high	39 Å²	39	26.1 Å²	26.1	15%	0.147	13%	0.125	C	C	.	.			trans	-118.4	116	176.6	-167.6	176.3	-84.8	-94.3	-7.2	109.9	H162 D310 T314 G522	H162-R312 PolarHBondContact CD2-NE 3.13Å; H162-R312 VanDerWaalsContact CD2-NE 3.33Å; H162-R312 PolarHBondContact CD2-NH2 3.06Å; H162-R312 VanDerWaalsContact CD2-NH2 3.29Å; H162-R312 VanDerWaalsContact CG-NH2 3.29Å; H162-R312 PolarHBondContact NE2-NH2 2.76Å; D310-R312 PolarHBondContact O-N 3.49Å; R312-T314 WeakPolarHBondContact CD-O 3.36Å; R312-T314 VanDerWaalsContact CG-O 3.23Å; R312-T314 WeakPolarHBondContact CG-O 3.33Å; R312-T314 PolarHBondContact O-N 2.85Å; R312-T314 VanDerWaalsContact O-N 3.13Å; R312-G522 PolarHBondContact NH1-O 3.25Å
313	P	84.8	Confident	91.9	Very high	25 Å²	25	26.9 Å²	26.9	16%	0.162	13%	0.134	C	C	.	.	S	Bend	trans	-60.8	-22.2	-179.3	-28	35.8	0	0	0	115.8	Y311 R527	Y311-P313 HydrophobicContact CD1-CG 4.42Å; Y311-P313 HydrophobicContact CE1-CB 4.43Å; Y311-P313 HydrophobicContact CE1-CG 3.93Å; P313-R527 HydrophobicContact CB-CG 3.88Å
314	T	89.7	Confident	90.8	Very high	6 Å²	6	28.3 Å²	28.3	4%	0.037	15%	0.151	C	C	.	.	S	Bend	trans	-128.9	108.3	173.7	-61.4	0	0	0	0	108.6	R312 D530	R312-T314 WeakPolarHBondContact CD-O 3.36Å; R312-T314 VanDerWaalsContact CG-O 3.23Å; R312-T314 WeakPolarHBondContact CG-O 3.33Å; R312-T314 PolarHBondContact O-N 2.85Å; R312-T314 VanDerWaalsContact O-N 3.13Å; T314-D530 HydrophobicContact CG2-CB 4.34Å; T314-D530 VanDerWaalsContact CG2-O 3.28Å; T314-D530 WeakPolarHBondContact CG2-O 3.2Å
315	P	92.2	Very high	89.7	Confident	39 Å²	39	28.5 Å²	28.5	25%	0.253	15%	0.153	S	C	.	.			trans	-65.4	160.7	-175.8	27.8	-36	0	0	0	112.2	E334 D531 R532 G533	P315-E334 HydrophobicContact CB-CB 3.99Å; P315-E334 HydrophobicContact CB-CG 4.14Å; P315-E334 HydrophobicContact CG-CB 4.42Å; P315-E334 HydrophobicContact CG-CG 4.28Å; P315-D531 WeakPolarHBondContact CD-O 3.49Å; P315-R532 HydrophobicContact CG-CB 4.3Å; P315-R532 CarbonylContact O-C 3.51Å; P315-R532 VanDerWaalsContact O-CA 3.27Å; P315-R532 WeakPolarHBondContact O-CA 3.48Å; P315-R532 WeakPolarHBondContact O-CB 3.29Å; P315-G533 PolarHBondContact O-N 3.16Å
316	L	94.3	Very high	88.7	Confident	16 Å²	16	35.6 Å²	35.6	8%	0.084	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	143.5	-177.9	-61.3	-174.8	0	0	0	112.1	H318 D333 E334 A524 G533 V535	L316-H318 WeakPolarHBondContact CB-NE2 3.45Å; L316-D333 CarbonylContact O-C 3.54Å; L316-E334 WeakPolarHBondContact O-CA 3.39Å; L316-A524 HydrophobicContact CD2-CB 3.88Å; L316-A524 WeakPolarHBondContact CD2-O 3.19Å; L316-G533 WeakPolarHBondContact CA-O 3.41Å; L316-V535 HydrophobicContact CB-CG2 4.49Å; L316-V535 HydrophobicContact CD1-CG2 4.23Å; L316-V535 HydrophobicContact CD2-CG2 4.41Å
317	Q	95.9	Very high	88	Confident	19 Å²	19	36.8 Å²	36.8	9%	0.089	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	122.7	164.5	-70.2	-174.3	-19.1	0	0	109.5	Y319 L330 E334 R532 G533 V535	Q317-Y319 HydrophobicContact CB-CD2 4.26Å; Q317-Y319 HydrophobicContact CB-CE2 3.55Å; Q317-Y319 PolarHBondContact OE1-OH 3.1Å; Q317-L330 HydrophobicContact CB-CD1 3.9Å; Q317-L330 HydrophobicContact CG-CD1 4.29Å; Q317-E334 HydrophobicContact CG-CG 3.75Å; Q317-E334 PolarHBondContact NE2-OE1 2.83Å; Q317-R532 VanDerWaalsContact CD-CD 3.5Å; Q317-G533 PolarHBondContact N-O 3.19Å; Q317-V535 PolarHBondContact O-N 2.92Å
318	H	96.8	Very high	87.8	Confident	20 Å²	20	39 Å²	39	9%	0.093	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	121	-178.6	-55.1	-110	0	0	0	110.6	L316 V331 V332 Y517	L316-H318 WeakPolarHBondContact CB-NE2 3.45Å; H318-V331 HydrophobicContact CB-CG2 4.46Å; H318-V331 VanDerWaalsContact O-CG2 3.26Å; H318-V331 WeakPolarHBondContact O-CG2 3.45Å; H318-V331 PolarHBondContact O-N 3.44Å; H318-V332 HydrophobicContact CB-CB 3.89Å; H318-V332 HydrophobicContact CB-CG2 4.3Å; H318-V332 PolarHBondContact N-O 3.14Å; H318-V332 PolarHBondContact O-N 3.07Å; H318-V332 VanDerWaalsContact O-N 3.16Å; H318-Y517 AromaticContact CE1-CE1 3.9Å; H318-Y517 AromaticContact ND1-CE1 3.57Å; H318-Y517 AromaticContact ND1-CZ 3.63Å; H318-Y517 PolarHBondContact ND1-OH 3.45Å
319	Y	96.1	Very high	87.7	Confident	48 Å²	48	38 Å²	38	19%	0.188	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	144.7	-178.8	-65.7	-96	0	0	0	111.4	Q317 L328 H329 L330 I534 V535 I536 L537	Q317-Y319 HydrophobicContact CB-CD2 4.26Å; Q317-Y319 HydrophobicContact CB-CE2 3.55Å; Q317-Y319 PolarHBondContact OE1-OH 3.1Å; Y319-L328 HydrophobicContact CD1-CB 3.89Å; Y319-L328 HydrophobicContact CG-CB 4.39Å; Y319-H329 CarbonylContact C-O 3.57Å; Y319-H329 WeakPolarHBondContact CA-O 3.11Å; Y319-L330 HydrophobicContact CD1-CB 4Å; Y319-L330 HydrophobicContact CD1-CD1 4.29Å; Y319-L330 HydrophobicContact CD2-CD1 4.31Å; Y319-L330 HydrophobicContact CE1-CB 3.75Å; Y319-L330 HydrophobicContact CE1-CD1 3.92Å; Y319-L330 HydrophobicContact CE1-CG 4.4Å; Y319-L330 HydrophobicContact CE2-CD1 3.94Å; Y319-L330 HydrophobicContact CG-CD1 4.48Å; Y319-I534 HydrophobicContact CD2-CG2 4.04Å; Y319-I534 HydrophobicContact CE2-CG2 4.09Å; Y319-V535 PolarHBondContact N-O 3.35Å; Y319-I536 WeakPolarHBondContact O-CA 3.08Å; Y319-L537 PolarHBondContact O-N 2.87Å
320	I	93.6	Very high	87.9	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	135.3	165	-74	177	0	0	0	110.3	H329 V331 F343 A346 M347 L537 V539 L552	I320-H329 PolarHBondContact N-O 3Å; I320-H329 PolarHBondContact O-N 3.36Å; I320-V331 HydrophobicContact CB-CG1 4.34Å; I320-V331 HydrophobicContact CD1-CG1 4.1Å; I320-V331 HydrophobicContact CD1-CG2 4.14Å; I320-V331 HydrophobicContact CG1-CG1 4.23Å; I320-V331 HydrophobicContact CG1-CG2 3.89Å; I320-F343 HydrophobicContact CD1-CD2 3.66Å; I320-F343 HydrophobicContact CD1-CE2 3.68Å; I320-A346 HydrophobicContact CB-CB 4.38Å; I320-A346 HydrophobicContact CG2-CB 3.91Å; I320-M347 HydrophobicContact CD1-CE 3.86Å; I320-M347 HydrophobicContact CG2-CE 4.3Å; I320-L537 WeakPolarHBondContact CA-O 3.37Å; I320-L537 HydrophobicContact CG1-CB 4.34Å; I320-V539 HydrophobicContact CD1-CG2 4.37Å; I320-V539 HydrophobicContact CG1-CG2 4.34Å; I320-V539 HydrophobicContact CG2-CB 4.22Å; I320-V539 HydrophobicContact CG2-CG2 3.88Å; I320-L552 HydrophobicContact CD1-CD1 4.45Å
321	F	92.8	Very high	88.2	Confident	10 Å²	10	34.8 Å²	34.8	4%	0.044	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	106	165.1	-173.2	-88.7	0	0	0	109.8	G325 L328 N373 I377 I536 L537 M538 V539	F321-G325 VanDerWaalsContact CZ-O 3.26Å; F321-G325 WeakPolarHBondContact CZ-O 3.37Å; F321-L328 HydrophobicContact CB-CD2 3.82Å; F321-L328 HydrophobicContact CD2-CD2 4.02Å; F321-L328 HydrophobicContact CD2-CG 4.46Å; F321-L328 HydrophobicContact CG-CD2 4.42Å; F321-N373 HydrophobicContact CE1-CB 3.78Å; F321-N373 HydrophobicContact CZ-CB 4.4Å; F321-I377 HydrophobicContact CB-CD1 4.07Å; F321-I377 HydrophobicContact CD1-CD1 3.79Å; F321-I377 HydrophobicContact CD2-CD1 3.93Å; F321-I377 HydrophobicContact CD2-CG1 3.97Å; F321-I377 HydrophobicContact CE1-CD1 4.25Å; F321-I377 HydrophobicContact CE2-CD1 4.37Å; F321-I377 HydrophobicContact CE2-CG1 4.15Å; F321-I377 HydrophobicContact CG-CD1 3.62Å; F321-I377 HydrophobicContact CG-CG1 4.19Å; F321-I536 HydrophobicContact CB-CG2 4.24Å; F321-L537 PolarHBondContact N-O 2.94Å; F321-M538 HydrophobicContact CB-CG 4.31Å; F321-M538 HydrophobicContact CD1-CG 4.5Å; F321-V539 PolarHBondContact O-N 3.23Å
322	P	85.8	Confident	88.7	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	128	174.3	29.3	-32	0	0	0	111	G324 G325 A346 V349 L350	P322-G324 PolarHBondContact O-N 3.31Å; P322-G324 VanDerWaalsContact O-N 3.16Å; P322-G325 PolarHBondContact O-N 2.88Å; P322-A346 WeakPolarHBondContact CB-O 3.38Å; P322-A346 HydrophobicContact CG-CB 4.45Å; P322-V349 HydrophobicContact CB-CB 4.19Å; P322-V349 HydrophobicContact CB-CG1 4.09Å; P322-V349 HydrophobicContact CG-CB 3.94Å; P322-V349 HydrophobicContact CG-CG1 3.76Å; P322-L350 HydrophobicContact CB-CD1 4.42Å; P322-L350 HydrophobicContact CB-CD2 3.94Å; P322-L350 HydrophobicContact CB-CG 3.73Å
323	A	78.5	Confident	89.1	Confident	32 Å²	32	28.4 Å²	28.4	26%	0.264	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	116.7	179.8	0	0	0	0	0	112	L350 V539 D540	A323-L350 HydrophobicContact CB-CD2 4.21Å; A323-V539 WeakPolarHBondContact CB-O 3.22Å; A323-V539 PolarHBondContact N-O 3.08Å; A323-D540 HydrophobicContact CB-CB 3.99Å
324	G	72.3	Confident	89.4	Confident	48 Å²	48	31.4 Å²	31.4	50%	0.495	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.2	-7.3	-176	0	0	0	0	0	114.2	P322	P322-G324 PolarHBondContact O-N 3.31Å; P322-G324 VanDerWaalsContact O-N 3.16Å
325	G	76.1	Confident	89.4	Confident	4 Å²	4	37.6 Å²	37.6	4%	0.041	22%	0.218	C	C	.	.			trans	-79.8	166.7	164.8	0	0	0	0	0	113	F321 P322	F321-G325 VanDerWaalsContact CZ-O 3.26Å; F321-G325 WeakPolarHBondContact CZ-O 3.37Å; P322-G325 PolarHBondContact O-N 2.88Å
326	D	76.6	Confident	89.1	Confident	152 Å²	152	36.7 Å²	36.7	81%	0.813	22%	0.216	S	C	*	.	S	Bend	trans	-105.9	3.2	-179.8	-70.9	-45.6	0	0	0	114	K376	D326-K376 IonicContact OD1-NZ 2.59Å
327	G	83.6	Confident	88.9	Confident	32 Å²	32	39.8 Å²	39.8	33%	0.33	23%	0.233	S	C	.	.	S	Bend	trans	-146	155.7	-171.7	0	0	0	0	0	116	H329	G327-H329 PolarHBondContact O-CE1 2.87Å; G327-H329 PolarHBondContact O-ND1 2.99Å
328	L	91.7	Very high	88.7	Confident	46 Å²	46	40.3 Å²	40.3	24%	0.241	24%	0.235	C	C	.	.			trans	-88.5	136.5	172.9	-71.3	168.4	0	0	0	110.7	Y319 F321 M380 I536	Y319-L328 HydrophobicContact CD1-CB 3.89Å; Y319-L328 HydrophobicContact CG-CB 4.39Å; F321-L328 HydrophobicContact CB-CD2 3.82Å; F321-L328 HydrophobicContact CD2-CD2 4.02Å; F321-L328 HydrophobicContact CD2-CG 4.46Å; F321-L328 HydrophobicContact CG-CD2 4.42Å; L328-M380 HydrophobicContact CD1-CE 3.76Å; L328-M380 HydrophobicContact CD1-SD 3.86Å; L328-I536 HydrophobicContact CD1-CD1 3.92Å; L328-I536 HydrophobicContact CD1-CG1 4.39Å; L328-I536 HydrophobicContact CD2-CB 4.45Å; L328-I536 HydrophobicContact CD2-CD1 4.23Å; L328-I536 HydrophobicContact CD2-CG1 4.11Å; L328-I536 HydrophobicContact CD2-CG2 3.54Å
329	H	93	Very high	88.4	Confident	33 Å²	33	44.6 Å²	44.6	15%	0.153	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	118.5	-178.6	-58.9	70.7	0	0	0	109.5	Y319 I320 G327 V331 A346	Y319-H329 CarbonylContact C-O 3.57Å; Y319-H329 WeakPolarHBondContact CA-O 3.11Å; I320-H329 PolarHBondContact N-O 3Å; I320-H329 PolarHBondContact O-N 3.36Å; G327-H329 PolarHBondContact O-CE1 2.87Å; G327-H329 PolarHBondContact O-ND1 2.99Å; H329-V331 PolarHBondContact O-N 3.27Å; H329-A346 HydrophobicContact CB-CB 3.95Å
330	L	95.8	Very high	87.9	Confident	45 Å²	45	46.4 Å²	46.4	24%	0.236	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	111.3	178.9	-179.1	68.7	0	0	0	109.8	Q317 Y319 V332 D333 N342	Q317-L330 HydrophobicContact CB-CD1 3.9Å; Q317-L330 HydrophobicContact CG-CD1 4.29Å; Y319-L330 HydrophobicContact CD1-CB 4Å; Y319-L330 HydrophobicContact CD1-CD1 4.29Å; Y319-L330 HydrophobicContact CD2-CD1 4.31Å; Y319-L330 HydrophobicContact CE1-CB 3.75Å; Y319-L330 HydrophobicContact CE1-CD1 3.92Å; Y319-L330 HydrophobicContact CE1-CG 4.4Å; Y319-L330 HydrophobicContact CE2-CD1 3.94Å; Y319-L330 HydrophobicContact CG-CD1 4.48Å; L330-V332 VanDerWaalsContact CD1-O 3.27Å; L330-V332 WeakPolarHBondContact CD1-O 3.5Å; L330-D333 HydrophobicContact CD2-CB 4.25Å; L330-N342 WeakPolarHBondContact O-CB 3.24Å; L330-N342 PolarHBondContact O-ND2 3.43Å
331	V	93.9	Very high	87.5	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	-21.6	-175.1	-67.6	0	0	0	0	114	H318 I320 H329 F338 R339 F343 L552	H318-V331 HydrophobicContact CB-CG2 4.46Å; H318-V331 VanDerWaalsContact O-CG2 3.26Å; H318-V331 WeakPolarHBondContact O-CG2 3.45Å; H318-V331 PolarHBondContact O-N 3.44Å; I320-V331 HydrophobicContact CB-CG1 4.34Å; I320-V331 HydrophobicContact CD1-CG1 4.1Å; I320-V331 HydrophobicContact CD1-CG2 4.14Å; I320-V331 HydrophobicContact CG1-CG1 4.23Å; I320-V331 HydrophobicContact CG1-CG2 3.89Å; H329-V331 PolarHBondContact O-N 3.27Å; V331-F338 CarbonylContact O-C 3.57Å; V331-F338 WeakPolarHBondContact O-CA 3.41Å; V331-F338 WeakPolarHBondContact O-CD2 3.11Å; V331-R339 PolarHBondContact O-N 3.37Å; V331-F343 HydrophobicContact CG1-CB 3.89Å; V331-F343 HydrophobicContact CG1-CD2 4.22Å; V331-L552 HydrophobicContact CB-CD1 4.26Å; V331-L552 HydrophobicContact CG2-CD1 3.6Å
332	V	94.9	Very high	87.2	Confident	3 Å²	3	55.2 Å²	55.2	2%	0.018	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	132.4	163	-170.7	0	0	0	0	108.7	H318 L330 G336 D337 F338 L552 K553	H318-V332 HydrophobicContact CB-CB 3.89Å; H318-V332 HydrophobicContact CB-CG2 4.3Å; H318-V332 PolarHBondContact N-O 3.14Å; H318-V332 PolarHBondContact O-N 3.07Å; H318-V332 VanDerWaalsContact O-N 3.16Å; L330-V332 VanDerWaalsContact CD1-O 3.27Å; L330-V332 WeakPolarHBondContact CD1-O 3.5Å; V332-G336 VanDerWaalsContact CG1-C 3.44Å; V332-D337 WeakPolarHBondContact CA-O 3.5Å; V332-F338 HydrophobicContact CG2-CD2 4.07Å; V332-L552 HydrophobicContact CG2-CB 3.89Å; V332-L552 HydrophobicContact CG2-CD1 4.45Å; V332-K553 HydrophobicContact CG2-CG 4.26Å
333	D	93.7	Very high	87.3	Confident	18 Å²	18	55.2 Å²	55.2	10%	0.096	31%	0.308	C	S	.	.			trans	-96.2	-176.3	178.7	62.3	40.6	0	0	0	113.6	L316 L330 N335 G336 D337 R339	L316-D333 CarbonylContact O-C 3.54Å; L330-D333 HydrophobicContact CD2-CB 4.25Å; D333-N335 PolarHBondContact O-N 3.16Å; D333-N335 PolarHBondContact OD1-N 2.89Å; D333-N335 VanDerWaalsContact OD1-N 3.13Å; D333-G336 WeakPolarHBondContact O-CA 3.44Å; D333-G336 PolarHBondContact O-N 2.64Å; D333-D337 PolarHBondContact N-O 2.82Å; D333-D337 PolarHBondContact OD1-N 3.39Å; D333-D337 VanDerWaalsContact OD1-N 3.09Å; D333-R339 IonicContact OD2-CZ 3.62Å; D333-R339 IonicContact OD2-NE 2.81Å; D333-R339 PolarHBondContact OD2-NE 3.04Å; D333-R339 IonicContact OD2-NH2 3.56Å; D333-R339 PolarHBondContact OD2-NH2 3.27Å
334	E	90.8	Very high	87.4	Confident	88 Å²	88	56.2 Å²	56.2	41%	0.411	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-22.6	-174.1	-69.8	164.1	-146.4	0	0	114.2	P315 L316 Q317 R532	P315-E334 HydrophobicContact CB-CB 3.99Å; P315-E334 HydrophobicContact CB-CG 4.14Å; P315-E334 HydrophobicContact CG-CB 4.42Å; P315-E334 HydrophobicContact CG-CG 4.28Å; L316-E334 WeakPolarHBondContact O-CA 3.39Å; Q317-E334 HydrophobicContact CG-CG 3.75Å; Q317-E334 PolarHBondContact NE2-OE1 2.83Å; E334-R532 WeakPolarHBondContact OE1-CD 3.3Å; E334-R532 IonicContact OE1-NE 3.68Å
335	N	88.1	Confident	88	Confident	136 Å²	136	57 Å²	57	73%	0.727	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-5.9	172.5	-60.6	-27.6	0	0	0	111.9	D333	D333-N335 PolarHBondContact O-N 3.16Å; D333-N335 PolarHBondContact OD1-N 2.89Å; D333-N335 VanDerWaalsContact OD1-N 3.13Å
336	G	86.4	Confident	88.3	Confident	21 Å²	21	56.8 Å²	56.8	22%	0.216	30%	0.302	C	S	.	.			trans	78.1	20.8	-169.9	0	0	0	0	0	113.5	V332 D333 K553	V332-G336 VanDerWaalsContact CG1-C 3.44Å; D333-G336 WeakPolarHBondContact O-CA 3.44Å; D333-G336 PolarHBondContact O-N 2.64Å; G336-K553 WeakPolarHBondContact O-CD 3.48Å; G336-K553 WeakPolarHBondContact O-CE 3.31Å; G336-K553 PolarHBondContact O-NZ 3.32Å
337	D	91.6	Very high	88.5	Confident	80 Å²	80	50.1 Å²	50.1	43%	0.428	27%	0.266	S	S	.	.			trans	-84.1	129.2	179.8	-81.6	-37.1	0	0	0	112.5	V332 D333 R339	V332-D337 WeakPolarHBondContact CA-O 3.5Å; D333-D337 PolarHBondContact N-O 2.82Å; D333-D337 PolarHBondContact OD1-N 3.39Å; D333-D337 VanDerWaalsContact OD1-N 3.09Å; D337-R339 PolarHBondContact O-N 3.47Å
338	F	90.9	Very high	88.1	Confident	30 Å²	30	53 Å²	53	13%	0.132	27%	0.271	C	S	.	.	B	Isolated β-bridge	trans	-81	116.3	-179.3	180	-102.8	0	0	0	111.4	V331 V332 E340 F343 K549 L552 K553	V331-F338 CarbonylContact O-C 3.57Å; V331-F338 WeakPolarHBondContact O-CA 3.41Å; V331-F338 WeakPolarHBondContact O-CD2 3.11Å; V332-F338 HydrophobicContact CG2-CD2 4.07Å; F338-E340 HydrophobicContact CD1-CB 3.99Å; F338-E340 HydrophobicContact CE1-CB 3.7Å; F338-E340 HydrophobicContact CE1-CG 4.04Å; F338-E340 PolarHBondContact O-N 3.09Å; F338-F343 HydrophobicContact CE2-CB 4.36Å; F338-F343 HydrophobicContact CE2-CD2 4.01Å; F338-F343 HydrophobicContact CE2-CG 4.31Å; F338-F343 HydrophobicContact CZ-CB 3.86Å; F338-F343 HydrophobicContact CZ-CD1 4.34Å; F338-F343 AromaticContact CZ-CD2 3.86Å; F338-F343 HydrophobicContact CZ-CD2 3.86Å; F338-F343 AromaticContact CZ-CG 3.75Å; F338-F343 HydrophobicContact CZ-CG 3.75Å; F338-K549 HydrophobicContact CD1-CD 4.32Å; F338-K549 HydrophobicContact CD1-CG 4.39Å; F338-K549 HydrophobicContact CE1-CB 4.33Å; F338-K549 HydrophobicContact CE2-CB 4.49Å; F338-K549 HydrophobicContact CG-CG 4.41Å; F338-K549 HydrophobicContact CZ-CB 4.32Å; F338-L552 HydrophobicContact CE2-CD1 4.07Å; F338-K553 HydrophobicContact CB-CD 4.13Å; F338-K553 HydrophobicContact CB-CG 4.36Å
339	R	91.1	Very high	87.5	Confident	110 Å²	110	52.7 Å²	52.7	42%	0.415	27%	0.271	S	S	.	.			trans	-91.5	80.5	-177.2	-58.6	-60.7	178.8	173.1	-8.8	110.6	V331 D333 D337 D341 N342 F343	V331-R339 PolarHBondContact O-N 3.37Å; D333-R339 IonicContact OD2-CZ 3.62Å; D333-R339 IonicContact OD2-NE 2.81Å; D333-R339 PolarHBondContact OD2-NE 3.04Å; D333-R339 IonicContact OD2-NH2 3.56Å; D333-R339 PolarHBondContact OD2-NH2 3.27Å; D337-R339 PolarHBondContact O-N 3.47Å; R339-D341 VanDerWaalsContact C-N 3.28Å; R339-D341 PolarHBondContact O-N 3.39Å; R339-N342 HydrophobicContact CB-CB 4.19Å; R339-N342 PolarHBondContact O-N 2.8Å; R339-N342 VanDerWaalsContact O-N 3.14Å; R339-F343 PolarHBondContact O-N 3.13Å
340	E	85.6	Confident	86.4	Confident	86 Å²	86	52.1 Å²	52.1	40%	0.402	27%	0.269	S	S	.	.	H	α-helix	trans	-58.8	-33.8	-174.8	-174	159.4	175.7	0	0	113.6	F338 F343 N344 P545	F338-E340 HydrophobicContact CD1-CB 3.99Å; F338-E340 HydrophobicContact CE1-CB 3.7Å; F338-E340 HydrophobicContact CE1-CG 4.04Å; F338-E340 PolarHBondContact O-N 3.09Å; E340-F343 PolarHBondContact O-N 3.32Å; E340-N344 WeakPolarHBondContact CG-ND2 2.89Å; E340-N344 WeakPolarHBondContact O-CB 3.33Å; E340-N344 PolarHBondContact O-N 3.27Å; E340-N344 PolarHBondContact O-ND2 2.88Å; E340-P545 WeakPolarHBondContact OE1-CB 3.41Å
341	D	83.5	Confident	84.8	Confident	129 Å²	129	56.3 Å²	56.3	69%	0.69	28%	0.281	S	S	*	.	H	α-helix	trans	-62.5	-43.6	175.4	-56.2	-58.6	0	0	0	112.6	R339 N344 T345	R339-D341 VanDerWaalsContact C-N 3.28Å; R339-D341 PolarHBondContact O-N 3.39Å; D341-N344 PolarHBondContact O-N 3.39Å; D341-T345 WeakPolarHBondContact O-CB 3.48Å; D341-T345 PolarHBondContact O-N 3.1Å; D341-T345 PolarHBondContact O-OG1 3.11Å
342	N	88.3	Confident	83.3	Confident	66 Å²	66	59.3 Å²	59.3	35%	0.353	30%	0.298	S	S	.	.	H	α-helix	trans	-69	-36.9	177.2	-69.6	-15.3	0	0	0	111.3	L330 R339 T345 A346	L330-N342 WeakPolarHBondContact O-CB 3.24Å; L330-N342 PolarHBondContact O-ND2 3.43Å; R339-N342 HydrophobicContact CB-CB 4.19Å; R339-N342 PolarHBondContact O-N 2.8Å; R339-N342 VanDerWaalsContact O-N 3.14Å; N342-T345 PolarHBondContact O-N 2.77Å; N342-A346 PolarHBondContact O-N 2.9Å
343	F	87.4	Confident	81.5	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62.9	-48.9	173.3	-178.4	-84.8	0	0	0	110.9	I320 V331 F338 R339 E340 T345 A346 M347 M543 P545	I320-F343 HydrophobicContact CD1-CD2 3.66Å; I320-F343 HydrophobicContact CD1-CE2 3.68Å; V331-F343 HydrophobicContact CG1-CB 3.89Å; V331-F343 HydrophobicContact CG1-CD2 4.22Å; F338-F343 HydrophobicContact CE2-CB 4.36Å; F338-F343 HydrophobicContact CE2-CD2 4.01Å; F338-F343 HydrophobicContact CE2-CG 4.31Å; F338-F343 HydrophobicContact CZ-CB 3.86Å; F338-F343 HydrophobicContact CZ-CD1 4.34Å; F338-F343 AromaticContact CZ-CD2 3.86Å; F338-F343 HydrophobicContact CZ-CD2 3.86Å; F338-F343 AromaticContact CZ-CG 3.75Å; F338-F343 HydrophobicContact CZ-CG 3.75Å; R339-F343 PolarHBondContact O-N 3.13Å; E340-F343 PolarHBondContact O-N 3.32Å; F343-T345 VanDerWaalsContact C-N 3.29Å; F343-T345 PolarHBondContact O-N 2.84Å; F343-A346 PolarHBondContact O-N 3.43Å; F343-M347 HydrophobicContact CD1-CG 4.05Å; F343-M347 HydrophobicContact CD2-CE 4.39Å; F343-M347 HydrophobicContact CE1-CE 4.29Å; F343-M347 HydrophobicContact CE1-CG 3.66Å; F343-M347 HydrophobicContact CE2-CE 3.83Å; F343-M347 HydrophobicContact CZ-CE 3.78Å; F343-M347 HydrophobicContact CZ-CG 4.08Å; F343-M347 HydrophobicContact CZ-SD 4.41Å; F343-M347 WeakPolarHBondContact O-CG 3.5Å; F343-M347 PolarHBondContact O-N 2.98Å; F343-M543 HydrophobicContact CE2-SD 3.98Å; F343-M543 HydrophobicContact CZ-CB 4.02Å; F343-M543 HydrophobicContact CZ-CG 4.01Å; F343-M543 HydrophobicContact CZ-SD 3.94Å; F343-P545 HydrophobicContact CD1-CB 4.39Å; F343-P545 HydrophobicContact CD1-CG 4.23Å; F343-P545 HydrophobicContact CE1-CB 4.28Å; F343-P545 HydrophobicContact CE1-CG 4.09Å
344	N	79.9	Confident	79.2	Confident	54 Å²	54	61.3 Å²	61.3	29%	0.289	32%	0.32	S	S	.	.	H	α-helix	trans	-62.3	-36.9	177.4	-77.4	-38.6	0	0	0	111.9	E340 D341 M347 Q348	E340-N344 WeakPolarHBondContact CG-ND2 2.89Å; E340-N344 WeakPolarHBondContact O-CB 3.33Å; E340-N344 PolarHBondContact O-N 3.27Å; E340-N344 PolarHBondContact O-ND2 2.88Å; D341-N344 PolarHBondContact O-N 3.39Å; N344-M347 PolarHBondContact O-N 2.8Å; N344-Q348 VanDerWaalsContact O-CG 3.26Å; N344-Q348 WeakPolarHBondContact O-CG 3.33Å; N344-Q348 PolarHBondContact O-N 2.89Å
345	T	84.3	Confident	76.7	Confident	63 Å²	63	60.3 Å²	60.3	39%	0.387	32%	0.317	S	S	.	.	H	α-helix	trans	-63.1	-46.7	173.9	-57.4	0	0	0	0	111.2	D341 N342 F343 M347 Q348 V349	D341-T345 WeakPolarHBondContact O-CB 3.48Å; D341-T345 PolarHBondContact O-N 3.1Å; D341-T345 PolarHBondContact O-OG1 3.11Å; N342-T345 PolarHBondContact O-N 2.77Å; F343-T345 VanDerWaalsContact C-N 3.29Å; F343-T345 PolarHBondContact O-N 2.84Å; T345-M347 VanDerWaalsContact C-N 3.32Å; T345-M347 PolarHBondContact O-N 3.41Å; T345-Q348 WeakPolarHBondContact O-CB 3.39Å; T345-Q348 PolarHBondContact O-N 2.85Å; T345-Q348 VanDerWaalsContact O-N 3.15Å; T345-V349 WeakPolarHBondContact O-CG2 3.45Å; T345-V349 PolarHBondContact O-N 2.93Å
346	A	82.5	Confident	74.5	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-60.6	-40.3	176.1	0	0	0	0	0	112.4	I320 P322 H329 N342 F343 V349 L350	I320-A346 HydrophobicContact CB-CB 4.38Å; I320-A346 HydrophobicContact CG2-CB 3.91Å; P322-A346 WeakPolarHBondContact CB-O 3.38Å; P322-A346 HydrophobicContact CG-CB 4.45Å; H329-A346 HydrophobicContact CB-CB 3.95Å; N342-A346 PolarHBondContact O-N 2.9Å; F343-A346 PolarHBondContact O-N 3.43Å; A346-V349 PolarHBondContact O-N 2.67Å; A346-L350 PolarHBondContact O-N 3.46Å
347	M	82.6	Confident	72.3	Confident	13 Å²	13	63.1 Å²	63.1	6%	0.064	34%	0.337	C	S	.	.	H	α-helix	trans	-72	-26.3	176.8	-62.6	-58.3	140.9	0	0	113.2	I320 F343 N344 T345 L350 R351 V539 M543	I320-M347 HydrophobicContact CD1-CE 3.86Å; I320-M347 HydrophobicContact CG2-CE 4.3Å; F343-M347 HydrophobicContact CD1-CG 4.05Å; F343-M347 HydrophobicContact CD2-CE 4.39Å; F343-M347 HydrophobicContact CE1-CE 4.29Å; F343-M347 HydrophobicContact CE1-CG 3.66Å; F343-M347 HydrophobicContact CE2-CE 3.83Å; F343-M347 HydrophobicContact CZ-CE 3.78Å; F343-M347 HydrophobicContact CZ-CG 4.08Å; F343-M347 HydrophobicContact CZ-SD 4.41Å; F343-M347 WeakPolarHBondContact O-CG 3.5Å; F343-M347 PolarHBondContact O-N 2.98Å; N344-M347 PolarHBondContact O-N 2.8Å; T345-M347 VanDerWaalsContact C-N 3.32Å; T345-M347 PolarHBondContact O-N 3.41Å; M347-L350 HydrophobicContact SD-CD1 3.87Å; M347-R351 PolarHBondContact O-N 3.2Å; M347-V539 HydrophobicContact CE-CG1 4.18Å; M347-M543 HydrophobicContact CE-CB 4.06Å; M347-M543 HydrophobicContact SD-CB 3.95Å; M347-M543 PolarHBondContact SD-N 3.4Å; M347-M543 VanDerWaalsContact SD-N 3.38Å
348	Q	74.2	Confident	69.7	Low	92 Å²	92	66 Å²	66	43%	0.43	35%	0.346	S	S	.	.	H	α-helix	trans	-69.7	-39.8	170.3	-74.3	173.4	38.4	0	0	111.7	N344 T345 L350 R351 D352	N344-Q348 VanDerWaalsContact O-CG 3.26Å; N344-Q348 WeakPolarHBondContact O-CG 3.33Å; N344-Q348 PolarHBondContact O-N 2.89Å; T345-Q348 WeakPolarHBondContact O-CB 3.39Å; T345-Q348 PolarHBondContact O-N 2.85Å; T345-Q348 VanDerWaalsContact O-N 3.15Å; Q348-L350 PolarHBondContact O-N 2.79Å; Q348-R351 WeakPolarHBondContact O-CB 3.26Å; Q348-R351 PolarHBondContact O-N 2.78Å; Q348-D352 VanDerWaalsContact O-CG 3.31Å; Q348-D352 PolarHBondContact O-N 2.82Å
349	V	78.9	Confident	66.8	Low	40 Å²	40	67.9 Å²	67.9	24%	0.242	37%	0.374	C	S	.	.	H	α-helix	trans	-58.5	-37.1	174.9	174.7	0	0	0	0	111.7	P322 T345 A346 D352 A353	P322-V349 HydrophobicContact CB-CB 4.19Å; P322-V349 HydrophobicContact CB-CG1 4.09Å; P322-V349 HydrophobicContact CG-CB 3.94Å; P322-V349 HydrophobicContact CG-CG1 3.76Å; T345-V349 WeakPolarHBondContact O-CG2 3.45Å; T345-V349 PolarHBondContact O-N 2.93Å; A346-V349 PolarHBondContact O-N 2.67Å; V349-D352 PolarHBondContact O-N 2.84Å; V349-A353 VanDerWaalsContact O-CB 3.22Å; V349-A353 WeakPolarHBondContact O-CB 3.48Å; V349-A353 PolarHBondContact O-N 2.79Å
350	L	70.3	Confident	63.8	Low	21 Å²	21	69.4 Å²	69.4	11%	0.11	39%	0.39	C	S	.	.	H	α-helix	trans	-64.4	-40.5	173.5	-73.2	172.7	0	0	0	113.3	P322 A323 A346 M347 Q348 G354 V539	P322-L350 HydrophobicContact CB-CD1 4.42Å; P322-L350 HydrophobicContact CB-CD2 3.94Å; P322-L350 HydrophobicContact CB-CG 3.73Å; A323-L350 HydrophobicContact CB-CD2 4.21Å; A346-L350 PolarHBondContact O-N 3.46Å; M347-L350 HydrophobicContact SD-CD1 3.87Å; Q348-L350 PolarHBondContact O-N 2.79Å; L350-G354 PolarHBondContact O-N 3.08Å; L350-V539 HydrophobicContact CD1-CB 4.44Å; L350-V539 HydrophobicContact CD1-CG1 3.89Å
351	R	62.9	Low	61.4	Low	132 Å²	132	73 Å²	73	50%	0.498	41%	0.407	S	S	.	.	H	α-helix	trans	-62.3	-51.3	173.7	-178.2	-165	67.3	-153.5	-10.8	110.2	M347 Q348 A353 G354 D355	M347-R351 PolarHBondContact O-N 3.2Å; Q348-R351 WeakPolarHBondContact O-CB 3.26Å; Q348-R351 PolarHBondContact O-N 2.78Å; R351-A353 PolarHBondContact O-N 3.16Å; R351-G354 CarbonylContact O-C 3.56Å; R351-G354 VanDerWaalsContact O-CA 3.29Å; R351-G354 WeakPolarHBondContact O-CA 3.46Å; R351-G354 PolarHBondContact O-N 3.17Å; R351-D355 PolarHBondContact O-N 3.36Å
352	D	61.7	Low	58.8	Low	64 Å²	64	76.6 Å²	76.6	34%	0.342	42%	0.417	S	S	.	.	H	α-helix	trans	-73.8	-31.8	-169.6	-62.5	-14.8	0	0	0	112	Q348 V349 G354 D355 L356	Q348-D352 VanDerWaalsContact O-CG 3.31Å; Q348-D352 PolarHBondContact O-N 2.82Å; V349-D352 PolarHBondContact O-N 2.84Å; D352-G354 VanDerWaalsContact C-N 3.33Å; D352-D355 PolarHBondContact O-N 3.27Å; D352-L356 WeakPolarHBondContact O-CB 3.4Å; D352-L356 WeakPolarHBondContact O-CG 3.33Å; D352-L356 PolarHBondContact O-N 3.47Å
353	A	56.1	Low	56.1	Low	30 Å²	30	76.8 Å²	76.8	25%	0.248	43%	0.434	C	S	.	.	H	α-helix	trans	-65.3	-36.2	166.3	0	0	0	0	0	112.2	V349 R351 D355 A357	V349-A353 VanDerWaalsContact O-CB 3.22Å; V349-A353 WeakPolarHBondContact O-CB 3.48Å; V349-A353 PolarHBondContact O-N 2.79Å; R351-A353 PolarHBondContact O-N 3.16Å; A353-D355 VanDerWaalsContact C-N 3.28Å; A353-D355 PolarHBondContact O-N 3.38Å; A353-A357 PolarHBondContact O-N 3.06Å
354	G	46.9	Very low	53.4	Low	32 Å²	32	88.9 Å²	88.9	33%	0.33	48%	0.48	S	S	.	.	H	α-helix	trans	-65.9	-26.8	171.4	0	0	0	0	0	114.1	L350 R351 D352	L350-G354 PolarHBondContact O-N 3.08Å; R351-G354 CarbonylContact O-C 3.56Å; R351-G354 VanDerWaalsContact O-CA 3.29Å; R351-G354 WeakPolarHBondContact O-CA 3.46Å; R351-G354 PolarHBondContact O-N 3.17Å; D352-G354 VanDerWaalsContact C-N 3.33Å
355	D	38.2	Very low	50.9	Low	67 Å²	67	96.2 Å²	96.2	36%	0.358	51%	0.509	S	S	.	.	H	α-helix	trans	-85.2	-39.4	174.7	-79	-42.4	0	0	0	113	R351 D352 A353 A357 K358	R351-D355 PolarHBondContact O-N 3.36Å; D352-D355 PolarHBondContact O-N 3.27Å; A353-D355 VanDerWaalsContact C-N 3.28Å; A353-D355 PolarHBondContact O-N 3.38Å; D355-A357 PolarHBondContact O-N 3.34Å; D355-K358 WeakPolarHBondContact O-CB 3.46Å; D355-K358 WeakPolarHBondContact O-CG 3.42Å; D355-K358 PolarHBondContact O-N 2.91Å; D355-K358 WeakPolarHBondContact OD1-CE 3.38Å; D355-K358 IonicContact OD1-NZ 2.68Å; D355-K358 PolarHBondContact OD1-NZ 3.47Å
356	L	41.9	Very low	48.3	Very low	139 Å²	139	96.8 Å²	96.8	73%	0.728	53%	0.527	S	S	*	.	H	α-helix	trans	-60	-33.4	173.9	-77.7	164	0	0	0	112.1	D352 K358 G359	D352-L356 WeakPolarHBondContact O-CB 3.4Å; D352-L356 WeakPolarHBondContact O-CG 3.33Å; D352-L356 PolarHBondContact O-N 3.47Å; L356-K358 PolarHBondContact O-N 3.28Å; L356-G359 PolarHBondContact O-N 2.99Å
357	A	39.7	Very low	45.8	Very low	77 Å²	77	100.1 Å²	100.1	64%	0.636	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-7.4	171.3	0	0	0	0	0	114.6	A353 D355	A353-A357 PolarHBondContact O-N 3.06Å; D355-A357 PolarHBondContact O-N 3.34Å
358	K	37.4	Very low	43.4	Very low	140 Å²	140	106.4 Å²	106.4	61%	0.609	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-15.3	172.6	-54.8	173.2	179.1	174.7	0	113.1	D355 L356	D355-K358 WeakPolarHBondContact O-CB 3.46Å; D355-K358 WeakPolarHBondContact O-CG 3.42Å; D355-K358 PolarHBondContact O-N 2.91Å; D355-K358 WeakPolarHBondContact OD1-CE 3.38Å; D355-K358 IonicContact OD1-NZ 2.68Å; D355-K358 PolarHBondContact OD1-NZ 3.47Å; L356-K358 PolarHBondContact O-N 3.28Å
359	G	29.6	Very low	41.5	Very low	70 Å²	70	112.1 Å²	112.1	72%	0.722	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-43.6	-169.9	0	0	0	0	0	116	L356	L356-G359 PolarHBondContact O-N 2.99Å
360	D	28.6	Very low	40	Very low	142 Å²	142	112.7 Å²	112.7	76%	0.759	64%	0.638	S	S	*	*			trans	-106	39.6	-161.4	-162.4	23.6	0	0	0	114.9	K362	D360-K362 PolarHBondContact O-N 3.27Å
361	Q	34.5	Very low	39.4	Very low	163 Å²	163	115.5 Å²	115.5	76%	0.762	66%	0.658	S	S	*	*			trans	-77.3	43.2	173.9	-71.3	-156.1	-43.4	0	0	113.3
362	K	29.6	Very low	39.8	Very low	204 Å²	204	110.8 Å²	110.8	89%	0.887	65%	0.645	S	S	*	*	S	Bend	trans	-125.4	37.8	174.8	-118.9	178.8	-175.9	179.7	0	115.8	D360	D360-K362 PolarHBondContact O-N 3.27Å
363	G	31.8	Very low	40.6	Very low	69 Å²	69	109.8 Å²	109.8	71%	0.711	64%	0.639	S	S	*	*			trans	121.9	97.5	140.3	0	0	0	0	0	116.2
364	R	30.2	Very low	42.1	Very low	254 Å²	254	108.5 Å²	108.5	96%	0.958	63%	0.629	S	S	*	*			trans	-143	119.9	154.7	-109.3	165.8	-177.2	161.4	1.1	111.2
365	K	28.1	Very low	44.1	Very low	209 Å²	209	108.3 Å²	108.3	91%	0.909	62%	0.619	S	S	*	*			trans	-69.4	139.6	168.7	-69.7	177.8	175.1	178.8	0	109.7
366	G	29.4	Very low	46.5	Very low	75 Å²	75	109 Å²	109	77%	0.773	62%	0.619	S	S	*	*	S	Bend	trans	55.9	103.2	146.3	0	0	0	0	0	118.4
367	G	30.4	Very low	48.8	Very low	70 Å²	70	102.6 Å²	102.6	72%	0.722	59%	0.585	S	S	*	*			trans	100.5	128.9	161.7	0	0	0	0	0	114.7	K369	G367-K369 VanDerWaalsContact C-N 3.29Å; G367-K369 PolarHBondContact O-N 3.06Å
368	T	31.9	Very low	51.4	Low	145 Å²	145	99 Å²	99	89%	0.89	56%	0.555	S	S	*	*			trans	-70.3	79.9	171.3	37.9	0	0	0	0	110.5	G370	T368-G370 PolarHBondContact O-N 3.34Å
369	K	33.3	Very low	53.9	Low	212 Å²	212	95.9 Å²	95.9	92%	0.922	54%	0.541	S	S	*	.			trans	-71.9	76	173.8	-75.8	-169.6	172.5	-173.6	0	111.7	G367	G367-K369 VanDerWaalsContact C-N 3.29Å; G367-K369 PolarHBondContact O-N 3.06Å
370	G	47.7	Very low	56.9	Low	51 Å²	51	94.4 Å²	94.4	53%	0.526	52%	0.516	S	S	.	.	S	Bend	trans	-163	157.1	170.1	0	0	0	0	0	111.4	T368	T368-G370 PolarHBondContact O-N 3.34Å
371	P	57.2	Low	60.1	Low	80 Å²	80	87.6 Å²	87.6	52%	0.519	48%	0.48	S	S	.	.			trans	-63.7	145.1	168	28.4	-33.4	0	0	0	110.2	F375 K376	P371-F375 HydrophobicContact CB-CB 4.2Å; P371-F375 HydrophobicContact CB-CD1 3.49Å; P371-F375 VanDerWaalsContact CB-CD1 3.49Å; P371-F375 HydrophobicContact CB-CE1 4.14Å; P371-F375 HydrophobicContact CB-CG 4.05Å; P371-K376 HydrophobicContact CG-CG 4.48Å
372	S	71	Confident	62.9	Low	33 Å²	33	81.7 Å²	81.7	23%	0.231	45%	0.453	C	S	.	.			trans	-65.3	159.5	175.5	63.1	0	0	0	0	111.6	V374 F375 K376 Q405	S372-V374 PolarHBondContact O-N 3.43Å; S372-F375 WeakPolarHBondContact O-CB 3.47Å; S372-F375 PolarHBondContact O-N 2.9Å; S372-F375 PolarHBondContact OG-N 2.98Å; S372-K376 PolarHBondContact O-N 3.27Å; S372-Q405 PolarHBondContact OG-OE1 2.66Å
373	N	79.6	Confident	65.9	Low	43 Å²	43	78.3 Å²	78.3	23%	0.23	44%	0.44	C	S	.	.	H	α-helix	trans	-61.5	-35.3	176.8	-68.1	-20	0	0	0	111.5	F321 F375 K376 I377 M538	F321-N373 HydrophobicContact CE1-CB 3.78Å; F321-N373 HydrophobicContact CZ-CB 4.4Å; N373-F375 VanDerWaalsContact C-N 3.35Å; N373-F375 PolarHBondContact O-N 3.24Å; N373-K376 WeakPolarHBondContact O-CB 3.32Å; N373-K376 PolarHBondContact O-N 3.36Å; N373-I377 WeakPolarHBondContact O-CD1 3.48Å; N373-I377 VanDerWaalsContact O-CG1 3.24Å; N373-I377 WeakPolarHBondContact O-CG1 3.48Å; N373-I377 PolarHBondContact O-N 2.84Å; N373-M538 HydrophobicContact CB-CE 3.59Å
374	V	86.9	Confident	68.8	Low	3 Å²	3	82.4 Å²	82.4	2%	0.018	43%	0.434	C	S	.	.	H	α-helix	trans	-59.2	-45.2	172	-172	0	0	0	0	110.8	S372 K376 I377 V378 I391 Y402 M406 F480 L497 T499 M538	S372-V374 PolarHBondContact O-N 3.43Å; V374-K376 PolarHBondContact O-N 3.06Å; V374-I377 PolarHBondContact O-N 3.13Å; V374-V378 HydrophobicContact CG1-CG2 4.18Å; V374-V378 WeakPolarHBondContact O-CB 3.47Å; V374-V378 WeakPolarHBondContact O-CG2 3.48Å; V374-V378 PolarHBondContact O-N 2.87Å; V374-I391 HydrophobicContact CG1-CG2 4.39Å; V374-Y402 HydrophobicContact CB-CD1 4Å; V374-Y402 HydrophobicContact CB-CE1 4.23Å; V374-Y402 HydrophobicContact CG1-CD1 4.28Å; V374-Y402 HydrophobicContact CG1-CG 4.39Å; V374-Y402 HydrophobicContact CG2-CD1 3.73Å; V374-Y402 HydrophobicContact CG2-CE1 3.5Å; V374-Y402 HydrophobicContact CG2-CE2 4.44Å; V374-Y402 HydrophobicContact CG2-CG 4.31Å; V374-M406 HydrophobicContact CB-CE 4.22Å; V374-M406 HydrophobicContact CG1-CE 3.76Å; V374-F480 HydrophobicContact CG1-CE1 4.14Å; V374-L497 HydrophobicContact CG1-CD2 4.28Å; V374-T499 HydrophobicContact CG2-CG2 4.14Å; V374-M538 HydrophobicContact CG2-CE 3.85Å; V374-M538 HydrophobicContact CG2-SD 3.79Å
375	F	89.5	Confident	71.8	Confident	29 Å²	29	74.6 Å²	74.6	13%	0.127	41%	0.412	C	S	.	.	H	α-helix	trans	-63	-41.1	177.3	-175.2	-81.6	0	0	0	112.4	P371 S372 N373 K379 Q405 M406 K408 L409	P371-F375 HydrophobicContact CB-CB 4.2Å; P371-F375 HydrophobicContact CB-CD1 3.49Å; P371-F375 VanDerWaalsContact CB-CD1 3.49Å; P371-F375 HydrophobicContact CB-CE1 4.14Å; P371-F375 HydrophobicContact CB-CG 4.05Å; S372-F375 WeakPolarHBondContact O-CB 3.47Å; S372-F375 PolarHBondContact O-N 2.9Å; S372-F375 PolarHBondContact OG-N 2.98Å; N373-F375 VanDerWaalsContact C-N 3.35Å; N373-F375 PolarHBondContact O-N 3.24Å; F375-K379 HydrophobicContact CE1-CD 4.31Å; F375-K379 VanDerWaalsContact O-CB 3.24Å; F375-K379 WeakPolarHBondContact O-CB 3.4Å; F375-K379 PolarHBondContact O-N 3.06Å; F375-Q405 WeakPolarHBondContact CD2-O 3.29Å; F375-Q405 WeakPolarHBondContact CE2-O 3.45Å; F375-M406 HydrophobicContact CB-CE 4.11Å; F375-M406 HydrophobicContact CB-SD 4.23Å; F375-M406 HydrophobicContact CD2-CE 4.47Å; F375-M406 HydrophobicContact CD2-SD 3.7Å; F375-M406 HydrophobicContact CG-SD 4.3Å; F375-K408 HydrophobicContact CE2-CB 4.29Å; F375-L409 HydrophobicContact CD2-CD1 4.49Å; F375-L409 HydrophobicContact CE1-CD1 4.38Å; F375-L409 HydrophobicContact CE2-CD1 3.79Å; F375-L409 HydrophobicContact CE2-CG 3.87Å; F375-L409 HydrophobicContact CZ-CD1 3.73Å; F375-L409 HydrophobicContact CZ-CD2 3.99Å; F375-L409 HydrophobicContact CZ-CG 3.75Å
376	K	88.1	Confident	74.9	Confident	82 Å²	82	66.5 Å²	66.5	36%	0.357	38%	0.376	S	S	.	.	H	α-helix	trans	-57.9	-48.4	173.4	-67.4	-176.9	176.6	-173	0	111.3	D326 P371 S372 N373 V374 M380	D326-K376 IonicContact OD1-NZ 2.59Å; P371-K376 HydrophobicContact CG-CG 4.48Å; S372-K376 PolarHBondContact O-N 3.27Å; N373-K376 WeakPolarHBondContact O-CB 3.32Å; N373-K376 PolarHBondContact O-N 3.36Å; V374-K376 PolarHBondContact O-N 3.06Å; K376-M380 WeakPolarHBondContact O-CB 3.48Å; K376-M380 PolarHBondContact O-N 3.49Å
377	I	91.5	Very high	77.9	Confident	4 Å²	4	65.5 Å²	65.5	2%	0.021	35%	0.352	C	S	.	.	H	α-helix	trans	-68	-48.7	-176.4	-63.6	160.8	0	0	0	110.9	F321 N373 V374 K379 M380 I381 L497 I536 M538	F321-I377 HydrophobicContact CB-CD1 4.07Å; F321-I377 HydrophobicContact CD1-CD1 3.79Å; F321-I377 HydrophobicContact CD2-CD1 3.93Å; F321-I377 HydrophobicContact CD2-CG1 3.97Å; F321-I377 HydrophobicContact CE1-CD1 4.25Å; F321-I377 HydrophobicContact CE2-CD1 4.37Å; F321-I377 HydrophobicContact CE2-CG1 4.15Å; F321-I377 HydrophobicContact CG-CD1 3.62Å; F321-I377 HydrophobicContact CG-CG1 4.19Å; N373-I377 WeakPolarHBondContact O-CD1 3.48Å; N373-I377 VanDerWaalsContact O-CG1 3.24Å; N373-I377 WeakPolarHBondContact O-CG1 3.48Å; N373-I377 PolarHBondContact O-N 2.84Å; V374-I377 PolarHBondContact O-N 3.13Å; I377-K379 VanDerWaalsContact C-N 3.33Å; I377-K379 PolarHBondContact O-N 3.2Å; I377-M380 PolarHBondContact O-N 3.4Å; I377-M380 VanDerWaalsContact O-N 3.15Å; I377-I381 HydrophobicContact CG2-CD1 3.85Å; I377-I381 HydrophobicContact CG2-CG1 4.35Å; I377-I381 WeakPolarHBondContact O-CG1 3.37Å; I377-I381 PolarHBondContact O-N 2.98Å; I377-L497 HydrophobicContact CB-CD2 4.34Å; I377-L497 HydrophobicContact CD1-CD1 4.25Å; I377-L497 HydrophobicContact CG2-CD1 3.96Å; I377-L497 HydrophobicContact CG2-CD2 3.85Å; I377-I536 HydrophobicContact CG2-CD1 4.03Å; I377-M538 HydrophobicContact CD1-CE 3.94Å; I377-M538 HydrophobicContact CD1-CG 3.7Å; I377-M538 HydrophobicContact CD1-SD 3.62Å
378	V	92.4	Very high	81	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-60.4	-42.6	178.5	173	0	0	0	0	110.8	V374 M380 I381 M382 I391 M406 F411 A478 F480 L497	V374-V378 HydrophobicContact CG1-CG2 4.18Å; V374-V378 WeakPolarHBondContact O-CB 3.47Å; V374-V378 WeakPolarHBondContact O-CG2 3.48Å; V374-V378 PolarHBondContact O-N 2.87Å; V378-M380 PolarHBondContact O-N 3.09Å; V378-I381 WeakPolarHBondContact O-CB 3.17Å; V378-I381 PolarHBondContact O-N 3.13Å; V378-M382 HydrophobicContact CG1-CE 4.37Å; V378-M382 WeakPolarHBondContact O-CG 3.41Å; V378-M382 PolarHBondContact O-N 2.91Å; V378-M382 VanDerWaalsContact O-N 3.09Å; V378-I391 HydrophobicContact CG2-CD1 4.43Å; V378-I391 HydrophobicContact CG2-CG1 4.18Å; V378-M406 HydrophobicContact CB-SD 4.06Å; V378-M406 HydrophobicContact CG1-SD 4.09Å; V378-M406 HydrophobicContact CG2-CE 4.4Å; V378-M406 HydrophobicContact CG2-SD 4.39Å; V378-F411 HydrophobicContact CG1-CZ 4.08Å; V378-A478 HydrophobicContact CG1-CB 4.43Å; V378-F480 HydrophobicContact CG2-CZ 4.37Å; V378-L497 HydrophobicContact CG2-CD2 4.17Å
379	K	91.7	Very high	84.1	Confident	75 Å²	75	55.6 Å²	55.6	33%	0.326	28%	0.277	S	S	.	.	H	α-helix	trans	-60	-45.7	174.3	-174.4	175.5	174.8	-70.5	0	112	F375 I377 I381 M382 E383 L409	F375-K379 HydrophobicContact CE1-CD 4.31Å; F375-K379 VanDerWaalsContact O-CB 3.24Å; F375-K379 WeakPolarHBondContact O-CB 3.4Å; F375-K379 PolarHBondContact O-N 3.06Å; I377-K379 VanDerWaalsContact C-N 3.33Å; I377-K379 PolarHBondContact O-N 3.2Å; K379-I381 VanDerWaalsContact C-N 3.34Å; K379-I381 PolarHBondContact O-N 2.69Å; K379-M382 PolarHBondContact O-N 3.02Å; K379-E383 IonicContact NZ-OE1 3.02Å; K379-E383 PolarHBondContact NZ-OE1 2.67Å; K379-E383 IonicContact NZ-OE2 3.73Å; K379-E383 PolarHBondContact NZ-OE2 3.13Å; K379-E383 WeakPolarHBondContact O-CG 3.06Å; K379-E383 PolarHBondContact O-N 3.14Å; K379-L409 HydrophobicContact CB-CD1 4.18Å; K379-L409 HydrophobicContact CG-CD1 4.42Å
380	M	92.3	Very high	87.1	Confident	39 Å²	39	45.5 Å²	45.5	19%	0.192	23%	0.233	C	C	.	.	H	α-helix	trans	-64.6	-34.4	176.9	-176.1	-130.3	61.3	0	0	112.9	L328 K376 I377 V378 R384 F386	L328-M380 HydrophobicContact CD1-CE 3.76Å; L328-M380 HydrophobicContact CD1-SD 3.86Å; K376-M380 WeakPolarHBondContact O-CB 3.48Å; K376-M380 PolarHBondContact O-N 3.49Å; I377-M380 PolarHBondContact O-N 3.4Å; I377-M380 VanDerWaalsContact O-N 3.15Å; V378-M380 PolarHBondContact O-N 3.09Å; M380-R384 WeakPolarHBondContact O-CB 3.12Å; M380-R384 WeakPolarHBondContact O-CG 3.46Å; M380-R384 PolarHBondContact O-N 3.07Å; M380-R384 VanDerWaalsContact O-N 3.08Å; M380-F386 HydrophobicContact CE-CD2 4.4Å
381	I	94.4	Very high	89.4	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-61.7	-47	173.9	-75.7	170.7	0	0	0	110.2	I377 V378 K379 R384 N385 F386 V389 T495 I536	I377-I381 HydrophobicContact CG2-CD1 3.85Å; I377-I381 HydrophobicContact CG2-CG1 4.35Å; I377-I381 WeakPolarHBondContact O-CG1 3.37Å; I377-I381 PolarHBondContact O-N 2.98Å; V378-I381 WeakPolarHBondContact O-CB 3.17Å; V378-I381 PolarHBondContact O-N 3.13Å; K379-I381 VanDerWaalsContact C-N 3.34Å; K379-I381 PolarHBondContact O-N 2.69Å; I381-R384 PolarHBondContact O-N 2.81Å; I381-N385 PolarHBondContact O-N 3.07Å; I381-F386 HydrophobicContact CB-CB 4.31Å; I381-F386 HydrophobicContact CG1-CB 4.49Å; I381-F386 HydrophobicContact CG2-CB 3.83Å; I381-F386 PolarHBondContact O-N 3.43Å; I381-V389 HydrophobicContact CD1-CB 4.4Å; I381-V389 HydrophobicContact CD1-CG2 3.9Å; I381-V389 HydrophobicContact CG2-CB 4.03Å; I381-V389 HydrophobicContact CG2-CG1 3.94Å; I381-T495 HydrophobicContact CD1-CG2 3.85Å; I381-T495 HydrophobicContact CG1-CG2 4.45Å; I381-I536 HydrophobicContact CD1-CD1 4.07Å; I381-I536 HydrophobicContact CG1-CD1 4.37Å
382	M	93.4	Very high	91.3	Very high	38 Å²	38	39.4 Å²	39.4	19%	0.187	18%	0.184	C	C	.	.	H	α-helix	trans	-65.9	-46	177.8	-59.9	-58.1	176.6	0	0	111.8	V378 K379 R384 N385 Q387 V389 F411 K477 A478	V378-M382 HydrophobicContact CG1-CE 4.37Å; V378-M382 WeakPolarHBondContact O-CG 3.41Å; V378-M382 PolarHBondContact O-N 2.91Å; V378-M382 VanDerWaalsContact O-N 3.09Å; K379-M382 PolarHBondContact O-N 3.02Å; M382-R384 PolarHBondContact O-N 3.43Å; M382-R384 VanDerWaalsContact O-N 3.15Å; M382-N385 PolarHBondContact O-N 2.97Å; M382-Q387 HydrophobicContact SD-CB 3.83Å; M382-Q387 HydrophobicContact SD-CG 4.45Å; M382-V389 HydrophobicContact CE-CG1 4.17Å; M382-F411 HydrophobicContact CB-CD1 4.49Å; M382-F411 HydrophobicContact CB-CE1 4.4Å; M382-F411 HydrophobicContact CE-CD1 4.27Å; M382-F411 HydrophobicContact CE-CD2 3.91Å; M382-F411 HydrophobicContact CE-CE1 4.31Å; M382-F411 HydrophobicContact CE-CE2 3.94Å; M382-F411 HydrophobicContact CE-CG 4.07Å; M382-F411 HydrophobicContact CE-CZ 4.15Å; M382-F411 HydrophobicContact CG-CD1 3.77Å; M382-F411 HydrophobicContact CG-CE1 3.61Å; M382-F411 HydrophobicContact CG-CG 4.45Å; M382-F411 HydrophobicContact CG-CZ 4.15Å; M382-F411 HydrophobicContact SD-CD1 4.25Å; M382-F411 HydrophobicContact SD-CG 4.4Å; M382-K477 HydrophobicContact CE-CB 3.65Å; M382-K477 HydrophobicContact SD-CB 4.08Å; M382-A478 HydrophobicContact CE-CB 3.77Å
383	E	92.4	Very high	92.3	Very high	133 Å²	133	38.1 Å²	38.1	62%	0.621	18%	0.175	S	C	*	.	H	α-helix	trans	-62.1	-21	177.9	-72.4	177.9	139.1	0	0	113.7	K379	K379-E383 IonicContact NZ-OE1 3.02Å; K379-E383 PolarHBondContact NZ-OE1 2.67Å; K379-E383 IonicContact NZ-OE2 3.73Å; K379-E383 PolarHBondContact NZ-OE2 3.13Å; K379-E383 WeakPolarHBondContact O-CG 3.06Å; K379-E383 PolarHBondContact O-N 3.14Å
384	R	92.5	Very high	92.7	Very high	155 Å²	155	38.6 Å²	38.6	59%	0.585	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.9	7.7	175.5	-66.6	-176.9	176.2	-158.6	-1.2	114	M380 I381 M382 F386	M380-R384 WeakPolarHBondContact O-CB 3.12Å; M380-R384 WeakPolarHBondContact O-CG 3.46Å; M380-R384 PolarHBondContact O-N 3.07Å; M380-R384 VanDerWaalsContact O-N 3.08Å; I381-R384 PolarHBondContact O-N 2.81Å; M382-R384 PolarHBondContact O-N 3.43Å; M382-R384 VanDerWaalsContact O-N 3.15Å; R384-F386 HydrophobicContact CB-CD1 4.04Å; R384-F386 HydrophobicContact CB-CD2 3.86Å; R384-F386 HydrophobicContact CB-CE1 4Å; R384-F386 HydrophobicContact CB-CE2 3.83Å; R384-F386 HydrophobicContact CB-CG 3.98Å; R384-F386 HydrophobicContact CB-CZ 3.9Å; R384-F386 HydrophobicContact CG-CE2 4.45Å; R384-F386 VanDerWaalsContact O-CD1 3.23Å; R384-F386 WeakPolarHBondContact O-CD1 3.4Å; R384-F386 PolarHBondContact O-N 2.92Å
385	N	93.1	Very high	92.7	Very high	91 Å²	91	40.2 Å²	40.2	49%	0.487	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	37	-175.4	-165.4	18.1	0	0	0	113.6	I381 M382 Q387 R494	I381-N385 PolarHBondContact O-N 3.07Å; M382-N385 PolarHBondContact O-N 2.97Å; N385-Q387 PolarHBondContact O-N 2.86Å; N385-Q387 PolarHBondContact OD1-NE2 3.14Å; N385-R494 PolarHBondContact O-NH1 3.03Å
386	F	94.8	Very high	92.7	Very high	39 Å²	39	41 Å²	41	17%	0.171	19%	0.19	C	C	.	.			trans	-87.2	16.5	176.2	-66.3	-13.8	0	0	0	112.6	M380 I381 R384 T495 I534	M380-F386 HydrophobicContact CE-CD2 4.4Å; I381-F386 HydrophobicContact CB-CB 4.31Å; I381-F386 HydrophobicContact CG1-CB 4.49Å; I381-F386 HydrophobicContact CG2-CB 3.83Å; I381-F386 PolarHBondContact O-N 3.43Å; R384-F386 HydrophobicContact CB-CD1 4.04Å; R384-F386 HydrophobicContact CB-CD2 3.86Å; R384-F386 HydrophobicContact CB-CE1 4Å; R384-F386 HydrophobicContact CB-CE2 3.83Å; R384-F386 HydrophobicContact CB-CG 3.98Å; R384-F386 HydrophobicContact CB-CZ 3.9Å; R384-F386 HydrophobicContact CG-CE2 4.45Å; R384-F386 VanDerWaalsContact O-CD1 3.23Å; R384-F386 WeakPolarHBondContact O-CD1 3.4Å; R384-F386 PolarHBondContact O-N 2.92Å; F386-T495 WeakPolarHBondContact O-CB 3.3Å; F386-T495 PolarHBondContact O-OG1 2.62Å; F386-I534 HydrophobicContact CB-CD1 4.31Å; F386-I534 HydrophobicContact CD1-CD1 3.69Å; F386-I534 HydrophobicContact CD2-CD1 3.6Å; F386-I534 HydrophobicContact CE1-CD1 3.76Å; F386-I534 HydrophobicContact CE2-CD1 3.67Å; F386-I534 HydrophobicContact CG-CD1 3.61Å; F386-I534 HydrophobicContact CZ-CD1 3.75Å
387	Q	91	Very high	92.7	Very high	54 Å²	54	44 Å²	44	25%	0.252	20%	0.203	S	C	.	.			trans	-79	157.6	175.6	60.4	73.4	32.7	0	0	112.2	M382 N385 K477 R494	M382-Q387 HydrophobicContact SD-CB 3.83Å; M382-Q387 HydrophobicContact SD-CG 4.45Å; N385-Q387 PolarHBondContact O-N 2.86Å; N385-Q387 PolarHBondContact OD1-NE2 3.14Å; Q387-K477 HydrophobicContact CB-CB 4.46Å; Q387-R494 WeakPolarHBondContact O-CB 3.33Å; Q387-R494 WeakPolarHBondContact O-CD 3.4Å
388	P	95.9	Very high	92.6	Very high	7 Å²	7	46.9 Å²	46.9	5%	0.045	22%	0.219	C	C	.	.	S	Bend	cis	-72.2	155.1	-8.4	30.9	-34.7	0	0	0	111.8	F471 K477 A493 R494 T495	P388-F471 HydrophobicContact CB-CE2 4.03Å; P388-F471 HydrophobicContact CB-CZ 4.19Å; P388-F471 HydrophobicContact CG-CZ 4.45Å; P388-K477 WeakPolarHBondContact CA-O 3.46Å; P388-A493 HydrophobicContact CG-CB 4.42Å; P388-R494 PolarHBondContact O-N 3.4Å; P388-T495 PolarHBondContact O-N 3.27Å; P388-T495 VanDerWaalsContact O-N 3.1Å
389	V	97	Very high	92.5	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	134	177.6	55.6	0	0	0	0	112.2	I381 M382 I391 K477 A478 L479 T495 L497	I381-V389 HydrophobicContact CD1-CB 4.4Å; I381-V389 HydrophobicContact CD1-CG2 3.9Å; I381-V389 HydrophobicContact CG2-CB 4.03Å; I381-V389 HydrophobicContact CG2-CG1 3.94Å; M382-V389 HydrophobicContact CE-CG1 4.17Å; V389-I391 HydrophobicContact CG1-CD1 3.94Å; V389-I391 HydrophobicContact CG2-CD1 4.06Å; V389-I391 HydrophobicContact CG2-CG1 4.16Å; V389-K477 WeakPolarHBondContact CG1-O 3.39Å; V389-K477 PolarHBondContact N-O 2.97Å; V389-A478 HydrophobicContact CG1-CB 3.98Å; V389-A478 WeakPolarHBondContact O-CA 3.46Å; V389-L479 PolarHBondContact O-N 2.97Å; V389-T495 VanDerWaalsContact CA-O 3.3Å; V389-T495 WeakPolarHBondContact CA-O 3.25Å; V389-T495 HydrophobicContact CG2-CG2 4.02Å; V389-L497 HydrophobicContact CG2-CB 4.23Å
390	I	96.9	Very high	92.4	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	129.1	164.8	-60.9	158.6	0	0	0	108.4	F392 F471 L479 A481 F485 A493 T495 V496 L497 R523	I390-F392 HydrophobicContact CB-CE2 4.5Å; I390-F392 HydrophobicContact CG2-CD1 4.23Å; I390-F392 HydrophobicContact CG2-CD2 4.08Å; I390-F392 HydrophobicContact CG2-CE1 3.87Å; I390-F392 HydrophobicContact CG2-CE2 3.7Å; I390-F392 HydrophobicContact CG2-CG 4.32Å; I390-F392 HydrophobicContact CG2-CZ 3.57Å; I390-F471 HydrophobicContact CD1-CZ 4.3Å; I390-F471 HydrophobicContact CG1-CE2 4.5Å; I390-F471 HydrophobicContact CG1-CZ 3.88Å; I390-L479 CarbonylContact C-O 3.55Å; I390-L479 WeakPolarHBondContact CA-O 3.13Å; I390-A481 HydrophobicContact CG2-CB 4.03Å; I390-F485 HydrophobicContact CD1-CD1 4.33Å; I390-F485 HydrophobicContact CD1-CE1 3.77Å; I390-F485 HydrophobicContact CG1-CE1 4.19Å; I390-F485 HydrophobicContact CG2-CD1 4.4Å; I390-A493 HydrophobicContact CD1-CB 3.57Å; I390-A493 HydrophobicContact CG1-CB 3.72Å; I390-T495 PolarHBondContact N-O 3.21Å; I390-V496 CarbonylContact O-C 3.46Å; I390-V496 WeakPolarHBondContact O-CA 3.32Å; I390-L497 PolarHBondContact O-N 3.01Å; I390-R523 HydrophobicContact CD1-CB 4.08Å
391	I	96.8	Very high	92.3	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.01	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	104.6	176.7	-54.9	87.9	0	0	0	108.3	V374 V378 V389 A478 L479 F480 A481 L497 T499	V374-I391 HydrophobicContact CG1-CG2 4.39Å; V378-I391 HydrophobicContact CG2-CD1 4.43Å; V378-I391 HydrophobicContact CG2-CG1 4.18Å; V389-I391 HydrophobicContact CG1-CD1 3.94Å; V389-I391 HydrophobicContact CG2-CD1 4.06Å; V389-I391 HydrophobicContact CG2-CG1 4.16Å; I391-A478 HydrophobicContact CD1-CB 4.06Å; I391-L479 PolarHBondContact N-O 2.96Å; I391-F480 HydrophobicContact CB-CD1 3.69Å; I391-F480 HydrophobicContact CB-CE1 3.78Å; I391-F480 HydrophobicContact CB-CG 4.38Å; I391-F480 HydrophobicContact CD1-CD1 4.26Å; I391-F480 HydrophobicContact CD1-CD2 4.35Å; I391-F480 HydrophobicContact CD1-CE1 3.95Å; I391-F480 HydrophobicContact CD1-CE2 4.05Å; I391-F480 HydrophobicContact CD1-CG 4.44Å; I391-F480 HydrophobicContact CD1-CZ 3.81Å; I391-F480 HydrophobicContact CG1-CD1 4.15Å; I391-F480 HydrophobicContact CG1-CE1 3.77Å; I391-F480 HydrophobicContact CG1-CZ 4.08Å; I391-F480 HydrophobicContact CG2-CD1 3.79Å; I391-F480 HydrophobicContact CG2-CE1 3.75Å; I391-A481 PolarHBondContact O-N 3.43Å; I391-L497 CarbonylContact C-O 3.59Å; I391-L497 VanDerWaalsContact CA-O 3.31Å; I391-L497 WeakPolarHBondContact CA-O 3.39Å; I391-L497 HydrophobicContact CG1-CB 4.25Å; I391-L497 HydrophobicContact CG1-CD2 3.98Å; I391-L497 HydrophobicContact CG2-CB 4.45Å; I391-L497 HydrophobicContact CG2-CD2 4.05Å; I391-L497 HydrophobicContact CG2-CG 4.18Å; I391-T499 HydrophobicContact CG2-CG2 3.42Å; I391-T499 VanDerWaalsContact CG2-CG2 3.42Å
392	F	95.9	Very high	92.2	Very high	1 Å²	1	49 Å²	49	0%	0.004	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	130.7	178.3	-73.6	-63.1	0	0	0	112.6	I390 A481 F485 A486 V496 L497 T499 M520	I390-F392 HydrophobicContact CB-CE2 4.5Å; I390-F392 HydrophobicContact CG2-CD1 4.23Å; I390-F392 HydrophobicContact CG2-CD2 4.08Å; I390-F392 HydrophobicContact CG2-CE1 3.87Å; I390-F392 HydrophobicContact CG2-CE2 3.7Å; I390-F392 HydrophobicContact CG2-CG 4.32Å; I390-F392 HydrophobicContact CG2-CZ 3.57Å; F392-A481 WeakPolarHBondContact CA-O 3.18Å; F392-A481 HydrophobicContact CD1-CB 4.13Å; F392-A481 HydrophobicContact CE1-CB 4.09Å; F392-F485 HydrophobicContact CE1-CB 4.31Å; F392-F485 HydrophobicContact CE1-CD1 4.47Å; F392-F485 HydrophobicContact CZ-CD1 4.5Å; F392-A486 HydrophobicContact CE1-CB 4Å; F392-A486 HydrophobicContact CZ-CB 3.73Å; F392-V496 HydrophobicContact CD2-CG1 3.62Å; F392-V496 HydrophobicContact CE2-CG1 3.76Å; F392-V496 HydrophobicContact CE2-CG2 4.47Å; F392-L497 PolarHBondContact N-O 3.47Å; F392-T499 PolarHBondContact O-N 2.8Å; F392-T499 PolarHBondContact O-OG1 2.96Å; F392-M520 HydrophobicContact CB-SD 4.25Å; F392-M520 HydrophobicContact CD1-CG 4.38Å; F392-M520 HydrophobicContact CD1-SD 4.3Å; F392-M520 HydrophobicContact CD2-CB 3.86Å; F392-M520 HydrophobicContact CD2-CG 4Å; F392-M520 HydrophobicContact CD2-SD 4.26Å; F392-M520 HydrophobicContact CE1-CG 4.34Å; F392-M520 HydrophobicContact CE2-CB 3.79Å; F392-M520 HydrophobicContact CE2-CG 3.98Å; F392-M520 HydrophobicContact CG-CG 4.22Å; F392-M520 HydrophobicContact CG-SD 4.03Å; F392-M520 HydrophobicContact CZ-CB 4.4Å; F392-M520 HydrophobicContact CZ-CG 4.16Å
393	S	91.9	Very high	92.1	Very high	6 Å²	6	47.2 Å²	47.2	4%	0.042	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	155.1	166.1	-176.6	0	0	0	0	111.1	D398 A481 T482 T499	S393-D398 VanDerWaalsContact OG-CB 3.32Å; S393-D398 WeakPolarHBondContact OG-CB 3.4Å; S393-A481 PolarHBondContact N-O 2.91Å; S393-T482 WeakPolarHBondContact O-CA 3.49Å; S393-T499 WeakPolarHBondContact CB-OG1 3.22Å; S393-T499 PolarHBondContact OG-OG1 3.06Å
394	F	88.5	Confident	91.9	Very high	53 Å²	53	45.9 Å²	45.9	23%	0.232	22%	0.223	C	C	.	.	S	Bend	trans	-91.2	5.8	-177.3	-52.8	-63.8	0	0	0	113.7	N500 R502 K503 I512 M520	F394-N500 HydrophobicContact CE2-CB 4.4Å; F394-R502 WeakPolarHBondContact CD2-O 3.48Å; F394-K503 HydrophobicContact CB-CG 4.37Å; F394-K503 HydrophobicContact CD1-CB 4.39Å; F394-K503 HydrophobicContact CD1-CD 3.93Å; F394-K503 HydrophobicContact CD1-CG 4.13Å; F394-K503 HydrophobicContact CD2-CB 4.07Å; F394-K503 HydrophobicContact CE1-CD 4.22Å; F394-K503 HydrophobicContact CE2-CB 4.32Å; F394-K503 HydrophobicContact CG-CB 4.13Å; F394-K503 HydrophobicContact CG-CD 4.39Å; F394-K503 HydrophobicContact CG-CG 4.06Å; F394-I512 HydrophobicContact CE1-CG2 4.22Å; F394-I512 HydrophobicContact CE2-CG2 4.12Å; F394-I512 HydrophobicContact CZ-CG2 3.58Å; F394-M520 HydrophobicContact CE1-CE 4.01Å; F394-M520 HydrophobicContact CE1-SD 4.1Å; F394-M520 HydrophobicContact CZ-CE 4.42Å
395	S	87.1	Confident	91.7	Very high	37 Å²	37	41.5 Å²	41.5	26%	0.259	21%	0.209	S	C	.	.			trans	-129.5	131.3	-177.6	157.6	0	0	0	0	111.2	K397 D398 C399	S395-K397 VanDerWaalsContact C-N 3.29Å; S395-K397 PolarHBondContact O-N 2.92Å; S395-K397 PolarHBondContact OG-N 3.42Å; S395-D398 VanDerWaalsContact CB-CG 3.45Å; S395-D398 WeakPolarHBondContact CB-OD1 3.31Å; S395-D398 PolarHBondContact O-N 3.44Å; S395-D398 PolarHBondContact OG-N 2.96Å; S395-D398 VanDerWaalsContact OG-N 3.13Å; S395-D398 PolarHBondContact OG-OD1 3.08Å; S395-C399 PolarHBondContact O-N 3.02Å; S395-C399 PolarHBondContact O-SG 3.49Å
396	K	89.3	Confident	91.5	Very high	44 Å²	44	37.1 Å²	37.1	19%	0.191	19%	0.186	C	C	.	.	H	α-helix	trans	-52.4	-49.4	172.8	-64.1	179.4	-178.4	179.9	0	110.1	D398 C399 H456 E916 F989 S992	K396-D398 PolarHBondContact O-N 3.43Å; K396-C399 PolarHBondContact O-N 3.31Å; K396-H456 HydrophobicContact CG-CB 4.36Å; K396-E916 IonicContact NZ-OE1 2.78Å; K396-E916 PolarHBondContact NZ-OE1 3.42Å; K396-E916 IonicContact NZ-OE2 3.91Å; K396-E916 PolarHBondContact NZ-OE2 2.91Å; K396-F989 HydrophobicContact CB-CE1 4.45Å; K396-F989 HydrophobicContact CB-CE2 3.96Å; K396-F989 HydrophobicContact CB-CZ 3.79Å; K396-F989 HydrophobicContact CD-CD2 3.6Å; K396-F989 HydrophobicContact CD-CE2 3.58Å; K396-F989 HydrophobicContact CD-CG 4.26Å; K396-F989 HydrophobicContact CD-CZ 4.21Å; K396-F989 HydrophobicContact CG-CE2 4.39Å; K396-S992 PolarHBondContact NZ-OG 3.4Å; K396-S992 VanDerWaalsContact NZ-OG 3.08Å
397	K	88.4	Confident	91.1	Very high	145 Å²	145	37.5 Å²	37.5	63%	0.63	19%	0.191	S	C	*	.	H	α-helix	trans	-66.5	-33.5	-177.5	-62.5	-177.4	179.5	-178.2	0	112.9	S395 A401 F989	S395-K397 VanDerWaalsContact C-N 3.29Å; S395-K397 PolarHBondContact O-N 2.92Å; S395-K397 PolarHBondContact OG-N 3.42Å; K397-A401 VanDerWaalsContact O-CB 3.25Å; K397-A401 WeakPolarHBondContact O-CB 3.45Å; K397-A401 PolarHBondContact O-N 3.42Å; K397-F989 HydrophobicContact CG-CZ 3.96Å
398	D	88.6	Confident	90.9	Very high	66 Å²	66	42.9 Å²	42.9	35%	0.353	21%	0.214	S	C	.	.	H	α-helix	trans	-71.8	-36.2	-180	-71	41.9	0	0	0	111.5	S393 S395 K396 A401 Y402	S393-D398 VanDerWaalsContact OG-CB 3.32Å; S393-D398 WeakPolarHBondContact OG-CB 3.4Å; S395-D398 VanDerWaalsContact CB-CG 3.45Å; S395-D398 WeakPolarHBondContact CB-OD1 3.31Å; S395-D398 PolarHBondContact O-N 3.44Å; S395-D398 PolarHBondContact OG-N 2.96Å; S395-D398 VanDerWaalsContact OG-N 3.13Å; S395-D398 PolarHBondContact OG-OD1 3.08Å; K396-D398 PolarHBondContact O-N 3.43Å; D398-A401 PolarHBondContact O-N 3.22Å; D398-Y402 HydrophobicContact CB-CD2 4.4Å; D398-Y402 HydrophobicContact CB-CE2 4.15Å; D398-Y402 WeakPolarHBondContact O-CD2 3.31Å; D398-Y402 PolarHBondContact O-N 3.17Å
399	C	90.3	Very high	90.5	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-59.6	-51.1	176.2	-62.6	0	0	0	0	110.9	S395 K396 Y402 A403 I454 F480	S395-C399 PolarHBondContact O-N 3.02Å; S395-C399 PolarHBondContact O-SG 3.49Å; K396-C399 PolarHBondContact O-N 3.31Å; C399-Y402 PolarHBondContact O-N 3.33Å; C399-A403 WeakPolarHBondContact O-CB 3.17Å; C399-A403 PolarHBondContact O-N 3.24Å; C399-I454 HydrophobicContact CB-CG2 4.42Å; C399-F480 HydrophobicContact CB-CB 4.36Å
400	E	90.7	Very high	90.4	Very high	60 Å²	60	48.3 Å²	48.3	28%	0.28	24%	0.242	S	C	.	.	H	α-helix	trans	-58.9	-47.8	174	-64.8	169	-163	0	0	111.6	Y402 A403 L404 I454 H456 F989	E400-Y402 VanDerWaalsContact C-N 3.33Å; E400-Y402 PolarHBondContact O-N 3.2Å; E400-A403 PolarHBondContact O-N 3.12Å; E400-L404 WeakPolarHBondContact O-CB 3.27Å; E400-L404 WeakPolarHBondContact O-CG 3.35Å; E400-L404 PolarHBondContact O-N 3.16Å; E400-I454 HydrophobicContact CG-CG2 4.46Å; E400-H456 IonicContact OE1-CE1 3.47Å; E400-H456 PolarHBondContact OE1-CE1 3.19Å; E400-H456 IonicContact OE1-NE2 3.94Å; E400-H456 PolarHBondContact OE1-NE2 3.45Å; E400-F989 WeakPolarHBondContact OE1-CE1 3.49Å
401	A	90.1	Very high	90.2	Very high	47 Å²	47	50.1 Å²	50.1	39%	0.388	25%	0.25	S	S	.	.	H	α-helix	trans	-63.2	-34.3	-178.2	0	0	0	0	0	113.3	K397 D398 Q405	K397-A401 VanDerWaalsContact O-CB 3.25Å; K397-A401 WeakPolarHBondContact O-CB 3.45Å; K397-A401 PolarHBondContact O-N 3.42Å; D398-A401 PolarHBondContact O-N 3.22Å; A401-Q405 WeakPolarHBondContact O-CG 3.41Å; A401-Q405 PolarHBondContact O-NE2 3.41Å
402	Y	91.3	Very high	90.2	Very high	52 Å²	52	50.5 Å²	50.5	20%	0.204	25%	0.252	C	S	.	.	H	α-helix	trans	-77	-40.9	173.6	-69	-52.9	0	0	0	112.3	V374 D398 C399 E400 L404 Q405 M406 T499	V374-Y402 HydrophobicContact CB-CD1 4Å; V374-Y402 HydrophobicContact CB-CE1 4.23Å; V374-Y402 HydrophobicContact CG1-CD1 4.28Å; V374-Y402 HydrophobicContact CG1-CG 4.39Å; V374-Y402 HydrophobicContact CG2-CD1 3.73Å; V374-Y402 HydrophobicContact CG2-CE1 3.5Å; V374-Y402 HydrophobicContact CG2-CE2 4.44Å; V374-Y402 HydrophobicContact CG2-CG 4.31Å; D398-Y402 HydrophobicContact CB-CD2 4.4Å; D398-Y402 HydrophobicContact CB-CE2 4.15Å; D398-Y402 WeakPolarHBondContact O-CD2 3.31Å; D398-Y402 PolarHBondContact O-N 3.17Å; C399-Y402 PolarHBondContact O-N 3.33Å; E400-Y402 VanDerWaalsContact C-N 3.33Å; E400-Y402 PolarHBondContact O-N 3.2Å; Y402-L404 VanDerWaalsContact C-N 3.34Å; Y402-L404 PolarHBondContact O-N 3.43Å; Y402-Q405 WeakPolarHBondContact O-CB 3.35Å; Y402-Q405 PolarHBondContact O-N 3.39Å; Y402-M406 WeakPolarHBondContact O-CE 3.29Å; Y402-M406 PolarHBondContact O-N 3.44Å; Y402-T499 HydrophobicContact CD2-CG2 4.06Å; Y402-T499 HydrophobicContact CE2-CG2 3.89Å
403	A	91.1	Very high	90.2	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-59.4	-43.6	175.4	0	0	0	0	0	112	C399 E400 Q405 M406 I452 I454 F480	C399-A403 WeakPolarHBondContact O-CB 3.17Å; C399-A403 PolarHBondContact O-N 3.24Å; E400-A403 PolarHBondContact O-N 3.12Å; A403-Q405 PolarHBondContact O-N 3.47Å; A403-M406 WeakPolarHBondContact O-CB 3.18Å; A403-M406 PolarHBondContact O-N 2.67Å; A403-I452 HydrophobicContact CB-CG2 4.08Å; A403-I454 HydrophobicContact CB-CD1 3.63Å; A403-I454 HydrophobicContact CB-CG1 3.55Å; A403-F480 HydrophobicContact CB-CB 4.3Å; A403-F480 HydrophobicContact CB-CD2 3.68Å; A403-F480 HydrophobicContact CB-CE2 4.28Å; A403-F480 HydrophobicContact CB-CG 3.99Å
404	L	88.8	Confident	90.4	Very high	105 Å²	105	59.4 Å²	59.4	55%	0.55	30%	0.302	S	S	.	.	H	α-helix	trans	-60.4	-28.6	174.8	-73.7	173.4	0	0	0	113.2	E400 Y402 M406 T407	E400-L404 WeakPolarHBondContact O-CB 3.27Å; E400-L404 WeakPolarHBondContact O-CG 3.35Å; E400-L404 PolarHBondContact O-N 3.16Å; Y402-L404 VanDerWaalsContact C-N 3.34Å; Y402-L404 PolarHBondContact O-N 3.43Å; L404-M406 VanDerWaalsContact C-N 3.34Å; L404-T407 WeakPolarHBondContact O-CG2 3.44Å; L404-T407 PolarHBondContact O-OG1 2.98Å
405	Q	89.1	Confident	90.8	Very high	62 Å²	62	63.7 Å²	63.7	29%	0.29	32%	0.323	S	S	.	.	H	α-helix	trans	-72.3	-27.4	174.1	-69.7	164.7	55.7	0	0	112.7	S372 F375 A401 Y402 A403	S372-Q405 PolarHBondContact OG-OE1 2.66Å; F375-Q405 WeakPolarHBondContact CD2-O 3.29Å; F375-Q405 WeakPolarHBondContact CE2-O 3.45Å; A401-Q405 WeakPolarHBondContact O-CG 3.41Å; A401-Q405 PolarHBondContact O-NE2 3.41Å; Y402-Q405 WeakPolarHBondContact O-CB 3.35Å; Y402-Q405 PolarHBondContact O-N 3.39Å; A403-Q405 PolarHBondContact O-N 3.47Å
406	M	89	Confident	91.2	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-78.7	-15.9	179.6	-54.5	-48.3	144.1	0	0	113.8	V374 F375 V378 Y402 A403 L404 K408 L409 I452 F480	V374-M406 HydrophobicContact CB-CE 4.22Å; V374-M406 HydrophobicContact CG1-CE 3.76Å; F375-M406 HydrophobicContact CB-CE 4.11Å; F375-M406 HydrophobicContact CB-SD 4.23Å; F375-M406 HydrophobicContact CD2-CE 4.47Å; F375-M406 HydrophobicContact CD2-SD 3.7Å; F375-M406 HydrophobicContact CG-SD 4.3Å; V378-M406 HydrophobicContact CB-SD 4.06Å; V378-M406 HydrophobicContact CG1-SD 4.09Å; V378-M406 HydrophobicContact CG2-CE 4.4Å; V378-M406 HydrophobicContact CG2-SD 4.39Å; Y402-M406 WeakPolarHBondContact O-CE 3.29Å; Y402-M406 PolarHBondContact O-N 3.44Å; A403-M406 WeakPolarHBondContact O-CB 3.18Å; A403-M406 PolarHBondContact O-N 2.67Å; L404-M406 VanDerWaalsContact C-N 3.34Å; M406-K408 PolarHBondContact O-N 3.45Å; M406-L409 PolarHBondContact O-N 3.38Å; M406-I452 HydrophobicContact CB-CD1 3.7Å; M406-I452 HydrophobicContact CB-CG1 4.24Å; M406-F480 HydrophobicContact CE-CE1 4.23Å; M406-F480 HydrophobicContact CE-CZ 3.84Å; M406-F480 HydrophobicContact CG-CE2 3.67Å; M406-F480 HydrophobicContact CG-CZ 3.43Å; M406-F480 VanDerWaalsContact CG-CZ 3.43Å; M406-F480 HydrophobicContact SD-CZ 4.28Å
407	T	85.7	Confident	91.6	Very high	46 Å²	46	62.9 Å²	62.9	28%	0.282	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	-19.3	179.1	54.7	0	0	0	0	116.3	L404 L409 L447 R450	L404-T407 WeakPolarHBondContact O-CG2 3.44Å; L404-T407 PolarHBondContact O-OG1 2.98Å; T407-L409 VanDerWaalsContact C-N 3.27Å; T407-L447 HydrophobicContact CG2-CD2 3.46Å; T407-L447 VanDerWaalsContact CG2-CD2 3.46Å; T407-R450 PolarHBondContact O-NE 3.23Å
408	K	86.3	Confident	91.9	Very high	168 Å²	168	62 Å²	62	73%	0.73	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-10	177	-58.5	172.1	-174.5	169.5	0	113.4	F375 M406	F375-K408 HydrophobicContact CE2-CB 4.29Å; M406-K408 PolarHBondContact O-N 3.45Å
409	L	88.5	Confident	92.3	Very high	38 Å²	38	62.7 Å²	62.7	20%	0.199	31%	0.314	C	S	.	.			trans	-113.2	154.4	174.6	-56.5	174.9	0	0	0	108.2	F375 K379 M406 T407 F411	F375-L409 HydrophobicContact CD2-CD1 4.49Å; F375-L409 HydrophobicContact CE1-CD1 4.38Å; F375-L409 HydrophobicContact CE2-CD1 3.79Å; F375-L409 HydrophobicContact CE2-CG 3.87Å; F375-L409 HydrophobicContact CZ-CD1 3.73Å; F375-L409 HydrophobicContact CZ-CD2 3.99Å; F375-L409 HydrophobicContact CZ-CG 3.75Å; K379-L409 HydrophobicContact CB-CD1 4.18Å; K379-L409 HydrophobicContact CG-CD1 4.42Å; M406-L409 PolarHBondContact O-N 3.38Å; T407-L409 VanDerWaalsContact C-N 3.27Å; L409-F411 HydrophobicContact CB-CD1 4.3Å; L409-F411 HydrophobicContact CB-CE1 3.49Å; L409-F411 VanDerWaalsContact CB-CE1 3.49Å; L409-F411 HydrophobicContact CB-CZ 3.66Å; L409-F411 HydrophobicContact CD1-CE1 3.8Å; L409-F411 HydrophobicContact CD1-CZ 3.79Å; L409-F411 HydrophobicContact CG-CE1 4.25Å; L409-F411 HydrophobicContact CG-CZ 4.36Å
410	D	94.3	Very high	92.6	Very high	83 Å²	83	62.7 Å²	62.7	44%	0.444	31%	0.314	S	S	.	.			trans	-132.8	120.1	176.4	-169.2	-7.4	0	0	0	106.2	N412 K417 R450	D410-N412 PolarHBondContact OD1-N 3.26Å; D410-K417 WeakPolarHBondContact OD1-CE 3.44Å; D410-K417 IonicContact OD1-NZ 3.56Å; D410-K417 PolarHBondContact OD1-NZ 3.01Å; D410-K417 WeakPolarHBondContact OD2-CE 3.31Å; D410-K417 IonicContact OD2-NZ 2.79Å; D410-K417 PolarHBondContact OD2-NZ 2.84Å; D410-R450 HydrophobicContact CB-CG 4.42Å; D410-R450 WeakPolarHBondContact OD1-CA 3.47Å
411	F	93.6	Very high	92.8	Very high	38 Å²	38	63.1 Å²	63.1	17%	0.167	32%	0.316	C	S	.	.			trans	-105.3	-4	-172.1	-51.5	-51	0	0	0	113.3	V378 M382 L409 R450 I452 K477 A478	V378-F411 HydrophobicContact CG1-CZ 4.08Å; M382-F411 HydrophobicContact CB-CD1 4.49Å; M382-F411 HydrophobicContact CB-CE1 4.4Å; M382-F411 HydrophobicContact CE-CD1 4.27Å; M382-F411 HydrophobicContact CE-CD2 3.91Å; M382-F411 HydrophobicContact CE-CE1 4.31Å; M382-F411 HydrophobicContact CE-CE2 3.94Å; M382-F411 HydrophobicContact CE-CG 4.07Å; M382-F411 HydrophobicContact CE-CZ 4.15Å; M382-F411 HydrophobicContact CG-CD1 3.77Å; M382-F411 HydrophobicContact CG-CE1 3.61Å; M382-F411 HydrophobicContact CG-CG 4.45Å; M382-F411 HydrophobicContact CG-CZ 4.15Å; M382-F411 HydrophobicContact SD-CD1 4.25Å; M382-F411 HydrophobicContact SD-CG 4.4Å; L409-F411 HydrophobicContact CB-CD1 4.3Å; L409-F411 HydrophobicContact CB-CE1 3.49Å; L409-F411 VanDerWaalsContact CB-CE1 3.49Å; L409-F411 HydrophobicContact CB-CZ 3.66Å; L409-F411 HydrophobicContact CD1-CE1 3.8Å; L409-F411 HydrophobicContact CD1-CZ 3.79Å; L409-F411 HydrophobicContact CG-CE1 4.25Å; L409-F411 HydrophobicContact CG-CZ 4.36Å; F411-R450 WeakPolarHBondContact CB-O 3.28Å; F411-R450 WeakPolarHBondContact CD2-O 3.4Å; F411-R450 PolarHBondContact N-O 2.87Å; F411-I452 HydrophobicContact CD2-CG1 3.9Å; F411-I452 HydrophobicContact CE2-CD1 4.21Å; F411-I452 HydrophobicContact CE2-CG1 3.73Å; F411-K477 HydrophobicContact CB-CB 3.98Å; F411-K477 HydrophobicContact CB-CG 3.69Å; F411-K477 HydrophobicContact CD2-CB 4.5Å; F411-K477 HydrophobicContact CG-CB 4.49Å; F411-A478 HydrophobicContact CE2-CB 4.2Å
412	N	95.6	Very high	93	Very high	10 Å²	10	66.6 Å²	66.6	5%	0.053	32%	0.324	C	S	.	.	S	Bend	trans	-112.5	146.6	-175.9	-74.5	9.7	0	0	0	111.2	D410 E416 K417 K449 G451 L475 K477	D410-N412 PolarHBondContact OD1-N 3.26Å; N412-E416 HydrophobicContact CB-CB 3.92Å; N412-K417 HydrophobicContact CB-CG 4.36Å; N412-K417 WeakPolarHBondContact O-CE 3.3Å; N412-K417 PolarHBondContact O-NZ 2.99Å; N412-K449 WeakPolarHBondContact CB-O 3.38Å; N412-G451 PolarHBondContact ND2-N 2.99Å; N412-G451 WeakPolarHBondContact OD1-CA 3.42Å; N412-L475 PolarHBondContact ND2-O 2.88Å; N412-L475 PolarHBondContact OD1-O 3.04Å; N412-K477 VanDerWaalsContact OD1-CE 3.23Å; N412-K477 WeakPolarHBondContact OD1-CE 3.37Å
413	T	96	Very high	93.2	Very high	76 Å²	76	66.3 Å²	66.3	47%	0.466	33%	0.328	S	S	.	.			trans	-68.1	165.7	165.6	60	0	0	0	0	111.4	E415 E416 K417	T413-E415 PolarHBondContact O-N 3.33Å; T413-E416 WeakPolarHBondContact CB-OE2 3.41Å; T413-E416 WeakPolarHBondContact CG2-OE2 3.45Å; T413-E416 PolarHBondContact N-OE2 3.46Å; T413-E416 PolarHBondContact O-N 3.19Å; T413-E416 VanDerWaalsContact OG1-CG 3.31Å; T413-E416 WeakPolarHBondContact OG1-CG 3.39Å; T413-E416 PolarHBondContact OG1-N 2.88Å; T413-E416 PolarHBondContact OG1-OE2 3.41Å; T413-K417 WeakPolarHBondContact O-CG 3.2Å; T413-K417 PolarHBondContact O-N 2.98Å
414	D	95.9	Very high	93.3	Very high	118 Å²	118	66.8 Å²	66.8	63%	0.631	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-6	176.9	-60.2	-30.3	0	0	0	113.4	K417	D414-K417 WeakPolarHBondContact OD1-CD 3.42Å; D414-K417 IonicContact OD1-NZ 3.27Å; D414-K417 PolarHBondContact OD1-NZ 3.34Å
415	E	96.3	Very high	93.5	Very high	143 Å²	143	64.9 Å²	64.9	67%	0.668	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-49	168.3	-173.5	166.2	-155	0	0	110.5	T413 K417 K418 M419	T413-E415 PolarHBondContact O-N 3.33Å; E415-K417 PolarHBondContact O-N 3.35Å; E415-K418 WeakPolarHBondContact O-CB 3.24Å; E415-K418 PolarHBondContact O-N 3.15Å; E415-M419 HydrophobicContact CG-CE 4.34Å; E415-M419 PolarHBondContact O-N 3.31Å
416	E	96.4	Very high	93.6	Very high	35 Å²	35	68 Å²	68	16%	0.164	34%	0.344	C	S	.	.	H	α-helix	trans	-58.4	-34.3	171.8	-70.2	164	118.5	0	0	112.3	N412 T413 K418 M419 V420 L475 K477	N412-E416 HydrophobicContact CB-CB 3.92Å; T413-E416 WeakPolarHBondContact CB-OE2 3.41Å; T413-E416 WeakPolarHBondContact CG2-OE2 3.45Å; T413-E416 PolarHBondContact N-OE2 3.46Å; T413-E416 PolarHBondContact O-N 3.19Å; T413-E416 VanDerWaalsContact OG1-CG 3.31Å; T413-E416 WeakPolarHBondContact OG1-CG 3.39Å; T413-E416 PolarHBondContact OG1-N 2.88Å; T413-E416 PolarHBondContact OG1-OE2 3.41Å; E416-K418 VanDerWaalsContact C-N 3.31Å; E416-K418 PolarHBondContact O-N 3.01Å; E416-M419 HydrophobicContact CB-CE 4.38Å; E416-M419 HydrophobicContact CG-CE 3.9Å; E416-M419 PolarHBondContact O-N 2.9Å; E416-V420 WeakPolarHBondContact O-CB 3.42Å; E416-V420 VanDerWaalsContact O-CG2 3.28Å; E416-V420 WeakPolarHBondContact O-CG2 3.43Å; E416-V420 PolarHBondContact O-N 3.25Å; E416-L475 HydrophobicContact CB-CD2 3.96Å; E416-L475 HydrophobicContact CG-CD2 3.94Å; E416-K477 WeakPolarHBondContact OE1-CE 3.23Å; E416-K477 IonicContact OE1-NZ 2.79Å; E416-K477 PolarHBondContact OE1-NZ 3.29Å
417	K	97	Very high	93.7	Very high	28 Å²	28	68.6 Å²	68.6	12%	0.122	35%	0.349	C	S	.	.	H	α-helix	trans	-60.1	-37.1	172.8	-80.4	164.4	-149.8	159.3	0	113.4	D410 N412 T413 D414 E415 E421 K449	D410-K417 WeakPolarHBondContact OD1-CE 3.44Å; D410-K417 IonicContact OD1-NZ 3.56Å; D410-K417 PolarHBondContact OD1-NZ 3.01Å; D410-K417 WeakPolarHBondContact OD2-CE 3.31Å; D410-K417 IonicContact OD2-NZ 2.79Å; D410-K417 PolarHBondContact OD2-NZ 2.84Å; N412-K417 HydrophobicContact CB-CG 4.36Å; N412-K417 WeakPolarHBondContact O-CE 3.3Å; N412-K417 PolarHBondContact O-NZ 2.99Å; T413-K417 WeakPolarHBondContact O-CG 3.2Å; T413-K417 PolarHBondContact O-N 2.98Å; D414-K417 WeakPolarHBondContact OD1-CD 3.42Å; D414-K417 IonicContact OD1-NZ 3.27Å; D414-K417 PolarHBondContact OD1-NZ 3.34Å; E415-K417 PolarHBondContact O-N 3.35Å; K417-E421 WeakPolarHBondContact O-CG 3.47Å; K417-E421 PolarHBondContact O-N 3.45Å; K417-K449 HydrophobicContact CG-CB 4.23Å; K417-K449 WeakPolarHBondContact CG-O 3.32Å
418	K	96.3	Very high	93.9	Very high	126 Å²	126	67 Å²	67	55%	0.548	34%	0.338	S	S	.	.	H	α-helix	trans	-73.3	-44.4	176	-67.6	174	-175.1	176.7	0	111	E415 E416 V420 E421 E422	E415-K418 WeakPolarHBondContact O-CB 3.24Å; E415-K418 PolarHBondContact O-N 3.15Å; E416-K418 VanDerWaalsContact C-N 3.31Å; E416-K418 PolarHBondContact O-N 3.01Å; K418-V420 VanDerWaalsContact C-N 3.27Å; K418-V420 PolarHBondContact O-N 2.94Å; K418-E421 CarbonylContact O-C 3.46Å; K418-E421 WeakPolarHBondContact O-CA 3.44Å; K418-E421 PolarHBondContact O-N 3.32Å; K418-E422 WeakPolarHBondContact O-CB 3.42Å; K418-E422 WeakPolarHBondContact O-CG 3.38Å; K418-E422 PolarHBondContact O-N 2.93Å
419	M	95.8	Very high	94.1	Very high	82 Å²	82	64.4 Å²	64.4	40%	0.404	33%	0.332	S	S	.	.	H	α-helix	trans	-58.6	-40.2	175.2	-66	-171.6	-73.6	0	0	111.6	E415 E416 V423 L475	E415-M419 HydrophobicContact CG-CE 4.34Å; E415-M419 PolarHBondContact O-N 3.31Å; E416-M419 HydrophobicContact CB-CE 4.38Å; E416-M419 HydrophobicContact CG-CE 3.9Å; E416-M419 PolarHBondContact O-N 2.9Å; M419-V423 WeakPolarHBondContact O-CB 3.37Å; M419-V423 VanDerWaalsContact O-CG2 3.29Å; M419-V423 WeakPolarHBondContact O-CG2 3.24Å; M419-V423 PolarHBondContact O-N 3.2Å; M419-L475 HydrophobicContact CB-CD1 4.1Å; M419-L475 HydrophobicContact CB-CD2 4.18Å; M419-L475 HydrophobicContact CE-CD2 4.07Å
420	V	96.6	Very high	93.9	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-61.5	-46	170.9	170.5	0	0	0	0	111.8	E416 K418 F424 L445 L448 K449 L470 L475	E416-V420 WeakPolarHBondContact O-CB 3.42Å; E416-V420 VanDerWaalsContact O-CG2 3.28Å; E416-V420 WeakPolarHBondContact O-CG2 3.43Å; E416-V420 PolarHBondContact O-N 3.25Å; K418-V420 VanDerWaalsContact C-N 3.27Å; K418-V420 PolarHBondContact O-N 2.94Å; V420-F424 WeakPolarHBondContact O-CB 3.14Å; V420-F424 PolarHBondContact O-N 3.43Å; V420-L445 HydrophobicContact CG1-CD1 4.29Å; V420-L448 HydrophobicContact CG1-CB 3.73Å; V420-K449 HydrophobicContact CG1-CG 4.21Å; V420-L470 HydrophobicContact CB-CD2 4.5Å; V420-L470 HydrophobicContact CG1-CD1 4.24Å; V420-L470 HydrophobicContact CG2-CD2 4.18Å; V420-L475 HydrophobicContact CG2-CB 3.8Å; V420-L475 HydrophobicContact CG2-CD1 4.12Å; V420-L475 HydrophobicContact CG2-CG 4.37Å
421	E	95.6	Very high	93.7	Very high	69 Å²	69	63.3 Å²	63.3	32%	0.322	33%	0.333	S	S	.	.	H	α-helix	trans	-64.9	-39.7	178.7	-80	178.6	133.8	0	0	112.9	K417 K418 S425 L445 K449	K417-E421 WeakPolarHBondContact O-CG 3.47Å; K417-E421 PolarHBondContact O-N 3.45Å; K418-E421 CarbonylContact O-C 3.46Å; K418-E421 WeakPolarHBondContact O-CA 3.44Å; K418-E421 PolarHBondContact O-N 3.32Å; E421-S425 WeakPolarHBondContact O-CB 3.14Å; E421-S425 PolarHBondContact O-N 2.86Å; E421-S425 PolarHBondContact O-OG 2.69Å; E421-L445 HydrophobicContact CG-CD1 4.24Å; E421-K449 HydrophobicContact CG-CD 3.69Å; E421-K449 HydrophobicContact CG-CG 4.08Å; E421-K449 WeakPolarHBondContact OE1-CD 3.49Å; E421-K449 WeakPolarHBondContact OE1-CE 3.42Å; E421-K449 IonicContact OE1-NZ 3.41Å; E421-K449 PolarHBondContact OE1-NZ 3.15Å; E421-K449 WeakPolarHBondContact OE2-CE 3.26Å; E421-K449 IonicContact OE2-NZ 2.75Å; E421-K449 PolarHBondContact OE2-NZ 2.91Å
422	E	94.9	Very high	93.4	Very high	119 Å²	119	63.8 Å²	63.8	56%	0.556	34%	0.34	S	S	*	.	H	α-helix	trans	-68.5	-50.1	178.9	-72.6	169	-156	0	0	110.9	K418 F424 S425 N426	K418-E422 WeakPolarHBondContact O-CB 3.42Å; K418-E422 WeakPolarHBondContact O-CG 3.38Å; K418-E422 PolarHBondContact O-N 2.93Å; E422-F424 PolarHBondContact O-N 3.43Å; E422-S425 PolarHBondContact O-N 3.27Å; E422-N426 WeakPolarHBondContact O-CB 3.24Å; E422-N426 PolarHBondContact O-N 3.41Å; E422-N426 PolarHBondContact O-ND2 2.74Å; E422-N426 VanDerWaalsContact O-ND2 3.09Å
423	V	93.6	Very high	93	Very high	47 Å²	47	68.6 Å²	68.6	29%	0.285	37%	0.366	S	S	.	.	H	α-helix	trans	-62.2	-44.3	176.1	172.2	0	0	0	0	111.4	M419 A427 I469 L470	M419-V423 WeakPolarHBondContact O-CB 3.37Å; M419-V423 VanDerWaalsContact O-CG2 3.29Å; M419-V423 WeakPolarHBondContact O-CG2 3.24Å; M419-V423 PolarHBondContact O-N 3.2Å; V423-A427 VanDerWaalsContact O-CB 3.3Å; V423-A427 WeakPolarHBondContact O-CB 3.43Å; V423-A427 PolarHBondContact O-N 3.21Å; V423-I469 HydrophobicContact CG1-CG2 4.23Å; V423-L470 HydrophobicContact CB-CD2 3.91Å; V423-L470 HydrophobicContact CG1-CD2 3.71Å; V423-L470 HydrophobicContact CG1-CG 4.25Å
424	F	94.6	Very high	92.7	Very high	10 Å²	10	70.5 Å²	70.5	4%	0.044	37%	0.37	C	S	.	.	H	α-helix	trans	-64.7	-44.3	177.8	-176.6	-89.7	0	0	0	111.9	V420 E422 A427 I428 V441 V444 L445 L448 L463 T466	V420-F424 WeakPolarHBondContact O-CB 3.14Å; V420-F424 PolarHBondContact O-N 3.43Å; E422-F424 PolarHBondContact O-N 3.43Å; F424-A427 PolarHBondContact O-N 3.26Å; F424-I428 HydrophobicContact CD1-CG1 4.06Å; F424-I428 HydrophobicContact CD2-CG1 4.44Å; F424-I428 HydrophobicContact CE1-CG1 3.82Å; F424-I428 HydrophobicContact CE2-CG1 4.22Å; F424-I428 HydrophobicContact CG-CG1 4.38Å; F424-I428 HydrophobicContact CZ-CD1 4.42Å; F424-I428 HydrophobicContact CZ-CG1 3.91Å; F424-I428 VanDerWaalsContact O-CB 3.24Å; F424-I428 WeakPolarHBondContact O-CB 3.49Å; F424-I428 VanDerWaalsContact O-CG1 3.24Å; F424-I428 WeakPolarHBondContact O-CG1 3.44Å; F424-I428 PolarHBondContact O-N 3.47Å; F424-V441 HydrophobicContact CE1-CG1 4.21Å; F424-V441 HydrophobicContact CZ-CG1 3.82Å; F424-V444 HydrophobicContact CE2-CG1 3.91Å; F424-V444 HydrophobicContact CZ-CG1 4.11Å; F424-L445 HydrophobicContact CB-CD1 4.08Å; F424-L445 HydrophobicContact CD1-CB 4.26Å; F424-L445 HydrophobicContact CD1-CD1 3.83Å; F424-L445 HydrophobicContact CD1-CD2 3.97Å; F424-L445 HydrophobicContact CD1-CG 4.23Å; F424-L445 HydrophobicContact CD2-CD1 4.35Å; F424-L445 HydrophobicContact CE1-CB 3.86Å; F424-L445 HydrophobicContact CE1-CD1 4.31Å; F424-L445 HydrophobicContact CE1-CD2 4.01Å; F424-L445 HydrophobicContact CE1-CG 4.27Å; F424-L445 HydrophobicContact CE2-CB 4.36Å; F424-L445 HydrophobicContact CG-CD1 3.84Å; F424-L445 HydrophobicContact CZ-CB 3.91Å; F424-L448 HydrophobicContact CD2-CD1 3.59Å; F424-L448 HydrophobicContact CE2-CD1 3.75Å; F424-L463 HydrophobicContact CE2-CD2 3.87Å; F424-L463 HydrophobicContact CZ-CD2 4.23Å; F424-T466 HydrophobicContact CD2-CG2 3.93Å
425	S	92.9	Very high	92.4	Very high	65 Å²	65	65.3 Å²	65.3	46%	0.455	34%	0.342	S	S	.	.	H	α-helix	trans	-65.3	-44.1	179.2	-57.8	0	0	0	0	111.4	E421 E422 A427 I428 D429	E421-S425 WeakPolarHBondContact O-CB 3.14Å; E421-S425 PolarHBondContact O-N 2.86Å; E421-S425 PolarHBondContact O-OG 2.69Å; E422-S425 PolarHBondContact O-N 3.27Å; S425-A427 PolarHBondContact O-N 2.86Å; S425-I428 PolarHBondContact O-N 2.73Å; S425-D429 WeakPolarHBondContact O-CB 3.42Å; S425-D429 PolarHBondContact O-N 2.78Å
426	N	91.4	Very high	92.1	Very high	128 Å²	128	60.8 Å²	60.8	68%	0.684	32%	0.32	S	S	*	.	H	α-helix	trans	-61.2	-43.3	176.3	-71.1	-28.4	0	0	0	111.9	E422	E422-N426 WeakPolarHBondContact O-CB 3.24Å; E422-N426 PolarHBondContact O-N 3.41Å; E422-N426 PolarHBondContact O-ND2 2.74Å; E422-N426 VanDerWaalsContact O-ND2 3.09Å
427	A	89.9	Confident	91.8	Very high	12 Å²	12	65.2 Å²	65.2	10%	0.099	34%	0.339	C	S	.	.	H	α-helix	trans	-65.5	-38.9	176.6	0	0	0	0	0	112.5	V423 F424 S425 C430 I462 T466 L1040	V423-A427 VanDerWaalsContact O-CB 3.3Å; V423-A427 WeakPolarHBondContact O-CB 3.43Å; V423-A427 PolarHBondContact O-N 3.21Å; F424-A427 PolarHBondContact O-N 3.26Å; S425-A427 PolarHBondContact O-N 2.86Å; A427-C430 PolarHBondContact O-SG 2.94Å; A427-I462 WeakPolarHBondContact O-CD1 3.15Å; A427-T466 HydrophobicContact CB-CG2 4.07Å; A427-T466 WeakPolarHBondContact CB-OG1 3.15Å; A427-L1040 HydrophobicContact CB-CD1 3.79Å; A427-L1040 HydrophobicContact CB-CD2 4.26Å
428	I	90.4	Very high	91.6	Very high	12 Å²	12	64 Å²	64	6%	0.062	33%	0.333	C	S	.	.	H	α-helix	trans	-82.3	-14.8	-178.3	-69.9	-67.2	0	0	0	112.8	F424 S425 C430 L431 K436 V441 I462 L463	F424-I428 HydrophobicContact CD1-CG1 4.06Å; F424-I428 HydrophobicContact CD2-CG1 4.44Å; F424-I428 HydrophobicContact CE1-CG1 3.82Å; F424-I428 HydrophobicContact CE2-CG1 4.22Å; F424-I428 HydrophobicContact CG-CG1 4.38Å; F424-I428 HydrophobicContact CZ-CD1 4.42Å; F424-I428 HydrophobicContact CZ-CG1 3.91Å; F424-I428 VanDerWaalsContact O-CB 3.24Å; F424-I428 WeakPolarHBondContact O-CB 3.49Å; F424-I428 VanDerWaalsContact O-CG1 3.24Å; F424-I428 WeakPolarHBondContact O-CG1 3.44Å; F424-I428 PolarHBondContact O-N 3.47Å; S425-I428 PolarHBondContact O-N 2.73Å; I428-C430 PolarHBondContact O-N 2.87Å; I428-C430 VanDerWaalsContact O-N 3.16Å; I428-L431 HydrophobicContact CD1-CD1 3.79Å; I428-L431 HydrophobicContact CG2-CD1 4.37Å; I428-L431 WeakPolarHBondContact O-CB 3.39Å; I428-L431 PolarHBondContact O-N 2.68Å; I428-K436 HydrophobicContact CG2-CG 3.84Å; I428-K436 WeakPolarHBondContact O-CE 3.45Å; I428-V441 HydrophobicContact CD1-CG1 4.03Å; I428-V441 HydrophobicContact CG1-CG1 4.41Å; I428-V441 HydrophobicContact CG2-CG1 4.3Å; I428-I462 HydrophobicContact CD1-CD1 4.38Å; I428-I462 HydrophobicContact CD1-CG2 4.46Å; I428-L463 HydrophobicContact CD1-CD2 4.02Å
429	D	89.9	Confident	91.2	Very high	113 Å²	113	61 Å²	61	60%	0.604	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-23.7	-174.2	-158.1	40.7	0	0	0	113.7	S425 L431 K436	S425-D429 WeakPolarHBondContact O-CB 3.42Å; S425-D429 PolarHBondContact O-N 2.78Å; D429-L431 PolarHBondContact O-N 2.84Å; D429-K436 WeakPolarHBondContact O-CE 3.48Å; D429-K436 PolarHBondContact O-NZ 2.94Å; D429-K436 IonicContact OD1-NZ 3Å; D429-K436 PolarHBondContact OD1-NZ 3.39Å
430	C	86.1	Confident	90.9	Very high	88 Å²	88	59.6 Å²	59.6	60%	0.595	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-8.2	174.4	74.2	0	0	0	0	114.6	A427 I428	A427-C430 PolarHBondContact O-SG 2.94Å; I428-C430 PolarHBondContact O-N 2.87Å; I428-C430 VanDerWaalsContact O-N 3.16Å
431	L	88.1	Confident	90.6	Very high	11 Å²	11	59.8 Å²	59.8	6%	0.058	32%	0.321	C	S	.	.	S	Bend	trans	-83.9	159.9	176.1	-62.7	-174.4	0	0	0	112.2	I428 D429 D435 K436 I462 I1034 A1037	I428-L431 HydrophobicContact CD1-CD1 3.79Å; I428-L431 HydrophobicContact CG2-CD1 4.37Å; I428-L431 WeakPolarHBondContact O-CB 3.39Å; I428-L431 PolarHBondContact O-N 2.68Å; D429-L431 PolarHBondContact O-N 2.84Å; L431-D435 HydrophobicContact CB-CB 4.07Å; L431-D435 HydrophobicContact CD1-CB 4.41Å; L431-K436 HydrophobicContact CB-CG 4.05Å; L431-K436 WeakPolarHBondContact O-CE 3.47Å; L431-K436 PolarHBondContact O-NZ 2.71Å; L431-I462 HydrophobicContact CD1-CD1 4.2Å; L431-I462 HydrophobicContact CD1-CG2 4.29Å; L431-I462 HydrophobicContact CD2-CD1 3.83Å; L431-I462 HydrophobicContact CG-CD1 3.89Å; L431-I1034 HydrophobicContact CD1-CD1 4.02Å; L431-I1034 HydrophobicContact CD1-CG1 4.46Å; L431-I1034 HydrophobicContact CD2-CB 4.15Å; L431-I1034 HydrophobicContact CD2-CD1 4.34Å; L431-I1034 HydrophobicContact CD2-CG1 3.87Å; L431-A1037 HydrophobicContact CD2-CB 4Å
432	S	88.6	Confident	90.3	Very high	47 Å²	47	61.7 Å²	61.7	33%	0.329	33%	0.33	S	S	.	.			trans	-67.9	155.9	172.8	78.3	0	0	0	0	111.6	E434 D435 K436	S432-E434 PolarHBondContact O-N 3.18Å; S432-E434 VanDerWaalsContact O-N 3.13Å; S432-D435 WeakPolarHBondContact CB-OD2 3.47Å; S432-D435 PolarHBondContact O-N 2.97Å; S432-D435 WeakPolarHBondContact OG-CB 3.39Å; S432-D435 PolarHBondContact OG-N 3.2Å; S432-D435 VanDerWaalsContact OG-N 3.09Å; S432-D435 PolarHBondContact OG-OD2 2.84Å; S432-K436 WeakPolarHBondContact O-CB 3.36Å; S432-K436 VanDerWaalsContact O-CG 3.31Å; S432-K436 WeakPolarHBondContact O-CG 3.34Å; S432-K436 PolarHBondContact O-N 2.96Å
433	D	87.8	Confident	90.1	Very high	111 Å²	111	62.5 Å²	62.5	59%	0.594	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-15.5	177	-79.7	-10	0	0	0	113.9	K436 K437	D433-K436 IonicContact OD1-NZ 2.75Å; D433-K437 WeakPolarHBondContact O-CG 3.16Å; D433-K437 PolarHBondContact O-NZ 2.88Å
434	E	88.1	Confident	90	Very high	117 Å²	117	60.8 Å²	60.8	55%	0.547	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-42.7	167.7	-68.6	-140.8	155	0	0	111.9	S432 K436 K437 L438 T978	S432-E434 PolarHBondContact O-N 3.18Å; S432-E434 VanDerWaalsContact O-N 3.13Å; E434-K436 VanDerWaalsContact C-N 3.29Å; E434-K436 PolarHBondContact O-N 3Å; E434-K437 CarbonylContact O-C 3.12Å; E434-K437 WeakPolarHBondContact O-CA 3.46Å; E434-K437 PolarHBondContact O-N 3.38Å; E434-L438 PolarHBondContact O-N 2.84Å; E434-T978 WeakPolarHBondContact OE2-CG2 2.97Å
435	D	89.6	Confident	90	Very high	8 Å²	8	62.1 Å²	62.1	4%	0.043	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-64.2	-34.9	178.4	-66.4	-46.8	0	0	0	112	L431 S432 K437 L438 I1034	L431-D435 HydrophobicContact CB-CB 4.07Å; L431-D435 HydrophobicContact CD1-CB 4.41Å; S432-D435 WeakPolarHBondContact CB-OD2 3.47Å; S432-D435 PolarHBondContact O-N 2.97Å; S432-D435 WeakPolarHBondContact OG-CB 3.39Å; S432-D435 PolarHBondContact OG-N 3.2Å; S432-D435 VanDerWaalsContact OG-N 3.09Å; S432-D435 PolarHBondContact OG-OD2 2.84Å; D435-K437 PolarHBondContact O-N 3.04Å; D435-L438 HydrophobicContact CB-CD1 4.18Å; D435-L438 WeakPolarHBondContact O-CB 3.31Å; D435-L438 WeakPolarHBondContact O-CD1 3.42Å; D435-L438 VanDerWaalsContact O-CG 3.31Å; D435-L438 WeakPolarHBondContact O-CG 3.33Å; D435-L438 PolarHBondContact O-N 2.88Å; D435-L438 VanDerWaalsContact O-N 3.13Å; D435-I1034 HydrophobicContact CB-CB 4.12Å; D435-I1034 HydrophobicContact CB-CD1 4.3Å; D435-I1034 VanDerWaalsContact OD1-CG2 3.28Å; D435-I1034 WeakPolarHBondContact OD1-CG2 3.19Å; D435-I1034 PolarHBondContact OD2-N 2.78Å
436	K	91	Very high	90.1	Very high	48 Å²	48	61.6 Å²	61.6	21%	0.209	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-58	-25.3	170.9	-73.5	173.3	177.9	166.2	0	113.3	I428 D429 L431 S432 D433 E434	I428-K436 HydrophobicContact CG2-CG 3.84Å; I428-K436 WeakPolarHBondContact O-CE 3.45Å; D429-K436 WeakPolarHBondContact O-CE 3.48Å; D429-K436 PolarHBondContact O-NZ 2.94Å; D429-K436 IonicContact OD1-NZ 3Å; D429-K436 PolarHBondContact OD1-NZ 3.39Å; L431-K436 HydrophobicContact CB-CG 4.05Å; L431-K436 WeakPolarHBondContact O-CE 3.47Å; L431-K436 PolarHBondContact O-NZ 2.71Å; S432-K436 WeakPolarHBondContact O-CB 3.36Å; S432-K436 VanDerWaalsContact O-CG 3.31Å; S432-K436 WeakPolarHBondContact O-CG 3.34Å; S432-K436 PolarHBondContact O-N 2.96Å; D433-K436 IonicContact OD1-NZ 2.75Å; E434-K436 VanDerWaalsContact C-N 3.29Å; E434-K436 PolarHBondContact O-N 3Å
437	K	90.6	Very high	90.3	Very high	128 Å²	128	56.1 Å²	56.1	56%	0.557	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-101.2	13.9	-179.6	-58.3	-178.8	-172.8	87.2	0	113	D433 E434 D435	D433-K437 WeakPolarHBondContact O-CG 3.16Å; D433-K437 PolarHBondContact O-NZ 2.88Å; E434-K437 CarbonylContact O-C 3.12Å; E434-K437 WeakPolarHBondContact O-CA 3.46Å; E434-K437 PolarHBondContact O-N 3.38Å; D435-K437 PolarHBondContact O-N 3.04Å
438	L	91.3	Very high	90.6	Very high	2 Å²	2	55.6 Å²	55.6	1%	0.01	29%	0.291	C	S	.	.			trans	-64.2	130.3	170.8	-76	166.3	0	0	0	109.4	E434 D435 Q440 V441 E442 L460 F979 A980 I1034	E434-L438 PolarHBondContact O-N 2.84Å; D435-L438 HydrophobicContact CB-CD1 4.18Å; D435-L438 WeakPolarHBondContact O-CB 3.31Å; D435-L438 WeakPolarHBondContact O-CD1 3.42Å; D435-L438 VanDerWaalsContact O-CG 3.31Å; D435-L438 WeakPolarHBondContact O-CG 3.33Å; D435-L438 PolarHBondContact O-N 2.88Å; D435-L438 VanDerWaalsContact O-N 3.13Å; L438-Q440 PolarHBondContact O-N 2.92Å; L438-V441 HydrophobicContact CB-CB 4.45Å; L438-V441 HydrophobicContact CB-CG2 4.02Å; L438-V441 WeakPolarHBondContact O-CA 3.47Å; L438-V441 WeakPolarHBondContact O-CB 3.37Å; L438-V441 PolarHBondContact O-N 3.38Å; L438-E442 PolarHBondContact O-N 3.38Å; L438-L460 HydrophobicContact CD1-CD1 4.48Å; L438-F979 HydrophobicContact CD1-CD1 3.77Å; L438-F979 HydrophobicContact CD1-CE1 4.37Å; L438-F979 HydrophobicContact CD2-CD1 4.07Å; L438-A980 HydrophobicContact CD2-CB 3.68Å; L438-I1034 HydrophobicContact CD1-CD1 3.66Å
439	P	89.1	Confident	90.9	Very high	63 Å²	63	57.7 Å²	57.7	41%	0.409	30%	0.3	S	S	.	.	H	α-helix	trans	-54.1	-28.6	178.4	-28.8	35.6	0	0	0	113.8	V441 H443	P439-V441 VanDerWaalsContact C-N 3.33Å; P439-H443 WeakPolarHBondContact O-CB 3.29Å; P439-H443 PolarHBondContact O-N 3.38Å; P439-H443 PolarHBondContact O-ND1 3.15Å; P439-H443 VanDerWaalsContact O-ND1 3.14Å
440	Q	88.2	Confident	91.2	Very high	54 Å²	54	56.4 Å²	56.4	25%	0.252	29%	0.287	S	S	.	.	H	α-helix	trans	-64.9	-34.1	175.3	-61.8	78	3.7	0	0	112.6	L438 V444 L460 E990	L438-Q440 PolarHBondContact O-N 2.92Å; Q440-V444 WeakPolarHBondContact O-CG1 3.45Å; Q440-L460 HydrophobicContact CB-CD1 4.1Å; Q440-E990 HydrophobicContact CG-CG 4.01Å; Q440-E990 WeakPolarHBondContact CG-OE1 3.39Å; Q440-E990 PolarHBondContact NE2-OE1 3.27Å
441	V	90.1	Very high	91.6	Very high	4 Å²	4	52.2 Å²	52.2	2%	0.024	26%	0.258	C	S	.	.	H	α-helix	trans	-82.7	-44.3	177.1	-178.8	0	0	0	0	110	F424 I428 L438 P439 V444 L460 L463	F424-V441 HydrophobicContact CE1-CG1 4.21Å; F424-V441 HydrophobicContact CZ-CG1 3.82Å; I428-V441 HydrophobicContact CD1-CG1 4.03Å; I428-V441 HydrophobicContact CG1-CG1 4.41Å; I428-V441 HydrophobicContact CG2-CG1 4.3Å; L438-V441 HydrophobicContact CB-CB 4.45Å; L438-V441 HydrophobicContact CB-CG2 4.02Å; L438-V441 WeakPolarHBondContact O-CA 3.47Å; L438-V441 WeakPolarHBondContact O-CB 3.37Å; L438-V441 PolarHBondContact O-N 3.38Å; P439-V441 VanDerWaalsContact C-N 3.33Å; V441-V444 WeakPolarHBondContact O-CG1 3.46Å; V441-L460 HydrophobicContact CG2-CD1 3.95Å; V441-L463 HydrophobicContact CG2-CD1 4.31Å; V441-L463 HydrophobicContact CG2-CD2 4.45Å
442	E	90.5	Very high	92.1	Very high	109 Å²	109	51.7 Å²	51.7	51%	0.509	26%	0.256	S	S	.	.	H	α-helix	trans	-65.5	-39.9	178.8	-65.5	-168.7	158.2	0	0	112.9	L438 P446	L438-E442 PolarHBondContact O-N 3.38Å; E442-P446 WeakPolarHBondContact O-CD 3.22Å
443	H	89.8	Confident	92.4	Very high	136 Å²	136	49.4 Å²	49.4	63%	0.63	24%	0.24	S	C	*	.	H	α-helix	trans	-77.2	-22.2	-177.5	-65.5	157.2	0	0	0	114.3	P439	P439-H443 WeakPolarHBondContact O-CB 3.29Å; P439-H443 PolarHBondContact O-N 3.38Å; P439-H443 PolarHBondContact O-ND1 3.15Å; P439-H443 VanDerWaalsContact O-ND1 3.14Å
444	V	92.7	Very high	92.8	Very high	11 Å²	11	44.7 Å²	44.7	7%	0.067	22%	0.215	C	C	.	.	H	α-helix	trans	-80.9	-38.2	-177.7	73.7	0	0	0	0	112.5	F424 Q440 V441 L447 L448 L463 I467	F424-V444 HydrophobicContact CE2-CG1 3.91Å; F424-V444 HydrophobicContact CZ-CG1 4.11Å; Q440-V444 WeakPolarHBondContact O-CG1 3.45Å; V441-V444 WeakPolarHBondContact O-CG1 3.46Å; V444-L447 WeakPolarHBondContact O-CA 3.3Å; V444-L447 VanDerWaalsContact O-CB 3.3Å; V444-L447 WeakPolarHBondContact O-CB 3.39Å; V444-L447 PolarHBondContact O-N 3.35Å; V444-L448 HydrophobicContact CG1-CD1 4.42Å; V444-L448 HydrophobicContact CG2-CD1 4.25Å; V444-L448 HydrophobicContact CG2-CD2 4.32Å; V444-L448 HydrophobicContact CG2-CG 4.15Å; V444-L448 WeakPolarHBondContact O-CG 3.38Å; V444-L448 PolarHBondContact O-N 2.97Å; V444-L448 VanDerWaalsContact O-N 3.12Å; V444-L463 HydrophobicContact CG1-CD1 4.03Å; V444-L463 HydrophobicContact CG1-CD2 3.86Å; V444-I467 HydrophobicContact CG2-CD1 4.13Å
445	L	93.9	Very high	93.1	Very high	37 Å²	37	39.8 Å²	39.8	19%	0.194	19%	0.191	C	C	.	.	H	α-helix	trans	-53.7	-43.7	-179.2	174.1	61.6	0	0	0	113.4	V420 E421 F424 L447 L448 K449	V420-L445 HydrophobicContact CG1-CD1 4.29Å; E421-L445 HydrophobicContact CG-CD1 4.24Å; F424-L445 HydrophobicContact CB-CD1 4.08Å; F424-L445 HydrophobicContact CD1-CB 4.26Å; F424-L445 HydrophobicContact CD1-CD1 3.83Å; F424-L445 HydrophobicContact CD1-CD2 3.97Å; F424-L445 HydrophobicContact CD1-CG 4.23Å; F424-L445 HydrophobicContact CD2-CD1 4.35Å; F424-L445 HydrophobicContact CE1-CB 3.86Å; F424-L445 HydrophobicContact CE1-CD1 4.31Å; F424-L445 HydrophobicContact CE1-CD2 4.01Å; F424-L445 HydrophobicContact CE1-CG 4.27Å; F424-L445 HydrophobicContact CE2-CB 4.36Å; F424-L445 HydrophobicContact CG-CD1 3.84Å; F424-L445 HydrophobicContact CZ-CB 3.91Å; L445-L447 PolarHBondContact O-N 3.06Å; L445-L447 VanDerWaalsContact O-N 3.17Å; L445-L448 PolarHBondContact O-N 3.03Å; L445-L448 VanDerWaalsContact O-N 3.16Å; L445-K449 HydrophobicContact CD1-CD 4.38Å; L445-K449 HydrophobicContact CD1-CG 3.93Å; L445-K449 HydrophobicContact CG-CD 4.45Å; L445-K449 HydrophobicContact CG-CG 4.38Å; L445-K449 WeakPolarHBondContact O-CG 3.42Å; L445-K449 PolarHBondContact O-N 3.48Å
446	P	94.7	Very high	93.2	Very high	55 Å²	55	39.4 Å²	39.4	36%	0.357	19%	0.189	S	C	.	.	H	α-helix	trans	-59.3	-22.2	172.8	-27.3	36	0	0	0	115.6	E442 R450	E442-P446 WeakPolarHBondContact O-CD 3.22Å; P446-R450 PolarHBondContact O-NH1 3Å
447	L	95.4	Very high	93.1	Very high	12 Å²	12	38.2 Å²	38.2	6%	0.063	19%	0.191	C	C	.	.	H	α-helix	trans	-80.3	-47.6	172.3	-55.1	179.7	0	0	0	110.5	T407 V444 L445 K449 R450 G451 I452 I454	T407-L447 HydrophobicContact CG2-CD2 3.46Å; T407-L447 VanDerWaalsContact CG2-CD2 3.46Å; V444-L447 WeakPolarHBondContact O-CA 3.3Å; V444-L447 VanDerWaalsContact O-CB 3.3Å; V444-L447 WeakPolarHBondContact O-CB 3.39Å; V444-L447 PolarHBondContact O-N 3.35Å; L445-L447 PolarHBondContact O-N 3.06Å; L445-L447 VanDerWaalsContact O-N 3.17Å; L447-K449 VanDerWaalsContact C-N 3.31Å; L447-K449 PolarHBondContact O-N 3.5Å; L447-R450 WeakPolarHBondContact O-CA 3.32Å; L447-R450 WeakPolarHBondContact O-CB 3.49Å; L447-R450 PolarHBondContact O-N 2.98Å; L447-G451 PolarHBondContact O-N 2.88Å; L447-I452 CarbonylContact C-O 3.57Å; L447-I452 HydrophobicContact CB-CB 4.32Å; L447-I452 HydrophobicContact CB-CG2 4.46Å; L447-I452 WeakPolarHBondContact CB-O 3.34Å; L447-I452 PolarHBondContact O-N 3.08Å; L447-I454 HydrophobicContact CD1-CD1 3.57Å; L447-I454 HydrophobicContact CD1-CG1 4.32Å
448	L	96.4	Very high	93	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-59	-43.1	-179.6	-55.6	177.8	0	0	0	111.3	V420 F424 V444 L445 R450 G451 I452 I467 L470 I476	V420-L448 HydrophobicContact CG1-CB 3.73Å; F424-L448 HydrophobicContact CD2-CD1 3.59Å; F424-L448 HydrophobicContact CE2-CD1 3.75Å; V444-L448 HydrophobicContact CG1-CD1 4.42Å; V444-L448 HydrophobicContact CG2-CD1 4.25Å; V444-L448 HydrophobicContact CG2-CD2 4.32Å; V444-L448 HydrophobicContact CG2-CG 4.15Å; V444-L448 WeakPolarHBondContact O-CG 3.38Å; V444-L448 PolarHBondContact O-N 2.97Å; V444-L448 VanDerWaalsContact O-N 3.12Å; L445-L448 PolarHBondContact O-N 3.03Å; L445-L448 VanDerWaalsContact O-N 3.16Å; L448-R450 PolarHBondContact O-N 3.03Å; L448-R450 VanDerWaalsContact O-N 3.15Å; L448-G451 PolarHBondContact O-N 3.29Å; L448-I452 PolarHBondContact N-O 2.97Å; L448-I467 HydrophobicContact CD1-CG1 4.26Å; L448-I467 HydrophobicContact CD2-CD1 3.98Å; L448-I467 HydrophobicContact CD2-CG1 3.64Å; L448-L470 HydrophobicContact CB-CD1 4.3Å; L448-L470 HydrophobicContact CD1-CD1 3.92Å; L448-L470 HydrophobicContact CG-CD1 4.45Å; L448-I476 HydrophobicContact CD2-CD1 3.95Å
449	K	96.4	Very high	93.1	Very high	56 Å²	56	33.2 Å²	33.2	24%	0.243	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-28.4	174.7	-73.2	-168	76.5	170	0	113.5	N412 K417 V420 E421 L445 L447 G451	N412-K449 WeakPolarHBondContact CB-O 3.38Å; K417-K449 HydrophobicContact CG-CB 4.23Å; K417-K449 WeakPolarHBondContact CG-O 3.32Å; V420-K449 HydrophobicContact CG1-CG 4.21Å; E421-K449 HydrophobicContact CG-CD 3.69Å; E421-K449 HydrophobicContact CG-CG 4.08Å; E421-K449 WeakPolarHBondContact OE1-CD 3.49Å; E421-K449 WeakPolarHBondContact OE1-CE 3.42Å; E421-K449 IonicContact OE1-NZ 3.41Å; E421-K449 PolarHBondContact OE1-NZ 3.15Å; E421-K449 WeakPolarHBondContact OE2-CE 3.26Å; E421-K449 IonicContact OE2-NZ 2.75Å; E421-K449 PolarHBondContact OE2-NZ 2.91Å; L445-K449 HydrophobicContact CD1-CD 4.38Å; L445-K449 HydrophobicContact CD1-CG 3.93Å; L445-K449 HydrophobicContact CG-CD 4.45Å; L445-K449 HydrophobicContact CG-CG 4.38Å; L445-K449 WeakPolarHBondContact O-CG 3.42Å; L445-K449 PolarHBondContact O-N 3.48Å; L447-K449 VanDerWaalsContact C-N 3.31Å; L447-K449 PolarHBondContact O-N 3.5Å; K449-G451 VanDerWaalsContact C-N 3.32Å
450	R	96.1	Very high	93.3	Very high	86 Å²	86	30.4 Å²	30.4	33%	0.325	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	4.6	177.3	-68.6	174.5	171.3	87.3	-1.2	113.5	T407 D410 F411 P446 L447 L448 I452	T407-R450 PolarHBondContact O-NE 3.23Å; D410-R450 HydrophobicContact CB-CG 4.42Å; D410-R450 WeakPolarHBondContact OD1-CA 3.47Å; F411-R450 WeakPolarHBondContact CB-O 3.28Å; F411-R450 WeakPolarHBondContact CD2-O 3.4Å; F411-R450 PolarHBondContact N-O 2.87Å; P446-R450 PolarHBondContact O-NH1 3Å; L447-R450 WeakPolarHBondContact O-CA 3.32Å; L447-R450 WeakPolarHBondContact O-CB 3.49Å; L447-R450 PolarHBondContact O-N 2.98Å; L448-R450 PolarHBondContact O-N 3.03Å; L448-R450 VanDerWaalsContact O-N 3.15Å; R450-I452 HydrophobicContact CB-CD1 3.91Å; R450-I452 HydrophobicContact CB-CG1 4.32Å
451	G	96.3	Very high	93.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.7	22.6	-173.4	0	0	0	0	0	114	N412 L447 L448 K449 L475 K477 A478	N412-G451 PolarHBondContact ND2-N 2.99Å; N412-G451 WeakPolarHBondContact OD1-CA 3.42Å; L447-G451 PolarHBondContact O-N 2.88Å; L448-G451 PolarHBondContact O-N 3.29Å; K449-G451 VanDerWaalsContact C-N 3.32Å; G451-L475 WeakPolarHBondContact CA-O 3.26Å; G451-K477 PolarHBondContact O-N 3.22Å; G451-A478 PolarHBondContact O-N 2.91Å
452	I	96.8	Very high	93.4	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	112.9	-178.4	-59.6	159.5	0	0	0	109.6	A403 M406 F411 L447 L448 R450 A478 F480	A403-I452 HydrophobicContact CB-CG2 4.08Å; M406-I452 HydrophobicContact CB-CD1 3.7Å; M406-I452 HydrophobicContact CB-CG1 4.24Å; F411-I452 HydrophobicContact CD2-CG1 3.9Å; F411-I452 HydrophobicContact CE2-CD1 4.21Å; F411-I452 HydrophobicContact CE2-CG1 3.73Å; L447-I452 CarbonylContact C-O 3.57Å; L447-I452 HydrophobicContact CB-CB 4.32Å; L447-I452 HydrophobicContact CB-CG2 4.46Å; L447-I452 WeakPolarHBondContact CB-O 3.34Å; L447-I452 PolarHBondContact O-N 3.08Å; L448-I452 PolarHBondContact N-O 2.97Å; R450-I452 HydrophobicContact CB-CD1 3.91Å; R450-I452 HydrophobicContact CB-CG1 4.32Å; I452-A478 WeakPolarHBondContact CA-O 3.47Å; I452-F480 HydrophobicContact CG2-CD2 4.16Å; I452-F480 HydrophobicContact CG2-CE2 4.12Å
453	G	95.9	Very high	93.5	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	158.6	175.3	0	0	0	0	0	113	A478 F480	G453-A478 PolarHBondContact N-O 2.8Å; G453-F480 PolarHBondContact O-N 3.47Å
454	I	95.7	Very high	93.5	Very high	12 Å²	12	19.4 Å²	19.4	6%	0.062	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	136.7	172.6	-56.2	175.7	0	0	0	107.9	C399 E400 A403 L447 H456 L459 I467 F480	C399-I454 HydrophobicContact CB-CG2 4.42Å; E400-I454 HydrophobicContact CG-CG2 4.46Å; A403-I454 HydrophobicContact CB-CD1 3.63Å; A403-I454 HydrophobicContact CB-CG1 3.55Å; L447-I454 HydrophobicContact CD1-CD1 3.57Å; L447-I454 HydrophobicContact CD1-CG1 4.32Å; I454-H456 VanDerWaalsContact CG2-CD2 3.43Å; I454-H456 WeakPolarHBondContact CG2-CD2 3.48Å; I454-H456 WeakPolarHBondContact CG2-NE2 3.34Å; I454-L459 HydrophobicContact CB-CD1 4.27Å; I454-L459 HydrophobicContact CG2-CD1 4.13Å; I454-L459 WeakPolarHBondContact O-CD1 3.49Å; I454-I467 VanDerWaalsContact O-CD1 3.24Å; I454-I467 WeakPolarHBondContact O-CD1 3.44Å; I454-F480 CarbonylContact C-O 3.54Å; I454-F480 WeakPolarHBondContact CA-O 3.37Å
455	H	94.4	Very high	93.4	Very high	13 Å²	13	19.5 Å²	19.5	6%	0.06	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	111.2	178.6	-166.1	-68.2	0	0	0	112.6	E468 L479 F480 A481 T482 F485	H455-E468 IonicContact CD2-OE1 3.61Å; H455-E468 IonicContact CE1-OE1 2.64Å; H455-E468 IonicContact NE2-OE1 3.16Å; H455-E468 PolarHBondContact NE2-OE1 3.35Å; H455-L479 HydrophobicContact CB-CD1 4.14Å; H455-F480 PolarHBondContact N-O 3.02Å; H455-A481 HydrophobicContact CB-CB 4.26Å; H455-A481 CarbonylContact O-C 3.56Å; H455-A481 VanDerWaalsContact O-CA 3.24Å; H455-A481 WeakPolarHBondContact O-CA 3.37Å; H455-T482 PolarHBondContact O-N 3.19Å; H455-F485 HydrophobicContact CB-CD2 4.35Å; H455-F485 AromaticContact CD2-CD2 3.64Å; H455-F485 AromaticContact CD2-CE2 3.99Å; H455-F485 AromaticContact CE1-CD2 3.77Å; H455-F485 AromaticContact CG-CD2 3.65Å; H455-F485 AromaticContact ND1-CD2 3.77Å; H455-F485 AromaticContact NE2-CD2 3.7Å
456	H	92.6	Very high	93.3	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.093	C	C	.	.			trans	-156	161	169.2	49.1	101.4	0	0	0	110.6	K396 E400 I454 G458 L459 T482	K396-H456 HydrophobicContact CG-CB 4.36Å; E400-H456 IonicContact OE1-CE1 3.47Å; E400-H456 PolarHBondContact OE1-CE1 3.19Å; E400-H456 IonicContact OE1-NE2 3.94Å; E400-H456 PolarHBondContact OE1-NE2 3.45Å; I454-H456 VanDerWaalsContact CG2-CD2 3.43Å; I454-H456 WeakPolarHBondContact CG2-CD2 3.48Å; I454-H456 WeakPolarHBondContact CG2-NE2 3.34Å; H456-G458 PolarHBondContact ND1-N 2.91Å; H456-G458 PolarHBondContact O-N 3.28Å; H456-L459 PolarHBondContact O-N 2.88Å; H456-T482 VanDerWaalsContact CA-OG1 3.32Å; H456-T482 WeakPolarHBondContact CA-OG1 3.26Å; H456-T482 HydrophobicContact CB-CG2 3.68Å; H456-T482 VanDerWaalsContact CB-OG1 3.25Å; H456-T482 WeakPolarHBondContact CB-OG1 3.48Å
457	G	87.4	Confident	93.3	Very high	23 Å²	23	15.2 Å²	15.2	24%	0.237	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	1.7	175.5	0	0	0	0	0	115.7	S992 R995	G457-S992 PolarHBondContact O-OG 2.89Å; G457-R995 PolarHBondContact O-NH2 3.33Å
458	G	90.3	Very high	93.1	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-28.1	168.5	0	0	0	0	0	113.5	H456 G991	H456-G458 PolarHBondContact ND1-N 2.91Å; H456-G458 PolarHBondContact O-N 3.28Å; G458-G991 VanDerWaalsContact O-CA 3.27Å; G458-G991 WeakPolarHBondContact O-CA 3.05Å; G458-G991 PolarHBondContact O-N 3.32Å
459	L	92.8	Very high	92.8	Very high	26 Å²	26	16.9 Å²	16.9	14%	0.136	8%	0.084	C	C	.	.	S	Bend	trans	-75.4	149.7	-175.5	-58.6	-179.2	0	0	0	112.8	I454 H456 K464 I467 G991	I454-L459 HydrophobicContact CB-CD1 4.27Å; I454-L459 HydrophobicContact CG2-CD1 4.13Å; I454-L459 WeakPolarHBondContact O-CD1 3.49Å; H456-L459 PolarHBondContact O-N 2.88Å; L459-K464 HydrophobicContact CB-CD 4.44Å; L459-K464 HydrophobicContact CB-CG 3.79Å; L459-I467 HydrophobicContact CD1-CD1 4.42Å; L459-G991 WeakPolarHBondContact O-CA 3.32Å
460	L	92.5	Very high	92.7	Very high	3 Å²	3	14.2 Å²	14.2	2%	0.016	7%	0.072	C	C	.	.			trans	-50.8	136.9	172.5	-59.1	170.4	0	0	0	110.6	L438 Q440 V441 I462 L463 K464 F979 E990 I994 I1034	L438-L460 HydrophobicContact CD1-CD1 4.48Å; Q440-L460 HydrophobicContact CB-CD1 4.1Å; V441-L460 HydrophobicContact CG2-CD1 3.95Å; L460-I462 VanDerWaalsContact C-N 3.35Å; L460-I462 HydrophobicContact CB-CG2 4.46Å; L460-I462 PolarHBondContact O-N 3.05Å; L460-L463 HydrophobicContact CB-CB 4.3Å; L460-L463 HydrophobicContact CB-CD1 4.14Å; L460-L463 HydrophobicContact CB-CG 4.09Å; L460-L463 HydrophobicContact CD1-CD1 3.8Å; L460-L463 HydrophobicContact CD1-CG 4.29Å; L460-L463 HydrophobicContact CG-CD1 4.27Å; L460-L463 PolarHBondContact O-N 2.94Å; L460-K464 PolarHBondContact O-N 3.24Å; L460-F979 HydrophobicContact CD2-CE1 3.8Å; L460-F979 HydrophobicContact CD2-CZ 4.11Å; L460-E990 HydrophobicContact CD2-CB 3.63Å; L460-E990 HydrophobicContact CG-CB 4.42Å; L460-I994 HydrophobicContact CD2-CD1 3.56Å; L460-I1034 HydrophobicContact CD1-CD1 3.9Å; L460-I1034 HydrophobicContact CD2-CD1 4.23Å
461	P	89.6	Confident	92.7	Very high	23 Å²	23	10.6 Å²	10.6	15%	0.149	6%	0.059	C	C	.	.	H	α-helix	trans	-51	-49.7	-176.2	-30.4	36.8	0	0	0	114.1	L463 K464 E465 I994	P461-L463 VanDerWaalsContact C-N 3.32Å; P461-L463 PolarHBondContact O-N 3.16Å; P461-K464 WeakPolarHBondContact O-CB 3.28Å; P461-K464 PolarHBondContact O-N 3.43Å; P461-K464 VanDerWaalsContact O-N 3.16Å; P461-E465 WeakPolarHBondContact O-CG 3.16Å; P461-E465 PolarHBondContact O-N 3.24Å; P461-E465 VanDerWaalsContact O-N 3.08Å; P461-I994 HydrophobicContact CG-CB 4.41Å; P461-I994 HydrophobicContact CG-CG2 3.73Å
462	I	90.8	Very high	92.3	Very high	5 Å²	5	14 Å²	14	3%	0.026	8%	0.083	C	C	.	.	H	α-helix	trans	-60.6	-36	179.5	-166	170.5	0	0	0	113.4	A427 I428 L431 L460 E465 T466 L1040	A427-I462 WeakPolarHBondContact O-CD1 3.15Å; I428-I462 HydrophobicContact CD1-CD1 4.38Å; I428-I462 HydrophobicContact CD1-CG2 4.46Å; L431-I462 HydrophobicContact CD1-CD1 4.2Å; L431-I462 HydrophobicContact CD1-CG2 4.29Å; L431-I462 HydrophobicContact CD2-CD1 3.83Å; L431-I462 HydrophobicContact CG-CD1 3.89Å; L460-I462 VanDerWaalsContact C-N 3.35Å; L460-I462 HydrophobicContact CB-CG2 4.46Å; L460-I462 PolarHBondContact O-N 3.05Å; I462-E465 PolarHBondContact O-N 2.83Å; I462-T466 WeakPolarHBondContact O-CB 3.36Å; I462-T466 PolarHBondContact O-N 3.36Å; I462-T466 PolarHBondContact O-OG1 2.91Å; I462-L1040 HydrophobicContact CG1-CD1 4.13Å; I462-L1040 HydrophobicContact CG1-CD2 4.4Å; I462-L1040 HydrophobicContact CG1-CG 4.32Å
463	L	92.6	Very high	92	Very high	5 Å²	5	20.1 Å²	20.1	3%	0.026	11%	0.112	C	C	.	.	H	α-helix	trans	-69.8	-38.6	176.9	-70.7	-176	0	0	0	111.6	F424 I428 V441 V444 L460 P461 I467	F424-L463 HydrophobicContact CE2-CD2 3.87Å; F424-L463 HydrophobicContact CZ-CD2 4.23Å; I428-L463 HydrophobicContact CD1-CD2 4.02Å; V441-L463 HydrophobicContact CG2-CD1 4.31Å; V441-L463 HydrophobicContact CG2-CD2 4.45Å; V444-L463 HydrophobicContact CG1-CD1 4.03Å; V444-L463 HydrophobicContact CG1-CD2 3.86Å; L460-L463 HydrophobicContact CB-CB 4.3Å; L460-L463 HydrophobicContact CB-CD1 4.14Å; L460-L463 HydrophobicContact CB-CG 4.09Å; L460-L463 HydrophobicContact CD1-CD1 3.8Å; L460-L463 HydrophobicContact CD1-CG 4.29Å; L460-L463 HydrophobicContact CG-CD1 4.27Å; L460-L463 PolarHBondContact O-N 2.94Å; P461-L463 VanDerWaalsContact C-N 3.32Å; P461-L463 PolarHBondContact O-N 3.16Å; L463-I467 VanDerWaalsContact O-CB 3.31Å; L463-I467 WeakPolarHBondContact O-CB 3.32Å; L463-I467 WeakPolarHBondContact O-CD1 3.35Å; L463-I467 WeakPolarHBondContact O-CG1 3.46Å; L463-I467 PolarHBondContact O-N 3.34Å
464	K	90.8	Very high	91.9	Very high	40 Å²	40	21.4 Å²	21.4	17%	0.174	13%	0.125	C	C	.	.	H	α-helix	trans	-62.7	-47.2	174.1	-62.6	-174.5	-56.3	75.4	0	110.9	L459 L460 P461 T466 I467 E468	L459-K464 HydrophobicContact CB-CD 4.44Å; L459-K464 HydrophobicContact CB-CG 3.79Å; L460-K464 PolarHBondContact O-N 3.24Å; P461-K464 WeakPolarHBondContact O-CB 3.28Å; P461-K464 PolarHBondContact O-N 3.43Å; P461-K464 VanDerWaalsContact O-N 3.16Å; K464-T466 PolarHBondContact O-N 2.99Å; K464-I467 CarbonylContact O-C 3.6Å; K464-I467 WeakPolarHBondContact O-CB 3.37Å; K464-I467 PolarHBondContact O-N 3.46Å; K464-I467 VanDerWaalsContact O-N 3.11Å; K464-E468 IonicContact NZ-OE1 2.67Å; K464-E468 WeakPolarHBondContact O-CB 3.47Å; K464-E468 VanDerWaalsContact O-CD 3.22Å; K464-E468 WeakPolarHBondContact O-CG 3.19Å; K464-E468 PolarHBondContact O-N 3.43Å
465	E	89.9	Confident	91.9	Very high	13 Å²	13	21.4 Å²	21.4	6%	0.061	13%	0.125	C	C	.	.	H	α-helix	trans	-64.2	-40.1	-179.6	-66.1	174.6	170.2	0	0	111.6	P461 I462 I467 E468 I469 S1039 L1040 Y1041	P461-E465 WeakPolarHBondContact O-CG 3.16Å; P461-E465 PolarHBondContact O-N 3.24Å; P461-E465 VanDerWaalsContact O-N 3.08Å; I462-E465 PolarHBondContact O-N 2.83Å; E465-I467 VanDerWaalsContact C-N 3.32Å; E465-I467 PolarHBondContact O-N 3.11Å; E465-E468 WeakPolarHBondContact CA-OE2 3.49Å; E465-E468 PolarHBondContact O-N 2.64Å; E465-I469 VanDerWaalsContact O-CG1 3.28Å; E465-I469 WeakPolarHBondContact O-CG1 3.49Å; E465-I469 PolarHBondContact O-N 2.97Å; E465-S1039 VanDerWaalsContact CD-OG 3.23Å; E465-S1039 WeakPolarHBondContact OE1-CB 3.45Å; E465-S1039 PolarHBondContact OE1-OG 3.05Å; E465-S1039 VanDerWaalsContact OE2-CA 3.23Å; E465-S1039 WeakPolarHBondContact OE2-CA 3.47Å; E465-S1039 PolarHBondContact OE2-OG 3.34Å; E465-L1040 HydrophobicContact CB-CB 4.19Å; E465-L1040 HydrophobicContact CB-CD1 3.91Å; E465-L1040 HydrophobicContact CB-CG 4.21Å; E465-L1040 PolarHBondContact OE2-N 3.17Å; E465-Y1041 HydrophobicContact CB-CE2 4.4Å; E465-Y1041 HydrophobicContact CG-CD2 4.24Å; E465-Y1041 HydrophobicContact CG-CE2 4.02Å
466	T	92.7	Very high	92	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.006	12%	0.122	C	C	.	.	H	α-helix	trans	-62	-40.3	172.1	-52.7	0	0	0	0	111.4	F424 A427 I462 K464 I469 L470 L1040	F424-T466 HydrophobicContact CD2-CG2 3.93Å; A427-T466 HydrophobicContact CB-CG2 4.07Å; A427-T466 WeakPolarHBondContact CB-OG1 3.15Å; I462-T466 WeakPolarHBondContact O-CB 3.36Å; I462-T466 PolarHBondContact O-N 3.36Å; I462-T466 PolarHBondContact O-OG1 2.91Å; K464-T466 PolarHBondContact O-N 2.99Å; T466-I469 PolarHBondContact O-N 3.01Å; T466-L470 HydrophobicContact CG2-CD1 4.04Å; T466-L470 HydrophobicContact CG2-CG 4.41Å; T466-L470 WeakPolarHBondContact O-CB 3.32Å; T466-L470 WeakPolarHBondContact O-CG 3.47Å; T466-L470 PolarHBondContact O-N 2.86Å; T466-L1040 WeakPolarHBondContact OG1-CD1 3.19Å
467	I	94.1	Very high	92.2	Very high	1 Å²	1	22 Å²	22	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-70.7	-36.2	178	-73.4	171.4	0	0	0	111.9	V444 L448 I454 L459 L463 K464 E465 F471 I476 L479	V444-I467 HydrophobicContact CG2-CD1 4.13Å; L448-I467 HydrophobicContact CD1-CG1 4.26Å; L448-I467 HydrophobicContact CD2-CD1 3.98Å; L448-I467 HydrophobicContact CD2-CG1 3.64Å; I454-I467 VanDerWaalsContact O-CD1 3.24Å; I454-I467 WeakPolarHBondContact O-CD1 3.44Å; L459-I467 HydrophobicContact CD1-CD1 4.42Å; L463-I467 VanDerWaalsContact O-CB 3.31Å; L463-I467 WeakPolarHBondContact O-CB 3.32Å; L463-I467 WeakPolarHBondContact O-CD1 3.35Å; L463-I467 WeakPolarHBondContact O-CG1 3.46Å; L463-I467 PolarHBondContact O-N 3.34Å; K464-I467 CarbonylContact O-C 3.6Å; K464-I467 WeakPolarHBondContact O-CB 3.37Å; K464-I467 PolarHBondContact O-N 3.46Å; K464-I467 VanDerWaalsContact O-N 3.11Å; E465-I467 VanDerWaalsContact C-N 3.32Å; E465-I467 PolarHBondContact O-N 3.11Å; I467-F471 VanDerWaalsContact O-CB 3.3Å; I467-F471 WeakPolarHBondContact O-CB 3.5Å; I467-F471 PolarHBondContact O-N 2.92Å; I467-I476 HydrophobicContact CB-CD1 4.39Å; I467-I476 HydrophobicContact CG2-CD1 3.9Å; I467-L479 HydrophobicContact CG2-CD1 3.65Å
468	E	91.3	Very high	92.6	Very high	4 Å²	4	21 Å²	21	2%	0.019	12%	0.117	C	C	.	.	H	α-helix	trans	-61.4	-48.5	172.9	-70.9	153	-165.3	0	0	109.6	H455 K464 E465 F471 S472 F485 I489 M491 Y1041	H455-E468 IonicContact CD2-OE1 3.61Å; H455-E468 IonicContact CE1-OE1 2.64Å; H455-E468 IonicContact NE2-OE1 3.16Å; H455-E468 PolarHBondContact NE2-OE1 3.35Å; K464-E468 IonicContact NZ-OE1 2.67Å; K464-E468 WeakPolarHBondContact O-CB 3.47Å; K464-E468 VanDerWaalsContact O-CD 3.22Å; K464-E468 WeakPolarHBondContact O-CG 3.19Å; K464-E468 PolarHBondContact O-N 3.43Å; E465-E468 WeakPolarHBondContact CA-OE2 3.49Å; E465-E468 PolarHBondContact O-N 2.64Å; E468-F471 WeakPolarHBondContact O-CB 3.22Å; E468-F471 PolarHBondContact O-N 2.82Å; E468-S472 PolarHBondContact O-N 3.5Å; E468-F485 HydrophobicContact CG-CE2 4.47Å; E468-I489 HydrophobicContact CG-CD1 3.88Å; E468-I489 VanDerWaalsContact OE2-CD1 3.23Å; E468-I489 WeakPolarHBondContact OE2-CD1 3.37Å; E468-M491 HydrophobicContact CB-CE 3.83Å; E468-M491 HydrophobicContact CB-SD 3.92Å; E468-M491 HydrophobicContact CG-SD 4.29Å; E468-M491 WeakPolarHBondContact O-CE 3.28Å; E468-Y1041 WeakPolarHBondContact CB-OH 3.36Å; E468-Y1041 PolarHBondContact OE2-OH 3.11Å
469	I	90.6	Very high	93	Very high	43 Å²	43	21 Å²	21	22%	0.221	12%	0.117	C	C	.	.	H	α-helix	trans	-62.2	-49.3	175.4	-66.6	163.2	0	0	0	111.8	V423 E465 T466 F471 S472 E473 L1040	V423-I469 HydrophobicContact CG1-CG2 4.23Å; E465-I469 VanDerWaalsContact O-CG1 3.28Å; E465-I469 WeakPolarHBondContact O-CG1 3.49Å; E465-I469 PolarHBondContact O-N 2.97Å; T466-I469 PolarHBondContact O-N 3.01Å; I469-F471 PolarHBondContact O-N 3.18Å; I469-F471 VanDerWaalsContact O-N 3.14Å; I469-S472 PolarHBondContact O-N 2.6Å; I469-S472 VanDerWaalsContact O-N 3.13Å; I469-S472 PolarHBondContact O-OG 2.75Å; I469-E473 WeakPolarHBondContact O-CG 3.25Å; I469-E473 PolarHBondContact O-N 2.92Å; I469-L1040 HydrophobicContact CD1-CB 3.92Å; I469-L1040 HydrophobicContact CD1-CD1 4.17Å
470	L	94.8	Very high	93.1	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-63.4	-19.9	177.7	-70.5	173.7	0	0	0	113	V420 V423 L448 T466 L475 I476	V420-L470 HydrophobicContact CB-CD2 4.5Å; V420-L470 HydrophobicContact CG1-CD1 4.24Å; V420-L470 HydrophobicContact CG2-CD2 4.18Å; V423-L470 HydrophobicContact CB-CD2 3.91Å; V423-L470 HydrophobicContact CG1-CD2 3.71Å; V423-L470 HydrophobicContact CG1-CG 4.25Å; L448-L470 HydrophobicContact CB-CD1 4.3Å; L448-L470 HydrophobicContact CD1-CD1 3.92Å; L448-L470 HydrophobicContact CG-CD1 4.45Å; T466-L470 HydrophobicContact CG2-CD1 4.04Å; T466-L470 HydrophobicContact CG2-CG 4.41Å; T466-L470 WeakPolarHBondContact O-CB 3.32Å; T466-L470 WeakPolarHBondContact O-CG 3.47Å; T466-L470 PolarHBondContact O-N 2.86Å; L470-L475 HydrophobicContact CD2-CB 4.29Å; L470-L475 HydrophobicContact CD2-CD1 3.62Å; L470-L475 WeakPolarHBondContact O-CA 3.44Å; L470-L475 WeakPolarHBondContact O-CB 3.34Å; L470-L475 PolarHBondContact O-N 3.13Å; L470-I476 HydrophobicContact CB-CD1 3.62Å; L470-I476 HydrophobicContact CB-CG1 3.94Å; L470-I476 PolarHBondContact O-N 2.9Å
471	F	94.3	Very high	93.2	Very high	10 Å²	10	19.6 Å²	19.6	4%	0.044	11%	0.11	C	C	.	.	H	α-helix	trans	-82.6	-39.1	172.6	-169.8	-99.7	0	0	0	112.5	P388 I390 I467 E468 I469 G474 I476 L479 F485 M491 A493	P388-F471 HydrophobicContact CB-CE2 4.03Å; P388-F471 HydrophobicContact CB-CZ 4.19Å; P388-F471 HydrophobicContact CG-CZ 4.45Å; I390-F471 HydrophobicContact CD1-CZ 4.3Å; I390-F471 HydrophobicContact CG1-CE2 4.5Å; I390-F471 HydrophobicContact CG1-CZ 3.88Å; I467-F471 VanDerWaalsContact O-CB 3.3Å; I467-F471 WeakPolarHBondContact O-CB 3.5Å; I467-F471 PolarHBondContact O-N 2.92Å; E468-F471 WeakPolarHBondContact O-CB 3.22Å; E468-F471 PolarHBondContact O-N 2.82Å; I469-F471 PolarHBondContact O-N 3.18Å; I469-F471 VanDerWaalsContact O-N 3.14Å; F471-G474 PolarHBondContact O-N 2.83Å; F471-G474 VanDerWaalsContact O-N 3.08Å; F471-I476 HydrophobicContact CD2-CB 4.07Å; F471-I476 HydrophobicContact CD2-CG2 3.96Å; F471-L479 HydrophobicContact CD1-CD2 4.4Å; F471-L479 HydrophobicContact CD2-CB 3.97Å; F471-L479 HydrophobicContact CD2-CD2 3.87Å; F471-L479 HydrophobicContact CD2-CG 4.44Å; F471-L479 HydrophobicContact CE2-CB 3.83Å; F471-L479 HydrophobicContact CE2-CD2 4.07Å; F471-L479 HydrophobicContact CG-CD2 4.05Å; F471-L479 HydrophobicContact CZ-CD2 4.42Å; F471-F485 HydrophobicContact CD1-CZ 4.46Å; F471-M491 HydrophobicContact CD1-CB 4.03Å; F471-M491 HydrophobicContact CD1-CG 4.3Å; F471-M491 HydrophobicContact CD1-SD 4.31Å; F471-M491 HydrophobicContact CE1-CB 4.16Å; F471-A493 HydrophobicContact CZ-CB 4Å
472	S	88.4	Confident	93.3	Very high	72 Å²	72	19.2 Å²	19.2	50%	0.503	11%	0.106	S	C	.	.	H	α-helix	trans	-66.1	-37.8	173.9	52.8	0	0	0	0	112.8	E468 I469 G474	E468-S472 PolarHBondContact O-N 3.5Å; I469-S472 PolarHBondContact O-N 2.6Å; I469-S472 VanDerWaalsContact O-N 3.13Å; I469-S472 PolarHBondContact O-OG 2.75Å; S472-G474 PolarHBondContact O-N 2.71Å; S472-G474 VanDerWaalsContact O-N 3.15Å
473	E	90.8	Very high	93.1	Very high	128 Å²	128	20.7 Å²	20.7	60%	0.598	11%	0.114	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-0.3	172.2	-60.6	-48.3	120.6	0	0	113.2	I469 L475	I469-E473 WeakPolarHBondContact O-CG 3.25Å; I469-E473 PolarHBondContact O-N 2.92Å; E473-L475 HydrophobicContact CB-CD1 4.09Å; E473-L475 HydrophobicContact CB-CG 4.09Å; E473-L475 PolarHBondContact O-N 3.2Å; E473-L475 VanDerWaalsContact O-N 3.15Å
474	G	92.8	Very high	92.7	Very high	28 Å²	28	23.9 Å²	23.9	29%	0.289	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.8	10.7	179.3	0	0	0	0	0	114.7	F471 S472 I476 K477	F471-G474 PolarHBondContact O-N 2.83Å; F471-G474 VanDerWaalsContact O-N 3.08Å; S472-G474 PolarHBondContact O-N 2.71Å; S472-G474 VanDerWaalsContact O-N 3.15Å; G474-I476 VanDerWaalsContact C-N 3.28Å; G474-I476 PolarHBondContact O-N 3.38Å; G474-K477 WeakPolarHBondContact O-CE 3.28Å; G474-K477 PolarHBondContact O-NZ 3.23Å
475	L	96.4	Very high	92.6	Very high	11 Å²	11	22 Å²	22	6%	0.058	13%	0.125	C	C	.	.			trans	-74.3	-18.7	178.5	-64	171.9	0	0	0	112.4	N412 E416 M419 V420 G451 L470 E473	N412-L475 PolarHBondContact ND2-O 2.88Å; N412-L475 PolarHBondContact OD1-O 3.04Å; E416-L475 HydrophobicContact CB-CD2 3.96Å; E416-L475 HydrophobicContact CG-CD2 3.94Å; M419-L475 HydrophobicContact CB-CD1 4.1Å; M419-L475 HydrophobicContact CB-CD2 4.18Å; M419-L475 HydrophobicContact CE-CD2 4.07Å; V420-L475 HydrophobicContact CG2-CB 3.8Å; V420-L475 HydrophobicContact CG2-CD1 4.12Å; V420-L475 HydrophobicContact CG2-CG 4.37Å; G451-L475 WeakPolarHBondContact CA-O 3.26Å; L470-L475 HydrophobicContact CD2-CB 4.29Å; L470-L475 HydrophobicContact CD2-CD1 3.62Å; L470-L475 WeakPolarHBondContact O-CA 3.44Å; L470-L475 WeakPolarHBondContact O-CB 3.34Å; L470-L475 PolarHBondContact O-N 3.13Å; E473-L475 HydrophobicContact CB-CD1 4.09Å; E473-L475 HydrophobicContact CB-CG 4.09Å; E473-L475 PolarHBondContact O-N 3.2Å; E473-L475 VanDerWaalsContact O-N 3.15Å
476	I	97	Very high	92.1	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.122	C	C	.	.			trans	-101.5	115.4	170.1	-66.1	171.4	0	0	0	109.6	L448 I467 L470 F471 G474 A478 L479	L448-I476 HydrophobicContact CD2-CD1 3.95Å; I467-I476 HydrophobicContact CB-CD1 4.39Å; I467-I476 HydrophobicContact CG2-CD1 3.9Å; L470-I476 HydrophobicContact CB-CD1 3.62Å; L470-I476 HydrophobicContact CB-CG1 3.94Å; L470-I476 PolarHBondContact O-N 2.9Å; F471-I476 HydrophobicContact CD2-CB 4.07Å; F471-I476 HydrophobicContact CD2-CG2 3.96Å; G474-I476 VanDerWaalsContact C-N 3.28Å; G474-I476 PolarHBondContact O-N 3.38Å; I476-A478 WeakPolarHBondContact CG2-O 3.39Å; I476-L479 HydrophobicContact CG2-CB 4.24Å
477	K	96.4	Very high	91.1	Very high	27 Å²	27	24.4 Å²	24.4	12%	0.117	14%	0.137	C	C	.	.	S	Bend	trans	-87.5	-29.7	179.7	-43.7	-54.5	178.6	-176.4	0	112.2	M382 Q387 P388 V389 F411 N412 E416 G451 G474	M382-K477 HydrophobicContact CE-CB 3.65Å; M382-K477 HydrophobicContact SD-CB 4.08Å; Q387-K477 HydrophobicContact CB-CB 4.46Å; P388-K477 WeakPolarHBondContact CA-O 3.46Å; V389-K477 WeakPolarHBondContact CG1-O 3.39Å; V389-K477 PolarHBondContact N-O 2.97Å; F411-K477 HydrophobicContact CB-CB 3.98Å; F411-K477 HydrophobicContact CB-CG 3.69Å; F411-K477 HydrophobicContact CD2-CB 4.5Å; F411-K477 HydrophobicContact CG-CB 4.49Å; N412-K477 VanDerWaalsContact OD1-CE 3.23Å; N412-K477 WeakPolarHBondContact OD1-CE 3.37Å; E416-K477 WeakPolarHBondContact OE1-CE 3.23Å; E416-K477 IonicContact OE1-NZ 2.79Å; E416-K477 PolarHBondContact OE1-NZ 3.29Å; G451-K477 PolarHBondContact O-N 3.22Å; G474-K477 WeakPolarHBondContact O-CE 3.28Å; G474-K477 PolarHBondContact O-NZ 3.23Å
478	A	96.7	Very high	89.6	Confident	0 Å²	0	25 Å²	25	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	117.2	178.4	0	0	0	0	0	111.4	V378 M382 V389 I391 F411 G451 I452 G453 I476 F480	V378-A478 HydrophobicContact CG1-CB 4.43Å; M382-A478 HydrophobicContact CE-CB 3.77Å; V389-A478 HydrophobicContact CG1-CB 3.98Å; V389-A478 WeakPolarHBondContact O-CA 3.46Å; I391-A478 HydrophobicContact CD1-CB 4.06Å; F411-A478 HydrophobicContact CE2-CB 4.2Å; G451-A478 PolarHBondContact O-N 2.91Å; I452-A478 WeakPolarHBondContact CA-O 3.47Å; G453-A478 PolarHBondContact N-O 2.8Å; I476-A478 WeakPolarHBondContact CG2-O 3.39Å; A478-F480 HydrophobicContact CB-CE2 4.3Å
479	L	96.8	Very high	88.5	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	114.3	-178.8	-177.4	63.2	0	0	0	110.8	V389 I390 I391 H455 I467 F471 I476 F485	V389-L479 PolarHBondContact O-N 2.97Å; I390-L479 CarbonylContact C-O 3.55Å; I390-L479 WeakPolarHBondContact CA-O 3.13Å; I391-L479 PolarHBondContact N-O 2.96Å; H455-L479 HydrophobicContact CB-CD1 4.14Å; I467-L479 HydrophobicContact CG2-CD1 3.65Å; F471-L479 HydrophobicContact CD1-CD2 4.4Å; F471-L479 HydrophobicContact CD2-CB 3.97Å; F471-L479 HydrophobicContact CD2-CD2 3.87Å; F471-L479 HydrophobicContact CD2-CG 4.44Å; F471-L479 HydrophobicContact CE2-CB 3.83Å; F471-L479 HydrophobicContact CE2-CD2 4.07Å; F471-L479 HydrophobicContact CG-CD2 4.05Å; F471-L479 HydrophobicContact CZ-CD2 4.42Å; I476-L479 HydrophobicContact CG2-CB 4.24Å; L479-F485 HydrophobicContact CD2-CD1 4.34Å; L479-F485 HydrophobicContact CD2-CD2 4.47Å; L479-F485 HydrophobicContact CD2-CE1 3.73Å; L479-F485 HydrophobicContact CD2-CE2 3.88Å; L479-F485 HydrophobicContact CD2-CZ 3.46Å; L479-F485 VanDerWaalsContact CD2-CZ 3.46Å
480	F	96.2	Very high	87.6	Confident	1 Å²	1	26.2 Å²	26.2	0%	0.004	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	105.8	176.5	-69.5	-88.1	0	0	0	110.3	V374 V378 I391 C399 A403 M406 I452 G453 I454 H455 A478	V374-F480 HydrophobicContact CG1-CE1 4.14Å; V378-F480 HydrophobicContact CG2-CZ 4.37Å; I391-F480 HydrophobicContact CB-CD1 3.69Å; I391-F480 HydrophobicContact CB-CE1 3.78Å; I391-F480 HydrophobicContact CB-CG 4.38Å; I391-F480 HydrophobicContact CD1-CD1 4.26Å; I391-F480 HydrophobicContact CD1-CD2 4.35Å; I391-F480 HydrophobicContact CD1-CE1 3.95Å; I391-F480 HydrophobicContact CD1-CE2 4.05Å; I391-F480 HydrophobicContact CD1-CG 4.44Å; I391-F480 HydrophobicContact CD1-CZ 3.81Å; I391-F480 HydrophobicContact CG1-CD1 4.15Å; I391-F480 HydrophobicContact CG1-CE1 3.77Å; I391-F480 HydrophobicContact CG1-CZ 4.08Å; I391-F480 HydrophobicContact CG2-CD1 3.79Å; I391-F480 HydrophobicContact CG2-CE1 3.75Å; C399-F480 HydrophobicContact CB-CB 4.36Å; A403-F480 HydrophobicContact CB-CB 4.3Å; A403-F480 HydrophobicContact CB-CD2 3.68Å; A403-F480 HydrophobicContact CB-CE2 4.28Å; A403-F480 HydrophobicContact CB-CG 3.99Å; M406-F480 HydrophobicContact CE-CE1 4.23Å; M406-F480 HydrophobicContact CE-CZ 3.84Å; M406-F480 HydrophobicContact CG-CE2 3.67Å; M406-F480 HydrophobicContact CG-CZ 3.43Å; M406-F480 VanDerWaalsContact CG-CZ 3.43Å; M406-F480 HydrophobicContact SD-CZ 4.28Å; I452-F480 HydrophobicContact CG2-CD2 4.16Å; I452-F480 HydrophobicContact CG2-CE2 4.12Å; G453-F480 PolarHBondContact O-N 3.47Å; I454-F480 CarbonylContact C-O 3.54Å; I454-F480 WeakPolarHBondContact CA-O 3.37Å; H455-F480 PolarHBondContact N-O 3.02Å; A478-F480 HydrophobicContact CB-CE2 4.3Å
481	A	94.9	Very high	87.1	Confident	0 Å²	0	27 Å²	27	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	145.9	-166.9	0	0	0	0	0	113.7	I390 I391 F392 S393 H455 F485	I390-A481 HydrophobicContact CG2-CB 4.03Å; I391-A481 PolarHBondContact O-N 3.43Å; F392-A481 WeakPolarHBondContact CA-O 3.18Å; F392-A481 HydrophobicContact CD1-CB 4.13Å; F392-A481 HydrophobicContact CE1-CB 4.09Å; S393-A481 PolarHBondContact N-O 2.91Å; H455-A481 HydrophobicContact CB-CB 4.26Å; H455-A481 CarbonylContact O-C 3.56Å; H455-A481 VanDerWaalsContact O-CA 3.24Å; H455-A481 WeakPolarHBondContact O-CA 3.37Å; A481-F485 HydrophobicContact CB-CB 3.87Å; A481-F485 HydrophobicContact CB-CD1 4.3Å; A481-F485 HydrophobicContact CB-CG 4.18Å
482	T	92.1	Very high	86.9	Confident	14 Å²	14	28.9 Å²	28.9	9%	0.086	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	156.1	158	50.8	0	0	0	0	111.4	S393 H455 H456 T484 F485	S393-T482 WeakPolarHBondContact O-CA 3.49Å; H455-T482 PolarHBondContact O-N 3.19Å; H456-T482 VanDerWaalsContact CA-OG1 3.32Å; H456-T482 WeakPolarHBondContact CA-OG1 3.26Å; H456-T482 HydrophobicContact CB-CG2 3.68Å; H456-T482 VanDerWaalsContact CB-OG1 3.25Å; H456-T482 WeakPolarHBondContact CB-OG1 3.48Å; T482-T484 PolarHBondContact O-N 3.08Å; T482-T484 PolarHBondContact OG1-OG1 3.01Å; T482-F485 WeakPolarHBondContact O-CB 3.4Å; T482-F485 PolarHBondContact O-N 2.98Å
483	E	86.6	Confident	87.2	Confident	37 Å²	37	25.4 Å²	25.4	17%	0.173	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-40.7	-35.2	174.8	-179.1	174.5	-154.7	0	0	114.7	F485 A486 M487 K503 M520	E483-F485 PolarHBondContact O-N 3.43Å; E483-A486 WeakPolarHBondContact O-CB 3.5Å; E483-A486 PolarHBondContact O-N 3.16Å; E483-M487 PolarHBondContact O-N 3.35Å; E483-K503 IonicContact OE1-NZ 2.62Å; E483-K503 PolarHBondContact OE1-NZ 2.99Å; E483-K503 VanDerWaalsContact OE2-CE 3.27Å; E483-K503 WeakPolarHBondContact OE2-CE 3.35Å; E483-K503 IonicContact OE2-NZ 2.85Å; E483-K503 PolarHBondContact OE2-NZ 3.26Å; E483-M520 HydrophobicContact CB-SD 4.31Å; E483-M520 HydrophobicContact CG-CE 4.23Å; E483-M520 HydrophobicContact CG-SD 4.13Å
484	T	83.7	Confident	87.4	Confident	72 Å²	72	21.5 Å²	21.5	44%	0.442	12%	0.123	S	C	.	.	G	3₁₀ helix	trans	-51.5	-26.5	173.5	54	0	0	0	0	114.8	T482 M487 G488	T482-T484 PolarHBondContact O-N 3.08Å; T482-T484 PolarHBondContact OG1-OG1 3.01Å; T484-M487 CarbonylContact O-C 3.56Å; T484-M487 PolarHBondContact O-N 3.13Å; T484-G488 PolarHBondContact O-N 3.39Å
485	F	87.4	Confident	87.6	Confident	1 Å²	1	20.1 Å²	20.1	0%	0.004	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-70.3	-39.7	175.1	-174.7	-103.1	0	0	0	111.7	I390 F392 H455 E468 F471 L479 A481 T482 E483 M487 G488 M491	I390-F485 HydrophobicContact CD1-CD1 4.33Å; I390-F485 HydrophobicContact CD1-CE1 3.77Å; I390-F485 HydrophobicContact CG1-CE1 4.19Å; I390-F485 HydrophobicContact CG2-CD1 4.4Å; F392-F485 HydrophobicContact CE1-CB 4.31Å; F392-F485 HydrophobicContact CE1-CD1 4.47Å; F392-F485 HydrophobicContact CZ-CD1 4.5Å; H455-F485 HydrophobicContact CB-CD2 4.35Å; H455-F485 AromaticContact CD2-CD2 3.64Å; H455-F485 AromaticContact CD2-CE2 3.99Å; H455-F485 AromaticContact CE1-CD2 3.77Å; H455-F485 AromaticContact CG-CD2 3.65Å; H455-F485 AromaticContact ND1-CD2 3.77Å; H455-F485 AromaticContact NE2-CD2 3.7Å; E468-F485 HydrophobicContact CG-CE2 4.47Å; F471-F485 HydrophobicContact CD1-CZ 4.46Å; L479-F485 HydrophobicContact CD2-CD1 4.34Å; L479-F485 HydrophobicContact CD2-CD2 4.47Å; L479-F485 HydrophobicContact CD2-CE1 3.73Å; L479-F485 HydrophobicContact CD2-CE2 3.88Å; L479-F485 HydrophobicContact CD2-CZ 3.46Å; L479-F485 VanDerWaalsContact CD2-CZ 3.46Å; A481-F485 HydrophobicContact CB-CB 3.87Å; A481-F485 HydrophobicContact CB-CD1 4.3Å; A481-F485 HydrophobicContact CB-CG 4.18Å; T482-F485 WeakPolarHBondContact O-CB 3.4Å; T482-F485 PolarHBondContact O-N 2.98Å; E483-F485 PolarHBondContact O-N 3.43Å; F485-M487 PolarHBondContact O-N 3.02Å; F485-G488 PolarHBondContact O-N 2.92Å; F485-G488 VanDerWaalsContact O-N 3.13Å; F485-M491 HydrophobicContact CE1-CB 4.17Å; F485-M491 HydrophobicContact CE2-CB 4.45Å; F485-M491 HydrophobicContact CE2-SD 4.21Å; F485-M491 HydrophobicContact CZ-CB 3.59Å; F485-M491 HydrophobicContact CZ-CG 4.43Å; F485-M491 HydrophobicContact CZ-SD 4.1Å
486	A	80.7	Confident	87.7	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-27.1	173.7	0	0	0	0	0	112.2	F392 E483 Q519 M520 R523	F392-A486 HydrophobicContact CE1-CB 4Å; F392-A486 HydrophobicContact CZ-CB 3.73Å; E483-A486 WeakPolarHBondContact O-CB 3.5Å; E483-A486 PolarHBondContact O-N 3.16Å; A486-Q519 HydrophobicContact CB-CG 4.44Å; A486-M520 HydrophobicContact CB-CB 4.41Å; A486-M520 HydrophobicContact CB-CG 3.67Å; A486-R523 HydrophobicContact CB-CG 4.47Å; A486-R523 PolarHBondContact O-NE 3.45Å; A486-R523 PolarHBondContact O-NH2 3.15Å
487	M	71.1	Confident	87.7	Confident	63 Å²	63	19.6 Å²	19.6	31%	0.31	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-11.4	176	-62.4	-175.9	77.8	0	0	114.7	I191 Y256 E483 T484 F485	I191-M487 VanDerWaalsContact CD1-O 3.3Å; I191-M487 WeakPolarHBondContact CD1-O 3.26Å; Y256-M487 HydrophobicContact CE1-CE 3.95Å; Y256-M487 WeakPolarHBondContact OH-CA 3.43Å; Y256-M487 VanDerWaalsContact OH-CB 3.28Å; Y256-M487 WeakPolarHBondContact OH-CB 3.32Å; Y256-M487 PolarHBondContact OH-O 2.87Å; E483-M487 PolarHBondContact O-N 3.35Å; T484-M487 CarbonylContact O-C 3.56Å; T484-M487 PolarHBondContact O-N 3.13Å; F485-M487 PolarHBondContact O-N 3.02Å
488	G	61.7	Low	87.6	Confident	14 Å²	14	18.3 Å²	18.3	14%	0.144	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-55.7	-161.7	0	0	0	0	0	115.4	T484 F485	T484-G488 PolarHBondContact O-N 3.39Å; F485-G488 PolarHBondContact O-N 2.92Å; F485-G488 VanDerWaalsContact O-N 3.13Å
489	I	69.4	Low	87.4	Confident	8 Å²	8	19 Å²	19	4%	0.041	11%	0.105	C	C	.	.			trans	-144.7	152.1	-159.2	-69.3	179.3	0	0	0	109.3	E468 M491 R523	E468-I489 HydrophobicContact CG-CD1 3.88Å; E468-I489 VanDerWaalsContact OE2-CD1 3.23Å; E468-I489 WeakPolarHBondContact OE2-CD1 3.37Å; I489-M491 VanDerWaalsContact C-N 3.31Å; I489-M491 HydrophobicContact CG2-CB 4.44Å; I489-M491 HydrophobicContact CG2-CE 3.86Å; I489-M491 HydrophobicContact CG2-CG 3.81Å; I489-M491 HydrophobicContact CG2-SD 3.76Å; I489-M491 PolarHBondContact O-N 3.45Å; I489-R523 PolarHBondContact O-NH1 3.14Å; I489-R523 PolarHBondContact O-NH2 2.88Å
490	N	72.3	Confident	87	Confident	65 Å²	65	20.4 Å²	20.4	35%	0.348	11%	0.113	S	C	.	.			trans	-82.5	66.5	179.1	-166.4	35.9	0	0	0	114	P492 R523	N490-P492 VanDerWaalsContact O-CD 3.3Å; N490-P492 WeakPolarHBondContact O-CD 3.32Å; N490-R523 PolarHBondContact OD1-NH1 3.23Å; N490-R523 VanDerWaalsContact OD1-NH1 3.15Å
491	M	83.8	Confident	86.6	Confident	17 Å²	17	20.4 Å²	20.4	8%	0.084	11%	0.112	C	C	.	.			trans	-112.4	95.6	178.9	-81.3	171	-176.5	0	0	112.3	E468 F471 F485 I489	E468-M491 HydrophobicContact CB-CE 3.83Å; E468-M491 HydrophobicContact CB-SD 3.92Å; E468-M491 HydrophobicContact CG-SD 4.29Å; E468-M491 WeakPolarHBondContact O-CE 3.28Å; F471-M491 HydrophobicContact CD1-CB 4.03Å; F471-M491 HydrophobicContact CD1-CG 4.3Å; F471-M491 HydrophobicContact CD1-SD 4.31Å; F471-M491 HydrophobicContact CE1-CB 4.16Å; F485-M491 HydrophobicContact CE1-CB 4.17Å; F485-M491 HydrophobicContact CE2-CB 4.45Å; F485-M491 HydrophobicContact CE2-SD 4.21Å; F485-M491 HydrophobicContact CZ-CB 3.59Å; F485-M491 HydrophobicContact CZ-CG 4.43Å; F485-M491 HydrophobicContact CZ-SD 4.1Å; I489-M491 VanDerWaalsContact C-N 3.31Å; I489-M491 HydrophobicContact CG2-CB 4.44Å; I489-M491 HydrophobicContact CG2-CE 3.86Å; I489-M491 HydrophobicContact CG2-CG 3.81Å; I489-M491 HydrophobicContact CG2-SD 3.76Å; I489-M491 PolarHBondContact O-N 3.45Å
492	P	90.1	Very high	86.1	Confident	48 Å²	48	21.5 Å²	21.5	31%	0.312	12%	0.117	S	C	.	.			trans	-82.2	155	175.6	32.7	-34.4	0	0	0	112.9	N490 R523 R526	N490-P492 VanDerWaalsContact O-CD 3.3Å; N490-P492 WeakPolarHBondContact O-CD 3.32Å; P492-R523 CarbonylContact C-O 3.52Å; P492-R523 WeakPolarHBondContact CA-O 3.39Å; P492-R526 HydrophobicContact CB-CG 3.94Å; P492-R526 HydrophobicContact CG-CG 4.02Å
493	A	94.3	Very high	85.7	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.119	C	C	.	.	B	Isolated β-bridge	trans	-129.8	166.2	179.7	0	0	0	0	0	111.2	P388 I390 F471 R523 A524 G525	P388-A493 HydrophobicContact CG-CB 4.42Å; I390-A493 HydrophobicContact CD1-CB 3.57Å; I390-A493 HydrophobicContact CG1-CB 3.72Å; F471-A493 HydrophobicContact CZ-CB 4Å; A493-R523 PolarHBondContact N-O 2.92Å; A493-A524 CarbonylContact O-C 3.56Å; A493-A524 WeakPolarHBondContact O-CA 3.34Å; A493-G525 PolarHBondContact O-N 3Å
494	R	95.7	Very high	85.2	Confident	45 Å²	45	23.3 Å²	23.3	17%	0.17	12%	0.123	C	C	.	.	S	Bend	trans	-71.8	-39.1	173	-174.5	166.9	-163.2	174.4	20.9	111.6	N385 Q387 P388 D530 D531 I534	N385-R494 PolarHBondContact O-NH1 3.03Å; Q387-R494 WeakPolarHBondContact O-CB 3.33Å; Q387-R494 WeakPolarHBondContact O-CD 3.4Å; P388-R494 PolarHBondContact O-N 3.4Å; R494-D530 WeakPolarHBondContact CA-OD2 3.44Å; R494-D530 WeakPolarHBondContact CD-OD1 3.46Å; R494-D530 HydrophobicContact CG-CB 4.48Å; R494-D530 VanDerWaalsContact CG-OD1 3.28Å; R494-D530 WeakPolarHBondContact CG-OD1 3.32Å; R494-D530 IonicContact NE-OD1 3.11Å; R494-D530 PolarHBondContact NE-OD1 3.33Å; R494-D531 IonicContact NH2-OD2 3.31Å; R494-I534 PolarHBondContact O-N 3.08Å
495	T	97.4	Very high	84.6	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	142.9	-178.1	-55.7	0	0	0	0	112.3	I381 F386 P388 V389 I390 I534 I536	I381-T495 HydrophobicContact CD1-CG2 3.85Å; I381-T495 HydrophobicContact CG1-CG2 4.45Å; F386-T495 WeakPolarHBondContact O-CB 3.3Å; F386-T495 PolarHBondContact O-OG1 2.62Å; P388-T495 PolarHBondContact O-N 3.27Å; P388-T495 VanDerWaalsContact O-N 3.1Å; V389-T495 VanDerWaalsContact CA-O 3.3Å; V389-T495 WeakPolarHBondContact CA-O 3.25Å; V389-T495 HydrophobicContact CG2-CG2 4.02Å; I390-T495 PolarHBondContact N-O 3.21Å; T495-I534 CarbonylContact C-O 3.45Å; T495-I534 VanDerWaalsContact CA-O 3.25Å; T495-I534 WeakPolarHBondContact CA-O 3.47Å; T495-I534 HydrophobicContact CG2-CB 4.13Å; T495-I534 HydrophobicContact CG2-CG2 4.06Å; T495-I536 HydrophobicContact CG2-CD1 4.18Å
496	V	97.3	Very high	83.7	Confident	0 Å²	0	26 Å²	26	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	129.5	167.1	171.5	0	0	0	0	109.5	I390 F392 F498 R523 A524 I534 V535 I536	I390-V496 CarbonylContact O-C 3.46Å; I390-V496 WeakPolarHBondContact O-CA 3.32Å; F392-V496 HydrophobicContact CD2-CG1 3.62Å; F392-V496 HydrophobicContact CE2-CG1 3.76Å; F392-V496 HydrophobicContact CE2-CG2 4.47Å; V496-F498 HydrophobicContact CG1-CD2 4.11Å; V496-F498 HydrophobicContact CG1-CE2 3.74Å; V496-F498 HydrophobicContact CG1-CZ 4.35Å; V496-R523 HydrophobicContact CG2-CB 4.11Å; V496-A524 HydrophobicContact CB-CB 4.25Å; V496-A524 HydrophobicContact CG2-CB 3.83Å; V496-I534 PolarHBondContact N-O 3.29Å; V496-V535 CarbonylContact O-C 3.54Å; V496-V535 WeakPolarHBondContact O-CA 3.39Å; V496-I536 PolarHBondContact O-N 3.01Å
497	L	96.9	Very high	82.9	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	117.2	177.9	173.9	60.9	0	0	0	109.9	V374 I377 V378 V389 I390 I391 F392 I536 M538	V374-L497 HydrophobicContact CG1-CD2 4.28Å; I377-L497 HydrophobicContact CB-CD2 4.34Å; I377-L497 HydrophobicContact CD1-CD1 4.25Å; I377-L497 HydrophobicContact CG2-CD1 3.96Å; I377-L497 HydrophobicContact CG2-CD2 3.85Å; V378-L497 HydrophobicContact CG2-CD2 4.17Å; V389-L497 HydrophobicContact CG2-CB 4.23Å; I390-L497 PolarHBondContact O-N 3.01Å; I391-L497 CarbonylContact C-O 3.59Å; I391-L497 VanDerWaalsContact CA-O 3.31Å; I391-L497 WeakPolarHBondContact CA-O 3.39Å; I391-L497 HydrophobicContact CG1-CB 4.25Å; I391-L497 HydrophobicContact CG1-CD2 3.98Å; I391-L497 HydrophobicContact CG2-CB 4.45Å; I391-L497 HydrophobicContact CG2-CD2 4.05Å; I391-L497 HydrophobicContact CG2-CG 4.18Å; F392-L497 PolarHBondContact N-O 3.47Å; L497-I536 CarbonylContact C-O 3.51Å; L497-I536 WeakPolarHBondContact CA-O 3.43Å; L497-I536 HydrophobicContact CD1-CB 3.75Å; L497-I536 HydrophobicContact CD1-CG2 3.48Å; L497-I536 VanDerWaalsContact CD1-CG2 3.48Å; L497-M538 HydrophobicContact CD1-CG 3.87Å; L497-M538 HydrophobicContact CD1-SD 4.06Å
498	F	95.6	Very high	82.8	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	123.4	169.7	-64.2	-103.5	0	0	0	109	V496 N500 I512 Y517 M520 V535 I536 L537 M538	V496-F498 HydrophobicContact CG1-CD2 4.11Å; V496-F498 HydrophobicContact CG1-CE2 3.74Å; V496-F498 HydrophobicContact CG1-CZ 4.35Å; F498-N500 VanDerWaalsContact C-N 3.29Å; F498-N500 PolarHBondContact O-N 3.3Å; F498-I512 HydrophobicContact CD1-CD1 4.16Å; F498-I512 HydrophobicContact CE1-CD1 4.09Å; F498-Y517 AromaticContact CD2-CE2 4Å; F498-Y517 HydrophobicContact CD2-CE2 4Å; F498-Y517 AromaticContact CE1-CD2 3.86Å; F498-Y517 HydrophobicContact CE1-CD2 3.86Å; F498-Y517 HydrophobicContact CE1-CE2 4.28Å; F498-Y517 AromaticContact CE2-CD2 3.8Å; F498-Y517 HydrophobicContact CE2-CD2 3.8Å; F498-Y517 AromaticContact CE2-CE2 3.41Å; F498-Y517 HydrophobicContact CE2-CE2 3.41Å; F498-Y517 VanDerWaalsContact CE2-CE2 3.41Å; F498-Y517 AromaticContact CZ-CD2 3.41Å; F498-Y517 HydrophobicContact CZ-CD2 3.41Å; F498-Y517 VanDerWaalsContact CZ-CD2 3.41Å; F498-Y517 AromaticContact CZ-CE2 3.56Å; F498-Y517 HydrophobicContact CZ-CE2 3.56Å; F498-Y517 HydrophobicContact CZ-CG 4.41Å; F498-M520 HydrophobicContact CD1-SD 4.36Å; F498-M520 HydrophobicContact CE1-CB 3.52Å; F498-M520 HydrophobicContact CE1-CE 3.99Å; F498-M520 HydrophobicContact CE1-CG 4.25Å; F498-M520 HydrophobicContact CE1-SD 3.77Å; F498-M520 HydrophobicContact CZ-CB 3.47Å; F498-M520 VanDerWaalsContact CZ-CB 3.47Å; F498-V535 HydrophobicContact CD2-CG1 4.24Å; F498-V535 HydrophobicContact CE2-CG1 3.73Å; F498-I536 PolarHBondContact N-O 2.66Å; F498-L537 HydrophobicContact CB-CD1 3.66Å; F498-L537 HydrophobicContact CD2-CD1 4.43Å; F498-L537 HydrophobicContact CG-CD1 4.03Å; F498-M538 VanDerWaalsContact O-CB 3.26Å; F498-M538 WeakPolarHBondContact O-CB 3.3Å; F498-M538 WeakPolarHBondContact O-CG 3.4Å; F498-M538 PolarHBondContact O-N 3.02Å
499	T	91.8	Very high	83.3	Confident	14 Å²	14	32 Å²	32	9%	0.086	17%	0.169	C	C	.	.	S	Bend	trans	-76.7	-16.5	178.8	61	0	0	0	0	113.8	V374 I391 F392 S393 Y402	V374-T499 HydrophobicContact CG2-CG2 4.14Å; I391-T499 HydrophobicContact CG2-CG2 3.42Å; I391-T499 VanDerWaalsContact CG2-CG2 3.42Å; F392-T499 PolarHBondContact O-N 2.8Å; F392-T499 PolarHBondContact O-OG1 2.96Å; S393-T499 WeakPolarHBondContact CB-OG1 3.22Å; S393-T499 PolarHBondContact OG-OG1 3.06Å; Y402-T499 HydrophobicContact CD2-CG2 4.06Å; Y402-T499 HydrophobicContact CE2-CG2 3.89Å
500	N	88.4	Confident	84.1	Confident	30 Å²	30	35.7 Å²	35.7	16%	0.16	18%	0.182	C	C	.	.			trans	-150	152.3	177.9	-166.2	-8.2	0	0	0	109.5	F394 F498 R502	F394-N500 HydrophobicContact CE2-CB 4.4Å; F498-N500 VanDerWaalsContact C-N 3.29Å; F498-N500 PolarHBondContact O-N 3.3Å; N500-R502 VanDerWaalsContact CG-O 3.27Å; N500-R502 PolarHBondContact ND2-O 2.67Å; N500-R502 VanDerWaalsContact ND2-O 3.16Å; N500-R502 PolarHBondContact OD1-N 3.3Å
501	A	87.1	Confident	84.8	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.176	C	C	.	.	S	Bend	trans	-96.9	-9.8	173.1	0	0	0	0	0	113.5	W511 I512 L537 V539 M543	A501-W511 HydrophobicContact CB-CE3 4.02Å; A501-W511 HydrophobicContact CB-CZ3 3.87Å; A501-I512 PolarHBondContact O-N 2.79Å; A501-L537 HydrophobicContact CB-CD1 3.81Å; A501-L537 HydrophobicContact CB-CD2 4.28Å; A501-L537 HydrophobicContact CB-CG 4.19Å; A501-V539 HydrophobicContact CB-CG2 4.31Å; A501-M543 HydrophobicContact CB-CE 4.13Å
502	R	83.9	Confident	85.2	Confident	23 Å²	23	34.7 Å²	34.7	9%	0.087	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	149.5	177.4	-62.9	-179	72.9	-156	-20.9	111.6	F394 N500 F509 R510 W511 E541 E705	F394-R502 WeakPolarHBondContact CD2-O 3.48Å; N500-R502 VanDerWaalsContact CG-O 3.27Å; N500-R502 PolarHBondContact ND2-O 2.67Å; N500-R502 VanDerWaalsContact ND2-O 3.16Å; N500-R502 PolarHBondContact OD1-N 3.3Å; R502-F509 HydrophobicContact CB-CD1 4.45Å; R502-F509 PolarHBondContact NH2-O 3.12Å; R502-R510 CarbonylContact C-O 3.55Å; R502-R510 WeakPolarHBondContact CA-O 3.38Å; R502-R510 WeakPolarHBondContact CB-O 3.34Å; R502-W511 HydrophobicContact CG-CD2 3.68Å; R502-W511 HydrophobicContact CG-CE3 3.28Å; R502-W511 HydrophobicContact CG-CG 4.36Å; R502-W511 HydrophobicContact CG-CH2 4.09Å; R502-W511 HydrophobicContact CG-CZ2 4.41Å; R502-W511 HydrophobicContact CG-CZ3 3.51Å; R502-E541 IonicContact CZ-OE2 3.67Å; R502-E541 IonicContact NH1-OE2 2.66Å; R502-E541 PolarHBondContact NH1-OE2 2.86Å; R502-E705 WeakPolarHBondContact CD-OE1 3.05Å; R502-E705 IonicContact CZ-OE1 3.82Å; R502-E705 IonicContact CZ-OE2 3.58Å; R502-E705 IonicContact NE-OE1 3.59Å; R502-E705 PolarHBondContact NE-OE1 2.9Å; R502-E705 IonicContact NH1-OE1 3.45Å; R502-E705 PolarHBondContact NH1-OE1 3.22Å; R502-E705 VanDerWaalsContact NH1-OE1 3.16Å; R502-E705 IonicContact NH1-OE2 3.72Å; R502-E705 PolarHBondContact NH1-OE2 2.69Å; R502-E705 IonicContact NH2-OE1 2.71Å; R502-E705 PolarHBondContact NH2-OE1 2.66Å; R502-E705 IonicContact NH2-OE2 2.84Å; R502-E705 PolarHBondContact NH2-OE2 3.01Å
503	K	84.6	Confident	85.1	Confident	32 Å²	32	33.9 Å²	33.9	14%	0.139	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	139.7	-175.1	174.1	177.8	169.7	-177.6	0	108.4	F394 E483 F509 R510 I512 E516	F394-K503 HydrophobicContact CB-CG 4.37Å; F394-K503 HydrophobicContact CD1-CB 4.39Å; F394-K503 HydrophobicContact CD1-CD 3.93Å; F394-K503 HydrophobicContact CD1-CG 4.13Å; F394-K503 HydrophobicContact CD2-CB 4.07Å; F394-K503 HydrophobicContact CE1-CD 4.22Å; F394-K503 HydrophobicContact CE2-CB 4.32Å; F394-K503 HydrophobicContact CG-CB 4.13Å; F394-K503 HydrophobicContact CG-CD 4.39Å; F394-K503 HydrophobicContact CG-CG 4.06Å; E483-K503 IonicContact OE1-NZ 2.62Å; E483-K503 PolarHBondContact OE1-NZ 2.99Å; E483-K503 VanDerWaalsContact OE2-CE 3.27Å; E483-K503 WeakPolarHBondContact OE2-CE 3.35Å; E483-K503 IonicContact OE2-NZ 2.85Å; E483-K503 PolarHBondContact OE2-NZ 3.26Å; K503-F509 WeakPolarHBondContact O-CA 3.41Å; K503-R510 PolarHBondContact N-O 3.2Å; K503-R510 PolarHBondContact O-N 3.14Å; K503-I512 HydrophobicContact CB-CG2 4.27Å; K503-E516 IonicContact NZ-OE1 2.7Å; K503-E516 PolarHBondContact NZ-OE1 3.27Å
504	F	77.1	Confident	84.9	Confident	57 Å²	57	34.2 Å²	34.2	25%	0.25	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	124.4	169.9	-175.2	-112.3	0	0	0	108.2	G506 K507 D508 F509	F504-G506 VanDerWaalsContact CZ-C 3.48Å; F504-G506 WeakPolarHBondContact CZ-O 3.48Å; F504-K507 WeakPolarHBondContact CE2-O 3.32Å; F504-D508 WeakPolarHBondContact CA-O 3.28Å; F504-D508 WeakPolarHBondContact CD2-O 3.42Å; F504-F509 HydrophobicContact CB-CD1 4.24Å; F504-F509 HydrophobicContact CB-CD2 4.25Å; F504-F509 HydrophobicContact CB-CE1 4.01Å; F504-F509 HydrophobicContact CB-CE2 4.02Å; F504-F509 HydrophobicContact CB-CG 4.36Å; F504-F509 HydrophobicContact CB-CZ 3.91Å; F504-F509 AromaticContact CD2-CD2 3.61Å; F504-F509 HydrophobicContact CD2-CD2 3.61Å; F504-F509 AromaticContact CD2-CE2 3.8Å; F504-F509 HydrophobicContact CD2-CE2 3.8Å; F504-F509 HydrophobicContact CD2-CG 4.21Å; F504-F509 HydrophobicContact CE2-CD2 4.42Å; F504-F509 HydrophobicContact CG-CD2 4.32Å; F504-F509 HydrophobicContact CG-CE2 4.16Å
505	D	70.1	Confident	84.5	Confident	84 Å²	84	32.2 Å²	32.2	45%	0.449	17%	0.165	S	C	.	.			trans	-92.7	-3.3	-177.6	56.8	28.7	0	0	0	114.2	K507 D508 R510	D505-K507 PolarHBondContact OD1-N 2.94Å; D505-D508 PolarHBondContact N-O 2.63Å; D505-D508 VanDerWaalsContact N-O 3.08Å; D505-D508 PolarHBondContact OD1-N 2.89Å; D505-R510 IonicContact OD2-NE 2.67Å
506	G	67.9	Low	84	Confident	47 Å²	47	33.4 Å²	33.4	49%	0.485	17%	0.17	S	C	.	.	S	Bend	trans	114	-22.1	-174.7	0	0	0	0	0	112.9	F504	F504-G506 VanDerWaalsContact CZ-C 3.48Å; F504-G506 WeakPolarHBondContact CZ-O 3.48Å
507	K	64.7	Low	83.8	Confident	121 Å²	121	33.5 Å²	33.5	53%	0.526	17%	0.17	S	C	.	.	S	Bend	trans	-119.7	-45.4	171.4	-174	177.1	176.9	169.1	0	112.2	F504 D505 E665	F504-K507 WeakPolarHBondContact CE2-O 3.32Å; D505-K507 PolarHBondContact OD1-N 2.94Å; K507-E665 WeakPolarHBondContact CE-OE2 3.25Å; K507-E665 IonicContact NZ-OE2 2.74Å; K507-E665 PolarHBondContact NZ-OE2 3.34Å
508	D	68.2	Low	83.4	Confident	56 Å²	56	35.7 Å²	35.7	30%	0.299	18%	0.181	S	C	.	.			trans	-130.5	154.9	-169.7	-82.3	-66.5	0	0	0	112.5	F504 D505 K716	F504-D508 WeakPolarHBondContact CA-O 3.28Å; F504-D508 WeakPolarHBondContact CD2-O 3.42Å; D505-D508 PolarHBondContact N-O 2.63Å; D505-D508 VanDerWaalsContact N-O 3.08Å; D505-D508 PolarHBondContact OD1-N 2.89Å; D508-K716 WeakPolarHBondContact OD1-CE 3.42Å; D508-K716 IonicContact OD1-NZ 3.15Å; D508-K716 PolarHBondContact OD1-NZ 2.86Å
509	F	73.8	Confident	83	Confident	26 Å²	26	37.9 Å²	37.9	11%	0.114	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	103	168.6	-96.4	-84.6	0	0	0	109.5	R502 K503 F504 E705 N709 A714	R502-F509 HydrophobicContact CB-CD1 4.45Å; R502-F509 PolarHBondContact NH2-O 3.12Å; K503-F509 WeakPolarHBondContact O-CA 3.41Å; F504-F509 HydrophobicContact CB-CD1 4.24Å; F504-F509 HydrophobicContact CB-CD2 4.25Å; F504-F509 HydrophobicContact CB-CE1 4.01Å; F504-F509 HydrophobicContact CB-CE2 4.02Å; F504-F509 HydrophobicContact CB-CG 4.36Å; F504-F509 HydrophobicContact CB-CZ 3.91Å; F504-F509 AromaticContact CD2-CD2 3.61Å; F504-F509 HydrophobicContact CD2-CD2 3.61Å; F504-F509 AromaticContact CD2-CE2 3.8Å; F504-F509 HydrophobicContact CD2-CE2 3.8Å; F504-F509 HydrophobicContact CD2-CG 4.21Å; F504-F509 HydrophobicContact CE2-CD2 4.42Å; F504-F509 HydrophobicContact CG-CD2 4.32Å; F504-F509 HydrophobicContact CG-CE2 4.16Å; F509-E705 HydrophobicContact CD1-CG 4.22Å; F509-E705 VanDerWaalsContact CD1-OE1 3.24Å; F509-E705 WeakPolarHBondContact CD1-OE1 3.39Å; F509-E705 HydrophobicContact CD2-CG 4.44Å; F509-E705 HydrophobicContact CE1-CG 4.34Å; F509-E705 HydrophobicContact CG-CG 4.26Å; F509-E705 HydrophobicContact CZ-CG 4.5Å; F509-N709 HydrophobicContact CE2-CB 4.32Å; F509-N709 WeakPolarHBondContact CE2-ND2 3.11Å; F509-N709 HydrophobicContact CZ-CB 4.44Å; F509-N709 WeakPolarHBondContact CZ-ND2 3.32Å; F509-A714 HydrophobicContact CD2-CB 4.5Å; F509-A714 HydrophobicContact CE2-CB 3.95Å
510	R	84.7	Confident	83	Confident	84 Å²	84	37.3 Å²	37.3	32%	0.317	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	163.9	176.4	61	172.1	-176.6	78.2	-4.7	112.1	R502 K503 D505 E516	R502-R510 CarbonylContact C-O 3.55Å; R502-R510 WeakPolarHBondContact CA-O 3.38Å; R502-R510 WeakPolarHBondContact CB-O 3.34Å; K503-R510 PolarHBondContact N-O 3.2Å; K503-R510 PolarHBondContact O-N 3.14Å; D505-R510 IonicContact OD2-NE 2.67Å; R510-E516 IonicContact CZ-OE1 2.67Å; R510-E516 IonicContact CZ-OE2 2.71Å; R510-E516 IonicContact NH1-OE1 3.38Å; R510-E516 IonicContact NH1-OE2 2.75Å; R510-E516 PolarHBondContact NH1-OE2 3.31Å; R510-E516 IonicContact NH2-OE1 2.66Å; R510-E516 PolarHBondContact NH2-OE1 3.38Å; R510-E516 IonicContact NH2-OE2 3.16Å; R510-E516 PolarHBondContact NH2-OE2 2.7Å
511	W	87.9	Confident	83.2	Confident	56 Å²	56	36 Å²	36	21%	0.212	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	153.9	162.7	-57.3	100.3	0	0	0	109.4	A501 R502 E541 M543 I547	A501-W511 HydrophobicContact CB-CE3 4.02Å; A501-W511 HydrophobicContact CB-CZ3 3.87Å; R502-W511 HydrophobicContact CG-CD2 3.68Å; R502-W511 HydrophobicContact CG-CE3 3.28Å; R502-W511 HydrophobicContact CG-CG 4.36Å; R502-W511 HydrophobicContact CG-CH2 4.09Å; R502-W511 HydrophobicContact CG-CZ2 4.41Å; R502-W511 HydrophobicContact CG-CZ3 3.51Å; W511-E541 HydrophobicContact CH2-CB 4.47Å; W511-M543 HydrophobicContact CD2-CE 4.33Å; W511-M543 HydrophobicContact CE3-CE 3.49Å; W511-M543 VanDerWaalsContact CE3-CE 3.49Å; W511-M543 HydrophobicContact CH2-CB 4.16Å; W511-M543 HydrophobicContact CH2-CE 3.99Å; W511-M543 HydrophobicContact CH2-CG 4.34Å; W511-M543 HydrophobicContact CZ3-CE 3.29Å; W511-I547 HydrophobicContact CD2-CG2 4.11Å; W511-I547 HydrophobicContact CG-CG2 4.03Å
512	I	90.8	Very high	83.3	Confident	6 Å²	6	36.8 Å²	36.8	3%	0.031	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-63.1	143.8	168.2	58.4	-176.1	0	0	0	110.6	F394 F498 A501 K503 E516 Y517 L551	F394-I512 HydrophobicContact CE1-CG2 4.22Å; F394-I512 HydrophobicContact CE2-CG2 4.12Å; F394-I512 HydrophobicContact CZ-CG2 3.58Å; F498-I512 HydrophobicContact CD1-CD1 4.16Å; F498-I512 HydrophobicContact CE1-CD1 4.09Å; A501-I512 PolarHBondContact O-N 2.79Å; K503-I512 HydrophobicContact CB-CG2 4.27Å; I512-E516 VanDerWaalsContact CA-OE2 3.29Å; I512-E516 WeakPolarHBondContact CA-OE2 3.32Å; I512-E516 HydrophobicContact CB-CB 4.39Å; I512-Y517 HydrophobicContact CD1-CD2 3.73Å; I512-Y517 HydrophobicContact CD1-CG 4.38Å; I512-L551 HydrophobicContact CD1-CD1 4.25Å; I512-L551 HydrophobicContact CD1-CD2 4.37Å; I512-L551 HydrophobicContact CD1-CG 4.44Å; I512-L551 HydrophobicContact CG1-CD1 3.7Å; I512-L551 HydrophobicContact CG1-CD2 4.47Å; I512-L551 HydrophobicContact CG1-CG 4Å
513	S	89.3	Confident	83.7	Confident	31 Å²	31	36.5 Å²	36.5	22%	0.217	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-71.2	163	176.5	85.2	0	0	0	0	111.2	G515 E516 Y517 D557	S513-G515 VanDerWaalsContact C-N 3.26Å; S513-G515 PolarHBondContact O-N 2.74Å; S513-G515 PolarHBondContact OG-N 2.73Å; S513-E516 PolarHBondContact N-OE2 3.26Å; S513-E516 PolarHBondContact O-N 3.04Å; S513-E516 WeakPolarHBondContact OG-CG 3.35Å; S513-E516 PolarHBondContact OG-N 2.74Å; S513-Y517 WeakPolarHBondContact O-CB 3.39Å; S513-Y517 PolarHBondContact O-N 2.92Å; S513-D557 WeakPolarHBondContact CB-OD2 3.15Å; S513-D557 PolarHBondContact OG-OD2 2.72Å
514	S	90	Very high	84.1	Confident	6 Å²	6	35 Å²	35	4%	0.042	18%	0.182	C	C	.	.	H	α-helix	trans	-59.2	-39.2	171.5	-50.9	0	0	0	0	111	I518 Q550 S555	S514-I518 WeakPolarHBondContact O-CB 3.24Å; S514-I518 WeakPolarHBondContact O-CD1 3.38Å; S514-I518 WeakPolarHBondContact O-CG1 3.21Å; S514-I518 PolarHBondContact O-N 3.48Å; S514-Q550 PolarHBondContact OG-NE2 2.55Å; S514-Q550 PolarHBondContact OG-O 3.19Å; S514-S555 WeakPolarHBondContact CB-O 3.29Å
515	G	86.1	Confident	84.8	Confident	4 Å²	4	32.3 Å²	32.3	4%	0.041	17%	0.17	C	C	.	.	H	α-helix	trans	-68.2	-46.2	175.2	0	0	0	0	0	114.2	S513 Y517 I518 Q519 D557	S513-G515 VanDerWaalsContact C-N 3.26Å; S513-G515 PolarHBondContact O-N 2.74Å; S513-G515 PolarHBondContact OG-N 2.73Å; G515-Y517 VanDerWaalsContact C-N 3.29Å; G515-Y517 PolarHBondContact O-N 2.75Å; G515-I518 PolarHBondContact O-N 2.73Å; G515-Q519 WeakPolarHBondContact O-CB 3.23Å; G515-Q519 PolarHBondContact O-N 3.42Å; G515-D557 WeakPolarHBondContact CA-OD2 3.39Å; G515-D557 PolarHBondContact N-OD2 2.74Å
516	E	88.2	Confident	85.8	Confident	25 Å²	25	31 Å²	31	12%	0.117	16%	0.159	C	C	.	.	H	α-helix	trans	-55.8	-46.3	173.5	-73.7	174.6	147.1	0	0	110.3	K503 R510 I512 S513 Q519 M520	K503-E516 IonicContact NZ-OE1 2.7Å; K503-E516 PolarHBondContact NZ-OE1 3.27Å; R510-E516 IonicContact CZ-OE1 2.67Å; R510-E516 IonicContact CZ-OE2 2.71Å; R510-E516 IonicContact NH1-OE1 3.38Å; R510-E516 IonicContact NH1-OE2 2.75Å; R510-E516 PolarHBondContact NH1-OE2 3.31Å; R510-E516 IonicContact NH2-OE1 2.66Å; R510-E516 PolarHBondContact NH2-OE1 3.38Å; R510-E516 IonicContact NH2-OE2 3.16Å; R510-E516 PolarHBondContact NH2-OE2 2.7Å; I512-E516 VanDerWaalsContact CA-OE2 3.29Å; I512-E516 WeakPolarHBondContact CA-OE2 3.32Å; I512-E516 HydrophobicContact CB-CB 4.39Å; S513-E516 PolarHBondContact N-OE2 3.26Å; S513-E516 PolarHBondContact O-N 3.04Å; S513-E516 WeakPolarHBondContact OG-CG 3.35Å; S513-E516 PolarHBondContact OG-N 2.74Å; E516-Q519 PolarHBondContact O-N 3.21Å; E516-M520 HydrophobicContact CB-CE 3.93Å; E516-M520 VanDerWaalsContact O-CE 3.23Å; E516-M520 WeakPolarHBondContact O-CE 3.45Å; E516-M520 PolarHBondContact O-N 3.12Å; E516-M520 VanDerWaalsContact O-N 3.09Å
517	Y	92.4	Very high	86.7	Confident	2 Å²	2	33.9 Å²	33.9	1%	0.008	16%	0.155	C	C	.	.	H	α-helix	trans	-64.4	-45.2	177.7	-175.2	-106.4	0	0	0	112.5	H318 F498 I512 S513 G515 Q519 M520 S521 V535 L551 L552	H318-Y517 AromaticContact CE1-CE1 3.9Å; H318-Y517 AromaticContact ND1-CE1 3.57Å; H318-Y517 AromaticContact ND1-CZ 3.63Å; H318-Y517 PolarHBondContact ND1-OH 3.45Å; F498-Y517 AromaticContact CD2-CE2 4Å; F498-Y517 HydrophobicContact CD2-CE2 4Å; F498-Y517 AromaticContact CE1-CD2 3.86Å; F498-Y517 HydrophobicContact CE1-CD2 3.86Å; F498-Y517 HydrophobicContact CE1-CE2 4.28Å; F498-Y517 AromaticContact CE2-CD2 3.8Å; F498-Y517 HydrophobicContact CE2-CD2 3.8Å; F498-Y517 AromaticContact CE2-CE2 3.41Å; F498-Y517 HydrophobicContact CE2-CE2 3.41Å; F498-Y517 VanDerWaalsContact CE2-CE2 3.41Å; F498-Y517 AromaticContact CZ-CD2 3.41Å; F498-Y517 HydrophobicContact CZ-CD2 3.41Å; F498-Y517 VanDerWaalsContact CZ-CD2 3.41Å; F498-Y517 AromaticContact CZ-CE2 3.56Å; F498-Y517 HydrophobicContact CZ-CE2 3.56Å; F498-Y517 HydrophobicContact CZ-CG 4.41Å; I512-Y517 HydrophobicContact CD1-CD2 3.73Å; I512-Y517 HydrophobicContact CD1-CG 4.38Å; S513-Y517 WeakPolarHBondContact O-CB 3.39Å; S513-Y517 PolarHBondContact O-N 2.92Å; G515-Y517 VanDerWaalsContact C-N 3.29Å; G515-Y517 PolarHBondContact O-N 2.75Å; Y517-Q519 VanDerWaalsContact C-N 3.33Å; Y517-Q519 PolarHBondContact O-N 3.38Å; Y517-M520 PolarHBondContact O-N 3.41Å; Y517-S521 WeakPolarHBondContact O-CB 3.44Å; Y517-S521 PolarHBondContact O-N 2.77Å; Y517-S521 PolarHBondContact O-OG 2.75Å; Y517-V535 HydrophobicContact CE2-CG1 4.3Å; Y517-V535 VanDerWaalsContact OH-CG1 3.29Å; Y517-V535 WeakPolarHBondContact OH-CG1 3.27Å; Y517-L551 HydrophobicContact CD1-CD2 4.09Å; Y517-L551 VanDerWaalsContact CD1-O 3.26Å; Y517-L551 WeakPolarHBondContact CD1-O 3.46Å; Y517-L551 HydrophobicContact CD2-CD2 3.71Å; Y517-L551 HydrophobicContact CE1-CD2 4.34Å; Y517-L551 HydrophobicContact CE2-CD2 3.96Å; Y517-L551 HydrophobicContact CG-CD2 3.77Å; Y517-L552 HydrophobicContact CE1-CD2 3.7Å; Y517-L552 HydrophobicContact CE2-CD2 4.29Å; Y517-L552 VanDerWaalsContact OH-CD2 3.29Å; Y517-L552 WeakPolarHBondContact OH-CD2 3.48Å
518	I	89.6	Confident	87.6	Confident	45 Å²	45	32.1 Å²	32.1	23%	0.231	17%	0.171	C	C	.	.	H	α-helix	trans	-63	-38	178	-73.4	164.3	0	0	0	111.5	S514 G515 G522 A556	S514-I518 WeakPolarHBondContact O-CB 3.24Å; S514-I518 WeakPolarHBondContact O-CD1 3.38Å; S514-I518 WeakPolarHBondContact O-CG1 3.21Å; S514-I518 PolarHBondContact O-N 3.48Å; G515-I518 PolarHBondContact O-N 2.73Å; I518-G522 VanDerWaalsContact O-CA 3.27Å; I518-G522 WeakPolarHBondContact O-CA 3.34Å; I518-G522 PolarHBondContact O-N 3.2Å; I518-A556 HydrophobicContact CD1-CB 4.14Å
519	Q	86.9	Confident	88.5	Confident	46 Å²	46	36 Å²	36	22%	0.215	19%	0.189	C	C	.	.	H	α-helix	trans	-68.9	-44.9	178.8	-170.2	172.7	15.6	0	0	112.2	Y256 A486 G515 E516 Y517	Y256-Q519 PolarHBondContact OH-NE2 3.02Å; A486-Q519 HydrophobicContact CB-CG 4.44Å; G515-Q519 WeakPolarHBondContact O-CB 3.23Å; G515-Q519 PolarHBondContact O-N 3.42Å; E516-Q519 PolarHBondContact O-N 3.21Å; Y517-Q519 VanDerWaalsContact C-N 3.33Å; Y517-Q519 PolarHBondContact O-N 3.38Å
520	M	91.5	Very high	89.4	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-72.3	-48.6	177.9	-78.7	178.7	-84	0	0	112.5	F392 F394 E483 A486 F498 E516 Y517 G522 R523	F392-M520 HydrophobicContact CB-SD 4.25Å; F392-M520 HydrophobicContact CD1-CG 4.38Å; F392-M520 HydrophobicContact CD1-SD 4.3Å; F392-M520 HydrophobicContact CD2-CB 3.86Å; F392-M520 HydrophobicContact CD2-CG 4Å; F392-M520 HydrophobicContact CD2-SD 4.26Å; F392-M520 HydrophobicContact CE1-CG 4.34Å; F392-M520 HydrophobicContact CE2-CB 3.79Å; F392-M520 HydrophobicContact CE2-CG 3.98Å; F392-M520 HydrophobicContact CG-CG 4.22Å; F392-M520 HydrophobicContact CG-SD 4.03Å; F392-M520 HydrophobicContact CZ-CB 4.4Å; F392-M520 HydrophobicContact CZ-CG 4.16Å; F394-M520 HydrophobicContact CE1-CE 4.01Å; F394-M520 HydrophobicContact CE1-SD 4.1Å; F394-M520 HydrophobicContact CZ-CE 4.42Å; E483-M520 HydrophobicContact CB-SD 4.31Å; E483-M520 HydrophobicContact CG-CE 4.23Å; E483-M520 HydrophobicContact CG-SD 4.13Å; A486-M520 HydrophobicContact CB-CB 4.41Å; A486-M520 HydrophobicContact CB-CG 3.67Å; F498-M520 HydrophobicContact CD1-SD 4.36Å; F498-M520 HydrophobicContact CE1-CB 3.52Å; F498-M520 HydrophobicContact CE1-CE 3.99Å; F498-M520 HydrophobicContact CE1-CG 4.25Å; F498-M520 HydrophobicContact CE1-SD 3.77Å; F498-M520 HydrophobicContact CZ-CB 3.47Å; F498-M520 VanDerWaalsContact CZ-CB 3.47Å; E516-M520 HydrophobicContact CB-CE 3.93Å; E516-M520 VanDerWaalsContact O-CE 3.23Å; E516-M520 WeakPolarHBondContact O-CE 3.45Å; E516-M520 PolarHBondContact O-N 3.12Å; E516-M520 VanDerWaalsContact O-N 3.09Å; Y517-M520 PolarHBondContact O-N 3.41Å; M520-G522 VanDerWaalsContact C-N 3.26Å; M520-G522 PolarHBondContact O-N 3.1Å; M520-R523 WeakPolarHBondContact O-CB 3.38Å; M520-R523 PolarHBondContact O-N 3.28Å
521	S	92.9	Very high	89.7	Confident	4 Å²	4	37 Å²	37	3%	0.028	20%	0.202	C	C	.	.	H	α-helix	trans	-67.5	-27.8	178	65.6	0	0	0	0	112.5	Y517 R523 A524	Y517-S521 WeakPolarHBondContact O-CB 3.44Å; Y517-S521 PolarHBondContact O-N 2.77Å; Y517-S521 PolarHBondContact O-OG 2.75Å; S521-R523 PolarHBondContact O-N 3.38Å; S521-R523 VanDerWaalsContact O-N 3.08Å; S521-A524 WeakPolarHBondContact O-CB 3.23Å; S521-A524 PolarHBondContact O-N 3.05Å
522	G	89.1	Confident	90	Very high	15 Å²	15	38.2 Å²	38.2	16%	0.155	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-12.4	175.9	0	0	0	0	0	114.8	R312 I518 M520 A524	R312-G522 PolarHBondContact NH1-O 3.25Å; I518-G522 VanDerWaalsContact O-CA 3.27Å; I518-G522 WeakPolarHBondContact O-CA 3.34Å; I518-G522 PolarHBondContact O-N 3.2Å; M520-G522 VanDerWaalsContact C-N 3.26Å; M520-G522 PolarHBondContact O-N 3.1Å; G522-A524 VanDerWaalsContact C-N 3.32Å
523	R	91.1	Very high	90.2	Very high	18 Å²	18	37.9 Å²	37.9	7%	0.068	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-8.7	170.5	-60.4	-65.9	175.4	-167.8	1.3	113.7	I390 A486 I489 N490 P492 A493 V496 M520 S521	I390-R523 HydrophobicContact CD1-CB 4.08Å; A486-R523 HydrophobicContact CB-CG 4.47Å; A486-R523 PolarHBondContact O-NE 3.45Å; A486-R523 PolarHBondContact O-NH2 3.15Å; I489-R523 PolarHBondContact O-NH1 3.14Å; I489-R523 PolarHBondContact O-NH2 2.88Å; N490-R523 PolarHBondContact OD1-NH1 3.23Å; N490-R523 VanDerWaalsContact OD1-NH1 3.15Å; P492-R523 CarbonylContact C-O 3.52Å; P492-R523 WeakPolarHBondContact CA-O 3.39Å; A493-R523 PolarHBondContact N-O 2.92Å; V496-R523 HydrophobicContact CG2-CB 4.11Å; M520-R523 WeakPolarHBondContact O-CB 3.38Å; M520-R523 PolarHBondContact O-N 3.28Å; S521-R523 PolarHBondContact O-N 3.38Å; S521-R523 VanDerWaalsContact O-N 3.08Å
524	A	93.5	Very high	90.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-80.6	142.4	171.6	0	0	0	0	0	111.8	L316 A493 V496 S521 G522 V535	L316-A524 HydrophobicContact CD2-CB 3.88Å; L316-A524 WeakPolarHBondContact CD2-O 3.19Å; A493-A524 CarbonylContact O-C 3.56Å; A493-A524 WeakPolarHBondContact O-CA 3.34Å; V496-A524 HydrophobicContact CB-CB 4.25Å; V496-A524 HydrophobicContact CG2-CB 3.83Å; S521-A524 WeakPolarHBondContact O-CB 3.23Å; S521-A524 PolarHBondContact O-N 3.05Å; G522-A524 VanDerWaalsContact C-N 3.32Å; A524-V535 HydrophobicContact CB-CG2 3.95Å
525	G	92.2	Very high	90.9	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.01	19%	0.194	C	C	.	.			trans	86.6	108.7	177.2	0	0	0	0	0	113.3	A493	A493-G525 PolarHBondContact O-N 3Å
526	R	90.1	Very high	91.4	Very high	55 Å²	55	36.2 Å²	36.2	21%	0.208	19%	0.192	C	C	.	.			trans	-94.2	116.2	177.2	-59.8	169.9	-66	162.2	5.8	110.5	P492 G528 M529 D530	P492-R526 HydrophobicContact CB-CG 3.94Å; P492-R526 HydrophobicContact CG-CG 4.02Å; R526-G528 PolarHBondContact O-N 3.36Å; R526-M529 HydrophobicContact CB-CB 3.97Å; R526-M529 HydrophobicContact CB-CG 4.42Å; R526-M529 HydrophobicContact CB-SD 4.29Å; R526-M529 PolarHBondContact O-N 3.01Å; R526-D530 VanDerWaalsContact CB-OD2 3.26Å; R526-D530 WeakPolarHBondContact CB-OD2 3.22Å; R526-D530 WeakPolarHBondContact CG-OD2 3.45Å; R526-D530 IonicContact CZ-OD1 3.24Å; R526-D530 IonicContact CZ-OD2 2.98Å; R526-D530 PolarHBondContact N-OD2 3.29Å; R526-D530 IonicContact NE-OD1 3.15Å; R526-D530 IonicContact NE-OD2 3.3Å; R526-D530 PolarHBondContact NE-OD2 3.28Å; R526-D530 IonicContact NH2-OD1 2.91Å; R526-D530 PolarHBondContact NH2-OD1 3.26Å; R526-D530 IonicContact NH2-OD2 2.55Å; R526-D530 PolarHBondContact O-N 3.07Å
527	R	86.8	Confident	91.7	Very high	109 Å²	109	35 Å²	35	41%	0.411	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	120.6	178.4	-172.9	174.8	-175.9	155.6	5	109.7	D141 A165 P313	D141-R527 VanDerWaalsContact CG-NH2 3.35Å; D141-R527 IonicContact OD1-NH2 2.7Å; D141-R527 PolarHBondContact OD1-NH2 3.4Å; D141-R527 VanDerWaalsContact OD1-NH2 3.11Å; D141-R527 IonicContact OD2-CZ 3.12Å; D141-R527 VanDerWaalsContact OD2-CZ 3.27Å; D141-R527 IonicContact OD2-NH1 2.75Å; D141-R527 PolarHBondContact OD2-NH1 2.86Å; D141-R527 IonicContact OD2-NH2 3.76Å; D141-R527 PolarHBondContact OD2-NH2 3.31Å; A165-R527 PolarHBondContact O-NH1 2.83Å; P313-R527 HydrophobicContact CB-CG 3.88Å
528	G	84.7	Confident	91.7	Very high	83 Å²	83	35.9 Å²	35.9	86%	0.856	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.4	-2.1	-179.7	0	0	0	0	0	116.6	R526	R526-G528 PolarHBondContact O-N 3.36Å
529	M	87.3	Confident	91.4	Very high	139 Å²	139	33.8 Å²	33.8	69%	0.685	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-120.6	-30.5	175.8	-58	179.7	179.9	0	0	113.8	R526	R526-M529 HydrophobicContact CB-CB 3.97Å; R526-M529 HydrophobicContact CB-CG 4.42Å; R526-M529 HydrophobicContact CB-SD 4.29Å; R526-M529 PolarHBondContact O-N 3.01Å
530	D	92.1	Very high	90.9	Very high	10 Å²	10	34.5 Å²	34.5	5%	0.053	19%	0.185	C	C	.	.			trans	-119.6	132.4	-179.9	-56.9	-51.9	0	0	0	111	T314 R494 R526 R532	T314-D530 HydrophobicContact CG2-CB 4.34Å; T314-D530 VanDerWaalsContact CG2-O 3.28Å; T314-D530 WeakPolarHBondContact CG2-O 3.2Å; R494-D530 WeakPolarHBondContact CA-OD2 3.44Å; R494-D530 WeakPolarHBondContact CD-OD1 3.46Å; R494-D530 HydrophobicContact CG-CB 4.48Å; R494-D530 VanDerWaalsContact CG-OD1 3.28Å; R494-D530 WeakPolarHBondContact CG-OD1 3.32Å; R494-D530 IonicContact NE-OD1 3.11Å; R494-D530 PolarHBondContact NE-OD1 3.33Å; R526-D530 VanDerWaalsContact CB-OD2 3.26Å; R526-D530 WeakPolarHBondContact CB-OD2 3.22Å; R526-D530 WeakPolarHBondContact CG-OD2 3.45Å; R526-D530 IonicContact CZ-OD1 3.24Å; R526-D530 IonicContact CZ-OD2 2.98Å; R526-D530 PolarHBondContact N-OD2 3.29Å; R526-D530 IonicContact NE-OD1 3.15Å; R526-D530 IonicContact NE-OD2 3.3Å; R526-D530 PolarHBondContact NE-OD2 3.28Å; R526-D530 IonicContact NH2-OD1 2.91Å; R526-D530 PolarHBondContact NH2-OD1 3.26Å; R526-D530 IonicContact NH2-OD2 2.55Å; R526-D530 PolarHBondContact O-N 3.07Å; D530-R532 PolarHBondContact O-N 3.36Å
531	D	91.5	Very high	89.9	Confident	120 Å²	120	36.3 Å²	36.3	64%	0.642	19%	0.194	S	C	*	.	S	Bend	trans	-62.6	-32.9	173.1	-35.5	-75.5	0	0	0	111.8	P315 R494	P315-D531 WeakPolarHBondContact CD-O 3.49Å; R494-D531 IonicContact NH2-OD2 3.31Å
532	R	93	Very high	88.8	Confident	81 Å²	81	42.6 Å²	42.6	31%	0.306	22%	0.221	S	C	.	.	S	Bend	trans	-157.5	146.4	-179.2	63.3	-173.5	-175.2	-85.2	-0.8	111.1	P315 Q317 E334 D530	P315-R532 HydrophobicContact CG-CB 4.3Å; P315-R532 CarbonylContact O-C 3.51Å; P315-R532 VanDerWaalsContact O-CA 3.27Å; P315-R532 WeakPolarHBondContact O-CA 3.48Å; P315-R532 WeakPolarHBondContact O-CB 3.29Å; Q317-R532 VanDerWaalsContact CD-CD 3.5Å; E334-R532 WeakPolarHBondContact OE1-CD 3.3Å; E334-R532 IonicContact OE1-NE 3.68Å; D530-R532 PolarHBondContact O-N 3.36Å
533	G	95.7	Very high	88.2	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	141.5	170.6	0	0	0	0	0	111.4	P315 L316 Q317	P315-G533 PolarHBondContact O-N 3.16Å; L316-G533 WeakPolarHBondContact CA-O 3.41Å; Q317-G533 PolarHBondContact N-O 3.19Å
534	I	97.1	Very high	87.5	Confident	5 Å²	5	43.2 Å²	43.2	3%	0.026	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	129.7	178.1	-61.2	175.3	0	0	0	109.2	Y319 F386 R494 T495 V496 I536	Y319-I534 HydrophobicContact CD2-CG2 4.04Å; Y319-I534 HydrophobicContact CE2-CG2 4.09Å; F386-I534 HydrophobicContact CB-CD1 4.31Å; F386-I534 HydrophobicContact CD1-CD1 3.69Å; F386-I534 HydrophobicContact CD2-CD1 3.6Å; F386-I534 HydrophobicContact CE1-CD1 3.76Å; F386-I534 HydrophobicContact CE2-CD1 3.67Å; F386-I534 HydrophobicContact CG-CD1 3.61Å; F386-I534 HydrophobicContact CZ-CD1 3.75Å; R494-I534 PolarHBondContact O-N 3.08Å; T495-I534 CarbonylContact C-O 3.45Å; T495-I534 VanDerWaalsContact CA-O 3.25Å; T495-I534 WeakPolarHBondContact CA-O 3.47Å; T495-I534 HydrophobicContact CG2-CB 4.13Å; T495-I534 HydrophobicContact CG2-CG2 4.06Å; V496-I534 PolarHBondContact N-O 3.29Å; I534-I536 HydrophobicContact CG2-CD1 4.3Å; I534-I536 HydrophobicContact CG2-CG1 4.09Å
535	V	97.4	Very high	86.7	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	126.1	177.4	-169.1	0	0	0	0	108.7	L316 Q317 Y319 V496 F498 Y517 A524	L316-V535 HydrophobicContact CB-CG2 4.49Å; L316-V535 HydrophobicContact CD1-CG2 4.23Å; L316-V535 HydrophobicContact CD2-CG2 4.41Å; Q317-V535 PolarHBondContact O-N 2.92Å; Y319-V535 PolarHBondContact N-O 3.35Å; V496-V535 CarbonylContact O-C 3.54Å; V496-V535 WeakPolarHBondContact O-CA 3.39Å; F498-V535 HydrophobicContact CD2-CG1 4.24Å; F498-V535 HydrophobicContact CE2-CG1 3.73Å; Y517-V535 HydrophobicContact CE2-CG1 4.3Å; Y517-V535 VanDerWaalsContact OH-CG1 3.29Å; Y517-V535 WeakPolarHBondContact OH-CG1 3.27Å; A524-V535 HydrophobicContact CB-CG2 3.95Å
536	I	96.8	Very high	86.3	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	119.7	-179.7	-61	168.8	0	0	0	109.1	Y319 F321 L328 I377 I381 T495 V496 L497 F498 I534	Y319-I536 WeakPolarHBondContact O-CA 3.08Å; F321-I536 HydrophobicContact CB-CG2 4.24Å; L328-I536 HydrophobicContact CD1-CD1 3.92Å; L328-I536 HydrophobicContact CD1-CG1 4.39Å; L328-I536 HydrophobicContact CD2-CB 4.45Å; L328-I536 HydrophobicContact CD2-CD1 4.23Å; L328-I536 HydrophobicContact CD2-CG1 4.11Å; L328-I536 HydrophobicContact CD2-CG2 3.54Å; I377-I536 HydrophobicContact CG2-CD1 4.03Å; I381-I536 HydrophobicContact CD1-CD1 4.07Å; I381-I536 HydrophobicContact CG1-CD1 4.37Å; T495-I536 HydrophobicContact CG2-CD1 4.18Å; V496-I536 PolarHBondContact O-N 3.01Å; L497-I536 CarbonylContact C-O 3.51Å; L497-I536 WeakPolarHBondContact CA-O 3.43Å; L497-I536 HydrophobicContact CD1-CB 3.75Å; L497-I536 HydrophobicContact CD1-CG2 3.48Å; L497-I536 VanDerWaalsContact CD1-CG2 3.48Å; F498-I536 PolarHBondContact N-O 2.66Å; I534-I536 HydrophobicContact CG2-CD1 4.3Å; I534-I536 HydrophobicContact CG2-CG1 4.09Å
537	L	95.1	Very high	86.1	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	112	174	-176.3	61.8	0	0	0	109.6	Y319 I320 F321 F498 A501 V539 L551 L552	Y319-L537 PolarHBondContact O-N 2.87Å; I320-L537 WeakPolarHBondContact CA-O 3.37Å; I320-L537 HydrophobicContact CG1-CB 4.34Å; F321-L537 PolarHBondContact N-O 2.94Å; F498-L537 HydrophobicContact CB-CD1 3.66Å; F498-L537 HydrophobicContact CD2-CD1 4.43Å; F498-L537 HydrophobicContact CG-CD1 4.03Å; A501-L537 HydrophobicContact CB-CD1 3.81Å; A501-L537 HydrophobicContact CB-CD2 4.28Å; A501-L537 HydrophobicContact CB-CG 4.19Å; L537-V539 HydrophobicContact CD2-CG2 4.1Å; L537-V539 HydrophobicContact CG-CG2 3.87Å; L537-L551 HydrophobicContact CD2-CD1 4.38Å; L537-L551 HydrophobicContact CD2-CD2 3.81Å; L537-L552 HydrophobicContact CD2-CD2 4.36Å
538	M	91.1	Very high	86	Confident	20 Å²	20	45.3 Å²	45.3	10%	0.099	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	126.6	168.6	-65.3	178.8	68.9	0	0	109.6	F321 N373 V374 I377 L497 F498	F321-M538 HydrophobicContact CB-CG 4.31Å; F321-M538 HydrophobicContact CD1-CG 4.5Å; N373-M538 HydrophobicContact CB-CE 3.59Å; V374-M538 HydrophobicContact CG2-CE 3.85Å; V374-M538 HydrophobicContact CG2-SD 3.79Å; I377-M538 HydrophobicContact CD1-CE 3.94Å; I377-M538 HydrophobicContact CD1-CG 3.7Å; I377-M538 HydrophobicContact CD1-SD 3.62Å; L497-M538 HydrophobicContact CD1-CG 3.87Å; L497-M538 HydrophobicContact CD1-SD 4.06Å; F498-M538 VanDerWaalsContact O-CB 3.26Å; F498-M538 WeakPolarHBondContact O-CB 3.3Å; F498-M538 WeakPolarHBondContact O-CG 3.4Å; F498-M538 PolarHBondContact O-N 3.02Å
539	V	84.1	Confident	86.2	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.006	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	130.1	179.4	-175.7	0	0	0	0	109	I320 F321 A323 M347 L350 A501 L537 E541	I320-V539 HydrophobicContact CD1-CG2 4.37Å; I320-V539 HydrophobicContact CG1-CG2 4.34Å; I320-V539 HydrophobicContact CG2-CB 4.22Å; I320-V539 HydrophobicContact CG2-CG2 3.88Å; F321-V539 PolarHBondContact O-N 3.23Å; A323-V539 WeakPolarHBondContact CB-O 3.22Å; A323-V539 PolarHBondContact N-O 3.08Å; M347-V539 HydrophobicContact CE-CG1 4.18Å; L350-V539 HydrophobicContact CD1-CB 4.44Å; L350-V539 HydrophobicContact CD1-CG1 3.89Å; A501-V539 HydrophobicContact CB-CG2 4.31Å; L537-V539 HydrophobicContact CD2-CG2 4.1Å; L537-V539 HydrophobicContact CG-CG2 3.87Å; V539-E541 WeakPolarHBondContact CG1-O 3.27Å
540	D	76.2	Confident	86.3	Confident	60 Å²	60	45.2 Å²	45.2	32%	0.321	23%	0.227	S	C	.	.			trans	-114.2	-21.4	-179.8	65.3	-34.6	0	0	0	113.6	A323 K708	A323-D540 HydrophobicContact CB-CB 3.99Å; D540-K708 IonicContact OD2-NZ 2.91Å; D540-K708 PolarHBondContact OD2-NZ 2.96Å
541	E	70.1	Confident	86.3	Confident	41 Å²	41	45 Å²	45	19%	0.192	23%	0.226	C	C	.	.	S	Bend	trans	-112.8	145.2	175.3	-158.8	-168.9	-169.1	0	0	111.9	R502 W511 V539 M543 K719	R502-E541 IonicContact CZ-OE2 3.67Å; R502-E541 IonicContact NH1-OE2 2.66Å; R502-E541 PolarHBondContact NH1-OE2 2.86Å; W511-E541 HydrophobicContact CH2-CB 4.47Å; V539-E541 WeakPolarHBondContact CG1-O 3.27Å; E541-M543 PolarHBondContact O-N 3.47Å; E541-K719 IonicContact OE1-NZ 2.68Å; E541-K719 PolarHBondContact OE1-NZ 3.34Å; E541-K719 IonicContact OE2-NZ 2.96Å; E541-K719 PolarHBondContact OE2-NZ 3.05Å
542	K	70.4	Confident	86.2	Confident	136 Å²	136	40 Å²	40	59%	0.591	20%	0.2	S	C	*	.	P	Polyproline II helix	trans	-60.8	119	175.7	179.3	-173.1	167.6	-161.9	0	111.3	D721	K542-D721 IonicContact NZ-OD2 2.97Å
543	M	75.9	Confident	86	Confident	5 Å²	5	41 Å²	41	3%	0.025	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-99.9	145	175.1	-171.6	-173.5	-76.7	0	0	109.9	F343 M347 A501 W511 E541 I547 G548 L551	F343-M543 HydrophobicContact CE2-SD 3.98Å; F343-M543 HydrophobicContact CZ-CB 4.02Å; F343-M543 HydrophobicContact CZ-CG 4.01Å; F343-M543 HydrophobicContact CZ-SD 3.94Å; M347-M543 HydrophobicContact CE-CB 4.06Å; M347-M543 HydrophobicContact SD-CB 3.95Å; M347-M543 PolarHBondContact SD-N 3.4Å; M347-M543 VanDerWaalsContact SD-N 3.38Å; A501-M543 HydrophobicContact CB-CE 4.13Å; W511-M543 HydrophobicContact CD2-CE 4.33Å; W511-M543 HydrophobicContact CE3-CE 3.49Å; W511-M543 VanDerWaalsContact CE3-CE 3.49Å; W511-M543 HydrophobicContact CH2-CB 4.16Å; W511-M543 HydrophobicContact CH2-CE 3.99Å; W511-M543 HydrophobicContact CH2-CG 4.34Å; W511-M543 HydrophobicContact CZ3-CE 3.29Å; E541-M543 PolarHBondContact O-N 3.47Å; M543-I547 HydrophobicContact CG-CB 3.89Å; M543-I547 HydrophobicContact CG-CG2 3.69Å; M543-I547 HydrophobicContact SD-CG2 4.21Å; M543-G548 WeakPolarHBondContact SD-CA 3.08Å; M543-L551 HydrophobicContact CE-CD1 3.86Å
544	S	76.6	Confident	85.4	Confident	41 Å²	41	41.5 Å²	41.5	29%	0.287	21%	0.211	S	C	.	.	P	Polyproline II helix	trans	-77.6	153.3	171.8	67.7	0	0	0	0	111	T546 I547 G548	S544-T546 PolarHBondContact O-N 3.28Å; S544-T546 PolarHBondContact OG-OG1 2.96Å; S544-I547 PolarHBondContact O-N 2.93Å; S544-I547 VanDerWaalsContact O-N 3.12Å; S544-I547 VanDerWaalsContact OG-CG1 3.31Å; S544-I547 WeakPolarHBondContact OG-CG1 3.42Å; S544-I547 PolarHBondContact OG-N 3.49Å; S544-I547 VanDerWaalsContact OG-N 3.14Å; S544-G548 PolarHBondContact O-N 2.94Å
545	P	77.1	Confident	84.8	Confident	37 Å²	37	45.1 Å²	45.1	24%	0.24	24%	0.237	C	C	.	.	H	α-helix	trans	-56.5	-32.2	173.1	-27.2	36.1	0	0	0	113.1	E340 F343 K549	E340-P545 WeakPolarHBondContact OE1-CB 3.41Å; F343-P545 HydrophobicContact CD1-CB 4.39Å; F343-P545 HydrophobicContact CD1-CG 4.23Å; F343-P545 HydrophobicContact CE1-CB 4.28Å; F343-P545 HydrophobicContact CE1-CG 4.09Å; P545-K549 WeakPolarHBondContact O-CB 3.43Å; P545-K549 PolarHBondContact O-N 3Å
546	T	83.3	Confident	84.3	Confident	109 Å²	109	45.7 Å²	45.7	67%	0.669	24%	0.242	S	C	*	.	H	α-helix	trans	-64.8	-46.1	174.2	46.8	0	0	0	0	113	S544 Q550	S544-T546 PolarHBondContact O-N 3.28Å; S544-T546 PolarHBondContact OG-OG1 2.96Å; T546-Q550 WeakPolarHBondContact O-CB 3.45Å; T546-Q550 PolarHBondContact O-N 2.92Å
547	I	85.3	Confident	83.9	Confident	63 Å²	63	48.2 Å²	48.2	32%	0.323	26%	0.255	S	S	.	.	H	α-helix	trans	-68.8	-41.8	177.1	-66.7	167.7	0	0	0	110.1	W511 M543 S544 Q550 L551	W511-I547 HydrophobicContact CD2-CG2 4.11Å; W511-I547 HydrophobicContact CG-CG2 4.03Å; M543-I547 HydrophobicContact CG-CB 3.89Å; M543-I547 HydrophobicContact CG-CG2 3.69Å; M543-I547 HydrophobicContact SD-CG2 4.21Å; S544-I547 PolarHBondContact O-N 2.93Å; S544-I547 VanDerWaalsContact O-N 3.12Å; S544-I547 VanDerWaalsContact OG-CG1 3.31Å; S544-I547 WeakPolarHBondContact OG-CG1 3.42Å; S544-I547 PolarHBondContact OG-N 3.49Å; S544-I547 VanDerWaalsContact OG-N 3.14Å; I547-Q550 PolarHBondContact O-N 3.5Å; I547-L551 WeakPolarHBondContact O-CB 3.03Å; I547-L551 PolarHBondContact O-N 2.62Å
548	G	85.8	Confident	83.8	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.5	-43.6	177.3	0	0	0	0	0	113.1	M543 S544 L551 L552	M543-G548 WeakPolarHBondContact SD-CA 3.08Å; S544-G548 PolarHBondContact O-N 2.94Å; G548-L551 PolarHBondContact O-N 3.13Å; G548-L552 VanDerWaalsContact O-CB 3.28Å; G548-L552 WeakPolarHBondContact O-CB 3.23Å; G548-L552 WeakPolarHBondContact O-CD1 3.27Å; G548-L552 VanDerWaalsContact O-CG 3.25Å; G548-L552 WeakPolarHBondContact O-CG 3.3Å; G548-L552 PolarHBondContact O-N 3.27Å
549	K	88.4	Confident	83.9	Confident	111 Å²	111	49.9 Å²	49.9	48%	0.483	27%	0.267	S	S	.	.	H	α-helix	trans	-66.3	-37.2	174.9	-169	172.6	-176.1	173.6	0	111.9	F338 P545 K553 G554	F338-K549 HydrophobicContact CD1-CD 4.32Å; F338-K549 HydrophobicContact CD1-CG 4.39Å; F338-K549 HydrophobicContact CE1-CB 4.33Å; F338-K549 HydrophobicContact CE2-CB 4.49Å; F338-K549 HydrophobicContact CG-CG 4.41Å; F338-K549 HydrophobicContact CZ-CB 4.32Å; P545-K549 WeakPolarHBondContact O-CB 3.43Å; P545-K549 PolarHBondContact O-N 3Å; K549-K553 HydrophobicContact CG-CB 4.4Å; K549-K553 CarbonylContact O-C 3.55Å; K549-K553 VanDerWaalsContact O-CA 3.32Å; K549-K553 WeakPolarHBondContact O-CA 3.31Å; K549-K553 VanDerWaalsContact O-CB 3.31Å; K549-K553 WeakPolarHBondContact O-CB 3.41Å; K549-K553 PolarHBondContact O-N 3.42Å; K549-G554 PolarHBondContact O-N 3.41Å
550	Q	89.8	Confident	84.4	Confident	108 Å²	108	53.6 Å²	53.6	51%	0.505	29%	0.287	S	S	.	.	H	α-helix	trans	-66.4	-43.1	173.7	-176.3	60.5	39.4	0	0	112.2	S514 T546 I547 G554	S514-Q550 PolarHBondContact OG-NE2 2.55Å; S514-Q550 PolarHBondContact OG-O 3.19Å; T546-Q550 WeakPolarHBondContact O-CB 3.45Å; T546-Q550 PolarHBondContact O-N 2.92Å; I547-Q550 PolarHBondContact O-N 3.5Å; Q550-G554 WeakPolarHBondContact O-CA 3.25Å; Q550-G554 PolarHBondContact O-N 3.39Å
551	L	90.8	Very high	85.2	Confident	6 Å²	6	51.5 Å²	51.5	3%	0.031	28%	0.277	C	S	.	.	H	α-helix	trans	-66	-45.1	179.6	-172.8	159.4	0	0	0	111.4	I512 Y517 L537 M543 I547 G548	I512-L551 HydrophobicContact CD1-CD1 4.25Å; I512-L551 HydrophobicContact CD1-CD2 4.37Å; I512-L551 HydrophobicContact CD1-CG 4.44Å; I512-L551 HydrophobicContact CG1-CD1 3.7Å; I512-L551 HydrophobicContact CG1-CD2 4.47Å; I512-L551 HydrophobicContact CG1-CG 4Å; Y517-L551 HydrophobicContact CD1-CD2 4.09Å; Y517-L551 VanDerWaalsContact CD1-O 3.26Å; Y517-L551 WeakPolarHBondContact CD1-O 3.46Å; Y517-L551 HydrophobicContact CD2-CD2 3.71Å; Y517-L551 HydrophobicContact CE1-CD2 4.34Å; Y517-L551 HydrophobicContact CE2-CD2 3.96Å; Y517-L551 HydrophobicContact CG-CD2 3.77Å; L537-L551 HydrophobicContact CD2-CD1 4.38Å; L537-L551 HydrophobicContact CD2-CD2 3.81Å; M543-L551 HydrophobicContact CE-CD1 3.86Å; I547-L551 WeakPolarHBondContact O-CB 3.03Å; I547-L551 PolarHBondContact O-N 2.62Å; G548-L551 PolarHBondContact O-N 3.13Å
552	L	90.4	Very high	86.2	Confident	16 Å²	16	50.4 Å²	50.4	8%	0.084	28%	0.275	C	S	.	.	H	α-helix	trans	-91.2	-25	-171.4	-60.5	167.9	0	0	0	114.5	I320 V331 V332 F338 Y517 L537 G548	I320-L552 HydrophobicContact CD1-CD1 4.45Å; V331-L552 HydrophobicContact CB-CD1 4.26Å; V331-L552 HydrophobicContact CG2-CD1 3.6Å; V332-L552 HydrophobicContact CG2-CB 3.89Å; V332-L552 HydrophobicContact CG2-CD1 4.45Å; F338-L552 HydrophobicContact CE2-CD1 4.07Å; Y517-L552 HydrophobicContact CE1-CD2 3.7Å; Y517-L552 HydrophobicContact CE2-CD2 4.29Å; Y517-L552 VanDerWaalsContact OH-CD2 3.29Å; Y517-L552 WeakPolarHBondContact OH-CD2 3.48Å; L537-L552 HydrophobicContact CD2-CD2 4.36Å; G548-L552 VanDerWaalsContact O-CB 3.28Å; G548-L552 WeakPolarHBondContact O-CB 3.23Å; G548-L552 WeakPolarHBondContact O-CD1 3.27Å; G548-L552 VanDerWaalsContact O-CG 3.25Å; G548-L552 WeakPolarHBondContact O-CG 3.3Å; G548-L552 PolarHBondContact O-N 3.27Å
553	K	88.6	Confident	87.3	Confident	101 Å²	101	44.1 Å²	44.1	44%	0.439	25%	0.248	S	C	.	.	H	α-helix	trans	-130.7	3	-176.6	-81.3	-135.5	74.4	165.4	0	114.5	V332 G336 F338 K549	V332-K553 HydrophobicContact CG2-CG 4.26Å; G336-K553 WeakPolarHBondContact O-CD 3.48Å; G336-K553 WeakPolarHBondContact O-CE 3.31Å; G336-K553 PolarHBondContact O-NZ 3.32Å; F338-K553 HydrophobicContact CB-CD 4.13Å; F338-K553 HydrophobicContact CB-CG 4.36Å; K549-K553 HydrophobicContact CG-CB 4.4Å; K549-K553 CarbonylContact O-C 3.55Å; K549-K553 VanDerWaalsContact O-CA 3.32Å; K549-K553 WeakPolarHBondContact O-CA 3.31Å; K549-K553 VanDerWaalsContact O-CB 3.31Å; K549-K553 WeakPolarHBondContact O-CB 3.41Å; K549-K553 PolarHBondContact O-N 3.42Å
554	G	83.8	Confident	88.1	Confident	11 Å²	11	47 Å²	47	11%	0.113	26%	0.261	C	S	.	.	S	Bend	trans	-65.1	153.2	174.2	0	0	0	0	0	111.6	K549 Q550	K549-G554 PolarHBondContact O-N 3.41Å; Q550-G554 WeakPolarHBondContact O-CA 3.25Å; Q550-G554 PolarHBondContact O-N 3.39Å
555	S	84.8	Confident	88.9	Confident	80 Å²	80	45.1 Å²	45.1	56%	0.559	25%	0.248	S	C	*	.	P	Polyproline II helix	trans	-59.5	151.5	170.5	54.2	0	0	0	0	111	S514	S514-S555 WeakPolarHBondContact CB-O 3.29Å
556	A	86.7	Confident	89.7	Confident	13 Å²	13	45.1 Å²	45.1	11%	0.107	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-56.5	148.3	165	0	0	0	0	0	110.9	T285 P287 I518	T285-A556 WeakPolarHBondContact O-CB 3.43Å; P287-A556 WeakPolarHBondContact CD-O 3.44Å; P287-A556 WeakPolarHBondContact CG-O 3.25Å; I518-A556 HydrophobicContact CD1-CB 4.14Å
557	D	88.2	Confident	90.3	Very high	54 Å²	54	40.8 Å²	40.8	29%	0.289	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-61	140	-179.7	-58.7	-48	0	0	0	110.5	R258 S513 G515	R258-D557 PolarHBondContact NH1-O 2.83Å; S513-D557 WeakPolarHBondContact CB-OD2 3.15Å; S513-D557 PolarHBondContact OG-OD2 2.72Å; G515-D557 WeakPolarHBondContact CA-OD2 3.39Å; G515-D557 PolarHBondContact N-OD2 2.74Å
558	P	91.8	Very high	90.7	Very high	54 Å²	54	38.2 Å²	38.2	35%	0.351	21%	0.206	S	C	.	.	P	Polyproline II helix	trans	-54.9	153.8	177.9	-27.1	35	0	0	0	113.9	P287 N560	P287-P558 HydrophobicContact CG-CB 4.21Å; P287-P558 HydrophobicContact CG-CG 3.94Å; P558-N560 PolarHBondContact O-N 3.26Å
559	L	94	Very high	91.1	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.206	C	C	.	.			trans	-82.1	90.4	164	-176.8	54.9	0	0	0	107.7	M257 R258 I286 N288 F292 F589 Q593	M257-L559 HydrophobicContact CB-CD1 4.04Å; M257-L559 HydrophobicContact CE-CD1 4.18Å; M257-L559 HydrophobicContact CE-CD2 4.12Å; M257-L559 HydrophobicContact CE-CG 3.98Å; R258-L559 HydrophobicContact CB-CD1 4.2Å; I286-L559 HydrophobicContact CD1-CB 3.77Å; I286-L559 HydrophobicContact CD1-CD2 3.65Å; I286-L559 HydrophobicContact CD1-CG 4.37Å; I286-L559 HydrophobicContact CG2-CB 4.43Å; N288-L559 PolarHBondContact ND2-O 3.12Å; N288-L559 PolarHBondContact OD1-N 2.77Å; F292-L559 HydrophobicContact CD2-CD2 3.77Å; F292-L559 HydrophobicContact CE2-CD2 4.25Å; F292-L559 HydrophobicContact CG-CD2 4.31Å; L559-F589 WeakPolarHBondContact O-CE1 3.4Å; L559-Q593 PolarHBondContact O-NE2 2.9Å
560	N	93.8	Very high	91.5	Very high	80 Å²	80	33 Å²	33	43%	0.428	18%	0.183	S	C	.	.			trans	-99.4	148.1	172.8	-70.8	-21.1	0	0	0	110.3	R258 P558 Q593	R258-N560 VanDerWaalsContact CA-O 3.31Å; R258-N560 WeakPolarHBondContact CA-O 3.45Å; R258-N560 VanDerWaalsContact CB-O 3.28Å; R258-N560 WeakPolarHBondContact CB-O 3.31Å; P558-N560 PolarHBondContact O-N 3.26Å; N560-Q593 PolarHBondContact OD1-NE2 3.38Å
561	S	93.8	Very high	91.8	Very high	16 Å²	16	27.9 Å²	27.9	11%	0.112	16%	0.159	C	C	.	.			trans	-61.8	139.4	174.8	173.2	0	0	0	0	111.9	E267 F563 Y590	E267-S561 VanDerWaalsContact CD-OG 3.23Å; E267-S561 VanDerWaalsContact OE1-CA 3.31Å; E267-S561 WeakPolarHBondContact OE1-CA 3.38Å; E267-S561 WeakPolarHBondContact OE1-CB 3.29Å; E267-S561 PolarHBondContact OE1-OG 2.84Å; E267-S561 PolarHBondContact OE2-OG 2.86Å; S561-F563 WeakPolarHBondContact OG-CB 3.38Å; S561-F563 PolarHBondContact OG-N 3.23Å; S561-F563 VanDerWaalsContact OG-N 3.12Å; S561-Y590 VanDerWaalsContact CB-N 3.34Å; S561-Y590 WeakPolarHBondContact OG-CA 3.16Å; S561-Y590 VanDerWaalsContact OG-CB 3.28Å; S561-Y590 WeakPolarHBondContact OG-CB 3.17Å; S561-Y590 PolarHBondContact OG-N 3.24Å
562	A	91.9	Very high	92	Very high	18 Å²	18	27.8 Å²	27.8	15%	0.149	16%	0.159	C	C	.	.			trans	-115	25.8	169.4	0	0	0	0	0	111.8	D259 E267 H564	D259-A562 WeakPolarHBondContact O-CB 3.49Å; E267-A562 PolarHBondContact OE1-N 3.46Å; A562-H564 PolarHBondContact O-CD2 3.23Å; A562-H564 PolarHBondContact O-N 2.71Å
563	F	93.6	Very high	92.1	Very high	4 Å²	4	27.1 Å²	27.1	2%	0.018	16%	0.155	C	C	.	.			trans	-63.9	131.7	-177.4	-170.3	-81	0	0	0	112.4	V264 E267 S561 L565 M569 M584 L585 Q847	V264-F563 HydrophobicContact CG2-CD2 4.03Å; V264-F563 HydrophobicContact CG2-CE2 4.21Å; V264-F563 HydrophobicContact CG2-CG 4.44Å; E267-F563 HydrophobicContact CB-CD2 4.14Å; S561-F563 WeakPolarHBondContact OG-CB 3.38Å; S561-F563 PolarHBondContact OG-N 3.23Å; S561-F563 VanDerWaalsContact OG-N 3.12Å; F563-L565 HydrophobicContact CE1-CD2 4.24Å; F563-M569 HydrophobicContact CE1-CE 4.22Å; F563-M569 HydrophobicContact CE1-SD 4.45Å; F563-M569 HydrophobicContact CE2-CE 3.65Å; F563-M569 HydrophobicContact CE2-SD 4.42Å; F563-M569 HydrophobicContact CZ-CE 3.43Å; F563-M569 VanDerWaalsContact CZ-CE 3.43Å; F563-M569 HydrophobicContact CZ-SD 3.71Å; F563-M584 HydrophobicContact CE2-CG 3.96Å; F563-M584 HydrophobicContact CE2-SD 4.26Å; F563-M584 HydrophobicContact CZ-CG 3.75Å; F563-L585 HydrophobicContact CD1-CD2 4.42Å; F563-L585 HydrophobicContact CE1-CD2 3.74Å; F563-Q847 PolarHBondContact O-NE2 2.87Å
564	H	92.4	Very high	92.4	Very high	64 Å²	64	23.5 Å²	23.5	30%	0.296	14%	0.141	S	C	.	.			trans	-146.5	158.2	172	51	78.5	0	0	0	110.9	S260 V264 A562	S260-H564 PolarHBondContact O-NE2 2.95Å; V264-H564 WeakPolarHBondContact CG2-O 3.39Å; A562-H564 PolarHBondContact O-CD2 3.23Å; A562-H564 PolarHBondContact O-N 2.71Å
565	L	92.9	Very high	92.8	Very high	3 Å²	3	26 Å²	26	2%	0.016	15%	0.146	C	C	.	.			trans	-82.3	127.2	-177.8	-68.3	168.8	0	0	0	111.2	F563 M569 V570 L585 Q847 E850 L851 R854	F563-L565 HydrophobicContact CE1-CD2 4.24Å; L565-M569 HydrophobicContact CD2-SD 4.03Å; L565-V570 HydrophobicContact CD2-CG2 4.29Å; L565-L585 HydrophobicContact CD2-CD2 4.02Å; L565-L585 HydrophobicContact CD2-CG 4.31Å; L565-L585 HydrophobicContact CG-CD2 4.35Å; L565-Q847 HydrophobicContact CD1-CB 4Å; L565-Q847 HydrophobicContact CG-CB 4.49Å; L565-E850 HydrophobicContact CD1-CB 4.25Å; L565-E850 HydrophobicContact CD1-CG 4.46Å; L565-L851 HydrophobicContact CD1-CB 3.73Å; L565-R854 PolarHBondContact O-NE 3.42Å; L565-R854 PolarHBondContact O-NH1 3.22Å; L565-R854 VanDerWaalsContact O-NH1 3.16Å; L565-R854 PolarHBondContact O-NH2 3.19Å
566	T	93.7	Very high	92.9	Very high	36 Å²	36	24.4 Å²	24.4	22%	0.221	13%	0.134	C	C	.	.			trans	-109.2	154	168.3	59.1	0	0	0	0	110	N568 M569 V570	T566-N568 VanDerWaalsContact C-N 3.34Å; T566-M569 PolarHBondContact O-N 3.37Å; T566-M569 WeakPolarHBondContact OG1-CB 3.36Å; T566-M569 PolarHBondContact OG1-N 2.93Å; T566-V570 WeakPolarHBondContact O-CG2 3.19Å; T566-V570 PolarHBondContact O-N 3.22Å; T566-V570 VanDerWaalsContact O-N 3.1Å
567	Y	95.4	Very high	92.5	Very high	19 Å²	19	33.3 Å²	33.3	8%	0.075	17%	0.173	C	C	.	.	H	α-helix	trans	-72.1	-32.1	179.9	-66.9	-79.7	0	0	0	111.2	V570 L571 R854 V857 L858 E885 L886 L951	Y567-V570 PolarHBondContact O-N 2.88Å; Y567-L571 VanDerWaalsContact O-CB 3.28Å; Y567-L571 WeakPolarHBondContact O-CB 3.35Å; Y567-L571 VanDerWaalsContact O-CG 3.26Å; Y567-L571 WeakPolarHBondContact O-CG 3.16Å; Y567-L571 PolarHBondContact O-N 2.93Å; Y567-R854 HydrophobicContact CD1-CB 4.12Å; Y567-R854 HydrophobicContact CD1-CG 4.36Å; Y567-R854 HydrophobicContact CE1-CB 3.61Å; Y567-R854 HydrophobicContact CE1-CG 3.7Å; Y567-V857 HydrophobicContact CE1-CB 4.18Å; Y567-V857 HydrophobicContact CE1-CG1 4.3Å; Y567-L858 HydrophobicContact CD1-CD1 4.36Å; Y567-L858 HydrophobicContact CD1-CD2 3.76Å; Y567-L858 HydrophobicContact CD1-CG 3.97Å; Y567-L858 HydrophobicContact CE1-CD2 4.41Å; Y567-L858 HydrophobicContact CE1-CG 4.38Å; Y567-L858 HydrophobicContact CG-CD2 4.47Å; Y567-E885 VanDerWaalsContact CA-OE1 3.29Å; Y567-E885 WeakPolarHBondContact CA-OE1 3.34Å; Y567-E885 VanDerWaalsContact CB-OE1 3.25Å; Y567-E885 WeakPolarHBondContact CB-OE1 3.28Å; Y567-E885 PolarHBondContact N-OE1 2.98Å; Y567-L886 HydrophobicContact CD1-CD1 4.07Å; Y567-L886 HydrophobicContact CD2-CD1 3.52Å; Y567-L886 HydrophobicContact CD2-CG 3.96Å; Y567-L886 HydrophobicContact CE1-CD1 3.99Å; Y567-L886 HydrophobicContact CE2-CD1 3.44Å; Y567-L886 VanDerWaalsContact CE2-CD1 3.44Å; Y567-L886 HydrophobicContact CE2-CG 4.37Å; Y567-L886 HydrophobicContact CG-CD1 3.82Å; Y567-L886 HydrophobicContact CG-CD2 4.29Å; Y567-L886 HydrophobicContact CG-CG 4.06Å; Y567-L951 WeakPolarHBondContact OH-CD1 3.5Å
568	N	94.9	Very high	92.2	Very high	9 Å²	9	39.7 Å²	39.7	5%	0.048	20%	0.201	C	C	.	.	H	α-helix	trans	-61.8	-42.9	172.9	-179.3	-82.3	0	0	0	111.7	T566 L571 N572 A877 C878 I880 E885	T566-N568 VanDerWaalsContact C-N 3.34Å; N568-L571 PolarHBondContact O-N 2.98Å; N568-N572 PolarHBondContact ND2-ND2 2.93Å; N568-N572 WeakPolarHBondContact O-CB 3.39Å; N568-N572 PolarHBondContact O-N 3.33Å; N568-N572 PolarHBondContact O-ND2 3.01Å; N568-N572 PolarHBondContact OD1-ND2 3.29Å; N568-A877 PolarHBondContact ND2-O 3.34Å; N568-C878 PolarHBondContact ND2-O 3.21Å; N568-I880 PolarHBondContact ND2-O 2.9Å; N568-E885 HydrophobicContact CB-CG 4.18Å; N568-E885 PolarHBondContact N-OE1 3.29Å
569	M	94.6	Very high	92	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-60.4	-52.8	172.2	176.7	-153	-76.2	0	0	110.5	Y237 V264 E268 F563 L565 T566 L571 N572 L573 M584	Y237-M569 WeakPolarHBondContact OH-CA 3.28Å; Y237-M569 PolarHBondContact OH-O 3.04Å; V264-M569 HydrophobicContact CG2-CE 3.38Å; E268-M569 HydrophobicContact CG-CE 4.28Å; E268-M569 HydrophobicContact CG-CG 4.48Å; E268-M569 WeakPolarHBondContact OE2-CE 3.39Å; F563-M569 HydrophobicContact CE1-CE 4.22Å; F563-M569 HydrophobicContact CE1-SD 4.45Å; F563-M569 HydrophobicContact CE2-CE 3.65Å; F563-M569 HydrophobicContact CE2-SD 4.42Å; F563-M569 HydrophobicContact CZ-CE 3.43Å; F563-M569 VanDerWaalsContact CZ-CE 3.43Å; F563-M569 HydrophobicContact CZ-SD 3.71Å; L565-M569 HydrophobicContact CD2-SD 4.03Å; T566-M569 PolarHBondContact O-N 3.37Å; T566-M569 WeakPolarHBondContact OG1-CB 3.36Å; T566-M569 PolarHBondContact OG1-N 2.93Å; M569-L571 VanDerWaalsContact C-N 3.3Å; M569-L571 PolarHBondContact O-N 3.01Å; M569-N572 PolarHBondContact O-N 3.04Å; M569-L573 HydrophobicContact CG-CD1 3.75Å; M569-L573 HydrophobicContact CG-CG 4.46Å; M569-L573 VanDerWaalsContact O-CB 3.32Å; M569-L573 WeakPolarHBondContact O-CB 3.34Å; M569-L573 VanDerWaalsContact O-CG 3.3Å; M569-L573 WeakPolarHBondContact O-CG 3.46Å; M569-L573 PolarHBondContact O-N 3.09Å; M569-L573 HydrophobicContact SD-CD1 4.39Å; M569-M584 HydrophobicContact SD-CG 4.24Å
570	V	95.8	Very high	91.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.5	-39.8	-179.2	175.6	0	0	0	0	111.4	L565 T566 Y567 L574 P581 L851 K855 L858	L565-V570 HydrophobicContact CD2-CG2 4.29Å; T566-V570 WeakPolarHBondContact O-CG2 3.19Å; T566-V570 PolarHBondContact O-N 3.22Å; T566-V570 VanDerWaalsContact O-N 3.1Å; Y567-V570 PolarHBondContact O-N 2.88Å; V570-L574 HydrophobicContact CG1-CD1 4.26Å; V570-L574 VanDerWaalsContact O-CG 3.28Å; V570-L574 WeakPolarHBondContact O-CG 3.42Å; V570-L574 PolarHBondContact O-N 3.43Å; V570-P581 HydrophobicContact CG1-CB 4.47Å; V570-P581 HydrophobicContact CG1-CG 4.05Å; V570-L851 HydrophobicContact CG1-CD1 4.03Å; V570-L851 HydrophobicContact CG2-CD1 3.72Å; V570-K855 HydrophobicContact CG1-CG 4.35Å; V570-L858 HydrophobicContact CB-CD1 4.4Å; V570-L858 HydrophobicContact CG1-CD1 3.72Å
571	L	95.6	Very high	91.8	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-70.6	-43.2	178.8	-74.9	170.8	0	0	0	112.6	Y567 N568 M569 L573 L574 R575 L858 F863 I870 A877	Y567-L571 VanDerWaalsContact O-CB 3.28Å; Y567-L571 WeakPolarHBondContact O-CB 3.35Å; Y567-L571 VanDerWaalsContact O-CG 3.26Å; Y567-L571 WeakPolarHBondContact O-CG 3.16Å; Y567-L571 PolarHBondContact O-N 2.93Å; N568-L571 PolarHBondContact O-N 2.98Å; M569-L571 VanDerWaalsContact C-N 3.3Å; M569-L571 PolarHBondContact O-N 3.01Å; L571-L573 VanDerWaalsContact C-N 3.32Å; L571-L573 PolarHBondContact O-N 3.34Å; L571-L574 CarbonylContact O-C 3.53Å; L571-L574 PolarHBondContact O-N 2.95Å; L571-L574 VanDerWaalsContact O-N 3.09Å; L571-R575 WeakPolarHBondContact O-CB 3.46Å; L571-R575 PolarHBondContact O-N 2.8Å; L571-L858 HydrophobicContact CD1-CD2 4.03Å; L571-L858 HydrophobicContact CD2-CD1 3.92Å; L571-L858 HydrophobicContact CD2-CD2 4.03Å; L571-L858 HydrophobicContact CG-CD1 4.08Å; L571-L858 HydrophobicContact CG-CD2 4.05Å; L571-F863 HydrophobicContact CD1-CD1 4.13Å; L571-F863 HydrophobicContact CD2-CB 4.08Å; L571-I870 HydrophobicContact CB-CD1 4.42Å; L571-I870 HydrophobicContact CD2-CD1 4.29Å; L571-I870 HydrophobicContact CD2-CG1 4.3Å; L571-I870 WeakPolarHBondContact O-CD1 3.34Å; L571-A877 HydrophobicContact CD1-CB 3.63Å
572	N	94.5	Very high	91.7	Very high	4 Å²	4	40.8 Å²	40.8	2%	0.021	20%	0.201	C	C	.	.	H	α-helix	trans	-65.5	-35.8	174.9	-81.3	-65.1	0	0	0	112	Y237 N568 M569 L574 R575 V576 C878	Y237-N572 HydrophobicContact CD1-CB 3.69Å; Y237-N572 HydrophobicContact CD2-CB 3.75Å; Y237-N572 HydrophobicContact CE1-CB 3.55Å; Y237-N572 HydrophobicContact CE2-CB 3.58Å; Y237-N572 HydrophobicContact CG-CB 3.78Å; Y237-N572 VanDerWaalsContact CZ-CB 3.48Å; N568-N572 PolarHBondContact ND2-ND2 2.93Å; N568-N572 WeakPolarHBondContact O-CB 3.39Å; N568-N572 PolarHBondContact O-N 3.33Å; N568-N572 PolarHBondContact O-ND2 3.01Å; N568-N572 PolarHBondContact OD1-ND2 3.29Å; M569-N572 PolarHBondContact O-N 3.04Å; N572-L574 VanDerWaalsContact C-N 3.27Å; N572-L574 PolarHBondContact O-N 3.27Å; N572-R575 WeakPolarHBondContact O-CB 3.47Å; N572-R575 PolarHBondContact O-N 3.34Å; N572-R575 PolarHBondContact OD1-NE 3.48Å; N572-R575 PolarHBondContact OD1-NH2 3.42Å; N572-R575 VanDerWaalsContact OD1-NH2 3.14Å; N572-V576 PolarHBondContact O-N 3.29Å; N572-C878 PolarHBondContact ND2-O 3.45Å; N572-C878 WeakPolarHBondContact OD1-CB 3.36Å
573	L	94.2	Very high	91.6	Very high	2 Å²	2	43.8 Å²	43.8	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-73	-12.6	171.5	-69.5	175.3	0	0	0	114.4	Y237 L272 M569 L571 I579 P581 M584	Y237-L573 HydrophobicContact CE1-CD2 3.97Å; Y237-L573 HydrophobicContact CE1-CG 4.17Å; Y237-L573 WeakPolarHBondContact OH-CG 3.06Å; L272-L573 HydrophobicContact CD2-CD2 4.36Å; M569-L573 HydrophobicContact CG-CD1 3.75Å; M569-L573 HydrophobicContact CG-CG 4.46Å; M569-L573 VanDerWaalsContact O-CB 3.32Å; M569-L573 WeakPolarHBondContact O-CB 3.34Å; M569-L573 VanDerWaalsContact O-CG 3.3Å; M569-L573 WeakPolarHBondContact O-CG 3.46Å; M569-L573 PolarHBondContact O-N 3.09Å; M569-L573 HydrophobicContact SD-CD1 4.39Å; L571-L573 VanDerWaalsContact C-N 3.32Å; L571-L573 PolarHBondContact O-N 3.34Å; L573-I579 HydrophobicContact CD2-CB 4.35Å; L573-I579 HydrophobicContact CD2-CG2 3.71Å; L573-I579 VanDerWaalsContact O-O 3.05Å; L573-P581 HydrophobicContact CB-CB 4.46Å; L573-P581 HydrophobicContact CB-CG 3.81Å; L573-M584 HydrophobicContact CD1-CB 3.56Å; L573-M584 HydrophobicContact CD1-CE 4.17Å; L573-M584 HydrophobicContact CD1-CG 3.83Å; L573-M584 HydrophobicContact CD2-CE 4.09Å
574	L	93.6	Very high	91.6	Very high	26 Å²	26	43.7 Å²	43.7	14%	0.136	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	1.5	165.8	-68.2	-178.4	0	0	0	112.7	V570 L571 N572 P581 A864 D868	V570-L574 HydrophobicContact CG1-CD1 4.26Å; V570-L574 VanDerWaalsContact O-CG 3.28Å; V570-L574 WeakPolarHBondContact O-CG 3.42Å; V570-L574 PolarHBondContact O-N 3.43Å; L571-L574 CarbonylContact O-C 3.53Å; L571-L574 PolarHBondContact O-N 2.95Å; L571-L574 VanDerWaalsContact O-N 3.09Å; N572-L574 VanDerWaalsContact C-N 3.27Å; N572-L574 PolarHBondContact O-N 3.27Å; L574-P581 HydrophobicContact CD2-CG 3.88Å; L574-P581 HydrophobicContact CG-CG 3.97Å; L574-A864 HydrophobicContact CD1-CB 4.35Å; L574-D868 HydrophobicContact CD1-CB 4.25Å; L574-D868 HydrophobicContact CD2-CB 3.84Å
575	R	91.9	Very high	91.6	Very high	62 Å²	62	40.7 Å²	40.7	23%	0.234	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101	-28.2	177	-169.4	177.8	75.7	171.6	4	112.7	Y237 L571 N572 I870 C878 E879	Y237-R575 PolarHBondContact O-NH2 2.83Å; L571-R575 WeakPolarHBondContact O-CB 3.46Å; L571-R575 PolarHBondContact O-N 2.8Å; N572-R575 WeakPolarHBondContact O-CB 3.47Å; N572-R575 PolarHBondContact O-N 3.34Å; N572-R575 PolarHBondContact OD1-NE 3.48Å; N572-R575 PolarHBondContact OD1-NH2 3.42Å; N572-R575 VanDerWaalsContact OD1-NH2 3.14Å; R575-I870 HydrophobicContact CB-CD1 4Å; R575-I870 HydrophobicContact CG-CD1 4.42Å; R575-C878 VanDerWaalsContact NH1-CB 3.35Å; R575-E879 IonicContact CZ-OE1 3.31Å; R575-E879 IonicContact NH1-OE1 2.6Å; R575-E879 PolarHBondContact NH1-OE1 3.46Å; R575-E879 IonicContact NH2-OE1 3.36Å
576	V	88.6	Confident	91.4	Very high	48 Å²	48	45.6 Å²	45.6	29%	0.291	22%	0.217	S	C	.	.	S	Bend	trans	-87.7	136.8	175.8	177.3	0	0	0	0	109.2	N572 I579	N572-V576 PolarHBondContact O-N 3.29Å; V576-I579 HydrophobicContact CG1-CB 4.38Å; V576-I579 HydrophobicContact CG1-CG1 4.35Å
577	E	78	Confident	91.4	Very high	200 Å²	200	45.6 Å²	45.6	94%	0.935	21%	0.214	S	C	*	.	S	Bend	trans	-82.2	-28.7	-173.6	-62	-172	165	0	0	113.9
578	E	80.4	Confident	91.3	Very high	188 Å²	188	44.9 Å²	44.9	88%	0.879	21%	0.212	S	C	*	.	S	Bend	trans	-90	-14	-173.2	-60.7	-173.5	153	0	0	114.3
579	I	88.1	Confident	91.4	Very high	42 Å²	42	44.4 Å²	44.4	22%	0.215	21%	0.209	C	C	.	.			trans	-130.7	143.9	-173	-50.9	176.7	0	0	0	108.2	L272 L573 V576 Y583	L272-I579 HydrophobicContact CD2-CD1 3.76Å; L573-I579 HydrophobicContact CD2-CB 4.35Å; L573-I579 HydrophobicContact CD2-CG2 3.71Å; L573-I579 VanDerWaalsContact O-O 3.05Å; V576-I579 HydrophobicContact CG1-CB 4.38Å; V576-I579 HydrophobicContact CG1-CG1 4.35Å; I579-Y583 HydrophobicContact CG2-CD1 3.69Å; I579-Y583 HydrophobicContact CG2-CE1 4.31Å; I579-Y583 HydrophobicContact CG2-CG 4.4Å
580	N	90.1	Very high	91.3	Very high	78 Å²	78	47.7 Å²	47.7	42%	0.417	22%	0.222	S	C	.	.			trans	-128	165.1	176.4	62	35.9	0	0	0	112	E582 Y583 M584	N580-E582 PolarHBondContact O-N 3.14Å; N580-E582 PolarHBondContact OD1-N 3.34Å; N580-Y583 PolarHBondContact O-N 3.3Å; N580-Y583 WeakPolarHBondContact OD1-CB 3.49Å; N580-Y583 PolarHBondContact OD1-N 2.92Å; N580-M584 PolarHBondContact O-N 3.48Å
581	P	93.4	Very high	91	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-59.3	-31.8	179	-25.5	34.9	0	0	0	114.1	V570 L573 L574 L585 L851	V570-P581 HydrophobicContact CG1-CB 4.47Å; V570-P581 HydrophobicContact CG1-CG 4.05Å; L573-P581 HydrophobicContact CB-CB 4.46Å; L573-P581 HydrophobicContact CB-CG 3.81Å; L574-P581 HydrophobicContact CD2-CG 3.88Å; L574-P581 HydrophobicContact CG-CG 3.97Å; P581-L585 PolarHBondContact O-N 2.98Å; P581-L851 HydrophobicContact CB-CD1 3.65Å; P581-L851 HydrophobicContact CB-CD2 3.82Å; P581-L851 HydrophobicContact CB-CG 4.38Å; P581-L851 HydrophobicContact CG-CD1 4.49Å
582	E	91.8	Very high	90.8	Very high	52 Å²	52	48 Å²	48	24%	0.243	22%	0.224	C	C	.	.	H	α-helix	trans	-64.2	-44.3	176.7	-72.9	78.3	179.8	0	0	112.6	N580 M584 L585 E586 M848 L851 K855	N580-E582 PolarHBondContact O-N 3.14Å; N580-E582 PolarHBondContact OD1-N 3.34Å; E582-M584 VanDerWaalsContact C-N 3.35Å; E582-M584 PolarHBondContact O-N 3.39Å; E582-L585 WeakPolarHBondContact O-CB 3.28Å; E582-L585 PolarHBondContact O-N 3.48Å; E582-E586 PolarHBondContact O-N 2.88Å; E582-M848 HydrophobicContact CB-CE 4.14Å; E582-M848 HydrophobicContact CG-CE 3.88Å; E582-M848 HydrophobicContact CG-SD 3.95Å; E582-L851 HydrophobicContact CG-CD2 3.97Å; E582-K855 IonicContact OE1-NZ 2.66Å; E582-K855 PolarHBondContact OE1-NZ 3.02Å; E582-K855 IonicContact OE2-NZ 3.98Å; E582-K855 PolarHBondContact OE2-NZ 3.25Å
583	Y	91	Very high	90.6	Very high	81 Å²	81	49 Å²	49	32%	0.318	23%	0.228	S	C	.	.	H	α-helix	trans	-60.2	-41.9	175.7	174.3	-90.6	0	0	0	112.2	I271 I579 N580 L585 E586 K587	I271-Y583 HydrophobicContact CG2-CD1 4.46Å; I271-Y583 HydrophobicContact CG2-CE1 4Å; I579-Y583 HydrophobicContact CG2-CD1 3.69Å; I579-Y583 HydrophobicContact CG2-CE1 4.31Å; I579-Y583 HydrophobicContact CG2-CG 4.4Å; N580-Y583 PolarHBondContact O-N 3.3Å; N580-Y583 WeakPolarHBondContact OD1-CB 3.49Å; N580-Y583 PolarHBondContact OD1-N 2.92Å; Y583-L585 VanDerWaalsContact C-N 3.31Å; Y583-L585 PolarHBondContact O-N 3.43Å; Y583-E586 PolarHBondContact O-N 3.19Å; Y583-K587 HydrophobicContact CD1-CG 4.38Å; Y583-K587 HydrophobicContact CD2-CG 4.31Å; Y583-K587 HydrophobicContact CE1-CG 4Å; Y583-K587 HydrophobicContact CE2-CG 3.91Å; Y583-K587 WeakPolarHBondContact O-CB 3.4Å; Y583-K587 PolarHBondContact O-N 3.33Å
584	M	93.3	Very high	90.3	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-61.2	-39.4	177.7	-175.8	62.8	63.5	0	0	111.8	E268 I271 L272 F563 M569 L573 N580 E582 S588	E268-M584 HydrophobicContact CB-SD 4.47Å; E268-M584 HydrophobicContact CG-CE 4.02Å; E268-M584 HydrophobicContact CG-SD 4.16Å; I271-M584 HydrophobicContact CB-CE 4.07Å; I271-M584 HydrophobicContact CB-SD 3.73Å; I271-M584 HydrophobicContact CD1-SD 3.59Å; I271-M584 VanDerWaalsContact CD1-SD 3.59Å; I271-M584 HydrophobicContact CG1-SD 4.28Å; I271-M584 HydrophobicContact CG2-CE 3.75Å; I271-M584 HydrophobicContact CG2-SD 3.58Å; I271-M584 VanDerWaalsContact CG2-SD 3.58Å; L272-M584 HydrophobicContact CD2-CE 3.95Å; L272-M584 HydrophobicContact CG-CE 3.92Å; F563-M584 HydrophobicContact CE2-CG 3.96Å; F563-M584 HydrophobicContact CE2-SD 4.26Å; F563-M584 HydrophobicContact CZ-CG 3.75Å; M569-M584 HydrophobicContact SD-CG 4.24Å; L573-M584 HydrophobicContact CD1-CB 3.56Å; L573-M584 HydrophobicContact CD1-CE 4.17Å; L573-M584 HydrophobicContact CD1-CG 3.83Å; L573-M584 HydrophobicContact CD2-CE 4.09Å; N580-M584 PolarHBondContact O-N 3.48Å; E582-M584 VanDerWaalsContact C-N 3.35Å; E582-M584 PolarHBondContact O-N 3.39Å; M584-S588 PolarHBondContact O-N 3.34Å
585	L	92.1	Very high	89.9	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.01	24%	0.241	C	C	.	.	H	α-helix	trans	-66	-48.4	173.7	-74.9	174.3	0	0	0	112.1	F563 L565 P581 E582 Y583 K587 S588 Q591 V845 Q847 M848 L851	F563-L585 HydrophobicContact CD1-CD2 4.42Å; F563-L585 HydrophobicContact CE1-CD2 3.74Å; L565-L585 HydrophobicContact CD2-CD2 4.02Å; L565-L585 HydrophobicContact CD2-CG 4.31Å; L565-L585 HydrophobicContact CG-CD2 4.35Å; P581-L585 PolarHBondContact O-N 2.98Å; E582-L585 WeakPolarHBondContact O-CB 3.28Å; E582-L585 PolarHBondContact O-N 3.48Å; Y583-L585 VanDerWaalsContact C-N 3.31Å; Y583-L585 PolarHBondContact O-N 3.43Å; L585-K587 PolarHBondContact O-N 2.8Å; L585-S588 WeakPolarHBondContact O-CB 3.31Å; L585-S588 PolarHBondContact O-N 2.84Å; L585-S588 PolarHBondContact O-OG 3.22Å; L585-Q591 WeakPolarHBondContact O-CB 3.08Å; L585-V845 HydrophobicContact CB-CG1 3.99Å; L585-Q847 HydrophobicContact CD2-CB 3.86Å; L585-M848 HydrophobicContact CD1-CE 4Å; L585-L851 HydrophobicContact CD1-CB 4.09Å; L585-L851 HydrophobicContact CD1-CD2 3.71Å
586	E	89.4	Confident	89.7	Confident	106 Å²	106	52.2 Å²	52.2	50%	0.495	24%	0.241	S	C	.	.	H	α-helix	trans	-63	-29.2	-180	-71.6	177.7	-174	0	0	113	E582 Y583 V845	E582-E586 PolarHBondContact O-N 2.88Å; Y583-E586 PolarHBondContact O-N 3.19Å; E586-V845 HydrophobicContact CG-CG1 4.35Å; E586-V845 HydrophobicContact CG-CG2 4.1Å
587	K	92.3	Very high	89.6	Confident	36 Å²	36	52.1 Å²	52.1	16%	0.157	25%	0.245	C	C	.	.	H	α-helix	trans	-94.8	-7.1	177.7	-72.6	-54.6	-164.1	172.1	0	115.5	I271 W295 H298 L299 Y583 L585	I271-K587 HydrophobicContact CG1-CB 4.36Å; I271-K587 HydrophobicContact CG2-CB 3.86Å; W295-K587 PolarHBondContact NE1-O 2.78Å; H298-K587 PolarHBondContact NE2-NZ 3.31Å; H298-K587 PolarHBondContact O-NZ 2.95Å; L299-K587 HydrophobicContact CD1-CB 3.82Å; L299-K587 HydrophobicContact CD1-CD 3.77Å; L299-K587 HydrophobicContact CD1-CG 3.91Å; Y583-K587 HydrophobicContact CD1-CG 4.38Å; Y583-K587 HydrophobicContact CD2-CG 4.31Å; Y583-K587 HydrophobicContact CE1-CG 4Å; Y583-K587 HydrophobicContact CE2-CG 3.91Å; Y583-K587 WeakPolarHBondContact O-CB 3.4Å; Y583-K587 PolarHBondContact O-N 3.33Å; L585-K587 PolarHBondContact O-N 2.8Å
588	S	94.6	Very high	90	Very high	3 Å²	3	43.1 Å²	43.1	2%	0.021	20%	0.203	C	C	.	.	S	Bend	trans	-55.2	147.1	178.2	66	0	0	0	0	113.2	M584 L585 Y590 Q591 F592	M584-S588 PolarHBondContact O-N 3.34Å; L585-S588 WeakPolarHBondContact O-CB 3.31Å; L585-S588 PolarHBondContact O-N 2.84Å; L585-S588 PolarHBondContact O-OG 3.22Å; S588-Y590 PolarHBondContact O-N 3.12Å; S588-Q591 PolarHBondContact O-N 3.48Å; S588-Q591 VanDerWaalsContact OG-CB 3.25Å; S588-Q591 WeakPolarHBondContact OG-CB 3.44Å; S588-Q591 PolarHBondContact OG-N 2.75Å; S588-F592 PolarHBondContact O-N 3.07Å; S588-F592 VanDerWaalsContact O-N 3.14Å
589	F	95.4	Very high	90.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-65.8	-30.9	171.2	-175.4	-128.2	0	0	0	109.9	M257 E267 Q291 F292 W295 L559 Q591 F592 Q593	M257-F589 HydrophobicContact CE-CB 4.41Å; M257-F589 HydrophobicContact CE-CD1 3.35Å; M257-F589 HydrophobicContact CE-CE1 3.77Å; M257-F589 HydrophobicContact CE-CG 4.07Å; E267-F589 HydrophobicContact CG-CB 4.14Å; E267-F589 WeakPolarHBondContact OE2-CA 3.16Å; E267-F589 VanDerWaalsContact OE2-CB 3.27Å; E267-F589 WeakPolarHBondContact OE2-CB 3.31Å; E267-F589 PolarHBondContact OE2-N 2.53Å; Q291-F589 HydrophobicContact CG-CE2 4.2Å; Q291-F589 HydrophobicContact CG-CZ 4.3Å; F292-F589 HydrophobicContact CB-CZ 4.46Å; W295-F589 HydrophobicContact CB-CD2 3.59Å; W295-F589 HydrophobicContact CB-CE2 3.88Å; W295-F589 HydrophobicContact CD2-CB 3.79Å; W295-F589 AromaticContact CD2-CD2 3.64Å; W295-F589 HydrophobicContact CD2-CD2 3.64Å; W295-F589 HydrophobicContact CD2-CG 4.04Å; W295-F589 HydrophobicContact CE3-CB 4.07Å; W295-F589 AromaticContact CE3-CD2 3.92Å; W295-F589 HydrophobicContact CE3-CD2 3.92Å; W295-F589 HydrophobicContact CE3-CG 4.14Å; W295-F589 HydrophobicContact CG-CB 4.3Å; W295-F589 AromaticContact CG-CD2 3.5Å; W295-F589 HydrophobicContact CG-CD2 3.5Å; W295-F589 VanDerWaalsContact CG-CD2 3.5Å; W295-F589 HydrophobicContact CG-CE2 4.28Å; W295-F589 HydrophobicContact CG-CG 4.32Å; W295-F589 HydrophobicContact CH2-CB 4.2Å; W295-F589 HydrophobicContact CZ2-CB 3.92Å; W295-F589 HydrophobicContact CZ3-CB 4.27Å; L559-F589 WeakPolarHBondContact O-CE1 3.4Å; F589-Q591 PolarHBondContact O-N 3.06Å; F589-F592 HydrophobicContact CD2-CB 4.41Å; F589-F592 HydrophobicContact CD2-CD1 4.11Å; F589-F592 HydrophobicContact CE2-CD1 4.06Å; F589-F592 PolarHBondContact O-N 3.14Å; F589-Q593 HydrophobicContact CD1-CG 3.99Å; F589-Q593 HydrophobicContact CD2-CG 4.03Å; F589-Q593 VanDerWaalsContact CE1-CD 3.44Å; F589-Q593 HydrophobicContact CE1-CG 3.69Å; F589-Q593 HydrophobicContact CE2-CG 3.73Å; F589-Q593 HydrophobicContact CG-CG 4.17Å; F589-Q593 HydrophobicContact CZ-CG 3.57Å; F589-Q593 WeakPolarHBondContact O-CB 3.29Å; F589-Q593 WeakPolarHBondContact O-CG 3.45Å; F589-Q593 PolarHBondContact O-N 2.72Å
590	Y	92.8	Very high	90.2	Very high	70 Å²	70	37.2 Å²	37.2	28%	0.275	19%	0.192	S	C	.	.	H	α-helix	trans	-49.2	-58.3	170	-163.1	-98.7	0	0	0	112.3	E267 S561 S588 F592 Q593 H594 L846	E267-Y590 PolarHBondContact OE2-N 2.91Å; S561-Y590 VanDerWaalsContact CB-N 3.34Å; S561-Y590 WeakPolarHBondContact OG-CA 3.16Å; S561-Y590 VanDerWaalsContact OG-CB 3.28Å; S561-Y590 WeakPolarHBondContact OG-CB 3.17Å; S561-Y590 PolarHBondContact OG-N 3.24Å; S588-Y590 PolarHBondContact O-N 3.12Å; Y590-F592 VanDerWaalsContact C-N 3.32Å; Y590-F592 PolarHBondContact O-N 3.38Å; Y590-Q593 PolarHBondContact O-N 3.13Å; Y590-H594 AromaticContact CD1-CD2 3.69Å; Y590-H594 AromaticContact CE1-CD2 3.48Å; Y590-H594 VanDerWaalsContact CE1-CD2 3.48Å; Y590-H594 WeakPolarHBondContact CE1-CD2 3.39Å; Y590-H594 AromaticContact CE1-NE2 3.37Å; Y590-H594 WeakPolarHBondContact CE1-NE2 3.45Å; Y590-H594 AromaticContact CE2-NE2 3.94Å; Y590-H594 AromaticContact CZ-CD2 3.86Å; Y590-H594 AromaticContact CZ-NE2 3.31Å; Y590-H594 VanDerWaalsContact CZ-NE2 3.31Å; Y590-H594 PolarHBondContact O-CD2 3.3Å; Y590-H594 VanDerWaalsContact O-CD2 3.24Å; Y590-H594 PolarHBondContact O-N 2.81Å; Y590-H594 PolarHBondContact OH-NE2 3Å; Y590-L846 HydrophobicContact CD1-CB 4.39Å; Y590-L846 HydrophobicContact CD1-CD1 4.43Å; Y590-L846 HydrophobicContact CE1-CB 3.95Å; Y590-L846 HydrophobicContact CE1-CD1 3.79Å
591	Q	89.9	Confident	90	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-66.5	-36.1	-177.3	-170.5	57	61.7	0	0	111.7	L585 S588 F589 H594 Y595	L585-Q591 WeakPolarHBondContact O-CB 3.08Å; S588-Q591 PolarHBondContact O-N 3.48Å; S588-Q591 VanDerWaalsContact OG-CB 3.25Å; S588-Q591 WeakPolarHBondContact OG-CB 3.44Å; S588-Q591 PolarHBondContact OG-N 2.75Å; F589-Q591 PolarHBondContact O-N 3.06Å; Q591-H594 PolarHBondContact O-N 2.7Å; Q591-Y595 HydrophobicContact CG-CD2 4.12Å; Q591-Y595 HydrophobicContact CG-CE2 3.57Å; Q591-Y595 WeakPolarHBondContact O-CD2 3.29Å; Q591-Y595 PolarHBondContact O-N 2.88Å
592	F	91.6	Very high	89.7	Confident	6 Å²	6	37.1 Å²	37.1	3%	0.026	19%	0.194	C	C	.	.	H	α-helix	trans	-61.6	-46.4	172.8	-177	-82.2	0	0	0	112.7	P97 Q291 E294 W295 H298 S588 F589 Y590 H594 Y595 R596	P97-F592 HydrophobicContact CB-CD2 4.17Å; P97-F592 HydrophobicContact CB-CE2 3.48Å; P97-F592 VanDerWaalsContact CB-CE2 3.48Å; P97-F592 HydrophobicContact CB-CZ 4.15Å; P97-F592 HydrophobicContact CG-CD2 3.7Å; P97-F592 HydrophobicContact CG-CE2 3.41Å; P97-F592 VanDerWaalsContact CG-CE2 3.41Å; P97-F592 HydrophobicContact CG-CZ 4.06Å; Q291-F592 HydrophobicContact CG-CD1 4.47Å; Q291-F592 HydrophobicContact CG-CE1 4.03Å; Q291-F592 WeakPolarHBondContact O-CE1 3.19Å; E294-F592 HydrophobicContact CB-CE1 4.27Å; E294-F592 HydrophobicContact CB-CZ 3.65Å; W295-F592 HydrophobicContact CB-CD1 3.8Å; W295-F592 HydrophobicContact CB-CD2 4.02Å; W295-F592 HydrophobicContact CB-CE1 3.94Å; W295-F592 HydrophobicContact CB-CE2 4.13Å; W295-F592 HydrophobicContact CB-CG 3.86Å; W295-F592 HydrophobicContact CB-CZ 4.13Å; W295-F592 AromaticContact CD1-CD2 3.88Å; W295-F592 AromaticContact CD1-CG 3.78Å; W295-F592 HydrophobicContact CG-CB 4.35Å; W295-F592 HydrophobicContact CG-CD1 4.45Å; W295-F592 HydrophobicContact CG-CD2 4.37Å; W295-F592 HydrophobicContact CG-CG 4.15Å; H298-F592 HydrophobicContact CB-CD2 4.35Å; H298-F592 HydrophobicContact CB-CE2 3.88Å; S588-F592 PolarHBondContact O-N 3.07Å; S588-F592 VanDerWaalsContact O-N 3.14Å; F589-F592 HydrophobicContact CD2-CB 4.41Å; F589-F592 HydrophobicContact CD2-CD1 4.11Å; F589-F592 HydrophobicContact CE2-CD1 4.06Å; F589-F592 PolarHBondContact O-N 3.14Å; Y590-F592 VanDerWaalsContact C-N 3.32Å; Y590-F592 PolarHBondContact O-N 3.38Å; F592-H594 VanDerWaalsContact C-N 3.34Å; F592-H594 PolarHBondContact O-N 3Å; F592-Y595 PolarHBondContact O-N 3.45Å; F592-R596 HydrophobicContact CD1-CG 4.27Å; F592-R596 HydrophobicContact CE1-CG 3.72Å; F592-R596 HydrophobicContact CZ-CG 4.06Å; F592-R596 PolarHBondContact O-N 3.33Å
593	Q	91.1	Very high	89.6	Confident	24 Å²	24	40.2 Å²	40.2	11%	0.112	21%	0.209	C	C	.	.	H	α-helix	trans	-61.9	-42.3	177.4	-73	-159.5	-66.4	0	0	111.1	L559 N560 F589 Y590 R596 A597	L559-Q593 PolarHBondContact O-NE2 2.9Å; N560-Q593 PolarHBondContact OD1-NE2 3.38Å; F589-Q593 HydrophobicContact CD1-CG 3.99Å; F589-Q593 HydrophobicContact CD2-CG 4.03Å; F589-Q593 VanDerWaalsContact CE1-CD 3.44Å; F589-Q593 HydrophobicContact CE1-CG 3.69Å; F589-Q593 HydrophobicContact CE2-CG 3.73Å; F589-Q593 HydrophobicContact CG-CG 4.17Å; F589-Q593 HydrophobicContact CZ-CG 3.57Å; F589-Q593 WeakPolarHBondContact O-CB 3.29Å; F589-Q593 WeakPolarHBondContact O-CG 3.45Å; F589-Q593 PolarHBondContact O-N 2.72Å; Y590-Q593 PolarHBondContact O-N 3.13Å; Q593-R596 PolarHBondContact O-N 2.82Å; Q593-A597 WeakPolarHBondContact O-CB 3.3Å; Q593-A597 PolarHBondContact O-N 3.34Å
594	H	86.6	Confident	89.4	Confident	60 Å²	60	41.3 Å²	41.3	28%	0.278	22%	0.215	S	C	.	.	H	α-helix	trans	-62.7	-45.4	175.4	-83.2	-77.2	0	0	0	112.4	Y590 Q591 F592 R596 A597 I598 L846	Y590-H594 AromaticContact CD1-CD2 3.69Å; Y590-H594 AromaticContact CE1-CD2 3.48Å; Y590-H594 VanDerWaalsContact CE1-CD2 3.48Å; Y590-H594 WeakPolarHBondContact CE1-CD2 3.39Å; Y590-H594 AromaticContact CE1-NE2 3.37Å; Y590-H594 WeakPolarHBondContact CE1-NE2 3.45Å; Y590-H594 AromaticContact CE2-NE2 3.94Å; Y590-H594 AromaticContact CZ-CD2 3.86Å; Y590-H594 AromaticContact CZ-NE2 3.31Å; Y590-H594 VanDerWaalsContact CZ-NE2 3.31Å; Y590-H594 PolarHBondContact O-CD2 3.3Å; Y590-H594 VanDerWaalsContact O-CD2 3.24Å; Y590-H594 PolarHBondContact O-N 2.81Å; Y590-H594 PolarHBondContact OH-NE2 3Å; Q591-H594 PolarHBondContact O-N 2.7Å; F592-H594 VanDerWaalsContact C-N 3.34Å; F592-H594 PolarHBondContact O-N 3Å; H594-R596 VanDerWaalsContact C-N 3.35Å; H594-R596 PolarHBondContact O-N 2.92Å; H594-A597 PolarHBondContact O-N 3.43Å; H594-A597 VanDerWaalsContact O-N 3.09Å; H594-I598 PolarHBondContact O-N 2.86Å; H594-L846 HydrophobicContact CB-CD1 3.97Å; H594-L846 WeakPolarHBondContact CD2-CD1 3.4Å; H594-L846 WeakPolarHBondContact NE2-CD1 3.36Å
595	Y	86.1	Confident	89.2	Confident	33 Å²	33	41.8 Å²	41.8	13%	0.129	22%	0.218	C	C	.	.	H	α-helix	trans	-61.7	-39.7	174.8	-68.6	-36	0	0	0	112.7	L95 Q591 F592 A597 I598	L95-Y595 HydrophobicContact CD2-CE1 4.45Å; Q591-Y595 HydrophobicContact CG-CD2 4.12Å; Q591-Y595 HydrophobicContact CG-CE2 3.57Å; Q591-Y595 WeakPolarHBondContact O-CD2 3.29Å; Q591-Y595 PolarHBondContact O-N 2.88Å; F592-Y595 PolarHBondContact O-N 3.45Å; Y595-A597 VanDerWaalsContact C-N 3.3Å; Y595-A597 PolarHBondContact O-N 3.47Å; Y595-I598 HydrophobicContact CD1-CD1 4.08Å
596	R	86.5	Confident	89.2	Confident	64 Å²	64	47.8 Å²	47.8	24%	0.242	24%	0.244	C	C	.	.	H	α-helix	trans	-69.4	-22.6	173.6	-81.1	-61.6	-158.3	-139	4.4	113.7	P97 E294 F592 Q593 H594	P97-R596 PolarHBondContact O-NH1 3.18Å; E294-R596 IonicContact OE2-CZ 2.66Å; E294-R596 IonicContact OE2-NE 2.87Å; E294-R596 PolarHBondContact OE2-NE 2.8Å; E294-R596 IonicContact OE2-NH2 3.73Å; E294-R596 PolarHBondContact OE2-NH2 2.85Å; F592-R596 HydrophobicContact CD1-CG 4.27Å; F592-R596 HydrophobicContact CE1-CG 3.72Å; F592-R596 HydrophobicContact CZ-CG 4.06Å; F592-R596 PolarHBondContact O-N 3.33Å; Q593-R596 PolarHBondContact O-N 2.82Å; H594-R596 VanDerWaalsContact C-N 3.35Å; H594-R596 PolarHBondContact O-N 2.92Å
597	A	86.5	Confident	89.3	Confident	46 Å²	46	45.8 Å²	45.8	38%	0.38	24%	0.237	S	C	.	.	H	α-helix	trans	-80.3	-25.8	177.3	0	0	0	0	0	114	Q593 H594 Y595 G600 V601	Q593-A597 WeakPolarHBondContact O-CB 3.3Å; Q593-A597 PolarHBondContact O-N 3.34Å; H594-A597 PolarHBondContact O-N 3.43Å; H594-A597 VanDerWaalsContact O-N 3.09Å; Y595-A597 VanDerWaalsContact C-N 3.3Å; Y595-A597 PolarHBondContact O-N 3.47Å; A597-G600 PolarHBondContact O-N 3.23Å; A597-V601 PolarHBondContact O-N 3.17Å; A597-V601 VanDerWaalsContact O-N 3.12Å
598	I	86.1	Confident	89.2	Confident	11 Å²	11	45 Å²	45	6%	0.056	24%	0.236	C	C	.	.	H	α-helix	trans	-47.8	-48.9	-176.1	-73.6	169.6	0	0	0	113.7	L92 H594 Y595 G600 V601 V602 L839 A842	L92-I598 HydrophobicContact CD2-CG2 4.11Å; H594-I598 PolarHBondContact O-N 2.86Å; Y595-I598 HydrophobicContact CD1-CD1 4.08Å; I598-G600 VanDerWaalsContact C-N 3.3Å; I598-G600 PolarHBondContact O-N 2.87Å; I598-V601 PolarHBondContact O-N 3.46Å; I598-V601 VanDerWaalsContact O-N 3.09Å; I598-V602 HydrophobicContact CG2-CG2 4.29Å; I598-V602 WeakPolarHBondContact O-CG2 3.31Å; I598-V602 PolarHBondContact O-N 3.04Å; I598-L839 HydrophobicContact CG2-CD1 3.89Å; I598-A842 HydrophobicContact CD1-CB 3.91Å; I598-A842 HydrophobicContact CG1-CB 3.62Å
599	P	86.8	Confident	89	Confident	63 Å²	63	47.5 Å²	47.5	41%	0.409	25%	0.247	S	C	.	.	H	α-helix	trans	-59.3	-38.8	-179.4	-25.4	36	0	0	0	113.2	M96 V602 E603	M96-P599 HydrophobicContact CE-CG 4.36Å; P599-V602 PolarHBondContact O-N 3.18Å; P599-E603 PolarHBondContact O-N 3.29Å
600	G	87.1	Confident	88.8	Confident	44 Å²	44	51.4 Å²	51.4	45%	0.454	27%	0.265	S	S	.	.	H	α-helix	trans	-69.2	-33.5	176	0	0	0	0	0	113.1	A597 I598 K604	A597-G600 PolarHBondContact O-N 3.23Å; I598-G600 VanDerWaalsContact C-N 3.3Å; I598-G600 PolarHBondContact O-N 2.87Å; G600-K604 WeakPolarHBondContact O-CB 3.47Å; G600-K604 PolarHBondContact O-N 3.4Å
601	V	86.1	Confident	88.7	Confident	13 Å²	13	53 Å²	53	8%	0.079	28%	0.276	C	S	.	.	H	α-helix	trans	-68.3	-40.6	172.4	-179.8	0	0	0	0	110.9	A597 I598 K604 V605 E838 L839	A597-V601 PolarHBondContact O-N 3.17Å; A597-V601 VanDerWaalsContact O-N 3.12Å; I598-V601 PolarHBondContact O-N 3.46Å; I598-V601 VanDerWaalsContact O-N 3.09Å; V601-K604 PolarHBondContact O-N 3.01Å; V601-V605 WeakPolarHBondContact O-CG2 3.37Å; V601-V605 PolarHBondContact O-N 2.82Å; V601-E838 HydrophobicContact CG1-CB 4.46Å; V601-E838 HydrophobicContact CG1-CG 4.25Å; V601-E838 HydrophobicContact CG2-CG 4.35Å; V601-L839 HydrophobicContact CG1-CB 4.11Å
602	V	87.7	Confident	88.7	Confident	63 Å²	63	54.9 Å²	54.9	38%	0.382	28%	0.283	S	S	.	.	H	α-helix	trans	-62.6	-44.8	174.6	173.4	0	0	0	0	111.1	I598 P599 V605 K606 L839	I598-V602 HydrophobicContact CG2-CG2 4.29Å; I598-V602 WeakPolarHBondContact O-CG2 3.31Å; I598-V602 PolarHBondContact O-N 3.04Å; P599-V602 PolarHBondContact O-N 3.18Å; V602-V605 PolarHBondContact O-N 2.93Å; V602-K606 PolarHBondContact O-N 3.19Å; V602-L839 HydrophobicContact CG2-CD1 3.74Å; V602-L839 HydrophobicContact CG2-CD2 4.02Å
603	E	88.7	Confident	88.6	Confident	117 Å²	117	60.3 Å²	60.3	55%	0.547	31%	0.312	S	S	.	.	H	α-helix	trans	-64.1	-43.4	176.1	-156.4	-157.1	136.9	0	0	111.8	P599 V605 K606 N607	P599-E603 PolarHBondContact O-N 3.29Å; E603-V605 PolarHBondContact O-N 2.8Å; E603-K606 PolarHBondContact O-N 2.87Å; E603-N607 WeakPolarHBondContact O-CB 3.31Å; E603-N607 VanDerWaalsContact O-CG 3.23Å; E603-N607 PolarHBondContact O-N 2.84Å; E603-N607 PolarHBondContact O-ND2 3.08Å; E603-N607 PolarHBondContact OE1-ND2 3.33Å
604	K	87.8	Confident	88.7	Confident	104 Å²	104	65.7 Å²	65.7	45%	0.452	34%	0.335	S	S	.	.	H	α-helix	trans	-57.9	-44.2	174	177.1	-175.5	172.5	-163.5	0	112	G600 V601 N607 S608 E838	G600-K604 WeakPolarHBondContact O-CB 3.47Å; G600-K604 PolarHBondContact O-N 3.4Å; V601-K604 PolarHBondContact O-N 3.01Å; K604-N607 PolarHBondContact O-N 2.96Å; K604-S608 WeakPolarHBondContact O-CB 3.35Å; K604-S608 PolarHBondContact O-N 3.27Å; K604-S608 PolarHBondContact O-OG 3.45Å; K604-E838 IonicContact NZ-OE2 3.11Å; K604-E838 PolarHBondContact NZ-OE2 3.24Å
605	V	88.8	Confident	88.8	Confident	11 Å²	11	64.4 Å²	64.4	7%	0.067	33%	0.33	C	S	.	.	H	α-helix	trans	-58.9	-49.8	174.6	167.4	0	0	0	0	110.6	V601 V602 E603 N607 S608 E609 A835 K836	V601-V605 WeakPolarHBondContact O-CG2 3.37Å; V601-V605 PolarHBondContact O-N 2.82Å; V602-V605 PolarHBondContact O-N 2.93Å; E603-V605 PolarHBondContact O-N 2.8Å; V605-N607 PolarHBondContact O-N 3.33Å; V605-S608 PolarHBondContact O-N 2.85Å; V605-E609 HydrophobicContact CG1-CG 4.5Å; V605-E609 WeakPolarHBondContact O-CB 3.31Å; V605-E609 WeakPolarHBondContact O-CG 3.37Å; V605-E609 PolarHBondContact O-N 3.44Å; V605-A835 HydrophobicContact CG2-CB 3.57Å; V605-K836 HydrophobicContact CG1-CD 4.42Å; V605-K836 VanDerWaalsContact CG1-CE 3.41Å; V605-K836 HydrophobicContact CG1-CG 4.08Å; V605-K836 HydrophobicContact CG2-CG 4.09Å
606	K	90.7	Very high	88.8	Confident	129 Å²	129	68.6 Å²	68.6	56%	0.561	36%	0.359	S	S	*	.	H	α-helix	trans	-60.5	-46.2	178.9	-177.4	-176.2	175.1	-172.7	0	112.1	V602 E603 E609 E610	V602-K606 PolarHBondContact O-N 3.19Å; E603-K606 PolarHBondContact O-N 2.87Å; K606-E609 PolarHBondContact O-N 2.88Å; K606-E610 PolarHBondContact O-N 3.39Å
607	N	91.3	Very high	88.7	Confident	63 Å²	63	66 Å²	66	34%	0.337	35%	0.349	S	S	.	.	H	α-helix	trans	-64.9	-39.4	179.7	-71	-20.9	0	0	0	111.7	E603 K604 V605 E610 Q611	E603-N607 WeakPolarHBondContact O-CB 3.31Å; E603-N607 VanDerWaalsContact O-CG 3.23Å; E603-N607 PolarHBondContact O-N 2.84Å; E603-N607 PolarHBondContact O-ND2 3.08Å; E603-N607 PolarHBondContact OE1-ND2 3.33Å; K604-N607 PolarHBondContact O-N 2.96Å; V605-N607 PolarHBondContact O-N 3.33Å; N607-E610 PolarHBondContact O-N 3.46Å; N607-Q611 WeakPolarHBondContact O-CG 3.45Å; N607-Q611 PolarHBondContact O-N 2.96Å
608	S	90.7	Very high	88.3	Confident	21 Å²	21	67.9 Å²	67.9	15%	0.147	36%	0.358	C	S	.	.	H	α-helix	trans	-70.3	-38.1	173.7	-68.6	0	0	0	0	112.8	K604 V605 E610 Q611 Y612 I828	K604-S608 WeakPolarHBondContact O-CB 3.35Å; K604-S608 PolarHBondContact O-N 3.27Å; K604-S608 PolarHBondContact O-OG 3.45Å; V605-S608 PolarHBondContact O-N 2.85Å; S608-E610 VanDerWaalsContact C-N 3.34Å; S608-Q611 PolarHBondContact O-N 3.19Å; S608-Y612 WeakPolarHBondContact O-CB 3.48Å; S608-Y612 PolarHBondContact O-N 2.99Å; S608-I828 WeakPolarHBondContact O-CG2 3.31Å
609	E	90.4	Very high	88	Confident	54 Å²	54	73.9 Å²	73.9	25%	0.252	39%	0.39	S	S	.	.	H	α-helix	trans	-63.6	-39.2	173	-76.8	-173.9	150.3	0	0	111.7	V605 K606 Y612 N613 I832 K836	V605-E609 HydrophobicContact CG1-CG 4.5Å; V605-E609 WeakPolarHBondContact O-CB 3.31Å; V605-E609 WeakPolarHBondContact O-CG 3.37Å; V605-E609 PolarHBondContact O-N 3.44Å; K606-E609 PolarHBondContact O-N 2.88Å; E609-Y612 PolarHBondContact O-N 3.18Å; E609-N613 WeakPolarHBondContact O-CB 3.39Å; E609-N613 VanDerWaalsContact O-CG 3.28Å; E609-N613 PolarHBondContact O-N 2.98Å; E609-N613 PolarHBondContact O-ND2 2.65Å; E609-I832 HydrophobicContact CG-CD1 3.89Å; E609-I832 HydrophobicContact CG-CG1 4.23Å; E609-I832 HydrophobicContact CG-CG2 4.15Å; E609-K836 VanDerWaalsContact OE1-CE 3.28Å; E609-K836 WeakPolarHBondContact OE1-CE 3.25Å; E609-K836 IonicContact OE1-NZ 3.3Å; E609-K836 PolarHBondContact OE1-NZ 2.64Å
610	E	91.9	Very high	87.8	Confident	82 Å²	82	73.1 Å²	73.1	38%	0.383	38%	0.381	S	S	.	.	H	α-helix	trans	-60.6	-44.5	169.6	-83.6	-164.9	-148.2	0	0	112.4	K606 N607 S608 N613 K614	K606-E610 PolarHBondContact O-N 3.39Å; N607-E610 PolarHBondContact O-N 3.46Å; S608-E610 VanDerWaalsContact C-N 3.34Å; E610-N613 PolarHBondContact O-N 2.71Å; E610-K614 WeakPolarHBondContact O-CB 3.49Å; E610-K614 VanDerWaalsContact O-CD 3.29Å; E610-K614 WeakPolarHBondContact O-CD 3.47Å; E610-K614 WeakPolarHBondContact O-CG 3.3Å; E610-K614 PolarHBondContact O-N 2.73Å; E610-K614 IonicContact OE2-NZ 3.7Å; E610-K614 PolarHBondContact OE2-NZ 2.67Å
611	Q	90.3	Very high	87.6	Confident	105 Å²	105	78.7 Å²	78.7	49%	0.491	40%	0.395	S	S	.	.	H	α-helix	trans	-63.6	-41.8	176.7	-72.7	-179.4	11.9	0	0	112.3	N607 S608 N613 K614 I615 I828	N607-Q611 WeakPolarHBondContact O-CG 3.45Å; N607-Q611 PolarHBondContact O-N 2.96Å; S608-Q611 PolarHBondContact O-N 3.19Å; Q611-N613 VanDerWaalsContact C-N 3.33Å; Q611-N613 PolarHBondContact O-N 3.35Å; Q611-K614 PolarHBondContact O-N 3.16Å; Q611-I615 PolarHBondContact O-N 3.32Å; Q611-I828 HydrophobicContact CB-CD1 4.32Å
612	Y	90.8	Very high	87.6	Confident	40 Å²	40	80 Å²	80	16%	0.157	41%	0.405	C	S	.	.	H	α-helix	trans	-58.9	-43.8	175	-175.9	-93.4	0	0	0	112	S608 E609 I615 K825 I828 A829 I832	S608-Y612 WeakPolarHBondContact O-CB 3.48Å; S608-Y612 PolarHBondContact O-N 2.99Å; E609-Y612 PolarHBondContact O-N 3.18Å; Y612-I615 PolarHBondContact O-N 3Å; Y612-K825 HydrophobicContact CD2-CG 3.69Å; Y612-K825 HydrophobicContact CE2-CD 4.16Å; Y612-K825 HydrophobicContact CE2-CG 3.38Å; Y612-K825 WeakPolarHBondContact CE2-O 3.37Å; Y612-I828 HydrophobicContact CD2-CG2 4.4Å; Y612-A829 HydrophobicContact CD2-CB 4.29Å; Y612-A829 HydrophobicContact CE2-CB 3.85Å; Y612-I832 HydrophobicContact CG-CD1 4.37Å
613	N	89.6	Confident	87.6	Confident	119 Å²	119	77 Å²	77	64%	0.636	39%	0.386	S	S	*	.	H	α-helix	trans	-72.5	-25.4	178.3	-70.9	-43.9	0	0	0	113.3	E609 E610 Q611 I615	E609-N613 WeakPolarHBondContact O-CB 3.39Å; E609-N613 VanDerWaalsContact O-CG 3.28Å; E609-N613 PolarHBondContact O-N 2.98Å; E609-N613 PolarHBondContact O-ND2 2.65Å; E610-N613 PolarHBondContact O-N 2.71Å; Q611-N613 VanDerWaalsContact C-N 3.33Å; Q611-N613 PolarHBondContact O-N 3.35Å; N613-I615 VanDerWaalsContact C-N 3.33Å
614	K	92.5	Very high	87.6	Confident	137 Å²	137	72 Å²	72	60%	0.596	36%	0.364	S	S	*	.	H	α-helix	trans	-73.5	-21.2	174.2	-73	159.7	-167.2	170.4	0	112.8	E610 Q611 V616	E610-K614 WeakPolarHBondContact O-CB 3.49Å; E610-K614 VanDerWaalsContact O-CD 3.29Å; E610-K614 WeakPolarHBondContact O-CD 3.47Å; E610-K614 WeakPolarHBondContact O-CG 3.3Å; E610-K614 PolarHBondContact O-N 2.73Å; E610-K614 IonicContact OE2-NZ 3.7Å; E610-K614 PolarHBondContact OE2-NZ 2.67Å; Q611-K614 PolarHBondContact O-N 3.16Å; K614-V616 PolarHBondContact O-N 2.64Å
615	I	89.1	Confident	87.7	Confident	33 Å²	33	71.2 Å²	71.2	17%	0.169	36%	0.364	C	S	.	.			trans	-88.9	95.1	177.1	-58.3	170.4	0	0	0	110.5	Q611 Y612 N613 I617 L821 K824 K825 I828	Q611-I615 PolarHBondContact O-N 3.32Å; Y612-I615 PolarHBondContact O-N 3Å; N613-I615 VanDerWaalsContact C-N 3.33Å; I615-I617 HydrophobicContact CG2-CD1 4.39Å; I615-I617 HydrophobicContact CG2-CG1 4.01Å; I615-L821 HydrophobicContact CG2-CD2 4.44Å; I615-K824 HydrophobicContact CD1-CB 4.49Å; I615-K825 HydrophobicContact CB-CD 4.34Å; I615-K825 HydrophobicContact CG2-CB 4.23Å; I615-K825 HydrophobicContact CG2-CD 4.14Å; I615-K825 WeakPolarHBondContact O-CE 3.4Å; I615-K825 PolarHBondContact O-NZ 2.83Å; I615-I828 HydrophobicContact CD1-CD1 3.58Å
616	V	85.4	Confident	87.7	Confident	122 Å²	122	70.9 Å²	70.9	74%	0.739	36%	0.362	S	S	*	.			trans	-89.4	126.9	170.8	-176.2	0	0	0	0	109.4	K614	K614-V616 PolarHBondContact O-N 2.64Å
617	I	85	Confident	87.6	Confident	8 Å²	8	65.6 Å²	65.6	4%	0.041	34%	0.338	C	S	.	.			trans	-112.6	124.8	-178.8	-56.5	-178.3	0	0	0	109.3	I615 N619 E620 V623 V818 L821 C822 K825	I615-I617 HydrophobicContact CG2-CD1 4.39Å; I615-I617 HydrophobicContact CG2-CG1 4.01Å; I617-N619 PolarHBondContact O-N 3.28Å; I617-E620 HydrophobicContact CB-CB 3.99Å; I617-E620 HydrophobicContact CB-CG 4.03Å; I617-E620 HydrophobicContact CD1-CG 4.36Å; I617-E620 HydrophobicContact CG2-CB 4.35Å; I617-E620 PolarHBondContact O-N 3.01Å; I617-V623 HydrophobicContact CG2-CB 4.22Å; I617-V623 HydrophobicContact CG2-CG1 4.39Å; I617-V623 HydrophobicContact CG2-CG2 3.76Å; I617-V818 HydrophobicContact CG2-CG1 4.21Å; I617-L821 HydrophobicContact CD1-CB 4.41Å; I617-L821 HydrophobicContact CG1-CB 4.33Å; I617-C822 HydrophobicContact CD1-CB 4.1Å; I617-K825 HydrophobicContact CD1-CB 4.07Å; I617-K825 HydrophobicContact CD1-CD 3.64Å; I617-K825 HydrophobicContact CD1-CG 4.47Å; I617-K825 HydrophobicContact CG1-CD 4.15Å
618	P	78.2	Confident	87.6	Confident	86 Å²	86	66.5 Å²	66.5	56%	0.558	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	130.8	171.8	-22.9	34	0	0	0	111	E620 V623	P618-E620 PolarHBondContact O-N 3.12Å; P618-V623 WeakPolarHBondContact O-CG2 3.41Å
619	N	79.5	Confident	87.6	Confident	138 Å²	138	66.3 Å²	66.3	74%	0.738	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	36.6	-179.6	-58.3	-19.4	0	0	0	114.4	I617 E621 S622 V623	I617-N619 PolarHBondContact O-N 3.28Å; N619-E621 PolarHBondContact O-N 3.23Å; N619-S622 PolarHBondContact O-N 2.98Å; N619-V623 PolarHBondContact O-N 2.88Å
620	E	81.5	Confident	87.6	Confident	46 Å²	46	68.5 Å²	68.5	22%	0.215	34%	0.342	C	S	.	.	H	α-helix	trans	-40.5	-42.9	-169.9	-171.7	164.7	161.1	0	0	115.3	I617 P618 S622 V623 V624 K825	I617-E620 HydrophobicContact CB-CB 3.99Å; I617-E620 HydrophobicContact CB-CG 4.03Å; I617-E620 HydrophobicContact CD1-CG 4.36Å; I617-E620 HydrophobicContact CG2-CB 4.35Å; I617-E620 PolarHBondContact O-N 3.01Å; P618-E620 PolarHBondContact O-N 3.12Å; E620-S622 PolarHBondContact O-N 3.39Å; E620-V623 WeakPolarHBondContact O-CB 3.24Å; E620-V623 PolarHBondContact O-N 3.39Å; E620-V624 HydrophobicContact CG-CG2 4.17Å; E620-V624 WeakPolarHBondContact O-CB 3.36Å; E620-V624 VanDerWaalsContact O-CG2 3.28Å; E620-V624 WeakPolarHBondContact O-CG2 3.33Å; E620-V624 PolarHBondContact O-N 3.11Å; E620-K825 WeakPolarHBondContact OE1-CE 3.28Å; E620-K825 IonicContact OE1-NZ 3.49Å; E620-K825 PolarHBondContact OE1-NZ 2.78Å; E620-K825 IonicContact OE2-NZ 2.9Å; E620-K825 PolarHBondContact OE2-NZ 3.3Å
621	E	83.2	Confident	87.5	Confident	162 Å²	162	68.6 Å²	68.6	76%	0.757	34%	0.343	S	S	*	.	H	α-helix	trans	-58.7	-43.8	179.3	-174.8	167.9	-150.4	0	0	113.3	N619 V624 I625	N619-E621 PolarHBondContact O-N 3.23Å; E621-V624 PolarHBondContact O-N 3.38Å; E621-I625 HydrophobicContact CG-CD1 4.39Å; E621-I625 WeakPolarHBondContact O-CD1 3.46Å; E621-I625 VanDerWaalsContact O-CG1 3.3Å; E621-I625 WeakPolarHBondContact O-CG1 3.39Å; E621-I625 PolarHBondContact O-N 2.59Å
622	S	86.9	Confident	87.5	Confident	39 Å²	39	66.6 Å²	66.6	27%	0.273	33%	0.333	S	S	.	.	H	α-helix	trans	-69.6	-36.4	176.4	176.5	0	0	0	0	111.7	N619 E620 I625 Y626 H807	N619-S622 PolarHBondContact O-N 2.98Å; E620-S622 PolarHBondContact O-N 3.39Å; S622-I625 PolarHBondContact O-N 3.06Å; S622-Y626 PolarHBondContact O-N 3.1Å; S622-Y626 VanDerWaalsContact O-N 3.08Å; S622-H807 PolarHBondContact O-CE1 2.99Å; S622-H807 PolarHBondContact O-NE2 3.29Å; S622-H807 PolarHBondContact OG-CE1 3.35Å; S622-H807 PolarHBondContact OG-NE2 3.25Å
623	V	87.9	Confident	87.5	Confident	0 Å²	0	66 Å²	66	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-64	-44.8	175	-167.2	0	0	0	0	111.1	I617 P618 N619 E620 I625 Y626 Y627 L809 V818 C822	I617-V623 HydrophobicContact CG2-CB 4.22Å; I617-V623 HydrophobicContact CG2-CG1 4.39Å; I617-V623 HydrophobicContact CG2-CG2 3.76Å; P618-V623 WeakPolarHBondContact O-CG2 3.41Å; N619-V623 PolarHBondContact O-N 2.88Å; E620-V623 WeakPolarHBondContact O-CB 3.24Å; E620-V623 PolarHBondContact O-N 3.39Å; V623-I625 VanDerWaalsContact C-N 3.34Å; V623-I625 PolarHBondContact O-N 3.09Å; V623-Y626 PolarHBondContact O-N 3.31Å; V623-Y627 WeakPolarHBondContact O-CB 3.11Å; V623-Y627 PolarHBondContact O-N 3.11Å; V623-L809 HydrophobicContact CB-CD1 4.33Å; V623-L809 HydrophobicContact CG1-CD1 4.45Å; V623-L809 HydrophobicContact CG2-CD1 3.78Å; V623-V818 HydrophobicContact CB-CG1 4.21Å; V623-V818 HydrophobicContact CG1-CG1 3.64Å; V623-V818 HydrophobicContact CG2-CG1 3.45Å; V623-V818 VanDerWaalsContact CG2-CG1 3.45Å; V623-C822 HydrophobicContact CG1-CB 3.56Å
624	V	88.6	Confident	87.4	Confident	14 Å²	14	63 Å²	63	9%	0.085	33%	0.325	C	S	.	.	H	α-helix	trans	-64.3	-37.8	178.6	167.8	0	0	0	0	111.3	F76 E620 E621 Y627 K628	F76-V624 HydrophobicContact CB-CG1 4.25Å; F76-V624 HydrophobicContact CB-CG2 4.27Å; F76-V624 HydrophobicContact CD1-CG2 3.56Å; F76-V624 HydrophobicContact CD2-CB 4.38Å; F76-V624 HydrophobicContact CD2-CG1 3.46Å; F76-V624 VanDerWaalsContact CD2-CG1 3.46Å; F76-V624 HydrophobicContact CD2-CG2 3.92Å; F76-V624 HydrophobicContact CE1-CG2 3.71Å; F76-V624 HydrophobicContact CE2-CG1 3.82Å; F76-V624 HydrophobicContact CE2-CG2 4.05Å; F76-V624 HydrophobicContact CG-CB 4.46Å; F76-V624 HydrophobicContact CG-CG1 3.88Å; F76-V624 HydrophobicContact CG-CG2 3.67Å; F76-V624 HydrophobicContact CZ-CG2 3.93Å; E620-V624 HydrophobicContact CG-CG2 4.17Å; E620-V624 WeakPolarHBondContact O-CB 3.36Å; E620-V624 VanDerWaalsContact O-CG2 3.28Å; E620-V624 WeakPolarHBondContact O-CG2 3.33Å; E620-V624 PolarHBondContact O-N 3.11Å; E621-V624 PolarHBondContact O-N 3.38Å; V624-Y627 PolarHBondContact O-N 2.83Å; V624-K628 HydrophobicContact CG1-CD 4.43Å; V624-K628 WeakPolarHBondContact O-CB 3.38Å; V624-K628 WeakPolarHBondContact O-CG 3.43Å; V624-K628 PolarHBondContact O-N 3.21Å
625	I	89.2	Confident	87.2	Confident	87 Å²	87	61.9 Å²	61.9	45%	0.446	32%	0.32	S	S	.	.	H	α-helix	trans	-61.3	-48.6	173	-71.3	163.6	0	0	0	110.6	E621 S622 V623 Y627 K628 I629	E621-I625 HydrophobicContact CG-CD1 4.39Å; E621-I625 WeakPolarHBondContact O-CD1 3.46Å; E621-I625 VanDerWaalsContact O-CG1 3.3Å; E621-I625 WeakPolarHBondContact O-CG1 3.39Å; E621-I625 PolarHBondContact O-N 2.59Å; S622-I625 PolarHBondContact O-N 3.06Å; V623-I625 VanDerWaalsContact C-N 3.34Å; V623-I625 PolarHBondContact O-N 3.09Å; I625-Y627 PolarHBondContact O-N 2.9Å; I625-K628 PolarHBondContact O-N 3.35Å; I625-I629 HydrophobicContact CG2-CD1 4Å; I625-I629 WeakPolarHBondContact O-CG1 3.4Å; I625-I629 PolarHBondContact O-N 3.12Å
626	Y	89.3	Confident	87.4	Confident	4 Å²	4	60.6 Å²	60.6	2%	0.016	31%	0.313	C	S	.	.	H	α-helix	trans	-63	-42	178.2	-172.3	-101.7	0	0	0	113	S622 V623 I629 R630 M804 H807 L809 H810 L815 Y819	S622-Y626 PolarHBondContact O-N 3.1Å; S622-Y626 VanDerWaalsContact O-N 3.08Å; V623-Y626 PolarHBondContact O-N 3.31Å; Y626-I629 PolarHBondContact O-N 3.31Å; Y626-R630 HydrophobicContact CE1-CG 4.22Å; Y626-R630 PolarHBondContact O-N 3.44Å; Y626-R630 VanDerWaalsContact O-N 3.07Å; Y626-M804 HydrophobicContact CD2-CG 4.5Å; Y626-M804 HydrophobicContact CE2-CG 3.62Å; Y626-H807 HydrophobicContact CD2-CB 3.85Å; Y626-H807 AromaticContact CD2-CG 3.77Å; Y626-H807 AromaticContact CD2-ND1 3.43Å; Y626-H807 WeakPolarHBondContact CD2-ND1 3.14Å; Y626-H807 HydrophobicContact CE2-CB 4.34Å; Y626-H807 AromaticContact CG-ND1 3.84Å; Y626-L809 HydrophobicContact CD1-CD2 4.19Å; Y626-H810 HydrophobicContact CE2-CB 3.94Å; Y626-H810 AromaticContact CE2-ND1 3.95Å; Y626-H810 AromaticContact CZ-ND1 3.86Å; Y626-H810 PolarHBondContact OH-ND1 3.06Å; Y626-L815 HydrophobicContact CD1-CD1 4.1Å; Y626-L815 HydrophobicContact CE1-CD1 3.36Å; Y626-Y819 HydrophobicContact CD1-CD2 4.08Å; Y626-Y819 HydrophobicContact CD1-CE2 4.46Å; Y626-Y819 HydrophobicContact CE1-CD2 4.2Å
627	Y	89.3	Confident	87.5	Confident	17 Å²	17	56.2 Å²	56.2	7%	0.067	29%	0.293	C	S	.	.	H	α-helix	trans	-59.1	-45.6	173.7	177.2	-95.2	0	0	0	111.7	P74 V623 V624 I625 I629 R630 Q631 Y819 E823 A826	P74-Y627 HydrophobicContact CG-CE1 4.42Å; V623-Y627 WeakPolarHBondContact O-CB 3.11Å; V623-Y627 PolarHBondContact O-N 3.11Å; V624-Y627 PolarHBondContact O-N 2.83Å; I625-Y627 PolarHBondContact O-N 2.9Å; Y627-I629 PolarHBondContact O-N 3.04Å; Y627-R630 PolarHBondContact O-N 3.39Å; Y627-Q631 HydrophobicContact CD1-CG 4.3Å; Y627-Q631 HydrophobicContact CE1-CG 3.87Å; Y627-Q631 HydrophobicContact CE2-CG 4.35Å; Y627-Q631 WeakPolarHBondContact O-CG 3.42Å; Y627-Q631 PolarHBondContact O-N 2.94Å; Y627-Q631 PolarHBondContact OH-NE2 3.42Å; Y627-Y819 HydrophobicContact CD2-CD2 4.45Å; Y627-Y819 HydrophobicContact CD2-CE1 4.42Å; Y627-Y819 AromaticContact CD2-CE2 3.79Å; Y627-Y819 HydrophobicContact CD2-CE2 3.79Å; Y627-Y819 AromaticContact CD2-CZ 3.76Å; Y627-E823 HydrophobicContact CE2-CB 4.1Å; Y627-E823 HydrophobicContact CE2-CG 4.35Å; Y627-A826 HydrophobicContact CE1-CB 4.01Å
628	K	89.7	Confident	87.7	Confident	82 Å²	82	62.3 Å²	62.3	36%	0.357	32%	0.319	S	S	.	.	H	α-helix	trans	-62.8	-39.1	175.5	-75.8	-173.6	175.8	-145.6	0	112.7	E73 V624 I625 Q631 Q632	E73-K628 IonicContact OE2-NZ 2.74Å; V624-K628 HydrophobicContact CG1-CD 4.43Å; V624-K628 WeakPolarHBondContact O-CB 3.38Å; V624-K628 WeakPolarHBondContact O-CG 3.43Å; V624-K628 PolarHBondContact O-N 3.21Å; I625-K628 PolarHBondContact O-N 3.35Å; K628-Q631 PolarHBondContact O-N 2.93Å; K628-Q632 WeakPolarHBondContact O-CG 3.09Å; K628-Q632 PolarHBondContact O-N 3.09Å
629	I	91.4	Very high	88.2	Confident	17 Å²	17	60.5 Å²	60.5	9%	0.087	30%	0.304	C	S	.	.	H	α-helix	trans	-59.9	-48.8	175	-69.9	164.1	0	0	0	110.5	I625 Y626 Y627 Q631 Q632 L633 F800 R803 M804	I625-I629 HydrophobicContact CG2-CD1 4Å; I625-I629 WeakPolarHBondContact O-CG1 3.4Å; I625-I629 PolarHBondContact O-N 3.12Å; Y626-I629 PolarHBondContact O-N 3.31Å; Y627-I629 PolarHBondContact O-N 3.04Å; I629-Q631 PolarHBondContact O-N 3.24Å; I629-Q632 PolarHBondContact O-N 3.28Å; I629-L633 HydrophobicContact CG2-CD1 4.12Å; I629-L633 WeakPolarHBondContact O-CG 3.42Å; I629-L633 PolarHBondContact O-N 3.41Å; I629-F800 HydrophobicContact CG1-CD1 4.26Å; I629-F800 HydrophobicContact CG2-CD1 4.21Å; I629-F800 WeakPolarHBondContact CG2-O 3.14Å; I629-R803 HydrophobicContact CD1-CB 4.25Å; I629-M804 HydrophobicContact CG2-CB 3.82Å; I629-M804 HydrophobicContact CG2-CG 4.42Å
630	R	89.8	Confident	88.7	Confident	100 Å²	100	55.3 Å²	55.3	38%	0.377	28%	0.275	S	S	.	.	H	α-helix	trans	-65.1	-36.6	178.9	-67.8	-170.5	74.6	-167.1	9.1	113.1	Y626 Y627 L633 A634 M804 Y819	Y626-R630 HydrophobicContact CE1-CG 4.22Å; Y626-R630 PolarHBondContact O-N 3.44Å; Y626-R630 VanDerWaalsContact O-N 3.07Å; Y627-R630 PolarHBondContact O-N 3.39Å; R630-L633 PolarHBondContact O-N 3.23Å; R630-A634 WeakPolarHBondContact O-CB 3.35Å; R630-A634 PolarHBondContact O-N 3.4Å; R630-M804 HydrophobicContact CG-SD 3.91Å; R630-Y819 HydrophobicContact CB-CE2 4.37Å; R630-Y819 HydrophobicContact CG-CE2 4.48Å
631	Q	89.3	Confident	89	Confident	85 Å²	85	56.4 Å²	56.4	40%	0.397	28%	0.281	S	S	.	.	H	α-helix	trans	-67.1	-39.8	174.5	-72.9	-71.3	10.6	0	0	112.7	Y627 K628 I629 A634 K635	Y627-Q631 HydrophobicContact CD1-CG 4.3Å; Y627-Q631 HydrophobicContact CE1-CG 3.87Å; Y627-Q631 HydrophobicContact CE2-CG 4.35Å; Y627-Q631 WeakPolarHBondContact O-CG 3.42Å; Y627-Q631 PolarHBondContact O-N 2.94Å; Y627-Q631 PolarHBondContact OH-NE2 3.42Å; K628-Q631 PolarHBondContact O-N 2.93Å; I629-Q631 PolarHBondContact O-N 3.24Å; Q631-A634 PolarHBondContact O-N 2.8Å; Q631-K635 PolarHBondContact O-N 2.97Å
632	Q	91	Very high	89.2	Confident	62 Å²	62	53.9 Å²	53.9	29%	0.29	27%	0.269	S	S	.	.	H	α-helix	trans	-68.4	-37.6	175.2	-67.5	-65.5	-20.4	0	0	111.8	E73 K628 I629 K635 L636 F800	E73-Q632 PolarHBondContact OE1-NE2 2.69Å; K628-Q632 WeakPolarHBondContact O-CG 3.09Å; K628-Q632 PolarHBondContact O-N 3.09Å; I629-Q632 PolarHBondContact O-N 3.28Å; Q632-K635 PolarHBondContact O-N 3.05Å; Q632-L636 WeakPolarHBondContact O-CB 3.44Å; Q632-L636 VanDerWaalsContact O-CG 3.28Å; Q632-L636 WeakPolarHBondContact O-CG 3.37Å; Q632-L636 PolarHBondContact O-N 2.72Å; Q632-F800 HydrophobicContact CB-CE1 4.36Å; Q632-F800 HydrophobicContact CB-CE2 4.35Å; Q632-F800 HydrophobicContact CB-CZ 4.2Å; Q632-F800 HydrophobicContact CG-CZ 4.44Å
633	L	90.2	Very high	89.4	Confident	27 Å²	27	54.2 Å²	54.2	14%	0.141	26%	0.264	C	S	.	.	H	α-helix	trans	-60.3	-46.1	170.5	-75.1	169.7	0	0	0	112	I629 R630 K635 L636 G637 V797 F800 E801 M804	I629-L633 HydrophobicContact CG2-CD1 4.12Å; I629-L633 WeakPolarHBondContact O-CG 3.42Å; I629-L633 PolarHBondContact O-N 3.41Å; R630-L633 PolarHBondContact O-N 3.23Å; L633-K635 VanDerWaalsContact C-N 3.26Å; L633-K635 PolarHBondContact O-N 3.27Å; L633-L636 PolarHBondContact O-N 3.32Å; L633-G637 PolarHBondContact O-N 3.44Å; L633-V797 HydrophobicContact CD2-CB 4.46Å; L633-V797 HydrophobicContact CD2-CG1 4.03Å; L633-F800 HydrophobicContact CD1-CB 4.45Å; L633-F800 HydrophobicContact CD2-CB 3.56Å; L633-F800 HydrophobicContact CG-CB 3.84Å; L633-E801 HydrophobicContact CD1-CG 4.19Å; L633-E801 HydrophobicContact CD2-CG 3.78Å; L633-M804 HydrophobicContact CD1-CB 4.34Å; L633-M804 HydrophobicContact CD1-CE 4.23Å; L633-M804 HydrophobicContact CD1-SD 3.84Å
634	A	87.9	Confident	89.4	Confident	58 Å²	58	55.2 Å²	55.2	48%	0.479	27%	0.27	S	S	.	.	H	α-helix	trans	-62.6	-31.6	176.9	0	0	0	0	0	113	R630 Q631	R630-A634 WeakPolarHBondContact O-CB 3.35Å; R630-A634 PolarHBondContact O-N 3.4Å; Q631-A634 PolarHBondContact O-N 2.8Å
635	K	89.4	Confident	89.3	Confident	112 Å²	112	56 Å²	56	49%	0.487	27%	0.272	S	S	.	.	H	α-helix	trans	-71.9	-51.2	172.7	-168.9	-166.6	176.2	-131.2	0	112	Q631 Q632 L633 G637 K638 E639	Q631-K635 PolarHBondContact O-N 2.97Å; Q632-K635 PolarHBondContact O-N 3.05Å; L633-K635 VanDerWaalsContact C-N 3.26Å; L633-K635 PolarHBondContact O-N 3.27Å; K635-G637 PolarHBondContact O-N 3.19Å; K635-K638 WeakPolarHBondContact O-CB 3.49Å; K635-K638 PolarHBondContact O-N 3.24Å; K635-E639 WeakPolarHBondContact CE-OE1 3.2Å; K635-E639 IonicContact NZ-OE1 3.43Å; K635-E639 PolarHBondContact NZ-OE1 3.39Å; K635-E639 PolarHBondContact O-N 3Å; K635-E639 VanDerWaalsContact O-N 3.08Å
636	L	92	Very high	89.3	Confident	6 Å²	6	55.4 Å²	55.4	3%	0.031	27%	0.266	C	S	.	.	H	α-helix	trans	-61.1	-33.2	179.6	-68.5	164.9	0	0	0	111.8	Q632 L633 K638 E639 I640 V793 K796 V797 F800	Q632-L636 WeakPolarHBondContact O-CB 3.44Å; Q632-L636 VanDerWaalsContact O-CG 3.28Å; Q632-L636 WeakPolarHBondContact O-CG 3.37Å; Q632-L636 PolarHBondContact O-N 2.72Å; L633-L636 PolarHBondContact O-N 3.32Å; L636-K638 PolarHBondContact O-N 3.05Å; L636-E639 WeakPolarHBondContact O-CB 3.25Å; L636-E639 PolarHBondContact O-N 3.42Å; L636-I640 WeakPolarHBondContact O-CG1 3.35Å; L636-I640 PolarHBondContact O-N 3.28Å; L636-V793 HydrophobicContact CB-CG1 4.26Å; L636-V793 HydrophobicContact CD2-CG1 4.01Å; L636-K796 HydrophobicContact CD1-CB 3.85Å; L636-K796 HydrophobicContact CD2-CB 4.19Å; L636-K796 HydrophobicContact CD2-CD 4Å; L636-V797 HydrophobicContact CB-CG2 3.57Å; L636-V797 HydrophobicContact CD1-CG2 4.17Å; L636-V797 HydrophobicContact CG-CG2 4.46Å; L636-F800 HydrophobicContact CD1-CD2 3.68Å; L636-F800 HydrophobicContact CD1-CE2 4.12Å
637	G	88.8	Confident	89.2	Confident	31 Å²	31	57.3 Å²	57.3	32%	0.32	28%	0.279	S	S	.	.	H	α-helix	trans	-57.9	-45	171.4	0	0	0	0	0	112.9	L633 K635 I640 E641	L633-G637 PolarHBondContact O-N 3.44Å; K635-G637 PolarHBondContact O-N 3.19Å; G637-I640 WeakPolarHBondContact O-CB 3.44Å; G637-I640 PolarHBondContact O-N 3.43Å; G637-I640 VanDerWaalsContact O-N 3.16Å; G637-E641 PolarHBondContact O-N 2.89Å
638	K	87.9	Confident	89.2	Confident	135 Å²	135	63.9 Å²	63.9	59%	0.587	31%	0.308	S	S	*	.	H	α-helix	trans	-64.3	-40.3	173	-67.6	-176.8	177.2	-174.3	0	112.3	K635 L636 I640 E641 E642	K635-K638 WeakPolarHBondContact O-CB 3.49Å; K635-K638 PolarHBondContact O-N 3.24Å; L636-K638 PolarHBondContact O-N 3.05Å; K638-I640 PolarHBondContact O-N 3.03Å; K638-E641 PolarHBondContact O-N 3.47Å; K638-E641 VanDerWaalsContact O-N 3.12Å; K638-E642 PolarHBondContact O-N 3.34Å
639	E	89.7	Confident	89.2	Confident	48 Å²	48	61.6 Å²	61.6	22%	0.224	30%	0.298	C	S	.	.	H	α-helix	trans	-58.8	-32.6	174.6	-65.5	178.1	-161.8	0	0	110.9	K635 L636 Y643 V793	K635-E639 WeakPolarHBondContact CE-OE1 3.2Å; K635-E639 IonicContact NZ-OE1 3.43Å; K635-E639 PolarHBondContact NZ-OE1 3.39Å; K635-E639 PolarHBondContact O-N 3Å; K635-E639 VanDerWaalsContact O-N 3.08Å; L636-E639 WeakPolarHBondContact O-CB 3.25Å; L636-E639 PolarHBondContact O-N 3.42Å; E639-Y643 WeakPolarHBondContact O-CD2 3.32Å; E639-V793 HydrophobicContact CB-CG1 4.11Å; E639-V793 HydrophobicContact CB-CG2 4.47Å
640	I	89	Confident	89.2	Confident	29 Å²	29	60.8 Å²	60.8	15%	0.149	29%	0.293	C	S	.	.	H	α-helix	trans	-72.3	-44.9	171.3	-65.1	173.5	0	0	0	112.3	L636 G637 K638 E642 Y643 I644 P779 L790 V793 I794 V797	L636-I640 WeakPolarHBondContact O-CG1 3.35Å; L636-I640 PolarHBondContact O-N 3.28Å; G637-I640 WeakPolarHBondContact O-CB 3.44Å; G637-I640 PolarHBondContact O-N 3.43Å; G637-I640 VanDerWaalsContact O-N 3.16Å; K638-I640 PolarHBondContact O-N 3.03Å; I640-E642 PolarHBondContact O-N 3.04Å; I640-Y643 PolarHBondContact O-N 3.06Å; I640-I644 HydrophobicContact CG2-CD1 3.84Å; I640-I644 HydrophobicContact CG2-CG1 4.29Å; I640-I644 PolarHBondContact O-N 3.09Å; I640-P779 HydrophobicContact CG2-CG 4.17Å; I640-L790 HydrophobicContact CB-CD1 4.43Å; I640-L790 HydrophobicContact CG1-CD1 4.02Å; I640-L790 HydrophobicContact CG2-CD1 4.25Å; I640-V793 HydrophobicContact CD1-CG1 4.14Å; I640-V793 HydrophobicContact CG1-CB 4.49Å; I640-V793 HydrophobicContact CG1-CG1 3.57Å; I640-I794 HydrophobicContact CD1-CG1 3.94Å; I640-I794 HydrophobicContact CG1-CG1 4.48Å; I640-V797 HydrophobicContact CD1-CG2 3.97Å
641	E	88.4	Confident	89.2	Confident	69 Å²	69	57.7 Å²	57.7	32%	0.322	28%	0.284	S	S	.	.	H	α-helix	trans	-53.8	-42.5	175.8	-66.9	-176.4	166.2	0	0	111	G637 K638 Y643 I644 H645 S737	G637-E641 PolarHBondContact O-N 2.89Å; K638-E641 PolarHBondContact O-N 3.47Å; K638-E641 VanDerWaalsContact O-N 3.12Å; E641-Y643 VanDerWaalsContact C-N 3.25Å; E641-Y643 PolarHBondContact O-N 2.86Å; E641-I644 PolarHBondContact O-N 3.34Å; E641-I644 VanDerWaalsContact O-N 3.16Å; E641-H645 PolarHBondContact O-N 3.48Å; E641-H645 VanDerWaalsContact O-N 3.08Å; E641-H645 PolarHBondContact O-ND1 3.45Å; E641-S737 WeakPolarHBondContact CG-O 3.35Å
642	E	88.1	Confident	89.4	Confident	110 Å²	110	57.2 Å²	57.2	51%	0.514	29%	0.288	S	S	.	.	H	α-helix	trans	-62.1	-22.3	174.8	-75	-179.3	-154.2	0	0	114.6	K638 I640 K646	K638-E642 PolarHBondContact O-N 3.34Å; I640-E642 PolarHBondContact O-N 3.04Å; E642-K646 WeakPolarHBondContact O-CD 3.37Å; E642-K646 WeakPolarHBondContact O-CE 3.28Å; E642-K646 WeakPolarHBondContact O-CG 3.5Å; E642-K646 PolarHBondContact O-NZ 3.33Å
643	Y	89.9	Confident	89.5	Confident	45 Å²	45	56 Å²	56	18%	0.176	28%	0.282	C	S	.	.	H	α-helix	trans	-84.3	-42.3	170	-79.6	-79.1	0	0	0	112.2	E639 I640 E641 H645 K646 D787 L790	E639-Y643 WeakPolarHBondContact O-CD2 3.32Å; I640-Y643 PolarHBondContact O-N 3.06Å; E641-Y643 VanDerWaalsContact C-N 3.25Å; E641-Y643 PolarHBondContact O-N 2.86Å; Y643-H645 PolarHBondContact O-N 3.29Å; Y643-K646 HydrophobicContact CD1-CD 4.37Å; Y643-K646 VanDerWaalsContact CD1-NZ 3.34Å; Y643-K646 PolarHBondContact O-N 3.49Å; Y643-D787 HydrophobicContact CD1-CB 4.47Å; Y643-D787 HydrophobicContact CE1-CB 4.17Å; Y643-D787 WeakPolarHBondContact CE1-OD2 3.44Å; Y643-L790 HydrophobicContact CD1-CB 4.12Å; Y643-L790 HydrophobicContact CD2-CB 3.97Å; Y643-L790 HydrophobicContact CD2-CD1 3.91Å; Y643-L790 HydrophobicContact CD2-CG 4.47Å; Y643-L790 HydrophobicContact CE1-CB 4.32Å; Y643-L790 HydrophobicContact CE2-CB 4.2Å; Y643-L790 HydrophobicContact CG-CB 3.94Å; Y643-L790 HydrophobicContact CG-CD1 4.11Å; Y643-L790 HydrophobicContact CG-CD2 4.46Å; Y643-L790 HydrophobicContact CG-CG 4.39Å
644	I	87.9	Confident	89.7	Confident	21 Å²	21	54.8 Å²	54.8	11%	0.108	28%	0.276	C	S	.	.	H	α-helix	trans	-58.4	-49.5	-178.5	-68.6	170.4	0	0	0	110.9	I640 E641 K646 C650 I739 P779 M783	I640-I644 HydrophobicContact CG2-CD1 3.84Å; I640-I644 HydrophobicContact CG2-CG1 4.29Å; I640-I644 PolarHBondContact O-N 3.09Å; E641-I644 PolarHBondContact O-N 3.34Å; E641-I644 VanDerWaalsContact O-N 3.16Å; I644-K646 VanDerWaalsContact C-N 3.32Å; I644-K646 PolarHBondContact O-N 2.8Å; I644-C650 WeakPolarHBondContact O-CB 3.48Å; I644-I739 HydrophobicContact CG2-CD1 4.04Å; I644-I739 HydrophobicContact CG2-CG1 4.2Å; I644-P779 HydrophobicContact CD1-CG 3.99Å; I644-P779 HydrophobicContact CG1-CB 4.41Å; I644-P779 HydrophobicContact CG1-CG 4Å; I644-M783 HydrophobicContact CG2-CE 4.12Å; I644-M783 HydrophobicContact CG2-SD 4.03Å
645	H	87.3	Confident	89.9	Confident	31 Å²	31	55.1 Å²	55.1	14%	0.144	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	4.9	-171.3	67.1	-148.9	0	0	0	115.5	E641 Y643 C650 H734 L736	E641-H645 PolarHBondContact O-N 3.48Å; E641-H645 VanDerWaalsContact O-N 3.08Å; E641-H645 PolarHBondContact O-ND1 3.45Å; Y643-H645 PolarHBondContact O-N 3.29Å; H645-C650 PolarHBondContact O-SG 3.1Å; H645-H734 PolarHBondContact CE1-O 2.9Å; H645-H734 PolarHBondContact ND1-O 3.36Å; H645-H734 VanDerWaalsContact ND1-O 3.16Å; H645-L736 HydrophobicContact CB-CB 4.47Å; H645-L736 PolarHBondContact ND1-O 3.05Å
646	K	88.5	Confident	90.1	Very high	74 Å²	74	52.7 Å²	52.7	32%	0.322	26%	0.263	S	S	.	.	S	Bend	trans	-63	130.9	172.7	-80.9	164.3	-178.3	121.7	0	109.1	E642 Y643 I644 K648 Y649 C650	E642-K646 WeakPolarHBondContact O-CD 3.37Å; E642-K646 WeakPolarHBondContact O-CE 3.28Å; E642-K646 WeakPolarHBondContact O-CG 3.5Å; E642-K646 PolarHBondContact O-NZ 3.33Å; Y643-K646 HydrophobicContact CD1-CD 4.37Å; Y643-K646 VanDerWaalsContact CD1-NZ 3.34Å; Y643-K646 PolarHBondContact O-N 3.49Å; I644-K646 VanDerWaalsContact C-N 3.32Å; I644-K646 PolarHBondContact O-N 2.8Å; K646-K648 PolarHBondContact O-N 3.24Å; K646-Y649 HydrophobicContact CB-CD2 3.94Å; K646-Y649 HydrophobicContact CB-CE2 4.5Å; K646-Y649 PolarHBondContact O-N 2.98Å; K646-C650 PolarHBondContact O-N 3.3Å; K646-C650 VanDerWaalsContact O-N 3.16Å; K646-C650 PolarHBondContact O-SG 3.31Å; K646-C650 VanDerWaalsContact O-SG 3.38Å
647	P	87.9	Confident	90.2	Very high	44 Å²	44	52.4 Å²	52.4	29%	0.286	26%	0.262	S	S	.	.	H	α-helix	trans	-47.6	-42.8	-173.2	-30.9	32.7	0	0	0	114.5	Y649 L651 Y694 V733	P647-Y649 PolarHBondContact O-N 3.33Å; P647-Y649 VanDerWaalsContact O-N 3.14Å; P647-L651 HydrophobicContact CB-CD1 3.89Å; P647-L651 HydrophobicContact CB-CG 4.4Å; P647-L651 VanDerWaalsContact O-CB 3.24Å; P647-L651 WeakPolarHBondContact O-CB 3.3Å; P647-L651 VanDerWaalsContact O-CD1 3.24Å; P647-L651 WeakPolarHBondContact O-CD1 3.33Å; P647-L651 WeakPolarHBondContact O-CG 3.32Å; P647-L651 PolarHBondContact O-N 2.7Å; P647-L651 VanDerWaalsContact O-N 3.15Å; P647-Y694 HydrophobicContact CB-CD2 3.76Å; P647-Y694 HydrophobicContact CB-CE2 3.86Å; P647-Y694 HydrophobicContact CB-CG 4.26Å; P647-Y694 HydrophobicContact CG-CD2 3.69Å; P647-Y694 HydrophobicContact CG-CE2 4.13Å; P647-Y694 HydrophobicContact CG-CG 4.36Å; P647-V733 HydrophobicContact CG-CG1 4.21Å
648	K	88.4	Confident	90.5	Very high	156 Å²	156	51.9 Å²	51.9	68%	0.678	25%	0.25	S	S	*	.	H	α-helix	trans	-51.7	-34	177.7	-178.6	-178.3	172.4	-167.4	0	114	K646	K646-K648 PolarHBondContact O-N 3.24Å
649	Y	90.2	Very high	90.9	Very high	33 Å²	33	45.4 Å²	45.4	13%	0.129	22%	0.222	C	C	.	.	H	α-helix	trans	-105.8	-37.1	-172.2	-55.6	-59	0	0	0	112.9	K646 P647 P652 F653 M783 I785	K646-Y649 HydrophobicContact CB-CD2 3.94Å; K646-Y649 HydrophobicContact CB-CE2 4.5Å; K646-Y649 PolarHBondContact O-N 2.98Å; P647-Y649 PolarHBondContact O-N 3.33Å; P647-Y649 VanDerWaalsContact O-N 3.14Å; Y649-P652 WeakPolarHBondContact O-CD 3.5Å; Y649-F653 VanDerWaalsContact O-CD2 3.28Å; Y649-F653 WeakPolarHBondContact O-CD2 3.47Å; Y649-F653 WeakPolarHBondContact O-CE2 3.16Å; Y649-M783 VanDerWaalsContact O-CE 3.31Å; Y649-M783 WeakPolarHBondContact O-CE 3.46Å; Y649-I785 HydrophobicContact CD1-CB 4.42Å; Y649-I785 HydrophobicContact CD1-CD1 4.41Å; Y649-I785 HydrophobicContact CD1-CG1 3.68Å; Y649-I785 HydrophobicContact CD1-CG2 4.42Å; Y649-I785 HydrophobicContact CD2-CD1 4.06Å; Y649-I785 HydrophobicContact CD2-CG1 4.12Å; Y649-I785 HydrophobicContact CD2-CG2 4.27Å; Y649-I785 HydrophobicContact CE1-CB 4.43Å; Y649-I785 HydrophobicContact CE1-CG1 4.18Å; Y649-I785 HydrophobicContact CE1-CG2 4.11Å; Y649-I785 HydrophobicContact CE2-CG2 4.01Å; Y649-I785 HydrophobicContact CG-CD1 3.86Å; Y649-I785 HydrophobicContact CG-CG1 3.64Å; Y649-I785 HydrophobicContact CG-CG2 4.49Å
650	C	91	Very high	91.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-79.8	-36.1	180	62.2	0	0	0	0	114.1	I644 H645 K646 P652 F653 L654 V733 I739	I644-C650 WeakPolarHBondContact O-CB 3.48Å; H645-C650 PolarHBondContact O-SG 3.1Å; K646-C650 PolarHBondContact O-N 3.3Å; K646-C650 VanDerWaalsContact O-N 3.16Å; K646-C650 PolarHBondContact O-SG 3.31Å; K646-C650 VanDerWaalsContact O-SG 3.38Å; C650-P652 VanDerWaalsContact C-CD 3.45Å; C650-F653 PolarHBondContact O-N 3.19Å; C650-L654 PolarHBondContact O-N 3.29Å; C650-V733 WeakPolarHBondContact SG-CG2 3.48Å; C650-I739 HydrophobicContact CB-CD1 3.68Å
651	L	90.3	Very high	91.4	Very high	35 Å²	35	44.2 Å²	44.2	18%	0.183	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-53	-41	-173.8	-74.4	167.7	0	0	0	114.2	P647 F653 L654 F677 Y694	P647-L651 HydrophobicContact CB-CD1 3.89Å; P647-L651 HydrophobicContact CB-CG 4.4Å; P647-L651 VanDerWaalsContact O-CB 3.24Å; P647-L651 WeakPolarHBondContact O-CB 3.3Å; P647-L651 VanDerWaalsContact O-CD1 3.24Å; P647-L651 WeakPolarHBondContact O-CD1 3.33Å; P647-L651 WeakPolarHBondContact O-CG 3.32Å; P647-L651 PolarHBondContact O-N 2.7Å; P647-L651 VanDerWaalsContact O-N 3.15Å; L651-F653 PolarHBondContact O-N 3Å; L651-F653 VanDerWaalsContact O-N 3.08Å; L651-L654 HydrophobicContact CD2-CD1 4.3Å; L651-L654 PolarHBondContact O-N 3.21Å; L651-F677 HydrophobicContact CD2-CD2 3.64Å; L651-F677 HydrophobicContact CD2-CE2 3.63Å; L651-F677 HydrophobicContact CD2-CG 4.34Å; L651-F677 HydrophobicContact CD2-CZ 4.3Å; L651-Y694 HydrophobicContact CD1-CD1 3.79Å; L651-Y694 HydrophobicContact CD1-CE1 3.46Å; L651-Y694 VanDerWaalsContact CD1-CE1 3.46Å; L651-Y694 HydrophobicContact CD1-CG 4.47Å; L651-Y694 HydrophobicContact CD2-CD1 3.71Å; L651-Y694 HydrophobicContact CD2-CE1 4.1Å; L651-Y694 HydrophobicContact CD2-CG 4.49Å; L651-Y694 HydrophobicContact CG-CD1 4.32Å; L651-Y694 HydrophobicContact CG-CE1 4.42Å
652	P	93.1	Very high	91.6	Very high	75 Å²	75	41 Å²	41	49%	0.487	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-59.9	-16.3	175	-25.2	35.8	0	0	0	115.2	Y649 C650 Q655	Y649-P652 WeakPolarHBondContact O-CD 3.5Å; C650-P652 VanDerWaalsContact C-CD 3.45Å; P652-Q655 PolarHBondContact O-NE2 2.79Å
653	F	93.9	Very high	91.6	Very high	37 Å²	37	40.3 Å²	40.3	16%	0.162	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-109.2	-8.6	-177.2	-57.4	-82.8	0	0	0	113.7	Y649 C650 L651 Q655 R658 I739 L777 D782 M783	Y649-F653 VanDerWaalsContact O-CD2 3.28Å; Y649-F653 WeakPolarHBondContact O-CD2 3.47Å; Y649-F653 WeakPolarHBondContact O-CE2 3.16Å; C650-F653 PolarHBondContact O-N 3.19Å; L651-F653 PolarHBondContact O-N 3Å; L651-F653 VanDerWaalsContact O-N 3.08Å; F653-Q655 PolarHBondContact O-N 3.22Å; F653-Q655 PolarHBondContact O-OE1 3.19Å; F653-R658 WeakPolarHBondContact O-CD 3.28Å; F653-R658 VanDerWaalsContact O-CG 3.26Å; F653-R658 WeakPolarHBondContact O-CG 3.48Å; F653-R658 PolarHBondContact O-NE 3.49Å; F653-I739 HydrophobicContact CB-CG2 4.31Å; F653-L777 HydrophobicContact CB-CD1 3.76Å; F653-L777 HydrophobicContact CD1-CD1 3.5Å; F653-L777 VanDerWaalsContact CD1-CD1 3.5Å; F653-L777 HydrophobicContact CD2-CD1 4.45Å; F653-L777 HydrophobicContact CE1-CD1 4.25Å; F653-L777 HydrophobicContact CG-CD1 3.63Å; F653-D782 VanDerWaalsContact CZ-O 3.26Å; F653-D782 WeakPolarHBondContact CZ-O 3.36Å; F653-M783 HydrophobicContact CD2-CE 4.11Å; F653-M783 HydrophobicContact CD2-CG 4.16Å; F653-M783 HydrophobicContact CE2-CB 4.05Å; F653-M783 HydrophobicContact CE2-CE 4.41Å; F653-M783 HydrophobicContact CE2-CG 3.89Å; F653-M783 HydrophobicContact CZ-CB 4.38Å; F653-M783 HydrophobicContact CZ-CG 4.22Å
654	L	93.4	Very high	91.3	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	20%	0.202	C	C	.	.			trans	-77.7	42.1	176.8	-61.3	-179.1	0	0	0	112.9	C650 L651 V660 V674 F677 V696 L736	C650-L654 PolarHBondContact O-N 3.29Å; L651-L654 HydrophobicContact CD2-CD1 4.3Å; L651-L654 PolarHBondContact O-N 3.21Å; L654-V660 HydrophobicContact CD2-CG1 4.25Å; L654-V674 HydrophobicContact CB-CG1 4.46Å; L654-V674 HydrophobicContact CD2-CG2 4.03Å; L654-F677 HydrophobicContact CB-CD1 3.81Å; L654-F677 HydrophobicContact CB-CE1 4.23Å; L654-F677 HydrophobicContact CB-CG 4.48Å; L654-F677 VanDerWaalsContact O-CD1 3.32Å; L654-F677 WeakPolarHBondContact O-CD1 3.42Å; L654-V696 HydrophobicContact CD1-CG1 4.23Å; L654-V696 HydrophobicContact CD1-CG2 3.65Å; L654-V696 HydrophobicContact CD2-CG1 4.44Å; L654-L736 HydrophobicContact CD1-CD1 4.38Å; L654-L736 HydrophobicContact CD2-CD1 3.71Å
655	Q	93.6	Very high	90.5	Very high	65 Å²	65	47.5 Å²	47.5	30%	0.304	23%	0.232	S	C	.	.			trans	-69.5	146.9	172.5	-59	96.8	-2.3	0	0	111.2	P652 F653 G657 R658	P652-Q655 PolarHBondContact O-NE2 2.79Å; F653-Q655 PolarHBondContact O-N 3.22Å; F653-Q655 PolarHBondContact O-OE1 3.19Å; Q655-G657 PolarHBondContact O-N 3.31Å; Q655-R658 WeakPolarHBondContact O-CB 3.34Å; Q655-R658 PolarHBondContact O-N 3.32Å
656	P	93.8	Very high	89.8	Confident	61 Å²	61	48.8 Å²	48.8	40%	0.396	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.2	135.1	170.5	-27.9	35.1	0	0	0	112.2	V674 V675 R743 I746	P656-V674 CarbonylContact C-O 3.6Å; P656-V674 WeakPolarHBondContact CA-O 3.43Å; P656-V675 WeakPolarHBondContact CB-O 3.43Å; P656-V675 WeakPolarHBondContact CG-O 3.46Å; P656-R743 PolarHBondContact O-NH2 2.82Å; P656-I746 HydrophobicContact CB-CG2 4.46Å
657	G	93.1	Very high	89.4	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.8	-10	-173.8	0	0	0	0	0	115.2	Q655 L659 V673 V674 R743 L744	Q655-G657 PolarHBondContact O-N 3.31Å; G657-L659 PolarHBondContact O-N 2.89Å; G657-V673 VanDerWaalsContact CA-CG2 3.43Å; G657-V673 VanDerWaalsContact O-CG2 3.27Å; G657-V673 WeakPolarHBondContact O-CG2 3.35Å; G657-V674 PolarHBondContact N-O 3.47Å; G657-R743 CarbonylContact O-C 3.49Å; G657-R743 VanDerWaalsContact O-CA 3.26Å; G657-R743 WeakPolarHBondContact O-CA 3.1Å; G657-L744 WeakPolarHBondContact CA-O 3.25Å; G657-L744 PolarHBondContact O-N 2.9Å
658	R	96.1	Very high	89.4	Confident	20 Å²	20	48.3 Å²	48.3	8%	0.075	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	131.3	175.7	179.4	69	61.8	-171.4	1.9	111.4	F653 Q655 V660 V673 V674 I739 S740 S741	F653-R658 WeakPolarHBondContact O-CD 3.28Å; F653-R658 VanDerWaalsContact O-CG 3.26Å; F653-R658 WeakPolarHBondContact O-CG 3.48Å; F653-R658 PolarHBondContact O-NE 3.49Å; Q655-R658 WeakPolarHBondContact O-CB 3.34Å; Q655-R658 PolarHBondContact O-N 3.32Å; R658-V660 HydrophobicContact CG-CG1 4.1Å; R658-V673 WeakPolarHBondContact O-CA 3.26Å; R658-V673 WeakPolarHBondContact O-CG2 3.08Å; R658-V674 HydrophobicContact CB-CB 4.19Å; R658-V674 HydrophobicContact CB-CG2 4.01Å; R658-V674 HydrophobicContact CG-CG2 4.41Å; R658-V674 PolarHBondContact O-N 2.85Å; R658-I739 HydrophobicContact CG-CG2 3.96Å; R658-S740 WeakPolarHBondContact CD-O 3.21Å; R658-S740 PolarHBondContact NH1-O 2.9Å; R658-S741 PolarHBondContact NH1-O 3.39Å
659	L	96.1	Very high	89.3	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	131.6	168.4	-75.1	-173.1	0	0	0	111	G657 W671 G672 V673 S740 V742 L744 I763 V766 I774	G657-L659 PolarHBondContact O-N 2.89Å; L659-W671 HydrophobicContact CB-CE3 4.13Å; L659-W671 HydrophobicContact CB-CZ3 4.33Å; L659-G672 WeakPolarHBondContact CD2-O 3.32Å; L659-V673 HydrophobicContact CD2-CB 4.31Å; L659-S740 PolarHBondContact O-N 3.35Å; L659-V742 HydrophobicContact CD1-CB 4.07Å; L659-V742 HydrophobicContact CD1-CG1 3.87Å; L659-V742 HydrophobicContact CG-CB 4.48Å; L659-V742 HydrophobicContact CG-CG1 4.35Å; L659-V742 PolarHBondContact N-O 2.98Å; L659-V742 VanDerWaalsContact N-O 3.13Å; L659-L744 HydrophobicContact CD2-CD1 3.72Å; L659-L744 HydrophobicContact CD2-CG 4.2Å; L659-L744 HydrophobicContact CG-CD1 4.32Å; L659-L744 HydrophobicContact CG-CG 4.29Å; L659-I763 HydrophobicContact CD2-CG1 3.99Å; L659-V766 HydrophobicContact CD1-CB 4.41Å; L659-V766 HydrophobicContact CD1-CG1 3.96Å; L659-I774 HydrophobicContact CD1-CD1 4.17Å; L659-I774 HydrophobicContact CD1-CG2 4.27Å
660	V	95.3	Very high	89.4	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	149.1	177.8	-68.5	0	0	0	0	110	L654 R658 V662 W671 G672 V674 V698 L736 A738 I739	L654-V660 HydrophobicContact CD2-CG1 4.25Å; R658-V660 HydrophobicContact CG-CG1 4.1Å; V660-V662 HydrophobicContact CG2-CG2 4.37Å; V660-W671 VanDerWaalsContact C-CE3 3.45Å; V660-G672 PolarHBondContact N-O 2.77Å; V660-G672 VanDerWaalsContact N-O 3.08Å; V660-G672 PolarHBondContact O-N 2.94Å; V660-V674 HydrophobicContact CB-CG2 4.44Å; V660-V674 HydrophobicContact CG1-CG2 3.69Å; V660-V674 HydrophobicContact CG2-CG2 3.82Å; V660-V698 HydrophobicContact CG2-CG1 3.73Å; V660-V698 HydrophobicContact CG2-CG2 4.09Å; V660-L736 HydrophobicContact CB-CD2 4.3Å; V660-L736 HydrophobicContact CG2-CD2 4.25Å; V660-A738 CarbonylContact C-O 3.59Å; V660-A738 WeakPolarHBondContact CA-O 3.1Å; V660-I739 HydrophobicContact CG1-CG1 4.33Å; V660-I739 HydrophobicContact CG1-CG2 4.23Å
661	K	93.7	Very high	89.5	Confident	52 Å²	52	43.3 Å²	43.3	23%	0.226	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	131.3	172.7	-159.7	-171.7	173.5	-163.3	0	109.8	D668 G670 W671 L736 S737 A738	K661-D668 VanDerWaalsContact CE-CG 3.5Å; K661-D668 WeakPolarHBondContact CE-OD1 3.47Å; K661-D668 WeakPolarHBondContact CE-OD2 3.48Å; K661-D668 IonicContact NZ-OD1 2.57Å; K661-D668 IonicContact NZ-OD2 2.89Å; K661-D668 PolarHBondContact NZ-OD2 3.3Å; K661-G670 WeakPolarHBondContact CA-O 3.41Å; K661-G670 WeakPolarHBondContact CG-O 3.5Å; K661-W671 HydrophobicContact CB-CD2 4.29Å; K661-W671 HydrophobicContact CB-CE3 4.14Å; K661-W671 HydrophobicContact CB-CH2 4.3Å; K661-W671 HydrophobicContact CB-CZ2 4.45Å; K661-W671 HydrophobicContact CB-CZ3 4.15Å; K661-L736 WeakPolarHBondContact O-CA 3.44Å; K661-S737 PolarHBondContact O-N 3.35Å; K661-A738 HydrophobicContact CB-CB 3.84Å; K661-A738 PolarHBondContact N-O 2.9Å
662	V	91.6	Very high	89.6	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.006	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	132	-175.4	-177.1	0	0	0	0	111.1	V660 F669 G670 V698 L700 V731 L735 L736	V660-V662 HydrophobicContact CG2-CG2 4.37Å; V662-F669 HydrophobicContact CB-CB 4.35Å; V662-F669 HydrophobicContact CG1-CD2 4.35Å; V662-F669 PolarHBondContact O-N 3.3Å; V662-G670 PolarHBondContact N-O 3.26Å; V662-V698 HydrophobicContact CG2-CG1 4.12Å; V662-V698 HydrophobicContact CG2-CG2 4.45Å; V662-L700 HydrophobicContact CB-CD1 4.2Å; V662-L700 HydrophobicContact CB-CD2 3.87Å; V662-L700 HydrophobicContact CG1-CD1 4.06Å; V662-L700 HydrophobicContact CG2-CD1 4.33Å; V662-L700 HydrophobicContact CG2-CD2 3.72Å; V662-V731 HydrophobicContact CG1-CG1 4.25Å; V662-V731 HydrophobicContact CG1-CG2 4.46Å; V662-L735 WeakPolarHBondContact CA-O 3.47Å; V662-L735 HydrophobicContact CG1-CB 4.32Å; V662-L736 HydrophobicContact CG2-CD2 3.83Å
663	K	89.1	Confident	89.8	Confident	96 Å²	96	38.1 Å²	38.1	42%	0.417	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	132.6	-178.2	-172	173.5	-179.1	174.5	0	110.9	D667 D668 L735	K663-D667 CarbonylContact C-O 3.54Å; K663-D667 VanDerWaalsContact CA-O 3.28Å; K663-D667 WeakPolarHBondContact CA-O 3.4Å; K663-D668 HydrophobicContact CG-CB 4.45Å; K663-L735 PolarHBondContact N-O 3.22Å
664	N	82.8	Confident	89.9	Confident	57 Å²	57	36.4 Å²	36.4	31%	0.305	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	113	-176.8	-175.8	34.5	0	0	0	111.2	G666 D667 F669 L735	N664-G666 PolarHBondContact O-N 2.97Å; N664-D667 PolarHBondContact N-O 3.44Å; N664-D667 WeakPolarHBondContact O-CB 3.28Å; N664-D667 PolarHBondContact O-N 3Å; N664-F669 HydrophobicContact CB-CE2 4.22Å; N664-L735 HydrophobicContact CB-CD2 4.09Å; N664-L735 WeakPolarHBondContact OD1-CD2 3.29Å
665	E	71	Confident	89.9	Confident	160 Å²	160	37.7 Å²	37.7	75%	0.748	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.7	4.8	176.3	-62.9	-164.8	157.5	0	0	118.7	K507	K507-E665 WeakPolarHBondContact CE-OE2 3.25Å; K507-E665 IonicContact NZ-OE2 2.74Å; K507-E665 PolarHBondContact NZ-OE2 3.34Å
666	G	72.7	Confident	89.8	Confident	58 Å²	58	38.1 Å²	38.1	60%	0.598	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	147.2	-35.9	-175.7	0	0	0	0	0	111.9	N664 D668	N664-G666 PolarHBondContact O-N 2.97Å; G666-D668 PolarHBondContact O-N 2.92Å
667	D	80.3	Confident	89.7	Confident	46 Å²	46	39 Å²	39	25%	0.246	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	112	175	-74.8	-50	0	0	0	111.1	K663 N664 F669 K716 P717	K663-D667 CarbonylContact C-O 3.54Å; K663-D667 VanDerWaalsContact CA-O 3.28Å; K663-D667 WeakPolarHBondContact CA-O 3.4Å; N664-D667 PolarHBondContact N-O 3.44Å; N664-D667 WeakPolarHBondContact O-CB 3.28Å; N664-D667 PolarHBondContact O-N 3Å; D667-F669 HydrophobicContact CB-CD2 4.49Å; D667-F669 HydrophobicContact CB-CE2 3.94Å; D667-K716 WeakPolarHBondContact OD2-CD 3.37Å; D667-K716 WeakPolarHBondContact OD2-CE 3.28Å; D667-K716 IonicContact OD2-NZ 2.6Å; D667-K716 PolarHBondContact OD2-NZ 2.61Å; D667-P717 HydrophobicContact CB-CG 3.91Å; D667-P717 WeakPolarHBondContact OD1-CD 3.49Å
668	D	87.4	Confident	89.4	Confident	62 Å²	62	40.5 Å²	40.5	33%	0.332	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	109.4	172.3	-166.3	-28.1	0	0	0	109.2	K661 K663 G666 G670	K661-D668 VanDerWaalsContact CE-CG 3.5Å; K661-D668 WeakPolarHBondContact CE-OD1 3.47Å; K661-D668 WeakPolarHBondContact CE-OD2 3.48Å; K661-D668 IonicContact NZ-OD1 2.57Å; K661-D668 IonicContact NZ-OD2 2.89Å; K661-D668 PolarHBondContact NZ-OD2 3.3Å; K663-D668 HydrophobicContact CG-CB 4.45Å; G666-D668 PolarHBondContact O-N 2.92Å; D668-G670 PolarHBondContact O-N 2.98Å; D668-G670 WeakPolarHBondContact OD1-CA 3.32Å; D668-G670 PolarHBondContact OD1-N 2.95Å
669	F	87.4	Confident	88.9	Confident	19 Å²	19	46 Å²	46	8%	0.083	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	-4	177.4	-65.3	-105.5	0	0	0	112.3	V662 N664 D667 L700 A715 K716 P717	V662-F669 HydrophobicContact CB-CB 4.35Å; V662-F669 HydrophobicContact CG1-CD2 4.35Å; V662-F669 PolarHBondContact O-N 3.3Å; N664-F669 HydrophobicContact CB-CE2 4.22Å; D667-F669 HydrophobicContact CB-CD2 4.49Å; D667-F669 HydrophobicContact CB-CE2 3.94Å; F669-L700 HydrophobicContact CB-CD1 4.28Å; F669-L700 HydrophobicContact CB-CD2 3.97Å; F669-L700 HydrophobicContact CD1-CB 4.27Å; F669-L700 HydrophobicContact CD1-CD1 3.97Å; F669-L700 HydrophobicContact CG-CD1 4.13Å; F669-A715 HydrophobicContact CE1-CB 4.45Å; F669-A715 WeakPolarHBondContact CZ-O 3.42Å; F669-K716 VanDerWaalsContact CE1-C 3.45Å; F669-P717 HydrophobicContact CD1-CB 4.1Å; F669-P717 HydrophobicContact CE1-CB 4.49Å; F669-P717 HydrophobicContact CG-CB 4.21Å
670	G	91.1	Very high	88	Confident	20 Å²	20	51.3 Å²	51.3	21%	0.206	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	64.4	-145.4	-174.3	0	0	0	0	0	112	K661 V662 D668	K661-G670 WeakPolarHBondContact CA-O 3.41Å; K661-G670 WeakPolarHBondContact CG-O 3.5Å; V662-G670 PolarHBondContact N-O 3.26Å; D668-G670 PolarHBondContact O-N 2.98Å; D668-G670 WeakPolarHBondContact OD1-CA 3.32Å; D668-G670 PolarHBondContact OD1-N 2.95Å
671	W	93.5	Very high	86.7	Confident	45 Å²	45	55.6 Å²	55.6	17%	0.17	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	118	-175.7	-70.9	101.5	0	0	0	111.9	L659 V660 K661 A738 I763 I774 L776	L659-W671 HydrophobicContact CB-CE3 4.13Å; L659-W671 HydrophobicContact CB-CZ3 4.33Å; V660-W671 VanDerWaalsContact C-CE3 3.45Å; K661-W671 HydrophobicContact CB-CD2 4.29Å; K661-W671 HydrophobicContact CB-CE3 4.14Å; K661-W671 HydrophobicContact CB-CH2 4.3Å; K661-W671 HydrophobicContact CB-CZ2 4.45Å; K661-W671 HydrophobicContact CB-CZ3 4.15Å; W671-A738 HydrophobicContact CH2-CB 4.11Å; W671-I763 HydrophobicContact CB-CG2 4.12Å; W671-I774 HydrophobicContact CD2-CD1 3.87Å; W671-I774 HydrophobicContact CG-CD1 3.83Å; W671-I774 HydrophobicContact CZ2-CB 4.04Å; W671-L776 HydrophobicContact CH2-CD2 3.67Å; W671-L776 HydrophobicContact CZ2-CD2 4.11Å
672	G	93.7	Very high	85	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	179.4	167.2	0	0	0	0	0	112.3	L659 V660 L699	L659-G672 WeakPolarHBondContact CD2-O 3.32Å; V660-G672 PolarHBondContact N-O 2.77Å; V660-G672 VanDerWaalsContact N-O 3.08Å; V660-G672 PolarHBondContact O-N 2.94Å; G672-L699 WeakPolarHBondContact CA-O 3.47Å
673	V	96.1	Very high	83.2	Confident	1 Å²	1	60 Å²	60	1%	0.006	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	136.5	171.9	73.4	0	0	0	0	111.3	G657 R658 L659 V675 V698 L699 V759	G657-V673 VanDerWaalsContact CA-CG2 3.43Å; G657-V673 VanDerWaalsContact O-CG2 3.27Å; G657-V673 WeakPolarHBondContact O-CG2 3.35Å; R658-V673 WeakPolarHBondContact O-CA 3.26Å; R658-V673 WeakPolarHBondContact O-CG2 3.08Å; L659-V673 HydrophobicContact CD2-CB 4.31Å; V673-V675 PolarHBondContact O-N 2.78Å; V673-V698 WeakPolarHBondContact O-CA 3.2Å; V673-V698 WeakPolarHBondContact O-CG1 3.33Å; V673-L699 HydrophobicContact CG1-CB 3.84Å; V673-L699 HydrophobicContact CG1-CD2 4.17Å; V673-L699 PolarHBondContact N-O 3.32Å; V673-L699 PolarHBondContact O-N 3.34Å; V673-V759 HydrophobicContact CB-CG1 4.37Å; V673-V759 HydrophobicContact CG1-CG1 3.6Å
674	V	95.6	Very high	81.5	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	125	172.5	-179.3	0	0	0	0	109.2	L654 P656 G657 R658 V660 V696	L654-V674 HydrophobicContact CB-CG1 4.46Å; L654-V674 HydrophobicContact CD2-CG2 4.03Å; P656-V674 CarbonylContact C-O 3.6Å; P656-V674 WeakPolarHBondContact CA-O 3.43Å; G657-V674 PolarHBondContact N-O 3.47Å; R658-V674 HydrophobicContact CB-CB 4.19Å; R658-V674 HydrophobicContact CB-CG2 4.01Å; R658-V674 HydrophobicContact CG-CG2 4.41Å; R658-V674 PolarHBondContact O-N 2.85Å; V660-V674 HydrophobicContact CB-CG2 4.44Å; V660-V674 HydrophobicContact CG1-CG2 3.69Å; V660-V674 HydrophobicContact CG2-CG2 3.82Å; V674-V696 HydrophobicContact CG1-CG1 4.07Å; V674-V696 HydrophobicContact CG2-CG1 4.27Å
675	V	93	Very high	80.1	Confident	28 Å²	28	60.3 Å²	60.3	17%	0.17	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-48.2	171.8	179.1	0	0	0	0	109.6	P656 V673 E697 L699 V728 I746 L750	P656-V675 WeakPolarHBondContact CB-O 3.43Å; P656-V675 WeakPolarHBondContact CG-O 3.46Å; V673-V675 PolarHBondContact O-N 2.78Å; V675-E697 HydrophobicContact CB-CB 4.32Å; V675-E697 WeakPolarHBondContact CB-O 3.15Å; V675-E697 PolarHBondContact N-O 2.69Å; V675-L699 HydrophobicContact CG2-CB 3.9Å; V675-V728 HydrophobicContact CG2-CG1 4.28Å; V675-V728 HydrophobicContact CG2-CG2 4.22Å; V675-I746 HydrophobicContact CB-CD1 4.33Å; V675-I746 HydrophobicContact CG1-CD1 4.09Å; V675-I746 HydrophobicContact CG2-CD1 4.24Å; V675-L750 HydrophobicContact CB-CD1 4.44Å; V675-L750 HydrophobicContact CG1-CD1 3.93Å; V675-L750 HydrophobicContact CG2-CD1 3.61Å
676	N	92.1	Very high	78.9	Confident	74 Å²	74	53.8 Å²	53.8	40%	0.396	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.1	171.8	-174.8	-169.9	24.9	0	0	0	110.2	E697	N676-E697 HydrophobicContact CB-CB 4.14Å; N676-E697 WeakPolarHBondContact CB-OE2 3.4Å; N676-E697 PolarHBondContact N-O 3.41Å; N676-E697 PolarHBondContact O-N 3.01Å
677	F	92	Very high	77.9	Confident	80 Å²	80	52.5 Å²	52.5	35%	0.351	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	154.2	163	69.3	-91.9	0	0	0	110.8	L651 L654 V695 V696	L651-F677 HydrophobicContact CD2-CD2 3.64Å; L651-F677 HydrophobicContact CD2-CE2 3.63Å; L651-F677 HydrophobicContact CD2-CG 4.34Å; L651-F677 HydrophobicContact CD2-CZ 4.3Å; L654-F677 HydrophobicContact CB-CD1 3.81Å; L654-F677 HydrophobicContact CB-CE1 4.23Å; L654-F677 HydrophobicContact CB-CG 4.48Å; L654-F677 VanDerWaalsContact O-CD1 3.32Å; L654-F677 WeakPolarHBondContact O-CD1 3.42Å; F677-V695 CarbonylContact C-O 3.51Å; F677-V695 WeakPolarHBondContact CA-O 3.29Å; F677-V696 HydrophobicContact CB-CG1 4.38Å; F677-V696 HydrophobicContact CB-CG2 4.44Å
678	S	87.3	Confident	76.6	Confident	31 Å²	31	53.2 Å²	53.2	22%	0.217	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	140.9	177.1	62.3	0	0	0	0	111.3	V695	S678-V695 PolarHBondContact N-O 3.38Å; S678-V695 PolarHBondContact O-N 3.27Å
679	K	86	Confident	74.7	Confident	135 Å²	135	60.2 Å²	60.2	59%	0.587	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.5	111.6	163.6	-175.1	-172.2	-176.3	-175.5	0	106.9	P692 Y694	K679-P692 HydrophobicContact CD-CB 4.28Å; K679-P692 HydrophobicContact CG-CB 3.98Å; K679-Y694 HydrophobicContact CB-CD1 4.15Å; K679-Y694 HydrophobicContact CB-CE1 3.74Å; K679-Y694 HydrophobicContact CD-CE1 4.21Å; K679-Y694 HydrophobicContact CG-CD1 4.35Å; K679-Y694 HydrophobicContact CG-CE1 3.74Å
680	K	75.6	Confident	73.3	Confident	113 Å²	113	62.3 Å²	62.3	49%	0.491	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	137.6	170.6	-63.5	-163.2	178.2	-175	0	109.2	L693 V695	K680-L693 PolarHBondContact N-O 3.26Å; K680-L693 PolarHBondContact O-N 3.25Å; K680-V695 HydrophobicContact CD-CG2 4.11Å; K680-V695 HydrophobicContact CG-CG2 4.25Å
681	S	67.9	Low	72.1	Confident	90 Å²	90	68.2 Å²	68.2	63%	0.629	37%	0.369	S	S	*	.			trans	-60.6	139.4	161.1	35.4	0	0	0	0	108.4	V683	S681-V683 PolarHBondContact O-N 2.96Å; S681-V683 VanDerWaalsContact OG-CG2 3.28Å; S681-V683 WeakPolarHBondContact OG-CG2 3.41Å
682	N	59.8	Low	71.1	Confident	36 Å²	36	67.8 Å²	67.8	19%	0.193	37%	0.372	C	S	.	.			trans	-79.3	74	176.4	-168.1	-2.4	0	0	0	109.2	K684 L690 L693	N682-K684 PolarHBondContact O-N 2.76Å; N682-L690 HydrophobicContact CB-CB 4.14Å; N682-L690 WeakPolarHBondContact ND2-CB 3.36Å; N682-L690 WeakPolarHBondContact ND2-CD1 3.34Å; N682-L693 HydrophobicContact CB-CD1 4.35Å; N682-L693 HydrophobicContact CB-CG 4.13Å
683	V	52.4	Low	70.4	Confident	109 Å²	109	71 Å²	71	66%	0.661	39%	0.389	S	S	*	.			trans	-80	60	-175.7	-163.7	0	0	0	0	110.8	S681 P685	S681-V683 PolarHBondContact O-N 2.96Å; S681-V683 VanDerWaalsContact OG-CG2 3.28Å; S681-V683 WeakPolarHBondContact OG-CG2 3.41Å; V683-P685 WeakPolarHBondContact O-CD 3.39Å
684	K	54.8	Low	69.8	Low	93 Å²	93	73.5 Å²	73.5	40%	0.404	40%	0.399	S	S	.	.			trans	-85.8	101.7	152.3	-74.6	-172.7	-176.7	-176.2	0	106.8	N682 N686 S687 E956	N682-K684 PolarHBondContact O-N 2.76Å; K684-N686 PolarHBondContact O-N 3.25Å; K684-S687 WeakPolarHBondContact CB-OG 3.31Å; K684-S687 PolarHBondContact O-N 3.24Å; K684-S687 PolarHBondContact O-OG 3.11Å; K684-E956 IonicContact NZ-OE2 3.51Å; K684-E956 PolarHBondContact NZ-OE2 2.72Å
685	P	51.7	Low	69.4	Low	67 Å²	67	74.2 Å²	74.2	44%	0.435	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-1.3	-174.8	29.4	-35.1	0	0	0	114.3	V683 M921	V683-P685 WeakPolarHBondContact O-CD 3.39Å; P685-M921 HydrophobicContact CG-CE 3.66Å; P685-M921 HydrophobicContact CG-SD 3.56Å; P685-M921 VanDerWaalsContact CG-SD 3.56Å
686	N	47.6	Very low	69.3	Low	22 Å²	22	73 Å²	73	12%	0.118	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	2.2	178.3	-59.2	21	0	0	0	112	K684 Q936 L959 F962	K684-N686 PolarHBondContact O-N 3.25Å; N686-Q936 VanDerWaalsContact CG-NE2 3.3Å; N686-Q936 PolarHBondContact OD1-NE2 3.1Å; N686-Q936 VanDerWaalsContact OD1-NE2 3.11Å; N686-L959 HydrophobicContact CB-CB 4.2Å; N686-L959 PolarHBondContact ND2-O 3.36Å; N686-F962 PolarHBondContact ND2-O 2.96Å
687	S	50.6	Low	69.2	Low	31 Å²	31	72.3 Å²	72.3	22%	0.217	39%	0.39	C	S	.	.	S	Bend	trans	-125.6	160.5	174	49.5	0	0	0	0	110.4	K684 L690	K684-S687 WeakPolarHBondContact CB-OG 3.31Å; K684-S687 PolarHBondContact O-N 3.24Å; K684-S687 PolarHBondContact O-OG 3.11Å; S687-L690 WeakPolarHBondContact OG-CD1 3.49Å
688	G	52.3	Low	69.2	Low	61 Å²	61	68.5 Å²	68.5	63%	0.629	37%	0.373	S	S	*	.			trans	-67.4	-173.2	173.9	0	0	0	0	0	113.1	L690	G688-L690 VanDerWaalsContact C-N 3.27Å; G688-L690 PolarHBondContact O-N 3.17Å
689	E	47.8	Very low	69.5	Low	210 Å²	210	67 Å²	67	98%	0.981	36%	0.363	S	S	*	.	S	Bend	trans	-66.2	85.1	174.9	-67	-165.9	146.8	0	0	111.4
690	L	59.5	Low	69.7	Low	62 Å²	62	60.6 Å²	60.6	33%	0.325	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-70.6	160.7	173.2	-70.1	172	0	0	0	111.4	N682 S687 G688 E956	N682-L690 HydrophobicContact CB-CB 4.14Å; N682-L690 WeakPolarHBondContact ND2-CB 3.36Å; N682-L690 WeakPolarHBondContact ND2-CD1 3.34Å; S687-L690 WeakPolarHBondContact OG-CD1 3.49Å; G688-L690 VanDerWaalsContact C-N 3.27Å; G688-L690 PolarHBondContact O-N 3.17Å; L690-E956 VanDerWaalsContact CD1-OE1 3.3Å; L690-E956 WeakPolarHBondContact CD1-OE1 3.4Å
691	D	64.8	Low	70.5	Confident	145 Å²	145	58.5 Å²	58.5	78%	0.775	32%	0.324	S	S	*	.	P	Polyproline II helix	trans	-53.6	138.2	175.4	-94.9	-47.7	0	0	0	111.8	L693	D691-L693 PolarHBondContact O-N 3.25Å
692	P	73	Confident	71.3	Confident	35 Å²	35	54.2 Å²	54.2	23%	0.227	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-71.9	131.2	-171.7	27.9	-34.5	0	0	0	111.9	K679 Y694	K679-P692 HydrophobicContact CD-CB 4.28Å; K679-P692 HydrophobicContact CG-CB 3.98Å; P692-Y694 HydrophobicContact CG-CE2 4.06Å; P692-Y694 VanDerWaalsContact O-CD2 3.23Å; P692-Y694 WeakPolarHBondContact O-CD2 3.46Å; P692-Y694 WeakPolarHBondContact O-CE2 3.44Å; P692-Y694 PolarHBondContact O-N 3.27Å
693	L	78.5	Confident	72.3	Confident	69 Å²	69	52.9 Å²	52.9	36%	0.361	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	122.1	-179.1	-63.6	175.6	0	0	0	110.8	K680 N682 D691 L732	K680-L693 PolarHBondContact N-O 3.26Å; K680-L693 PolarHBondContact O-N 3.25Å; N682-L693 HydrophobicContact CB-CD1 4.35Å; N682-L693 HydrophobicContact CB-CG 4.13Å; D691-L693 PolarHBondContact O-N 3.25Å; L693-L732 HydrophobicContact CB-CD2 4.47Å; L693-L732 HydrophobicContact CD2-CD2 4.48Å
694	Y	84.7	Confident	73.2	Confident	52 Å²	52	53.8 Å²	53.8	20%	0.204	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	112.5	173.5	-72.3	-85.4	0	0	0	109.9	P647 L651 K679 P692 V733	P647-Y694 HydrophobicContact CB-CD2 3.76Å; P647-Y694 HydrophobicContact CB-CE2 3.86Å; P647-Y694 HydrophobicContact CB-CG 4.26Å; P647-Y694 HydrophobicContact CG-CD2 3.69Å; P647-Y694 HydrophobicContact CG-CE2 4.13Å; P647-Y694 HydrophobicContact CG-CG 4.36Å; L651-Y694 HydrophobicContact CD1-CD1 3.79Å; L651-Y694 HydrophobicContact CD1-CE1 3.46Å; L651-Y694 VanDerWaalsContact CD1-CE1 3.46Å; L651-Y694 HydrophobicContact CD1-CG 4.47Å; L651-Y694 HydrophobicContact CD2-CD1 3.71Å; L651-Y694 HydrophobicContact CD2-CE1 4.1Å; L651-Y694 HydrophobicContact CD2-CG 4.49Å; L651-Y694 HydrophobicContact CG-CD1 4.32Å; L651-Y694 HydrophobicContact CG-CE1 4.42Å; K679-Y694 HydrophobicContact CB-CD1 4.15Å; K679-Y694 HydrophobicContact CB-CE1 3.74Å; K679-Y694 HydrophobicContact CD-CE1 4.21Å; K679-Y694 HydrophobicContact CG-CD1 4.35Å; K679-Y694 HydrophobicContact CG-CE1 3.74Å; P692-Y694 HydrophobicContact CG-CE2 4.06Å; P692-Y694 VanDerWaalsContact O-CD2 3.23Å; P692-Y694 WeakPolarHBondContact O-CD2 3.46Å; P692-Y694 WeakPolarHBondContact O-CE2 3.44Å; P692-Y694 PolarHBondContact O-N 3.27Å; Y694-V733 PolarHBondContact O-N 3.49Å; Y694-V733 VanDerWaalsContact O-N 3.16Å
695	V	86.3	Confident	73.6	Confident	16 Å²	16	50.3 Å²	50.3	10%	0.097	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	123.8	-177.7	-179.2	0	0	0	0	108.8	F677 S678 K680 P730 V731 L732	F677-V695 CarbonylContact C-O 3.51Å; F677-V695 WeakPolarHBondContact CA-O 3.29Å; S678-V695 PolarHBondContact N-O 3.38Å; S678-V695 PolarHBondContact O-N 3.27Å; K680-V695 HydrophobicContact CD-CG2 4.11Å; K680-V695 HydrophobicContact CG-CG2 4.25Å; V695-P730 HydrophobicContact CG1-CB 3.53Å; V695-V731 WeakPolarHBondContact CA-O 3.49Å; V695-L732 HydrophobicContact CG2-CD2 4.24Å
696	V	90.3	Very high	74.1	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.006	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	123.3	-179.8	-166.9	0	0	0	0	108.3	L654 V674 F677 V698 P730 V731 V733 L736	L654-V696 HydrophobicContact CD1-CG1 4.23Å; L654-V696 HydrophobicContact CD1-CG2 3.65Å; L654-V696 HydrophobicContact CD2-CG1 4.44Å; V674-V696 HydrophobicContact CG1-CG1 4.07Å; V674-V696 HydrophobicContact CG2-CG1 4.27Å; F677-V696 HydrophobicContact CB-CG1 4.38Å; F677-V696 HydrophobicContact CB-CG2 4.44Å; V696-V698 HydrophobicContact CB-CG2 4.17Å; V696-V698 HydrophobicContact CG1-CG2 3.7Å; V696-V698 PolarHBondContact O-N 2.99Å; V696-P730 WeakPolarHBondContact O-CA 3.4Å; V696-V731 HydrophobicContact CB-CG2 4.35Å; V696-V731 PolarHBondContact N-O 3.02Å; V696-V731 WeakPolarHBondContact O-CG2 3.39Å; V696-V731 PolarHBondContact O-N 2.67Å; V696-V733 HydrophobicContact CG2-CB 4.41Å; V696-V733 HydrophobicContact CG2-CG2 4.37Å; V696-L736 HydrophobicContact CG2-CD1 4.36Å
697	E	90.4	Very high	74.6	Confident	60 Å²	60	49.6 Å²	49.6	28%	0.28	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	107	174	-71.1	167.9	-157.7	0	0	107.9	V675 N676 V728 P730	V675-E697 HydrophobicContact CB-CB 4.32Å; V675-E697 WeakPolarHBondContact CB-O 3.15Å; V675-E697 PolarHBondContact N-O 2.69Å; N676-E697 HydrophobicContact CB-CB 4.14Å; N676-E697 WeakPolarHBondContact CB-OE2 3.4Å; N676-E697 PolarHBondContact N-O 3.41Å; N676-E697 PolarHBondContact O-N 3.01Å; E697-V728 HydrophobicContact CB-CG1 4Å; E697-P730 HydrophobicContact CG-CB 4.48Å
698	V	92.6	Very high	74.8	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	132	-177.5	-173.1	0	0	0	0	109.4	V660 V662 V673 V696 L700 V729 V731 L736	V660-V698 HydrophobicContact CG2-CG1 3.73Å; V660-V698 HydrophobicContact CG2-CG2 4.09Å; V662-V698 HydrophobicContact CG2-CG1 4.12Å; V662-V698 HydrophobicContact CG2-CG2 4.45Å; V673-V698 WeakPolarHBondContact O-CA 3.2Å; V673-V698 WeakPolarHBondContact O-CG1 3.33Å; V696-V698 HydrophobicContact CB-CG2 4.17Å; V696-V698 HydrophobicContact CG1-CG2 3.7Å; V696-V698 PolarHBondContact O-N 2.99Å; V698-L700 HydrophobicContact CB-CD2 4.42Å; V698-L700 HydrophobicContact CB-CG 4.16Å; V698-L700 HydrophobicContact CG1-CD2 3.64Å; V698-L700 HydrophobicContact CG1-CG 3.85Å; V698-L700 PolarHBondContact O-N 3.31Å; V698-V729 PolarHBondContact N-O 2.65Å; V698-V729 PolarHBondContact O-N 3.28Å; V698-V731 HydrophobicContact CB-CG2 4.41Å; V698-V731 HydrophobicContact CG2-CG2 3.78Å; V698-L736 HydrophobicContact CG2-CD2 4.49Å
699	L	93.3	Very high	74.8	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	107.6	171.6	-172.1	81.2	0	0	0	108.8	G672 V673 V675 M726 Q727 V728 R756 V759	G672-L699 WeakPolarHBondContact CA-O 3.47Å; V673-L699 HydrophobicContact CG1-CB 3.84Å; V673-L699 HydrophobicContact CG1-CD2 4.17Å; V673-L699 PolarHBondContact N-O 3.32Å; V673-L699 PolarHBondContact O-N 3.34Å; V675-L699 HydrophobicContact CG2-CB 3.9Å; L699-M726 HydrophobicContact CD1-CB 4.15Å; L699-M726 HydrophobicContact CD2-CB 4.15Å; L699-M726 HydrophobicContact CD2-CE 3.95Å; L699-M726 HydrophobicContact CG-CB 4.04Å; L699-M726 HydrophobicContact CG-CE 3.98Å; L699-Q727 CarbonylContact C-O 3.5Å; L699-Q727 WeakPolarHBondContact CA-O 3.4Å; L699-V728 HydrophobicContact CD1-CG2 3.52Å; L699-R756 HydrophobicContact CD1-CB 4.17Å; L699-R756 HydrophobicContact CD1-CG 3.8Å; L699-R756 HydrophobicContact CD2-CB 4.44Å; L699-V759 HydrophobicContact CD2-CB 3.84Å; L699-V759 HydrophobicContact CD2-CG1 3.9Å; L699-V759 HydrophobicContact CD2-CG2 4.13Å
700	L	90.9	Very high	74.9	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	153.8	-172.8	-66.4	173.1	0	0	0	112.3	V662 F669 V698 C702 M726 Q727 V729 V731	V662-L700 HydrophobicContact CB-CD1 4.2Å; V662-L700 HydrophobicContact CB-CD2 3.87Å; V662-L700 HydrophobicContact CG1-CD1 4.06Å; V662-L700 HydrophobicContact CG2-CD1 4.33Å; V662-L700 HydrophobicContact CG2-CD2 3.72Å; F669-L700 HydrophobicContact CB-CD1 4.28Å; F669-L700 HydrophobicContact CB-CD2 3.97Å; F669-L700 HydrophobicContact CD1-CB 4.27Å; F669-L700 HydrophobicContact CD1-CD1 3.97Å; F669-L700 HydrophobicContact CG-CD1 4.13Å; V698-L700 HydrophobicContact CB-CD2 4.42Å; V698-L700 HydrophobicContact CB-CG 4.16Å; V698-L700 HydrophobicContact CG1-CD2 3.64Å; V698-L700 HydrophobicContact CG1-CG 3.85Å; V698-L700 PolarHBondContact O-N 3.31Å; L700-C702 PolarHBondContact O-N 3.3Å; L700-C702 VanDerWaalsContact O-N 3.14Å; L700-M726 CarbonylContact O-C 3.59Å; L700-M726 VanDerWaalsContact O-CA 3.32Å; L700-M726 WeakPolarHBondContact O-CA 3.31Å; L700-Q727 PolarHBondContact N-O 2.98Å; L700-Q727 PolarHBondContact O-N 3.47Å; L700-V729 HydrophobicContact CD1-CB 4.2Å; L700-V729 HydrophobicContact CD1-CG2 4.42Å; L700-V731 HydrophobicContact CD1-CG1 4.23Å
701	R	90.6	Very high	74.5	Confident	69 Å²	69	49.2 Å²	49.2	26%	0.26	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	82.8	176.5	-165.9	-172.2	85.8	126.5	5.4	110.8	A718 K719 E722 K723 M726	R701-A718 HydrophobicContact CG-CB 4.15Å; R701-A718 PolarHBondContact NH2-O 3.19Å; R701-A718 PolarHBondContact O-N 2.56Å; R701-K719 PolarHBondContact NH2-O 2.9Å; R701-K719 VanDerWaalsContact NH2-O 3.09Å; R701-E722 PolarHBondContact NH1-O 3.45Å; R701-K723 PolarHBondContact NH1-O 2.86Å; R701-M726 HydrophobicContact CB-SD 3.84Å; R701-M726 HydrophobicContact CG-SD 4.27Å
702	C	85.4	Confident	74.1	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	159.5	-176.5	-58.6	0	0	0	0	112.3	L700 K716 G724 E725 Q727	L700-C702 PolarHBondContact O-N 3.3Å; L700-C702 VanDerWaalsContact O-N 3.14Å; C702-K716 CarbonylContact C-O 3.51Å; C702-K716 VanDerWaalsContact CA-O 3.25Å; C702-K716 WeakPolarHBondContact CA-O 3.29Å; C702-G724 VanDerWaalsContact O-CA 3.3Å; C702-G724 WeakPolarHBondContact O-CA 3.35Å; C702-E725 PolarHBondContact N-O 3.02Å; C702-E725 PolarHBondContact O-N 2.63Å; C702-Q727 HydrophobicContact CB-CB 4.21Å
703	S	81	Confident	73.4	Confident	8 Å²	8	51 Å²	51	6%	0.056	27%	0.266	C	S	.	.			trans	-68	160.4	172.3	78.7	0	0	0	0	111.5	E705 S706 K716 E722	S703-E705 PolarHBondContact O-N 3.26Å; S703-E705 PolarHBondContact OG-N 3.1Å; S703-S706 PolarHBondContact O-N 2.85Å; S703-S706 PolarHBondContact OG-OG 3.43Å; S703-K716 PolarHBondContact N-O 2.94Å; S703-E722 WeakPolarHBondContact CA-OE2 3.29Å; S703-E722 WeakPolarHBondContact CB-OE2 3.27Å
704	K	70.9	Confident	72.5	Confident	129 Å²	129	47.9 Å²	47.9	56%	0.561	25%	0.25	S	C	*	.	S	Bend	trans	-64.4	-20.2	173.9	-74	173.6	175	179.8	0	114.1	E722	K704-E722 WeakPolarHBondContact CG-OE1 3.28Å; K704-E722 PolarHBondContact N-OE1 3.18Å
705	E	63.8	Low	71.9	Confident	20 Å²	20	46.1 Å²	46.1	9%	0.093	25%	0.246	C	C	.	.	S	Bend	trans	-72.8	-40.8	179.5	-176.5	177.3	-135.5	0	0	111.3	R502 F509 S703 L707 K708	R502-E705 WeakPolarHBondContact CD-OE1 3.05Å; R502-E705 IonicContact CZ-OE1 3.82Å; R502-E705 IonicContact CZ-OE2 3.58Å; R502-E705 IonicContact NE-OE1 3.59Å; R502-E705 PolarHBondContact NE-OE1 2.9Å; R502-E705 IonicContact NH1-OE1 3.45Å; R502-E705 PolarHBondContact NH1-OE1 3.22Å; R502-E705 VanDerWaalsContact NH1-OE1 3.16Å; R502-E705 IonicContact NH1-OE2 3.72Å; R502-E705 PolarHBondContact NH1-OE2 2.69Å; R502-E705 IonicContact NH2-OE1 2.71Å; R502-E705 PolarHBondContact NH2-OE1 2.66Å; R502-E705 IonicContact NH2-OE2 2.84Å; R502-E705 PolarHBondContact NH2-OE2 3.01Å; F509-E705 HydrophobicContact CD1-CG 4.22Å; F509-E705 VanDerWaalsContact CD1-OE1 3.24Å; F509-E705 WeakPolarHBondContact CD1-OE1 3.39Å; F509-E705 HydrophobicContact CD2-CG 4.44Å; F509-E705 HydrophobicContact CE1-CG 4.34Å; F509-E705 HydrophobicContact CG-CG 4.26Å; F509-E705 HydrophobicContact CZ-CG 4.5Å; S703-E705 PolarHBondContact O-N 3.26Å; S703-E705 PolarHBondContact OG-N 3.1Å; E705-L707 PolarHBondContact O-N 3.36Å; E705-K708 WeakPolarHBondContact O-CB 3.46Å; E705-K708 PolarHBondContact O-N 2.59Å
706	S	62	Low	71.5	Confident	3 Å²	3	47.4 Å²	47.4	2%	0.021	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-12.7	176.4	-59.4	0	0	0	0	114.8	S703 K708 A714 A715 K716 Q727	S703-S706 PolarHBondContact O-N 2.85Å; S703-S706 PolarHBondContact OG-OG 3.43Å; S706-K708 VanDerWaalsContact C-N 3.35Å; S706-A714 VanDerWaalsContact CB-O 3.31Å; S706-A714 WeakPolarHBondContact CB-O 3.45Å; S706-A714 PolarHBondContact OG-O 3.44Å; S706-A715 WeakPolarHBondContact OG-CA 3.36Å; S706-K716 PolarHBondContact OG-N 3.03Å; S706-Q727 PolarHBondContact O-NE2 3.29Å
707	L	58.7	Low	71.2	Confident	70 Å²	70	48.5 Å²	48.5	37%	0.366	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-14.7	173.5	-58	172.3	0	0	0	113.1	E705 E725 Q727	E705-L707 PolarHBondContact O-N 3.36Å; L707-E725 HydrophobicContact CD1-CB 4.03Å; L707-E725 HydrophobicContact CD1-CG 4.47Å; L707-Q727 HydrophobicContact CD2-CB 4.49Å; L707-Q727 HydrophobicContact CD2-CG 4.42Å
708	K	54.3	Low	70.9	Confident	118 Å²	118	46.1 Å²	46.1	51%	0.513	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-37	-175.9	-65.1	-178.2	171.1	-175	0	113.5	D540 E705 S706	D540-K708 IonicContact OD2-NZ 2.91Å; D540-K708 PolarHBondContact OD2-NZ 2.96Å; E705-K708 WeakPolarHBondContact O-CB 3.46Å; E705-K708 PolarHBondContact O-N 2.59Å; S706-K708 VanDerWaalsContact C-N 3.35Å
709	N	51.7	Low	70.3	Confident	57 Å²	57	50.2 Å²	50.2	31%	0.305	27%	0.266	S	S	.	.			trans	-89.5	139.9	178.5	-93.9	16.4	0	0	0	111.3	F509 A711 A714	F509-N709 HydrophobicContact CE2-CB 4.32Å; F509-N709 WeakPolarHBondContact CE2-ND2 3.11Å; F509-N709 HydrophobicContact CZ-CB 4.44Å; F509-N709 WeakPolarHBondContact CZ-ND2 3.32Å; N709-A711 VanDerWaalsContact C-N 3.31Å; N709-A714 HydrophobicContact CB-CB 3.52Å
710	S	49.7	Very low	69.2	Low	134 Å²	134	56.7 Å²	56.7	94%	0.937	31%	0.308	S	S	*	.			trans	-83.7	-3.6	174.8	-45.6	0	0	0	0	114
711	A	52.4	Low	68.2	Low	47 Å²	47	62.4 Å²	62.4	39%	0.388	34%	0.339	S	S	.	.	S	Bend	trans	-86.6	133.5	-179.1	0	0	0	0	0	111.5	N709 E713 A714	N709-A711 VanDerWaalsContact C-N 3.31Å; A711-E713 PolarHBondContact O-N 3.43Å; A711-A714 WeakPolarHBondContact O-CB 3.34Å; A711-A714 PolarHBondContact O-N 3.38Å; A711-A714 VanDerWaalsContact O-N 3.12Å
712	T	56.2	Low	67.4	Low	79 Å²	79	60.7 Å²	60.7	49%	0.485	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-55.5	-38.1	-179.9	-53.1	0	0	0	0	113.2	A714 A715 V729 P730	T712-A714 PolarHBondContact O-N 3.27Å; T712-A715 WeakPolarHBondContact O-CB 3.38Å; T712-A715 PolarHBondContact O-N 3.42Å; T712-V729 HydrophobicContact CG2-CG1 4.49Å; T712-P730 HydrophobicContact CG2-CG 3.83Å; T712-P730 WeakPolarHBondContact CG2-O 3.29Å
713	E	56.8	Low	66.8	Low	139 Å²	139	67.3 Å²	67.3	65%	0.65	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-67	-17.6	-177.6	-69.1	145.5	-176.4	0	0	113.2	A711 A715	A711-E713 PolarHBondContact O-N 3.43Å; E713-A715 PolarHBondContact O-N 2.84Å
714	A	59.8	Low	66.5	Low	3 Å²	3	67.3 Å²	67.3	3%	0.025	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-75.9	-1.3	175.7	0	0	0	0	0	114.1	F509 S706 N709 A711 T712 K716	F509-A714 HydrophobicContact CD2-CB 4.5Å; F509-A714 HydrophobicContact CE2-CB 3.95Å; S706-A714 VanDerWaalsContact CB-O 3.31Å; S706-A714 WeakPolarHBondContact CB-O 3.45Å; S706-A714 PolarHBondContact OG-O 3.44Å; N709-A714 HydrophobicContact CB-CB 3.52Å; A711-A714 WeakPolarHBondContact O-CB 3.34Å; A711-A714 PolarHBondContact O-N 3.38Å; A711-A714 VanDerWaalsContact O-N 3.12Å; T712-A714 PolarHBondContact O-N 3.27Å; A714-K716 PolarHBondContact O-N 3.29Å
715	A	72.2	Confident	67.1	Low	16 Å²	16	63.2 Å²	63.2	13%	0.132	35%	0.346	C	S	.	.			trans	-69.9	121.6	176.6	0	0	0	0	0	111.3	F669 S706 T712 E713 V729	F669-A715 HydrophobicContact CE1-CB 4.45Å; F669-A715 WeakPolarHBondContact CZ-O 3.42Å; S706-A715 WeakPolarHBondContact OG-CA 3.36Å; T712-A715 WeakPolarHBondContact O-CB 3.38Å; T712-A715 PolarHBondContact O-N 3.42Å; E713-A715 PolarHBondContact O-N 2.84Å; A715-V729 HydrophobicContact CB-CG1 3.77Å; A715-V729 HydrophobicContact CB-CG2 4.07Å
716	K	78.5	Confident	68.2	Low	42 Å²	42	62.3 Å²	62.3	18%	0.183	34%	0.342	C	S	.	.			trans	-133.7	148.8	178.2	-71.3	-63.4	-170.6	-179	0	111	D508 D667 F669 C702 S703 S706 A714	D508-K716 WeakPolarHBondContact OD1-CE 3.42Å; D508-K716 IonicContact OD1-NZ 3.15Å; D508-K716 PolarHBondContact OD1-NZ 2.86Å; D667-K716 WeakPolarHBondContact OD2-CD 3.37Å; D667-K716 WeakPolarHBondContact OD2-CE 3.28Å; D667-K716 IonicContact OD2-NZ 2.6Å; D667-K716 PolarHBondContact OD2-NZ 2.61Å; F669-K716 VanDerWaalsContact CE1-C 3.45Å; C702-K716 CarbonylContact C-O 3.51Å; C702-K716 VanDerWaalsContact CA-O 3.25Å; C702-K716 WeakPolarHBondContact CA-O 3.29Å; S703-K716 PolarHBondContact N-O 2.94Å; S706-K716 PolarHBondContact OG-N 3.03Å; A714-K716 PolarHBondContact O-N 3.29Å
717	P	84.7	Confident	69.3	Low	25 Å²	25	64.2 Å²	64.2	16%	0.162	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-67.7	143.8	-179.5	29.3	-36.1	0	0	0	111.3	D667 F669 K719	D667-P717 HydrophobicContact CB-CG 3.91Å; D667-P717 WeakPolarHBondContact OD1-CD 3.49Å; F669-P717 HydrophobicContact CD1-CB 4.1Å; F669-P717 HydrophobicContact CE1-CB 4.49Å; F669-P717 HydrophobicContact CG-CB 4.21Å; P717-K719 PolarHBondContact O-N 3.35Å
718	A	83.9	Confident	70.6	Confident	10 Å²	10	63.3 Å²	63.3	8%	0.083	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-67.4	131.8	173	0	0	0	0	0	111.2	R701 E722 G724	R701-A718 HydrophobicContact CG-CB 4.15Å; R701-A718 PolarHBondContact NH2-O 3.19Å; R701-A718 PolarHBondContact O-N 2.56Å; A718-E722 WeakPolarHBondContact CA-OE2 3.4Å; A718-E722 HydrophobicContact CB-CB 4.41Å; A718-G724 VanDerWaalsContact CB-CA 3.44Å
719	K	78.8	Confident	72.1	Confident	86 Å²	86	58.1 Å²	58.1	37%	0.374	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-62.3	162.2	-176.9	-67.7	170.8	-178.6	167.5	0	112.3	E541 R701 P717 D721 E722	E541-K719 IonicContact OE1-NZ 2.68Å; E541-K719 PolarHBondContact OE1-NZ 3.34Å; E541-K719 IonicContact OE2-NZ 2.96Å; E541-K719 PolarHBondContact OE2-NZ 3.05Å; R701-K719 PolarHBondContact NH2-O 2.9Å; R701-K719 VanDerWaalsContact NH2-O 3.09Å; P717-K719 PolarHBondContact O-N 3.35Å; K719-D721 VanDerWaalsContact C-N 3.3Å; K719-D721 PolarHBondContact O-N 3.35Å; K719-E722 HydrophobicContact CB-CB 4.04Å; K719-E722 PolarHBondContact N-OE2 3.39Å; K719-E722 WeakPolarHBondContact O-CB 3.26Å; K719-E722 PolarHBondContact O-N 3.49Å
720	P	71.1	Confident	73.7	Confident	136 Å²	136	57.7 Å²	57.7	88%	0.883	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-34.1	-176.9	-25.7	35.9	0	0	0	114.4
721	D	69.4	Low	75.5	Confident	119 Å²	119	51.9 Å²	51.9	64%	0.636	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-5	174.1	60.8	-28.9	0	0	0	113.4	K542 K719	K542-D721 IonicContact NZ-OD2 2.97Å; K719-D721 VanDerWaalsContact C-N 3.3Å; K719-D721 PolarHBondContact O-N 3.35Å
722	E	74.9	Confident	77.1	Confident	33 Å²	33	52.6 Å²	52.6	15%	0.154	28%	0.282	C	S	.	.			trans	-92.8	137.5	177.7	-160.1	-168.1	177.1	0	0	112	R701 S703 K704 A718 K719 G724	R701-E722 PolarHBondContact NH1-O 3.45Å; S703-E722 WeakPolarHBondContact CA-OE2 3.29Å; S703-E722 WeakPolarHBondContact CB-OE2 3.27Å; K704-E722 WeakPolarHBondContact CG-OE1 3.28Å; K704-E722 PolarHBondContact N-OE1 3.18Å; A718-E722 WeakPolarHBondContact CA-OE2 3.4Å; A718-E722 HydrophobicContact CB-CB 4.41Å; K719-E722 HydrophobicContact CB-CB 4.04Å; K719-E722 PolarHBondContact N-OE2 3.39Å; K719-E722 WeakPolarHBondContact O-CB 3.26Å; K719-E722 PolarHBondContact O-N 3.49Å; E722-G724 VanDerWaalsContact C-N 3.29Å; E722-G724 PolarHBondContact O-N 2.88Å
723	K	71.9	Confident	78.7	Confident	140 Å²	140	49.5 Å²	49.5	61%	0.609	26%	0.263	S	S	*	.			trans	-63	-35.4	173.6	-170.5	-179.2	179.1	-173.9	0	112.5	R701	R701-K723 PolarHBondContact NH1-O 2.86Å
724	G	75.6	Confident	80.1	Confident	7 Å²	7	47.8 Å²	47.8	7%	0.072	26%	0.255	C	S	.	.			trans	67.8	168	-170	0	0	0	0	0	114.1	C702 A718 E722	C702-G724 VanDerWaalsContact O-CA 3.3Å; C702-G724 WeakPolarHBondContact O-CA 3.35Å; A718-G724 VanDerWaalsContact CB-CA 3.44Å; E722-G724 VanDerWaalsContact C-N 3.29Å; E722-G724 PolarHBondContact O-N 2.88Å
725	E	82.9	Confident	81.5	Confident	43 Å²	43	48.9 Å²	48.9	20%	0.201	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	144.8	162.9	-173.7	168	141.7	0	0	109.5	C702 L707 Q727 V753 R756	C702-E725 PolarHBondContact N-O 3.02Å; C702-E725 PolarHBondContact O-N 2.63Å; L707-E725 HydrophobicContact CD1-CB 4.03Å; L707-E725 HydrophobicContact CD1-CG 4.47Å; E725-Q727 PolarHBondContact O-N 3Å; E725-V753 HydrophobicContact CG-CG1 4.43Å; E725-R756 IonicContact OE1-CZ 2.94Å; E725-R756 IonicContact OE1-NH1 3.19Å; E725-R756 PolarHBondContact OE1-NH1 3.29Å; E725-R756 IonicContact OE1-NH2 2.64Å; E725-R756 PolarHBondContact OE1-NH2 2.7Å
726	M	86.5	Confident	82.4	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	115.1	173.8	-67	-58.3	-79.4	0	0	109.8	L699 L700 R701 R756 L760 I763	L699-M726 HydrophobicContact CD1-CB 4.15Å; L699-M726 HydrophobicContact CD2-CB 4.15Å; L699-M726 HydrophobicContact CD2-CE 3.95Å; L699-M726 HydrophobicContact CG-CB 4.04Å; L699-M726 HydrophobicContact CG-CE 3.98Å; L700-M726 CarbonylContact O-C 3.59Å; L700-M726 VanDerWaalsContact O-CA 3.32Å; L700-M726 WeakPolarHBondContact O-CA 3.31Å; R701-M726 HydrophobicContact CB-SD 3.84Å; R701-M726 HydrophobicContact CG-SD 4.27Å; M726-R756 HydrophobicContact CB-CB 3.88Å; M726-R756 WeakPolarHBondContact CG-O 3.38Å; M726-R756 VanDerWaalsContact O-CD 3.31Å; M726-R756 WeakPolarHBondContact O-CD 3.31Å; M726-R756 PolarHBondContact O-NH1 2.97Å; M726-L760 HydrophobicContact CE-CB 4.44Å; M726-L760 HydrophobicContact CG-CB 3.68Å; M726-L760 HydrophobicContact CG-CD2 4.39Å; M726-L760 HydrophobicContact CG-CG 4.45Å; M726-L760 HydrophobicContact SD-CB 3.9Å; M726-L760 HydrophobicContact SD-CD1 3.84Å; M726-L760 HydrophobicContact SD-CD2 4.39Å; M726-L760 HydrophobicContact SD-CG 4.25Å; M726-I763 HydrophobicContact CE-CD1 3.62Å
727	Q	84.9	Confident	82.9	Confident	44 Å²	44	46.8 Å²	46.8	21%	0.206	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	141.6	-178.3	-175.1	173.1	1.1	0	0	110	L699 L700 C702 S706 L707 E725 V729	L699-Q727 CarbonylContact C-O 3.5Å; L699-Q727 WeakPolarHBondContact CA-O 3.4Å; L700-Q727 PolarHBondContact N-O 2.98Å; L700-Q727 PolarHBondContact O-N 3.47Å; C702-Q727 HydrophobicContact CB-CB 4.21Å; S706-Q727 PolarHBondContact O-NE2 3.29Å; L707-Q727 HydrophobicContact CD2-CB 4.49Å; L707-Q727 HydrophobicContact CD2-CG 4.42Å; E725-Q727 PolarHBondContact O-N 3Å; Q727-V729 HydrophobicContact CB-CG2 4.44Å; Q727-V729 HydrophobicContact CG-CG2 4.28Å; Q727-V729 PolarHBondContact O-N 3.27Å
728	V	87.5	Confident	83.2	Confident	50 Å²	50	46.2 Å²	46.2	30%	0.303	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	113.8	173.4	-176.2	0	0	0	0	107.6	V675 E697 L699 L750	V675-V728 HydrophobicContact CG2-CG1 4.28Å; V675-V728 HydrophobicContact CG2-CG2 4.22Å; E697-V728 HydrophobicContact CB-CG1 4Å; L699-V728 HydrophobicContact CD1-CG2 3.52Å; V728-L750 HydrophobicContact CG2-CD1 4.25Å
729	V	85.1	Confident	83.7	Confident	9 Å²	9	46 Å²	46	6%	0.055	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	125.3	-178.8	-174.5	0	0	0	0	108.7	V698 L700 T712 A715 Q727 V731	V698-V729 PolarHBondContact N-O 2.65Å; V698-V729 PolarHBondContact O-N 3.28Å; L700-V729 HydrophobicContact CD1-CB 4.2Å; L700-V729 HydrophobicContact CD1-CG2 4.42Å; T712-V729 HydrophobicContact CG2-CG1 4.49Å; A715-V729 HydrophobicContact CB-CG1 3.77Å; A715-V729 HydrophobicContact CB-CG2 4.07Å; Q727-V729 HydrophobicContact CB-CG2 4.44Å; Q727-V729 HydrophobicContact CG-CG2 4.28Å; Q727-V729 PolarHBondContact O-N 3.27Å; V729-V731 HydrophobicContact CB-CG1 4.33Å; V729-V731 HydrophobicContact CG1-CG1 3.84Å; V729-V731 PolarHBondContact O-N 3.19Å
730	P	84.9	Confident	84.5	Confident	48 Å²	48	41.9 Å²	41.9	31%	0.312	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	110.1	169.9	28.3	-28.5	0	0	0	109.7	V695 V696 E697 T712	V695-P730 HydrophobicContact CG1-CB 3.53Å; V696-P730 WeakPolarHBondContact O-CA 3.4Å; E697-P730 HydrophobicContact CG-CB 4.48Å; T712-P730 HydrophobicContact CG2-CG 3.83Å; T712-P730 WeakPolarHBondContact CG2-O 3.29Å
731	V	86.9	Confident	85.5	Confident	13 Å²	13	38 Å²	38	8%	0.079	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	150.8	-179.7	-61.4	0	0	0	0	111.5	V662 V695 V696 V698 L700 V729 L735 L736	V662-V731 HydrophobicContact CG1-CG1 4.25Å; V662-V731 HydrophobicContact CG1-CG2 4.46Å; V695-V731 WeakPolarHBondContact CA-O 3.49Å; V696-V731 HydrophobicContact CB-CG2 4.35Å; V696-V731 PolarHBondContact N-O 3.02Å; V696-V731 WeakPolarHBondContact O-CG2 3.39Å; V696-V731 PolarHBondContact O-N 2.67Å; V698-V731 HydrophobicContact CB-CG2 4.41Å; V698-V731 HydrophobicContact CG2-CG2 3.78Å; L700-V731 HydrophobicContact CD1-CG1 4.23Å; V729-V731 HydrophobicContact CB-CG1 4.33Å; V729-V731 HydrophobicContact CG1-CG1 3.84Å; V729-V731 PolarHBondContact O-N 3.19Å; V731-L735 HydrophobicContact CB-CD1 4.22Å; V731-L736 HydrophobicContact CG2-CD2 4.41Å
732	L	86.5	Confident	86.6	Confident	62 Å²	62	33.5 Å²	33.5	33%	0.325	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	145.3	172.2	-68.2	175.7	0	0	0	110.6	L693 V695 H734 L735	L693-L732 HydrophobicContact CB-CD2 4.47Å; L693-L732 HydrophobicContact CD2-CD2 4.48Å; V695-L732 HydrophobicContact CG2-CD2 4.24Å; L732-H734 PolarHBondContact O-N 2.9Å; L732-H734 VanDerWaalsContact O-N 3.14Å; L732-L735 HydrophobicContact CB-CD1 4.38Å; L732-L735 HydrophobicContact CB-CG 4.44Å; L732-L735 WeakPolarHBondContact O-CB 3.48Å; L732-L735 PolarHBondContact O-N 2.91Å
733	V	89.1	Confident	87.5	Confident	13 Å²	13	38.4 Å²	38.4	8%	0.079	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-58.2	-30.8	-172.7	73.3	0	0	0	0	114.4	P647 C650 Y694 V696 L735 L736	P647-V733 HydrophobicContact CG-CG1 4.21Å; C650-V733 WeakPolarHBondContact SG-CG2 3.48Å; Y694-V733 PolarHBondContact O-N 3.49Å; Y694-V733 VanDerWaalsContact O-N 3.16Å; V696-V733 HydrophobicContact CG2-CB 4.41Å; V696-V733 HydrophobicContact CG2-CG2 4.37Å; V733-L735 PolarHBondContact O-N 3.5Å; V733-L736 HydrophobicContact CG2-CD1 4.26Å; V733-L736 WeakPolarHBondContact O-CB 3.45Å; V733-L736 VanDerWaalsContact O-CG 3.3Å; V733-L736 WeakPolarHBondContact O-CG 3.37Å; V733-L736 PolarHBondContact O-N 3.31Å
734	H	87.3	Confident	88.5	Confident	103 Å²	103	33 Å²	33	48%	0.477	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-70.9	-13	178.1	64.6	-113.6	0	0	0	113.9	H645 L732 L736	H645-H734 PolarHBondContact CE1-O 2.9Å; H645-H734 PolarHBondContact ND1-O 3.36Å; H645-H734 VanDerWaalsContact ND1-O 3.16Å; L732-H734 PolarHBondContact O-N 2.9Å; L732-H734 VanDerWaalsContact O-N 3.14Å; H734-L736 PolarHBondContact O-N 2.87Å
735	L	89.4	Confident	89.2	Confident	26 Å²	26	41.4 Å²	41.4	14%	0.136	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-81	-3.6	174.6	-56.3	176.4	0	0	0	112.2	V662 K663 N664 V731 L732 V733 S737	V662-L735 WeakPolarHBondContact CA-O 3.47Å; V662-L735 HydrophobicContact CG1-CB 4.32Å; K663-L735 PolarHBondContact N-O 3.22Å; N664-L735 HydrophobicContact CB-CD2 4.09Å; N664-L735 WeakPolarHBondContact OD1-CD2 3.29Å; V731-L735 HydrophobicContact CB-CD1 4.22Å; L732-L735 HydrophobicContact CB-CD1 4.38Å; L732-L735 HydrophobicContact CB-CG 4.44Å; L732-L735 WeakPolarHBondContact O-CB 3.48Å; L732-L735 PolarHBondContact O-N 2.91Å; V733-L735 PolarHBondContact O-N 3.5Å; L735-S737 PolarHBondContact O-N 3.44Å
736	L	90.6	Very high	89.6	Confident	2 Å²	2	41.3 Å²	41.3	1%	0.01	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	113.6	169.9	-54.5	-174.6	0	0	0	109	H645 L654 V660 K661 V662 V696 V698 V731 V733 H734	H645-L736 HydrophobicContact CB-CB 4.47Å; H645-L736 PolarHBondContact ND1-O 3.05Å; L654-L736 HydrophobicContact CD1-CD1 4.38Å; L654-L736 HydrophobicContact CD2-CD1 3.71Å; V660-L736 HydrophobicContact CB-CD2 4.3Å; V660-L736 HydrophobicContact CG2-CD2 4.25Å; K661-L736 WeakPolarHBondContact O-CA 3.44Å; V662-L736 HydrophobicContact CG2-CD2 3.83Å; V696-L736 HydrophobicContact CG2-CD1 4.36Å; V698-L736 HydrophobicContact CG2-CD2 4.49Å; V731-L736 HydrophobicContact CG2-CD2 4.41Å; V733-L736 HydrophobicContact CG2-CD1 4.26Å; V733-L736 WeakPolarHBondContact O-CB 3.45Å; V733-L736 VanDerWaalsContact O-CG 3.3Å; V733-L736 WeakPolarHBondContact O-CG 3.37Å; V733-L736 PolarHBondContact O-N 3.31Å; H734-L736 PolarHBondContact O-N 2.87Å
737	S	89.1	Confident	89.7	Confident	13 Å²	13	42.3 Å²	42.3	9%	0.091	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	-20.6	177.5	99.1	0	0	0	0	112.6	E641 K661 L735	E641-S737 WeakPolarHBondContact CG-O 3.35Å; K661-S737 PolarHBondContact O-N 3.35Å; L735-S737 PolarHBondContact O-N 3.44Å
738	A	91.1	Very high	89.7	Confident	12 Å²	12	50.3 Å²	50.3	10%	0.099	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	150	175.2	0	0	0	0	0	112.2	V660 K661 W671 L776	V660-A738 CarbonylContact C-O 3.59Å; V660-A738 WeakPolarHBondContact CA-O 3.1Å; K661-A738 HydrophobicContact CB-CB 3.84Å; K661-A738 PolarHBondContact N-O 2.9Å; W671-A738 HydrophobicContact CH2-CB 4.11Å; A738-L776 HydrophobicContact CB-CD2 4Å
739	I	94.1	Very high	89.6	Confident	6 Å²	6	50.4 Å²	50.4	3%	0.031	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	132.6	174.3	-50.8	178.6	0	0	0	107.8	I644 C650 F653 R658 V660 L776 L777 M783	I644-I739 HydrophobicContact CG2-CD1 4.04Å; I644-I739 HydrophobicContact CG2-CG1 4.2Å; C650-I739 HydrophobicContact CB-CD1 3.68Å; F653-I739 HydrophobicContact CB-CG2 4.31Å; R658-I739 HydrophobicContact CG-CG2 3.96Å; V660-I739 HydrophobicContact CG1-CG1 4.33Å; V660-I739 HydrophobicContact CG1-CG2 4.23Å; I739-L776 WeakPolarHBondContact O-CA 3.31Å; I739-L777 HydrophobicContact CB-CD1 4.21Å; I739-L777 HydrophobicContact CG2-CD1 3.59Å; I739-L777 HydrophobicContact CG2-CG 4.43Å; I739-L777 PolarHBondContact O-N 3.22Å; I739-M783 HydrophobicContact CD1-CE 4.34Å
740	S	94.9	Very high	89.6	Confident	0 Å²	0	51 Å²	51	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	148.6	-176.6	173.9	0	0	0	0	113	R658 L659 V742 I774 P775	R658-S740 WeakPolarHBondContact CD-O 3.21Å; R658-S740 PolarHBondContact NH1-O 2.9Å; L659-S740 PolarHBondContact O-N 3.35Å; S740-V742 PolarHBondContact O-N 3.5Å; S740-V742 WeakPolarHBondContact OG-CB 3.48Å; S740-V742 PolarHBondContact OG-N 3.34Å; S740-I774 WeakPolarHBondContact OG-CG2 3.31Å; S740-P775 WeakPolarHBondContact CA-O 2.95Å; S740-P775 VanDerWaalsContact CB-O 3.29Å; S740-P775 WeakPolarHBondContact CB-O 3.47Å; S740-P775 PolarHBondContact OG-O 2.9Å
741	S	92.9	Very high	89.4	Confident	54 Å²	54	58.2 Å²	58.2	38%	0.378	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	-23.8	168	53.1	0	0	0	0	112.9	R658 P775	R658-S741 PolarHBondContact NH1-O 3.39Å; S741-P775 PolarHBondContact N-O 2.74Å; S741-P775 PolarHBondContact OG-O 2.78Å
742	V	93.6	Very high	89.4	Confident	24 Å²	24	60.1 Å²	60.1	15%	0.145	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	136.7	-179.1	-177.8	0	0	0	0	112.4	L659 S740 V766 F770 I774 P775	L659-V742 HydrophobicContact CD1-CB 4.07Å; L659-V742 HydrophobicContact CD1-CG1 3.87Å; L659-V742 HydrophobicContact CG-CB 4.48Å; L659-V742 HydrophobicContact CG-CG1 4.35Å; L659-V742 PolarHBondContact N-O 2.98Å; L659-V742 VanDerWaalsContact N-O 3.13Å; S740-V742 PolarHBondContact O-N 3.5Å; S740-V742 WeakPolarHBondContact OG-CB 3.48Å; S740-V742 PolarHBondContact OG-N 3.34Å; V742-V766 HydrophobicContact CG1-CG1 4.2Å; V742-V766 HydrophobicContact CG1-CG2 4.05Å; V742-V766 HydrophobicContact CG2-CG1 4.33Å; V742-F770 HydrophobicContact CG2-CE2 4.47Å; V742-I774 HydrophobicContact CG2-CG2 4Å; V742-P775 HydrophobicContact CG2-CG 4.01Å
743	R	93.2	Very high	89.1	Confident	136 Å²	136	60.2 Å²	60.2	51%	0.513	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	130.5	166.8	-64.1	-176.7	65.8	-164.7	-2.9	110.8	P656 G657	P656-R743 PolarHBondContact O-NH2 2.82Å; G657-R743 CarbonylContact O-C 3.49Å; G657-R743 VanDerWaalsContact O-CA 3.26Å; G657-R743 WeakPolarHBondContact O-CA 3.1Å
744	L	92.4	Very high	89	Confident	28 Å²	28	65 Å²	65	15%	0.147	31%	0.309	C	S	.	.			trans	-95	157	175.3	-69.4	-177.1	0	0	0	112.2	G657 L659 I763 V766	G657-L744 WeakPolarHBondContact CA-O 3.25Å; G657-L744 PolarHBondContact O-N 2.9Å; L659-L744 HydrophobicContact CD2-CD1 3.72Å; L659-L744 HydrophobicContact CD2-CG 4.2Å; L659-L744 HydrophobicContact CG-CD1 4.32Å; L659-L744 HydrophobicContact CG-CG 4.29Å; L744-I763 HydrophobicContact CD1-CG1 3.66Å; L744-V766 HydrophobicContact CD2-CG2 3.69Å
745	Y	91	Very high	89	Confident	182 Å²	182	62.8 Å²	62.8	71%	0.714	30%	0.301	S	S	*	.			trans	-72.8	125.2	165.4	178.6	-92.5	0	0	0	110.4
746	I	90.3	Very high	88.9	Confident	41 Å²	41	63 Å²	63	21%	0.21	30%	0.3	C	S	.	.			trans	-105.7	124.1	177.3	165	169	0	0	0	109.3	P656 V675 L750	P656-I746 HydrophobicContact CB-CG2 4.46Å; V675-I746 HydrophobicContact CB-CD1 4.33Å; V675-I746 HydrophobicContact CG1-CD1 4.09Å; V675-I746 HydrophobicContact CG2-CD1 4.24Å; I746-L750 HydrophobicContact CD1-CD1 3.8Å; I746-L750 HydrophobicContact CG1-CD1 4.22Å; I746-L750 HydrophobicContact CG1-CD2 4.46Å; I746-L750 HydrophobicContact CG1-CG 4.49Å
747	P	89.1	Confident	88.7	Confident	22 Å²	22	64.8 Å²	64.8	14%	0.143	31%	0.308	C	S	.	.			trans	-58.9	140.5	171.5	-24.7	34.3	0	0	0	112.3	D749 L750 N755 V759	P747-D749 PolarHBondContact O-N 3.16Å; P747-D749 VanDerWaalsContact O-N 3.12Å; P747-L750 HydrophobicContact CB-CD2 4.35Å; P747-L750 HydrophobicContact CG-CD2 4.42Å; P747-N755 HydrophobicContact CB-CB 4.15Å; P747-N755 HydrophobicContact CG-CB 4.3Å; P747-V759 HydrophobicContact CG-CG2 4.36Å
748	K	84.6	Confident	88.7	Confident	213 Å²	213	66.9 Å²	66.9	93%	0.926	32%	0.323	S	S	*	.	S	Bend	trans	-63.4	-16.6	-178	-69.1	-172	176.4	-175.6	0	115.3
749	D	85.2	Confident	88.7	Confident	52 Å²	52	66.4 Å²	66.4	28%	0.278	32%	0.319	S	S	.	.			trans	-131.7	114.9	174.8	-171.5	-8.8	0	0	0	109.1	P747 R751 N755	P747-D749 PolarHBondContact O-N 3.16Å; P747-D749 VanDerWaalsContact O-N 3.12Å; D749-R751 VanDerWaalsContact OD1-CB 3.31Å; D749-R751 WeakPolarHBondContact OD1-CB 3.44Å; D749-R751 WeakPolarHBondContact OD1-CG 3.33Å; D749-R751 IonicContact OD1-CZ 2.71Å; D749-R751 PolarHBondContact OD1-N 2.97Å; D749-R751 IonicContact OD1-NE 3.47Å; D749-R751 PolarHBondContact OD1-NE 3.23Å; D749-R751 IonicContact OD1-NH2 2.75Å; D749-R751 IonicContact OD2-CZ 3.39Å; D749-R751 IonicContact OD2-NE 2.77Å; D749-R751 PolarHBondContact OD2-NE 3.12Å; D749-R751 IonicContact OD2-NH2 3.09Å; D749-R751 PolarHBondContact OD2-NH2 3.49Å; D749-N755 WeakPolarHBondContact O-CB 3.36Å; D749-N755 PolarHBondContact O-ND2 3.41Å
750	L	85	Confident	88.5	Confident	22 Å²	22	66.8 Å²	66.8	12%	0.115	32%	0.321	C	S	.	.			trans	-99.2	6.9	177.7	-66.8	-177	0	0	0	113.1	V675 V728 I746 P747 R756	V675-L750 HydrophobicContact CB-CD1 4.44Å; V675-L750 HydrophobicContact CG1-CD1 3.93Å; V675-L750 HydrophobicContact CG2-CD1 3.61Å; V728-L750 HydrophobicContact CG2-CD1 4.25Å; I746-L750 HydrophobicContact CD1-CD1 3.8Å; I746-L750 HydrophobicContact CG1-CD1 4.22Å; I746-L750 HydrophobicContact CG1-CD2 4.46Å; I746-L750 HydrophobicContact CG1-CG 4.49Å; P747-L750 HydrophobicContact CB-CD2 4.35Å; P747-L750 HydrophobicContact CG-CD2 4.42Å; L750-R756 HydrophobicContact CB-CG 4.03Å; L750-R756 HydrophobicContact CD2-CG 4.2Å; L750-R756 WeakPolarHBondContact O-CD 3.45Å; L750-R756 WeakPolarHBondContact O-CG 3.34Å; L750-R756 PolarHBondContact O-NE 2.85Å
751	R	80.7	Confident	88.3	Confident	199 Å²	199	73.4 Å²	73.4	75%	0.751	35%	0.35	S	S	*	.	S	Bend	trans	-64.9	-44.8	174.2	-59.9	169.9	-66.2	-179.1	4	111.8	D749 R756	D749-R751 VanDerWaalsContact OD1-CB 3.31Å; D749-R751 WeakPolarHBondContact OD1-CB 3.44Å; D749-R751 WeakPolarHBondContact OD1-CG 3.33Å; D749-R751 IonicContact OD1-CZ 2.71Å; D749-R751 PolarHBondContact OD1-N 2.97Å; D749-R751 IonicContact OD1-NE 3.47Å; D749-R751 PolarHBondContact OD1-NE 3.23Å; D749-R751 IonicContact OD1-NH2 2.75Å; D749-R751 IonicContact OD2-CZ 3.39Å; D749-R751 IonicContact OD2-NE 2.77Å; D749-R751 PolarHBondContact OD2-NE 3.12Å; D749-R751 IonicContact OD2-NH2 3.09Å; D749-R751 PolarHBondContact OD2-NH2 3.49Å; R751-R756 PolarHBondContact O-NH2 3.22Å
752	P	86.4	Confident	88.3	Confident	52 Å²	52	72.4 Å²	72.4	34%	0.338	34%	0.343	S	S	.	.	S	Bend	trans	-64.7	134.7	176.9	-20.5	34.1	0	0	0	112.7	D754 N755 R756	P752-D754 VanDerWaalsContact C-N 3.29Å; P752-D754 PolarHBondContact O-N 2.68Å; P752-N755 HydrophobicContact CB-CB 4.34Å; P752-N755 PolarHBondContact O-N 3.48Å; P752-R756 PolarHBondContact O-N 2.72Å
753	V	81.4	Confident	88.2	Confident	65 Å²	65	71.5 Å²	71.5	39%	0.394	34%	0.337	S	S	.	.	H	α-helix	trans	-57.7	-42.8	177	-177.5	0	0	0	0	110.8	E725 N755 R756 Q757	E725-V753 HydrophobicContact CG-CG1 4.43Å; V753-N755 VanDerWaalsContact C-N 3.29Å; V753-N755 PolarHBondContact O-N 3.38Å; V753-R756 PolarHBondContact O-N 2.88Å; V753-R756 VanDerWaalsContact O-N 3.16Å; V753-Q757 WeakPolarHBondContact O-CB 3.41Å; V753-Q757 PolarHBondContact O-N 2.99Å
754	D	85.9	Confident	88	Confident	112 Å²	112	68.9 Å²	68.9	60%	0.599	33%	0.331	S	S	*	.	H	α-helix	trans	-61.1	-36.2	-178.4	-56.7	-62.1	0	0	0	112.9	P752 Q757 S758	P752-D754 VanDerWaalsContact C-N 3.29Å; P752-D754 PolarHBondContact O-N 2.68Å; D754-Q757 PolarHBondContact O-N 2.71Å; D754-S758 WeakPolarHBondContact O-CB 3.38Å; D754-S758 PolarHBondContact O-N 2.82Å
755	N	88.1	Confident	87.9	Confident	57 Å²	57	74 Å²	74	31%	0.305	35%	0.354	S	S	.	.	H	α-helix	trans	-68.6	-43.2	176.9	-70.9	-1.2	0	0	0	110.9	P747 D749 P752 V753 S758 V759	P747-N755 HydrophobicContact CB-CB 4.15Å; P747-N755 HydrophobicContact CG-CB 4.3Å; D749-N755 WeakPolarHBondContact O-CB 3.36Å; D749-N755 PolarHBondContact O-ND2 3.41Å; P752-N755 HydrophobicContact CB-CB 4.34Å; P752-N755 PolarHBondContact O-N 3.48Å; V753-N755 VanDerWaalsContact C-N 3.29Å; V753-N755 PolarHBondContact O-N 3.38Å; N755-S758 WeakPolarHBondContact O-CB 3.46Å; N755-S758 PolarHBondContact O-N 2.75Å; N755-V759 PolarHBondContact O-N 2.97Å
756	R	87.6	Confident	88	Confident	32 Å²	32	66.1 Å²	66.1	12%	0.121	32%	0.324	C	S	.	.	H	α-helix	trans	-64.4	-41.1	174.7	-67.6	-175.4	-84.5	119.8	-5.7	111.6	L699 E725 M726 L750 R751 P752 V753 S758 V759 L760	L699-R756 HydrophobicContact CD1-CB 4.17Å; L699-R756 HydrophobicContact CD1-CG 3.8Å; L699-R756 HydrophobicContact CD2-CB 4.44Å; E725-R756 IonicContact OE1-CZ 2.94Å; E725-R756 IonicContact OE1-NH1 3.19Å; E725-R756 PolarHBondContact OE1-NH1 3.29Å; E725-R756 IonicContact OE1-NH2 2.64Å; E725-R756 PolarHBondContact OE1-NH2 2.7Å; M726-R756 HydrophobicContact CB-CB 3.88Å; M726-R756 WeakPolarHBondContact CG-O 3.38Å; M726-R756 VanDerWaalsContact O-CD 3.31Å; M726-R756 WeakPolarHBondContact O-CD 3.31Å; M726-R756 PolarHBondContact O-NH1 2.97Å; L750-R756 HydrophobicContact CB-CG 4.03Å; L750-R756 HydrophobicContact CD2-CG 4.2Å; L750-R756 WeakPolarHBondContact O-CD 3.45Å; L750-R756 WeakPolarHBondContact O-CG 3.34Å; L750-R756 PolarHBondContact O-NE 2.85Å; R751-R756 PolarHBondContact O-NH2 3.22Å; P752-R756 PolarHBondContact O-N 2.72Å; V753-R756 PolarHBondContact O-N 2.88Å; V753-R756 VanDerWaalsContact O-N 3.16Å; R756-S758 VanDerWaalsContact C-N 3.32Å; R756-S758 PolarHBondContact O-N 2.85Å; R756-V759 WeakPolarHBondContact O-CB 3.41Å; R756-V759 PolarHBondContact O-N 3.23Å; R756-L760 PolarHBondContact O-N 3.39Å
757	Q	85.8	Confident	88	Confident	38 Å²	38	68.1 Å²	68.1	18%	0.178	33%	0.333	C	S	.	.	H	α-helix	trans	-71.5	-25.1	178.1	-156	69.5	4.4	0	0	113.1	V753 D754 V759 L760 K761	V753-Q757 WeakPolarHBondContact O-CB 3.41Å; V753-Q757 PolarHBondContact O-N 2.99Å; D754-Q757 PolarHBondContact O-N 2.71Å; Q757-V759 VanDerWaalsContact C-N 3.32Å; Q757-L760 PolarHBondContact O-N 3.33Å; Q757-K761 PolarHBondContact O-N 2.94Å
758	S	90.2	Very high	88	Confident	58 Å²	58	75.3 Å²	75.3	41%	0.406	36%	0.362	S	S	.	.	H	α-helix	trans	-61.1	-42.4	170.3	-161.7	0	0	0	0	111.2	D754 N755 R756 L760 K761 S762	D754-S758 WeakPolarHBondContact O-CB 3.38Å; D754-S758 PolarHBondContact O-N 2.82Å; N755-S758 WeakPolarHBondContact O-CB 3.46Å; N755-S758 PolarHBondContact O-N 2.75Å; R756-S758 VanDerWaalsContact C-N 3.32Å; R756-S758 PolarHBondContact O-N 2.85Å; S758-L760 VanDerWaalsContact C-N 3.34Å; S758-L760 PolarHBondContact O-N 2.99Å; S758-K761 WeakPolarHBondContact O-CB 3.31Å; S758-K761 PolarHBondContact O-N 3.08Å; S758-K761 VanDerWaalsContact O-N 3.1Å; S758-S762 PolarHBondContact O-N 3.42Å; S758-S762 PolarHBondContact O-OG 3.16Å
759	V	90.7	Very high	88.4	Confident	2 Å²	2	74.6 Å²	74.6	1%	0.012	35%	0.353	C	S	.	.	H	α-helix	trans	-63.4	-37.3	177.7	-178.9	0	0	0	0	112	V673 L699 P747 N755 R756 Q757 K761 S762 I763	V673-V759 HydrophobicContact CB-CG1 4.37Å; V673-V759 HydrophobicContact CG1-CG1 3.6Å; L699-V759 HydrophobicContact CD2-CB 3.84Å; L699-V759 HydrophobicContact CD2-CG1 3.9Å; L699-V759 HydrophobicContact CD2-CG2 4.13Å; P747-V759 HydrophobicContact CG-CG2 4.36Å; N755-V759 PolarHBondContact O-N 2.97Å; R756-V759 WeakPolarHBondContact O-CB 3.41Å; R756-V759 PolarHBondContact O-N 3.23Å; Q757-V759 VanDerWaalsContact C-N 3.32Å; V759-K761 VanDerWaalsContact C-N 3.27Å; V759-K761 PolarHBondContact O-N 3.3Å; V759-S762 WeakPolarHBondContact O-CB 3.39Å; V759-S762 PolarHBondContact O-N 2.71Å; V759-S762 VanDerWaalsContact O-N 3.1Å; V759-I763 HydrophobicContact CG1-CD1 4.22Å; V759-I763 HydrophobicContact CG1-CG1 4.49Å; V759-I763 WeakPolarHBondContact O-CG1 3.25Å; V759-I763 PolarHBondContact O-N 3.43Å
760	L	89.8	Confident	88.7	Confident	13 Å²	13	75.7 Å²	75.7	7%	0.068	36%	0.356	C	S	.	.	H	α-helix	trans	-59.5	-38.1	173.9	-178.1	60.3	0	0	0	112.3	M726 R756 Q757 S758 S762 I763 Q764	M726-L760 HydrophobicContact CE-CB 4.44Å; M726-L760 HydrophobicContact CG-CB 3.68Å; M726-L760 HydrophobicContact CG-CD2 4.39Å; M726-L760 HydrophobicContact CG-CG 4.45Å; M726-L760 HydrophobicContact SD-CB 3.9Å; M726-L760 HydrophobicContact SD-CD1 3.84Å; M726-L760 HydrophobicContact SD-CD2 4.39Å; M726-L760 HydrophobicContact SD-CG 4.25Å; R756-L760 PolarHBondContact O-N 3.39Å; Q757-L760 PolarHBondContact O-N 3.33Å; S758-L760 VanDerWaalsContact C-N 3.34Å; S758-L760 PolarHBondContact O-N 2.99Å; L760-S762 VanDerWaalsContact C-N 3.33Å; L760-I763 PolarHBondContact O-N 3.44Å; L760-Q764 HydrophobicContact CD1-CG 4.48Å; L760-Q764 WeakPolarHBondContact O-CG 3.3Å; L760-Q764 PolarHBondContact O-N 2.8Å
761	K	90.1	Very high	88.7	Confident	140 Å²	140	79.5 Å²	79.5	61%	0.609	38%	0.382	S	S	*	.	H	α-helix	trans	-63.3	-41.7	175.3	-61.7	174.8	-177.2	175.3	0	110.8	Q757 S758 V759 Q764 E765	Q757-K761 PolarHBondContact O-N 2.94Å; S758-K761 WeakPolarHBondContact O-CB 3.31Å; S758-K761 PolarHBondContact O-N 3.08Å; S758-K761 VanDerWaalsContact O-N 3.1Å; V759-K761 VanDerWaalsContact C-N 3.27Å; V759-K761 PolarHBondContact O-N 3.3Å; K761-Q764 PolarHBondContact O-N 3.43Å; K761-E765 WeakPolarHBondContact O-CB 3.41Å; K761-E765 PolarHBondContact O-N 3.42Å
762	S	93	Very high	88.8	Confident	33 Å²	33	78 Å²	78	23%	0.231	39%	0.389	C	S	.	.	H	α-helix	trans	-64.8	-37.3	175.8	-54.7	0	0	0	0	113	S758 V759 L760 E765 V766	S758-S762 PolarHBondContact O-N 3.42Å; S758-S762 PolarHBondContact O-OG 3.16Å; V759-S762 WeakPolarHBondContact O-CB 3.39Å; V759-S762 PolarHBondContact O-N 2.71Å; V759-S762 VanDerWaalsContact O-N 3.1Å; L760-S762 VanDerWaalsContact C-N 3.33Å; S762-E765 PolarHBondContact O-N 3.14Å; S762-V766 WeakPolarHBondContact O-CG2 3.44Å; S762-V766 PolarHBondContact O-N 2.97Å
763	I	91.1	Very high	88.8	Confident	4 Å²	4	77.8 Å²	77.8	2%	0.021	40%	0.396	C	S	.	.	H	α-helix	trans	-62.6	-46.8	172.2	-64.8	166.6	0	0	0	110.2	L659 W671 M726 L744 V759 L760 E765 V766 Q767	L659-I763 HydrophobicContact CD2-CG1 3.99Å; W671-I763 HydrophobicContact CB-CG2 4.12Å; M726-I763 HydrophobicContact CE-CD1 3.62Å; L744-I763 HydrophobicContact CD1-CG1 3.66Å; V759-I763 HydrophobicContact CG1-CD1 4.22Å; V759-I763 HydrophobicContact CG1-CG1 4.49Å; V759-I763 WeakPolarHBondContact O-CG1 3.25Å; V759-I763 PolarHBondContact O-N 3.43Å; L760-I763 PolarHBondContact O-N 3.44Å; I763-E765 VanDerWaalsContact C-N 3.29Å; I763-E765 PolarHBondContact O-N 3.1Å; I763-V766 PolarHBondContact O-N 3.15Å; I763-Q767 WeakPolarHBondContact O-CG 3.41Å; I763-Q767 PolarHBondContact O-N 3.37Å
764	Q	89.6	Confident	89.2	Confident	81 Å²	81	75.4 Å²	75.4	38%	0.379	38%	0.381	S	S	.	.	H	α-helix	trans	-64.6	-30.4	177.2	-71	174.3	-8.6	0	0	113.1	L760 K761 K768	L760-Q764 HydrophobicContact CD1-CG 4.48Å; L760-Q764 WeakPolarHBondContact O-CG 3.3Å; L760-Q764 PolarHBondContact O-N 2.8Å; K761-Q764 PolarHBondContact O-N 3.43Å; Q764-K768 VanDerWaalsContact O-CG 3.28Å; Q764-K768 WeakPolarHBondContact O-CG 3.32Å; Q764-K768 PolarHBondContact O-N 2.99Å
765	E	91.4	Very high	89.5	Confident	137 Å²	137	72.2 Å²	72.2	64%	0.64	37%	0.367	S	S	*	.	H	α-helix	trans	-70.3	-41.5	174.1	-169.9	177.1	169.6	0	0	111.6	K761 S762 I763 K768 R769	K761-E765 WeakPolarHBondContact O-CB 3.41Å; K761-E765 PolarHBondContact O-N 3.42Å; S762-E765 PolarHBondContact O-N 3.14Å; I763-E765 VanDerWaalsContact C-N 3.29Å; I763-E765 PolarHBondContact O-N 3.1Å; E765-K768 PolarHBondContact O-N 3.14Å; E765-R769 WeakPolarHBondContact O-CB 3.4Å; E765-R769 PolarHBondContact O-N 2.93Å
766	V	91.9	Very high	89.8	Confident	15 Å²	15	74.1 Å²	74.1	9%	0.091	38%	0.376	C	S	.	.	H	α-helix	trans	-62.1	-44.9	171.5	173.7	0	0	0	0	110.8	L659 V742 L744 S762 I763 K768 R769 F770 I774	L659-V766 HydrophobicContact CD1-CB 4.41Å; L659-V766 HydrophobicContact CD1-CG1 3.96Å; V742-V766 HydrophobicContact CG1-CG1 4.2Å; V742-V766 HydrophobicContact CG1-CG2 4.05Å; V742-V766 HydrophobicContact CG2-CG1 4.33Å; L744-V766 HydrophobicContact CD2-CG2 3.69Å; S762-V766 WeakPolarHBondContact O-CG2 3.44Å; S762-V766 PolarHBondContact O-N 2.97Å; I763-V766 PolarHBondContact O-N 3.15Å; V766-K768 VanDerWaalsContact C-N 3.3Å; V766-K768 PolarHBondContact O-N 2.91Å; V766-R769 PolarHBondContact O-N 3.33Å; V766-F770 HydrophobicContact CG1-CD2 3.87Å; V766-F770 HydrophobicContact CG1-CE2 4.31Å; V766-F770 WeakPolarHBondContact O-CD2 3.45Å; V766-F770 PolarHBondContact O-N 2.67Å; V766-I774 HydrophobicContact CG1-CD1 3.96Å; V766-I774 HydrophobicContact CG1-CG1 4.16Å; V766-I774 HydrophobicContact CG1-CG2 3.95Å
767	Q	90	Very high	90	Very high	83 Å²	83	73.2 Å²	73.2	39%	0.388	37%	0.374	S	S	.	.	H	α-helix	trans	-59.8	-37.9	176.2	-72	174	-38	0	0	112.7	I763 R769 F770 I774	I763-Q767 WeakPolarHBondContact O-CG 3.41Å; I763-Q767 PolarHBondContact O-N 3.37Å; Q767-R769 VanDerWaalsContact C-N 3.34Å; Q767-F770 CarbonylContact O-C 3.56Å; Q767-I774 HydrophobicContact CG-CD1 3.91Å; Q767-I774 HydrophobicContact CG-CG1 4.46Å
768	K	90.6	Very high	90.1	Very high	174 Å²	174	74.6 Å²	74.6	76%	0.757	38%	0.382	S	S	*	.	H	α-helix	trans	-70.4	-28.6	173.9	-74.8	170.3	-179.5	179.6	0	113.6	Q764 E765 V766	Q764-K768 VanDerWaalsContact O-CG 3.28Å; Q764-K768 WeakPolarHBondContact O-CG 3.32Å; Q764-K768 PolarHBondContact O-N 2.99Å; E765-K768 PolarHBondContact O-N 3.14Å; V766-K768 VanDerWaalsContact C-N 3.3Å; V766-K768 PolarHBondContact O-N 2.91Å
769	R	92.1	Very high	90.1	Very high	197 Å²	197	72.6 Å²	72.6	74%	0.743	37%	0.368	S	S	*	.	H	α-helix	trans	-80.9	-24.8	178.8	-174.5	171.9	179.6	169.4	0.3	112.9	E765 V766 Q767	E765-R769 WeakPolarHBondContact O-CB 3.4Å; E765-R769 PolarHBondContact O-N 2.93Å; V766-R769 PolarHBondContact O-N 3.33Å; Q767-R769 VanDerWaalsContact C-N 3.34Å
770	F	90.9	Very high	90	Very high	75 Å²	75	74.7 Å²	74.7	33%	0.329	38%	0.378	S	S	.	.			trans	-127.3	70.4	179.5	-61.5	-79.5	0	0	0	110.3	V742 V766 Q767 D772 G773 P775	V742-F770 HydrophobicContact CG2-CE2 4.47Å; V766-F770 HydrophobicContact CG1-CD2 3.87Å; V766-F770 HydrophobicContact CG1-CE2 4.31Å; V766-F770 WeakPolarHBondContact O-CD2 3.45Å; V766-F770 PolarHBondContact O-N 2.67Å; Q767-F770 CarbonylContact O-C 3.56Å; F770-D772 VanDerWaalsContact C-N 3.28Å; F770-D772 PolarHBondContact O-N 2.66Å; F770-G773 WeakPolarHBondContact CB-O 3.11Å; F770-G773 CarbonylContact O-C 3.58Å; F770-G773 PolarHBondContact O-N 3.05Å; F770-P775 HydrophobicContact CD1-CG 4.34Å; F770-P775 HydrophobicContact CE1-CG 4.12Å; F770-P775 HydrophobicContact CZ-CG 4.26Å
771	P	85.1	Confident	90	Very high	103 Å²	103	81 Å²	81	67%	0.669	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-31.9	-174.2	26.9	-34.8	0	0	0	113	G773	P771-G773 PolarHBondContact O-N 3.35Å
772	D	83.6	Confident	90	Very high	167 Å²	167	78.3 Å²	78.3	89%	0.893	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-9	179.7	-45.6	-70.6	0	0	0	113.1	F770	F770-D772 VanDerWaalsContact C-N 3.28Å; F770-D772 PolarHBondContact O-N 2.66Å
773	G	85.1	Confident	89.8	Confident	47 Å²	47	77.4 Å²	77.4	49%	0.485	40%	0.397	S	S	.	.			trans	138	139.1	179.9	0	0	0	0	0	112.7	F770 P771	F770-G773 WeakPolarHBondContact CB-O 3.11Å; F770-G773 CarbonylContact O-C 3.58Å; F770-G773 PolarHBondContact O-N 3.05Å; P771-G773 PolarHBondContact O-N 3.35Å
774	I	91.3	Very high	89.7	Confident	15 Å²	15	79.1 Å²	79.1	8%	0.077	42%	0.415	C	S	.	.			trans	-67.4	128.7	175.1	-53.4	-174.4	0	0	0	108.6	L659 W671 S740 V742 V766 Q767 L776	L659-I774 HydrophobicContact CD1-CD1 4.17Å; L659-I774 HydrophobicContact CD1-CG2 4.27Å; W671-I774 HydrophobicContact CD2-CD1 3.87Å; W671-I774 HydrophobicContact CG-CD1 3.83Å; W671-I774 HydrophobicContact CZ2-CB 4.04Å; S740-I774 WeakPolarHBondContact OG-CG2 3.31Å; V742-I774 HydrophobicContact CG2-CG2 4Å; V766-I774 HydrophobicContact CG1-CD1 3.96Å; V766-I774 HydrophobicContact CG1-CG1 4.16Å; V766-I774 HydrophobicContact CG1-CG2 3.95Å; Q767-I774 HydrophobicContact CG-CD1 3.91Å; Q767-I774 HydrophobicContact CG-CG1 4.46Å; I774-L776 PolarHBondContact O-N 3.49Å
775	P	92.2	Very high	89.7	Confident	46 Å²	46	75.2 Å²	75.2	30%	0.299	40%	0.397	S	S	.	.			trans	-62.8	130	-175.5	24.1	-34.1	0	0	0	111.7	S740 S741 V742 F770	S740-P775 WeakPolarHBondContact CA-O 2.95Å; S740-P775 VanDerWaalsContact CB-O 3.29Å; S740-P775 WeakPolarHBondContact CB-O 3.47Å; S740-P775 PolarHBondContact OG-O 2.9Å; S741-P775 PolarHBondContact N-O 2.74Å; S741-P775 PolarHBondContact OG-O 2.78Å; V742-P775 HydrophobicContact CG2-CG 4.01Å; F770-P775 HydrophobicContact CD1-CG 4.34Å; F770-P775 HydrophobicContact CE1-CG 4.12Å; F770-P775 HydrophobicContact CZ-CG 4.26Å
776	L	92.9	Very high	89.5	Confident	96 Å²	96	76.7 Å²	76.7	50%	0.503	40%	0.404	S	S	.	.	B	Isolated β-bridge	trans	-79	175.3	177.4	-56.1	-171.2	0	0	0	110.9	W671 A738 I739 I774	W671-L776 HydrophobicContact CH2-CD2 3.67Å; W671-L776 HydrophobicContact CZ2-CD2 4.11Å; A738-L776 HydrophobicContact CB-CD2 4Å; I739-L776 WeakPolarHBondContact O-CA 3.31Å; I774-L776 PolarHBondContact O-N 3.49Å
777	L	91.8	Very high	89.4	Confident	14 Å²	14	78.7 Å²	78.7	7%	0.073	41%	0.414	C	S	.	.			trans	-89.6	136.3	157.8	-66.3	172.5	0	0	0	108.5	F653 I739 D782 M783	F653-L777 HydrophobicContact CB-CD1 3.76Å; F653-L777 HydrophobicContact CD1-CD1 3.5Å; F653-L777 VanDerWaalsContact CD1-CD1 3.5Å; F653-L777 HydrophobicContact CD2-CD1 4.45Å; F653-L777 HydrophobicContact CE1-CD1 4.25Å; F653-L777 HydrophobicContact CG-CD1 3.63Å; I739-L777 HydrophobicContact CB-CD1 4.21Å; I739-L777 HydrophobicContact CG2-CD1 3.59Å; I739-L777 HydrophobicContact CG2-CG 4.43Å; I739-L777 PolarHBondContact O-N 3.22Å; L777-D782 WeakPolarHBondContact CA-OD2 3.39Å; L777-D782 HydrophobicContact CB-CB 3.99Å; L777-D782 HydrophobicContact CD2-CB 3.92Å; L777-M783 HydrophobicContact CB-CG 3.95Å; L777-M783 HydrophobicContact CB-SD 4.19Å; L777-M783 HydrophobicContact CD1-CG 4.28Å
778	D	89.9	Confident	89.3	Confident	67 Å²	67	81.6 Å²	81.6	36%	0.358	43%	0.428	S	S	.	.			trans	-72.2	133.2	172.9	-172.8	-92.7	0	0	0	111.8	I780 D781 D782 M783	D778-I780 VanDerWaalsContact C-N 3.29Å; D778-I780 PolarHBondContact O-N 3.29Å; D778-I780 WeakPolarHBondContact OD1-CA 3.35Å; D778-I780 PolarHBondContact OD1-N 2.71Å; D778-D781 HydrophobicContact CB-CB 4.19Å; D778-D781 PolarHBondContact OD1-N 3.09Å; D778-D782 PolarHBondContact N-OD2 2.79Å; D778-D782 WeakPolarHBondContact O-CB 3.28Å; D778-D782 PolarHBondContact O-N 3.48Å; D778-M783 PolarHBondContact O-N 3.41Å
779	P	89.4	Confident	89.3	Confident	15 Å²	15	74.4 Å²	74.4	10%	0.097	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-30.7	179.4	-26.4	36.7	0	0	0	114.9	I640 I644 I785 L790	I640-P779 HydrophobicContact CG2-CG 4.17Å; I644-P779 HydrophobicContact CD1-CG 3.99Å; I644-P779 HydrophobicContact CG1-CB 4.41Å; I644-P779 HydrophobicContact CG1-CG 4Å; P779-I785 HydrophobicContact CB-CD1 4.28Å; P779-I785 WeakPolarHBondContact O-CB 3.44Å; P779-I785 WeakPolarHBondContact O-CG1 3.42Å; P779-I785 PolarHBondContact O-N 2.97Å; P779-L790 HydrophobicContact CB-CD2 3.77Å
780	I	88.6	Confident	89.2	Confident	46 Å²	46	65 Å²	65	24%	0.236	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-53.1	-178.5	-62.5	173.7	0	0	0	110.4	D778 G784 K791 I794	D778-I780 VanDerWaalsContact C-N 3.29Å; D778-I780 PolarHBondContact O-N 3.29Å; D778-I780 WeakPolarHBondContact OD1-CA 3.35Å; D778-I780 PolarHBondContact OD1-N 2.71Å; I780-G784 WeakPolarHBondContact O-CA 3.37Å; I780-G784 PolarHBondContact O-N 2.89Å; I780-K791 HydrophobicContact CD1-CG 3.91Å; I780-I794 HydrophobicContact CD1-CD1 3.7Å; I780-I794 HydrophobicContact CG1-CD1 4.1Å
781	D	89	Confident	89.1	Confident	145 Å²	145	65.7 Å²	65.7	78%	0.775	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-41.3	-167.4	-74.9	-8.8	0	0	0	113	D778	D778-D781 HydrophobicContact CB-CB 4.19Å; D778-D781 PolarHBondContact OD1-N 3.09Å
782	D	91.1	Very high	89.4	Confident	85 Å²	85	66.7 Å²	66.7	46%	0.455	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-47.5	173.8	-75.2	-53.2	0	0	0	111.9	F653 L777 D778	F653-D782 VanDerWaalsContact CZ-O 3.26Å; F653-D782 WeakPolarHBondContact CZ-O 3.36Å; L777-D782 WeakPolarHBondContact CA-OD2 3.39Å; L777-D782 HydrophobicContact CB-CB 3.99Å; L777-D782 HydrophobicContact CD2-CB 3.92Å; D778-D782 PolarHBondContact N-OD2 2.79Å; D778-D782 WeakPolarHBondContact O-CB 3.28Å; D778-D782 PolarHBondContact O-N 3.48Å
783	M	88.3	Confident	89.7	Confident	13 Å²	13	59.2 Å²	59.2	6%	0.064	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-10.9	-171.6	-63.1	-172	62.8	0	0	114.4	I644 Y649 F653 I739 L777 D778 I785	I644-M783 HydrophobicContact CG2-CE 4.12Å; I644-M783 HydrophobicContact CG2-SD 4.03Å; Y649-M783 VanDerWaalsContact O-CE 3.31Å; Y649-M783 WeakPolarHBondContact O-CE 3.46Å; F653-M783 HydrophobicContact CD2-CE 4.11Å; F653-M783 HydrophobicContact CD2-CG 4.16Å; F653-M783 HydrophobicContact CE2-CB 4.05Å; F653-M783 HydrophobicContact CE2-CE 4.41Å; F653-M783 HydrophobicContact CE2-CG 3.89Å; F653-M783 HydrophobicContact CZ-CB 4.38Å; F653-M783 HydrophobicContact CZ-CG 4.22Å; I739-M783 HydrophobicContact CD1-CE 4.34Å; L777-M783 HydrophobicContact CB-CG 3.95Å; L777-M783 HydrophobicContact CB-SD 4.19Å; L777-M783 HydrophobicContact CD1-CG 4.28Å; D778-M783 PolarHBondContact O-N 3.41Å; M783-I785 VanDerWaalsContact C-N 3.34Å; M783-I785 HydrophobicContact CB-CD1 4.36Å; M783-I785 HydrophobicContact CB-CG1 4.14Å; M783-I785 PolarHBondContact O-N 2.67Å
784	G	88.5	Confident	90	Very high	40 Å²	40	58.4 Å²	58.4	41%	0.412	31%	0.309	S	S	.	.			trans	68.6	24.9	173.7	0	0	0	0	0	114.9	I780 Q786	I780-G784 WeakPolarHBondContact O-CA 3.37Å; I780-G784 PolarHBondContact O-N 2.89Å; G784-Q786 PolarHBondContact O-N 3.24Å
785	I	89.9	Confident	89.9	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	33%	0.332	C	S	.	.			trans	-76.3	93.1	-176.6	-52.9	177	0	0	0	110.3	Y649 P779 M783 D787 L790	Y649-I785 HydrophobicContact CD1-CB 4.42Å; Y649-I785 HydrophobicContact CD1-CD1 4.41Å; Y649-I785 HydrophobicContact CD1-CG1 3.68Å; Y649-I785 HydrophobicContact CD1-CG2 4.42Å; Y649-I785 HydrophobicContact CD2-CD1 4.06Å; Y649-I785 HydrophobicContact CD2-CG1 4.12Å; Y649-I785 HydrophobicContact CD2-CG2 4.27Å; Y649-I785 HydrophobicContact CE1-CB 4.43Å; Y649-I785 HydrophobicContact CE1-CG1 4.18Å; Y649-I785 HydrophobicContact CE1-CG2 4.11Å; Y649-I785 HydrophobicContact CE2-CG2 4.01Å; Y649-I785 HydrophobicContact CG-CD1 3.86Å; Y649-I785 HydrophobicContact CG-CG1 3.64Å; Y649-I785 HydrophobicContact CG-CG2 4.49Å; P779-I785 HydrophobicContact CB-CD1 4.28Å; P779-I785 WeakPolarHBondContact O-CB 3.44Å; P779-I785 WeakPolarHBondContact O-CG1 3.42Å; P779-I785 PolarHBondContact O-N 2.97Å; M783-I785 VanDerWaalsContact C-N 3.34Å; M783-I785 HydrophobicContact CB-CD1 4.36Å; M783-I785 HydrophobicContact CB-CG1 4.14Å; M783-I785 PolarHBondContact O-N 2.67Å; I785-D787 HydrophobicContact CG2-CB 3.9Å; I785-D787 PolarHBondContact O-N 3.12Å; I785-D787 VanDerWaalsContact O-N 3.11Å; I785-L790 HydrophobicContact CB-CD2 3.67Å; I785-L790 HydrophobicContact CD1-CD2 4.1Å; I785-L790 HydrophobicContact CG1-CD2 4.47Å; I785-L790 HydrophobicContact CG2-CD2 3.49Å; I785-L790 VanDerWaalsContact CG2-CD2 3.49Å
786	Q	87.8	Confident	89.9	Confident	168 Å²	168	66.3 Å²	66.3	79%	0.785	34%	0.34	S	S	*	.			trans	-77.1	16.6	179.6	-62.9	-179.2	-3	0	0	114.7	G784	G784-Q786 PolarHBondContact O-N 3.24Å
787	D	89.4	Confident	89.8	Confident	56 Å²	56	62.8 Å²	62.8	30%	0.299	32%	0.323	S	S	.	.			trans	-73.3	126.6	-176.5	-163.7	-49.5	0	0	0	111.7	Y643 I785 G789 L790 K791	Y643-D787 HydrophobicContact CD1-CB 4.47Å; Y643-D787 HydrophobicContact CE1-CB 4.17Å; Y643-D787 WeakPolarHBondContact CE1-OD2 3.44Å; I785-D787 HydrophobicContact CG2-CB 3.9Å; I785-D787 PolarHBondContact O-N 3.12Å; I785-D787 VanDerWaalsContact O-N 3.11Å; D787-G789 VanDerWaalsContact C-N 3.26Å; D787-G789 PolarHBondContact O-N 3.24Å; D787-G789 WeakPolarHBondContact OD1-CA 3.26Å; D787-G789 PolarHBondContact OD1-N 3.28Å; D787-L790 HydrophobicContact CB-CB 4.28Å; D787-L790 PolarHBondContact O-N 3.11Å; D787-K791 PolarHBondContact O-N 2.94Å
788	Q	88.4	Confident	89.8	Confident	144 Å²	144	67.8 Å²	67.8	67%	0.673	35%	0.345	S	S	*	.	H	α-helix	trans	-67.8	-25	178.8	-68.8	-166.9	2.4	0	0	113.3	K792	Q788-K792 WeakPolarHBondContact O-CG 3.32Å; Q788-K792 PolarHBondContact O-N 3.37Å
789	G	89.6	Confident	89.9	Confident	24 Å²	24	66.9 Å²	66.9	25%	0.247	35%	0.348	C	S	.	.	H	α-helix	trans	-64.5	-52	173.2	0	0	0	0	0	110.9	D787 K791 K792 V793	D787-G789 VanDerWaalsContact C-N 3.26Å; D787-G789 PolarHBondContact O-N 3.24Å; D787-G789 WeakPolarHBondContact OD1-CA 3.26Å; D787-G789 PolarHBondContact OD1-N 3.28Å; G789-K791 VanDerWaalsContact C-N 3.35Å; G789-K791 PolarHBondContact O-N 3.16Å; G789-K792 WeakPolarHBondContact O-CB 3.43Å; G789-K792 PolarHBondContact O-N 2.96Å; G789-K792 VanDerWaalsContact O-N 3.13Å; G789-V793 WeakPolarHBondContact O-CG2 3.35Å; G789-V793 PolarHBondContact O-N 2.94Å
790	L	89.6	Confident	90	Very high	0 Å²	0	68.5 Å²	68.5	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-58	-44.5	176.8	176.7	61	0	0	0	112.1	I640 Y643 P779 I785 D787 K792 V793 I794	I640-L790 HydrophobicContact CB-CD1 4.43Å; I640-L790 HydrophobicContact CG1-CD1 4.02Å; I640-L790 HydrophobicContact CG2-CD1 4.25Å; Y643-L790 HydrophobicContact CD1-CB 4.12Å; Y643-L790 HydrophobicContact CD2-CB 3.97Å; Y643-L790 HydrophobicContact CD2-CD1 3.91Å; Y643-L790 HydrophobicContact CD2-CG 4.47Å; Y643-L790 HydrophobicContact CE1-CB 4.32Å; Y643-L790 HydrophobicContact CE2-CB 4.2Å; Y643-L790 HydrophobicContact CG-CB 3.94Å; Y643-L790 HydrophobicContact CG-CD1 4.11Å; Y643-L790 HydrophobicContact CG-CD2 4.46Å; Y643-L790 HydrophobicContact CG-CG 4.39Å; P779-L790 HydrophobicContact CB-CD2 3.77Å; I785-L790 HydrophobicContact CB-CD2 3.67Å; I785-L790 HydrophobicContact CD1-CD2 4.1Å; I785-L790 HydrophobicContact CG1-CD2 4.47Å; I785-L790 HydrophobicContact CG2-CD2 3.49Å; I785-L790 VanDerWaalsContact CG2-CD2 3.49Å; D787-L790 HydrophobicContact CB-CB 4.28Å; D787-L790 PolarHBondContact O-N 3.11Å; L790-K792 VanDerWaalsContact C-N 3.29Å; L790-K792 PolarHBondContact O-N 3.01Å; L790-V793 WeakPolarHBondContact O-CA 3.36Å; L790-V793 WeakPolarHBondContact O-CB 3.43Å; L790-V793 PolarHBondContact O-N 2.96Å; L790-I794 HydrophobicContact CD1-CD1 3.91Å; L790-I794 HydrophobicContact CD1-CG1 4.15Å; L790-I794 HydrophobicContact CD2-CD1 4.5Å; L790-I794 HydrophobicContact CG-CD1 3.89Å; L790-I794 PolarHBondContact O-N 3.14Å
791	K	88.9	Confident	90.1	Very high	89 Å²	89	70 Å²	70	39%	0.387	36%	0.359	S	S	.	.	H	α-helix	trans	-59	-39.7	176.9	-69.5	-170.8	175.4	-162.9	0	112.5	I780 D787 G789 V793 I794 Q795	I780-K791 HydrophobicContact CD1-CG 3.91Å; D787-K791 PolarHBondContact O-N 2.94Å; G789-K791 VanDerWaalsContact C-N 3.35Å; G789-K791 PolarHBondContact O-N 3.16Å; K791-V793 VanDerWaalsContact C-N 3.35Å; K791-I794 PolarHBondContact O-N 2.9Å; K791-Q795 WeakPolarHBondContact O-CB 3.47Å; K791-Q795 VanDerWaalsContact O-CG 3.28Å; K791-Q795 WeakPolarHBondContact O-CG 3.4Å; K791-Q795 PolarHBondContact O-N 3.23Å
792	K	91.4	Very high	90.2	Very high	124 Å²	124	69.2 Å²	69.2	54%	0.539	35%	0.351	S	S	.	.	H	α-helix	trans	-69.3	-28.2	173.6	-74	170.9	177.9	176.2	0	113.3	Q788 G789 L790 K796	Q788-K792 WeakPolarHBondContact O-CG 3.32Å; Q788-K792 PolarHBondContact O-N 3.37Å; G789-K792 WeakPolarHBondContact O-CB 3.43Å; G789-K792 PolarHBondContact O-N 2.96Å; G789-K792 VanDerWaalsContact O-N 3.13Å; L790-K792 VanDerWaalsContact C-N 3.29Å; L790-K792 PolarHBondContact O-N 3.01Å; K792-K796 WeakPolarHBondContact O-CD 3.46Å; K792-K796 VanDerWaalsContact O-CG 3.23Å; K792-K796 WeakPolarHBondContact O-CG 3.38Å; K792-K796 PolarHBondContact O-N 2.95Å
793	V	91.1	Very high	90.1	Very high	9 Å²	9	71.6 Å²	71.6	6%	0.055	35%	0.353	C	S	.	.	H	α-helix	trans	-72.8	-45.7	173.5	176.1	0	0	0	0	110.3	L636 E639 I640 G789 L790 K791 K796 V797	L636-V793 HydrophobicContact CB-CG1 4.26Å; L636-V793 HydrophobicContact CD2-CG1 4.01Å; E639-V793 HydrophobicContact CB-CG1 4.11Å; E639-V793 HydrophobicContact CB-CG2 4.47Å; I640-V793 HydrophobicContact CD1-CG1 4.14Å; I640-V793 HydrophobicContact CG1-CB 4.49Å; I640-V793 HydrophobicContact CG1-CG1 3.57Å; G789-V793 WeakPolarHBondContact O-CG2 3.35Å; G789-V793 PolarHBondContact O-N 2.94Å; L790-V793 WeakPolarHBondContact O-CA 3.36Å; L790-V793 WeakPolarHBondContact O-CB 3.43Å; L790-V793 PolarHBondContact O-N 2.96Å; K791-V793 VanDerWaalsContact C-N 3.35Å; V793-K796 WeakPolarHBondContact O-CB 3.21Å; V793-K796 PolarHBondContact O-N 3.41Å; V793-K796 VanDerWaalsContact O-N 3.11Å; V793-V797 WeakPolarHBondContact O-CG2 3.45Å; V793-V797 PolarHBondContact O-N 2.89Å
794	I	90	Very high	90.3	Very high	30 Å²	30	71.9 Å²	71.9	15%	0.154	36%	0.355	C	S	.	.	H	α-helix	trans	-60.8	-47.7	177.1	-69.6	166.9	0	0	0	111	I640 I780 L790 K791 K796 V797 E798	I640-I794 HydrophobicContact CD1-CG1 3.94Å; I640-I794 HydrophobicContact CG1-CG1 4.48Å; I780-I794 HydrophobicContact CD1-CD1 3.7Å; I780-I794 HydrophobicContact CG1-CD1 4.1Å; L790-I794 HydrophobicContact CD1-CD1 3.91Å; L790-I794 HydrophobicContact CD1-CG1 4.15Å; L790-I794 HydrophobicContact CD2-CD1 4.5Å; L790-I794 HydrophobicContact CG-CD1 3.89Å; L790-I794 PolarHBondContact O-N 3.14Å; K791-I794 PolarHBondContact O-N 2.9Å; I794-K796 PolarHBondContact O-N 3.28Å; I794-V797 WeakPolarHBondContact O-CA 3.38Å; I794-V797 WeakPolarHBondContact O-CB 3.4Å; I794-V797 PolarHBondContact O-N 3.47Å; I794-E798 HydrophobicContact CG2-CG 4.42Å; I794-E798 WeakPolarHBondContact O-CG 3.42Å; I794-E798 PolarHBondContact O-N 2.82Å
795	Q	90.1	Very high	90.4	Very high	120 Å²	120	75.8 Å²	75.8	56%	0.561	36%	0.358	S	S	*	.	H	α-helix	trans	-58	-32.8	174.5	-73.7	172.8	-25.1	0	0	113.4	K791 A799	K791-Q795 WeakPolarHBondContact O-CB 3.47Å; K791-Q795 VanDerWaalsContact O-CG 3.28Å; K791-Q795 WeakPolarHBondContact O-CG 3.4Å; K791-Q795 PolarHBondContact O-N 3.23Å; Q795-A799 VanDerWaalsContact O-CB 3.29Å; Q795-A799 WeakPolarHBondContact O-CB 3.35Å; Q795-A799 PolarHBondContact O-N 2.76Å; Q795-A799 VanDerWaalsContact O-N 3.1Å
796	K	92.1	Very high	90.4	Very high	107 Å²	107	79.4 Å²	79.4	47%	0.465	38%	0.383	S	S	.	.	H	α-helix	trans	-71.4	-40.8	172.3	-74.1	168.3	-178.3	179	0	111.7	L636 K792 V793 I794 A799 F800	L636-K796 HydrophobicContact CD1-CB 3.85Å; L636-K796 HydrophobicContact CD2-CB 4.19Å; L636-K796 HydrophobicContact CD2-CD 4Å; K792-K796 WeakPolarHBondContact O-CD 3.46Å; K792-K796 VanDerWaalsContact O-CG 3.23Å; K792-K796 WeakPolarHBondContact O-CG 3.38Å; K792-K796 PolarHBondContact O-N 2.95Å; V793-K796 WeakPolarHBondContact O-CB 3.21Å; V793-K796 PolarHBondContact O-N 3.41Å; V793-K796 VanDerWaalsContact O-N 3.11Å; I794-K796 PolarHBondContact O-N 3.28Å; K796-A799 PolarHBondContact O-N 3.42Å; K796-F800 WeakPolarHBondContact O-CB 3.4Å; K796-F800 VanDerWaalsContact O-CD2 3.25Å; K796-F800 WeakPolarHBondContact O-CD2 3.36Å; K796-F800 PolarHBondContact O-N 2.88Å
797	V	91.9	Very high	90.5	Very high	23 Å²	23	72.4 Å²	72.4	14%	0.139	35%	0.35	C	S	.	.	H	α-helix	trans	-59.5	-53	175.5	171.6	0	0	0	0	109.7	L633 L636 I640 V793 I794 A799 F800 E801	L633-V797 HydrophobicContact CD2-CB 4.46Å; L633-V797 HydrophobicContact CD2-CG1 4.03Å; L636-V797 HydrophobicContact CB-CG2 3.57Å; L636-V797 HydrophobicContact CD1-CG2 4.17Å; L636-V797 HydrophobicContact CG-CG2 4.46Å; I640-V797 HydrophobicContact CD1-CG2 3.97Å; V793-V797 WeakPolarHBondContact O-CG2 3.45Å; V793-V797 PolarHBondContact O-N 2.89Å; I794-V797 WeakPolarHBondContact O-CA 3.38Å; I794-V797 WeakPolarHBondContact O-CB 3.4Å; I794-V797 PolarHBondContact O-N 3.47Å; V797-A799 VanDerWaalsContact C-N 3.31Å; V797-A799 PolarHBondContact O-N 3.19Å; V797-F800 CarbonylContact O-C 3.58Å; V797-F800 PolarHBondContact O-N 2.9Å; V797-F800 VanDerWaalsContact O-N 3.08Å; V797-E801 HydrophobicContact CG1-CG 4.22Å; V797-E801 WeakPolarHBondContact O-CB 3.4Å; V797-E801 WeakPolarHBondContact O-CG 3.38Å; V797-E801 PolarHBondContact O-N 3.25Å
798	E	90.8	Very high	90.3	Very high	118 Å²	118	74.8 Å²	74.8	55%	0.551	37%	0.369	S	S	*	.	H	α-helix	trans	-52.7	-46.6	175.5	-67.1	168.8	166	0	0	112	I794 E801 H802	I794-E798 HydrophobicContact CG2-CG 4.42Å; I794-E798 WeakPolarHBondContact O-CG 3.42Å; I794-E798 PolarHBondContact O-N 2.82Å; E798-E801 PolarHBondContact O-N 3.37Å; E798-H802 WeakPolarHBondContact O-CB 3.33Å; E798-H802 PolarHBondContact O-N 3.3Å
799	A	91.3	Very high	90.2	Very high	49 Å²	49	68.6 Å²	68.6	41%	0.405	34%	0.34	S	S	.	.	H	α-helix	trans	-67.5	-35.5	178.6	0	0	0	0	0	113.5	Q795 K796 V797 R803	Q795-A799 VanDerWaalsContact O-CB 3.29Å; Q795-A799 WeakPolarHBondContact O-CB 3.35Å; Q795-A799 PolarHBondContact O-N 2.76Å; Q795-A799 VanDerWaalsContact O-N 3.1Å; K796-A799 PolarHBondContact O-N 3.42Å; V797-A799 VanDerWaalsContact C-N 3.31Å; V797-A799 PolarHBondContact O-N 3.19Å; A799-R803 WeakPolarHBondContact O-CB 3.43Å; A799-R803 WeakPolarHBondContact O-CD 3.44Å; A799-R803 WeakPolarHBondContact O-CG 3.38Å; A799-R803 PolarHBondContact O-N 2.9Å; A799-R803 VanDerWaalsContact O-N 3.14Å
800	F	91.8	Very high	90.1	Very high	49 Å²	49	69.8 Å²	69.8	22%	0.215	34%	0.339	C	S	.	.	H	α-helix	trans	-77.1	-33.2	175.3	-86.2	-67	0	0	0	112.6	I629 Q632 L633 L636 K796 V797 R803 M804	I629-F800 HydrophobicContact CG1-CD1 4.26Å; I629-F800 HydrophobicContact CG2-CD1 4.21Å; I629-F800 WeakPolarHBondContact CG2-O 3.14Å; Q632-F800 HydrophobicContact CB-CE1 4.36Å; Q632-F800 HydrophobicContact CB-CE2 4.35Å; Q632-F800 HydrophobicContact CB-CZ 4.2Å; Q632-F800 HydrophobicContact CG-CZ 4.44Å; L633-F800 HydrophobicContact CD1-CB 4.45Å; L633-F800 HydrophobicContact CD2-CB 3.56Å; L633-F800 HydrophobicContact CG-CB 3.84Å; L636-F800 HydrophobicContact CD1-CD2 3.68Å; L636-F800 HydrophobicContact CD1-CE2 4.12Å; K796-F800 WeakPolarHBondContact O-CB 3.4Å; K796-F800 VanDerWaalsContact O-CD2 3.25Å; K796-F800 WeakPolarHBondContact O-CD2 3.36Å; K796-F800 PolarHBondContact O-N 2.88Å; V797-F800 CarbonylContact O-C 3.58Å; V797-F800 PolarHBondContact O-N 2.9Å; V797-F800 VanDerWaalsContact O-N 3.08Å; F800-R803 CarbonylContact O-C 3.59Å; F800-R803 PolarHBondContact O-N 3.3Å; F800-M804 WeakPolarHBondContact O-CB 3.48Å; F800-M804 PolarHBondContact O-N 2.7Å
801	E	90.8	Very high	89.9	Confident	76 Å²	76	76 Å²	76	36%	0.355	37%	0.372	S	S	.	.	H	α-helix	trans	-66.2	-48.1	171.6	-77.6	-163.3	-175.1	0	0	111	L633 V797 E798 R803 M804 Y805	L633-E801 HydrophobicContact CD1-CG 4.19Å; L633-E801 HydrophobicContact CD2-CG 3.78Å; V797-E801 HydrophobicContact CG1-CG 4.22Å; V797-E801 WeakPolarHBondContact O-CB 3.4Å; V797-E801 WeakPolarHBondContact O-CG 3.38Å; V797-E801 PolarHBondContact O-N 3.25Å; E798-E801 PolarHBondContact O-N 3.37Å; E801-R803 PolarHBondContact O-N 3.16Å; E801-M804 CarbonylContact O-C 3.58Å; E801-M804 WeakPolarHBondContact O-CA 3.36Å; E801-M804 WeakPolarHBondContact O-CB 3.48Å; E801-M804 PolarHBondContact O-N 3.23Å; E801-Y805 HydrophobicContact CB-CD2 4.27Å; E801-Y805 HydrophobicContact CB-CE2 3.86Å; E801-Y805 HydrophobicContact CG-CE2 4.47Å; E801-Y805 WeakPolarHBondContact O-CD2 3.43Å; E801-Y805 PolarHBondContact O-N 3.13Å
802	H	91.1	Very high	89.7	Confident	130 Å²	130	74.6 Å²	74.6	60%	0.602	37%	0.369	S	S	*	.	H	α-helix	trans	-55	-42.9	172.7	-176.3	-73.4	0	0	0	111.2	E798 S806	E798-H802 WeakPolarHBondContact O-CB 3.33Å; E798-H802 PolarHBondContact O-N 3.3Å; H802-S806 PolarHBondContact CE1-OG 3.45Å; H802-S806 VanDerWaalsContact CE1-OG 3.29Å; H802-S806 PolarHBondContact ND1-OG 2.74Å; H802-S806 WeakPolarHBondContact O-CB 3.49Å; H802-S806 PolarHBondContact O-N 3.45Å; H802-S806 PolarHBondContact O-OG 2.96Å
803	R	90.2	Very high	89.3	Confident	135 Å²	135	74.6 Å²	74.6	51%	0.509	38%	0.382	S	S	.	.	H	α-helix	trans	-65.7	-34	174	-74.3	169	-179.7	-162.6	-1.1	113.1	I629 A799 F800 E801 H807	I629-R803 HydrophobicContact CD1-CB 4.25Å; A799-R803 WeakPolarHBondContact O-CB 3.43Å; A799-R803 WeakPolarHBondContact O-CD 3.44Å; A799-R803 WeakPolarHBondContact O-CG 3.38Å; A799-R803 PolarHBondContact O-N 2.9Å; A799-R803 VanDerWaalsContact O-N 3.14Å; F800-R803 CarbonylContact O-C 3.59Å; F800-R803 PolarHBondContact O-N 3.3Å; E801-R803 PolarHBondContact O-N 3.16Å; R803-H807 WeakPolarHBondContact O-CB 3.46Å; R803-H807 PolarHBondContact O-N 2.69Å
804	M	91.8	Very high	89	Confident	19 Å²	19	78.7 Å²	78.7	9%	0.094	40%	0.403	C	S	.	.	H	α-helix	trans	-66.6	-54.1	175.2	-173.5	179.7	62.3	0	0	110.8	Y626 I629 R630 L633 F800 E801 S806 H807 H810	Y626-M804 HydrophobicContact CD2-CG 4.5Å; Y626-M804 HydrophobicContact CE2-CG 3.62Å; I629-M804 HydrophobicContact CG2-CB 3.82Å; I629-M804 HydrophobicContact CG2-CG 4.42Å; R630-M804 HydrophobicContact CG-SD 3.91Å; L633-M804 HydrophobicContact CD1-CB 4.34Å; L633-M804 HydrophobicContact CD1-CE 4.23Å; L633-M804 HydrophobicContact CD1-SD 3.84Å; F800-M804 WeakPolarHBondContact O-CB 3.48Å; F800-M804 PolarHBondContact O-N 2.7Å; E801-M804 CarbonylContact O-C 3.58Å; E801-M804 WeakPolarHBondContact O-CA 3.36Å; E801-M804 WeakPolarHBondContact O-CB 3.48Å; E801-M804 PolarHBondContact O-N 3.23Å; M804-S806 VanDerWaalsContact C-N 3.3Å; M804-S806 PolarHBondContact O-N 2.91Å; M804-H807 WeakPolarHBondContact O-CB 3.46Å; M804-H807 PolarHBondContact O-N 2.89Å; M804-H807 VanDerWaalsContact O-N 3.08Å; M804-H810 WeakPolarHBondContact O-CB 3.36Å
805	Y	90.1	Very high	88.9	Confident	122 Å²	122	79 Å²	79	48%	0.478	41%	0.405	S	S	.	.	H	α-helix	trans	-64.5	-33.2	179.5	-61.1	-56.9	0	0	0	112.7	E801 H807 H810	E801-Y805 HydrophobicContact CB-CD2 4.27Å; E801-Y805 HydrophobicContact CB-CE2 3.86Å; E801-Y805 HydrophobicContact CG-CE2 4.47Å; E801-Y805 WeakPolarHBondContact O-CD2 3.43Å; E801-Y805 PolarHBondContact O-N 3.13Å; Y805-H807 VanDerWaalsContact C-N 3.28Å; Y805-H807 PolarHBondContact O-N 2.6Å; Y805-H810 AromaticContact CD1-CD2 3.87Å; Y805-H810 AromaticContact CD1-CE1 3.69Å; Y805-H810 AromaticContact CD1-NE2 3.36Å; Y805-H810 WeakPolarHBondContact CD1-NE2 3.36Å; Y805-H810 AromaticContact CE1-CE1 3.77Å; Y805-H810 AromaticContact CE1-NE2 3.63Å
806	S	89.8	Confident	88.6	Confident	75 Å²	75	80.8 Å²	80.8	52%	0.524	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-13.1	174.3	-58.9	0	0	0	0	113.9	H802 M804	H802-S806 PolarHBondContact CE1-OG 3.45Å; H802-S806 VanDerWaalsContact CE1-OG 3.29Å; H802-S806 PolarHBondContact ND1-OG 2.74Å; H802-S806 WeakPolarHBondContact O-CB 3.49Å; H802-S806 PolarHBondContact O-N 3.45Å; H802-S806 PolarHBondContact O-OG 2.96Å; M804-S806 VanDerWaalsContact C-N 3.3Å; M804-S806 PolarHBondContact O-N 2.91Å
807	H	90	Very high	88.4	Confident	22 Å²	22	80.2 Å²	80.2	10%	0.102	42%	0.419	C	S	.	.	S	Bend	trans	-78.1	130.6	-176.6	-169.4	-98.2	0	0	0	110.4	S622 Y626 R803 M804 Y805 L809 H810	S622-H807 PolarHBondContact O-CE1 2.99Å; S622-H807 PolarHBondContact O-NE2 3.29Å; S622-H807 PolarHBondContact OG-CE1 3.35Å; S622-H807 PolarHBondContact OG-NE2 3.25Å; Y626-H807 HydrophobicContact CD2-CB 3.85Å; Y626-H807 AromaticContact CD2-CG 3.77Å; Y626-H807 AromaticContact CD2-ND1 3.43Å; Y626-H807 WeakPolarHBondContact CD2-ND1 3.14Å; Y626-H807 HydrophobicContact CE2-CB 4.34Å; Y626-H807 AromaticContact CG-ND1 3.84Å; R803-H807 WeakPolarHBondContact O-CB 3.46Å; R803-H807 PolarHBondContact O-N 2.69Å; M804-H807 WeakPolarHBondContact O-CB 3.46Å; M804-H807 PolarHBondContact O-N 2.89Å; M804-H807 VanDerWaalsContact O-N 3.08Å; Y805-H807 VanDerWaalsContact C-N 3.28Å; Y805-H807 PolarHBondContact O-N 2.6Å; H807-L809 WeakPolarHBondContact ND1-CB 3.15Å; H807-L809 PolarHBondContact ND1-N 3.02Å; H807-L809 PolarHBondContact O-N 3.36Å; H807-H810 WeakPolarHBondContact O-CB 3.29Å; H807-H810 PolarHBondContact O-N 3.2Å
808	P	86.1	Confident	88.2	Confident	106 Å²	106	80 Å²	80	69%	0.688	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-53.1	-35.5	-174.6	-29.3	35.5	0	0	0	114.4	H810	P808-H810 VanDerWaalsContact C-N 3.27Å; P808-H810 PolarHBondContact O-N 2.95Å
809	L	85.6	Confident	88	Confident	13 Å²	13	75.7 Å²	75.7	7%	0.068	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-71.1	-15.3	-178.2	-150.6	146.3	0	0	0	113.8	V623 Y626 H807 N811 D812 L815 V818	V623-L809 HydrophobicContact CB-CD1 4.33Å; V623-L809 HydrophobicContact CG1-CD1 4.45Å; V623-L809 HydrophobicContact CG2-CD1 3.78Å; Y626-L809 HydrophobicContact CD1-CD2 4.19Å; H807-L809 WeakPolarHBondContact ND1-CB 3.15Å; H807-L809 PolarHBondContact ND1-N 3.02Å; H807-L809 PolarHBondContact O-N 3.36Å; L809-N811 VanDerWaalsContact C-N 3.27Å; L809-N811 PolarHBondContact O-N 3.43Å; L809-D812 PolarHBondContact O-N 3.44Å; L809-L815 HydrophobicContact CD2-CB 4.16Å; L809-L815 HydrophobicContact CD2-CD1 3.48Å; L809-L815 VanDerWaalsContact CD2-CD1 3.48Å; L809-L815 HydrophobicContact CD2-CG 4.39Å; L809-V818 HydrophobicContact CD1-CG1 4.22Å
810	H	88.2	Confident	87.9	Confident	50 Å²	50	75.6 Å²	75.6	23%	0.231	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-65.4	-32.6	177.7	-170.2	81.3	0	0	0	112.6	Y626 M804 Y805 H807 P808	Y626-H810 HydrophobicContact CE2-CB 3.94Å; Y626-H810 AromaticContact CE2-ND1 3.95Å; Y626-H810 AromaticContact CZ-ND1 3.86Å; Y626-H810 PolarHBondContact OH-ND1 3.06Å; M804-H810 WeakPolarHBondContact O-CB 3.36Å; Y805-H810 AromaticContact CD1-CD2 3.87Å; Y805-H810 AromaticContact CD1-CE1 3.69Å; Y805-H810 AromaticContact CD1-NE2 3.36Å; Y805-H810 WeakPolarHBondContact CD1-NE2 3.36Å; Y805-H810 AromaticContact CE1-CE1 3.77Å; Y805-H810 AromaticContact CE1-NE2 3.63Å; H807-H810 WeakPolarHBondContact O-CB 3.29Å; H807-H810 PolarHBondContact O-N 3.2Å; P808-H810 VanDerWaalsContact C-N 3.27Å; P808-H810 PolarHBondContact O-N 2.95Å
811	N	84.9	Confident	87.7	Confident	129 Å²	129	76.1 Å²	76.1	69%	0.69	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-103.1	9.1	-178.8	-57.5	-62	0	0	0	112.6	L809	L809-N811 VanDerWaalsContact C-N 3.27Å; L809-N811 PolarHBondContact O-N 3.43Å
812	D	85	Confident	87.6	Confident	60 Å²	60	72.5 Å²	72.5	32%	0.321	38%	0.379	S	S	.	.			trans	-80.9	125.1	178.2	-172.2	-28.5	0	0	0	109.9	L809 N814 L815	L809-D812 PolarHBondContact O-N 3.44Å; D812-N814 PolarHBondContact O-N 3.26Å; D812-N814 VanDerWaalsContact O-N 3.09Å; D812-N814 WeakPolarHBondContact OD1-CB 3.43Å; D812-N814 PolarHBondContact OD1-N 2.88Å; D812-N814 PolarHBondContact OD1-ND2 3.33Å; D812-L815 WeakPolarHBondContact O-CB 3.19Å; D812-L815 PolarHBondContact O-N 2.66Å
813	P	83.6	Confident	87.5	Confident	124 Å²	124	70.3 Å²	70.3	81%	0.805	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-17.6	176.9	26	-35.5	0	0	0	113.9
814	N	84.9	Confident	87.5	Confident	95 Å²	95	69.6 Å²	69.6	51%	0.508	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	0.4	175.5	-53.9	-72.1	0	0	0	113.6	D812 E816 T817 V818	D812-N814 PolarHBondContact O-N 3.26Å; D812-N814 VanDerWaalsContact O-N 3.09Å; D812-N814 WeakPolarHBondContact OD1-CB 3.43Å; D812-N814 PolarHBondContact OD1-N 2.88Å; D812-N814 PolarHBondContact OD1-ND2 3.33Å; N814-E816 VanDerWaalsContact C-N 3.3Å; N814-E816 PolarHBondContact O-N 2.97Å; N814-T817 PolarHBondContact O-N 2.94Å; N814-T817 VanDerWaalsContact O-N 3.13Å; N814-V818 HydrophobicContact CB-CG2 4.19Å; N814-V818 WeakPolarHBondContact O-CG2 3.23Å; N814-V818 PolarHBondContact O-N 3.39Å
815	L	86.1	Confident	87.4	Confident	36 Å²	36	69.4 Å²	69.4	19%	0.188	37%	0.368	C	S	.	.	H	α-helix	trans	-39.9	-55.4	-179	158.4	57.1	0	0	0	112.5	Y626 L809 D812 T817 V818 Y819	Y626-L815 HydrophobicContact CD1-CD1 4.1Å; Y626-L815 HydrophobicContact CE1-CD1 3.36Å; L809-L815 HydrophobicContact CD2-CB 4.16Å; L809-L815 HydrophobicContact CD2-CD1 3.48Å; L809-L815 VanDerWaalsContact CD2-CD1 3.48Å; L809-L815 HydrophobicContact CD2-CG 4.39Å; D812-L815 WeakPolarHBondContact O-CB 3.19Å; D812-L815 PolarHBondContact O-N 2.66Å; L815-T817 PolarHBondContact O-N 3.07Å; L815-V818 PolarHBondContact O-N 3.11Å; L815-Y819 WeakPolarHBondContact O-CB 3.22Å; L815-Y819 PolarHBondContact O-N 2.96Å
816	E	85.8	Confident	87.3	Confident	158 Å²	158	63.6 Å²	63.6	74%	0.738	35%	0.345	S	S	*	.	H	α-helix	trans	-63.9	-44.7	-173.5	-171.8	168.9	-148.8	0	0	112.1	N814 V818 Y819 T820	N814-E816 VanDerWaalsContact C-N 3.3Å; N814-E816 PolarHBondContact O-N 2.97Å; E816-V818 PolarHBondContact O-N 3.18Å; E816-Y819 PolarHBondContact O-N 2.68Å; E816-T820 WeakPolarHBondContact O-CB 3.27Å; E816-T820 PolarHBondContact O-N 3.35Å; E816-T820 PolarHBondContact O-OG1 2.84Å
817	T	87.1	Confident	87.3	Confident	96 Å²	96	64.6 Å²	64.6	59%	0.589	34%	0.342	S	S	*	.	H	α-helix	trans	-62.6	-46.4	177.6	-65.3	0	0	0	0	111.4	N814 L815 T820 L821	N814-T817 PolarHBondContact O-N 2.94Å; N814-T817 VanDerWaalsContact O-N 3.13Å; L815-T817 PolarHBondContact O-N 3.07Å; T817-T820 PolarHBondContact O-N 3.15Å; T817-L821 WeakPolarHBondContact O-CG 3.4Å; T817-L821 PolarHBondContact O-N 2.97Å; T817-L821 VanDerWaalsContact O-N 3.09Å
818	V	87.3	Confident	87.3	Confident	18 Å²	18	64.6 Å²	64.6	11%	0.109	34%	0.342	C	S	.	.	H	α-helix	trans	-70.7	-35.6	-177.8	176	0	0	0	0	111.2	I617 V623 L809 N814 L815 E816 L821 C822	I617-V818 HydrophobicContact CG2-CG1 4.21Å; V623-V818 HydrophobicContact CB-CG1 4.21Å; V623-V818 HydrophobicContact CG1-CG1 3.64Å; V623-V818 HydrophobicContact CG2-CG1 3.45Å; V623-V818 VanDerWaalsContact CG2-CG1 3.45Å; L809-V818 HydrophobicContact CD1-CG1 4.22Å; N814-V818 HydrophobicContact CB-CG2 4.19Å; N814-V818 WeakPolarHBondContact O-CG2 3.23Å; N814-V818 PolarHBondContact O-N 3.39Å; L815-V818 PolarHBondContact O-N 3.11Å; E816-V818 PolarHBondContact O-N 3.18Å; V818-L821 PolarHBondContact O-N 3.38Å; V818-C822 PolarHBondContact O-N 2.97Å; V818-C822 VanDerWaalsContact O-N 3.08Å
819	Y	87.8	Confident	87.5	Confident	27 Å²	27	60.3 Å²	60.3	11%	0.106	32%	0.316	C	S	.	.	H	α-helix	trans	-65.2	-47.9	173.4	-173.5	-87.4	0	0	0	111.8	Y626 Y627 R630 L815 E816 L821 C822 E823	Y626-Y819 HydrophobicContact CD1-CD2 4.08Å; Y626-Y819 HydrophobicContact CD1-CE2 4.46Å; Y626-Y819 HydrophobicContact CE1-CD2 4.2Å; Y627-Y819 HydrophobicContact CD2-CD2 4.45Å; Y627-Y819 HydrophobicContact CD2-CE1 4.42Å; Y627-Y819 AromaticContact CD2-CE2 3.79Å; Y627-Y819 HydrophobicContact CD2-CE2 3.79Å; Y627-Y819 AromaticContact CD2-CZ 3.76Å; R630-Y819 HydrophobicContact CB-CE2 4.37Å; R630-Y819 HydrophobicContact CG-CE2 4.48Å; L815-Y819 WeakPolarHBondContact O-CB 3.22Å; L815-Y819 PolarHBondContact O-N 2.96Å; E816-Y819 PolarHBondContact O-N 2.68Å; Y819-L821 VanDerWaalsContact C-N 3.28Å; Y819-L821 PolarHBondContact O-N 3.35Å; Y819-C822 CarbonylContact O-C 3.42Å; Y819-C822 WeakPolarHBondContact O-CA 3.39Å; Y819-C822 WeakPolarHBondContact O-CB 3.2Å; Y819-C822 PolarHBondContact O-N 3.21Å; Y819-C822 VanDerWaalsContact O-N 3.07Å; Y819-E823 WeakPolarHBondContact O-CB 3.22Å; Y819-E823 PolarHBondContact O-N 3.29Å
820	T	88.6	Confident	87.7	Confident	47 Å²	47	62 Å²	62	29%	0.288	33%	0.325	S	S	.	.	H	α-helix	trans	-63.6	-31.4	177	-64.2	0	0	0	0	112.6	E816 T817 K824	E816-T820 WeakPolarHBondContact O-CB 3.27Å; E816-T820 PolarHBondContact O-N 3.35Å; E816-T820 PolarHBondContact O-OG1 2.84Å; T817-T820 PolarHBondContact O-N 3.15Å; T820-K824 HydrophobicContact CG2-CD 4.22Å; T820-K824 WeakPolarHBondContact O-CB 3.29Å; T820-K824 VanDerWaalsContact O-CG 3.29Å; T820-K824 WeakPolarHBondContact O-CG 3.31Å; T820-K824 PolarHBondContact O-N 3.34Å
821	L	88.1	Confident	87.7	Confident	60 Å²	60	62.7 Å²	62.7	31%	0.314	33%	0.33	S	S	.	.	H	α-helix	trans	-67.1	-42.1	170.6	-71.4	173.5	0	0	0	111.9	I615 I617 T817 V818 Y819 K825	I615-L821 HydrophobicContact CG2-CD2 4.44Å; I617-L821 HydrophobicContact CD1-CB 4.41Å; I617-L821 HydrophobicContact CG1-CB 4.33Å; T817-L821 WeakPolarHBondContact O-CG 3.4Å; T817-L821 PolarHBondContact O-N 2.97Å; T817-L821 VanDerWaalsContact O-N 3.09Å; V818-L821 PolarHBondContact O-N 3.38Å; Y819-L821 VanDerWaalsContact C-N 3.28Å; Y819-L821 PolarHBondContact O-N 3.35Å; L821-K825 WeakPolarHBondContact O-CB 3.39Å; L821-K825 PolarHBondContact O-N 2.88Å
822	C	88.4	Confident	87.8	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-64.9	-40.3	175.2	-172.2	0	0	0	0	112.5	I617 V623 V818 Y819 K825 A826	I617-C822 HydrophobicContact CD1-CB 4.1Å; V623-C822 HydrophobicContact CG1-CB 3.56Å; V818-C822 PolarHBondContact O-N 2.97Å; V818-C822 VanDerWaalsContact O-N 3.08Å; Y819-C822 CarbonylContact O-C 3.42Å; Y819-C822 WeakPolarHBondContact O-CA 3.39Å; Y819-C822 WeakPolarHBondContact O-CB 3.2Å; Y819-C822 PolarHBondContact O-N 3.21Å; Y819-C822 VanDerWaalsContact O-N 3.07Å; C822-K825 PolarHBondContact O-N 2.93Å; C822-A826 WeakPolarHBondContact O-CB 3.47Å; C822-A826 PolarHBondContact O-N 3.06Å
823	E	88.6	Confident	88.1	Confident	84 Å²	84	58.1 Å²	58.1	39%	0.393	30%	0.302	S	S	.	.	H	α-helix	trans	-64.1	-46.9	176.5	-176.3	172.1	-116.9	0	0	111.7	Y627 Y819 K825 A826 Q827	Y627-E823 HydrophobicContact CE2-CB 4.1Å; Y627-E823 HydrophobicContact CE2-CG 4.35Å; Y819-E823 WeakPolarHBondContact O-CB 3.22Å; Y819-E823 PolarHBondContact O-N 3.29Å; E823-K825 VanDerWaalsContact C-N 3.34Å; E823-K825 PolarHBondContact O-N 3.39Å; E823-A826 WeakPolarHBondContact O-CB 3.35Å; E823-A826 PolarHBondContact O-N 3.32Å; E823-Q827 PolarHBondContact O-N 3.42Å
824	K	89.1	Confident	88.4	Confident	120 Å²	120	55.1 Å²	55.1	52%	0.522	28%	0.284	S	S	.	.	H	α-helix	trans	-60.1	-42.1	172.7	-74.1	172.3	-179.4	176.7	0	112.2	I615 T820 Q827 I828	I615-K824 HydrophobicContact CD1-CB 4.49Å; T820-K824 HydrophobicContact CG2-CD 4.22Å; T820-K824 WeakPolarHBondContact O-CB 3.29Å; T820-K824 VanDerWaalsContact O-CG 3.29Å; T820-K824 WeakPolarHBondContact O-CG 3.31Å; T820-K824 PolarHBondContact O-N 3.34Å; K824-Q827 PolarHBondContact O-N 2.82Å; K824-I828 WeakPolarHBondContact O-CG1 3.45Å; K824-I828 PolarHBondContact O-N 3.28Å
825	K	90.4	Very high	88.4	Confident	15 Å²	15	50.8 Å²	50.8	7%	0.065	26%	0.261	C	S	.	.	H	α-helix	trans	-68	-33.9	177	-166.6	168.6	-173	174.3	0	112.3	Y612 I615 I617 E620 L821 C822 E823 A829	Y612-K825 HydrophobicContact CD2-CG 3.69Å; Y612-K825 HydrophobicContact CE2-CD 4.16Å; Y612-K825 HydrophobicContact CE2-CG 3.38Å; Y612-K825 WeakPolarHBondContact CE2-O 3.37Å; I615-K825 HydrophobicContact CB-CD 4.34Å; I615-K825 HydrophobicContact CG2-CB 4.23Å; I615-K825 HydrophobicContact CG2-CD 4.14Å; I615-K825 WeakPolarHBondContact O-CE 3.4Å; I615-K825 PolarHBondContact O-NZ 2.83Å; I617-K825 HydrophobicContact CD1-CB 4.07Å; I617-K825 HydrophobicContact CD1-CD 3.64Å; I617-K825 HydrophobicContact CD1-CG 4.47Å; I617-K825 HydrophobicContact CG1-CD 4.15Å; E620-K825 WeakPolarHBondContact OE1-CE 3.28Å; E620-K825 IonicContact OE1-NZ 3.49Å; E620-K825 PolarHBondContact OE1-NZ 2.78Å; E620-K825 IonicContact OE2-NZ 2.9Å; E620-K825 PolarHBondContact OE2-NZ 3.3Å; L821-K825 WeakPolarHBondContact O-CB 3.39Å; L821-K825 PolarHBondContact O-N 2.88Å; C822-K825 PolarHBondContact O-N 2.93Å; E823-K825 VanDerWaalsContact C-N 3.34Å; E823-K825 PolarHBondContact O-N 3.39Å; K825-A829 WeakPolarHBondContact O-CB 3.34Å; K825-A829 PolarHBondContact O-N 3.34Å; K825-A829 VanDerWaalsContact O-N 3.12Å
826	A	88.6	Confident	88.4	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-64.9	-46.6	172	0	0	0	0	0	111.5	P74 F76 Y627 C822 E823 A829 I830	P74-A826 HydrophobicContact CB-CB 4.36Å; P74-A826 HydrophobicContact CG-CB 4.4Å; F76-A826 HydrophobicContact CZ-CB 3.8Å; Y627-A826 HydrophobicContact CE1-CB 4.01Å; C822-A826 WeakPolarHBondContact O-CB 3.47Å; C822-A826 PolarHBondContact O-N 3.06Å; E823-A826 WeakPolarHBondContact O-CB 3.35Å; E823-A826 PolarHBondContact O-N 3.32Å; A826-A829 WeakPolarHBondContact O-CB 3.32Å; A826-A829 PolarHBondContact O-N 3.45Å; A826-I830 WeakPolarHBondContact O-CG1 3.33Å; A826-I830 PolarHBondContact O-N 3.29Å
827	Q	89.4	Confident	88.4	Confident	97 Å²	97	50.5 Å²	50.5	45%	0.453	25%	0.253	S	S	.	.	H	α-helix	trans	-60.6	-49.7	178.4	-173.5	58.7	52.4	0	0	111	E823 K824 A829 I830 D831	E823-Q827 PolarHBondContact O-N 3.42Å; K824-Q827 PolarHBondContact O-N 2.82Å; Q827-A829 VanDerWaalsContact C-N 3.25Å; Q827-A829 PolarHBondContact O-N 2.98Å; Q827-I830 CarbonylContact O-C 3.57Å; Q827-I830 WeakPolarHBondContact O-CA 3.45Å; Q827-I830 WeakPolarHBondContact O-CB 3.43Å; Q827-I830 PolarHBondContact O-N 2.8Å; Q827-D831 PolarHBondContact NE2-OD1 3.02Å; Q827-D831 PolarHBondContact O-N 3.44Å
828	I	90.5	Very high	88.1	Confident	21 Å²	21	50 Å²	50	11%	0.108	24%	0.244	C	C	.	.	H	α-helix	trans	-60.8	-35	177.9	-63.6	161.5	0	0	0	111.3	S608 Q611 Y612 I615 K824 D831 I832	S608-I828 WeakPolarHBondContact O-CG2 3.31Å; Q611-I828 HydrophobicContact CB-CD1 4.32Å; Y612-I828 HydrophobicContact CD2-CG2 4.4Å; I615-I828 HydrophobicContact CD1-CD1 3.58Å; K824-I828 WeakPolarHBondContact O-CG1 3.45Å; K824-I828 PolarHBondContact O-N 3.28Å; I828-D831 PolarHBondContact O-N 3.06Å; I828-I832 HydrophobicContact CG2-CD1 3.88Å; I828-I832 HydrophobicContact CG2-CG1 4.39Å; I828-I832 WeakPolarHBondContact O-CD1 3.49Å; I828-I832 WeakPolarHBondContact O-CG1 3.35Å; I828-I832 PolarHBondContact O-N 3.37Å
829	A	89.7	Confident	87.8	Confident	17 Å²	17	50.3 Å²	50.3	14%	0.14	25%	0.245	C	C	.	.	H	α-helix	trans	-66.1	-38.1	173.3	0	0	0	0	0	113.1	Y612 K825 A826 Q827 K833	Y612-A829 HydrophobicContact CD2-CB 4.29Å; Y612-A829 HydrophobicContact CE2-CB 3.85Å; K825-A829 WeakPolarHBondContact O-CB 3.34Å; K825-A829 PolarHBondContact O-N 3.34Å; K825-A829 VanDerWaalsContact O-N 3.12Å; A826-A829 WeakPolarHBondContact O-CB 3.32Å; A826-A829 PolarHBondContact O-N 3.45Å; Q827-A829 VanDerWaalsContact C-N 3.25Å; Q827-A829 PolarHBondContact O-N 2.98Å; A829-K833 VanDerWaalsContact O-CB 3.31Å; A829-K833 WeakPolarHBondContact O-CB 3.37Å; A829-K833 PolarHBondContact O-N 2.81Å
830	I	89.8	Confident	87.5	Confident	48 Å²	48	56.3 Å²	56.3	25%	0.246	27%	0.272	C	S	.	.	H	α-helix	trans	-65.2	-43.4	172.6	-68.1	161.9	0	0	0	109.9	P74 A826 Q827 K833 S834	P74-I830 HydrophobicContact CB-CG1 4.47Å; A826-I830 WeakPolarHBondContact O-CG1 3.33Å; A826-I830 PolarHBondContact O-N 3.29Å; Q827-I830 CarbonylContact O-C 3.57Å; Q827-I830 WeakPolarHBondContact O-CA 3.45Å; Q827-I830 WeakPolarHBondContact O-CB 3.43Å; Q827-I830 PolarHBondContact O-N 2.8Å; I830-K833 CarbonylContact O-C 3.6Å; I830-K833 PolarHBondContact O-N 2.79Å; I830-S834 WeakPolarHBondContact O-CB 3.5Å; I830-S834 PolarHBondContact O-N 3Å
831	D	88.1	Confident	86.8	Confident	64 Å²	64	60.9 Å²	60.9	34%	0.342	29%	0.287	S	S	.	.	H	α-helix	trans	-63.7	-42.1	178.9	-58.7	-25.8	0	0	0	111.6	Q827 I828 S834 A835	Q827-D831 PolarHBondContact NE2-OD1 3.02Å; Q827-D831 PolarHBondContact O-N 3.44Å; I828-D831 PolarHBondContact O-N 3.06Å; D831-S834 WeakPolarHBondContact O-CB 3.21Å; D831-S834 PolarHBondContact O-N 2.83Å; D831-A835 WeakPolarHBondContact O-CB 3.45Å; D831-A835 PolarHBondContact O-N 3.37Å
832	I	87.9	Confident	85.9	Confident	20 Å²	20	58.4 Å²	58.4	10%	0.103	28%	0.276	C	S	.	.	H	α-helix	trans	-63.7	-45.2	172.6	-66.4	159.3	0	0	0	110.6	E609 Y612 I828 S834 A835 K836	E609-I832 HydrophobicContact CG-CD1 3.89Å; E609-I832 HydrophobicContact CG-CG1 4.23Å; E609-I832 HydrophobicContact CG-CG2 4.15Å; Y612-I832 HydrophobicContact CG-CD1 4.37Å; I828-I832 HydrophobicContact CG2-CD1 3.88Å; I828-I832 HydrophobicContact CG2-CG1 4.39Å; I828-I832 WeakPolarHBondContact O-CD1 3.49Å; I828-I832 WeakPolarHBondContact O-CG1 3.35Å; I828-I832 PolarHBondContact O-N 3.37Å; I832-S834 PolarHBondContact O-N 2.99Å; I832-A835 PolarHBondContact O-N 2.82Å; I832-K836 HydrophobicContact CG2-CD 4.09Å; I832-K836 HydrophobicContact CG2-CG 4.38Å; I832-K836 WeakPolarHBondContact O-CB 3.48Å; I832-K836 WeakPolarHBondContact O-CG 3.31Å; I832-K836 PolarHBondContact O-N 3.3Å
833	K	90.5	Very high	84.8	Confident	73 Å²	73	61.9 Å²	61.9	32%	0.317	29%	0.289	S	S	.	.	H	α-helix	trans	-64.5	-28	176.7	-169.5	-170.6	177.6	-166.3	0	111.8	D72 A829 I830 R837	D72-K833 WeakPolarHBondContact OD1-CD 3.36Å; D72-K833 VanDerWaalsContact OD1-CE 3.24Å; D72-K833 WeakPolarHBondContact OD1-CE 3.38Å; D72-K833 IonicContact OD1-NZ 2.74Å; D72-K833 PolarHBondContact OD1-NZ 2.95Å; A829-K833 VanDerWaalsContact O-CB 3.31Å; A829-K833 WeakPolarHBondContact O-CB 3.37Å; A829-K833 PolarHBondContact O-N 2.81Å; I830-K833 CarbonylContact O-C 3.6Å; I830-K833 PolarHBondContact O-N 2.79Å; K833-R837 WeakPolarHBondContact O-CG 3.47Å; K833-R837 PolarHBondContact O-N 2.89Å; K833-R837 PolarHBondContact O-NE 3.35Å
834	S	88.9	Confident	84.1	Confident	62 Å²	62	61.7 Å²	61.7	43%	0.434	29%	0.293	S	S	.	.	H	α-helix	trans	-75.1	-54.8	173.7	-164.2	0	0	0	0	110.8	I830 D831 I832 K836 R837 E838	I830-S834 WeakPolarHBondContact O-CB 3.5Å; I830-S834 PolarHBondContact O-N 3Å; D831-S834 WeakPolarHBondContact O-CB 3.21Å; D831-S834 PolarHBondContact O-N 2.83Å; I832-S834 PolarHBondContact O-N 2.99Å; S834-K836 VanDerWaalsContact C-N 3.29Å; S834-K836 PolarHBondContact O-N 3.04Å; S834-R837 CarbonylContact O-C 3.6Å; S834-R837 WeakPolarHBondContact O-CA 3.44Å; S834-R837 WeakPolarHBondContact O-CB 3.2Å; S834-R837 PolarHBondContact O-N 2.89Å; S834-E838 PolarHBondContact O-N 2.9Å
835	A	85.4	Confident	83.3	Confident	3 Å²	3	57.5 Å²	57.5	3%	0.025	28%	0.278	C	S	.	.	H	α-helix	trans	-62.9	-29.9	-179.9	0	0	0	0	0	113.4	V605 D831 I832 E838 L839	V605-A835 HydrophobicContact CG2-CB 3.57Å; D831-A835 WeakPolarHBondContact O-CB 3.45Å; D831-A835 PolarHBondContact O-N 3.37Å; I832-A835 PolarHBondContact O-N 2.82Å; A835-E838 WeakPolarHBondContact O-CB 3.46Å; A835-L839 WeakPolarHBondContact O-CB 3.39Å; A835-L839 PolarHBondContact O-N 3.29Å
836	K	86.4	Confident	82.4	Confident	85 Å²	85	58.1 Å²	58.1	37%	0.37	28%	0.282	S	S	.	.	H	α-helix	trans	-74.6	-28.6	170.5	-70.8	-172	179.5	-171.6	0	113.4	V605 E609 I832 S834 K840	V605-K836 HydrophobicContact CG1-CD 4.42Å; V605-K836 VanDerWaalsContact CG1-CE 3.41Å; V605-K836 HydrophobicContact CG1-CG 4.08Å; V605-K836 HydrophobicContact CG2-CG 4.09Å; E609-K836 VanDerWaalsContact OE1-CE 3.28Å; E609-K836 WeakPolarHBondContact OE1-CE 3.25Å; E609-K836 IonicContact OE1-NZ 3.3Å; E609-K836 PolarHBondContact OE1-NZ 2.64Å; I832-K836 HydrophobicContact CG2-CD 4.09Å; I832-K836 HydrophobicContact CG2-CG 4.38Å; I832-K836 WeakPolarHBondContact O-CB 3.48Å; I832-K836 WeakPolarHBondContact O-CG 3.31Å; I832-K836 PolarHBondContact O-N 3.3Å; S834-K836 VanDerWaalsContact C-N 3.29Å; S834-K836 PolarHBondContact O-N 3.04Å; K836-K840 WeakPolarHBondContact O-CB 3.44Å; K836-K840 PolarHBondContact O-N 3.5Å
837	R	85.7	Confident	82.1	Confident	103 Å²	103	59.9 Å²	59.9	39%	0.389	29%	0.29	S	S	.	.	H	α-helix	trans	-71.8	-40.4	169	-82.2	179.8	-75.7	-174.2	-3.3	111.2	D72 K833 S834 K840 K841	D72-R837 VanDerWaalsContact CG-NH2 3.31Å; D72-R837 IonicContact OD1-CZ 3.91Å; D72-R837 IonicContact OD1-NH1 3.48Å; D72-R837 PolarHBondContact OD1-NH1 2.88Å; D72-R837 IonicContact OD1-NH2 2.94Å; D72-R837 PolarHBondContact OD1-NH2 3.47Å; D72-R837 IonicContact OD2-CZ 2.69Å; D72-R837 IonicContact OD2-NH1 3.57Å; D72-R837 PolarHBondContact OD2-NH1 2.82Å; D72-R837 IonicContact OD2-NH2 2.66Å; D72-R837 PolarHBondContact OD2-NH2 3.34Å; D72-R837 VanDerWaalsContact OD2-NH2 3.09Å; K833-R837 WeakPolarHBondContact O-CG 3.47Å; K833-R837 PolarHBondContact O-N 2.89Å; K833-R837 PolarHBondContact O-NE 3.35Å; S834-R837 CarbonylContact O-C 3.6Å; S834-R837 WeakPolarHBondContact O-CA 3.44Å; S834-R837 WeakPolarHBondContact O-CB 3.2Å; S834-R837 PolarHBondContact O-N 2.89Å; R837-K840 PolarHBondContact O-N 3.49Å; R837-K841 WeakPolarHBondContact O-CG 3.4Å; R837-K841 PolarHBondContact O-N 3.05Å
838	E	81.8	Confident	82	Confident	86 Å²	86	56.7 Å²	56.7	40%	0.402	28%	0.275	S	S	.	.	H	α-helix	trans	-55.8	-52.7	171.4	-173.8	177.5	-162.5	0	0	110.5	V601 K604 S834 A835 K840 K841 A842	V601-E838 HydrophobicContact CG1-CB 4.46Å; V601-E838 HydrophobicContact CG1-CG 4.25Å; V601-E838 HydrophobicContact CG2-CG 4.35Å; K604-E838 IonicContact NZ-OE2 3.11Å; K604-E838 PolarHBondContact NZ-OE2 3.24Å; S834-E838 PolarHBondContact O-N 2.9Å; A835-E838 WeakPolarHBondContact O-CB 3.46Å; E838-K840 PolarHBondContact O-N 2.95Å; E838-K841 PolarHBondContact O-N 3.48Å; E838-K841 VanDerWaalsContact O-N 3.16Å; E838-A842 PolarHBondContact O-N 2.66Å
839	L	80.9	Confident	81.9	Confident	25 Å²	25	61 Å²	61	13%	0.131	30%	0.299	C	S	.	.	H	α-helix	trans	-60.2	-40.8	175.8	-174.5	63.1	0	0	0	113.3	I598 V601 V602 A835 K841 A842 R843	I598-L839 HydrophobicContact CG2-CD1 3.89Å; V601-L839 HydrophobicContact CG1-CB 4.11Å; V602-L839 HydrophobicContact CG2-CD1 3.74Å; V602-L839 HydrophobicContact CG2-CD2 4.02Å; A835-L839 WeakPolarHBondContact O-CB 3.39Å; A835-L839 PolarHBondContact O-N 3.29Å; L839-K841 VanDerWaalsContact C-N 3.34Å; L839-K841 PolarHBondContact O-N 3.43Å; L839-A842 PolarHBondContact O-N 3.06Å; L839-R843 PolarHBondContact O-N 3.03Å
840	K	80.9	Confident	82.1	Confident	152 Å²	152	63 Å²	63	66%	0.661	31%	0.305	S	S	*	.	H	α-helix	trans	-63.8	-38.6	175.6	-171.2	-175.7	177.7	-170.5	0	111.7	K836 R837 E838	K836-K840 WeakPolarHBondContact O-CB 3.44Å; K836-K840 PolarHBondContact O-N 3.5Å; R837-K840 PolarHBondContact O-N 3.49Å; E838-K840 PolarHBondContact O-N 2.95Å
841	K	74.3	Confident	82.3	Confident	143 Å²	143	60.7 Å²	60.7	62%	0.622	29%	0.293	S	S	*	.	H	α-helix	trans	-67.9	-42.3	174.3	-73.6	-174.6	175.6	-169.6	0	111.8	R837 E838 L839 R843 T844 L846	R837-K841 WeakPolarHBondContact O-CG 3.4Å; R837-K841 PolarHBondContact O-N 3.05Å; E838-K841 PolarHBondContact O-N 3.48Å; E838-K841 VanDerWaalsContact O-N 3.16Å; L839-K841 VanDerWaalsContact C-N 3.34Å; L839-K841 PolarHBondContact O-N 3.43Å; K841-R843 PolarHBondContact O-N 2.62Å; K841-T844 PolarHBondContact O-N 3.39Å; K841-T844 PolarHBondContact O-OG1 3.35Å; K841-L846 HydrophobicContact CB-CD2 4.16Å; K841-L846 WeakPolarHBondContact O-CD2 3.35Å
842	A	67.8	Low	82.6	Confident	8 Å²	8	62.4 Å²	62.4	7%	0.066	30%	0.298	C	S	.	.	H	α-helix	trans	-65.3	-22.4	-177.2	0	0	0	0	0	114.3	I598 E838 L839 T844	I598-A842 HydrophobicContact CD1-CB 3.91Å; I598-A842 HydrophobicContact CG1-CB 3.62Å; E838-A842 PolarHBondContact O-N 2.66Å; L839-A842 PolarHBondContact O-N 3.06Å; A842-T844 VanDerWaalsContact C-N 3.28Å; A842-T844 PolarHBondContact O-N 3.11Å
843	R	66.8	Low	83	Confident	73 Å²	73	62.2 Å²	62.2	28%	0.275	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-11.6	170.9	-71.1	-173.1	-176.2	159.4	5	114.4	E88 L92 L839 K841	E88-R843 VanDerWaalsContact CD-NH1 3.28Å; E88-R843 IonicContact OE1-CZ 3.6Å; E88-R843 IonicContact OE1-NH1 2.65Å; E88-R843 PolarHBondContact OE1-NH1 3.23Å; E88-R843 IonicContact OE1-NH2 2.75Å; E88-R843 PolarHBondContact OE1-NH2 2.91Å; E88-R843 IonicContact OE2-CZ 2.79Å; E88-R843 IonicContact OE2-NH1 3.86Å; E88-R843 IonicContact OE2-NH2 3.22Å; E88-R843 PolarHBondContact OE2-NH2 2.98Å; L92-R843 HydrophobicContact CD2-CG 4.35Å; L839-R843 PolarHBondContact O-N 3.03Å; K841-R843 PolarHBondContact O-N 2.62Å
844	T	72.6	Confident	83.2	Confident	80 Å²	80	60.8 Å²	60.8	49%	0.491	29%	0.291	S	S	.	.	S	Bend	trans	-103.2	147.4	173.9	52.9	0	0	0	0	110.5	K841 A842 L846	K841-T844 PolarHBondContact O-N 3.39Å; K841-T844 PolarHBondContact O-OG1 3.35Å; A842-T844 VanDerWaalsContact C-N 3.28Å; A842-T844 PolarHBondContact O-N 3.11Å; T844-L846 PolarHBondContact O-N 3.36Å; T844-L846 VanDerWaalsContact O-N 3.12Å
845	V	72.6	Confident	83.6	Confident	32 Å²	32	58.3 Å²	58.3	19%	0.194	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-60.6	117.3	166.9	-178	0	0	0	0	107.6	L585 E586 M848	L585-V845 HydrophobicContact CB-CG1 3.99Å; E586-V845 HydrophobicContact CG-CG1 4.35Å; E586-V845 HydrophobicContact CG-CG2 4.1Å; V845-M848 HydrophobicContact CB-CB 4.12Å; V845-M848 HydrophobicContact CB-CE 4.16Å; V845-M848 HydrophobicContact CG1-CB 4.23Å; V845-M848 HydrophobicContact CG1-CE 3.8Å; V845-M848 WeakPolarHBondContact O-CB 3.39Å
846	L	71.1	Confident	84.1	Confident	28 Å²	28	63.4 Å²	63.4	15%	0.147	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	157.3	-177	-62.1	172.5	0	0	0	109.7	Y590 H594 K841 T844 M848	Y590-L846 HydrophobicContact CD1-CB 4.39Å; Y590-L846 HydrophobicContact CD1-CD1 4.43Å; Y590-L846 HydrophobicContact CE1-CB 3.95Å; Y590-L846 HydrophobicContact CE1-CD1 3.79Å; H594-L846 HydrophobicContact CB-CD1 3.97Å; H594-L846 WeakPolarHBondContact CD2-CD1 3.4Å; H594-L846 WeakPolarHBondContact NE2-CD1 3.36Å; K841-L846 HydrophobicContact CB-CD2 4.16Å; K841-L846 WeakPolarHBondContact O-CD2 3.35Å; T844-L846 PolarHBondContact O-N 3.36Å; T844-L846 VanDerWaalsContact O-N 3.12Å; L846-M848 PolarHBondContact O-N 2.93Å
847	Q	82.3	Confident	84.6	Confident	38 Å²	38	59.3 Å²	59.3	18%	0.178	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.7	-5.7	-171.5	-55.1	172.7	-1	0	0	115.4	F563 L565 L585 D849 E850 L851	F563-Q847 PolarHBondContact O-NE2 2.87Å; L565-Q847 HydrophobicContact CD1-CB 4Å; L565-Q847 HydrophobicContact CG-CB 4.49Å; L585-Q847 HydrophobicContact CD2-CB 3.86Å; Q847-D849 VanDerWaalsContact C-N 3.28Å; Q847-D849 PolarHBondContact O-N 3.37Å; Q847-E850 CarbonylContact O-C 3.55Å; Q847-E850 WeakPolarHBondContact O-CA 3.33Å; Q847-E850 VanDerWaalsContact O-CB 3.29Å; Q847-E850 WeakPolarHBondContact O-CB 3.39Å; Q847-E850 PolarHBondContact O-N 3.29Å; Q847-L851 PolarHBondContact O-N 3.5Å
848	M	87.9	Confident	85.2	Confident	29 Å²	29	54.5 Å²	54.5	14%	0.143	26%	0.255	C	S	.	.	H	α-helix	trans	-60	-31.8	178.8	-176.8	56.9	67.7	0	0	113.6	E582 L585 V845 L846 L851 K852	E582-M848 HydrophobicContact CB-CE 4.14Å; E582-M848 HydrophobicContact CG-CE 3.88Å; E582-M848 HydrophobicContact CG-SD 3.95Å; L585-M848 HydrophobicContact CD1-CE 4Å; V845-M848 HydrophobicContact CB-CB 4.12Å; V845-M848 HydrophobicContact CB-CE 4.16Å; V845-M848 HydrophobicContact CG1-CB 4.23Å; V845-M848 HydrophobicContact CG1-CE 3.8Å; V845-M848 WeakPolarHBondContact O-CB 3.39Å; L846-M848 PolarHBondContact O-N 2.93Å; M848-L851 HydrophobicContact SD-CD2 4.21Å; M848-K852 VanDerWaalsContact O-CE 3.26Å; M848-K852 WeakPolarHBondContact O-CE 3.3Å; M848-K852 VanDerWaalsContact O-CG 3.32Å; M848-K852 WeakPolarHBondContact O-CG 3.39Å; M848-K852 PolarHBondContact O-N 3.03Å
849	D	89.6	Confident	85.9	Confident	112 Å²	112	55.1 Å²	55.1	60%	0.599	25%	0.253	S	S	*	.	H	α-helix	trans	-78.5	-30.7	172.2	-76.6	-27.8	0	0	0	112.8	Q847 K852 C853	Q847-D849 VanDerWaalsContact C-N 3.28Å; Q847-D849 PolarHBondContact O-N 3.37Å; D849-K852 PolarHBondContact O-N 3.2Å; D849-K852 WeakPolarHBondContact OD1-CD 3.46Å; D849-K852 IonicContact OD1-NZ 2.67Å; D849-K852 PolarHBondContact OD1-NZ 3.18Å; D849-C853 PolarHBondContact O-N 3.44Å; D849-C853 PolarHBondContact O-SG 3.28Å
850	E	92.6	Very high	86.6	Confident	59 Å²	59	59.9 Å²	59.9	28%	0.276	27%	0.27	S	S	.	.	H	α-helix	trans	-64.8	-43.2	171	-167.5	-163.3	147.1	0	0	110.5	L565 Q847 K852 C853 R854 L951	L565-E850 HydrophobicContact CD1-CB 4.25Å; L565-E850 HydrophobicContact CD1-CG 4.46Å; Q847-E850 CarbonylContact O-C 3.55Å; Q847-E850 WeakPolarHBondContact O-CA 3.33Å; Q847-E850 VanDerWaalsContact O-CB 3.29Å; Q847-E850 WeakPolarHBondContact O-CB 3.39Å; Q847-E850 PolarHBondContact O-N 3.29Å; E850-K852 VanDerWaalsContact C-N 3.32Å; E850-K852 PolarHBondContact O-N 2.76Å; E850-C853 CarbonylContact O-C 3.5Å; E850-C853 WeakPolarHBondContact O-CA 3.33Å; E850-C853 WeakPolarHBondContact O-CB 3.5Å; E850-C853 PolarHBondContact O-N 3.34Å; E850-R854 WeakPolarHBondContact O-CG 3.39Å; E850-R854 PolarHBondContact O-N 2.87Å; E850-R854 IonicContact OE1-CZ 2.89Å; E850-R854 IonicContact OE1-NE 3.42Å; E850-R854 PolarHBondContact OE1-NE 2.71Å; E850-R854 IonicContact OE1-NH2 2.74Å; E850-R854 PolarHBondContact OE1-NH2 2.67Å; E850-L951 HydrophobicContact CG-CD2 3.97Å
851	L	94.6	Very high	87.4	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-55.6	-44.2	172.8	176.9	60.3	0	0	0	111.8	L565 V570 P581 E582 L585 Q847 M848 C853 R854 K855	L565-L851 HydrophobicContact CD1-CB 3.73Å; V570-L851 HydrophobicContact CG1-CD1 4.03Å; V570-L851 HydrophobicContact CG2-CD1 3.72Å; P581-L851 HydrophobicContact CB-CD1 3.65Å; P581-L851 HydrophobicContact CB-CD2 3.82Å; P581-L851 HydrophobicContact CB-CG 4.38Å; P581-L851 HydrophobicContact CG-CD1 4.49Å; E582-L851 HydrophobicContact CG-CD2 3.97Å; L585-L851 HydrophobicContact CD1-CB 4.09Å; L585-L851 HydrophobicContact CD1-CD2 3.71Å; Q847-L851 PolarHBondContact O-N 3.5Å; M848-L851 HydrophobicContact SD-CD2 4.21Å; L851-C853 VanDerWaalsContact C-N 3.31Å; L851-C853 PolarHBondContact O-N 3.01Å; L851-R854 PolarHBondContact O-N 2.87Å; L851-K855 HydrophobicContact CD1-CD 4.3Å; L851-K855 HydrophobicContact CD1-CG 4.14Å; L851-K855 HydrophobicContact CG-CD 4.31Å; L851-K855 WeakPolarHBondContact O-CB 3.37Å; L851-K855 WeakPolarHBondContact O-CG 3.28Å; L851-K855 PolarHBondContact O-N 2.95Å
852	K	94.4	Very high	88.4	Confident	99 Å²	99	47.8 Å²	47.8	43%	0.43	23%	0.227	S	C	.	.	H	α-helix	trans	-63.3	-37.6	175.8	-67.7	163.6	-152.7	159.3	0	111.8	M848 D849 E850 R856	M848-K852 VanDerWaalsContact O-CE 3.26Å; M848-K852 WeakPolarHBondContact O-CE 3.3Å; M848-K852 VanDerWaalsContact O-CG 3.32Å; M848-K852 WeakPolarHBondContact O-CG 3.39Å; M848-K852 PolarHBondContact O-N 3.03Å; D849-K852 PolarHBondContact O-N 3.2Å; D849-K852 WeakPolarHBondContact OD1-CD 3.46Å; D849-K852 IonicContact OD1-NZ 2.67Å; D849-K852 PolarHBondContact OD1-NZ 3.18Å; E850-K852 VanDerWaalsContact C-N 3.32Å; E850-K852 PolarHBondContact O-N 2.76Å; K852-R856 WeakPolarHBondContact O-CB 3.36Å; K852-R856 PolarHBondContact O-N 2.94Å
853	C	95.8	Very high	89.8	Confident	16 Å²	16	47.4 Å²	47.4	11%	0.108	22%	0.223	C	C	.	.	H	α-helix	trans	-70.6	-41	175.8	-66.3	0	0	0	0	111.9	D849 E850 L851 R856 V857 A949 L951	D849-C853 PolarHBondContact O-N 3.44Å; D849-C853 PolarHBondContact O-SG 3.28Å; E850-C853 CarbonylContact O-C 3.5Å; E850-C853 WeakPolarHBondContact O-CA 3.33Å; E850-C853 WeakPolarHBondContact O-CB 3.5Å; E850-C853 PolarHBondContact O-N 3.34Å; L851-C853 VanDerWaalsContact C-N 3.31Å; L851-C853 PolarHBondContact O-N 3.01Å; C853-R856 WeakPolarHBondContact O-CB 3.43Å; C853-R856 PolarHBondContact O-N 3.43Å; C853-V857 PolarHBondContact O-N 3.44Å; C853-A949 PolarHBondContact SG-O 3.33Å; C853-A949 VanDerWaalsContact SG-O 3.36Å; C853-L951 HydrophobicContact CB-CD2 3.44Å; C853-L951 VanDerWaalsContact CB-CD2 3.44Å; C853-L951 HydrophobicContact CB-CG 3.86Å
854	R	96.1	Very high	91.3	Very high	44 Å²	44	44.1 Å²	44.1	17%	0.166	21%	0.212	C	C	.	.	H	α-helix	trans	-64.2	-46.9	173	-71	-176.1	-176.1	-101.9	6.2	112.2	L565 Y567 E850 L851 R856 V857 L858 L951	L565-R854 PolarHBondContact O-NE 3.42Å; L565-R854 PolarHBondContact O-NH1 3.22Å; L565-R854 VanDerWaalsContact O-NH1 3.16Å; L565-R854 PolarHBondContact O-NH2 3.19Å; Y567-R854 HydrophobicContact CD1-CB 4.12Å; Y567-R854 HydrophobicContact CD1-CG 4.36Å; Y567-R854 HydrophobicContact CE1-CB 3.61Å; Y567-R854 HydrophobicContact CE1-CG 3.7Å; E850-R854 WeakPolarHBondContact O-CG 3.39Å; E850-R854 PolarHBondContact O-N 2.87Å; E850-R854 IonicContact OE1-CZ 2.89Å; E850-R854 IonicContact OE1-NE 3.42Å; E850-R854 PolarHBondContact OE1-NE 2.71Å; E850-R854 IonicContact OE1-NH2 2.74Å; E850-R854 PolarHBondContact OE1-NH2 2.67Å; L851-R854 PolarHBondContact O-N 2.87Å; R854-R856 PolarHBondContact O-N 3.24Å; R854-V857 WeakPolarHBondContact O-CB 3.25Å; R854-V857 PolarHBondContact O-N 3.48Å; R854-L858 WeakPolarHBondContact O-CG 3.25Å; R854-L858 PolarHBondContact O-N 2.88Å; R854-L951 HydrophobicContact CG-CD1 4.09Å; R854-L951 HydrophobicContact CG-CD2 4.17Å
855	K	96.1	Very high	92.4	Very high	9 Å²	9	42.1 Å²	42.1	4%	0.039	20%	0.2	C	C	.	.	H	α-helix	trans	-56.2	-38.1	171.2	-76.6	-176.9	169.9	-169.5	0	111.5	V570 E582 L851 L858 R859 D868	V570-K855 HydrophobicContact CG1-CG 4.35Å; E582-K855 IonicContact OE1-NZ 2.66Å; E582-K855 PolarHBondContact OE1-NZ 3.02Å; E582-K855 IonicContact OE2-NZ 3.98Å; E582-K855 PolarHBondContact OE2-NZ 3.25Å; L851-K855 HydrophobicContact CD1-CD 4.3Å; L851-K855 HydrophobicContact CD1-CG 4.14Å; L851-K855 HydrophobicContact CG-CD 4.31Å; L851-K855 WeakPolarHBondContact O-CB 3.37Å; L851-K855 WeakPolarHBondContact O-CG 3.28Å; L851-K855 PolarHBondContact O-N 2.95Å; K855-L858 PolarHBondContact O-N 3.11Å; K855-R859 WeakPolarHBondContact O-CB 3.47Å; K855-R859 WeakPolarHBondContact O-CD 3.43Å; K855-R859 WeakPolarHBondContact O-CG 3.42Å; K855-R859 PolarHBondContact O-N 3.15Å; K855-D868 WeakPolarHBondContact CD-OD2 3.36Å; K855-D868 WeakPolarHBondContact CE-OD2 3.39Å; K855-D868 IonicContact NZ-OD2 3.46Å; K855-D868 PolarHBondContact NZ-OD2 3.33Å
856	R	96.9	Very high	93.4	Very high	110 Å²	110	45.3 Å²	45.3	42%	0.415	22%	0.223	S	C	.	.	H	α-helix	trans	-63	-39.7	172.6	-178.1	-173.4	-69	130.9	4	112.6	K852 C853 R854 R860 A949	K852-R856 WeakPolarHBondContact O-CB 3.36Å; K852-R856 PolarHBondContact O-N 2.94Å; C853-R856 WeakPolarHBondContact O-CB 3.43Å; C853-R856 PolarHBondContact O-N 3.43Å; R854-R856 PolarHBondContact O-N 3.24Å; R856-R860 WeakPolarHBondContact O-CB 3.39Å; R856-R860 VanDerWaalsContact O-CG 3.3Å; R856-R860 WeakPolarHBondContact O-CG 3.44Å; R856-R860 PolarHBondContact O-N 2.91Å; R856-R860 VanDerWaalsContact O-N 3.09Å; R856-A949 HydrophobicContact CB-CB 4.33Å; R856-A949 HydrophobicContact CG-CB 4.05Å; R856-A949 PolarHBondContact NH1-O 2.91Å
857	V	97.1	Very high	94.4	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.1	-50.6	173.9	175.5	0	0	0	0	111.1	Y567 C853 R854 R859 R860 L861 L886 V945 A949 L951	Y567-V857 HydrophobicContact CE1-CB 4.18Å; Y567-V857 HydrophobicContact CE1-CG1 4.3Å; C853-V857 PolarHBondContact O-N 3.44Å; R854-V857 WeakPolarHBondContact O-CB 3.25Å; R854-V857 PolarHBondContact O-N 3.48Å; V857-R859 VanDerWaalsContact C-N 3.29Å; V857-R859 PolarHBondContact O-N 3.45Å; V857-R860 PolarHBondContact O-N 3.11Å; V857-L861 HydrophobicContact CG1-CD1 3.8Å; V857-L861 HydrophobicContact CG1-CG 4.39Å; V857-L861 PolarHBondContact O-N 3.32Å; V857-L886 HydrophobicContact CG1-CD1 4.17Å; V857-V945 HydrophobicContact CG1-CG1 4.38Å; V857-A949 HydrophobicContact CG2-CB 3.51Å; V857-L951 HydrophobicContact CG2-CD1 3.96Å
858	L	97.5	Very high	94.9	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.005	25%	0.25	C	S	.	.	H	α-helix	trans	-54.9	-44.5	178.5	-65.7	177.4	0	0	0	112	Y567 V570 L571 R854 K855 R860 G862 F863 L886	Y567-L858 HydrophobicContact CD1-CD1 4.36Å; Y567-L858 HydrophobicContact CD1-CD2 3.76Å; Y567-L858 HydrophobicContact CD1-CG 3.97Å; Y567-L858 HydrophobicContact CE1-CD2 4.41Å; Y567-L858 HydrophobicContact CE1-CG 4.38Å; Y567-L858 HydrophobicContact CG-CD2 4.47Å; V570-L858 HydrophobicContact CB-CD1 4.4Å; V570-L858 HydrophobicContact CG1-CD1 3.72Å; L571-L858 HydrophobicContact CD1-CD2 4.03Å; L571-L858 HydrophobicContact CD2-CD1 3.92Å; L571-L858 HydrophobicContact CD2-CD2 4.03Å; L571-L858 HydrophobicContact CG-CD1 4.08Å; L571-L858 HydrophobicContact CG-CD2 4.05Å; R854-L858 WeakPolarHBondContact O-CG 3.25Å; R854-L858 PolarHBondContact O-N 2.88Å; K855-L858 PolarHBondContact O-N 3.11Å; L858-R860 PolarHBondContact O-N 3.4Å; L858-G862 PolarHBondContact O-N 3.19Å; L858-F863 HydrophobicContact CB-CB 4.26Å; L858-F863 HydrophobicContact CD2-CB 3.84Å; L858-F863 HydrophobicContact CD2-CG 4.2Å; L858-F863 PolarHBondContact O-N 3.34Å; L858-L886 HydrophobicContact CD2-CD2 3.73Å
859	R	96.9	Very high	95.2	Very high	100 Å²	100	51.5 Å²	51.5	38%	0.377	27%	0.269	S	S	.	.	H	α-helix	trans	-66.6	-31.4	176.5	-68.4	168.5	-171.4	-175.5	11.7	113.8	K855 V857 A864 T865 D868	K855-R859 WeakPolarHBondContact O-CB 3.47Å; K855-R859 WeakPolarHBondContact O-CD 3.43Å; K855-R859 WeakPolarHBondContact O-CG 3.42Å; K855-R859 PolarHBondContact O-N 3.15Å; V857-R859 VanDerWaalsContact C-N 3.29Å; V857-R859 PolarHBondContact O-N 3.45Å; R859-A864 WeakPolarHBondContact CA-O 3.43Å; R859-T865 WeakPolarHBondContact CG-O 3.2Å; R859-D868 IonicContact CZ-OD1 2.68Å; R859-D868 IonicContact NE-OD1 3.19Å; R859-D868 PolarHBondContact NE-OD1 3.49Å; R859-D868 IonicContact NH2-OD1 3.5Å; R859-D868 PolarHBondContact NH2-OD1 3.22Å; R859-D868 IonicContact NH2-OD2 2.67Å; R859-D868 PolarHBondContact NH2-OD2 3.46Å
860	R	95.8	Very high	95.4	Very high	124 Å²	124	46.7 Å²	46.7	47%	0.468	24%	0.244	S	C	.	.	H	α-helix	trans	-81.7	-28.7	179.2	-76.6	-172.7	73.8	-160.2	5.5	114.1	R856 V857 L858 V945 E948	R856-R860 WeakPolarHBondContact O-CB 3.39Å; R856-R860 VanDerWaalsContact O-CG 3.3Å; R856-R860 WeakPolarHBondContact O-CG 3.44Å; R856-R860 PolarHBondContact O-N 2.91Å; R856-R860 VanDerWaalsContact O-N 3.09Å; V857-R860 PolarHBondContact O-N 3.11Å; L858-R860 PolarHBondContact O-N 3.4Å; R860-V945 HydrophobicContact CB-CG1 3.95Å; R860-V945 PolarHBondContact NH1-O 2.87Å; R860-E948 IonicContact CZ-OE2 2.75Å; R860-E948 IonicContact NH1-OE2 3.65Å; R860-E948 PolarHBondContact NH1-OE2 2.96Å; R860-E948 IonicContact NH2-OE2 2.73Å; R860-E948 PolarHBondContact NH2-OE2 3.35Å
861	L	96.1	Very high	95.6	Very high	10 Å²	10	48 Å²	48	5%	0.052	25%	0.249	C	C	.	.	H	α-helix	trans	-91.3	-14.3	176.4	-61.7	175.7	0	0	0	112.9	V857 F863 K873 I942 V945	V857-L861 HydrophobicContact CG1-CD1 3.8Å; V857-L861 HydrophobicContact CG1-CG 4.39Å; V857-L861 PolarHBondContact O-N 3.32Å; L861-F863 HydrophobicContact CB-CD2 3.61Å; L861-F863 HydrophobicContact CB-CE2 3.57Å; L861-F863 HydrophobicContact CD1-CE2 4.15Å; L861-K873 PolarHBondContact O-NZ 3.49Å; L861-I942 HydrophobicContact CD1-CG1 4.16Å; L861-I942 HydrophobicContact CD1-CG2 4.45Å; L861-V945 HydrophobicContact CD2-CB 4.38Å; L861-V945 HydrophobicContact CD2-CG1 4.13Å; L861-V945 HydrophobicContact CD2-CG2 4.19Å; L861-V945 HydrophobicContact CG-CG1 4.17Å
862	G	96.4	Very high	95.5	Very high	32 Å²	32	52.4 Å²	52.4	33%	0.33	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.4	27.4	175.2	0	0	0	0	0	114.6	L858 E871	L858-G862 PolarHBondContact O-N 3.19Å; G862-E871 WeakPolarHBondContact O-CB 3.35Å
863	F	97.5	Very high	95.6	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.259	C	S	.	.	S	Bend	trans	-84.8	-24.1	175	-69.7	-105.7	0	0	0	112.6	L571 L858 L861 E871 K873 G874 A877 L886 T889 E890	L571-F863 HydrophobicContact CD1-CD1 4.13Å; L571-F863 HydrophobicContact CD2-CB 4.08Å; L858-F863 HydrophobicContact CB-CB 4.26Å; L858-F863 HydrophobicContact CD2-CB 3.84Å; L858-F863 HydrophobicContact CD2-CG 4.2Å; L858-F863 PolarHBondContact O-N 3.34Å; L861-F863 HydrophobicContact CB-CD2 3.61Å; L861-F863 HydrophobicContact CB-CE2 3.57Å; L861-F863 HydrophobicContact CD1-CE2 4.15Å; F863-E871 PolarHBondContact O-N 2.8Å; F863-K873 HydrophobicContact CD1-CB 3.95Å; F863-K873 HydrophobicContact CD2-CB 4.48Å; F863-K873 HydrophobicContact CD2-CD 4.38Å; F863-K873 HydrophobicContact CE1-CB 4.26Å; F863-K873 HydrophobicContact CE2-CD 4.29Å; F863-K873 HydrophobicContact CG-CB 4.07Å; F863-G874 VanDerWaalsContact O-CA 3.27Å; F863-G874 WeakPolarHBondContact O-CA 3.28Å; F863-G874 PolarHBondContact O-N 3.1Å; F863-A877 HydrophobicContact CD1-CB 3.91Å; F863-A877 HydrophobicContact CE1-CB 3.8Å; F863-L886 HydrophobicContact CD1-CD2 4.06Å; F863-L886 HydrophobicContact CD2-CD2 4.17Å; F863-L886 HydrophobicContact CE1-CD2 3.82Å; F863-L886 HydrophobicContact CE2-CD2 3.94Å; F863-L886 HydrophobicContact CG-CD2 4.23Å; F863-L886 HydrophobicContact CZ-CB 4.4Å; F863-L886 HydrophobicContact CZ-CD2 3.77Å; F863-T889 HydrophobicContact CD1-CG2 4.48Å; F863-T889 HydrophobicContact CE1-CG2 3.56Å; F863-T889 HydrophobicContact CZ-CG2 3.92Å; F863-E890 HydrophobicContact CE2-CG 4.39Å; F863-E890 HydrophobicContact CZ-CG 4.41Å
864	A	96.8	Very high	95.6	Very high	3 Å²	3	48.7 Å²	48.7	3%	0.025	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-147.1	156	173.2	0	0	0	0	0	110.4	L574 R859 V869	L574-A864 HydrophobicContact CD1-CB 4.35Å; R859-A864 WeakPolarHBondContact CA-O 3.43Å; A864-V869 WeakPolarHBondContact CA-O 3.5Å
865	T	96.2	Very high	95.5	Very high	39 Å²	39	52.5 Å²	52.5	24%	0.239	27%	0.268	C	S	.	.			trans	-76.1	167.2	176.3	65.7	0	0	0	0	112.2	R859 S867 D868 V869 E871	R859-T865 WeakPolarHBondContact CG-O 3.2Å; T865-S867 PolarHBondContact O-N 3.4Å; T865-S867 VanDerWaalsContact O-N 3.11Å; T865-S867 PolarHBondContact OG1-N 3.39Å; T865-D868 PolarHBondContact O-N 3.48Å; T865-V869 HydrophobicContact CG2-CB 4.41Å; T865-V869 PolarHBondContact N-O 3.41Å; T865-V869 WeakPolarHBondContact OG1-CB 3.34Å; T865-V869 PolarHBondContact OG1-N 3.45Å; T865-V869 VanDerWaalsContact OG1-N 3.15Å; T865-V869 PolarHBondContact OG1-O 3.33Å; T865-E871 HydrophobicContact CG2-CG 4.02Å; T865-E871 WeakPolarHBondContact CG2-OE1 2.99Å
866	S	93.3	Very high	95.4	Very high	99 Å²	99	52 Å²	52	69%	0.692	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-18.1	172.2	-65.4	0	0	0	0	114.4	D868	S866-D868 VanDerWaalsContact C-N 3.34Å
867	S	92.7	Very high	95.4	Very high	103 Å²	103	46.8 Å²	46.8	72%	0.72	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.1	15.5	175.3	-52.4	0	0	0	0	112.7	T865 V869	T865-S867 PolarHBondContact O-N 3.4Å; T865-S867 VanDerWaalsContact O-N 3.11Å; T865-S867 PolarHBondContact OG1-N 3.39Å; S867-V869 PolarHBondContact O-N 3.35Å; S867-V869 VanDerWaalsContact O-N 3.07Å
868	D	92.8	Very high	95.2	Very high	32 Å²	32	47.2 Å²	47.2	17%	0.171	25%	0.249	C	C	.	.	S	Bend	trans	60.2	8.4	-178	-74.3	-18.5	0	0	0	116.6	L574 K855 R859 T865 S866 I870	L574-D868 HydrophobicContact CD1-CB 4.25Å; L574-D868 HydrophobicContact CD2-CB 3.84Å; K855-D868 WeakPolarHBondContact CD-OD2 3.36Å; K855-D868 WeakPolarHBondContact CE-OD2 3.39Å; K855-D868 IonicContact NZ-OD2 3.46Å; K855-D868 PolarHBondContact NZ-OD2 3.33Å; R859-D868 IonicContact CZ-OD1 2.68Å; R859-D868 IonicContact NE-OD1 3.19Å; R859-D868 PolarHBondContact NE-OD1 3.49Å; R859-D868 IonicContact NH2-OD1 3.5Å; R859-D868 PolarHBondContact NH2-OD1 3.22Å; R859-D868 IonicContact NH2-OD2 2.67Å; R859-D868 PolarHBondContact NH2-OD2 3.46Å; T865-D868 PolarHBondContact O-N 3.48Å; S866-D868 VanDerWaalsContact C-N 3.34Å; D868-I870 PolarHBondContact O-N 3.24Å
869	V	93.9	Very high	95	Very high	90 Å²	90	48.7 Å²	48.7	55%	0.545	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-67.8	130.2	167.8	-175	0	0	0	0	109.9	A864 T865 S867	A864-V869 WeakPolarHBondContact CA-O 3.5Å; T865-V869 HydrophobicContact CG2-CB 4.41Å; T865-V869 PolarHBondContact N-O 3.41Å; T865-V869 WeakPolarHBondContact OG1-CB 3.34Å; T865-V869 PolarHBondContact OG1-N 3.45Å; T865-V869 VanDerWaalsContact OG1-N 3.15Å; T865-V869 PolarHBondContact OG1-O 3.33Å; S867-V869 PolarHBondContact O-N 3.35Å; S867-V869 VanDerWaalsContact O-N 3.07Å
870	I	94.6	Very high	94.9	Very high	11 Å²	11	43.9 Å²	43.9	6%	0.056	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-70.8	131.9	-178.5	-165.3	173.7	0	0	0	113.3	L571 R575 D868 R875 C878	L571-I870 HydrophobicContact CB-CD1 4.42Å; L571-I870 HydrophobicContact CD2-CD1 4.29Å; L571-I870 HydrophobicContact CD2-CG1 4.3Å; L571-I870 WeakPolarHBondContact O-CD1 3.34Å; R575-I870 HydrophobicContact CB-CD1 4Å; R575-I870 HydrophobicContact CG-CD1 4.42Å; D868-I870 PolarHBondContact O-N 3.24Å; I870-R875 HydrophobicContact CD1-CG 4.24Å; I870-R875 HydrophobicContact CG1-CG 4.35Å; I870-R875 HydrophobicContact CG2-CG 4.3Å; I870-C878 VanDerWaalsContact CD1-SG 3.56Å
871	E	95.8	Very high	94.6	Very high	85 Å²	85	41.3 Å²	41.3	40%	0.397	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-90	172.1	178.5	-80.7	-69.6	177.5	0	0	112.6	G862 F863 T865 K873 G874 R875	G862-E871 WeakPolarHBondContact O-CB 3.35Å; F863-E871 PolarHBondContact O-N 2.8Å; T865-E871 HydrophobicContact CG2-CG 4.02Å; T865-E871 WeakPolarHBondContact CG2-OE1 2.99Å; E871-K873 VanDerWaalsContact C-N 3.3Å; E871-K873 PolarHBondContact O-N 3.19Å; E871-G874 WeakPolarHBondContact O-CA 3.32Å; E871-G874 PolarHBondContact O-N 2.84Å; E871-R875 PolarHBondContact O-N 3.22Å
872	M	93.7	Very high	94.1	Very high	93 Å²	93	42 Å²	42	46%	0.458	24%	0.244	S	C	.	.	H	α-helix	trans	-55.3	-41.2	176.1	-75.7	-59.1	-63.9	0	0	112.9	G874 R875 V876 A1013	M872-G874 VanDerWaalsContact C-N 3.32Å; M872-G874 PolarHBondContact O-N 2.74Å; M872-R875 PolarHBondContact O-N 3.12Å; M872-V876 VanDerWaalsContact O-CG2 3.31Å; M872-V876 WeakPolarHBondContact O-CG2 3.34Å; M872-V876 PolarHBondContact O-N 3.25Å; M872-A1013 WeakPolarHBondContact CE-O 3.45Å
873	K	95.7	Very high	93.9	Very high	38 Å²	38	41.2 Å²	41.2	17%	0.165	24%	0.235	C	C	.	.	H	α-helix	trans	-59.5	-41.3	171.8	-78	-172.8	177.2	-174.8	0	112.6	L861 F863 E871 V876 A877 T889 E890 F893	L861-K873 PolarHBondContact O-NZ 3.49Å; F863-K873 HydrophobicContact CD1-CB 3.95Å; F863-K873 HydrophobicContact CD2-CB 4.48Å; F863-K873 HydrophobicContact CD2-CD 4.38Å; F863-K873 HydrophobicContact CE1-CB 4.26Å; F863-K873 HydrophobicContact CE2-CD 4.29Å; F863-K873 HydrophobicContact CG-CB 4.07Å; E871-K873 VanDerWaalsContact C-N 3.3Å; E871-K873 PolarHBondContact O-N 3.19Å; K873-V876 PolarHBondContact O-N 2.95Å; K873-A877 PolarHBondContact O-N 3.04Å; K873-A877 VanDerWaalsContact O-N 3.08Å; K873-T889 HydrophobicContact CB-CG2 4.19Å; K873-T889 HydrophobicContact CG-CG2 4.34Å; K873-E890 IonicContact NZ-OE1 2.7Å; K873-E890 PolarHBondContact NZ-OE1 3.37Å; K873-E890 IonicContact NZ-OE2 3.18Å; K873-F893 HydrophobicContact CB-CE2 4.45Å; K873-F893 HydrophobicContact CB-CZ 4.46Å; K873-F893 HydrophobicContact CD-CG 4.46Å; K873-F893 HydrophobicContact CG-CD1 3.91Å; K873-F893 HydrophobicContact CG-CD2 3.91Å; K873-F893 HydrophobicContact CG-CE1 3.79Å; K873-F893 HydrophobicContact CG-CE2 3.78Å; K873-F893 HydrophobicContact CG-CG 3.96Å; K873-F893 HydrophobicContact CG-CZ 3.72Å
874	G	95.5	Very high	93.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60.7	-46	177.3	0	0	0	0	0	111.9	F863 E871 M872 V876 A877 C878	F863-G874 VanDerWaalsContact O-CA 3.27Å; F863-G874 WeakPolarHBondContact O-CA 3.28Å; F863-G874 PolarHBondContact O-N 3.1Å; E871-G874 WeakPolarHBondContact O-CA 3.32Å; E871-G874 PolarHBondContact O-N 2.84Å; M872-G874 VanDerWaalsContact C-N 3.32Å; M872-G874 PolarHBondContact O-N 2.74Å; G874-V876 VanDerWaalsContact C-N 3.26Å; G874-V876 PolarHBondContact O-N 2.74Å; G874-A877 PolarHBondContact O-N 2.89Å; G874-C878 PolarHBondContact O-N 2.99Å; G874-C878 PolarHBondContact O-SG 3.08Å
875	R	93.3	Very high	93.7	Very high	123 Å²	123	43.8 Å²	43.8	46%	0.464	25%	0.247	S	C	.	.	H	α-helix	trans	-60.5	-34.2	177.8	-67	175.3	-178.4	-94.9	-6.1	112.9	I870 E871 M872	I870-R875 HydrophobicContact CD1-CG 4.24Å; I870-R875 HydrophobicContact CG1-CG 4.35Å; I870-R875 HydrophobicContact CG2-CG 4.3Å; E871-R875 PolarHBondContact O-N 3.22Å; M872-R875 PolarHBondContact O-N 3.12Å
876	V	95.1	Very high	93.7	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-69.5	-47.8	175.7	175	0	0	0	0	111.1	M872 K873 G874 C878 E879 T889 M892 F893 A1010 A1013 I1014	M872-V876 VanDerWaalsContact O-CG2 3.31Å; M872-V876 WeakPolarHBondContact O-CG2 3.34Å; M872-V876 PolarHBondContact O-N 3.25Å; K873-V876 PolarHBondContact O-N 2.95Å; G874-V876 VanDerWaalsContact C-N 3.26Å; G874-V876 PolarHBondContact O-N 2.74Å; V876-C878 VanDerWaalsContact C-N 3.27Å; V876-C878 PolarHBondContact O-N 3.3Å; V876-E879 PolarHBondContact O-N 3.07Å; V876-T889 HydrophobicContact CB-CG2 4.18Å; V876-T889 HydrophobicContact CG1-CG2 3.99Å; V876-M892 HydrophobicContact CG1-SD 4.36Å; V876-F893 HydrophobicContact CB-CE2 4.34Å; V876-F893 HydrophobicContact CG1-CE2 4.39Å; V876-F893 HydrophobicContact CG2-CE2 4.05Å; V876-F893 HydrophobicContact CG2-CZ 4.34Å; V876-A1010 HydrophobicContact CG1-CB 3.76Å; V876-A1013 HydrophobicContact CG2-CB 4.34Å; V876-I1014 HydrophobicContact CG2-CG2 3.35Å
877	A	96.2	Very high	93.9	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-64.5	-25.9	176.4	0	0	0	0	0	114	N568 L571 F863 K873 G874 E879 I880 E885	N568-A877 PolarHBondContact ND2-O 3.34Å; L571-A877 HydrophobicContact CD1-CB 3.63Å; F863-A877 HydrophobicContact CD1-CB 3.91Å; F863-A877 HydrophobicContact CE1-CB 3.8Å; K873-A877 PolarHBondContact O-N 3.04Å; K873-A877 VanDerWaalsContact O-N 3.08Å; G874-A877 PolarHBondContact O-N 2.89Å; A877-E879 PolarHBondContact O-N 2.97Å; A877-I880 PolarHBondContact O-N 3.22Å; A877-E885 HydrophobicContact CB-CB 4.16Å
878	C	94.4	Very high	94.1	Very high	9 Å²	9	32.4 Å²	32.4	6%	0.061	17%	0.169	C	C	.	.	H	α-helix	trans	-59.2	-31.6	173.6	-71.9	0	0	0	0	113.6	N568 N572 R575 I870 G874 V876	N568-C878 PolarHBondContact ND2-O 3.21Å; N572-C878 PolarHBondContact ND2-O 3.45Å; N572-C878 WeakPolarHBondContact OD1-CB 3.36Å; R575-C878 VanDerWaalsContact NH1-CB 3.35Å; I870-C878 VanDerWaalsContact CD1-SG 3.56Å; G874-C878 PolarHBondContact O-N 2.99Å; G874-C878 PolarHBondContact O-SG 3.08Å; V876-C878 VanDerWaalsContact C-N 3.27Å; V876-C878 PolarHBondContact O-N 3.3Å
879	E	92.9	Very high	94.3	Very high	31 Å²	31	30.9 Å²	30.9	15%	0.145	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-7.1	-179.1	-57.6	-57.9	125.5	0	0	113.1	R238 R575 V876 A877 Q1006 Q1009	R238-E879 IonicContact CZ-OE2 2.58Å; R238-E879 IonicContact NE-OE2 2.71Å; R238-E879 PolarHBondContact NE-OE2 3.37Å; R238-E879 IonicContact NH2-OE2 2.66Å; R238-E879 PolarHBondContact NH2-OE2 3.16Å; R575-E879 IonicContact CZ-OE1 3.31Å; R575-E879 IonicContact NH1-OE1 2.6Å; R575-E879 PolarHBondContact NH1-OE1 3.46Å; R575-E879 IonicContact NH2-OE1 3.36Å; V876-E879 PolarHBondContact O-N 3.07Å; A877-E879 PolarHBondContact O-N 2.97Å; E879-Q1006 VanDerWaalsContact O-CB 3.3Å; E879-Q1006 WeakPolarHBondContact O-CB 3.35Å; E879-Q1006 VanDerWaalsContact O-CG 3.29Å; E879-Q1006 WeakPolarHBondContact O-CG 3.36Å; E879-Q1009 HydrophobicContact CB-CB 4.36Å
880	I	94.1	Very high	94.4	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.135	C	C	.	.			trans	-101.6	120.5	175.4	-56.5	175	0	0	0	108.9	N568 A877 E885 L888 L1003 M1007 A1010	N568-I880 PolarHBondContact ND2-O 2.9Å; A877-I880 PolarHBondContact O-N 3.22Å; I880-E885 HydrophobicContact CB-CB 4.22Å; I880-E885 HydrophobicContact CG2-CB 4.24Å; I880-L888 HydrophobicContact CD1-CB 3.95Å; I880-L888 HydrophobicContact CG2-CD1 3.77Å; I880-L1003 HydrophobicContact CG2-CD1 4.31Å; I880-M1007 HydrophobicContact CD1-SD 3.86Å; I880-M1007 HydrophobicContact CG1-SD 4.42Å; I880-A1010 HydrophobicContact CD1-CB 4.2Å; I880-A1010 HydrophobicContact CG1-CB 4.18Å
881	S	89.1	Confident	94.5	Very high	69 Å²	69	26.2 Å²	26.2	48%	0.483	13%	0.133	S	C	.	.			trans	-143.5	-10.5	-176.6	62.9	0	0	0	0	115.3	Q1006	S881-Q1006 PolarHBondContact OG-NE2 2.8Å
882	S	86.1	Confident	94.4	Very high	25 Å²	25	22.5 Å²	22.5	18%	0.175	12%	0.116	C	C	.	.	S	Bend	trans	-88.5	-2.1	177.4	-65.3	0	0	0	0	114.5	Q1006	S882-Q1006 PolarHBondContact OG-NE2 3.43Å
883	A	92	Very high	94.5	Very high	16 Å²	16	22 Å²	22	13%	0.132	11%	0.111	C	C	.	.	S	Bend	trans	-163	172.4	-170.2	0	0	0	0	0	110.8	E885 L888 F912 L1003	A883-E885 PolarHBondContact O-N 3.35Å; A883-L888 HydrophobicContact CB-CD1 3.61Å; A883-F912 HydrophobicContact CB-CB 3.76Å; A883-F912 HydrophobicContact CB-CD1 4.22Å; A883-F912 HydrophobicContact CB-CG 4.4Å; A883-L1003 HydrophobicContact CB-CD1 3.71Å; A883-L1003 HydrophobicContact CB-CD2 3.8Å; A883-L1003 HydrophobicContact CB-CG 4.4Å
884	D	95	Very high	94.4	Very high	34 Å²	34	24.1 Å²	24.1	18%	0.182	12%	0.124	C	C	.	.			trans	-58.2	104.3	179.9	-167.4	-60.9	0	0	0	113	L886 L887 L888 F912 Y958 F962	D884-L886 VanDerWaalsContact C-N 3.32Å; D884-L886 PolarHBondContact O-N 3.09Å; D884-L886 PolarHBondContact OD1-N 2.77Å; D884-L886 VanDerWaalsContact OD1-N 3.1Å; D884-L887 HydrophobicContact CB-CB 4.25Å; D884-L887 WeakPolarHBondContact OD1-CB 3.48Å; D884-L887 PolarHBondContact OD1-N 3.01Å; D884-L888 WeakPolarHBondContact O-CB 3.49Å; D884-L888 VanDerWaalsContact O-CG 3.29Å; D884-L888 WeakPolarHBondContact O-CG 3.46Å; D884-L888 PolarHBondContact O-N 2.95Å; D884-L888 VanDerWaalsContact O-N 3.14Å; D884-F912 HydrophobicContact CB-CD1 4.26Å; D884-F912 HydrophobicContact CB-CE1 4.32Å; D884-Y958 PolarHBondContact OD2-OH 2.89Å; D884-F962 HydrophobicContact CB-CE1 3.95Å; D884-F962 HydrophobicContact CB-CZ 4.03Å
885	E	95.2	Very high	94.3	Very high	23 Å²	23	25 Å²	25	11%	0.107	13%	0.133	C	C	.	.	H	α-helix	trans	-69.1	-25.6	-174.6	63.1	-87.1	-147.4	0	0	113.3	Y567 N568 A877 I880 A883 T889	Y567-E885 VanDerWaalsContact CA-OE1 3.29Å; Y567-E885 WeakPolarHBondContact CA-OE1 3.34Å; Y567-E885 VanDerWaalsContact CB-OE1 3.25Å; Y567-E885 WeakPolarHBondContact CB-OE1 3.28Å; Y567-E885 PolarHBondContact N-OE1 2.98Å; N568-E885 HydrophobicContact CB-CG 4.18Å; N568-E885 PolarHBondContact N-OE1 3.29Å; A877-E885 HydrophobicContact CB-CB 4.16Å; I880-E885 HydrophobicContact CB-CB 4.22Å; I880-E885 HydrophobicContact CG2-CB 4.24Å; A883-E885 PolarHBondContact O-N 3.35Å; E885-T889 VanDerWaalsContact O-CB 3.31Å; E885-T889 WeakPolarHBondContact O-CB 3.28Å; E885-T889 PolarHBondContact O-OG1 3.01Å
886	L	96.6	Very high	94.4	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.005	11%	0.114	C	C	.	.	H	α-helix	trans	-79.4	-50	177.2	-64.7	-174.9	0	0	0	111	Y567 V857 L858 F863 D884 T889 E890 I942	Y567-L886 HydrophobicContact CD1-CD1 4.07Å; Y567-L886 HydrophobicContact CD2-CD1 3.52Å; Y567-L886 HydrophobicContact CD2-CG 3.96Å; Y567-L886 HydrophobicContact CE1-CD1 3.99Å; Y567-L886 HydrophobicContact CE2-CD1 3.44Å; Y567-L886 VanDerWaalsContact CE2-CD1 3.44Å; Y567-L886 HydrophobicContact CE2-CG 4.37Å; Y567-L886 HydrophobicContact CG-CD1 3.82Å; Y567-L886 HydrophobicContact CG-CD2 4.29Å; Y567-L886 HydrophobicContact CG-CG 4.06Å; V857-L886 HydrophobicContact CG1-CD1 4.17Å; L858-L886 HydrophobicContact CD2-CD2 3.73Å; F863-L886 HydrophobicContact CD1-CD2 4.06Å; F863-L886 HydrophobicContact CD2-CD2 4.17Å; F863-L886 HydrophobicContact CE1-CD2 3.82Å; F863-L886 HydrophobicContact CE2-CD2 3.94Å; F863-L886 HydrophobicContact CG-CD2 4.23Å; F863-L886 HydrophobicContact CZ-CB 4.4Å; F863-L886 HydrophobicContact CZ-CD2 3.77Å; D884-L886 VanDerWaalsContact C-N 3.32Å; D884-L886 PolarHBondContact O-N 3.09Å; D884-L886 PolarHBondContact OD1-N 2.77Å; D884-L886 VanDerWaalsContact OD1-N 3.1Å; L886-T889 PolarHBondContact O-N 3.03Å; L886-E890 PolarHBondContact O-N 2.79Å; L886-I942 HydrophobicContact CB-CD1 4.17Å; L886-I942 HydrophobicContact CD1-CG2 4.3Å
887	L	96.8	Very high	94.4	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-66.7	-45	-175.9	178.6	55.7	0	0	0	111.3	D884 T889 E890 M891 F912 M935 C938 A939 I942 F962	D884-L887 HydrophobicContact CB-CB 4.25Å; D884-L887 WeakPolarHBondContact OD1-CB 3.48Å; D884-L887 PolarHBondContact OD1-N 3.01Å; L887-T889 VanDerWaalsContact C-N 3.33Å; L887-T889 PolarHBondContact O-N 3Å; L887-E890 PolarHBondContact O-N 3.22Å; L887-M891 HydrophobicContact CD1-CG 4.08Å; L887-M891 HydrophobicContact CD1-SD 3.88Å; L887-M891 HydrophobicContact CG-SD 3.81Å; L887-M891 WeakPolarHBondContact O-CB 3.39Å; L887-M891 WeakPolarHBondContact O-CG 3.42Å; L887-M891 PolarHBondContact O-N 3.02Å; L887-F912 HydrophobicContact CB-CE1 4.15Å; L887-F912 HydrophobicContact CD2-CE1 3.67Å; L887-F912 HydrophobicContact CD2-CZ 3.73Å; L887-F912 HydrophobicContact CG-CE1 3.86Å; L887-F912 HydrophobicContact CG-CZ 3.9Å; L887-M935 HydrophobicContact CD2-CG 4.37Å; L887-C938 HydrophobicContact CD1-CB 3.57Å; L887-A939 HydrophobicContact CD1-CB 4.12Å; L887-A939 HydrophobicContact CD2-CB 3.78Å; L887-I942 VanDerWaalsContact CA-CD1 3.48Å; L887-I942 HydrophobicContact CB-CD1 3.88Å; L887-I942 HydrophobicContact CD1-CD1 4Å; L887-F962 HydrophobicContact CD2-CD1 4.31Å; L887-F962 HydrophobicContact CD2-CD2 4.3Å; L887-F962 HydrophobicContact CD2-CE1 3.77Å; L887-F962 HydrophobicContact CD2-CE2 3.75Å; L887-F962 HydrophobicContact CD2-CZ 3.47Å; L887-F962 VanDerWaalsContact CD2-CZ 3.47Å
888	L	97	Very high	94.3	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61.8	-41.4	177.2	-69.9	171.7	0	0	0	112	I880 A883 D884 M891 M892 F897 L909 F912 L1003 M1007	I880-L888 HydrophobicContact CD1-CB 3.95Å; I880-L888 HydrophobicContact CG2-CD1 3.77Å; A883-L888 HydrophobicContact CB-CD1 3.61Å; D884-L888 WeakPolarHBondContact O-CB 3.49Å; D884-L888 VanDerWaalsContact O-CG 3.29Å; D884-L888 WeakPolarHBondContact O-CG 3.46Å; D884-L888 PolarHBondContact O-N 2.95Å; D884-L888 VanDerWaalsContact O-N 3.14Å; L888-M891 PolarHBondContact O-N 3.24Å; L888-M892 WeakPolarHBondContact O-CG 3.4Å; L888-M892 PolarHBondContact O-N 3.36Å; L888-F897 HydrophobicContact CD2-CZ 4.36Å; L888-L909 HydrophobicContact CD2-CD2 3.41Å; L888-L909 VanDerWaalsContact CD2-CD2 3.41Å; L888-F912 HydrophobicContact CD1-CD1 4.05Å; L888-F912 HydrophobicContact CD1-CE1 4.32Å; L888-F912 HydrophobicContact CD2-CD1 3.9Å; L888-F912 HydrophobicContact CD2-CD2 4.11Å; L888-F912 HydrophobicContact CD2-CE1 3.58Å; L888-F912 HydrophobicContact CD2-CE2 3.82Å; L888-F912 HydrophobicContact CD2-CG 4.16Å; L888-F912 HydrophobicContact CD2-CZ 3.56Å; L888-F912 HydrophobicContact CG-CD1 3.83Å; L888-F912 HydrophobicContact CG-CE1 3.58Å; L888-F912 HydrophobicContact CG-CG 4.49Å; L888-F912 HydrophobicContact CG-CZ 4.07Å; L888-L1003 HydrophobicContact CD1-CD1 3.82Å; L888-L1003 HydrophobicContact CD1-CD2 4.34Å; L888-M1007 HydrophobicContact CB-CE 4.49Å; L888-M1007 HydrophobicContact CB-SD 4.16Å; L888-M1007 HydrophobicContact CD1-SD 4.19Å; L888-M1007 HydrophobicContact CD2-CE 4.42Å; L888-M1007 HydrophobicContact CD2-SD 4.36Å; L888-M1007 HydrophobicContact CG-SD 4.49Å
889	T	96.8	Very high	94.1	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-69.1	-42.6	177	-55.7	0	0	0	0	112	F863 K873 V876 E885 L886 L887 M891 M892 F893	F863-T889 HydrophobicContact CD1-CG2 4.48Å; F863-T889 HydrophobicContact CE1-CG2 3.56Å; F863-T889 HydrophobicContact CZ-CG2 3.92Å; K873-T889 HydrophobicContact CB-CG2 4.19Å; K873-T889 HydrophobicContact CG-CG2 4.34Å; V876-T889 HydrophobicContact CB-CG2 4.18Å; V876-T889 HydrophobicContact CG1-CG2 3.99Å; E885-T889 VanDerWaalsContact O-CB 3.31Å; E885-T889 WeakPolarHBondContact O-CB 3.28Å; E885-T889 PolarHBondContact O-OG1 3.01Å; L886-T889 PolarHBondContact O-N 3.03Å; L887-T889 VanDerWaalsContact C-N 3.33Å; L887-T889 PolarHBondContact O-N 3Å; T889-M891 VanDerWaalsContact C-N 3.31Å; T889-M891 PolarHBondContact O-N 3.01Å; T889-M892 PolarHBondContact O-N 3.09Å; T889-F893 HydrophobicContact CG2-CD2 3.75Å; T889-F893 HydrophobicContact CG2-CE2 3.85Å; T889-F893 WeakPolarHBondContact O-CD2 3.4Å; T889-F893 PolarHBondContact O-N 3.47Å
890	E	96.4	Very high	94.3	Very high	3 Å²	3	29.9 Å²	29.9	1%	0.014	17%	0.169	C	C	.	.	H	α-helix	trans	-59.2	-42.4	172.5	-79.5	-67	120.4	0	0	111	F863 K873 L886 L887 M892 F893 N894 R941 I942	F863-E890 HydrophobicContact CE2-CG 4.39Å; F863-E890 HydrophobicContact CZ-CG 4.41Å; K873-E890 IonicContact NZ-OE1 2.7Å; K873-E890 PolarHBondContact NZ-OE1 3.37Å; K873-E890 IonicContact NZ-OE2 3.18Å; L886-E890 PolarHBondContact O-N 2.79Å; L887-E890 PolarHBondContact O-N 3.22Å; E890-M892 PolarHBondContact O-N 3.49Å; E890-F893 PolarHBondContact O-N 3.13Å; E890-N894 VanDerWaalsContact O-CB 3.22Å; E890-N894 WeakPolarHBondContact O-CB 3.43Å; E890-N894 PolarHBondContact O-N 3.35Å; E890-N894 PolarHBondContact O-ND2 3.09Å; E890-R941 IonicContact OE2-CZ 3.58Å; E890-R941 IonicContact OE2-NH1 2.73Å; E890-R941 PolarHBondContact OE2-NH1 3.37Å; E890-R941 IonicContact OE2-NH2 2.74Å; E890-I942 HydrophobicContact CB-CD1 4.31Å; E890-I942 HydrophobicContact CG-CD1 4.01Å; E890-I942 HydrophobicContact CG-CG1 4.38Å
891	M	96.1	Very high	94.3	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-63.5	-39.5	177.4	-70.6	166.6	62.9	0	0	112.6	L887 L888 T889 G895 L896 F897 L908 F912 M935 C938	L887-M891 HydrophobicContact CD1-CG 4.08Å; L887-M891 HydrophobicContact CD1-SD 3.88Å; L887-M891 HydrophobicContact CG-SD 3.81Å; L887-M891 WeakPolarHBondContact O-CB 3.39Å; L887-M891 WeakPolarHBondContact O-CG 3.42Å; L887-M891 PolarHBondContact O-N 3.02Å; L888-M891 PolarHBondContact O-N 3.24Å; T889-M891 VanDerWaalsContact C-N 3.31Å; T889-M891 PolarHBondContact O-N 3.01Å; M891-G895 PolarHBondContact O-N 2.92Å; M891-L896 HydrophobicContact CB-CB 4.33Å; M891-L896 HydrophobicContact CB-CD1 4.46Å; M891-L896 HydrophobicContact CE-CD1 3.98Å; M891-L896 HydrophobicContact CE-CD2 3.88Å; M891-L896 HydrophobicContact CG-CD1 4.12Å; M891-L896 WeakPolarHBondContact O-CB 3.46Å; M891-L896 PolarHBondContact O-N 3.49Å; M891-F897 HydrophobicContact CB-CD2 4.32Å; M891-F897 HydrophobicContact CB-CE2 3.7Å; M891-F897 HydrophobicContact CB-CZ 4.42Å; M891-F897 HydrophobicContact CE-CE1 4.41Å; M891-F897 HydrophobicContact CE-CE2 4.14Å; M891-F897 HydrophobicContact CE-CZ 3.73Å; M891-L908 HydrophobicContact CE-CD2 3.55Å; M891-L908 HydrophobicContact CE-CG 4.21Å; M891-F912 HydrophobicContact CE-CE2 4.46Å; M891-F912 HydrophobicContact CE-CZ 4.37Å; M891-F912 HydrophobicContact SD-CE2 4.41Å; M891-F912 HydrophobicContact SD-CZ 3.76Å; M891-M935 HydrophobicContact CE-CB 4.02Å; M891-M935 HydrophobicContact CE-CG 3.86Å; M891-M935 HydrophobicContact SD-CB 4.27Å; M891-M935 HydrophobicContact SD-CG 3.74Å; M891-C938 HydrophobicContact CG-CB 4.26Å
892	M	95.1	Very high	94.7	Very high	8 Å²	8	28.6 Å²	28.6	4%	0.039	16%	0.159	C	C	.	.	H	α-helix	trans	-63.3	-49.1	172.6	-72.1	178.4	72.2	0	0	112	V876 L888 T889 E890 N894 G895 F897 M1007 A1010 A1011 I1014 L1019 F1023	V876-M892 HydrophobicContact CG1-SD 4.36Å; L888-M892 WeakPolarHBondContact O-CG 3.4Å; L888-M892 PolarHBondContact O-N 3.36Å; T889-M892 PolarHBondContact O-N 3.09Å; E890-M892 PolarHBondContact O-N 3.49Å; M892-N894 VanDerWaalsContact C-N 3.35Å; M892-N894 PolarHBondContact O-N 3.16Å; M892-G895 PolarHBondContact O-N 2.82Å; M892-F897 HydrophobicContact CG-CD2 3.83Å; M892-F897 HydrophobicContact CG-CE2 4Å; M892-M1007 HydrophobicContact CG-CE 3.75Å; M892-M1007 HydrophobicContact SD-CE 3.49Å; M892-M1007 WeakPolarHBondContact SD-CE 3.34Å; M892-M1007 HydrophobicContact SD-SD 4.26Å; M892-A1010 HydrophobicContact CE-CB 4.07Å; M892-A1010 HydrophobicContact SD-CB 4.05Å; M892-A1011 HydrophobicContact CE-CB 4.12Å; M892-I1014 HydrophobicContact CE-CD1 4.19Å; M892-L1019 HydrophobicContact CE-CD1 4.33Å; M892-F1023 HydrophobicContact CE-CE2 4.45Å
893	F	94.6	Very high	95.2	Very high	83 Å²	83	29.1 Å²	29.1	36%	0.364	16%	0.159	S	C	.	.	H	α-helix	trans	-73.3	-23.7	-177.9	-84.2	-100.7	0	0	0	113.7	K873 V876 T889 E890 G895 I1014	K873-F893 HydrophobicContact CB-CE2 4.45Å; K873-F893 HydrophobicContact CB-CZ 4.46Å; K873-F893 HydrophobicContact CD-CG 4.46Å; K873-F893 HydrophobicContact CG-CD1 3.91Å; K873-F893 HydrophobicContact CG-CD2 3.91Å; K873-F893 HydrophobicContact CG-CE1 3.79Å; K873-F893 HydrophobicContact CG-CE2 3.78Å; K873-F893 HydrophobicContact CG-CG 3.96Å; K873-F893 HydrophobicContact CG-CZ 3.72Å; V876-F893 HydrophobicContact CB-CE2 4.34Å; V876-F893 HydrophobicContact CG1-CE2 4.39Å; V876-F893 HydrophobicContact CG2-CE2 4.05Å; V876-F893 HydrophobicContact CG2-CZ 4.34Å; T889-F893 HydrophobicContact CG2-CD2 3.75Å; T889-F893 HydrophobicContact CG2-CE2 3.85Å; T889-F893 WeakPolarHBondContact O-CD2 3.4Å; T889-F893 PolarHBondContact O-N 3.47Å; E890-F893 PolarHBondContact O-N 3.13Å; F893-G895 PolarHBondContact O-N 3.43Å; F893-I1014 HydrophobicContact CE2-CG2 4.14Å; F893-I1014 HydrophobicContact CZ-CG2 3.83Å
894	N	93.9	Very high	95.3	Very high	82 Å²	82	30 Å²	30	44%	0.439	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-2.6	169.3	-64.6	-27.9	0	0	0	112.5	E890 M892 L896	E890-N894 VanDerWaalsContact O-CB 3.22Å; E890-N894 WeakPolarHBondContact O-CB 3.43Å; E890-N894 PolarHBondContact O-N 3.35Å; E890-N894 PolarHBondContact O-ND2 3.09Å; M892-N894 VanDerWaalsContact C-N 3.35Å; M892-N894 PolarHBondContact O-N 3.16Å; N894-L896 VanDerWaalsContact C-N 3.33Å; N894-L896 PolarHBondContact O-N 2.94Å
895	G	93.6	Very high	95.4	Very high	17 Å²	17	28.3 Å²	28.3	18%	0.175	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.9	10.3	176.8	0	0	0	0	0	115.4	M891 M892 F893 F897 N898	M891-G895 PolarHBondContact O-N 2.92Å; M892-G895 PolarHBondContact O-N 2.82Å; F893-G895 PolarHBondContact O-N 3.43Å; G895-F897 VanDerWaalsContact C-N 3.26Å; G895-F897 PolarHBondContact O-N 3.43Å; G895-N898 WeakPolarHBondContact O-CB 3.45Å; G895-N898 VanDerWaalsContact O-CG 3.27Å; G895-N898 PolarHBondContact O-N 2.8Å
896	L	94.9	Very high	95.5	Very high	14 Å²	14	27.3 Å²	27.3	7%	0.073	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-41	-174	-175.9	156.1	0	0	0	112.2	M891 N894 N898 L900 L908 Q934	M891-L896 HydrophobicContact CB-CB 4.33Å; M891-L896 HydrophobicContact CB-CD1 4.46Å; M891-L896 HydrophobicContact CE-CD1 3.98Å; M891-L896 HydrophobicContact CE-CD2 3.88Å; M891-L896 HydrophobicContact CG-CD1 4.12Å; M891-L896 WeakPolarHBondContact O-CB 3.46Å; M891-L896 PolarHBondContact O-N 3.49Å; N894-L896 VanDerWaalsContact C-N 3.33Å; N894-L896 PolarHBondContact O-N 2.94Å; L896-N898 VanDerWaalsContact C-N 3.25Å; L896-N898 PolarHBondContact O-N 3.33Å; L896-L900 HydrophobicContact CD2-CD1 3.84Å; L896-L908 HydrophobicContact CD2-CD2 3.54Å; L896-Q934 HydrophobicContact CD1-CB 3.6Å; L896-Q934 HydrophobicContact CG-CB 4.44Å
897	F	95.9	Very high	95.4	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-7.6	179.9	-64.9	-74	0	0	0	114.4	L888 M891 M892 G895 L900 A905 L908 L909 M1007 L1019 K1022 F1023	L888-F897 HydrophobicContact CD2-CZ 4.36Å; M891-F897 HydrophobicContact CB-CD2 4.32Å; M891-F897 HydrophobicContact CB-CE2 3.7Å; M891-F897 HydrophobicContact CB-CZ 4.42Å; M891-F897 HydrophobicContact CE-CE1 4.41Å; M891-F897 HydrophobicContact CE-CE2 4.14Å; M891-F897 HydrophobicContact CE-CZ 3.73Å; M892-F897 HydrophobicContact CG-CD2 3.83Å; M892-F897 HydrophobicContact CG-CE2 4Å; G895-F897 VanDerWaalsContact C-N 3.26Å; G895-F897 PolarHBondContact O-N 3.43Å; F897-L900 HydrophobicContact CD1-CD1 4.2Å; F897-A905 HydrophobicContact CD1-CB 4Å; F897-A905 HydrophobicContact CE1-CB 4.49Å; F897-L908 HydrophobicContact CE1-CD2 4.47Å; F897-L909 HydrophobicContact CE1-CD2 4.2Å; F897-L909 HydrophobicContact CE1-CG 4.19Å; F897-L909 HydrophobicContact CZ-CD2 3.93Å; F897-L909 HydrophobicContact CZ-CG 4.43Å; F897-M1007 HydrophobicContact CD2-CE 4.4Å; F897-M1007 HydrophobicContact CE2-CE 3.79Å; F897-M1007 HydrophobicContact CZ-CE 4.02Å; F897-L1019 HydrophobicContact CB-CD2 3.76Å; F897-K1022 PolarHBondContact O-NZ 2.88Å; F897-F1023 HydrophobicContact CB-CZ 4.12Å; F897-F1023 AromaticContact CD1-CE1 3.92Å; F897-F1023 HydrophobicContact CD1-CE1 3.92Å; F897-F1023 AromaticContact CD1-CZ 3.98Å; F897-F1023 HydrophobicContact CD1-CZ 3.98Å; F897-F1023 HydrophobicContact CD2-CZ 4.08Å; F897-F1023 HydrophobicContact CE1-CE1 4.2Å; F897-F1023 HydrophobicContact CE1-CZ 4.39Å; F897-F1023 HydrophobicContact CE2-CZ 4.48Å; F897-F1023 HydrophobicContact CG-CE1 4.23Å; F897-F1023 AromaticContact CG-CZ 3.81Å; F897-F1023 HydrophobicContact CG-CZ 3.81Å
898	N	93.7	Very high	95.4	Very high	82 Å²	82	27.3 Å²	27.3	44%	0.439	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-42.7	-176.8	-62.2	-8.7	0	0	0	111.7	G895 L896 K1022	G895-N898 WeakPolarHBondContact O-CB 3.45Å; G895-N898 VanDerWaalsContact O-CG 3.27Å; G895-N898 PolarHBondContact O-N 2.8Å; L896-N898 VanDerWaalsContact C-N 3.25Å; L896-N898 PolarHBondContact O-N 3.33Å; N898-K1022 PolarHBondContact O-NZ 3.36Å
899	D	91.6	Very high	95.4	Very high	155 Å²	155	27.3 Å²	27.3	83%	0.829	15%	0.147	S	C	*	.	S	Bend	trans	-86.5	-13.3	-175.5	-63.2	-26.9	0	0	0	113.7
900	L	95.2	Very high	95.3	Very high	16 Å²	16	27.3 Å²	27.3	8%	0.084	15%	0.147	C	C	.	.	S	Bend	trans	-76.9	148.7	-178.8	-58	-172.5	0	0	0	112.9	L896 F897 Q904 A905 L908 P931 K1022	L896-L900 HydrophobicContact CD2-CD1 3.84Å; F897-L900 HydrophobicContact CD1-CD1 4.2Å; L900-Q904 HydrophobicContact CB-CB 4.07Å; L900-Q904 HydrophobicContact CD2-CB 4.39Å; L900-A905 HydrophobicContact CB-CB 4.29Å; L900-A905 HydrophobicContact CD1-CB 4.3Å; L900-L908 HydrophobicContact CD1-CD2 4.15Å; L900-P931 HydrophobicContact CD1-CB 4.37Å; L900-P931 HydrophobicContact CD2-CB 4.05Å; L900-P931 HydrophobicContact CD2-CG 3.56Å; L900-K1022 WeakPolarHBondContact O-CD 3.44Å; L900-K1022 WeakPolarHBondContact O-CE 3.43Å; L900-K1022 PolarHBondContact O-NZ 3.13Å
901	S	95.7	Very high	95.2	Very high	38 Å²	38	27.2 Å²	27.2	27%	0.266	15%	0.147	S	C	.	.			trans	-67.9	163.2	161.6	93.7	0	0	0	0	111.4	E903 Q904 A905	S901-E903 VanDerWaalsContact C-N 3.26Å; S901-E903 WeakPolarHBondContact CB-OE2 3.42Å; S901-E903 PolarHBondContact O-N 2.94Å; S901-E903 PolarHBondContact OG-N 3.27Å; S901-E903 PolarHBondContact OG-OE2 3.43Å; S901-Q904 PolarHBondContact O-N 3Å; S901-Q904 PolarHBondContact OG-N 2.9Å; S901-Q904 VanDerWaalsContact OG-N 3.1Å; S901-A905 WeakPolarHBondContact O-CB 3.47Å; S901-A905 PolarHBondContact O-N 3.14Å
902	A	96.4	Very high	95.2	Very high	3 Å²	3	28 Å²	28	3%	0.025	15%	0.15	C	C	.	.	H	α-helix	trans	-60.3	-36.9	175.8	0	0	0	0	0	112.1	T906 K1022 E1025 K1029	A902-T906 VanDerWaalsContact O-CB 3.28Å; A902-T906 WeakPolarHBondContact O-CB 3.24Å; A902-T906 PolarHBondContact O-N 3.1Å; A902-T906 PolarHBondContact O-OG1 2.75Å; A902-K1022 HydrophobicContact CB-CG 4.25Å; A902-E1025 HydrophobicContact CB-CB 4.13Å; A902-E1025 HydrophobicContact CB-CG 4.09Å; A902-K1029 HydrophobicContact CB-CD 4.5Å
903	E	96.1	Very high	95.1	Very high	36 Å²	36	27.8 Å²	27.8	17%	0.168	15%	0.149	C	C	.	.	H	α-helix	trans	-66.7	-45.3	175.2	-53.1	87	166.7	0	0	111.5	S901 T906 A907 Y971 A974 T975 K1029	S901-E903 VanDerWaalsContact C-N 3.26Å; S901-E903 WeakPolarHBondContact CB-OE2 3.42Å; S901-E903 PolarHBondContact O-N 2.94Å; S901-E903 PolarHBondContact OG-N 3.27Å; S901-E903 PolarHBondContact OG-OE2 3.43Å; E903-T906 PolarHBondContact O-N 3.25Å; E903-A907 VanDerWaalsContact O-CB 3.26Å; E903-A907 WeakPolarHBondContact O-CB 3.48Å; E903-A907 PolarHBondContact O-N 2.78Å; E903-Y971 HydrophobicContact CB-CD2 3.66Å; E903-Y971 HydrophobicContact CB-CE2 3.64Å; E903-A974 HydrophobicContact CB-CB 3.87Å; E903-A974 HydrophobicContact CG-CB 3.8Å; E903-T975 HydrophobicContact CB-CG2 4.41Å; E903-T975 HydrophobicContact CG-CG2 3.96Å; E903-K1029 VanDerWaalsContact CD-NZ 3.28Å; E903-K1029 HydrophobicContact CG-CD 3.98Å; E903-K1029 WeakPolarHBondContact OE1-CE 3.12Å; E903-K1029 IonicContact OE1-NZ 3.92Å; E903-K1029 PolarHBondContact OE1-NZ 3.01Å; E903-K1029 IonicContact OE2-NZ 2.67Å
904	Q	95.6	Very high	95	Very high	34 Å²	34	24.2 Å²	24.2	16%	0.159	13%	0.133	C	C	.	.	H	α-helix	trans	-65.1	-42.8	177.4	-70.5	177.1	-55.3	0	0	112	L900 S901 A907 L908 Q927 L928 Y971	L900-Q904 HydrophobicContact CB-CB 4.07Å; L900-Q904 HydrophobicContact CD2-CB 4.39Å; S901-Q904 PolarHBondContact O-N 3Å; S901-Q904 PolarHBondContact OG-N 2.9Å; S901-Q904 VanDerWaalsContact OG-N 3.1Å; Q904-A907 PolarHBondContact O-N 3.41Å; Q904-L908 WeakPolarHBondContact O-CB 3.4Å; Q904-L908 PolarHBondContact O-N 3.37Å; Q904-Q927 PolarHBondContact NE2-O 3.07Å; Q904-Q927 VanDerWaalsContact NE2-O 3.11Å; Q904-L928 HydrophobicContact CB-CD2 4.49Å; Q904-L928 HydrophobicContact CG-CD2 4.22Å; Q904-Y971 HydrophobicContact CG-CD2 4.49Å; Q904-Y971 HydrophobicContact CG-CE2 3.91Å
905	A	96.4	Very high	94.4	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61.6	-45.3	175.7	0	0	0	0	0	111.1	F897 L900 S901 L908 L909 F1023	F897-A905 HydrophobicContact CD1-CB 4Å; F897-A905 HydrophobicContact CE1-CB 4.49Å; L900-A905 HydrophobicContact CB-CB 4.29Å; L900-A905 HydrophobicContact CD1-CB 4.3Å; S901-A905 WeakPolarHBondContact O-CB 3.47Å; S901-A905 PolarHBondContact O-N 3.14Å; A905-L908 PolarHBondContact O-N 3.33Å; A905-L909 VanDerWaalsContact O-CG 3.29Å; A905-L909 WeakPolarHBondContact O-CG 3.42Å; A905-L909 PolarHBondContact O-N 2.85Å; A905-F1023 HydrophobicContact CB-CE1 4.46Å
906	T	96.6	Very high	93.8	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.006	14%	0.136	C	C	.	.	H	α-helix	trans	-66.5	-40	178.4	-55.4	0	0	0	0	111.9	A902 E903 L909 S910 V970 L1000 L1004 G1026 I1030	A902-T906 VanDerWaalsContact O-CB 3.28Å; A902-T906 WeakPolarHBondContact O-CB 3.24Å; A902-T906 PolarHBondContact O-N 3.1Å; A902-T906 PolarHBondContact O-OG1 2.75Å; E903-T906 PolarHBondContact O-N 3.25Å; T906-L909 PolarHBondContact O-N 3.34Å; T906-S910 PolarHBondContact O-N 3.23Å; T906-V970 HydrophobicContact CG2-CG1 3.99Å; T906-L1000 HydrophobicContact CG2-CD2 3.71Å; T906-L1000 HydrophobicContact CG2-CG 4.14Å; T906-L1004 HydrophobicContact CG2-CD1 3.82Å; T906-G1026 WeakPolarHBondContact OG1-CA 3.48Å; T906-I1030 HydrophobicContact CG2-CD1 4.32Å; T906-I1030 HydrophobicContact CG2-CG2 3.63Å
907	A	95.9	Very high	92.9	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61.9	-41.8	173.6	0	0	0	0	0	112.3	E903 Q904 S910 L928 V970 Y971	E903-A907 VanDerWaalsContact O-CB 3.26Å; E903-A907 WeakPolarHBondContact O-CB 3.48Å; E903-A907 PolarHBondContact O-N 2.78Å; Q904-A907 PolarHBondContact O-N 3.41Å; A907-S910 VanDerWaalsContact O-CB 3.32Å; A907-S910 WeakPolarHBondContact O-CB 3.37Å; A907-S910 PolarHBondContact O-N 3.05Å; A907-S910 PolarHBondContact O-OG 2.87Å; A907-L928 HydrophobicContact CB-CD2 3.96Å; A907-V970 HydrophobicContact CB-CG1 4.48Å; A907-Y971 HydrophobicContact CB-CD2 4.43Å
908	L	96	Very high	91.8	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-67	-38.6	176.9	-173.1	64.2	0	0	0	112.7	M891 L896 F897 L900 Q904 A905 S910 C911 P931 M935 M967	M891-L908 HydrophobicContact CE-CD2 3.55Å; M891-L908 HydrophobicContact CE-CG 4.21Å; L896-L908 HydrophobicContact CD2-CD2 3.54Å; F897-L908 HydrophobicContact CE1-CD2 4.47Å; L900-L908 HydrophobicContact CD1-CD2 4.15Å; Q904-L908 WeakPolarHBondContact O-CB 3.4Å; Q904-L908 PolarHBondContact O-N 3.37Å; A905-L908 PolarHBondContact O-N 3.33Å; L908-S910 PolarHBondContact O-N 3.47Å; L908-C911 WeakPolarHBondContact O-CB 3.12Å; L908-C911 PolarHBondContact O-N 2.65Å; L908-C911 PolarHBondContact O-SG 2.87Å; L908-P931 HydrophobicContact CD1-CB 4.34Å; L908-P931 HydrophobicContact CD2-CB 4.01Å; L908-M935 HydrophobicContact CD1-CB 4.07Å; L908-M935 HydrophobicContact CD1-CG 4.44Å; L908-M935 HydrophobicContact CD1-SD 3.9Å; L908-M967 HydrophobicContact CD1-CE 3.95Å
909	L	96.9	Very high	90.4	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.4	-22.2	175.7	-71.2	169.4	0	0	0	112.8	L888 F897 A905 T906 C911 F912 L1000 L1003 L1004 M1007 F1023	L888-L909 HydrophobicContact CD2-CD2 3.41Å; L888-L909 VanDerWaalsContact CD2-CD2 3.41Å; F897-L909 HydrophobicContact CE1-CD2 4.2Å; F897-L909 HydrophobicContact CE1-CG 4.19Å; F897-L909 HydrophobicContact CZ-CD2 3.93Å; F897-L909 HydrophobicContact CZ-CG 4.43Å; A905-L909 VanDerWaalsContact O-CG 3.29Å; A905-L909 WeakPolarHBondContact O-CG 3.42Å; A905-L909 PolarHBondContact O-N 2.85Å; T906-L909 PolarHBondContact O-N 3.34Å; L909-C911 PolarHBondContact O-N 3.23Å; L909-F912 PolarHBondContact O-N 3.29Å; L909-F912 VanDerWaalsContact O-N 3.17Å; L909-L1000 HydrophobicContact CB-CD1 3.52Å; L909-L1003 HydrophobicContact CB-CD2 4.28Å; L909-L1003 HydrophobicContact CD2-CD2 4.09Å; L909-L1004 HydrophobicContact CD1-CD2 3.56Å; L909-L1004 HydrophobicContact CD1-CG 4.21Å; L909-M1007 HydrophobicContact CD1-CG 4.28Å; L909-M1007 HydrophobicContact CD2-CE 4.33Å; L909-M1007 HydrophobicContact CD2-CG 4.31Å; L909-M1007 HydrophobicContact CD2-SD 4.48Å; L909-F1023 HydrophobicContact CD1-CD1 4.16Å; L909-F1023 HydrophobicContact CD1-CE1 3.97Å
910	S	95.4	Very high	89.1	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-59.6	-31.1	174.9	78.4	0	0	0	0	113.4	T906 A907 L908 F912 V913 F914	T906-S910 PolarHBondContact O-N 3.23Å; A907-S910 VanDerWaalsContact O-CB 3.32Å; A907-S910 WeakPolarHBondContact O-CB 3.37Å; A907-S910 PolarHBondContact O-N 3.05Å; A907-S910 PolarHBondContact O-OG 2.87Å; L908-S910 PolarHBondContact O-N 3.47Å; S910-F912 PolarHBondContact O-N 2.86Å; S910-F912 VanDerWaalsContact O-N 3.11Å; S910-V913 PolarHBondContact O-N 2.67Å; S910-F914 WeakPolarHBondContact O-CB 3.45Å; S910-F914 PolarHBondContact O-N 3.49Å; S910-F914 VanDerWaalsContact O-N 3.1Å
911	C	94.6	Very high	87.5	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.007	20%	0.195	C	C	.	.	H	α-helix	trans	-58.7	-23.9	177.8	-63.4	0	0	0	0	113.8	L908 L909 M935 F962 K963 M967	L908-C911 WeakPolarHBondContact O-CB 3.12Å; L908-C911 PolarHBondContact O-N 2.65Å; L908-C911 PolarHBondContact O-SG 2.87Å; L909-C911 PolarHBondContact O-N 3.23Å; C911-M935 HydrophobicContact CB-CE 4.48Å; C911-M935 HydrophobicContact CB-SD 4.04Å; C911-F962 HydrophobicContact CB-CB 4.47Å; C911-F962 WeakPolarHBondContact O-CA 3.33Å; C911-K963 PolarHBondContact O-N 3.4Å; C911-M967 VanDerWaalsContact SG-CG 3.56Å
912	F	94.7	Very high	86.1	Confident	18 Å²	18	36.6 Å²	36.6	8%	0.079	19%	0.194	C	C	.	.	H	α-helix	trans	-90.7	-25.3	-175.5	-68.4	-103.5	0	0	0	113.3	A883 D884 L887 L888 M891 L909 S910 M935 F962 L1003	A883-F912 HydrophobicContact CB-CB 3.76Å; A883-F912 HydrophobicContact CB-CD1 4.22Å; A883-F912 HydrophobicContact CB-CG 4.4Å; D884-F912 HydrophobicContact CB-CD1 4.26Å; D884-F912 HydrophobicContact CB-CE1 4.32Å; L887-F912 HydrophobicContact CB-CE1 4.15Å; L887-F912 HydrophobicContact CD2-CE1 3.67Å; L887-F912 HydrophobicContact CD2-CZ 3.73Å; L887-F912 HydrophobicContact CG-CE1 3.86Å; L887-F912 HydrophobicContact CG-CZ 3.9Å; L888-F912 HydrophobicContact CD1-CD1 4.05Å; L888-F912 HydrophobicContact CD1-CE1 4.32Å; L888-F912 HydrophobicContact CD2-CD1 3.9Å; L888-F912 HydrophobicContact CD2-CD2 4.11Å; L888-F912 HydrophobicContact CD2-CE1 3.58Å; L888-F912 HydrophobicContact CD2-CE2 3.82Å; L888-F912 HydrophobicContact CD2-CG 4.16Å; L888-F912 HydrophobicContact CD2-CZ 3.56Å; L888-F912 HydrophobicContact CG-CD1 3.83Å; L888-F912 HydrophobicContact CG-CE1 3.58Å; L888-F912 HydrophobicContact CG-CG 4.49Å; L888-F912 HydrophobicContact CG-CZ 4.07Å; M891-F912 HydrophobicContact CE-CE2 4.46Å; M891-F912 HydrophobicContact CE-CZ 4.37Å; M891-F912 HydrophobicContact SD-CE2 4.41Å; M891-F912 HydrophobicContact SD-CZ 3.76Å; L909-F912 PolarHBondContact O-N 3.29Å; L909-F912 VanDerWaalsContact O-N 3.17Å; S910-F912 PolarHBondContact O-N 2.86Å; S910-F912 VanDerWaalsContact O-N 3.11Å; F912-M935 HydrophobicContact CE2-CG 4.16Å; F912-M935 HydrophobicContact CE2-SD 3.63Å; F912-M935 HydrophobicContact CZ-CG 4.05Å; F912-M935 HydrophobicContact CZ-SD 4Å; F912-F962 AromaticContact CD1-CD1 3.89Å; F912-F962 HydrophobicContact CD1-CD1 3.89Å; F912-F962 AromaticContact CD1-CE1 3.62Å; F912-F962 HydrophobicContact CD1-CE1 3.62Å; F912-F962 AromaticContact CE1-CD1 3.98Å; F912-F962 HydrophobicContact CE1-CD1 3.98Å; F912-F962 AromaticContact CE1-CE1 3.62Å; F912-F962 HydrophobicContact CE1-CE1 3.62Å; F912-F962 HydrophobicContact CG-CD1 4.23Å; F912-F962 HydrophobicContact CG-CE1 4.4Å; F912-F962 HydrophobicContact CZ-CD1 4.39Å; F912-F962 HydrophobicContact CZ-CE1 4.39Å; F912-L1003 HydrophobicContact CB-CD2 4.15Å
913	V	93.3	Very high	84.7	Confident	3 Å²	3	46.2 Å²	46.2	2%	0.018	24%	0.236	C	C	.	.	H	α-helix	trans	-108.4	-16.6	-174.2	-61.3	0	0	0	0	113.5	S910 Q915 R999 L1000 L1003	S910-V913 PolarHBondContact O-N 2.67Å; V913-Q915 PolarHBondContact O-N 2.91Å; V913-R999 HydrophobicContact CB-CB 3.85Å; V913-R999 HydrophobicContact CG1-CB 4.12Å; V913-R999 HydrophobicContact CG2-CB 4.38Å; V913-L1000 HydrophobicContact CG2-CB 4.05Å; V913-L1000 HydrophobicContact CG2-CD1 4.28Å; V913-L1003 HydrophobicContact CG1-CB 4.14Å; V913-L1003 HydrophobicContact CG1-CD2 3.71Å
914	F	91.8	Very high	83.7	Confident	7 Å²	7	46.4 Å²	46.4	3%	0.031	24%	0.238	C	C	.	.			trans	-81.9	98.4	175.8	-177.4	-115.3	0	0	0	111.8	S910 E916 K963 H965 L966 V988 C996	S910-F914 WeakPolarHBondContact O-CB 3.45Å; S910-F914 PolarHBondContact O-N 3.49Å; S910-F914 VanDerWaalsContact O-N 3.1Å; F914-E916 WeakPolarHBondContact CE1-O 3.36Å; F914-E916 HydrophobicContact CE2-CB 3.89Å; F914-E916 HydrophobicContact CZ-CB 4.03Å; F914-E916 WeakPolarHBondContact CZ-O 3.34Å; F914-K963 HydrophobicContact CD1-CB 3.77Å; F914-K963 HydrophobicContact CD1-CD 4.38Å; F914-K963 HydrophobicContact CE1-CB 4.42Å; F914-K963 WeakPolarHBondContact O-CB 3.31Å; F914-H965 HydrophobicContact CD1-CB 4.29Å; F914-H965 HydrophobicContact CE1-CB 3.83Å; F914-L966 HydrophobicContact CB-CD1 4.44Å; F914-L966 HydrophobicContact CD1-CD1 4.47Å; F914-L966 HydrophobicContact CD1-CG 4.28Å; F914-L966 HydrophobicContact CD2-CD1 3.35Å; F914-L966 HydrophobicContact CD2-CG 4.01Å; F914-L966 HydrophobicContact CE1-CG 4.4Å; F914-L966 HydrophobicContact CE2-CD1 3.63Å; F914-L966 HydrophobicContact CE2-CG 4.13Å; F914-L966 HydrophobicContact CG-CD1 3.83Å; F914-L966 HydrophobicContact CG-CG 4.09Å; F914-L966 HydrophobicContact CZ-CD1 4.32Å; F914-L966 HydrophobicContact CZ-CG 4.33Å; F914-V988 HydrophobicContact CE2-CG1 4.1Å; F914-V988 HydrophobicContact CE2-CG2 4.29Å; F914-V988 HydrophobicContact CZ-CG1 4.45Å; F914-V988 HydrophobicContact CZ-CG2 3.83Å; F914-C996 HydrophobicContact CD2-CB 4.45Å
915	Q	81.9	Confident	83	Confident	91 Å²	91	47.7 Å²	47.7	43%	0.425	25%	0.248	S	C	.	.			trans	-94.3	-18.9	-179.6	-72.5	171.7	-31.6	0	0	114.9	E261 V913 K963 R999	E261-Q915 PolarHBondContact OE1-NE2 2.83Å; V913-Q915 PolarHBondContact O-N 2.91Å; Q915-K963 PolarHBondContact O-NZ 2.85Å; Q915-R999 VanDerWaalsContact CD-NH1 3.33Å
916	E	81.9	Confident	82	Confident	52 Å²	52	56.4 Å²	56.4	24%	0.243	29%	0.289	C	S	.	.	S	Bend	trans	-69.4	162.8	-177.1	-63.6	-158.6	-171.3	0	0	112.3	K396 F914 K963 S992 R995	K396-E916 IonicContact NZ-OE1 2.78Å; K396-E916 PolarHBondContact NZ-OE1 3.42Å; K396-E916 IonicContact NZ-OE2 3.91Å; K396-E916 PolarHBondContact NZ-OE2 2.91Å; F914-E916 WeakPolarHBondContact CE1-O 3.36Å; F914-E916 HydrophobicContact CE2-CB 3.89Å; F914-E916 HydrophobicContact CZ-CB 4.03Å; F914-E916 WeakPolarHBondContact CZ-O 3.34Å; E916-K963 WeakPolarHBondContact O-CD 3.47Å; E916-K963 PolarHBondContact O-NZ 3.01Å; E916-S992 PolarHBondContact OE1-OG 3.37Å; E916-R995 IonicContact OE1-CZ 3.9Å; E916-R995 IonicContact OE1-NH1 2.77Å; E916-R995 PolarHBondContact OE1-NH1 3.45Å; E916-R995 IonicContact OE1-NH2 3.14Å; E916-R995 PolarHBondContact OE1-NH2 2.73Å; E916-R995 VanDerWaalsContact OE1-NH2 3.12Å
917	N	75.4	Confident	81.3	Confident	141 Å²	141	61.8 Å²	61.8	75%	0.754	31%	0.314	S	S	*	.			trans	-95	125.7	174.6	-71.7	-15.3	0	0	0	109.5	K963	N917-K963 PolarHBondContact OD1-NZ 2.97Å
918	S	73.1	Confident	80.9	Confident	20 Å²	20	61.9 Å²	61.9	14%	0.14	31%	0.314	C	S	.	.			trans	-104.3	151.6	169.5	166.7	0	0	0	0	109.2	E920 D987	S918-E920 PolarHBondContact OG-N 2.99Å; S918-E920 PolarHBondContact OG-O 2.89Å; S918-D987 WeakPolarHBondContact CB-OD1 3.44Å; S918-D987 PolarHBondContact OG-OD1 3.33Å
919	S	63.8	Low	80.5	Confident	107 Å²	107	62.8 Å²	62.8	75%	0.748	32%	0.322	S	S	*	.	S	Bend	trans	-93.9	-13.6	177.8	66.7	0	0	0	0	114.1	D987	S919-D987 WeakPolarHBondContact CB-OD2 3.32Å; S919-D987 PolarHBondContact N-OD2 3.47Å; S919-D987 PolarHBondContact OG-OD2 3.27Å
920	E	64.1	Low	80.2	Confident	129 Å²	129	64.1 Å²	64.1	60%	0.603	34%	0.336	S	S	*	.			trans	-118.3	122.8	-179.9	-62.6	-163	155.8	0	0	111.2	S918 P922	S918-E920 PolarHBondContact OG-N 2.99Å; S918-E920 PolarHBondContact OG-O 2.89Å; E920-P922 WeakPolarHBondContact O-CD 3.09Å
921	M	62.8	Low	80.1	Confident	85 Å²	85	64.7 Å²	64.7	42%	0.419	34%	0.339	S	S	.	.			trans	-86.4	116.6	165.7	-69	-158.7	72.5	0	0	109.4	P685 P964	P685-M921 HydrophobicContact CG-CE 3.66Å; P685-M921 HydrophobicContact CG-SD 3.56Å; P685-M921 VanDerWaalsContact CG-SD 3.56Å; M921-P964 HydrophobicContact CE-CG 3.74Å
922	P	64.5	Low	80	Confident	39 Å²	39	65.1 Å²	65.1	25%	0.253	34%	0.342	S	S	.	.			trans	-64.2	151.1	173.1	29	-34.8	0	0	0	110.2	E920 L924	E920-P922 WeakPolarHBondContact O-CD 3.09Å; P922-L924 VanDerWaalsContact C-N 3.28Å; P922-L924 PolarHBondContact O-N 3.07Å
923	K	67.6	Low	79.8	Confident	206 Å²	206	72.1 Å²	72.1	90%	0.896	37%	0.368	S	S	*	.			trans	-77	84.4	172.4	-73.3	-173.8	178.3	-179.5	0	109.4	T925	K923-T925 PolarHBondContact O-N 3.22Å
924	L	76.2	Confident	79.7	Confident	40 Å²	40	76.6 Å²	76.6	21%	0.209	39%	0.388	C	S	.	.			trans	-40.4	128.9	174.4	-65.9	168.7	0	0	0	111.3	P922 A929 L932 P964 M967 D968	P922-L924 VanDerWaalsContact C-N 3.28Å; P922-L924 PolarHBondContact O-N 3.07Å; L924-A929 HydrophobicContact CB-CB 4.44Å; L924-L932 HydrophobicContact CD1-CD2 3.41Å; L924-L932 VanDerWaalsContact CD1-CD2 3.41Å; L924-P964 HydrophobicContact CD1-CB 4.33Å; L924-M967 HydrophobicContact CD1-SD 4.45Å; L924-M967 HydrophobicContact CD2-CB 3.67Å; L924-M967 HydrophobicContact CD2-CG 4.29Å; L924-M967 HydrophobicContact CD2-SD 3.92Å; L924-D968 WeakPolarHBondContact CA-OD2 3.45Å
925	T	79.2	Confident	79.8	Confident	61 Å²	61	76.3 Å²	76.3	37%	0.374	39%	0.387	S	S	.	.			trans	-59.8	150.5	171.1	58.8	0	0	0	0	111	K923 Q927 L928 A929 D968	K923-T925 PolarHBondContact O-N 3.22Å; T925-Q927 PolarHBondContact O-N 3.17Å; T925-Q927 VanDerWaalsContact O-N 3.11Å; T925-L928 PolarHBondContact O-N 2.87Å; T925-A929 PolarHBondContact O-N 2.85Å; T925-D968 PolarHBondContact N-OD1 3Å
926	E	75.4	Confident	80.3	Confident	183 Å²	183	73.3 Å²	73.3	86%	0.855	37%	0.373	S	S	*	.	H	α-helix	trans	-57.1	-31	179.7	-64	-169.9	145.7	0	0	112.5	L928 G930	E926-L928 PolarHBondContact O-N 3.17Å; E926-G930 PolarHBondContact O-N 3.36Å
927	Q	82.5	Confident	80.8	Confident	114 Å²	114	77.3 Å²	77.3	53%	0.533	39%	0.392	S	S	.	.	H	α-helix	trans	-63.3	-23.4	175.1	-66.6	-178.1	-16.1	0	0	114.3	Q904 T925 P931 Y971	Q904-Q927 PolarHBondContact NE2-O 3.07Å; Q904-Q927 VanDerWaalsContact NE2-O 3.11Å; T925-Q927 PolarHBondContact O-N 3.17Å; T925-Q927 VanDerWaalsContact O-N 3.11Å; Q927-P931 VanDerWaalsContact O-CD 3.31Å; Q927-P931 WeakPolarHBondContact O-CD 3.46Å; Q927-Y971 PolarHBondContact OE1-OH 3.42Å
928	L	87.3	Confident	81.7	Confident	1 Å²	1	71.6 Å²	71.6	1%	0.005	36%	0.362	C	S	.	.	H	α-helix	trans	-107.5	-28.9	178.3	-64.5	-179.3	0	0	0	112.3	Q904 A907 T925 E926 G930 P931 L932 M967 Y971	Q904-L928 HydrophobicContact CB-CD2 4.49Å; Q904-L928 HydrophobicContact CG-CD2 4.22Å; A907-L928 HydrophobicContact CB-CD2 3.96Å; T925-L928 PolarHBondContact O-N 2.87Å; E926-L928 PolarHBondContact O-N 3.17Å; L928-G930 VanDerWaalsContact C-N 3.31Å; L928-G930 PolarHBondContact O-N 2.83Å; L928-P931 WeakPolarHBondContact O-CD 3.45Å; L928-L932 WeakPolarHBondContact O-CB 3.3Å; L928-L932 PolarHBondContact O-N 3.36Å; L928-L932 VanDerWaalsContact O-N 3.15Å; L928-M967 HydrophobicContact CB-CE 4.01Å; L928-M967 HydrophobicContact CD1-CB 4.4Å; L928-Y971 HydrophobicContact CD1-CD1 4.24Å; L928-Y971 HydrophobicContact CD1-CG 3.95Å; L928-Y971 HydrophobicContact CD2-CD2 4.09Å; L928-Y971 HydrophobicContact CD2-CG 4.33Å
929	A	88.3	Confident	82.7	Confident	20 Å²	20	70.6 Å²	70.6	17%	0.165	36%	0.356	C	S	.	.	H	α-helix	trans	-64.4	-32.2	174.1	0	0	0	0	0	113	L924 T925 R933	L924-A929 HydrophobicContact CB-CB 4.44Å; T925-A929 PolarHBondContact O-N 2.85Å; A929-R933 WeakPolarHBondContact O-CG 3.46Å; A929-R933 PolarHBondContact O-N 2.95Å
930	G	90.1	Very high	84.1	Confident	29 Å²	29	70.3 Å²	70.3	30%	0.299	34%	0.341	S	S	.	.	H	α-helix	trans	-61.6	-60.1	174	0	0	0	0	0	113.2	E926 L928 L932 R933 Q934	E926-G930 PolarHBondContact O-N 3.36Å; L928-G930 VanDerWaalsContact C-N 3.31Å; L928-G930 PolarHBondContact O-N 2.83Å; G930-L932 VanDerWaalsContact C-N 3.29Å; G930-L932 PolarHBondContact O-N 3.31Å; G930-R933 PolarHBondContact O-N 3.28Å; G930-R933 VanDerWaalsContact O-N 3.17Å; G930-Q934 PolarHBondContact O-N 2.97Å
931	P	92.8	Very high	85.5	Confident	11 Å²	11	70 Å²	70	7%	0.071	33%	0.334	C	S	.	.	H	α-helix	trans	-58.3	-36.1	177.2	-26.5	34.8	0	0	0	113.8	L900 L908 Q927 L928 R933 Q934 M935	L900-P931 HydrophobicContact CD1-CB 4.37Å; L900-P931 HydrophobicContact CD2-CB 4.05Å; L900-P931 HydrophobicContact CD2-CG 3.56Å; L908-P931 HydrophobicContact CD1-CB 4.34Å; L908-P931 HydrophobicContact CD2-CB 4.01Å; Q927-P931 VanDerWaalsContact O-CD 3.31Å; Q927-P931 WeakPolarHBondContact O-CD 3.46Å; L928-P931 WeakPolarHBondContact O-CD 3.45Å; P931-R933 PolarHBondContact O-N 2.92Å; P931-Q934 PolarHBondContact O-N 3.03Å; P931-M935 PolarHBondContact O-N 3.38Å
932	L	92.4	Very high	87.1	Confident	11 Å²	11	66 Å²	66	6%	0.058	32%	0.315	C	S	.	.	H	α-helix	trans	-61.2	-42.5	175.7	-179.3	62.9	0	0	0	112.4	L924 L928 G930 M935 Q936 P964 M967	L924-L932 HydrophobicContact CD1-CD2 3.41Å; L924-L932 VanDerWaalsContact CD1-CD2 3.41Å; L928-L932 WeakPolarHBondContact O-CB 3.3Å; L928-L932 PolarHBondContact O-N 3.36Å; L928-L932 VanDerWaalsContact O-N 3.15Å; G930-L932 VanDerWaalsContact C-N 3.29Å; G930-L932 PolarHBondContact O-N 3.31Å; L932-M935 HydrophobicContact CD1-CE 3.67Å; L932-M935 HydrophobicContact CD1-SD 4.27Å; L932-M935 WeakPolarHBondContact O-CB 3.3Å; L932-M935 PolarHBondContact O-N 3.36Å; L932-Q936 VanDerWaalsContact O-CG 3.31Å; L932-Q936 WeakPolarHBondContact O-CG 3.41Å; L932-Q936 PolarHBondContact O-N 2.8Å; L932-P964 HydrophobicContact CD1-CB 4.11Å; L932-P964 HydrophobicContact CD2-CB 3.73Å; L932-P964 HydrophobicContact CD2-CG 4.03Å; L932-M967 HydrophobicContact CB-CE 4.21Å; L932-M967 HydrophobicContact CB-SD 4.19Å; L932-M967 HydrophobicContact CD1-SD 4.06Å; L932-M967 HydrophobicContact CD2-SD 4.1Å; L932-M967 HydrophobicContact CG-SD 4.34Å
933	R	90.9	Very high	88.5	Confident	165 Å²	165	64.3 Å²	64.3	62%	0.623	30%	0.304	S	S	*	.	H	α-helix	trans	-63.1	-43	176.8	-72.5	170.4	-175.7	164.6	3.9	111.8	A929 G930 P931 M935 Q936 E937	A929-R933 WeakPolarHBondContact O-CG 3.46Å; A929-R933 PolarHBondContact O-N 2.95Å; G930-R933 PolarHBondContact O-N 3.28Å; G930-R933 VanDerWaalsContact O-N 3.17Å; P931-R933 PolarHBondContact O-N 2.92Å; R933-M935 VanDerWaalsContact C-N 3.33Å; R933-M935 PolarHBondContact O-N 2.85Å; R933-Q936 WeakPolarHBondContact O-CB 3.36Å; R933-Q936 PolarHBondContact O-N 2.85Å; R933-E937 WeakPolarHBondContact O-CG 3.43Å; R933-E937 PolarHBondContact O-N 3.06Å
934	Q	92.2	Very high	89.7	Confident	96 Å²	96	60.3 Å²	60.3	45%	0.449	29%	0.287	S	S	.	.	H	α-helix	trans	-63.8	-38.2	177.5	-64.8	179.7	-4.3	0	0	112.1	L896 G930 P931 E937 C938	L896-Q934 HydrophobicContact CD1-CB 3.6Å; L896-Q934 HydrophobicContact CG-CB 4.44Å; G930-Q934 PolarHBondContact O-N 2.97Å; P931-Q934 PolarHBondContact O-N 3.03Å; Q934-E937 PolarHBondContact O-N 3.25Å; Q934-C938 PolarHBondContact O-N 3.36Å; Q934-C938 PolarHBondContact O-SG 2.86Å
935	M	94.3	Very high	90.6	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-61.7	-46.3	171.3	-177.1	-155.1	85.6	0	0	111.5	L887 M891 L908 C911 F912 P931 L932 R933 E937 C938 A939 F962	L887-M935 HydrophobicContact CD2-CG 4.37Å; M891-M935 HydrophobicContact CE-CB 4.02Å; M891-M935 HydrophobicContact CE-CG 3.86Å; M891-M935 HydrophobicContact SD-CB 4.27Å; M891-M935 HydrophobicContact SD-CG 3.74Å; L908-M935 HydrophobicContact CD1-CB 4.07Å; L908-M935 HydrophobicContact CD1-CG 4.44Å; L908-M935 HydrophobicContact CD1-SD 3.9Å; C911-M935 HydrophobicContact CB-CE 4.48Å; C911-M935 HydrophobicContact CB-SD 4.04Å; F912-M935 HydrophobicContact CE2-CG 4.16Å; F912-M935 HydrophobicContact CE2-SD 3.63Å; F912-M935 HydrophobicContact CZ-CG 4.05Å; F912-M935 HydrophobicContact CZ-SD 4Å; P931-M935 PolarHBondContact O-N 3.38Å; L932-M935 HydrophobicContact CD1-CE 3.67Å; L932-M935 HydrophobicContact CD1-SD 4.27Å; L932-M935 WeakPolarHBondContact O-CB 3.3Å; L932-M935 PolarHBondContact O-N 3.36Å; R933-M935 VanDerWaalsContact C-N 3.33Å; R933-M935 PolarHBondContact O-N 2.85Å; M935-E937 PolarHBondContact O-N 3.08Å; M935-C938 PolarHBondContact O-N 3.39Å; M935-A939 WeakPolarHBondContact O-CB 3.41Å; M935-A939 PolarHBondContact O-N 3.36Å; M935-F962 HydrophobicContact CE-CB 3.66Å; M935-F962 HydrophobicContact CE-CG 4.16Å
936	Q	92.6	Very high	91.3	Very high	29 Å²	29	56.4 Å²	56.4	14%	0.136	26%	0.264	C	S	.	.	H	α-helix	trans	-62.7	-39.7	177.2	-71.8	169.1	-24.3	0	0	112.3	N686 L932 R933 A939 K940 L959	N686-Q936 VanDerWaalsContact CG-NE2 3.3Å; N686-Q936 PolarHBondContact OD1-NE2 3.1Å; N686-Q936 VanDerWaalsContact OD1-NE2 3.11Å; L932-Q936 VanDerWaalsContact O-CG 3.31Å; L932-Q936 WeakPolarHBondContact O-CG 3.41Å; L932-Q936 PolarHBondContact O-N 2.8Å; R933-Q936 WeakPolarHBondContact O-CB 3.36Å; R933-Q936 PolarHBondContact O-N 2.85Å; Q936-A939 PolarHBondContact O-N 2.92Å; Q936-K940 VanDerWaalsContact O-CB 3.28Å; Q936-K940 WeakPolarHBondContact O-CB 3.36Å; Q936-K940 PolarHBondContact O-N 3.1Å; Q936-L959 HydrophobicContact CB-CD2 4.3Å; Q936-L959 WeakPolarHBondContact O-CD2 3.34Å
937	E	92.3	Very high	92.1	Very high	136 Å²	136	50.2 Å²	50.2	64%	0.636	25%	0.245	S	C	*	.	H	α-helix	trans	-64.3	-41.2	174.6	-73.8	175.3	-175.7	0	0	112.1	R933 Q934 M935 R941	R933-E937 WeakPolarHBondContact O-CG 3.43Å; R933-E937 PolarHBondContact O-N 3.06Å; Q934-E937 PolarHBondContact O-N 3.25Å; M935-E937 PolarHBondContact O-N 3.08Å; E937-R941 PolarHBondContact O-N 3.12Å; E937-R941 VanDerWaalsContact O-N 3.1Å
938	C	93.3	Very high	92.7	Very high	20 Å²	20	49.5 Å²	49.5	14%	0.135	24%	0.241	C	C	.	.	H	α-helix	trans	-63.6	-44.5	172.8	-67.5	0	0	0	0	111.7	L887 M891 Q934 M935 R941 I942	L887-C938 HydrophobicContact CD1-CB 3.57Å; M891-C938 HydrophobicContact CG-CB 4.26Å; Q934-C938 PolarHBondContact O-N 3.36Å; Q934-C938 PolarHBondContact O-SG 2.86Å; M935-C938 PolarHBondContact O-N 3.39Å; C938-R941 WeakPolarHBondContact O-CB 3.44Å; C938-R941 PolarHBondContact O-N 3.29Å; C938-I942 PolarHBondContact O-N 3.23Å; C938-I942 VanDerWaalsContact O-N 3.14Å
939	A	94.1	Very high	93	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61.4	-45.8	177.3	0	0	0	0	0	111.8	L887 M935 Q936 R941 I942 A943 Y958 L959 F962	L887-A939 HydrophobicContact CD1-CB 4.12Å; L887-A939 HydrophobicContact CD2-CB 3.78Å; M935-A939 WeakPolarHBondContact O-CB 3.41Å; M935-A939 PolarHBondContact O-N 3.36Å; Q936-A939 PolarHBondContact O-N 2.92Å; A939-R941 VanDerWaalsContact C-N 3.28Å; A939-R941 PolarHBondContact O-N 3.38Å; A939-I942 PolarHBondContact O-N 3.44Å; A939-A943 PolarHBondContact O-N 2.85Å; A939-Y958 HydrophobicContact CB-CD1 4.35Å; A939-Y958 HydrophobicContact CB-CE1 3.84Å; A939-Y958 WeakPolarHBondContact O-CE1 3.36Å; A939-L959 HydrophobicContact CB-CD2 3.65Å; A939-F962 HydrophobicContact CB-CE2 4.36Å
940	K	93.6	Very high	93.2	Very high	100 Å²	100	56.8 Å²	56.8	44%	0.435	27%	0.269	S	S	.	.	H	α-helix	trans	-58.1	-38.7	175.8	-171.2	177.2	178.6	64.5	0	112.1	Q936 K944 E955 L959	Q936-K940 VanDerWaalsContact O-CB 3.28Å; Q936-K940 WeakPolarHBondContact O-CB 3.36Å; Q936-K940 PolarHBondContact O-N 3.1Å; K940-K944 WeakPolarHBondContact O-CB 3.43Å; K940-K944 PolarHBondContact O-N 3.03Å; K940-E955 HydrophobicContact CG-CG 4.42Å; K940-E955 WeakPolarHBondContact CG-OE2 3.28Å; K940-E955 IonicContact NZ-OE1 3.98Å; K940-E955 PolarHBondContact NZ-OE1 2.57Å; K940-E955 IonicContact NZ-OE2 3.52Å; K940-E955 PolarHBondContact NZ-OE2 2.92Å; K940-L959 HydrophobicContact CB-CD1 4.31Å; K940-L959 HydrophobicContact CB-CD2 4.36Å; K940-L959 HydrophobicContact CG-CD1 4.46Å
941	R	93.9	Very high	93.3	Very high	122 Å²	122	56.4 Å²	56.4	46%	0.46	26%	0.26	S	S	.	.	H	α-helix	trans	-63.8	-41.7	174.1	-177.9	177.6	170.4	-128.9	-7.8	112.1	E890 E937 C938 A939 V945	E890-R941 IonicContact OE2-CZ 3.58Å; E890-R941 IonicContact OE2-NH1 2.73Å; E890-R941 PolarHBondContact OE2-NH1 3.37Å; E890-R941 IonicContact OE2-NH2 2.74Å; E937-R941 PolarHBondContact O-N 3.12Å; E937-R941 VanDerWaalsContact O-N 3.1Å; C938-R941 WeakPolarHBondContact O-CB 3.44Å; C938-R941 PolarHBondContact O-N 3.29Å; A939-R941 VanDerWaalsContact C-N 3.28Å; A939-R941 PolarHBondContact O-N 3.38Å; R941-V945 WeakPolarHBondContact O-CG2 3.37Å; R941-V945 PolarHBondContact O-N 3.01Å
942	I	94.8	Very high	93.1	Very high	2 Å²	2	65.9 Å²	65.9	1%	0.01	30%	0.303	C	S	.	.	H	α-helix	trans	-69.2	-45.2	178.1	-64.9	171.8	0	0	0	111.3	L861 L886 L887 E890 C938 A939 K944 V945 S946 Y958	L861-I942 HydrophobicContact CD1-CG1 4.16Å; L861-I942 HydrophobicContact CD1-CG2 4.45Å; L886-I942 HydrophobicContact CB-CD1 4.17Å; L886-I942 HydrophobicContact CD1-CG2 4.3Å; L887-I942 VanDerWaalsContact CA-CD1 3.48Å; L887-I942 HydrophobicContact CB-CD1 3.88Å; L887-I942 HydrophobicContact CD1-CD1 4Å; E890-I942 HydrophobicContact CB-CD1 4.31Å; E890-I942 HydrophobicContact CG-CD1 4.01Å; E890-I942 HydrophobicContact CG-CG1 4.38Å; C938-I942 PolarHBondContact O-N 3.23Å; C938-I942 VanDerWaalsContact O-N 3.14Å; A939-I942 PolarHBondContact O-N 3.44Å; I942-K944 VanDerWaalsContact C-N 3.35Å; I942-K944 PolarHBondContact O-N 3.46Å; I942-V945 PolarHBondContact O-N 2.68Å; I942-S946 WeakPolarHBondContact O-CB 3.41Å; I942-S946 PolarHBondContact O-N 2.7Å; I942-S946 PolarHBondContact O-OG 3.05Å; I942-Y958 HydrophobicContact CB-CE1 4.48Å
943	A	94.1	Very high	92.8	Very high	3 Å²	3	68 Å²	68	3%	0.025	31%	0.314	C	S	.	.	H	α-helix	trans	-56	-48.6	174.6	0	0	0	0	0	111.2	A939 V945 S946 A947 E955 Y958	A939-A943 PolarHBondContact O-N 2.85Å; A943-V945 PolarHBondContact O-N 3.2Å; A943-S946 WeakPolarHBondContact O-CB 3.37Å; A943-S946 PolarHBondContact O-N 2.74Å; A943-S946 VanDerWaalsContact O-N 3.13Å; A943-A947 PolarHBondContact O-N 2.82Å; A943-E955 HydrophobicContact CB-CG 3.86Å; A943-Y958 HydrophobicContact CB-CD1 3.83Å; A943-Y958 HydrophobicContact CB-CE1 4.4Å; A943-Y958 HydrophobicContact CB-CG 4.36Å
944	K	93.6	Very high	92.6	Very high	123 Å²	123	64 Å²	64	54%	0.535	31%	0.305	S	S	.	.	H	α-helix	trans	-60	-45.8	176.3	179.2	171.7	175	173.9	0	113.1	K940 I942 S946 A947 E948	K940-K944 WeakPolarHBondContact O-CB 3.43Å; K940-K944 PolarHBondContact O-N 3.03Å; I942-K944 VanDerWaalsContact C-N 3.35Å; I942-K944 PolarHBondContact O-N 3.46Å; K944-S946 PolarHBondContact O-N 3.41Å; K944-A947 PolarHBondContact O-N 3.09Å; K944-E948 WeakPolarHBondContact CE-OE1 3.37Å; K944-E948 HydrophobicContact CG-CG 4.48Å; K944-E948 IonicContact NZ-OE1 2.73Å; K944-E948 WeakPolarHBondContact O-CB 3.27Å; K944-E948 VanDerWaalsContact O-CG 3.31Å; K944-E948 WeakPolarHBondContact O-CG 3.26Å; K944-E948 PolarHBondContact O-N 2.8Å
945	V	94.7	Very high	92.4	Very high	16 Å²	16	62.6 Å²	62.6	10%	0.097	30%	0.298	C	S	.	.	H	α-helix	trans	-62.8	-31.4	177	168.1	0	0	0	0	111.6	V857 R860 L861 R941 I942 A943 A949	V857-V945 HydrophobicContact CG1-CG1 4.38Å; R860-V945 HydrophobicContact CB-CG1 3.95Å; R860-V945 PolarHBondContact NH1-O 2.87Å; L861-V945 HydrophobicContact CD2-CB 4.38Å; L861-V945 HydrophobicContact CD2-CG1 4.13Å; L861-V945 HydrophobicContact CD2-CG2 4.19Å; L861-V945 HydrophobicContact CG-CG1 4.17Å; R941-V945 WeakPolarHBondContact O-CG2 3.37Å; R941-V945 PolarHBondContact O-N 3.01Å; I942-V945 PolarHBondContact O-N 2.68Å; A943-V945 PolarHBondContact O-N 3.2Å; V945-A949 VanDerWaalsContact O-CB 3.28Å; V945-A949 WeakPolarHBondContact O-CB 3.48Å; V945-A949 PolarHBondContact O-N 2.96Å
946	S	94.4	Very high	91.8	Very high	2 Å²	2	65.2 Å²	65.2	1%	0.014	31%	0.311	C	S	.	.	H	α-helix	trans	-75.4	-43.4	178.1	-56.7	0	0	0	0	113	I942 A943 K944 A949 K950 L951	I942-S946 WeakPolarHBondContact O-CB 3.41Å; I942-S946 PolarHBondContact O-N 2.7Å; I942-S946 PolarHBondContact O-OG 3.05Å; A943-S946 WeakPolarHBondContact O-CB 3.37Å; A943-S946 PolarHBondContact O-N 2.74Å; A943-S946 VanDerWaalsContact O-N 3.13Å; K944-S946 PolarHBondContact O-N 3.41Å; S946-A949 CarbonylContact O-C 3.58Å; S946-A949 WeakPolarHBondContact O-CA 3.43Å; S946-A949 WeakPolarHBondContact O-CB 3.4Å; S946-A949 PolarHBondContact O-N 3.18Å; S946-K950 PolarHBondContact O-N 2.95Å; S946-L951 PolarHBondContact O-N 3.47Å
947	A	92.9	Very high	91.5	Very high	54 Å²	54	68.1 Å²	68.1	45%	0.446	33%	0.331	S	S	.	.	H	α-helix	trans	-61.8	-45.7	171.6	0	0	0	0	0	111.3	A943 K944 A949 K950	A943-A947 PolarHBondContact O-N 2.82Å; K944-A947 PolarHBondContact O-N 3.09Å; A947-A949 PolarHBondContact O-N 3.01Å; A947-K950 PolarHBondContact O-N 3.03Å
948	E	93.8	Very high	91.3	Very high	99 Å²	99	63.3 Å²	63.3	46%	0.463	31%	0.307	S	S	.	.	H	α-helix	trans	-61.5	-23.3	171.6	-73.3	175.4	-174	0	0	112.9	R860 K944 K950	R860-E948 IonicContact CZ-OE2 2.75Å; R860-E948 IonicContact NH1-OE2 3.65Å; R860-E948 PolarHBondContact NH1-OE2 2.96Å; R860-E948 IonicContact NH2-OE2 2.73Å; R860-E948 PolarHBondContact NH2-OE2 3.35Å; K944-E948 WeakPolarHBondContact CE-OE1 3.37Å; K944-E948 HydrophobicContact CG-CG 4.48Å; K944-E948 IonicContact NZ-OE1 2.73Å; K944-E948 WeakPolarHBondContact O-CB 3.27Å; K944-E948 VanDerWaalsContact O-CG 3.31Å; K944-E948 WeakPolarHBondContact O-CG 3.26Å; K944-E948 PolarHBondContact O-N 2.8Å; E948-K950 VanDerWaalsContact C-N 3.33Å
949	A	93.5	Very high	91.1	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-3.4	173.6	0	0	0	0	0	114	C853 R856 V857 V945 S946 A947	C853-A949 PolarHBondContact SG-O 3.33Å; C853-A949 VanDerWaalsContact SG-O 3.36Å; R856-A949 HydrophobicContact CB-CB 4.33Å; R856-A949 HydrophobicContact CG-CB 4.05Å; R856-A949 PolarHBondContact NH1-O 2.91Å; V857-A949 HydrophobicContact CG2-CB 3.51Å; V945-A949 VanDerWaalsContact O-CB 3.28Å; V945-A949 WeakPolarHBondContact O-CB 3.48Å; V945-A949 PolarHBondContact O-N 2.96Å; S946-A949 CarbonylContact O-C 3.58Å; S946-A949 WeakPolarHBondContact O-CA 3.43Å; S946-A949 WeakPolarHBondContact O-CB 3.4Å; S946-A949 PolarHBondContact O-N 3.18Å; A947-A949 PolarHBondContact O-N 3.01Å
950	K	93.4	Very high	90.7	Very high	174 Å²	174	65.1 Å²	65.1	76%	0.757	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.3	42.5	-171.6	-53.5	-168.9	175	-161.2	0	115	S946 A947 E948	S946-K950 PolarHBondContact O-N 2.95Å; A947-K950 PolarHBondContact O-N 3.03Å; E948-K950 VanDerWaalsContact C-N 3.33Å
951	L	91	Very high	90.5	Very high	20 Å²	20	63.4 Å²	63.4	11%	0.105	32%	0.32	C	S	.	.			trans	-93.5	143.4	160.1	-66.6	174.3	0	0	0	110.1	Y567 E850 C853 R854 V857 S946 I953	Y567-L951 WeakPolarHBondContact OH-CD1 3.5Å; E850-L951 HydrophobicContact CG-CD2 3.97Å; C853-L951 HydrophobicContact CB-CD2 3.44Å; C853-L951 VanDerWaalsContact CB-CD2 3.44Å; C853-L951 HydrophobicContact CB-CG 3.86Å; R854-L951 HydrophobicContact CG-CD1 4.09Å; R854-L951 HydrophobicContact CG-CD2 4.17Å; V857-L951 HydrophobicContact CG2-CD1 3.96Å; S946-L951 PolarHBondContact O-N 3.47Å; L951-I953 HydrophobicContact CB-CD1 3.96Å; L951-I953 HydrophobicContact CB-CG1 4.21Å; L951-I953 HydrophobicContact CD1-CD1 4.11Å; L951-I953 PolarHBondContact O-N 2.89Å
952	E	88.6	Confident	90.3	Very high	210 Å²	210	58 Å²	58	98%	0.981	30%	0.3	S	S	*	.			trans	-77.6	70.6	175.4	-67.9	176.9	-161.6	0	0	110.1
953	I	86.2	Confident	90.1	Very high	57 Å²	57	59.6 Å²	59.6	29%	0.292	31%	0.307	S	S	.	.			trans	-119.8	116.2	179.1	-69.5	169.2	0	0	0	108.8	L951 Y958	L951-I953 HydrophobicContact CB-CD1 3.96Å; L951-I953 HydrophobicContact CB-CG1 4.21Å; L951-I953 HydrophobicContact CD1-CD1 4.11Å; L951-I953 PolarHBondContact O-N 2.89Å; I953-Y958 HydrophobicContact CG2-CG 4.38Å
954	D	87.7	Confident	90	Very high	81 Å²	81	59.6 Å²	59.6	43%	0.433	31%	0.307	S	S	.	.			trans	-76	136.9	166.8	167.9	48.6	0	0	0	110.8	E956 T957 Y958	D954-E956 PolarHBondContact OD1-N 3.23Å; D954-E956 PolarHBondContact OD2-N 3.48Å; D954-T957 VanDerWaalsContact OD2-CB 3.23Å; D954-T957 WeakPolarHBondContact OD2-CB 3.5Å; D954-T957 PolarHBondContact OD2-N 3.16Å; D954-T957 PolarHBondContact OD2-OG1 3.49Å; D954-Y958 WeakPolarHBondContact O-CB 3.3Å; D954-Y958 PolarHBondContact O-N 2.76Å
955	E	87.2	Confident	89.8	Confident	65 Å²	65	55.2 Å²	55.2	30%	0.304	29%	0.288	S	S	.	.	H	α-helix	trans	-70.5	-39.6	-176.7	-154.3	-156.6	78.7	0	0	111.5	K940 A943 L959	K940-E955 HydrophobicContact CG-CG 4.42Å; K940-E955 WeakPolarHBondContact CG-OE2 3.28Å; K940-E955 IonicContact NZ-OE1 3.98Å; K940-E955 PolarHBondContact NZ-OE1 2.57Å; K940-E955 IonicContact NZ-OE2 3.52Å; K940-E955 PolarHBondContact NZ-OE2 2.92Å; A943-E955 HydrophobicContact CB-CG 3.86Å; E955-L959 HydrophobicContact CG-CD1 4.04Å; E955-L959 VanDerWaalsContact O-CB 3.25Å; E955-L959 WeakPolarHBondContact O-CB 3.44Å; E955-L959 WeakPolarHBondContact O-CD1 3.37Å; E955-L959 VanDerWaalsContact O-CG 3.25Å; E955-L959 WeakPolarHBondContact O-CG 3.43Å; E955-L959 PolarHBondContact O-N 3.4Å
956	E	82.1	Confident	89.7	Confident	56 Å²	56	54.5 Å²	54.5	26%	0.262	28%	0.284	S	S	.	.	H	α-helix	trans	-68.1	-42.5	178.7	-69.2	-171.3	-156.3	0	0	111.7	K684 L690 D954 L959 S960	K684-E956 IonicContact NZ-OE2 3.51Å; K684-E956 PolarHBondContact NZ-OE2 2.72Å; L690-E956 VanDerWaalsContact CD1-OE1 3.3Å; L690-E956 WeakPolarHBondContact CD1-OE1 3.4Å; D954-E956 PolarHBondContact OD1-N 3.23Å; D954-E956 PolarHBondContact OD2-N 3.48Å; E956-L959 PolarHBondContact O-N 3.17Å; E956-S960 VanDerWaalsContact O-CB 3.29Å; E956-S960 WeakPolarHBondContact O-CB 2.91Å; E956-S960 PolarHBondContact O-N 3.19Å; E956-S960 PolarHBondContact O-OG 2.86Å
957	T	85.9	Confident	89.7	Confident	91 Å²	91	54.4 Å²	54.4	56%	0.558	28%	0.283	S	S	*	.	H	α-helix	trans	-65.7	-44.5	179.5	-58.9	0	0	0	0	110.9	D954 S960 S961	D954-T957 VanDerWaalsContact OD2-CB 3.23Å; D954-T957 WeakPolarHBondContact OD2-CB 3.5Å; D954-T957 PolarHBondContact OD2-N 3.16Å; D954-T957 PolarHBondContact OD2-OG1 3.49Å; T957-S960 PolarHBondContact O-N 3.28Å; T957-S960 PolarHBondContact O-OG 2.98Å; T957-S961 PolarHBondContact O-N 3.14Å; T957-S961 VanDerWaalsContact O-N 3.11Å
958	Y	89.4	Confident	89.6	Confident	34 Å²	34	52.6 Å²	52.6	13%	0.133	27%	0.266	C	S	.	.	H	α-helix	trans	-65.7	-38.7	174.1	-177.3	-98	0	0	0	112.3	D884 A939 I942 A943 I953 D954 S960 S961 F962	D884-Y958 PolarHBondContact OD2-OH 2.89Å; A939-Y958 HydrophobicContact CB-CD1 4.35Å; A939-Y958 HydrophobicContact CB-CE1 3.84Å; A939-Y958 WeakPolarHBondContact O-CE1 3.36Å; I942-Y958 HydrophobicContact CB-CE1 4.48Å; A943-Y958 HydrophobicContact CB-CD1 3.83Å; A943-Y958 HydrophobicContact CB-CE1 4.4Å; A943-Y958 HydrophobicContact CB-CG 4.36Å; I953-Y958 HydrophobicContact CG2-CG 4.38Å; D954-Y958 WeakPolarHBondContact O-CB 3.3Å; D954-Y958 PolarHBondContact O-N 2.76Å; Y958-S960 VanDerWaalsContact C-N 3.35Å; Y958-S961 PolarHBondContact O-OG 3.16Å; Y958-F962 HydrophobicContact CD1-CE2 4.26Å; Y958-F962 AromaticContact CE1-CE2 3.97Å; Y958-F962 HydrophobicContact CE1-CE2 3.97Å; Y958-F962 HydrophobicContact CE2-CE2 4.36Å; Y958-F962 HydrophobicContact CE2-CZ 4.4Å; Y958-F962 VanDerWaalsContact O-CD2 3.27Å; Y958-F962 WeakPolarHBondContact O-CD2 3.43Å; Y958-F962 VanDerWaalsContact O-CE2 3.22Å; Y958-F962 WeakPolarHBondContact O-CE2 3.34Å
959	L	87.8	Confident	89.6	Confident	5 Å²	5	48 Å²	48	3%	0.026	25%	0.245	C	C	.	.	H	α-helix	trans	-70.4	-29.5	176.7	-77.3	166.4	0	0	0	112.9	N686 Q936 A939 K940 E955 E956	N686-L959 HydrophobicContact CB-CB 4.2Å; N686-L959 PolarHBondContact ND2-O 3.36Å; Q936-L959 HydrophobicContact CB-CD2 4.3Å; Q936-L959 WeakPolarHBondContact O-CD2 3.34Å; A939-L959 HydrophobicContact CB-CD2 3.65Å; K940-L959 HydrophobicContact CB-CD1 4.31Å; K940-L959 HydrophobicContact CB-CD2 4.36Å; K940-L959 HydrophobicContact CG-CD1 4.46Å; E955-L959 HydrophobicContact CG-CD1 4.04Å; E955-L959 VanDerWaalsContact O-CB 3.25Å; E955-L959 WeakPolarHBondContact O-CB 3.44Å; E955-L959 WeakPolarHBondContact O-CD1 3.37Å; E955-L959 VanDerWaalsContact O-CG 3.25Å; E955-L959 WeakPolarHBondContact O-CG 3.43Å; E955-L959 PolarHBondContact O-N 3.4Å; E956-L959 PolarHBondContact O-N 3.17Å
960	S	85.5	Confident	89.7	Confident	54 Å²	54	48.1 Å²	48.1	38%	0.378	25%	0.245	S	C	.	.	H	α-helix	trans	-91.4	-5.3	-178.9	56.5	0	0	0	0	115.2	E956 T957 Y958 F962	E956-S960 VanDerWaalsContact O-CB 3.29Å; E956-S960 WeakPolarHBondContact O-CB 2.91Å; E956-S960 PolarHBondContact O-N 3.19Å; E956-S960 PolarHBondContact O-OG 2.86Å; T957-S960 PolarHBondContact O-N 3.28Å; T957-S960 PolarHBondContact O-OG 2.98Å; Y958-S960 VanDerWaalsContact C-N 3.35Å; S960-F962 VanDerWaalsContact C-N 3.28Å
961	S	89.2	Confident	89.8	Confident	63 Å²	63	42 Å²	42	44%	0.441	22%	0.218	S	C	.	.	H	α-helix	trans	-67	-30.4	169	69.6	0	0	0	0	112.3	T957 Y958	T957-S961 PolarHBondContact O-N 3.14Å; T957-S961 VanDerWaalsContact O-N 3.11Å; Y958-S961 PolarHBondContact O-OG 3.16Å
962	F	90.9	Very high	90	Very high	10 Å²	10	42.5 Å²	42.5	4%	0.044	22%	0.222	C	C	.	.	S	Bend	trans	-82.7	113.8	175.8	-53.8	-75.2	0	0	0	110.7	N686 D884 L887 C911 F912 M935 A939 Y958 S960 P964	N686-F962 PolarHBondContact ND2-O 2.96Å; D884-F962 HydrophobicContact CB-CE1 3.95Å; D884-F962 HydrophobicContact CB-CZ 4.03Å; L887-F962 HydrophobicContact CD2-CD1 4.31Å; L887-F962 HydrophobicContact CD2-CD2 4.3Å; L887-F962 HydrophobicContact CD2-CE1 3.77Å; L887-F962 HydrophobicContact CD2-CE2 3.75Å; L887-F962 HydrophobicContact CD2-CZ 3.47Å; L887-F962 VanDerWaalsContact CD2-CZ 3.47Å; C911-F962 HydrophobicContact CB-CB 4.47Å; C911-F962 WeakPolarHBondContact O-CA 3.33Å; F912-F962 AromaticContact CD1-CD1 3.89Å; F912-F962 HydrophobicContact CD1-CD1 3.89Å; F912-F962 AromaticContact CD1-CE1 3.62Å; F912-F962 HydrophobicContact CD1-CE1 3.62Å; F912-F962 AromaticContact CE1-CD1 3.98Å; F912-F962 HydrophobicContact CE1-CD1 3.98Å; F912-F962 AromaticContact CE1-CE1 3.62Å; F912-F962 HydrophobicContact CE1-CE1 3.62Å; F912-F962 HydrophobicContact CG-CD1 4.23Å; F912-F962 HydrophobicContact CG-CE1 4.4Å; F912-F962 HydrophobicContact CZ-CD1 4.39Å; F912-F962 HydrophobicContact CZ-CE1 4.39Å; M935-F962 HydrophobicContact CE-CB 3.66Å; M935-F962 HydrophobicContact CE-CG 4.16Å; A939-F962 HydrophobicContact CB-CE2 4.36Å; Y958-F962 HydrophobicContact CD1-CE2 4.26Å; Y958-F962 AromaticContact CE1-CE2 3.97Å; Y958-F962 HydrophobicContact CE1-CE2 3.97Å; Y958-F962 HydrophobicContact CE2-CE2 4.36Å; Y958-F962 HydrophobicContact CE2-CZ 4.4Å; Y958-F962 VanDerWaalsContact O-CD2 3.27Å; Y958-F962 WeakPolarHBondContact O-CD2 3.43Å; Y958-F962 VanDerWaalsContact O-CE2 3.22Å; Y958-F962 WeakPolarHBondContact O-CE2 3.34Å; S960-F962 VanDerWaalsContact C-N 3.28Å; F962-P964 WeakPolarHBondContact O-CD 3.28Å
963	K	90.7	Very high	90.3	Very high	34 Å²	34	32.5 Å²	32.5	15%	0.148	18%	0.175	C	C	.	.			trans	-110.2	103	-164.9	-69.8	-173.1	-170.2	-179.6	0	113	C911 F914 Q915 E916 N917 H965	C911-K963 PolarHBondContact O-N 3.4Å; F914-K963 HydrophobicContact CD1-CB 3.77Å; F914-K963 HydrophobicContact CD1-CD 4.38Å; F914-K963 HydrophobicContact CE1-CB 4.42Å; F914-K963 WeakPolarHBondContact O-CB 3.31Å; Q915-K963 PolarHBondContact O-NZ 2.85Å; E916-K963 WeakPolarHBondContact O-CD 3.47Å; E916-K963 PolarHBondContact O-NZ 3.01Å; N917-K963 PolarHBondContact OD1-NZ 2.97Å; K963-H965 PolarHBondContact O-N 3.05Å; K963-H965 VanDerWaalsContact O-N 3.16Å
964	P	91.1	Very high	90.8	Very high	4 Å²	4	30.1 Å²	30.1	3%	0.026	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-77.7	2.9	-174.4	32.8	-38	0	0	0	115.5	M921 L924 L932 F962 L966 M967	M921-P964 HydrophobicContact CE-CG 3.74Å; L924-P964 HydrophobicContact CD1-CB 4.33Å; L932-P964 HydrophobicContact CD1-CB 4.11Å; L932-P964 HydrophobicContact CD2-CB 3.73Å; L932-P964 HydrophobicContact CD2-CG 4.03Å; F962-P964 WeakPolarHBondContact O-CD 3.28Å; P964-L966 PolarHBondContact O-N 3.01Å; P964-M967 HydrophobicContact CB-CG 3.99Å; P964-M967 HydrophobicContact CB-SD 3.55Å; P964-M967 VanDerWaalsContact CB-SD 3.55Å; P964-M967 WeakPolarHBondContact O-CB 3.47Å; P964-M967 WeakPolarHBondContact O-CG 3.19Å; P964-M967 PolarHBondContact O-N 3.13Å
965	H	90.6	Very high	91.1	Very high	30 Å²	30	30 Å²	30	14%	0.139	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-56.2	-24.6	-172.7	-55.1	88	0	0	0	115	F914 K963	F914-H965 HydrophobicContact CD1-CB 4.29Å; F914-H965 HydrophobicContact CE1-CB 3.83Å; K963-H965 PolarHBondContact O-N 3.05Å; K963-H965 VanDerWaalsContact O-N 3.16Å
966	L	92.2	Very high	91.4	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.005	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-107.1	8.6	177.9	-63.3	-174	0	0	0	114.2	F914 P964 V969 V970 T986 V988 C996	F914-L966 HydrophobicContact CB-CD1 4.44Å; F914-L966 HydrophobicContact CD1-CD1 4.47Å; F914-L966 HydrophobicContact CD1-CG 4.28Å; F914-L966 HydrophobicContact CD2-CD1 3.35Å; F914-L966 HydrophobicContact CD2-CG 4.01Å; F914-L966 HydrophobicContact CE1-CG 4.4Å; F914-L966 HydrophobicContact CE2-CD1 3.63Å; F914-L966 HydrophobicContact CE2-CG 4.13Å; F914-L966 HydrophobicContact CG-CD1 3.83Å; F914-L966 HydrophobicContact CG-CG 4.09Å; F914-L966 HydrophobicContact CZ-CD1 4.32Å; F914-L966 HydrophobicContact CZ-CG 4.33Å; P964-L966 PolarHBondContact O-N 3.01Å; L966-V969 HydrophobicContact CB-CB 4.39Å; L966-V969 HydrophobicContact CD2-CB 4.17Å; L966-V969 HydrophobicContact CD2-CG1 4.2Å; L966-V969 HydrophobicContact CD2-CG2 4.11Å; L966-V969 WeakPolarHBondContact O-CB 3.36Å; L966-V969 PolarHBondContact O-N 2.87Å; L966-V970 HydrophobicContact CB-CG2 4.44Å; L966-V970 WeakPolarHBondContact O-CB 3.44Å; L966-V970 WeakPolarHBondContact O-CG2 3.49Å; L966-V970 PolarHBondContact O-N 3.49Å; L966-T986 HydrophobicContact CD2-CG2 4.15Å; L966-V988 HydrophobicContact CD2-CB 4.42Å; L966-V988 HydrophobicContact CD2-CG2 4.31Å; L966-C996 HydrophobicContact CD1-CB 3.93Å
967	M	93	Very high	92	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-59.3	-52.3	-179.6	-73	-176.3	77.1	0	0	112.5	L908 C911 L924 L928 L932 P964 V969 V970 Y971	L908-M967 HydrophobicContact CD1-CE 3.95Å; C911-M967 VanDerWaalsContact SG-CG 3.56Å; L924-M967 HydrophobicContact CD1-SD 4.45Å; L924-M967 HydrophobicContact CD2-CB 3.67Å; L924-M967 HydrophobicContact CD2-CG 4.29Å; L924-M967 HydrophobicContact CD2-SD 3.92Å; L928-M967 HydrophobicContact CB-CE 4.01Å; L928-M967 HydrophobicContact CD1-CB 4.4Å; L932-M967 HydrophobicContact CB-CE 4.21Å; L932-M967 HydrophobicContact CB-SD 4.19Å; L932-M967 HydrophobicContact CD1-SD 4.06Å; L932-M967 HydrophobicContact CD2-SD 4.1Å; L932-M967 HydrophobicContact CG-SD 4.34Å; P964-M967 HydrophobicContact CB-CG 3.99Å; P964-M967 HydrophobicContact CB-SD 3.55Å; P964-M967 VanDerWaalsContact CB-SD 3.55Å; P964-M967 WeakPolarHBondContact O-CB 3.47Å; P964-M967 WeakPolarHBondContact O-CG 3.19Å; P964-M967 PolarHBondContact O-N 3.13Å; M967-V969 VanDerWaalsContact C-N 3.32Å; M967-V969 PolarHBondContact O-N 2.86Å; M967-V970 PolarHBondContact O-N 2.78Å; M967-Y971 WeakPolarHBondContact O-CB 3.49Å; M967-Y971 PolarHBondContact O-N 2.95Å
968	D	91.9	Very high	92.4	Very high	17 Å²	17	26.1 Å²	26.1	9%	0.091	16%	0.162	C	C	.	.	H	α-helix	trans	-64.3	-38.3	178.4	-61.7	-63.3	0	0	0	111.1	L924 T925 V970 Y971 T972 M985	L924-D968 WeakPolarHBondContact CA-OD2 3.45Å; T925-D968 PolarHBondContact N-OD1 3Å; D968-V970 PolarHBondContact O-N 3.36Å; D968-Y971 PolarHBondContact O-N 2.86Å; D968-T972 VanDerWaalsContact O-CB 3.31Å; D968-T972 WeakPolarHBondContact O-CB 3.45Å; D968-T972 PolarHBondContact O-N 2.82Å; D968-T972 PolarHBondContact O-OG1 2.78Å; D968-M985 HydrophobicContact CB-CE 4.07Å
969	V	93.5	Very high	92.6	Very high	3 Å²	3	24.6 Å²	24.6	2%	0.018	16%	0.156	C	C	.	.	H	α-helix	trans	-58.7	-46.7	175.8	162.6	0	0	0	0	111.6	L966 M967 W973 I982 M985 T986 I993	L966-V969 HydrophobicContact CB-CB 4.39Å; L966-V969 HydrophobicContact CD2-CB 4.17Å; L966-V969 HydrophobicContact CD2-CG1 4.2Å; L966-V969 HydrophobicContact CD2-CG2 4.11Å; L966-V969 WeakPolarHBondContact O-CB 3.36Å; L966-V969 PolarHBondContact O-N 2.87Å; M967-V969 VanDerWaalsContact C-N 3.32Å; M967-V969 PolarHBondContact O-N 2.86Å; V969-W973 WeakPolarHBondContact O-CB 3.37Å; V969-W973 PolarHBondContact O-N 3.36Å; V969-I982 HydrophobicContact CG1-CB 4.28Å; V969-I982 HydrophobicContact CG1-CD1 4.3Å; V969-M985 HydrophobicContact CG2-CB 3.93Å; V969-T986 HydrophobicContact CG2-CG2 4.01Å; V969-I993 HydrophobicContact CG1-CG2 4.21Å
970	V	95.5	Very high	92.8	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.006	17%	0.165	C	C	.	.	H	α-helix	trans	-72.6	-37.5	179.7	170.5	0	0	0	0	111.6	T906 A907 L966 M967 D968 W973 A974 M997 L1000	T906-V970 HydrophobicContact CG2-CG1 3.99Å; A907-V970 HydrophobicContact CB-CG1 4.48Å; L966-V970 HydrophobicContact CB-CG2 4.44Å; L966-V970 WeakPolarHBondContact O-CB 3.44Å; L966-V970 WeakPolarHBondContact O-CG2 3.49Å; L966-V970 PolarHBondContact O-N 3.49Å; M967-V970 PolarHBondContact O-N 2.78Å; D968-V970 PolarHBondContact O-N 3.36Å; V970-W973 PolarHBondContact O-N 2.99Å; V970-A974 WeakPolarHBondContact O-CB 3.23Å; V970-A974 PolarHBondContact O-N 3.02Å; V970-M997 HydrophobicContact CB-CE 4.48Å; V970-M997 HydrophobicContact CG2-CE 3.86Å; V970-M997 HydrophobicContact CG2-SD 4.02Å; V970-L1000 HydrophobicContact CG1-CD2 3.52Å; V970-L1000 HydrophobicContact CG2-CD2 4.19Å
971	Y	95.4	Very high	93.2	Very high	47 Å²	47	27.6 Å²	27.6	18%	0.184	17%	0.168	C	C	.	.	H	α-helix	trans	-62.7	-49.3	174.4	-176.5	-110.6	0	0	0	111.8	E903 Q904 A907 Q927 L928 M967 D968 W973 A974 T975	E903-Y971 HydrophobicContact CB-CD2 3.66Å; E903-Y971 HydrophobicContact CB-CE2 3.64Å; Q904-Y971 HydrophobicContact CG-CD2 4.49Å; Q904-Y971 HydrophobicContact CG-CE2 3.91Å; A907-Y971 HydrophobicContact CB-CD2 4.43Å; Q927-Y971 PolarHBondContact OE1-OH 3.42Å; L928-Y971 HydrophobicContact CD1-CD1 4.24Å; L928-Y971 HydrophobicContact CD1-CG 3.95Å; L928-Y971 HydrophobicContact CD2-CD2 4.09Å; L928-Y971 HydrophobicContact CD2-CG 4.33Å; M967-Y971 WeakPolarHBondContact O-CB 3.49Å; M967-Y971 PolarHBondContact O-N 2.95Å; D968-Y971 PolarHBondContact O-N 2.86Å; Y971-W973 VanDerWaalsContact C-N 3.28Å; Y971-W973 PolarHBondContact O-N 3.16Å; Y971-A974 PolarHBondContact O-N 3.45Å; Y971-A974 VanDerWaalsContact O-N 3.12Å; Y971-T975 HydrophobicContact CE1-CG2 4.41Å; Y971-T975 HydrophobicContact CE2-CG2 4.47Å; Y971-T975 PolarHBondContact O-N 2.86Å; Y971-T975 PolarHBondContact O-OG1 3.19Å
972	T	94.8	Very high	93.4	Very high	30 Å²	30	24.6 Å²	24.6	18%	0.184	15%	0.147	C	C	.	.	H	α-helix	trans	-66.5	-28.7	177.6	-66.1	0	0	0	0	112.4	D968 T975 A977 I982 M985	D968-T972 VanDerWaalsContact O-CB 3.31Å; D968-T972 WeakPolarHBondContact O-CB 3.45Å; D968-T972 PolarHBondContact O-N 2.82Å; D968-T972 PolarHBondContact O-OG1 2.78Å; T972-T975 WeakPolarHBondContact CA-OG1 3.29Å; T972-T975 PolarHBondContact O-OG1 3.38Å; T972-A977 HydrophobicContact CG2-CB 3.52Å; T972-A977 WeakPolarHBondContact O-CB 3.35Å; T972-A977 PolarHBondContact O-N 2.91Å; T972-A977 VanDerWaalsContact O-N 3.11Å; T972-I982 HydrophobicContact CG2-CG2 4.03Å; T972-M985 HydrophobicContact CG2-CE 4.38Å; T972-M985 HydrophobicContact CG2-SD 3.88Å
973	W	95.9	Very high	93.4	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-67.5	-48	166.9	-175.4	-112.1	0	0	0	112.1	V969 V970 Y971 T975 G976 A977 F979 I982 M997 I1030 R1032 D1033 V1035	V969-W973 WeakPolarHBondContact O-CB 3.37Å; V969-W973 PolarHBondContact O-N 3.36Å; V970-W973 PolarHBondContact O-N 2.99Å; Y971-W973 VanDerWaalsContact C-N 3.28Å; Y971-W973 PolarHBondContact O-N 3.16Å; W973-T975 VanDerWaalsContact C-N 3.25Å; W973-T975 PolarHBondContact O-N 3.24Å; W973-G976 PolarHBondContact O-N 3.47Å; W973-A977 VanDerWaalsContact CE3-O 3.26Å; W973-A977 VanDerWaalsContact CZ3-O 3.29Å; W973-A977 WeakPolarHBondContact CZ3-O 3.48Å; W973-F979 HydrophobicContact CH2-CB 4.35Å; W973-F979 HydrophobicContact CH2-CD2 4.45Å; W973-F979 HydrophobicContact CZ3-CB 3.97Å; W973-F979 HydrophobicContact CZ3-CD2 4.24Å; W973-I982 HydrophobicContact CB-CD1 4.23Å; W973-I982 HydrophobicContact CB-CG2 4.47Å; W973-I982 HydrophobicContact CD2-CD1 4.1Å; W973-I982 HydrophobicContact CE3-CD1 3.69Å; W973-I982 HydrophobicContact CE3-CG1 4.34Å; W973-I982 HydrophobicContact CG-CD1 4.35Å; W973-I982 HydrophobicContact CZ3-CD1 4.44Å; W973-M997 HydrophobicContact CB-CE 3.54Å; W973-M997 VanDerWaalsContact CD1-CE 3.47Å; W973-M997 HydrophobicContact CD2-CE 4.31Å; W973-M997 HydrophobicContact CG-CE 3.48Å; W973-M997 VanDerWaalsContact CG-CE 3.48Å; W973-M997 HydrophobicContact CG-SD 4.33Å; W973-I1030 PolarHBondContact NE1-O 3.02Å; W973-R1032 VanDerWaalsContact CE3-NH2 3.27Å; W973-R1032 HydrophobicContact CH2-CG 4.25Å; W973-R1032 VanDerWaalsContact CH2-NH1 3.34Å; W973-R1032 HydrophobicContact CZ2-CG 3.63Å; W973-R1032 PolarHBondContact O-NH2 3.18Å; W973-D1033 HydrophobicContact CH2-CB 4.11Å; W973-V1035 HydrophobicContact CH2-CG2 3.79Å; W973-V1035 HydrophobicContact CZ2-CB 4.11Å; W973-V1035 HydrophobicContact CZ2-CG2 3.36Å
974	A	95.6	Very high	93.4	Very high	6 Å²	6	31.8 Å²	31.8	5%	0.05	18%	0.181	C	C	.	.	H	α-helix	trans	-65.5	-25.2	-178.7	0	0	0	0	0	113.5	E903 V970 Y971 G976 K1029 I1030	E903-A974 HydrophobicContact CB-CB 3.87Å; E903-A974 HydrophobicContact CG-CB 3.8Å; V970-A974 WeakPolarHBondContact O-CB 3.23Å; V970-A974 PolarHBondContact O-N 3.02Å; Y971-A974 PolarHBondContact O-N 3.45Å; Y971-A974 VanDerWaalsContact O-N 3.12Å; A974-G976 VanDerWaalsContact C-N 3.31Å; A974-K1029 HydrophobicContact CB-CB 4.29Å; A974-I1030 HydrophobicContact CB-CG2 4.29Å
975	T	95.3	Very high	93.3	Very high	79 Å²	79	34.7 Å²	34.7	49%	0.485	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	0.6	172.4	57.2	0	0	0	0	114.5	E903 Y971 T972 W973	E903-T975 HydrophobicContact CB-CG2 4.41Å; E903-T975 HydrophobicContact CG-CG2 3.96Å; Y971-T975 HydrophobicContact CE1-CG2 4.41Å; Y971-T975 HydrophobicContact CE2-CG2 4.47Å; Y971-T975 PolarHBondContact O-N 2.86Å; Y971-T975 PolarHBondContact O-OG1 3.19Å; T972-T975 WeakPolarHBondContact CA-OG1 3.29Å; T972-T975 PolarHBondContact O-OG1 3.38Å; W973-T975 VanDerWaalsContact C-N 3.25Å; W973-T975 PolarHBondContact O-N 3.24Å
976	G	94.1	Very high	93.3	Very high	46 Å²	46	34.3 Å²	34.3	47%	0.474	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	104	11.3	170	0	0	0	0	0	116.8	W973 A974 R1032	W973-G976 PolarHBondContact O-N 3.47Å; A974-G976 VanDerWaalsContact C-N 3.31Å; G976-R1032 VanDerWaalsContact C-NH2 3.31Å
977	A	94.4	Very high	93	Very high	22 Å²	22	37.5 Å²	37.5	18%	0.182	21%	0.212	C	C	.	.			trans	-67.7	155.4	177.6	0	0	0	0	0	113.1	T972 W973 H981 I982 R1032	T972-A977 HydrophobicContact CG2-CB 3.52Å; T972-A977 WeakPolarHBondContact O-CB 3.35Å; T972-A977 PolarHBondContact O-N 2.91Å; T972-A977 VanDerWaalsContact O-N 3.11Å; W973-A977 VanDerWaalsContact CE3-O 3.26Å; W973-A977 VanDerWaalsContact CZ3-O 3.29Å; W973-A977 WeakPolarHBondContact CZ3-O 3.48Å; A977-H981 HydrophobicContact CB-CB 4.46Å; A977-I982 HydrophobicContact CB-CG2 4.42Å; A977-R1032 PolarHBondContact O-NH1 3.39Å; A977-R1032 PolarHBondContact O-NH2 3.38Å
978	T	94.1	Very high	92.9	Very high	62 Å²	62	38.2 Å²	38.2	38%	0.38	22%	0.216	S	C	.	.			trans	-77.9	155.8	-178.1	70.7	0	0	0	0	111.9	E434 A980 H981 I982	E434-T978 WeakPolarHBondContact OE2-CG2 2.97Å; T978-A980 PolarHBondContact O-N 3.05Å; T978-H981 WeakPolarHBondContact O-CB 3.44Å; T978-H981 PolarHBondContact O-N 2.93Å; T978-I982 PolarHBondContact O-N 3.31Å
979	F	93.9	Very high	92.9	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.009	22%	0.221	C	C	.	.	H	α-helix	trans	-63.4	-35.7	-174.4	-169.2	-100.6	0	0	0	111.5	L438 L460 W973 H981 I982 C983 E990 I993 I994 I1034 V1035	L438-F979 HydrophobicContact CD1-CD1 3.77Å; L438-F979 HydrophobicContact CD1-CE1 4.37Å; L438-F979 HydrophobicContact CD2-CD1 4.07Å; L460-F979 HydrophobicContact CD2-CE1 3.8Å; L460-F979 HydrophobicContact CD2-CZ 4.11Å; W973-F979 HydrophobicContact CH2-CB 4.35Å; W973-F979 HydrophobicContact CH2-CD2 4.45Å; W973-F979 HydrophobicContact CZ3-CB 3.97Å; W973-F979 HydrophobicContact CZ3-CD2 4.24Å; F979-H981 PolarHBondContact O-N 3.21Å; F979-I982 HydrophobicContact CD2-CD1 3.93Å; F979-I982 HydrophobicContact CD2-CG1 4.26Å; F979-I982 HydrophobicContact CE2-CD1 4.19Å; F979-I982 WeakPolarHBondContact O-CG1 3.32Å; F979-I982 PolarHBondContact O-N 3.08Å; F979-C983 WeakPolarHBondContact CE1-SG 3.49Å; F979-C983 VanDerWaalsContact CZ-SG 3.57Å; F979-C983 PolarHBondContact O-N 3.41Å; F979-C983 PolarHBondContact O-SG 3.48Å; F979-E990 HydrophobicContact CE1-CB 4.05Å; F979-E990 HydrophobicContact CZ-CB 4.1Å; F979-I993 HydrophobicContact CE2-CG2 4.44Å; F979-I994 HydrophobicContact CE1-CD1 4.4Å; F979-I994 HydrophobicContact CE2-CD1 4.07Å; F979-I994 HydrophobicContact CE2-CG1 3.7Å; F979-I994 HydrophobicContact CZ-CD1 3.73Å; F979-I994 HydrophobicContact CZ-CG1 3.67Å; F979-I1034 HydrophobicContact CB-CG2 3.81Å; F979-I1034 HydrophobicContact CD1-CG2 3.81Å; F979-I1034 HydrophobicContact CD2-CG2 3.89Å; F979-I1034 HydrophobicContact CE1-CG2 4.38Å; F979-I1034 HydrophobicContact CE2-CG2 4.46Å; F979-I1034 HydrophobicContact CG-CG2 3.55Å; F979-V1035 HydrophobicContact CD2-CG2 3.73Å; F979-V1035 HydrophobicContact CE2-CG2 3.88Å
980	A	92.2	Very high	92.8	Very high	27 Å²	27	41.1 Å²	41.1	22%	0.223	23%	0.229	C	C	.	.	H	α-helix	trans	-65.2	-13.4	172.8	0	0	0	0	0	114.9	L438 T978 K984	L438-A980 HydrophobicContact CD2-CB 3.68Å; T978-A980 PolarHBondContact O-N 3.05Å; A980-K984 WeakPolarHBondContact O-CD 3.37Å; A980-K984 WeakPolarHBondContact O-CE 3.33Å; A980-K984 PolarHBondContact O-NZ 3.02Å
981	H	92.6	Very high	92.6	Very high	96 Å²	96	41.3 Å²	41.3	44%	0.444	23%	0.231	S	C	.	.	H	α-helix	trans	-87	-52.8	171.2	-179.4	75.5	0	0	0	110.9	A977 T978 F979 C983 K984	A977-H981 HydrophobicContact CB-CB 4.46Å; T978-H981 WeakPolarHBondContact O-CB 3.44Å; T978-H981 PolarHBondContact O-N 2.93Å; F979-H981 PolarHBondContact O-N 3.21Å; H981-C983 VanDerWaalsContact C-N 3.29Å; H981-C983 PolarHBondContact O-N 3.5Å; H981-K984 WeakPolarHBondContact O-CB 3.26Å; H981-K984 PolarHBondContact O-N 3.39Å
982	I	92.9	Very high	92.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-65	-30.7	-175.3	62.2	164.3	0	0	0	113.3	V969 T972 W973 A977 T978 F979 K984 M985 I993 M997	V969-I982 HydrophobicContact CG1-CB 4.28Å; V969-I982 HydrophobicContact CG1-CD1 4.3Å; T972-I982 HydrophobicContact CG2-CG2 4.03Å; W973-I982 HydrophobicContact CB-CD1 4.23Å; W973-I982 HydrophobicContact CB-CG2 4.47Å; W973-I982 HydrophobicContact CD2-CD1 4.1Å; W973-I982 HydrophobicContact CE3-CD1 3.69Å; W973-I982 HydrophobicContact CE3-CG1 4.34Å; W973-I982 HydrophobicContact CG-CD1 4.35Å; W973-I982 HydrophobicContact CZ3-CD1 4.44Å; A977-I982 HydrophobicContact CB-CG2 4.42Å; T978-I982 PolarHBondContact O-N 3.31Å; F979-I982 HydrophobicContact CD2-CD1 3.93Å; F979-I982 HydrophobicContact CD2-CG1 4.26Å; F979-I982 HydrophobicContact CE2-CD1 4.19Å; F979-I982 WeakPolarHBondContact O-CG1 3.32Å; F979-I982 PolarHBondContact O-N 3.08Å; I982-K984 PolarHBondContact O-N 3.39Å; I982-K984 VanDerWaalsContact O-N 3.1Å; I982-M985 HydrophobicContact CB-SD 4.41Å; I982-M985 HydrophobicContact CG2-SD 4.16Å; I982-M985 WeakPolarHBondContact O-CB 3.13Å; I982-M985 PolarHBondContact O-N 3.39Å; I982-I993 HydrophobicContact CD1-CG2 4.27Å; I982-M997 HydrophobicContact CD1-CE 4.15Å
983	C	91.4	Very high	92.3	Very high	24 Å²	24	37.9 Å²	37.9	16%	0.162	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-7.5	174.2	-62.2	0	0	0	0	114	F979 H981 E990	F979-C983 WeakPolarHBondContact CE1-SG 3.49Å; F979-C983 VanDerWaalsContact CZ-SG 3.57Å; F979-C983 PolarHBondContact O-N 3.41Å; F979-C983 PolarHBondContact O-SG 3.48Å; H981-C983 VanDerWaalsContact C-N 3.29Å; H981-C983 PolarHBondContact O-N 3.5Å; C983-E990 HydrophobicContact CB-CG 4.32Å
984	K	90.7	Very high	92.2	Very high	171 Å²	171	37.9 Å²	37.9	74%	0.743	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.5	-0.4	174.3	-62.7	168.1	-178.2	141.8	0	112.9	A980 H981 I982	A980-K984 WeakPolarHBondContact O-CD 3.37Å; A980-K984 WeakPolarHBondContact O-CE 3.33Å; A980-K984 PolarHBondContact O-NZ 3.02Å; H981-K984 WeakPolarHBondContact O-CB 3.26Å; H981-K984 PolarHBondContact O-N 3.39Å; I982-K984 PolarHBondContact O-N 3.39Å; I982-K984 VanDerWaalsContact O-N 3.1Å
985	M	89.6	Confident	91.9	Very high	64 Å²	64	42.4 Å²	42.4	32%	0.315	23%	0.231	S	C	.	.	S	Bend	trans	-97.5	-4	-177.7	-61.3	173.2	62.1	0	0	113.6	D968 V969 T972 I982	D968-M985 HydrophobicContact CB-CE 4.07Å; V969-M985 HydrophobicContact CG2-CB 3.93Å; T972-M985 HydrophobicContact CG2-CE 4.38Å; T972-M985 HydrophobicContact CG2-SD 3.88Å; I982-M985 HydrophobicContact CB-SD 4.41Å; I982-M985 HydrophobicContact CG2-SD 4.16Å; I982-M985 WeakPolarHBondContact O-CB 3.13Å; I982-M985 PolarHBondContact O-N 3.39Å
986	T	89.4	Confident	91.8	Very high	23 Å²	23	38.9 Å²	38.9	14%	0.141	21%	0.209	C	C	.	.			trans	-153.3	158.8	-172.2	-176.9	0	0	0	0	111.7	L966 V969 V988 I993	L966-T986 HydrophobicContact CD2-CG2 4.15Å; V969-T986 HydrophobicContact CG2-CG2 4.01Å; T986-V988 VanDerWaalsContact C-N 3.31Å; T986-V988 HydrophobicContact CG2-CB 4.12Å; T986-V988 WeakPolarHBondContact OG1-CG2 3.4Å; T986-V988 PolarHBondContact OG1-N 2.97Å; T986-I993 HydrophobicContact CG2-CD1 3.75Å; T986-I993 HydrophobicContact CG2-CG1 4.47Å
987	D	87.7	Confident	91.8	Very high	68 Å²	68	36.8 Å²	36.8	36%	0.364	19%	0.187	S	C	.	.	S	Bend	trans	-84.2	-2.9	172.3	70.5	-25.7	0	0	0	113.6	S918 S919	S918-D987 WeakPolarHBondContact CB-OD1 3.44Å; S918-D987 PolarHBondContact OG-OD1 3.33Å; S919-D987 WeakPolarHBondContact CB-OD2 3.32Å; S919-D987 PolarHBondContact N-OD2 3.47Å; S919-D987 PolarHBondContact OG-OD2 3.27Å
988	V	90.8	Very high	91.7	Very high	14 Å²	14	38 Å²	38	9%	0.085	19%	0.187	C	C	.	.	S	Bend	trans	-78	128	-176.5	177.3	0	0	0	0	111.5	F914 L966 T986 I993	F914-V988 HydrophobicContact CE2-CG1 4.1Å; F914-V988 HydrophobicContact CE2-CG2 4.29Å; F914-V988 HydrophobicContact CZ-CG1 4.45Å; F914-V988 HydrophobicContact CZ-CG2 3.83Å; L966-V988 HydrophobicContact CD2-CB 4.42Å; L966-V988 HydrophobicContact CD2-CG2 4.31Å; T986-V988 VanDerWaalsContact C-N 3.31Å; T986-V988 HydrophobicContact CG2-CB 4.12Å; T986-V988 WeakPolarHBondContact OG1-CG2 3.4Å; T986-V988 PolarHBondContact OG1-N 2.97Å; V988-I993 HydrophobicContact CB-CG1 4.37Å; V988-I993 HydrophobicContact CG1-CG1 4.03Å
989	F	91.1	Very high	91.6	Very high	43 Å²	43	38 Å²	38	19%	0.189	18%	0.18	C	C	.	.			trans	-52.2	144.4	175.9	-70.4	-86	0	0	0	113.5	K396 K397 E400 G991 S992 I993	K396-F989 HydrophobicContact CB-CE1 4.45Å; K396-F989 HydrophobicContact CB-CE2 3.96Å; K396-F989 HydrophobicContact CB-CZ 3.79Å; K396-F989 HydrophobicContact CD-CD2 3.6Å; K396-F989 HydrophobicContact CD-CE2 3.58Å; K396-F989 HydrophobicContact CD-CG 4.26Å; K396-F989 HydrophobicContact CD-CZ 4.21Å; K396-F989 HydrophobicContact CG-CE2 4.39Å; K397-F989 HydrophobicContact CG-CZ 3.96Å; E400-F989 WeakPolarHBondContact OE1-CE1 3.49Å; F989-G991 PolarHBondContact O-N 2.99Å; F989-S992 CarbonylContact O-C 3.54Å; F989-S992 VanDerWaalsContact O-CA 3.3Å; F989-S992 WeakPolarHBondContact O-CA 3.42Å; F989-S992 VanDerWaalsContact O-CB 3.23Å; F989-S992 WeakPolarHBondContact O-CB 3.25Å; F989-S992 PolarHBondContact O-N 3.07Å; F989-I993 PolarHBondContact O-N 2.96Å
990	E	91.8	Very high	91.6	Very high	39 Å²	39	37.9 Å²	37.9	18%	0.182	18%	0.179	C	C	.	.	H	α-helix	trans	-65.6	-41.5	-167.6	-52.3	81.7	175.5	0	0	112.5	Q440 L460 F979 C983 S992 I993 I994	Q440-E990 HydrophobicContact CG-CG 4.01Å; Q440-E990 WeakPolarHBondContact CG-OE1 3.39Å; Q440-E990 PolarHBondContact NE2-OE1 3.27Å; L460-E990 HydrophobicContact CD2-CB 3.63Å; L460-E990 HydrophobicContact CG-CB 4.42Å; F979-E990 HydrophobicContact CE1-CB 4.05Å; F979-E990 HydrophobicContact CZ-CB 4.1Å; C983-E990 HydrophobicContact CB-CG 4.32Å; E990-S992 PolarHBondContact O-N 2.95Å; E990-I993 WeakPolarHBondContact O-CB 3.41Å; E990-I993 PolarHBondContact O-N 3.47Å; E990-I994 WeakPolarHBondContact O-CG1 3.43Å; E990-I994 PolarHBondContact O-N 2.89Å
991	G	91.2	Very high	91.8	Very high	5 Å²	5	36.9 Å²	36.9	5%	0.052	17%	0.17	C	C	.	.	H	α-helix	trans	-67.6	-20.7	172	0	0	0	0	0	113.7	G458 L459 F989 R995	G458-G991 VanDerWaalsContact O-CA 3.27Å; G458-G991 WeakPolarHBondContact O-CA 3.05Å; G458-G991 PolarHBondContact O-N 3.32Å; L459-G991 WeakPolarHBondContact O-CA 3.32Å; F989-G991 PolarHBondContact O-N 2.99Å; G991-R995 WeakPolarHBondContact O-CB 3.42Å; G991-R995 PolarHBondContact O-N 3.49Å
992	S	90.8	Very high	91.7	Very high	3 Å²	3	34.3 Å²	34.3	2%	0.021	16%	0.158	C	C	.	.	H	α-helix	trans	-82.2	-33.8	173	-50.6	0	0	0	0	111.1	K396 G457 E916 F989 E990 R995 C996	K396-S992 PolarHBondContact NZ-OG 3.4Å; K396-S992 VanDerWaalsContact NZ-OG 3.08Å; G457-S992 PolarHBondContact O-OG 2.89Å; E916-S992 PolarHBondContact OE1-OG 3.37Å; F989-S992 CarbonylContact O-C 3.54Å; F989-S992 VanDerWaalsContact O-CA 3.3Å; F989-S992 WeakPolarHBondContact O-CA 3.42Å; F989-S992 VanDerWaalsContact O-CB 3.23Å; F989-S992 WeakPolarHBondContact O-CB 3.25Å; F989-S992 PolarHBondContact O-N 3.07Å; E990-S992 PolarHBondContact O-N 2.95Å; S992-R995 PolarHBondContact O-N 3.3Å; S992-R995 PolarHBondContact OG-NH2 2.88Å; S992-C996 PolarHBondContact O-N 3.32Å
993	I	93.6	Very high	91.8	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-61	-49	165.7	-58.2	174.4	0	0	0	110.3	V969 F979 I982 T986 V988 F989 E990 R995 C996 M997	V969-I993 HydrophobicContact CG1-CG2 4.21Å; F979-I993 HydrophobicContact CE2-CG2 4.44Å; I982-I993 HydrophobicContact CD1-CG2 4.27Å; T986-I993 HydrophobicContact CG2-CD1 3.75Å; T986-I993 HydrophobicContact CG2-CG1 4.47Å; V988-I993 HydrophobicContact CB-CG1 4.37Å; V988-I993 HydrophobicContact CG1-CG1 4.03Å; F989-I993 PolarHBondContact O-N 2.96Å; E990-I993 WeakPolarHBondContact O-CB 3.41Å; E990-I993 PolarHBondContact O-N 3.47Å; I993-R995 VanDerWaalsContact C-N 3.33Å; I993-R995 PolarHBondContact O-N 3Å; I993-C996 VanDerWaalsContact O-CB 3.31Å; I993-C996 WeakPolarHBondContact O-CB 3.42Å; I993-C996 PolarHBondContact O-N 3.08Å; I993-C996 VanDerWaalsContact O-N 3.14Å; I993-M997 HydrophobicContact CG2-CE 4.41Å; I993-M997 WeakPolarHBondContact O-CG 3.46Å; I993-M997 PolarHBondContact O-N 2.96Å
994	I	93.3	Very high	92	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.9	-38.7	178.9	-66.1	176.2	0	0	0	111.5	L460 P461 F979 E990 C996 M997 R998 I1034 V1035	L460-I994 HydrophobicContact CD2-CD1 3.56Å; P461-I994 HydrophobicContact CG-CB 4.41Å; P461-I994 HydrophobicContact CG-CG2 3.73Å; F979-I994 HydrophobicContact CE1-CD1 4.4Å; F979-I994 HydrophobicContact CE2-CD1 4.07Å; F979-I994 HydrophobicContact CE2-CG1 3.7Å; F979-I994 HydrophobicContact CZ-CD1 3.73Å; F979-I994 HydrophobicContact CZ-CG1 3.67Å; E990-I994 WeakPolarHBondContact O-CG1 3.43Å; E990-I994 PolarHBondContact O-N 2.89Å; I994-C996 VanDerWaalsContact C-N 3.32Å; I994-C996 PolarHBondContact O-N 3.2Å; I994-M997 PolarHBondContact O-N 3.27Å; I994-R998 HydrophobicContact CG2-CG 4.35Å; I994-R998 WeakPolarHBondContact O-CG 3.18Å; I994-R998 PolarHBondContact O-N 2.99Å; I994-I1034 HydrophobicContact CD1-CG1 4.38Å; I994-V1035 HydrophobicContact CG1-CB 4.5Å; I994-V1035 HydrophobicContact CG1-CG1 4.37Å; I994-V1035 HydrophobicContact CG1-CG2 4.29Å; I994-V1035 HydrophobicContact CG2-CG1 4.16Å; I994-V1035 WeakPolarHBondContact CG2-O 3.5Å
995	R	89.9	Confident	92.2	Very high	102 Å²	102	30.3 Å²	30.3	39%	0.385	14%	0.135	S	C	.	.	H	α-helix	trans	-62.3	-39.7	174.4	-160	-167.3	-44.6	127.4	17	112.1	G457 E916 G991 S992 I993 R999	G457-R995 PolarHBondContact O-NH2 3.33Å; E916-R995 IonicContact OE1-CZ 3.9Å; E916-R995 IonicContact OE1-NH1 2.77Å; E916-R995 PolarHBondContact OE1-NH1 3.45Å; E916-R995 IonicContact OE1-NH2 3.14Å; E916-R995 PolarHBondContact OE1-NH2 2.73Å; E916-R995 VanDerWaalsContact OE1-NH2 3.12Å; G991-R995 WeakPolarHBondContact O-CB 3.42Å; G991-R995 PolarHBondContact O-N 3.49Å; S992-R995 PolarHBondContact O-N 3.3Å; S992-R995 PolarHBondContact OG-NH2 2.88Å; I993-R995 VanDerWaalsContact C-N 3.33Å; I993-R995 PolarHBondContact O-N 3Å; R995-R999 PolarHBondContact O-N 3.27Å; R995-R999 VanDerWaalsContact O-N 3.1Å
996	C	93.4	Very high	92.4	Very high	5 Å²	5	28.4 Å²	28.4	3%	0.034	13%	0.125	C	C	.	.	H	α-helix	trans	-59.8	-51.4	173.1	-175.3	0	0	0	0	110.8	F914 L966 S992 I993 I994 R998 R999 L1000	F914-C996 HydrophobicContact CD2-CB 4.45Å; L966-C996 HydrophobicContact CD1-CB 3.93Å; S992-C996 PolarHBondContact O-N 3.32Å; I993-C996 VanDerWaalsContact O-CB 3.31Å; I993-C996 WeakPolarHBondContact O-CB 3.42Å; I993-C996 PolarHBondContact O-N 3.08Å; I993-C996 VanDerWaalsContact O-N 3.14Å; I994-C996 VanDerWaalsContact C-N 3.32Å; I994-C996 PolarHBondContact O-N 3.2Å; C996-R998 PolarHBondContact O-N 3.12Å; C996-R999 PolarHBondContact O-N 3.37Å; C996-L1000 VanDerWaalsContact O-CB 3.3Å; C996-L1000 WeakPolarHBondContact O-CB 3.47Å; C996-L1000 PolarHBondContact O-N 3.06Å
997	M	94	Very high	92.7	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-60	-39.8	179.1	-66	-71.1	-169.8	0	0	113.5	V970 W973 I982 I993 I994 L1000 E1001 V1035 F1036	V970-M997 HydrophobicContact CB-CE 4.48Å; V970-M997 HydrophobicContact CG2-CE 3.86Å; V970-M997 HydrophobicContact CG2-SD 4.02Å; W973-M997 HydrophobicContact CB-CE 3.54Å; W973-M997 VanDerWaalsContact CD1-CE 3.47Å; W973-M997 HydrophobicContact CD2-CE 4.31Å; W973-M997 HydrophobicContact CG-CE 3.48Å; W973-M997 VanDerWaalsContact CG-CE 3.48Å; W973-M997 HydrophobicContact CG-SD 4.33Å; I982-M997 HydrophobicContact CD1-CE 4.15Å; I993-M997 HydrophobicContact CG2-CE 4.41Å; I993-M997 WeakPolarHBondContact O-CG 3.46Å; I993-M997 PolarHBondContact O-N 2.96Å; I994-M997 PolarHBondContact O-N 3.27Å; M997-L1000 WeakPolarHBondContact O-CB 3.47Å; M997-L1000 PolarHBondContact O-N 3.49Å; M997-E1001 PolarHBondContact O-N 3.3Å; M997-V1035 HydrophobicContact CB-CG1 3.34Å; M997-V1035 HydrophobicContact CG-CG1 3.81Å; M997-F1036 HydrophobicContact CB-CE2 4.5Å
998	R	91.2	Very high	93.1	Very high	48 Å²	48	24.9 Å²	24.9	18%	0.181	11%	0.106	C	C	.	.	H	α-helix	trans	-67.6	-43.6	177	-70.8	-173.2	-176.4	-152.7	-0.9	112	D215 I994 C996 L1000 E1001 E1002 V1035 F1036 A1037	D215-R998 IonicContact OD2-NH1 2.7Å; I994-R998 HydrophobicContact CG2-CG 4.35Å; I994-R998 WeakPolarHBondContact O-CG 3.18Å; I994-R998 PolarHBondContact O-N 2.99Å; C996-R998 PolarHBondContact O-N 3.12Å; R998-L1000 VanDerWaalsContact C-N 3.25Å; R998-L1000 PolarHBondContact O-N 3.16Å; R998-E1001 PolarHBondContact O-N 3.2Å; R998-E1002 PolarHBondContact O-N 3.35Å; R998-V1035 PolarHBondContact NE-O 2.98Å; R998-V1035 PolarHBondContact NH2-O 3.29Å; R998-F1036 HydrophobicContact CG-CD1 4.37Å; R998-F1036 HydrophobicContact CG-CE1 3.98Å; R998-F1036 HydrophobicContact CG-CZ 4.38Å; R998-A1037 PolarHBondContact NH2-O 3.23Å
999	R	91.8	Very high	93.3	Very high	61 Å²	61	28.3 Å²	28.3	23%	0.23	12%	0.122	C	C	.	.	H	α-helix	trans	-63.6	-31.4	171.7	-73.4	-178.8	69.8	163.9	-0.3	112.6	V913 Q915 R995 C996 L1003	V913-R999 HydrophobicContact CB-CB 3.85Å; V913-R999 HydrophobicContact CG1-CB 4.12Å; V913-R999 HydrophobicContact CG2-CB 4.38Å; Q915-R999 VanDerWaalsContact CD-NH1 3.33Å; R995-R999 PolarHBondContact O-N 3.27Å; R995-R999 VanDerWaalsContact O-N 3.1Å; C996-R999 PolarHBondContact O-N 3.37Å; R999-L1003 WeakPolarHBondContact O-CB 3.31Å; R999-L1003 PolarHBondContact O-N 2.63Å
1000	L	95.1	Very high	93.4	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-69.7	-36.3	176.7	-174.2	58.2	0	0	0	112	T906 L909 V913 V970 C996 M997 R998 L1004 I1030	T906-L1000 HydrophobicContact CG2-CD2 3.71Å; T906-L1000 HydrophobicContact CG2-CG 4.14Å; L909-L1000 HydrophobicContact CB-CD1 3.52Å; V913-L1000 HydrophobicContact CG2-CB 4.05Å; V913-L1000 HydrophobicContact CG2-CD1 4.28Å; V970-L1000 HydrophobicContact CG1-CD2 3.52Å; V970-L1000 HydrophobicContact CG2-CD2 4.19Å; C996-L1000 VanDerWaalsContact O-CB 3.3Å; C996-L1000 WeakPolarHBondContact O-CB 3.47Å; C996-L1000 PolarHBondContact O-N 3.06Å; M997-L1000 WeakPolarHBondContact O-CB 3.47Å; M997-L1000 PolarHBondContact O-N 3.49Å; R998-L1000 VanDerWaalsContact C-N 3.25Å; R998-L1000 PolarHBondContact O-N 3.16Å; L1000-L1004 HydrophobicContact CG-CD1 4.44Å; L1000-L1004 WeakPolarHBondContact O-CB 3.14Å; L1000-L1004 VanDerWaalsContact O-CG 3.31Å; L1000-L1004 WeakPolarHBondContact O-CG 3.37Å; L1000-L1004 PolarHBondContact O-N 3.08Å; L1000-I1030 HydrophobicContact CB-CD1 4.35Å; L1000-I1030 HydrophobicContact CD2-CD1 4.3Å; L1000-I1030 HydrophobicContact CG-CD1 4.11Å
1001	E	94.7	Very high	93.6	Very high	7 Å²	7	24.4 Å²	24.4	3%	0.033	10%	0.104	C	C	.	.	H	α-helix	trans	-69.4	-42.5	172.5	-162.2	-102.6	-151.3	0	0	111.5	M997 R998 L1003 L1004 R1005 I1027 I1030 K1031 F1036	M997-E1001 PolarHBondContact O-N 3.3Å; R998-E1001 PolarHBondContact O-N 3.2Å; E1001-L1003 VanDerWaalsContact C-N 3.32Å; E1001-L1003 PolarHBondContact O-N 3.48Å; E1001-L1004 PolarHBondContact O-N 3.16Å; E1001-R1005 VanDerWaalsContact CD-NE 3.3Å; E1001-R1005 WeakPolarHBondContact O-CG 3.28Å; E1001-R1005 PolarHBondContact O-N 3.36Å; E1001-R1005 IonicContact OE1-CZ 3.61Å; E1001-R1005 IonicContact OE1-NE 2.67Å; E1001-R1005 PolarHBondContact OE1-NE 3.04Å; E1001-R1005 IonicContact OE1-NH2 2.69Å; E1001-R1005 PolarHBondContact OE1-NH2 3.28Å; E1001-R1005 WeakPolarHBondContact OE2-CD 3.36Å; E1001-R1005 IonicContact OE2-CZ 3.23Å; E1001-R1005 IonicContact OE2-NE 3.78Å; E1001-R1005 PolarHBondContact OE2-NE 3.49Å; E1001-R1005 IonicContact OE2-NH2 2.78Å; E1001-I1027 HydrophobicContact CG-CG1 4.43Å; E1001-I1027 HydrophobicContact CG-CG2 3.91Å; E1001-I1030 HydrophobicContact CB-CD1 4.04Å; E1001-K1031 VanDerWaalsContact OE1-CD 3.3Å; E1001-K1031 WeakPolarHBondContact OE1-CD 3.34Å; E1001-K1031 WeakPolarHBondContact OE1-CE 3.42Å; E1001-K1031 IonicContact OE1-NZ 3.8Å; E1001-K1031 PolarHBondContact OE1-NZ 3.49Å; E1001-F1036 HydrophobicContact CB-CE1 3.73Å; E1001-F1036 HydrophobicContact CB-CZ 3.67Å; E1001-F1036 HydrophobicContact CG-CE1 3.9Å; E1001-F1036 HydrophobicContact CG-CZ 4.04Å
1002	E	91.3	Very high	93.7	Very high	41 Å²	41	29.5 Å²	29.5	19%	0.192	13%	0.125	C	C	.	.	H	α-helix	trans	-59.7	-40.3	173.1	-168.7	164.7	-153.3	0	0	111.6	K192 G214 R998 Q1006	K192-E1002 IonicContact NZ-OE1 3.38Å; K192-E1002 PolarHBondContact NZ-OE1 3.2Å; K192-E1002 IonicContact NZ-OE2 3.44Å; K192-E1002 PolarHBondContact NZ-OE2 3.41Å; G214-E1002 WeakPolarHBondContact CA-OE1 3.23Å; R998-E1002 PolarHBondContact O-N 3.35Å; E1002-Q1006 WeakPolarHBondContact O-CG 3.24Å; E1002-Q1006 PolarHBondContact O-N 3.33Å
1003	L	95.4	Very high	93.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-68.5	-44.3	172.1	179.8	57.6	0	0	0	112.5	I880 A883 L888 L909 F912 V913 R999 E1001 R1005 Q1006 M1007	I880-L1003 HydrophobicContact CG2-CD1 4.31Å; A883-L1003 HydrophobicContact CB-CD1 3.71Å; A883-L1003 HydrophobicContact CB-CD2 3.8Å; A883-L1003 HydrophobicContact CB-CG 4.4Å; L888-L1003 HydrophobicContact CD1-CD1 3.82Å; L888-L1003 HydrophobicContact CD1-CD2 4.34Å; L909-L1003 HydrophobicContact CB-CD2 4.28Å; L909-L1003 HydrophobicContact CD2-CD2 4.09Å; F912-L1003 HydrophobicContact CB-CD2 4.15Å; V913-L1003 HydrophobicContact CG1-CB 4.14Å; V913-L1003 HydrophobicContact CG1-CD2 3.71Å; R999-L1003 WeakPolarHBondContact O-CB 3.31Å; R999-L1003 PolarHBondContact O-N 2.63Å; E1001-L1003 VanDerWaalsContact C-N 3.32Å; E1001-L1003 PolarHBondContact O-N 3.48Å; L1003-R1005 VanDerWaalsContact C-N 3.27Å; L1003-R1005 PolarHBondContact O-N 2.95Å; L1003-Q1006 CarbonylContact O-C 3.57Å; L1003-Q1006 WeakPolarHBondContact O-CA 3.49Å; L1003-Q1006 WeakPolarHBondContact O-CB 3.11Å; L1003-Q1006 PolarHBondContact O-N 2.86Å; L1003-M1007 HydrophobicContact CD1-CG 4.34Å; L1003-M1007 HydrophobicContact CG-CG 4.37Å; L1003-M1007 WeakPolarHBondContact O-CG 3.47Å; L1003-M1007 PolarHBondContact O-N 3.34Å
1004	L	96.1	Very high	93.6	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-60.8	-36	177.3	-81.6	164.5	0	0	0	111.9	T906 L909 L1000 E1001 Q1006 M1007 C1008 F1023 I1027 I1030	T906-L1004 HydrophobicContact CG2-CD1 3.82Å; L909-L1004 HydrophobicContact CD1-CD2 3.56Å; L909-L1004 HydrophobicContact CD1-CG 4.21Å; L1000-L1004 HydrophobicContact CG-CD1 4.44Å; L1000-L1004 WeakPolarHBondContact O-CB 3.14Å; L1000-L1004 VanDerWaalsContact O-CG 3.31Å; L1000-L1004 WeakPolarHBondContact O-CG 3.37Å; L1000-L1004 PolarHBondContact O-N 3.08Å; E1001-L1004 PolarHBondContact O-N 3.16Å; L1004-Q1006 VanDerWaalsContact C-N 3.32Å; L1004-Q1006 PolarHBondContact O-N 3.02Å; L1004-M1007 PolarHBondContact O-N 3.3Å; L1004-C1008 PolarHBondContact O-N 2.96Å; L1004-C1008 PolarHBondContact O-SG 2.96Å; L1004-C1008 VanDerWaalsContact O-SG 3.4Å; L1004-F1023 HydrophobicContact CD2-CB 4.03Å; L1004-F1023 HydrophobicContact CD2-CD1 3.71Å; L1004-F1023 HydrophobicContact CD2-CG 4.28Å; L1004-I1027 HydrophobicContact CB-CD1 3.99Å; L1004-I1027 HydrophobicContact CB-CG1 3.51Å; L1004-I1027 HydrophobicContact CD1-CG1 4.06Å; L1004-I1027 HydrophobicContact CG-CG1 4.36Å; L1004-I1030 HydrophobicContact CD1-CD1 3.71Å; L1004-I1030 HydrophobicContact CD1-CG1 4.46Å
1005	R	94	Very high	93.5	Very high	112 Å²	112	36.9 Å²	36.9	42%	0.423	18%	0.183	S	C	.	.	H	α-helix	trans	-60.2	-40.8	171.6	-72.8	176.4	-178.2	-70.7	-20.6	112.4	E1001 L1003 C1008 Q1009 I1027	E1001-R1005 VanDerWaalsContact CD-NE 3.3Å; E1001-R1005 WeakPolarHBondContact O-CG 3.28Å; E1001-R1005 PolarHBondContact O-N 3.36Å; E1001-R1005 IonicContact OE1-CZ 3.61Å; E1001-R1005 IonicContact OE1-NE 2.67Å; E1001-R1005 PolarHBondContact OE1-NE 3.04Å; E1001-R1005 IonicContact OE1-NH2 2.69Å; E1001-R1005 PolarHBondContact OE1-NH2 3.28Å; E1001-R1005 WeakPolarHBondContact OE2-CD 3.36Å; E1001-R1005 IonicContact OE2-CZ 3.23Å; E1001-R1005 IonicContact OE2-NE 3.78Å; E1001-R1005 PolarHBondContact OE2-NE 3.49Å; E1001-R1005 IonicContact OE2-NH2 2.78Å; L1003-R1005 VanDerWaalsContact C-N 3.27Å; L1003-R1005 PolarHBondContact O-N 2.95Å; R1005-C1008 PolarHBondContact O-N 2.92Å; R1005-Q1009 PolarHBondContact O-N 3.38Å; R1005-I1027 HydrophobicContact CG-CD1 3.92Å
1006	Q	94	Very high	93.6	Very high	24 Å²	24	34 Å²	34	11%	0.112	18%	0.175	C	C	.	.	H	α-helix	trans	-66.6	-42.4	174.5	-67.6	170.1	12.7	0	0	111	E879 S881 S882 E1002 L1003 L1004 C1008 Q1009 A1010	E879-Q1006 VanDerWaalsContact O-CB 3.3Å; E879-Q1006 WeakPolarHBondContact O-CB 3.35Å; E879-Q1006 VanDerWaalsContact O-CG 3.29Å; E879-Q1006 WeakPolarHBondContact O-CG 3.36Å; S881-Q1006 PolarHBondContact OG-NE2 2.8Å; S882-Q1006 PolarHBondContact OG-NE2 3.43Å; E1002-Q1006 WeakPolarHBondContact O-CG 3.24Å; E1002-Q1006 PolarHBondContact O-N 3.33Å; L1003-Q1006 CarbonylContact O-C 3.57Å; L1003-Q1006 WeakPolarHBondContact O-CA 3.49Å; L1003-Q1006 WeakPolarHBondContact O-CB 3.11Å; L1003-Q1006 PolarHBondContact O-N 2.86Å; L1004-Q1006 VanDerWaalsContact C-N 3.32Å; L1004-Q1006 PolarHBondContact O-N 3.02Å; Q1006-C1008 VanDerWaalsContact C-N 3.34Å; Q1006-C1008 PolarHBondContact O-N 2.88Å; Q1006-Q1009 PolarHBondContact O-N 2.82Å; Q1006-Q1009 VanDerWaalsContact O-N 3.17Å; Q1006-A1010 VanDerWaalsContact O-CB 3.29Å; Q1006-A1010 WeakPolarHBondContact O-CB 3.24Å; Q1006-A1010 PolarHBondContact O-N 2.98Å
1007	M	96.3	Very high	93.7	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-63.8	-34.6	175.5	-63.5	-62.8	-69.8	0	0	112.9	I880 L888 M892 F897 L909 L1003 L1004 A1011 F1023	I880-M1007 HydrophobicContact CD1-SD 3.86Å; I880-M1007 HydrophobicContact CG1-SD 4.42Å; L888-M1007 HydrophobicContact CB-CE 4.49Å; L888-M1007 HydrophobicContact CB-SD 4.16Å; L888-M1007 HydrophobicContact CD1-SD 4.19Å; L888-M1007 HydrophobicContact CD2-CE 4.42Å; L888-M1007 HydrophobicContact CD2-SD 4.36Å; L888-M1007 HydrophobicContact CG-SD 4.49Å; M892-M1007 HydrophobicContact CG-CE 3.75Å; M892-M1007 HydrophobicContact SD-CE 3.49Å; M892-M1007 WeakPolarHBondContact SD-CE 3.34Å; M892-M1007 HydrophobicContact SD-SD 4.26Å; F897-M1007 HydrophobicContact CD2-CE 4.4Å; F897-M1007 HydrophobicContact CE2-CE 3.79Å; F897-M1007 HydrophobicContact CZ-CE 4.02Å; L909-M1007 HydrophobicContact CD1-CG 4.28Å; L909-M1007 HydrophobicContact CD2-CE 4.33Å; L909-M1007 HydrophobicContact CD2-CG 4.31Å; L909-M1007 HydrophobicContact CD2-SD 4.48Å; L1003-M1007 HydrophobicContact CD1-CG 4.34Å; L1003-M1007 HydrophobicContact CG-CG 4.37Å; L1003-M1007 WeakPolarHBondContact O-CG 3.47Å; L1003-M1007 PolarHBondContact O-N 3.34Å; L1004-M1007 PolarHBondContact O-N 3.3Å; M1007-A1011 WeakPolarHBondContact O-CB 3.39Å; M1007-A1011 PolarHBondContact O-N 2.94Å; M1007-F1023 HydrophobicContact CB-CB 4.42Å; M1007-F1023 HydrophobicContact CB-CD1 4.1Å; M1007-F1023 HydrophobicContact CB-CD2 3.7Å; M1007-F1023 HydrophobicContact CB-CE1 4.27Å; M1007-F1023 HydrophobicContact CB-CE2 3.89Å; M1007-F1023 HydrophobicContact CB-CG 3.82Å; M1007-F1023 HydrophobicContact CB-CZ 4.18Å; M1007-F1023 HydrophobicContact CE-CE1 4.17Å; M1007-F1023 HydrophobicContact CE-CE2 3.97Å; M1007-F1023 HydrophobicContact CE-CZ 3.55Å
1008	C	95.9	Very high	93.7	Very high	16 Å²	16	45.3 Å²	45.3	11%	0.108	23%	0.234	C	C	.	.	H	α-helix	trans	-61.9	-47.9	169.7	-72.2	0	0	0	0	111.8	L1004 R1005 Q1006 A1011 K1012 F1023 A1024	L1004-C1008 PolarHBondContact O-N 2.96Å; L1004-C1008 PolarHBondContact O-SG 2.96Å; L1004-C1008 VanDerWaalsContact O-SG 3.4Å; R1005-C1008 PolarHBondContact O-N 2.92Å; Q1006-C1008 VanDerWaalsContact C-N 3.34Å; Q1006-C1008 PolarHBondContact O-N 2.88Å; C1008-A1011 PolarHBondContact O-N 3.08Å; C1008-K1012 WeakPolarHBondContact O-CB 3.16Å; C1008-K1012 PolarHBondContact O-N 3.47Å; C1008-F1023 VanDerWaalsContact SG-CB 3.53Å; C1008-A1024 PolarHBondContact SG-N 3.29Å; C1008-A1024 VanDerWaalsContact SG-N 3.45Å
1009	Q	93.4	Very high	93.9	Very high	86 Å²	86	43.1 Å²	43.1	40%	0.402	23%	0.226	S	C	.	.	H	α-helix	trans	-66.8	-37	178.4	-67.5	-75.8	44.2	0	0	112.1	E879 R1005 Q1006 K1012 A1013	E879-Q1009 HydrophobicContact CB-CB 4.36Å; R1005-Q1009 PolarHBondContact O-N 3.38Å; Q1006-Q1009 PolarHBondContact O-N 2.82Å; Q1006-Q1009 VanDerWaalsContact O-N 3.17Å; Q1009-K1012 WeakPolarHBondContact O-CB 3.37Å; Q1009-K1012 PolarHBondContact O-N 3.41Å; Q1009-A1013 WeakPolarHBondContact O-CB 3.26Å; Q1009-A1013 PolarHBondContact O-N 3.13Å
1010	A	94.4	Very high	94.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.2	-44	171.7	0	0	0	0	0	112	V876 I880 M892 Q1006 A1013 I1014	V876-A1010 HydrophobicContact CG1-CB 3.76Å; I880-A1010 HydrophobicContact CD1-CB 4.2Å; I880-A1010 HydrophobicContact CG1-CB 4.18Å; M892-A1010 HydrophobicContact CE-CB 4.07Å; M892-A1010 HydrophobicContact SD-CB 4.05Å; Q1006-A1010 VanDerWaalsContact O-CB 3.29Å; Q1006-A1010 WeakPolarHBondContact O-CB 3.24Å; Q1006-A1010 PolarHBondContact O-N 2.98Å; A1010-A1013 PolarHBondContact O-N 3.4Å; A1010-I1014 PolarHBondContact O-N 2.81Å
1011	A	94.8	Very high	94.2	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-67.1	-39.1	175.3	0	0	0	0	0	112.2	M892 M1007 C1008 A1013 I1014 G1015 N1016 L1019 E1020 F1023	M892-A1011 HydrophobicContact CE-CB 4.12Å; M1007-A1011 WeakPolarHBondContact O-CB 3.39Å; M1007-A1011 PolarHBondContact O-N 2.94Å; C1008-A1011 PolarHBondContact O-N 3.08Å; A1011-A1013 VanDerWaalsContact C-N 3.34Å; A1011-A1013 PolarHBondContact O-N 2.95Å; A1011-I1014 WeakPolarHBondContact O-CG1 3.18Å; A1011-I1014 PolarHBondContact O-N 3.27Å; A1011-G1015 PolarHBondContact O-N 3.08Å; A1011-N1016 PolarHBondContact O-N 3.22Å; A1011-L1019 HydrophobicContact CB-CB 3.75Å; A1011-E1020 HydrophobicContact CB-CB 4.1Å; A1011-F1023 HydrophobicContact CB-CD2 4.38Å
1012	K	93.6	Very high	94.3	Very high	112 Å²	112	48.6 Å²	48.6	49%	0.487	26%	0.256	S	S	.	.	H	α-helix	trans	-62.6	-39.1	173.9	-162.1	-170.9	-155.2	84.5	0	112.2	C1008 Q1009 I1014 G1015 E1020	C1008-K1012 WeakPolarHBondContact O-CB 3.16Å; C1008-K1012 PolarHBondContact O-N 3.47Å; Q1009-K1012 WeakPolarHBondContact O-CB 3.37Å; Q1009-K1012 PolarHBondContact O-N 3.41Å; K1012-I1014 VanDerWaalsContact C-N 3.25Å; K1012-I1014 PolarHBondContact O-N 3.45Å; K1012-G1015 PolarHBondContact O-N 2.76Å; K1012-E1020 IonicContact NZ-OE1 3.69Å; K1012-E1020 PolarHBondContact NZ-OE1 2.85Å; K1012-E1020 IonicContact NZ-OE2 3.35Å
1013	A	90.2	Very high	94.6	Very high	44 Å²	44	46.7 Å²	46.7	36%	0.364	25%	0.247	S	C	.	.	H	α-helix	trans	-65.8	-22.9	178.6	0	0	0	0	0	113.9	M872 V876 Q1009 A1010 A1011	M872-A1013 WeakPolarHBondContact CE-O 3.45Å; V876-A1013 HydrophobicContact CG2-CB 4.34Å; Q1009-A1013 WeakPolarHBondContact O-CB 3.26Å; Q1009-A1013 PolarHBondContact O-N 3.13Å; A1010-A1013 PolarHBondContact O-N 3.4Å; A1011-A1013 VanDerWaalsContact C-N 3.34Å; A1011-A1013 PolarHBondContact O-N 2.95Å
1014	I	91.9	Very high	94.7	Very high	57 Å²	57	48.5 Å²	48.5	29%	0.292	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-0.6	169.3	61	173.9	0	0	0	113.7	V876 M892 F893 A1010 A1011 K1012 N1016	V876-I1014 HydrophobicContact CG2-CG2 3.35Å; M892-I1014 HydrophobicContact CE-CD1 4.19Å; F893-I1014 HydrophobicContact CE2-CG2 4.14Å; F893-I1014 HydrophobicContact CZ-CG2 3.83Å; A1010-I1014 PolarHBondContact O-N 2.81Å; A1011-I1014 WeakPolarHBondContact O-CG1 3.18Å; A1011-I1014 PolarHBondContact O-N 3.27Å; K1012-I1014 VanDerWaalsContact C-N 3.25Å; K1012-I1014 PolarHBondContact O-N 3.45Å; I1014-N1016 VanDerWaalsContact C-N 3.29Å; I1014-N1016 HydrophobicContact CD1-CB 3.73Å; I1014-N1016 HydrophobicContact CG1-CB 3.73Å; I1014-N1016 PolarHBondContact O-N 2.98Å
1015	G	91	Very high	94.7	Very high	58 Å²	58	52.8 Å²	52.8	60%	0.598	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.3	22.2	-175.7	0	0	0	0	0	114.5	A1011 K1012 T1017	A1011-G1015 PolarHBondContact O-N 3.08Å; K1012-G1015 PolarHBondContact O-N 2.76Å; G1015-T1017 PolarHBondContact O-N 3.38Å
1016	N	93.4	Very high	94.8	Very high	42 Å²	42	47.5 Å²	47.5	23%	0.225	26%	0.263	C	S	.	.			trans	-92.4	88.1	179.3	-172.4	-27	0	0	0	110.7	A1011 I1014 E1018 L1019 E1020	A1011-N1016 PolarHBondContact O-N 3.22Å; I1014-N1016 VanDerWaalsContact C-N 3.29Å; I1014-N1016 HydrophobicContact CD1-CB 3.73Å; I1014-N1016 HydrophobicContact CG1-CB 3.73Å; I1014-N1016 PolarHBondContact O-N 2.98Å; N1016-E1018 PolarHBondContact O-N 2.93Å; N1016-E1018 PolarHBondContact OD1-N 2.8Å; N1016-E1018 VanDerWaalsContact OD1-N 3.14Å; N1016-L1019 HydrophobicContact CB-CB 4.39Å; N1016-L1019 WeakPolarHBondContact ND2-CD1 3.45Å; N1016-L1019 PolarHBondContact O-N 3.25Å; N1016-L1019 PolarHBondContact OD1-N 2.9Å; N1016-E1020 PolarHBondContact O-N 3.07Å
1017	T	94.6	Very high	94.9	Very high	85 Å²	85	47.3 Å²	47.3	52%	0.521	26%	0.262	S	S	.	.	H	α-helix	trans	-62.6	-27.1	179.4	-34.7	0	0	0	0	113.2	G1015 N1021	G1015-T1017 PolarHBondContact O-N 3.38Å; T1017-N1021 VanDerWaalsContact O-CB 3.25Å; T1017-N1021 WeakPolarHBondContact O-CB 3.23Å; T1017-N1021 PolarHBondContact O-N 3.14Å; T1017-N1021 PolarHBondContact O-ND2 3.15Å
1018	E	95.4	Very high	94.8	Very high	158 Å²	158	52.1 Å²	52.1	74%	0.738	29%	0.292	S	S	*	.	H	α-helix	trans	-69.7	-42.4	178.2	-62.5	-176	171.4	0	0	111.1	N1016 K1022	N1016-E1018 PolarHBondContact O-N 2.93Å; N1016-E1018 PolarHBondContact OD1-N 2.8Å; N1016-E1018 VanDerWaalsContact OD1-N 3.14Å; E1018-K1022 VanDerWaalsContact O-CB 3.28Å; E1018-K1022 WeakPolarHBondContact O-CB 3.29Å; E1018-K1022 PolarHBondContact O-N 2.73Å
1019	L	95.3	Very high	94.8	Very high	3 Å²	3	53.6 Å²	53.6	2%	0.016	30%	0.296	C	S	.	.	H	α-helix	trans	-70.9	-39.5	172.4	-70.1	-178.9	0	0	0	112.2	M892 F897 A1011 N1016 N1021 K1022 F1023	M892-L1019 HydrophobicContact CE-CD1 4.33Å; F897-L1019 HydrophobicContact CB-CD2 3.76Å; A1011-L1019 HydrophobicContact CB-CB 3.75Å; N1016-L1019 HydrophobicContact CB-CB 4.39Å; N1016-L1019 WeakPolarHBondContact ND2-CD1 3.45Å; N1016-L1019 PolarHBondContact O-N 3.25Å; N1016-L1019 PolarHBondContact OD1-N 2.9Å; L1019-N1021 VanDerWaalsContact C-N 3.33Å; L1019-N1021 PolarHBondContact O-N 2.87Å; L1019-K1022 PolarHBondContact O-N 3.16Å; L1019-F1023 HydrophobicContact CB-CD2 4.36Å; L1019-F1023 HydrophobicContact CB-CE2 4.07Å; L1019-F1023 HydrophobicContact CD2-CE2 4.46Å; L1019-F1023 WeakPolarHBondContact O-CD2 3.49Å; L1019-F1023 WeakPolarHBondContact O-CG 3.45Å; L1019-F1023 PolarHBondContact O-N 2.7Å
1020	E	96.2	Very high	94.8	Very high	44 Å²	44	49.5 Å²	49.5	21%	0.206	28%	0.277	C	S	.	.	H	α-helix	trans	-57.4	-47.6	175.2	-173.4	175.8	-173.3	0	0	110.6	A1011 K1012 N1016 A1024	A1011-E1020 HydrophobicContact CB-CB 4.1Å; K1012-E1020 IonicContact NZ-OE1 3.69Å; K1012-E1020 PolarHBondContact NZ-OE1 2.85Å; K1012-E1020 IonicContact NZ-OE2 3.35Å; N1016-E1020 PolarHBondContact O-N 3.07Å; E1020-A1024 VanDerWaalsContact O-CB 3.31Å; E1020-A1024 WeakPolarHBondContact O-CB 3.5Å; E1020-A1024 PolarHBondContact O-N 2.94Å
1021	N	96.6	Very high	94.8	Very high	101 Å²	101	53.7 Å²	53.7	54%	0.54	30%	0.296	S	S	.	.	H	α-helix	trans	-64.6	-43.3	175.5	-73.6	-24.1	0	0	0	112.6	T1017 L1019 A1024 E1025	T1017-N1021 VanDerWaalsContact O-CB 3.25Å; T1017-N1021 WeakPolarHBondContact O-CB 3.23Å; T1017-N1021 PolarHBondContact O-N 3.14Å; T1017-N1021 PolarHBondContact O-ND2 3.15Å; L1019-N1021 VanDerWaalsContact C-N 3.33Å; L1019-N1021 PolarHBondContact O-N 2.87Å; N1021-A1024 PolarHBondContact O-N 3.14Å; N1021-E1025 WeakPolarHBondContact O-CB 3.39Å; N1021-E1025 PolarHBondContact O-N 3.02Å
1022	K	97	Very high	94.6	Very high	37 Å²	37	56.4 Å²	56.4	16%	0.161	31%	0.306	C	S	.	.	H	α-helix	trans	-63.9	-41.9	-179.3	-173.5	-179.9	-59.9	-167.1	0	112.3	F897 N898 L900 A902 E1018 L1019 G1026	F897-K1022 PolarHBondContact O-NZ 2.88Å; N898-K1022 PolarHBondContact O-NZ 3.36Å; L900-K1022 WeakPolarHBondContact O-CD 3.44Å; L900-K1022 WeakPolarHBondContact O-CE 3.43Å; L900-K1022 PolarHBondContact O-NZ 3.13Å; A902-K1022 HydrophobicContact CB-CG 4.25Å; E1018-K1022 VanDerWaalsContact O-CB 3.28Å; E1018-K1022 WeakPolarHBondContact O-CB 3.29Å; E1018-K1022 PolarHBondContact O-N 2.73Å; L1019-K1022 PolarHBondContact O-N 3.16Å; K1022-G1026 PolarHBondContact O-N 3.38Å
1023	F	97.3	Very high	94.3	Very high	1 Å²	1	54.8 Å²	54.8	0%	0.004	30%	0.302	C	S	.	.	H	α-helix	trans	-70.4	-35.6	174.8	-64.7	-51.3	0	0	0	111.6	M892 F897 A905 L909 L1004 M1007 C1008 A1011 L1019 G1026 I1027	M892-F1023 HydrophobicContact CE-CE2 4.45Å; F897-F1023 HydrophobicContact CB-CZ 4.12Å; F897-F1023 AromaticContact CD1-CE1 3.92Å; F897-F1023 HydrophobicContact CD1-CE1 3.92Å; F897-F1023 AromaticContact CD1-CZ 3.98Å; F897-F1023 HydrophobicContact CD1-CZ 3.98Å; F897-F1023 HydrophobicContact CD2-CZ 4.08Å; F897-F1023 HydrophobicContact CE1-CE1 4.2Å; F897-F1023 HydrophobicContact CE1-CZ 4.39Å; F897-F1023 HydrophobicContact CE2-CZ 4.48Å; F897-F1023 HydrophobicContact CG-CE1 4.23Å; F897-F1023 AromaticContact CG-CZ 3.81Å; F897-F1023 HydrophobicContact CG-CZ 3.81Å; A905-F1023 HydrophobicContact CB-CE1 4.46Å; L909-F1023 HydrophobicContact CD1-CD1 4.16Å; L909-F1023 HydrophobicContact CD1-CE1 3.97Å; L1004-F1023 HydrophobicContact CD2-CB 4.03Å; L1004-F1023 HydrophobicContact CD2-CD1 3.71Å; L1004-F1023 HydrophobicContact CD2-CG 4.28Å; M1007-F1023 HydrophobicContact CB-CB 4.42Å; M1007-F1023 HydrophobicContact CB-CD1 4.1Å; M1007-F1023 HydrophobicContact CB-CD2 3.7Å; M1007-F1023 HydrophobicContact CB-CE1 4.27Å; M1007-F1023 HydrophobicContact CB-CE2 3.89Å; M1007-F1023 HydrophobicContact CB-CG 3.82Å; M1007-F1023 HydrophobicContact CB-CZ 4.18Å; M1007-F1023 HydrophobicContact CE-CE1 4.17Å; M1007-F1023 HydrophobicContact CE-CE2 3.97Å; M1007-F1023 HydrophobicContact CE-CZ 3.55Å; C1008-F1023 VanDerWaalsContact SG-CB 3.53Å; A1011-F1023 HydrophobicContact CB-CD2 4.38Å; L1019-F1023 HydrophobicContact CB-CD2 4.36Å; L1019-F1023 HydrophobicContact CB-CE2 4.07Å; L1019-F1023 HydrophobicContact CD2-CE2 4.46Å; L1019-F1023 WeakPolarHBondContact O-CD2 3.49Å; L1019-F1023 WeakPolarHBondContact O-CG 3.45Å; L1019-F1023 PolarHBondContact O-N 2.7Å; F1023-G1026 WeakPolarHBondContact O-CA 3.46Å; F1023-G1026 PolarHBondContact O-N 2.87Å; F1023-I1027 WeakPolarHBondContact O-CG1 3.39Å; F1023-I1027 PolarHBondContact O-N 2.89Å
1024	A	96.6	Very high	94.1	Very high	39 Å²	39	52.8 Å²	52.8	32%	0.322	29%	0.286	S	S	.	.	H	α-helix	trans	-66	-37.5	173.9	0	0	0	0	0	112.8	C1008 E1020 N1021 G1026 I1027 T1028	C1008-A1024 PolarHBondContact SG-N 3.29Å; C1008-A1024 VanDerWaalsContact SG-N 3.45Å; E1020-A1024 VanDerWaalsContact O-CB 3.31Å; E1020-A1024 WeakPolarHBondContact O-CB 3.5Å; E1020-A1024 PolarHBondContact O-N 2.94Å; N1021-A1024 PolarHBondContact O-N 3.14Å; A1024-G1026 VanDerWaalsContact C-N 3.34Å; A1024-I1027 WeakPolarHBondContact O-CB 3.44Å; A1024-I1027 PolarHBondContact O-N 3.08Å; A1024-T1028 PolarHBondContact O-N 3.29Å
1025	E	96.4	Very high	93.9	Very high	90 Å²	90	50.1 Å²	50.1	42%	0.421	27%	0.272	S	S	.	.	H	α-helix	trans	-65.2	-38.2	170.6	-169.6	-171.7	174	0	0	111.4	A902 N1021 I1027 T1028 K1029	A902-E1025 HydrophobicContact CB-CB 4.13Å; A902-E1025 HydrophobicContact CB-CG 4.09Å; N1021-E1025 WeakPolarHBondContact O-CB 3.39Å; N1021-E1025 PolarHBondContact O-N 3.02Å; E1025-I1027 VanDerWaalsContact C-N 3.33Å; E1025-I1027 PolarHBondContact O-N 2.96Å; E1025-T1028 PolarHBondContact O-N 3.02Å; E1025-T1028 PolarHBondContact O-OG1 3.48Å; E1025-K1029 HydrophobicContact CG-CD 4.36Å; E1025-K1029 WeakPolarHBondContact O-CG 3.45Å; E1025-K1029 PolarHBondContact O-N 2.86Å; E1025-K1029 WeakPolarHBondContact OE1-CE 3.14Å; E1025-K1029 IonicContact OE1-NZ 3.47Å; E1025-K1029 PolarHBondContact OE1-NZ 2.99Å
1026	G	96.4	Very high	93.6	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-56	-45.8	170.1	0	0	0	0	0	112.3	T906 K1022 F1023 A1024 K1029 I1030	T906-G1026 WeakPolarHBondContact OG1-CA 3.48Å; K1022-G1026 PolarHBondContact O-N 3.38Å; F1023-G1026 WeakPolarHBondContact O-CA 3.46Å; F1023-G1026 PolarHBondContact O-N 2.87Å; A1024-G1026 VanDerWaalsContact C-N 3.34Å; G1026-K1029 PolarHBondContact O-N 3.29Å; G1026-I1030 PolarHBondContact O-N 3.1Å
1027	I	95.4	Very high	93.2	Very high	21 Å²	21	48.2 Å²	48.2	11%	0.108	25%	0.248	C	C	.	.	H	α-helix	trans	-58.1	-50.5	174.2	-65.4	171	0	0	0	110.7	E1001 L1004 R1005 F1023 A1024 E1025 K1029 I1030 K1031	E1001-I1027 HydrophobicContact CG-CG1 4.43Å; E1001-I1027 HydrophobicContact CG-CG2 3.91Å; L1004-I1027 HydrophobicContact CB-CD1 3.99Å; L1004-I1027 HydrophobicContact CB-CG1 3.51Å; L1004-I1027 HydrophobicContact CD1-CG1 4.06Å; L1004-I1027 HydrophobicContact CG-CG1 4.36Å; R1005-I1027 HydrophobicContact CG-CD1 3.92Å; F1023-I1027 WeakPolarHBondContact O-CG1 3.39Å; F1023-I1027 PolarHBondContact O-N 2.89Å; A1024-I1027 WeakPolarHBondContact O-CB 3.44Å; A1024-I1027 PolarHBondContact O-N 3.08Å; E1025-I1027 VanDerWaalsContact C-N 3.33Å; E1025-I1027 PolarHBondContact O-N 2.96Å; I1027-K1029 VanDerWaalsContact C-N 3.3Å; I1027-K1029 PolarHBondContact O-N 2.93Å; I1027-I1030 PolarHBondContact O-N 3.2Å; I1027-K1031 HydrophobicContact CG2-CB 4.34Å; I1027-K1031 HydrophobicContact CG2-CD 4.45Å; I1027-K1031 WeakPolarHBondContact O-CB 3.47Å; I1027-K1031 PolarHBondContact O-N 3.11Å
1028	T	95.4	Very high	92.4	Very high	100 Å²	100	47.8 Å²	47.8	61%	0.613	25%	0.254	S	S	*	.	H	α-helix	trans	-66.3	-31.2	-176.9	58.1	0	0	0	0	113.1	A1024 E1025	A1024-T1028 PolarHBondContact O-N 3.29Å; E1025-T1028 PolarHBondContact O-N 3.02Å; E1025-T1028 PolarHBondContact O-OG1 3.48Å
1029	K	95.1	Very high	91.6	Very high	47 Å²	47	40.8 Å²	40.8	20%	0.204	22%	0.222	C	C	.	.	H	α-helix	trans	-70.8	-34.1	176.1	-75.1	179.3	-176.9	172.4	0	113.7	A902 E903 A974 E1025 G1026 I1027 R1032	A902-K1029 HydrophobicContact CB-CD 4.5Å; E903-K1029 VanDerWaalsContact CD-NZ 3.28Å; E903-K1029 HydrophobicContact CG-CD 3.98Å; E903-K1029 WeakPolarHBondContact OE1-CE 3.12Å; E903-K1029 IonicContact OE1-NZ 3.92Å; E903-K1029 PolarHBondContact OE1-NZ 3.01Å; E903-K1029 IonicContact OE2-NZ 2.67Å; A974-K1029 HydrophobicContact CB-CB 4.29Å; E1025-K1029 HydrophobicContact CG-CD 4.36Å; E1025-K1029 WeakPolarHBondContact O-CG 3.45Å; E1025-K1029 PolarHBondContact O-N 2.86Å; E1025-K1029 WeakPolarHBondContact OE1-CE 3.14Å; E1025-K1029 IonicContact OE1-NZ 3.47Å; E1025-K1029 PolarHBondContact OE1-NZ 2.99Å; G1026-K1029 PolarHBondContact O-N 3.29Å; I1027-K1029 VanDerWaalsContact C-N 3.3Å; I1027-K1029 PolarHBondContact O-N 2.93Å; K1029-R1032 PolarHBondContact O-NE 2.9Å
1030	I	94.9	Very high	90.8	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-89.6	-27.2	176.3	70.9	173.8	0	0	0	113.7	T906 W973 A974 L1000 E1001 L1004 G1026 I1027 R1032 F1036	T906-I1030 HydrophobicContact CG2-CD1 4.32Å; T906-I1030 HydrophobicContact CG2-CG2 3.63Å; W973-I1030 PolarHBondContact NE1-O 3.02Å; A974-I1030 HydrophobicContact CB-CG2 4.29Å; L1000-I1030 HydrophobicContact CB-CD1 4.35Å; L1000-I1030 HydrophobicContact CD2-CD1 4.3Å; L1000-I1030 HydrophobicContact CG-CD1 4.11Å; E1001-I1030 HydrophobicContact CB-CD1 4.04Å; L1004-I1030 HydrophobicContact CD1-CD1 3.71Å; L1004-I1030 HydrophobicContact CD1-CG1 4.46Å; G1026-I1030 PolarHBondContact O-N 3.1Å; I1027-I1030 PolarHBondContact O-N 3.2Å; I1030-R1032 PolarHBondContact O-N 3.13Å; I1030-F1036 HydrophobicContact CG1-CE2 4.5Å; I1030-F1036 VanDerWaalsContact O-CE2 3.25Å; I1030-F1036 WeakPolarHBondContact O-CE2 3.28Å
1031	K	92.8	Very high	89.7	Confident	89 Å²	89	41.9 Å²	41.9	39%	0.387	23%	0.227	S	C	.	.	S	Bend	trans	-83.8	75.1	-173	-166.7	173.2	-164.8	148.9	0	112.8	E1001 I1027 F1036	E1001-K1031 VanDerWaalsContact OE1-CD 3.3Å; E1001-K1031 WeakPolarHBondContact OE1-CD 3.34Å; E1001-K1031 WeakPolarHBondContact OE1-CE 3.42Å; E1001-K1031 IonicContact OE1-NZ 3.8Å; E1001-K1031 PolarHBondContact OE1-NZ 3.49Å; I1027-K1031 HydrophobicContact CG2-CB 4.34Å; I1027-K1031 HydrophobicContact CG2-CD 4.45Å; I1027-K1031 WeakPolarHBondContact O-CB 3.47Å; I1027-K1031 PolarHBondContact O-N 3.11Å; K1031-F1036 HydrophobicContact CB-CD2 4.29Å; K1031-F1036 HydrophobicContact CB-CE2 4.42Å; K1031-F1036 HydrophobicContact CB-CG 4.47Å; K1031-F1036 HydrophobicContact CD-CD1 4.46Å; K1031-F1036 HydrophobicContact CG-CB 4.07Å; K1031-F1036 HydrophobicContact CG-CD1 3.96Å; K1031-F1036 HydrophobicContact CG-CD2 4.05Å; K1031-F1036 HydrophobicContact CG-CE1 4.44Å; K1031-F1036 HydrophobicContact CG-CG 3.75Å
1032	R	90.7	Very high	88.6	Confident	56 Å²	56	41.8 Å²	41.8	21%	0.211	23%	0.226	C	C	.	.			trans	-148.5	165.2	177.5	58.9	-178.5	178.2	90.8	0.6	112.2	W973 G976 A977 K1029 I1030	W973-R1032 VanDerWaalsContact CE3-NH2 3.27Å; W973-R1032 HydrophobicContact CH2-CG 4.25Å; W973-R1032 VanDerWaalsContact CH2-NH1 3.34Å; W973-R1032 HydrophobicContact CZ2-CG 3.63Å; W973-R1032 PolarHBondContact O-NH2 3.18Å; G976-R1032 VanDerWaalsContact C-NH2 3.31Å; A977-R1032 PolarHBondContact O-NH1 3.39Å; A977-R1032 PolarHBondContact O-NH2 3.38Å; K1029-R1032 PolarHBondContact O-NE 2.9Å; I1030-R1032 PolarHBondContact O-N 3.13Å
1033	D	87.4	Confident	88.2	Confident	78 Å²	78	42 Å²	42	42%	0.417	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	52.4	-156.7	167	-42.2	-40.1	0	0	0	114.2	W973 V1035 F1036 A1037	W973-D1033 HydrophobicContact CH2-CB 4.11Å; D1033-V1035 PolarHBondContact O-N 2.83Å; D1033-F1036 PolarHBondContact O-N 2.75Å; D1033-F1036 VanDerWaalsContact O-N 3.08Å; D1033-A1037 PolarHBondContact O-N 2.96Å
1034	I	87.3	Confident	87.7	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.015	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-49.4	-29.2	-176	-171.2	166.6	0	0	0	115.3	L431 D435 L438 L460 F979 I994 F1036 A1037	L431-I1034 HydrophobicContact CD1-CD1 4.02Å; L431-I1034 HydrophobicContact CD1-CG1 4.46Å; L431-I1034 HydrophobicContact CD2-CB 4.15Å; L431-I1034 HydrophobicContact CD2-CD1 4.34Å; L431-I1034 HydrophobicContact CD2-CG1 3.87Å; D435-I1034 HydrophobicContact CB-CB 4.12Å; D435-I1034 HydrophobicContact CB-CD1 4.3Å; D435-I1034 VanDerWaalsContact OD1-CG2 3.28Å; D435-I1034 WeakPolarHBondContact OD1-CG2 3.19Å; D435-I1034 PolarHBondContact OD2-N 2.78Å; L438-I1034 HydrophobicContact CD1-CD1 3.66Å; L460-I1034 HydrophobicContact CD1-CD1 3.9Å; L460-I1034 HydrophobicContact CD2-CD1 4.23Å; F979-I1034 HydrophobicContact CB-CG2 3.81Å; F979-I1034 HydrophobicContact CD1-CG2 3.81Å; F979-I1034 HydrophobicContact CD2-CG2 3.89Å; F979-I1034 HydrophobicContact CE1-CG2 4.38Å; F979-I1034 HydrophobicContact CE2-CG2 4.46Å; F979-I1034 HydrophobicContact CG-CG2 3.55Å; I994-I1034 HydrophobicContact CD1-CG1 4.38Å; I1034-F1036 PolarHBondContact O-N 3.29Å; I1034-A1037 PolarHBondContact O-N 2.9Å
1035	V	87.3	Confident	87.2	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-60.5	-37.3	-178.2	-174.3	0	0	0	0	111.3	W973 F979 I994 M997 R998 D1033	W973-V1035 HydrophobicContact CH2-CG2 3.79Å; W973-V1035 HydrophobicContact CZ2-CB 4.11Å; W973-V1035 HydrophobicContact CZ2-CG2 3.36Å; F979-V1035 HydrophobicContact CD2-CG2 3.73Å; F979-V1035 HydrophobicContact CE2-CG2 3.88Å; I994-V1035 HydrophobicContact CG1-CB 4.5Å; I994-V1035 HydrophobicContact CG1-CG1 4.37Å; I994-V1035 HydrophobicContact CG1-CG2 4.29Å; I994-V1035 HydrophobicContact CG2-CG1 4.16Å; I994-V1035 WeakPolarHBondContact CG2-O 3.5Å; M997-V1035 HydrophobicContact CB-CG1 3.34Å; M997-V1035 HydrophobicContact CG-CG1 3.81Å; R998-V1035 PolarHBondContact NE-O 2.98Å; R998-V1035 PolarHBondContact NH2-O 3.29Å; D1033-V1035 PolarHBondContact O-N 2.83Å
1036	F	84.9	Confident	86.7	Confident	43 Å²	43	41.8 Å²	41.8	19%	0.189	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-116.8	22.6	-178.2	-66.8	-89.6	0	0	0	113.5	M997 R998 E1001 I1030 K1031 D1033 I1034 A1038	M997-F1036 HydrophobicContact CB-CE2 4.5Å; R998-F1036 HydrophobicContact CG-CD1 4.37Å; R998-F1036 HydrophobicContact CG-CE1 3.98Å; R998-F1036 HydrophobicContact CG-CZ 4.38Å; E1001-F1036 HydrophobicContact CB-CE1 3.73Å; E1001-F1036 HydrophobicContact CB-CZ 3.67Å; E1001-F1036 HydrophobicContact CG-CE1 3.9Å; E1001-F1036 HydrophobicContact CG-CZ 4.04Å; I1030-F1036 HydrophobicContact CG1-CE2 4.5Å; I1030-F1036 VanDerWaalsContact O-CE2 3.25Å; I1030-F1036 WeakPolarHBondContact O-CE2 3.28Å; K1031-F1036 HydrophobicContact CB-CD2 4.29Å; K1031-F1036 HydrophobicContact CB-CE2 4.42Å; K1031-F1036 HydrophobicContact CB-CG 4.47Å; K1031-F1036 HydrophobicContact CD-CD1 4.46Å; K1031-F1036 HydrophobicContact CG-CB 4.07Å; K1031-F1036 HydrophobicContact CG-CD1 3.96Å; K1031-F1036 HydrophobicContact CG-CD2 4.05Å; K1031-F1036 HydrophobicContact CG-CE1 4.44Å; K1031-F1036 HydrophobicContact CG-CG 3.75Å; D1033-F1036 PolarHBondContact O-N 2.75Å; D1033-F1036 VanDerWaalsContact O-N 3.08Å; I1034-F1036 PolarHBondContact O-N 3.29Å; F1036-A1038 PolarHBondContact O-N 3.39Å
1037	A	84.4	Confident	86.1	Confident	17 Å²	17	44.4 Å²	44.4	14%	0.14	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-51.3	137.2	164.9	0	0	0	0	0	110.8	L431 R998 D1033 I1034	L431-A1037 HydrophobicContact CD2-CB 4Å; R998-A1037 PolarHBondContact NH2-O 3.23Å; D1033-A1037 PolarHBondContact O-N 2.96Å; I1034-A1037 PolarHBondContact O-N 2.9Å
1038	A	76.9	Confident	85.5	Confident	77 Å²	77	45.9 Å²	45.9	64%	0.636	25%	0.249	S	C	*	.	P	Polyproline II helix	trans	-61.7	157.9	178.5	0	0	0	0	0	111.6	F1036	F1036-A1038 PolarHBondContact O-N 3.39Å
1039	S	78.9	Confident	84.8	Confident	11 Å²	11	42.1 Å²	42.1	8%	0.077	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-77.4	135.5	173.8	-175.5	0	0	0	0	109.3	N196 E465 Y1041 L1042	N196-S1039 WeakPolarHBondContact ND2-CB 3.47Å; N196-S1039 PolarHBondContact ND2-OG 2.93Å; N196-S1039 VanDerWaalsContact ND2-OG 3.11Å; E465-S1039 VanDerWaalsContact CD-OG 3.23Å; E465-S1039 WeakPolarHBondContact OE1-CB 3.45Å; E465-S1039 PolarHBondContact OE1-OG 3.05Å; E465-S1039 VanDerWaalsContact OE2-CA 3.23Å; E465-S1039 WeakPolarHBondContact OE2-CA 3.47Å; E465-S1039 PolarHBondContact OE2-OG 3.34Å; S1039-Y1041 PolarHBondContact O-N 3.38Å; S1039-L1042 PolarHBondContact O-N 2.98Å
1040	L	79.5	Confident	84	Confident	44 Å²	44	41.7 Å²	41.7	23%	0.23	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-3.2	179.2	-58.6	175.6	0	0	0	113.6	A427 I462 E465 T466 I469	A427-L1040 HydrophobicContact CB-CD1 3.79Å; A427-L1040 HydrophobicContact CB-CD2 4.26Å; I462-L1040 HydrophobicContact CG1-CD1 4.13Å; I462-L1040 HydrophobicContact CG1-CD2 4.4Å; I462-L1040 HydrophobicContact CG1-CG 4.32Å; E465-L1040 HydrophobicContact CB-CB 4.19Å; E465-L1040 HydrophobicContact CB-CD1 3.91Å; E465-L1040 HydrophobicContact CB-CG 4.21Å; E465-L1040 PolarHBondContact OE2-N 3.17Å; T466-L1040 WeakPolarHBondContact OG1-CD1 3.19Å; I469-L1040 HydrophobicContact CD1-CB 3.92Å; I469-L1040 HydrophobicContact CD1-CD1 4.17Å
1041	Y	72.3	Confident	83	Confident	25 Å²	25	45.2 Å²	45.2	10%	0.098	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-4.1	175.8	-71.1	-66.3	0	0	0	114.4	N196 E465 E468 S1039	N196-Y1041 HydrophobicContact CB-CG 4.42Å; E465-Y1041 HydrophobicContact CB-CE2 4.4Å; E465-Y1041 HydrophobicContact CG-CD2 4.24Å; E465-Y1041 HydrophobicContact CG-CE2 4.02Å; E468-Y1041 WeakPolarHBondContact CB-OH 3.36Å; E468-Y1041 PolarHBondContact OE2-OH 3.11Å; S1039-Y1041 PolarHBondContact O-N 3.38Å
1042	L	74.1	Confident	82.2	Confident	99 Å²	99	41.2 Å²	41.2	52%	0.518	23%	0.23	S	C	.	.			trans	-118.3	0	-169.5	-60.3	179.9	0	0	0	113.6	N196 Y199 L211 V216 I218 S1039	N196-L1042 HydrophobicContact CB-CD2 3.99Å; N196-L1042 HydrophobicContact CB-CG 4.44Å; Y199-L1042 HydrophobicContact CD1-CD2 4.11Å; Y199-L1042 HydrophobicContact CE1-CD2 4.47Å; L211-L1042 HydrophobicContact CD2-CD2 3.46Å; L211-L1042 VanDerWaalsContact CD2-CD2 3.46Å; V216-L1042 HydrophobicContact CB-CD1 4.38Å; V216-L1042 HydrophobicContact CG1-CD1 4.2Å; V216-L1042 HydrophobicContact CG2-CD1 4.02Å; I218-L1042 HydrophobicContact CD1-CD2 4.5Å; S1039-L1042 PolarHBondContact O-N 2.98Å

Retrieved 1,042 of 1,042 residues in 196.5 ms (Link to these results)

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