A0A096MFK1_POEFO Loading...

Tyrosine-protein kinase

AlphaFold DB , UniProt , Accession A0A096MFK1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,189 aa.

						>A0A096MFK1_POEFO|A0A096MFK1
MGQQVGRVGEVTSTGLQPPQPHAPQPHQGKGSRGSVTGRRPREPGCSTMIPPVRTTVANPPDPGINIFTQHSVLTEAVRWSSKENLLGATESDPNLFVALYDFVASGDNTLSITKGEKLRVLGYNQSGEWSEVRSKNGQGWVPSNYITPVNSLEKHSWYHGPVSRSAAEYLLSSLINGSFLVRESESSPGQLSISLRYEGRVYHYRINTATDGKVYVTSESRFATLAELVHHHSTVPDGLVTTLHYPAPKCNKPTVYGVSPIHDKWEMERTDITMKHKLGGGQYGEVYVGVWKKYSLTVAVKTLKEDTMEVEEFLKEAAVMKEVKHPNLVQLLGVCTLEPPFYIVTEYMPHGNLLDYLRDCEKSEVNAVVLLYMATQISSAMEYLEKKNFIHRDLAARNCLVGENHVVKVADFGLSRLMTGDTYTAHAGAKFPIKWTAPESLAYNTFSIKSDVWAFGVLLWEIATYGMSPYPGIDLSQVYDLLEKGYRMEQPEGCPPKVYELMRACWQWSPLDRPSFAEIHQAFETMFHDSSISEEVAEELCKTAHSVSHDMPLLPSKSRTLHKHTENKENIEGGLDGHSDHSTHSHSGWTSLFGGDGRSSSSPALPRKQQPRDKSPSSLLEDAQDIGTFTRDRKTGFFSSFIKKKSTSSSSSSSSPSSQVQQNLPTPPKRSSSFREMETQPHKKYEPTADFSAPPPLPQSDSLGGFSPSHSHAETTQSQSRCCGAAFGQKPSAGGLGSQLTSGSSWSGLAGFFTPRLIKKTLGLRTGKTASSDESGIVGGPKPFPRSNSTSSMSSGLPDLERMALTLPRNRSAKPPLERTASTTSQPENGAARPSENLLRRMDEGTAQIRDRPKAKLLPRGTAVGVRAPGVGGEVGESESLSRVRDGREEGGGLDRQQSWSSPSKNSSSTHNHKVPVLISPTLKHSPADVHLVGLDSQGNRFKLLSEHQGERDRPRLVKPRCAPPPPPTLRGLQQSYSCDSEDQVSGAPVEVNGDAVKGQRSGRMSGGATTGRPSVPPPQVPPASSSSSSCPASTNTTPTKMANGAATTASSSQTTPSAGSKMALRRTRQQVERVPLERVSREALLECAESLSSVLSSVLSASSDSPSSSQVLDAGHQLLDCCSGYVDCIPQTRNKFAFREAVGKLELSLQELRASSSGGGGLSSVGSNTVLDNLHNCIKEISDVVQR
					

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Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.1	Very low	32.5	Very low	255 Å²	255	150.1 Å²	150.1	100%	1.256	84%	0.843	S	S	*	*				0	140.9	0	-56.4	171.2	-176.1	0	0	107.1
2	G	33.6	Very low	32.1	Very low	73 Å²	73	146.4 Å²	146.4	75%	0.753	83%	0.827	S	S	*	*			cis	168	123.7	-7.3	0	0	0	0	0	111.6
3	Q	39.9	Very low	32	Very low	183 Å²	183	142.8 Å²	142.8	86%	0.855	82%	0.816	S	S	*	*			trans	9	152.5	143.3	-75.7	174.5	-15.8	0	0	120.2
4	Q	40	Very low	31.8	Very low	160 Å²	160	143.1 Å²	143.1	75%	0.748	82%	0.823	S	S	*	*			cis	176.2	170.9	-0.5	170.9	173.8	9.4	0	0	107.7
5	V	35.6	Very low	31.4	Very low	146 Å²	146	137.8 Å²	137.8	89%	0.885	81%	0.811	S	S	*	*			trans	163.7	137.1	139	153.6	0	0	0	0	113.3
6	G	34.2	Very low	31.1	Very low	68 Å²	68	141 Å²	141	70%	0.701	82%	0.822	S	S	*	*			trans	102.9	160.8	164.5	0	0	0	0	0	116.5
7	R	28.5	Very low	30.8	Very low	253 Å²	253	143.8 Å²	143.8	96%	0.955	83%	0.826	S	S	*	*			cis	-160.2	172.8	-21.3	-141.8	-168.8	176.2	-171.9	-2	111.8
8	V	27.6	Very low	31.3	Very low	136 Å²	136	142.2 Å²	142.2	82%	0.824	82%	0.822	S	S	*	*			trans	-84.5	156.8	173	-177	0	0	0	0	110.1
9	G	27.9	Very low	31.6	Very low	62 Å²	62	141 Å²	141	64%	0.639	82%	0.819	S	S	*	*			cis	147	164.7	-2.7	0	0	0	0	0	112.5
10	E	29.8	Very low	31.9	Very low	184 Å²	184	141.9 Å²	141.9	86%	0.86	82%	0.815	S	S	*	*			trans	64.3	150.9	179.5	-81.5	175.2	159.3	0	0	117
11	V	27.8	Very low	32.2	Very low	131 Å²	131	141 Å²	141	79%	0.794	81%	0.814	S	S	*	*			cis	-117.2	-134	26.1	-164.1	0	0	0	0	113.3
12	T	27.8	Very low	32	Very low	106 Å²	106	136.8 Å²	136.8	65%	0.65	79%	0.791	S	S	*	*			trans	-151.7	178.5	-152	63.1	0	0	0	0	116.3
13	S	30.5	Very low	31.8	Very low	99 Å²	99	137 Å²	137	69%	0.692	79%	0.786	S	S	*	*			trans	67.2	130.3	151.7	53.8	0	0	0	0	120
14	T	29.3	Very low	31.4	Very low	148 Å²	148	134.5 Å²	134.5	91%	0.908	79%	0.786	S	S	*	*			cis	-167	176.5	-3.7	5.6	0	0	0	0	108.2
15	G	26.2	Very low	31.1	Very low	63 Å²	63	134 Å²	134	65%	0.649	78%	0.784	S	S	*	*			cis	166.1	-173.4	2.1	0	0	0	0	0	112.2
16	L	26.8	Very low	31.1	Very low	189 Å²	189	133 Å²	133	99%	0.99	78%	0.78	S	S	*	*			trans	70.4	154.8	178.9	-64.4	173.6	0	0	0	118.6
17	Q	25.8	Very low	30.9	Very low	189 Å²	189	137.4 Å²	137.4	88%	0.883	78%	0.782	S	S	*	*			trans	-112.5	174.9	-166.8	-91.6	179.3	-54.7	0	0	112.4
18	P	39.9	Very low	30.9	Very low	115 Å²	115	134.9 Å²	134.9	75%	0.747	78%	0.781	S	S	*	*			cis	-125.5	-146.4	14.1	41.2	-20.5	0	0	0	111.5
19	P	36.5	Very low	30.9	Very low	119 Å²	119	132 Å²	132	77%	0.773	78%	0.778	S	S	*	*			cis	-134.5	-139.3	-8.7	43.3	-22	0	0	0	114.3
20	Q	36.5	Very low	31	Very low	158 Å²	158	139.4 Å²	139.4	74%	0.738	79%	0.793	S	S	*	*			trans	-137.8	169.1	169.4	-82.9	-165.3	-23	0	0	110.7
21	P	39.2	Very low	30.9	Very low	123 Å²	123	134.4 Å²	134.4	80%	0.799	79%	0.791	S	S	*	*				-143.6	172.1	111.4	39.6	-27.8	0	0	0	113.8
22	H	28.4	Very low	31	Very low	167 Å²	167	133.4 Å²	133.4	77%	0.773	79%	0.79	S	S	*	*			cis	-161.5	145.2	-46.4	-133.4	-74.7	0	0	0	107.9
23	A	28.7	Very low	31.1	Very low	77 Å²	77	140.3 Å²	140.3	64%	0.636	80%	0.804	S	S	*	*			trans	-106.5	149.9	169.3	0	0	0	0	0	111.1
24	P	33.4	Very low	31.1	Very low	132 Å²	132	139.1 Å²	139.1	86%	0.857	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-80.1	124	167.8	-7.5	25.4	0	0	0	111.1
25	Q	32.8	Very low	31.1	Very low	150 Å²	150	137.5 Å²	137.5	70%	0.701	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-88.8	161.8	168.7	-64.4	-176.7	-50.7	0	0	111.8	H27	Q25-H27 PolarHBondContact OE1-CD2 2.7Å
26	P	36	Very low	31.4	Very low	124 Å²	124	140.5 Å²	140.5	81%	0.805	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-97.6	119.4	147.5	33.8	-25.6	0	0	0	111.5
27	H	30.5	Very low	31.8	Very low	160 Å²	160	137.6 Å²	137.6	74%	0.741	80%	0.797	S	S	*	*			trans	-139.2	153.7	165.9	-92	-26.4	0	0	0	110.9	Q25	Q25-H27 PolarHBondContact OE1-CD2 2.7Å
28	Q	27.4	Very low	32	Very low	201 Å²	201	131.8 Å²	131.8	94%	0.939	79%	0.788	S	S	*	*			trans	-103.2	146.6	-176.7	-60.9	177.1	-7.3	0	0	111.2
29	G	28.2	Very low	31.7	Very low	74 Å²	74	138.3 Å²	138.3	76%	0.763	80%	0.798	S	S	*	*			trans	179.4	65.7	176.6	0	0	0	0	0	121.2
30	K	28.7	Very low	31.4	Very low	219 Å²	219	142.8 Å²	142.8	95%	0.952	80%	0.799	S	S	*	*			trans	59.4	126.4	150.6	-62.8	179.9	177.2	176.9	0	121.9
31	G	28.6	Very low	31.9	Very low	79 Å²	79	140.7 Å²	140.7	81%	0.814	80%	0.799	S	S	*	*			trans	105.5	142.3	150.2	0	0	0	0	0	115.7
32	S	28.9	Very low	31.3	Very low	110 Å²	110	146.1 Å²	146.1	77%	0.769	80%	0.804	S	S	*	*			cis	-161.7	155.2	-10.9	-170.3	0	0	0	0	110.7
33	R	31.6	Very low	31.4	Very low	251 Å²	251	145.4 Å²	145.4	95%	0.947	80%	0.801	S	S	*	*			trans	68.3	129.7	-179.9	-51.3	173.7	176	172.9	-2.2	115.4
34	G	30	Very low	31.9	Very low	73 Å²	73	148 Å²	148	75%	0.753	81%	0.812	S	S	*	*			cis	171.8	168.4	-11.8	0	0	0	0	0	115
35	S	29.6	Very low	31.6	Very low	114 Å²	114	145.2 Å²	145.2	80%	0.797	81%	0.806	S	S	*	*			trans	81.4	119.2	162.3	-141.8	0	0	0	0	120.9
36	V	32.4	Very low	31.2	Very low	126 Å²	126	144.5 Å²	144.5	76%	0.764	82%	0.816	S	S	*	*			trans	56.8	126.7	133.1	171	0	0	0	0	118.9
37	T	34.9	Very low	30.7	Very low	128 Å²	128	143.3 Å²	143.3	79%	0.785	81%	0.811	S	S	*	*			cis	-154.5	149	1.3	11.8	0	0	0	0	108.4
38	G	30.7	Very low	30.5	Very low	68 Å²	68	142.6 Å²	142.6	70%	0.701	82%	0.818	S	S	*	*				79.4	123.1	79.6	0	0	0	0	0	112.5
39	R	33	Very low	30.3	Very low	251 Å²	251	140.1 Å²	140.1	95%	0.947	81%	0.809	S	S	*	*			cis	-148.7	156.6	14.8	-61	177.9	174	-170.2	-2.2	113
40	R	29.9	Very low	30.4	Very low	213 Å²	213	143.6 Å²	143.6	80%	0.804	81%	0.808	S	S	*	*			trans	-104.2	165.9	150.9	-85.9	-167.9	-177	-176.8	1.9	109.8	E43	R40-E43 IonicContact NH1-OE1 3.36Å
41	P	47.9	Very low	30.9	Very low	114 Å²	114	138.5 Å²	138.5	74%	0.74	80%	0.798	S	S	*	*				-138.7	160.9	121.5	38.2	-27.6	0	0	0	112.7
42	R	26.1	Very low	31.6	Very low	238 Å²	238	140.3 Å²	140.3	90%	0.898	80%	0.795	S	S	*	*			cis	-162.8	153	-17	-114.5	179.5	175.4	171.7	-3.3	108.2
43	E	31.1	Very low	31.5	Very low	151 Å²	151	141.9 Å²	141.9	71%	0.706	80%	0.799	S	S	*	*			trans	-100.3	173.9	166	-58.7	172.7	-163.5	0	0	109.7	R40	R40-E43 IonicContact NH1-OE1 3.36Å
44	P	38.5	Very low	31.2	Very low	133 Å²	133	140.8 Å²	140.8	86%	0.864	80%	0.795	S	S	*	*				-123.7	177.9	68.2	9.4	14.9	0	0	0	112.5
45	G	26.8	Very low	31.1	Very low	72 Å²	72	144.2 Å²	144.2	74%	0.742	80%	0.802	S	S	*	*			cis	124.6	147.8	19.6	0	0	0	0	0	108.7
46	C	24.1	Very low	30.9	Very low	135 Å²	135	144.2 Å²	144.2	91%	0.912	80%	0.797	S	S	*	*			cis	-151.4	166.2	14.8	-167.2	0	0	0	0	111.5
47	S	25.4	Very low	30.7	Very low	100 Å²	100	144.8 Å²	144.8	70%	0.699	80%	0.8	S	S	*	*			trans	-88.9	170	178.8	-42.4	0	0	0	0	114.3
48	T	26.4	Very low	30.2	Very low	145 Å²	145	143.2 Å²	143.2	89%	0.89	80%	0.801	S	S	*	*			trans	-160.3	157.1	141.4	-73.8	0	0	0	0	107.9
49	M	24.2	Very low	30	Very low	149 Å²	149	147.3 Å²	147.3	73%	0.734	81%	0.806	S	S	*	*			trans	-151.4	179.8	-160.9	-71.3	-116.2	-70.1	0	0	112.8
50	I	30.4	Very low	30.1	Very low	147 Å²	147	141 Å²	141	75%	0.754	80%	0.798	S	S	*	*			trans	81.4	150.1	143.9	-95.9	161.8	0	0	0	116.6
51	P	37.5	Very low	30.3	Very low	112 Å²	112	136.3 Å²	136.3	73%	0.727	80%	0.795	S	S	*	*			cis	-134.7	-135.5	-13.8	38.3	-13.9	0	0	0	114.4
52	P	43.6	Very low	29.6	Very low	116 Å²	116	138.3 Å²	138.3	75%	0.753	80%	0.799	S	S	*	*				-136	-168.5	-118.8	44.6	-23.1	0	0	0	116.8
53	V	27.7	Very low	30.1	Very low	143 Å²	143	132.1 Å²	132.1	87%	0.867	79%	0.79	S	S	*	*			trans	-165	158.5	134.9	132.3	0	0	0	0	111.4
54	R	25.6	Very low	30	Very low	229 Å²	229	127.6 Å²	127.6	86%	0.864	78%	0.784	S	S	*	*			trans	-112	154.9	-177.9	-70.6	171.8	164.2	169.9	-7.3	112.8
55	T	26.9	Very low	29.8	Very low	145 Å²	145	129.6 Å²	129.6	89%	0.89	79%	0.786	S	S	*	*			trans	-150.3	169.2	135.8	-24.3	0	0	0	0	110
56	T	26.6	Very low	29.8	Very low	113 Å²	113	131.8 Å²	131.8	69%	0.693	78%	0.78	S	S	*	*			trans	-132.8	130.9	-153	49.3	0	0	0	0	116.3
57	V	27.4	Very low	30.1	Very low	138 Å²	138	133.5 Å²	133.5	84%	0.836	78%	0.779	S	S	*	*			trans	35.2	124.4	136.3	-172.5	0	0	0	0	120
58	A	23.9	Very low	30	Very low	96 Å²	96	136.7 Å²	136.7	79%	0.793	78%	0.78	S	S	*	*			trans	-145.5	133.3	141.5	0	0	0	0	0	110.7
59	N	26.2	Very low	30.2	Very low	153 Å²	153	134.3 Å²	134.3	82%	0.818	77%	0.766	S	S	*	*			trans	-116.3	167.5	168.7	-93.5	1.6	0	0	0	106.8
60	P	36	Very low	30.8	Very low	118 Å²	118	135.1 Å²	135.1	77%	0.766	77%	0.768	S	S	*	*			cis	-141.8	-140	35.8	34.3	-6.4	0	0	0	113.2
61	P	34.9	Very low	30.7	Very low	116 Å²	116	135.6 Å²	135.6	75%	0.753	77%	0.766	S	S	*	*				-129.2	144.9	-93.4	39.5	-23	0	0	0	115.8
62	D	33.1	Very low	30.2	Very low	155 Å²	155	133.3 Å²	133.3	83%	0.829	75%	0.753	S	S	*	*			trans	-167.4	142.6	142.6	-130.2	-15.4	0	0	0	110
63	P	34.9	Very low	29.7	Very low	108 Å²	108	132.8 Å²	132.8	70%	0.701	75%	0.747	S	S	*	*				-141.1	144.6	127.6	36.1	-22.5	0	0	0	112.1
64	G	28.8	Very low	30.2	Very low	56 Å²	56	130.8 Å²	130.8	58%	0.577	73%	0.731	S	S	*	*			cis	89.1	89.2	26.7	0	0	0	0	0	109.6	N66	G64-N66 PolarHBondContact O-N 3.48Å
65	I	34.3	Very low	30.4	Very low	176 Å²	176	125.5 Å²	125.5	90%	0.903	73%	0.725	S	S	*	*			trans	-66.4	109.7	-176.5	-61.4	175.6	0	0	0	108.7
66	N	27.8	Very low	30.8	Very low	117 Å²	117	126.6 Å²	126.6	63%	0.626	72%	0.72	S	S	*	*			trans	-81.8	135	-168	-83.9	-49	0	0	0	113.2	G64 F68	G64-N66 PolarHBondContact O-N 3.48Å; N66-F68 PolarHBondContact O-N 2.94Å
67	I	30.2	Very low	31.5	Very low	171 Å²	171	123.3 Å²	123.3	88%	0.877	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	18.5	-179.2	-65.6	166.9	0	0	0	112.3
68	F	24.2	Very low	32.5	Very low	168 Å²	168	122.5 Å²	122.5	74%	0.737	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.7	2.6	-168.3	-106.4	-82.2	0	0	0	115.9	N66	N66-F68 PolarHBondContact O-N 2.94Å
69	T	29.8	Very low	33.7	Very low	95 Å²	95	125.1 Å²	125.1	58%	0.583	69%	0.688	S	S	*	*			trans	-72.1	-30.5	-171.7	13.7	0	0	0	0	114.9	H71 S72 V73	T69-H71 PolarHBondContact O-N 2.74Å; T69-S72 PolarHBondContact O-N 2.81Å; T69-S72 PolarHBondContact O-OG 3.12Å; T69-V73 PolarHBondContact O-N 3.33Å
70	Q	37	Very low	35.1	Very low	165 Å²	165	119.2 Å²	119.2	77%	0.771	66%	0.655	S	S	*	*	H	α-helix	trans	-60.6	-42.3	-175.4	-77.8	-175.9	-19.2	0	0	113.3	S72 V73	Q70-S72 PolarHBondContact O-N 3.38Å; Q70-V73 PolarHBondContact O-N 2.91Å
71	H	28.7	Very low	36.1	Very low	158 Å²	158	117.9 Å²	117.9	73%	0.731	65%	0.648	S	S	*	*	H	α-helix	trans	-67.9	-19.2	177.1	-97.1	-70	0	0	0	114.1	T69	T69-H71 PolarHBondContact O-N 2.74Å
72	S	26.3	Very low	36.9	Very low	63 Å²	63	113 Å²	113	44%	0.441	62%	0.617	S	S	.	*	H	α-helix	trans	-85.6	-30.7	179	65.2	0	0	0	0	113.9	T69 Q70 L74 T75	T69-S72 PolarHBondContact O-N 2.81Å; T69-S72 PolarHBondContact O-OG 3.12Å; Q70-S72 PolarHBondContact O-N 3.38Å; S72-L74 VanDerWaalsContact C-N 3.33Å; S72-L74 PolarHBondContact O-N 3.45Å; S72-T75 WeakPolarHBondContact O-CB 3.42Å; S72-T75 PolarHBondContact O-N 3.19Å; S72-T75 VanDerWaalsContact O-N 3.09Å; S72-T75 PolarHBondContact O-OG1 3.04Å
73	V	33.2	Very low	37.5	Very low	105 Å²	105	113.3 Å²	113.3	64%	0.636	61%	0.611	S	S	*	*	H	α-helix	trans	-67.8	-31.9	-176.3	174.5	0	0	0	0	112.3	T69 Q70 T75 E76	T69-V73 PolarHBondContact O-N 3.33Å; Q70-V73 PolarHBondContact O-N 2.91Å; V73-T75 PolarHBondContact O-N 3.24Å; V73-T75 VanDerWaalsContact O-N 3.15Å; V73-E76 PolarHBondContact O-N 3.28Å
74	L	38.1	Very low	38.2	Very low	101 Å²	101	116.5 Å²	116.5	53%	0.529	62%	0.617	S	S	.	*	G	3₁₀ helix	trans	-63.7	-16.8	174.4	-70.7	173.2	0	0	0	113.6	S72	S72-L74 VanDerWaalsContact C-N 3.33Å; S72-L74 PolarHBondContact O-N 3.45Å
75	T	29.6	Very low	39.1	Very low	118 Å²	118	117.5 Å²	117.5	72%	0.724	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-80.8	-16.8	178	-14.9	0	0	0	0	113.4	S72 V73	S72-T75 WeakPolarHBondContact O-CB 3.42Å; S72-T75 PolarHBondContact O-N 3.19Å; S72-T75 VanDerWaalsContact O-N 3.09Å; S72-T75 PolarHBondContact O-OG1 3.04Å; V73-T75 PolarHBondContact O-N 3.24Å; V73-T75 VanDerWaalsContact O-N 3.15Å
76	E	36.5	Very low	39.9	Very low	168 Å²	168	112.4 Å²	112.4	79%	0.785	58%	0.583	S	S	*	*	G	3₁₀ helix	trans	-108.2	39.2	175.3	-68.9	-160.4	128.5	0	0	112.3	V73 V78	V73-E76 PolarHBondContact O-N 3.28Å; E76-V78 PolarHBondContact O-N 3.32Å
77	A	40.8	Very low	40.7	Very low	44 Å²	44	113.7 Å²	113.7	36%	0.364	59%	0.589	S	S	.	*			trans	-66.5	79.9	165.3	0	0	0	0	0	110.3	R79 I176 Y246	A77-R79 PolarHBondContact O-N 3.32Å; A77-I176 HydrophobicContact CB-CD1 4.31Å; A77-Y246 HydrophobicContact CB-CD1 3.86Å; A77-Y246 HydrophobicContact CB-CE1 4.09Å; A77-Y246 WeakPolarHBondContact O-CD1 3.05Å; A77-Y246 WeakPolarHBondContact O-CE1 3.29Å
78	V	48.4	Very low	41.4	Very low	121 Å²	121	108.4 Å²	108.4	73%	0.733	58%	0.577	S	S	*	*			trans	-57.3	106.3	-178.4	180	0	0	0	0	109.5	E76 W80	E76-V78 PolarHBondContact O-N 3.32Å; V78-W80 PolarHBondContact O-N 3.22Å; V78-W80 VanDerWaalsContact O-N 3.12Å
79	R	47.9	Very low	42.3	Very low	151 Å²	151	105 Å²	105	57%	0.57	58%	0.579	S	S	*	*			trans	-55.9	118	176.5	-176	-177.7	-171.7	173.7	6.5	108.8	A77 S81 H245 Y246	A77-R79 PolarHBondContact O-N 3.32Å; R79-S81 PolarHBondContact O-N 3.35Å; R79-H245 PolarHBondContact NH2-NE2 3.15Å; R79-Y246 HydrophobicContact CB-CE1 4.23Å
80	W	55.4	Low	43.1	Very low	29 Å²	29	106.3 Å²	106.3	11%	0.11	59%	0.588	C	S	.	*			trans	-74.9	115.6	-176.4	-177.8	83.4	0	0	0	110.3	V78 S82 W158 V230 H231 H245 P247	V78-W80 PolarHBondContact O-N 3.22Å; V78-W80 VanDerWaalsContact O-N 3.12Å; W80-S82 WeakPolarHBondContact CZ2-OG 3.44Å; W80-S82 PolarHBondContact NE1-OG 3.44Å; W80-S82 VanDerWaalsContact NE1-OG 3.07Å; W80-W158 AromaticContact CE2-CD1 3.84Å; W80-W158 AromaticContact CE2-NE1 3.56Å; W80-W158 AromaticContact CH2-NE1 3.97Å; W80-W158 AromaticContact CZ2-NE1 3.37Å; W80-W158 AromaticContact NE1-CD1 3.96Å; W80-W158 AromaticContact NE1-NE1 3.89Å; W80-V230 HydrophobicContact CE3-CG1 4.36Å; W80-V230 HydrophobicContact CH2-CB 4.35Å; W80-V230 HydrophobicContact CH2-CG1 3.87Å; W80-V230 HydrophobicContact CZ3-CG1 3.73Å; W80-H231 HydrophobicContact CH2-CB 4.1Å; W80-H231 HydrophobicContact CZ3-CB 4.37Å; W80-H245 PolarHBondContact N-O 3.17Å; W80-P247 HydrophobicContact CB-CG 3.71Å; W80-P247 HydrophobicContact CG-CG 3.96Å
81	S	57.8	Low	43.9	Very low	90 Å²	90	102.8 Å²	102.8	63%	0.629	57%	0.571	S	S	*	*			trans	-136.2	34	-177.5	69.7	0	0	0	0	112.2	R79 K83	R79-S81 PolarHBondContact O-N 3.35Å; S81-K83 VanDerWaalsContact C-N 3.31Å; S81-K83 PolarHBondContact O-N 3.07Å
82	S	51.7	Low	45.1	Very low	15 Å²	15	100.5 Å²	100.5	11%	0.105	57%	0.573	C	S	.	*			trans	-78.2	75.4	-166.8	75.1	0	0	0	0	113.8	W80 E84 N85	W80-S82 WeakPolarHBondContact CZ2-OG 3.44Å; W80-S82 PolarHBondContact NE1-OG 3.44Å; W80-S82 VanDerWaalsContact NE1-OG 3.07Å; S82-E84 PolarHBondContact O-N 2.78Å; S82-E84 VanDerWaalsContact O-N 3.16Å; S82-N85 VanDerWaalsContact CB-ND2 3.33Å; S82-N85 WeakPolarHBondContact CB-ND2 3.39Å; S82-N85 PolarHBondContact O-N 2.94Å; S82-N85 PolarHBondContact OG-ND2 3.06Å
83	K	45.8	Very low	47.2	Very low	160 Å²	160	99.5 Å²	99.5	70%	0.696	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-53.5	-24.4	159.2	-170.4	172.8	-177.1	175.1	0	111.9	S81 N85 L86	S81-K83 VanDerWaalsContact C-N 3.31Å; S81-K83 PolarHBondContact O-N 3.07Å; K83-N85 PolarHBondContact O-N 3.2Å; K83-L86 PolarHBondContact O-N 2.67Å
84	E	48.8	Very low	48.9	Very low	176 Å²	176	99.1 Å²	99.1	82%	0.822	56%	0.562	S	S	*	*	G	3₁₀ helix	trans	-67.3	-26.3	178.2	-59.9	174.4	161.3	0	0	114.1	S82	S82-E84 PolarHBondContact O-N 2.78Å; S82-E84 VanDerWaalsContact O-N 3.16Å
85	N	48.8	Very low	50.7	Low	77 Å²	77	98.7 Å²	98.7	41%	0.412	56%	0.56	S	S	.	*	G	3₁₀ helix	trans	-82.7	-13	179.4	-84.3	-61.6	0	0	0	113.9	S82 K83 L87	S82-N85 VanDerWaalsContact CB-ND2 3.33Å; S82-N85 WeakPolarHBondContact CB-ND2 3.39Å; S82-N85 PolarHBondContact O-N 2.94Å; S82-N85 PolarHBondContact OG-ND2 3.06Å; K83-N85 PolarHBondContact O-N 3.2Å; N85-L87 VanDerWaalsContact C-N 3.26Å; N85-L87 PolarHBondContact O-N 2.83Å
86	L	51.3	Low	53.5	Low	68 Å²	68	94.4 Å²	94.4	36%	0.356	53%	0.533	S	S	.	.	G	3₁₀ helix	trans	-77	-8.9	-177.4	-65.2	170.1	0	0	0	113.8	K83 E228 H231	K83-L86 PolarHBondContact O-N 2.67Å; L86-E228 HydrophobicContact CD2-CG 3.98Å; L86-H231 HydrophobicContact CD2-CB 4.49Å
87	L	44.6	Very low	56.1	Low	144 Å²	144	87.5 Å²	87.5	75%	0.754	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-118.8	14.9	-172.5	-62.6	176.6	0	0	0	113.7	N85 A89	N85-L87 VanDerWaalsContact C-N 3.26Å; N85-L87 PolarHBondContact O-N 2.83Å; L87-A89 PolarHBondContact O-N 2.95Å
88	G	45.4	Very low	58.5	Low	61 Å²	61	86.6 Å²	86.6	63%	0.629	49%	0.49	S	S	*	.			trans	-75.4	43.9	179.7	0	0	0	0	0	115.1
89	A	42	Very low	60.5	Low	95 Å²	95	81 Å²	81	79%	0.785	46%	0.457	S	S	*	.			trans	-99.2	8.4	-168.6	0	0	0	0	0	115.4	L87	L87-A89 PolarHBondContact O-N 2.95Å
90	T	46.3	Very low	62.4	Low	124 Å²	124	75 Å²	75	76%	0.761	44%	0.436	S	S	*	.	S	Bend	trans	-125.6	-11.2	-164.6	51.1	0	0	0	0	116.6	S92	T90-S92 PolarHBondContact O-N 2.95Å
91	E	54.8	Low	63.9	Low	91 Å²	91	75.1 Å²	75.1	43%	0.425	44%	0.436	S	S	.	.			trans	-94.6	71.1	174.9	-75	-173	-158.6	0	0	111.4	D93 L96 K118	E91-D93 PolarHBondContact O-N 3.41Å; E91-L96 HydrophobicContact CB-CD2 4.47Å; E91-L96 WeakPolarHBondContact OE2-CD2 3.38Å; E91-K118 IonicContact OE1-NZ 3.72Å; E91-K118 PolarHBondContact OE1-NZ 3.03Å; E91-K118 IonicContact OE2-NZ 2.81Å; E91-K118 PolarHBondContact OE2-NZ 3.14Å
92	S	54.6	Low	65.4	Low	110 Å²	110	74.2 Å²	74.2	77%	0.769	43%	0.425	S	S	*	.			trans	-81.2	43.7	-179.2	68.5	0	0	0	0	114	T90 P94	T90-S92 PolarHBondContact O-N 2.95Å; S92-P94 WeakPolarHBondContact O-CD 3.44Å
93	D	69.1	Low	67.1	Low	41 Å²	41	74.5 Å²	74.5	22%	0.219	42%	0.424	C	S	.	.			trans	-93.2	106.5	167.9	179.7	1.5	0	0	0	108.9	E91 N95 L96 R120	E91-D93 PolarHBondContact O-N 3.41Å; D93-N95 PolarHBondContact O-N 2.96Å; D93-N95 PolarHBondContact OD1-N 3.1Å; D93-L96 HydrophobicContact CB-CB 3.94Å; D93-L96 WeakPolarHBondContact O-CB 3.38Å; D93-L96 PolarHBondContact O-N 3.15Å; D93-L96 VanDerWaalsContact O-N 3.12Å; D93-R120 IonicContact OD2-CZ 2.68Å; D93-R120 IonicContact OD2-NE 2.7Å; D93-R120 PolarHBondContact OD2-NE 3.35Å; D93-R120 IonicContact OD2-NH2 2.67Å; D93-R120 PolarHBondContact OD2-NH2 2.91Å
94	P	69.5	Low	69	Low	97 Å²	97	72 Å²	72	63%	0.63	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-15.1	-177.6	29.5	-36.1	0	0	0	113.2	S92 L96	S92-P94 WeakPolarHBondContact O-CD 3.44Å; P94-L96 VanDerWaalsContact C-N 3.35Å
95	N	76.2	Confident	70.7	Confident	92 Å²	92	65.6 Å²	65.6	49%	0.492	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	7.2	177.7	-62.4	-22.2	0	0	0	112.5	D93 R120 V121	D93-N95 PolarHBondContact O-N 2.96Å; D93-N95 PolarHBondContact OD1-N 3.1Å; N95-R120 HydrophobicContact CB-CG 4.26Å; N95-R120 WeakPolarHBondContact O-CA 3.36Å; N95-V121 PolarHBondContact O-N 2.99Å
96	L	88.3	Confident	71.8	Confident	29 Å²	29	63.5 Å²	63.5	15%	0.152	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	121	178.6	-167	70.6	0	0	0	111.2	E91 D93 P94 K118 V150	E91-L96 HydrophobicContact CB-CD2 4.47Å; E91-L96 WeakPolarHBondContact OE2-CD2 3.38Å; D93-L96 HydrophobicContact CB-CB 3.94Å; D93-L96 WeakPolarHBondContact O-CB 3.38Å; D93-L96 PolarHBondContact O-N 3.15Å; D93-L96 VanDerWaalsContact O-N 3.12Å; P94-L96 VanDerWaalsContact C-N 3.35Å; L96-K118 HydrophobicContact CD1-CB 4.41Å; L96-K118 HydrophobicContact CD2-CD 4.38Å; L96-V150 HydrophobicContact CB-CG2 4.42Å; L96-V150 HydrophobicContact CD2-CG2 4.15Å; L96-V150 HydrophobicContact CG-CG2 3.93Å; L96-V150 WeakPolarHBondContact O-CG2 3Å; L96-V150 PolarHBondContact O-N 3.4Å
97	F	91.4	Very high	72.7	Confident	23 Å²	23	60.8 Å²	60.8	10%	0.101	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	161.3	-176.7	-76.6	-118.2	0	0	0	110.4	K118 L119 V121 I147 T148 P149	F97-K118 CarbonylContact O-C 3.56Å; F97-K118 WeakPolarHBondContact O-CA 3.48Å; F97-L119 HydrophobicContact CB-CB 4.42Å; F97-L119 PolarHBondContact N-O 3.44Å; F97-L119 PolarHBondContact O-N 3.03Å; F97-V121 HydrophobicContact CB-CG2 4.42Å; F97-V121 HydrophobicContact CD1-CG2 3.98Å; F97-V121 HydrophobicContact CD2-CB 4.27Å; F97-V121 HydrophobicContact CD2-CG2 3.53Å; F97-V121 HydrophobicContact CE1-CG2 4.08Å; F97-V121 HydrophobicContact CE2-CB 4.15Å; F97-V121 HydrophobicContact CE2-CG2 3.66Å; F97-V121 HydrophobicContact CG-CG2 3.73Å; F97-V121 HydrophobicContact CZ-CG2 3.93Å; F97-I147 HydrophobicContact CD1-CB 4.25Å; F97-I147 HydrophobicContact CD1-CD1 3.81Å; F97-I147 HydrophobicContact CD1-CG1 3.88Å; F97-I147 HydrophobicContact CE1-CD1 4.37Å; F97-I147 HydrophobicContact CE1-CG1 4.47Å; F97-I147 HydrophobicContact CG-CD1 4.35Å; F97-T148 CarbonylContact C-O 3.6Å; F97-T148 WeakPolarHBondContact CA-O 3.41Å; F97-T148 WeakPolarHBondContact CB-O 3.18Å; F97-P149 HydrophobicContact CD1-CG 4.31Å; F97-P149 HydrophobicContact CE1-CG 3.79Å; F97-P149 HydrophobicContact CE2-CG 4.39Å; F97-P149 HydrophobicContact CZ-CG 3.84Å
98	V	90.7	Very high	74.3	Confident	24 Å²	24	61 Å²	61	15%	0.145	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	138.7	172	62.9	0	0	0	0	110.2	E117 I147 T148 V150 K155	V98-E117 WeakPolarHBondContact CA-O 3.3Å; V98-I147 WeakPolarHBondContact O-CA 3.42Å; V98-T148 HydrophobicContact CG1-CG2 3.79Å; V98-T148 PolarHBondContact N-O 2.94Å; V98-T148 PolarHBondContact O-N 2.92Å; V98-V150 HydrophobicContact CB-CG2 4.24Å; V98-K155 HydrophobicContact CG1-CB 4.11Å
99	A	90.9	Very high	76.1	Confident	3 Å²	3	60.8 Å²	60.8	3%	0.025	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	127.6	175	0	0	0	0	0	111.6	I113 T114 G116 E117 L119	A99-I113 HydrophobicContact CB-CD1 4Å; A99-T114 VanDerWaalsContact CB-O 3.23Å; A99-T114 WeakPolarHBondContact CB-O 3.39Å; A99-G116 PolarHBondContact O-N 3.14Å; A99-E117 HydrophobicContact CB-CB 4.46Å; A99-E117 PolarHBondContact N-O 3.15Å; A99-L119 HydrophobicContact CB-CD1 4.35Å
100	L	86.1	Confident	78.4	Confident	26 Å²	26	57 Å²	57	14%	0.136	33%	0.332	C	S	.	.	S	Bend	trans	-87.1	-28.5	177.6	-67.2	179	0	0	0	113.1	K115 Y146 T148 E154	L100-K115 VanDerWaalsContact O-CD 3.29Å; L100-K115 WeakPolarHBondContact O-CD 3.36Å; L100-K115 WeakPolarHBondContact O-CE 3.48Å; L100-K115 WeakPolarHBondContact O-CG 3.17Å; L100-Y146 PolarHBondContact N-O 2.8Å; L100-T148 HydrophobicContact CD1-CG2 4.08Å; L100-T148 HydrophobicContact CD2-CG2 3.65Å; L100-T148 HydrophobicContact CG-CG2 3.88Å; L100-E154 HydrophobicContact CD1-CB 4.32Å; L100-E154 WeakPolarHBondContact CD2-O 3.38Å
101	Y	87.3	Confident	80.5	Confident	31 Å²	31	52 Å²	52	12%	0.122	30%	0.301	C	S	.	.	S	Bend	trans	-141.9	151.8	-175.4	-51.1	-87	0	0	0	110.4	Y146 K250 K253 P254	Y101-Y146 HydrophobicContact CD2-CG 4.41Å; Y101-K250 HydrophobicContact CE1-CB 4.19Å; Y101-K253 HydrophobicContact CD1-CG 4.23Å; Y101-P254 HydrophobicContact CD2-CG 4.01Å; Y101-P254 HydrophobicContact CE2-CG 3.53Å
102	D	89.1	Confident	82.3	Confident	71 Å²	71	50.4 Å²	50.4	38%	0.38	30%	0.3	S	S	.	.			trans	-71.1	130.7	172.9	-46.8	-66.3	0	0	0	110.7	I113 K115 K253	D102-I113 WeakPolarHBondContact CA-O 3.27Å; D102-K115 WeakPolarHBondContact OD1-CB 3.32Å; D102-K115 PolarHBondContact OD1-N 3.18Å; D102-K253 PolarHBondContact O-NZ 3.18Å
103	F	88.1	Confident	84.1	Confident	21 Å²	21	45.3 Å²	45.3	9%	0.092	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-125.7	133.6	173.3	171.7	-98.2	0	0	0	109.2	L111 S112 I113 W130 V142 P143 Y146	F103-L111 VanDerWaalsContact CD1-O 3.24Å; F103-L111 WeakPolarHBondContact CD1-O 3.3Å; F103-L111 WeakPolarHBondContact CE1-O 3.46Å; F103-S112 CarbonylContact O-C 3.58Å; F103-S112 VanDerWaalsContact O-CA 3.28Å; F103-S112 WeakPolarHBondContact O-CA 3.28Å; F103-I113 HydrophobicContact CB-CD1 4.45Å; F103-I113 HydrophobicContact CB-CG1 3.84Å; F103-I113 HydrophobicContact CD1-CG1 4.46Å; F103-I113 PolarHBondContact N-O 3.41Å; F103-I113 PolarHBondContact O-N 3.01Å; F103-W130 HydrophobicContact CE1-CZ3 4.47Å; F103-W130 HydrophobicContact CE2-CH2 4.18Å; F103-W130 HydrophobicContact CE2-CZ3 4.3Å; F103-W130 AromaticContact CZ-CH2 3.95Å; F103-W130 HydrophobicContact CZ-CH2 3.95Å; F103-W130 AromaticContact CZ-CZ3 3.76Å; F103-W130 HydrophobicContact CZ-CZ3 3.76Å; F103-V142 HydrophobicContact CD1-CB 4.48Å; F103-V142 HydrophobicContact CD1-CG1 4.13Å; F103-V142 HydrophobicContact CE1-CG1 4.37Å; F103-P143 HydrophobicContact CD2-CG 3.87Å; F103-P143 HydrophobicContact CE2-CG 3.83Å; F103-P143 HydrophobicContact CZ-CG 4.44Å; F103-Y146 HydrophobicContact CB-CD1 3.71Å; F103-Y146 HydrophobicContact CB-CE1 3.89Å; F103-Y146 HydrophobicContact CD2-CE1 4.24Å
104	V	86.8	Confident	85.1	Confident	108 Å²	108	47.4 Å²	47.4	66%	0.655	28%	0.278	S	S	*	.			trans	-104	133.2	178.5	-178.7	0	0	0	0	107.6	S106	V104-S106 PolarHBondContact O-N 3.27Å
105	A	83.2	Confident	86	Confident	41 Å²	41	48.7 Å²	48.7	34%	0.339	27%	0.274	S	S	.	.			trans	-57.6	127.9	176.3	0	0	0	0	0	111.3	T110 S112	A105-T110 WeakPolarHBondContact CA-OG1 3.17Å; A105-T110 WeakPolarHBondContact CB-O 3.22Å; A105-S112 WeakPolarHBondContact CB-OG 3.33Å; A105-S112 PolarHBondContact N-OG 2.85Å
106	S	71.3	Confident	86.5	Confident	34 Å²	34	46.7 Å²	46.7	24%	0.238	28%	0.275	C	S	.	.			trans	-108.1	-60.2	177.4	-65.7	0	0	0	0	110.1	V104 T110 K294 Y295	V104-S106 PolarHBondContact O-N 3.27Å; S106-T110 PolarHBondContact N-OG1 3.4Å; S106-K294 WeakPolarHBondContact O-CE 3.35Å; S106-Y295 VanDerWaalsContact C-CE1 3.48Å; S106-Y295 VanDerWaalsContact CB-CE1 3.48Å; S106-Y295 WeakPolarHBondContact O-CE1 3.14Å
107	G	70.9	Confident	86.6	Confident	11 Å²	11	46.7 Å²	46.7	11%	0.113	27%	0.274	C	S	.	.	S	Bend	trans	-79.1	151.6	174	0	0	0	0	0	112.2	N109 T110	G107-N109 PolarHBondContact O-N 2.58Å; G107-T110 PolarHBondContact N-OG1 3.31Å; G107-T110 PolarHBondContact O-N 2.76Å; G107-T110 PolarHBondContact O-OG1 3.26Å
108	D	77.9	Confident	86.6	Confident	148 Å²	148	50.2 Å²	50.2	79%	0.791	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-16.2	178.8	-45.4	14.7	0	0	0	112.9	K294	D108-K294 IonicContact OD1-NZ 2.95Å; D108-K294 PolarHBondContact OD1-NZ 2.69Å
109	N	84.7	Confident	86.7	Confident	57 Å²	57	49.2 Å²	49.2	31%	0.305	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	1.1	176.8	62.9	-19.2	0	0	0	113.9	G107 G140 W141 P261	G107-N109 PolarHBondContact O-N 2.58Å; N109-G140 WeakPolarHBondContact O-CA 3.48Å; N109-W141 VanDerWaalsContact O-CD1 3.3Å; N109-W141 PolarHBondContact O-N 3.32Å; N109-P261 WeakPolarHBondContact ND2-CG 3.27Å
110	T	88.6	Confident	86.8	Confident	14 Å²	14	55.2 Å²	55.2	9%	0.086	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-96.6	151.8	179.3	64.3	0	0	0	0	111.4	A105 S106 G107 W130 W141	A105-T110 WeakPolarHBondContact CA-OG1 3.17Å; A105-T110 WeakPolarHBondContact CB-O 3.22Å; S106-T110 PolarHBondContact N-OG1 3.4Å; G107-T110 PolarHBondContact N-OG1 3.31Å; G107-T110 PolarHBondContact O-N 2.76Å; G107-T110 PolarHBondContact O-OG1 3.26Å; T110-W130 HydrophobicContact CG2-CH2 4.34Å; T110-W130 HydrophobicContact CG2-CZ3 3.87Å; T110-W141 CarbonylContact C-O 3.49Å; T110-W141 WeakPolarHBondContact CA-O 3.44Å; T110-W141 WeakPolarHBondContact CB-O 3.27Å; T110-W141 HydrophobicContact CG2-CB 4.33Å
111	L	91.5	Very high	87.1	Confident	20 Å²	20	54.8 Å²	54.8	11%	0.105	30%	0.304	C	S	.	.			trans	-114.1	128.5	-175.6	-175.9	69.1	0	0	0	111	F103 I113 V133 W141 V142	F103-L111 VanDerWaalsContact CD1-O 3.24Å; F103-L111 WeakPolarHBondContact CD1-O 3.3Å; F103-L111 WeakPolarHBondContact CE1-O 3.46Å; L111-I113 HydrophobicContact CD2-CG2 4.37Å; L111-I113 HydrophobicContact CG-CG2 4.47Å; L111-V133 HydrophobicContact CD2-CG2 4.02Å; L111-W141 PolarHBondContact N-O 2.63Å; L111-V142 HydrophobicContact CB-CG1 4.24Å; L111-V142 WeakPolarHBondContact O-CG1 3.26Å
112	S	91.4	Very high	87.3	Confident	57 Å²	57	56.7 Å²	56.7	40%	0.399	32%	0.316	S	S	.	.			trans	-67.8	132.8	170.4	-59.9	0	0	0	0	110.5	F103 A105	F103-S112 CarbonylContact O-C 3.58Å; F103-S112 VanDerWaalsContact O-CA 3.28Å; F103-S112 WeakPolarHBondContact O-CA 3.28Å; A105-S112 WeakPolarHBondContact CB-OG 3.33Å; A105-S112 PolarHBondContact N-OG 2.85Å
113	I	92.4	Very high	87.3	Confident	4 Å²	4	54.5 Å²	54.5	2%	0.021	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-133	142.9	176.6	54.8	166.4	0	0	0	111	A99 D102 F103 L111 L119 V142 I147	A99-I113 HydrophobicContact CB-CD1 4Å; D102-I113 WeakPolarHBondContact CA-O 3.27Å; F103-I113 HydrophobicContact CB-CD1 4.45Å; F103-I113 HydrophobicContact CB-CG1 3.84Å; F103-I113 HydrophobicContact CD1-CG1 4.46Å; F103-I113 PolarHBondContact N-O 3.41Å; F103-I113 PolarHBondContact O-N 3.01Å; L111-I113 HydrophobicContact CD2-CG2 4.37Å; L111-I113 HydrophobicContact CG-CG2 4.47Å; I113-L119 HydrophobicContact CB-CD2 4.48Å; I113-L119 HydrophobicContact CD1-CD1 4.03Å; I113-L119 HydrophobicContact CG2-CD1 4.36Å; I113-L119 HydrophobicContact CG2-CD2 3.77Å; I113-V142 HydrophobicContact CD1-CB 4.11Å; I113-V142 HydrophobicContact CD1-CG1 3.94Å; I113-V142 HydrophobicContact CD1-CG2 4.33Å; I113-V142 HydrophobicContact CG1-CG1 4.1Å; I113-V142 HydrophobicContact CG2-CG1 4.04Å; I113-I147 HydrophobicContact CD1-CG2 3.84Å
114	T	91.3	Very high	87.4	Confident	84 Å²	84	59.8 Å²	59.8	52%	0.515	33%	0.33	S	S	.	.			trans	-100	143.9	178.9	-44.2	0	0	0	0	110.3	A99 G116 E117	A99-T114 VanDerWaalsContact CB-O 3.23Å; A99-T114 WeakPolarHBondContact CB-O 3.39Å; T114-G116 PolarHBondContact O-N 3.47Å; T114-E117 PolarHBondContact N-OE2 3.38Å; T114-E117 WeakPolarHBondContact O-CB 3.39Å; T114-E117 PolarHBondContact O-N 3.46Å
115	K	88.3	Confident	87.5	Confident	125 Å²	125	55.9 Å²	55.9	54%	0.543	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	130.9	174.2	-178.1	169.5	-176.4	171	0	111.8	L100 D102 E117	L100-K115 VanDerWaalsContact O-CD 3.29Å; L100-K115 WeakPolarHBondContact O-CD 3.36Å; L100-K115 WeakPolarHBondContact O-CE 3.48Å; L100-K115 WeakPolarHBondContact O-CG 3.17Å; D102-K115 WeakPolarHBondContact OD1-CB 3.32Å; D102-K115 PolarHBondContact OD1-N 3.18Å; K115-E117 VanDerWaalsContact C-N 3.32Å
116	G	85.9	Confident	87.5	Confident	50 Å²	50	62.2 Å²	62.2	52%	0.515	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	84	-5.2	-174.6	0	0	0	0	0	115.2	A99 T114	A99-G116 PolarHBondContact O-N 3.14Å; T114-G116 PolarHBondContact O-N 3.47Å
117	E	91.1	Very high	88	Confident	28 Å²	28	63.4 Å²	63.4	13%	0.131	34%	0.336	C	S	.	.			trans	-66.1	133.1	174.5	-168.8	174.8	162.5	0	0	110.9	V98 A99 T114 K115 L119 S135 N137	V98-E117 WeakPolarHBondContact CA-O 3.3Å; A99-E117 HydrophobicContact CB-CB 4.46Å; A99-E117 PolarHBondContact N-O 3.15Å; T114-E117 PolarHBondContact N-OE2 3.38Å; T114-E117 WeakPolarHBondContact O-CB 3.39Å; T114-E117 PolarHBondContact O-N 3.46Å; K115-E117 VanDerWaalsContact C-N 3.32Å; E117-L119 HydrophobicContact CB-CD2 4.33Å; E117-L119 HydrophobicContact CG-CD2 3.94Å; E117-S135 WeakPolarHBondContact OE1-CB 3.42Å; E117-S135 PolarHBondContact OE1-OG 3.17Å; E117-N137 PolarHBondContact OE1-ND2 3.26Å
118	K	90.9	Very high	88.7	Confident	98 Å²	98	64.5 Å²	64.5	43%	0.426	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	129.1	176.2	-67.9	-172	-178.8	-173.6	0	110.6	E91 L96 F97	E91-K118 IonicContact OE1-NZ 3.72Å; E91-K118 PolarHBondContact OE1-NZ 3.03Å; E91-K118 IonicContact OE2-NZ 2.81Å; E91-K118 PolarHBondContact OE2-NZ 3.14Å; L96-K118 HydrophobicContact CD1-CB 4.41Å; L96-K118 HydrophobicContact CD2-CD 4.38Å; F97-K118 CarbonylContact O-C 3.56Å; F97-K118 WeakPolarHBondContact O-CA 3.48Å
119	L	92.8	Very high	89.1	Confident	2 Å²	2	59.9 Å²	59.9	1%	0.01	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	151.7	-170.8	-44.1	173.5	0	0	0	109.6	F97 A99 I113 E117 V133 I147	F97-L119 HydrophobicContact CB-CB 4.42Å; F97-L119 PolarHBondContact N-O 3.44Å; F97-L119 PolarHBondContact O-N 3.03Å; A99-L119 HydrophobicContact CB-CD1 4.35Å; I113-L119 HydrophobicContact CB-CD2 4.48Å; I113-L119 HydrophobicContact CD1-CD1 4.03Å; I113-L119 HydrophobicContact CG2-CD1 4.36Å; I113-L119 HydrophobicContact CG2-CD2 3.77Å; E117-L119 HydrophobicContact CB-CD2 4.33Å; E117-L119 HydrophobicContact CG-CD2 3.94Å; L119-V133 HydrophobicContact CB-CB 4.48Å; L119-I147 HydrophobicContact CD1-CB 4.23Å; L119-I147 HydrophobicContact CD1-CG2 3.41Å; L119-I147 VanDerWaalsContact CD1-CG2 3.41Å
120	R	92.3	Very high	89.3	Confident	129 Å²	129	57.5 Å²	57.5	49%	0.487	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	124	163	-178.1	175.2	-76.5	168.7	-2.1	109.9	D93 N95 V133 R134	D93-R120 IonicContact OD2-CZ 2.68Å; D93-R120 IonicContact OD2-NE 2.7Å; D93-R120 PolarHBondContact OD2-NE 3.35Å; D93-R120 IonicContact OD2-NH2 2.67Å; D93-R120 PolarHBondContact OD2-NH2 2.91Å; N95-R120 HydrophobicContact CB-CG 4.26Å; N95-R120 WeakPolarHBondContact O-CA 3.36Å; R120-V133 CarbonylContact O-C 3.59Å; R120-V133 WeakPolarHBondContact O-CA 3.47Å; R120-R134 PolarHBondContact N-O 2.83Å; R120-R134 PolarHBondContact O-N 2.83Å
121	V	93	Very high	89.4	Confident	17 Å²	17	56.9 Å²	56.9	10%	0.103	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	137.3	173	178	0	0	0	0	109.4	N95 F97 Y124 V133 I147	N95-V121 PolarHBondContact O-N 2.99Å; F97-V121 HydrophobicContact CB-CG2 4.42Å; F97-V121 HydrophobicContact CD1-CG2 3.98Å; F97-V121 HydrophobicContact CD2-CB 4.27Å; F97-V121 HydrophobicContact CD2-CG2 3.53Å; F97-V121 HydrophobicContact CE1-CG2 4.08Å; F97-V121 HydrophobicContact CE2-CB 4.15Å; F97-V121 HydrophobicContact CE2-CG2 3.66Å; F97-V121 HydrophobicContact CG-CG2 3.73Å; F97-V121 HydrophobicContact CZ-CG2 3.93Å; V121-Y124 HydrophobicContact CG1-CE1 4.36Å; V121-Y124 HydrophobicContact CG1-CE2 4.18Å; V121-V133 HydrophobicContact CG2-CG1 4.03Å; V121-I147 HydrophobicContact CG2-CD1 3.67Å
122	L	90.9	Very high	89.6	Confident	72 Å²	72	58.5 Å²	58.5	38%	0.377	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	-32.2	177.7	-56.8	-176.8	0	0	0	112.2	E132 R134 Q139	L122-E132 HydrophobicContact CD1-CG 4.39Å; L122-E132 PolarHBondContact N-O 2.91Å; L122-R134 HydrophobicContact CD1-CB 4.16Å; L122-R134 HydrophobicContact CD2-CB 4.35Å; L122-R134 HydrophobicContact CG-CB 4.34Å; L122-Q139 HydrophobicContact CD1-CG 3.87Å
123	G	89.8	Confident	89.7	Confident	24 Å²	24	55.8 Å²	55.8	25%	0.247	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.8	-178.4	-178.6	0	0	0	0	0	112.1	S131 E132	G123-S131 WeakPolarHBondContact O-CA 3.36Å; G123-E132 PolarHBondContact O-N 3.08Å
124	Y	90.8	Very high	89.7	Confident	133 Å²	133	62 Å²	62	52%	0.522	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	156.4	-179.5	-60.5	-87	0	0	0	110.3	V121 W130 S131	V121-Y124 HydrophobicContact CG1-CE1 4.36Å; V121-Y124 HydrophobicContact CG1-CE2 4.18Å; Y124-W130 WeakPolarHBondContact CA-O 3.38Å; Y124-S131 WeakPolarHBondContact CD1-OG 3.5Å; Y124-S131 WeakPolarHBondContact CE1-OG 3.46Å
125	N	87.8	Confident	89.7	Confident	26 Å²	26	58.9 Å²	58.9	14%	0.139	30%	0.297	C	S	.	.			trans	-77.9	175.7	172.9	83.7	-34.1	0	0	0	110.7	S127 G128 E129 W130 W141 P261	N125-S127 PolarHBondContact ND2-OG 2.88Å; N125-S127 VanDerWaalsContact ND2-OG 3.08Å; N125-S127 PolarHBondContact O-N 3.04Å; N125-S127 VanDerWaalsContact O-N 3.12Å; N125-S127 PolarHBondContact OD1-OG 2.96Å; N125-G128 PolarHBondContact O-N 3.31Å; N125-G128 PolarHBondContact OD1-N 3.22Å; N125-E129 PolarHBondContact OD1-N 3.14Å; N125-E129 VanDerWaalsContact OD1-N 3.16Å; N125-W130 HydrophobicContact CB-CB 4.17Å; N125-W130 PolarHBondContact N-O 3.2Å; N125-W130 PolarHBondContact OD1-N 3.38Å; N125-W130 VanDerWaalsContact OD1-N 3.08Å; N125-W130 PolarHBondContact OD1-O 3.49Å; N125-W141 HydrophobicContact CB-CE3 4.41Å; N125-W141 HydrophobicContact CB-CH2 4.06Å; N125-W141 HydrophobicContact CB-CZ3 3.76Å; N125-W141 VanDerWaalsContact N-CZ3 3.32Å; N125-P261 PolarHBondContact ND2-O 3.04Å; N125-P261 VanDerWaalsContact ND2-O 3.07Å
126	Q	84.8	Confident	89.7	Confident	174 Å²	174	62.7 Å²	62.7	81%	0.813	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-27.9	-175.4	-68.2	177.8	-8.7	0	0	114.3
127	S	81	Confident	89.7	Confident	59 Å²	59	65.8 Å²	65.8	41%	0.413	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-7.2	178.2	56.4	0	0	0	0	114.4	N125 E129	N125-S127 PolarHBondContact ND2-OG 2.88Å; N125-S127 VanDerWaalsContact ND2-OG 3.08Å; N125-S127 PolarHBondContact O-N 3.04Å; N125-S127 VanDerWaalsContact O-N 3.12Å; N125-S127 PolarHBondContact OD1-OG 2.96Å; S127-E129 WeakPolarHBondContact CB-OE2 3.41Å; S127-E129 PolarHBondContact O-N 3.06Å; S127-E129 VanDerWaalsContact O-N 3.17Å; S127-E129 WeakPolarHBondContact OG-CG 3.36Å; S127-E129 PolarHBondContact OG-OE2 3.5Å
128	G	85.6	Confident	89.6	Confident	33 Å²	33	66 Å²	66	34%	0.34	33%	0.327	S	S	.	.	S	Bend	trans	72.3	-9.1	-171.5	0	0	0	0	0	114.9	N125 W130 S144	N125-G128 PolarHBondContact O-N 3.31Å; N125-G128 PolarHBondContact OD1-N 3.22Å; G128-W130 PolarHBondContact O-N 2.93Å; G128-S144 VanDerWaalsContact O-CB 3.27Å; G128-S144 WeakPolarHBondContact O-CB 3.24Å; G128-S144 PolarHBondContact O-OG 3.21Å
129	E	86.1	Confident	89.8	Confident	52 Å²	52	65.5 Å²	65.5	24%	0.243	33%	0.327	C	S	.	.	S	Bend	trans	-66.9	-24.7	-177.4	-64.5	168.1	131.5	0	0	112.8	N125 S127 S144 Y257 K325	N125-E129 PolarHBondContact OD1-N 3.14Å; N125-E129 VanDerWaalsContact OD1-N 3.16Å; S127-E129 WeakPolarHBondContact CB-OE2 3.41Å; S127-E129 PolarHBondContact O-N 3.06Å; S127-E129 VanDerWaalsContact O-N 3.17Å; S127-E129 WeakPolarHBondContact OG-CG 3.36Å; S127-E129 PolarHBondContact OG-OE2 3.5Å; E129-S144 PolarHBondContact O-N 3.39Å; E129-S144 PolarHBondContact O-OG 3.02Å; E129-Y257 WeakPolarHBondContact OE1-CD2 3.33Å; E129-K325 WeakPolarHBondContact OE1-CD 3.46Å; E129-K325 IonicContact OE1-NZ 3.68Å; E129-K325 PolarHBondContact OE1-NZ 2.79Å; E129-K325 IonicContact OE2-NZ 2.68Å; E129-K325 PolarHBondContact OE2-NZ 3.19Å
130	W	89.7	Confident	89.7	Confident	6 Å²	6	65.7 Å²	65.7	2%	0.023	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	140.2	177.3	-66.3	78.7	0	0	0	111.5	F103 T110 Y124 N125 G128 W141 V142 P143 S144 V256 S260 P261	F103-W130 HydrophobicContact CE1-CZ3 4.47Å; F103-W130 HydrophobicContact CE2-CH2 4.18Å; F103-W130 HydrophobicContact CE2-CZ3 4.3Å; F103-W130 AromaticContact CZ-CH2 3.95Å; F103-W130 HydrophobicContact CZ-CH2 3.95Å; F103-W130 AromaticContact CZ-CZ3 3.76Å; F103-W130 HydrophobicContact CZ-CZ3 3.76Å; T110-W130 HydrophobicContact CG2-CH2 4.34Å; T110-W130 HydrophobicContact CG2-CZ3 3.87Å; Y124-W130 WeakPolarHBondContact CA-O 3.38Å; N125-W130 HydrophobicContact CB-CB 4.17Å; N125-W130 PolarHBondContact N-O 3.2Å; N125-W130 PolarHBondContact OD1-N 3.38Å; N125-W130 VanDerWaalsContact OD1-N 3.08Å; N125-W130 PolarHBondContact OD1-O 3.49Å; G128-W130 PolarHBondContact O-N 2.93Å; W130-W141 HydrophobicContact CB-CE3 3.86Å; W130-W141 HydrophobicContact CB-CZ3 4.39Å; W130-W141 HydrophobicContact CE3-CB 4.12Å; W130-W141 WeakPolarHBondContact O-CZ3 3.37Å; W130-V142 WeakPolarHBondContact CA-O 3.33Å; W130-P143 HydrophobicContact CE3-CG 4.4Å; W130-P143 HydrophobicContact CH2-CG 4.2Å; W130-P143 HydrophobicContact CZ3-CG 4.06Å; W130-S144 WeakPolarHBondContact CA-OG 3.14Å; W130-S144 PolarHBondContact N-OG 3.23Å; W130-V256 HydrophobicContact CH2-CG1 4.2Å; W130-V256 HydrophobicContact CZ2-CG1 3.59Å; W130-S260 PolarHBondContact NE1-O 3.02Å; W130-P261 HydrophobicContact CB-CB 3.77Å; W130-P261 HydrophobicContact CD2-CB 3.86Å; W130-P261 HydrophobicContact CE3-CB 4.19Å; W130-P261 HydrophobicContact CG-CB 3.68Å
131	S	91.1	Very high	89.7	Confident	1 Å²	1	62 Å²	62	1%	0.007	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	133.6	176	-65.7	0	0	0	0	110	G123 Y124 W141 V142 S144	G123-S131 WeakPolarHBondContact O-CA 3.36Å; Y124-S131 WeakPolarHBondContact CD1-OG 3.5Å; Y124-S131 WeakPolarHBondContact CE1-OG 3.46Å; S131-W141 WeakPolarHBondContact O-CA 3.29Å; S131-V142 PolarHBondContact N-O 2.87Å; S131-V142 PolarHBondContact O-N 3.4Å; S131-S144 PolarHBondContact N-OG 3.33Å; S131-S144 WeakPolarHBondContact OG-CB 3.2Å; S131-S144 PolarHBondContact OG-OG 3.07Å
132	E	94.1	Very high	89.7	Confident	54 Å²	54	61.1 Å²	61.1	25%	0.252	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	121.7	165.1	-170.6	179.7	-162.1	0	0	107.9	L122 G123 Q139 W141	L122-E132 HydrophobicContact CD1-CG 4.39Å; L122-E132 PolarHBondContact N-O 2.91Å; G123-E132 PolarHBondContact O-N 3.08Å; E132-Q139 HydrophobicContact CG-CG 4.32Å; E132-Q139 PolarHBondContact OE1-NE2 3.03Å; E132-W141 HydrophobicContact CB-CD2 4.06Å; E132-W141 HydrophobicContact CB-CE3 4Å; E132-W141 HydrophobicContact CB-CH2 3.88Å; E132-W141 HydrophobicContact CB-CZ2 3.93Å; E132-W141 HydrophobicContact CB-CZ3 3.9Å; E132-W141 VanDerWaalsContact N-CE3 3.31Å; E132-W141 VanDerWaalsContact N-CZ3 3.31Å
133	V	93.4	Very high	89.7	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	151.2	-177	-66.6	0	0	0	0	111.4	L111 L119 R120 V121 Q139 G140 V142 I147	L111-V133 HydrophobicContact CD2-CG2 4.02Å; L119-V133 HydrophobicContact CB-CB 4.48Å; R120-V133 CarbonylContact O-C 3.59Å; R120-V133 WeakPolarHBondContact O-CA 3.47Å; V121-V133 HydrophobicContact CG2-CG1 4.03Å; V133-Q139 VanDerWaalsContact O-CA 3.29Å; V133-Q139 WeakPolarHBondContact O-CA 3.34Å; V133-G140 WeakPolarHBondContact CG2-O 3.41Å; V133-G140 PolarHBondContact N-O 2.78Å; V133-G140 PolarHBondContact O-N 2.67Å; V133-V142 HydrophobicContact CB-CG2 4.34Å; V133-V142 HydrophobicContact CG1-CG2 3.72Å; V133-V142 HydrophobicContact CG2-CB 4.28Å; V133-V142 HydrophobicContact CG2-CG1 3.68Å; V133-V142 HydrophobicContact CG2-CG2 3.63Å; V133-I147 HydrophobicContact CG1-CD1 3.94Å
134	R	93.3	Very high	89.7	Confident	135 Å²	135	57.8 Å²	57.8	51%	0.509	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	126	166.4	-169.9	175.9	-65.7	162.7	2	109.4	R120 L122 Q139	R120-R134 PolarHBondContact N-O 2.83Å; R120-R134 PolarHBondContact O-N 2.83Å; L122-R134 HydrophobicContact CD1-CB 4.16Å; L122-R134 HydrophobicContact CD2-CB 4.35Å; L122-R134 HydrophobicContact CG-CB 4.34Å; R134-Q139 HydrophobicContact CG-CB 4.47Å; R134-Q139 VanDerWaalsContact CZ-OE1 3.29Å
135	S	90.6	Very high	89.5	Confident	18 Å²	18	54.8 Å²	54.8	13%	0.126	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	-179.9	169.5	-173.4	0	0	0	0	110	E117 N137 G138	E117-S135 WeakPolarHBondContact OE1-CB 3.42Å; E117-S135 PolarHBondContact OE1-OG 3.17Å; S135-N137 PolarHBondContact O-N 3.06Å; S135-G138 PolarHBondContact N-O 2.88Å; S135-G138 PolarHBondContact O-N 2.96Å; S135-G138 VanDerWaalsContact O-O 3.08Å
136	K	88.1	Confident	89.6	Confident	206 Å²	206	54.5 Å²	54.5	90%	0.896	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-29.9	167.5	-60.5	177	-176.9	175.9	0	112.1
137	N	86.7	Confident	89.9	Confident	114 Å²	114	46.7 Å²	46.7	61%	0.61	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-11.2	-175.8	-63.1	-31.9	0	0	0	113.8	E117 S135	E117-N137 PolarHBondContact OE1-ND2 3.26Å; S135-N137 PolarHBondContact O-N 3.06Å
138	G	90	Very high	90.3	Very high	32 Å²	32	44.2 Å²	44.2	33%	0.33	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	144.8	-161.6	-178	0	0	0	0	0	113.5	S135	S135-G138 PolarHBondContact N-O 2.88Å; S135-G138 PolarHBondContact O-N 2.96Å; S135-G138 VanDerWaalsContact O-O 3.08Å
139	Q	93.6	Very high	90.3	Very high	89 Å²	89	44.9 Å²	44.9	42%	0.416	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	141	174.5	174.3	175.4	-34.8	0	0	109.3	L122 E132 V133 R134	L122-Q139 HydrophobicContact CD1-CG 3.87Å; E132-Q139 HydrophobicContact CG-CG 4.32Å; E132-Q139 PolarHBondContact OE1-NE2 3.03Å; V133-Q139 VanDerWaalsContact O-CA 3.29Å; V133-Q139 WeakPolarHBondContact O-CA 3.34Å; R134-Q139 HydrophobicContact CG-CB 4.47Å; R134-Q139 VanDerWaalsContact CZ-OE1 3.29Å
140	G	92.4	Very high	90.2	Very high	5 Å²	5	43.7 Å²	43.7	5%	0.052	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.6	-175.5	177.2	0	0	0	0	0	112.2	N109 V133	N109-G140 WeakPolarHBondContact O-CA 3.48Å; V133-G140 WeakPolarHBondContact CG2-O 3.41Å; V133-G140 PolarHBondContact N-O 2.78Å; V133-G140 PolarHBondContact O-N 2.67Å
141	W	92.3	Very high	89.7	Confident	51 Å²	51	48.1 Å²	48.1	19%	0.193	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	138.7	-175.6	-66.6	91.1	0	0	0	113	N109 T110 L111 N125 W130 S131 E132 P261	N109-W141 VanDerWaalsContact O-CD1 3.3Å; N109-W141 PolarHBondContact O-N 3.32Å; T110-W141 CarbonylContact C-O 3.49Å; T110-W141 WeakPolarHBondContact CA-O 3.44Å; T110-W141 WeakPolarHBondContact CB-O 3.27Å; T110-W141 HydrophobicContact CG2-CB 4.33Å; L111-W141 PolarHBondContact N-O 2.63Å; N125-W141 HydrophobicContact CB-CE3 4.41Å; N125-W141 HydrophobicContact CB-CH2 4.06Å; N125-W141 HydrophobicContact CB-CZ3 3.76Å; N125-W141 VanDerWaalsContact N-CZ3 3.32Å; W130-W141 HydrophobicContact CB-CE3 3.86Å; W130-W141 HydrophobicContact CB-CZ3 4.39Å; W130-W141 HydrophobicContact CE3-CB 4.12Å; W130-W141 WeakPolarHBondContact O-CZ3 3.37Å; S131-W141 WeakPolarHBondContact O-CA 3.29Å; E132-W141 HydrophobicContact CB-CD2 4.06Å; E132-W141 HydrophobicContact CB-CE3 4Å; E132-W141 HydrophobicContact CB-CH2 3.88Å; E132-W141 HydrophobicContact CB-CZ2 3.93Å; E132-W141 HydrophobicContact CB-CZ3 3.9Å; E132-W141 VanDerWaalsContact N-CE3 3.31Å; E132-W141 VanDerWaalsContact N-CZ3 3.31Å; W141-P261 HydrophobicContact CB-CB 3.98Å; W141-P261 HydrophobicContact CB-CG 3.75Å; W141-P261 HydrophobicContact CD2-CB 3.83Å; W141-P261 HydrophobicContact CD2-CG 4.12Å; W141-P261 HydrophobicContact CE3-CB 4.04Å; W141-P261 HydrophobicContact CG-CB 3.8Å; W141-P261 HydrophobicContact CG-CG 3.62Å
142	V	91.6	Very high	89.4	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	157.2	171.1	-59.5	0	0	0	0	110.2	F103 L111 I113 W130 S131 V133 S144 I147	F103-V142 HydrophobicContact CD1-CB 4.48Å; F103-V142 HydrophobicContact CD1-CG1 4.13Å; F103-V142 HydrophobicContact CE1-CG1 4.37Å; L111-V142 HydrophobicContact CB-CG1 4.24Å; L111-V142 WeakPolarHBondContact O-CG1 3.26Å; I113-V142 HydrophobicContact CD1-CB 4.11Å; I113-V142 HydrophobicContact CD1-CG1 3.94Å; I113-V142 HydrophobicContact CD1-CG2 4.33Å; I113-V142 HydrophobicContact CG1-CG1 4.1Å; I113-V142 HydrophobicContact CG2-CG1 4.04Å; W130-V142 WeakPolarHBondContact CA-O 3.33Å; S131-V142 PolarHBondContact N-O 2.87Å; S131-V142 PolarHBondContact O-N 3.4Å; V133-V142 HydrophobicContact CB-CG2 4.34Å; V133-V142 HydrophobicContact CG1-CG2 3.72Å; V133-V142 HydrophobicContact CG2-CB 4.28Å; V133-V142 HydrophobicContact CG2-CG1 3.68Å; V133-V142 HydrophobicContact CG2-CG2 3.63Å; V142-S144 PolarHBondContact O-N 2.99Å; V142-I147 HydrophobicContact CG2-CD1 4.35Å; V142-I147 HydrophobicContact CG2-CG2 4.08Å
143	P	90.6	Very high	88.9	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	130.5	173.5	-20.5	32.9	0	0	0	111	F103 W130 N145 Y146 V256	F103-P143 HydrophobicContact CD2-CG 3.87Å; F103-P143 HydrophobicContact CE2-CG 3.83Å; F103-P143 HydrophobicContact CZ-CG 4.44Å; W130-P143 HydrophobicContact CE3-CG 4.4Å; W130-P143 HydrophobicContact CH2-CG 4.2Å; W130-P143 HydrophobicContact CZ3-CG 4.06Å; P143-N145 VanDerWaalsContact CB-OD1 3.3Å; P143-N145 WeakPolarHBondContact CB-OD1 3.27Å; P143-N145 PolarHBondContact O-N 2.63Å; P143-Y146 HydrophobicContact CB-CD2 3.7Å; P143-Y146 HydrophobicContact CB-CE2 4.21Å; P143-Y146 HydrophobicContact CB-CG 4.14Å; P143-Y146 HydrophobicContact CG-CD2 4.05Å; P143-Y146 HydrophobicContact CG-CE2 4.27Å; P143-Y146 HydrophobicContact CG-CG 4.26Å; P143-Y146 WeakPolarHBondContact O-CB 3.25Å; P143-Y146 PolarHBondContact O-N 2.86Å; P143-V256 HydrophobicContact CB-CG1 4.35Å; P143-V256 HydrophobicContact CB-CG2 4Å; P143-V256 HydrophobicContact CG-CG1 4.03Å; P143-V256 HydrophobicContact CG-CG2 3.77Å
144	S	89.7	Confident	88.5	Confident	25 Å²	25	53 Å²	53	18%	0.175	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-63	-28.9	-177.4	-59.5	0	0	0	0	112.7	G128 E129 W130 S131 V142 Y146 I147	G128-S144 VanDerWaalsContact O-CB 3.27Å; G128-S144 WeakPolarHBondContact O-CB 3.24Å; G128-S144 PolarHBondContact O-OG 3.21Å; E129-S144 PolarHBondContact O-N 3.39Å; E129-S144 PolarHBondContact O-OG 3.02Å; W130-S144 WeakPolarHBondContact CA-OG 3.14Å; W130-S144 PolarHBondContact N-OG 3.23Å; S131-S144 PolarHBondContact N-OG 3.33Å; S131-S144 WeakPolarHBondContact OG-CB 3.2Å; S131-S144 PolarHBondContact OG-OG 3.07Å; V142-S144 PolarHBondContact O-N 2.99Å; S144-Y146 VanDerWaalsContact C-N 3.3Å; S144-Y146 PolarHBondContact O-N 3.35Å; S144-I147 WeakPolarHBondContact O-CG1 3.47Å
145	N	87.6	Confident	88	Confident	70 Å²	70	50.2 Å²	50.2	37%	0.374	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-79.9	-5	177.3	58.5	-2.6	0	0	0	114	P143 P254 T255	P143-N145 VanDerWaalsContact CB-OD1 3.3Å; P143-N145 WeakPolarHBondContact CB-OD1 3.27Å; P143-N145 PolarHBondContact O-N 2.63Å; N145-P254 HydrophobicContact CB-CB 4.13Å; N145-P254 VanDerWaalsContact ND2-CB 3.35Å; N145-P254 WeakPolarHBondContact ND2-CB 3.17Å; N145-T255 PolarHBondContact ND2-O 2.89Å; N145-T255 VanDerWaalsContact ND2-O 3.16Å
146	Y	89.4	Confident	87.8	Confident	21 Å²	21	50 Å²	50	8%	0.082	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-88.7	-5.9	173.4	-84.5	-132.5	0	0	0	113	L100 Y101 F103 P143 S144 K253 P254 V256	L100-Y146 PolarHBondContact N-O 2.8Å; Y101-Y146 HydrophobicContact CD2-CG 4.41Å; F103-Y146 HydrophobicContact CB-CD1 3.71Å; F103-Y146 HydrophobicContact CB-CE1 3.89Å; F103-Y146 HydrophobicContact CD2-CE1 4.24Å; P143-Y146 HydrophobicContact CB-CD2 3.7Å; P143-Y146 HydrophobicContact CB-CE2 4.21Å; P143-Y146 HydrophobicContact CB-CG 4.14Å; P143-Y146 HydrophobicContact CG-CD2 4.05Å; P143-Y146 HydrophobicContact CG-CE2 4.27Å; P143-Y146 HydrophobicContact CG-CG 4.26Å; P143-Y146 WeakPolarHBondContact O-CB 3.25Å; P143-Y146 PolarHBondContact O-N 2.86Å; S144-Y146 VanDerWaalsContact C-N 3.3Å; S144-Y146 PolarHBondContact O-N 3.35Å; Y146-K253 HydrophobicContact CE1-CD 4.23Å; Y146-P254 HydrophobicContact CD2-CB 4.33Å; Y146-P254 HydrophobicContact CD2-CG 4.27Å; Y146-P254 HydrophobicContact CE2-CB 4.15Å; Y146-P254 HydrophobicContact CE2-CG 4.33Å; Y146-P254 WeakPolarHBondContact CE2-O 3.14Å; Y146-V256 HydrophobicContact CD2-CG2 4.38Å; Y146-V256 HydrophobicContact CE2-CG2 3.52Å
147	I	90.6	Very high	87.8	Confident	10 Å²	10	43.1 Å²	43.1	5%	0.051	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	152.8	-173.8	67.6	171.3	0	0	0	110.3	F97 V98 I113 L119 V121 V133 V142 S144	F97-I147 HydrophobicContact CD1-CB 4.25Å; F97-I147 HydrophobicContact CD1-CD1 3.81Å; F97-I147 HydrophobicContact CD1-CG1 3.88Å; F97-I147 HydrophobicContact CE1-CD1 4.37Å; F97-I147 HydrophobicContact CE1-CG1 4.47Å; F97-I147 HydrophobicContact CG-CD1 4.35Å; V98-I147 WeakPolarHBondContact O-CA 3.42Å; I113-I147 HydrophobicContact CD1-CG2 3.84Å; L119-I147 HydrophobicContact CD1-CB 4.23Å; L119-I147 HydrophobicContact CD1-CG2 3.41Å; L119-I147 VanDerWaalsContact CD1-CG2 3.41Å; V121-I147 HydrophobicContact CG2-CD1 3.67Å; V133-I147 HydrophobicContact CG1-CD1 3.94Å; V142-I147 HydrophobicContact CG2-CD1 4.35Å; V142-I147 HydrophobicContact CG2-CG2 4.08Å; S144-I147 WeakPolarHBondContact O-CG1 3.47Å
148	T	89.3	Confident	88	Confident	7 Å²	7	37.7 Å²	37.7	4%	0.043	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	150.9	175.6	-171.5	0	0	0	0	111.1	F97 V98 L100 S152 E154 K155	F97-T148 CarbonylContact C-O 3.6Å; F97-T148 WeakPolarHBondContact CA-O 3.41Å; F97-T148 WeakPolarHBondContact CB-O 3.18Å; V98-T148 HydrophobicContact CG1-CG2 3.79Å; V98-T148 PolarHBondContact N-O 2.94Å; V98-T148 PolarHBondContact O-N 2.92Å; L100-T148 HydrophobicContact CD1-CG2 4.08Å; L100-T148 HydrophobicContact CD2-CG2 3.65Å; L100-T148 HydrophobicContact CG-CG2 3.88Å; T148-S152 WeakPolarHBondContact OG1-CB 3.29Å; T148-E154 HydrophobicContact CG2-CB 4.25Å; T148-K155 HydrophobicContact CG2-CB 4.16Å
149	P	87.3	Confident	88.1	Confident	46 Å²	46	36.7 Å²	36.7	30%	0.299	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.4	144	173.3	-25.9	34.9	0	0	0	112.4	F97 N151 S152	F97-P149 HydrophobicContact CD1-CG 4.31Å; F97-P149 HydrophobicContact CE1-CG 3.79Å; F97-P149 HydrophobicContact CE2-CG 4.39Å; F97-P149 HydrophobicContact CZ-CG 3.84Å; P149-N151 PolarHBondContact O-N 3.13Å; P149-S152 WeakPolarHBondContact O-CB 3.26Å; P149-S152 PolarHBondContact O-N 2.54Å
150	V	83.8	Confident	87.8	Confident	27 Å²	27	34 Å²	34	16%	0.164	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-19.7	-179.7	169.7	0	0	0	0	112.8	L96 V98 K155	L96-V150 HydrophobicContact CB-CG2 4.42Å; L96-V150 HydrophobicContact CD2-CG2 4.15Å; L96-V150 HydrophobicContact CG-CG2 3.93Å; L96-V150 WeakPolarHBondContact O-CG2 3Å; L96-V150 PolarHBondContact O-N 3.4Å; V98-V150 HydrophobicContact CB-CG2 4.24Å; V150-K155 WeakPolarHBondContact O-CD 3.32Å; V150-K155 PolarHBondContact O-NZ 2.85Å
151	N	78.6	Confident	87.7	Confident	100 Å²	100	33.9 Å²	33.9	54%	0.535	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-6.2	177.7	-62.9	-28.7	0	0	0	114.1	P149	P149-N151 PolarHBondContact O-N 3.13Å
152	S	84.3	Confident	87.4	Confident	36 Å²	36	36.7 Å²	36.7	25%	0.252	21%	0.207	S	C	.	.	S	Bend	trans	-71.9	163.8	178.7	-124	0	0	0	0	113.9	T148 P149 E154 K155	T148-S152 WeakPolarHBondContact OG1-CB 3.29Å; P149-S152 WeakPolarHBondContact O-CB 3.26Å; P149-S152 PolarHBondContact O-N 2.54Å; S152-E154 WeakPolarHBondContact CB-OE2 3.48Å; S152-E154 PolarHBondContact OG-OE2 2.83Å; S152-K155 WeakPolarHBondContact O-CD 3.41Å; S152-K155 WeakPolarHBondContact O-CE 3.27Å; S152-K155 WeakPolarHBondContact O-CG 3.33Å
153	L	84.6	Confident	87.2	Confident	60 Å²	60	38 Å²	38	31%	0.314	22%	0.215	S	C	.	.	S	Bend	trans	-77.8	-29.5	175.7	-69.9	179.3	0	0	0	112.8	K155 H156 Y159 L226	L153-K155 PolarHBondContact O-N 3.5Å; L153-H156 WeakPolarHBondContact O-CB 3.44Å; L153-H156 PolarHBondContact O-CD2 3.2Å; L153-H156 PolarHBondContact O-N 3.22Å; L153-Y159 HydrophobicContact CB-CD1 3.69Å; L153-Y159 HydrophobicContact CB-CD2 4.16Å; L153-Y159 HydrophobicContact CB-CE1 3.83Å; L153-Y159 HydrophobicContact CB-CE2 4.29Å; L153-Y159 HydrophobicContact CB-CG 3.86Å; L153-Y159 HydrophobicContact CD1-CD2 4.26Å; L153-Y159 HydrophobicContact CD1-CE1 4.5Å; L153-Y159 HydrophobicContact CD1-CE2 3.83Å; L153-Y159 WeakPolarHBondContact O-CB 3.49Å; L153-L226 HydrophobicContact CD1-CD2 3.96Å; L153-L226 HydrophobicContact CD2-CD2 4.12Å
154	E	85.3	Confident	87	Confident	62 Å²	62	38.6 Å²	38.6	29%	0.29	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-21.7	-173.3	-63	66.2	-137.2	0	0	113.4	L100 T148 S152 H156 Y159 K250	L100-E154 HydrophobicContact CD1-CB 4.32Å; L100-E154 WeakPolarHBondContact CD2-O 3.38Å; T148-E154 HydrophobicContact CG2-CB 4.25Å; S152-E154 WeakPolarHBondContact CB-OE2 3.48Å; S152-E154 PolarHBondContact OG-OE2 2.83Å; E154-H156 PolarHBondContact O-N 3Å; E154-Y159 HydrophobicContact CG-CD1 4.42Å; E154-Y159 HydrophobicContact CG-CE1 4.46Å; E154-Y159 WeakPolarHBondContact OE1-CE1 3.47Å; E154-K250 PolarHBondContact O-NZ 3.36Å
155	K	82.9	Confident	86.8	Confident	75 Å²	75	39.8 Å²	39.8	33%	0.326	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-26.6	173.4	78.1	-167.3	178.1	-159.9	0	113.1	V98 T148 V150 S152 L153	V98-K155 HydrophobicContact CG1-CB 4.11Å; T148-K155 HydrophobicContact CG2-CB 4.16Å; V150-K155 WeakPolarHBondContact O-CD 3.32Å; V150-K155 PolarHBondContact O-NZ 2.85Å; S152-K155 WeakPolarHBondContact O-CD 3.41Å; S152-K155 WeakPolarHBondContact O-CE 3.27Å; S152-K155 WeakPolarHBondContact O-CG 3.33Å; L153-K155 PolarHBondContact O-N 3.5Å
156	H	85.7	Confident	86.6	Confident	14 Å²	14	37.1 Å²	37.1	7%	0.065	21%	0.206	C	C	.	.	S	Bend	trans	-77.5	131.5	178.9	-63.8	-65.3	0	0	0	110	L153 E154 W158 Y159 K250	L153-H156 WeakPolarHBondContact O-CB 3.44Å; L153-H156 PolarHBondContact O-CD2 3.2Å; L153-H156 PolarHBondContact O-N 3.22Å; E154-H156 PolarHBondContact O-N 3Å; H156-W158 HydrophobicContact CB-CD2 3.87Å; H156-W158 HydrophobicContact CB-CE3 4.24Å; H156-W158 HydrophobicContact CB-CG 4.39Å; H156-W158 HydrophobicContact CB-CH2 4.14Å; H156-W158 HydrophobicContact CB-CZ2 3.77Å; H156-W158 HydrophobicContact CB-CZ3 4.36Å; H156-W158 AromaticContact CD2-CH2 3.91Å; H156-W158 AromaticContact CD2-CZ2 3.82Å; H156-W158 AromaticContact CG-CE2 3.86Å; H156-W158 AromaticContact CG-CH2 4Å; H156-W158 AromaticContact CG-CZ2 3.55Å; H156-W158 AromaticContact ND1-CZ2 3.9Å; H156-W158 PolarHBondContact O-N 3.4Å; H156-Y159 PolarHBondContact O-N 2.87Å; H156-Y159 VanDerWaalsContact O-N 3.14Å; H156-K250 PolarHBondContact O-NZ 2.91Å; H156-K250 VanDerWaalsContact O-NZ 3.09Å
157	S	87.1	Confident	86.5	Confident	62 Å²	62	36.8 Å²	36.8	43%	0.434	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-33.5	178.3	48.7	0	0	0	0	112.5	H160 K250	S157-H160 PolarHBondContact O-NE2 2.92Å; S157-K250 WeakPolarHBondContact O-CE 3.44Å
158	W	91.4	Very high	86.5	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-16.4	177.5	49.9	-108.4	0	0	0	114.5	W80 H156 H160 F180 L181 V182 L226 A227 V230 P247	W80-W158 AromaticContact CE2-CD1 3.84Å; W80-W158 AromaticContact CE2-NE1 3.56Å; W80-W158 AromaticContact CH2-NE1 3.97Å; W80-W158 AromaticContact CZ2-NE1 3.37Å; W80-W158 AromaticContact NE1-CD1 3.96Å; W80-W158 AromaticContact NE1-NE1 3.89Å; H156-W158 HydrophobicContact CB-CD2 3.87Å; H156-W158 HydrophobicContact CB-CE3 4.24Å; H156-W158 HydrophobicContact CB-CG 4.39Å; H156-W158 HydrophobicContact CB-CH2 4.14Å; H156-W158 HydrophobicContact CB-CZ2 3.77Å; H156-W158 HydrophobicContact CB-CZ3 4.36Å; H156-W158 AromaticContact CD2-CH2 3.91Å; H156-W158 AromaticContact CD2-CZ2 3.82Å; H156-W158 AromaticContact CG-CE2 3.86Å; H156-W158 AromaticContact CG-CH2 4Å; H156-W158 AromaticContact CG-CZ2 3.55Å; H156-W158 AromaticContact ND1-CZ2 3.9Å; H156-W158 PolarHBondContact O-N 3.4Å; W158-H160 PolarHBondContact O-N 3.41Å; W158-F180 HydrophobicContact CB-CD2 4.3Å; W158-F180 HydrophobicContact CB-CE2 3.48Å; W158-F180 VanDerWaalsContact CB-CE2 3.48Å; W158-F180 HydrophobicContact CB-CZ 3.71Å; W158-F180 AromaticContact CG-CE2 3.91Å; W158-F180 HydrophobicContact CG-CE2 3.91Å; W158-F180 HydrophobicContact CG-CZ 4.02Å; W158-L181 CarbonylContact O-C 3.6Å; W158-L181 WeakPolarHBondContact O-CA 3.37Å; W158-V182 HydrophobicContact CE3-CB 3.88Å; W158-V182 HydrophobicContact CE3-CG2 3.61Å; W158-V182 HydrophobicContact CZ3-CB 4.17Å; W158-V182 HydrophobicContact CZ3-CG2 4.03Å; W158-V182 PolarHBondContact O-N 3.34Å; W158-L226 HydrophobicContact CH2-CB 4.48Å; W158-L226 HydrophobicContact CH2-CD2 3.94Å; W158-L226 HydrophobicContact CH2-CG 3.84Å; W158-L226 HydrophobicContact CZ3-CD2 3.69Å; W158-L226 HydrophobicContact CZ3-CG 3.9Å; W158-A227 HydrophobicContact CZ2-CB 4.35Å; W158-V230 HydrophobicContact CD2-CG1 4.09Å; W158-V230 HydrophobicContact CD2-CG2 4.27Å; W158-V230 HydrophobicContact CE3-CG2 4.15Å; W158-V230 HydrophobicContact CG-CG1 4.21Å; W158-V230 HydrophobicContact CH2-CG2 4.1Å; W158-V230 HydrophobicContact CZ2-CB 4.19Å; W158-V230 HydrophobicContact CZ2-CG1 4.4Å; W158-V230 HydrophobicContact CZ2-CG2 4.18Å; W158-V230 HydrophobicContact CZ3-CG2 4.07Å; W158-P247 HydrophobicContact CB-CB 3.91Å; W158-P247 HydrophobicContact CB-CG 4.15Å
159	Y	91.4	Very high	86.5	Confident	11 Å²	11	36.9 Å²	36.9	4%	0.043	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	109	178.3	-172.3	-98.7	0	0	0	110.3	L153 E154 H156 G161 V182 E184 L192 L226 K250	L153-Y159 HydrophobicContact CB-CD1 3.69Å; L153-Y159 HydrophobicContact CB-CD2 4.16Å; L153-Y159 HydrophobicContact CB-CE1 3.83Å; L153-Y159 HydrophobicContact CB-CE2 4.29Å; L153-Y159 HydrophobicContact CB-CG 3.86Å; L153-Y159 HydrophobicContact CD1-CD2 4.26Å; L153-Y159 HydrophobicContact CD1-CE1 4.5Å; L153-Y159 HydrophobicContact CD1-CE2 3.83Å; L153-Y159 WeakPolarHBondContact O-CB 3.49Å; E154-Y159 HydrophobicContact CG-CD1 4.42Å; E154-Y159 HydrophobicContact CG-CE1 4.46Å; E154-Y159 WeakPolarHBondContact OE1-CE1 3.47Å; H156-Y159 PolarHBondContact O-N 2.87Å; H156-Y159 VanDerWaalsContact O-N 3.14Å; Y159-G161 VanDerWaalsContact CE1-CA 3.46Å; Y159-V182 HydrophobicContact CD2-CB 4.33Å; Y159-V182 HydrophobicContact CD2-CG1 4.23Å; Y159-E184 WeakPolarHBondContact OH-CG 3.32Å; Y159-E184 PolarHBondContact OH-OE1 2.9Å; Y159-L192 HydrophobicContact CE2-CD1 4.21Å; Y159-L192 HydrophobicContact CE2-CD2 4.03Å; Y159-L226 HydrophobicContact CD2-CD2 4.15Å; Y159-L226 HydrophobicContact CE2-CD2 4.37Å; Y159-K250 WeakPolarHBondContact O-CE 3.38Å; Y159-K250 PolarHBondContact O-NZ 2.97Å
160	H	89.1	Confident	86.5	Confident	31 Å²	31	35.6 Å²	35.6	14%	0.144	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	-7.8	-177.7	-78.9	-123.7	0	0	0	113.4	S157 W158 V163 V182 A248	S157-H160 PolarHBondContact O-NE2 2.92Å; W158-H160 PolarHBondContact O-N 3.41Å; H160-V163 HydrophobicContact CB-CB 4.41Å; H160-V163 HydrophobicContact CB-CG2 3.88Å; H160-V182 PolarHBondContact N-O 2.81Å; H160-A248 PolarHBondContact CE1-O 3.13Å; H160-A248 PolarHBondContact NE2-O 2.88Å
161	G	88.4	Confident	86.8	Confident	3 Å²	3	36.3 Å²	36.3	3%	0.031	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	72.7	-139.6	178.4	0	0	0	0	0	112.5	Y159 V163 R183 E184	Y159-G161 VanDerWaalsContact CE1-CA 3.46Å; G161-V163 VanDerWaalsContact C-N 3.29Å; G161-V163 PolarHBondContact O-N 3.34Å; G161-R183 CarbonylContact O-C 3.55Å; G161-R183 VanDerWaalsContact O-CA 3.27Å; G161-R183 WeakPolarHBondContact O-CA 3.34Å; G161-R183 WeakPolarHBondContact O-CB 3.48Å; G161-E184 PolarHBondContact O-N 2.91Å
162	P	86.8	Confident	87.3	Confident	111 Å²	111	31.5 Å²	31.5	72%	0.721	17%	0.174	S	C	*	.	S	Bend	trans	-75.1	79.4	179.9	32	-35.5	0	0	0	111.4
163	V	87.1	Confident	87.4	Confident	27 Å²	27	31.7 Å²	31.7	16%	0.164	18%	0.175	C	C	.	.			trans	-113.1	132.7	171.5	168.5	0	0	0	0	109.1	H160 G161 A167 A168 L171 R183	H160-V163 HydrophobicContact CB-CB 4.41Å; H160-V163 HydrophobicContact CB-CG2 3.88Å; G161-V163 VanDerWaalsContact C-N 3.29Å; G161-V163 PolarHBondContact O-N 3.34Å; V163-A167 HydrophobicContact CG1-CB 3.84Å; V163-A168 HydrophobicContact CG1-CB 4.22Å; V163-L171 HydrophobicContact CG1-CD1 4.01Å; V163-R183 HydrophobicContact CB-CB 4.23Å; V163-R183 WeakPolarHBondContact O-CD 3.38Å; V163-R183 PolarHBondContact O-NH1 3.07Å; V163-R183 VanDerWaalsContact O-NH1 3.13Å
164	S	85.9	Confident	87	Confident	13 Å²	13	33.2 Å²	33.2	9%	0.091	19%	0.191	C	C	.	.			trans	-71.4	165.8	-177.5	58.4	0	0	0	0	113.7	S166 A167 A168 E186 E525	S164-S166 VanDerWaalsContact C-N 3.32Å; S164-S166 PolarHBondContact OG-OG 3.18Å; S164-A167 PolarHBondContact O-N 2.74Å; S164-A167 VanDerWaalsContact OG-CB 3.22Å; S164-A167 WeakPolarHBondContact OG-CB 3.46Å; S164-A167 PolarHBondContact OG-N 3.09Å; S164-A168 VanDerWaalsContact O-CB 3.24Å; S164-A168 WeakPolarHBondContact O-CB 3.47Å; S164-A168 PolarHBondContact O-N 3.15Å; S164-E186 VanDerWaalsContact CA-OE1 3.28Å; S164-E186 WeakPolarHBondContact CA-OE1 3.39Å; S164-E186 WeakPolarHBondContact CA-OE2 3.45Å; S164-E186 WeakPolarHBondContact CB-OE1 3.39Å; S164-E525 WeakPolarHBondContact CB-OE1 3.43Å; S164-E525 VanDerWaalsContact CB-OE2 3.24Å; S164-E525 WeakPolarHBondContact CB-OE2 3.42Å; S164-E525 VanDerWaalsContact OG-CD 3.25Å; S164-E525 PolarHBondContact OG-OE1 2.8Å; S164-E525 PolarHBondContact OG-OE2 2.97Å; S164-E525 VanDerWaalsContact OG-OE2 3.13Å
165	R	86	Confident	87.1	Confident	49 Å²	49	31.5 Å²	31.5	19%	0.185	18%	0.184	C	C	.	.	H	α-helix	trans	-58.9	-47.1	174	-171.4	-163.9	169.7	136.6	-31.7	110.6	A168 E169 R183 E186 H204 F528 H529 S531	R165-A168 PolarHBondContact O-N 3.19Å; R165-E169 IonicContact CZ-OE1 3.82Å; R165-E169 IonicContact NE-OE1 2.77Å; R165-E169 PolarHBondContact NE-OE1 3.01Å; R165-E169 IonicContact NH2-OE1 3.65Å; R165-E169 WeakPolarHBondContact O-CG 3.19Å; R165-E169 PolarHBondContact O-N 2.79Å; R165-R183 VanDerWaalsContact N-NH1 3.18Å; R165-E186 PolarHBondContact N-OE2 3.19Å; R165-H204 WeakPolarHBondContact CG-CE1 3.24Å; R165-H204 WeakPolarHBondContact CG-NE2 3.38Å; R165-H204 PolarHBondContact NE-NE2 3.36Å; R165-F528 PolarHBondContact NE-O 3.4Å; R165-F528 PolarHBondContact NH2-O 3.09Å; R165-H529 PolarHBondContact NH1-O 2.93Å; R165-H529 PolarHBondContact NH2-O 3.2Å; R165-S531 PolarHBondContact NH2-O 3.08Å; R165-S531 VanDerWaalsContact NH2-O 3.12Å
166	S	84.4	Confident	87.5	Confident	14 Å²	14	31.3 Å²	31.3	10%	0.098	19%	0.185	C	C	.	.	H	α-helix	trans	-63.1	-45.8	-179.1	72.5	0	0	0	0	111.3	S164 A168 E169 Y170 E525	S164-S166 VanDerWaalsContact C-N 3.32Å; S164-S166 PolarHBondContact OG-OG 3.18Å; S166-A168 VanDerWaalsContact C-N 3.35Å; S166-A168 PolarHBondContact O-N 2.8Å; S166-E169 PolarHBondContact O-N 2.62Å; S166-Y170 PolarHBondContact O-N 2.81Å; S166-E525 WeakPolarHBondContact CB-OE2 3.27Å; S166-E525 PolarHBondContact OG-OE2 2.61Å
167	A	86.2	Confident	87.9	Confident	14 Å²	14	34 Å²	34	12%	0.116	20%	0.2	C	C	.	.	H	α-helix	trans	-66.1	-34.2	176.3	0	0	0	0	0	112.7	V163 S164 Y170 L171 Y373	V163-A167 HydrophobicContact CG1-CB 3.84Å; S164-A167 PolarHBondContact O-N 2.74Å; S164-A167 VanDerWaalsContact OG-CB 3.22Å; S164-A167 WeakPolarHBondContact OG-CB 3.46Å; S164-A167 PolarHBondContact OG-N 3.09Å; A167-Y170 PolarHBondContact O-N 3.37Å; A167-L171 WeakPolarHBondContact O-CB 3.43Å; A167-L171 VanDerWaalsContact O-CG 3.24Å; A167-L171 WeakPolarHBondContact O-CG 3.2Å; A167-L171 PolarHBondContact O-N 3.18Å; A167-Y373 HydrophobicContact CB-CD2 4.33Å; A167-Y373 HydrophobicContact CB-CE2 4.04Å
168	A	90.2	Very high	88.1	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-68.9	-37	174.7	0	0	0	0	0	112.7	V163 S164 R165 S166 L172 L181	V163-A168 HydrophobicContact CG1-CB 4.22Å; S164-A168 VanDerWaalsContact O-CB 3.24Å; S164-A168 WeakPolarHBondContact O-CB 3.47Å; S164-A168 PolarHBondContact O-N 3.15Å; R165-A168 PolarHBondContact O-N 3.19Å; S166-A168 VanDerWaalsContact C-N 3.35Å; S166-A168 PolarHBondContact O-N 2.8Å; A168-L172 WeakPolarHBondContact O-CB 3.16Å; A168-L172 VanDerWaalsContact O-CG 3.27Å; A168-L172 WeakPolarHBondContact O-CG 3.33Å; A168-L172 PolarHBondContact O-N 2.97Å; A168-L181 HydrophobicContact CB-CD1 4.01Å; A168-L181 HydrophobicContact CB-CD2 4.4Å
169	E	90.1	Very high	88.3	Confident	19 Å²	19	31.3 Å²	31.3	9%	0.089	18%	0.181	C	C	.	.	H	α-helix	trans	-64.6	-44.2	171.8	-71	176.3	-157	0	0	110.8	R165 S166 L172 S173 V202 H204 V369	R165-E169 IonicContact CZ-OE1 3.82Å; R165-E169 IonicContact NE-OE1 2.77Å; R165-E169 PolarHBondContact NE-OE1 3.01Å; R165-E169 IonicContact NH2-OE1 3.65Å; R165-E169 WeakPolarHBondContact O-CG 3.19Å; R165-E169 PolarHBondContact O-N 2.79Å; S166-E169 PolarHBondContact O-N 2.62Å; E169-L172 PolarHBondContact O-N 2.94Å; E169-S173 WeakPolarHBondContact O-CB 3.42Å; E169-S173 PolarHBondContact O-N 3.24Å; E169-V202 HydrophobicContact CG-CB 4.06Å; E169-V202 HydrophobicContact CG-CG1 3.95Å; E169-H204 WeakPolarHBondContact CG-NE2 3.48Å; E169-H204 IonicContact OE1-CD2 2.72Å; E169-H204 IonicContact OE1-CE1 3.38Å; E169-H204 IonicContact OE1-NE2 2.74Å; E169-H204 PolarHBondContact OE1-NE2 2.71Å; E169-V369 HydrophobicContact CB-CG1 4.38Å
170	Y	87.6	Confident	88.5	Confident	19 Å²	19	30.8 Å²	30.8	8%	0.075	18%	0.179	C	C	.	.	H	α-helix	trans	-60	-50.5	173.4	170.9	-108.3	0	0	0	113.1	S166 A167 L172 S173 V370 Y373 N405 H406	S166-Y170 PolarHBondContact O-N 2.81Å; A167-Y170 PolarHBondContact O-N 3.37Å; Y170-L172 PolarHBondContact O-N 2.98Å; Y170-L172 VanDerWaalsContact O-N 3.13Å; Y170-S173 VanDerWaalsContact O-CB 3.27Å; Y170-S173 WeakPolarHBondContact O-CB 3.42Å; Y170-S173 PolarHBondContact O-N 2.99Å; Y170-S173 PolarHBondContact O-OG 3.12Å; Y170-V370 HydrophobicContact CD2-CG2 4.18Å; Y170-V370 HydrophobicContact CE2-CG1 4.28Å; Y170-V370 HydrophobicContact CE2-CG2 4.12Å; Y170-Y373 AromaticContact CD1-CD1 3.46Å; Y170-Y373 HydrophobicContact CD1-CD1 3.46Å; Y170-Y373 VanDerWaalsContact CD1-CD1 3.46Å; Y170-Y373 AromaticContact CD1-CD2 3.81Å; Y170-Y373 HydrophobicContact CD1-CD2 3.81Å; Y170-Y373 AromaticContact CD1-CE1 3.42Å; Y170-Y373 HydrophobicContact CD1-CE1 3.42Å; Y170-Y373 VanDerWaalsContact CD1-CE1 3.42Å; Y170-Y373 AromaticContact CD1-CE2 3.78Å; Y170-Y373 HydrophobicContact CD1-CE2 3.78Å; Y170-Y373 AromaticContact CD1-CG 3.66Å; Y170-Y373 HydrophobicContact CD1-CG 3.66Å; Y170-Y373 AromaticContact CD1-CZ 3.59Å; Y170-Y373 HydrophobicContact CD2-CD1 4.11Å; Y170-Y373 HydrophobicContact CD2-CG 4.26Å; Y170-Y373 AromaticContact CE1-CD1 3.52Å; Y170-Y373 HydrophobicContact CE1-CD1 3.52Å; Y170-Y373 AromaticContact CE1-CE1 3.21Å; Y170-Y373 HydrophobicContact CE1-CE1 3.21Å; Y170-Y373 HydrophobicContact CE1-CE2 4.36Å; Y170-Y373 HydrophobicContact CE1-CG 4.21Å; Y170-Y373 AromaticContact CE1-CZ 3.69Å; Y170-Y373 HydrophobicContact CE2-CD1 4.18Å; Y170-Y373 AromaticContact CG-CD1 3.78Å; Y170-Y373 HydrophobicContact CG-CD1 3.78Å; Y170-Y373 HydrophobicContact CG-CD2 4.07Å; Y170-Y373 HydrophobicContact CG-CE1 4.22Å; Y170-Y373 HydrophobicContact CG-CE2 4.49Å; Y170-Y373 AromaticContact CG-CG 3.69Å; Y170-Y373 HydrophobicContact CG-CG 3.69Å; Y170-Y373 AromaticContact CZ-CD1 3.91Å; Y170-Y373 AromaticContact CZ-CE1 3.9Å; Y170-N405 PolarHBondContact OH-O 2.84Å; Y170-H406 HydrophobicContact CE2-CB 4.39Å; Y170-H406 AromaticContact CE2-ND1 3.67Å; Y170-H406 AromaticContact CZ-ND1 3.66Å; Y170-H406 WeakPolarHBondContact OH-CB 3.43Å; Y170-H406 PolarHBondContact OH-ND1 3.35Å
171	L	88.9	Confident	88.8	Confident	42 Å²	42	29.3 Å²	29.3	22%	0.22	17%	0.173	C	C	.	.	H	α-helix	trans	-61.1	-23.3	179.9	-75.2	169.4	0	0	0	113.6	V163 A167 L175 L181	V163-L171 HydrophobicContact CG1-CD1 4.01Å; A167-L171 WeakPolarHBondContact O-CB 3.43Å; A167-L171 VanDerWaalsContact O-CG 3.24Å; A167-L171 WeakPolarHBondContact O-CG 3.2Å; A167-L171 PolarHBondContact O-N 3.18Å; L171-L175 WeakPolarHBondContact O-CD1 3.39Å; L171-L181 HydrophobicContact CB-CD2 4.09Å; L171-L181 HydrophobicContact CD1-CD2 4.08Å
172	L	90.4	Very high	89.1	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-96.3	-12.7	175.8	-64.7	174.6	0	0	0	112.9	A168 E169 Y170 S174 L175 L181 R197 V202 A248	A168-L172 WeakPolarHBondContact O-CB 3.16Å; A168-L172 VanDerWaalsContact O-CG 3.27Å; A168-L172 WeakPolarHBondContact O-CG 3.33Å; A168-L172 PolarHBondContact O-N 2.97Å; E169-L172 PolarHBondContact O-N 2.94Å; Y170-L172 PolarHBondContact O-N 2.98Å; Y170-L172 VanDerWaalsContact O-N 3.13Å; L172-S174 VanDerWaalsContact C-N 3.28Å; L172-S174 PolarHBondContact O-N 3.22Å; L172-L175 HydrophobicContact CD2-CD1 4.09Å; L172-L175 PolarHBondContact O-N 3.17Å; L172-L181 HydrophobicContact CG-CD2 4.42Å; L172-R197 HydrophobicContact CB-CB 4.45Å; L172-R197 VanDerWaalsContact O-CD 3.32Å; L172-R197 WeakPolarHBondContact O-CD 3.45Å; L172-R197 PolarHBondContact O-NH1 3.15Å; L172-V202 HydrophobicContact CB-CG2 3.8Å; L172-V202 HydrophobicContact CD1-CG1 3.72Å; L172-V202 HydrophobicContact CD1-CG2 4.25Å; L172-A248 HydrophobicContact CD2-CB 3.93Å
173	S	84.9	Confident	89.4	Confident	40 Å²	40	24.4 Å²	24.4	28%	0.28	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-23.1	-170	69.2	0	0	0	0	115.5	E169 Y170 R197	E169-S173 WeakPolarHBondContact O-CB 3.42Å; E169-S173 PolarHBondContact O-N 3.24Å; Y170-S173 VanDerWaalsContact O-CB 3.27Å; Y170-S173 WeakPolarHBondContact O-CB 3.42Å; Y170-S173 PolarHBondContact O-N 2.99Å; Y170-S173 PolarHBondContact O-OG 3.12Å; S173-R197 PolarHBondContact O-NH1 3.29Å
174	S	77.4	Confident	89.5	Confident	91 Å²	91	26.5 Å²	26.5	64%	0.636	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.3	-0.3	177.9	57.3	0	0	0	0	114.9	L172	L172-S174 VanDerWaalsContact C-N 3.28Å; L172-S174 PolarHBondContact O-N 3.22Å
175	L	86.8	Confident	89.1	Confident	27 Å²	27	26.2 Å²	26.2	14%	0.141	15%	0.145	C	C	.	.	S	Bend	trans	-91.8	-160.6	-174	-54.1	-174.2	0	0	0	113.2	L171 L172 S179 R197 A248	L171-L175 WeakPolarHBondContact O-CD1 3.39Å; L172-L175 HydrophobicContact CD2-CD1 4.09Å; L172-L175 PolarHBondContact O-N 3.17Å; L175-S179 WeakPolarHBondContact CB-OG 3.46Å; L175-R197 PolarHBondContact O-NE 3.49Å; L175-R197 PolarHBondContact O-NH1 2.67Å; L175-R197 PolarHBondContact O-NH2 3.45Å; L175-A248 HydrophobicContact CD1-CB 4.01Å
176	I	91.8	Very high	88.3	Confident	70 Å²	70	27.3 Å²	27.3	36%	0.359	15%	0.152	S	C	.	.			trans	-116.1	171.2	-171.5	59.4	174.8	0	0	0	112.8	A77 G178 S179 R197 Y246	A77-I176 HydrophobicContact CB-CD1 4.31Å; I176-G178 PolarHBondContact O-N 3Å; I176-S179 WeakPolarHBondContact CG1-OG 3.45Å; I176-S179 PolarHBondContact N-OG 2.81Å; I176-S179 WeakPolarHBondContact O-CB 3.45Å; I176-S179 PolarHBondContact O-N 3.34Å; I176-S179 PolarHBondContact O-OG 2.93Å; I176-R197 WeakPolarHBondContact O-CD 3.42Å; I176-Y246 HydrophobicContact CD1-CD1 4.38Å; I176-Y246 HydrophobicContact CD1-CD2 3.58Å; I176-Y246 HydrophobicContact CD1-CE1 4.31Å; I176-Y246 HydrophobicContact CD1-CE2 3.5Å; I176-Y246 HydrophobicContact CD1-CG 4.04Å; I176-Y246 HydrophobicContact CG1-CD2 3.8Å; I176-Y246 HydrophobicContact CG1-CE2 4.12Å; I176-Y246 HydrophobicContact CG1-CG 4.36Å
177	N	93.5	Very high	87.4	Confident	72 Å²	72	30.5 Å²	30.5	39%	0.385	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	133.8	175.7	-73.5	6.2	0	0	0	110.5	S179 Y198 E199	N177-S179 VanDerWaalsContact C-N 3.29Å; N177-Y198 HydrophobicContact CB-CD2 4.33Å; N177-E199 PolarHBondContact ND2-N 3.34Å; N177-E199 PolarHBondContact OD1-N 2.93Å
178	G	91.3	Very high	86.5	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.6	6.1	-172	0	0	0	0	0	114.1	I176 R197 T243 H245 Y246	I176-G178 PolarHBondContact O-N 3Å; G178-R197 PolarHBondContact N-O 3.24Å; G178-T243 WeakPolarHBondContact CA-O 3.4Å; G178-H245 PolarHBondContact O-N 3.29Å; G178-Y246 PolarHBondContact O-N 3.36Å
179	S	95.6	Very high	85.3	Confident	5 Å²	5	37.5 Å²	37.5	4%	0.035	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	132.9	166.6	-68.3	0	0	0	0	111.1	L175 I176 N177 R197 Y246	L175-S179 WeakPolarHBondContact CB-OG 3.46Å; I176-S179 WeakPolarHBondContact CG1-OG 3.45Å; I176-S179 PolarHBondContact N-OG 2.81Å; I176-S179 WeakPolarHBondContact O-CB 3.45Å; I176-S179 PolarHBondContact O-N 3.34Å; I176-S179 PolarHBondContact O-OG 2.93Å; N177-S179 VanDerWaalsContact C-N 3.29Å; S179-R197 PolarHBondContact O-N 3Å; S179-Y246 CarbonylContact C-O 3.52Å; S179-Y246 WeakPolarHBondContact CA-O 3.22Å
180	F	96.5	Very high	84.4	Confident	0 Å²	0	40 Å²	40	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	160.3	-170.2	80.3	-79.2	0	0	0	114	W158 I194 S195 L196 V230 L244 Y246 P247 A248	W158-F180 HydrophobicContact CB-CD2 4.3Å; W158-F180 HydrophobicContact CB-CE2 3.48Å; W158-F180 VanDerWaalsContact CB-CE2 3.48Å; W158-F180 HydrophobicContact CB-CZ 3.71Å; W158-F180 AromaticContact CG-CE2 3.91Å; W158-F180 HydrophobicContact CG-CE2 3.91Å; W158-F180 HydrophobicContact CG-CZ 4.02Å; F180-I194 HydrophobicContact CD2-CG2 4.49Å; F180-S195 CarbonylContact C-O 3.6Å; F180-S195 WeakPolarHBondContact CA-O 3.48Å; F180-S195 WeakPolarHBondContact CB-O 3.5Å; F180-L196 HydrophobicContact CB-CD1 3.96Å; F180-V230 HydrophobicContact CE2-CG1 3.62Å; F180-V230 HydrophobicContact CZ-CG1 3.71Å; F180-L244 HydrophobicContact CB-CD2 3.85Å; F180-L244 HydrophobicContact CD1-CB 3.74Å; F180-L244 HydrophobicContact CD1-CD2 4.39Å; F180-L244 HydrophobicContact CD2-CB 4.08Å; F180-L244 HydrophobicContact CD2-CD1 4.08Å; F180-L244 HydrophobicContact CD2-CD2 3.97Å; F180-L244 HydrophobicContact CD2-CG 4.27Å; F180-L244 HydrophobicContact CE1-CB 3.7Å; F180-L244 HydrophobicContact CE2-CB 4.04Å; F180-L244 HydrophobicContact CE2-CD1 4.06Å; F180-L244 HydrophobicContact CE2-CG 4.48Å; F180-L244 HydrophobicContact CG-CB 3.94Å; F180-L244 HydrophobicContact CG-CD2 3.82Å; F180-L244 HydrophobicContact CG-CG 4.33Å; F180-L244 HydrophobicContact CZ-CB 3.85Å; F180-Y246 PolarHBondContact N-O 2.95Å; F180-P247 HydrophobicContact CE1-CG 3.96Å; F180-P247 HydrophobicContact CZ-CG 4.11Å; F180-P247 CarbonylContact O-C 3.53Å; F180-P247 WeakPolarHBondContact O-CA 3.05Å; F180-A248 PolarHBondContact O-N 2.92Å
181	L	95.2	Very high	84.2	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	160.9	166.9	60	84.2	0	0	0	111	W158 A168 L171 L172 R183 I194 S195 A248	W158-L181 CarbonylContact O-C 3.6Å; W158-L181 WeakPolarHBondContact O-CA 3.37Å; A168-L181 HydrophobicContact CB-CD1 4.01Å; A168-L181 HydrophobicContact CB-CD2 4.4Å; L171-L181 HydrophobicContact CB-CD2 4.09Å; L171-L181 HydrophobicContact CD1-CD2 4.08Å; L172-L181 HydrophobicContact CG-CD2 4.42Å; L181-R183 HydrophobicContact CD1-CB 3.98Å; L181-R183 HydrophobicContact CD1-CG 4.19Å; L181-I194 WeakPolarHBondContact O-CA 3.38Å; L181-S195 PolarHBondContact N-O 3.48Å; L181-S195 PolarHBondContact O-N 2.88Å; L181-A248 HydrophobicContact CB-CB 4.04Å; L181-A248 HydrophobicContact CD2-CB 3.9Å; L181-A248 HydrophobicContact CG-CB 4.47Å
182	V	94.5	Very high	84.3	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	131.8	170.8	-173.9	0	0	0	0	108.3	W158 Y159 H160 L192 S193 I194 I207 L226 V230	W158-V182 HydrophobicContact CE3-CB 3.88Å; W158-V182 HydrophobicContact CE3-CG2 3.61Å; W158-V182 HydrophobicContact CZ3-CB 4.17Å; W158-V182 HydrophobicContact CZ3-CG2 4.03Å; W158-V182 PolarHBondContact O-N 3.34Å; Y159-V182 HydrophobicContact CD2-CB 4.33Å; Y159-V182 HydrophobicContact CD2-CG1 4.23Å; H160-V182 PolarHBondContact N-O 2.81Å; V182-L192 HydrophobicContact CG1-CB 4.37Å; V182-L192 HydrophobicContact CG1-CD1 4.48Å; V182-S193 WeakPolarHBondContact CA-O 3.41Å; V182-I194 HydrophobicContact CG2-CG1 4.37Å; V182-I207 HydrophobicContact CG1-CD1 3.92Å; V182-L226 HydrophobicContact CG1-CD1 4.38Å; V182-L226 HydrophobicContact CG1-CD2 4.27Å; V182-V230 HydrophobicContact CG2-CG2 3.97Å
183	R	92.7	Very high	84.5	Confident	10 Å²	10	41.1 Å²	41.1	4%	0.038	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	164.5	-174.5	66.7	-165.9	-173.6	83.8	-1.3	111.1	G161 V163 R165 L181 E186 L192 S193 S195 H204	G161-R183 CarbonylContact O-C 3.55Å; G161-R183 VanDerWaalsContact O-CA 3.27Å; G161-R183 WeakPolarHBondContact O-CA 3.34Å; G161-R183 WeakPolarHBondContact O-CB 3.48Å; V163-R183 HydrophobicContact CB-CB 4.23Å; V163-R183 WeakPolarHBondContact O-CD 3.38Å; V163-R183 PolarHBondContact O-NH1 3.07Å; V163-R183 VanDerWaalsContact O-NH1 3.13Å; R165-R183 VanDerWaalsContact N-NH1 3.18Å; L181-R183 HydrophobicContact CD1-CB 3.98Å; L181-R183 HydrophobicContact CD1-CG 4.19Å; R183-E186 IonicContact CZ-OE2 2.85Å; R183-E186 IonicContact NH1-OE2 2.6Å; R183-E186 PolarHBondContact NH1-OE2 3.12Å; R183-L192 CarbonylContact O-C 3.55Å; R183-L192 WeakPolarHBondContact O-CA 3.32Å; R183-S193 PolarHBondContact N-O 2.92Å; R183-S193 PolarHBondContact O-N 2.8Å; R183-S195 PolarHBondContact NE-OG 3.49Å; R183-H204 PolarHBondContact NH2-ND1 3.33Å
184	E	89.5	Confident	85	Confident	71 Å²	71	39.2 Å²	39.2	33%	0.332	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	149	169.6	-68.8	168.7	-132.4	0	0	110.9	Y159 G161 L192	Y159-E184 WeakPolarHBondContact OH-CG 3.32Å; Y159-E184 PolarHBondContact OH-OE1 2.9Å; G161-E184 PolarHBondContact O-N 2.91Å; E184-L192 HydrophobicContact CB-CD2 4.34Å; E184-L192 HydrophobicContact CG-CD2 3.62Å
185	S	77.6	Confident	85.8	Confident	7 Å²	7	34.9 Å²	34.9	5%	0.049	21%	0.213	C	C	.	.			trans	-95.6	105.5	-173.5	-160.6	0	0	0	0	110.8	S187 S188 Q191	S185-S187 VanDerWaalsContact C-N 3.28Å; S185-S187 PolarHBondContact O-N 2.83Å; S185-S187 PolarHBondContact OG-OG 2.76Å; S185-S188 CarbonylContact O-C 3.54Å; S185-S188 PolarHBondContact O-N 3.16Å; S185-Q191 VanDerWaalsContact CB-O 3.28Å; S185-Q191 WeakPolarHBondContact CB-O 3.44Å; S185-Q191 PolarHBondContact N-O 3.06Å
186	E	69.9	Low	86.3	Confident	72 Å²	72	33.6 Å²	33.6	34%	0.336	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-43.7	179.5	-57.1	145.8	99	0	0	112.2	S164 R165 R183 S188	S164-E186 VanDerWaalsContact CA-OE1 3.28Å; S164-E186 WeakPolarHBondContact CA-OE1 3.39Å; S164-E186 WeakPolarHBondContact CA-OE2 3.45Å; S164-E186 WeakPolarHBondContact CB-OE1 3.39Å; R165-E186 PolarHBondContact N-OE2 3.19Å; R183-E186 IonicContact CZ-OE2 2.85Å; R183-E186 IonicContact NH1-OE2 2.6Å; R183-E186 PolarHBondContact NH1-OE2 3.12Å; E186-S188 PolarHBondContact O-N 2.82Å
187	S	64.7	Low	86.4	Confident	81 Å²	81	32.3 Å²	32.3	57%	0.566	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-2.7	177.3	57.6	0	0	0	0	114.4	S185	S185-S187 VanDerWaalsContact C-N 3.28Å; S185-S187 PolarHBondContact O-N 2.83Å; S185-S187 PolarHBondContact OG-OG 2.76Å
188	S	66.7	Low	86.4	Confident	36 Å²	36	31.8 Å²	31.8	25%	0.252	19%	0.19	S	C	.	.	S	Bend	trans	-159.6	78.7	179.5	-70.1	0	0	0	0	110.4	S185 E186 G190 Q191	S185-S188 CarbonylContact O-C 3.54Å; S185-S188 PolarHBondContact O-N 3.16Å; E186-S188 PolarHBondContact O-N 2.82Å; S188-G190 PolarHBondContact O-N 3.49Å; S188-Q191 WeakPolarHBondContact O-CB 3.4Å; S188-Q191 PolarHBondContact O-N 3.33Å
189	P	65.4	Low	86.4	Confident	126 Å²	126	38 Å²	38	82%	0.818	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.8	129.2	-178.7	-28.8	36.1	0	0	0	112.5
190	G	71.4	Confident	85.7	Confident	70 Å²	70	40.2 Å²	40.2	72%	0.722	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.7	8.4	-173	0	0	0	0	0	115.3	S188	S188-G190 PolarHBondContact O-N 3.49Å
191	Q	83.3	Confident	85.3	Confident	46 Å²	46	46.5 Å²	46.5	22%	0.215	27%	0.266	C	S	.	.			trans	-108.3	158.1	161.8	-63.8	-69.6	-98.6	0	0	110.6	S185 S188 T209	S185-Q191 VanDerWaalsContact CB-O 3.28Å; S185-Q191 WeakPolarHBondContact CB-O 3.44Å; S185-Q191 PolarHBondContact N-O 3.06Å; S188-Q191 WeakPolarHBondContact O-CB 3.4Å; S188-Q191 PolarHBondContact O-N 3.33Å; Q191-T209 PolarHBondContact NE2-OG1 3.26Å
192	L	92.2	Very high	85.1	Confident	32 Å²	32	48 Å²	48	17%	0.168	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	157.1	178.4	-60.4	-178.5	0	0	0	110.5	Y159 V182 R183 E184 I207 L226	Y159-L192 HydrophobicContact CE2-CD1 4.21Å; Y159-L192 HydrophobicContact CE2-CD2 4.03Å; V182-L192 HydrophobicContact CG1-CB 4.37Å; V182-L192 HydrophobicContact CG1-CD1 4.48Å; R183-L192 CarbonylContact O-C 3.55Å; R183-L192 WeakPolarHBondContact O-CA 3.32Å; E184-L192 HydrophobicContact CB-CD2 4.34Å; E184-L192 HydrophobicContact CG-CD2 3.62Å; L192-I207 HydrophobicContact CB-CB 4.21Å; L192-I207 HydrophobicContact CB-CD1 4.02Å; L192-I207 HydrophobicContact CB-CG1 4.37Å; L192-I207 WeakPolarHBondContact O-CB 3.35Å; L192-I207 PolarHBondContact O-N 2.8Å; L192-L226 HydrophobicContact CD1-CD1 4.08Å; L192-L226 HydrophobicContact CD1-CD2 3.51Å; L192-L226 HydrophobicContact CD1-CG 4.42Å
193	S	93.6	Very high	85.1	Confident	8 Å²	8	51.9 Å²	51.9	6%	0.056	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	145.1	173.7	-71.3	0	0	0	0	111.3	V182 R183 Y205	V182-S193 WeakPolarHBondContact CA-O 3.41Å; R183-S193 PolarHBondContact N-O 2.92Å; R183-S193 PolarHBondContact O-N 2.8Å; S193-Y205 CarbonylContact C-O 3.53Å; S193-Y205 VanDerWaalsContact CA-O 3.27Å; S193-Y205 WeakPolarHBondContact CA-O 3.47Å
194	I	95.3	Very high	85	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	128.8	167.4	-48	179.6	0	0	0	107.9	F180 L181 V182 H204 Y205 I207 V217 L229 L244	F180-I194 HydrophobicContact CD2-CG2 4.49Å; L181-I194 WeakPolarHBondContact O-CA 3.38Å; V182-I194 HydrophobicContact CG2-CG1 4.37Å; I194-H204 CarbonylContact O-C 3.58Å; I194-H204 WeakPolarHBondContact O-CA 3.31Å; I194-Y205 PolarHBondContact N-O 2.94Å; I194-Y205 PolarHBondContact O-N 3.39Å; I194-I207 HydrophobicContact CD1-CD1 4.26Å; I194-I207 HydrophobicContact CD1-CG1 4.34Å; I194-I207 HydrophobicContact CG1-CD1 3.7Å; I194-I207 HydrophobicContact CG1-CG1 3.82Å; I194-V217 HydrophobicContact CD1-CG2 3.96Å; I194-L229 HydrophobicContact CD1-CD2 3.94Å; I194-L244 HydrophobicContact CD1-CD1 4.24Å; I194-L244 HydrophobicContact CG2-CD1 4.45Å; I194-L244 HydrophobicContact CG2-CD2 3.97Å
195	S	95.3	Very high	85.1	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	127.5	166.8	-61.4	0	0	0	0	108.6	F180 L181 R183 Y203 H204	F180-S195 CarbonylContact C-O 3.6Å; F180-S195 WeakPolarHBondContact CA-O 3.48Å; F180-S195 WeakPolarHBondContact CB-O 3.5Å; L181-S195 PolarHBondContact N-O 3.48Å; L181-S195 PolarHBondContact O-N 2.88Å; R183-S195 PolarHBondContact NE-OG 3.49Å; S195-Y203 CarbonylContact C-O 3.6Å; S195-Y203 WeakPolarHBondContact CA-O 3.39Å; S195-H204 PolarHBondContact OG-CE1 3.39Å; S195-H204 PolarHBondContact OG-ND1 3.17Å
196	L	95.9	Very high	85.8	Confident	0 Å²	0	58 Å²	58	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	126.2	-167.8	170.7	60	0	0	0	111.2	F180 V202 Y203 Y205 L240 V241 T242 L244	F180-L196 HydrophobicContact CB-CD1 3.96Å; L196-V202 WeakPolarHBondContact O-CA 3.13Å; L196-Y203 PolarHBondContact N-O 2.66Å; L196-Y203 PolarHBondContact O-N 2.68Å; L196-Y205 HydrophobicContact CB-CE2 4.32Å; L196-Y205 HydrophobicContact CD2-CE2 4.14Å; L196-L240 HydrophobicContact CD2-CB 4.12Å; L196-L240 HydrophobicContact CD2-CD1 4.28Å; L196-V241 HydrophobicContact CD2-CG1 3.92Å; L196-V241 HydrophobicContact CG-CG1 4.34Å; L196-T242 HydrophobicContact CD1-CG2 3.85Å; L196-T242 HydrophobicContact CD2-CG2 4.03Å; L196-T242 HydrophobicContact CG-CG2 4.15Å; L196-L244 HydrophobicContact CD1-CD2 3.9Å; L196-L244 HydrophobicContact CD2-CD2 3.98Å; L196-L244 HydrophobicContact CG-CD2 4.37Å
197	R	94.2	Very high	86.9	Confident	42 Å²	42	54.8 Å²	54.8	16%	0.158	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	131.6	175	177.2	170.9	178.1	136.5	-3.2	112.6	L172 S173 L175 I176 G178 S179 R201	L172-R197 HydrophobicContact CB-CB 4.45Å; L172-R197 VanDerWaalsContact O-CD 3.32Å; L172-R197 WeakPolarHBondContact O-CD 3.45Å; L172-R197 PolarHBondContact O-NH1 3.15Å; S173-R197 PolarHBondContact O-NH1 3.29Å; L175-R197 PolarHBondContact O-NE 3.49Å; L175-R197 PolarHBondContact O-NH1 2.67Å; L175-R197 PolarHBondContact O-NH2 3.45Å; I176-R197 WeakPolarHBondContact O-CD 3.42Å; G178-R197 PolarHBondContact N-O 3.24Å; S179-R197 PolarHBondContact O-N 3Å; R197-R201 WeakPolarHBondContact CA-O 3.43Å
198	Y	94.3	Very high	88.1	Confident	61 Å²	61	52.3 Å²	52.3	24%	0.239	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	132.9	167.9	-173.6	-99.2	0	0	0	111.1	N177 G200 R201 V241 T242	N177-Y198 HydrophobicContact CB-CD2 4.33Å; Y198-G200 PolarHBondContact O-N 3.3Å; Y198-G200 VanDerWaalsContact O-N 3.17Å; Y198-R201 PolarHBondContact N-O 3.35Å; Y198-R201 PolarHBondContact O-N 3.34Å; Y198-R201 VanDerWaalsContact O-O 3.11Å; Y198-V241 HydrophobicContact CD1-CG2 3.56Å; Y198-V241 HydrophobicContact CE1-CG2 4.17Å; Y198-V241 HydrophobicContact CG-CG1 4.22Å; Y198-V241 HydrophobicContact CG-CG2 3.92Å; Y198-T242 HydrophobicContact CD2-CG2 3.72Å; Y198-T242 HydrophobicContact CG-CG2 4.34Å
199	E	90.1	Very high	89.3	Confident	131 Å²	131	54.1 Å²	54.1	61%	0.612	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	40.6	179	-72.8	175.3	-166.6	0	0	114	N177 R201	N177-E199 PolarHBondContact ND2-N 3.34Å; N177-E199 PolarHBondContact OD1-N 2.93Å; E199-R201 PolarHBondContact O-N 3.23Å
200	G	82	Confident	90.5	Very high	51 Å²	51	48.8 Å²	48.8	53%	0.526	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.1	-9.2	-179.9	0	0	0	0	0	115	Y198	Y198-G200 PolarHBondContact O-N 3.3Å; Y198-G200 VanDerWaalsContact O-N 3.17Å
201	R	87.5	Confident	91.3	Very high	132 Å²	132	53.2 Å²	53.2	50%	0.498	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	156.7	174	-68.8	168.9	167.6	-88.6	-9.2	110.7	R197 Y198 E199 Y203 E535	R197-R201 WeakPolarHBondContact CA-O 3.43Å; Y198-R201 PolarHBondContact N-O 3.35Å; Y198-R201 PolarHBondContact O-N 3.34Å; Y198-R201 VanDerWaalsContact O-O 3.11Å; E199-R201 PolarHBondContact O-N 3.23Å; R201-Y203 HydrophobicContact CB-CD2 4.43Å; R201-Y203 HydrophobicContact CB-CE2 3.72Å; R201-E535 IonicContact CZ-OE1 3.48Å; R201-E535 IonicContact NH1-OE1 2.91Å; R201-E535 PolarHBondContact NH1-OE1 3.43Å; R201-E535 IonicContact NH2-OE1 2.94Å; R201-E535 PolarHBondContact NH2-OE1 2.83Å
202	V	92.3	Very high	91.7	Very high	33 Å²	33	55.3 Å²	55.3	20%	0.2	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	126.4	173.9	175.9	0	0	0	0	109.1	E169 L172 L196	E169-V202 HydrophobicContact CG-CB 4.06Å; E169-V202 HydrophobicContact CG-CG1 3.95Å; L172-V202 HydrophobicContact CB-CG2 3.8Å; L172-V202 HydrophobicContact CD1-CG1 3.72Å; L172-V202 HydrophobicContact CD1-CG2 4.25Å; L196-V202 WeakPolarHBondContact O-CA 3.13Å
203	Y	92.6	Very high	91.4	Very high	81 Å²	81	56 Å²	56	32%	0.318	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	137.4	-178.4	-64.3	-100.3	0	0	0	109.3	S195 L196 R201 V241	S195-Y203 CarbonylContact C-O 3.6Å; S195-Y203 WeakPolarHBondContact CA-O 3.39Å; L196-Y203 PolarHBondContact N-O 2.66Å; L196-Y203 PolarHBondContact O-N 2.68Å; R201-Y203 HydrophobicContact CB-CD2 4.43Å; R201-Y203 HydrophobicContact CB-CE2 3.72Å; Y203-V241 HydrophobicContact CD1-CG1 4.49Å; Y203-V241 HydrophobicContact CD2-CG1 3.77Å; Y203-V241 HydrophobicContact CE2-CG1 4.15Å; Y203-V241 HydrophobicContact CE2-CG2 4.32Å; Y203-V241 HydrophobicContact CG-CG1 3.97Å
204	H	91.8	Very high	91.4	Very high	45 Å²	45	59.3 Å²	59.3	21%	0.208	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	126.9	179.9	-57.7	-93.8	0	0	0	110.6	R165 E169 R183 I194 S195	R165-H204 WeakPolarHBondContact CG-CE1 3.24Å; R165-H204 WeakPolarHBondContact CG-NE2 3.38Å; R165-H204 PolarHBondContact NE-NE2 3.36Å; E169-H204 WeakPolarHBondContact CG-NE2 3.48Å; E169-H204 IonicContact OE1-CD2 2.72Å; E169-H204 IonicContact OE1-CE1 3.38Å; E169-H204 IonicContact OE1-NE2 2.74Å; E169-H204 PolarHBondContact OE1-NE2 2.71Å; R183-H204 PolarHBondContact NH2-ND1 3.33Å; I194-H204 CarbonylContact O-C 3.58Å; I194-H204 WeakPolarHBondContact O-CA 3.31Å; S195-H204 PolarHBondContact OG-CE1 3.39Å; S195-H204 PolarHBondContact OG-ND1 3.17Å
205	Y	92.4	Very high	91.2	Very high	42 Å²	42	60.4 Å²	60.4	17%	0.165	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	121.1	-178.1	-58.7	-92.6	0	0	0	109.9	S193 I194 L196 I207 V217 L240 V241	S193-Y205 CarbonylContact C-O 3.53Å; S193-Y205 VanDerWaalsContact CA-O 3.27Å; S193-Y205 WeakPolarHBondContact CA-O 3.47Å; I194-Y205 PolarHBondContact N-O 2.94Å; I194-Y205 PolarHBondContact O-N 3.39Å; L196-Y205 HydrophobicContact CB-CE2 4.32Å; L196-Y205 HydrophobicContact CD2-CE2 4.14Å; Y205-I207 PolarHBondContact O-N 2.77Å; Y205-V217 HydrophobicContact CD1-CG1 4.39Å; Y205-L240 HydrophobicContact CD1-CD2 3.53Å; Y205-L240 HydrophobicContact CD2-CD2 3.66Å; Y205-L240 HydrophobicContact CE1-CD2 3.77Å; Y205-L240 HydrophobicContact CE2-CD2 3.87Å; Y205-L240 HydrophobicContact CG-CD2 3.48Å; Y205-L240 VanDerWaalsContact CG-CD2 3.48Å; Y205-V241 WeakPolarHBondContact OH-CB 3.5Å; Y205-V241 WeakPolarHBondContact OH-CG1 3.26Å; Y205-V241 PolarHBondContact OH-N 2.88Å
206	R	91.1	Very high	91.1	Very high	130 Å²	130	62.9 Å²	62.9	49%	0.491	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	128.6	175.8	-164.9	-179.8	74.1	-167.5	1.7	110.3	N208	R206-N208 VanDerWaalsContact CZ-OD1 3.32Å; R206-N208 PolarHBondContact NE-OD1 2.7Å; R206-N208 PolarHBondContact NH2-OD1 3.05Å; R206-N208 PolarHBondContact O-ND2 3.39Å
207	I	92.9	Very high	91	Very high	4 Å²	4	64.1 Å²	64.1	2%	0.021	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	118.6	170	-51.9	-176.4	0	0	0	107.4	V182 L192 I194 Y205 V215 V217 L226 L229	V182-I207 HydrophobicContact CG1-CD1 3.92Å; L192-I207 HydrophobicContact CB-CB 4.21Å; L192-I207 HydrophobicContact CB-CD1 4.02Å; L192-I207 HydrophobicContact CB-CG1 4.37Å; L192-I207 WeakPolarHBondContact O-CB 3.35Å; L192-I207 PolarHBondContact O-N 2.8Å; I194-I207 HydrophobicContact CD1-CD1 4.26Å; I194-I207 HydrophobicContact CD1-CG1 4.34Å; I194-I207 HydrophobicContact CG1-CD1 3.7Å; I194-I207 HydrophobicContact CG1-CG1 3.82Å; Y205-I207 PolarHBondContact O-N 2.77Å; I207-V215 HydrophobicContact CG2-CB 3.92Å; I207-V215 HydrophobicContact CG2-CG1 4.35Å; I207-V217 HydrophobicContact CG1-CG2 4.49Å; I207-L226 HydrophobicContact CD1-CD1 3.46Å; I207-L226 VanDerWaalsContact CD1-CD1 3.46Å; I207-L229 HydrophobicContact CD1-CD2 4.39Å; I207-L229 HydrophobicContact CG2-CD1 3.86Å
208	N	90.9	Very high	90.8	Very high	29 Å²	29	63.3 Å²	63.3	16%	0.155	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	143.9	-179.5	-56.4	-74.1	0	0	0	110.1	R206 V215 Y216	R206-N208 VanDerWaalsContact CZ-OD1 3.32Å; R206-N208 PolarHBondContact NE-OD1 2.7Å; R206-N208 PolarHBondContact NH2-OD1 3.05Å; R206-N208 PolarHBondContact O-ND2 3.39Å; N208-V215 WeakPolarHBondContact O-CA 3.42Å; N208-Y216 HydrophobicContact CB-CD1 4.14Å; N208-Y216 HydrophobicContact CB-CD2 4.23Å; N208-Y216 HydrophobicContact CB-CE1 3.65Å; N208-Y216 HydrophobicContact CB-CE2 3.79Å; N208-Y216 HydrophobicContact CB-CG 4.41Å; N208-Y216 VanDerWaalsContact CB-CZ 3.46Å; N208-Y216 PolarHBondContact N-O 2.89Å; N208-Y216 VanDerWaalsContact O-CD1 3.25Å; N208-Y216 WeakPolarHBondContact O-CD1 3.24Å; N208-Y216 PolarHBondContact O-N 3.06Å
209	T	90.5	Very high	90.5	Very high	73 Å²	73	63.5 Å²	63.5	45%	0.448	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	128.9	171	-42.7	0	0	0	0	110	Q191	Q191-T209 PolarHBondContact NE2-OG1 3.26Å
210	A	90.2	Very high	90.5	Very high	14 Å²	14	64.3 Å²	64.3	12%	0.116	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-82.3	165.2	174.4	0	0	0	0	0	111.8	D212 G213 K214 Y216	A210-D212 WeakPolarHBondContact CB-OD1 3.49Å; A210-D212 PolarHBondContact O-N 3.46Å; A210-G213 PolarHBondContact O-N 3.36Å; A210-K214 PolarHBondContact N-O 2.93Å; A210-Y216 HydrophobicContact CB-CD1 4.22Å; A210-Y216 HydrophobicContact CB-CE1 3.88Å
211	T	89.8	Confident	90.9	Very high	164 Å²	164	63 Å²	63	100%	1.006	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-16	-179.4	48.8	0	0	0	0	114.3
212	D	90.1	Very high	91.2	Very high	89 Å²	89	62.6 Å²	62.6	48%	0.476	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	11.7	172.1	69	-22.4	0	0	0	113	A210 K214	A210-D212 WeakPolarHBondContact CB-OD1 3.49Å; A210-D212 PolarHBondContact O-N 3.46Å; D212-K214 VanDerWaalsContact C-N 3.27Å; D212-K214 PolarHBondContact O-N 3.39Å; D212-K214 PolarHBondContact OD1-N 3.33Å; D212-K214 IonicContact OD2-NZ 2.74Å; D212-K214 PolarHBondContact OD2-NZ 3.08Å
213	G	87.3	Confident	91.2	Very high	48 Å²	48	62.6 Å²	62.6	50%	0.495	32%	0.324	S	S	.	.	S	Bend	trans	80.7	-6.1	179	0	0	0	0	0	115.1	A210	A210-G213 PolarHBondContact O-N 3.36Å
214	K	92	Very high	91.1	Very high	77 Å²	77	62 Å²	62	34%	0.335	34%	0.336	S	S	.	.			trans	-69.2	143.3	179.4	-67.9	-163.5	-172.6	80.6	0	112.2	A210 D212 R222 F223	A210-K214 PolarHBondContact N-O 2.93Å; D212-K214 VanDerWaalsContact C-N 3.27Å; D212-K214 PolarHBondContact O-N 3.39Å; D212-K214 PolarHBondContact OD1-N 3.33Å; D212-K214 IonicContact OD2-NZ 2.74Å; D212-K214 PolarHBondContact OD2-NZ 3.08Å; K214-R222 HydrophobicContact CB-CB 4.06Å; K214-R222 HydrophobicContact CD-CB 3.98Å; K214-F223 CarbonylContact C-O 3.56Å; K214-F223 WeakPolarHBondContact CA-O 3.33Å; K214-F223 VanDerWaalsContact CB-O 3.24Å; K214-F223 WeakPolarHBondContact CB-O 3.33Å
215	V	92.4	Very high	91	Very high	23 Å²	23	62.8 Å²	62.8	14%	0.139	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	143.9	175.3	-68.9	0	0	0	0	111.2	I207 N208 F223 L229	I207-V215 HydrophobicContact CG2-CB 3.92Å; I207-V215 HydrophobicContact CG2-CG1 4.35Å; N208-V215 WeakPolarHBondContact O-CA 3.42Å; V215-F223 HydrophobicContact CG2-CB 4.42Å; V215-F223 PolarHBondContact N-O 3.13Å; V215-F223 PolarHBondContact O-N 3.1Å; V215-L229 HydrophobicContact CB-CD1 4.02Å; V215-L229 HydrophobicContact CG2-CB 4.26Å; V215-L229 HydrophobicContact CG2-CD1 3.87Å
216	Y	93.4	Very high	90.9	Very high	52 Å²	52	61.5 Å²	61.5	20%	0.204	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	157.8	-178.7	67.7	-83	0	0	0	113.3	N208 A210 T218 S221 R222	N208-Y216 HydrophobicContact CB-CD1 4.14Å; N208-Y216 HydrophobicContact CB-CD2 4.23Å; N208-Y216 HydrophobicContact CB-CE1 3.65Å; N208-Y216 HydrophobicContact CB-CE2 3.79Å; N208-Y216 HydrophobicContact CB-CG 4.41Å; N208-Y216 VanDerWaalsContact CB-CZ 3.46Å; N208-Y216 PolarHBondContact N-O 2.89Å; N208-Y216 VanDerWaalsContact O-CD1 3.25Å; N208-Y216 WeakPolarHBondContact O-CD1 3.24Å; N208-Y216 PolarHBondContact O-N 3.06Å; A210-Y216 HydrophobicContact CB-CD1 4.22Å; A210-Y216 HydrophobicContact CB-CE1 3.88Å; Y216-T218 WeakPolarHBondContact CD2-O 3.47Å; Y216-S221 VanDerWaalsContact CB-O 3.28Å; Y216-S221 WeakPolarHBondContact CB-O 3.39Å; Y216-R222 HydrophobicContact CD1-CG 4.42Å; Y216-R222 HydrophobicContact CG-CG 4.22Å
217	V	92.8	Very high	90.8	Very high	25 Å²	25	56 Å²	56	15%	0.152	32%	0.322	C	S	.	.	S	Bend	trans	-105.9	-62.4	165.1	-179	0	0	0	0	108.7	I194 Y205 I207 L229 L240	I194-V217 HydrophobicContact CD1-CG2 3.96Å; Y205-V217 HydrophobicContact CD1-CG1 4.39Å; I207-V217 HydrophobicContact CG1-CG2 4.49Å; V217-L229 HydrophobicContact CG2-CD1 4.49Å; V217-L229 HydrophobicContact CG2-CD2 4.33Å; V217-L240 HydrophobicContact CG1-CD2 4.04Å
218	T	90	Very high	90.7	Very high	25 Å²	25	58.8 Å²	58.8	15%	0.153	34%	0.335	C	S	.	.	S	Bend	trans	-79	142.5	168.7	44.3	0	0	0	0	111.1	Y216 E220 S221 D238	Y216-T218 WeakPolarHBondContact CD2-O 3.47Å; T218-E220 PolarHBondContact O-N 3.22Å; T218-S221 PolarHBondContact O-N 2.91Å; T218-D238 VanDerWaalsContact CG2-O 3.22Å; T218-D238 WeakPolarHBondContact CG2-O 3.49Å; T218-D238 PolarHBondContact OG1-OD2 3.29Å
219	S	88.6	Confident	90.8	Very high	65 Å²	65	57.4 Å²	57.4	46%	0.455	33%	0.328	S	S	.	.	S	Bend	trans	-69.2	-18.6	-175.1	41.4	0	0	0	0	114.4	R222	S219-R222 PolarHBondContact O-NE 2.98Å; S219-R222 PolarHBondContact O-NH2 3.13Å
220	E	89.3	Confident	90.9	Very high	148 Å²	148	53.9 Å²	53.9	69%	0.692	31%	0.306	S	S	*	.	S	Bend	trans	-74.8	-41.7	175.4	-62.4	75	-166.5	0	0	112	T218	T218-E220 PolarHBondContact O-N 3.22Å
221	S	90.9	Very high	90.9	Very high	23 Å²	23	55.5 Å²	55.5	16%	0.161	31%	0.311	C	S	.	.			trans	-106.7	97.5	-168.2	-65.2	0	0	0	0	111.7	Y216 T218 F223 D238	Y216-S221 VanDerWaalsContact CB-O 3.28Å; Y216-S221 WeakPolarHBondContact CB-O 3.39Å; T218-S221 PolarHBondContact O-N 2.91Å; S221-F223 VanDerWaalsContact O-CE2 3.26Å; S221-F223 WeakPolarHBondContact O-CE2 3.33Å; S221-D238 WeakPolarHBondContact CB-OD2 3.21Å; S221-D238 PolarHBondContact OG-OD2 3.37Å
222	R	93.4	Very high	91	Very high	124 Å²	124	50 Å²	50	47%	0.468	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	133.2	-174.9	-44.5	-171.7	-168.6	176.6	2.4	112.2	K214 Y216 S219	K214-R222 HydrophobicContact CB-CB 4.06Å; K214-R222 HydrophobicContact CD-CB 3.98Å; Y216-R222 HydrophobicContact CD1-CG 4.42Å; Y216-R222 HydrophobicContact CG-CG 4.22Å; S219-R222 PolarHBondContact O-NE 2.98Å; S219-R222 PolarHBondContact O-NH2 3.13Å
223	F	93.1	Very high	91.2	Very high	33 Å²	33	45.7 Å²	45.7	15%	0.145	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	150.7	-169.3	-56	-78.5	0	0	0	111.7	K214 V215 S221 E228 L229 H232	K214-F223 CarbonylContact C-O 3.56Å; K214-F223 WeakPolarHBondContact CA-O 3.33Å; K214-F223 VanDerWaalsContact CB-O 3.24Å; K214-F223 WeakPolarHBondContact CB-O 3.33Å; V215-F223 HydrophobicContact CG2-CB 4.42Å; V215-F223 PolarHBondContact N-O 3.13Å; V215-F223 PolarHBondContact O-N 3.1Å; S221-F223 VanDerWaalsContact O-CE2 3.26Å; S221-F223 WeakPolarHBondContact O-CE2 3.33Å; F223-E228 HydrophobicContact CB-CB 3.81Å; F223-E228 HydrophobicContact CD1-CB 3.97Å; F223-E228 HydrophobicContact CG-CB 4.17Å; F223-L229 HydrophobicContact CB-CB 4.11Å; F223-L229 HydrophobicContact CD2-CB 3.63Å; F223-L229 HydrophobicContact CD2-CD1 4.17Å; F223-L229 HydrophobicContact CD2-CG 3.86Å; F223-L229 HydrophobicContact CE2-CB 4.41Å; F223-L229 HydrophobicContact CE2-CG 4.35Å; F223-L229 HydrophobicContact CG-CB 4.01Å; F223-H232 HydrophobicContact CE1-CB 3.67Å; F223-H232 AromaticContact CE1-CG 3.88Å; F223-H232 HydrophobicContact CE2-CB 4.18Å; F223-H232 AromaticContact CE2-CD2 3.99Å; F223-H232 HydrophobicContact CZ-CB 3.45Å; F223-H232 VanDerWaalsContact CZ-CB 3.45Å; F223-H232 AromaticContact CZ-CD2 3.46Å; F223-H232 VanDerWaalsContact CZ-CD2 3.46Å; F223-H232 WeakPolarHBondContact CZ-CD2 3.2Å; F223-H232 AromaticContact CZ-CG 3.31Å; F223-H232 AromaticContact CZ-ND1 3.81Å; F223-H232 AromaticContact CZ-NE2 3.97Å
224	A	90.4	Very high	91.4	Very high	69 Å²	69	43.8 Å²	43.8	57%	0.57	23%	0.23	S	C	*	.	S	Bend	trans	-76.5	-27.3	178.4	0	0	0	0	0	111.8	E228	A224-E228 WeakPolarHBondContact CB-OE2 3.43Å; A224-E228 PolarHBondContact N-OE2 2.65Å
225	T	89.2	Confident	91.4	Very high	62 Å²	62	44.4 Å²	44.4	38%	0.38	24%	0.24	S	C	.	.	S	Bend	trans	-130.8	156.4	177.2	67.7	0	0	0	0	113.1	A227 E228 L229	T225-A227 PolarHBondContact O-N 3.13Å; T225-E228 WeakPolarHBondContact CB-OE1 3.33Å; T225-E228 VanDerWaalsContact CG2-OE1 3.32Å; T225-E228 WeakPolarHBondContact CG2-OE1 3.48Å; T225-E228 PolarHBondContact N-OE1 2.96Å; T225-E228 PolarHBondContact N-OE2 3.42Å; T225-E228 PolarHBondContact O-N 3.23Å; T225-E228 WeakPolarHBondContact OG1-CG 3.27Å; T225-E228 PolarHBondContact OG1-N 2.84Å; T225-E228 PolarHBondContact OG1-OE1 2.93Å; T225-L229 PolarHBondContact O-N 2.98Å
226	L	90.4	Very high	91.3	Very high	15 Å²	15	46.3 Å²	46.3	8%	0.079	25%	0.252	C	S	.	.	H	α-helix	trans	-61.2	-32.2	172.6	-174.3	65.1	0	0	0	112.3	L153 W158 Y159 V182 L192 I207 L229 V230	L153-L226 HydrophobicContact CD1-CD2 3.96Å; L153-L226 HydrophobicContact CD2-CD2 4.12Å; W158-L226 HydrophobicContact CH2-CB 4.48Å; W158-L226 HydrophobicContact CH2-CD2 3.94Å; W158-L226 HydrophobicContact CH2-CG 3.84Å; W158-L226 HydrophobicContact CZ3-CD2 3.69Å; W158-L226 HydrophobicContact CZ3-CG 3.9Å; Y159-L226 HydrophobicContact CD2-CD2 4.15Å; Y159-L226 HydrophobicContact CE2-CD2 4.37Å; V182-L226 HydrophobicContact CG1-CD1 4.38Å; V182-L226 HydrophobicContact CG1-CD2 4.27Å; L192-L226 HydrophobicContact CD1-CD1 4.08Å; L192-L226 HydrophobicContact CD1-CD2 3.51Å; L192-L226 HydrophobicContact CD1-CG 4.42Å; I207-L226 HydrophobicContact CD1-CD1 3.46Å; I207-L226 VanDerWaalsContact CD1-CD1 3.46Å; L226-L229 PolarHBondContact O-N 2.88Å; L226-V230 WeakPolarHBondContact O-CG2 3.28Å; L226-V230 PolarHBondContact O-N 3.47Å
227	A	89	Confident	91.2	Very high	14 Å²	14	46.5 Å²	46.5	12%	0.116	26%	0.259	C	S	.	.	H	α-helix	trans	-69.7	-36.6	178.1	0	0	0	0	0	112.6	W158 T225 H231	W158-A227 HydrophobicContact CZ2-CB 4.35Å; T225-A227 PolarHBondContact O-N 3.13Å; A227-H231 VanDerWaalsContact O-CB 3.29Å; A227-H231 WeakPolarHBondContact O-CB 3.44Å; A227-H231 PolarHBondContact O-N 3.39Å
228	E	90.2	Very high	91.2	Very high	62 Å²	62	47.8 Å²	47.8	29%	0.29	27%	0.265	S	S	.	.	H	α-helix	trans	-63.4	-45.2	170.2	-74.8	151	-127.2	0	0	111.8	L86 F223 A224 T225 H231 H232	L86-E228 HydrophobicContact CD2-CG 3.98Å; F223-E228 HydrophobicContact CB-CB 3.81Å; F223-E228 HydrophobicContact CD1-CB 3.97Å; F223-E228 HydrophobicContact CG-CB 4.17Å; A224-E228 WeakPolarHBondContact CB-OE2 3.43Å; A224-E228 PolarHBondContact N-OE2 2.65Å; T225-E228 WeakPolarHBondContact CB-OE1 3.33Å; T225-E228 VanDerWaalsContact CG2-OE1 3.32Å; T225-E228 WeakPolarHBondContact CG2-OE1 3.48Å; T225-E228 PolarHBondContact N-OE1 2.96Å; T225-E228 PolarHBondContact N-OE2 3.42Å; T225-E228 PolarHBondContact O-N 3.23Å; T225-E228 WeakPolarHBondContact OG1-CG 3.27Å; T225-E228 PolarHBondContact OG1-N 2.84Å; T225-E228 PolarHBondContact OG1-OE1 2.93Å; E228-H231 WeakPolarHBondContact O-CB 3.48Å; E228-H231 PolarHBondContact O-N 3.45Å; E228-H231 VanDerWaalsContact O-N 3.13Å; E228-H232 PolarHBondContact O-N 3.1Å
229	L	93.9	Very high	91.2	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-58.8	-50.2	178.2	-176.4	155	0	0	0	111.2	I194 I207 V215 V217 F223 T225 L226 H231 H232 H233	I194-L229 HydrophobicContact CD1-CD2 3.94Å; I207-L229 HydrophobicContact CD1-CD2 4.39Å; I207-L229 HydrophobicContact CG2-CD1 3.86Å; V215-L229 HydrophobicContact CB-CD1 4.02Å; V215-L229 HydrophobicContact CG2-CB 4.26Å; V215-L229 HydrophobicContact CG2-CD1 3.87Å; V217-L229 HydrophobicContact CG2-CD1 4.49Å; V217-L229 HydrophobicContact CG2-CD2 4.33Å; F223-L229 HydrophobicContact CB-CB 4.11Å; F223-L229 HydrophobicContact CD2-CB 3.63Å; F223-L229 HydrophobicContact CD2-CD1 4.17Å; F223-L229 HydrophobicContact CD2-CG 3.86Å; F223-L229 HydrophobicContact CE2-CB 4.41Å; F223-L229 HydrophobicContact CE2-CG 4.35Å; F223-L229 HydrophobicContact CG-CB 4.01Å; T225-L229 PolarHBondContact O-N 2.98Å; L226-L229 PolarHBondContact O-N 2.88Å; L229-H231 VanDerWaalsContact C-N 3.27Å; L229-H231 PolarHBondContact O-N 3.31Å; L229-H232 PolarHBondContact O-N 2.94Å; L229-H233 PolarHBondContact O-CD2 3.45Å; L229-H233 PolarHBondContact O-N 3.29Å; L229-H233 VanDerWaalsContact O-N 3.07Å
230	V	93.1	Very high	91.5	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-64.7	-33.7	176.6	177.1	0	0	0	0	111	W80 W158 F180 V182 L226 S234 L244	W80-V230 HydrophobicContact CE3-CG1 4.36Å; W80-V230 HydrophobicContact CH2-CB 4.35Å; W80-V230 HydrophobicContact CH2-CG1 3.87Å; W80-V230 HydrophobicContact CZ3-CG1 3.73Å; W158-V230 HydrophobicContact CD2-CG1 4.09Å; W158-V230 HydrophobicContact CD2-CG2 4.27Å; W158-V230 HydrophobicContact CE3-CG2 4.15Å; W158-V230 HydrophobicContact CG-CG1 4.21Å; W158-V230 HydrophobicContact CH2-CG2 4.1Å; W158-V230 HydrophobicContact CZ2-CB 4.19Å; W158-V230 HydrophobicContact CZ2-CG1 4.4Å; W158-V230 HydrophobicContact CZ2-CG2 4.18Å; W158-V230 HydrophobicContact CZ3-CG2 4.07Å; F180-V230 HydrophobicContact CE2-CG1 3.62Å; F180-V230 HydrophobicContact CZ-CG1 3.71Å; V182-V230 HydrophobicContact CG2-CG2 3.97Å; L226-V230 WeakPolarHBondContact O-CG2 3.28Å; L226-V230 PolarHBondContact O-N 3.47Å; V230-S234 WeakPolarHBondContact O-CB 3.28Å; V230-S234 PolarHBondContact O-N 2.98Å; V230-L244 HydrophobicContact CG1-CD1 4.16Å
231	H	90.3	Very high	91.8	Very high	47 Å²	47	42.2 Å²	42.2	22%	0.218	25%	0.25	C	S	.	.	H	α-helix	trans	-64.4	-48.1	174.3	-169	53.6	0	0	0	112.8	W80 L86 A227 E228 L229 S234	W80-H231 HydrophobicContact CH2-CB 4.1Å; W80-H231 HydrophobicContact CZ3-CB 4.37Å; L86-H231 HydrophobicContact CD2-CB 4.49Å; A227-H231 VanDerWaalsContact O-CB 3.29Å; A227-H231 WeakPolarHBondContact O-CB 3.44Å; A227-H231 PolarHBondContact O-N 3.39Å; E228-H231 WeakPolarHBondContact O-CB 3.48Å; E228-H231 PolarHBondContact O-N 3.45Å; E228-H231 VanDerWaalsContact O-N 3.13Å; L229-H231 VanDerWaalsContact C-N 3.27Å; L229-H231 PolarHBondContact O-N 3.31Å; H231-S234 PolarHBondContact O-N 3.28Å; H231-S234 PolarHBondContact O-OG 2.87Å
232	H	92	Very high	92.1	Very high	48 Å²	48	42.4 Å²	42.4	22%	0.222	25%	0.25	C	S	.	.	H	α-helix	trans	-55.9	-55.5	175.7	176.9	81.2	0	0	0	111.3	F223 E228 L229 S234 T235 V236 D238	F223-H232 HydrophobicContact CE1-CB 3.67Å; F223-H232 AromaticContact CE1-CG 3.88Å; F223-H232 HydrophobicContact CE2-CB 4.18Å; F223-H232 AromaticContact CE2-CD2 3.99Å; F223-H232 HydrophobicContact CZ-CB 3.45Å; F223-H232 VanDerWaalsContact CZ-CB 3.45Å; F223-H232 AromaticContact CZ-CD2 3.46Å; F223-H232 VanDerWaalsContact CZ-CD2 3.46Å; F223-H232 WeakPolarHBondContact CZ-CD2 3.2Å; F223-H232 AromaticContact CZ-CG 3.31Å; F223-H232 AromaticContact CZ-ND1 3.81Å; F223-H232 AromaticContact CZ-NE2 3.97Å; E228-H232 PolarHBondContact O-N 3.1Å; L229-H232 PolarHBondContact O-N 2.94Å; H232-S234 PolarHBondContact O-N 3.24Å; H232-S234 VanDerWaalsContact O-N 3.15Å; H232-T235 PolarHBondContact O-N 3.49Å; H232-T235 PolarHBondContact O-OG1 3.14Å; H232-V236 PolarHBondContact O-N 3.26Å; H232-V236 VanDerWaalsContact O-N 3.15Å; H232-D238 IonicContact CD2-OD2 2.68Å; H232-D238 IonicContact CE1-OD2 3.55Å; H232-D238 IonicContact NE2-OD2 2.73Å; H232-D238 PolarHBondContact NE2-OD2 2.8Å
233	H	93.5	Very high	92.1	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-68.6	-12.3	-179	-68.3	-70.4	0	0	0	114.3	L229 T235 V236 P237 D238 L240 T243 L244	L229-H233 PolarHBondContact O-CD2 3.45Å; L229-H233 PolarHBondContact O-N 3.29Å; L229-H233 VanDerWaalsContact O-N 3.07Å; H233-T235 VanDerWaalsContact C-N 3.31Å; H233-V236 CarbonylContact C-O 3.53Å; H233-V236 VanDerWaalsContact CA-O 3.27Å; H233-V236 WeakPolarHBondContact CA-O 3.36Å; H233-P237 PolarHBondContact ND1-O 2.78Å; H233-D238 PolarHBondContact CE1-O 3.14Å; H233-D238 VanDerWaalsContact CE1-O 3.27Å; H233-L240 HydrophobicContact CB-CD1 3.7Å; H233-T243 WeakPolarHBondContact O-CA 3.47Å; H233-L244 HydrophobicContact CB-CD1 3.58Å; H233-L244 HydrophobicContact CB-CG 3.83Å; H233-L244 PolarHBondContact O-N 3.37Å
234	S	92.2	Very high	92.2	Very high	8 Å²	8	35.7 Å²	35.7	6%	0.056	23%	0.226	C	C	.	.	H	α-helix	trans	-75.8	-17.6	168.4	76	0	0	0	0	113.8	V230 H231 H232 L244	V230-S234 WeakPolarHBondContact O-CB 3.28Å; V230-S234 PolarHBondContact O-N 2.98Å; H231-S234 PolarHBondContact O-N 3.28Å; H231-S234 PolarHBondContact O-OG 2.87Å; H232-S234 PolarHBondContact O-N 3.24Å; H232-S234 VanDerWaalsContact O-N 3.15Å; S234-L244 WeakPolarHBondContact CA-O 3.46Å; S234-L244 WeakPolarHBondContact CB-O 3.45Å
235	T	90.8	Very high	92.2	Very high	90 Å²	90	34.2 Å²	34.2	55%	0.552	21%	0.207	S	C	*	.	H	α-helix	trans	-107.1	-34	-176.9	66.1	0	0	0	0	113.7	H232 H233	H232-T235 PolarHBondContact O-N 3.49Å; H232-T235 PolarHBondContact O-OG1 3.14Å; H233-T235 VanDerWaalsContact C-N 3.31Å
236	V	91.9	Very high	92.3	Very high	62 Å²	62	34.1 Å²	34.1	38%	0.376	20%	0.2	S	C	.	.			trans	-136.3	143.4	176.9	-69.7	0	0	0	0	109.7	H232 H233 D238	H232-V236 PolarHBondContact O-N 3.26Å; H232-V236 VanDerWaalsContact O-N 3.15Å; H233-V236 CarbonylContact C-O 3.53Å; H233-V236 VanDerWaalsContact CA-O 3.27Å; H233-V236 WeakPolarHBondContact CA-O 3.36Å; V236-D238 HydrophobicContact CG2-CB 4.11Å
237	P	91.1	Very high	92.4	Very high	56 Å²	56	34.5 Å²	34.5	36%	0.364	20%	0.203	S	C	.	.			trans	-65	-44.8	-179.7	-20.1	31.4	0	0	0	112.2	H233 L240 T243	H233-P237 PolarHBondContact ND1-O 2.78Å; P237-L240 VanDerWaalsContact CB-O 3.29Å; P237-L240 WeakPolarHBondContact CB-O 3.47Å; P237-L240 VanDerWaalsContact O-CB 3.27Å; P237-L240 WeakPolarHBondContact O-CB 3.31Å; P237-L240 VanDerWaalsContact O-CG 3.3Å; P237-L240 WeakPolarHBondContact O-CG 3.47Å; P237-L240 PolarHBondContact O-N 3.49Å; P237-L240 VanDerWaalsContact O-N 3.1Å; P237-T243 HydrophobicContact CG-CG2 4.08Å
238	D	91.9	Very high	92.5	Very high	52 Å²	52	33.9 Å²	33.9	28%	0.278	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.1	66.4	176.8	-167.7	29.1	0	0	0	113.8	T218 S221 H232 H233 V236 L240	T218-D238 VanDerWaalsContact CG2-O 3.22Å; T218-D238 WeakPolarHBondContact CG2-O 3.49Å; T218-D238 PolarHBondContact OG1-OD2 3.29Å; S221-D238 WeakPolarHBondContact CB-OD2 3.21Å; S221-D238 PolarHBondContact OG-OD2 3.37Å; H232-D238 IonicContact CD2-OD2 2.68Å; H232-D238 IonicContact CE1-OD2 3.55Å; H232-D238 IonicContact NE2-OD2 2.73Å; H232-D238 PolarHBondContact NE2-OD2 2.8Å; H233-D238 PolarHBondContact CE1-O 3.14Å; H233-D238 VanDerWaalsContact CE1-O 3.27Å; V236-D238 HydrophobicContact CG2-CB 4.11Å; D238-L240 VanDerWaalsContact C-N 3.31Å; D238-L240 PolarHBondContact O-N 3.22Å
239	G	90.8	Very high	92.3	Very high	59 Å²	59	34.2 Å²	34.2	61%	0.608	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	87	-16.8	-176.7	0	0	0	0	0	115.1
240	L	94.9	Very high	91.7	Very high	11 Å²	11	36.5 Å²	36.5	6%	0.058	22%	0.216	C	C	.	.	S	Bend	trans	-77.6	156.2	166.4	-53.5	-176	0	0	0	111.3	L196 Y205 V217 H233 P237 D238 T242 L244	L196-L240 HydrophobicContact CD2-CB 4.12Å; L196-L240 HydrophobicContact CD2-CD1 4.28Å; Y205-L240 HydrophobicContact CD1-CD2 3.53Å; Y205-L240 HydrophobicContact CD2-CD2 3.66Å; Y205-L240 HydrophobicContact CE1-CD2 3.77Å; Y205-L240 HydrophobicContact CE2-CD2 3.87Å; Y205-L240 HydrophobicContact CG-CD2 3.48Å; Y205-L240 VanDerWaalsContact CG-CD2 3.48Å; V217-L240 HydrophobicContact CG1-CD2 4.04Å; H233-L240 HydrophobicContact CB-CD1 3.7Å; P237-L240 VanDerWaalsContact CB-O 3.29Å; P237-L240 WeakPolarHBondContact CB-O 3.47Å; P237-L240 VanDerWaalsContact O-CB 3.27Å; P237-L240 WeakPolarHBondContact O-CB 3.31Å; P237-L240 VanDerWaalsContact O-CG 3.3Å; P237-L240 WeakPolarHBondContact O-CG 3.47Å; P237-L240 PolarHBondContact O-N 3.49Å; P237-L240 VanDerWaalsContact O-N 3.1Å; D238-L240 VanDerWaalsContact C-N 3.31Å; D238-L240 PolarHBondContact O-N 3.22Å; L240-T242 WeakPolarHBondContact CB-O 3.36Å; L240-T242 PolarHBondContact O-N 3.36Å; L240-L244 HydrophobicContact CD1-CD1 4.28Å; L240-L244 HydrophobicContact CD1-CD2 3.76Å; L240-L244 HydrophobicContact CD1-CG 3.94Å
241	V	95.6	Very high	90.3	Very high	52 Å²	52	39.9 Å²	39.9	32%	0.315	24%	0.238	S	C	.	.	S	Bend	trans	-64.1	-28.5	176.1	66.7	0	0	0	0	112.6	L196 Y198 Y203 Y205	L196-V241 HydrophobicContact CD2-CG1 3.92Å; L196-V241 HydrophobicContact CG-CG1 4.34Å; Y198-V241 HydrophobicContact CD1-CG2 3.56Å; Y198-V241 HydrophobicContact CE1-CG2 4.17Å; Y198-V241 HydrophobicContact CG-CG1 4.22Å; Y198-V241 HydrophobicContact CG-CG2 3.92Å; Y203-V241 HydrophobicContact CD1-CG1 4.49Å; Y203-V241 HydrophobicContact CD2-CG1 3.77Å; Y203-V241 HydrophobicContact CE2-CG1 4.15Å; Y203-V241 HydrophobicContact CE2-CG2 4.32Å; Y203-V241 HydrophobicContact CG-CG1 3.97Å; Y205-V241 WeakPolarHBondContact OH-CB 3.5Å; Y205-V241 WeakPolarHBondContact OH-CG1 3.26Å; Y205-V241 PolarHBondContact OH-N 2.88Å
242	T	95.8	Very high	89.2	Confident	27 Å²	27	40.7 Å²	40.7	17%	0.166	24%	0.244	C	C	.	.	S	Bend	trans	-158.3	176.9	176.8	-157.9	0	0	0	0	111	L196 Y198 L240	L196-T242 HydrophobicContact CD1-CG2 3.85Å; L196-T242 HydrophobicContact CD2-CG2 4.03Å; L196-T242 HydrophobicContact CG-CG2 4.15Å; Y198-T242 HydrophobicContact CD2-CG2 3.72Å; Y198-T242 HydrophobicContact CG-CG2 4.34Å; L240-T242 WeakPolarHBondContact CB-O 3.36Å; L240-T242 PolarHBondContact O-N 3.36Å
243	T	94.6	Very high	88.4	Confident	16 Å²	16	43.4 Å²	43.4	10%	0.098	26%	0.256	C	S	.	.			trans	-78.9	149.1	177.7	41.3	0	0	0	0	113.8	G178 H233 P237 H245	G178-T243 WeakPolarHBondContact CA-O 3.4Å; H233-T243 WeakPolarHBondContact O-CA 3.47Å; P237-T243 HydrophobicContact CG-CG2 4.08Å; T243-H245 PolarHBondContact O-N 3.14Å; T243-H245 PolarHBondContact OG1-CD2 3.33Å; T243-H245 PolarHBondContact OG1-CE1 2.98Å; T243-H245 PolarHBondContact OG1-NE2 3.23Å
244	L	94.7	Very high	87.6	Confident	0 Å²	0	45 Å²	45	0%	0	27%	0.266	C	S	.	.			trans	-78.7	80.9	177.3	-54.8	-175	0	0	0	111.3	F180 I194 L196 V230 H233 S234 L240	F180-L244 HydrophobicContact CB-CD2 3.85Å; F180-L244 HydrophobicContact CD1-CB 3.74Å; F180-L244 HydrophobicContact CD1-CD2 4.39Å; F180-L244 HydrophobicContact CD2-CB 4.08Å; F180-L244 HydrophobicContact CD2-CD1 4.08Å; F180-L244 HydrophobicContact CD2-CD2 3.97Å; F180-L244 HydrophobicContact CD2-CG 4.27Å; F180-L244 HydrophobicContact CE1-CB 3.7Å; F180-L244 HydrophobicContact CE2-CB 4.04Å; F180-L244 HydrophobicContact CE2-CD1 4.06Å; F180-L244 HydrophobicContact CE2-CG 4.48Å; F180-L244 HydrophobicContact CG-CB 3.94Å; F180-L244 HydrophobicContact CG-CD2 3.82Å; F180-L244 HydrophobicContact CG-CG 4.33Å; F180-L244 HydrophobicContact CZ-CB 3.85Å; I194-L244 HydrophobicContact CD1-CD1 4.24Å; I194-L244 HydrophobicContact CG2-CD1 4.45Å; I194-L244 HydrophobicContact CG2-CD2 3.97Å; L196-L244 HydrophobicContact CD1-CD2 3.9Å; L196-L244 HydrophobicContact CD2-CD2 3.98Å; L196-L244 HydrophobicContact CG-CD2 4.37Å; V230-L244 HydrophobicContact CG1-CD1 4.16Å; H233-L244 HydrophobicContact CB-CD1 3.58Å; H233-L244 HydrophobicContact CB-CG 3.83Å; H233-L244 PolarHBondContact O-N 3.37Å; S234-L244 WeakPolarHBondContact CA-O 3.46Å; S234-L244 WeakPolarHBondContact CB-O 3.45Å; L240-L244 HydrophobicContact CD1-CD1 4.28Å; L240-L244 HydrophobicContact CD1-CD2 3.76Å; L240-L244 HydrophobicContact CD1-CG 3.94Å
245	H	90.6	Very high	86.8	Confident	38 Å²	38	46.2 Å²	46.2	18%	0.176	27%	0.273	C	S	.	.			trans	-90	-39.6	-173.4	-76.3	165.1	0	0	0	115.2	R79 W80 G178 T243	R79-H245 PolarHBondContact NH2-NE2 3.15Å; W80-H245 PolarHBondContact N-O 3.17Å; G178-H245 PolarHBondContact O-N 3.29Å; T243-H245 PolarHBondContact O-N 3.14Å; T243-H245 PolarHBondContact OG1-CD2 3.33Å; T243-H245 PolarHBondContact OG1-CE1 2.98Å; T243-H245 PolarHBondContact OG1-NE2 3.23Å
246	Y	92.3	Very high	86.2	Confident	60 Å²	60	43.6 Å²	43.6	24%	0.235	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	101.7	-165.5	-52.4	-74.2	0	0	0	112	A77 R79 I176 G178 S179 F180 A248	A77-Y246 HydrophobicContact CB-CD1 3.86Å; A77-Y246 HydrophobicContact CB-CE1 4.09Å; A77-Y246 WeakPolarHBondContact O-CD1 3.05Å; A77-Y246 WeakPolarHBondContact O-CE1 3.29Å; R79-Y246 HydrophobicContact CB-CE1 4.23Å; I176-Y246 HydrophobicContact CD1-CD1 4.38Å; I176-Y246 HydrophobicContact CD1-CD2 3.58Å; I176-Y246 HydrophobicContact CD1-CE1 4.31Å; I176-Y246 HydrophobicContact CD1-CE2 3.5Å; I176-Y246 HydrophobicContact CD1-CG 4.04Å; I176-Y246 HydrophobicContact CG1-CD2 3.8Å; I176-Y246 HydrophobicContact CG1-CE2 4.12Å; I176-Y246 HydrophobicContact CG1-CG 4.36Å; G178-Y246 PolarHBondContact O-N 3.36Å; S179-Y246 CarbonylContact C-O 3.52Å; S179-Y246 WeakPolarHBondContact CA-O 3.22Å; F180-Y246 PolarHBondContact N-O 2.95Å; Y246-A248 PolarHBondContact O-N 2.78Å
247	P	92.5	Very high	85.3	Confident	22 Å²	22	43 Å²	43	14%	0.143	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.7	129.5	173.4	-28.9	37.6	0	0	0	112.2	W80 W158 F180	W80-P247 HydrophobicContact CB-CG 3.71Å; W80-P247 HydrophobicContact CG-CG 3.96Å; W158-P247 HydrophobicContact CB-CB 3.91Å; W158-P247 HydrophobicContact CB-CG 4.15Å; F180-P247 HydrophobicContact CE1-CG 3.96Å; F180-P247 HydrophobicContact CZ-CG 4.11Å; F180-P247 CarbonylContact O-C 3.53Å; F180-P247 WeakPolarHBondContact O-CA 3.05Å
248	A	90.1	Very high	84.2	Confident	1 Å²	1	40.8 Å²	40.8	1%	0.008	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-60	129.6	177	0	0	0	0	0	110.3	H160 L172 L175 F180 L181 Y246 K250	H160-A248 PolarHBondContact CE1-O 3.13Å; H160-A248 PolarHBondContact NE2-O 2.88Å; L172-A248 HydrophobicContact CD2-CB 3.93Å; L175-A248 HydrophobicContact CD1-CB 4.01Å; F180-A248 PolarHBondContact O-N 2.92Å; L181-A248 HydrophobicContact CB-CB 4.04Å; L181-A248 HydrophobicContact CD2-CB 3.9Å; L181-A248 HydrophobicContact CG-CB 4.47Å; Y246-A248 PolarHBondContact O-N 2.78Å; A248-K250 PolarHBondContact O-N 2.83Å
249	P	85.3	Confident	83.2	Confident	69 Å²	69	39.6 Å²	39.6	45%	0.448	23%	0.23	S	C	.	.	P	Polyproline II helix	trans	-62.8	134.7	-178.8	-25.2	35.6	0	0	0	113.1	C251	P249-C251 VanDerWaalsContact C-N 3.28Å; P249-C251 PolarHBondContact O-N 2.76Å; P249-C251 VanDerWaalsContact O-N 3.11Å
250	K	81.7	Confident	82.5	Confident	49 Å²	49	37.8 Å²	37.8	21%	0.213	21%	0.208	C	C	.	.			trans	-81.9	74.6	166.2	-61.8	179.6	-177.8	-179.7	0	108.8	Y101 E154 H156 S157 Y159 A248	Y101-K250 HydrophobicContact CE1-CB 4.19Å; E154-K250 PolarHBondContact O-NZ 3.36Å; H156-K250 PolarHBondContact O-NZ 2.91Å; H156-K250 VanDerWaalsContact O-NZ 3.09Å; S157-K250 WeakPolarHBondContact O-CE 3.44Å; Y159-K250 WeakPolarHBondContact O-CE 3.38Å; Y159-K250 PolarHBondContact O-NZ 2.97Å; A248-K250 PolarHBondContact O-N 2.83Å
251	C	63.3	Low	81.4	Confident	70 Å²	70	37.7 Å²	37.7	47%	0.473	21%	0.208	S	C	.	.			trans	-63.2	-48.3	-175.4	-62.7	0	0	0	0	112.3	P249 K253	P249-C251 VanDerWaalsContact C-N 3.28Å; P249-C251 PolarHBondContact O-N 2.76Å; P249-C251 VanDerWaalsContact O-N 3.11Å; C251-K253 PolarHBondContact O-N 3.3Å
252	N	68.1	Low	80.3	Confident	64 Å²	64	39.4 Å²	39.4	34%	0.342	22%	0.215	S	C	.	.	S	Bend	trans	-81.1	119.5	-168.9	-56.5	5.6	0	0	0	109.4	N405 V407	N252-N405 WeakPolarHBondContact OD1-CB 3.24Å; N252-V407 WeakPolarHBondContact ND2-CG2 3.33Å
253	K	75.9	Confident	78.8	Confident	106 Å²	106	44.2 Å²	44.2	46%	0.461	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-65.6	142	169	-62.6	-169.3	-178	-171.1	0	109.1	Y101 D102 Y146 C251 T255	Y101-K253 HydrophobicContact CD1-CG 4.23Å; D102-K253 PolarHBondContact O-NZ 3.18Å; Y146-K253 HydrophobicContact CE1-CD 4.23Å; C251-K253 PolarHBondContact O-N 3.3Å; K253-T255 PolarHBondContact O-N 2.84Å
254	P	76.9	Confident	77.7	Confident	32 Å²	32	48.5 Å²	48.5	21%	0.208	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-54.5	140	174.9	-26.2	35.1	0	0	0	111.2	Y101 N145 Y146 V256	Y101-P254 HydrophobicContact CD2-CG 4.01Å; Y101-P254 HydrophobicContact CE2-CG 3.53Å; N145-P254 HydrophobicContact CB-CB 4.13Å; N145-P254 VanDerWaalsContact ND2-CB 3.35Å; N145-P254 WeakPolarHBondContact ND2-CB 3.17Å; Y146-P254 HydrophobicContact CD2-CB 4.33Å; Y146-P254 HydrophobicContact CD2-CG 4.27Å; Y146-P254 HydrophobicContact CE2-CB 4.15Å; Y146-P254 HydrophobicContact CE2-CG 4.33Å; Y146-P254 WeakPolarHBondContact CE2-O 3.14Å; P254-V256 PolarHBondContact O-N 2.94Å
255	T	75.1	Confident	77.1	Confident	35 Å²	35	54.9 Å²	54.9	22%	0.215	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-63.7	133.7	176	-61.1	0	0	0	0	109.6	N145 K253 Y257	N145-T255 PolarHBondContact ND2-O 2.89Å; N145-T255 VanDerWaalsContact ND2-O 3.16Å; K253-T255 PolarHBondContact O-N 2.84Å; T255-Y257 HydrophobicContact CG2-CD1 3.85Å; T255-Y257 HydrophobicContact CG2-CE1 3.55Å
256	V	77.3	Confident	76.9	Confident	35 Å²	35	54.3 Å²	54.3	21%	0.212	28%	0.281	C	S	.	.			trans	-107.3	120.3	175.4	-174.2	0	0	0	0	107.8	W130 P143 Y146 P254 G258	W130-V256 HydrophobicContact CH2-CG1 4.2Å; W130-V256 HydrophobicContact CZ2-CG1 3.59Å; P143-V256 HydrophobicContact CB-CG1 4.35Å; P143-V256 HydrophobicContact CB-CG2 4Å; P143-V256 HydrophobicContact CG-CG1 4.03Å; P143-V256 HydrophobicContact CG-CG2 3.77Å; Y146-V256 HydrophobicContact CD2-CG2 4.38Å; Y146-V256 HydrophobicContact CE2-CG2 3.52Å; P254-V256 PolarHBondContact O-N 2.94Å; V256-G258 PolarHBondContact O-N 3.31Å
257	Y	72.4	Confident	76.8	Confident	50 Å²	50	54.4 Å²	54.4	20%	0.196	28%	0.284	C	S	.	.	S	Bend	trans	-85.5	96.3	-174.1	-59.2	-53.6	0	0	0	111.1	E129 T255 K325 H326 P327 Q331	E129-Y257 WeakPolarHBondContact OE1-CD2 3.33Å; T255-Y257 HydrophobicContact CG2-CD1 3.85Å; T255-Y257 HydrophobicContact CG2-CE1 3.55Å; Y257-K325 HydrophobicContact CD1-CB 3.97Å; Y257-K325 HydrophobicContact CD1-CG 4.11Å; Y257-K325 HydrophobicContact CD2-CB 4.04Å; Y257-K325 HydrophobicContact CD2-CD 3.97Å; Y257-K325 HydrophobicContact CD2-CG 4.28Å; Y257-K325 HydrophobicContact CE1-CB 3.99Å; Y257-K325 HydrophobicContact CE2-CB 4.06Å; Y257-K325 HydrophobicContact CG-CB 3.99Å; Y257-K325 HydrophobicContact CG-CD 3.88Å; Y257-K325 HydrophobicContact CG-CG 3.91Å; Y257-H326 WeakPolarHBondContact OH-CA 3.2Å; Y257-H326 PolarHBondContact OH-N 3.42Å; Y257-P327 WeakPolarHBondContact OH-CD 3.48Å; Y257-Q331 HydrophobicContact CD1-CG 4.27Å
258	G	68.8	Low	76.6	Confident	9 Å²	9	54.3 Å²	54.3	9%	0.093	28%	0.282	C	S	.	.	S	Bend	trans	83.2	166.6	-175	0	0	0	0	0	113.5	V256	V256-G258 PolarHBondContact O-N 3.31Å
259	V	71	Confident	76.6	Confident	26 Å²	26	60.6 Å²	60.6	16%	0.158	31%	0.311	C	S	.	.	S	Bend	trans	-97.2	7.8	-172.6	-58.7	0	0	0	0	114.7	W292 Y295 L333	V259-W292 HydrophobicContact CG1-CH2 4.37Å; V259-W292 HydrophobicContact CG1-CZ3 3.91Å; V259-W292 HydrophobicContact CG2-CH2 3.6Å; V259-W292 HydrophobicContact CG2-CZ2 4.46Å; V259-W292 HydrophobicContact CG2-CZ3 4.01Å; V259-Y295 HydrophobicContact CB-CE2 4.02Å; V259-Y295 HydrophobicContact CG1-CE2 4.07Å; V259-Y295 HydrophobicContact CG2-CE2 4.11Å; V259-L333 HydrophobicContact CG1-CB 4.43Å; V259-L333 HydrophobicContact CG1-CD2 4.4Å
260	S	76.2	Confident	76.9	Confident	22 Å²	22	59.8 Å²	59.8	15%	0.154	30%	0.299	C	S	.	.			trans	-140.5	143.2	-175.2	-157	0	0	0	0	112.5	W130 I262	W130-S260 PolarHBondContact NE1-O 3.02Å; S260-I262 PolarHBondContact O-N 3.44Å
261	P	70.6	Confident	77.4	Confident	8 Å²	8	61.5 Å²	61.5	5%	0.052	31%	0.313	C	S	.	.	S	Bend	trans	-71.4	-11.9	168.8	31.8	-38.5	0	0	0	113.2	N109 N125 W130 W141	N109-P261 WeakPolarHBondContact ND2-CG 3.27Å; N125-P261 PolarHBondContact ND2-O 3.04Å; N125-P261 VanDerWaalsContact ND2-O 3.07Å; W130-P261 HydrophobicContact CB-CB 3.77Å; W130-P261 HydrophobicContact CD2-CB 3.86Å; W130-P261 HydrophobicContact CE3-CB 4.19Å; W130-P261 HydrophobicContact CG-CB 3.68Å; W141-P261 HydrophobicContact CB-CB 3.98Å; W141-P261 HydrophobicContact CB-CG 3.75Å; W141-P261 HydrophobicContact CD2-CB 3.83Å; W141-P261 HydrophobicContact CD2-CG 4.12Å; W141-P261 HydrophobicContact CE3-CB 4.04Å; W141-P261 HydrophobicContact CG-CB 3.8Å; W141-P261 HydrophobicContact CG-CG 3.62Å
262	I	73.9	Confident	78.8	Confident	89 Å²	89	60 Å²	60	46%	0.456	30%	0.3	S	S	.	.	S	Bend	trans	-82.9	127.1	-179.2	-54.9	175.6	0	0	0	109.4	S260 K265	S260-I262 PolarHBondContact O-N 3.44Å; I262-K265 HydrophobicContact CB-CB 4.35Å; I262-K265 HydrophobicContact CD1-CD 4.44Å; I262-K265 HydrophobicContact CG2-CB 4.37Å
263	H	64.4	Low	80	Confident	128 Å²	128	57.5 Å²	57.5	59%	0.593	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	141.4	178.3	-169.7	53.2	0	0	0	112	K265	H263-K265 PolarHBondContact O-N 3.11Å
264	D	70.6	Confident	80.9	Confident	105 Å²	105	55.3 Å²	55.3	56%	0.561	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	17	178.8	-79.2	-15.6	0	0	0	119.1	W266	D264-W266 PolarHBondContact O-N 3.49Å; D264-W266 PolarHBondContact OD1-NE1 3.45Å
265	K	82.4	Confident	81.8	Confident	134 Å²	134	56.7 Å²	56.7	58%	0.583	29%	0.287	S	S	*	.			trans	-77.4	67.1	172	-162.7	-179.1	178.5	-180	0	112.1	I262 H263	I262-K265 HydrophobicContact CB-CB 4.35Å; I262-K265 HydrophobicContact CD1-CD 4.44Å; I262-K265 HydrophobicContact CG2-CB 4.37Å; H263-K265 PolarHBondContact O-N 3.11Å
266	W	85.8	Confident	82.7	Confident	26 Å²	26	60.1 Å²	60.1	10%	0.098	30%	0.299	C	S	.	.			trans	-92.2	-28.3	-178	-62	107.1	0	0	0	114.8	D264 K322 L332 G334 V335	D264-W266 PolarHBondContact O-N 3.49Å; D264-W266 PolarHBondContact OD1-NE1 3.45Å; W266-K322 HydrophobicContact CD2-CD 4.43Å; W266-K322 HydrophobicContact CD2-CG 3.97Å; W266-K322 HydrophobicContact CG-CD 4.09Å; W266-K322 HydrophobicContact CG-CG 4.15Å; W266-K322 HydrophobicContact CZ2-CB 4.16Å; W266-K322 HydrophobicContact CZ2-CG 4.14Å; W266-L332 HydrophobicContact CD2-CD2 4.25Å; W266-L332 HydrophobicContact CE3-CD2 3.76Å; W266-L332 HydrophobicContact CE3-CG 4.11Å; W266-L332 HydrophobicContact CZ3-CB 4.15Å; W266-L332 HydrophobicContact CZ3-CD2 3.93Å; W266-L332 HydrophobicContact CZ3-CG 4.07Å; W266-G334 CarbonylContact O-C 3.57Å; W266-G334 WeakPolarHBondContact O-CA 3.44Å; W266-V335 HydrophobicContact CB-CG2 4.19Å; W266-V335 PolarHBondContact O-N 3.12Å
267	E	90.2	Very high	83.4	Confident	62 Å²	62	64.2 Å²	64.2	29%	0.29	32%	0.316	S	S	.	.	B	Isolated β-bridge	trans	-69.6	134.6	177	-72.4	-64.8	141.9	0	0	111.2	V335 C336 T337 L338	E267-V335 WeakPolarHBondContact CA-O 3.46Å; E267-V335 WeakPolarHBondContact OE1-CG2 3.49Å; E267-C336 WeakPolarHBondContact OE2-CA 2.96Å; E267-T337 WeakPolarHBondContact OE1-CB 3.2Å; E267-T337 PolarHBondContact OE1-N 2.84Å; E267-T337 PolarHBondContact OE1-OG1 3.15Å; E267-T337 PolarHBondContact OE2-N 2.9Å; E267-L338 HydrophobicContact CG-CD2 4.44Å; E267-L338 HydrophobicContact CG-CG 4.49Å
268	M	88.8	Confident	84.4	Confident	21 Å²	21	66.3 Å²	66.3	10%	0.103	33%	0.326	C	S	.	.			trans	-127	157.1	175.5	73.7	177.1	78.3	0	0	111.9	R270 I273 W292 G334 V335 C336 V345	M268-R270 PolarHBondContact O-N 3.04Å; M268-I273 HydrophobicContact SD-CD1 3.7Å; M268-I273 HydrophobicContact SD-CG1 3.85Å; M268-W292 HydrophobicContact CB-CH2 4.08Å; M268-W292 HydrophobicContact CB-CZ2 3.81Å; M268-W292 HydrophobicContact CE-CE3 4.07Å; M268-W292 HydrophobicContact CE-CH2 3.36Å; M268-W292 HydrophobicContact CE-CZ2 4.05Å; M268-W292 HydrophobicContact CE-CZ3 3.39Å; M268-W292 HydrophobicContact CG-CZ2 4.42Å; M268-W292 HydrophobicContact SD-CD2 4.2Å; M268-W292 HydrophobicContact SD-CE3 4.16Å; M268-W292 HydrophobicContact SD-CH2 3.73Å; M268-W292 HydrophobicContact SD-CZ2 3.78Å; M268-W292 HydrophobicContact SD-CZ3 3.94Å; M268-G334 VanDerWaalsContact CE-CA 3.4Å; M268-V335 PolarHBondContact N-O 3.32Å; M268-C336 VanDerWaalsContact CG-SG 3.56Å; M268-C336 PolarHBondContact O-SG 3.37Å; M268-V345 HydrophobicContact CE-CB 3.64Å; M268-V345 HydrophobicContact CE-CG1 3.98Å; M268-V345 HydrophobicContact CE-CG2 3.8Å; M268-V345 HydrophobicContact SD-CB 4.32Å; M268-V345 HydrophobicContact SD-CG1 4.43Å; M268-V345 HydrophobicContact SD-CG2 3.92Å
269	E	89.8	Confident	85.3	Confident	132 Å²	132	70 Å²	70	62%	0.617	34%	0.343	S	S	*	.			trans	-75.1	123.9	177.6	-160.2	-176.2	142.8	0	0	110.6	T271 D272	E269-T271 HydrophobicContact CG-CG2 4.23Å; E269-T271 WeakPolarHBondContact CG-OG1 3.24Å; E269-T271 PolarHBondContact O-N 3.22Å; E269-T271 VanDerWaalsContact O-N 3.13Å; E269-T271 WeakPolarHBondContact OE1-CB 3.28Å; E269-T271 WeakPolarHBondContact OE1-CG2 3.47Å; E269-T271 PolarHBondContact OE1-OG1 2.68Å; E269-D272 VanDerWaalsContact O-CB 3.25Å; E269-D272 WeakPolarHBondContact O-CB 3.49Å; E269-D272 PolarHBondContact O-N 3.42Å
270	R	91.1	Very high	85.7	Confident	53 Å²	53	70.1 Å²	70.1	20%	0.2	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-59.4	-29.2	-177.9	-159.7	-167.2	-63.3	96.7	2	112.6	M268 D272 I273 E339 P340 P341 Y343	M268-R270 PolarHBondContact O-N 3.04Å; R270-D272 PolarHBondContact O-N 3.08Å; R270-I273 PolarHBondContact O-N 3.48Å; R270-I273 VanDerWaalsContact O-N 3.12Å; R270-E339 IonicContact CZ-OE1 2.64Å; R270-E339 IonicContact NH1-OE1 3.89Å; R270-E339 PolarHBondContact NH1-OE1 3.1Å; R270-E339 PolarHBondContact NH2-O 2.95Å; R270-E339 IonicContact NH2-OE1 2.8Å; R270-E339 PolarHBondContact NH2-OE1 3.28Å; R270-P340 VanDerWaalsContact NH2-C 3.29Å; R270-P340 PolarHBondContact NH2-O 3.25Å; R270-P341 PolarHBondContact NE-O 2.85Å; R270-P341 VanDerWaalsContact NE-O 3.15Å; R270-P341 PolarHBondContact NH2-O 2.82Å; R270-P341 VanDerWaalsContact NH2-O 3.09Å; R270-Y343 HydrophobicContact CG-CD2 3.8Å; R270-Y343 HydrophobicContact CG-CE2 3.36Å
271	T	92.6	Very high	85.6	Confident	84 Å²	84	71.6 Å²	71.6	52%	0.515	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-62.2	-23.7	178.3	68.3	0	0	0	0	112.7	E269 I273 K293	E269-T271 HydrophobicContact CG-CG2 4.23Å; E269-T271 WeakPolarHBondContact CG-OG1 3.24Å; E269-T271 PolarHBondContact O-N 3.22Å; E269-T271 VanDerWaalsContact O-N 3.13Å; E269-T271 WeakPolarHBondContact OE1-CB 3.28Å; E269-T271 WeakPolarHBondContact OE1-CG2 3.47Å; E269-T271 PolarHBondContact OE1-OG1 2.68Å; T271-I273 VanDerWaalsContact C-N 3.29Å; T271-K293 WeakPolarHBondContact O-CE 3.43Å; T271-K293 PolarHBondContact O-NZ 3.13Å
272	D	91.9	Very high	85.4	Confident	38 Å²	38	73.5 Å²	73.5	20%	0.203	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-77.9	-17.4	-179.7	-136.8	7.5	0	0	0	111.5	E269 R270 W292 K293 K294	E269-D272 VanDerWaalsContact O-CB 3.25Å; E269-D272 WeakPolarHBondContact O-CB 3.49Å; E269-D272 PolarHBondContact O-N 3.42Å; R270-D272 PolarHBondContact O-N 3.08Å; D272-W292 PolarHBondContact OD2-NE1 2.57Å; D272-K293 WeakPolarHBondContact O-CB 3.04Å; D272-K293 VanDerWaalsContact O-CG 3.29Å; D272-K293 WeakPolarHBondContact O-CG 2.93Å; D272-K293 PolarHBondContact O-N 3.21Å; D272-K294 PolarHBondContact OD1-N 2.76Å; D272-K294 WeakPolarHBondContact OD2-CB 3.33Å
273	I	94.4	Very high	84.8	Confident	13 Å²	13	75.1 Å²	75.1	7%	0.067	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	125.6	176.8	-59.7	-53.9	0	0	0	110.9	M268 R270 T271 M275 W292 V299 V301 Y343	M268-I273 HydrophobicContact SD-CD1 3.7Å; M268-I273 HydrophobicContact SD-CG1 3.85Å; R270-I273 PolarHBondContact O-N 3.48Å; R270-I273 VanDerWaalsContact O-N 3.12Å; T271-I273 VanDerWaalsContact C-N 3.29Å; I273-M275 HydrophobicContact CG2-SD 3.87Å; I273-W292 HydrophobicContact CD1-CB 3.78Å; I273-W292 HydrophobicContact CD1-CD2 4.11Å; I273-W292 HydrophobicContact CD1-CG 3.75Å; I273-V299 HydrophobicContact CD1-CG2 4.47Å; I273-V301 HydrophobicContact CG2-CG2 4.04Å; I273-Y343 HydrophobicContact CG2-CE2 4.39Å
274	T	95.3	Very high	84.6	Confident	59 Å²	59	70.2 Å²	70.2	36%	0.362	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	106.1	170.3	-43.3	0	0	0	0	109.1	G290 V291 K293	T274-G290 CarbonylContact O-C 3.55Å; T274-G290 VanDerWaalsContact O-CA 3.27Å; T274-G290 WeakPolarHBondContact O-CA 3.25Å; T274-V291 PolarHBondContact N-O 2.98Å; T274-V291 PolarHBondContact O-N 2.85Å; T274-V291 PolarHBondContact OG1-O 2.66Å; T274-K293 WeakPolarHBondContact OG1-CE 3.45Å; T274-K293 WeakPolarHBondContact OG1-CG 3.28Å
275	M	94.6	Very high	84.9	Confident	61 Å²	61	65.3 Å²	65.3	30%	0.3	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	136	173.7	-57.3	-61.5	-86.9	0	0	110.3	I273 Y288 V301 T303 Y343	I273-M275 HydrophobicContact CG2-SD 3.87Å; M275-Y288 HydrophobicContact CE-CD1 4.43Å; M275-Y288 HydrophobicContact CE-CD2 3.76Å; M275-Y288 HydrophobicContact CE-CG 3.68Å; M275-V301 HydrophobicContact CE-CB 4.07Å; M275-V301 HydrophobicContact CE-CG1 3.87Å; M275-V301 HydrophobicContact SD-CB 4.05Å; M275-V301 HydrophobicContact SD-CG1 3.9Å; M275-V301 HydrophobicContact SD-CG2 4.11Å; M275-T303 HydrophobicContact CE-CG2 3.63Å; M275-Y343 HydrophobicContact CE-CE1 4.43Å; M275-Y343 HydrophobicContact CE-CE2 4.5Å; M275-Y343 HydrophobicContact SD-CE2 3.93Å
276	K	94.8	Very high	85.1	Confident	108 Å²	108	61.1 Å²	61.1	47%	0.47	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	-139	173.8	-67.4	174.2	162.9	172.6	0	109.2	V289 V291	K276-V289 WeakPolarHBondContact CA-O 3.36Å; K276-V289 HydrophobicContact CB-CB 4.15Å; K276-V289 HydrophobicContact CB-CG1 4.45Å; K276-V289 WeakPolarHBondContact CB-O 3.33Å; K276-V289 HydrophobicContact CD-CB 4.48Å; K276-V289 HydrophobicContact CD-CG1 3.91Å; K276-V289 PolarHBondContact N-O 3.19Å; K276-V291 HydrophobicContact CD-CG2 4.02Å
277	H	92.4	Very high	85.3	Confident	121 Å²	121	62 Å²	62	56%	0.56	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.6	156.9	178.5	58.8	-102.6	0	0	0	112.1	V289	H277-V289 WeakPolarHBondContact NE2-CG2 3.27Å; H277-V289 PolarHBondContact O-N 3.11Å
278	K	92.6	Very high	85.5	Confident	94 Å²	94	61.7 Å²	61.7	41%	0.409	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	132.6	173.2	-172	171.7	173.1	178.3	0	110.1	G280 E286 V287 Y288	K278-G280 WeakPolarHBondContact CE-O 3.37Å; K278-G280 WeakPolarHBondContact CG-O 3.26Å; K278-E286 IonicContact NZ-OE1 2.65Å; K278-E286 PolarHBondContact NZ-OE1 2.85Å; K278-E286 IonicContact NZ-OE2 3.96Å; K278-V287 WeakPolarHBondContact CG-O 3.46Å; K278-Y288 HydrophobicContact CB-CD1 3.91Å; K278-Y288 HydrophobicContact CB-CE1 3.7Å; K278-Y288 HydrophobicContact CD-CE1 4.46Å; K278-Y288 HydrophobicContact CG-CD1 4.48Å; K278-Y288 HydrophobicContact CG-CE1 4.17Å
279	L	87.3	Confident	85.8	Confident	85 Å²	85	61 Å²	61	45%	0.445	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	-41.5	170.6	-71	173.2	0	0	0	111.3	V287 V289 A300 Y348	L279-V287 HydrophobicContact CB-CG1 4.42Å; L279-V287 HydrophobicContact CD1-CG1 4.2Å; L279-V287 PolarHBondContact N-O 3.08Å; L279-V289 HydrophobicContact CD1-CG2 3.89Å; L279-V289 HydrophobicContact CD2-CG2 3.48Å; L279-V289 VanDerWaalsContact CD2-CG2 3.48Å; L279-V289 HydrophobicContact CG-CG2 3.57Å; L279-A300 HydrophobicContact CD1-CB 4.41Å; L279-Y348 HydrophobicContact CD1-CD2 4.22Å; L279-Y348 HydrophobicContact CD1-CE2 3.96Å; L279-Y348 HydrophobicContact CD2-CE2 4.14Å
280	G	81.1	Confident	86.1	Confident	30 Å²	30	54.7 Å²	54.7	31%	0.309	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.2	172.3	-176.1	0	0	0	0	0	113.1	K278 V287	K278-G280 WeakPolarHBondContact CE-O 3.37Å; K278-G280 WeakPolarHBondContact CG-O 3.26Å; G280-V287 PolarHBondContact N-O 3.46Å; G280-V287 PolarHBondContact O-N 3.14Å
281	G	72.1	Confident	86.2	Confident	53 Å²	53	53.4 Å²	53.4	55%	0.546	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	117.8	171.9	0	0	0	0	0	109.1
282	G	66.6	Low	86.2	Confident	48 Å²	48	49.9 Å²	49.9	50%	0.495	28%	0.276	S	S	.	.			trans	-104.9	-163.2	179.7	0	0	0	0	0	111.9	G285 K305	G282-G285 PolarHBondContact N-O 3.39Å; G282-G285 VanDerWaalsContact N-O 3.09Å; G282-K305 PolarHBondContact O-NZ 2.91Å; G282-K305 VanDerWaalsContact O-NZ 3.08Å
283	Q	61.5	Low	86	Confident	122 Å²	122	53.2 Å²	53.2	57%	0.57	29%	0.289	S	S	*	.	S	Bend	trans	-62	-59	166	-176.5	167.3	-29.1	0	0	109.3	G285	Q283-G285 PolarHBondContact O-N 3.31Å
284	Y	61.7	Low	85.3	Confident	26 Å²	26	57.5 Å²	57.5	10%	0.102	31%	0.307	C	S	.	.	S	Bend	trans	-72.8	38.7	-174.5	-41	-63.3	0	0	0	115.4	K302 L415	Y284-K302 WeakPolarHBondContact O-CE 3.49Å; Y284-L415 HydrophobicContact CE2-CG 4.27Å; Y284-L415 WeakPolarHBondContact OH-CD1 3.27Å; Y284-L415 WeakPolarHBondContact OH-CD2 3.44Å; Y284-L415 VanDerWaalsContact OH-CG 3.24Å; Y284-L415 WeakPolarHBondContact OH-CG 3.35Å
285	G	75.8	Confident	84.5	Confident	2 Å²	2	57.2 Å²	57.2	2%	0.021	30%	0.299	C	S	.	.			trans	101.1	-148.7	177.7	0	0	0	0	0	115	G282 Q283 K305	G282-G285 PolarHBondContact N-O 3.39Å; G282-G285 VanDerWaalsContact N-O 3.09Å; Q283-G285 PolarHBondContact O-N 3.31Å; G285-K305 PolarHBondContact O-NZ 2.9Å
286	E	87	Confident	84	Confident	46 Å²	46	59.2 Å²	59.2	22%	0.215	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	146.1	-175	-53.1	-158.1	137.2	0	0	111.3	K278 Y288 K302 T303 K305	K278-E286 IonicContact NZ-OE1 2.65Å; K278-E286 PolarHBondContact NZ-OE1 2.85Å; K278-E286 IonicContact NZ-OE2 3.96Å; E286-Y288 HydrophobicContact CB-CD2 4.39Å; E286-Y288 HydrophobicContact CB-CE2 3.66Å; E286-Y288 PolarHBondContact OE2-OH 3.28Å; E286-K302 CarbonylContact O-C 3.5Å; E286-K302 WeakPolarHBondContact O-CA 3.16Å; E286-T303 PolarHBondContact N-O 3.24Å; E286-T303 VanDerWaalsContact N-O 3.11Å; E286-T303 PolarHBondContact O-N 3.1Å; E286-T303 PolarHBondContact O-OG1 2.87Å; E286-K305 VanDerWaalsContact CG-CE 3.48Å; E286-K305 HydrophobicContact CG-CG 4.29Å
287	V	90.9	Very high	83.6	Confident	44 Å²	44	57.5 Å²	57.5	27%	0.267	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	129.3	-178.9	-172.5	0	0	0	0	109.7	K278 L279 G280 A300 V301 K302	K278-V287 WeakPolarHBondContact CG-O 3.46Å; L279-V287 HydrophobicContact CB-CG1 4.42Å; L279-V287 HydrophobicContact CD1-CG1 4.2Å; L279-V287 PolarHBondContact N-O 3.08Å; G280-V287 PolarHBondContact N-O 3.46Å; G280-V287 PolarHBondContact O-N 3.14Å; V287-A300 HydrophobicContact CG1-CB 4.36Å; V287-V301 WeakPolarHBondContact CA-O 3.28Å; V287-K302 HydrophobicContact CG2-CB 4.37Å; V287-K302 HydrophobicContact CG2-CG 4.1Å
288	Y	93.5	Very high	83.7	Confident	56 Å²	56	54.2 Å²	54.2	22%	0.22	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	152.2	-179.2	-68.1	-98	0	0	0	111.2	M275 K278 E286 A300 V301 T303	M275-Y288 HydrophobicContact CE-CD1 4.43Å; M275-Y288 HydrophobicContact CE-CD2 3.76Å; M275-Y288 HydrophobicContact CE-CG 3.68Å; K278-Y288 HydrophobicContact CB-CD1 3.91Å; K278-Y288 HydrophobicContact CB-CE1 3.7Å; K278-Y288 HydrophobicContact CD-CE1 4.46Å; K278-Y288 HydrophobicContact CG-CD1 4.48Å; K278-Y288 HydrophobicContact CG-CE1 4.17Å; E286-Y288 HydrophobicContact CB-CD2 4.39Å; E286-Y288 HydrophobicContact CB-CE2 3.66Å; E286-Y288 PolarHBondContact OE2-OH 3.28Å; Y288-A300 WeakPolarHBondContact O-CA 3.24Å; Y288-V301 PolarHBondContact N-O 2.98Å; Y288-V301 PolarHBondContact O-N 3Å; Y288-T303 HydrophobicContact CD2-CG2 4.07Å; Y288-T303 HydrophobicContact CE2-CG2 4.43Å
289	V	95.3	Very high	83.8	Confident	5 Å²	5	49.8 Å²	49.8	3%	0.03	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	133	158.2	-174.7	0	0	0	0	107.8	K276 H277 L279 T298 Y348	K276-V289 WeakPolarHBondContact CA-O 3.36Å; K276-V289 HydrophobicContact CB-CB 4.15Å; K276-V289 HydrophobicContact CB-CG1 4.45Å; K276-V289 WeakPolarHBondContact CB-O 3.33Å; K276-V289 HydrophobicContact CD-CB 4.48Å; K276-V289 HydrophobicContact CD-CG1 3.91Å; K276-V289 PolarHBondContact N-O 3.19Å; H277-V289 WeakPolarHBondContact NE2-CG2 3.27Å; H277-V289 PolarHBondContact O-N 3.11Å; L279-V289 HydrophobicContact CD1-CG2 3.89Å; L279-V289 HydrophobicContact CD2-CG2 3.48Å; L279-V289 VanDerWaalsContact CD2-CG2 3.48Å; L279-V289 HydrophobicContact CG-CG2 3.57Å; V289-T298 HydrophobicContact CG1-CG2 3.6Å; V289-Y348 HydrophobicContact CG2-CD2 4.39Å; V289-Y348 HydrophobicContact CG2-CE2 3.84Å
290	G	95.3	Very high	84.2	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	166.5	169.1	0	0	0	0	0	112.1	T274 T298 V299	T274-G290 CarbonylContact O-C 3.55Å; T274-G290 VanDerWaalsContact O-CA 3.27Å; T274-G290 WeakPolarHBondContact O-CA 3.25Å; G290-T298 WeakPolarHBondContact O-CA 3.37Å; G290-V299 PolarHBondContact N-O 3.48Å; G290-V299 PolarHBondContact O-N 2.76Å
291	V	94.3	Very high	84.8	Confident	27 Å²	27	44.9 Å²	44.9	16%	0.164	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	121.9	161	173.6	0	0	0	0	109.4	T274 K276 K293 L297	T274-V291 PolarHBondContact N-O 2.98Å; T274-V291 PolarHBondContact O-N 2.85Å; T274-V291 PolarHBondContact OG1-O 2.66Å; K276-V291 HydrophobicContact CD-CG2 4.02Å; V291-K293 PolarHBondContact O-N 3.06Å; V291-L297 CarbonylContact C-O 3.53Å; V291-L297 VanDerWaalsContact CA-O 3.31Å; V291-L297 WeakPolarHBondContact CA-O 3.4Å
292	W	91.8	Very high	85.7	Confident	9 Å²	9	43.3 Å²	43.3	3%	0.034	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	104.3	170.6	-163.6	-16.1	0	0	0	108.9	V259 M268 D272 I273 K294 Y295 S296 L297 V299 L333	V259-W292 HydrophobicContact CG1-CH2 4.37Å; V259-W292 HydrophobicContact CG1-CZ3 3.91Å; V259-W292 HydrophobicContact CG2-CH2 3.6Å; V259-W292 HydrophobicContact CG2-CZ2 4.46Å; V259-W292 HydrophobicContact CG2-CZ3 4.01Å; M268-W292 HydrophobicContact CB-CH2 4.08Å; M268-W292 HydrophobicContact CB-CZ2 3.81Å; M268-W292 HydrophobicContact CE-CE3 4.07Å; M268-W292 HydrophobicContact CE-CH2 3.36Å; M268-W292 HydrophobicContact CE-CZ2 4.05Å; M268-W292 HydrophobicContact CE-CZ3 3.39Å; M268-W292 HydrophobicContact CG-CZ2 4.42Å; M268-W292 HydrophobicContact SD-CD2 4.2Å; M268-W292 HydrophobicContact SD-CE3 4.16Å; M268-W292 HydrophobicContact SD-CH2 3.73Å; M268-W292 HydrophobicContact SD-CZ2 3.78Å; M268-W292 HydrophobicContact SD-CZ3 3.94Å; D272-W292 PolarHBondContact OD2-NE1 2.57Å; I273-W292 HydrophobicContact CD1-CB 3.78Å; I273-W292 HydrophobicContact CD1-CD2 4.11Å; I273-W292 HydrophobicContact CD1-CG 3.75Å; W292-K294 PolarHBondContact O-N 2.83Å; W292-Y295 AromaticContact CD2-CD2 3.6Å; W292-Y295 HydrophobicContact CD2-CD2 3.6Å; W292-Y295 AromaticContact CD2-CE2 3.52Å; W292-Y295 HydrophobicContact CD2-CE2 3.52Å; W292-Y295 AromaticContact CE2-CD2 3.96Å; W292-Y295 AromaticContact CE2-CE2 3.43Å; W292-Y295 VanDerWaalsContact CE2-CE2 3.43Å; W292-Y295 AromaticContact CE3-CD2 3.8Å; W292-Y295 HydrophobicContact CE3-CD2 3.8Å; W292-Y295 AromaticContact CE3-CE2 3.68Å; W292-Y295 HydrophobicContact CE3-CE2 3.68Å; W292-Y295 AromaticContact CG-CD2 3.93Å; W292-Y295 HydrophobicContact CG-CD2 3.93Å; W292-Y295 HydrophobicContact CG-CE2 4.23Å; W292-Y295 AromaticContact CH2-CE2 3.75Å; W292-Y295 HydrophobicContact CH2-CE2 3.75Å; W292-Y295 HydrophobicContact CZ2-CD2 4.48Å; W292-Y295 AromaticContact CZ2-CE2 3.56Å; W292-Y295 HydrophobicContact CZ2-CE2 3.56Å; W292-Y295 HydrophobicContact CZ3-CD2 4.32Å; W292-Y295 AromaticContact CZ3-CE2 3.79Å; W292-Y295 HydrophobicContact CZ3-CE2 3.79Å; W292-Y295 PolarHBondContact O-N 3.29Å; W292-S296 WeakPolarHBondContact O-CA 3.29Å; W292-S296 PolarHBondContact O-N 3.09Å; W292-L297 PolarHBondContact N-O 3.02Å; W292-L297 PolarHBondContact O-N 3.29Å; W292-V299 HydrophobicContact CB-CG1 4.45Å; W292-L333 HydrophobicContact CZ3-CB 4.19Å
293	K	87.4	Confident	86.8	Confident	109 Å²	109	41.8 Å²	41.8	47%	0.474	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-53.3	-50.5	-172	-66.7	168.3	-171.6	172	0	112	T271 D272 T274 V291 Y295 S296	T271-K293 WeakPolarHBondContact O-CE 3.43Å; T271-K293 PolarHBondContact O-NZ 3.13Å; D272-K293 WeakPolarHBondContact O-CB 3.04Å; D272-K293 VanDerWaalsContact O-CG 3.29Å; D272-K293 WeakPolarHBondContact O-CG 2.93Å; D272-K293 PolarHBondContact O-N 3.21Å; T274-K293 WeakPolarHBondContact OG1-CE 3.45Å; T274-K293 WeakPolarHBondContact OG1-CG 3.28Å; V291-K293 PolarHBondContact O-N 3.06Å; K293-Y295 PolarHBondContact O-N 3.28Å; K293-Y295 VanDerWaalsContact O-N 3.09Å; K293-S296 PolarHBondContact O-N 2.96Å; K293-S296 VanDerWaalsContact O-N 3.11Å
294	K	80.9	Confident	87.8	Confident	103 Å²	103	36.8 Å²	36.8	45%	0.448	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-53.5	-31.9	-178	-169.8	171.2	179.1	161.3	0	114.3	S106 D108 D272 W292	S106-K294 WeakPolarHBondContact O-CE 3.35Å; D108-K294 IonicContact OD1-NZ 2.95Å; D108-K294 PolarHBondContact OD1-NZ 2.69Å; D272-K294 PolarHBondContact OD1-N 2.76Å; D272-K294 WeakPolarHBondContact OD2-CB 3.33Å; W292-K294 PolarHBondContact O-N 2.83Å
295	Y	77.1	Confident	88.4	Confident	52 Å²	52	39 Å²	39	20%	0.204	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-110.7	-3.1	-178.3	-45.9	-34.9	0	0	0	113.2	S106 V259 W292 K293 L297	S106-Y295 VanDerWaalsContact C-CE1 3.48Å; S106-Y295 VanDerWaalsContact CB-CE1 3.48Å; S106-Y295 WeakPolarHBondContact O-CE1 3.14Å; V259-Y295 HydrophobicContact CB-CE2 4.02Å; V259-Y295 HydrophobicContact CG1-CE2 4.07Å; V259-Y295 HydrophobicContact CG2-CE2 4.11Å; W292-Y295 AromaticContact CD2-CD2 3.6Å; W292-Y295 HydrophobicContact CD2-CD2 3.6Å; W292-Y295 AromaticContact CD2-CE2 3.52Å; W292-Y295 HydrophobicContact CD2-CE2 3.52Å; W292-Y295 AromaticContact CE2-CD2 3.96Å; W292-Y295 AromaticContact CE2-CE2 3.43Å; W292-Y295 VanDerWaalsContact CE2-CE2 3.43Å; W292-Y295 AromaticContact CE3-CD2 3.8Å; W292-Y295 HydrophobicContact CE3-CD2 3.8Å; W292-Y295 AromaticContact CE3-CE2 3.68Å; W292-Y295 HydrophobicContact CE3-CE2 3.68Å; W292-Y295 AromaticContact CG-CD2 3.93Å; W292-Y295 HydrophobicContact CG-CD2 3.93Å; W292-Y295 HydrophobicContact CG-CE2 4.23Å; W292-Y295 AromaticContact CH2-CE2 3.75Å; W292-Y295 HydrophobicContact CH2-CE2 3.75Å; W292-Y295 HydrophobicContact CZ2-CD2 4.48Å; W292-Y295 AromaticContact CZ2-CE2 3.56Å; W292-Y295 HydrophobicContact CZ2-CE2 3.56Å; W292-Y295 HydrophobicContact CZ3-CD2 4.32Å; W292-Y295 AromaticContact CZ3-CE2 3.79Å; W292-Y295 HydrophobicContact CZ3-CE2 3.79Å; W292-Y295 PolarHBondContact O-N 3.29Å; K293-Y295 PolarHBondContact O-N 3.28Å; K293-Y295 VanDerWaalsContact O-N 3.09Å; Y295-L297 PolarHBondContact O-N 2.95Å; Y295-L297 VanDerWaalsContact O-N 3.08Å
296	S	85.1	Confident	88.1	Confident	104 Å²	104	46.6 Å²	46.6	73%	0.727	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.1	23.5	-165	-60.8	0	0	0	0	114.3	W292 K293	W292-S296 WeakPolarHBondContact O-CA 3.29Å; W292-S296 PolarHBondContact O-N 3.09Å; K293-S296 PolarHBondContact O-N 2.96Å; K293-S296 VanDerWaalsContact O-N 3.11Å
297	L	87.2	Confident	87.1	Confident	71 Å²	71	52.4 Å²	52.4	37%	0.372	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	131.5	-173.5	-179.3	62.8	0	0	0	110.5	V291 W292 Y295 V299 L333	V291-L297 CarbonylContact C-O 3.53Å; V291-L297 VanDerWaalsContact CA-O 3.31Å; V291-L297 WeakPolarHBondContact CA-O 3.4Å; W292-L297 PolarHBondContact N-O 3.02Å; W292-L297 PolarHBondContact O-N 3.29Å; Y295-L297 PolarHBondContact O-N 2.95Å; Y295-L297 VanDerWaalsContact O-N 3.08Å; L297-V299 HydrophobicContact CD2-CG1 4.09Å; L297-V299 HydrophobicContact CG-CG1 3.97Å; L297-L333 HydrophobicContact CD2-CD1 3.83Å
298	T	93.3	Very high	85.8	Confident	53 Å²	53	52.1 Å²	52.1	33%	0.325	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	131.3	169.3	-59	0	0	0	0	109.1	V289 G290 Y348	V289-T298 HydrophobicContact CG1-CG2 3.6Å; G290-T298 WeakPolarHBondContact O-CA 3.37Å; T298-Y348 HydrophobicContact CG2-CD1 3.73Å; T298-Y348 HydrophobicContact CG2-CD2 4.39Å; T298-Y348 HydrophobicContact CG2-CE1 4.34Å; T298-Y348 HydrophobicContact CG2-CG 3.77Å; T298-Y348 WeakPolarHBondContact O-CB 3.39Å
299	V	94.8	Very high	83.8	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	159.4	-172.5	-63.9	0	0	0	0	110.1	I273 G290 W292 L297 V301 L333 V345 T346	I273-V299 HydrophobicContact CD1-CG2 4.47Å; G290-V299 PolarHBondContact N-O 3.48Å; G290-V299 PolarHBondContact O-N 2.76Å; W292-V299 HydrophobicContact CB-CG1 4.45Å; L297-V299 HydrophobicContact CD2-CG1 4.09Å; L297-V299 HydrophobicContact CG-CG1 3.97Å; V299-V301 HydrophobicContact CG2-CG2 3.94Å; V299-L333 HydrophobicContact CG1-CD1 3.66Å; V299-V345 HydrophobicContact CB-CG1 3.79Å; V299-V345 HydrophobicContact CG1-CG1 4.1Å; V299-V345 HydrophobicContact CG2-CG1 3.83Å; V299-T346 WeakPolarHBondContact CA-O 3.28Å; V299-T346 WeakPolarHBondContact CB-O 3.27Å
300	A	94.9	Very high	82.6	Confident	12 Å²	12	60.9 Å²	60.9	10%	0.099	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	140.4	163.9	0	0	0	0	0	109.4	L279 V287 Y288 V345 T346	L279-A300 HydrophobicContact CD1-CB 4.41Å; V287-A300 HydrophobicContact CG1-CB 4.36Å; Y288-A300 WeakPolarHBondContact O-CA 3.24Å; A300-V345 WeakPolarHBondContact O-CA 3.41Å; A300-T346 PolarHBondContact N-O 3.12Å; A300-T346 PolarHBondContact O-N 3.35Å
301	V	93.8	Very high	81.8	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	108.9	-175.4	-173	0	0	0	0	109	I273 M275 V287 Y288 V299 T303 Y343 I344 V345	I273-V301 HydrophobicContact CG2-CG2 4.04Å; M275-V301 HydrophobicContact CE-CB 4.07Å; M275-V301 HydrophobicContact CE-CG1 3.87Å; M275-V301 HydrophobicContact SD-CB 4.05Å; M275-V301 HydrophobicContact SD-CG1 3.9Å; M275-V301 HydrophobicContact SD-CG2 4.11Å; V287-V301 WeakPolarHBondContact CA-O 3.28Å; Y288-V301 PolarHBondContact N-O 2.98Å; Y288-V301 PolarHBondContact O-N 3Å; V299-V301 HydrophobicContact CG2-CG2 3.94Å; V301-T303 HydrophobicContact CG1-CG2 4.05Å; V301-Y343 HydrophobicContact CG1-CD1 4.11Å; V301-Y343 HydrophobicContact CG1-CD2 3.68Å; V301-Y343 HydrophobicContact CG1-CE2 4.15Å; V301-Y343 HydrophobicContact CG1-CG 3.66Å; V301-I344 WeakPolarHBondContact CA-O 3.25Å; V301-V345 HydrophobicContact CG1-CG2 4.39Å; V301-V345 HydrophobicContact CG2-CG2 4.43Å
302	K	91.3	Very high	81.1	Confident	21 Å²	21	68.6 Å²	68.6	9%	0.091	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	125.7	171.4	-164.5	-178.5	-156.4	179.8	0	108.3	Y284 E286 V287 F314 E317 Y343 I344 D412	Y284-K302 WeakPolarHBondContact O-CE 3.49Å; E286-K302 CarbonylContact O-C 3.5Å; E286-K302 WeakPolarHBondContact O-CA 3.16Å; V287-K302 HydrophobicContact CG2-CB 4.37Å; V287-K302 HydrophobicContact CG2-CG 4.1Å; K302-F314 HydrophobicContact CG-CE2 4.26Å; K302-E317 IonicContact NZ-OE1 2.73Å; K302-E317 PolarHBondContact NZ-OE1 2.92Å; K302-E317 IonicContact NZ-OE2 3.71Å; K302-E317 PolarHBondContact NZ-OE2 3Å; K302-Y343 WeakPolarHBondContact O-CA 3.39Å; K302-I344 HydrophobicContact CB-CB 4.27Å; K302-I344 PolarHBondContact N-O 3.31Å; K302-I344 PolarHBondContact O-N 2.84Å; K302-D412 IonicContact NZ-OD1 3.62Å; K302-D412 PolarHBondContact NZ-OD1 3.17Å
303	T	89.5	Confident	80.5	Confident	15 Å²	15	70.3 Å²	70.3	9%	0.092	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	129.1	-176.6	65.6	0	0	0	0	110.5	M275 E286 Y288 V301 Y343	M275-T303 HydrophobicContact CE-CG2 3.63Å; E286-T303 PolarHBondContact N-O 3.24Å; E286-T303 VanDerWaalsContact N-O 3.11Å; E286-T303 PolarHBondContact O-N 3.1Å; E286-T303 PolarHBondContact O-OG1 2.87Å; Y288-T303 HydrophobicContact CD2-CG2 4.07Å; Y288-T303 HydrophobicContact CE2-CG2 4.43Å; V301-T303 HydrophobicContact CG1-CG2 4.05Å; T303-Y343 HydrophobicContact CG2-CD1 3.62Å; T303-Y343 HydrophobicContact CG2-CE1 3.51Å
304	L	82.8	Confident	80.1	Confident	17 Å²	17	65.5 Å²	65.5	9%	0.089	34%	0.336	C	S	.	.			trans	-70.2	141.7	173.3	-172.3	61.7	0	0	0	111	T308 E310 V311 F314 F342	L304-T308 WeakPolarHBondContact CD1-OG1 3.33Å; L304-E310 HydrophobicContact CD1-CB 4.37Å; L304-V311 HydrophobicContact CD2-CB 4.17Å; L304-V311 HydrophobicContact CD2-CG2 3.62Å; L304-F314 HydrophobicContact CB-CD1 4.45Å; L304-F314 HydrophobicContact CB-CD2 3.94Å; L304-F314 HydrophobicContact CB-CE1 4.49Å; L304-F314 HydrophobicContact CB-CE2 3.98Å; L304-F314 HydrophobicContact CB-CG 4.18Å; L304-F314 HydrophobicContact CB-CZ 4.25Å; L304-F314 HydrophobicContact CD1-CB 4.12Å; L304-F314 HydrophobicContact CD1-CD2 4.08Å; L304-F314 HydrophobicContact CD1-CG 4.25Å; L304-F314 HydrophobicContact CD2-CB 4.29Å; L304-F314 HydrophobicContact CD2-CG 4.37Å; L304-F314 HydrophobicContact CG-CD2 4.5Å; L304-F342 HydrophobicContact CD2-CD2 4.05Å; L304-F342 PolarHBondContact N-O 3.46Å
305	K	74.4	Confident	80.2	Confident	72 Å²	72	63.9 Å²	63.9	31%	0.313	33%	0.332	S	S	.	.			trans	-83.7	130.8	175.1	-68.5	166.3	-170.7	152.2	0	109.6	G282 G285 E286 D307 T308	G282-K305 PolarHBondContact O-NZ 2.91Å; G282-K305 VanDerWaalsContact O-NZ 3.08Å; G285-K305 PolarHBondContact O-NZ 2.9Å; E286-K305 VanDerWaalsContact CG-CE 3.48Å; E286-K305 HydrophobicContact CG-CG 4.29Å; K305-D307 PolarHBondContact O-N 3.22Å; K305-T308 HydrophobicContact CB-CG2 3.91Å; K305-T308 PolarHBondContact O-N 3.17Å; K305-T308 VanDerWaalsContact O-N 3.13Å; K305-T308 PolarHBondContact O-OG1 3.16Å
306	E	70	Confident	80.4	Confident	163 Å²	163	65.5 Å²	65.5	76%	0.762	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-30.8	-172.5	-60.9	-178.7	154.9	0	0	113.4	T308	E306-T308 VanDerWaalsContact C-N 3.3Å; E306-T308 PolarHBondContact O-N 3.4Å
307	D	66.1	Low	80.3	Confident	167 Å²	167	61 Å²	61	89%	0.893	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	11.4	179.2	-59.6	-53.3	0	0	0	114.9	K305	K305-D307 PolarHBondContact O-N 3.22Å
308	T	63.1	Low	80.2	Confident	38 Å²	38	57.7 Å²	57.7	23%	0.233	29%	0.291	C	S	.	.			trans	-109.7	134.3	-175.3	60	0	0	0	0	113.4	L304 K305 E306 E310	L304-T308 WeakPolarHBondContact CD1-OG1 3.33Å; K305-T308 HydrophobicContact CB-CG2 3.91Å; K305-T308 PolarHBondContact O-N 3.17Å; K305-T308 VanDerWaalsContact O-N 3.13Å; K305-T308 PolarHBondContact O-OG1 3.16Å; E306-T308 VanDerWaalsContact C-N 3.3Å; E306-T308 PolarHBondContact O-N 3.4Å; T308-E310 PolarHBondContact O-N 2.98Å
309	M	51.7	Low	79.8	Confident	193 Å²	193	57.6 Å²	57.6	95%	0.951	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	13.4	174.9	-64.3	-179.5	67.2	0	0	113.3	V311	M309-V311 PolarHBondContact O-N 3.44Å
310	E	70.1	Confident	79.2	Confident	52 Å²	52	58.3 Å²	58.3	24%	0.243	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	10.2	-165.8	-61.8	179.1	176.7	0	0	113.3	L304 T308 E312 E313 F314	L304-E310 HydrophobicContact CD1-CB 4.37Å; T308-E310 PolarHBondContact O-N 2.98Å; E310-E312 PolarHBondContact O-N 3.33Å; E310-E313 PolarHBondContact O-N 3.29Å; E310-F314 PolarHBondContact O-N 3.12Å
311	V	78.1	Confident	78.8	Confident	58 Å²	58	58 Å²	58	35%	0.352	30%	0.296	S	S	.	.	H	α-helix	trans	-49.5	-43.9	179.6	176.5	0	0	0	0	112.3	L304 M309 E313 F314 L315 F342	L304-V311 HydrophobicContact CD2-CB 4.17Å; L304-V311 HydrophobicContact CD2-CG2 3.62Å; M309-V311 PolarHBondContact O-N 3.44Å; V311-E313 VanDerWaalsContact C-N 3.34Å; V311-E313 PolarHBondContact O-N 3.28Å; V311-F314 PolarHBondContact O-N 2.97Å; V311-L315 HydrophobicContact CG1-CD1 3.94Å; V311-L315 HydrophobicContact CG1-CG 4.44Å; V311-L315 WeakPolarHBondContact O-CB 3.44Å; V311-L315 VanDerWaalsContact O-CG 3.3Å; V311-L315 WeakPolarHBondContact O-CG 3.38Å; V311-L315 PolarHBondContact O-N 2.76Å; V311-F342 HydrophobicContact CG1-CD2 4.37Å; V311-F342 HydrophobicContact CG1-CE2 3.81Å; V311-F342 HydrophobicContact CG2-CE2 4.46Å
312	E	79.8	Confident	78.4	Confident	132 Å²	132	61.2 Å²	61.2	62%	0.617	31%	0.31	S	S	*	.	H	α-helix	trans	-69.9	-30.8	-178.9	-151.7	-152.9	162.9	0	0	112.4	E310 K316	E310-E312 PolarHBondContact O-N 3.33Å; E312-K316 VanDerWaalsContact CD-CE 3.47Å; E312-K316 WeakPolarHBondContact O-CB 3.34Å; E312-K316 VanDerWaalsContact O-CD 3.29Å; E312-K316 WeakPolarHBondContact O-CD 3.32Å; E312-K316 WeakPolarHBondContact O-CG 3.39Å; E312-K316 PolarHBondContact O-N 3.06Å; E312-K316 WeakPolarHBondContact OE1-CE 3.45Å; E312-K316 IonicContact OE1-NZ 3.1Å; E312-K316 PolarHBondContact OE1-NZ 3.04Å; E312-K316 IonicContact OE2-NZ 3.86Å; E312-K316 PolarHBondContact OE2-NZ 3.34Å
313	E	78.2	Confident	78	Confident	45 Å²	45	65.8 Å²	65.8	21%	0.21	33%	0.332	C	S	.	.	H	α-helix	trans	-75.9	-40.1	176.3	-173.1	155.9	-144.4	0	0	111.2	E310 V311 L315 K316 E317 R417	E310-E313 PolarHBondContact O-N 3.29Å; V311-E313 VanDerWaalsContact C-N 3.34Å; V311-E313 PolarHBondContact O-N 3.28Å; E313-L315 PolarHBondContact O-N 3.32Å; E313-K316 WeakPolarHBondContact O-CB 3.4Å; E313-K316 PolarHBondContact O-N 3.09Å; E313-E317 PolarHBondContact O-N 3.43Å; E313-R417 IonicContact OE1-CZ 3.49Å; E313-R417 IonicContact OE1-NH1 2.66Å; E313-R417 IonicContact OE1-NH2 3.38Å; E313-R417 PolarHBondContact OE1-NH2 2.88Å
314	F	80.4	Confident	77.8	Confident	7 Å²	7	65.2 Å²	65.2	3%	0.031	33%	0.328	C	S	.	.	H	α-helix	trans	-60.7	-42.9	171.7	-171.5	-91.1	0	0	0	112.2	K302 L304 E310 V311 E317 A318 F342 I344	K302-F314 HydrophobicContact CG-CE2 4.26Å; L304-F314 HydrophobicContact CB-CD1 4.45Å; L304-F314 HydrophobicContact CB-CD2 3.94Å; L304-F314 HydrophobicContact CB-CE1 4.49Å; L304-F314 HydrophobicContact CB-CE2 3.98Å; L304-F314 HydrophobicContact CB-CG 4.18Å; L304-F314 HydrophobicContact CB-CZ 4.25Å; L304-F314 HydrophobicContact CD1-CB 4.12Å; L304-F314 HydrophobicContact CD1-CD2 4.08Å; L304-F314 HydrophobicContact CD1-CG 4.25Å; L304-F314 HydrophobicContact CD2-CB 4.29Å; L304-F314 HydrophobicContact CD2-CG 4.37Å; L304-F314 HydrophobicContact CG-CD2 4.5Å; E310-F314 PolarHBondContact O-N 3.12Å; V311-F314 PolarHBondContact O-N 2.97Å; F314-E317 PolarHBondContact O-N 2.9Å; F314-A318 PolarHBondContact O-N 2.97Å; F314-F342 HydrophobicContact CD1-CB 4.17Å; F314-F342 HydrophobicContact CE1-CB 3.61Å; F314-F342 HydrophobicContact CZ-CB 4.32Å; F314-F342 WeakPolarHBondContact CZ-O 3.37Å; F314-I344 HydrophobicContact CD1-CD1 4.17Å; F314-I344 HydrophobicContact CD1-CG1 4.43Å; F314-I344 HydrophobicContact CD2-CD1 4.14Å; F314-I344 HydrophobicContact CE1-CD1 3.92Å; F314-I344 HydrophobicContact CE1-CG1 3.75Å; F314-I344 HydrophobicContact CE2-CD1 3.91Å; F314-I344 HydrophobicContact CE2-CG1 4.26Å; F314-I344 HydrophobicContact CG-CD1 4.28Å; F314-I344 HydrophobicContact CZ-CB 4.29Å; F314-I344 HydrophobicContact CZ-CD1 3.8Å; F314-I344 HydrophobicContact CZ-CG1 3.67Å
315	L	82.8	Confident	78	Confident	69 Å²	69	67 Å²	67	36%	0.361	34%	0.335	S	S	.	.	H	α-helix	trans	-70.7	-30.2	175.1	-68.4	175	0	0	0	112.7	V311 E313 A319 T337	V311-L315 HydrophobicContact CG1-CD1 3.94Å; V311-L315 HydrophobicContact CG1-CG 4.44Å; V311-L315 WeakPolarHBondContact O-CB 3.44Å; V311-L315 VanDerWaalsContact O-CG 3.3Å; V311-L315 WeakPolarHBondContact O-CG 3.38Å; V311-L315 PolarHBondContact O-N 2.76Å; E313-L315 PolarHBondContact O-N 3.32Å; L315-A319 WeakPolarHBondContact O-CB 3.3Å; L315-A319 PolarHBondContact O-N 2.89Å; L315-T337 HydrophobicContact CD2-CG2 3.68Å
316	K	81.3	Confident	78.8	Confident	86 Å²	86	64.7 Å²	64.7	37%	0.374	33%	0.325	S	S	.	.	H	α-helix	trans	-67.1	-43.2	170.9	-77.9	162.1	-172.3	165.8	0	111.7	E312 E313 A319 V320	E312-K316 VanDerWaalsContact CD-CE 3.47Å; E312-K316 WeakPolarHBondContact O-CB 3.34Å; E312-K316 VanDerWaalsContact O-CD 3.29Å; E312-K316 WeakPolarHBondContact O-CD 3.32Å; E312-K316 WeakPolarHBondContact O-CG 3.39Å; E312-K316 PolarHBondContact O-N 3.06Å; E312-K316 WeakPolarHBondContact OE1-CE 3.45Å; E312-K316 IonicContact OE1-NZ 3.1Å; E312-K316 PolarHBondContact OE1-NZ 3.04Å; E312-K316 IonicContact OE2-NZ 3.86Å; E312-K316 PolarHBondContact OE2-NZ 3.34Å; E313-K316 WeakPolarHBondContact O-CB 3.4Å; E313-K316 PolarHBondContact O-N 3.09Å; K316-A319 WeakPolarHBondContact O-CB 3.31Å; K316-A319 PolarHBondContact O-N 3.47Å; K316-A319 VanDerWaalsContact O-N 3.14Å; K316-V320 WeakPolarHBondContact O-CG2 3.45Å; K316-V320 PolarHBondContact O-N 3.27Å
317	E	83.4	Confident	79.7	Confident	9 Å²	9	59.5 Å²	59.5	4%	0.042	31%	0.306	C	S	.	.	H	α-helix	trans	-56.7	-50.9	172.6	-176.5	178.7	177	0	0	110.7	K302 E313 F314 A319 V320 M321 I344 F413	K302-E317 IonicContact NZ-OE1 2.73Å; K302-E317 PolarHBondContact NZ-OE1 2.92Å; K302-E317 IonicContact NZ-OE2 3.71Å; K302-E317 PolarHBondContact NZ-OE2 3Å; E313-E317 PolarHBondContact O-N 3.43Å; F314-E317 PolarHBondContact O-N 2.9Å; E317-A319 PolarHBondContact O-N 2.95Å; E317-V320 PolarHBondContact O-N 2.84Å; E317-M321 HydrophobicContact CG-CG 4.49Å; E317-M321 HydrophobicContact CG-SD 4.32Å; E317-M321 WeakPolarHBondContact O-CG 3.33Å; E317-M321 PolarHBondContact O-N 3.3Å; E317-I344 HydrophobicContact CB-CD1 4.3Å; E317-I344 HydrophobicContact CG-CD1 4.21Å; E317-F413 HydrophobicContact CG-CB 4.17Å
318	A	84.1	Confident	81.1	Confident	3 Å²	3	52.4 Å²	52.4	3%	0.025	27%	0.268	C	S	.	.	H	α-helix	trans	-58	-32.5	176	0	0	0	0	0	113.5	F314 K322 V335 I344	F314-A318 PolarHBondContact O-N 2.97Å; A318-K322 WeakPolarHBondContact O-CG 3.18Å; A318-V335 HydrophobicContact CB-CG1 4.15Å; A318-I344 HydrophobicContact CB-CD1 3.94Å; A318-I344 HydrophobicContact CB-CG1 3.98Å
319	A	84.6	Confident	82.5	Confident	50 Å²	50	50.7 Å²	50.7	41%	0.413	26%	0.257	S	S	.	.	H	α-helix	trans	-73.9	-44.2	175.6	0	0	0	0	0	112.3	L315 K316 E317 M321 K322	L315-A319 WeakPolarHBondContact O-CB 3.3Å; L315-A319 PolarHBondContact O-N 2.89Å; K316-A319 WeakPolarHBondContact O-CB 3.31Å; K316-A319 PolarHBondContact O-N 3.47Å; K316-A319 VanDerWaalsContact O-N 3.14Å; E317-A319 PolarHBondContact O-N 2.95Å; A319-M321 VanDerWaalsContact C-N 3.29Å; A319-M321 PolarHBondContact O-N 2.68Å; A319-K322 PolarHBondContact O-N 3.39Å
320	V	83.8	Confident	84.4	Confident	16 Å²	16	41.9 Å²	41.9	10%	0.097	21%	0.214	C	C	.	.	H	α-helix	trans	-58	-44.3	174	174.2	0	0	0	0	110.4	K316 E317 K322 E323 V324 F390 F413	K316-V320 WeakPolarHBondContact O-CG2 3.45Å; K316-V320 PolarHBondContact O-N 3.27Å; E317-V320 PolarHBondContact O-N 2.84Å; V320-K322 PolarHBondContact O-N 3.38Å; V320-K322 VanDerWaalsContact O-N 3.16Å; V320-E323 PolarHBondContact O-N 3.12Å; V320-E323 VanDerWaalsContact O-N 3.09Å; V320-V324 HydrophobicContact CG1-CG1 4.36Å; V320-V324 PolarHBondContact O-N 2.91Å; V320-F390 HydrophobicContact CB-CE1 4.4Å; V320-F390 HydrophobicContact CG1-CD1 4.19Å; V320-F390 HydrophobicContact CG1-CE1 3.9Å; V320-F390 HydrophobicContact CG1-CZ 4.2Å; V320-F390 HydrophobicContact CG2-CE1 3.84Å; V320-F390 HydrophobicContact CG2-CZ 4.44Å; V320-F413 HydrophobicContact CG1-CB 4.32Å; V320-F413 HydrophobicContact CG1-CD1 4.26Å; V320-F413 HydrophobicContact CG1-CG 4.48Å
321	M	85.6	Confident	85.4	Confident	6 Å²	6	39.6 Å²	39.6	3%	0.03	20%	0.204	C	C	.	.	H	α-helix	trans	-68.2	-9	-179.1	-67.5	-164.4	76.9	0	0	115.3	E317 A319 V330 L332 I344 T346 F413	E317-M321 HydrophobicContact CG-CG 4.49Å; E317-M321 HydrophobicContact CG-SD 4.32Å; E317-M321 WeakPolarHBondContact O-CG 3.33Å; E317-M321 PolarHBondContact O-N 3.3Å; A319-M321 VanDerWaalsContact C-N 3.29Å; A319-M321 PolarHBondContact O-N 2.68Å; M321-V330 HydrophobicContact CE-CG1 4.36Å; M321-V330 WeakPolarHBondContact CE-O 3.27Å; M321-L332 HydrophobicContact CB-CB 4.11Å; M321-L332 HydrophobicContact CB-CD1 4.37Å; M321-L332 HydrophobicContact CB-CD2 4.23Å; M321-L332 HydrophobicContact CB-CG 4.48Å; M321-L332 WeakPolarHBondContact O-CB 3.4Å; M321-I344 HydrophobicContact SD-CG2 4.16Å; M321-T346 HydrophobicContact CE-CG2 3.69Å; M321-T346 HydrophobicContact SD-CG2 4.45Å; M321-F413 HydrophobicContact CE-CD2 4.05Å; M321-F413 HydrophobicContact CE-CE2 4.11Å; M321-F413 HydrophobicContact CG-CB 4.35Å; M321-F413 HydrophobicContact CG-CD2 3.72Å; M321-F413 HydrophobicContact CG-CE2 4.39Å; M321-F413 HydrophobicContact CG-CG 4.25Å; M321-F413 HydrophobicContact SD-CD2 3.96Å
322	K	85.4	Confident	85.9	Confident	66 Å²	66	36.9 Å²	36.9	29%	0.287	19%	0.187	S	C	.	.	H	α-helix	trans	-85.1	-33.1	169.6	-69.1	170.8	-177	178.9	0	112.5	W266 A318 A319 V320 L332	W266-K322 HydrophobicContact CD2-CD 4.43Å; W266-K322 HydrophobicContact CD2-CG 3.97Å; W266-K322 HydrophobicContact CG-CD 4.09Å; W266-K322 HydrophobicContact CG-CG 4.15Å; W266-K322 HydrophobicContact CZ2-CB 4.16Å; W266-K322 HydrophobicContact CZ2-CG 4.14Å; A318-K322 WeakPolarHBondContact O-CG 3.18Å; A319-K322 PolarHBondContact O-N 3.39Å; V320-K322 PolarHBondContact O-N 3.38Å; V320-K322 VanDerWaalsContact O-N 3.16Å; K322-L332 HydrophobicContact CG-CD2 3.55Å
323	E	83.8	Confident	86.4	Confident	118 Å²	118	31.5 Å²	31.5	55%	0.551	16%	0.162	S	C	*	.	H	α-helix	trans	-87.2	-23	-174.4	-70.5	-59.7	146.5	0	0	114	V320 K388 F390	V320-E323 PolarHBondContact O-N 3.12Å; V320-E323 VanDerWaalsContact O-N 3.09Å; E323-K388 PolarHBondContact O-NZ 2.96Å; E323-F390 HydrophobicContact CB-CE2 4.48Å
324	V	84.5	Confident	87	Confident	2 Å²	2	29.4 Å²	29.4	1%	0.012	15%	0.153	C	C	.	.			trans	-91.4	126.4	176	-58.5	0	0	0	0	111	V320 L329 Y384 L385 F390 F413	V320-V324 HydrophobicContact CG1-CG1 4.36Å; V320-V324 PolarHBondContact O-N 2.91Å; V324-L329 HydrophobicContact CB-CD1 3.89Å; V324-L329 HydrophobicContact CG1-CD1 4.46Å; V324-L329 HydrophobicContact CG2-CD1 4.31Å; V324-Y384 HydrophobicContact CB-CE1 4.08Å; V324-Y384 HydrophobicContact CG1-CE1 4.3Å; V324-L385 HydrophobicContact CG1-CD2 3.81Å; V324-F390 HydrophobicContact CG1-CD2 3.99Å; V324-F390 HydrophobicContact CG1-CE2 4.01Å; V324-F413 HydrophobicContact CG2-CZ 4.39Å
325	K	87.6	Confident	87.5	Confident	54 Å²	54	29 Å²	29	24%	0.235	15%	0.151	C	C	.	.			trans	-140.8	97.4	-179.8	-71.8	-175.7	171.4	-169.6	0	108.8	E129 Y257 Y384	E129-K325 WeakPolarHBondContact OE1-CD 3.46Å; E129-K325 IonicContact OE1-NZ 3.68Å; E129-K325 PolarHBondContact OE1-NZ 2.79Å; E129-K325 IonicContact OE2-NZ 2.68Å; E129-K325 PolarHBondContact OE2-NZ 3.19Å; Y257-K325 HydrophobicContact CD1-CB 3.97Å; Y257-K325 HydrophobicContact CD1-CG 4.11Å; Y257-K325 HydrophobicContact CD2-CB 4.04Å; Y257-K325 HydrophobicContact CD2-CD 3.97Å; Y257-K325 HydrophobicContact CD2-CG 4.28Å; Y257-K325 HydrophobicContact CE1-CB 3.99Å; Y257-K325 HydrophobicContact CE2-CB 4.06Å; Y257-K325 HydrophobicContact CG-CB 3.99Å; Y257-K325 HydrophobicContact CG-CD 3.88Å; Y257-K325 HydrophobicContact CG-CG 3.91Å; K325-Y384 PolarHBondContact N-OH 3.5Å; K325-Y384 WeakPolarHBondContact O-CE2 3.31Å; K325-Y384 PolarHBondContact O-OH 3.43Å; K325-Y384 VanDerWaalsContact O-OH 3.13Å
326	H	90	Very high	88	Confident	25 Å²	25	26 Å²	26	12%	0.116	14%	0.135	C	C	.	.			trans	-149.1	142.5	-178.4	-166.1	-103.6	0	0	0	109.7	Y257 N328 L329 Y384	Y257-H326 WeakPolarHBondContact OH-CA 3.2Å; Y257-H326 PolarHBondContact OH-N 3.42Å; H326-N328 PolarHBondContact ND1-N 2.97Å; H326-N328 PolarHBondContact O-N 3.41Å; H326-N328 VanDerWaalsContact O-N 3.16Å; H326-L329 HydrophobicContact CB-CB 4.13Å; H326-L329 HydrophobicContact CB-CD1 3.74Å; H326-L329 HydrophobicContact CB-CG 3.8Å; H326-L329 PolarHBondContact O-N 2.95Å; H326-Y384 HydrophobicContact CB-CD1 4.06Å; H326-Y384 HydrophobicContact CB-CD2 4.08Å; H326-Y384 HydrophobicContact CB-CE1 4.36Å; H326-Y384 HydrophobicContact CB-CE2 4.35Å; H326-Y384 HydrophobicContact CB-CG 3.92Å; H326-Y384 AromaticContact CD2-CD2 3.48Å; H326-Y384 VanDerWaalsContact CD2-CD2 3.48Å; H326-Y384 WeakPolarHBondContact CD2-CD2 3.44Å; H326-Y384 AromaticContact CD2-CG 3.68Å; H326-Y384 AromaticContact CG-CG 3.88Å
327	P	89.3	Confident	88.4	Confident	54 Å²	54	23.9 Å²	23.9	35%	0.351	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-30.1	179.2	22.7	-35.2	0	0	0	113.4	Y257 K409	Y257-P327 WeakPolarHBondContact OH-CD 3.48Å; P327-K409 WeakPolarHBondContact O-CE 3.3Å; P327-K409 PolarHBondContact O-NZ 3.21Å
328	N	94.6	Very high	88.6	Confident	18 Å²	18	30.5 Å²	30.5	10%	0.096	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	20.2	-178.1	-58.1	102.9	0	0	0	114.3	H326 Q377 A381 V408 K409 V410	H326-N328 PolarHBondContact ND1-N 2.97Å; H326-N328 PolarHBondContact O-N 3.41Å; H326-N328 VanDerWaalsContact O-N 3.16Å; N328-Q377 WeakPolarHBondContact CB-O 3.4Å; N328-Q377 WeakPolarHBondContact ND2-CB 3.3Å; N328-Q377 WeakPolarHBondContact ND2-CG 3.47Å; N328-Q377 PolarHBondContact ND2-OE1 3.12Å; N328-A381 HydrophobicContact CB-CB 3.82Å; N328-A381 WeakPolarHBondContact O-CB 3.18Å; N328-V408 WeakPolarHBondContact CB-O 3.46Å; N328-V408 PolarHBondContact ND2-O 3.08Å; N328-K409 CarbonylContact O-C 3.55Å; N328-K409 WeakPolarHBondContact O-CA 3.4Å; N328-V410 PolarHBondContact O-N 2.79Å
329	L	93.5	Very high	88.8	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-115.9	143.7	165.1	-64	176.3	0	0	0	108.4	V324 H326 Q331 A381 Y384 L385 V410 F413	V324-L329 HydrophobicContact CB-CD1 3.89Å; V324-L329 HydrophobicContact CG1-CD1 4.46Å; V324-L329 HydrophobicContact CG2-CD1 4.31Å; H326-L329 HydrophobicContact CB-CB 4.13Å; H326-L329 HydrophobicContact CB-CD1 3.74Å; H326-L329 HydrophobicContact CB-CG 3.8Å; H326-L329 PolarHBondContact O-N 2.95Å; L329-Q331 PolarHBondContact O-N 3.17Å; L329-A381 HydrophobicContact CD2-CB 3.78Å; L329-A381 HydrophobicContact CG-CB 4.25Å; L329-Y384 HydrophobicContact CD1-CD1 3.67Å; L329-Y384 HydrophobicContact CD1-CE1 4.05Å; L329-L385 HydrophobicContact CD1-CD2 3.81Å; L329-L385 HydrophobicContact CD1-CG 4.19Å; L329-L385 HydrophobicContact CD2-CD1 4.14Å; L329-L385 HydrophobicContact CD2-CG 4.32Å; L329-V410 HydrophobicContact CD2-CB 4Å; L329-F413 HydrophobicContact CB-CZ 4.15Å; L329-F413 HydrophobicContact CD2-CE1 4.2Å; L329-F413 HydrophobicContact CD2-CZ 3.92Å; L329-F413 HydrophobicContact CG-CZ 4.43Å
330	V	92.5	Very high	88.8	Confident	8 Å²	8	37.3 Å²	37.3	5%	0.048	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-65.8	121	179.5	170.5	0	0	0	0	110.3	M321 T346 E347 L401 K409 V410 A411	M321-V330 HydrophobicContact CE-CG1 4.36Å; M321-V330 WeakPolarHBondContact CE-O 3.27Å; V330-T346 HydrophobicContact CG1-CG2 4.05Å; V330-E347 HydrophobicContact CG1-CG 4.35Å; V330-L401 HydrophobicContact CG2-CD1 4.03Å; V330-L401 HydrophobicContact CG2-CG 4.48Å; V330-K409 HydrophobicContact CG2-CB 3.67Å; V330-V410 PolarHBondContact N-O 3.47Å; V330-A411 HydrophobicContact CB-CB 4.3Å; V330-A411 HydrophobicContact CG2-CB 3.63Å
331	Q	89.3	Confident	89	Confident	5 Å²	5	38.7 Å²	38.7	2%	0.023	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-83.8	130.5	-171.7	-174.9	50.9	51.4	0	0	112.6	Y257 L329 T346 E347	Y257-Q331 HydrophobicContact CD1-CG 4.27Å; L329-Q331 PolarHBondContact O-N 3.17Å; Q331-T346 VanDerWaalsContact O-CA 3.31Å; Q331-T346 WeakPolarHBondContact O-CA 3.32Å; Q331-T346 WeakPolarHBondContact O-CB 3.37Å; Q331-E347 WeakPolarHBondContact CB-OE1 3.42Å; Q331-E347 PolarHBondContact N-OE1 3.49Å; Q331-E347 PolarHBondContact O-N 3.21Å
332	L	90.4	Very high	89.2	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	127.9	165.2	-169.6	67.1	0	0	0	110.6	W266 M321 K322 G334 V335 I344	W266-L332 HydrophobicContact CD2-CD2 4.25Å; W266-L332 HydrophobicContact CE3-CD2 3.76Å; W266-L332 HydrophobicContact CE3-CG 4.11Å; W266-L332 HydrophobicContact CZ3-CB 4.15Å; W266-L332 HydrophobicContact CZ3-CD2 3.93Å; W266-L332 HydrophobicContact CZ3-CG 4.07Å; M321-L332 HydrophobicContact CB-CB 4.11Å; M321-L332 HydrophobicContact CB-CD1 4.37Å; M321-L332 HydrophobicContact CB-CD2 4.23Å; M321-L332 HydrophobicContact CB-CG 4.48Å; M321-L332 WeakPolarHBondContact O-CB 3.4Å; K322-L332 HydrophobicContact CG-CD2 3.55Å; L332-G334 WeakPolarHBondContact CD1-O 3.27Å; L332-V335 HydrophobicContact CD1-CG1 4.07Å; L332-V335 HydrophobicContact CD2-CG1 4.44Å; L332-I344 HydrophobicContact CD1-CG2 3.72Å
333	L	89.1	Confident	89.5	Confident	18 Å²	18	38.2 Å²	38.2	9%	0.094	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	-27.8	171	-58.6	-179.6	0	0	0	111.5	V259 W292 L297 V299 V345	V259-L333 HydrophobicContact CG1-CB 4.43Å; V259-L333 HydrophobicContact CG1-CD2 4.4Å; W292-L333 HydrophobicContact CZ3-CB 4.19Å; L297-L333 HydrophobicContact CD2-CD1 3.83Å; V299-L333 HydrophobicContact CG1-CD1 3.66Å; L333-V345 PolarHBondContact N-O 3.45Å
334	G	90.1	Very high	89.9	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.01	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.9	-168.2	170	0	0	0	0	0	112.3	W266 M268 L332 V345	W266-G334 CarbonylContact O-C 3.57Å; W266-G334 WeakPolarHBondContact O-CA 3.44Å; M268-G334 VanDerWaalsContact CE-CA 3.4Å; L332-G334 WeakPolarHBondContact CD1-O 3.27Å; G334-V345 PolarHBondContact N-O 3.35Å; G334-V345 PolarHBondContact O-N 3.13Å
335	V	92.3	Very high	90.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	162.7	-176.4	-67.3	0	0	0	0	111.3	W266 E267 M268 A318 L332 T337 Y343 I344	W266-V335 HydrophobicContact CB-CG2 4.19Å; W266-V335 PolarHBondContact O-N 3.12Å; E267-V335 WeakPolarHBondContact CA-O 3.46Å; E267-V335 WeakPolarHBondContact OE1-CG2 3.49Å; M268-V335 PolarHBondContact N-O 3.32Å; A318-V335 HydrophobicContact CB-CG1 4.15Å; L332-V335 HydrophobicContact CD1-CG1 4.07Å; L332-V335 HydrophobicContact CD2-CG1 4.44Å; V335-T337 HydrophobicContact CB-CG2 4Å; V335-T337 HydrophobicContact CG2-CG2 4.09Å; V335-Y343 CarbonylContact C-O 3.57Å; V335-Y343 VanDerWaalsContact CA-O 3.3Å; V335-Y343 WeakPolarHBondContact CA-O 3.43Å; V335-I344 HydrophobicContact CG1-CG1 4.35Å
336	C	92.3	Very high	90.5	Very high	4 Å²	4	30.8 Å²	30.8	3%	0.027	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	102	161.3	-56.2	0	0	0	0	107.6	E267 M268 F342 Y343	E267-C336 WeakPolarHBondContact OE2-CA 2.96Å; M268-C336 VanDerWaalsContact CG-SG 3.56Å; M268-C336 PolarHBondContact O-SG 3.37Å; C336-F342 VanDerWaalsContact O-CA 3.3Å; C336-F342 WeakPolarHBondContact O-CA 3.39Å; C336-Y343 PolarHBondContact N-O 3.39Å; C336-Y343 PolarHBondContact O-N 3.03Å
337	T	90.1	Very high	90.6	Very high	43 Å²	43	31.6 Å²	31.6	26%	0.264	17%	0.173	S	C	.	.			trans	-119.5	-3.9	-179.6	74.7	0	0	0	0	114.5	E267 L315 V335 E339 F342	E267-T337 WeakPolarHBondContact OE1-CB 3.2Å; E267-T337 PolarHBondContact OE1-N 2.84Å; E267-T337 PolarHBondContact OE1-OG1 3.15Å; E267-T337 PolarHBondContact OE2-N 2.9Å; L315-T337 HydrophobicContact CD2-CG2 3.68Å; V335-T337 HydrophobicContact CB-CG2 4Å; V335-T337 HydrophobicContact CG2-CG2 4.09Å; T337-E339 VanDerWaalsContact C-N 3.3Å; T337-E339 PolarHBondContact O-N 3.26Å; T337-F342 WeakPolarHBondContact O-CE1 3.48Å
338	L	88.4	Confident	90.8	Very high	148 Å²	148	32.5 Å²	32.5	78%	0.775	17%	0.17	S	C	*	.	S	Bend	trans	-64	-30.3	-179.3	-59.3	179.2	0	0	0	114.2	E267	E267-L338 HydrophobicContact CG-CD2 4.44Å; E267-L338 HydrophobicContact CG-CG 4.49Å
339	E	87.1	Confident	90.7	Very high	110 Å²	110	32.3 Å²	32.3	51%	0.514	17%	0.168	S	C	.	.	S	Bend	trans	-155.7	154.5	-179.4	40.9	159.4	-126	0	0	110.7	R270 T337 F342	R270-E339 IonicContact CZ-OE1 2.64Å; R270-E339 IonicContact NH1-OE1 3.89Å; R270-E339 PolarHBondContact NH1-OE1 3.1Å; R270-E339 PolarHBondContact NH2-O 2.95Å; R270-E339 IonicContact NH2-OE1 2.8Å; R270-E339 PolarHBondContact NH2-OE1 3.28Å; T337-E339 VanDerWaalsContact C-N 3.3Å; T337-E339 PolarHBondContact O-N 3.26Å; E339-F342 VanDerWaalsContact C-CE1 3.41Å; E339-F342 VanDerWaalsContact O-CD1 3.26Å; E339-F342 WeakPolarHBondContact O-CD1 3.33Å
340	P	85.4	Confident	90.6	Very high	86 Å²	86	34.8 Å²	34.8	56%	0.558	19%	0.185	S	C	*	.	S	Bend	trans	-66.9	155	171.4	-21.3	34.4	0	0	0	113.1	R270 F342	R270-P340 VanDerWaalsContact NH2-C 3.29Å; R270-P340 PolarHBondContact NH2-O 3.25Å; P340-F342 HydrophobicContact CG-CE1 4.23Å; P340-F342 HydrophobicContact CG-CZ 4.2Å
341	P	87.5	Confident	90.7	Very high	44 Å²	44	39 Å²	39	29%	0.286	20%	0.204	S	C	.	.	S	Bend	cis	-69.8	141.6	-11.7	29.9	-35.3	0	0	0	110.9	R270 Y343	R270-P341 PolarHBondContact NE-O 2.85Å; R270-P341 VanDerWaalsContact NE-O 3.15Å; R270-P341 PolarHBondContact NH2-O 2.82Å; R270-P341 VanDerWaalsContact NH2-O 3.09Å; P341-Y343 HydrophobicContact CB-CE1 4.2Å; P341-Y343 HydrophobicContact CG-CE1 3.93Å
342	F	89.5	Confident	90.9	Very high	36 Å²	36	40.4 Å²	40.4	16%	0.158	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-82.7	134.5	180	-58.4	-41.3	0	0	0	111.5	L304 V311 F314 C336 T337 E339 P340	L304-F342 HydrophobicContact CD2-CD2 4.05Å; L304-F342 PolarHBondContact N-O 3.46Å; V311-F342 HydrophobicContact CG1-CD2 4.37Å; V311-F342 HydrophobicContact CG1-CE2 3.81Å; V311-F342 HydrophobicContact CG2-CE2 4.46Å; F314-F342 HydrophobicContact CD1-CB 4.17Å; F314-F342 HydrophobicContact CE1-CB 3.61Å; F314-F342 HydrophobicContact CZ-CB 4.32Å; F314-F342 WeakPolarHBondContact CZ-O 3.37Å; C336-F342 VanDerWaalsContact O-CA 3.3Å; C336-F342 WeakPolarHBondContact O-CA 3.39Å; T337-F342 WeakPolarHBondContact O-CE1 3.48Å; E339-F342 VanDerWaalsContact C-CE1 3.41Å; E339-F342 VanDerWaalsContact O-CD1 3.26Å; E339-F342 WeakPolarHBondContact O-CD1 3.33Å; P340-F342 HydrophobicContact CG-CE1 4.23Å; P340-F342 HydrophobicContact CG-CZ 4.2Å
343	Y	92.1	Very high	91.1	Very high	26 Å²	26	42 Å²	42	10%	0.102	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	137.6	-178.8	-67.9	-3.8	0	0	0	111.4	R270 I273 M275 V301 K302 T303 V335 C336 P341	R270-Y343 HydrophobicContact CG-CD2 3.8Å; R270-Y343 HydrophobicContact CG-CE2 3.36Å; I273-Y343 HydrophobicContact CG2-CE2 4.39Å; M275-Y343 HydrophobicContact CE-CE1 4.43Å; M275-Y343 HydrophobicContact CE-CE2 4.5Å; M275-Y343 HydrophobicContact SD-CE2 3.93Å; V301-Y343 HydrophobicContact CG1-CD1 4.11Å; V301-Y343 HydrophobicContact CG1-CD2 3.68Å; V301-Y343 HydrophobicContact CG1-CE2 4.15Å; V301-Y343 HydrophobicContact CG1-CG 3.66Å; K302-Y343 WeakPolarHBondContact O-CA 3.39Å; T303-Y343 HydrophobicContact CG2-CD1 3.62Å; T303-Y343 HydrophobicContact CG2-CE1 3.51Å; V335-Y343 CarbonylContact C-O 3.57Å; V335-Y343 VanDerWaalsContact CA-O 3.3Å; V335-Y343 WeakPolarHBondContact CA-O 3.43Å; C336-Y343 PolarHBondContact N-O 3.39Å; C336-Y343 PolarHBondContact O-N 3.03Å; P341-Y343 HydrophobicContact CB-CE1 4.2Å; P341-Y343 HydrophobicContact CG-CE1 3.93Å
344	I	91.9	Very high	91.5	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	125.4	158.3	-67.5	166	0	0	0	106.6	V301 K302 F314 E317 A318 M321 L332 V335 T346	V301-I344 WeakPolarHBondContact CA-O 3.25Å; K302-I344 HydrophobicContact CB-CB 4.27Å; K302-I344 PolarHBondContact N-O 3.31Å; K302-I344 PolarHBondContact O-N 2.84Å; F314-I344 HydrophobicContact CD1-CD1 4.17Å; F314-I344 HydrophobicContact CD1-CG1 4.43Å; F314-I344 HydrophobicContact CD2-CD1 4.14Å; F314-I344 HydrophobicContact CE1-CD1 3.92Å; F314-I344 HydrophobicContact CE1-CG1 3.75Å; F314-I344 HydrophobicContact CE2-CD1 3.91Å; F314-I344 HydrophobicContact CE2-CG1 4.26Å; F314-I344 HydrophobicContact CG-CD1 4.28Å; F314-I344 HydrophobicContact CZ-CB 4.29Å; F314-I344 HydrophobicContact CZ-CD1 3.8Å; F314-I344 HydrophobicContact CZ-CG1 3.67Å; E317-I344 HydrophobicContact CB-CD1 4.3Å; E317-I344 HydrophobicContact CG-CD1 4.21Å; A318-I344 HydrophobicContact CB-CD1 3.94Å; A318-I344 HydrophobicContact CB-CG1 3.98Å; M321-I344 HydrophobicContact SD-CG2 4.16Å; L332-I344 HydrophobicContact CD1-CG2 3.72Å; V335-I344 HydrophobicContact CG1-CG1 4.35Å; I344-T346 HydrophobicContact CG2-CG2 4.13Å
345	V	92.8	Very high	91.8	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	118.8	-175.4	-174.8	0	0	0	0	109.5	M268 V299 A300 V301 L333 G334	M268-V345 HydrophobicContact CE-CB 3.64Å; M268-V345 HydrophobicContact CE-CG1 3.98Å; M268-V345 HydrophobicContact CE-CG2 3.8Å; M268-V345 HydrophobicContact SD-CB 4.32Å; M268-V345 HydrophobicContact SD-CG1 4.43Å; M268-V345 HydrophobicContact SD-CG2 3.92Å; V299-V345 HydrophobicContact CB-CG1 3.79Å; V299-V345 HydrophobicContact CG1-CG1 4.1Å; V299-V345 HydrophobicContact CG2-CG1 3.83Å; A300-V345 WeakPolarHBondContact O-CA 3.41Å; V301-V345 HydrophobicContact CG1-CG2 4.39Å; V301-V345 HydrophobicContact CG2-CG2 4.43Å; L333-V345 PolarHBondContact N-O 3.45Å; G334-V345 PolarHBondContact N-O 3.35Å; G334-V345 PolarHBondContact O-N 3.13Å
346	T	92.9	Very high	92	Very high	18 Å²	18	45.5 Å²	45.5	11%	0.11	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	171	-178.1	69.7	0	0	0	0	111.2	V299 A300 M321 V330 Q331 I344	V299-T346 WeakPolarHBondContact CA-O 3.28Å; V299-T346 WeakPolarHBondContact CB-O 3.27Å; A300-T346 PolarHBondContact N-O 3.12Å; A300-T346 PolarHBondContact O-N 3.35Å; M321-T346 HydrophobicContact CE-CG2 3.69Å; M321-T346 HydrophobicContact SD-CG2 4.45Å; V330-T346 HydrophobicContact CG1-CG2 4.05Å; Q331-T346 VanDerWaalsContact O-CA 3.31Å; Q331-T346 WeakPolarHBondContact O-CA 3.32Å; Q331-T346 WeakPolarHBondContact O-CB 3.37Å; I344-T346 HydrophobicContact CG2-CG2 4.13Å
347	E	90.6	Very high	92.2	Very high	42 Å²	42	47 Å²	47	20%	0.196	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.7	150.8	164.3	68.2	-167.3	134.9	0	0	111.7	V330 Q331 M349 K409	V330-E347 HydrophobicContact CG1-CG 4.35Å; Q331-E347 WeakPolarHBondContact CB-OE1 3.42Å; Q331-E347 PolarHBondContact N-OE1 3.49Å; Q331-E347 PolarHBondContact O-N 3.21Å; E347-M349 HydrophobicContact CG-SD 4.28Å; E347-K409 WeakPolarHBondContact OE1-CD 3.36Å; E347-K409 WeakPolarHBondContact OE1-CE 3.45Å; E347-K409 IonicContact OE1-NZ 2.67Å; E347-K409 PolarHBondContact OE1-NZ 3.13Å; E347-K409 WeakPolarHBondContact OE2-CE 3.31Å; E347-K409 IonicContact OE2-NZ 3.98Å; E347-K409 PolarHBondContact OE2-NZ 3.01Å
348	Y	93.4	Very high	92.5	Very high	72 Å²	72	44.9 Å²	44.9	28%	0.282	24%	0.239	S	C	.	.			trans	-94.9	130.5	175.7	174.5	-107.3	0	0	0	110.4	L279 V289 T298 P350	L279-Y348 HydrophobicContact CD1-CD2 4.22Å; L279-Y348 HydrophobicContact CD1-CE2 3.96Å; L279-Y348 HydrophobicContact CD2-CE2 4.14Å; V289-Y348 HydrophobicContact CG2-CD2 4.39Å; V289-Y348 HydrophobicContact CG2-CE2 3.84Å; T298-Y348 HydrophobicContact CG2-CD1 3.73Å; T298-Y348 HydrophobicContact CG2-CD2 4.39Å; T298-Y348 HydrophobicContact CG2-CE1 4.34Å; T298-Y348 HydrophobicContact CG2-CG 3.77Å; T298-Y348 WeakPolarHBondContact O-CB 3.39Å; Y348-P350 HydrophobicContact CE1-CB 3.95Å; Y348-P350 WeakPolarHBondContact O-CD 3.46Å
349	M	93.7	Very high	92.9	Very high	14 Å²	14	43.7 Å²	43.7	7%	0.069	22%	0.224	C	C	.	.			trans	-106	102.7	-177.5	-63.2	-65.2	-75.1	0	0	109.4	E347 H351 G352 L401 V402 K409	E347-M349 HydrophobicContact CG-SD 4.28Å; M349-H351 VanDerWaalsContact C-N 3.32Å; M349-H351 PolarHBondContact O-N 2.94Å; M349-G352 PolarHBondContact O-N 3.45Å; M349-L401 HydrophobicContact CB-CB 3.75Å; M349-L401 HydrophobicContact CB-CD1 4.12Å; M349-L401 HydrophobicContact CE-CB 4.08Å; M349-L401 VanDerWaalsContact CE-O 3.31Å; M349-L401 WeakPolarHBondContact CE-O 3.16Å; M349-L401 HydrophobicContact CG-CB 3.67Å; M349-L401 HydrophobicContact CG-CD1 3.87Å; M349-L401 HydrophobicContact CG-CG 4.45Å; M349-V402 CarbonylContact C-O 3.54Å; M349-K409 HydrophobicContact CE-CB 3.93Å; M349-K409 HydrophobicContact CE-CD 3.95Å; M349-K409 HydrophobicContact CE-CG 3.66Å; M349-K409 HydrophobicContact SD-CD 3.99Å; M349-K409 HydrophobicContact SD-CG 4.37Å
350	P	92.1	Very high	93.3	Very high	54 Å²	54	45.3 Å²	45.3	35%	0.351	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-23.4	-164.2	21.3	-34.3	0	0	0	116.3	Y348 E404	Y348-P350 HydrophobicContact CE1-CB 3.95Å; Y348-P350 WeakPolarHBondContact O-CD 3.46Å; P350-E404 HydrophobicContact CG-CG 3.97Å
351	H	93.5	Very high	93.6	Very high	96 Å²	96	42.2 Å²	42.2	44%	0.444	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	11.7	-179.4	-61.8	-82.6	0	0	0	113.2	M349 Y357 V402 G403	M349-H351 VanDerWaalsContact C-N 3.32Å; M349-H351 PolarHBondContact O-N 2.94Å; H351-Y357 HydrophobicContact CB-CD2 3.87Å; H351-Y357 HydrophobicContact CB-CE2 4.17Å; H351-V402 HydrophobicContact CB-CB 3.86Å; H351-V402 HydrophobicContact CB-CG1 3.88Å; H351-V402 WeakPolarHBondContact CB-O 3.23Å; H351-V402 PolarHBondContact N-O 2.83Å; H351-V402 VanDerWaalsContact N-O 3.07Å; H351-G403 PolarHBondContact CD2-O 3.37Å
352	G	93.3	Very high	93.8	Very high	34 Å²	34	46.6 Å²	46.6	35%	0.351	23%	0.233	S	C	.	.			trans	71.9	-138.4	175.8	0	0	0	0	0	112.7	M349 L401 V402	M349-G352 PolarHBondContact O-N 3.45Å; G352-L401 CarbonylContact O-C 3.54Å; G352-L401 VanDerWaalsContact O-CA 3.27Å; G352-L401 WeakPolarHBondContact O-CA 3Å; G352-V402 PolarHBondContact O-N 3.12Å
353	N	95.1	Very high	93.8	Very high	36 Å²	36	50.6 Å²	50.6	19%	0.193	25%	0.25	C	S	.	.	B	Isolated β-bridge	trans	-98.1	153.4	-179.5	76.9	81.7	0	0	0	112.3	L355 D356 Y357 R398 C400 L401	N353-L355 VanDerWaalsContact C-N 3.31Å; N353-L355 PolarHBondContact O-N 3.26Å; N353-L355 WeakPolarHBondContact OD1-CB 3.32Å; N353-L355 PolarHBondContact OD1-N 2.72Å; N353-D356 PolarHBondContact ND2-OD2 3.11Å; N353-D356 PolarHBondContact O-N 2.8Å; N353-D356 PolarHBondContact OD1-N 3Å; N353-D356 VanDerWaalsContact OD1-N 3.08Å; N353-Y357 VanDerWaalsContact O-CB 3.28Å; N353-Y357 WeakPolarHBondContact O-CB 3.48Å; N353-Y357 PolarHBondContact O-N 2.88Å; N353-R398 WeakPolarHBondContact CB-O 3.3Å; N353-C400 CarbonylContact C-O 3.43Å; N353-C400 VanDerWaalsContact CA-O 3.28Å; N353-C400 WeakPolarHBondContact CA-O 3.34Å; N353-L401 HydrophobicContact CB-CD2 3.95Å
354	L	97.3	Very high	93.4	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-66	-30.9	-174.5	-179.2	63.5	0	0	0	112.8	Y357 L358 M374 I378 A397 C400 V402 V408 I463	L354-Y357 HydrophobicContact CD1-CD1 4.33Å; L354-L358 HydrophobicContact CD1-CD1 4.05Å; L354-L358 HydrophobicContact CD1-CD2 4.4Å; L354-L358 HydrophobicContact CD1-CG 3.86Å; L354-L358 HydrophobicContact CG-CD1 3.84Å; L354-L358 HydrophobicContact CG-CG 4.16Å; L354-L358 VanDerWaalsContact O-CB 3.27Å; L354-L358 WeakPolarHBondContact O-CB 3.2Å; L354-L358 WeakPolarHBondContact O-CD1 3.41Å; L354-L358 WeakPolarHBondContact O-CG 3.47Å; L354-L358 PolarHBondContact O-N 2.86Å; L354-M374 HydrophobicContact CD1-CE 4.11Å; L354-M374 HydrophobicContact CD1-SD 3.59Å; L354-M374 VanDerWaalsContact CD1-SD 3.59Å; L354-I378 HydrophobicContact CD2-CD1 3.82Å; L354-A397 HydrophobicContact CB-CB 4.5Å; L354-A397 WeakPolarHBondContact CB-O 3.43Å; L354-A397 PolarHBondContact N-O 2.97Å; L354-C400 HydrophobicContact CB-CB 3.83Å; L354-C400 HydrophobicContact CD2-CB 3.93Å; L354-C400 PolarHBondContact N-O 3.35Å; L354-V402 HydrophobicContact CB-CG2 3.91Å; L354-V402 HydrophobicContact CD1-CG2 3.78Å; L354-V402 HydrophobicContact CG-CG2 4.47Å; L354-V408 HydrophobicContact CD2-CG1 4.38Å; L354-I463 HydrophobicContact CD2-CD1 4.24Å; L354-I463 HydrophobicContact CD2-CG1 4.16Å
355	L	96.7	Very high	93.2	Very high	21 Å²	21	58 Å²	58	11%	0.11	29%	0.294	C	S	.	.	H	α-helix	trans	-66.4	-43.7	-179.4	-178.7	59.4	0	0	0	112.2	N353 R359 A397 R398	N353-L355 VanDerWaalsContact C-N 3.31Å; N353-L355 PolarHBondContact O-N 3.26Å; N353-L355 WeakPolarHBondContact OD1-CB 3.32Å; N353-L355 PolarHBondContact OD1-N 2.72Å; L355-R359 WeakPolarHBondContact O-CD 3.35Å; L355-R359 WeakPolarHBondContact O-CG 3.46Å; L355-A397 HydrophobicContact CB-CB 3.74Å; L355-A397 HydrophobicContact CD1-CB 4.18Å; L355-A397 PolarHBondContact N-O 3.48Å; L355-R398 HydrophobicContact CD2-CB 4.28Å
356	D	95.8	Very high	93.2	Very high	70 Å²	70	58 Å²	58	37%	0.374	29%	0.294	S	S	.	.	H	α-helix	trans	-79	-37.9	177.8	-60.9	-35.3	0	0	0	110.8	N353 L358 R359 D360	N353-D356 PolarHBondContact ND2-OD2 3.11Å; N353-D356 PolarHBondContact O-N 2.8Å; N353-D356 PolarHBondContact OD1-N 3Å; N353-D356 VanDerWaalsContact OD1-N 3.08Å; D356-L358 VanDerWaalsContact C-N 3.33Å; D356-L358 PolarHBondContact O-N 2.64Å; D356-R359 WeakPolarHBondContact O-CB 3.04Å; D356-R359 PolarHBondContact O-N 2.8Å; D356-R359 IonicContact OD1-NH1 2.66Å; D356-R359 PolarHBondContact OD1-NH1 3.23Å; D356-R359 VanDerWaalsContact OD1-NH1 3.1Å; D356-D360 PolarHBondContact O-N 3.45Å; D356-D360 VanDerWaalsContact O-N 3.09Å
357	Y	96.8	Very high	93.1	Very high	35 Å²	35	59.4 Å²	59.4	14%	0.137	30%	0.301	C	S	.	.	H	α-helix	trans	-56	-43.4	172.9	-179.2	-99.3	0	0	0	113	H351 N353 L354 R359 D360 C361 V366 M374 V402 H406	H351-Y357 HydrophobicContact CB-CD2 3.87Å; H351-Y357 HydrophobicContact CB-CE2 4.17Å; N353-Y357 VanDerWaalsContact O-CB 3.28Å; N353-Y357 WeakPolarHBondContact O-CB 3.48Å; N353-Y357 PolarHBondContact O-N 2.88Å; L354-Y357 HydrophobicContact CD1-CD1 4.33Å; Y357-R359 PolarHBondContact O-N 3.37Å; Y357-D360 PolarHBondContact O-N 2.96Å; Y357-C361 HydrophobicContact CE1-CB 4.44Å; Y357-C361 WeakPolarHBondContact O-CB 3.49Å; Y357-C361 PolarHBondContact O-N 3.39Å; Y357-C361 VanDerWaalsContact O-N 3.11Å; Y357-C361 PolarHBondContact O-SG 2.9Å; Y357-V366 HydrophobicContact CE1-CG2 4.13Å; Y357-V366 WeakPolarHBondContact OH-CG2 3.5Å; Y357-M374 HydrophobicContact CE1-SD 4.36Å; Y357-V402 HydrophobicContact CD1-CG1 4.13Å; Y357-V402 HydrophobicContact CD1-CG2 4.04Å; Y357-V402 HydrophobicContact CD2-CG1 4.31Å; Y357-V402 HydrophobicContact CE1-CG1 4.2Å; Y357-V402 HydrophobicContact CE2-CG1 4.38Å; Y357-V402 HydrophobicContact CG-CB 4.32Å; Y357-V402 HydrophobicContact CG-CG1 4.19Å; Y357-V402 HydrophobicContact CG-CG2 4.05Å; Y357-H406 AromaticContact CZ-CD2 3.97Å; Y357-H406 PolarHBondContact OH-CD2 2.84Å; Y357-H406 PolarHBondContact OH-NE2 2.94Å
358	L	97.2	Very high	93.1	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-65	-22.9	177.2	-78.7	168.9	0	0	0	114	L354 D356 C361 L371 M374 I463 Y466	L354-L358 HydrophobicContact CD1-CD1 4.05Å; L354-L358 HydrophobicContact CD1-CD2 4.4Å; L354-L358 HydrophobicContact CD1-CG 3.86Å; L354-L358 HydrophobicContact CG-CD1 3.84Å; L354-L358 HydrophobicContact CG-CG 4.16Å; L354-L358 VanDerWaalsContact O-CB 3.27Å; L354-L358 WeakPolarHBondContact O-CB 3.2Å; L354-L358 WeakPolarHBondContact O-CD1 3.41Å; L354-L358 WeakPolarHBondContact O-CG 3.47Å; L354-L358 PolarHBondContact O-N 2.86Å; D356-L358 VanDerWaalsContact C-N 3.33Å; D356-L358 PolarHBondContact O-N 2.64Å; L358-C361 PolarHBondContact O-SG 3.48Å; L358-L371 HydrophobicContact CD2-CD2 3.55Å; L358-M374 HydrophobicContact CD2-CE 3.98Å; L358-I463 HydrophobicContact CD1-CG1 4.17Å; L358-Y466 WeakPolarHBondContact O-CB 3.32Å
359	R	96.6	Very high	92.9	Very high	122 Å²	122	55.4 Å²	55.4	46%	0.46	29%	0.288	S	S	.	.	H	α-helix	trans	-87	-37	-179.9	-69.6	166.2	176.4	160.3	-1.2	112.3	L355 D356 Y357 G467	L355-R359 WeakPolarHBondContact O-CD 3.35Å; L355-R359 WeakPolarHBondContact O-CG 3.46Å; D356-R359 WeakPolarHBondContact O-CB 3.04Å; D356-R359 PolarHBondContact O-N 2.8Å; D356-R359 IonicContact OD1-NH1 2.66Å; D356-R359 PolarHBondContact OD1-NH1 3.23Å; D356-R359 VanDerWaalsContact OD1-NH1 3.1Å; Y357-R359 PolarHBondContact O-N 3.37Å; R359-G467 PolarHBondContact NE-O 3.23Å; R359-G467 PolarHBondContact NH2-O 2.92Å
360	D	94.9	Very high	92.9	Very high	144 Å²	144	54.9 Å²	54.9	77%	0.77	29%	0.286	S	S	*	.	H	α-helix	trans	-94.6	-7.8	-173.2	-67.8	-8.8	0	0	0	113.2	D356 Y357	D356-D360 PolarHBondContact O-N 3.45Å; D356-D360 VanDerWaalsContact O-N 3.09Å; Y357-D360 PolarHBondContact O-N 2.96Å
361	C	92.8	Very high	93.1	Very high	21 Å²	21	53.2 Å²	53.2	14%	0.142	27%	0.274	C	S	.	.	S	Bend	trans	-77.6	155.5	-177.4	68.2	0	0	0	0	114.9	Y357 L358 K363 V366	Y357-C361 HydrophobicContact CE1-CB 4.44Å; Y357-C361 WeakPolarHBondContact O-CB 3.49Å; Y357-C361 PolarHBondContact O-N 3.39Å; Y357-C361 VanDerWaalsContact O-N 3.11Å; Y357-C361 PolarHBondContact O-SG 2.9Å; L358-C361 PolarHBondContact O-SG 3.48Å; C361-K363 PolarHBondContact O-N 3.18Å; C361-V366 HydrophobicContact CB-CB 4.24Å; C361-V366 HydrophobicContact CB-CG2 3.64Å
362	E	91.1	Very high	93.1	Very high	137 Å²	137	49.3 Å²	49.3	64%	0.64	26%	0.256	S	S	*	.			trans	-79.3	116.8	170.7	-154.3	-170.4	144.9	0	0	110.1	S364 E365 V366	E362-S364 VanDerWaalsContact CG-OG 3.26Å; E362-S364 WeakPolarHBondContact CG-OG 3.36Å; E362-S364 PolarHBondContact O-N 3.37Å; E362-S364 VanDerWaalsContact O-N 3.1Å; E362-S364 PolarHBondContact OE1-OG 2.99Å; E362-E365 PolarHBondContact O-N 3.41Å; E362-E365 VanDerWaalsContact O-N 3.08Å; E362-V366 PolarHBondContact O-N 2.96Å
363	K	88.6	Confident	93	Very high	120 Å²	120	49.3 Å²	49.3	52%	0.522	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-10.3	-174.8	-55	-164.9	176.2	-163.8	0	114.9	C361 Y466	C361-K363 PolarHBondContact O-N 3.18Å; K363-Y466 HydrophobicContact CB-CE1 4.07Å; K363-Y466 HydrophobicContact CD-CD1 3.94Å; K363-Y466 HydrophobicContact CD-CD2 4.24Å; K363-Y466 HydrophobicContact CD-CE1 3.83Å; K363-Y466 HydrophobicContact CD-CE2 4.13Å; K363-Y466 HydrophobicContact CD-CG 4.15Å; K363-Y466 HydrophobicContact CG-CD1 3.96Å; K363-Y466 HydrophobicContact CG-CE1 3.65Å
364	S	85	Confident	93.1	Very high	74 Å²	74	47.6 Å²	47.6	52%	0.517	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-42.6	171.4	55.7	0	0	0	0	111.3	E362	E362-S364 VanDerWaalsContact CG-OG 3.26Å; E362-S364 WeakPolarHBondContact CG-OG 3.36Å; E362-S364 PolarHBondContact O-N 3.37Å; E362-S364 VanDerWaalsContact O-N 3.1Å; E362-S364 PolarHBondContact OE1-OG 2.99Å
365	E	87.4	Confident	93.1	Very high	107 Å²	107	47.8 Å²	47.8	50%	0.5	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-58.2	172.4	-178.2	176.5	-158.6	0	0	110	E362 N367 V370 H406	E362-E365 PolarHBondContact O-N 3.41Å; E362-E365 VanDerWaalsContact O-N 3.08Å; E365-N367 PolarHBondContact O-N 2.58Å; E365-N367 PolarHBondContact O-ND2 3.03Å; E365-V370 WeakPolarHBondContact O-CG2 3.4Å; E365-H406 IonicContact OE1-CE1 2.72Å
366	V	91.9	Very high	93.1	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.235	C	C	.	.	S	Bend	trans	-83	62.1	-179.3	-169.2	0	0	0	0	110.3	Y357 C361 E362 V370 L371 M374 Y466	Y357-V366 HydrophobicContact CE1-CG2 4.13Å; Y357-V366 WeakPolarHBondContact OH-CG2 3.5Å; C361-V366 HydrophobicContact CB-CB 4.24Å; C361-V366 HydrophobicContact CB-CG2 3.64Å; E362-V366 PolarHBondContact O-N 2.96Å; V366-V370 HydrophobicContact CG1-CB 4.25Å; V366-V370 HydrophobicContact CG1-CG1 4.07Å; V366-L371 HydrophobicContact CG1-CD2 3.95Å; V366-M374 HydrophobicContact CG1-CE 3.74Å; V366-Y466 WeakPolarHBondContact O-CE1 3.2Å; V366-Y466 PolarHBondContact O-OH 2.79Å; V366-Y466 VanDerWaalsContact O-OH 3.13Å
367	N	91	Very high	93.1	Very high	49 Å²	49	44.5 Å²	44.5	26%	0.262	22%	0.221	S	C	.	.			trans	-79.9	-179.4	177.6	66.4	69.8	0	0	0	112.2	E365 V369 V370 L371	E365-N367 PolarHBondContact O-N 2.58Å; E365-N367 PolarHBondContact O-ND2 3.03Å; N367-V369 VanDerWaalsContact C-N 3.26Å; N367-V369 PolarHBondContact O-N 3.03Å; N367-V369 VanDerWaalsContact O-N 3.13Å; N367-V369 WeakPolarHBondContact OD1-CB 3.47Å; N367-V369 PolarHBondContact OD1-N 3.43Å; N367-V370 WeakPolarHBondContact O-CA 3.21Å; N367-V370 WeakPolarHBondContact O-CB 3.24Å; N367-V370 PolarHBondContact O-N 3.16Å; N367-L371 PolarHBondContact O-N 3Å
368	A	91.1	Very high	93.2	Very high	15 Å²	15	42.9 Å²	42.9	12%	0.124	21%	0.214	C	C	.	.	H	α-helix	trans	-54.4	-33.1	-176.2	0	0	0	0	0	115.3	V370 L371 L372 I533 V537	A368-V370 VanDerWaalsContact C-N 3.33Å; A368-L371 PolarHBondContact O-N 2.78Å; A368-L372 WeakPolarHBondContact O-CB 3.43Å; A368-L372 PolarHBondContact O-N 3.26Å; A368-I533 HydrophobicContact CB-CD1 4.4Å; A368-I533 HydrophobicContact CB-CG1 4.26Å; A368-I533 HydrophobicContact CB-CG2 4.36Å; A368-V537 HydrophobicContact CB-CB 4.46Å; A368-V537 HydrophobicContact CB-CG2 3.76Å
369	V	90	Very high	93.2	Very high	15 Å²	15	42.9 Å²	42.9	9%	0.091	21%	0.214	C	C	.	.	H	α-helix	trans	-66.9	-38.2	175.9	-175.3	0	0	0	0	110.5	E169 N367 Y373 I533 S534	E169-V369 HydrophobicContact CB-CG1 4.38Å; N367-V369 VanDerWaalsContact C-N 3.26Å; N367-V369 PolarHBondContact O-N 3.03Å; N367-V369 VanDerWaalsContact O-N 3.13Å; N367-V369 WeakPolarHBondContact OD1-CB 3.47Å; N367-V369 PolarHBondContact OD1-N 3.43Å; V369-Y373 VanDerWaalsContact O-CB 3.31Å; V369-Y373 WeakPolarHBondContact O-CB 3.48Å; V369-Y373 PolarHBondContact O-N 3Å; V369-I533 HydrophobicContact CB-CG2 4.48Å; V369-I533 HydrophobicContact CG2-CG2 3.87Å; V369-S534 WeakPolarHBondContact CG2-OG 3.48Å
370	V	92.8	Very high	93.2	Very high	2 Å²	2	38 Å²	38	1%	0.012	20%	0.199	C	C	.	.	H	α-helix	trans	-72.1	-42	177.4	-167.8	0	0	0	0	110.7	Y170 E365 V366 N367 A368 L372 Y373 M374 H406	Y170-V370 HydrophobicContact CD2-CG2 4.18Å; Y170-V370 HydrophobicContact CE2-CG1 4.28Å; Y170-V370 HydrophobicContact CE2-CG2 4.12Å; E365-V370 WeakPolarHBondContact O-CG2 3.4Å; V366-V370 HydrophobicContact CG1-CB 4.25Å; V366-V370 HydrophobicContact CG1-CG1 4.07Å; N367-V370 WeakPolarHBondContact O-CA 3.21Å; N367-V370 WeakPolarHBondContact O-CB 3.24Å; N367-V370 PolarHBondContact O-N 3.16Å; A368-V370 VanDerWaalsContact C-N 3.33Å; V370-L372 VanDerWaalsContact C-N 3.35Å; V370-L372 PolarHBondContact O-N 3.08Å; V370-Y373 PolarHBondContact O-N 3.27Å; V370-M374 HydrophobicContact CG1-CE 4.28Å; V370-M374 WeakPolarHBondContact O-CG 3.41Å; V370-M374 PolarHBondContact O-N 3.35Å; V370-H406 HydrophobicContact CG1-CB 3.91Å; V370-H406 VanDerWaalsContact CG1-CD2 3.47Å; V370-H406 WeakPolarHBondContact CG1-CD2 3.28Å; V370-H406 VanDerWaalsContact CG1-CG 3.47Å
371	L	95.7	Very high	93.2	Very high	19 Å²	19	31.2 Å²	31.2	10%	0.099	16%	0.163	C	C	.	.	H	α-helix	trans	-58.7	-45.1	173.7	-63.4	-177.2	0	0	0	111.9	L358 V366 N367 A368 M374 A375 I463 Y466	L358-L371 HydrophobicContact CD2-CD2 3.55Å; V366-L371 HydrophobicContact CG1-CD2 3.95Å; N367-L371 PolarHBondContact O-N 3Å; A368-L371 PolarHBondContact O-N 2.78Å; L371-M374 HydrophobicContact CD2-CE 3.88Å; L371-M374 PolarHBondContact O-N 2.91Å; L371-A375 PolarHBondContact O-N 3.1Å; L371-I463 HydrophobicContact CB-CG2 3.95Å; L371-I463 HydrophobicContact CD2-CG2 4.05Å; L371-I463 HydrophobicContact CG-CG2 4.49Å; L371-Y466 HydrophobicContact CD1-CE1 4.36Å; L371-Y466 HydrophobicContact CD1-CE2 3.97Å; L371-Y466 HydrophobicContact CD2-CE1 4.3Å
372	L	93.3	Very high	93.5	Very high	14 Å²	14	30.2 Å²	30.2	7%	0.073	16%	0.156	C	C	.	.	H	α-helix	trans	-61.6	-47.7	174.1	177.8	63.6	0	0	0	111.2	A368 V370 M374 A375 T376 F524 F528 I533	A368-L372 WeakPolarHBondContact O-CB 3.43Å; A368-L372 PolarHBondContact O-N 3.26Å; V370-L372 VanDerWaalsContact C-N 3.35Å; V370-L372 PolarHBondContact O-N 3.08Å; L372-M374 VanDerWaalsContact C-N 3.27Å; L372-M374 PolarHBondContact O-N 3.07Å; L372-A375 PolarHBondContact O-N 3.08Å; L372-A375 VanDerWaalsContact O-N 3.1Å; L372-T376 PolarHBondContact O-N 3.47Å; L372-T376 PolarHBondContact O-OG1 3.06Å; L372-T376 VanDerWaalsContact O-OG1 3.08Å; L372-F524 HydrophobicContact CD1-CD1 3.52Å; L372-F524 HydrophobicContact CD1-CE1 4.12Å; L372-F524 HydrophobicContact CD1-CG 4.36Å; L372-F528 HydrophobicContact CD2-CD2 3.95Å; L372-F528 HydrophobicContact CD2-CE2 4.2Å; L372-I533 HydrophobicContact CB-CD1 3.95Å; L372-I533 HydrophobicContact CD2-CB 4.39Å; L372-I533 HydrophobicContact CD2-CD1 4.08Å; L372-I533 HydrophobicContact CD2-CG2 4.16Å; L372-I533 HydrophobicContact CG-CD1 4.43Å
373	Y	92.3	Very high	93.7	Very high	34 Å²	34	25.3 Å²	25.3	13%	0.133	13%	0.133	C	C	.	.	H	α-helix	trans	-59.3	-36.7	178.3	-179.4	-112	0	0	0	112.7	A167 Y170 V369 V370 Q377 H406	A167-Y373 HydrophobicContact CB-CD2 4.33Å; A167-Y373 HydrophobicContact CB-CE2 4.04Å; Y170-Y373 AromaticContact CD1-CD1 3.46Å; Y170-Y373 HydrophobicContact CD1-CD1 3.46Å; Y170-Y373 VanDerWaalsContact CD1-CD1 3.46Å; Y170-Y373 AromaticContact CD1-CD2 3.81Å; Y170-Y373 HydrophobicContact CD1-CD2 3.81Å; Y170-Y373 AromaticContact CD1-CE1 3.42Å; Y170-Y373 HydrophobicContact CD1-CE1 3.42Å; Y170-Y373 VanDerWaalsContact CD1-CE1 3.42Å; Y170-Y373 AromaticContact CD1-CE2 3.78Å; Y170-Y373 HydrophobicContact CD1-CE2 3.78Å; Y170-Y373 AromaticContact CD1-CG 3.66Å; Y170-Y373 HydrophobicContact CD1-CG 3.66Å; Y170-Y373 AromaticContact CD1-CZ 3.59Å; Y170-Y373 HydrophobicContact CD2-CD1 4.11Å; Y170-Y373 HydrophobicContact CD2-CG 4.26Å; Y170-Y373 AromaticContact CE1-CD1 3.52Å; Y170-Y373 HydrophobicContact CE1-CD1 3.52Å; Y170-Y373 AromaticContact CE1-CE1 3.21Å; Y170-Y373 HydrophobicContact CE1-CE1 3.21Å; Y170-Y373 HydrophobicContact CE1-CE2 4.36Å; Y170-Y373 HydrophobicContact CE1-CG 4.21Å; Y170-Y373 AromaticContact CE1-CZ 3.69Å; Y170-Y373 HydrophobicContact CE2-CD1 4.18Å; Y170-Y373 AromaticContact CG-CD1 3.78Å; Y170-Y373 HydrophobicContact CG-CD1 3.78Å; Y170-Y373 HydrophobicContact CG-CD2 4.07Å; Y170-Y373 HydrophobicContact CG-CE1 4.22Å; Y170-Y373 HydrophobicContact CG-CE2 4.49Å; Y170-Y373 AromaticContact CG-CG 3.69Å; Y170-Y373 HydrophobicContact CG-CG 3.69Å; Y170-Y373 AromaticContact CZ-CD1 3.91Å; Y170-Y373 AromaticContact CZ-CE1 3.9Å; V369-Y373 VanDerWaalsContact O-CB 3.31Å; V369-Y373 WeakPolarHBondContact O-CB 3.48Å; V369-Y373 PolarHBondContact O-N 3Å; V370-Y373 PolarHBondContact O-N 3.27Å; Y373-Q377 VanDerWaalsContact CD1-NE2 3.3Å; Y373-Q377 VanDerWaalsContact O-CG 3.26Å; Y373-Q377 WeakPolarHBondContact O-CG 3.38Å; Y373-Q377 PolarHBondContact O-N 3.37Å; Y373-Q377 PolarHBondContact O-NE2 2.79Å; Y373-H406 HydrophobicContact CD1-CB 4.39Å
374	M	96.9	Very high	94	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-69.5	-42.2	173.1	-68.4	-167.6	-67.3	0	0	112.1	L354 Y357 L358 V366 V370 L371 L372 I378 V408	L354-M374 HydrophobicContact CD1-CE 4.11Å; L354-M374 HydrophobicContact CD1-SD 3.59Å; L354-M374 VanDerWaalsContact CD1-SD 3.59Å; Y357-M374 HydrophobicContact CE1-SD 4.36Å; L358-M374 HydrophobicContact CD2-CE 3.98Å; V366-M374 HydrophobicContact CG1-CE 3.74Å; V370-M374 HydrophobicContact CG1-CE 4.28Å; V370-M374 WeakPolarHBondContact O-CG 3.41Å; V370-M374 PolarHBondContact O-N 3.35Å; L371-M374 HydrophobicContact CD2-CE 3.88Å; L371-M374 PolarHBondContact O-N 2.91Å; L372-M374 VanDerWaalsContact C-N 3.27Å; L372-M374 PolarHBondContact O-N 3.07Å; M374-I378 WeakPolarHBondContact O-CD1 3.46Å; M374-I378 WeakPolarHBondContact O-CG1 3.33Å; M374-I378 PolarHBondContact O-N 3.23Å; M374-V408 HydrophobicContact CB-CG2 3.82Å; M374-V408 HydrophobicContact CG-CG2 3.54Å; M374-V408 HydrophobicContact SD-CG2 3.87Å
375	A	97.8	Very high	94.4	Very high	4 Å²	4	18.1 Å²	18.1	3%	0.033	9%	0.092	C	C	.	.	H	α-helix	trans	-63.9	-44.7	176.7	0	0	0	0	0	113	L371 L372 Q377 I378 S379 L460 I463 F524	L371-A375 PolarHBondContact O-N 3.1Å; L372-A375 PolarHBondContact O-N 3.08Å; L372-A375 VanDerWaalsContact O-N 3.1Å; A375-Q377 PolarHBondContact O-N 3.23Å; A375-I378 PolarHBondContact O-N 3.44Å; A375-S379 PolarHBondContact O-N 2.98Å; A375-L460 HydrophobicContact CB-CD2 3.76Å; A375-I463 HydrophobicContact CB-CD1 4.26Å; A375-F524 HydrophobicContact CB-CZ 4.33Å
376	T	95.8	Very high	94.7	Very high	8 Å²	8	14.7 Å²	14.7	5%	0.049	8%	0.076	C	C	.	.	H	α-helix	trans	-60.1	-46.2	177.8	-57.1	0	0	0	0	111.2	L372 I378 S379 S380 F524 E525	L372-T376 PolarHBondContact O-N 3.47Å; L372-T376 PolarHBondContact O-OG1 3.06Å; L372-T376 VanDerWaalsContact O-OG1 3.08Å; T376-I378 VanDerWaalsContact C-N 3.32Å; T376-I378 PolarHBondContact O-N 2.91Å; T376-S379 PolarHBondContact O-N 3.25Å; T376-S379 VanDerWaalsContact O-N 3.12Å; T376-S379 PolarHBondContact O-OG 2.87Å; T376-S380 PolarHBondContact O-N 3.21Å; T376-F524 HydrophobicContact CG2-CB 4.42Å; T376-E525 HydrophobicContact CG2-CG 4.38Å; T376-E525 WeakPolarHBondContact CG2-OE1 3.36Å
377	Q	96.2	Very high	94.7	Very high	14 Å²	14	21.1 Å²	21.1	7%	0.065	10%	0.104	C	C	.	.	H	α-helix	trans	-55.8	-43.3	176.1	-79.6	178.2	93.4	0	0	113.1	N328 Y373 A375 S380 A381 H406 V407 V408	N328-Q377 WeakPolarHBondContact CB-O 3.4Å; N328-Q377 WeakPolarHBondContact ND2-CB 3.3Å; N328-Q377 WeakPolarHBondContact ND2-CG 3.47Å; N328-Q377 PolarHBondContact ND2-OE1 3.12Å; Y373-Q377 VanDerWaalsContact CD1-NE2 3.3Å; Y373-Q377 VanDerWaalsContact O-CG 3.26Å; Y373-Q377 WeakPolarHBondContact O-CG 3.38Å; Y373-Q377 PolarHBondContact O-N 3.37Å; Y373-Q377 PolarHBondContact O-NE2 2.79Å; A375-Q377 PolarHBondContact O-N 3.23Å; Q377-S380 PolarHBondContact O-N 3.25Å; Q377-A381 PolarHBondContact O-N 3.35Å; Q377-H406 PolarHBondContact NE2-O 2.93Å; Q377-V407 VanDerWaalsContact OE1-CA 3.31Å; Q377-V408 HydrophobicContact CB-CB 4.49Å
378	I	98.3	Very high	94.7	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-67.3	-42.5	176.8	-61.3	159.1	0	0	0	110.4	L354 M374 A375 T376 S380 A381 M382 L395 V408 V410 F456 L459 I463	L354-I378 HydrophobicContact CD2-CD1 3.82Å; M374-I378 WeakPolarHBondContact O-CD1 3.46Å; M374-I378 WeakPolarHBondContact O-CG1 3.33Å; M374-I378 PolarHBondContact O-N 3.23Å; A375-I378 PolarHBondContact O-N 3.44Å; T376-I378 VanDerWaalsContact C-N 3.32Å; T376-I378 PolarHBondContact O-N 2.91Å; I378-S380 VanDerWaalsContact C-N 3.29Å; I378-S380 PolarHBondContact O-N 2.96Å; I378-A381 WeakPolarHBondContact O-CB 3.46Å; I378-A381 PolarHBondContact O-N 2.79Å; I378-M382 HydrophobicContact CG2-CG 4.49Å; I378-M382 WeakPolarHBondContact O-CG 3.33Å; I378-M382 PolarHBondContact O-N 2.78Å; I378-L395 HydrophobicContact CG2-CD1 4.38Å; I378-V408 HydrophobicContact CD1-CG1 4.01Å; I378-V408 HydrophobicContact CG1-CB 4.48Å; I378-V408 HydrophobicContact CG1-CG1 3.71Å; I378-V410 HydrophobicContact CG2-CG2 3.96Å; I378-F456 HydrophobicContact CB-CE2 4.06Å; I378-F456 HydrophobicContact CG2-CD2 3.92Å; I378-F456 HydrophobicContact CG2-CE2 3.65Å; I378-L459 HydrophobicContact CD1-CD2 4.27Å; I378-L459 HydrophobicContact CG2-CD2 3.87Å; I378-I463 HydrophobicContact CD1-CD1 3.82Å
379	S	97.9	Very high	94.6	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-61.3	-38	177.3	73.6	0	0	0	0	112.5	A375 T376 M382 E383	A375-S379 PolarHBondContact O-N 2.98Å; T376-S379 PolarHBondContact O-N 3.25Å; T376-S379 VanDerWaalsContact O-N 3.12Å; T376-S379 PolarHBondContact O-OG 2.87Å; S379-M382 PolarHBondContact O-N 2.99Å; S379-E383 WeakPolarHBondContact O-CB 3.34Å; S379-E383 PolarHBondContact O-N 2.97Å
380	S	96.2	Very high	94.6	Very high	21 Å²	21	26 Å²	26	15%	0.147	12%	0.123	C	C	.	.	H	α-helix	trans	-64.4	-43.3	174.8	-158.9	0	0	0	0	112	T376 Q377 I378 M382 E383 Y384 H521	T376-S380 PolarHBondContact O-N 3.21Å; Q377-S380 PolarHBondContact O-N 3.25Å; I378-S380 VanDerWaalsContact C-N 3.29Å; I378-S380 PolarHBondContact O-N 2.96Å; S380-M382 VanDerWaalsContact C-N 3.32Å; S380-M382 PolarHBondContact O-N 3.36Å; S380-E383 PolarHBondContact O-N 2.83Å; S380-Y384 PolarHBondContact O-N 2.9Å; S380-Y384 VanDerWaalsContact O-N 3.08Å; S380-H521 VanDerWaalsContact CA-CD2 3.49Å; S380-H521 WeakPolarHBondContact CA-CD2 3.28Å; S380-H521 VanDerWaalsContact CB-NE2 3.33Å; S380-H521 WeakPolarHBondContact CB-NE2 3.49Å; S380-H521 PolarHBondContact OG-CD2 3.19Å; S380-H521 PolarHBondContact OG-NE2 2.83Å
381	A	96.2	Very high	94.5	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-59.4	-41.1	173.5	0	0	0	0	0	112.9	N328 L329 Q377 I378 Y384 L385 V410	N328-A381 HydrophobicContact CB-CB 3.82Å; N328-A381 WeakPolarHBondContact O-CB 3.18Å; L329-A381 HydrophobicContact CD2-CB 3.78Å; L329-A381 HydrophobicContact CG-CB 4.25Å; Q377-A381 PolarHBondContact O-N 3.35Å; I378-A381 WeakPolarHBondContact O-CB 3.46Å; I378-A381 PolarHBondContact O-N 2.79Å; A381-Y384 WeakPolarHBondContact O-CB 3.5Å; A381-Y384 PolarHBondContact O-N 2.79Å; A381-L385 PolarHBondContact O-N 2.92Å; A381-V410 HydrophobicContact CB-CG2 3.79Å
382	M	97.3	Very high	94.4	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-76.4	-32.8	179.6	-66.8	-55.2	-53.1	0	0	113	I378 S379 S380 Y384 L385 E386 H392 L395 I449 D452 F517	I378-M382 HydrophobicContact CG2-CG 4.49Å; I378-M382 WeakPolarHBondContact O-CG 3.33Å; I378-M382 PolarHBondContact O-N 2.78Å; S379-M382 PolarHBondContact O-N 2.99Å; S380-M382 VanDerWaalsContact C-N 3.32Å; S380-M382 PolarHBondContact O-N 3.36Å; M382-Y384 VanDerWaalsContact C-N 3.29Å; M382-Y384 PolarHBondContact O-N 2.52Å; M382-L385 HydrophobicContact CE-CD1 4.16Å; M382-L385 PolarHBondContact O-N 3.45Å; M382-L385 HydrophobicContact SD-CD1 3.89Å; M382-E386 WeakPolarHBondContact O-CB 3.48Å; M382-E386 PolarHBondContact O-N 2.94Å; M382-H392 HydrophobicContact CE-CB 4.12Å; M382-L395 HydrophobicContact CE-CD2 4.04Å; M382-L395 HydrophobicContact CG-CD2 3.87Å; M382-L395 HydrophobicContact SD-CD1 4Å; M382-L395 HydrophobicContact SD-CD2 3.81Å; M382-L395 HydrophobicContact SD-CG 4.49Å; M382-I449 HydrophobicContact CE-CD1 4.38Å; M382-D452 HydrophobicContact CE-CB 3.9Å; M382-F517 HydrophobicContact CB-CB 4.29Å; M382-F517 HydrophobicContact CB-CD1 3.34Å; M382-F517 HydrophobicContact CB-CD2 3.82Å; M382-F517 HydrophobicContact CB-CE1 3.39Å; M382-F517 HydrophobicContact CB-CE2 3.86Å; M382-F517 HydrophobicContact CB-CG 3.55Å; M382-F517 HydrophobicContact CB-CZ 3.65Å; M382-F517 HydrophobicContact CE-CD2 4.49Å; M382-F517 HydrophobicContact CE-CE2 3.74Å; M382-F517 HydrophobicContact CE-CZ 3.83Å; M382-F517 HydrophobicContact CG-CD1 4.24Å; M382-F517 HydrophobicContact CG-CE1 3.8Å; M382-F517 HydrophobicContact CG-CE2 4.45Å; M382-F517 HydrophobicContact CG-CZ 3.91Å
383	E	96.8	Very high	94.3	Very high	34 Å²	34	25.3 Å²	25.3	16%	0.159	12%	0.118	C	C	.	.	H	α-helix	trans	-62	-39.2	170.7	-170.1	-159.8	-159.7	0	0	111.1	S379 S380 L385 E386 K387 F517 A518 H521	S379-E383 WeakPolarHBondContact O-CB 3.34Å; S379-E383 PolarHBondContact O-N 2.97Å; S380-E383 PolarHBondContact O-N 2.83Å; E383-L385 PolarHBondContact O-N 3.5Å; E383-E386 PolarHBondContact O-N 3.29Å; E383-K387 HydrophobicContact CG-CD 4.17Å; E383-K387 WeakPolarHBondContact O-CB 3.25Å; E383-K387 VanDerWaalsContact O-CG 3.31Å; E383-K387 WeakPolarHBondContact O-CG 3.44Å; E383-K387 PolarHBondContact O-N 2.98Å; E383-K387 WeakPolarHBondContact OE1-CE 3.44Å; E383-K387 IonicContact OE1-NZ 2.62Å; E383-K387 PolarHBondContact OE1-NZ 2.73Å; E383-K387 IonicContact OE2-NZ 2.78Å; E383-K387 PolarHBondContact OE2-NZ 3.1Å; E383-F517 HydrophobicContact CB-CB 4.06Å; E383-A518 HydrophobicContact CG-CB 3.97Å; E383-A518 WeakPolarHBondContact OE1-CA 3.39Å; E383-A518 VanDerWaalsContact OE1-CB 3.31Å; E383-A518 WeakPolarHBondContact OE1-CB 3.24Å; E383-H521 IonicContact OE2-CD2 3.19Å
384	Y	94.6	Very high	94.3	Very high	43 Å²	43	24.8 Å²	24.8	17%	0.169	12%	0.117	C	C	.	.	H	α-helix	trans	-61.3	-42.3	173.3	179.6	-84.5	0	0	0	112.3	V324 K325 H326 L329 S380 A381 M382 K387 K388	V324-Y384 HydrophobicContact CB-CE1 4.08Å; V324-Y384 HydrophobicContact CG1-CE1 4.3Å; K325-Y384 PolarHBondContact N-OH 3.5Å; K325-Y384 WeakPolarHBondContact O-CE2 3.31Å; K325-Y384 PolarHBondContact O-OH 3.43Å; K325-Y384 VanDerWaalsContact O-OH 3.13Å; H326-Y384 HydrophobicContact CB-CD1 4.06Å; H326-Y384 HydrophobicContact CB-CD2 4.08Å; H326-Y384 HydrophobicContact CB-CE1 4.36Å; H326-Y384 HydrophobicContact CB-CE2 4.35Å; H326-Y384 HydrophobicContact CB-CG 3.92Å; H326-Y384 AromaticContact CD2-CD2 3.48Å; H326-Y384 VanDerWaalsContact CD2-CD2 3.48Å; H326-Y384 WeakPolarHBondContact CD2-CD2 3.44Å; H326-Y384 AromaticContact CD2-CG 3.68Å; H326-Y384 AromaticContact CG-CG 3.88Å; L329-Y384 HydrophobicContact CD1-CD1 3.67Å; L329-Y384 HydrophobicContact CD1-CE1 4.05Å; S380-Y384 PolarHBondContact O-N 2.9Å; S380-Y384 VanDerWaalsContact O-N 3.08Å; A381-Y384 WeakPolarHBondContact O-CB 3.5Å; A381-Y384 PolarHBondContact O-N 2.79Å; M382-Y384 VanDerWaalsContact C-N 3.29Å; M382-Y384 PolarHBondContact O-N 2.52Å; Y384-K387 PolarHBondContact O-N 3.02Å; Y384-K388 HydrophobicContact CD1-CG 4.27Å; Y384-K388 HydrophobicContact CE1-CG 3.83Å; Y384-K388 WeakPolarHBondContact O-CB 3.25Å; Y384-K388 WeakPolarHBondContact O-CG 3.39Å; Y384-K388 PolarHBondContact O-N 3.36Å; Y384-K388 WeakPolarHBondContact OH-CE 3.31Å
385	L	92.8	Very high	94.2	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.005	12%	0.118	C	C	.	.	H	α-helix	trans	-67.2	-41.2	176.4	-65.8	178.8	0	0	0	111.9	V324 L329 A381 M382 E383 K388 N389 F390 F413	V324-L385 HydrophobicContact CG1-CD2 3.81Å; L329-L385 HydrophobicContact CD1-CD2 3.81Å; L329-L385 HydrophobicContact CD1-CG 4.19Å; L329-L385 HydrophobicContact CD2-CD1 4.14Å; L329-L385 HydrophobicContact CD2-CG 4.32Å; A381-L385 PolarHBondContact O-N 2.92Å; M382-L385 HydrophobicContact CE-CD1 4.16Å; M382-L385 PolarHBondContact O-N 3.45Å; M382-L385 HydrophobicContact SD-CD1 3.89Å; E383-L385 PolarHBondContact O-N 3.5Å; L385-K388 CarbonylContact O-C 3.59Å; L385-K388 PolarHBondContact O-N 2.87Å; L385-K388 VanDerWaalsContact O-N 3.12Å; L385-N389 PolarHBondContact O-N 3.22Å; L385-F390 HydrophobicContact CB-CB 4.17Å; L385-F390 HydrophobicContact CD2-CB 3.91Å; L385-F390 HydrophobicContact CD2-CD2 4.44Å; L385-F390 HydrophobicContact CD2-CG 4.47Å; L385-F390 PolarHBondContact O-N 2.82Å; L385-F413 HydrophobicContact CD1-CE1 4.41Å; L385-F413 HydrophobicContact CD2-CE1 4.46Å
386	E	93.8	Very high	94.2	Very high	35 Å²	35	24.7 Å²	24.7	16%	0.164	12%	0.116	C	C	.	.	H	α-helix	trans	-55.6	-52.1	172.3	-179.6	170.3	-109.8	0	0	111	M382 E383 K388 N389 I449 S516 F517 A518	M382-E386 WeakPolarHBondContact O-CB 3.48Å; M382-E386 PolarHBondContact O-N 2.94Å; E383-E386 PolarHBondContact O-N 3.29Å; E386-K388 PolarHBondContact O-N 3.48Å; E386-N389 PolarHBondContact O-N 3.39Å; E386-I449 HydrophobicContact CB-CD1 3.94Å; E386-I449 HydrophobicContact CB-CG1 3.82Å; E386-I449 HydrophobicContact CG-CG1 3.91Å; E386-S516 WeakPolarHBondContact OE1-CA 3.32Å; E386-S516 WeakPolarHBondContact OE1-CB 3.37Å; E386-F517 HydrophobicContact CB-CB 4.42Å; E386-F517 HydrophobicContact CB-CD2 4.49Å; E386-F517 VanDerWaalsContact CD-N 3.33Å; E386-F517 PolarHBondContact OE1-N 3.37Å; E386-F517 VanDerWaalsContact OE1-N 3.07Å; E386-F517 WeakPolarHBondContact OE2-CA 3.41Å; E386-F517 WeakPolarHBondContact OE2-CB 3.45Å; E386-F517 PolarHBondContact OE2-N 2.82Å; E386-A518 PolarHBondContact OE2-N 2.8Å; E386-A518 VanDerWaalsContact OE2-N 3.08Å
387	K	93	Very high	94.3	Very high	134 Å²	134	24.3 Å²	24.3	58%	0.583	11%	0.114	S	C	*	.	H	α-helix	trans	-60.7	-26	176.3	-72.9	167.7	179.3	168.3	0	113.7	E383 Y384	E383-K387 HydrophobicContact CG-CD 4.17Å; E383-K387 WeakPolarHBondContact O-CB 3.25Å; E383-K387 VanDerWaalsContact O-CG 3.31Å; E383-K387 WeakPolarHBondContact O-CG 3.44Å; E383-K387 PolarHBondContact O-N 2.98Å; E383-K387 WeakPolarHBondContact OE1-CE 3.44Å; E383-K387 IonicContact OE1-NZ 2.62Å; E383-K387 PolarHBondContact OE1-NZ 2.73Å; E383-K387 IonicContact OE2-NZ 2.78Å; E383-K387 PolarHBondContact OE2-NZ 3.1Å; Y384-K387 PolarHBondContact O-N 3.02Å
388	K	89.8	Confident	94.2	Very high	74 Å²	74	26.7 Å²	26.7	32%	0.322	12%	0.122	S	C	.	.	H	α-helix	trans	-92	-2.3	176.1	-77.1	-85.1	-171	141.5	0	113.8	E323 Y384 L385 E386 F390	E323-K388 PolarHBondContact O-NZ 2.96Å; Y384-K388 HydrophobicContact CD1-CG 4.27Å; Y384-K388 HydrophobicContact CE1-CG 3.83Å; Y384-K388 WeakPolarHBondContact O-CB 3.25Å; Y384-K388 WeakPolarHBondContact O-CG 3.39Å; Y384-K388 PolarHBondContact O-N 3.36Å; Y384-K388 WeakPolarHBondContact OH-CE 3.31Å; L385-K388 CarbonylContact O-C 3.59Å; L385-K388 PolarHBondContact O-N 2.87Å; L385-K388 VanDerWaalsContact O-N 3.12Å; E386-K388 PolarHBondContact O-N 3.48Å; K388-F390 VanDerWaalsContact C-N 3.32Å; K388-F390 HydrophobicContact CB-CD2 3.74Å; K388-F390 HydrophobicContact CB-CE2 4.32Å
389	N	89.5	Confident	94	Very high	92 Å²	92	27.5 Å²	27.5	49%	0.492	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	36.2	-173.1	-52.5	-87	0	0	0	113.4	L385 E386 M419	L385-N389 PolarHBondContact O-N 3.22Å; E386-N389 PolarHBondContact O-N 3.39Å; N389-M419 HydrophobicContact CB-CB 4.29Å; N389-M419 WeakPolarHBondContact O-CB 3.14Å; N389-M419 PolarHBondContact O-N 3.17Å
390	F	90.2	Very high	94	Very high	15 Å²	15	27.5 Å²	27.5	7%	0.066	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	141.8	171.1	-81.5	-68.3	0	0	0	111.5	V320 E323 V324 L385 K388 R417 L418	V320-F390 HydrophobicContact CB-CE1 4.4Å; V320-F390 HydrophobicContact CG1-CD1 4.19Å; V320-F390 HydrophobicContact CG1-CE1 3.9Å; V320-F390 HydrophobicContact CG1-CZ 4.2Å; V320-F390 HydrophobicContact CG2-CE1 3.84Å; V320-F390 HydrophobicContact CG2-CZ 4.44Å; E323-F390 HydrophobicContact CB-CE2 4.48Å; V324-F390 HydrophobicContact CG1-CD2 3.99Å; V324-F390 HydrophobicContact CG1-CE2 4.01Å; L385-F390 HydrophobicContact CB-CB 4.17Å; L385-F390 HydrophobicContact CD2-CB 3.91Å; L385-F390 HydrophobicContact CD2-CD2 4.44Å; L385-F390 HydrophobicContact CD2-CG 4.47Å; L385-F390 PolarHBondContact O-N 2.82Å; K388-F390 VanDerWaalsContact C-N 3.32Å; K388-F390 HydrophobicContact CB-CD2 3.74Å; K388-F390 HydrophobicContact CB-CE2 4.32Å; F390-R417 WeakPolarHBondContact CD1-O 3.46Å; F390-L418 HydrophobicContact CD1-CB 4.21Å; F390-L418 HydrophobicContact CD1-CD1 4.28Å; F390-L418 HydrophobicContact CE1-CB 3.77Å; F390-L418 HydrophobicContact CE1-CD1 3.95Å; F390-L418 HydrophobicContact CE1-CG 4.47Å; F390-L418 HydrophobicContact CE2-CD1 4.22Å; F390-L418 HydrophobicContact CZ-CB 4.42Å; F390-L418 HydrophobicContact CZ-CD1 3.92Å
391	I	91.4	Very high	94	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	141.1	167	52.9	176.7	0	0	0	110.5	R393 S416 R417 M419 Y424 F447 I449 D452	I391-R393 HydrophobicContact CB-CG 4.23Å; I391-R393 HydrophobicContact CD1-CG 3.9Å; I391-R393 HydrophobicContact CG1-CG 4.04Å; I391-S416 WeakPolarHBondContact O-CA 3.38Å; I391-S416 VanDerWaalsContact O-CB 3.29Å; I391-S416 WeakPolarHBondContact O-CB 3.35Å; I391-R417 HydrophobicContact CD1-CB 4.44Å; I391-R417 HydrophobicContact CG1-CB 4.15Å; I391-R417 WeakPolarHBondContact CG1-O 3.46Å; I391-R417 PolarHBondContact N-O 3.26Å; I391-R417 PolarHBondContact O-N 3.49Å; I391-R417 VanDerWaalsContact O-N 3.09Å; I391-M419 HydrophobicContact CD1-CG 4.46Å; I391-M419 HydrophobicContact CG1-CG 4.41Å; I391-M419 HydrophobicContact CG2-CG 3.87Å; I391-M419 HydrophobicContact CG2-SD 3.46Å; I391-M419 WeakPolarHBondContact CG2-SD 3.43Å; I391-Y424 HydrophobicContact CD1-CD1 4.33Å; I391-Y424 HydrophobicContact CD1-CG 4.28Å; I391-F447 HydrophobicContact CD1-CB 4.05Å; I391-I449 HydrophobicContact CG2-CB 4.46Å; I391-I449 VanDerWaalsContact CG2-N 3.34Å; I391-D452 VanDerWaalsContact CA-OD2 3.27Å; I391-D452 WeakPolarHBondContact CA-OD2 3.42Å; I391-D452 WeakPolarHBondContact CB-OD2 3.07Å
392	H	92.6	Very high	94	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.131	C	C	.	.			trans	-90.3	-41.4	-177.3	-161	-78	0	0	0	112.3	M382 D394 V410 A411 D452	M382-H392 HydrophobicContact CE-CB 4.12Å; H392-D394 PolarHBondContact CE1-O 3.22Å; H392-D394 PolarHBondContact ND1-O 3.31Å; H392-D394 PolarHBondContact O-N 2.81Å; H392-V410 WeakPolarHBondContact NE2-CG1 3.41Å; H392-A411 PolarHBondContact CE1-O 3.44Å; H392-A411 PolarHBondContact NE2-O 3.12Å; H392-D452 PolarHBondContact N-OD2 2.92Å
393	R	91.4	Very high	93.8	Very high	21 Å²	21	28.9 Å²	28.9	8%	0.079	13%	0.133	C	C	.	.	S	Bend	trans	64.2	-20	177.3	-57.6	172.1	54.9	-130.5	-2.3	116.9	I391 L415 F447 D452	I391-R393 HydrophobicContact CB-CG 4.23Å; I391-R393 HydrophobicContact CD1-CG 3.9Å; I391-R393 HydrophobicContact CG1-CG 4.04Å; R393-L415 HydrophobicContact CB-CB 4.39Å; R393-L415 WeakPolarHBondContact CD-O 3.47Å; R393-L415 PolarHBondContact NH1-O 3.44Å; R393-F447 HydrophobicContact CB-CD1 4.06Å; R393-F447 HydrophobicContact CB-CE1 4.38Å; R393-F447 HydrophobicContact CG-CB 4.05Å; R393-F447 HydrophobicContact CG-CD1 3.81Å; R393-F447 HydrophobicContact CG-CG 4.03Å; R393-D452 WeakPolarHBondContact CA-OD1 3.49Å; R393-D452 PolarHBondContact N-OD1 3.27Å
394	D	91.4	Very high	93.4	Very high	23 Å²	23	33.7 Å²	33.7	12%	0.123	16%	0.156	C	C	.	.			trans	-129.5	56	171.5	-167.1	21.4	0	0	0	112.4	H392 R398 N399 L415 P433	H392-D394 PolarHBondContact CE1-O 3.22Å; H392-D394 PolarHBondContact ND1-O 3.31Å; H392-D394 PolarHBondContact O-N 2.81Å; D394-R398 IonicContact OD1-CZ 3.19Å; D394-R398 IonicContact OD1-NE 2.83Å; D394-R398 IonicContact OD1-NH2 3.7Å; D394-R398 PolarHBondContact OD1-NH2 3.2Å; D394-R398 IonicContact OD2-NE 3.88Å; D394-N399 PolarHBondContact O-ND2 3.3Å; D394-N399 PolarHBondContact OD2-ND2 3.16Å; D394-L415 HydrophobicContact CB-CD1 3.87Å; D394-P433 WeakPolarHBondContact OD1-CG 3.42Å
395	L	96.4	Very high	93.1	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	17%	0.166	C	C	.	.			trans	-82.3	114.9	177	-178.8	62.9	0	0	0	110.8	I378 M382 V410 A455 F456 L459 F517	I378-L395 HydrophobicContact CG2-CD1 4.38Å; M382-L395 HydrophobicContact CE-CD2 4.04Å; M382-L395 HydrophobicContact CG-CD2 3.87Å; M382-L395 HydrophobicContact SD-CD1 4Å; M382-L395 HydrophobicContact SD-CD2 3.81Å; M382-L395 HydrophobicContact SD-CG 4.49Å; L395-V410 HydrophobicContact CD1-CG1 3.83Å; L395-A455 HydrophobicContact CB-CB 4.09Å; L395-F456 HydrophobicContact CD2-CB 3.78Å; L395-F456 HydrophobicContact CD2-CD2 4.21Å; L395-L459 HydrophobicContact CD1-CD2 3.8Å; L395-L459 HydrophobicContact CG-CD2 3.89Å; L395-F517 HydrophobicContact CD2-CZ 4.34Å
396	A	96.8	Very high	93	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.17	C	C	.	.	S	Bend	trans	-162	166.5	-179.2	0	0	0	0	0	111	R398 N399 C400 W436	A396-R398 VanDerWaalsContact C-N 3.26Å; A396-R398 HydrophobicContact CB-CG 3.79Å; A396-R398 PolarHBondContact O-N 3.41Å; A396-N399 PolarHBondContact O-N 3.16Å; A396-C400 PolarHBondContact O-N 3.46Å; A396-W436 HydrophobicContact CB-CD2 4.31Å; A396-W436 HydrophobicContact CB-CG 4.16Å
397	A	97.6	Very high	93	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-64.3	-30.7	-175.9	0	0	0	0	0	112.8	L354 L355 N399 C400 L459 E462	L354-A397 HydrophobicContact CB-CB 4.5Å; L354-A397 WeakPolarHBondContact CB-O 3.43Å; L354-A397 PolarHBondContact N-O 2.97Å; L355-A397 HydrophobicContact CB-CB 3.74Å; L355-A397 HydrophobicContact CD1-CB 4.18Å; L355-A397 PolarHBondContact N-O 3.48Å; A397-N399 PolarHBondContact O-N 2.99Å; A397-C400 PolarHBondContact O-N 3.31Å; A397-L459 HydrophobicContact CB-CD1 3.65Å; A397-E462 HydrophobicContact CB-CB 4.14Å; A397-E462 HydrophobicContact CB-CG 4.5Å; A397-E462 PolarHBondContact N-OE2 3.45Å
398	R	94.6	Very high	93.1	Very high	65 Å²	65	29.2 Å²	29.2	25%	0.245	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-57.9	-26.4	171.4	53.4	162.4	178.4	-69.8	-6.8	114.2	N353 L355 D394 A396	N353-R398 WeakPolarHBondContact CB-O 3.3Å; L355-R398 HydrophobicContact CD2-CB 4.28Å; D394-R398 IonicContact OD1-CZ 3.19Å; D394-R398 IonicContact OD1-NE 2.83Å; D394-R398 IonicContact OD1-NH2 3.7Å; D394-R398 PolarHBondContact OD1-NH2 3.2Å; D394-R398 IonicContact OD2-NE 3.88Å; A396-R398 VanDerWaalsContact C-N 3.26Å; A396-R398 HydrophobicContact CB-CG 3.79Å; A396-R398 PolarHBondContact O-N 3.41Å
399	N	94.8	Very high	93.4	Very high	17 Å²	17	26 Å²	26	9%	0.091	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-109.6	9.5	-174.7	-62.9	-4.7	0	0	0	111.6	D394 A396 A397 A411	D394-N399 PolarHBondContact O-ND2 3.3Å; D394-N399 PolarHBondContact OD2-ND2 3.16Å; A396-N399 PolarHBondContact O-N 3.16Å; A397-N399 PolarHBondContact O-N 2.99Å; N399-A411 WeakPolarHBondContact O-CA 3.36Å; N399-A411 WeakPolarHBondContact O-CB 3.46Å; N399-A411 PolarHBondContact O-N 3.07Å
400	C	97.1	Very high	93.7	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	132.3	163.8	-61.9	0	0	0	0	107.6	N353 L354 A396 A397 V408 K409	N353-C400 CarbonylContact C-O 3.43Å; N353-C400 VanDerWaalsContact CA-O 3.28Å; N353-C400 WeakPolarHBondContact CA-O 3.34Å; L354-C400 HydrophobicContact CB-CB 3.83Å; L354-C400 HydrophobicContact CD2-CB 3.93Å; L354-C400 PolarHBondContact N-O 3.35Å; A396-C400 PolarHBondContact O-N 3.46Å; A397-C400 PolarHBondContact O-N 3.31Å; C400-V408 HydrophobicContact CB-CG1 3.89Å; C400-K409 CarbonylContact C-O 3.46Å
401	L	96	Very high	93.8	Very high	45 Å²	45	21.4 Å²	21.4	24%	0.236	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	145.6	179	-58.6	-174.1	0	0	0	111.4	V330 M349 G352 N353 V408 K409 A411	V330-L401 HydrophobicContact CG2-CD1 4.03Å; V330-L401 HydrophobicContact CG2-CG 4.48Å; M349-L401 HydrophobicContact CB-CB 3.75Å; M349-L401 HydrophobicContact CB-CD1 4.12Å; M349-L401 HydrophobicContact CE-CB 4.08Å; M349-L401 VanDerWaalsContact CE-O 3.31Å; M349-L401 WeakPolarHBondContact CE-O 3.16Å; M349-L401 HydrophobicContact CG-CB 3.67Å; M349-L401 HydrophobicContact CG-CD1 3.87Å; M349-L401 HydrophobicContact CG-CG 4.45Å; G352-L401 CarbonylContact O-C 3.54Å; G352-L401 VanDerWaalsContact O-CA 3.27Å; G352-L401 WeakPolarHBondContact O-CA 3Å; N353-L401 HydrophobicContact CB-CD2 3.95Å; L401-V408 WeakPolarHBondContact O-CA 3.43Å; L401-K409 PolarHBondContact N-O 3.48Å; L401-K409 PolarHBondContact O-N 3.05Å; L401-A411 HydrophobicContact CD1-CB 4.02Å; L401-A411 HydrophobicContact CG-CB 3.88Å
402	V	96.3	Very high	93.3	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	125	-175.2	-173.7	0	0	0	0	110.7	M349 H351 G352 L354 Y357 V408	M349-V402 CarbonylContact C-O 3.54Å; H351-V402 HydrophobicContact CB-CB 3.86Å; H351-V402 HydrophobicContact CB-CG1 3.88Å; H351-V402 WeakPolarHBondContact CB-O 3.23Å; H351-V402 PolarHBondContact N-O 2.83Å; H351-V402 VanDerWaalsContact N-O 3.07Å; G352-V402 PolarHBondContact O-N 3.12Å; L354-V402 HydrophobicContact CB-CG2 3.91Å; L354-V402 HydrophobicContact CD1-CG2 3.78Å; L354-V402 HydrophobicContact CG-CG2 4.47Å; Y357-V402 HydrophobicContact CD1-CG1 4.13Å; Y357-V402 HydrophobicContact CD1-CG2 4.04Å; Y357-V402 HydrophobicContact CD2-CG1 4.31Å; Y357-V402 HydrophobicContact CE1-CG1 4.2Å; Y357-V402 HydrophobicContact CE2-CG1 4.38Å; Y357-V402 HydrophobicContact CG-CB 4.32Å; Y357-V402 HydrophobicContact CG-CG1 4.19Å; Y357-V402 HydrophobicContact CG-CG2 4.05Å; V402-V408 HydrophobicContact CG2-CG2 4.48Å
403	G	92.3	Very high	92.3	Very high	5 Å²	5	23.6 Å²	23.6	5%	0.052	12%	0.117	C	C	.	.			trans	-104.5	-175.2	177.5	0	0	0	0	0	112.4	H351 V407	H351-G403 PolarHBondContact CD2-O 3.37Å; G403-V407 PolarHBondContact N-O 3.38Å
404	E	89.4	Confident	91.1	Very high	136 Å²	136	22.7 Å²	22.7	64%	0.636	11%	0.114	S	C	*	.	G	3₁₀ helix	trans	-56.4	152.1	173.4	-59.5	-177.5	172.7	0	0	110.8	P350 H406 V407	P350-E404 HydrophobicContact CG-CG 3.97Å; E404-H406 VanDerWaalsContact C-N 3.27Å; E404-H406 PolarHBondContact O-N 2.74Å; E404-V407 WeakPolarHBondContact O-CG2 3.44Å; E404-V407 PolarHBondContact O-N 2.88Å
405	N	87.1	Confident	90	Very high	73 Å²	73	22.8 Å²	22.8	39%	0.39	12%	0.115	S	C	.	.	G	3₁₀ helix	trans	53.8	37.8	177.7	-62.8	91.9	0	0	0	114.4	Y170 N252 V407	Y170-N405 PolarHBondContact OH-O 2.84Å; N252-N405 WeakPolarHBondContact OD1-CB 3.24Å; N405-V407 PolarHBondContact O-N 3.35Å
406	H	92.3	Very high	89.2	Confident	19 Å²	19	23 Å²	23	9%	0.088	12%	0.116	C	C	.	.	G	3₁₀ helix	trans	55.2	28.6	179.9	-51	101.2	0	0	0	114.2	Y170 Y357 E365 V370 Y373 Q377 E404 V408	Y170-H406 HydrophobicContact CE2-CB 4.39Å; Y170-H406 AromaticContact CE2-ND1 3.67Å; Y170-H406 AromaticContact CZ-ND1 3.66Å; Y170-H406 WeakPolarHBondContact OH-CB 3.43Å; Y170-H406 PolarHBondContact OH-ND1 3.35Å; Y357-H406 AromaticContact CZ-CD2 3.97Å; Y357-H406 PolarHBondContact OH-CD2 2.84Å; Y357-H406 PolarHBondContact OH-NE2 2.94Å; E365-H406 IonicContact OE1-CE1 2.72Å; V370-H406 HydrophobicContact CG1-CB 3.91Å; V370-H406 VanDerWaalsContact CG1-CD2 3.47Å; V370-H406 WeakPolarHBondContact CG1-CD2 3.28Å; V370-H406 VanDerWaalsContact CG1-CG 3.47Å; Y373-H406 HydrophobicContact CD1-CB 4.39Å; Q377-H406 PolarHBondContact NE2-O 2.93Å; E404-H406 VanDerWaalsContact C-N 3.27Å; E404-H406 PolarHBondContact O-N 2.74Å; H406-V408 PolarHBondContact O-N 2.82Å
407	V	92.4	Very high	88.4	Confident	25 Å²	25	25.2 Å²	25.2	15%	0.152	13%	0.125	C	C	.	.			trans	-71	123.7	172.2	174.1	0	0	0	0	109.2	N252 Q377 G403 E404 N405 K409	N252-V407 WeakPolarHBondContact ND2-CG2 3.33Å; Q377-V407 VanDerWaalsContact OE1-CA 3.31Å; G403-V407 PolarHBondContact N-O 3.38Å; E404-V407 WeakPolarHBondContact O-CG2 3.44Å; E404-V407 PolarHBondContact O-N 2.88Å; N405-V407 PolarHBondContact O-N 3.35Å; V407-K409 HydrophobicContact CG1-CG 4.33Å
408	V	96.6	Very high	87.4	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.006	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	135.2	178.4	-178.5	0	0	0	0	110.6	N328 L354 M374 Q377 I378 C400 L401 V402 H406	N328-V408 WeakPolarHBondContact CB-O 3.46Å; N328-V408 PolarHBondContact ND2-O 3.08Å; L354-V408 HydrophobicContact CD2-CG1 4.38Å; M374-V408 HydrophobicContact CB-CG2 3.82Å; M374-V408 HydrophobicContact CG-CG2 3.54Å; M374-V408 HydrophobicContact SD-CG2 3.87Å; Q377-V408 HydrophobicContact CB-CB 4.49Å; I378-V408 HydrophobicContact CD1-CG1 4.01Å; I378-V408 HydrophobicContact CG1-CB 4.48Å; I378-V408 HydrophobicContact CG1-CG1 3.71Å; C400-V408 HydrophobicContact CB-CG1 3.89Å; L401-V408 WeakPolarHBondContact O-CA 3.43Å; V402-V408 HydrophobicContact CG2-CG2 4.48Å; H406-V408 PolarHBondContact O-N 2.82Å
409	K	96.1	Very high	86.5	Confident	8 Å²	8	28.7 Å²	28.7	4%	0.035	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	130.3	176.4	-56.1	-167.2	175.8	-151.2	0	111.5	P327 N328 V330 E347 M349 C400 L401 V407	P327-K409 WeakPolarHBondContact O-CE 3.3Å; P327-K409 PolarHBondContact O-NZ 3.21Å; N328-K409 CarbonylContact O-C 3.55Å; N328-K409 WeakPolarHBondContact O-CA 3.4Å; V330-K409 HydrophobicContact CG2-CB 3.67Å; E347-K409 WeakPolarHBondContact OE1-CD 3.36Å; E347-K409 WeakPolarHBondContact OE1-CE 3.45Å; E347-K409 IonicContact OE1-NZ 2.67Å; E347-K409 PolarHBondContact OE1-NZ 3.13Å; E347-K409 WeakPolarHBondContact OE2-CE 3.31Å; E347-K409 IonicContact OE2-NZ 3.98Å; E347-K409 PolarHBondContact OE2-NZ 3.01Å; M349-K409 HydrophobicContact CE-CB 3.93Å; M349-K409 HydrophobicContact CE-CD 3.95Å; M349-K409 HydrophobicContact CE-CG 3.66Å; M349-K409 HydrophobicContact SD-CD 3.99Å; M349-K409 HydrophobicContact SD-CG 4.37Å; C400-K409 CarbonylContact C-O 3.46Å; L401-K409 PolarHBondContact N-O 3.48Å; L401-K409 PolarHBondContact O-N 3.05Å; V407-K409 HydrophobicContact CG1-CG 4.33Å
410	V	95.8	Very high	85.3	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	141.8	175.8	-168.7	0	0	0	0	110	N328 L329 V330 I378 A381 H392 L395	N328-V410 PolarHBondContact O-N 2.79Å; L329-V410 HydrophobicContact CD2-CB 4Å; V330-V410 PolarHBondContact N-O 3.47Å; I378-V410 HydrophobicContact CG2-CG2 3.96Å; A381-V410 HydrophobicContact CB-CG2 3.79Å; H392-V410 WeakPolarHBondContact NE2-CG1 3.41Å; L395-V410 HydrophobicContact CD1-CG1 3.83Å
411	A	91.2	Very high	84	Confident	9 Å²	9	36.8 Å²	36.8	7%	0.074	21%	0.205	C	C	.	.			trans	-144.8	174.5	-165.1	0	0	0	0	0	113.7	V330 H392 N399 L401	V330-A411 HydrophobicContact CB-CB 4.3Å; V330-A411 HydrophobicContact CG2-CB 3.63Å; H392-A411 PolarHBondContact CE1-O 3.44Å; H392-A411 PolarHBondContact NE2-O 3.12Å; N399-A411 WeakPolarHBondContact O-CA 3.36Å; N399-A411 WeakPolarHBondContact O-CB 3.46Å; N399-A411 PolarHBondContact O-N 3.07Å; L401-A411 HydrophobicContact CD1-CB 4.02Å; L401-A411 HydrophobicContact CG-CB 3.88Å
412	D	80.6	Confident	83	Confident	47 Å²	47	41.4 Å²	41.4	25%	0.251	23%	0.23	S	C	.	.			trans	61.2	66.9	-176	-156.4	12.5	0	0	0	114.6	K302 G414	K302-D412 IonicContact NZ-OD1 3.62Å; K302-D412 PolarHBondContact NZ-OD1 3.17Å; D412-G414 PolarHBondContact O-N 3.39Å; D412-G414 VanDerWaalsContact O-N 3.09Å
413	F	72.6	Confident	82.4	Confident	1 Å²	1	45.6 Å²	45.6	0%	0.004	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-74.2	11.1	178.1	-57.5	-89.4	0	0	0	114.1	E317 V320 M321 V324 L329 L385 L415 S416	E317-F413 HydrophobicContact CG-CB 4.17Å; V320-F413 HydrophobicContact CG1-CB 4.32Å; V320-F413 HydrophobicContact CG1-CD1 4.26Å; V320-F413 HydrophobicContact CG1-CG 4.48Å; M321-F413 HydrophobicContact CE-CD2 4.05Å; M321-F413 HydrophobicContact CE-CE2 4.11Å; M321-F413 HydrophobicContact CG-CB 4.35Å; M321-F413 HydrophobicContact CG-CD2 3.72Å; M321-F413 HydrophobicContact CG-CE2 4.39Å; M321-F413 HydrophobicContact CG-CG 4.25Å; M321-F413 HydrophobicContact SD-CD2 3.96Å; V324-F413 HydrophobicContact CG2-CZ 4.39Å; L329-F413 HydrophobicContact CB-CZ 4.15Å; L329-F413 HydrophobicContact CD2-CE1 4.2Å; L329-F413 HydrophobicContact CD2-CZ 3.92Å; L329-F413 HydrophobicContact CG-CZ 4.43Å; L385-F413 HydrophobicContact CD1-CE1 4.41Å; L385-F413 HydrophobicContact CD2-CE1 4.46Å; F413-L415 VanDerWaalsContact C-N 3.3Å; F413-L415 PolarHBondContact O-N 3.3Å; F413-S416 WeakPolarHBondContact CA-OG 3.45Å; F413-S416 VanDerWaalsContact O-CB 3.28Å; F413-S416 WeakPolarHBondContact O-CB 3.35Å; F413-S416 PolarHBondContact O-N 2.68Å
414	G	65.9	Low	82	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.01	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-57.3	-40.8	-178	0	0	0	0	0	113.2	D412 R417	D412-G414 PolarHBondContact O-N 3.39Å; D412-G414 VanDerWaalsContact O-N 3.09Å; G414-R417 PolarHBondContact O-NH1 3.36Å
415	L	68.7	Low	81.7	Confident	26 Å²	26	45.9 Å²	45.9	14%	0.136	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-83	-11.6	174.3	-75.4	172.3	0	0	0	114.1	Y284 R393 D394 F413 R417	Y284-L415 HydrophobicContact CE2-CG 4.27Å; Y284-L415 WeakPolarHBondContact OH-CD1 3.27Å; Y284-L415 WeakPolarHBondContact OH-CD2 3.44Å; Y284-L415 VanDerWaalsContact OH-CG 3.24Å; Y284-L415 WeakPolarHBondContact OH-CG 3.35Å; R393-L415 HydrophobicContact CB-CB 4.39Å; R393-L415 WeakPolarHBondContact CD-O 3.47Å; R393-L415 PolarHBondContact NH1-O 3.44Å; D394-L415 HydrophobicContact CB-CD1 3.87Å; F413-L415 VanDerWaalsContact C-N 3.3Å; F413-L415 PolarHBondContact O-N 3.3Å; L415-R417 PolarHBondContact O-NH1 3.31Å
416	S	79.7	Confident	81.4	Confident	4 Å²	4	42.8 Å²	42.8	3%	0.028	24%	0.243	C	C	.	.			trans	-67.9	146.1	-173.2	-60	0	0	0	0	112.3	I391 F413	I391-S416 WeakPolarHBondContact O-CA 3.38Å; I391-S416 VanDerWaalsContact O-CB 3.29Å; I391-S416 WeakPolarHBondContact O-CB 3.35Å; F413-S416 WeakPolarHBondContact CA-OG 3.45Å; F413-S416 VanDerWaalsContact O-CB 3.28Å; F413-S416 WeakPolarHBondContact O-CB 3.35Å; F413-S416 PolarHBondContact O-N 2.68Å
417	R	79.1	Confident	80.8	Confident	48 Å²	48	49.1 Å²	49.1	18%	0.181	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	147.2	-177.9	-60.5	-64.1	180	-95.7	0.4	110.9	E313 F390 I391 G414 L415	E313-R417 IonicContact OE1-CZ 3.49Å; E313-R417 IonicContact OE1-NH1 2.66Å; E313-R417 IonicContact OE1-NH2 3.38Å; E313-R417 PolarHBondContact OE1-NH2 2.88Å; F390-R417 WeakPolarHBondContact CD1-O 3.46Å; I391-R417 HydrophobicContact CD1-CB 4.44Å; I391-R417 HydrophobicContact CG1-CB 4.15Å; I391-R417 WeakPolarHBondContact CG1-O 3.46Å; I391-R417 PolarHBondContact N-O 3.26Å; I391-R417 PolarHBondContact O-N 3.49Å; I391-R417 VanDerWaalsContact O-N 3.09Å; G414-R417 PolarHBondContact O-NH1 3.36Å; L415-R417 PolarHBondContact O-NH1 3.31Å
418	L	76.7	Confident	80	Confident	103 Å²	103	52.7 Å²	52.7	54%	0.539	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	130.7	166.8	-174.1	70.9	0	0	0	109	F390 T420	F390-L418 HydrophobicContact CD1-CB 4.21Å; F390-L418 HydrophobicContact CD1-CD1 4.28Å; F390-L418 HydrophobicContact CE1-CB 3.77Å; F390-L418 HydrophobicContact CE1-CD1 3.95Å; F390-L418 HydrophobicContact CE1-CG 4.47Å; F390-L418 HydrophobicContact CE2-CD1 4.22Å; F390-L418 HydrophobicContact CZ-CB 4.42Å; F390-L418 HydrophobicContact CZ-CD1 3.92Å; L418-T420 PolarHBondContact O-N 2.85Å
419	M	75.5	Confident	79	Confident	35 Å²	35	56.2 Å²	56.2	17%	0.172	34%	0.341	C	S	.	.			trans	-77.3	106.1	172.7	-75.8	174.7	56.8	0	0	110.2	N389 I391 G421 D422	N389-M419 HydrophobicContact CB-CB 4.29Å; N389-M419 WeakPolarHBondContact O-CB 3.14Å; N389-M419 PolarHBondContact O-N 3.17Å; I391-M419 HydrophobicContact CD1-CG 4.46Å; I391-M419 HydrophobicContact CG1-CG 4.41Å; I391-M419 HydrophobicContact CG2-CG 3.87Å; I391-M419 HydrophobicContact CG2-SD 3.46Å; I391-M419 WeakPolarHBondContact CG2-SD 3.43Å; M419-G421 WeakPolarHBondContact CE-O 3.49Å; M419-G421 PolarHBondContact O-N 2.74Å; M419-D422 WeakPolarHBondContact CE-O 3.37Å
420	T	69.1	Low	78.1	Confident	147 Å²	147	57.9 Å²	57.9	90%	0.902	36%	0.357	S	S	*	.	S	Bend	trans	-79.2	-3.4	167.4	-36.5	0	0	0	0	112.4	L418	L418-T420 PolarHBondContact O-N 2.85Å
421	G	71.1	Confident	77.3	Confident	39 Å²	39	67.1 Å²	67.1	40%	0.402	40%	0.397	S	S	.	.	S	Bend	trans	-174.8	177.3	178	0	0	0	0	0	110.3	M419 T423	M419-G421 WeakPolarHBondContact CE-O 3.49Å; M419-G421 PolarHBondContact O-N 2.74Å; G421-T423 PolarHBondContact O-N 3.07Å
422	D	74.9	Confident	76.9	Confident	143 Å²	143	68.6 Å²	68.6	77%	0.765	40%	0.402	S	S	*	.	S	Bend	trans	-61.1	-20.3	-163.8	-50	-36.7	0	0	0	115.7	M419 S448	M419-D422 WeakPolarHBondContact CE-O 3.37Å; D422-S448 WeakPolarHBondContact O-CB 3.27Å
423	T	82.6	Confident	77.4	Confident	87 Å²	87	68.1 Å²	68.1	53%	0.534	40%	0.401	S	S	.	.			trans	-143.3	147.1	177.9	56	0	0	0	0	112.3	G421 F447	G421-T423 PolarHBondContact O-N 3.07Å; T423-F447 CarbonylContact C-O 3.46Å; T423-F447 WeakPolarHBondContact CA-O 3.4Å
424	Y	83.8	Confident	78.5	Confident	62 Å²	62	71 Å²	71	24%	0.243	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	124.6	168.7	168.8	-100.3	0	0	0	110.3	I391 A426 F447	I391-Y424 HydrophobicContact CD1-CD1 4.33Å; I391-Y424 HydrophobicContact CD1-CG 4.28Å; Y424-A426 HydrophobicContact CE1-CB 3.91Å; Y424-F447 HydrophobicContact CD1-CB 4.37Å; Y424-F447 HydrophobicContact CD1-CD2 4.32Å; Y424-F447 PolarHBondContact N-O 2.94Å; Y424-F447 PolarHBondContact O-N 2.96Å
425	T	84.1	Confident	79.9	Confident	86 Å²	86	72.4 Å²	72.4	53%	0.528	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	120.8	173.6	-50.3	0	0	0	0	110.1	N445	T425-N445 WeakPolarHBondContact CA-O 3.47Å; T425-N445 HydrophobicContact CG2-CB 4.47Å
426	A	81.6	Confident	81.3	Confident	7 Å²	7	72.7 Å²	72.7	6%	0.058	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-79.9	150.3	175	0	0	0	0	0	111.8	Y424 F432 N445 F447	Y424-A426 HydrophobicContact CE1-CB 3.91Å; A426-F432 HydrophobicContact CB-CE1 4.34Å; A426-F432 HydrophobicContact CB-CZ 3.77Å; A426-N445 HydrophobicContact CB-CB 4.33Å; A426-N445 PolarHBondContact N-O 2.93Å; A426-N445 WeakPolarHBondContact O-CB 3.27Å; A426-N445 PolarHBondContact O-ND2 3.34Å; A426-F447 HydrophobicContact CB-CD2 4.11Å; A426-F447 HydrophobicContact CB-CE2 3.73Å
427	H	79.2	Confident	82.1	Confident	153 Å²	153	72.9 Å²	72.9	71%	0.708	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-56	146.9	179.1	-58.6	-73.7	0	0	0	112.8	A430 N445	H427-A430 VanDerWaalsContact O-CB 3.27Å; H427-A430 WeakPolarHBondContact O-CB 3.4Å; H427-A430 PolarHBondContact O-N 2.91Å; H427-N445 PolarHBondContact O-ND2 3.09Å; H427-N445 VanDerWaalsContact O-ND2 3.1Å
428	A	75.7	Confident	83	Confident	99 Å²	99	70.7 Å²	70.7	82%	0.818	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	143	175.6	0	0	0	0	0	111.1	A430	A428-A430 VanDerWaalsContact C-N 3.26Å; A428-A430 PolarHBondContact O-N 2.6Å
429	G	74.2	Confident	83.9	Confident	75 Å²	75	65.9 Å²	65.9	77%	0.773	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.9	-1.3	-177.3	0	0	0	0	0	115.7
430	A	77.3	Confident	84.9	Confident	44 Å²	44	65.2 Å²	65.2	36%	0.364	39%	0.385	S	S	.	.			trans	-59.8	143	169.3	0	0	0	0	0	111.4	H427 A428 F432	H427-A430 VanDerWaalsContact O-CB 3.27Å; H427-A430 WeakPolarHBondContact O-CB 3.4Å; H427-A430 PolarHBondContact O-N 2.91Å; A428-A430 VanDerWaalsContact C-N 3.26Å; A428-A430 PolarHBondContact O-N 2.6Å; A430-F432 HydrophobicContact CB-CE1 3.8Å; A430-F432 HydrophobicContact CB-CE2 4.27Å; A430-F432 HydrophobicContact CB-CZ 3.47Å; A430-F432 VanDerWaalsContact CB-CZ 3.47Å
431	K	80.1	Confident	86	Confident	193 Å²	193	58.2 Å²	58.2	84%	0.839	34%	0.343	S	S	*	.			trans	-100.3	135.7	-177.3	-64	176.1	-176.9	172.4	0	110.1
432	F	82.9	Confident	87	Confident	40 Å²	40	58.5 Å²	58.5	18%	0.175	34%	0.335	C	S	.	.			trans	-130.3	152.1	-177.2	-52.1	-53	0	0	0	111.9	A426 A430 I434 T437 F447	A426-F432 HydrophobicContact CB-CE1 4.34Å; A426-F432 HydrophobicContact CB-CZ 3.77Å; A430-F432 HydrophobicContact CB-CE1 3.8Å; A430-F432 HydrophobicContact CB-CE2 4.27Å; A430-F432 HydrophobicContact CB-CZ 3.47Å; A430-F432 VanDerWaalsContact CB-CZ 3.47Å; F432-I434 VanDerWaalsContact C-N 3.34Å; F432-I434 PolarHBondContact O-N 2.76Å; F432-T437 HydrophobicContact CB-CG2 4.11Å; F432-F447 AromaticContact CD1-CZ 3.72Å; F432-F447 HydrophobicContact CD1-CZ 3.72Å; F432-F447 HydrophobicContact CD2-CZ 4.11Å; F432-F447 AromaticContact CE1-CE2 3.89Å; F432-F447 HydrophobicContact CE1-CE2 3.89Å; F432-F447 AromaticContact CE1-CZ 3.52Å; F432-F447 HydrophobicContact CE1-CZ 3.52Å; F432-F447 HydrophobicContact CE2-CE2 4.11Å; F432-F447 AromaticContact CE2-CZ 3.92Å; F432-F447 HydrophobicContact CE2-CZ 3.92Å; F432-F447 HydrophobicContact CG-CZ 4.02Å; F432-F447 AromaticContact CZ-CE2 3.65Å; F432-F447 HydrophobicContact CZ-CE2 3.65Å; F432-F447 AromaticContact CZ-CZ 3.62Å; F432-F447 HydrophobicContact CZ-CZ 3.62Å
433	P	91.4	Very high	87.8	Confident	38 Å²	38	53.2 Å²	53.2	25%	0.247	31%	0.311	C	S	.	.			trans	-76.1	84.1	176.9	33	-36	0	0	0	110	D394 K435 W436 T437	D394-P433 WeakPolarHBondContact OD1-CG 3.42Å; P433-K435 VanDerWaalsContact C-N 3.26Å; P433-K435 PolarHBondContact O-N 2.73Å; P433-W436 HydrophobicContact CB-CE3 3.98Å; P433-W436 PolarHBondContact O-N 2.68Å; P433-T437 VanDerWaalsContact C-OG1 3.25Å; P433-T437 PolarHBondContact O-N 2.82Å; P433-T437 PolarHBondContact O-OG1 3.48Å
434	I	94.3	Very high	88	Confident	62 Å²	62	56.7 Å²	56.7	32%	0.318	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-40.7	-47	-167.4	-64.6	169	0	0	0	113.9	F432 W436 T437 L442 L476 V479	F432-I434 VanDerWaalsContact C-N 3.34Å; F432-I434 PolarHBondContact O-N 2.76Å; I434-W436 VanDerWaalsContact C-N 3.26Å; I434-W436 PolarHBondContact O-N 2.99Å; I434-T437 PolarHBondContact O-N 3.08Å; I434-T437 VanDerWaalsContact O-N 3.09Å; I434-L442 HydrophobicContact CB-CD2 4.46Å; I434-L442 HydrophobicContact CG1-CD2 4.3Å; I434-L442 HydrophobicContact CG2-CD2 4.2Å; I434-L476 HydrophobicContact CB-CD2 4.48Å; I434-L476 HydrophobicContact CD1-CB 4.14Å; I434-V479 HydrophobicContact CG2-CB 4.29Å; I434-V479 HydrophobicContact CG2-CG1 4.45Å
435	K	97	Very high	88.3	Confident	29 Å²	29	55.3 Å²	55.3	13%	0.126	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-61.4	-25.8	-178	-66.2	-177.2	170.7	-160.3	0	114.8	P433 S469 P470 Y471 L476	P433-K435 VanDerWaalsContact C-N 3.26Å; P433-K435 PolarHBondContact O-N 2.73Å; K435-S469 PolarHBondContact NZ-OG 3.2Å; K435-S469 VanDerWaalsContact NZ-OG 3.08Å; K435-P470 HydrophobicContact CB-CB 4.37Å; K435-P470 HydrophobicContact CD-CB 4.44Å; K435-P470 VanDerWaalsContact CD-O 3.25Å; K435-P470 WeakPolarHBondContact CD-O 3.42Å; K435-P470 VanDerWaalsContact CE-O 3.24Å; K435-P470 WeakPolarHBondContact CE-O 3.43Å; K435-P470 PolarHBondContact NZ-O 2.91Å; K435-Y471 HydrophobicContact CB-CD2 4.04Å; K435-Y471 HydrophobicContact CB-CE2 4.42Å; K435-Y471 HydrophobicContact CG-CD2 4.11Å; K435-Y471 VanDerWaalsContact O-CE2 3.3Å; K435-Y471 WeakPolarHBondContact O-CE2 3.29Å; K435-L476 HydrophobicContact CD-CD2 4.04Å; K435-L476 HydrophobicContact CG-CD2 3.64Å
436	W	97.6	Very high	88.6	Confident	33 Å²	33	52.6 Å²	52.6	13%	0.125	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-100.8	-9.5	176.7	-65.7	-101.8	0	0	0	112.8	A396 P433 I434 A455 V458 E462 P470	A396-W436 HydrophobicContact CB-CD2 4.31Å; A396-W436 HydrophobicContact CB-CG 4.16Å; P433-W436 HydrophobicContact CB-CE3 3.98Å; P433-W436 PolarHBondContact O-N 2.68Å; I434-W436 VanDerWaalsContact C-N 3.26Å; I434-W436 PolarHBondContact O-N 2.99Å; W436-A455 HydrophobicContact CB-CB 4.5Å; W436-A455 WeakPolarHBondContact O-CB 3.39Å; W436-V458 HydrophobicContact CD2-CG1 4.39Å; W436-V458 HydrophobicContact CG-CB 4.45Å; W436-V458 HydrophobicContact CG-CG1 4.02Å; W436-E462 WeakPolarHBondContact CZ2-OE1 3.31Å; W436-E462 PolarHBondContact NE1-OE2 3.09Å; W436-P470 HydrophobicContact CH2-CG 4.42Å; W436-P470 HydrophobicContact CZ2-CG 3.89Å
437	T	96.6	Very high	89.1	Confident	8 Å²	8	52.6 Å²	52.6	5%	0.049	29%	0.294	C	S	.	.	S	Bend	trans	-84.5	133.3	-171.5	-51.9	0	0	0	0	110.2	F432 P433 I434 L442 W454	F432-T437 HydrophobicContact CB-CG2 4.11Å; P433-T437 VanDerWaalsContact C-OG1 3.25Å; P433-T437 PolarHBondContact O-N 2.82Å; P433-T437 PolarHBondContact O-OG1 3.48Å; I434-T437 PolarHBondContact O-N 3.08Å; I434-T437 VanDerWaalsContact O-N 3.09Å; T437-L442 HydrophobicContact CG2-CD2 3.71Å; T437-L442 HydrophobicContact CG2-CG 3.8Å; T437-W454 PolarHBondContact O-NE1 3.26Å
438	A	97.5	Very high	89.8	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.008	27%	0.265	C	S	.	.			trans	-70.4	154.8	-178.5	0	0	0	0	0	112.3	E440 S441 L442 W454	A438-E440 VanDerWaalsContact C-N 3.32Å; A438-E440 WeakPolarHBondContact CB-OE1 3.38Å; A438-E440 WeakPolarHBondContact CB-OE2 3.36Å; A438-E440 PolarHBondContact O-N 3.27Å; A438-S441 CarbonylContact O-C 3.01Å; A438-S441 WeakPolarHBondContact O-CA 3.43Å; A438-S441 WeakPolarHBondContact O-CB 3.28Å; A438-S441 PolarHBondContact O-N 2.66Å; A438-L442 PolarHBondContact O-N 2.8Å; A438-W454 HydrophobicContact CB-CB 3.76Å; A438-W454 HydrophobicContact CB-CD2 4.17Å; A438-W454 HydrophobicContact CB-CG 3.71Å
439	P	96.1	Very high	90.8	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.013	23%	0.23	C	C	.	.	H	α-helix	trans	-57.3	-39.3	-176.7	-26	34.8	0	0	0	114.2	S441 L442 A443 W454 Y480 W509	P439-S441 VanDerWaalsContact C-N 3.34Å; P439-L442 PolarHBondContact O-N 2.74Å; P439-A443 WeakPolarHBondContact O-CB 3.35Å; P439-A443 PolarHBondContact O-N 2.8Å; P439-W454 HydrophobicContact CG-CE3 4.28Å; P439-W454 HydrophobicContact CG-CH2 3.59Å; P439-W454 HydrophobicContact CG-CZ2 4.05Å; P439-W454 HydrophobicContact CG-CZ3 3.71Å; P439-Y480 HydrophobicContact CB-CE2 4.35Å; P439-W509 HydrophobicContact CB-CD2 4.48Å; P439-W509 HydrophobicContact CB-CE3 3.89Å; P439-W509 HydrophobicContact CB-CH2 3.77Å; P439-W509 HydrophobicContact CB-CZ2 4.36Å; P439-W509 HydrophobicContact CB-CZ3 3.49Å; P439-W509 VanDerWaalsContact CB-CZ3 3.49Å; P439-W509 HydrophobicContact CG-CE3 3.77Å; P439-W509 HydrophobicContact CG-CH2 4.46Å; P439-W509 HydrophobicContact CG-CZ3 3.69Å
440	E	94.9	Very high	91.9	Very high	21 Å²	21	40.5 Å²	40.5	10%	0.098	20%	0.202	C	C	.	.	H	α-helix	trans	-66.7	-35.8	175.4	71.7	-76.1	-172	0	0	112.4	A438 Y444 T446 P511 R514	A438-E440 VanDerWaalsContact C-N 3.32Å; A438-E440 WeakPolarHBondContact CB-OE1 3.38Å; A438-E440 WeakPolarHBondContact CB-OE2 3.36Å; A438-E440 PolarHBondContact O-N 3.27Å; E440-Y444 HydrophobicContact CB-CD2 4.27Å; E440-Y444 WeakPolarHBondContact O-CA 3.48Å; E440-Y444 WeakPolarHBondContact O-CB 3.47Å; E440-Y444 PolarHBondContact O-N 2.91Å; E440-T446 PolarHBondContact O-OG1 2.84Å; E440-P511 HydrophobicContact CB-CG 4.48Å; E440-P511 HydrophobicContact CG-CG 3.96Å; E440-R514 IonicContact OE1-CZ 2.76Å; E440-R514 IonicContact OE1-NH1 3.68Å; E440-R514 PolarHBondContact OE1-NH1 2.6Å; E440-R514 IonicContact OE1-NH2 3.75Å; E440-R514 IonicContact OE2-CZ 2.67Å; E440-R514 IonicContact OE2-NH1 2.76Å; E440-R514 PolarHBondContact OE2-NH1 2.9Å; E440-R514 IonicContact OE2-NH2 3.68Å; E440-R514 PolarHBondContact OE2-NH2 2.81Å
441	S	94.1	Very high	92.8	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.007	19%	0.186	C	C	.	.	H	α-helix	trans	-72.6	-30.7	176.4	-49.3	0	0	0	0	112.2	A438 P439 N445 T446 S451	A438-S441 CarbonylContact O-C 3.01Å; A438-S441 WeakPolarHBondContact O-CA 3.43Å; A438-S441 WeakPolarHBondContact O-CB 3.28Å; A438-S441 PolarHBondContact O-N 2.66Å; P439-S441 VanDerWaalsContact C-N 3.34Å; S441-N445 WeakPolarHBondContact O-CA 3.36Å; S441-N445 PolarHBondContact O-N 2.79Å; S441-T446 WeakPolarHBondContact CA-O 3.39Å; S441-T446 VanDerWaalsContact CB-O 3.29Å; S441-T446 WeakPolarHBondContact CB-O 3.44Å; S441-T446 PolarHBondContact N-O 2.77Å; S441-T446 PolarHBondContact OG-O 3.29Å; S441-S451 WeakPolarHBondContact OG-CB 3.34Å
442	L	92	Very high	93.7	Very high	45 Å²	45	29.5 Å²	29.5	24%	0.236	15%	0.147	C	C	.	.	H	α-helix	trans	-73.9	-39.2	172.5	-71.7	175.2	0	0	0	112.8	I434 T437 A438 P439 Y480	I434-L442 HydrophobicContact CB-CD2 4.46Å; I434-L442 HydrophobicContact CG1-CD2 4.3Å; I434-L442 HydrophobicContact CG2-CD2 4.2Å; T437-L442 HydrophobicContact CG2-CD2 3.71Å; T437-L442 HydrophobicContact CG2-CG 3.8Å; A438-L442 PolarHBondContact O-N 2.8Å; P439-L442 PolarHBondContact O-N 2.74Å; L442-Y480 HydrophobicContact CB-CD2 4.14Å; L442-Y480 HydrophobicContact CD1-CD2 4.35Å
443	A	89.9	Confident	94.4	Very high	32 Å²	32	27.6 Å²	27.6	26%	0.264	14%	0.138	S	C	.	.	H	α-helix	trans	-88.2	-31.4	-174.3	0	0	0	0	0	114.2	P439 Y480	P439-A443 WeakPolarHBondContact O-CB 3.35Å; P439-A443 PolarHBondContact O-N 2.8Å; A443-Y480 HydrophobicContact CB-CE2 3.97Å
444	Y	88.5	Confident	94.8	Very high	159 Å²	159	25.8 Å²	25.8	62%	0.624	13%	0.127	S	C	*	.	H	α-helix	trans	-130.8	4.3	-168.9	-47.4	-61.7	0	0	0	114.1	E440 T446	E440-Y444 HydrophobicContact CB-CD2 4.27Å; E440-Y444 WeakPolarHBondContact O-CA 3.48Å; E440-Y444 WeakPolarHBondContact O-CB 3.47Å; E440-Y444 PolarHBondContact O-N 2.91Å; Y444-T446 PolarHBondContact O-N 2.89Å; Y444-T446 VanDerWaalsContact O-N 3.1Å
445	N	89.5	Confident	95	Very high	33 Å²	33	23.1 Å²	23.1	18%	0.176	11%	0.114	C	C	.	.			trans	54.4	20.5	-171.9	-72	14.6	0	0	0	114.2	T425 A426 H427 S441 F447	T425-N445 WeakPolarHBondContact CA-O 3.47Å; T425-N445 HydrophobicContact CG2-CB 4.47Å; A426-N445 HydrophobicContact CB-CB 4.33Å; A426-N445 PolarHBondContact N-O 2.93Å; A426-N445 WeakPolarHBondContact O-CB 3.27Å; A426-N445 PolarHBondContact O-ND2 3.34Å; H427-N445 PolarHBondContact O-ND2 3.09Å; H427-N445 VanDerWaalsContact O-ND2 3.1Å; S441-N445 WeakPolarHBondContact O-CA 3.36Å; S441-N445 PolarHBondContact O-N 2.79Å; N445-F447 VanDerWaalsContact O-CD2 3.27Å; N445-F447 WeakPolarHBondContact O-CD2 3.18Å; N445-F447 WeakPolarHBondContact O-CE2 3.44Å
446	T	90.6	Very high	95	Very high	30 Å²	30	21.8 Å²	21.8	18%	0.184	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	130.2	-179.5	49.6	0	0	0	0	111.5	E440 S441 Y444	E440-T446 PolarHBondContact O-OG1 2.84Å; S441-T446 WeakPolarHBondContact CA-O 3.39Å; S441-T446 VanDerWaalsContact CB-O 3.29Å; S441-T446 WeakPolarHBondContact CB-O 3.44Å; S441-T446 PolarHBondContact N-O 2.77Å; S441-T446 PolarHBondContact OG-O 3.29Å; Y444-T446 PolarHBondContact O-N 2.89Å; Y444-T446 VanDerWaalsContact O-N 3.1Å
447	F	92.6	Very high	95.1	Very high	6 Å²	6	20.2 Å²	20.2	3%	0.026	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	148	178.1	-63.9	-95.5	0	0	0	110	I391 R393 T423 Y424 A426 F432 N445 S451	I391-F447 HydrophobicContact CD1-CB 4.05Å; R393-F447 HydrophobicContact CB-CD1 4.06Å; R393-F447 HydrophobicContact CB-CE1 4.38Å; R393-F447 HydrophobicContact CG-CB 4.05Å; R393-F447 HydrophobicContact CG-CD1 3.81Å; R393-F447 HydrophobicContact CG-CG 4.03Å; T423-F447 CarbonylContact C-O 3.46Å; T423-F447 WeakPolarHBondContact CA-O 3.4Å; Y424-F447 HydrophobicContact CD1-CB 4.37Å; Y424-F447 HydrophobicContact CD1-CD2 4.32Å; Y424-F447 PolarHBondContact N-O 2.94Å; Y424-F447 PolarHBondContact O-N 2.96Å; A426-F447 HydrophobicContact CB-CD2 4.11Å; A426-F447 HydrophobicContact CB-CE2 3.73Å; F432-F447 AromaticContact CD1-CZ 3.72Å; F432-F447 HydrophobicContact CD1-CZ 3.72Å; F432-F447 HydrophobicContact CD2-CZ 4.11Å; F432-F447 AromaticContact CE1-CE2 3.89Å; F432-F447 HydrophobicContact CE1-CE2 3.89Å; F432-F447 AromaticContact CE1-CZ 3.52Å; F432-F447 HydrophobicContact CE1-CZ 3.52Å; F432-F447 HydrophobicContact CE2-CE2 4.11Å; F432-F447 AromaticContact CE2-CZ 3.92Å; F432-F447 HydrophobicContact CE2-CZ 3.92Å; F432-F447 HydrophobicContact CG-CZ 4.02Å; F432-F447 AromaticContact CZ-CE2 3.65Å; F432-F447 HydrophobicContact CZ-CE2 3.65Å; F432-F447 AromaticContact CZ-CZ 3.62Å; F432-F447 HydrophobicContact CZ-CZ 3.62Å; N445-F447 VanDerWaalsContact O-CD2 3.27Å; N445-F447 WeakPolarHBondContact O-CD2 3.18Å; N445-F447 WeakPolarHBondContact O-CE2 3.44Å; F447-S451 WeakPolarHBondContact CA-OG 3.43Å
448	S	94.1	Very high	95.2	Very high	12 Å²	12	19.8 Å²	19.8	8%	0.084	10%	0.1	C	C	.	.			trans	-156.9	175.1	175.9	64.4	0	0	0	0	108.9	D422 K450 S451 D452	D422-S448 WeakPolarHBondContact O-CB 3.27Å; S448-K450 PolarHBondContact O-N 3.5Å; S448-K450 VanDerWaalsContact O-N 3.09Å; S448-K450 PolarHBondContact OG-N 3.34Å; S448-S451 PolarHBondContact N-OG 3.26Å; S448-S451 PolarHBondContact O-N 3.22Å; S448-S451 PolarHBondContact O-OG 3.19Å; S448-S451 PolarHBondContact OG-N 3.2Å; S448-D452 PolarHBondContact O-N 2.88Å
449	I	95.6	Very high	95.2	Very high	20 Å²	20	19.8 Å²	19.8	10%	0.103	10%	0.099	C	C	.	.	H	α-helix	trans	-57.3	-27.3	172	-165.4	66.5	0	0	0	111.9	M382 E386 I391 D452 V453 F517	M382-I449 HydrophobicContact CE-CD1 4.38Å; E386-I449 HydrophobicContact CB-CD1 3.94Å; E386-I449 HydrophobicContact CB-CG1 3.82Å; E386-I449 HydrophobicContact CG-CG1 3.91Å; I391-I449 HydrophobicContact CG2-CB 4.46Å; I391-I449 VanDerWaalsContact CG2-N 3.34Å; I449-D452 WeakPolarHBondContact O-CB 3.2Å; I449-D452 PolarHBondContact O-N 2.89Å; I449-V453 WeakPolarHBondContact O-CG2 3.48Å; I449-V453 PolarHBondContact O-N 2.8Å; I449-F517 HydrophobicContact CD1-CD2 3.73Å; I449-F517 HydrophobicContact CD1-CE2 3.71Å; I449-F517 HydrophobicContact CG1-CD2 3.75Å; I449-F517 HydrophobicContact CG1-CE2 3.94Å
450	K	97.4	Very high	95.4	Very high	41 Å²	41	19.9 Å²	19.9	18%	0.178	10%	0.1	C	C	.	.	H	α-helix	trans	-74.4	-21.6	176.2	-59.7	-65.3	-175.2	169.9	0	113.8	S448 W454 P511 R514 P515	S448-K450 PolarHBondContact O-N 3.5Å; S448-K450 VanDerWaalsContact O-N 3.09Å; S448-K450 PolarHBondContact OG-N 3.34Å; K450-W454 PolarHBondContact O-N 3.36Å; K450-P511 HydrophobicContact CB-CB 3.81Å; K450-P511 WeakPolarHBondContact CB-O 2.97Å; K450-P511 WeakPolarHBondContact CD-O 3.39Å; K450-P511 HydrophobicContact CG-CB 4.5Å; K450-P511 VanDerWaalsContact CG-O 3.25Å; K450-P511 WeakPolarHBondContact CG-O 3.38Å; K450-R514 HydrophobicContact CD-CB 4.36Å; K450-R514 PolarHBondContact NZ-O 2.8Å; K450-R514 WeakPolarHBondContact O-CD 3.29Å; K450-R514 PolarHBondContact O-NH1 2.87Å; K450-P515 PolarHBondContact NZ-O 3.36Å
451	S	97.1	Very high	95.5	Very high	4 Å²	4	19.5 Å²	19.5	3%	0.028	10%	0.097	C	C	.	.	H	α-helix	trans	-76.8	-31.5	167.4	61.8	0	0	0	0	111.5	S441 F447 S448 W454 A455	S441-S451 WeakPolarHBondContact OG-CB 3.34Å; F447-S451 WeakPolarHBondContact CA-OG 3.43Å; S448-S451 PolarHBondContact N-OG 3.26Å; S448-S451 PolarHBondContact O-N 3.22Å; S448-S451 PolarHBondContact O-OG 3.19Å; S448-S451 PolarHBondContact OG-N 3.2Å; S451-W454 WeakPolarHBondContact O-CB 3.31Å; S451-W454 PolarHBondContact O-N 3.01Å; S451-A455 PolarHBondContact O-N 3.48Å; S451-A455 VanDerWaalsContact O-N 3.16Å
452	D	97.4	Very high	95.7	Very high	2 Å²	2	19.5 Å²	19.5	1%	0.011	10%	0.097	C	C	.	.	H	α-helix	trans	-69.5	-34.6	171.3	-65.4	-29.6	0	0	0	111.7	M382 I391 H392 R393 S448 I449 W454 A455 F456 F517	M382-D452 HydrophobicContact CE-CB 3.9Å; I391-D452 VanDerWaalsContact CA-OD2 3.27Å; I391-D452 WeakPolarHBondContact CA-OD2 3.42Å; I391-D452 WeakPolarHBondContact CB-OD2 3.07Å; H392-D452 PolarHBondContact N-OD2 2.92Å; R393-D452 WeakPolarHBondContact CA-OD1 3.49Å; R393-D452 PolarHBondContact N-OD1 3.27Å; S448-D452 PolarHBondContact O-N 2.88Å; I449-D452 WeakPolarHBondContact O-CB 3.2Å; I449-D452 PolarHBondContact O-N 2.89Å; D452-W454 VanDerWaalsContact C-N 3.33Å; D452-W454 PolarHBondContact O-N 3Å; D452-A455 PolarHBondContact O-N 3.46Å; D452-F456 WeakPolarHBondContact O-CB 3.37Å; D452-F456 PolarHBondContact O-N 3.16Å; D452-F517 HydrophobicContact CB-CE2 4.03Å; D452-F517 HydrophobicContact CB-CZ 4.22Å
453	V	98.6	Very high	96	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-59.3	-41.7	170.8	167.3	0	0	0	0	111.8	I449 F456 G457 C506 R514 P515 F517 I520	I449-V453 WeakPolarHBondContact O-CG2 3.48Å; I449-V453 PolarHBondContact O-N 2.8Å; V453-F456 WeakPolarHBondContact O-CB 3.47Å; V453-F456 PolarHBondContact O-N 3.36Å; V453-G457 PolarHBondContact O-N 3.24Å; V453-C506 HydrophobicContact CG1-CB 4.04Å; V453-C506 WeakPolarHBondContact O-CB 3.48Å; V453-R514 HydrophobicContact CG1-CB 3.95Å; V453-P515 HydrophobicContact CG1-CG 4.5Å; V453-F517 HydrophobicContact CB-CE2 4.4Å; V453-F517 HydrophobicContact CB-CZ 4.34Å; V453-F517 HydrophobicContact CG2-CD1 4.45Å; V453-F517 HydrophobicContact CG2-CD2 3.73Å; V453-F517 HydrophobicContact CG2-CE1 4.21Å; V453-F517 HydrophobicContact CG2-CE2 3.45Å; V453-F517 VanDerWaalsContact CG2-CE2 3.45Å; V453-F517 HydrophobicContact CG2-CG 4.24Å; V453-F517 HydrophobicContact CG2-CZ 3.73Å; V453-I520 HydrophobicContact CG1-CD1 3.92Å; V453-I520 HydrophobicContact CG2-CD1 4.11Å
454	W	98.7	Very high	96.4	Very high	1 Å²	1	17.2 Å²	17.2	0%	0.004	8%	0.084	C	C	.	.	H	α-helix	trans	-60.4	-47.2	174	176.2	-76.6	0	0	0	111.6	T437 A438 P439 K450 S451 D452 F456 G457 V458 L483 W507	T437-W454 PolarHBondContact O-NE1 3.26Å; A438-W454 HydrophobicContact CB-CB 3.76Å; A438-W454 HydrophobicContact CB-CD2 4.17Å; A438-W454 HydrophobicContact CB-CG 3.71Å; P439-W454 HydrophobicContact CG-CE3 4.28Å; P439-W454 HydrophobicContact CG-CH2 3.59Å; P439-W454 HydrophobicContact CG-CZ2 4.05Å; P439-W454 HydrophobicContact CG-CZ3 3.71Å; K450-W454 PolarHBondContact O-N 3.36Å; S451-W454 WeakPolarHBondContact O-CB 3.31Å; S451-W454 PolarHBondContact O-N 3.01Å; D452-W454 VanDerWaalsContact C-N 3.33Å; D452-W454 PolarHBondContact O-N 3Å; W454-F456 VanDerWaalsContact C-N 3.31Å; W454-F456 PolarHBondContact O-N 2.86Å; W454-G457 PolarHBondContact O-N 3.41Å; W454-G457 VanDerWaalsContact O-N 3.13Å; W454-V458 PolarHBondContact O-N 2.93Å; W454-L483 HydrophobicContact CH2-CD1 4.12Å; W454-L483 HydrophobicContact CH2-CD2 3.89Å; W454-L483 HydrophobicContact CH2-CG 4.47Å; W454-L483 HydrophobicContact CZ2-CD1 3.65Å; W454-L483 HydrophobicContact CZ2-CD2 3.82Å; W454-L483 HydrophobicContact CZ2-CG 4.32Å; W454-W507 AromaticContact CD2-CD1 3.93Å; W454-W507 HydrophobicContact CE3-CB 4.13Å; W454-W507 HydrophobicContact CH2-CB 4.11Å; W454-W507 HydrophobicContact CZ3-CB 3.89Å; W454-W507 VanDerWaalsContact CZ3-O 3.27Å; W454-W507 WeakPolarHBondContact CZ3-O 3.38Å; W454-W507 PolarHBondContact O-NE1 3.28Å
455	A	98.4	Very high	96.8	Very high	6 Å²	6	10.4 Å²	10.4	5%	0.05	6%	0.059	C	C	.	.	H	α-helix	trans	-62.1	-37.8	177.4	0	0	0	0	0	112	L395 W436 S451 D452 G457 V458 L459	L395-A455 HydrophobicContact CB-CB 4.09Å; W436-A455 HydrophobicContact CB-CB 4.5Å; W436-A455 WeakPolarHBondContact O-CB 3.39Å; S451-A455 PolarHBondContact O-N 3.48Å; S451-A455 VanDerWaalsContact O-N 3.16Å; D452-A455 PolarHBondContact O-N 3.46Å; A455-G457 PolarHBondContact O-N 2.85Å; A455-V458 WeakPolarHBondContact O-CB 3.44Å; A455-V458 PolarHBondContact O-N 2.84Å; A455-V458 VanDerWaalsContact O-N 3.12Å; A455-L459 PolarHBondContact O-N 2.95Å
456	F	98.7	Very high	97.2	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-61.8	-40.1	172.2	-177	-101.7	0	0	0	112.4	I378 L395 D452 V453 W454 V458 L459 L460 F517 I520 F524	I378-F456 HydrophobicContact CB-CE2 4.06Å; I378-F456 HydrophobicContact CG2-CD2 3.92Å; I378-F456 HydrophobicContact CG2-CE2 3.65Å; L395-F456 HydrophobicContact CD2-CB 3.78Å; L395-F456 HydrophobicContact CD2-CD2 4.21Å; D452-F456 WeakPolarHBondContact O-CB 3.37Å; D452-F456 PolarHBondContact O-N 3.16Å; V453-F456 WeakPolarHBondContact O-CB 3.47Å; V453-F456 PolarHBondContact O-N 3.36Å; W454-F456 VanDerWaalsContact C-N 3.31Å; W454-F456 PolarHBondContact O-N 2.86Å; F456-V458 VanDerWaalsContact C-N 3.27Å; F456-V458 PolarHBondContact O-N 2.78Å; F456-L459 HydrophobicContact CD2-CD2 4.37Å; F456-L459 CarbonylContact O-C 3.59Å; F456-L459 WeakPolarHBondContact O-CB 3.38Å; F456-L459 PolarHBondContact O-N 3.38Å; F456-L459 VanDerWaalsContact O-N 3.15Å; F456-L460 HydrophobicContact CD1-CD1 4.11Å; F456-L460 HydrophobicContact CD1-CG 4.08Å; F456-L460 HydrophobicContact CE1-CD1 3.63Å; F456-L460 HydrophobicContact CE1-CD2 3.79Å; F456-L460 HydrophobicContact CE1-CG 3.65Å; F456-L460 HydrophobicContact CE2-CD2 4.3Å; F456-L460 HydrophobicContact CZ-CD1 4.33Å; F456-L460 HydrophobicContact CZ-CD2 3.6Å; F456-L460 HydrophobicContact CZ-CG 3.95Å; F456-L460 WeakPolarHBondContact O-CG 3.31Å; F456-L460 PolarHBondContact O-N 2.72Å; F456-F517 HydrophobicContact CB-CE1 3.67Å; F456-F517 HydrophobicContact CB-CZ 3.93Å; F456-F517 HydrophobicContact CD1-CE1 4.13Å; F456-F517 HydrophobicContact CD2-CE1 4.11Å; F456-F517 AromaticContact CG-CE1 3.7Å; F456-F517 HydrophobicContact CG-CE1 3.7Å; F456-F517 HydrophobicContact CG-CZ 4.44Å; F456-I520 HydrophobicContact CD1-CD1 4.23Å; F456-I520 HydrophobicContact CD1-CG2 4.04Å; F456-I520 HydrophobicContact CE1-CG2 3.38Å; F456-I520 HydrophobicContact CZ-CG2 4.06Å; F456-F524 AromaticContact CE1-CE2 3.87Å; F456-F524 HydrophobicContact CE1-CE2 3.87Å; F456-F524 HydrophobicContact CE1-CZ 4.35Å; F456-F524 AromaticContact CZ-CE2 3.8Å; F456-F524 HydrophobicContact CZ-CE2 3.8Å; F456-F524 HydrophobicContact CZ-CZ 4.36Å
457	G	98.6	Very high	97.5	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-58	-39.2	171.9	0	0	0	0	0	112.6	V453 W454 A455 W461 W507	V453-G457 PolarHBondContact O-N 3.24Å; W454-G457 PolarHBondContact O-N 3.41Å; W454-G457 VanDerWaalsContact O-N 3.13Å; A455-G457 PolarHBondContact O-N 2.85Å; G457-W461 PolarHBondContact O-N 3.21Å; G457-W507 VanDerWaalsContact C-NE1 3.27Å; G457-W507 WeakPolarHBondContact O-CZ2 3.42Å
458	V	98.8	Very high	97.7	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-69	-39.7	174.8	-176.7	0	0	0	0	111.3	W436 W454 A455 F456 W461 E462 P470 M489 W507	W436-V458 HydrophobicContact CD2-CG1 4.39Å; W436-V458 HydrophobicContact CG-CB 4.45Å; W436-V458 HydrophobicContact CG-CG1 4.02Å; W454-V458 PolarHBondContact O-N 2.93Å; A455-V458 WeakPolarHBondContact O-CB 3.44Å; A455-V458 PolarHBondContact O-N 2.84Å; A455-V458 VanDerWaalsContact O-N 3.12Å; F456-V458 VanDerWaalsContact C-N 3.27Å; F456-V458 PolarHBondContact O-N 2.78Å; V458-W461 WeakPolarHBondContact O-CA 3.46Å; V458-W461 WeakPolarHBondContact O-CB 3.43Å; V458-W461 PolarHBondContact O-N 3.3Å; V458-W461 VanDerWaalsContact O-N 3.12Å; V458-E462 PolarHBondContact O-N 2.97Å; V458-P470 HydrophobicContact CG1-CB 3.8Å; V458-P470 HydrophobicContact CG1-CG 3.56Å; V458-M489 HydrophobicContact CG1-CE 4.33Å; V458-W507 HydrophobicContact CG2-CZ2 4.44Å
459	L	98.7	Very high	97.8	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-62.8	-39.2	174.4	174.2	50.3	0	0	0	112.7	I378 L395 A397 A455 F456 W461 E462 I463	I378-L459 HydrophobicContact CD1-CD2 4.27Å; I378-L459 HydrophobicContact CG2-CD2 3.87Å; L395-L459 HydrophobicContact CD1-CD2 3.8Å; L395-L459 HydrophobicContact CG-CD2 3.89Å; A397-L459 HydrophobicContact CB-CD1 3.65Å; A455-L459 PolarHBondContact O-N 2.95Å; F456-L459 HydrophobicContact CD2-CD2 4.37Å; F456-L459 CarbonylContact O-C 3.59Å; F456-L459 WeakPolarHBondContact O-CB 3.38Å; F456-L459 PolarHBondContact O-N 3.38Å; F456-L459 VanDerWaalsContact O-N 3.15Å; L459-W461 VanDerWaalsContact C-N 3.25Å; L459-W461 PolarHBondContact O-N 2.77Å; L459-E462 WeakPolarHBondContact O-CB 3.39Å; L459-E462 PolarHBondContact O-N 2.95Å; L459-I463 HydrophobicContact CD1-CD1 4.01Å; L459-I463 HydrophobicContact CD1-CG1 4.18Å; L459-I463 HydrophobicContact CG-CD1 4.16Å; L459-I463 WeakPolarHBondContact O-CG1 3.35Å; L459-I463 PolarHBondContact O-N 2.88Å
460	L	98.5	Very high	98	Very high	5 Å²	5	15.7 Å²	15.7	3%	0.026	9%	0.087	C	C	.	.	H	α-helix	trans	-60	-37.1	171.3	-70.3	-177	0	0	0	112.1	A375 F456 I463 A464 L502 M503 F524	A375-L460 HydrophobicContact CB-CD2 3.76Å; F456-L460 HydrophobicContact CD1-CD1 4.11Å; F456-L460 HydrophobicContact CD1-CG 4.08Å; F456-L460 HydrophobicContact CE1-CD1 3.63Å; F456-L460 HydrophobicContact CE1-CD2 3.79Å; F456-L460 HydrophobicContact CE1-CG 3.65Å; F456-L460 HydrophobicContact CE2-CD2 4.3Å; F456-L460 HydrophobicContact CZ-CD1 4.33Å; F456-L460 HydrophobicContact CZ-CD2 3.6Å; F456-L460 HydrophobicContact CZ-CG 3.95Å; F456-L460 WeakPolarHBondContact O-CG 3.31Å; F456-L460 PolarHBondContact O-N 2.72Å; L460-I463 PolarHBondContact O-N 3.39Å; L460-A464 VanDerWaalsContact O-CB 3.31Å; L460-A464 WeakPolarHBondContact O-CB 3.36Å; L460-A464 PolarHBondContact O-N 2.8Å; L460-L502 HydrophobicContact CD1-CG 4.48Å; L460-M503 HydrophobicContact CB-CE 4.09Å; L460-M503 HydrophobicContact CB-CG 3.9Å; L460-M503 HydrophobicContact CD1-CG 4.19Å; L460-F524 HydrophobicContact CD1-CZ 3.83Å; L460-F524 HydrophobicContact CD2-CE2 4.28Å; L460-F524 HydrophobicContact CD2-CZ 3.6Å; L460-F524 HydrophobicContact CG-CZ 4.36Å
461	W	98.6	Very high	97.9	Very high	12 Å²	12	13.9 Å²	13.9	5%	0.045	8%	0.079	C	C	.	.	H	α-helix	trans	-70	-38.2	174.8	-167.8	97.4	0	0	0	111.7	G457 V458 L459 I463 T465 M468 P470 P472 M489 E490 P492 M503 W507	G457-W461 PolarHBondContact O-N 3.21Å; V458-W461 WeakPolarHBondContact O-CA 3.46Å; V458-W461 WeakPolarHBondContact O-CB 3.43Å; V458-W461 PolarHBondContact O-N 3.3Å; V458-W461 VanDerWaalsContact O-N 3.12Å; L459-W461 VanDerWaalsContact C-N 3.25Å; L459-W461 PolarHBondContact O-N 2.77Å; W461-I463 PolarHBondContact O-N 2.89Å; W461-T465 HydrophobicContact CD2-CG2 3.89Å; W461-T465 HydrophobicContact CE3-CG2 3.95Å; W461-T465 HydrophobicContact CH2-CG2 3.92Å; W461-T465 HydrophobicContact CZ2-CG2 3.86Å; W461-T465 HydrophobicContact CZ3-CG2 3.95Å; W461-T465 WeakPolarHBondContact O-CB 3.38Å; W461-T465 VanDerWaalsContact O-CG2 3.28Å; W461-T465 WeakPolarHBondContact O-CG2 3.18Å; W461-T465 PolarHBondContact O-N 2.99Å; W461-T465 VanDerWaalsContact O-N 3.08Å; W461-T465 PolarHBondContact O-OG1 3.5Å; W461-M468 HydrophobicContact CH2-CB 4.05Å; W461-M468 HydrophobicContact CZ3-CB 3.89Å; W461-P470 HydrophobicContact CE3-CB 4.35Å; W461-P470 HydrophobicContact CE3-CG 4.29Å; W461-P470 HydrophobicContact CZ3-CB 4.41Å; W461-P470 HydrophobicContact CZ3-CG 4.44Å; W461-P472 HydrophobicContact CH2-CG 4.37Å; W461-M489 HydrophobicContact CB-CE 3.73Å; W461-M489 HydrophobicContact CD2-CE 3.72Å; W461-M489 HydrophobicContact CD2-SD 3.79Å; W461-M489 HydrophobicContact CE3-CE 4.22Å; W461-M489 HydrophobicContact CE3-SD 4.1Å; W461-M489 HydrophobicContact CG-CE 3.5Å; W461-M489 VanDerWaalsContact CG-CE 3.5Å; W461-M489 HydrophobicContact CG-SD 4.17Å; W461-M489 HydrophobicContact CZ2-SD 4.22Å; W461-M489 HydrophobicContact CZ3-SD 4.47Å; W461-E490 PolarHBondContact NE1-O 3.35Å; W461-E490 VanDerWaalsContact NE1-O 3.14Å; W461-P492 HydrophobicContact CG-CG 4.35Å; W461-M503 HydrophobicContact CB-SD 3.95Å; W461-M503 HydrophobicContact CG-SD 4.43Å; W461-W507 HydrophobicContact CB-CH2 4.17Å; W461-W507 HydrophobicContact CB-CZ2 4.14Å; W461-W507 HydrophobicContact CG-CH2 4.33Å
462	E	98.6	Very high	97.9	Very high	1 Å²	1	17.1 Å²	17.1	1%	0.005	10%	0.099	C	C	.	.	H	α-helix	trans	-58.4	-45.1	170	-65.7	-176.9	97.9	0	0	111.6	A397 W436 V458 L459 T465 Y466 G467 P470	A397-E462 HydrophobicContact CB-CB 4.14Å; A397-E462 HydrophobicContact CB-CG 4.5Å; A397-E462 PolarHBondContact N-OE2 3.45Å; W436-E462 WeakPolarHBondContact CZ2-OE1 3.31Å; W436-E462 PolarHBondContact NE1-OE2 3.09Å; V458-E462 PolarHBondContact O-N 2.97Å; L459-E462 WeakPolarHBondContact O-CB 3.39Å; L459-E462 PolarHBondContact O-N 2.95Å; E462-T465 PolarHBondContact O-N 3.12Å; E462-T465 PolarHBondContact O-OG1 3.07Å; E462-Y466 PolarHBondContact O-N 3.49Å; E462-G467 PolarHBondContact O-N 2.69Å; E462-P470 HydrophobicContact CG-CG 4.01Å
463	I	98.3	Very high	97.7	Very high	5 Å²	5	21.4 Å²	21.4	3%	0.026	14%	0.144	C	C	.	.	H	α-helix	trans	-64.7	-50.1	179.4	-68	164.7	0	0	0	110.8	L354 L358 L371 A375 I378 L459 L460 W461 T465 Y466	L354-I463 HydrophobicContact CD2-CD1 4.24Å; L354-I463 HydrophobicContact CD2-CG1 4.16Å; L358-I463 HydrophobicContact CD1-CG1 4.17Å; L371-I463 HydrophobicContact CB-CG2 3.95Å; L371-I463 HydrophobicContact CD2-CG2 4.05Å; L371-I463 HydrophobicContact CG-CG2 4.49Å; A375-I463 HydrophobicContact CB-CD1 4.26Å; I378-I463 HydrophobicContact CD1-CD1 3.82Å; L459-I463 HydrophobicContact CD1-CD1 4.01Å; L459-I463 HydrophobicContact CD1-CG1 4.18Å; L459-I463 HydrophobicContact CG-CD1 4.16Å; L459-I463 WeakPolarHBondContact O-CG1 3.35Å; L459-I463 PolarHBondContact O-N 2.88Å; L460-I463 PolarHBondContact O-N 3.39Å; W461-I463 PolarHBondContact O-N 2.89Å; I463-T465 PolarHBondContact O-N 3.21Å; I463-Y466 PolarHBondContact O-N 3.13Å
464	A	97.4	Very high	97.6	Very high	24 Å²	24	22.9 Å²	22.9	20%	0.198	15%	0.152	C	C	.	.	H	α-helix	trans	-65.6	-19.4	-179.6	0	0	0	0	0	113.9	L460 P492 M503	L460-A464 VanDerWaalsContact O-CB 3.31Å; L460-A464 WeakPolarHBondContact O-CB 3.36Å; L460-A464 PolarHBondContact O-N 2.8Å; A464-P492 HydrophobicContact CB-CB 4.27Å; A464-P492 HydrophobicContact CB-CG 3.99Å; A464-M503 HydrophobicContact CB-CE 3.85Å
465	T	97.1	Very high	97.4	Very high	16 Å²	16	27.5 Å²	27.5	10%	0.098	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.5	4.2	178.8	56.8	0	0	0	0	114.3	W461 E462 I463 G467 M468 P492	W461-T465 HydrophobicContact CD2-CG2 3.89Å; W461-T465 HydrophobicContact CE3-CG2 3.95Å; W461-T465 HydrophobicContact CH2-CG2 3.92Å; W461-T465 HydrophobicContact CZ2-CG2 3.86Å; W461-T465 HydrophobicContact CZ3-CG2 3.95Å; W461-T465 WeakPolarHBondContact O-CB 3.38Å; W461-T465 VanDerWaalsContact O-CG2 3.28Å; W461-T465 WeakPolarHBondContact O-CG2 3.18Å; W461-T465 PolarHBondContact O-N 2.99Å; W461-T465 VanDerWaalsContact O-N 3.08Å; W461-T465 PolarHBondContact O-OG1 3.5Å; E462-T465 PolarHBondContact O-N 3.12Å; E462-T465 PolarHBondContact O-OG1 3.07Å; I463-T465 PolarHBondContact O-N 3.21Å; T465-G467 VanDerWaalsContact C-N 3.34Å; T465-M468 HydrophobicContact CG2-CB 4.48Å; T465-M468 HydrophobicContact CG2-SD 4.16Å; T465-M468 PolarHBondContact OG1-N 2.99Å; T465-P492 HydrophobicContact CG2-CB 3.79Å; T465-P492 HydrophobicContact CG2-CG 3.84Å
466	Y	97.5	Very high	97.2	Very high	46 Å²	46	31.6 Å²	31.6	18%	0.18	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	45.2	-172.4	-63.7	-99.8	0	0	0	112.6	L358 K363 V366 L371 E462 I463	L358-Y466 WeakPolarHBondContact O-CB 3.32Å; K363-Y466 HydrophobicContact CB-CE1 4.07Å; K363-Y466 HydrophobicContact CD-CD1 3.94Å; K363-Y466 HydrophobicContact CD-CD2 4.24Å; K363-Y466 HydrophobicContact CD-CE1 3.83Å; K363-Y466 HydrophobicContact CD-CE2 4.13Å; K363-Y466 HydrophobicContact CD-CG 4.15Å; K363-Y466 HydrophobicContact CG-CD1 3.96Å; K363-Y466 HydrophobicContact CG-CE1 3.65Å; V366-Y466 WeakPolarHBondContact O-CE1 3.2Å; V366-Y466 PolarHBondContact O-OH 2.79Å; V366-Y466 VanDerWaalsContact O-OH 3.13Å; L371-Y466 HydrophobicContact CD1-CE1 4.36Å; L371-Y466 HydrophobicContact CD1-CE2 3.97Å; L371-Y466 HydrophobicContact CD2-CE1 4.3Å; E462-Y466 PolarHBondContact O-N 3.49Å; I463-Y466 PolarHBondContact O-N 3.13Å
467	G	96.9	Very high	96.9	Very high	2 Å²	2	36.4 Å²	36.4	2%	0.021	23%	0.231	C	C	.	.	S	Bend	trans	81	26.3	171.2	0	0	0	0	0	116	R359 E462 T465	R359-G467 PolarHBondContact NE-O 3.23Å; R359-G467 PolarHBondContact NH2-O 2.92Å; E462-G467 PolarHBondContact O-N 2.69Å; T465-G467 VanDerWaalsContact C-N 3.34Å
468	M	97.3	Very high	96.8	Very high	99 Å²	99	40.8 Å²	40.8	49%	0.488	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-62.8	155.4	170	-70.2	178.5	63.4	0	0	111.3	W461 T465 P470	W461-M468 HydrophobicContact CH2-CB 4.05Å; W461-M468 HydrophobicContact CZ3-CB 3.89Å; T465-M468 HydrophobicContact CG2-CB 4.48Å; T465-M468 HydrophobicContact CG2-SD 4.16Å; T465-M468 PolarHBondContact OG1-N 2.99Å; M468-P470 WeakPolarHBondContact O-CD 3.45Å
469	S	96.8	Very high	96.6	Very high	65 Å²	65	40.9 Å²	40.9	46%	0.455	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-71.8	124.8	172.5	-165.5	0	0	0	0	109.8	K435	K435-S469 PolarHBondContact NZ-OG 3.2Å; K435-S469 VanDerWaalsContact NZ-OG 3.08Å
470	P	97.9	Very high	96.5	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.006	26%	0.262	C	S	.	.	S	Bend	trans	-55.2	155.3	175	-27.7	36.7	0	0	0	112.2	K435 W436 V458 W461 E462 M468 M489	K435-P470 HydrophobicContact CB-CB 4.37Å; K435-P470 HydrophobicContact CD-CB 4.44Å; K435-P470 VanDerWaalsContact CD-O 3.25Å; K435-P470 WeakPolarHBondContact CD-O 3.42Å; K435-P470 VanDerWaalsContact CE-O 3.24Å; K435-P470 WeakPolarHBondContact CE-O 3.43Å; K435-P470 PolarHBondContact NZ-O 2.91Å; W436-P470 HydrophobicContact CH2-CG 4.42Å; W436-P470 HydrophobicContact CZ2-CG 3.89Å; V458-P470 HydrophobicContact CG1-CB 3.8Å; V458-P470 HydrophobicContact CG1-CG 3.56Å; W461-P470 HydrophobicContact CE3-CB 4.35Å; W461-P470 HydrophobicContact CE3-CG 4.29Å; W461-P470 HydrophobicContact CZ3-CB 4.41Å; W461-P470 HydrophobicContact CZ3-CG 4.44Å; E462-P470 HydrophobicContact CG-CG 4.01Å; M468-P470 WeakPolarHBondContact O-CD 3.45Å; P470-M489 HydrophobicContact CB-CE 4.15Å; P470-M489 HydrophobicContact CB-SD 3.71Å
471	Y	97.1	Very high	96.3	Very high	3 Å²	3	47.3 Å²	47.3	1%	0.012	28%	0.282	C	S	.	.	S	Bend	trans	51.7	60.2	-178.1	-54.8	-92.1	0	0	0	112.1	K435 I474 V479 L483 Y487 M489	K435-Y471 HydrophobicContact CB-CD2 4.04Å; K435-Y471 HydrophobicContact CB-CE2 4.42Å; K435-Y471 HydrophobicContact CG-CD2 4.11Å; K435-Y471 VanDerWaalsContact O-CE2 3.3Å; K435-Y471 WeakPolarHBondContact O-CE2 3.29Å; Y471-I474 HydrophobicContact CD1-CD1 4.32Å; Y471-I474 PolarHBondContact O-N 2.77Å; Y471-V479 HydrophobicContact CD1-CG1 4.5Å; Y471-V479 HydrophobicContact CE1-CG1 4.39Å; Y471-L483 HydrophobicContact CE1-CD2 3.99Å; Y471-Y487 AromaticContact CD1-CE1 4Å; Y471-Y487 HydrophobicContact CD1-CE1 4Å; Y471-Y487 HydrophobicContact CE1-CE1 4.2Å; Y471-M489 HydrophobicContact CD1-CG 3.9Å; Y471-M489 HydrophobicContact CD1-SD 4.43Å; Y471-M489 HydrophobicContact CD2-CG 4.36Å; Y471-M489 HydrophobicContact CD2-SD 3.85Å; Y471-M489 HydrophobicContact CE1-CG 3.84Å; Y471-M489 HydrophobicContact CE1-SD 4.49Å; Y471-M489 HydrophobicContact CE2-CE 4.19Å; Y471-M489 HydrophobicContact CE2-CG 4.29Å; Y471-M489 HydrophobicContact CE2-SD 3.89Å; Y471-M489 HydrophobicContact CG-CG 4.15Å; Y471-M489 HydrophobicContact CG-SD 4.09Å; Y471-M489 PolarHBondContact N-SD 3.2Å
472	P	95.4	Very high	96.2	Very high	71 Å²	71	49 Å²	49	46%	0.461	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	137.7	178	27.3	-34.7	0	0	0	110.7	W461 I474	W461-P472 HydrophobicContact CH2-CG 4.37Å; P472-I474 PolarHBondContact O-N 2.93Å
473	G	94.8	Very high	96.2	Very high	92 Å²	92	49 Å²	49	95%	0.948	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	2	-180	0	0	0	0	0	116.3
474	I	96.2	Very high	96.1	Very high	31 Å²	31	54 Å²	54	16%	0.159	32%	0.315	C	S	.	.			trans	-109.7	128.7	-177.3	-64.1	167.7	0	0	0	110.7	Y471 P472 Q478 V479 L482 Y487	Y471-I474 HydrophobicContact CD1-CD1 4.32Å; Y471-I474 PolarHBondContact O-N 2.77Å; P472-I474 PolarHBondContact O-N 2.93Å; I474-Q478 HydrophobicContact CG2-CB 4.31Å; I474-V479 HydrophobicContact CG2-CG2 3.96Å; I474-L482 HydrophobicContact CD1-CD1 4.05Å; I474-L482 HydrophobicContact CG1-CD1 4.23Å; I474-L482 HydrophobicContact CG2-CD1 3.68Å; I474-Y487 HydrophobicContact CD1-CD1 4.41Å; I474-Y487 HydrophobicContact CD1-CE1 3.57Å
475	D	94.8	Very high	96	Very high	99 Å²	99	60 Å²	60	53%	0.529	34%	0.337	S	S	.	.			trans	-67.7	142.9	173	-69.6	-48.9	0	0	0	112	S477 Q478 V479	D475-S477 PolarHBondContact O-N 2.86Å; D475-S477 VanDerWaalsContact O-N 3.12Å; D475-Q478 HydrophobicContact CB-CG 4.08Å; D475-Q478 PolarHBondContact O-N 2.8Å; D475-Q478 PolarHBondContact OD2-NE2 2.94Å; D475-V479 PolarHBondContact O-N 2.98Å
476	L	92.8	Very high	95.9	Very high	91 Å²	91	61.6 Å²	61.6	48%	0.476	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-31.8	179.6	-63.3	179.8	0	0	0	113.8	I434 K435 Q478	I434-L476 HydrophobicContact CB-CD2 4.48Å; I434-L476 HydrophobicContact CD1-CB 4.14Å; K435-L476 HydrophobicContact CD-CD2 4.04Å; K435-L476 HydrophobicContact CG-CD2 3.64Å; L476-Q478 VanDerWaalsContact C-N 3.31Å; L476-Q478 PolarHBondContact O-N 2.86Å
477	S	93.6	Very high	95.9	Very high	102 Å²	102	62.8 Å²	62.8	71%	0.713	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-22.3	176.7	49.6	0	0	0	0	113.8	D475	D475-S477 PolarHBondContact O-N 2.86Å; D475-S477 VanDerWaalsContact O-N 3.12Å
478	Q	95.3	Very high	96	Very high	92 Å²	92	64 Å²	64	43%	0.43	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-13.9	-178.3	-59	-174.4	52.4	0	0	112.7	I474 D475 L476 Y480 D481 L482	I474-Q478 HydrophobicContact CG2-CB 4.31Å; D475-Q478 HydrophobicContact CB-CG 4.08Å; D475-Q478 PolarHBondContact O-N 2.8Å; D475-Q478 PolarHBondContact OD2-NE2 2.94Å; L476-Q478 VanDerWaalsContact C-N 3.31Å; L476-Q478 PolarHBondContact O-N 2.86Å; Q478-Y480 PolarHBondContact O-N 3.28Å; Q478-D481 PolarHBondContact O-N 3.08Å; Q478-L482 HydrophobicContact CB-CD1 4.2Å; Q478-L482 WeakPolarHBondContact O-CG 3.27Å; Q478-L482 PolarHBondContact O-N 3.11Å
479	V	95.4	Very high	96	Very high	1 Å²	1	59.3 Å²	59.3	1%	0.006	34%	0.342	C	S	.	.	H	α-helix	trans	-57.5	-51.8	-173.4	174.4	0	0	0	0	111.9	I434 Y471 I474 D475 D481 L482 L483	I434-V479 HydrophobicContact CG2-CB 4.29Å; I434-V479 HydrophobicContact CG2-CG1 4.45Å; Y471-V479 HydrophobicContact CD1-CG1 4.5Å; Y471-V479 HydrophobicContact CE1-CG1 4.39Å; I474-V479 HydrophobicContact CG2-CG2 3.96Å; D475-V479 PolarHBondContact O-N 2.98Å; V479-D481 PolarHBondContact O-N 2.91Å; V479-L482 PolarHBondContact O-N 2.69Å; V479-L483 HydrophobicContact CG1-CD1 3.73Å; V479-L483 HydrophobicContact CG1-CG 4.24Å; V479-L483 VanDerWaalsContact O-CG 3.24Å; V479-L483 WeakPolarHBondContact O-CG 3.38Å; V479-L483 PolarHBondContact O-N 3.33Å
480	Y	95.4	Very high	96	Very high	56 Å²	56	63.4 Å²	63.4	22%	0.22	35%	0.354	C	S	.	.	H	α-helix	trans	-59.3	-50.7	179.8	179.9	-84.6	0	0	0	111.6	P439 L442 A443 Q478 L482 L483 E484 W509	P439-Y480 HydrophobicContact CB-CE2 4.35Å; L442-Y480 HydrophobicContact CB-CD2 4.14Å; L442-Y480 HydrophobicContact CD1-CD2 4.35Å; A443-Y480 HydrophobicContact CB-CE2 3.97Å; Q478-Y480 PolarHBondContact O-N 3.28Å; Y480-L482 PolarHBondContact O-N 3.2Å; Y480-L482 VanDerWaalsContact O-N 3.17Å; Y480-L483 PolarHBondContact O-N 3.39Å; Y480-L483 VanDerWaalsContact O-N 3.1Å; Y480-E484 HydrophobicContact CE1-CB 4.26Å; Y480-E484 VanDerWaalsContact CE1-OE1 3.28Å; Y480-E484 WeakPolarHBondContact CE1-OE1 3.29Å; Y480-E484 PolarHBondContact O-N 3Å; Y480-E484 PolarHBondContact OH-OE1 2.87Å; Y480-W509 AromaticContact CE2-CH2 3.98Å; Y480-W509 HydrophobicContact CE2-CH2 3.98Å; Y480-W509 AromaticContact CZ-CH2 3.84Å
481	D	95.7	Very high	96	Very high	85 Å²	85	67 Å²	67	46%	0.455	37%	0.371	S	S	.	.	H	α-helix	trans	-55.7	-31.5	178.4	-90.1	44.4	0	0	0	113.8	Q478 V479 K485	Q478-D481 PolarHBondContact O-N 3.08Å; V479-D481 PolarHBondContact O-N 2.91Å; D481-K485 VanDerWaalsContact O-CD 3.3Å; D481-K485 WeakPolarHBondContact O-CD 3.46Å; D481-K485 WeakPolarHBondContact O-CE 3.14Å; D481-K485 WeakPolarHBondContact O-CG 3.4Å; D481-K485 PolarHBondContact O-NZ 3.09Å; D481-K485 IonicContact OD2-NZ 2.83Å
482	L	96.8	Very high	95.9	Very high	47 Å²	47	67.5 Å²	67.5	25%	0.246	38%	0.375	C	S	.	.	H	α-helix	trans	-82.1	-43	176.2	-70.8	169.2	0	0	0	111.2	I474 Q478 V479 Y480 E484 K485 G486 Y487	I474-L482 HydrophobicContact CD1-CD1 4.05Å; I474-L482 HydrophobicContact CG1-CD1 4.23Å; I474-L482 HydrophobicContact CG2-CD1 3.68Å; Q478-L482 HydrophobicContact CB-CD1 4.2Å; Q478-L482 WeakPolarHBondContact O-CG 3.27Å; Q478-L482 PolarHBondContact O-N 3.11Å; V479-L482 PolarHBondContact O-N 2.69Å; Y480-L482 PolarHBondContact O-N 3.2Å; Y480-L482 VanDerWaalsContact O-N 3.17Å; L482-E484 VanDerWaalsContact C-N 3.3Å; L482-E484 PolarHBondContact O-N 2.89Å; L482-K485 CarbonylContact O-C 3.59Å; L482-K485 PolarHBondContact O-N 3.02Å; L482-K485 VanDerWaalsContact O-N 3.13Å; L482-G486 PolarHBondContact O-N 2.71Å; L482-Y487 HydrophobicContact CB-CD1 4.12Å; L482-Y487 HydrophobicContact CB-CG 4.3Å; L482-Y487 VanDerWaalsContact O-CB 3.31Å; L482-Y487 WeakPolarHBondContact O-CB 3.29Å; L482-Y487 PolarHBondContact O-N 2.98Å
483	L	97	Very high	95.8	Very high	2 Å²	2	71.5 Å²	71.5	1%	0.01	39%	0.387	C	S	.	.	H	α-helix	trans	-60.5	-38	177.3	-69.3	174	0	0	0	112.4	W454 Y471 V479 Y480 K485 G486 Y487 R488 W509	W454-L483 HydrophobicContact CH2-CD1 4.12Å; W454-L483 HydrophobicContact CH2-CD2 3.89Å; W454-L483 HydrophobicContact CH2-CG 4.47Å; W454-L483 HydrophobicContact CZ2-CD1 3.65Å; W454-L483 HydrophobicContact CZ2-CD2 3.82Å; W454-L483 HydrophobicContact CZ2-CG 4.32Å; Y471-L483 HydrophobicContact CE1-CD2 3.99Å; V479-L483 HydrophobicContact CG1-CD1 3.73Å; V479-L483 HydrophobicContact CG1-CG 4.24Å; V479-L483 VanDerWaalsContact O-CG 3.24Å; V479-L483 WeakPolarHBondContact O-CG 3.38Å; V479-L483 PolarHBondContact O-N 3.33Å; Y480-L483 PolarHBondContact O-N 3.39Å; Y480-L483 VanDerWaalsContact O-N 3.1Å; L483-K485 VanDerWaalsContact C-N 3.34Å; L483-G486 PolarHBondContact O-N 3.22Å; L483-G486 VanDerWaalsContact O-N 3.11Å; L483-Y487 WeakPolarHBondContact CD2-O 3.42Å; L483-R488 PolarHBondContact O-NH1 2.89Å; L483-W509 HydrophobicContact CB-CZ3 4.16Å
484	E	96	Very high	95.6	Very high	109 Å²	109	67.5 Å²	67.5	51%	0.509	35%	0.345	S	S	.	.	H	α-helix	trans	-66.7	-34.8	175.7	-169.6	174.5	-100.7	0	0	112	Y480 L482 G486 W509	Y480-E484 HydrophobicContact CE1-CB 4.26Å; Y480-E484 VanDerWaalsContact CE1-OE1 3.28Å; Y480-E484 WeakPolarHBondContact CE1-OE1 3.29Å; Y480-E484 PolarHBondContact O-N 3Å; Y480-E484 PolarHBondContact OH-OE1 2.87Å; L482-E484 VanDerWaalsContact C-N 3.3Å; L482-E484 PolarHBondContact O-N 2.89Å; E484-G486 PolarHBondContact O-N 2.93Å; E484-W509 VanDerWaalsContact CA-CZ3 3.47Å; E484-W509 HydrophobicContact CB-CH2 3.64Å; E484-W509 HydrophobicContact CB-CZ2 4.4Å; E484-W509 HydrophobicContact CB-CZ3 4.01Å; E484-W509 HydrophobicContact CG-CH2 3.84Å; E484-W509 HydrophobicContact CG-CZ2 4.11Å
485	K	96.4	Very high	95.5	Very high	150 Å²	150	66.4 Å²	66.4	65%	0.652	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	4.9	172.1	-64.7	172.9	-169.3	91.7	0	113.3	D481 L482 L483	D481-K485 VanDerWaalsContact O-CD 3.3Å; D481-K485 WeakPolarHBondContact O-CD 3.46Å; D481-K485 WeakPolarHBondContact O-CE 3.14Å; D481-K485 WeakPolarHBondContact O-CG 3.4Å; D481-K485 PolarHBondContact O-NZ 3.09Å; D481-K485 IonicContact OD2-NZ 2.83Å; L482-K485 CarbonylContact O-C 3.59Å; L482-K485 PolarHBondContact O-N 3.02Å; L482-K485 VanDerWaalsContact O-N 3.13Å; L483-K485 VanDerWaalsContact C-N 3.34Å
486	G	95.2	Very high	95.5	Very high	50 Å²	50	61.9 Å²	61.9	52%	0.515	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.5	3.7	178	0	0	0	0	0	115.5	L482 L483 E484	L482-G486 PolarHBondContact O-N 2.71Å; L483-G486 PolarHBondContact O-N 3.22Å; L483-G486 VanDerWaalsContact O-N 3.11Å; E484-G486 PolarHBondContact O-N 2.93Å
487	Y	97.6	Very high	95.5	Very high	71 Å²	71	59.6 Å²	59.6	28%	0.278	31%	0.307	S	S	.	.			trans	-61.5	142.8	172.3	171.9	-91.6	0	0	0	110.4	Y471 I474 L482 L483	Y471-Y487 AromaticContact CD1-CE1 4Å; Y471-Y487 HydrophobicContact CD1-CE1 4Å; Y471-Y487 HydrophobicContact CE1-CE1 4.2Å; I474-Y487 HydrophobicContact CD1-CD1 4.41Å; I474-Y487 HydrophobicContact CD1-CE1 3.57Å; L482-Y487 HydrophobicContact CB-CD1 4.12Å; L482-Y487 HydrophobicContact CB-CG 4.3Å; L482-Y487 VanDerWaalsContact O-CB 3.31Å; L482-Y487 WeakPolarHBondContact O-CB 3.29Å; L482-Y487 PolarHBondContact O-N 2.98Å; L483-Y487 WeakPolarHBondContact CD2-O 3.42Å
488	R	97.9	Very high	95.6	Very high	27 Å²	27	58.2 Å²	58.2	10%	0.102	29%	0.288	C	S	.	.			trans	-140.6	159.9	169.3	-63.7	-62.4	-178.1	-89.3	2.7	108	L483 W507	L483-R488 PolarHBondContact O-NH1 2.89Å; R488-W507 HydrophobicContact CB-CE3 4.06Å; R488-W507 HydrophobicContact CB-CZ3 4.44Å; R488-W507 HydrophobicContact CG-CE3 4.37Å; R488-W507 VanDerWaalsContact CZ-O 3.31Å; R488-W507 PolarHBondContact NE-O 2.9Å; R488-W507 PolarHBondContact NH2-O 3.05Å
489	M	97.8	Very high	95.6	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.005	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-59	146.1	175	-61.4	-173	-67.4	0	0	110.9	V458 W461 P470 Y471 Y500 W507	V458-M489 HydrophobicContact CG1-CE 4.33Å; W461-M489 HydrophobicContact CB-CE 3.73Å; W461-M489 HydrophobicContact CD2-CE 3.72Å; W461-M489 HydrophobicContact CD2-SD 3.79Å; W461-M489 HydrophobicContact CE3-CE 4.22Å; W461-M489 HydrophobicContact CE3-SD 4.1Å; W461-M489 HydrophobicContact CG-CE 3.5Å; W461-M489 VanDerWaalsContact CG-CE 3.5Å; W461-M489 HydrophobicContact CG-SD 4.17Å; W461-M489 HydrophobicContact CZ2-SD 4.22Å; W461-M489 HydrophobicContact CZ3-SD 4.47Å; P470-M489 HydrophobicContact CB-CE 4.15Å; P470-M489 HydrophobicContact CB-SD 3.71Å; Y471-M489 HydrophobicContact CD1-CG 3.9Å; Y471-M489 HydrophobicContact CD1-SD 4.43Å; Y471-M489 HydrophobicContact CD2-CG 4.36Å; Y471-M489 HydrophobicContact CD2-SD 3.85Å; Y471-M489 HydrophobicContact CE1-CG 3.84Å; Y471-M489 HydrophobicContact CE1-SD 4.49Å; Y471-M489 HydrophobicContact CE2-CE 4.19Å; Y471-M489 HydrophobicContact CE2-CG 4.29Å; Y471-M489 HydrophobicContact CE2-SD 3.89Å; Y471-M489 HydrophobicContact CG-CG 4.15Å; Y471-M489 HydrophobicContact CG-SD 4.09Å; Y471-M489 PolarHBondContact N-SD 3.2Å; M489-Y500 WeakPolarHBondContact O-CE2 3.17Å; M489-Y500 PolarHBondContact O-OH 2.85Å; M489-W507 HydrophobicContact CB-CH2 4.13Å; M489-W507 HydrophobicContact CB-CZ3 4.31Å; M489-W507 HydrophobicContact CE-CH2 3.52Å; M489-W507 HydrophobicContact CE-CZ2 3.36Å
490	E	96.7	Very high	95.8	Very high	150 Å²	150	55.8 Å²	55.8	70%	0.701	28%	0.277	S	S	*	.	P	Polyproline II helix	trans	-70.6	160.5	178.8	-63.9	179.3	173.6	0	0	111.5	W461 P492	W461-E490 PolarHBondContact NE1-O 3.35Å; W461-E490 VanDerWaalsContact NE1-O 3.14Å; E490-P492 WeakPolarHBondContact O-CD 3.48Å
491	Q	97.4	Very high	95.9	Very high	77 Å²	77	59.5 Å²	59.5	36%	0.36	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-64	123.6	175.6	-178.4	172.3	-14.3	0	0	109.3	C495 Y500	Q491-C495 HydrophobicContact CG-CB 4.26Å; Q491-C495 PolarHBondContact NE2-O 3.22Å; Q491-Y500 HydrophobicContact CB-CD1 3.77Å; Q491-Y500 HydrophobicContact CB-CD2 3.97Å; Q491-Y500 HydrophobicContact CB-CE1 3.95Å; Q491-Y500 HydrophobicContact CB-CE2 4.13Å; Q491-Y500 HydrophobicContact CB-CG 3.78Å; Q491-Y500 HydrophobicContact CG-CD1 4.05Å; Q491-Y500 HydrophobicContact CG-CD2 4.33Å; Q491-Y500 HydrophobicContact CG-CG 3.84Å
492	P	96.2	Very high	96	Very high	14 Å²	14	56.4 Å²	56.4	9%	0.091	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-60.9	149.4	176.7	-23.3	33.6	0	0	0	112.2	W461 A464 T465 E490 G494 C495	W461-P492 HydrophobicContact CG-CG 4.35Å; A464-P492 HydrophobicContact CB-CB 4.27Å; A464-P492 HydrophobicContact CB-CG 3.99Å; T465-P492 HydrophobicContact CG2-CB 3.79Å; T465-P492 HydrophobicContact CG2-CG 3.84Å; E490-P492 WeakPolarHBondContact O-CD 3.48Å; P492-G494 PolarHBondContact O-N 2.76Å; P492-C495 HydrophobicContact CB-CB 3.94Å; P492-C495 HydrophobicContact CG-CB 4.24Å; P492-C495 WeakPolarHBondContact O-CB 3.43Å; P492-C495 PolarHBondContact O-N 3.09Å
493	E	92.5	Very high	96.1	Very high	155 Å²	155	54.1 Å²	54.1	72%	0.724	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	128.4	177.2	-173.9	176.6	-176.8	0	0	111.1	C495 L541	E493-C495 PolarHBondContact O-N 3.34Å; E493-L541 HydrophobicContact CG-CD2 3.97Å
494	G	90.2	Very high	96.2	Very high	7 Å²	7	59.2 Å²	59.2	7%	0.072	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.7	0.7	-176.3	0	0	0	0	0	116	P492 P496 V537	P492-G494 PolarHBondContact O-N 2.76Å; G494-P496 WeakPolarHBondContact O-CD 3.45Å; G494-V537 WeakPolarHBondContact O-CG2 3.48Å
495	C	94.8	Very high	96.3	Very high	8 Å²	8	55.6 Å²	55.6	5%	0.054	28%	0.275	C	S	.	.			trans	-70.9	124.6	177.2	-174.5	0	0	0	0	110.8	Q491 P492 E493	Q491-C495 HydrophobicContact CG-CB 4.26Å; Q491-C495 PolarHBondContact NE2-O 3.22Å; P492-C495 HydrophobicContact CB-CB 3.94Å; P492-C495 HydrophobicContact CG-CB 4.24Å; P492-C495 WeakPolarHBondContact O-CB 3.43Å; P492-C495 PolarHBondContact O-N 3.09Å; E493-C495 PolarHBondContact O-N 3.34Å
496	P	93.9	Very high	96.4	Very high	5 Å²	5	48.4 Å²	48.4	3%	0.032	24%	0.244	C	C	.	.			trans	-61.9	140.2	179.7	-23.3	34.4	0	0	0	111.8	G494 K498 V499 Y500 F528 I533 E536 V537	G494-P496 WeakPolarHBondContact O-CD 3.45Å; P496-K498 VanDerWaalsContact C-N 3.27Å; P496-K498 PolarHBondContact O-N 2.94Å; P496-K498 VanDerWaalsContact O-N 3.14Å; P496-V499 HydrophobicContact CB-CG2 4.2Å; P496-V499 HydrophobicContact CG-CG2 4.31Å; P496-V499 WeakPolarHBondContact O-CB 3.42Å; P496-V499 PolarHBondContact O-N 2.6Å; P496-Y500 PolarHBondContact O-N 3.31Å; P496-F528 HydrophobicContact CB-CE1 4.43Å; P496-F528 HydrophobicContact CB-CZ 4.22Å; P496-F528 HydrophobicContact CG-CZ 4.3Å; P496-I533 HydrophobicContact CG-CD1 4.49Å; P496-I533 HydrophobicContact CG-CG1 4.1Å; P496-E536 HydrophobicContact CB-CB 4.3Å; P496-E536 HydrophobicContact CG-CB 4.37Å; P496-V537 HydrophobicContact CG-CG2 3.71Å
497	P	94.6	Very high	96.5	Very high	42 Å²	42	46.1 Å²	46.1	27%	0.273	22%	0.22	S	C	.	.	H	α-helix	trans	-54.9	-40	-174.4	-28.5	35.9	0	0	0	113.4	V499 Y500 E501	P497-V499 VanDerWaalsContact C-N 3.26Å; P497-V499 PolarHBondContact O-N 3.2Å; P497-Y500 CarbonylContact O-C 3.58Å; P497-Y500 PolarHBondContact O-N 2.8Å; P497-Y500 VanDerWaalsContact O-N 3.1Å; P497-E501 WeakPolarHBondContact O-CG 3.39Å; P497-E501 PolarHBondContact O-N 2.89Å
498	K	94.7	Very high	96.6	Very high	74 Å²	74	46.9 Å²	46.9	32%	0.322	23%	0.226	S	C	.	.	H	α-helix	trans	-55.5	-36.6	176.5	-56.8	169.9	-175.8	165.5	0	113.4	P496 L502 M527 F528 E536	P496-K498 VanDerWaalsContact C-N 3.27Å; P496-K498 PolarHBondContact O-N 2.94Å; P496-K498 VanDerWaalsContact O-N 3.14Å; K498-L502 PolarHBondContact O-N 2.72Å; K498-M527 HydrophobicContact CB-CE 4.29Å; K498-M527 HydrophobicContact CB-CG 3.63Å; K498-M527 HydrophobicContact CB-SD 3.61Å; K498-M527 HydrophobicContact CD-CG 3.61Å; K498-M527 WeakPolarHBondContact CD-O 3.49Å; K498-M527 HydrophobicContact CG-CG 4.26Å; K498-M527 PolarHBondContact NZ-O 2.85Å; K498-F528 HydrophobicContact CD-CE1 4.25Å; K498-E536 WeakPolarHBondContact CE-OE2 3.41Å; K498-E536 VanDerWaalsContact NZ-CD 3.35Å; K498-E536 IonicContact NZ-OE1 2.69Å; K498-E536 PolarHBondContact NZ-OE1 3.33Å; K498-E536 IonicContact NZ-OE2 2.66Å; K498-E536 PolarHBondContact NZ-OE2 3.48Å
499	V	96.1	Very high	96.6	Very high	15 Å²	15	50.5 Å²	50.5	9%	0.091	24%	0.24	C	C	.	.	H	α-helix	trans	-74.5	-40.8	179.1	-175.9	0	0	0	0	110	P496 P497 L502 M503 M527 F528	P496-V499 HydrophobicContact CB-CG2 4.2Å; P496-V499 HydrophobicContact CG-CG2 4.31Å; P496-V499 WeakPolarHBondContact O-CB 3.42Å; P496-V499 PolarHBondContact O-N 2.6Å; P497-V499 VanDerWaalsContact C-N 3.26Å; P497-V499 PolarHBondContact O-N 3.2Å; V499-L502 WeakPolarHBondContact O-CB 3.21Å; V499-L502 PolarHBondContact O-N 3.08Å; V499-M503 HydrophobicContact CG1-CE 4.12Å; V499-M503 WeakPolarHBondContact O-CG 3.34Å; V499-M503 PolarHBondContact O-N 3.35Å; V499-M527 HydrophobicContact CB-SD 4.46Å; V499-M527 HydrophobicContact CG2-SD 3.56Å; V499-M527 VanDerWaalsContact CG2-SD 3.56Å; V499-F528 HydrophobicContact CG2-CE2 4.45Å; V499-F528 HydrophobicContact CG2-CZ 4.15Å
500	Y	98	Very high	96.5	Very high	27 Å²	27	52 Å²	52	11%	0.106	25%	0.25	C	S	.	.	H	α-helix	trans	-69.2	-36.8	175.8	-179.4	-115.7	0	0	0	112.7	M489 Q491 P496 P497 L502 M503 R504 W507	M489-Y500 WeakPolarHBondContact O-CE2 3.17Å; M489-Y500 PolarHBondContact O-OH 2.85Å; Q491-Y500 HydrophobicContact CB-CD1 3.77Å; Q491-Y500 HydrophobicContact CB-CD2 3.97Å; Q491-Y500 HydrophobicContact CB-CE1 3.95Å; Q491-Y500 HydrophobicContact CB-CE2 4.13Å; Q491-Y500 HydrophobicContact CB-CG 3.78Å; Q491-Y500 HydrophobicContact CG-CD1 4.05Å; Q491-Y500 HydrophobicContact CG-CD2 4.33Å; Q491-Y500 HydrophobicContact CG-CG 3.84Å; P496-Y500 PolarHBondContact O-N 3.31Å; P497-Y500 CarbonylContact O-C 3.58Å; P497-Y500 PolarHBondContact O-N 2.8Å; P497-Y500 VanDerWaalsContact O-N 3.1Å; Y500-L502 VanDerWaalsContact C-N 3.27Å; Y500-L502 PolarHBondContact O-N 2.85Å; Y500-M503 HydrophobicContact CD2-SD 4.05Å; Y500-M503 WeakPolarHBondContact O-CB 3.46Å; Y500-M503 PolarHBondContact O-N 3.27Å; Y500-M503 VanDerWaalsContact O-N 3.17Å; Y500-R504 HydrophobicContact CD1-CG 4.23Å; Y500-R504 HydrophobicContact CD2-CG 4.41Å; Y500-R504 HydrophobicContact CE1-CG 3.86Å; Y500-R504 HydrophobicContact CE2-CG 4.07Å; Y500-R504 HydrophobicContact CG-CG 4.49Å; Y500-R504 WeakPolarHBondContact O-CB 3.48Å; Y500-R504 VanDerWaalsContact O-CG 3.27Å; Y500-R504 WeakPolarHBondContact O-CG 3.39Å; Y500-R504 PolarHBondContact O-N 2.64Å; Y500-R504 PolarHBondContact OH-NH1 3.33Å; Y500-W507 HydrophobicContact CE2-CZ3 4.27Å
501	E	98	Very high	96.5	Very high	134 Å²	134	46.8 Å²	46.8	63%	0.626	23%	0.229	S	C	*	.	H	α-helix	trans	-58.1	-40.3	170.4	-75.5	176.2	175.2	0	0	111.5	P497 R504 A505	P497-E501 WeakPolarHBondContact O-CG 3.39Å; P497-E501 PolarHBondContact O-N 2.89Å; E501-R504 CarbonylContact O-C 3.57Å; E501-R504 PolarHBondContact O-N 3.1Å; E501-A505 PolarHBondContact O-N 2.99Å
502	L	98.2	Very high	96.4	Very high	19 Å²	19	50.3 Å²	50.3	10%	0.099	25%	0.25	C	S	.	.	H	α-helix	trans	-66	-40	174	-172.2	59.1	0	0	0	112.5	L460 K498 V499 Y500 R504 A505 C506 I520 A523 F524 M527	L460-L502 HydrophobicContact CD1-CG 4.48Å; K498-L502 PolarHBondContact O-N 2.72Å; V499-L502 WeakPolarHBondContact O-CB 3.21Å; V499-L502 PolarHBondContact O-N 3.08Å; Y500-L502 VanDerWaalsContact C-N 3.27Å; Y500-L502 PolarHBondContact O-N 2.85Å; L502-R504 VanDerWaalsContact C-N 3.31Å; L502-R504 PolarHBondContact O-N 2.83Å; L502-A505 PolarHBondContact O-N 2.82Å; L502-C506 PolarHBondContact O-N 3.48Å; L502-C506 PolarHBondContact O-SG 3.29Å; L502-I520 HydrophobicContact CD1-CG1 4.23Å; L502-I520 HydrophobicContact CD2-CG2 4.46Å; L502-A523 HydrophobicContact CD1-CB 4.48Å; L502-A523 HydrophobicContact CD2-CB 4.4Å; L502-F524 HydrophobicContact CD2-CD1 4.33Å; L502-F524 HydrophobicContact CD2-CD2 4.29Å; L502-F524 HydrophobicContact CD2-CE1 3.8Å; L502-F524 HydrophobicContact CD2-CE2 3.74Å; L502-F524 HydrophobicContact CD2-CZ 3.46Å; L502-F524 VanDerWaalsContact CD2-CZ 3.46Å; L502-M527 HydrophobicContact CB-CE 4.43Å; L502-M527 HydrophobicContact CD2-CE 3.91Å
503	M	98.6	Very high	96.5	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-58.9	-43.7	169.9	-59.2	179.6	-163.3	0	0	111.2	L460 W461 A464 V499 Y500 A505 C506 W507	L460-M503 HydrophobicContact CB-CE 4.09Å; L460-M503 HydrophobicContact CB-CG 3.9Å; L460-M503 HydrophobicContact CD1-CG 4.19Å; W461-M503 HydrophobicContact CB-SD 3.95Å; W461-M503 HydrophobicContact CG-SD 4.43Å; A464-M503 HydrophobicContact CB-CE 3.85Å; V499-M503 HydrophobicContact CG1-CE 4.12Å; V499-M503 WeakPolarHBondContact O-CG 3.34Å; V499-M503 PolarHBondContact O-N 3.35Å; Y500-M503 HydrophobicContact CD2-SD 4.05Å; Y500-M503 WeakPolarHBondContact O-CB 3.46Å; Y500-M503 PolarHBondContact O-N 3.27Å; Y500-M503 VanDerWaalsContact O-N 3.17Å; M503-A505 PolarHBondContact O-N 3.17Å; M503-C506 WeakPolarHBondContact O-CB 3.4Å; M503-C506 PolarHBondContact O-N 2.79Å; M503-W507 HydrophobicContact CB-CE3 4.28Å; M503-W507 HydrophobicContact CB-CH2 3.83Å; M503-W507 HydrophobicContact CB-CZ2 4.13Å; M503-W507 HydrophobicContact CB-CZ3 3.92Å; M503-W507 HydrophobicContact CG-CH2 4.43Å; M503-W507 VanDerWaalsContact O-CD2 3.31Å; M503-W507 PolarHBondContact O-N 3.16Å; M503-W507 HydrophobicContact SD-CH2 4.02Å
504	R	98.5	Very high	96.8	Very high	109 Å²	109	47.5 Å²	47.5	41%	0.411	24%	0.239	S	C	.	.	H	α-helix	trans	-68.3	-32	-179.7	-69.2	-70.6	-67.2	-92.8	-5.6	112.8	Y500 E501 L502 W507 Q508	Y500-R504 HydrophobicContact CD1-CG 4.23Å; Y500-R504 HydrophobicContact CD2-CG 4.41Å; Y500-R504 HydrophobicContact CE1-CG 3.86Å; Y500-R504 HydrophobicContact CE2-CG 4.07Å; Y500-R504 HydrophobicContact CG-CG 4.49Å; Y500-R504 WeakPolarHBondContact O-CB 3.48Å; Y500-R504 VanDerWaalsContact O-CG 3.27Å; Y500-R504 WeakPolarHBondContact O-CG 3.39Å; Y500-R504 PolarHBondContact O-N 2.64Å; Y500-R504 PolarHBondContact OH-NH1 3.33Å; E501-R504 CarbonylContact O-C 3.57Å; E501-R504 PolarHBondContact O-N 3.1Å; L502-R504 VanDerWaalsContact C-N 3.31Å; L502-R504 PolarHBondContact O-N 2.83Å; R504-W507 PolarHBondContact O-N 3.04Å; R504-Q508 PolarHBondContact O-N 3.43Å
505	A	98.6	Very high	97.2	Very high	32 Å²	32	48.2 Å²	48.2	26%	0.264	24%	0.242	S	C	.	.	H	α-helix	trans	-68.1	-40.6	169.3	0	0	0	0	0	111.8	E501 L502 M503 W507 Q508 P515	E501-A505 PolarHBondContact O-N 2.99Å; L502-A505 PolarHBondContact O-N 2.82Å; M503-A505 PolarHBondContact O-N 3.17Å; A505-W507 VanDerWaalsContact C-N 3.27Å; A505-W507 PolarHBondContact O-N 3.04Å; A505-Q508 WeakPolarHBondContact O-CG 3.37Å; A505-Q508 PolarHBondContact O-N 2.92Å; A505-P515 HydrophobicContact CB-CG 4.26Å; A505-P515 WeakPolarHBondContact O-CD 3.39Å
506	C	98.8	Very high	97.4	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.4	-32.5	173.5	-65.1	0	0	0	0	112.6	V453 L502 M503 R514	V453-C506 HydrophobicContact CG1-CB 4.04Å; V453-C506 WeakPolarHBondContact O-CB 3.48Å; L502-C506 PolarHBondContact O-N 3.48Å; L502-C506 PolarHBondContact O-SG 3.29Å; M503-C506 WeakPolarHBondContact O-CB 3.4Å; M503-C506 PolarHBondContact O-N 2.79Å; C506-R514 VanDerWaalsContact O-CD 3.3Å; C506-R514 WeakPolarHBondContact O-CD 3.43Å; C506-R514 WeakPolarHBondContact O-CG 3.37Å
507	W	98.6	Very high	97.5	Very high	1 Å²	1	48.7 Å²	48.7	0%	0.004	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	24.3	178.3	-53	-38.3	0	0	0	115.2	W454 G457 V458 W461 R488 M489 Y500 M503 R504 A505	W454-W507 AromaticContact CD2-CD1 3.93Å; W454-W507 HydrophobicContact CE3-CB 4.13Å; W454-W507 HydrophobicContact CH2-CB 4.11Å; W454-W507 HydrophobicContact CZ3-CB 3.89Å; W454-W507 VanDerWaalsContact CZ3-O 3.27Å; W454-W507 WeakPolarHBondContact CZ3-O 3.38Å; W454-W507 PolarHBondContact O-NE1 3.28Å; G457-W507 VanDerWaalsContact C-NE1 3.27Å; G457-W507 WeakPolarHBondContact O-CZ2 3.42Å; V458-W507 HydrophobicContact CG2-CZ2 4.44Å; W461-W507 HydrophobicContact CB-CH2 4.17Å; W461-W507 HydrophobicContact CB-CZ2 4.14Å; W461-W507 HydrophobicContact CG-CH2 4.33Å; R488-W507 HydrophobicContact CB-CE3 4.06Å; R488-W507 HydrophobicContact CB-CZ3 4.44Å; R488-W507 HydrophobicContact CG-CE3 4.37Å; R488-W507 VanDerWaalsContact CZ-O 3.31Å; R488-W507 PolarHBondContact NE-O 2.9Å; R488-W507 PolarHBondContact NH2-O 3.05Å; M489-W507 HydrophobicContact CB-CH2 4.13Å; M489-W507 HydrophobicContact CB-CZ3 4.31Å; M489-W507 HydrophobicContact CE-CH2 3.52Å; M489-W507 HydrophobicContact CE-CZ2 3.36Å; Y500-W507 HydrophobicContact CE2-CZ3 4.27Å; M503-W507 HydrophobicContact CB-CE3 4.28Å; M503-W507 HydrophobicContact CB-CH2 3.83Å; M503-W507 HydrophobicContact CB-CZ2 4.13Å; M503-W507 HydrophobicContact CB-CZ3 3.92Å; M503-W507 HydrophobicContact CG-CH2 4.43Å; M503-W507 VanDerWaalsContact O-CD2 3.31Å; M503-W507 PolarHBondContact O-N 3.16Å; M503-W507 HydrophobicContact SD-CH2 4.02Å; R504-W507 PolarHBondContact O-N 3.04Å; A505-W507 VanDerWaalsContact C-N 3.27Å; A505-W507 PolarHBondContact O-N 3.04Å
508	Q	98.6	Very high	97.6	Very high	87 Å²	87	48.2 Å²	48.2	41%	0.407	25%	0.245	S	C	.	.			trans	-60.9	143	169	-69.4	-63.5	-5.5	0	0	110.9	R504 A505 D513 R514	R504-Q508 PolarHBondContact O-N 3.43Å; A505-Q508 WeakPolarHBondContact O-CG 3.37Å; A505-Q508 PolarHBondContact O-N 2.92Å; Q508-D513 HydrophobicContact CB-CB 3.95Å; Q508-D513 HydrophobicContact CG-CB 4.27Å; Q508-R514 HydrophobicContact CB-CG 3.93Å; Q508-R514 PolarHBondContact O-NE 3.49Å; Q508-R514 PolarHBondContact O-NH2 3.3Å
509	W	97.5	Very high	97.7	Very high	103 Å²	103	50.2 Å²	50.2	39%	0.39	26%	0.256	S	S	.	.	S	Bend	trans	-65.4	-54.1	-174.7	180	-98.8	0	0	0	111.2	P439 Y480 L483 E484 R514	P439-W509 HydrophobicContact CB-CD2 4.48Å; P439-W509 HydrophobicContact CB-CE3 3.89Å; P439-W509 HydrophobicContact CB-CH2 3.77Å; P439-W509 HydrophobicContact CB-CZ2 4.36Å; P439-W509 HydrophobicContact CB-CZ3 3.49Å; P439-W509 VanDerWaalsContact CB-CZ3 3.49Å; P439-W509 HydrophobicContact CG-CE3 3.77Å; P439-W509 HydrophobicContact CG-CH2 4.46Å; P439-W509 HydrophobicContact CG-CZ3 3.69Å; Y480-W509 AromaticContact CE2-CH2 3.98Å; Y480-W509 HydrophobicContact CE2-CH2 3.98Å; Y480-W509 AromaticContact CZ-CH2 3.84Å; L483-W509 HydrophobicContact CB-CZ3 4.16Å; E484-W509 VanDerWaalsContact CA-CZ3 3.47Å; E484-W509 HydrophobicContact CB-CH2 3.64Å; E484-W509 HydrophobicContact CB-CZ2 4.4Å; E484-W509 HydrophobicContact CB-CZ3 4.01Å; E484-W509 HydrophobicContact CG-CH2 3.84Å; E484-W509 HydrophobicContact CG-CZ2 4.11Å; W509-R514 PolarHBondContact O-NH2 2.8Å
510	S	97.1	Very high	97.8	Very high	33 Å²	33	49.5 Å²	49.5	23%	0.231	25%	0.252	C	S	.	.	S	Bend	trans	-61.4	128.5	169.2	168	0	0	0	0	110.5	L512 D513	S510-L512 PolarHBondContact O-N 3.12Å; S510-L512 PolarHBondContact OG-N 3.02Å; S510-D513 WeakPolarHBondContact CB-OD1 3.47Å; S510-D513 VanDerWaalsContact CB-OD2 3.25Å; S510-D513 WeakPolarHBondContact CB-OD2 3.27Å; S510-D513 PolarHBondContact O-N 2.88Å; S510-D513 VanDerWaalsContact OG-CG 3.27Å; S510-D513 PolarHBondContact OG-N 2.79Å; S510-D513 PolarHBondContact OG-OD1 2.63Å
511	P	96.6	Very high	97.6	Very high	40 Å²	40	49.7 Å²	49.7	26%	0.26	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-63.2	-25.4	173.1	-22.9	34.3	0	0	0	113.6	E440 K450	E440-P511 HydrophobicContact CB-CG 4.48Å; E440-P511 HydrophobicContact CG-CG 3.96Å; K450-P511 HydrophobicContact CB-CB 3.81Å; K450-P511 WeakPolarHBondContact CB-O 2.97Å; K450-P511 WeakPolarHBondContact CD-O 3.39Å; K450-P511 HydrophobicContact CG-CB 4.5Å; K450-P511 VanDerWaalsContact CG-O 3.25Å; K450-P511 WeakPolarHBondContact CG-O 3.38Å
512	L	95.5	Very high	97.3	Very high	152 Å²	152	49 Å²	49	80%	0.796	25%	0.25	S	S	*	.	G	3₁₀ helix	trans	-75.6	-25.5	180	-60.2	177.6	0	0	0	112.6	S510 R514	S510-L512 PolarHBondContact O-N 3.12Å; S510-L512 PolarHBondContact OG-N 3.02Å; L512-R514 VanDerWaalsContact C-N 3.3Å
513	D	97.9	Very high	97	Very high	106 Å²	106	49.5 Å²	49.5	57%	0.567	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-87	-5.6	-176.7	-53.2	6	0	0	0	111.6	Q508 S510	Q508-D513 HydrophobicContact CB-CB 3.95Å; Q508-D513 HydrophobicContact CG-CB 4.27Å; S510-D513 WeakPolarHBondContact CB-OD1 3.47Å; S510-D513 VanDerWaalsContact CB-OD2 3.25Å; S510-D513 WeakPolarHBondContact CB-OD2 3.27Å; S510-D513 PolarHBondContact O-N 2.88Å; S510-D513 VanDerWaalsContact OG-CG 3.27Å; S510-D513 PolarHBondContact OG-N 2.79Å; S510-D513 PolarHBondContact OG-OD1 2.63Å
514	R	98.5	Very high	96.6	Very high	4 Å²	4	49.7 Å²	49.7	2%	0.015	26%	0.258	C	S	.	.	S	Bend	trans	-81.8	143.9	173.9	-57.3	172.6	-162.9	155	11.3	109.7	E440 K450 V453 C506 Q508 W509 L512	E440-R514 IonicContact OE1-CZ 2.76Å; E440-R514 IonicContact OE1-NH1 3.68Å; E440-R514 PolarHBondContact OE1-NH1 2.6Å; E440-R514 IonicContact OE1-NH2 3.75Å; E440-R514 IonicContact OE2-CZ 2.67Å; E440-R514 IonicContact OE2-NH1 2.76Å; E440-R514 PolarHBondContact OE2-NH1 2.9Å; E440-R514 IonicContact OE2-NH2 3.68Å; E440-R514 PolarHBondContact OE2-NH2 2.81Å; K450-R514 HydrophobicContact CD-CB 4.36Å; K450-R514 PolarHBondContact NZ-O 2.8Å; K450-R514 WeakPolarHBondContact O-CD 3.29Å; K450-R514 PolarHBondContact O-NH1 2.87Å; V453-R514 HydrophobicContact CG1-CB 3.95Å; C506-R514 VanDerWaalsContact O-CD 3.3Å; C506-R514 WeakPolarHBondContact O-CD 3.43Å; C506-R514 WeakPolarHBondContact O-CG 3.37Å; Q508-R514 HydrophobicContact CB-CG 3.93Å; Q508-R514 PolarHBondContact O-NE 3.49Å; Q508-R514 PolarHBondContact O-NH2 3.3Å; W509-R514 PolarHBondContact O-NH2 2.8Å; L512-R514 VanDerWaalsContact C-N 3.3Å
515	P	98.3	Very high	95.9	Very high	22 Å²	22	45.6 Å²	45.6	14%	0.143	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-63.1	163.5	175.8	27	-34.2	0	0	0	112.5	K450 V453 A505 E519 I520	K450-P515 PolarHBondContact NZ-O 3.36Å; V453-P515 HydrophobicContact CG1-CG 4.5Å; A505-P515 HydrophobicContact CB-CG 4.26Å; A505-P515 WeakPolarHBondContact O-CD 3.39Å; P515-E519 HydrophobicContact CB-CB 4.11Å; P515-I520 HydrophobicContact CB-CG1 4.1Å; P515-I520 HydrophobicContact CG-CD1 4.07Å; P515-I520 HydrophobicContact CG-CG1 3.8Å
516	S	98.1	Very high	95.3	Very high	22 Å²	22	47.1 Å²	47.1	15%	0.154	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-77.7	162.9	164.6	58.8	0	0	0	0	111	E386 A518 E519 I520	E386-S516 WeakPolarHBondContact OE1-CA 3.32Å; E386-S516 WeakPolarHBondContact OE1-CB 3.37Å; S516-A518 PolarHBondContact O-N 3.09Å; S516-E519 VanDerWaalsContact CB-OE2 3.31Å; S516-E519 WeakPolarHBondContact CB-OE2 3.42Å; S516-E519 PolarHBondContact N-OE2 3.48Å; S516-E519 PolarHBondContact O-N 3.19Å; S516-E519 WeakPolarHBondContact OG-CB 3.38Å; S516-E519 VanDerWaalsContact OG-CD 3.25Å; S516-E519 VanDerWaalsContact OG-CG 3.25Å; S516-E519 WeakPolarHBondContact OG-CG 3.21Å; S516-E519 PolarHBondContact OG-N 3.11Å; S516-E519 VanDerWaalsContact OG-N 3.16Å; S516-E519 PolarHBondContact OG-OE2 3.09Å; S516-I520 VanDerWaalsContact O-CG1 3.27Å; S516-I520 WeakPolarHBondContact O-CG1 3.17Å; S516-I520 PolarHBondContact O-N 2.89Å
517	F	98.1	Very high	94.7	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-67	-28.6	172.8	-79.5	-70.2	0	0	0	112.6	M382 E383 E386 L395 I449 D452 V453 F456 I520 H521	M382-F517 HydrophobicContact CB-CB 4.29Å; M382-F517 HydrophobicContact CB-CD1 3.34Å; M382-F517 HydrophobicContact CB-CD2 3.82Å; M382-F517 HydrophobicContact CB-CE1 3.39Å; M382-F517 HydrophobicContact CB-CE2 3.86Å; M382-F517 HydrophobicContact CB-CG 3.55Å; M382-F517 HydrophobicContact CB-CZ 3.65Å; M382-F517 HydrophobicContact CE-CD2 4.49Å; M382-F517 HydrophobicContact CE-CE2 3.74Å; M382-F517 HydrophobicContact CE-CZ 3.83Å; M382-F517 HydrophobicContact CG-CD1 4.24Å; M382-F517 HydrophobicContact CG-CE1 3.8Å; M382-F517 HydrophobicContact CG-CE2 4.45Å; M382-F517 HydrophobicContact CG-CZ 3.91Å; E383-F517 HydrophobicContact CB-CB 4.06Å; E386-F517 HydrophobicContact CB-CB 4.42Å; E386-F517 HydrophobicContact CB-CD2 4.49Å; E386-F517 VanDerWaalsContact CD-N 3.33Å; E386-F517 PolarHBondContact OE1-N 3.37Å; E386-F517 VanDerWaalsContact OE1-N 3.07Å; E386-F517 WeakPolarHBondContact OE2-CA 3.41Å; E386-F517 WeakPolarHBondContact OE2-CB 3.45Å; E386-F517 PolarHBondContact OE2-N 2.82Å; L395-F517 HydrophobicContact CD2-CZ 4.34Å; I449-F517 HydrophobicContact CD1-CD2 3.73Å; I449-F517 HydrophobicContact CD1-CE2 3.71Å; I449-F517 HydrophobicContact CG1-CD2 3.75Å; I449-F517 HydrophobicContact CG1-CE2 3.94Å; D452-F517 HydrophobicContact CB-CE2 4.03Å; D452-F517 HydrophobicContact CB-CZ 4.22Å; V453-F517 HydrophobicContact CB-CE2 4.4Å; V453-F517 HydrophobicContact CB-CZ 4.34Å; V453-F517 HydrophobicContact CG2-CD1 4.45Å; V453-F517 HydrophobicContact CG2-CD2 3.73Å; V453-F517 HydrophobicContact CG2-CE1 4.21Å; V453-F517 HydrophobicContact CG2-CE2 3.45Å; V453-F517 VanDerWaalsContact CG2-CE2 3.45Å; V453-F517 HydrophobicContact CG2-CG 4.24Å; V453-F517 HydrophobicContact CG2-CZ 3.73Å; F456-F517 HydrophobicContact CB-CE1 3.67Å; F456-F517 HydrophobicContact CB-CZ 3.93Å; F456-F517 HydrophobicContact CD1-CE1 4.13Å; F456-F517 HydrophobicContact CD2-CE1 4.11Å; F456-F517 AromaticContact CG-CE1 3.7Å; F456-F517 HydrophobicContact CG-CE1 3.7Å; F456-F517 HydrophobicContact CG-CZ 4.44Å; F517-I520 HydrophobicContact CD1-CD1 3.88Å; F517-I520 HydrophobicContact CE1-CD1 4.17Å; F517-I520 PolarHBondContact O-N 3.08Å; F517-H521 WeakPolarHBondContact O-CB 3.27Å; F517-H521 PolarHBondContact O-N 2.66Å
518	A	95.6	Very high	93.9	Very high	32 Å²	32	48.8 Å²	48.8	26%	0.264	26%	0.257	S	S	.	.	H	α-helix	trans	-59.7	-47.1	169.6	0	0	0	0	0	112.3	E383 E386 S516 Q522	E383-A518 HydrophobicContact CG-CB 3.97Å; E383-A518 WeakPolarHBondContact OE1-CA 3.39Å; E383-A518 VanDerWaalsContact OE1-CB 3.31Å; E383-A518 WeakPolarHBondContact OE1-CB 3.24Å; E386-A518 PolarHBondContact OE2-N 2.8Å; E386-A518 VanDerWaalsContact OE2-N 3.08Å; S516-A518 PolarHBondContact O-N 3.09Å; A518-Q522 VanDerWaalsContact O-CB 3.26Å; A518-Q522 WeakPolarHBondContact O-CB 3.33Å; A518-Q522 PolarHBondContact O-N 2.91Å
519	E	97	Very high	92.7	Very high	117 Å²	117	47.4 Å²	47.4	55%	0.547	25%	0.251	S	S	.	.	H	α-helix	trans	-65.9	-37.9	176.3	-71.8	160.5	130.7	0	0	112.1	P515 S516 A523	P515-E519 HydrophobicContact CB-CB 4.11Å; S516-E519 VanDerWaalsContact CB-OE2 3.31Å; S516-E519 WeakPolarHBondContact CB-OE2 3.42Å; S516-E519 PolarHBondContact N-OE2 3.48Å; S516-E519 PolarHBondContact O-N 3.19Å; S516-E519 WeakPolarHBondContact OG-CB 3.38Å; S516-E519 VanDerWaalsContact OG-CD 3.25Å; S516-E519 VanDerWaalsContact OG-CG 3.25Å; S516-E519 WeakPolarHBondContact OG-CG 3.21Å; S516-E519 PolarHBondContact OG-N 3.11Å; S516-E519 VanDerWaalsContact OG-N 3.16Å; S516-E519 PolarHBondContact OG-OE2 3.09Å; E519-A523 VanDerWaalsContact O-CB 3.27Å; E519-A523 WeakPolarHBondContact O-CB 3.35Å; E519-A523 PolarHBondContact O-N 2.98Å
520	I	97.8	Very high	91.5	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-63.5	-49.4	175.9	-69.2	165.4	0	0	0	111.4	V453 F456 L502 P515 S516 F517 A523 F524	V453-I520 HydrophobicContact CG1-CD1 3.92Å; V453-I520 HydrophobicContact CG2-CD1 4.11Å; F456-I520 HydrophobicContact CD1-CD1 4.23Å; F456-I520 HydrophobicContact CD1-CG2 4.04Å; F456-I520 HydrophobicContact CE1-CG2 3.38Å; F456-I520 HydrophobicContact CZ-CG2 4.06Å; L502-I520 HydrophobicContact CD1-CG1 4.23Å; L502-I520 HydrophobicContact CD2-CG2 4.46Å; P515-I520 HydrophobicContact CB-CG1 4.1Å; P515-I520 HydrophobicContact CG-CD1 4.07Å; P515-I520 HydrophobicContact CG-CG1 3.8Å; S516-I520 VanDerWaalsContact O-CG1 3.27Å; S516-I520 WeakPolarHBondContact O-CG1 3.17Å; S516-I520 PolarHBondContact O-N 2.89Å; F517-I520 HydrophobicContact CD1-CD1 3.88Å; F517-I520 HydrophobicContact CE1-CD1 4.17Å; F517-I520 PolarHBondContact O-N 3.08Å; I520-A523 WeakPolarHBondContact O-CB 3.37Å; I520-A523 PolarHBondContact O-N 2.8Å; I520-F524 HydrophobicContact CG2-CD2 4.06Å; I520-F524 HydrophobicContact CG2-CE2 3.68Å; I520-F524 VanDerWaalsContact O-CD2 3.28Å; I520-F524 WeakPolarHBondContact O-CD2 3.47Å; I520-F524 PolarHBondContact O-N 2.84Å; I520-F524 VanDerWaalsContact O-N 3.12Å
521	H	94.5	Very high	90.7	Very high	30 Å²	30	50.1 Å²	50.1	14%	0.139	27%	0.273	C	S	.	.	H	α-helix	trans	-63.9	-42.8	179.4	-174.7	-1.4	0	0	0	111	S380 E383 F517 A523 F524 E525	S380-H521 VanDerWaalsContact CA-CD2 3.49Å; S380-H521 WeakPolarHBondContact CA-CD2 3.28Å; S380-H521 VanDerWaalsContact CB-NE2 3.33Å; S380-H521 WeakPolarHBondContact CB-NE2 3.49Å; S380-H521 PolarHBondContact OG-CD2 3.19Å; S380-H521 PolarHBondContact OG-NE2 2.83Å; E383-H521 IonicContact OE2-CD2 3.19Å; F517-H521 WeakPolarHBondContact O-CB 3.27Å; F517-H521 PolarHBondContact O-N 2.66Å; H521-A523 VanDerWaalsContact C-N 3.31Å; H521-A523 PolarHBondContact O-N 2.68Å; H521-F524 PolarHBondContact O-N 2.96Å; H521-E525 IonicContact CE1-OE1 3.58Å; H521-E525 PolarHBondContact O-N 3.22Å
522	Q	91	Very high	89.9	Confident	120 Å²	120	49.5 Å²	49.5	56%	0.561	27%	0.269	S	S	*	.	H	α-helix	trans	-65	-34.1	177.1	-174.9	60.9	92.6	0	0	112.4	A518 T526	A518-Q522 VanDerWaalsContact O-CB 3.26Å; A518-Q522 WeakPolarHBondContact O-CB 3.33Å; A518-Q522 PolarHBondContact O-N 2.91Å; Q522-T526 WeakPolarHBondContact O-CG2 3.48Å; Q522-T526 PolarHBondContact O-N 3.37Å; Q522-T526 PolarHBondContact O-OG1 3.42Å
523	A	92.9	Very high	89.5	Confident	29 Å²	29	42.8 Å²	42.8	24%	0.24	23%	0.234	C	C	.	.	H	α-helix	trans	-63.7	-46.9	173.4	0	0	0	0	0	111.4	L502 E519 I520 H521 E525 T526 M527	L502-A523 HydrophobicContact CD1-CB 4.48Å; L502-A523 HydrophobicContact CD2-CB 4.4Å; E519-A523 VanDerWaalsContact O-CB 3.27Å; E519-A523 WeakPolarHBondContact O-CB 3.35Å; E519-A523 PolarHBondContact O-N 2.98Å; I520-A523 WeakPolarHBondContact O-CB 3.37Å; I520-A523 PolarHBondContact O-N 2.8Å; H521-A523 VanDerWaalsContact C-N 3.31Å; H521-A523 PolarHBondContact O-N 2.68Å; A523-E525 PolarHBondContact O-N 2.83Å; A523-T526 PolarHBondContact O-N 3.47Å; A523-T526 VanDerWaalsContact O-N 3.14Å; A523-T526 PolarHBondContact O-OG1 3.32Å; A523-M527 WeakPolarHBondContact O-CB 3.41Å; A523-M527 PolarHBondContact O-N 2.77Å
524	F	89.6	Confident	88.9	Confident	4 Å²	4	40.3 Å²	40.3	2%	0.018	23%	0.225	C	C	.	.	H	α-helix	trans	-58.8	-43	179.7	-78.9	-58.7	0	0	0	113.6	L372 A375 T376 F456 L460 L502 I520 H521 T526 M527	L372-F524 HydrophobicContact CD1-CD1 3.52Å; L372-F524 HydrophobicContact CD1-CE1 4.12Å; L372-F524 HydrophobicContact CD1-CG 4.36Å; A375-F524 HydrophobicContact CB-CZ 4.33Å; T376-F524 HydrophobicContact CG2-CB 4.42Å; F456-F524 AromaticContact CE1-CE2 3.87Å; F456-F524 HydrophobicContact CE1-CE2 3.87Å; F456-F524 HydrophobicContact CE1-CZ 4.35Å; F456-F524 AromaticContact CZ-CE2 3.8Å; F456-F524 HydrophobicContact CZ-CE2 3.8Å; F456-F524 HydrophobicContact CZ-CZ 4.36Å; L460-F524 HydrophobicContact CD1-CZ 3.83Å; L460-F524 HydrophobicContact CD2-CE2 4.28Å; L460-F524 HydrophobicContact CD2-CZ 3.6Å; L460-F524 HydrophobicContact CG-CZ 4.36Å; L502-F524 HydrophobicContact CD2-CD1 4.33Å; L502-F524 HydrophobicContact CD2-CD2 4.29Å; L502-F524 HydrophobicContact CD2-CE1 3.8Å; L502-F524 HydrophobicContact CD2-CE2 3.74Å; L502-F524 HydrophobicContact CD2-CZ 3.46Å; L502-F524 VanDerWaalsContact CD2-CZ 3.46Å; I520-F524 HydrophobicContact CG2-CD2 4.06Å; I520-F524 HydrophobicContact CG2-CE2 3.68Å; I520-F524 VanDerWaalsContact O-CD2 3.28Å; I520-F524 WeakPolarHBondContact O-CD2 3.47Å; I520-F524 PolarHBondContact O-N 2.84Å; I520-F524 VanDerWaalsContact O-N 3.12Å; H521-F524 PolarHBondContact O-N 2.96Å; F524-T526 VanDerWaalsContact C-N 3.26Å; F524-T526 PolarHBondContact O-N 3.1Å; F524-M527 HydrophobicContact CD1-CE 4.33Å; F524-M527 HydrophobicContact CE1-CE 4.46Å
525	E	84.1	Confident	88.4	Confident	23 Å²	23	43.5 Å²	43.5	11%	0.107	24%	0.24	C	C	.	.	H	α-helix	trans	-72.3	-19.8	-179.8	-59.6	-67.1	-156.9	0	0	113.1	S164 S166 T376 H521 A523 H529	S164-E525 WeakPolarHBondContact CB-OE1 3.43Å; S164-E525 VanDerWaalsContact CB-OE2 3.24Å; S164-E525 WeakPolarHBondContact CB-OE2 3.42Å; S164-E525 VanDerWaalsContact OG-CD 3.25Å; S164-E525 PolarHBondContact OG-OE1 2.8Å; S164-E525 PolarHBondContact OG-OE2 2.97Å; S164-E525 VanDerWaalsContact OG-OE2 3.13Å; S166-E525 WeakPolarHBondContact CB-OE2 3.27Å; S166-E525 PolarHBondContact OG-OE2 2.61Å; T376-E525 HydrophobicContact CG2-CG 4.38Å; T376-E525 WeakPolarHBondContact CG2-OE1 3.36Å; H521-E525 IonicContact CE1-OE1 3.58Å; H521-E525 PolarHBondContact O-N 3.22Å; A523-E525 PolarHBondContact O-N 2.83Å; E525-H529 PolarHBondContact O-CE1 3.18Å; E525-H529 PolarHBondContact O-ND1 2.94Å
526	T	85.8	Confident	87.9	Confident	64 Å²	64	44 Å²	44	39%	0.393	24%	0.24	S	C	.	.	H	α-helix	trans	-100.7	-17.5	180	54.1	0	0	0	0	114.7	Q522 A523 F524 F528 H529	Q522-T526 WeakPolarHBondContact O-CG2 3.48Å; Q522-T526 PolarHBondContact O-N 3.37Å; Q522-T526 PolarHBondContact O-OG1 3.42Å; A523-T526 PolarHBondContact O-N 3.47Å; A523-T526 VanDerWaalsContact O-N 3.14Å; A523-T526 PolarHBondContact O-OG1 3.32Å; F524-T526 VanDerWaalsContact C-N 3.26Å; F524-T526 PolarHBondContact O-N 3.1Å; T526-F528 VanDerWaalsContact C-N 3.27Å; T526-F528 PolarHBondContact O-N 3.42Å; T526-F528 VanDerWaalsContact O-N 3.15Å; T526-H529 PolarHBondContact O-N 3.16Å
527	M	85.6	Confident	87.4	Confident	25 Å²	25	44.4 Å²	44.4	12%	0.123	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-30.3	-171	-166.9	174.2	-69	0	0	115	K498 V499 L502 A523 F524	K498-M527 HydrophobicContact CB-CE 4.29Å; K498-M527 HydrophobicContact CB-CG 3.63Å; K498-M527 HydrophobicContact CB-SD 3.61Å; K498-M527 HydrophobicContact CD-CG 3.61Å; K498-M527 WeakPolarHBondContact CD-O 3.49Å; K498-M527 HydrophobicContact CG-CG 4.26Å; K498-M527 PolarHBondContact NZ-O 2.85Å; V499-M527 HydrophobicContact CB-SD 4.46Å; V499-M527 HydrophobicContact CG2-SD 3.56Å; V499-M527 VanDerWaalsContact CG2-SD 3.56Å; L502-M527 HydrophobicContact CB-CE 4.43Å; L502-M527 HydrophobicContact CD2-CE 3.91Å; A523-M527 WeakPolarHBondContact O-CB 3.41Å; A523-M527 PolarHBondContact O-N 2.77Å; F524-M527 HydrophobicContact CD1-CE 4.33Å; F524-M527 HydrophobicContact CE1-CE 4.46Å
528	F	81.4	Confident	86.9	Confident	12 Å²	12	46.8 Å²	46.8	5%	0.053	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128	51.5	-175.2	-55.6	-73.8	0	0	0	111.3	R165 L372 P496 K498 V499 T526 S531 I533 E536	R165-F528 PolarHBondContact NE-O 3.4Å; R165-F528 PolarHBondContact NH2-O 3.09Å; L372-F528 HydrophobicContact CD2-CD2 3.95Å; L372-F528 HydrophobicContact CD2-CE2 4.2Å; P496-F528 HydrophobicContact CB-CE1 4.43Å; P496-F528 HydrophobicContact CB-CZ 4.22Å; P496-F528 HydrophobicContact CG-CZ 4.3Å; K498-F528 HydrophobicContact CD-CE1 4.25Å; V499-F528 HydrophobicContact CG2-CE2 4.45Å; V499-F528 HydrophobicContact CG2-CZ 4.15Å; T526-F528 VanDerWaalsContact C-N 3.27Å; T526-F528 PolarHBondContact O-N 3.42Å; T526-F528 VanDerWaalsContact O-N 3.15Å; F528-S531 VanDerWaalsContact O-O 3.13Å; F528-I533 HydrophobicContact CD1-CB 4.26Å; F528-I533 HydrophobicContact CD2-CB 4.07Å; F528-I533 HydrophobicContact CE1-CB 4.19Å; F528-I533 HydrophobicContact CE1-CG1 4.17Å; F528-I533 HydrophobicContact CE2-CB 3.99Å; F528-I533 HydrophobicContact CE2-CD1 3.78Å; F528-I533 HydrophobicContact CE2-CG1 3.92Å; F528-I533 HydrophobicContact CG-CB 4.2Å; F528-I533 HydrophobicContact CZ-CB 4.06Å; F528-I533 HydrophobicContact CZ-CD1 3.93Å; F528-I533 HydrophobicContact CZ-CG1 3.73Å; F528-E536 HydrophobicContact CE1-CB 4.33Å; F528-E536 HydrophobicContact CE1-CG 4.34Å
529	H	73.9	Confident	86.6	Confident	57 Å²	57	50.3 Å²	50.3	26%	0.264	27%	0.273	S	S	.	.	S	Bend	trans	-77	-27.6	174.9	-86.1	4	0	0	0	114.1	R165 E525 T526	R165-H529 PolarHBondContact NH1-O 2.93Å; R165-H529 PolarHBondContact NH2-O 3.2Å; E525-H529 PolarHBondContact O-CE1 3.18Å; E525-H529 PolarHBondContact O-ND1 2.94Å; T526-H529 PolarHBondContact O-N 3.16Å
530	D	73.1	Confident	86.3	Confident	167 Å²	167	46.2 Å²	46.2	89%	0.893	25%	0.253	S	S	*	.	S	Bend	trans	-109.6	-15.2	-176.4	-59.7	-51.4	0	0	0	113.8
531	S	78.6	Confident	85.8	Confident	27 Å²	27	49.8 Å²	49.8	19%	0.189	27%	0.272	C	S	.	.	S	Bend	trans	-127.8	175.5	-178.1	52.3	0	0	0	0	110.6	R165 F528 E536	R165-S531 PolarHBondContact NH2-O 3.08Å; R165-S531 VanDerWaalsContact NH2-O 3.12Å; F528-S531 VanDerWaalsContact O-O 3.13Å; S531-E536 WeakPolarHBondContact CB-OE1 3.26Å; S531-E536 PolarHBondContact OG-OE1 3.07Å
532	S	80.6	Confident	85.3	Confident	26 Å²	26	52 Å²	52	18%	0.182	29%	0.29	C	S	.	.			trans	-106.4	146.8	162.5	71.3	0	0	0	0	110.7	S534 E535 E536	S532-S534 PolarHBondContact O-N 2.84Å; S532-E535 WeakPolarHBondContact CB-OE2 3.41Å; S532-E535 PolarHBondContact N-OE2 3.16Å; S532-E535 PolarHBondContact O-N 3.32Å; S532-E535 VanDerWaalsContact O-N 3.08Å; S532-E535 VanDerWaalsContact OG-CD 3.31Å; S532-E535 WeakPolarHBondContact OG-CG 3.48Å; S532-E535 PolarHBondContact OG-OE2 3.46Å; S532-E536 PolarHBondContact O-N 2.9Å
533	I	86.5	Confident	85	Confident	11 Å²	11	50.8 Å²	50.8	6%	0.056	28%	0.283	C	S	.	.	H	α-helix	trans	-59.9	-33.5	179.4	-172.6	172.5	0	0	0	112	A368 V369 L372 P496 F528 E535 E536 V537	A368-I533 HydrophobicContact CB-CD1 4.4Å; A368-I533 HydrophobicContact CB-CG1 4.26Å; A368-I533 HydrophobicContact CB-CG2 4.36Å; V369-I533 HydrophobicContact CB-CG2 4.48Å; V369-I533 HydrophobicContact CG2-CG2 3.87Å; L372-I533 HydrophobicContact CB-CD1 3.95Å; L372-I533 HydrophobicContact CD2-CB 4.39Å; L372-I533 HydrophobicContact CD2-CD1 4.08Å; L372-I533 HydrophobicContact CD2-CG2 4.16Å; L372-I533 HydrophobicContact CG-CD1 4.43Å; P496-I533 HydrophobicContact CG-CD1 4.49Å; P496-I533 HydrophobicContact CG-CG1 4.1Å; F528-I533 HydrophobicContact CD1-CB 4.26Å; F528-I533 HydrophobicContact CD2-CB 4.07Å; F528-I533 HydrophobicContact CE1-CB 4.19Å; F528-I533 HydrophobicContact CE1-CG1 4.17Å; F528-I533 HydrophobicContact CE2-CB 3.99Å; F528-I533 HydrophobicContact CE2-CD1 3.78Å; F528-I533 HydrophobicContact CE2-CG1 3.92Å; F528-I533 HydrophobicContact CG-CB 4.2Å; F528-I533 HydrophobicContact CZ-CB 4.06Å; F528-I533 HydrophobicContact CZ-CD1 3.93Å; F528-I533 HydrophobicContact CZ-CG1 3.73Å; I533-E535 VanDerWaalsContact C-N 3.26Å; I533-E535 PolarHBondContact O-N 3.42Å; I533-E536 PolarHBondContact O-N 2.73Å; I533-V537 HydrophobicContact CG1-CG2 4.16Å; I533-V537 VanDerWaalsContact O-CG2 3.32Å; I533-V537 WeakPolarHBondContact O-CG2 3.37Å; I533-V537 PolarHBondContact O-N 3.49Å
534	S	86.1	Confident	83.8	Confident	55 Å²	55	52 Å²	52	39%	0.385	29%	0.287	S	S	.	.	H	α-helix	trans	-61.3	-32.5	176.6	-57.3	0	0	0	0	113.3	V369 S532 A538	V369-S534 WeakPolarHBondContact CG2-OG 3.48Å; S532-S534 PolarHBondContact O-N 2.84Å; S534-A538 WeakPolarHBondContact O-CB 3.1Å; S534-A538 PolarHBondContact O-N 2.88Å
535	E	87.2	Confident	82.6	Confident	70 Å²	70	54.6 Å²	54.6	33%	0.327	31%	0.31	S	S	.	.	H	α-helix	trans	-76.2	-42	176.8	-72.3	166.2	130.2	0	0	111.2	R201 S532 I533 V537 A538 E539	R201-E535 IonicContact CZ-OE1 3.48Å; R201-E535 IonicContact NH1-OE1 2.91Å; R201-E535 PolarHBondContact NH1-OE1 3.43Å; R201-E535 IonicContact NH2-OE1 2.94Å; R201-E535 PolarHBondContact NH2-OE1 2.83Å; S532-E535 WeakPolarHBondContact CB-OE2 3.41Å; S532-E535 PolarHBondContact N-OE2 3.16Å; S532-E535 PolarHBondContact O-N 3.32Å; S532-E535 VanDerWaalsContact O-N 3.08Å; S532-E535 VanDerWaalsContact OG-CD 3.31Å; S532-E535 WeakPolarHBondContact OG-CG 3.48Å; S532-E535 PolarHBondContact OG-OE2 3.46Å; I533-E535 VanDerWaalsContact C-N 3.26Å; I533-E535 PolarHBondContact O-N 3.42Å; E535-V537 PolarHBondContact O-N 3.16Å; E535-A538 PolarHBondContact O-N 2.7Å; E535-E539 PolarHBondContact O-N 3.33Å
536	E	88.3	Confident	81.4	Confident	33 Å²	33	60 Å²	60	15%	0.154	34%	0.335	C	S	.	.	H	α-helix	trans	-67.5	-35.6	177.1	-65.9	-164.5	-150.3	0	0	112.5	P496 K498 F528 S531 S532 I533 E539 E540	P496-E536 HydrophobicContact CB-CB 4.3Å; P496-E536 HydrophobicContact CG-CB 4.37Å; K498-E536 WeakPolarHBondContact CE-OE2 3.41Å; K498-E536 VanDerWaalsContact NZ-CD 3.35Å; K498-E536 IonicContact NZ-OE1 2.69Å; K498-E536 PolarHBondContact NZ-OE1 3.33Å; K498-E536 IonicContact NZ-OE2 2.66Å; K498-E536 PolarHBondContact NZ-OE2 3.48Å; F528-E536 HydrophobicContact CE1-CB 4.33Å; F528-E536 HydrophobicContact CE1-CG 4.34Å; S531-E536 WeakPolarHBondContact CB-OE1 3.26Å; S531-E536 PolarHBondContact OG-OE1 3.07Å; S532-E536 PolarHBondContact O-N 2.9Å; I533-E536 PolarHBondContact O-N 2.73Å; E536-E539 PolarHBondContact O-N 3.05Å; E536-E540 WeakPolarHBondContact O-CG 3.47Å; E536-E540 PolarHBondContact O-N 3.31Å
537	V	88.6	Confident	79.7	Confident	30 Å²	30	61 Å²	61	18%	0.182	34%	0.344	C	S	.	.	H	α-helix	trans	-63.7	-41.9	171.1	170.3	0	0	0	0	111.5	A368 G494 P496 I533 E535 E539 E540 L541	A368-V537 HydrophobicContact CB-CB 4.46Å; A368-V537 HydrophobicContact CB-CG2 3.76Å; G494-V537 WeakPolarHBondContact O-CG2 3.48Å; P496-V537 HydrophobicContact CG-CG2 3.71Å; I533-V537 HydrophobicContact CG1-CG2 4.16Å; I533-V537 VanDerWaalsContact O-CG2 3.32Å; I533-V537 WeakPolarHBondContact O-CG2 3.37Å; I533-V537 PolarHBondContact O-N 3.49Å; E535-V537 PolarHBondContact O-N 3.16Å; V537-E539 VanDerWaalsContact C-N 3.34Å; V537-E539 PolarHBondContact O-N 2.71Å; V537-E540 PolarHBondContact O-N 3.12Å; V537-L541 HydrophobicContact CG1-CD1 4Å; V537-L541 WeakPolarHBondContact O-CG 3.43Å; V537-L541 PolarHBondContact O-N 3.22Å
538	A	87.3	Confident	78	Confident	50 Å²	50	65.5 Å²	65.5	41%	0.413	37%	0.373	S	S	.	.	H	α-helix	trans	-65	-38.2	177.1	0	0	0	0	0	112	S534 E535 C542	S534-A538 WeakPolarHBondContact O-CB 3.1Å; S534-A538 PolarHBondContact O-N 2.88Å; E535-A538 PolarHBondContact O-N 2.7Å; A538-C542 PolarHBondContact O-N 3.02Å; A538-C542 VanDerWaalsContact O-N 3.14Å; A538-C542 PolarHBondContact O-SG 2.96Å
539	E	89.8	Confident	76.2	Confident	107 Å²	107	69.2 Å²	69.2	50%	0.5	40%	0.401	S	S	.	.	H	α-helix	trans	-61.6	-48.4	172.6	-85.2	-164	-151.8	0	0	112.9	E535 E536 V537 C542 K543	E535-E539 PolarHBondContact O-N 3.33Å; E536-E539 PolarHBondContact O-N 3.05Å; V537-E539 VanDerWaalsContact C-N 3.34Å; V537-E539 PolarHBondContact O-N 2.71Å; E539-C542 WeakPolarHBondContact O-CB 3.37Å; E539-C542 PolarHBondContact O-N 3.31Å; E539-K543 VanDerWaalsContact O-CG 3.3Å; E539-K543 WeakPolarHBondContact O-CG 3.41Å; E539-K543 PolarHBondContact O-N 3.23Å; E539-K543 WeakPolarHBondContact OE2-CE 3.39Å; E539-K543 IonicContact OE2-NZ 3.86Å; E539-K543 PolarHBondContact OE2-NZ 2.91Å
540	E	89.9	Confident	74.8	Confident	30 Å²	30	74.5 Å²	74.5	14%	0.14	43%	0.425	C	S	.	.	H	α-helix	trans	-64.1	-43.3	-179.4	-68.1	-48.6	118.7	0	0	111.9	E536 V537 C542 K543 T544	E536-E540 WeakPolarHBondContact O-CG 3.47Å; E536-E540 PolarHBondContact O-N 3.31Å; V537-E540 PolarHBondContact O-N 3.12Å; E540-C542 VanDerWaalsContact C-N 3.26Å; E540-C542 PolarHBondContact O-N 3.05Å; E540-K543 WeakPolarHBondContact O-CB 3.25Å; E540-K543 PolarHBondContact O-N 2.67Å; E540-K543 WeakPolarHBondContact OE1-CD 3.3Å; E540-K543 WeakPolarHBondContact OE1-CE 3.47Å; E540-K543 IonicContact OE1-NZ 3.22Å; E540-K543 PolarHBondContact OE1-NZ 2.92Å; E540-T544 PolarHBondContact O-N 2.86Å; E540-T544 PolarHBondContact O-OG1 3.31Å; E540-T544 VanDerWaalsContact O-OG1 3.04Å
541	L	87.8	Confident	73.1	Confident	75 Å²	75	73.9 Å²	73.9	39%	0.393	42%	0.422	S	S	.	.	H	α-helix	trans	-58.5	-38.3	174.2	-69.5	170.9	0	0	0	112.1	E493 V537 A545	E493-L541 HydrophobicContact CG-CD2 3.97Å; V537-L541 HydrophobicContact CG1-CD1 4Å; V537-L541 WeakPolarHBondContact O-CG 3.43Å; V537-L541 PolarHBondContact O-N 3.22Å; L541-A545 PolarHBondContact O-N 2.65Å
542	C	84.2	Confident	71	Confident	76 Å²	76	79.9 Å²	79.9	51%	0.514	45%	0.448	S	S	.	.	H	α-helix	trans	-65.3	-41.8	173.2	-68.8	0	0	0	0	112.2	A538 E539 E540 A545 H546	A538-C542 PolarHBondContact O-N 3.02Å; A538-C542 VanDerWaalsContact O-N 3.14Å; A538-C542 PolarHBondContact O-SG 2.96Å; E539-C542 WeakPolarHBondContact O-CB 3.37Å; E539-C542 PolarHBondContact O-N 3.31Å; E540-C542 VanDerWaalsContact C-N 3.26Å; E540-C542 PolarHBondContact O-N 3.05Å; C542-A545 PolarHBondContact O-N 3.43Å; C542-H546 PolarHBondContact O-N 3.19Å; C542-H546 PolarHBondContact O-ND1 2.96Å
543	K	84.1	Confident	69.2	Low	96 Å²	96	83.5 Å²	83.5	42%	0.417	47%	0.472	S	S	.	.	H	α-helix	trans	-63.9	-43.4	177.8	-66.8	160.4	-159	168.5	0	111.1	E539 E540 A545 H546 S547	E539-K543 VanDerWaalsContact O-CG 3.3Å; E539-K543 WeakPolarHBondContact O-CG 3.41Å; E539-K543 PolarHBondContact O-N 3.23Å; E539-K543 WeakPolarHBondContact OE2-CE 3.39Å; E539-K543 IonicContact OE2-NZ 3.86Å; E539-K543 PolarHBondContact OE2-NZ 2.91Å; E540-K543 WeakPolarHBondContact O-CB 3.25Å; E540-K543 PolarHBondContact O-N 2.67Å; E540-K543 WeakPolarHBondContact OE1-CD 3.3Å; E540-K543 WeakPolarHBondContact OE1-CE 3.47Å; E540-K543 IonicContact OE1-NZ 3.22Å; E540-K543 PolarHBondContact OE1-NZ 2.92Å; K543-A545 PolarHBondContact O-N 2.88Å; K543-H546 PolarHBondContact O-N 3Å; K543-S547 PolarHBondContact O-N 3.05Å
544	T	68.5	Low	66.9	Low	53 Å²	53	91 Å²	91	33%	0.325	51%	0.511	S	S	.	.	H	α-helix	trans	-59.5	-45.9	176.7	-50.9	0	0	0	0	111.9	E540 H546 S547 V548	E540-T544 PolarHBondContact O-N 2.86Å; E540-T544 PolarHBondContact O-OG1 3.31Å; E540-T544 VanDerWaalsContact O-OG1 3.04Å; T544-H546 VanDerWaalsContact C-N 3.31Å; T544-H546 PolarHBondContact O-N 3.49Å; T544-S547 WeakPolarHBondContact O-CB 3.39Å; T544-S547 PolarHBondContact O-N 3.37Å; T544-S547 VanDerWaalsContact O-N 3.14Å; T544-V548 PolarHBondContact O-N 3.48Å
545	A	63.3	Low	64.4	Low	60 Å²	60	96.6 Å²	96.6	50%	0.496	54%	0.535	S	S	.	.	H	α-helix	trans	-60.9	-35.3	179.7	0	0	0	0	0	113.7	L541 C542 K543 S549	L541-A545 PolarHBondContact O-N 2.65Å; C542-A545 PolarHBondContact O-N 3.43Å; K543-A545 PolarHBondContact O-N 2.88Å; A545-S549 PolarHBondContact O-OG 3.26Å
546	H	58	Low	62.5	Low	136 Å²	136	98.7 Å²	98.7	63%	0.63	56%	0.555	S	S	*	*	H	α-helix	trans	-74.4	-31	176.8	-71.6	79.3	0	0	0	112.6	C542 K543 T544 S549	C542-H546 PolarHBondContact O-N 3.19Å; C542-H546 PolarHBondContact O-ND1 2.96Å; K543-H546 PolarHBondContact O-N 3Å; T544-H546 VanDerWaalsContact C-N 3.31Å; T544-H546 PolarHBondContact O-N 3.49Å; H546-S549 WeakPolarHBondContact O-CB 3.44Å; H546-S549 PolarHBondContact O-N 2.99Å
547	S	51.1	Low	59.7	Low	85 Å²	85	102.8 Å²	102.8	59%	0.594	59%	0.588	S	S	*	*	H	α-helix	trans	-61.5	-47.8	176.5	-168.9	0	0	0	0	112.1	K543 T544 S549 H550	K543-S547 PolarHBondContact O-N 3.05Å; T544-S547 WeakPolarHBondContact O-CB 3.39Å; T544-S547 PolarHBondContact O-N 3.37Å; T544-S547 VanDerWaalsContact O-N 3.14Å; S547-S549 PolarHBondContact O-N 2.84Å; S547-H550 PolarHBondContact O-N 2.73Å
548	V	50.6	Low	57	Low	119 Å²	119	111.1 Å²	111.1	72%	0.721	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	-17.6	-179.9	-177.2	0	0	0	0	112.7	T544 H550	T544-V548 PolarHBondContact O-N 3.48Å; V548-H550 VanDerWaalsContact C-N 3.33Å; V548-H550 PolarHBondContact O-N 3.14Å
549	S	43.3	Very low	54.4	Low	91 Å²	91	114.6 Å²	114.6	64%	0.636	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-11.2	-180	-59.5	0	0	0	0	114.5	A545 H546 S547	A545-S549 PolarHBondContact O-OG 3.26Å; H546-S549 WeakPolarHBondContact O-CB 3.44Å; H546-S549 PolarHBondContact O-N 2.99Å; S547-S549 PolarHBondContact O-N 2.84Å
550	H	43.8	Very low	51.4	Low	167 Å²	167	120 Å²	120	77%	0.773	66%	0.659	S	S	*	*	S	Bend	trans	-102.9	-19.5	-171.3	-85.9	-73.3	0	0	0	116.2	S547 V548 M552	S547-H550 PolarHBondContact O-N 2.73Å; V548-H550 VanDerWaalsContact C-N 3.33Å; V548-H550 PolarHBondContact O-N 3.14Å; H550-M552 PolarHBondContact O-N 2.92Å
551	D	37.1	Very low	48.4	Very low	155 Å²	155	124.2 Å²	124.2	83%	0.829	69%	0.686	S	S	*	*			trans	-97.6	58.3	-175.1	-99.9	-37.4	0	0	0	113.6
552	M	34.6	Very low	45.4	Very low	152 Å²	152	128.3 Å²	128.3	75%	0.749	71%	0.708	S	S	*	*			trans	-124.8	103.8	171.8	-132.6	-54.8	114.3	0	0	111.6	H550 L554	H550-M552 PolarHBondContact O-N 2.92Å; M552-L554 PolarHBondContact O-N 3Å; M552-L554 VanDerWaalsContact O-N 3.12Å
553	P	42.6	Very low	42.9	Very low	103 Å²	103	133.8 Å²	133.8	67%	0.669	73%	0.726	S	S	*	*			trans	-69	106.8	-175.8	-23	35.1	0	0	0	113.8	L555	P553-L555 PolarHBondContact O-N 2.73Å
554	L	38.9	Very low	40.3	Very low	169 Å²	169	137.1 Å²	137.1	89%	0.885	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-72.7	117.4	175.9	-70.3	172.6	0	0	0	112.2	M552	M552-L554 PolarHBondContact O-N 3Å; M552-L554 VanDerWaalsContact O-N 3.12Å
555	L	34.4	Very low	38.3	Very low	171 Å²	171	141.8 Å²	141.8	90%	0.895	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-78.8	126.6	172.9	-71.1	171.6	0	0	0	111.6	P553	P553-L555 PolarHBondContact O-N 2.73Å
556	P	46.9	Very low	36.6	Very low	114 Å²	114	144 Å²	144	74%	0.74	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-96.6	124.5	-175.7	34.2	-32.5	0	0	0	113.8
557	S	30	Very low	35	Very low	120 Å²	120	144.8 Å²	144.8	84%	0.839	77%	0.769	S	S	*	*			trans	-156.4	81.6	165	-85.8	0	0	0	0	116.2
558	K	30.9	Very low	34	Very low	204 Å²	204	147.3 Å²	147.3	89%	0.887	78%	0.776	S	S	*	*			trans	32.6	108.6	136.2	-59.4	173.4	-178.3	172.8	0	120
559	S	32.2	Very low	33.1	Very low	124 Å²	124	149.8 Å²	149.8	87%	0.867	78%	0.777	S	S	*	*				174.7	162	124.9	48.3	0	0	0	0	111.2
560	R	27.7	Very low	32.4	Very low	221 Å²	221	152.4 Å²	152.4	83%	0.834	78%	0.779	S	S	*	*			cis	-165.7	115.5	-44.4	162.9	173	168.5	-179.4	-4.2	107.4
561	T	26.9	Very low	31.6	Very low	117 Å²	117	151.2 Å²	151.2	72%	0.718	78%	0.778	S	S	*	*			trans	36.4	121.2	158.8	62.1	0	0	0	0	120.9
562	L	24.7	Very low	31.5	Very low	161 Å²	161	150.1 Å²	150.1	84%	0.843	77%	0.771	S	S	*	*				-153.3	136	119.3	-163.7	65.9	0	0	0	111.4
563	H	32	Very low	31.4	Very low	192 Å²	192	151.9 Å²	151.9	89%	0.889	78%	0.778	S	S	*	*			trans	-118.7	129.1	169.9	-125.8	-64.9	0	0	0	108.3
564	K	29	Very low	30.8	Very low	166 Å²	166	150.7 Å²	150.7	72%	0.722	78%	0.784	S	S	*	*			trans	-168.5	136.8	175.6	-148.2	-178	-179.2	-176.4	0	107.9
565	H	25.7	Very low	30.2	Very low	150 Å²	150	145.9 Å²	145.9	69%	0.694	78%	0.775	S	S	*	*			cis	-144.2	148.9	-10.6	-122.2	-147.9	0	0	0	105.1
566	T	27.4	Very low	30.1	Very low	107 Å²	107	145.4 Å²	145.4	66%	0.656	77%	0.773	S	S	*	*				57.3	137.7	88.9	-45	0	0	0	0	115.1
567	E	26.4	Very low	29.3	Very low	153 Å²	153	147.4 Å²	147.4	72%	0.715	78%	0.778	S	S	*	*			cis	179	137.4	-28.6	-179.9	173.5	163.7	0	0	108.1
568	N	28.6	Very low	29.3	Very low	137 Å²	137	144.4 Å²	144.4	73%	0.733	77%	0.765	S	S	*	*			trans	47.3	140.4	158.8	-65.6	-33.7	0	0	0	124.7
569	K	31.6	Very low	29.3	Very low	172 Å²	172	143.4 Å²	143.4	75%	0.748	76%	0.763	S	S	*	*			trans	94	133.1	139	-100.8	-171.4	162	-145.3	0	124.2
570	E	29	Very low	29.1	Very low	146 Å²	146	141.7 Å²	141.7	68%	0.682	75%	0.751	S	S	*	*			trans	82.6	102.4	138.2	-83.2	165.9	175.2	0	0	125.2
571	N	27.8	Very low	29	Very low	141 Å²	141	137.4 Å²	137.4	75%	0.754	75%	0.745	S	S	*	*				95.6	153	113.9	-152.3	22.3	0	0	0	122
572	I	34.8	Very low	29	Very low	133 Å²	133	139.9 Å²	139.9	68%	0.682	75%	0.748	S	S	*	*			trans	67.9	137.8	167.4	-73.4	157.7	0	0	0	115.8
573	E	32.1	Very low	29.2	Very low	188 Å²	188	137.7 Å²	137.7	88%	0.879	75%	0.746	S	S	*	*			cis	-155.3	161.7	-8.5	-114.9	175.3	153.9	0	0	105.9
574	G	29.1	Very low	29.3	Very low	78 Å²	78	134.6 Å²	134.6	80%	0.804	74%	0.741	S	S	*	*			cis	-178.2	178.5	-0.9	0	0	0	0	0	106.8
575	G	27.8	Very low	29.3	Very low	68 Å²	68	136.1 Å²	136.1	70%	0.701	75%	0.75	S	S	*	*			cis	176.6	170.5	-2.2	0	0	0	0	0	109.8
576	L	30.8	Very low	29.6	Very low	161 Å²	161	133.7 Å²	133.7	84%	0.843	75%	0.75	S	S	*	*			trans	67.6	132.7	-177.5	-43.4	167.9	0	0	0	115
577	D	30.7	Very low	29.8	Very low	157 Å²	157	136.8 Å²	136.8	84%	0.84	76%	0.757	S	S	*	*			cis	-166	168.2	-16.5	-96.5	-32.1	0	0	0	107.1
578	G	29.6	Very low	30.3	Very low	56 Å²	56	133.5 Å²	133.5	58%	0.577	75%	0.751	S	S	*	*			cis	167.7	151.4	-2.8	0	0	0	0	0	110.9
579	H	30.5	Very low	30.4	Very low	184 Å²	184	130 Å²	130	85%	0.852	75%	0.747	S	S	*	*			trans	65	132.3	-177.6	-67	-72.3	0	0	0	116.8
580	S	29.1	Very low	31.6	Very low	87 Å²	87	132.3 Å²	132.3	61%	0.608	75%	0.751	S	S	*	*			cis	79	138.1	32.2	91.2	0	0	0	0	114.1
581	D	25.4	Very low	31.7	Very low	132 Å²	132	131.4 Å²	131.4	71%	0.706	76%	0.756	S	S	*	*			cis	-166.7	176.9	-8.5	-135.9	-49.9	0	0	0	110.3
582	H	27.9	Very low	31.9	Very low	168 Å²	168	129.5 Å²	129.5	78%	0.778	75%	0.753	S	S	*	*			trans	50.8	129.9	163.7	-68	-58.6	0	0	0	119.1
583	S	28.6	Very low	31.7	Very low	115 Å²	115	130.2 Å²	130.2	80%	0.804	76%	0.758	S	S	*	*				179.7	166.1	65.4	41.5	0	0	0	0	111.2
584	T	32.4	Very low	31.8	Very low	128 Å²	128	130.7 Å²	130.7	79%	0.785	76%	0.757	S	S	*	*			trans	-129.8	125.3	-170.1	52.7	0	0	0	0	113.6
585	H	30.7	Very low	31.7	Very low	198 Å²	198	130.6 Å²	130.6	92%	0.917	76%	0.757	S	S	*	*			trans	-152.9	165.9	162.9	-89.1	-65.6	0	0	0	111
586	S	31.6	Very low	31.7	Very low	98 Å²	98	130.8 Å²	130.8	69%	0.685	76%	0.759	S	S	*	*			trans	-141.9	140.8	-151.2	-37.3	0	0	0	0	115.2
587	H	31.9	Very low	31.7	Very low	172 Å²	172	131.8 Å²	131.8	80%	0.796	77%	0.765	S	S	*	*			trans	58.5	151.4	159.8	-58.2	-63.1	0	0	0	118.4
588	S	36.3	Very low	31.6	Very low	84 Å²	84	127.8 Å²	127.8	59%	0.587	76%	0.761	S	S	*	*			cis	-166.5	130.2	-16.6	47.4	0	0	0	0	107.4
589	G	30.6	Very low	31.6	Very low	64 Å²	64	136.3 Å²	136.3	66%	0.66	78%	0.775	S	S	*	*			trans	-116.6	-69.4	-162.8	0	0	0	0	0	116.5
590	W	56.8	Low	31.4	Very low	221 Å²	221	132.6 Å²	132.6	84%	0.837	77%	0.77	S	S	*	*			cis	-114.2	-6.2	0.7	-59.5	62	0	0	0	112.2
591	T	31.3	Very low	31.2	Very low	126 Å²	126	134.1 Å²	134.1	77%	0.773	78%	0.781	S	S	*	*			trans	-76.6	170.4	158.3	55.2	0	0	0	0	109.1
592	S	32.7	Very low	31.2	Very low	101 Å²	101	132.9 Å²	132.9	71%	0.706	78%	0.783	S	S	*	*			cis	-159.2	179.3	19.3	-159.7	0	0	0	0	112.7
593	L	29.9	Very low	31.5	Very low	148 Å²	148	129.8 Å²	129.8	78%	0.775	78%	0.78	S	S	*	*			trans	98.9	137.9	162.4	-55.7	173.4	0	0	0	119.8
594	F	33.2	Very low	32.2	Very low	198 Å²	198	130.8 Å²	130.8	87%	0.868	78%	0.783	S	S	*	*			trans	-52.5	164.6	178.1	-48.7	-94.8	0	0	0	115.2
595	G	27.8	Very low	32.4	Very low	77 Å²	77	128.6 Å²	128.6	79%	0.794	78%	0.778	S	S	*	*			cis	169.4	178.9	2.2	0	0	0	0	0	110.4
596	G	27.7	Very low	32.8	Very low	72 Å²	72	127.1 Å²	127.1	74%	0.742	78%	0.777	S	S	*	*			cis	-176.1	-166.1	1.7	0	0	0	0	0	111.6
597	D	30.2	Very low	33.8	Very low	181 Å²	181	127.7 Å²	127.7	97%	0.968	78%	0.778	S	S	*	*			trans	59.9	141.3	177.4	-67.1	-29.7	0	0	0	118.5
598	G	28.7	Very low	33.5	Very low	73 Å²	73	130.5 Å²	130.5	75%	0.753	78%	0.781	S	S	*	*			trans	180	-26.9	178.1	0	0	0	0	0	120.1
599	R	29.1	Very low	33.1	Very low	235 Å²	235	135 Å²	135	89%	0.887	79%	0.79	S	S	*	*			trans	52.6	109.6	171.8	-70.7	175.5	151.9	-164.1	-5.1	118.9
600	S	27.2	Very low	32.9	Very low	107 Å²	107	139.8 Å²	139.8	75%	0.748	80%	0.795	S	S	*	*				69.5	155.5	127.6	74.6	0	0	0	0	122.8
601	S	25.8	Very low	31.9	Very low	118 Å²	118	137.8 Å²	137.8	83%	0.825	80%	0.795	S	S	*	*			trans	98.6	150.7	149.2	81.9	0	0	0	0	119.6
602	S	24.7	Very low	33	Very low	107 Å²	107	137 Å²	137	75%	0.748	79%	0.793	S	S	*	*			trans	-79.7	174.3	-162.8	51.8	0	0	0	0	116.2
603	S	33.9	Very low	33	Very low	103 Å²	103	141.9 Å²	141.9	72%	0.72	80%	0.796	S	S	*	*			trans	-39.7	165.3	144.7	-25.6	0	0	0	0	113
604	P	44.4	Very low	33	Very low	135 Å²	135	138.8 Å²	138.8	88%	0.877	78%	0.78	S	S	*	*			cis	-141.9	-138.7	28.8	42.2	-19.5	0	0	0	114.4
605	A	36.4	Very low	32.8	Very low	82 Å²	82	137.8 Å²	137.8	68%	0.678	78%	0.775	S	S	*	*			trans	-101.5	159.9	-165.6	0	0	0	0	0	115.9
606	L	38	Very low	32.9	Very low	168 Å²	168	139.4 Å²	139.4	88%	0.88	77%	0.774	S	S	*	*			trans	65.6	175.8	170.2	-54.5	172.5	0	0	0	114.8
607	P	52.7	Low	34.2	Very low	109 Å²	109	141.1 Å²	141.1	71%	0.708	77%	0.772	S	S	*	*			cis	-133.8	-175.7	-14.6	32.8	-12	0	0	0	115.7
608	R	25.7	Very low	34	Very low	232 Å²	232	138 Å²	138	88%	0.875	77%	0.765	S	S	*	*			trans	77.4	112.8	141.5	-98.9	-176.2	170.7	167.9	-1.6	123.9
609	K	28.3	Very low	33.9	Very low	177 Å²	177	139 Å²	139	77%	0.77	76%	0.76	S	S	*	*				87.3	140.2	118.9	-143.9	-165.8	-178.7	-166.2	0	122.2
610	Q	25.7	Very low	33.9	Very low	165 Å²	165	134.8 Å²	134.8	77%	0.771	75%	0.754	S	S	*	*			trans	88.5	124.7	167.1	-52.6	-177.1	103.6	0	0	114.8
611	Q	36.7	Very low	34	Very low	179 Å²	179	136.1 Å²	136.1	84%	0.836	75%	0.752	S	S	*	*				76.8	153.2	53.4	-95.4	-144.3	-9.3	0	0	115
612	P	54.4	Low	34.2	Very low	110 Å²	110	137.7 Å²	137.7	71%	0.714	75%	0.747	S	S	*	*			cis	-99	-151.4	-1.4	42.6	-36.6	0	0	0	111.3
613	R	31.4	Very low	34.4	Very low	204 Å²	204	138.7 Å²	138.7	77%	0.77	74%	0.744	S	S	*	*			cis	-159.7	178.1	-9.7	-138.8	-171	149.2	67.8	31.8	106.3
614	D	31.7	Very low	34.2	Very low	83 Å²	83	138.1 Å²	138.1	44%	0.444	75%	0.745	S	S	.	*			cis	-157	163.2	-4.5	-160.9	11.7	0	0	0	110.8
615	K	28.9	Very low	33.5	Very low	176 Å²	176	139.2 Å²	139.2	77%	0.765	74%	0.738	S	S	*	*			trans	62.8	164.1	158.5	-77.8	158.3	-170	167.6	0	120.5
616	S	28.2	Very low	33	Very low	112 Å²	112	141.8 Å²	141.8	78%	0.783	74%	0.741	S	S	*	*			trans	-153.6	-166.9	-140	-42.5	0	0	0	0	110
617	P	55.4	Low	32.8	Very low	108 Å²	108	142.4 Å²	142.4	70%	0.701	74%	0.743	S	S	*	*			cis	-142.9	179.6	-0.4	41.2	-21.6	0	0	0	118
618	S	27.6	Very low	31.6	Very low	115 Å²	115	140.3 Å²	140.3	80%	0.804	74%	0.742	S	S	*	*			trans	70.3	153.2	148.6	67.4	0	0	0	0	119.1
619	S	26.6	Very low	31.6	Very low	93 Å²	93	135.6 Å²	135.6	65%	0.65	74%	0.738	S	S	*	*			cis	-154.6	147.3	13.8	61.4	0	0	0	0	115
620	L	27.5	Very low	31.6	Very low	148 Å²	148	135.5 Å²	135.5	78%	0.775	74%	0.738	S	S	*	*			trans	65.7	145.9	152.8	-59	162.6	0	0	0	117.8
621	L	30.3	Very low	31.8	Very low	135 Å²	135	133 Å²	133	71%	0.707	73%	0.734	S	S	*	*			cis	74.5	145.5	29.5	-59.7	172.6	0	0	0	114.3
622	E	30.8	Very low	31.6	Very low	151 Å²	151	134.4 Å²	134.4	71%	0.706	73%	0.732	S	S	*	*			cis	-163.4	-179.3	-27.5	-157.6	163.5	-155.8	0	0	107
623	D	29	Very low	30.3	Very low	128 Å²	128	135 Å²	135	68%	0.684	73%	0.729	S	S	*	*			trans	34	131.5	156.1	-70	-31.5	0	0	0	123.9
624	A	28.9	Very low	30.6	Very low	91 Å²	91	136.3 Å²	136.3	75%	0.752	73%	0.734	S	S	*	*				179.6	132.4	103.2	0	0	0	0	0	109.4
625	Q	28.8	Very low	30.5	Very low	157 Å²	157	142.4 Å²	142.4	73%	0.734	76%	0.757	S	S	*	*			cis	94	136.2	36.5	-161.2	174.6	31.3	0	0	113.6
626	D	27.6	Very low	31	Very low	136 Å²	136	140.1 Å²	140.1	73%	0.727	76%	0.758	S	S	*	*			trans	55.5	119.2	168.6	-64.6	-29.1	0	0	0	122.3
627	I	32	Very low	31.2	Very low	182 Å²	182	137 Å²	137	93%	0.933	74%	0.744	S	S	*	*				174.3	144.2	123.7	-92.2	158.5	0	0	0	108.4
628	G	27.7	Very low	30	Very low	65 Å²	65	137.4 Å²	137.4	67%	0.67	73%	0.734	S	S	*	*			cis	172.8	138.8	-4.3	0	0	0	0	0	110.8
629	T	26.5	Very low	29.9	Very low	132 Å²	132	139 Å²	139	81%	0.81	73%	0.727	S	S	*	*			trans	-66.2	166.2	-176.6	27	0	0	0	0	115.4
630	F	27.4	Very low	30	Very low	175 Å²	175	139.6 Å²	139.6	77%	0.768	73%	0.732	S	S	*	*			trans	86.7	117.4	142	-100.5	-133.7	0	0	0	121.9
631	T	30.1	Very low	30.2	Very low	112 Å²	112	136.6 Å²	136.6	69%	0.687	72%	0.723	S	S	*	*			trans	66.9	154.2	137.6	60.2	0	0	0	0	119.4
632	R	33.4	Very low	30	Very low	209 Å²	209	137.6 Å²	137.6	79%	0.789	72%	0.722	S	S	*	*			cis	-149.1	146.6	-8.7	-121.4	168.4	71.4	172.6	2.1	105.9
633	D	27.6	Very low	29.8	Very low	122 Å²	122	137.3 Å²	137.3	65%	0.652	72%	0.723	S	S	*	*				-165.7	-174.5	64.3	-142.6	-75.4	0	0	0	112.7
634	R	36.3	Very low	29.5	Very low	232 Å²	232	139.7 Å²	139.7	88%	0.875	73%	0.728	S	S	*	*			trans	-93.4	109.1	-163.6	-86.5	176.6	155.8	176.8	-6.2	116.3
635	K	30.2	Very low	29.4	Very low	211 Å²	211	143.5 Å²	143.5	92%	0.917	73%	0.727	S	S	*	*			trans	-175.9	139.7	138.4	-104.7	153	-176.4	167.3	0	111.8
636	T	40.1	Very low	29.3	Very low	129 Å²	129	141 Å²	141	79%	0.791	71%	0.714	S	S	*	*			trans	-117.2	131.6	-168.8	42.8	0	0	0	0	115.7	K646	T636-K646 PolarHBondContact O-NZ 3.31Å
637	G	31	Very low	29.2	Very low	47 Å²	47	138.7 Å²	138.7	49%	0.485	71%	0.708	S	S	.	*			trans	117.4	138.5	156.6	0	0	0	0	0	116.4
638	F	31.3	Very low	28.7	Very low	115 Å²	115	136.2 Å²	136.2	50%	0.504	70%	0.702	S	S	.	*			trans	61.7	143.2	-154.6	-76	-89.2	0	0	0	112.4	S640 S641 F642 K646	F638-S640 WeakPolarHBondContact CD1-O 3.2Å; F638-S641 WeakPolarHBondContact CD1-O 3.41Å; F638-F642 AromaticContact CE1-CD2 3.94Å; F638-F642 HydrophobicContact CE1-CD2 3.94Å; F638-F642 HydrophobicContact CE1-CE2 4.48Å; F638-K646 HydrophobicContact CD2-CB 4.06Å; F638-K646 HydrophobicContact CD2-CD 4.41Å; F638-K646 HydrophobicContact CD2-CG 4.39Å
639	F	24.9	Very low	28.6	Very low	149 Å²	149	138.1 Å²	138.1	65%	0.654	71%	0.705	S	S	*	*			cis	-77.8	-167.6	-0.2	-37.6	-59.6	0	0	0	110.9	F642 I643	F639-F642 WeakPolarHBondContact CD1-O 3.14Å; F639-F642 VanDerWaalsContact CE1-O 3.29Å; F639-F642 WeakPolarHBondContact CE1-O 3.49Å; F639-I643 HydrophobicContact CE1-CG1 3.65Å; F639-I643 HydrophobicContact CZ-CD1 4.35Å; F639-I643 HydrophobicContact CZ-CG1 3.82Å
640	S	29.4	Very low	28.5	Very low	106 Å²	106	136.6 Å²	136.6	74%	0.741	70%	0.7	S	S	*	*	S	Bend	cis	-67.6	169.5	1.7	-160.9	0	0	0	0	113.9	F638	F638-S640 WeakPolarHBondContact CD1-O 3.2Å
641	S	30.2	Very low	28.4	Very low	84 Å²	84	132.7 Å²	132.7	59%	0.587	69%	0.694	S	S	*	*	S	Bend	trans	58.4	146.5	-172.1	-64.7	0	0	0	0	115.5	F638	F638-S641 WeakPolarHBondContact CD1-O 3.41Å
642	F	26.2	Very low	28.2	Very low	156 Å²	156	132.6 Å²	132.6	68%	0.684	70%	0.698	S	S	*	*			trans	64.3	149.8	-173.6	-56.9	-89.7	0	0	0	116.7	F638 F639	F638-F642 AromaticContact CE1-CD2 3.94Å; F638-F642 HydrophobicContact CE1-CD2 3.94Å; F638-F642 HydrophobicContact CE1-CE2 4.48Å; F639-F642 WeakPolarHBondContact CD1-O 3.14Å; F639-F642 VanDerWaalsContact CE1-O 3.29Å; F639-F642 WeakPolarHBondContact CE1-O 3.49Å
643	I	28	Very low	27.8	Very low	145 Å²	145	127.1 Å²	127.1	74%	0.744	69%	0.692	S	S	*	*	S	Bend		-112	126.3	118.7	-71.9	170.3	0	0	0	102.7	F639	F639-I643 HydrophobicContact CE1-CG1 3.65Å; F639-I643 HydrophobicContact CZ-CD1 4.35Å; F639-I643 HydrophobicContact CZ-CG1 3.82Å
644	K	22.7	Very low	27.7	Very low	178 Å²	178	126.4 Å²	126.4	77%	0.774	70%	0.697	S	S	*	*	S	Bend	cis	-152.1	110.8	42.6	-172.1	176.1	178.6	179.8	0	113.5
645	K	26.5	Very low	27.2	Very low	172 Å²	172	120.7 Å²	120.7	75%	0.748	69%	0.692	S	S	*	*			trans	68.5	102.7	134.6	-159.4	174.7	-174.5	175.2	0	120.7
646	K	26.6	Very low	27.1	Very low	104 Å²	104	116 Å²	116	45%	0.452	69%	0.685	S	S	.	*			trans	-7.8	135.3	139.9	-156	176.5	168.7	177.9	0	114.9	T636 F638	T636-K646 PolarHBondContact O-NZ 3.31Å; F638-K646 HydrophobicContact CD2-CB 4.06Å; F638-K646 HydrophobicContact CD2-CD 4.41Å; F638-K646 HydrophobicContact CD2-CG 4.39Å
647	S	24.6	Very low	27.2	Very low	87 Å²	87	115 Å²	115	61%	0.608	68%	0.682	S	S	*	*				-176	164.7	74.6	-56.8	0	0	0	0	114.1
648	T	22.5	Very low	27	Very low	130 Å²	130	117.1 Å²	117.1	80%	0.798	69%	0.689	S	S	*	*			trans	65.7	127.8	153.7	39.6	0	0	0	0	120.5
649	S	24.8	Very low	26.9	Very low	105 Å²	105	116.8 Å²	116.8	73%	0.734	70%	0.701	S	S	*	*			trans	-8.3	145.6	137.4	56.1	0	0	0	0	117.4
650	S	24.4	Very low	27.2	Very low	101 Å²	101	117.5 Å²	117.5	71%	0.706	71%	0.706	S	S	*	*			cis	-157.5	175	26.6	55.7	0	0	0	0	114.8
651	S	25.4	Very low	27.2	Very low	93 Å²	93	117.7 Å²	117.7	65%	0.65	70%	0.703	S	S	*	*			trans	63.1	116.3	139.6	58.9	0	0	0	0	121.8
652	S	26.5	Very low	27.2	Very low	109 Å²	109	120.4 Å²	120.4	76%	0.762	71%	0.706	S	S	*	*				88.6	166.4	124.9	75.7	0	0	0	0	121.5
653	S	25.6	Very low	27.6	Very low	95 Å²	95	120.1 Å²	120.1	66%	0.664	71%	0.707	S	S	*	*			trans	64.2	96.3	164.2	61.5	0	0	0	0	120.3
654	S	25.4	Very low	27.6	Very low	107 Å²	107	119.9 Å²	119.9	75%	0.748	71%	0.707	S	S	*	*				58.4	163.8	115.7	65.2	0	0	0	0	123.5
655	S	25.8	Very low	27.8	Very low	112 Å²	112	118 Å²	118	78%	0.783	71%	0.705	S	S	*	*			trans	80.4	120.6	156.6	56.9	0	0	0	0	120.8
656	S	26.4	Very low	28.7	Very low	111 Å²	111	114.9 Å²	114.9	78%	0.776	70%	0.702	S	S	*	*			trans	-58.6	178.7	148.4	-28.4	0	0	0	0	111.3
657	P	42.9	Very low	28.8	Very low	109 Å²	109	115.4 Å²	115.4	71%	0.708	71%	0.714	S	S	*	*			cis	-147.7	-171.8	23.8	36.2	-10.7	0	0	0	117.7
658	S	26.2	Very low	30	Very low	92 Å²	92	116.5 Å²	116.5	64%	0.643	72%	0.719	S	S	*	*			trans	50.6	115	141.3	65.7	0	0	0	0	120.8
659	S	29.8	Very low	31	Very low	107 Å²	107	115.7 Å²	115.7	75%	0.748	72%	0.716	S	S	*	*				88.6	166.7	98.2	84.2	0	0	0	0	113.2
660	Q	31.7	Very low	31.2	Very low	165 Å²	165	120.1 Å²	120.1	77%	0.771	72%	0.722	S	S	*	*			cis	-159.7	148.2	18.8	-139.2	-168.9	5.8	0	0	111.6
661	V	29.2	Very low	31.3	Very low	110 Å²	110	126 Å²	126	67%	0.667	73%	0.729	S	S	*	*			trans	69.5	152	138.1	156.2	0	0	0	0	118.2
662	Q	30.1	Very low	31.4	Very low	141 Å²	141	125.9 Å²	125.9	66%	0.659	73%	0.728	S	S	*	*			cis	-160.1	141.4	38.3	-158.1	137.9	0.7	0	0	117.7
663	Q	34.5	Very low	31.4	Very low	149 Å²	149	125.1 Å²	125.1	70%	0.696	72%	0.723	S	S	*	*			trans	62.6	157.3	146.8	-77.7	170.1	7.5	0	0	122
664	N	27.3	Very low	31.4	Very low	140 Å²	140	126.1 Å²	126.1	75%	0.749	73%	0.73	S	S	*	*			cis	-148.3	179.2	1.8	-128.6	-22.9	0	0	0	114.7
665	L	28.2	Very low	31.3	Very low	140 Å²	140	129 Å²	129	73%	0.733	73%	0.729	S	S	*	*			trans	-137.4	167.6	-162.5	-113.3	156.1	0	0	0	114.9	T667	L665-T667 HydrophobicContact CD2-CG2 4.42Å
666	P	44.5	Very low	31.3	Very low	105 Å²	105	133.1 Å²	133.1	68%	0.682	73%	0.727	S	S	*	*				-147.2	175.6	96	44.6	-28.8	0	0	0	113
667	T	29.3	Very low	31.2	Very low	115 Å²	115	132.9 Å²	132.9	71%	0.706	71%	0.714	S	S	*	*			cis	72.6	154.6	20.8	70.2	0	0	0	0	117	L665	L665-T667 HydrophobicContact CD2-CG2 4.42Å
668	P	49	Very low	30.3	Very low	111 Å²	111	135.1 Å²	135.1	72%	0.721	72%	0.717	S	S	*	*			cis	-127.3	-158.2	0.1	43.9	-26.4	0	0	0	112.6
669	P	44	Very low	30.2	Very low	113 Å²	113	138.4 Å²	138.4	73%	0.734	72%	0.722	S	S	*	*			cis	-114.8	169.4	-11.9	42.2	-28.5	0	0	0	113.5
670	K	29.4	Very low	30	Very low	198 Å²	198	139.2 Å²	139.2	86%	0.861	72%	0.723	S	S	*	*			cis	74.5	141.5	36.1	-61.6	-177.4	177.7	178.6	0	113.8
671	R	26.7	Very low	29.7	Very low	224 Å²	224	139.5 Å²	139.5	85%	0.845	72%	0.724	S	S	*	*			cis	-139.8	-171.1	11.7	-158.9	-166.6	168.6	175.3	-2.1	107.6
672	S	27.5	Very low	30.4	Very low	91 Å²	91	138.4 Å²	138.4	64%	0.636	72%	0.719	S	S	*	*			cis	-159.7	164.7	8.8	-24.2	0	0	0	0	107.3
673	S	26.1	Very low	30.3	Very low	92 Å²	92	138.4 Å²	138.4	64%	0.643	72%	0.719	S	S	*	*			cis	87.2	135.7	27.5	88.1	0	0	0	0	117.9
674	S	25.8	Very low	30	Very low	116 Å²	116	139 Å²	139	81%	0.811	72%	0.719	S	S	*	*			trans	86.8	155.3	-176.8	-130.7	0	0	0	0	115.1
675	F	22.2	Very low	29.8	Very low	167 Å²	167	141.5 Å²	141.5	73%	0.732	72%	0.723	S	S	*	*			cis	-148.3	-170.8	8.8	-173.1	-115.9	0	0	0	112.2
676	R	26.6	Very low	29.7	Very low	199 Å²	199	145.7 Å²	145.7	75%	0.751	73%	0.731	S	S	*	*			trans	-73.6	-173.3	166.9	-73.9	-173.4	169.8	-175.8	-2.3	111.1
677	E	25	Very low	28.5	Very low	107 Å²	107	148.3 Å²	148.3	50%	0.5	73%	0.734	S	S	.	*			cis	-174.6	150.2	34.4	-160.9	132.1	-122.6	0	0	113.4
678	M	23	Very low	29.3	Very low	156 Å²	156	147 Å²	147	77%	0.768	73%	0.727	S	S	*	*			trans	59.4	165.5	156	-76.1	173.3	-163.4	0	0	118.6
679	E	24.6	Very low	28.1	Very low	160 Å²	160	147.7 Å²	147.7	75%	0.748	73%	0.73	S	S	*	*			cis	-148.6	177.2	3.8	-140.2	172.2	161.7	0	0	113.3
680	T	26.1	Very low	27.3	Very low	125 Å²	125	146.7 Å²	146.7	77%	0.767	73%	0.731	S	S	*	*			trans	58.2	90.6	159.7	53.1	0	0	0	0	120.8
681	Q	24.6	Very low	27	Very low	171 Å²	171	144.6 Å²	144.6	80%	0.799	73%	0.729	S	S	*	*				-58.1	168.6	124.9	-124.5	-159.1	62.8	0	0	109.6
682	P	44.5	Very low	27	Very low	87 Å²	87	142.7 Å²	142.7	57%	0.565	73%	0.728	S	S	*	*				-160.7	-177.7	50.7	44.6	-21.9	0	0	0	119.9
683	H	27.9	Very low	26.8	Very low	140 Å²	140	143.8 Å²	143.8	65%	0.648	74%	0.736	S	S	*	*			trans	75.5	148.7	148.9	-64.3	-19.9	0	0	0	120.5
684	K	27.6	Very low	26.9	Very low	161 Å²	161	144 Å²	144	70%	0.7	74%	0.743	S	S	*	*			cis	-153.4	130.5	-10.3	-105.8	155.1	-171.1	166.6	0	106.7
685	K	24	Very low	27.5	Very low	193 Å²	193	144.3 Å²	144.3	84%	0.839	74%	0.742	S	S	*	*				45.8	110.5	86.7	-75	-166	174.7	-169.7	0	115.9
686	Y	24.9	Very low	29.2	Very low	229 Å²	229	142 Å²	142	90%	0.898	74%	0.744	S	S	*	*				-167.9	151.7	109.1	-131.8	-114.6	0	0	0	114.4
687	E	20.4	Very low	30.3	Very low	160 Å²	160	137.5 Å²	137.5	75%	0.748	74%	0.741	S	S	*	*			trans	-136	172.3	169.1	-134	-155.4	138.6	0	0	104.8
688	P	45.9	Very low	30.7	Very low	86 Å²	86	140.2 Å²	140.2	56%	0.558	76%	0.757	S	S	*	*			cis	-138.2	-171.3	-12.9	32.4	-8.7	0	0	0	114.4
689	T	23.7	Very low	31.8	Very low	126 Å²	126	137.9 Å²	137.9	77%	0.773	75%	0.754	S	S	*	*			trans	56	134.1	144.8	46.8	0	0	0	0	125.3
690	A	26.9	Very low	31.9	Very low	93 Å²	93	139.2 Å²	139.2	77%	0.769	76%	0.76	S	S	*	*			trans	67.8	139.8	139.8	0	0	0	0	0	119.2
691	D	22.9	Very low	32	Very low	153 Å²	153	137.9 Å²	137.9	82%	0.818	76%	0.756	S	S	*	*				-158.4	-174.6	61.4	-135.7	-34.6	0	0	0	116.1
692	F	26.8	Very low	32.1	Very low	184 Å²	184	136.8 Å²	136.8	81%	0.807	76%	0.756	S	S	*	*			trans	-82.1	150.1	-172	-79.2	-114.9	0	0	0	117
693	S	24.2	Very low	31.3	Very low	115 Å²	115	137.8 Å²	137.8	80%	0.804	77%	0.765	S	S	*	*				158.3	155.2	114.1	-72.7	0	0	0	0	118
694	A	27.1	Very low	31.3	Very low	97 Å²	97	139.8 Å²	139.8	80%	0.802	78%	0.78	S	S	*	*			trans	76.4	121	148.4	0	0	0	0	0	123.8
695	P	39.8	Very low	31.2	Very low	121 Å²	121	136 Å²	136	79%	0.786	79%	0.785	S	S	*	*			trans	-122.7	-163.9	153.9	42.8	-31.3	0	0	0	111.5
696	P	57.8	Low	31.2	Very low	119 Å²	119	129.8 Å²	129.8	77%	0.773	78%	0.776	S	S	*	*			cis	-107.5	-147.1	-44.8	41.1	-24	0	0	0	109.4
697	P	48.9	Very low	31.1	Very low	105 Å²	105	129 Å²	129	68%	0.682	78%	0.778	S	S	*	*			cis	-148.4	155.4	49.2	40.9	-19.4	0	0	0	119.7
698	L	33.7	Very low	31.8	Very low	163 Å²	163	126.8 Å²	126.8	85%	0.853	78%	0.78	S	S	*	*			trans	49.1	163.6	141.1	-61.9	171.4	0	0	0	122.7
699	P	45.1	Very low	31.2	Very low	108 Å²	108	128.9 Å²	128.9	70%	0.701	79%	0.794	S	S	*	*			cis	-122.2	172.8	-41.1	36.9	-20	0	0	0	110.8
700	Q	26.5	Very low	31.2	Very low	187 Å²	187	127.7 Å²	127.7	87%	0.874	79%	0.791	S	S	*	*				-153.9	145.2	60.1	-75.4	-175.3	-35.9	0	0	115.2
701	S	29.7	Very low	31.4	Very low	97 Å²	97	131.9 Å²	131.9	68%	0.678	79%	0.794	S	S	*	*			trans	-70	167.8	168.6	51.7	0	0	0	0	114.3
702	D	26.7	Very low	31.7	Very low	148 Å²	148	129.7 Å²	129.7	79%	0.791	79%	0.791	S	S	*	*			cis	-174.6	-179.2	-15.7	-105.2	-53.7	0	0	0	109.4
703	S	26.7	Very low	32.1	Very low	109 Å²	109	130.2 Å²	130.2	76%	0.762	80%	0.796	S	S	*	*			trans	109.8	85.8	148.2	-49.2	0	0	0	0	118.9
704	L	28.9	Very low	32.3	Very low	182 Å²	182	129.6 Å²	129.6	95%	0.953	80%	0.797	S	S	*	*				-2.2	140.5	125.1	-62.6	162	0	0	0	117.7
705	G	25.4	Very low	32.5	Very low	80 Å²	80	132.4 Å²	132.4	83%	0.825	79%	0.794	S	S	*	*			trans	-175.5	60.9	172.9	0	0	0	0	0	120.1
706	G	23	Very low	32	Very low	63 Å²	63	131.9 Å²	131.9	65%	0.649	79%	0.789	S	S	*	*			trans	53.3	124.1	139.5	0	0	0	0	0	124.4
707	F	22.6	Very low	30.6	Very low	212 Å²	212	131.5 Å²	131.5	93%	0.93	78%	0.784	S	S	*	*			trans	70.5	157.7	141	-64.9	-77.3	0	0	0	122.1
708	S	36.3	Very low	29.5	Very low	114 Å²	114	134.9 Å²	134.9	80%	0.797	79%	0.791	S	S	*	*			trans	-80.5	157.5	-174.7	-34.2	0	0	0	0	114.1
709	P	31.7	Very low	29.3	Very low	130 Å²	130	131.6 Å²	131.6	84%	0.844	78%	0.781	S	S	*	*			trans	-115.3	174.1	152.5	37.8	-29.2	0	0	0	112.8
710	S	25.1	Very low	28.4	Very low	101 Å²	101	135.5 Å²	135.5	71%	0.706	79%	0.79	S	S	*	*			trans	-153.6	163.7	-177.7	61.2	0	0	0	0	112.9
711	H	30.7	Very low	28.5	Very low	181 Å²	181	130.9 Å²	130.9	84%	0.838	78%	0.779	S	S	*	*			trans	71.9	164.8	159	-75	-67	0	0	0	122.1
712	S	29.4	Very low	28.4	Very low	108 Å²	108	137 Å²	137	76%	0.755	79%	0.787	S	S	*	*			trans	71.7	143.4	167.2	75	0	0	0	0	119
713	H	33.8	Very low	28.2	Very low	195 Å²	195	135.2 Å²	135.2	90%	0.903	79%	0.785	S	S	*	*			cis	77.2	117.1	23.9	-80.1	-81.3	0	0	0	117.7
714	A	30.3	Very low	28	Very low	102 Å²	102	136.3 Å²	136.3	84%	0.843	79%	0.792	S	S	*	*			trans	-164.8	161	158.7	0	0	0	0	0	111.3
715	E	30.5	Very low	27.7	Very low	155 Å²	155	131.6 Å²	131.6	72%	0.724	79%	0.786	S	S	*	*			cis	-114	-95.5	-10.6	-174.5	-157.1	108.2	0	0	110.1	T717	E715-T717 WeakPolarHBondContact OE1-CA 3.32Å
716	T	29.5	Very low	27.7	Very low	111 Å²	111	132.6 Å²	132.6	68%	0.681	79%	0.787	S	S	*	*			cis	-164.7	144.3	-9.3	-11.2	0	0	0	0	106.3
717	T	28.3	Very low	27.8	Very low	110 Å²	110	133.5 Å²	133.5	68%	0.675	79%	0.788	S	S	*	*			cis	-158.7	143.4	1.3	-22	0	0	0	0	109.8	E715	E715-T717 WeakPolarHBondContact OE1-CA 3.32Å
718	Q	26.6	Very low	27.9	Very low	176 Å²	176	133.8 Å²	133.8	82%	0.822	79%	0.789	S	S	*	*			trans	-177.9	105.3	147.6	-100.6	-174	16.5	0	0	109.1
719	S	27.6	Very low	27.3	Very low	94 Å²	94	131.4 Å²	131.4	66%	0.657	78%	0.783	S	S	*	*				65.1	123.3	87.8	73.3	0	0	0	0	114.7
720	Q	27.1	Very low	27.1	Very low	190 Å²	190	133.6 Å²	133.6	89%	0.888	78%	0.782	S	S	*	*			cis	-151.4	174.9	-2.4	-88.1	175.5	8.3	0	0	106.7
721	S	27.9	Very low	27.3	Very low	91 Å²	91	137.6 Å²	137.6	64%	0.636	79%	0.787	S	S	*	*			cis	-171.8	168.9	38.5	74.5	0	0	0	0	114.3
722	R	27.9	Very low	28.5	Very low	224 Å²	224	134.2 Å²	134.2	85%	0.845	78%	0.781	S	S	*	*			trans	78	105.3	152.7	-69.8	177.8	-176	-161.4	0.5	122.4
723	C	22.7	Very low	28.3	Very low	111 Å²	111	134.6 Å²	134.6	75%	0.75	78%	0.784	S	S	*	*				83.1	103.6	123.5	-59.9	0	0	0	0	122.5
724	C	23.8	Very low	28.3	Very low	133 Å²	133	130 Å²	130	90%	0.899	78%	0.779	S	S	*	*				48.3	118.7	122.2	-51.6	0	0	0	0	121.4
725	G	22.3	Very low	28.2	Very low	82 Å²	82	129.1 Å²	129.1	85%	0.845	78%	0.78	S	S	*	*			trans	-178	156.3	162.6	0	0	0	0	0	111.4
726	A	25.5	Very low	28.1	Very low	101 Å²	101	125 Å²	125	84%	0.835	78%	0.78	S	S	*	*			trans	-147	150.5	-173.8	0	0	0	0	0	114.9
727	A	25.3	Very low	28.1	Very low	82 Å²	82	128.9 Å²	128.9	68%	0.678	80%	0.795	S	S	*	*			trans	64.9	157	153.5	0	0	0	0	0	121
728	F	24.4	Very low	28.1	Very low	218 Å²	218	126.8 Å²	126.8	96%	0.956	80%	0.795	S	S	*	*			trans	60.2	156.9	174.7	-63	-84.9	0	0	0	116.3
729	G	23	Very low	28.2	Very low	64 Å²	64	123.8 Å²	123.8	66%	0.66	79%	0.794	S	S	*	*			cis	145.5	123.8	-6.2	0	0	0	0	0	112.9
730	Q	27.7	Very low	28.2	Very low	176 Å²	176	127.8 Å²	127.8	82%	0.822	80%	0.802	S	S	*	*			trans	78.2	145.5	163.9	-75.1	-159.5	24.9	0	0	123.2
731	K	28.5	Very low	28.3	Very low	185 Å²	185	125.9 Å²	125.9	80%	0.804	80%	0.797	S	S	*	*			trans	89.2	154.1	145.7	-82.7	-171	177.1	-176.8	0	121.1
732	P	55.6	Low	28.2	Very low	111 Å²	111	127.9 Å²	127.9	72%	0.721	81%	0.806	S	S	*	*			trans	-142.4	-178.1	-137	44.8	-25.3	0	0	0	116.9
733	S	27	Very low	28	Very low	116 Å²	116	123.4 Å²	123.4	81%	0.811	81%	0.809	S	S	*	*			trans	-171.8	145.1	140.9	-77.1	0	0	0	0	108.8
734	A	33.5	Very low	28	Very low	97 Å²	97	121.5 Å²	121.5	80%	0.802	81%	0.808	S	S	*	*			cis	101.6	127.2	13.6	0	0	0	0	0	115.9
735	G	28.6	Very low	28.2	Very low	85 Å²	85	121.1 Å²	121.1	88%	0.876	81%	0.807	S	S	*	*			trans	88	146.4	179.2	0	0	0	0	0	114.5
736	G	28.4	Very low	28.4	Very low	69 Å²	69	121.5 Å²	121.5	71%	0.711	80%	0.797	S	S	*	*			cis	-175.8	132.2	-7.7	0	0	0	0	0	109.2
737	L	29.3	Very low	28.4	Very low	191 Å²	191	127.7 Å²	127.7	100%	1	80%	0.799	S	S	*	*				72.3	116.9	85.7	-100	168.4	0	0	0	116.2
738	G	26.6	Very low	28.4	Very low	66 Å²	66	129 Å²	129	68%	0.68	80%	0.803	S	S	*	*			trans	150	118.2	171.6	0	0	0	0	0	110.8
739	S	29.6	Very low	28.4	Very low	113 Å²	113	122.1 Å²	122.1	79%	0.79	79%	0.793	S	S	*	*			cis	77.1	134.7	46.3	-171.2	0	0	0	0	112.8
740	Q	26.6	Very low	28.7	Very low	179 Å²	179	127.8 Å²	127.8	84%	0.836	81%	0.807	S	S	*	*			cis	-165.3	176.1	-16	177.5	165.5	-13.9	0	0	107.6
741	L	30.8	Very low	28.7	Very low	150 Å²	150	123.9 Å²	123.9	79%	0.785	81%	0.806	S	S	*	*			trans	-76.3	160.4	-170.9	-68.2	84	0	0	0	116.1
742	T	25.9	Very low	28.6	Very low	133 Å²	133	118.2 Å²	118.2	82%	0.816	80%	0.799	S	S	*	*			trans	111.5	146.9	145.7	70.8	0	0	0	0	119.7
743	S	23.5	Very low	27.3	Very low	129 Å²	129	122.2 Å²	122.2	90%	0.902	81%	0.806	S	S	*	*			trans	64	146.8	177.9	-71	0	0	0	0	118.1
744	G	22.6	Very low	27.3	Very low	72 Å²	72	125.6 Å²	125.6	74%	0.742	81%	0.806	S	S	*	*			cis	161.9	125.7	-10.2	0	0	0	0	0	113.7
745	S	27.8	Very low	27	Very low	124 Å²	124	126.3 Å²	126.3	87%	0.867	80%	0.801	S	S	*	*			trans	176.8	161	176.4	42.4	0	0	0	0	110.7
746	S	25.4	Very low	28.1	Very low	91 Å²	91	127.2 Å²	127.2	64%	0.636	79%	0.791	S	S	*	*			cis	-164.3	135.3	-30	-166.8	0	0	0	0	110.9
747	W	26.2	Very low	28.3	Very low	230 Å²	230	134.1 Å²	134.1	87%	0.871	80%	0.796	S	S	*	*			trans	55.4	142	143.8	-74.2	45.5	0	0	0	123.1
748	S	25.3	Very low	28.6	Very low	110 Å²	110	131.6 Å²	131.6	77%	0.769	78%	0.783	S	S	*	*			trans	44.7	137.4	142.4	-51.7	0	0	0	0	122
749	G	24.7	Very low	28.8	Very low	73 Å²	73	135.1 Å²	135.1	75%	0.753	78%	0.784	S	S	*	*			cis	129.4	110	-2.1	0	0	0	0	0	113.5
750	L	28.5	Very low	28.9	Very low	183 Å²	183	138 Å²	138	96%	0.958	78%	0.783	S	S	*	*			trans	-169	177	161.3	-108.4	166.5	0	0	0	110.7
751	A	29.4	Very low	29	Very low	95 Å²	95	138.4 Å²	138.4	79%	0.785	78%	0.781	S	S	*	*			trans	-73.5	162.2	-170.7	0	0	0	0	0	115
752	G	25.8	Very low	28.9	Very low	65 Å²	65	136 Å²	136	67%	0.67	77%	0.773	S	S	*	*			cis	168	-161.9	-2.8	0	0	0	0	0	113.7
753	F	28.6	Very low	28.9	Very low	196 Å²	196	137.9 Å²	137.9	86%	0.86	78%	0.777	S	S	*	*			trans	81.6	132.9	169.1	-72	-78.4	0	0	0	122.7
754	F	25.7	Very low	29	Very low	187 Å²	187	135.6 Å²	135.6	82%	0.82	77%	0.774	S	S	*	*			trans	73.3	158.1	157.1	-80.6	-71	0	0	0	124.3
755	T	28.7	Very low	29.1	Very low	111 Å²	111	140 Å²	140	68%	0.681	78%	0.78	S	S	*	*			trans	-125.9	-175.2	-163.3	48.2	0	0	0	0	109.7
756	P	51.5	Low	28.9	Very low	104 Å²	104	144.8 Å²	144.8	68%	0.675	78%	0.779	S	S	*	*			cis	-115.3	156.3	-3.1	4.3	22.8	0	0	0	114.6
757	R	32.6	Very low	28.7	Very low	215 Å²	215	147.2 Å²	147.2	81%	0.811	79%	0.79	S	S	*	*				65.1	145.4	80.3	-56.4	-171.3	161.5	-175.3	-2.7	114.7
758	L	34.8	Very low	28.6	Very low	138 Å²	138	139.6 Å²	139.6	72%	0.723	78%	0.783	S	S	*	*			cis	-166.3	166.2	-0.9	-130.6	59	0	0	0	107.1
759	I	31.6	Very low	28.6	Very low	140 Å²	140	144 Å²	144	72%	0.718	79%	0.789	S	S	*	*			cis	-148.1	162.1	-8.7	-151.8	164.5	0	0	0	110.3
760	K	30.9	Very low	28.6	Very low	174 Å²	174	146.7 Å²	146.7	76%	0.757	79%	0.791	S	S	*	*			trans	-125.5	143.3	166.5	164	-175.9	175.1	179.3	0	109.1
761	K	29	Very low	28.5	Very low	186 Å²	186	141.7 Å²	141.7	81%	0.809	78%	0.775	S	S	*	*			trans	175.5	157.7	157.1	-99.4	155.2	178.8	-168.4	0	109.8
762	T	28.3	Very low	28.4	Very low	100 Å²	100	142.3 Å²	142.3	61%	0.613	77%	0.774	S	S	*	*				179.1	161.1	-55.6	32.7	0	0	0	0	107.8
763	L	26.6	Very low	28.4	Very low	173 Å²	173	143.9 Å²	143.9	91%	0.906	78%	0.775	S	S	*	*			trans	-33.2	149.9	174.8	-69.9	64.8	0	0	0	117.1
764	G	25.1	Very low	28.4	Very low	81 Å²	81	140.7 Å²	140.7	84%	0.835	77%	0.767	S	S	*	*			trans	178.7	118.8	160.5	0	0	0	0	0	114.5
765	L	24.9	Very low	28.5	Very low	165 Å²	165	140.9 Å²	140.9	86%	0.864	77%	0.77	S	S	*	*			trans	-91	149.8	-172.8	-81.8	156.2	0	0	0	115.2
766	R	23	Very low	28.4	Very low	224 Å²	224	140.6 Å²	140.6	85%	0.845	77%	0.773	S	S	*	*			trans	85	135.6	139.8	-86.8	-178.9	173.7	-179.4	-1.5	124.2
767	T	22.5	Very low	27.2	Very low	141 Å²	141	138.7 Å²	138.7	87%	0.865	77%	0.772	S	S	*	*			trans	89.9	135.8	138.1	42.5	0	0	0	0	123.8
768	G	24.3	Very low	27	Very low	71 Å²	71	136.4 Å²	136.4	73%	0.732	77%	0.774	S	S	*	*			trans	102.9	109.8	-178.1	0	0	0	0	0	112.2
769	K	25	Very low	26.6	Very low	203 Å²	203	136.5 Å²	136.5	88%	0.883	78%	0.78	S	S	*	*			cis	66.7	112.6	21.5	-130.8	-174.1	-178.9	-177.3	0	110.9
770	T	25.1	Very low	26.3	Very low	129 Å²	129	133.6 Å²	133.6	79%	0.791	79%	0.785	S	S	*	*			cis	-159.6	169.7	48.1	36.8	0	0	0	0	111
771	A	26	Very low	26	Very low	77 Å²	77	129 Å²	129	64%	0.636	79%	0.786	S	S	*	*			cis	-171	170.3	-16.3	0	0	0	0	0	109.7
772	S	26.3	Very low	26.3	Very low	109 Å²	109	125.9 Å²	125.9	76%	0.762	79%	0.785	S	S	*	*			trans	51.5	138.6	148.7	55.7	0	0	0	0	121.2
773	S	27.1	Very low	26.5	Very low	98 Å²	98	130.5 Å²	130.5	69%	0.685	80%	0.796	S	S	*	*			cis	-168.5	168	-0.9	-103.6	0	0	0	0	110.1
774	D	26.7	Very low	26.8	Very low	129 Å²	129	128.2 Å²	128.2	69%	0.69	79%	0.792	S	S	*	*			cis	-119.2	-113.9	-1.4	-149.6	66.2	0	0	0	112.6
775	E	28.5	Very low	27.1	Very low	191 Å²	191	133.1 Å²	133.1	89%	0.893	79%	0.791	S	S	*	*			cis	-147	155.5	-2.5	-165.4	179.8	85.1	0	0	109.3
776	S	26.1	Very low	27.4	Very low	105 Å²	105	131 Å²	131	73%	0.734	79%	0.787	S	S	*	*			trans	-133.1	147.5	-163.5	54.5	0	0	0	0	115.2
777	G	26.8	Very low	27.6	Very low	64 Å²	64	131.4 Å²	131.4	66%	0.66	79%	0.788	S	S	*	*			cis	147.4	142.3	-17	0	0	0	0	0	115.9
778	I	28.3	Very low	28	Very low	167 Å²	167	129.5 Å²	129.5	86%	0.856	78%	0.781	S	S	*	*			trans	65.7	147.4	159.5	-20.2	-173.3	0	0	0	113.3
779	V	27.6	Very low	28.2	Very low	140 Å²	140	132.8 Å²	132.8	85%	0.848	78%	0.782	S	S	*	*			cis	-144.3	159.2	27.7	-169.3	0	0	0	0	110.9
780	G	25	Very low	28.4	Very low	79 Å²	79	128 Å²	128	81%	0.814	77%	0.774	S	S	*	*			trans	-104.9	173.2	-177.6	0	0	0	0	0	116.8
781	G	23.7	Very low	28.6	Very low	76 Å²	76	127.7 Å²	127.7	78%	0.784	77%	0.772	S	S	*	*			trans	-175.8	166.3	176.7	0	0	0	0	0	111.8
782	P	35.2	Very low	28.9	Very low	121 Å²	121	129.4 Å²	129.4	79%	0.786	78%	0.779	S	S	*	*			trans	-118.6	145.2	-156.7	38.6	-28.5	0	0	0	118.4
783	K	33.3	Very low	29	Very low	197 Å²	197	129.8 Å²	129.8	86%	0.857	78%	0.782	S	S	*	*			trans	62.3	151.6	155.9	-72.3	-179.1	179.1	177.8	0	117.2
784	P	33.2	Very low	28.9	Very low	126 Å²	126	134.1 Å²	134.1	82%	0.818	79%	0.794	S	S	*	*			cis	-143.5	-160.2	40.4	42.2	-20	0	0	0	117.2
785	F	30.4	Very low	29	Very low	184 Å²	184	133.7 Å²	133.7	81%	0.807	80%	0.801	S	S	*	*			trans	-81.3	164.2	-176.5	-72.9	-92.7	0	0	0	115.1
786	P	31.9	Very low	29.1	Very low	120 Å²	120	130.8 Å²	130.8	78%	0.779	80%	0.801	S	S	*	*				-131.4	161.8	91.7	39	-30.3	0	0	0	112.5
787	R	27.4	Very low	29.2	Very low	232 Å²	232	129 Å²	129	88%	0.875	80%	0.8	S	S	*	*			cis	90.3	130.3	18.7	-139.3	-174.6	-157.4	-164.5	7.3	116.7
788	S	29.3	Very low	29.5	Very low	101 Å²	101	133.8 Å²	133.8	71%	0.706	81%	0.81	S	S	*	*			trans	-178.8	167	166.1	-81.1	0	0	0	0	108.2
789	N	29.5	Very low	30.3	Very low	140 Å²	140	131.7 Å²	131.7	75%	0.749	81%	0.807	S	S	*	*			cis	-171.7	142.7	-37.8	-95.1	-10.5	0	0	0	106.2
790	S	29.5	Very low	30.3	Very low	103 Å²	103	131.7 Å²	131.7	72%	0.72	80%	0.802	S	S	*	*			cis	-126	-78.6	-7.3	-67.9	0	0	0	0	110.5
791	T	29.9	Very low	30.6	Very low	122 Å²	122	135 Å²	135	75%	0.748	80%	0.801	S	S	*	*			cis	-162.5	137	-22.4	-29	0	0	0	0	107.1
792	S	30.9	Very low	30.9	Very low	113 Å²	113	137.6 Å²	137.6	79%	0.79	79%	0.792	S	S	*	*			cis	-155.9	144.3	-29.8	51	0	0	0	0	109.7
793	S	27.9	Very low	30.6	Very low	117 Å²	117	141.2 Å²	141.2	82%	0.818	79%	0.79	S	S	*	*			trans	-115.3	172.9	171.5	51	0	0	0	0	111.1
794	M	26.6	Very low	30.3	Very low	190 Å²	190	140.6 Å²	140.6	94%	0.936	79%	0.793	S	S	*	*			trans	-134.5	138.4	-179.9	-86.4	-71.7	169.9	0	0	112.2
795	S	28.7	Very low	30	Very low	119 Å²	119	138.9 Å²	138.9	83%	0.832	79%	0.789	S	S	*	*			trans	-157.9	150.4	167	61.1	0	0	0	0	110.1
796	S	31	Very low	29.8	Very low	130 Å²	130	137.5 Å²	137.5	91%	0.909	79%	0.789	S	S	*	*			trans	-169	166.3	170.6	58.1	0	0	0	0	110.3
797	G	27	Very low	29.6	Very low	69 Å²	69	137.5 Å²	137.5	71%	0.711	79%	0.787	S	S	*	*			trans	-169.5	133	170.7	0	0	0	0	0	114.7
798	L	32.9	Very low	30	Very low	164 Å²	164	134.5 Å²	134.5	86%	0.859	79%	0.787	S	S	*	*			trans	65.2	156.4	160.8	-74.1	171.7	0	0	0	117.4
799	P	45.3	Very low	30.4	Very low	122 Å²	122	135.2 Å²	135.2	79%	0.792	79%	0.789	S	S	*	*			cis	-125.8	-171.3	27.6	42.2	-26.2	0	0	0	117.9
800	D	28.4	Very low	30.3	Very low	141 Å²	141	138.5 Å²	138.5	75%	0.754	79%	0.792	S	S	*	*			trans	-59.6	151.9	-173.3	-77.6	-69.1	0	0	0	118.3
801	L	30.1	Very low	30.1	Very low	149 Å²	149	140.4 Å²	140.4	78%	0.78	79%	0.793	S	S	*	*				-167.9	139.7	103.6	-143.5	75.8	0	0	0	115.7
802	E	30.8	Very low	30	Very low	130 Å²	130	144.7 Å²	144.7	61%	0.607	80%	0.796	S	S	*	*			trans	65.8	125.5	148.9	-92.4	-170.1	158.9	0	0	125.3
803	R	28.3	Very low	29.8	Very low	196 Å²	196	145 Å²	145	74%	0.74	80%	0.799	S	S	*	*			trans	50.8	124.4	132.5	-71.9	171.8	162.1	102.9	4.7	118.6
804	M	27.5	Very low	29.7	Very low	185 Å²	185	144.1 Å²	144.1	91%	0.911	80%	0.798	S	S	*	*				-160.7	172.3	50.4	-118.1	155.6	-174.2	0	0	112.9
805	A	26	Very low	29.9	Very low	89 Å²	89	144.4 Å²	144.4	74%	0.736	79%	0.794	S	S	*	*			trans	-97.3	172	-176	0	0	0	0	0	114.1
806	L	27.2	Very low	30.9	Very low	156 Å²	156	144.4 Å²	144.4	82%	0.817	79%	0.791	S	S	*	*				178.2	113.1	125.3	-93.2	165.5	0	0	0	115
807	T	28.3	Very low	31.8	Very low	120 Å²	120	143 Å²	143	74%	0.736	78%	0.779	S	S	*	*			trans	39.5	128.5	135.6	56.5	0	0	0	0	124
808	L	35.5	Very low	31.8	Very low	168 Å²	168	147 Å²	147	88%	0.88	78%	0.784	S	S	*	*			trans	-61.8	152.3	146.9	-65.6	165.8	0	0	0	111.3
809	P	36.8	Very low	31.6	Very low	116 Å²	116	147.8 Å²	147.8	75%	0.753	78%	0.783	S	S	*	*				-154.5	127.2	102.3	35.5	-15.7	0	0	0	118.4
810	R	28.3	Very low	30.7	Very low	210 Å²	210	153 Å²	153	79%	0.792	79%	0.786	S	S	*	*				40.1	102.5	116.2	-169.2	-164.4	-159.7	103.9	-6.8	120.4
811	N	25.8	Very low	30.7	Very low	142 Å²	142	153 Å²	153	76%	0.759	79%	0.792	S	S	*	*				-179	143.3	128.8	-89.5	-31	0	0	0	109
812	R	26.3	Very low	30.5	Very low	212 Å²	212	150.4 Å²	150.4	80%	0.8	79%	0.792	S	S	*	*			cis	90.2	141	35.2	-78.3	-168.8	166.6	-161.5	-3.2	114.8
813	S	26.1	Very low	30.2	Very low	121 Å²	121	149.1 Å²	149.1	85%	0.846	80%	0.797	S	S	*	*			trans	78.3	140.9	178.8	75.9	0	0	0	0	116.8
814	A	26	Very low	30.1	Very low	98 Å²	98	146.3 Å²	146.3	81%	0.81	80%	0.802	S	S	*	*			cis	-161.3	163.7	-18.3	0	0	0	0	0	113.9
815	K	31.9	Very low	29.9	Very low	195 Å²	195	143 Å²	143	85%	0.848	79%	0.793	S	S	*	*			trans	-104.8	-166.1	157.8	-65.8	-172.2	178.8	-174.5	0	108.5
816	P	49.4	Very low	30	Very low	120 Å²	120	143.4 Å²	143.4	78%	0.779	79%	0.79	S	S	*	*			cis	-107.6	-92.7	-22.8	17.7	6.9	0	0	0	112.2
817	P	49.5	Very low	30	Very low	101 Å²	101	144.2 Å²	144.2	66%	0.656	79%	0.789	S	S	*	*			cis	-120.8	168.5	-0.7	42.7	-29.3	0	0	0	116.3
818	L	28	Very low	30.8	Very low	153 Å²	153	143.1 Å²	143.1	80%	0.801	78%	0.784	S	S	*	*			trans	62.5	156.5	156.1	-98.2	64.1	0	0	0	118.8
819	E	27.8	Very low	30.3	Very low	180 Å²	180	141.9 Å²	141.9	84%	0.841	77%	0.774	S	S	*	*			cis	-121.1	-163.8	3.8	-80	-145.2	110.9	0	0	114.1
820	R	27.3	Very low	29.9	Very low	230 Å²	230	143.1 Å²	143.1	87%	0.868	78%	0.775	S	S	*	*			trans	-140.7	174.6	-169.1	-165.9	178.4	-173.3	141.3	0.5	110.1
821	T	27.9	Very low	29.8	Very low	141 Å²	141	136.5 Å²	136.5	87%	0.865	77%	0.772	S	S	*	*			trans	81.7	153.3	-179.3	78.8	0	0	0	0	113.7
822	A	25.7	Very low	29.7	Very low	95 Å²	95	134.7 Å²	134.7	79%	0.785	78%	0.777	S	S	*	*			cis	-120.4	-179.1	6.4	0	0	0	0	0	113.8
823	S	25.4	Very low	29.7	Very low	103 Å²	103	129.4 Å²	129.4	72%	0.72	78%	0.778	S	S	*	*			trans	-118	-176.7	178.8	-56.9	0	0	0	0	110.5
824	T	25.3	Very low	29.6	Very low	137 Å²	137	135 Å²	135	84%	0.84	78%	0.781	S	S	*	*			trans	75.5	167.9	163.6	79.8	0	0	0	0	117
825	T	24.5	Very low	30.2	Very low	117 Å²	117	135.6 Å²	135.6	72%	0.718	78%	0.776	S	S	*	*			cis	-172.5	161.6	-45.3	-167.7	0	0	0	0	109.3
826	S	26.8	Very low	29.8	Very low	96 Å²	96	131.3 Å²	131.3	67%	0.671	77%	0.771	S	S	*	*			trans	59.8	166.5	166.5	62.4	0	0	0	0	116.3
827	Q	28.3	Very low	28.6	Very low	173 Å²	173	133.5 Å²	133.5	81%	0.808	77%	0.771	S	S	*	*			cis	62.1	165.3	31.3	-82.3	-150	-7.7	0	0	114.4
828	P	44.5	Very low	27.5	Very low	97 Å²	97	135.8 Å²	135.8	63%	0.63	78%	0.777	S	S	*	*			cis	-96.6	-144.4	-10.3	17.5	6.1	0	0	0	109.5
829	E	25.5	Very low	27.5	Very low	142 Å²	142	135.1 Å²	135.1	66%	0.664	77%	0.774	S	S	*	*			cis	-135.8	167.2	4.1	-81.2	-76.3	100.8	0	0	107.6
830	N	26.9	Very low	27.6	Very low	143 Å²	143	132 Å²	132	77%	0.765	76%	0.763	S	S	*	*			cis	78.9	148.4	27.2	-170	44.3	0	0	0	114.1
831	G	26.4	Very low	27.9	Very low	71 Å²	71	130.8 Å²	130.8	73%	0.732	76%	0.758	S	S	*	*			trans	130.8	106.8	-179.9	0	0	0	0	0	116.1
832	A	24.6	Very low	28.1	Very low	104 Å²	104	131.6 Å²	131.6	86%	0.86	75%	0.745	S	S	*	*			trans	-94	157.3	-169.4	0	0	0	0	0	116.2
833	A	25.2	Very low	28.4	Very low	101 Å²	101	134.5 Å²	134.5	84%	0.835	74%	0.744	S	S	*	*			trans	-157.5	154.5	143.5	0	0	0	0	0	112.4
834	R	24.9	Very low	28.5	Very low	238 Å²	238	133.4 Å²	133.4	90%	0.898	73%	0.73	S	S	*	*			trans	-110.4	-176.6	164	-54.1	177.1	170.6	176.5	-4.1	107.7
835	P	38.7	Very low	28.7	Very low	111 Å²	111	134.2 Å²	134.2	72%	0.721	72%	0.724	S	S	*	*			cis	-138.4	-167.6	-3.3	43.8	-25.3	0	0	0	115
836	S	24.1	Very low	28.9	Very low	104 Å²	104	131.6 Å²	131.6	73%	0.727	72%	0.721	S	S	*	*			trans	68.7	120.9	146.3	-59.4	0	0	0	0	123.6
837	E	22.7	Very low	29.1	Very low	167 Å²	167	133.5 Å²	133.5	78%	0.78	73%	0.728	S	S	*	*			trans	31.3	117.8	134.6	-58.1	-172.8	120.6	0	0	122.6
838	N	27.6	Very low	29.2	Very low	149 Å²	149	129.5 Å²	129.5	80%	0.797	73%	0.725	S	S	*	*				163.6	116	124.5	-88.5	-64.5	0	0	0	107.1
839	L	27.5	Very low	28.5	Very low	139 Å²	139	132.9 Å²	132.9	73%	0.728	73%	0.733	S	S	*	*			cis	78.4	136.6	31.3	-133.7	177.1	0	0	0	113.3
840	L	30.8	Very low	28.7	Very low	115 Å²	115	133.3 Å²	133.3	60%	0.602	74%	0.738	S	S	*	*			trans	86.2	141	175	-51.9	173.5	0	0	0	115.6
841	R	32.2	Very low	28.9	Very low	203 Å²	203	137.5 Å²	137.5	77%	0.766	74%	0.743	S	S	*	*			cis	-159.2	151.7	4	-141.2	160.8	177.2	125.3	4.2	113.8
842	R	33.3	Very low	28.9	Very low	159 Å²	159	141.4 Å²	141.4	60%	0.6	75%	0.747	S	S	*	*			cis	-124.4	-77.2	-41.6	179	-174.6	175.2	-142.1	-8.9	110	D844 E845	R842-D844 WeakPolarHBondContact CD-OD1 3.22Å; R842-D844 WeakPolarHBondContact CG-OD1 3.31Å; R842-D844 VanDerWaalsContact CZ-CG 3.47Å; R842-D844 IonicContact CZ-OD1 2.74Å; R842-D844 IonicContact CZ-OD2 3.73Å; R842-D844 IonicContact NE-OD1 3.42Å; R842-D844 PolarHBondContact NE-OD1 2.84Å; R842-D844 IonicContact NE-OD2 3.58Å; R842-D844 IonicContact NH1-OD1 2.68Å; R842-D844 PolarHBondContact NH1-OD1 3.14Å; R842-D844 IonicContact NH1-OD2 3.53Å; R842-D844 PolarHBondContact NH1-OD2 3.4Å; R842-D844 IonicContact NH2-OD1 3.56Å; R842-D844 PolarHBondContact NH2-OD1 3.23Å; R842-E845 IonicContact CZ-OE2 3.48Å; R842-E845 IonicContact NH1-OE2 2.83Å; R842-E845 PolarHBondContact NH1-OE2 2.96Å; R842-E845 IonicContact NH2-OE1 2.7Å; R842-E845 IonicContact NH2-OE2 3.87Å; R842-E845 PolarHBondContact NH2-OE2 3.27Å
843	M	31	Very low	29.3	Very low	155 Å²	155	146 Å²	146	76%	0.764	74%	0.742	S	S	*	*			cis	-168.2	139.6	-33.7	-149.4	155.3	-178.1	0	0	109.9
844	D	28.1	Very low	29.9	Very low	81 Å²	81	146.7 Å²	146.7	43%	0.433	74%	0.738	S	S	.	*			cis	-149	135.2	-31.2	-100.5	-5.7	0	0	0	109	R842	R842-D844 WeakPolarHBondContact CD-OD1 3.22Å; R842-D844 WeakPolarHBondContact CG-OD1 3.31Å; R842-D844 VanDerWaalsContact CZ-CG 3.47Å; R842-D844 IonicContact CZ-OD1 2.74Å; R842-D844 IonicContact CZ-OD2 3.73Å; R842-D844 IonicContact NE-OD1 3.42Å; R842-D844 PolarHBondContact NE-OD1 2.84Å; R842-D844 IonicContact NE-OD2 3.58Å; R842-D844 IonicContact NH1-OD1 2.68Å; R842-D844 PolarHBondContact NH1-OD1 3.14Å; R842-D844 IonicContact NH1-OD2 3.53Å; R842-D844 PolarHBondContact NH1-OD2 3.4Å; R842-D844 IonicContact NH2-OD1 3.56Å; R842-D844 PolarHBondContact NH2-OD1 3.23Å
845	E	29.2	Very low	30.2	Very low	153 Å²	153	143.9 Å²	143.9	72%	0.715	73%	0.732	S	S	*	*				75.2	135.1	91.2	-162.9	168	-162.2	0	0	114.2	R842	R842-E845 IonicContact CZ-OE2 3.48Å; R842-E845 IonicContact NH1-OE2 2.83Å; R842-E845 PolarHBondContact NH1-OE2 2.96Å; R842-E845 IonicContact NH2-OE1 2.7Å; R842-E845 IonicContact NH2-OE2 3.87Å; R842-E845 PolarHBondContact NH2-OE2 3.27Å
846	G	28.6	Very low	29.6	Very low	62 Å²	62	143.3 Å²	143.3	64%	0.639	74%	0.737	S	S	*	*			cis	-145.5	-153.3	0.4	0	0	0	0	0	111.4
847	T	30.1	Very low	29.8	Very low	136 Å²	136	147.3 Å²	147.3	83%	0.834	74%	0.741	S	S	*	*			cis	-162.9	160	17.5	-52.7	0	0	0	0	110.6
848	A	31	Very low	30	Very low	90 Å²	90	147.7 Å²	147.7	74%	0.744	75%	0.748	S	S	*	*			trans	71.5	156.4	158.9	0	0	0	0	0	119.8
849	Q	29.5	Very low	30	Very low	168 Å²	168	147.5 Å²	147.5	79%	0.785	75%	0.746	S	S	*	*			cis	-166.1	176	-42.7	-137.5	-171	43.3	0	0	110.1
850	I	29.3	Very low	30.9	Very low	151 Å²	151	145.7 Å²	145.7	77%	0.774	74%	0.743	S	S	*	*			trans	76.7	144.7	161	-65.9	154.3	0	0	0	116.6
851	R	32.5	Very low	30.8	Very low	231 Å²	231	152 Å²	152	87%	0.872	76%	0.758	S	S	*	*			trans	-138.9	126.2	-169.7	159.7	-152.4	-161.7	170	7.2	104.6
852	D	26.9	Very low	30.6	Very low	152 Å²	152	145.5 Å²	145.5	81%	0.813	75%	0.754	S	S	*	*			trans	-161.7	159.3	157.3	-126.8	-30.8	0	0	0	117.2
853	R	31.7	Very low	30.4	Very low	202 Å²	202	144.4 Å²	144.4	76%	0.762	77%	0.765	S	S	*	*			trans	-157.4	119.4	159.3	-177.8	-166	-164.9	167	12.1	108.7
854	P	39.2	Very low	30.2	Very low	114 Å²	114	141.2 Å²	141.2	74%	0.74	76%	0.764	S	S	*	*			trans	-101.9	146.7	160.6	32.1	-26.9	0	0	0	112.8
855	K	29.5	Very low	30.2	Very low	179 Å²	179	144.7 Å²	144.7	78%	0.778	79%	0.787	S	S	*	*			trans	-111.4	133.2	153.6	-76.8	-178.3	176.6	178.9	0	107.7
856	A	26.1	Very low	30	Very low	99 Å²	99	140.1 Å²	140.1	82%	0.818	78%	0.782	S	S	*	*			trans	-144.6	130.8	153	0	0	0	0	0	105.7
857	K	29.2	Very low	29.9	Very low	189 Å²	189	143.6 Å²	143.6	82%	0.822	79%	0.79	S	S	*	*			cis	72.8	88.7	18.5	-131.5	-171.1	-172.5	-168.7	0	114.1
858	L	26.7	Very low	29.7	Very low	175 Å²	175	148.4 Å²	148.4	92%	0.916	79%	0.793	S	S	*	*			trans	-126.4	157.6	152	-96.4	167.2	0	0	0	109.1
859	L	28.6	Very low	29.8	Very low	145 Å²	145	148 Å²	148	76%	0.759	79%	0.79	S	S	*	*			trans	-118.2	-163.6	-178	-60.3	165.4	0	0	0	107.3
860	P	45.3	Very low	30.5	Very low	101 Å²	101	146.4 Å²	146.4	66%	0.656	79%	0.794	S	S	*	*			cis	-137.1	-173.5	-10.6	38.1	-18.5	0	0	0	115.1
861	R	29.7	Very low	30.4	Very low	248 Å²	248	142.4 Å²	142.4	94%	0.936	79%	0.79	S	S	*	*			trans	69.4	145.4	160.6	-72.3	170.1	164.7	152.3	-6	117.6
862	G	28.1	Very low	30.3	Very low	65 Å²	65	138.9 Å²	138.9	67%	0.67	79%	0.794	S	S	*	*			cis	-179.1	176	-4.6	0	0	0	0	0	114.5
863	T	28.5	Very low	30.3	Very low	137 Å²	137	135.2 Å²	135.2	84%	0.84	79%	0.792	S	S	*	*			trans	-7.4	125.4	162.7	49.3	0	0	0	0	117.6
864	A	27.5	Very low	30.2	Very low	88 Å²	88	129.3 Å²	129.3	73%	0.727	79%	0.793	S	S	*	*				77.1	142.5	61.2	0	0	0	0	0	114.7
865	V	27.6	Very low	29.7	Very low	153 Å²	153	132.5 Å²	132.5	93%	0.927	80%	0.798	S	S	*	*			trans	69.7	141.9	-171.1	-167.3	0	0	0	0	113.3
866	G	25.4	Very low	29.8	Very low	58 Å²	58	130.3 Å²	130.3	60%	0.598	80%	0.8	S	S	*	*			cis	146.1	126.4	-11.1	0	0	0	0	0	114.2
867	V	26	Very low	29.9	Very low	135 Å²	135	129.2 Å²	129.2	82%	0.818	80%	0.798	S	S	*	*			trans	58.7	110.1	159.8	-173.2	0	0	0	0	119
868	R	26.5	Very low	29.9	Very low	236 Å²	236	128.9 Å²	128.9	89%	0.891	80%	0.799	S	S	*	*				-168.1	151.8	107.5	-137.9	158.8	-78.6	-156.1	-5.8	113.8
869	A	32.5	Very low	30	Very low	83 Å²	83	125.9 Å²	125.9	69%	0.686	79%	0.793	S	S	*	*			trans	-96.4	-167.1	163.4	0	0	0	0	0	109.2
870	P	43.4	Very low	29.9	Very low	134 Å²	134	127 Å²	127	87%	0.87	80%	0.795	S	S	*	*			cis	-147.7	-166.4	39.6	43.3	-21	0	0	0	116.5
871	G	27.9	Very low	28.9	Very low	66 Å²	66	126.4 Å²	126.4	68%	0.68	79%	0.793	S	S	*	*			trans	98.2	110.6	170.2	0	0	0	0	0	113.2
872	V	29.7	Very low	28.8	Very low	158 Å²	158	121.9 Å²	121.9	96%	0.958	79%	0.786	S	S	*	*			cis	74.2	108.1	25.4	-168.1	0	0	0	0	114.5
873	G	27.9	Very low	28.9	Very low	75 Å²	75	123.7 Å²	123.7	77%	0.773	79%	0.788	S	S	*	*			trans	160.1	132.3	170.7	0	0	0	0	0	111.8
874	G	29.3	Very low	28.9	Very low	77 Å²	77	128.3 Å²	128.3	79%	0.794	79%	0.79	S	S	*	*			trans	-80.2	-165.5	167.5	0	0	0	0	0	111.3
875	E	29.3	Very low	29	Very low	181 Å²	181	130 Å²	130	85%	0.846	79%	0.792	S	S	*	*			cis	-165.1	158.5	-10.9	-124.8	-168.8	135.5	0	0	106.8
876	V	29.8	Very low	29.2	Very low	133 Å²	133	132.8 Å²	132.8	81%	0.806	79%	0.786	S	S	*	*			trans	29.5	116.8	157.4	-171	0	0	0	0	119.9
877	G	28.6	Very low	29.4	Very low	76 Å²	76	136.8 Å²	136.8	78%	0.784	79%	0.793	S	S	*	*			trans	-168.5	132.5	159.8	0	0	0	0	0	111.6
878	E	29.1	Very low	29.5	Very low	182 Å²	182	133.8 Å²	133.8	85%	0.85	79%	0.789	S	S	*	*			trans	-109.1	156.5	-170.4	-63.2	-174.7	101.8	0	0	114.6
879	S	30.1	Very low	29.7	Very low	113 Å²	113	133.9 Å²	133.9	79%	0.79	79%	0.79	S	S	*	*			trans	83.6	159.7	147.3	-62.9	0	0	0	0	122.2
880	E	24.9	Very low	29.6	Very low	169 Å²	169	137.1 Å²	137.1	79%	0.79	79%	0.791	S	S	*	*			trans	88	92	160.5	-64.2	-89.2	60.9	0	0	121
881	S	25.1	Very low	29	Very low	87 Å²	87	140.1 Å²	140.1	61%	0.608	79%	0.793	S	S	*	*				66.5	106.7	109.1	-58	0	0	0	0	123.5
882	L	27.3	Very low	29.1	Very low	154 Å²	154	140.7 Å²	140.7	81%	0.806	80%	0.8	S	S	*	*				72.8	101.1	127.4	-64.3	171.9	0	0	0	123
883	S	30.9	Very low	28.9	Very low	102 Å²	102	137.4 Å²	137.4	71%	0.713	80%	0.798	S	S	*	*				72.6	144.9	121.9	77.9	0	0	0	0	122.5
884	R	29.2	Very low	29	Very low	234 Å²	234	137.6 Å²	137.6	88%	0.883	80%	0.8	S	S	*	*			trans	175.6	153.8	130.8	-104.5	175.3	177.3	-173.1	-0.4	115.8
885	V	28.5	Very low	29.2	Very low	125 Å²	125	141.8 Å²	141.8	76%	0.758	80%	0.803	S	S	*	*			trans	74.2	135.8	142	160.6	0	0	0	0	117.6
886	R	31.2	Very low	29.4	Very low	211 Å²	211	139.4 Å²	139.4	80%	0.796	80%	0.796	S	S	*	*			cis	-158.9	179.9	2.7	-135.8	-177.8	167.8	171.1	-1.8	114.9
887	D	29.7	Very low	29.5	Very low	141 Å²	141	143 Å²	143	75%	0.754	80%	0.795	S	S	*	*			trans	78.5	137.1	155.7	-56.8	-25.6	0	0	0	120
888	G	29.2	Very low	29.7	Very low	72 Å²	72	146.7 Å²	146.7	74%	0.742	79%	0.792	S	S	*	*			cis	145.7	117.1	-18.8	0	0	0	0	0	116.2
889	R	30.6	Very low	29.9	Very low	238 Å²	238	144.4 Å²	144.4	90%	0.898	78%	0.781	S	S	*	*			trans	-166.6	156.6	155.2	-118.4	177.9	171.9	151.9	3.9	116
890	E	30.3	Very low	29.7	Very low	152 Å²	152	142.5 Å²	142.5	71%	0.71	77%	0.768	S	S	*	*			trans	-46.5	135.9	-173.5	-66	136.2	144	0	0	117.1
891	E	31.5	Very low	29.8	Very low	196 Å²	196	145.4 Å²	145.4	92%	0.916	77%	0.772	S	S	*	*				67.7	137.5	97.7	-61.1	-145.7	127	0	0	117.2
892	G	28.5	Very low	29.8	Very low	79 Å²	79	146.8 Å²	146.8	81%	0.814	78%	0.781	S	S	*	*			cis	173.7	163	-6.2	0	0	0	0	0	114.8
893	G	26.9	Very low	30.1	Very low	89 Å²	89	145.4 Å²	145.4	92%	0.918	78%	0.784	S	S	*	*			trans	106.7	144.1	166.3	0	0	0	0	0	117.6
894	G	28.9	Very low	30.8	Very low	79 Å²	79	146.7 Å²	146.7	81%	0.814	79%	0.791	S	S	*	*			trans	147	5.2	156	0	0	0	0	0	124.9
895	L	33.3	Very low	30.9	Very low	164 Å²	164	141 Å²	141	86%	0.859	79%	0.786	S	S	*	*			trans	52	116.9	160.6	-128.2	78.7	0	0	0	123
896	D	34.4	Very low	31.3	Very low	131 Å²	131	145 Å²	145	70%	0.701	79%	0.793	S	S	*	*				101.4	144.8	125.6	-120.9	-28.2	0	0	0	125.5
897	R	32.2	Very low	31.2	Very low	209 Å²	209	142.8 Å²	142.8	79%	0.789	80%	0.797	S	S	*	*			trans	55.5	115.8	170.4	-68.6	-173.9	158	-162	-9.3	119.5
898	Q	30.9	Very low	31.2	Very low	154 Å²	154	140.4 Å²	140.4	72%	0.72	79%	0.792	S	S	*	*				68.9	139.4	59.4	-68.7	-165.4	1.7	0	0	113.8
899	Q	33.3	Very low	31.2	Very low	134 Å²	134	141.7 Å²	141.7	63%	0.626	79%	0.789	S	S	*	*			cis	-158.4	-177.6	8.9	-119.5	-177	69.9	0	0	107.1
900	S	27.2	Very low	31.1	Very low	73 Å²	73	135.2 Å²	135.2	51%	0.51	78%	0.781	S	S	.	*			cis	-169.3	164.7	0.6	-116.9	0	0	0	0	107.9
901	W	27.4	Very low	31.1	Very low	230 Å²	230	134 Å²	134	87%	0.871	78%	0.784	S	S	*	*			cis	-167.2	172.4	-22	-111	11.1	0	0	0	110.8
902	S	25.5	Very low	31	Very low	115 Å²	115	133.2 Å²	133.2	80%	0.804	78%	0.78	S	S	*	*			trans	-106	170.5	-179.2	-51.5	0	0	0	0	113.8
903	S	33.3	Very low	31.1	Very low	125 Å²	125	135.4 Å²	135.4	87%	0.874	77%	0.773	S	S	*	*			trans	-75.2	147.2	176.3	-45.6	0	0	0	0	114.7
904	P	45.3	Very low	31.4	Very low	130 Å²	130	139.6 Å²	139.6	84%	0.844	77%	0.768	S	S	*	*			trans	-127.4	-177.4	170.1	41.2	-29.2	0	0	0	115
905	S	30.3	Very low	31.3	Very low	113 Å²	113	144.9 Å²	144.9	79%	0.79	77%	0.769	S	S	*	*			trans	-147	129.2	-172.8	59.5	0	0	0	0	118
906	K	37	Very low	31.2	Very low	209 Å²	209	143.5 Å²	143.5	91%	0.909	77%	0.767	S	S	*	*			trans	62.2	120	151.7	-70.5	-171.9	174.3	-179.1	0	124.3
907	N	30.3	Very low	31.4	Very low	165 Å²	165	142.5 Å²	142.5	88%	0.882	77%	0.768	S	S	*	*			trans	-177.9	169.1	148.9	-101.7	-29.2	0	0	0	110.4
908	S	29.9	Very low	31.4	Very low	92 Å²	92	139 Å²	139	64%	0.643	77%	0.769	S	S	*	*			cis	-167.1	170.2	-17.9	57.2	0	0	0	0	113.1
909	S	29	Very low	31.3	Very low	98 Å²	98	139.3 Å²	139.3	69%	0.685	78%	0.775	S	S	*	*			trans	59.7	118.1	143.9	55.6	0	0	0	0	126.2
910	S	28	Very low	30.9	Very low	102 Å²	102	139.7 Å²	139.7	71%	0.713	78%	0.78	S	S	*	*			trans	70.6	105.8	130.5	64.2	0	0	0	0	127.1
911	T	29	Very low	31.2	Very low	128 Å²	128	141.5 Å²	141.5	79%	0.785	79%	0.793	S	S	*	*				44.1	123.9	126.5	59.4	0	0	0	0	125.7
912	H	31.3	Very low	32.4	Very low	178 Å²	178	135.8 Å²	135.8	82%	0.824	79%	0.785	S	S	*	*				-172.3	178.8	109.8	-123.5	-105.2	0	0	0	114.6
913	N	29.1	Very low	32.6	Very low	125 Å²	125	135.9 Å²	135.9	67%	0.668	78%	0.781	S	S	*	*			trans	-95.2	145.3	-165.5	-65.8	-64.4	0	0	0	117.3
914	H	33	Very low	32.4	Very low	177 Å²	177	137.5 Å²	137.5	82%	0.819	78%	0.779	S	S	*	*				171.4	139	110.5	-91.3	-64.1	0	0	0	116
915	K	28.3	Very low	31.4	Very low	190 Å²	190	139.6 Å²	139.6	83%	0.826	78%	0.775	S	S	*	*			trans	27.2	101.3	157.7	-68.6	-177.8	175.1	178.8	0	121.6
916	V	30	Very low	31.2	Very low	136 Å²	136	142.3 Å²	142.3	82%	0.824	78%	0.775	S	S	*	*				45.6	136.6	111.9	176.7	0	0	0	0	119.3
917	P	40.1	Very low	30.7	Very low	110 Å²	110	137.3 Å²	137.3	71%	0.714	77%	0.766	S	S	*	*			cis	-129.2	156.7	14.5	36.7	-20.3	0	0	0	117.6
918	V	31.2	Very low	31.4	Very low	134 Å²	134	135.1 Å²	135.1	81%	0.812	76%	0.761	S	S	*	*				-177.8	144.2	125.5	147.5	0	0	0	0	107.6
919	L	29	Very low	31.3	Very low	162 Å²	162	135.2 Å²	135.2	85%	0.848	77%	0.767	S	S	*	*			trans	-103.4	161.4	-167.3	-68.9	132.7	0	0	0	113.4
920	I	25.8	Very low	31.3	Very low	142 Å²	142	137.3 Å²	137.3	73%	0.728	77%	0.77	S	S	*	*				-168.9	149.2	-50.8	-111.6	162.6	0	0	0	109.3
921	S	33.1	Very low	31.4	Very low	111 Å²	111	137.2 Å²	137.2	78%	0.776	77%	0.765	S	S	*	*			trans	-171.8	165.9	171.9	-79.6	0	0	0	0	108.1
922	P	51.9	Low	31.5	Very low	109 Å²	109	134.4 Å²	134.4	71%	0.708	74%	0.743	S	S	*	*			cis	-137.1	-170	-3.9	34.2	-11	0	0	0	115.6
923	T	29.2	Very low	31.6	Very low	117 Å²	117	133.6 Å²	133.6	72%	0.718	74%	0.744	S	S	*	*			trans	64.6	115.9	147.7	43.8	0	0	0	0	124.8
924	L	29.5	Very low	32.1	Very low	160 Å²	160	130.2 Å²	130.2	84%	0.838	73%	0.728	S	S	*	*				57	112.5	129.8	-74.4	166	0	0	0	123.4
925	K	24.5	Very low	32.7	Very low	174 Å²	174	123.5 Å²	123.5	76%	0.757	71%	0.706	S	S	*	*				173.7	137.7	111.9	-101.5	179.7	176.3	-175.4	0	114.2
926	H	26.4	Very low	33.9	Very low	170 Å²	170	119.8 Å²	119.8	79%	0.787	70%	0.695	S	S	*	*			trans	49.6	140.4	157.7	-58.8	-66.1	0	0	0	119.6
927	S	25.7	Very low	35.5	Very low	104 Å²	104	116.4 Å²	116.4	73%	0.727	67%	0.672	S	S	*	*			cis	-161.3	-161.9	-8.2	-160.9	0	0	0	0	109.1
928	P	46.5	Very low	35.5	Very low	119 Å²	119	117.4 Å²	117.4	77%	0.773	68%	0.682	S	S	*	*				-93.3	157.1	-109.1	40.2	-27.8	0	0	0	116.9
929	A	27.4	Very low	36.4	Very low	93 Å²	93	119.3 Å²	119.3	77%	0.769	68%	0.682	S	S	*	*			trans	-176.2	119.1	147.6	0	0	0	0	0	113
930	D	28.1	Very low	37.2	Very low	143 Å²	143	113.9 Å²	113.9	77%	0.765	67%	0.665	S	S	*	*			trans	31	162	136.4	-49.4	-4.1	0	0	0	125.4
931	V	31.4	Very low	38.2	Very low	100 Å²	100	111.8 Å²	111.8	61%	0.606	66%	0.656	S	S	*	*			trans	98	69.5	152.2	-156.4	0	0	0	0	121	K944	V931-K944 PolarHBondContact O-NZ 2.8Å
932	H	30.4	Very low	39	Very low	69 Å²	69	115.2 Å²	115.2	32%	0.319	65%	0.651	S	S	.	*			trans	50	152.8	137.5	-59.6	-151	0	0	0	121.3	K944 L946	H932-K944 HydrophobicContact CB-CD 3.5Å; H932-K944 VanDerWaalsContact CB-CD 3.5Å; H932-K944 HydrophobicContact CB-CG 3.76Å; H932-K944 WeakPolarHBondContact O-CE 3.46Å; H932-K944 PolarHBondContact O-NZ 3.49Å; H932-L946 WeakPolarHBondContact CD2-CD1 3.31Å; H932-L946 WeakPolarHBondContact CD2-CG 3.45Å
933	L	33.2	Very low	38.4	Very low	161 Å²	161	116.7 Å²	116.7	84%	0.843	65%	0.647	S	S	*	*			trans	-118.1	165.5	157.6	-115.2	169.5	0	0	0	112.8	K944	L933-K944 WeakPolarHBondContact O-CG 3.25Å
934	V	39.8	Very low	38.7	Very low	54 Å²	54	115 Å²	115	33%	0.327	63%	0.63	S	S	.	*			trans	-120.3	144.2	-163.5	-150.9	0	0	0	0	112.7	R942 F943 K944	V934-R942 HydrophobicContact CG1-CB 3.71Å; V934-R942 HydrophobicContact CG1-CG 3.97Å; V934-F943 WeakPolarHBondContact CG1-O 3.41Å; V934-K944 HydrophobicContact CB-CG 4.09Å; V934-K944 HydrophobicContact CG1-CB 3.96Å; V934-K944 HydrophobicContact CG1-CG 4.03Å; V934-K944 HydrophobicContact CG2-CD 3.76Å; V934-K944 VanDerWaalsContact CG2-CE 3.4Å; V934-K944 HydrophobicContact CG2-CG 3.81Å
935	G	44.8	Very low	38.8	Very low	35 Å²	35	114.9 Å²	114.9	36%	0.361	63%	0.629	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.1	148.5	162.7	0	0	0	0	0	112.5	R942 F943	G935-R942 WeakPolarHBondContact O-CA 3.44Å; G935-F943 PolarHBondContact N-O 2.86Å; G935-F943 PolarHBondContact O-N 2.93Å; G935-F943 VanDerWaalsContact O-N 3.09Å
936	L	54.3	Low	39	Very low	113 Å²	113	110.5 Å²	110.5	59%	0.592	61%	0.614	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-114.1	141.9	172.6	-91.2	166.1	0	0	0	109.8	G940 N941 R942	L936-G940 VanDerWaalsContact CD2-C 3.49Å; L936-G940 WeakPolarHBondContact CD2-O 3.46Å; L936-N941 WeakPolarHBondContact CA-O 3.35Å; L936-R942 HydrophobicContact CD2-CB 4.5Å; L936-R942 HydrophobicContact CD2-CG 3.36Å; L936-R942 HydrophobicContact CG-CG 3.73Å
937	D	62.5	Low	39.3	Very low	64 Å²	64	107.2 Å²	107.2	34%	0.342	61%	0.61	S	S	.	*			trans	-97.6	175.2	170	71.3	23.5	0	0	0	113.6	Q939 G940 N941 F943	D937-Q939 PolarHBondContact O-N 2.97Å; D937-Q939 VanDerWaalsContact O-N 3.14Å; D937-Q939 PolarHBondContact OD1-N 2.93Å; D937-G940 PolarHBondContact O-N 3.09Å; D937-G940 PolarHBondContact OD1-N 3.34Å; D937-N941 PolarHBondContact N-O 3.01Å; D937-N941 PolarHBondContact OD1-N 3.07Å; D937-F943 HydrophobicContact CB-CE1 4.24Å
938	S	41.3	Very low	39.5	Very low	132 Å²	132	108.8 Å²	108.8	92%	0.923	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	7.2	-178.2	56.5	0	0	0	0	115.1
939	Q	49.3	Very low	38.9	Very low	173 Å²	173	109.6 Å²	109.6	81%	0.808	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.6	6.9	165.2	-66.2	-168.1	-10.5	0	0	112.6	D937	D937-Q939 PolarHBondContact O-N 2.97Å; D937-Q939 VanDerWaalsContact O-N 3.14Å; D937-Q939 PolarHBondContact OD1-N 2.93Å
940	G	47	Very low	38.9	Very low	49 Å²	49	113.1 Å²	113.1	51%	0.505	60%	0.599	S	S	.	*	S	Bend	trans	90.9	9.9	172.4	0	0	0	0	0	115.2	L936 D937	L936-G940 VanDerWaalsContact CD2-C 3.49Å; L936-G940 WeakPolarHBondContact CD2-O 3.46Å; D937-G940 PolarHBondContact O-N 3.09Å; D937-G940 PolarHBondContact OD1-N 3.34Å
941	N	45.6	Very low	38.7	Very low	98 Å²	98	109.6 Å²	109.6	52%	0.524	60%	0.597	S	S	.	*			trans	-88.3	147	-178.5	-66.9	-57.3	0	0	0	112.3	L936 D937	L936-N941 WeakPolarHBondContact CA-O 3.35Å; D937-N941 PolarHBondContact N-O 3.01Å; D937-N941 PolarHBondContact OD1-N 3.07Å
942	R	49.8	Very low	38.5	Very low	182 Å²	182	113.4 Å²	113.4	69%	0.687	61%	0.608	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-115.6	125	-167.5	-87.9	-149.5	-61	-95.3	4.9	113.4	V934 G935 L936	V934-R942 HydrophobicContact CG1-CB 3.71Å; V934-R942 HydrophobicContact CG1-CG 3.97Å; G935-R942 WeakPolarHBondContact O-CA 3.44Å; L936-R942 HydrophobicContact CD2-CB 4.5Å; L936-R942 HydrophobicContact CD2-CG 3.36Å; L936-R942 HydrophobicContact CG-CG 3.73Å
943	F	40.3	Very low	38.4	Very low	141 Å²	141	120.7 Å²	120.7	62%	0.618	63%	0.633	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-134.3	146.3	174.5	47	-91.8	0	0	0	114.1	V934 G935 D937	V934-F943 WeakPolarHBondContact CG1-O 3.41Å; G935-F943 PolarHBondContact N-O 2.86Å; G935-F943 PolarHBondContact O-N 2.93Å; G935-F943 VanDerWaalsContact O-N 3.09Å; D937-F943 HydrophobicContact CB-CE1 4.24Å
944	K	35.3	Very low	38.1	Very low	82 Å²	82	121 Å²	121	36%	0.357	64%	0.635	S	S	.	*			trans	-151.6	131.4	-155.2	-144.2	-169.5	-163.8	-160.2	0	109.9	V931 H932 L933 V934	V931-K944 PolarHBondContact O-NZ 2.8Å; H932-K944 HydrophobicContact CB-CD 3.5Å; H932-K944 VanDerWaalsContact CB-CD 3.5Å; H932-K944 HydrophobicContact CB-CG 3.76Å; H932-K944 WeakPolarHBondContact O-CE 3.46Å; H932-K944 PolarHBondContact O-NZ 3.49Å; L933-K944 WeakPolarHBondContact O-CG 3.25Å; V934-K944 HydrophobicContact CB-CG 4.09Å; V934-K944 HydrophobicContact CG1-CB 3.96Å; V934-K944 HydrophobicContact CG1-CG 4.03Å; V934-K944 HydrophobicContact CG2-CD 3.76Å; V934-K944 VanDerWaalsContact CG2-CE 3.4Å; V934-K944 HydrophobicContact CG2-CG 3.81Å
945	L	30.5	Very low	37.6	Very low	156 Å²	156	129.5 Å²	129.5	82%	0.817	66%	0.661	S	S	*	*			trans	-163.6	154.8	160.2	-135.2	73.8	0	0	0	115.5
946	L	29.3	Very low	37.7	Very low	83 Å²	83	133 Å²	133	44%	0.435	68%	0.678	S	S	.	*			trans	-101.1	168.3	166.5	-69.4	177.8	0	0	0	109.3	H932	H932-L946 WeakPolarHBondContact CD2-CD1 3.31Å; H932-L946 WeakPolarHBondContact CD2-CG 3.45Å
947	S	33.2	Very low	36.4	Very low	101 Å²	101	139.2 Å²	139.2	71%	0.706	69%	0.693	S	S	*	*			cis	84.5	154.8	24	-162.4	0	0	0	0	116.2
948	E	28.8	Very low	34.7	Very low	137 Å²	137	143.3 Å²	143.3	64%	0.64	71%	0.714	S	S	*	*			trans	79.1	160.4	174.9	-52.5	-158.5	136.9	0	0	117.8
949	H	34.3	Very low	34.1	Very low	136 Å²	136	143.9 Å²	143.9	63%	0.63	71%	0.712	S	S	*	*			cis	-173.6	167.4	-37.2	-94.4	-32.6	0	0	0	108.1
950	Q	27.5	Very low	33.2	Very low	167 Å²	167	143.9 Å²	143.9	78%	0.78	71%	0.709	S	S	*	*			cis	-170.5	164.3	-28.8	-174.2	154.7	-96.1	0	0	109.2
951	G	24.9	Very low	32.7	Very low	69 Å²	69	147 Å²	147	71%	0.711	72%	0.72	S	S	*	*			trans	-108.8	169.1	176.6	0	0	0	0	0	114.8
952	E	26.5	Very low	32	Very low	180 Å²	180	154 Å²	154	84%	0.841	74%	0.739	S	S	*	*			trans	-90.3	-176.9	-162.7	-87.9	-144.7	98	0	0	118.2
953	R	28.4	Very low	31	Very low	222 Å²	222	151.1 Å²	151.1	84%	0.838	75%	0.746	S	S	*	*			trans	-82.7	154.9	-162.3	-47.4	162.6	-177.7	165.3	2	114
954	D	27.3	Very low	31	Very low	166 Å²	166	148.8 Å²	148.8	89%	0.888	75%	0.752	S	S	*	*				-158.4	176.9	116.4	-138.4	-29.8	0	0	0	113.1
955	R	29.5	Very low	31.4	Very low	234 Å²	234	150.5 Å²	150.5	88%	0.883	77%	0.772	S	S	*	*			trans	-112.8	178.3	-169.4	-111.4	-159.4	169.1	179.1	-1.8	114.2
956	P	45.8	Very low	31.9	Very low	109 Å²	109	148.7 Å²	148.7	71%	0.708	77%	0.77	S	S	*	*			trans	-113.9	157.7	-131	41.9	-33.6	0	0	0	116.1
957	R	27.3	Very low	32.4	Very low	243 Å²	243	150.3 Å²	150.3	92%	0.917	79%	0.785	S	S	*	*			trans	-142.8	113.3	162.3	-72.1	-168	172.9	163.4	-0.7	114.9
958	L	26.5	Very low	32.8	Very low	150 Å²	150	151 Å²	151	79%	0.785	79%	0.787	S	S	*	*			trans	44.7	107.6	132.8	-163.5	73.7	0	0	0	119.8
959	V	29.8	Very low	33.1	Very low	143 Å²	143	150.6 Å²	150.6	87%	0.867	80%	0.796	S	S	*	*			trans	-104.8	135.3	156.8	178.3	0	0	0	0	109.2
960	K	29.8	Very low	32.9	Very low	173 Å²	173	150.9 Å²	150.9	75%	0.752	81%	0.808	S	S	*	*			trans	-87.6	153.5	-177.2	-73.3	-178.4	176.8	-180	0	112.6
961	P	35.3	Very low	33.1	Very low	114 Å²	114	151 Å²	151	74%	0.74	81%	0.813	S	S	*	*			trans	-69.4	162.1	170.3	31.5	-36.7	0	0	0	112.5
962	R	31.4	Very low	33.2	Very low	246 Å²	246	159.6 Å²	159.6	93%	0.928	82%	0.824	S	S	*	*			trans	-119.1	114.3	153.8	-72.2	-171.6	175.2	-133.7	-0.2	106.5
963	C	29.2	Very low	33.2	Very low	122 Å²	122	154.6 Å²	154.6	82%	0.824	82%	0.821	S	S	*	*				82.4	120.7	69.4	-70.2	0	0	0	0	111.9
964	A	40	Very low	33	Very low	91 Å²	91	151.3 Å²	151.3	75%	0.752	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-77	163	-172.4	0	0	0	0	0	113.6
965	P	43.3	Very low	32.8	Very low	119 Å²	119	150.4 Å²	150.4	77%	0.773	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-64.8	155.1	169.4	28.4	-36.3	0	0	0	112.6
966	P	41	Very low	32.5	Very low	118 Å²	118	148.5 Å²	148.5	77%	0.766	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-78.5	156.4	-179.3	33.1	-36	0	0	0	113.3
967	P	41.4	Very low	31.4	Very low	117 Å²	117	148.2 Å²	148.2	76%	0.76	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-76.9	159	175.8	33	-36.1	0	0	0	113
968	P	40.1	Very low	31.4	Very low	115 Å²	115	147.1 Å²	147.1	75%	0.747	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-74.1	152.2	177.2	31.5	-35.8	0	0	0	112.8
969	P	35.8	Very low	31.3	Very low	128 Å²	128	145.8 Å²	145.8	83%	0.831	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-77.8	139	179.5	31.5	-34.7	0	0	0	112.7
970	T	30.8	Very low	31	Very low	143 Å²	143	144.1 Å²	144.1	88%	0.877	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-89.8	140.5	173.4	43.2	0	0	0	0	111.9
971	L	30.7	Very low	30.8	Very low	169 Å²	169	142.7 Å²	142.7	89%	0.885	81%	0.806	S	S	*	*			trans	-108.3	112.6	178.2	-78	172.3	0	0	0	111.9
972	R	26.3	Very low	30.3	Very low	249 Å²	249	141.4 Å²	141.4	94%	0.94	80%	0.799	S	S	*	*			trans	177.8	127.9	140.2	-104.7	170	-176.4	-172	1.9	113
973	G	26.6	Very low	30.1	Very low	75 Å²	75	139.1 Å²	139.1	77%	0.773	80%	0.8	S	S	*	*			trans	65.9	141.3	146.2	0	0	0	0	0	118.9
974	L	26.1	Very low	30.1	Very low	153 Å²	153	139.8 Å²	139.8	80%	0.801	80%	0.795	S	S	*	*			cis	-160.7	155.2	7	-121.8	165.2	0	0	0	110.3
975	Q	22.9	Very low	29.6	Very low	148 Å²	148	143.1 Å²	143.1	69%	0.692	80%	0.795	S	S	*	*			trans	56.3	128.6	158.9	-93.1	168.3	-59.5	0	0	121.1
976	Q	23.1	Very low	28.9	Very low	193 Å²	193	142.9 Å²	142.9	90%	0.902	79%	0.791	S	S	*	*			trans	-75	146.7	139.6	-80.6	177.7	-57.1	0	0	109.4
977	S	21.8	Very low	28.2	Very low	103 Å²	103	143.1 Å²	143.1	72%	0.72	80%	0.795	S	S	*	*			trans	-109.9	153.9	175.5	-69	0	0	0	0	111.9
978	Y	27.2	Very low	27.4	Very low	220 Å²	220	141 Å²	141	86%	0.863	80%	0.795	S	S	*	*			trans	-36	149.4	172	-56.7	-94.2	0	0	0	116.9
979	S	23.8	Very low	26.8	Very low	123 Å²	123	140.4 Å²	140.4	86%	0.86	80%	0.8	S	S	*	*				-159.9	139.9	129.4	-169.2	0	0	0	0	109
980	C	24.6	Very low	27.4	Very low	107 Å²	107	140 Å²	140	72%	0.723	80%	0.797	S	S	*	*			cis	-167.9	156.9	-26.9	-171.4	0	0	0	0	105.5
981	D	24.4	Very low	27.2	Very low	144 Å²	144	139.2 Å²	139.2	77%	0.77	79%	0.792	S	S	*	*			trans	-142.5	120.1	153.5	-135	-29.2	0	0	0	112.2
982	S	26.5	Very low	26.8	Very low	86 Å²	86	139.3 Å²	139.3	60%	0.601	79%	0.788	S	S	*	*			trans	39.5	130.5	144.8	-54.5	0	0	0	0	123.6
983	E	26.8	Very low	26.8	Very low	199 Å²	199	133.5 Å²	133.5	93%	0.93	78%	0.78	S	S	*	*			trans	80	168.2	142.4	-67.6	-179.4	148.3	0	0	120
984	D	29.7	Very low	26.6	Very low	136 Å²	136	137.6 Å²	137.6	73%	0.727	78%	0.784	S	S	*	*			trans	-148.3	161.8	-136.1	-179.8	38.7	0	0	0	113.4
985	Q	29.3	Very low	26.6	Very low	160 Å²	160	133.6 Å²	133.6	75%	0.748	78%	0.78	S	S	*	*			trans	89.1	151.8	149	-133	170.7	113.1	0	0	121.4
986	V	27.1	Very low	26.7	Very low	115 Å²	115	134.3 Å²	134.3	70%	0.697	79%	0.788	S	S	*	*			trans	85.5	81.7	165.5	-163.7	0	0	0	0	118.6
987	S	26.1	Very low	26.9	Very low	122 Å²	122	129 Å²	129	85%	0.853	78%	0.777	S	S	*	*				59.6	127.4	124.6	-54.9	0	0	0	0	122.9
988	G	26.3	Very low	27.2	Very low	73 Å²	73	129.9 Å²	129.9	75%	0.753	78%	0.778	S	S	*	*				136.9	93.7	123.1	0	0	0	0	0	120.4
989	A	26.2	Very low	27.2	Very low	103 Å²	103	128 Å²	128	85%	0.851	77%	0.774	S	S	*	*			trans	66.5	176.7	143.3	0	0	0	0	0	117.9
990	P	49.3	Very low	27.4	Very low	118 Å²	118	125.6 Å²	125.6	77%	0.766	77%	0.768	S	S	*	*			trans	-124.5	-164.4	-157.5	42.7	-28.9	0	0	0	115.3
991	V	25.7	Very low	27.5	Very low	127 Å²	127	128 Å²	128	77%	0.77	77%	0.769	S	S	*	*			trans	123.6	156.8	160.6	179.4	0	0	0	0	114.3
992	E	23.7	Very low	27.7	Very low	171 Å²	171	131.4 Å²	131.4	80%	0.799	77%	0.771	S	S	*	*			trans	-62.3	172.8	-171.2	-51.6	162.9	108.7	0	0	116.1
993	V	25.1	Very low	27.7	Very low	128 Å²	128	133.5 Å²	133.5	78%	0.776	79%	0.786	S	S	*	*				157.8	156.2	120.6	163.4	0	0	0	0	112.4
994	N	23.6	Very low	27.7	Very low	161 Å²	161	127.5 Å²	127.5	86%	0.861	78%	0.778	S	S	*	*			trans	-55.2	170.4	175.5	-50.1	-59.2	0	0	0	116.6
995	G	25.3	Very low	27.6	Very low	69 Å²	69	132.2 Å²	132.2	71%	0.711	79%	0.785	S	S	*	*			trans	137.1	85.2	164.9	0	0	0	0	0	111
996	D	25.4	Very low	27.4	Very low	162 Å²	162	132.4 Å²	132.4	87%	0.866	79%	0.788	S	S	*	*				66.1	139.7	56.1	-163.8	24.5	0	0	0	114.3
997	A	26.6	Very low	27.3	Very low	81 Å²	81	132.8 Å²	132.8	67%	0.669	80%	0.796	S	S	*	*			trans	66.8	149.1	167.7	0	0	0	0	0	117.5
998	V	28.2	Very low	27.1	Very low	122 Å²	122	131 Å²	131	74%	0.739	80%	0.796	S	S	*	*			cis	-156.5	161.7	-11.1	111.3	0	0	0	0	112.7
999	K	26.9	Very low	27	Very low	182 Å²	182	131.1 Å²	131.1	79%	0.791	80%	0.798	S	S	*	*			trans	-14.9	141.2	164.5	-50.8	155.9	-175.7	170.2	0	119.5
1000	G	27.4	Very low	27.5	Very low	71 Å²	71	130.8 Å²	130.8	73%	0.732	80%	0.795	S	S	*	*			trans	-168.7	101.9	147	0	0	0	0	0	109.5
1001	Q	27.6	Very low	26.6	Very low	158 Å²	158	131.5 Å²	131.5	74%	0.738	80%	0.798	S	S	*	*				49.8	131	66.4	-84.8	-170.4	-125.4	0	0	114.5
1002	R	28.1	Very low	26.9	Very low	216 Å²	216	132.2 Å²	132.2	82%	0.815	80%	0.802	S	S	*	*			cis	-171.6	146.7	-9.3	-150.6	-176.2	-165	177	4.9	110
1003	S	26.7	Very low	27	Very low	129 Å²	129	128 Å²	128	90%	0.902	81%	0.805	S	S	*	*			trans	65.1	168.6	156.3	-154.4	0	0	0	0	118
1004	G	26.4	Very low	27.3	Very low	74 Å²	74	131.8 Å²	131.8	76%	0.763	81%	0.805	S	S	*	*			trans	133.6	117.7	173.5	0	0	0	0	0	113.4
1005	R	27.4	Very low	28.7	Very low	234 Å²	234	129.5 Å²	129.5	88%	0.883	80%	0.799	S	S	*	*			trans	-139.6	154.5	177.2	-153.3	-173.6	-174.2	-175.7	2	108.9
1006	M	25.8	Very low	29.2	Very low	164 Å²	164	130.9 Å²	130.9	81%	0.808	80%	0.798	S	S	*	*			trans	81.4	105.9	165.8	-61.6	146.8	58.4	0	0	119.4
1007	S	25.2	Very low	29.9	Very low	123 Å²	123	127.5 Å²	127.5	86%	0.86	78%	0.783	S	S	*	*				70.9	95	113.1	-168	0	0	0	0	122.4
1008	G	23.1	Very low	31.5	Very low	84 Å²	84	128.8 Å²	128.8	87%	0.866	79%	0.785	S	S	*	*				90.6	148.9	127.9	0	0	0	0	0	119.8
1009	G	24	Very low	33	Very low	77 Å²	77	128.3 Å²	128.3	79%	0.794	78%	0.784	S	S	*	*			trans	139.6	71.1	155	0	0	0	0	0	121.9
1010	A	36.4	Very low	33.9	Very low	96 Å²	96	124.9 Å²	124.9	79%	0.793	78%	0.78	S	S	*	*			trans	62.8	-178.3	140.9	0	0	0	0	0	122.6
1011	T	28.9	Very low	34	Very low	132 Å²	132	129.5 Å²	129.5	81%	0.81	78%	0.783	S	S	*	*			trans	77.6	140.8	-177.5	72.2	0	0	0	0	116.5
1012	T	32	Very low	34.1	Very low	142 Å²	142	128.2 Å²	128.2	87%	0.871	79%	0.785	S	S	*	*			cis	-164.4	154.8	-10.5	14.9	0	0	0	0	111.1
1013	G	26.8	Very low	35.1	Very low	82 Å²	82	123.4 Å²	123.4	85%	0.845	78%	0.782	S	S	*	*			trans	144.9	143.3	161.4	0	0	0	0	0	118.3
1014	R	32.5	Very low	36.3	Very low	208 Å²	208	122.5 Å²	122.5	79%	0.785	77%	0.773	S	S	*	*			trans	-155.8	174.8	179.6	-138.4	-150.7	173.2	178.5	5.5	110.3
1015	P	52.9	Low	36.3	Very low	114 Å²	114	123.1 Å²	123.1	74%	0.74	77%	0.771	S	S	*	*			cis	-86.7	-156.5	16.9	-14.5	36	0	0	0	116.8
1016	S	33.9	Very low	36.4	Very low	98 Å²	98	117 Å²	117	69%	0.685	76%	0.764	S	S	*	*			cis	-157.9	168.7	-5.5	-133.1	0	0	0	0	109.8
1017	V	40.7	Very low	36.5	Very low	90 Å²	90	114.1 Å²	114.1	55%	0.545	76%	0.76	S	S	.	*			cis	90.7	127.1	-3.7	176.9	0	0	0	0	118.7
1018	P	61.1	Low	36.6	Very low	109 Å²	109	113.1 Å²	113.1	71%	0.708	75%	0.753	S	S	*	*			cis	-146.6	-147.5	-28.9	45.2	-24	0	0	0	113.4
1019	P	59	Low	36.9	Very low	111 Å²	111	114 Å²	114	72%	0.721	75%	0.746	S	S	*	*			cis	-116.4	-169.3	-47.2	37.8	-22	0	0	0	111.9
1020	P	46.3	Very low	37.2	Very low	111 Å²	111	115.3 Å²	115.3	72%	0.721	74%	0.743	S	S	*	*			cis	-118.5	-137.7	-10.8	28.9	-3.6	0	0	0	109.8
1021	Q	29.6	Very low	36.9	Very low	168 Å²	168	115.7 Å²	115.7	79%	0.785	74%	0.74	S	S	*	*			cis	-156.3	172.1	-9	-160.3	135	-37	0	0	111
1022	V	30.2	Very low	36.6	Very low	131 Å²	131	115.1 Å²	115.1	79%	0.794	74%	0.74	S	S	*	*			trans	-164.6	175	177.3	-108.7	0	0	0	0	109.8
1023	P	47.8	Very low	37.9	Very low	114 Å²	114	113.8 Å²	113.8	74%	0.74	73%	0.733	S	S	*	*			cis	-121.4	-119.6	-28.9	31.8	-8.6	0	0	0	109.3
1024	P	51.5	Low	38.2	Very low	111 Å²	111	114.4 Å²	114.4	72%	0.721	73%	0.731	S	S	*	*			cis	-134.1	-178.8	-44.3	38.9	-20.2	0	0	0	117
1025	A	27.6	Very low	38.4	Very low	86 Å²	86	109.4 Å²	109.4	71%	0.711	73%	0.727	S	S	*	*			trans	89.4	140.3	136.6	0	0	0	0	0	126.4
1026	S	28.4	Very low	37.3	Very low	105 Å²	105	110.7 Å²	110.7	73%	0.734	73%	0.733	S	S	*	*			trans	69.3	109.5	137.9	59.2	0	0	0	0	125.3
1027	S	28.3	Very low	37.3	Very low	104 Å²	104	113.3 Å²	113.3	73%	0.727	74%	0.74	S	S	*	*				59.7	131.8	126.2	65.5	0	0	0	0	125.4
1028	S	28.4	Very low	37	Very low	103 Å²	103	116 Å²	116	72%	0.72	76%	0.756	S	S	*	*			trans	75.9	135.4	136.1	58.4	0	0	0	0	124.1
1029	S	28.7	Very low	35.8	Very low	101 Å²	101	116.9 Å²	116.9	71%	0.706	76%	0.76	S	S	*	*			trans	71	110.1	140.3	62	0	0	0	0	123.4
1030	S	30.5	Very low	35.7	Very low	105 Å²	105	116.7 Å²	116.7	73%	0.734	76%	0.759	S	S	*	*				67.5	138	127	63.3	0	0	0	0	124.7
1031	S	29.2	Very low	35.1	Very low	104 Å²	104	117.7 Å²	117.7	73%	0.727	76%	0.763	S	S	*	*			trans	66.9	111	144.8	55.5	0	0	0	0	122.6
1032	C	24.1	Very low	35.5	Very low	120 Å²	120	118 Å²	118	81%	0.811	76%	0.762	S	S	*	*				16.1	161.6	114.2	-61	0	0	0	0	121.6
1033	P	58.7	Low	35.7	Very low	114 Å²	114	119.1 Å²	119.1	74%	0.74	76%	0.761	S	S	*	*			cis	-142.9	-169	-26	39.2	-19.7	0	0	0	115
1034	A	33.2	Very low	35.1	Very low	95 Å²	95	117.4 Å²	117.4	79%	0.785	76%	0.756	S	S	*	*			trans	70.3	162.8	154.3	0	0	0	0	0	118.5
1035	S	36.3	Very low	34.3	Very low	103 Å²	103	120.2 Å²	120.2	72%	0.72	77%	0.765	S	S	*	*			cis	-171.5	168.3	-29.4	60.9	0	0	0	0	109.6
1036	T	30	Very low	34.5	Very low	141 Å²	141	119.8 Å²	119.8	87%	0.865	77%	0.769	S	S	*	*			trans	168.5	165.8	138.1	32.9	0	0	0	0	113.7
1037	N	33.5	Very low	34.8	Very low	154 Å²	154	119.6 Å²	119.6	82%	0.824	77%	0.773	S	S	*	*			trans	-114.5	162.2	-175.1	-64.6	-46	0	0	0	113.2
1038	T	33.8	Very low	34.9	Very low	145 Å²	145	119 Å²	119	89%	0.89	78%	0.775	S	S	*	*			trans	-167.9	169.6	131.9	11.8	0	0	0	0	113.5
1039	T	36.8	Very low	35	Very low	129 Å²	129	119.9 Å²	119.9	79%	0.791	78%	0.776	S	S	*	*			trans	-123.9	-165.5	-169.2	57.4	0	0	0	0	110.2
1040	P	56.3	Low	35	Very low	106 Å²	106	121.1 Å²	121.1	69%	0.688	78%	0.78	S	S	*	*			cis	-144.5	-153.4	6.1	39.3	-13.9	0	0	0	116.6
1041	T	33.8	Very low	35	Very low	133 Å²	133	120.4 Å²	120.4	82%	0.816	78%	0.78	S	S	*	*			trans	90	143.8	167.5	64.4	0	0	0	0	119.9
1042	K	38.1	Very low	34.9	Very low	174 Å²	174	120.4 Å²	120.4	76%	0.757	78%	0.78	S	S	*	*			cis	-171.5	150.4	-21.5	-164.9	-158.3	172.4	-168.3	0	112.1
1043	M	34.8	Very low	35	Very low	155 Å²	155	120 Å²	120	76%	0.764	78%	0.778	S	S	*	*			trans	74.7	148.2	163.5	-53.6	-154.1	-58.2	0	0	119.5
1044	A	35.7	Very low	33.4	Very low	77 Å²	77	120 Å²	120	64%	0.636	78%	0.781	S	S	*	*			cis	-165.4	157.5	-18.8	0	0	0	0	0	112.9
1045	N	34.2	Very low	33.2	Very low	170 Å²	170	123.6 Å²	123.6	91%	0.909	78%	0.782	S	S	*	*			trans	55.4	131.2	164.4	-57.2	-4.4	0	0	0	119.1
1046	G	31.6	Very low	32.8	Very low	78 Å²	78	123.9 Å²	123.9	80%	0.804	78%	0.779	S	S	*	*			cis	125.5	148.4	1.6	0	0	0	0	0	112.3
1047	A	34.3	Very low	32.9	Very low	100 Å²	100	123.1 Å²	123.1	83%	0.826	78%	0.775	S	S	*	*			cis	-168.9	-175.1	-6.2	0	0	0	0	0	110.7
1048	A	31.6	Very low	33.3	Very low	91 Å²	91	121.1 Å²	121.1	75%	0.752	77%	0.77	S	S	*	*			trans	74.3	142.4	165	0	0	0	0	0	119.2
1049	T	29.8	Very low	33.2	Very low	122 Å²	122	120 Å²	120	75%	0.748	77%	0.768	S	S	*	*			cis	-159.9	145.4	-11.9	14.9	0	0	0	0	112.8
1050	T	29.1	Very low	32.9	Very low	128 Å²	128	118.6 Å²	118.6	79%	0.785	77%	0.77	S	S	*	*			trans	49.1	113.1	147.5	59.1	0	0	0	0	124
1051	A	28.9	Very low	31.5	Very low	89 Å²	89	117.3 Å²	117.3	74%	0.736	78%	0.776	S	S	*	*				86	143.9	115.3	0	0	0	0	0	124.5
1052	S	27.1	Very low	31.2	Very low	105 Å²	105	116.6 Å²	116.6	73%	0.734	78%	0.776	S	S	*	*			trans	63.6	99.6	149.4	52.5	0	0	0	0	122.4
1053	S	27.4	Very low	30.7	Very low	111 Å²	111	118.1 Å²	118.1	78%	0.776	78%	0.783	S	S	*	*				45.4	110.8	128.1	61.5	0	0	0	0	121.7
1054	S	25.7	Very low	30.3	Very low	113 Å²	113	120.1 Å²	120.1	79%	0.79	79%	0.793	S	S	*	*				177.3	154.1	113.2	44.6	0	0	0	0	114.6
1055	Q	28	Very low	29.9	Very low	172 Å²	172	121 Å²	121	80%	0.804	80%	0.799	S	S	*	*			trans	40.3	120.2	148	-68.7	-176.9	-12.9	0	0	124.1
1056	T	28.3	Very low	29.7	Very low	108 Å²	108	121.3 Å²	121.3	66%	0.663	80%	0.8	S	S	*	*				69.3	109.7	128.8	60.8	0	0	0	0	124.7
1057	T	31.1	Very low	29.6	Very low	126 Å²	126	128.8 Å²	128.8	77%	0.773	80%	0.804	S	S	*	*			trans	69.1	171.8	130	67.3	0	0	0	0	119.9
1058	P	41.9	Very low	29.5	Very low	112 Å²	112	135.9 Å²	135.9	73%	0.727	81%	0.81	S	S	*	*			cis	-133.1	161	-9.3	20.6	4.1	0	0	0	118.1
1059	S	32.3	Very low	29.4	Very low	120 Å²	120	138 Å²	138	84%	0.839	81%	0.813	S	S	*	*			trans	73	151	139.1	-154	0	0	0	0	125.3
1060	A	30.9	Very low	29.5	Very low	101 Å²	101	144.2 Å²	144.2	84%	0.835	82%	0.823	S	S	*	*			trans	84.2	119.4	153.2	0	0	0	0	0	121.4
1061	G	26.5	Very low	29.4	Very low	79 Å²	79	146.4 Å²	146.4	81%	0.814	82%	0.824	S	S	*	*			trans	171.3	71.4	172.4	0	0	0	0	0	118.4
1062	S	28.4	Very low	29.4	Very low	118 Å²	118	151.4 Å²	151.4	83%	0.825	83%	0.832	S	S	*	*			trans	30.9	114.7	152.9	-62.2	0	0	0	0	123.6
1063	K	27.1	Very low	29.5	Very low	205 Å²	205	152.8 Å²	152.8	89%	0.891	84%	0.836	S	S	*	*			trans	6.9	129.4	131.4	-53.9	169.4	-176	173	0	118.5
1064	M	25.3	Very low	29.6	Very low	198 Å²	198	156.1 Å²	156.1	98%	0.975	84%	0.839	S	S	*	*				-166.2	163.3	104.5	-111.3	-169.8	176.7	0	0	112.5
1065	A	29.1	Very low	29.8	Very low	94 Å²	94	161.9 Å²	161.9	78%	0.777	84%	0.844	S	S	*	*			trans	-125.1	151.5	179.7	0	0	0	0	0	110.8
1066	L	29.6	Very low	30	Very low	178 Å²	178	159.7 Å²	159.7	93%	0.932	84%	0.842	S	S	*	*			trans	-142.9	132.8	168.8	-119	160	0	0	0	110.8
1067	R	28.7	Very low	30.4	Very low	234 Å²	234	160.2 Å²	160.2	88%	0.883	85%	0.847	S	S	*	*			trans	-74.5	148.5	-178.6	-64	168.4	171.9	156.9	-6.1	110.5
1068	R	32.8	Very low	31.2	Very low	249 Å²	249	160.7 Å²	160.7	94%	0.94	85%	0.845	S	S	*	*			trans	-121.8	144	148.7	-82.3	-171.6	169.8	173.8	-2.5	110
1069	T	28.9	Very low	31.7	Very low	135 Å²	135	163.9 Å²	163.9	83%	0.828	85%	0.85	S	S	*	*			trans	-79.2	146.7	-175.3	28	0	0	0	0	111.5	Q1071	T1069-Q1071 PolarHBondContact O-N 2.87Å; T1069-Q1071 VanDerWaalsContact O-N 3.11Å
1070	R	32	Very low	33	Very low	254 Å²	254	168.8 Å²	168.8	96%	0.958	85%	0.85	S	S	*	*			trans	-74.4	97.7	174.7	-177	179.5	-178.6	178.8	0.1	109.3
1071	Q	27.9	Very low	35.2	Very low	173 Å²	173	165.5 Å²	165.5	81%	0.808	82%	0.819	S	S	*	*			trans	-77.2	148	172.1	-149.3	160.8	-2.4	0	0	109.4	T1069	T1069-Q1071 PolarHBondContact O-N 2.87Å; T1069-Q1071 VanDerWaalsContact O-N 3.11Å
1072	Q	28.4	Very low	37.9	Very low	194 Å²	194	164.1 Å²	164.1	91%	0.907	80%	0.797	S	S	*	*			trans	-67.3	136.1	169.7	-79.2	176.4	-48.7	0	0	109.2
1073	V	29	Very low	40.6	Very low	135 Å²	135	163.2 Å²	163.2	82%	0.818	78%	0.776	S	S	*	*			trans	-87.8	107.3	167.8	176.7	0	0	0	0	107.4	R1075	V1073-R1075 PolarHBondContact O-N 2.98Å
1074	E	28.7	Very low	43.3	Very low	180 Å²	180	159.3 Å²	159.3	84%	0.841	76%	0.761	S	S	*	*			trans	-63.4	119	165.9	-173	169.9	-164.6	0	0	108.3	V1076	E1074-V1076 PolarHBondContact O-N 3.06Å
1075	R	31.6	Very low	46.2	Very low	234 Å²	234	151.5 Å²	151.5	88%	0.883	73%	0.727	S	S	*	*			trans	-74.8	107.5	179	-83.6	-173.5	172.9	178.6	-3.2	109.4	V1073	V1073-R1075 PolarHBondContact O-N 2.98Å
1076	V	31.7	Very low	49	Very low	127 Å²	127	147 Å²	147	77%	0.77	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-52.7	137.7	161	-177.7	0	0	0	0	108.6	E1074 L1078	E1074-V1076 PolarHBondContact O-N 3.06Å; V1076-L1078 PolarHBondContact O-N 2.92Å
1077	P	36.5	Very low	51.8	Low	118 Å²	118	140 Å²	140	77%	0.766	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-58.4	123.7	173	-22.9	33.9	0	0	0	110.3
1078	L	48.4	Very low	54.7	Low	137 Å²	137	135.2 Å²	135.2	72%	0.717	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-62.4	136.2	169	-162.2	74.6	0	0	0	108.2	V1076 R1080	V1076-L1078 PolarHBondContact O-N 2.92Å; L1078-R1080 PolarHBondContact O-N 2.87Å
1079	E	50.9	Low	57.4	Low	179 Å²	179	124.7 Å²	124.7	84%	0.836	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-58.7	137.8	171.5	-69.4	-168	122.6	0	0	109.3	V1081	E1079-V1081 PolarHBondContact O-N 3.33Å
1080	R	60.8	Low	60.2	Low	223 Å²	223	118.3 Å²	118.3	84%	0.842	57%	0.566	S	S	*	*			trans	-70.2	103.4	-180	-73.7	-176.3	176.8	174.1	-1.9	108.9	L1078 S1082	L1078-R1080 PolarHBondContact O-N 2.87Å; R1080-S1082 PolarHBondContact O-N 3.2Å
1081	V	77.2	Confident	63	Low	32 Å²	32	112.7 Å²	112.7	19%	0.194	55%	0.551	C	S	.	*			trans	-49.5	122.9	169.7	-178.5	0	0	0	0	108.4	E1079 L1086 C1123	E1079-V1081 PolarHBondContact O-N 3.33Å; V1081-L1086 HydrophobicContact CG1-CB 4.5Å; V1081-C1123 HydrophobicContact CG1-CB 4.16Å
1082	S	82.9	Confident	65.8	Low	50 Å²	50	107.4 Å²	107.4	35%	0.35	53%	0.533	S	S	.	.			trans	-74.9	158.6	179.4	68.9	0	0	0	0	110.7	R1080 E1084 A1085 L1086	R1080-S1082 PolarHBondContact O-N 3.2Å; S1082-E1084 WeakPolarHBondContact CB-OE2 3.33Å; S1082-E1084 PolarHBondContact O-N 3.42Å; S1082-A1085 PolarHBondContact O-N 3.11Å; S1082-A1085 VanDerWaalsContact OG-CB 3.3Å; S1082-A1085 WeakPolarHBondContact OG-CB 3.49Å; S1082-A1085 PolarHBondContact OG-N 3.19Å; S1082-A1085 VanDerWaalsContact OG-N 3.07Å; S1082-L1086 PolarHBondContact O-N 2.69Å
1083	R	84.6	Confident	68.6	Low	98 Å²	98	98.1 Å²	98.1	37%	0.37	49%	0.49	S	S	.	.	H	α-helix	trans	-60.6	-37.9	175.5	-175.1	-166.7	-160.1	-161.5	10.6	110.3	L1087 Y1127 V1187 Q1188	R1083-L1087 HydrophobicContact CG-CD1 4.33Å; R1083-L1087 WeakPolarHBondContact O-CG 3.35Å; R1083-L1087 PolarHBondContact O-N 3.13Å; R1083-Y1127 HydrophobicContact CB-CE2 4.04Å; R1083-V1187 HydrophobicContact CG-CG1 3.62Å; R1083-V1187 VanDerWaalsContact CZ-O 3.24Å; R1083-V1187 PolarHBondContact NE-O 3.41Å; R1083-V1187 PolarHBondContact NH2-O 2.98Å; R1083-Q1188 VanDerWaalsContact NH2-CA 3.33Å; R1083-Q1188 PolarHBondContact NH2-O 2.95Å
1084	E	84.8	Confident	71.4	Confident	124 Å²	124	93.2 Å²	93.2	58%	0.579	46%	0.461	S	S	*	.	H	α-helix	trans	-67	-47.1	-177.7	-61.4	66.4	-145.3	0	0	110.8	S1082 L1086 L1087 E1088	S1082-E1084 WeakPolarHBondContact CB-OE2 3.33Å; S1082-E1084 PolarHBondContact O-N 3.42Å; E1084-L1086 VanDerWaalsContact C-N 3.34Å; E1084-L1086 PolarHBondContact O-N 3.22Å; E1084-L1087 PolarHBondContact O-N 3.17Å; E1084-E1088 WeakPolarHBondContact O-CB 3.38Å; E1084-E1088 PolarHBondContact O-N 3.34Å
1085	A	84.9	Confident	74.1	Confident	33 Å²	33	88.4 Å²	88.4	27%	0.273	45%	0.447	S	S	.	.	H	α-helix	trans	-63.8	-37.2	178.3	0	0	0	0	0	112.6	S1082 E1088 C1089	S1082-A1085 PolarHBondContact O-N 3.11Å; S1082-A1085 VanDerWaalsContact OG-CB 3.3Å; S1082-A1085 WeakPolarHBondContact OG-CB 3.49Å; S1082-A1085 PolarHBondContact OG-N 3.19Å; S1082-A1085 VanDerWaalsContact OG-N 3.07Å; A1085-E1088 PolarHBondContact O-N 2.58Å; A1085-C1089 PolarHBondContact O-N 3.13Å; A1085-C1089 PolarHBondContact O-SG 3.15Å; A1085-C1089 VanDerWaalsContact O-SG 3.39Å
1086	L	89.3	Confident	76.6	Confident	0 Å²	0	78.9 Å²	78.9	0%	0	42%	0.415	C	S	.	.	H	α-helix	trans	-65.9	-43.6	175.6	-174.4	154.4	0	0	0	111.7	V1081 S1082 E1084 E1088 C1089 A1090 L1120 C1124 Y1127 F1140 I1183 V1187	V1081-L1086 HydrophobicContact CG1-CB 4.5Å; S1082-L1086 PolarHBondContact O-N 2.69Å; E1084-L1086 VanDerWaalsContact C-N 3.34Å; E1084-L1086 PolarHBondContact O-N 3.22Å; L1086-E1088 VanDerWaalsContact C-N 3.33Å; L1086-C1089 PolarHBondContact O-N 3.33Å; L1086-A1090 PolarHBondContact O-N 2.76Å; L1086-L1120 HydrophobicContact CG-CD1 4.46Å; L1086-C1124 HydrophobicContact CD1-CB 4.49Å; L1086-Y1127 VanDerWaalsContact CD1-CB 3.49Å; L1086-Y1127 HydrophobicContact CD1-CD1 3.87Å; L1086-Y1127 HydrophobicContact CD1-CD2 4.43Å; L1086-Y1127 HydrophobicContact CD1-CG 3.68Å; L1086-F1140 HydrophobicContact CD1-CE2 4.15Å; L1086-F1140 HydrophobicContact CD1-CZ 3.74Å; L1086-I1183 HydrophobicContact CD2-CG2 3.96Å; L1086-V1187 HydrophobicContact CD2-CB 4.46Å; L1086-V1187 HydrophobicContact CD2-CG1 4.36Å; L1086-V1187 HydrophobicContact CD2-CG2 3.94Å
1087	L	88.8	Confident	79	Confident	30 Å²	30	72.8 Å²	72.8	16%	0.157	38%	0.379	C	S	.	.	H	α-helix	trans	-64.7	-37.8	176.3	-69.4	171.2	0	0	0	111.4	R1083 E1084 C1089 A1090 E1091 V1187 Q1188	R1083-L1087 HydrophobicContact CG-CD1 4.33Å; R1083-L1087 WeakPolarHBondContact O-CG 3.35Å; R1083-L1087 PolarHBondContact O-N 3.13Å; E1084-L1087 PolarHBondContact O-N 3.17Å; L1087-C1089 PolarHBondContact O-N 3.09Å; L1087-A1090 WeakPolarHBondContact O-CB 3.3Å; L1087-A1090 PolarHBondContact O-N 3.38Å; L1087-A1090 VanDerWaalsContact O-N 3.15Å; L1087-E1091 WeakPolarHBondContact O-CG 3.42Å; L1087-E1091 PolarHBondContact O-N 3.46Å; L1087-V1187 HydrophobicContact CD1-CG1 4.39Å; L1087-V1187 HydrophobicContact CD2-CB 4.38Å; L1087-V1187 HydrophobicContact CD2-CG1 4.16Å; L1087-V1187 HydrophobicContact CG-CG1 4.13Å; L1087-Q1188 HydrophobicContact CD1-CG 4.48Å; L1087-Q1188 HydrophobicContact CD2-CG 4.34Å
1088	E	88.4	Confident	81	Confident	135 Å²	135	69.5 Å²	69.5	63%	0.631	36%	0.358	S	S	*	.	H	α-helix	trans	-62.5	-39.7	174	-171.6	171.2	-158.5	0	0	112.2	E1084 A1085 L1086 S1092	E1084-E1088 WeakPolarHBondContact O-CB 3.38Å; E1084-E1088 PolarHBondContact O-N 3.34Å; A1085-E1088 PolarHBondContact O-N 2.58Å; L1086-E1088 VanDerWaalsContact C-N 3.33Å; E1088-S1092 VanDerWaalsContact O-CB 3.28Å; E1088-S1092 WeakPolarHBondContact O-CB 3.44Å; E1088-S1092 PolarHBondContact O-N 2.94Å; E1088-S1092 PolarHBondContact O-OG 2.7Å
1089	C	89	Confident	82.4	Confident	28 Å²	28	65.6 Å²	65.6	19%	0.189	34%	0.342	C	S	.	.	H	α-helix	trans	-66.6	-37	171.1	-68.8	0	0	0	0	113	A1085 L1086 L1087 S1092 L1093 L1120 C1123	A1085-C1089 PolarHBondContact O-N 3.13Å; A1085-C1089 PolarHBondContact O-SG 3.15Å; A1085-C1089 VanDerWaalsContact O-SG 3.39Å; L1086-C1089 PolarHBondContact O-N 3.33Å; L1087-C1089 PolarHBondContact O-N 3.09Å; C1089-S1092 PolarHBondContact O-N 3.03Å; C1089-L1093 PolarHBondContact O-N 3.35Å; C1089-L1093 VanDerWaalsContact O-N 3.08Å; C1089-L1120 HydrophobicContact CB-CB 4.47Å; C1089-L1120 HydrophobicContact CB-CD1 3.96Å; C1089-C1123 VanDerWaalsContact SG-SG 3.6Å
1090	A	89.5	Confident	83.4	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-67.4	-45.1	177.6	0	0	0	0	0	111.7	L1086 L1087 L1093 S1094 L1120 I1180	L1086-A1090 PolarHBondContact O-N 2.76Å; L1087-A1090 WeakPolarHBondContact O-CB 3.3Å; L1087-A1090 PolarHBondContact O-N 3.38Å; L1087-A1090 VanDerWaalsContact O-N 3.15Å; A1090-L1093 PolarHBondContact O-N 3.07Å; A1090-S1094 WeakPolarHBondContact O-CB 3.14Å; A1090-S1094 PolarHBondContact O-N 3.46Å; A1090-L1120 HydrophobicContact CB-CD1 4.11Å; A1090-I1180 HydrophobicContact CB-CG2 4.01Å; A1090-I1180 WeakPolarHBondContact O-CG2 3.48Å
1091	E	88.9	Confident	83.9	Confident	136 Å²	136	51.8 Å²	51.8	64%	0.636	29%	0.291	S	S	*	.	H	α-helix	trans	-64.3	-39.5	174	-72.4	-178	-174.3	0	0	111.7	L1087 S1094 S1095	L1087-E1091 WeakPolarHBondContact O-CG 3.42Å; L1087-E1091 PolarHBondContact O-N 3.46Å; E1091-S1094 PolarHBondContact O-N 2.95Å; E1091-S1095 WeakPolarHBondContact O-CB 3.26Å; E1091-S1095 PolarHBondContact O-N 3.17Å
1092	S	86.7	Confident	83.2	Confident	62 Å²	62	54.3 Å²	54.3	43%	0.434	31%	0.311	S	S	.	.	H	α-helix	trans	-58.2	-49.7	175	-64.9	0	0	0	0	112	E1088 C1089 S1095 V1096	E1088-S1092 VanDerWaalsContact O-CB 3.28Å; E1088-S1092 WeakPolarHBondContact O-CB 3.44Å; E1088-S1092 PolarHBondContact O-N 2.94Å; E1088-S1092 PolarHBondContact O-OG 2.7Å; C1089-S1092 PolarHBondContact O-N 3.03Å; S1092-S1095 PolarHBondContact O-N 2.92Å; S1092-V1096 WeakPolarHBondContact O-CG2 3.44Å; S1092-V1096 PolarHBondContact O-N 2.85Å; S1092-V1096 VanDerWaalsContact O-N 3.09Å
1093	L	87.9	Confident	82.1	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-66.3	-38.4	177.6	-176.6	60.4	0	0	0	111.9	C1089 A1090 S1095 V1096 L1097 V1113 A1116 L1120 L1147 I1180	C1089-L1093 PolarHBondContact O-N 3.35Å; C1089-L1093 VanDerWaalsContact O-N 3.08Å; A1090-L1093 PolarHBondContact O-N 3.07Å; L1093-S1095 VanDerWaalsContact C-N 3.33Å; L1093-S1095 PolarHBondContact O-N 2.69Å; L1093-V1096 PolarHBondContact O-N 3.48Å; L1093-L1097 HydrophobicContact CG-CD1 4.39Å; L1093-L1097 WeakPolarHBondContact O-CG 3.48Å; L1093-L1097 PolarHBondContact O-N 3.24Å; L1093-V1113 HydrophobicContact CD1-CG1 4.27Å; L1093-V1113 WeakPolarHBondContact CD1-O 3.46Å; L1093-A1116 HydrophobicContact CB-CB 4.44Å; L1093-A1116 HydrophobicContact CD1-CB 3.73Å; L1093-L1120 HydrophobicContact CD2-CD2 3.83Å; L1093-L1147 HydrophobicContact CD2-CD1 4.46Å; L1093-I1180 HydrophobicContact CB-CD1 4.07Å; L1093-I1180 HydrophobicContact CD2-CD1 3.5Å; L1093-I1180 HydrophobicContact CD2-CG1 3.86Å; L1093-I1180 HydrophobicContact CG-CD1 3.51Å; L1093-I1180 HydrophobicContact CG-CG1 4.34Å
1094	S	88.5	Confident	80	Confident	32 Å²	32	55.7 Å²	55.7	22%	0.224	34%	0.341	C	S	.	.	H	α-helix	trans	-61.8	-38.3	175.1	-168.5	0	0	0	0	112.7	A1090 E1091 L1097 S1098	A1090-S1094 WeakPolarHBondContact O-CB 3.14Å; A1090-S1094 PolarHBondContact O-N 3.46Å; E1091-S1094 PolarHBondContact O-N 2.95Å; S1094-L1097 PolarHBondContact O-N 2.58Å; S1094-S1098 WeakPolarHBondContact O-CB 3.39Å; S1094-S1098 PolarHBondContact O-N 2.66Å; S1094-S1098 PolarHBondContact O-OG 2.91Å
1095	S	84.1	Confident	78.2	Confident	78 Å²	78	55.8 Å²	55.8	55%	0.545	36%	0.355	S	S	.	.	H	α-helix	trans	-66.9	-42.1	175	-173.2	0	0	0	0	112.4	E1091 S1092 L1093 S1098 S1099	E1091-S1095 WeakPolarHBondContact O-CB 3.26Å; E1091-S1095 PolarHBondContact O-N 3.17Å; S1092-S1095 PolarHBondContact O-N 2.92Å; L1093-S1095 VanDerWaalsContact C-N 3.33Å; L1093-S1095 PolarHBondContact O-N 2.69Å; S1095-S1098 PolarHBondContact O-N 3.42Å; S1095-S1099 PolarHBondContact O-N 2.92Å; S1095-S1099 PolarHBondContact O-OG 3.47Å; S1095-S1099 VanDerWaalsContact O-OG 3.09Å
1096	V	84.1	Confident	76.7	Confident	34 Å²	34	61.3 Å²	61.3	21%	0.206	38%	0.38	C	S	.	.	H	α-helix	trans	-62.7	-43	173.8	176.9	0	0	0	0	110.8	S1092 L1093 S1099 V1100 P1108 V1113	S1092-V1096 WeakPolarHBondContact O-CG2 3.44Å; S1092-V1096 PolarHBondContact O-N 2.85Å; S1092-V1096 VanDerWaalsContact O-N 3.09Å; L1093-V1096 PolarHBondContact O-N 3.48Å; V1096-S1099 PolarHBondContact O-N 3.38Å; V1096-S1099 PolarHBondContact O-OG 2.79Å; V1096-V1100 WeakPolarHBondContact O-CG2 3.29Å; V1096-V1100 PolarHBondContact O-N 2.75Å; V1096-V1100 VanDerWaalsContact O-N 3.08Å; V1096-P1108 HydrophobicContact CG1-CB 4.35Å; V1096-P1108 HydrophobicContact CG1-CG 4.3Å; V1096-V1113 HydrophobicContact CG1-CG2 3.93Å
1097	L	82.6	Confident	75	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	42%	0.416	C	S	.	.	H	α-helix	trans	-65.3	-40.9	175.2	-68.4	171.7	0	0	0	112.7	L1093 S1094 S1099 V1100 L1101 V1113 L1173 L1176 H1177 I1180	L1093-L1097 HydrophobicContact CG-CD1 4.39Å; L1093-L1097 WeakPolarHBondContact O-CG 3.48Å; L1093-L1097 PolarHBondContact O-N 3.24Å; S1094-L1097 PolarHBondContact O-N 2.58Å; L1097-S1099 VanDerWaalsContact C-N 3.28Å; L1097-S1099 PolarHBondContact O-N 3.46Å; L1097-V1100 WeakPolarHBondContact O-CB 3.3Å; L1097-V1100 PolarHBondContact O-N 2.94Å; L1097-L1101 WeakPolarHBondContact O-CG 3.45Å; L1097-L1101 PolarHBondContact O-N 3.25Å; L1097-V1113 HydrophobicContact CD2-CG1 3.75Å; L1097-L1173 HydrophobicContact CD2-CB 4.49Å; L1097-L1173 HydrophobicContact CD2-CD2 3.57Å; L1097-L1176 HydrophobicContact CD1-CB 4.39Å; L1097-L1176 HydrophobicContact CD1-CD2 4.21Å; L1097-L1176 HydrophobicContact CD1-CG 3.97Å; L1097-L1176 HydrophobicContact CD2-CD2 4.01Å; L1097-H1177 HydrophobicContact CD1-CB 4.25Å; L1097-I1180 HydrophobicContact CD1-CD1 3.42Å; L1097-I1180 VanDerWaalsContact CD1-CD1 3.42Å
1098	S	80	Confident	73.4	Confident	49 Å²	49	66 Å²	66	34%	0.343	42%	0.415	S	S	.	.	H	α-helix	trans	-61.2	-36.8	177.3	-62	0	0	0	0	112	S1094 S1095 S1102	S1094-S1098 WeakPolarHBondContact O-CB 3.39Å; S1094-S1098 PolarHBondContact O-N 2.66Å; S1094-S1098 PolarHBondContact O-OG 2.91Å; S1095-S1098 PolarHBondContact O-N 3.42Å; S1098-S1102 VanDerWaalsContact O-CB 3.25Å; S1098-S1102 WeakPolarHBondContact O-CB 3.39Å; S1098-S1102 PolarHBondContact O-N 3.38Å; S1098-S1102 PolarHBondContact O-OG 3.18Å
1099	S	75.9	Confident	72.3	Confident	55 Å²	55	62.4 Å²	62.4	39%	0.385	41%	0.405	S	S	.	.	H	α-helix	trans	-75.8	-31.4	175.7	52.7	0	0	0	0	113.7	S1095 V1096 L1097	S1095-S1099 PolarHBondContact O-N 2.92Å; S1095-S1099 PolarHBondContact O-OG 3.47Å; S1095-S1099 VanDerWaalsContact O-OG 3.09Å; V1096-S1099 PolarHBondContact O-N 3.38Å; V1096-S1099 PolarHBondContact O-OG 2.79Å; L1097-S1099 VanDerWaalsContact C-N 3.28Å; L1097-S1099 PolarHBondContact O-N 3.46Å
1100	V	73.4	Confident	71.4	Confident	29 Å²	29	61.8 Å²	61.8	18%	0.176	40%	0.401	C	S	.	.	H	α-helix	trans	-59.4	-50	166.4	175	0	0	0	0	110.6	V1096 L1097 S1102 P1108 V1113 L1164 L1173	V1096-V1100 WeakPolarHBondContact O-CG2 3.29Å; V1096-V1100 PolarHBondContact O-N 2.75Å; V1096-V1100 VanDerWaalsContact O-N 3.08Å; L1097-V1100 WeakPolarHBondContact O-CB 3.3Å; L1097-V1100 PolarHBondContact O-N 2.94Å; V1100-S1102 PolarHBondContact O-N 3.02Å; V1100-P1108 HydrophobicContact CG2-CG 3.6Å; V1100-V1113 HydrophobicContact CG2-CG2 4.03Å; V1100-L1164 HydrophobicContact CG1-CD2 4.34Å; V1100-L1173 HydrophobicContact CG1-CD1 3.73Å
1101	L	69.6	Low	70.9	Confident	82 Å²	82	64.7 Å²	64.7	43%	0.429	42%	0.421	S	S	.	.	H	α-helix	trans	-73.2	-23.7	-173.2	-66.9	169.2	0	0	0	113.6	L1097 L1173	L1097-L1101 WeakPolarHBondContact O-CG 3.45Å; L1097-L1101 PolarHBondContact O-N 3.25Å; L1101-L1173 HydrophobicContact CD2-CD1 4.38Å
1102	S	64.3	Low	70.4	Confident	86 Å²	86	63 Å²	63	60%	0.601	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-4.3	-175.5	-57.2	0	0	0	0	115.3	S1098 V1100 S1104	S1098-S1102 VanDerWaalsContact O-CB 3.25Å; S1098-S1102 WeakPolarHBondContact O-CB 3.39Å; S1098-S1102 PolarHBondContact O-N 3.38Å; S1098-S1102 PolarHBondContact O-OG 3.18Å; V1100-S1102 PolarHBondContact O-N 3.02Å; S1102-S1104 PolarHBondContact O-N 3.15Å
1103	A	59.3	Low	70.3	Confident	91 Å²	91	60.1 Å²	60.1	75%	0.752	39%	0.393	S	S	*	.			trans	49.6	52.5	165.4	0	0	0	0	0	117.3
1104	S	40.7	Very low	70.1	Confident	86 Å²	86	61 Å²	61	60%	0.601	40%	0.398	S	S	*	.			trans	-120.4	100	176.6	62.9	0	0	0	0	114	S1102 D1106	S1102-S1104 PolarHBondContact O-N 3.15Å; S1104-D1106 VanDerWaalsContact C-N 3.27Å; S1104-D1106 PolarHBondContact O-N 2.93Å
1105	S	47.2	Very low	69.9	Low	126 Å²	126	63.2 Å²	63.2	88%	0.881	41%	0.407	S	S	*	.	S	Bend	trans	55.4	-37.6	164.9	50.3	0	0	0	0	121.2
1106	D	52.2	Low	70	Confident	149 Å²	149	60.3 Å²	60.3	80%	0.797	39%	0.387	S	S	*	.	S	Bend	trans	-122.9	83.4	176.3	-82.8	-56.6	0	0	0	109.4	S1104 P1108	S1104-D1106 VanDerWaalsContact C-N 3.27Å; S1104-D1106 PolarHBondContact O-N 2.93Å; D1106-P1108 WeakPolarHBondContact O-CD 3.06Å
1107	S	53.1	Low	70.2	Confident	107 Å²	107	58.7 Å²	58.7	75%	0.748	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-71.1	121.7	178.1	56.8	0	0	0	0	110.6
1108	P	56.3	Low	70.6	Confident	20 Å²	20	62.1 Å²	62.1	13%	0.13	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-62.9	144.3	174.5	28.1	-34.8	0	0	0	110.2	V1096 V1100 D1106 Q1112	V1096-P1108 HydrophobicContact CG1-CB 4.35Å; V1096-P1108 HydrophobicContact CG1-CG 4.3Å; V1100-P1108 HydrophobicContact CG2-CG 3.6Å; D1106-P1108 WeakPolarHBondContact O-CD 3.06Å; P1108-Q1112 HydrophobicContact CB-CB 4.44Å
1109	S	65.7	Low	71	Confident	60 Å²	60	65.3 Å²	65.3	42%	0.42	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-74.5	155.9	-175.1	75.9	0	0	0	0	111.4	S1111 Q1112	S1109-S1111 PolarHBondContact O-N 3.45Å; S1109-Q1112 WeakPolarHBondContact O-CB 3.35Å; S1109-Q1112 PolarHBondContact O-N 3.01Å
1110	S	69.7	Low	71.7	Confident	16 Å²	16	62.7 Å²	62.7	11%	0.112	39%	0.385	C	S	.	.	H	α-helix	trans	-53	-28.7	174.1	-172.1	0	0	0	0	113	L1114 S1158	S1110-L1114 WeakPolarHBondContact O-CG 3.49Å; S1110-L1114 PolarHBondContact O-N 3.1Å; S1110-S1158 WeakPolarHBondContact CB-OG 3.31Å; S1110-S1158 VanDerWaalsContact OG-CB 3.3Å; S1110-S1158 WeakPolarHBondContact OG-CB 3.38Å; S1110-S1158 PolarHBondContact OG-OG 3.15Å
1111	S	78	Confident	72.5	Confident	60 Å²	60	62 Å²	62	42%	0.42	38%	0.38	S	S	.	.	H	α-helix	trans	-60.2	-49	171.5	-160.6	0	0	0	0	111.4	S1109 V1113 L1114 D1115	S1109-S1111 PolarHBondContact O-N 3.45Å; S1111-V1113 VanDerWaalsContact C-N 3.27Å; S1111-V1113 PolarHBondContact O-N 3.48Å; S1111-L1114 CarbonylContact O-C 3.53Å; S1111-L1114 WeakPolarHBondContact O-CA 3.48Å; S1111-L1114 WeakPolarHBondContact O-CB 3.36Å; S1111-L1114 PolarHBondContact O-N 2.9Å; S1111-D1115 WeakPolarHBondContact O-CB 3.42Å; S1111-D1115 PolarHBondContact O-N 3.41Å; S1111-D1115 PolarHBondContact OG-OD2 3.17Å
1112	Q	79.7	Confident	73.3	Confident	101 Å²	101	63.9 Å²	63.9	47%	0.472	39%	0.39	S	S	.	.	H	α-helix	trans	-62.4	-33.4	-174.6	-68	171.8	-16	0	0	112.8	P1108 S1109 A1116	P1108-Q1112 HydrophobicContact CB-CB 4.44Å; S1109-Q1112 WeakPolarHBondContact O-CB 3.35Å; S1109-Q1112 PolarHBondContact O-N 3.01Å; Q1112-A1116 WeakPolarHBondContact O-CB 3.45Å; Q1112-A1116 PolarHBondContact O-N 3.28Å; Q1112-A1116 VanDerWaalsContact O-N 3.08Å
1113	V	83.4	Confident	74.4	Confident	2 Å²	2	61.1 Å²	61.1	1%	0.012	37%	0.371	C	S	.	.	H	α-helix	trans	-66.9	-43.7	172	-174.8	0	0	0	0	111.1	L1093 V1096 L1097 V1100 S1111 G1117 L1154 L1176	L1093-V1113 HydrophobicContact CD1-CG1 4.27Å; L1093-V1113 WeakPolarHBondContact CD1-O 3.46Å; V1096-V1113 HydrophobicContact CG1-CG2 3.93Å; L1097-V1113 HydrophobicContact CD2-CG1 3.75Å; V1100-V1113 HydrophobicContact CG2-CG2 4.03Å; S1111-V1113 VanDerWaalsContact C-N 3.27Å; S1111-V1113 PolarHBondContact O-N 3.48Å; V1113-G1117 PolarHBondContact O-N 3.43Å; V1113-L1154 HydrophobicContact CB-CD2 3.99Å; V1113-L1154 HydrophobicContact CG1-CD2 3.52Å; V1113-L1176 HydrophobicContact CG1-CD2 3.78Å
1114	L	84.9	Confident	75.8	Confident	18 Å²	18	56.8 Å²	56.8	9%	0.094	34%	0.335	C	S	.	.	H	α-helix	trans	-68.1	-41.2	177.8	-68.9	168.4	0	0	0	112.3	S1110 S1111 G1117 H1118 L1151 L1154 R1155	S1110-L1114 WeakPolarHBondContact O-CG 3.49Å; S1110-L1114 PolarHBondContact O-N 3.1Å; S1111-L1114 CarbonylContact O-C 3.53Å; S1111-L1114 WeakPolarHBondContact O-CA 3.48Å; S1111-L1114 WeakPolarHBondContact O-CB 3.36Å; S1111-L1114 PolarHBondContact O-N 2.9Å; L1114-G1117 PolarHBondContact O-N 3.38Å; L1114-H1118 PolarHBondContact O-CD2 3.25Å; L1114-H1118 PolarHBondContact O-N 3.47Å; L1114-L1151 HydrophobicContact CD2-CB 4.35Å; L1114-L1151 HydrophobicContact CD2-CD2 4.08Å; L1114-L1151 VanDerWaalsContact CD2-O 3.31Å; L1114-L1151 WeakPolarHBondContact CD2-O 3.43Å; L1114-L1154 HydrophobicContact CD2-CB 4.09Å; L1114-L1154 HydrophobicContact CD2-CD2 3.92Å; L1114-L1154 HydrophobicContact CD2-CG 4.07Å; L1114-L1154 HydrophobicContact CG-CD2 4.13Å; L1114-L1154 HydrophobicContact CG-CG 4.37Å; L1114-R1155 HydrophobicContact CD1-CB 4.13Å; L1114-R1155 HydrophobicContact CD1-CG 4.39Å; L1114-R1155 HydrophobicContact CD2-CB 4.01Å
1115	D	84.6	Confident	77.9	Confident	79 Å²	79	55.8 Å²	55.8	42%	0.422	33%	0.328	S	S	.	.	H	α-helix	trans	-67.3	-40.9	-179	-65.3	-42.8	0	0	0	110.9	S1111 Q1119	S1111-D1115 WeakPolarHBondContact O-CB 3.42Å; S1111-D1115 PolarHBondContact O-N 3.41Å; S1111-D1115 PolarHBondContact OG-OD2 3.17Å; D1115-Q1119 WeakPolarHBondContact O-CG 3.38Å; D1115-Q1119 PolarHBondContact O-N 3.46Å; D1115-Q1119 PolarHBondContact O-NE2 3.36Å
1116	A	86.2	Confident	79.6	Confident	16 Å²	16	50.5 Å²	50.5	13%	0.132	29%	0.293	C	S	.	.	H	α-helix	trans	-71.1	-34.9	171.2	0	0	0	0	0	112.4	L1093 Q1112 Q1119 L1120	L1093-A1116 HydrophobicContact CB-CB 4.44Å; L1093-A1116 HydrophobicContact CD1-CB 3.73Å; Q1112-A1116 WeakPolarHBondContact O-CB 3.45Å; Q1112-A1116 PolarHBondContact O-N 3.28Å; Q1112-A1116 VanDerWaalsContact O-N 3.08Å; A1116-Q1119 PolarHBondContact O-N 2.82Å; A1116-L1120 PolarHBondContact O-N 2.87Å
1117	G	88.6	Confident	81.1	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-60.8	-45.1	173.5	0	0	0	0	0	113.4	V1113 L1114 L1120 L1121	V1113-G1117 PolarHBondContact O-N 3.43Å; L1114-G1117 PolarHBondContact O-N 3.38Å; G1117-L1120 PolarHBondContact O-N 3.28Å; G1117-L1121 WeakPolarHBondContact O-CG 3.48Å; G1117-L1121 PolarHBondContact O-N 3.44Å
1118	H	89.6	Confident	82.5	Confident	73 Å²	73	40.2 Å²	40.2	34%	0.338	23%	0.228	S	C	.	.	H	α-helix	trans	-67.1	-37.9	176.2	-74.5	-54	0	0	0	112.4	L1114 L1120 L1121 D1122	L1114-H1118 PolarHBondContact O-CD2 3.25Å; L1114-H1118 PolarHBondContact O-N 3.47Å; H1118-L1120 VanDerWaalsContact C-N 3.35Å; H1118-L1120 PolarHBondContact O-N 3.07Å; H1118-L1121 WeakPolarHBondContact O-CB 3.35Å; H1118-L1121 PolarHBondContact O-N 3.11Å; H1118-D1122 PolarHBondContact O-N 3.34Å
1119	Q	88.6	Confident	83.6	Confident	116 Å²	116	44.7 Å²	44.7	54%	0.542	25%	0.251	S	S	.	.	H	α-helix	trans	-60.9	-41	172.6	-75.4	165.8	76	0	0	112.6	D1115 A1116 D1122 C1123	D1115-Q1119 WeakPolarHBondContact O-CG 3.38Å; D1115-Q1119 PolarHBondContact O-N 3.46Å; D1115-Q1119 PolarHBondContact O-NE2 3.36Å; A1116-Q1119 PolarHBondContact O-N 2.82Å; Q1119-D1122 PolarHBondContact O-N 3.09Å; Q1119-C1123 PolarHBondContact O-N 2.9Å; Q1119-C1123 VanDerWaalsContact O-N 3.09Å; Q1119-C1123 PolarHBondContact O-SG 2.8Å
1120	L	90	Very high	84.3	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-65.1	-38.5	174.1	-179.6	59.2	0	0	0	111.8	L1086 C1089 A1090 L1093 A1116 G1117 H1118 C1123 C1124 L1147 I1180	L1086-L1120 HydrophobicContact CG-CD1 4.46Å; C1089-L1120 HydrophobicContact CB-CB 4.47Å; C1089-L1120 HydrophobicContact CB-CD1 3.96Å; A1090-L1120 HydrophobicContact CB-CD1 4.11Å; L1093-L1120 HydrophobicContact CD2-CD2 3.83Å; A1116-L1120 PolarHBondContact O-N 2.87Å; G1117-L1120 PolarHBondContact O-N 3.28Å; H1118-L1120 VanDerWaalsContact C-N 3.35Å; H1118-L1120 PolarHBondContact O-N 3.07Å; L1120-C1123 PolarHBondContact O-N 3.18Å; L1120-C1124 VanDerWaalsContact O-CB 3.3Å; L1120-C1124 WeakPolarHBondContact O-CB 3.3Å; L1120-C1124 PolarHBondContact O-N 3.23Å; L1120-C1124 PolarHBondContact O-SG 3.21Å; L1120-L1147 HydrophobicContact CB-CD2 4.47Å; L1120-L1147 HydrophobicContact CD2-CD2 3.78Å; L1120-L1147 HydrophobicContact CG-CD2 3.89Å; L1120-I1180 HydrophobicContact CD2-CG1 4.12Å
1121	L	90.3	Very high	84.9	Confident	14 Å²	14	44.5 Å²	44.5	7%	0.073	25%	0.247	C	C	.	.	H	α-helix	trans	-64.6	-41.7	175.9	-76.4	173.8	0	0	0	113.2	G1117 H1118 C1124 S1125 V1144 L1147 E1148 L1151	G1117-L1121 WeakPolarHBondContact O-CG 3.48Å; G1117-L1121 PolarHBondContact O-N 3.44Å; H1118-L1121 WeakPolarHBondContact O-CB 3.35Å; H1118-L1121 PolarHBondContact O-N 3.11Å; L1121-C1124 PolarHBondContact O-N 3.26Å; L1121-S1125 WeakPolarHBondContact O-CB 3.3Å; L1121-S1125 PolarHBondContact O-N 3.01Å; L1121-S1125 PolarHBondContact O-OG 3.48Å; L1121-V1144 HydrophobicContact CD2-CG1 3.94Å; L1121-L1147 HydrophobicContact CD2-CB 4.31Å; L1121-L1147 HydrophobicContact CD2-CD2 3.64Å; L1121-L1147 HydrophobicContact CD2-CG 3.75Å; L1121-L1147 HydrophobicContact CG-CD2 3.97Å; L1121-L1147 HydrophobicContact CG-CG 4.08Å; L1121-E1148 HydrophobicContact CD1-CG 3.93Å; L1121-E1148 HydrophobicContact CD2-CG 3.48Å; L1121-E1148 VanDerWaalsContact CD2-CG 3.48Å; L1121-E1148 HydrophobicContact CG-CG 4.37Å; L1121-L1151 HydrophobicContact CD1-CD1 3.65Å; L1121-L1151 HydrophobicContact CG-CD1 4.16Å
1122	D	87.3	Confident	84.5	Confident	121 Å²	121	47.6 Å²	47.6	65%	0.647	27%	0.266	S	S	*	.	H	α-helix	trans	-64.4	-44.2	175.9	-75.7	-29.2	0	0	0	111	H1118 Q1119 S1125 G1126	H1118-D1122 PolarHBondContact O-N 3.34Å; Q1119-D1122 PolarHBondContact O-N 3.09Å; D1122-S1125 WeakPolarHBondContact O-CB 3.17Å; D1122-S1125 PolarHBondContact O-N 3.48Å; D1122-G1126 PolarHBondContact O-N 3.12Å; D1122-G1126 VanDerWaalsContact O-N 3.11Å
1123	C	86.8	Confident	84.2	Confident	28 Å²	28	48.5 Å²	48.5	19%	0.189	27%	0.27	C	S	.	.	H	α-helix	trans	-64.1	-43	175.6	-66.4	0	0	0	0	112	V1081 C1089 Q1119 L1120 S1125 G1126 Y1127	V1081-C1123 HydrophobicContact CG1-CB 4.16Å; C1089-C1123 VanDerWaalsContact SG-SG 3.6Å; Q1119-C1123 PolarHBondContact O-N 2.9Å; Q1119-C1123 VanDerWaalsContact O-N 3.09Å; Q1119-C1123 PolarHBondContact O-SG 2.8Å; L1120-C1123 PolarHBondContact O-N 3.18Å; C1123-S1125 VanDerWaalsContact C-N 3.34Å; C1123-S1125 PolarHBondContact O-N 3.48Å; C1123-G1126 PolarHBondContact O-N 2.93Å; C1123-Y1127 WeakPolarHBondContact O-CB 3.29Å; C1123-Y1127 PolarHBondContact O-N 2.75Å
1124	C	89.3	Confident	83.8	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-58.3	-47.5	173.4	-73.2	0	0	0	0	110.9	L1086 L1120 L1121 G1126 Y1127 V1128 F1140 V1144	L1086-C1124 HydrophobicContact CD1-CB 4.49Å; L1120-C1124 VanDerWaalsContact O-CB 3.3Å; L1120-C1124 WeakPolarHBondContact O-CB 3.3Å; L1120-C1124 PolarHBondContact O-N 3.23Å; L1120-C1124 PolarHBondContact O-SG 3.21Å; L1121-C1124 PolarHBondContact O-N 3.26Å; C1124-G1126 VanDerWaalsContact C-N 3.31Å; C1124-G1126 PolarHBondContact O-N 2.9Å; C1124-Y1127 CarbonylContact O-C 3.54Å; C1124-Y1127 WeakPolarHBondContact O-CA 3.37Å; C1124-Y1127 PolarHBondContact O-N 3.08Å; C1124-V1128 VanDerWaalsContact O-CG2 3.31Å; C1124-V1128 WeakPolarHBondContact O-CG2 3.4Å; C1124-V1128 PolarHBondContact O-N 3.05Å; C1124-F1140 HydrophobicContact CB-CE1 4.3Å; C1124-F1140 HydrophobicContact CB-CZ 3.95Å; C1124-V1144 HydrophobicContact CB-CG2 3.69Å
1125	S	84.4	Confident	83.3	Confident	65 Å²	65	63.2 Å²	63.2	46%	0.455	34%	0.337	S	S	.	.	H	α-helix	trans	-57.8	-40	-179.5	-64.1	0	0	0	0	112.9	L1121 D1122 C1123	L1121-S1125 WeakPolarHBondContact O-CB 3.3Å; L1121-S1125 PolarHBondContact O-N 3.01Å; L1121-S1125 PolarHBondContact O-OG 3.48Å; D1122-S1125 WeakPolarHBondContact O-CB 3.17Å; D1122-S1125 PolarHBondContact O-N 3.48Å; C1123-S1125 VanDerWaalsContact C-N 3.34Å; C1123-S1125 PolarHBondContact O-N 3.48Å
1126	G	82.1	Confident	83.1	Confident	15 Å²	15	60.5 Å²	60.5	16%	0.155	32%	0.323	C	S	.	.	H	α-helix	trans	-70.4	-28.8	172	0	0	0	0	0	114.1	D1122 C1123 C1124	D1122-G1126 PolarHBondContact O-N 3.12Å; D1122-G1126 VanDerWaalsContact O-N 3.11Å; C1123-G1126 PolarHBondContact O-N 2.93Å; C1124-G1126 VanDerWaalsContact C-N 3.31Å; C1124-G1126 PolarHBondContact O-N 2.9Å
1127	Y	84.8	Confident	83	Confident	32 Å²	32	62.2 Å²	62.2	13%	0.125	33%	0.327	C	S	.	.	H	α-helix	trans	-86.2	-26.1	-178.1	-165.3	-97.7	0	0	0	114.5	R1083 L1086 C1123 C1124 D1129 C1130 I1131 F1140 V1187	R1083-Y1127 HydrophobicContact CB-CE2 4.04Å; L1086-Y1127 VanDerWaalsContact CD1-CB 3.49Å; L1086-Y1127 HydrophobicContact CD1-CD1 3.87Å; L1086-Y1127 HydrophobicContact CD1-CD2 4.43Å; L1086-Y1127 HydrophobicContact CD1-CG 3.68Å; C1123-Y1127 WeakPolarHBondContact O-CB 3.29Å; C1123-Y1127 PolarHBondContact O-N 2.75Å; C1124-Y1127 CarbonylContact O-C 3.54Å; C1124-Y1127 WeakPolarHBondContact O-CA 3.37Å; C1124-Y1127 PolarHBondContact O-N 3.08Å; Y1127-D1129 PolarHBondContact O-N 3.4Å; Y1127-C1130 HydrophobicContact CD2-CB 4.35Å; Y1127-C1130 HydrophobicContact CE2-CB 4.43Å; Y1127-C1130 WeakPolarHBondContact O-CB 3.32Å; Y1127-C1130 PolarHBondContact O-N 3.49Å; Y1127-I1131 HydrophobicContact CD1-CD1 4.07Å; Y1127-I1131 HydrophobicContact CD1-CG1 3.94Å; Y1127-I1131 HydrophobicContact CE1-CD1 4.07Å; Y1127-I1131 HydrophobicContact CE1-CG1 3.72Å; Y1127-F1140 HydrophobicContact CD1-CE1 4.31Å; Y1127-F1140 HydrophobicContact CD1-CE2 4.28Å; Y1127-F1140 AromaticContact CD1-CZ 3.88Å; Y1127-F1140 HydrophobicContact CD1-CZ 3.88Å; Y1127-V1187 HydrophobicContact CD1-CG2 4.24Å; Y1127-V1187 HydrophobicContact CE1-CG1 4.1Å; Y1127-V1187 HydrophobicContact CE1-CG2 3.88Å
1128	V	83.3	Confident	82.5	Confident	8 Å²	8	68.6 Å²	68.6	5%	0.048	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-50.3	-40.4	-177.5	-178	0	0	0	0	112.1	C1124 C1130 I1131 K1137 F1140 R1141	C1124-V1128 VanDerWaalsContact O-CG2 3.31Å; C1124-V1128 WeakPolarHBondContact O-CG2 3.4Å; C1124-V1128 PolarHBondContact O-N 3.05Å; V1128-C1130 VanDerWaalsContact C-N 3.34Å; V1128-I1131 PolarHBondContact O-N 2.98Å; V1128-K1137 HydrophobicContact CG1-CG 4.17Å; V1128-K1137 WeakPolarHBondContact O-CE 3.37Å; V1128-K1137 PolarHBondContact O-NZ 3.3Å; V1128-F1140 HydrophobicContact CB-CD1 4.29Å; V1128-F1140 HydrophobicContact CB-CE1 4.15Å; V1128-F1140 HydrophobicContact CG1-CD1 4.45Å; V1128-F1140 HydrophobicContact CG2-CD1 3.86Å; V1128-F1140 HydrophobicContact CG2-CE1 3.57Å; V1128-R1141 HydrophobicContact CG1-CG 3.8Å; V1128-R1141 VanDerWaalsContact CG1-CZ 3.42Å
1129	D	79	Confident	82.1	Confident	114 Å²	114	66.4 Å²	66.4	61%	0.61	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-86.3	-2.4	-176.9	-69.5	-32.5	0	0	0	114.6	Y1127 K1137 R1141	Y1127-D1129 PolarHBondContact O-N 3.4Å; D1129-K1137 WeakPolarHBondContact OD1-CE 3.25Å; D1129-K1137 IonicContact OD1-NZ 3.98Å; D1129-K1137 PolarHBondContact OD1-NZ 3.02Å; D1129-R1141 IonicContact OD1-NH2 2.69Å
1130	C	80.1	Confident	82.2	Confident	54 Å²	54	60.9 Å²	60.9	37%	0.365	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-86.4	-14	167.5	-64.7	0	0	0	0	113.4	Y1127 V1128 P1132	Y1127-C1130 HydrophobicContact CD2-CB 4.35Å; Y1127-C1130 HydrophobicContact CE2-CB 4.43Å; Y1127-C1130 WeakPolarHBondContact O-CB 3.32Å; Y1127-C1130 PolarHBondContact O-N 3.49Å; V1128-C1130 VanDerWaalsContact C-N 3.34Å; C1130-P1132 WeakPolarHBondContact O-CD 3.38Å
1131	I	82.6	Confident	82.1	Confident	19 Å²	19	67.4 Å²	67.4	10%	0.097	35%	0.349	C	S	.	.			trans	-79.1	117.7	-179	-56.6	176.2	0	0	0	110.5	Y1127 V1128 N1136 K1137 F1140	Y1127-I1131 HydrophobicContact CD1-CD1 4.07Å; Y1127-I1131 HydrophobicContact CD1-CG1 3.94Å; Y1127-I1131 HydrophobicContact CE1-CD1 4.07Å; Y1127-I1131 HydrophobicContact CE1-CG1 3.72Å; V1128-I1131 PolarHBondContact O-N 2.98Å; I1131-N1136 HydrophobicContact CG2-CB 4.09Å; I1131-K1137 HydrophobicContact CB-CB 4.18Å; I1131-K1137 HydrophobicContact CB-CG 4.43Å; I1131-K1137 HydrophobicContact CG2-CB 3.9Å; I1131-F1140 HydrophobicContact CD1-CB 3.6Å; I1131-F1140 HydrophobicContact CD1-CD1 3.42Å; I1131-F1140 VanDerWaalsContact CD1-CD1 3.42Å; I1131-F1140 HydrophobicContact CD1-CD2 3.87Å; I1131-F1140 HydrophobicContact CD1-CE1 3.99Å; I1131-F1140 HydrophobicContact CD1-CE2 4.38Å; I1131-F1140 HydrophobicContact CD1-CG 3.35Å; I1131-F1140 HydrophobicContact CD1-CZ 4.43Å
1132	P	68.9	Low	82	Confident	125 Å²	125	71.1 Å²	71.1	81%	0.812	37%	0.366	S	S	*	.			trans	-86.6	-23.6	-172.9	33.5	-35.5	0	0	0	114.3	C1130	C1130-P1132 WeakPolarHBondContact O-CD 3.38Å
1133	Q	74.4	Confident	82.1	Confident	119 Å²	119	65.4 Å²	65.4	56%	0.556	34%	0.335	S	S	*	.			trans	-91.9	119.7	-179.9	-65.2	-173	14.3	0	0	110.5	R1135 N1136 K1137	Q1133-R1135 VanDerWaalsContact C-N 3.29Å; Q1133-R1135 PolarHBondContact O-N 2.98Å; Q1133-N1136 HydrophobicContact CB-CB 4.35Å; Q1133-N1136 PolarHBondContact O-N 2.96Å; Q1133-N1136 VanDerWaalsContact O-N 3.16Å; Q1133-K1137 WeakPolarHBondContact O-CB 3.46Å; Q1133-K1137 PolarHBondContact O-N 3Å
1134	T	73.7	Confident	82.3	Confident	117 Å²	117	64.6 Å²	64.6	72%	0.718	33%	0.329	S	S	*	.	H	α-helix	trans	-55	-40.1	-179.3	42	0	0	0	0	113.2	K1137 F1138	T1134-K1137 PolarHBondContact O-N 3.42Å; T1134-F1138 WeakPolarHBondContact O-CB 3.47Å; T1134-F1138 PolarHBondContact O-N 2.85Å
1135	R	74.3	Confident	82.4	Confident	212 Å²	212	65.8 Å²	65.8	80%	0.8	34%	0.341	S	S	*	.	H	α-helix	trans	-63.2	-44.2	177.1	-173.1	177.3	-179.6	179.9	0.3	113.1	Q1133 F1138 A1139	Q1133-R1135 VanDerWaalsContact C-N 3.29Å; Q1133-R1135 PolarHBondContact O-N 2.98Å; R1135-F1138 PolarHBondContact O-N 3.45Å; R1135-A1139 PolarHBondContact O-N 3.15Å; R1135-A1139 VanDerWaalsContact O-N 3.16Å
1136	N	79.8	Confident	82.6	Confident	22 Å²	22	65.7 Å²	65.7	12%	0.118	33%	0.333	C	S	.	.	H	α-helix	trans	-71.6	-36.5	176.6	-68.5	11	0	0	0	110.4	I1131 Q1133 F1138 A1139 F1140 V1186	I1131-N1136 HydrophobicContact CG2-CB 4.09Å; Q1133-N1136 HydrophobicContact CB-CB 4.35Å; Q1133-N1136 PolarHBondContact O-N 2.96Å; Q1133-N1136 VanDerWaalsContact O-N 3.16Å; N1136-F1138 VanDerWaalsContact C-N 3.31Å; N1136-F1138 PolarHBondContact O-N 3.42Å; N1136-A1139 PolarHBondContact O-N 3.39Å; N1136-F1140 VanDerWaalsContact O-CB 3.26Å; N1136-F1140 WeakPolarHBondContact O-CB 3.49Å; N1136-F1140 PolarHBondContact O-N 3.48Å; N1136-V1186 HydrophobicContact CB-CG1 4.34Å; N1136-V1186 WeakPolarHBondContact O-CG1 3.28Å
1137	K	84.4	Confident	83	Confident	52 Å²	52	65 Å²	65	23%	0.226	33%	0.325	C	S	.	.	H	α-helix	trans	-63.8	-33.4	174.9	-170.4	167	-177.4	161	0	112.8	V1128 D1129 I1131 Q1133 T1134 R1141	V1128-K1137 HydrophobicContact CG1-CG 4.17Å; V1128-K1137 WeakPolarHBondContact O-CE 3.37Å; V1128-K1137 PolarHBondContact O-NZ 3.3Å; D1129-K1137 WeakPolarHBondContact OD1-CE 3.25Å; D1129-K1137 IonicContact OD1-NZ 3.98Å; D1129-K1137 PolarHBondContact OD1-NZ 3.02Å; I1131-K1137 HydrophobicContact CB-CB 4.18Å; I1131-K1137 HydrophobicContact CB-CG 4.43Å; I1131-K1137 HydrophobicContact CG2-CB 3.9Å; Q1133-K1137 WeakPolarHBondContact O-CB 3.46Å; Q1133-K1137 PolarHBondContact O-N 3Å; T1134-K1137 PolarHBondContact O-N 3.42Å; K1137-R1141 WeakPolarHBondContact O-CB 3.49Å; K1137-R1141 WeakPolarHBondContact O-CG 3.42Å; K1137-R1141 PolarHBondContact O-N 3.23Å
1138	F	78.2	Confident	83.4	Confident	134 Å²	134	68.3 Å²	68.3	59%	0.588	34%	0.342	S	S	*	.	H	α-helix	trans	-66	-55.7	170.6	-176.7	-82.6	0	0	0	111	T1134 R1135 N1136 F1140 R1141 E1142	T1134-F1138 WeakPolarHBondContact O-CB 3.47Å; T1134-F1138 PolarHBondContact O-N 2.85Å; R1135-F1138 PolarHBondContact O-N 3.45Å; N1136-F1138 VanDerWaalsContact C-N 3.31Å; N1136-F1138 PolarHBondContact O-N 3.42Å; F1138-F1140 PolarHBondContact O-N 3.05Å; F1138-R1141 PolarHBondContact O-N 3.48Å; F1138-R1141 VanDerWaalsContact O-N 3.09Å; F1138-E1142 PolarHBondContact O-N 3.17Å
1139	A	81.9	Confident	83.6	Confident	27 Å²	27	73 Å²	73	22%	0.223	37%	0.367	C	S	.	.	H	α-helix	trans	-58.5	-35.5	179.6	0	0	0	0	0	112.6	R1135 N1136 E1142 A1143 V1186	R1135-A1139 PolarHBondContact O-N 3.15Å; R1135-A1139 VanDerWaalsContact O-N 3.16Å; N1136-A1139 PolarHBondContact O-N 3.39Å; A1139-E1142 PolarHBondContact O-N 3.04Å; A1139-A1143 WeakPolarHBondContact O-CB 3.49Å; A1139-A1143 PolarHBondContact O-N 2.71Å; A1139-V1186 HydrophobicContact CB-CG2 3.88Å
1140	F	89.8	Confident	84	Confident	0 Å²	0	68 Å²	68	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-65.4	-49.1	173.9	-171.3	-107.4	0	0	0	112	L1086 C1124 Y1127 V1128 I1131 N1136 F1138 E1142 A1143 V1144 I1183 V1186 V1187	L1086-F1140 HydrophobicContact CD1-CE2 4.15Å; L1086-F1140 HydrophobicContact CD1-CZ 3.74Å; C1124-F1140 HydrophobicContact CB-CE1 4.3Å; C1124-F1140 HydrophobicContact CB-CZ 3.95Å; Y1127-F1140 HydrophobicContact CD1-CE1 4.31Å; Y1127-F1140 HydrophobicContact CD1-CE2 4.28Å; Y1127-F1140 AromaticContact CD1-CZ 3.88Å; Y1127-F1140 HydrophobicContact CD1-CZ 3.88Å; V1128-F1140 HydrophobicContact CB-CD1 4.29Å; V1128-F1140 HydrophobicContact CB-CE1 4.15Å; V1128-F1140 HydrophobicContact CG1-CD1 4.45Å; V1128-F1140 HydrophobicContact CG2-CD1 3.86Å; V1128-F1140 HydrophobicContact CG2-CE1 3.57Å; I1131-F1140 HydrophobicContact CD1-CB 3.6Å; I1131-F1140 HydrophobicContact CD1-CD1 3.42Å; I1131-F1140 VanDerWaalsContact CD1-CD1 3.42Å; I1131-F1140 HydrophobicContact CD1-CD2 3.87Å; I1131-F1140 HydrophobicContact CD1-CE1 3.99Å; I1131-F1140 HydrophobicContact CD1-CE2 4.38Å; I1131-F1140 HydrophobicContact CD1-CG 3.35Å; I1131-F1140 HydrophobicContact CD1-CZ 4.43Å; N1136-F1140 VanDerWaalsContact O-CB 3.26Å; N1136-F1140 WeakPolarHBondContact O-CB 3.49Å; N1136-F1140 PolarHBondContact O-N 3.48Å; F1138-F1140 PolarHBondContact O-N 3.05Å; F1140-E1142 VanDerWaalsContact C-N 3.29Å; F1140-E1142 PolarHBondContact O-N 3.33Å; F1140-A1143 PolarHBondContact O-N 3.45Å; F1140-V1144 HydrophobicContact CD1-CG2 4.34Å; F1140-V1144 HydrophobicContact CE1-CG2 4.15Å; F1140-V1144 HydrophobicContact CZ-CG2 4.29Å; F1140-V1144 WeakPolarHBondContact O-CB 3.34Å; F1140-V1144 VanDerWaalsContact O-CG2 3.25Å; F1140-V1144 WeakPolarHBondContact O-CG2 3.38Å; F1140-V1144 PolarHBondContact O-N 3.35Å; F1140-I1183 HydrophobicContact CE2-CG2 3.98Å; F1140-V1186 HydrophobicContact CB-CG1 3.77Å; F1140-V1186 HydrophobicContact CD2-CG1 4.18Å; F1140-V1186 HydrophobicContact CG-CG1 4.46Å; F1140-V1187 HydrophobicContact CD2-CG2 3.83Å; F1140-V1187 HydrophobicContact CE2-CG2 3.41Å; F1140-V1187 VanDerWaalsContact CE2-CG2 3.41Å; F1140-V1187 HydrophobicContact CZ-CG2 4.39Å
1141	R	89.2	Confident	84.4	Confident	138 Å²	138	65.6 Å²	65.6	52%	0.521	32%	0.324	S	S	.	.	H	α-helix	trans	-62.2	-35.3	175.5	-78.2	-174.8	175.6	-77.8	-1.5	112.4	V1128 D1129 K1137 F1138 G1145	V1128-R1141 HydrophobicContact CG1-CG 3.8Å; V1128-R1141 VanDerWaalsContact CG1-CZ 3.42Å; D1129-R1141 IonicContact OD1-NH2 2.69Å; K1137-R1141 WeakPolarHBondContact O-CB 3.49Å; K1137-R1141 WeakPolarHBondContact O-CG 3.42Å; K1137-R1141 PolarHBondContact O-N 3.23Å; F1138-R1141 PolarHBondContact O-N 3.48Å; F1138-R1141 VanDerWaalsContact O-N 3.09Å; R1141-G1145 PolarHBondContact O-N 2.97Å
1142	E	88.2	Confident	84.6	Confident	92 Å²	92	71.3 Å²	71.3	43%	0.43	35%	0.35	S	S	.	.	H	α-helix	trans	-63.3	-51	174.9	-167.4	-163.4	130.5	0	0	111.1	F1138 A1139 F1140 V1144 G1145 K1146	F1138-E1142 PolarHBondContact O-N 3.17Å; A1139-E1142 PolarHBondContact O-N 3.04Å; F1140-E1142 VanDerWaalsContact C-N 3.29Å; F1140-E1142 PolarHBondContact O-N 3.33Å; E1142-V1144 VanDerWaalsContact C-N 3.35Å; E1142-V1144 PolarHBondContact O-N 3.33Å; E1142-G1145 PolarHBondContact O-N 2.86Å; E1142-G1145 VanDerWaalsContact O-N 3.15Å; E1142-K1146 WeakPolarHBondContact O-CG 3.47Å; E1142-K1146 PolarHBondContact O-N 2.77Å; E1142-K1146 WeakPolarHBondContact OE1-CE 3.27Å; E1142-K1146 IonicContact OE1-NZ 2.91Å; E1142-K1146 PolarHBondContact OE1-NZ 3.43Å
1143	A	88.5	Confident	85.3	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-65.5	-35.8	179.5	0	0	0	0	0	112.7	A1139 F1140 K1146 L1147 E1182 I1183	A1139-A1143 WeakPolarHBondContact O-CB 3.49Å; A1139-A1143 PolarHBondContact O-N 2.71Å; F1140-A1143 PolarHBondContact O-N 3.45Å; A1143-K1146 PolarHBondContact O-N 2.93Å; A1143-L1147 PolarHBondContact O-N 2.89Å; A1143-E1182 HydrophobicContact CB-CB 3.76Å; A1143-I1183 HydrophobicContact CB-CG1 3.66Å
1144	V	91.9	Very high	85.7	Confident	11 Å²	11	64.6 Å²	64.6	7%	0.067	31%	0.308	C	S	.	.	H	α-helix	trans	-64.1	-41.1	171	170.5	0	0	0	0	111.5	L1121 C1124 F1140 E1142 K1146 L1147 E1148 I1183	L1121-V1144 HydrophobicContact CD2-CG1 3.94Å; C1124-V1144 HydrophobicContact CB-CG2 3.69Å; F1140-V1144 HydrophobicContact CD1-CG2 4.34Å; F1140-V1144 HydrophobicContact CE1-CG2 4.15Å; F1140-V1144 HydrophobicContact CZ-CG2 4.29Å; F1140-V1144 WeakPolarHBondContact O-CB 3.34Å; F1140-V1144 VanDerWaalsContact O-CG2 3.25Å; F1140-V1144 WeakPolarHBondContact O-CG2 3.38Å; F1140-V1144 PolarHBondContact O-N 3.35Å; E1142-V1144 VanDerWaalsContact C-N 3.35Å; E1142-V1144 PolarHBondContact O-N 3.33Å; V1144-K1146 PolarHBondContact O-N 3.1Å; V1144-L1147 WeakPolarHBondContact O-CB 3.31Å; V1144-L1147 PolarHBondContact O-N 2.94Å; V1144-E1148 WeakPolarHBondContact O-CG 3.41Å; V1144-E1148 PolarHBondContact O-N 3.03Å; V1144-I1183 HydrophobicContact CG2-CD1 4.21Å; V1144-I1183 HydrophobicContact CG2-CG1 4.45Å
1145	G	90.1	Very high	86.1	Confident	25 Å²	25	66.5 Å²	66.5	26%	0.258	30%	0.302	S	S	.	.	H	α-helix	trans	-64	-37.1	174.8	0	0	0	0	0	113.4	R1141 E1142 E1148 L1149	R1141-G1145 PolarHBondContact O-N 2.97Å; E1142-G1145 PolarHBondContact O-N 2.86Å; E1142-G1145 VanDerWaalsContact O-N 3.15Å; G1145-E1148 PolarHBondContact O-N 2.87Å; G1145-L1149 WeakPolarHBondContact O-CG 3.49Å; G1145-L1149 PolarHBondContact O-N 3.43Å; G1145-L1149 VanDerWaalsContact O-N 3.15Å
1146	K	89.8	Confident	86.2	Confident	63 Å²	63	59.3 Å²	59.3	27%	0.274	29%	0.288	S	S	.	.	H	α-helix	trans	-65.2	-37.9	172	-62.1	169.9	-172.5	161	0	111.8	E1142 A1143 V1144 S1150 C1179 E1182	E1142-K1146 WeakPolarHBondContact O-CG 3.47Å; E1142-K1146 PolarHBondContact O-N 2.77Å; E1142-K1146 WeakPolarHBondContact OE1-CE 3.27Å; E1142-K1146 IonicContact OE1-NZ 2.91Å; E1142-K1146 PolarHBondContact OE1-NZ 3.43Å; A1143-K1146 PolarHBondContact O-N 2.93Å; V1144-K1146 PolarHBondContact O-N 3.1Å; K1146-S1150 WeakPolarHBondContact O-CB 3.43Å; K1146-S1150 PolarHBondContact O-N 2.95Å; K1146-S1150 PolarHBondContact O-OG 3.45Å; K1146-C1179 WeakPolarHBondContact CB-SG 3.4Å; K1146-E1182 WeakPolarHBondContact CD-OE2 3.49Å; K1146-E1182 IonicContact NZ-OE1 2.69Å; K1146-E1182 PolarHBondContact NZ-OE1 2.87Å; K1146-E1182 IonicContact NZ-OE2 2.92Å; K1146-E1182 PolarHBondContact NZ-OE2 3.05Å
1147	L	90.6	Very high	85.7	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-63.6	-46.5	174.7	172.8	62	0	0	0	111.7	L1093 L1120 L1121 A1143 V1144 L1149 S1150 L1151 L1176 C1179 I1183	L1093-L1147 HydrophobicContact CD2-CD1 4.46Å; L1120-L1147 HydrophobicContact CB-CD2 4.47Å; L1120-L1147 HydrophobicContact CD2-CD2 3.78Å; L1120-L1147 HydrophobicContact CG-CD2 3.89Å; L1121-L1147 HydrophobicContact CD2-CB 4.31Å; L1121-L1147 HydrophobicContact CD2-CD2 3.64Å; L1121-L1147 HydrophobicContact CD2-CG 3.75Å; L1121-L1147 HydrophobicContact CG-CD2 3.97Å; L1121-L1147 HydrophobicContact CG-CG 4.08Å; A1143-L1147 PolarHBondContact O-N 2.89Å; V1144-L1147 WeakPolarHBondContact O-CB 3.31Å; V1144-L1147 PolarHBondContact O-N 2.94Å; L1147-L1149 PolarHBondContact O-N 3.35Å; L1147-S1150 PolarHBondContact O-N 3.01Å; L1147-L1151 HydrophobicContact CD1-CD1 3.66Å; L1147-L1151 HydrophobicContact CD1-CG 4.08Å; L1147-L1151 HydrophobicContact CG-CD1 4Å; L1147-L1151 WeakPolarHBondContact O-CG 3.32Å; L1147-L1151 PolarHBondContact O-N 2.96Å; L1147-L1176 HydrophobicContact CD1-CD1 3.25Å; L1147-C1179 HydrophobicContact CB-CB 4.28Å; L1147-I1183 HydrophobicContact CB-CD1 4.15Å; L1147-I1183 HydrophobicContact CD2-CD1 3.55Å; L1147-I1183 HydrophobicContact CG-CD1 4.44Å
1148	E	92.3	Very high	84.7	Confident	103 Å²	103	61.7 Å²	61.7	48%	0.481	31%	0.313	S	S	.	.	H	α-helix	trans	-57	-49.1	175.4	-71.2	-178.4	164.8	0	0	112	L1121 V1144 G1145 L1151 Q1152	L1121-E1148 HydrophobicContact CD1-CG 3.93Å; L1121-E1148 HydrophobicContact CD2-CG 3.48Å; L1121-E1148 VanDerWaalsContact CD2-CG 3.48Å; L1121-E1148 HydrophobicContact CG-CG 4.37Å; V1144-E1148 WeakPolarHBondContact O-CG 3.41Å; V1144-E1148 PolarHBondContact O-N 3.03Å; G1145-E1148 PolarHBondContact O-N 2.87Å; E1148-L1151 PolarHBondContact O-N 3.42Å; E1148-Q1152 PolarHBondContact O-N 2.87Å
1149	L	87.9	Confident	83.7	Confident	107 Å²	107	60.2 Å²	60.2	56%	0.56	32%	0.32	S	S	*	.	H	α-helix	trans	-61.5	-47.6	178.3	-73.5	165.8	0	0	0	112	G1145 L1147 L1151 Q1152 E1153	G1145-L1149 WeakPolarHBondContact O-CG 3.49Å; G1145-L1149 PolarHBondContact O-N 3.43Å; G1145-L1149 VanDerWaalsContact O-N 3.15Å; L1147-L1149 PolarHBondContact O-N 3.35Å; L1149-L1151 VanDerWaalsContact C-N 3.31Å; L1149-L1151 PolarHBondContact O-N 3.33Å; L1149-Q1152 WeakPolarHBondContact O-CB 3.38Å; L1149-Q1152 PolarHBondContact O-N 3.08Å; L1149-Q1152 VanDerWaalsContact O-N 3.1Å; L1149-E1153 WeakPolarHBondContact O-CG 3.44Å; L1149-E1153 PolarHBondContact O-N 2.93Å
1150	S	87.6	Confident	82.4	Confident	8 Å²	8	62 Å²	62	6%	0.056	34%	0.34	C	S	.	.	H	α-helix	trans	-61.1	-38.6	-179.7	-56.9	0	0	0	0	112.2	K1146 L1147 L1154 V1172	K1146-S1150 WeakPolarHBondContact O-CB 3.43Å; K1146-S1150 PolarHBondContact O-N 2.95Å; K1146-S1150 PolarHBondContact O-OG 3.45Å; L1147-S1150 PolarHBondContact O-N 3.01Å; S1150-L1154 WeakPolarHBondContact O-CB 3.34Å; S1150-L1154 PolarHBondContact O-N 3.28Å; S1150-V1172 WeakPolarHBondContact O-CG1 3.44Å
1151	L	88.2	Confident	80.3	Confident	3 Å²	3	65.9 Å²	65.9	2%	0.016	38%	0.38	C	S	.	.	H	α-helix	trans	-71.5	-33.7	175.6	-68.7	168	0	0	0	112.2	L1114 L1121 L1147 E1148 L1149 R1155 L1176	L1114-L1151 HydrophobicContact CD2-CB 4.35Å; L1114-L1151 HydrophobicContact CD2-CD2 4.08Å; L1114-L1151 VanDerWaalsContact CD2-O 3.31Å; L1114-L1151 WeakPolarHBondContact CD2-O 3.43Å; L1121-L1151 HydrophobicContact CD1-CD1 3.65Å; L1121-L1151 HydrophobicContact CG-CD1 4.16Å; L1147-L1151 HydrophobicContact CD1-CD1 3.66Å; L1147-L1151 HydrophobicContact CD1-CG 4.08Å; L1147-L1151 HydrophobicContact CG-CD1 4Å; L1147-L1151 WeakPolarHBondContact O-CG 3.32Å; L1147-L1151 PolarHBondContact O-N 2.96Å; E1148-L1151 PolarHBondContact O-N 3.42Å; L1149-L1151 VanDerWaalsContact C-N 3.31Å; L1149-L1151 PolarHBondContact O-N 3.33Å; L1151-R1155 VanDerWaalsContact O-CB 3.27Å; L1151-R1155 WeakPolarHBondContact O-CB 3.37Å; L1151-R1155 PolarHBondContact O-N 3.31Å; L1151-L1176 HydrophobicContact CD2-CD1 4.04Å; L1151-L1176 HydrophobicContact CD2-CD2 3.98Å; L1151-L1176 HydrophobicContact CG-CD1 4.07Å
1152	Q	86.4	Confident	78.3	Confident	140 Å²	140	62.1 Å²	62.1	65%	0.654	38%	0.384	S	S	*	.	H	α-helix	trans	-67.3	-40.3	173.7	-173.1	171.7	-9.5	0	0	112.1	E1148 L1149 R1155 A1156	E1148-Q1152 PolarHBondContact O-N 2.87Å; L1149-Q1152 WeakPolarHBondContact O-CB 3.38Å; L1149-Q1152 PolarHBondContact O-N 3.08Å; L1149-Q1152 VanDerWaalsContact O-N 3.1Å; Q1152-R1155 PolarHBondContact O-N 3.09Å; Q1152-A1156 PolarHBondContact O-N 3.48Å
1153	E	84.1	Confident	76.5	Confident	99 Å²	99	60.3 Å²	60.3	46%	0.463	39%	0.39	S	S	.	.	H	α-helix	trans	-65	-42.6	173.8	-71.4	179.6	174.3	0	0	112.3	L1149 R1155 A1156 S1157 V1172	L1149-E1153 WeakPolarHBondContact O-CG 3.44Å; L1149-E1153 PolarHBondContact O-N 2.93Å; E1153-R1155 PolarHBondContact O-N 3.39Å; E1153-A1156 PolarHBondContact O-N 2.91Å; E1153-S1157 WeakPolarHBondContact O-CB 3.48Å; E1153-S1157 PolarHBondContact O-N 2.85Å; E1153-S1157 PolarHBondContact O-OG 3.39Å; E1153-V1172 HydrophobicContact CB-CG1 4.24Å; E1153-V1172 HydrophobicContact CB-CG2 4.34Å
1154	L	82.9	Confident	74.8	Confident	4 Å²	4	63.3 Å²	63.3	2%	0.021	41%	0.406	C	S	.	.	H	α-helix	trans	-62.2	-42.5	174.8	-175.7	63.5	0	0	0	111.4	V1113 L1114 S1150 S1157 S1158 V1172 L1173 L1176	V1113-L1154 HydrophobicContact CB-CD2 3.99Å; V1113-L1154 HydrophobicContact CG1-CD2 3.52Å; L1114-L1154 HydrophobicContact CD2-CB 4.09Å; L1114-L1154 HydrophobicContact CD2-CD2 3.92Å; L1114-L1154 HydrophobicContact CD2-CG 4.07Å; L1114-L1154 HydrophobicContact CG-CD2 4.13Å; L1114-L1154 HydrophobicContact CG-CG 4.37Å; S1150-L1154 WeakPolarHBondContact O-CB 3.34Å; S1150-L1154 PolarHBondContact O-N 3.28Å; L1154-S1157 PolarHBondContact O-N 2.86Å; L1154-S1158 WeakPolarHBondContact O-CB 3.36Å; L1154-S1158 PolarHBondContact O-N 3.25Å; L1154-V1172 HydrophobicContact CB-CG1 3.95Å; L1154-L1173 HydrophobicContact CD1-CD2 4.42Å; L1154-L1176 HydrophobicContact CD2-CD2 4.35Å
1155	R	83	Confident	72.7	Confident	156 Å²	156	68.4 Å²	68.4	59%	0.589	44%	0.442	S	S	*	.	H	α-helix	trans	-65.3	-40.2	177.1	-174	174.9	-176.8	147.8	0.5	112.7	L1114 L1151 Q1152 E1153 S1159	L1114-R1155 HydrophobicContact CD1-CB 4.13Å; L1114-R1155 HydrophobicContact CD1-CG 4.39Å; L1114-R1155 HydrophobicContact CD2-CB 4.01Å; L1151-R1155 VanDerWaalsContact O-CB 3.27Å; L1151-R1155 WeakPolarHBondContact O-CB 3.37Å; L1151-R1155 PolarHBondContact O-N 3.31Å; Q1152-R1155 PolarHBondContact O-N 3.09Å; E1153-R1155 PolarHBondContact O-N 3.39Å; R1155-S1159 PolarHBondContact O-N 3.23Å
1156	A	76.2	Confident	71	Confident	61 Å²	61	70.8 Å²	70.8	50%	0.504	46%	0.455	S	S	.	.	H	α-helix	trans	-62.4	-48.7	173.1	0	0	0	0	0	110.8	Q1152 E1153 S1158 S1159	Q1152-A1156 PolarHBondContact O-N 3.48Å; E1153-A1156 PolarHBondContact O-N 2.91Å; A1156-S1158 VanDerWaalsContact C-N 3.32Å; A1156-S1158 PolarHBondContact O-N 3.1Å; A1156-S1159 WeakPolarHBondContact O-CB 3.41Å; A1156-S1159 PolarHBondContact O-N 3.28Å; A1156-S1159 VanDerWaalsContact O-N 3.13Å; A1156-S1159 PolarHBondContact O-OG 3.1Å
1157	S	68.3	Low	69	Low	65 Å²	65	74.2 Å²	74.2	46%	0.455	48%	0.481	S	S	.	.	H	α-helix	trans	-58.1	-42.9	178.3	-57.2	0	0	0	0	112.3	E1153 L1154 S1159 G1160	E1153-S1157 WeakPolarHBondContact O-CB 3.48Å; E1153-S1157 PolarHBondContact O-N 2.85Å; E1153-S1157 PolarHBondContact O-OG 3.39Å; L1154-S1157 PolarHBondContact O-N 2.86Å; S1157-S1159 PolarHBondContact O-N 3.17Å; S1157-G1160 PolarHBondContact O-N 2.95Å
1158	S	62.8	Low	67.3	Low	60 Å²	60	76 Å²	76	42%	0.42	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-12.3	179.8	-164.6	0	0	0	0	114.7	S1110 L1154 A1156	S1110-S1158 WeakPolarHBondContact CB-OG 3.31Å; S1110-S1158 VanDerWaalsContact OG-CB 3.3Å; S1110-S1158 WeakPolarHBondContact OG-CB 3.38Å; S1110-S1158 PolarHBondContact OG-OG 3.15Å; L1154-S1158 WeakPolarHBondContact O-CB 3.36Å; L1154-S1158 PolarHBondContact O-N 3.25Å; A1156-S1158 VanDerWaalsContact C-N 3.32Å; A1156-S1158 PolarHBondContact O-N 3.1Å
1159	S	58	Low	65.7	Low	103 Å²	103	71.6 Å²	71.6	72%	0.72	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-14.7	176.8	73.7	0	0	0	0	113.6	R1155 A1156 S1157 G1161	R1155-S1159 PolarHBondContact O-N 3.23Å; A1156-S1159 WeakPolarHBondContact O-CB 3.41Å; A1156-S1159 PolarHBondContact O-N 3.28Å; A1156-S1159 VanDerWaalsContact O-N 3.13Å; A1156-S1159 PolarHBondContact O-OG 3.1Å; S1157-S1159 PolarHBondContact O-N 3.17Å; S1159-G1161 PolarHBondContact O-N 3.16Å
1160	G	53.8	Low	64.7	Low	64 Å²	64	70.5 Å²	70.5	66%	0.66	48%	0.475	S	S	*	.	S	Bend	trans	-85.9	13.1	-170	0	0	0	0	0	116.8	S1157 G1162	S1157-G1160 PolarHBondContact O-N 2.95Å; G1160-G1162 PolarHBondContact O-N 2.8Å
1161	G	47.4	Very low	64.3	Low	81 Å²	81	73.8 Å²	73.8	84%	0.835	49%	0.494	S	S	*	.	S	Bend	trans	68.8	-12.3	173.3	0	0	0	0	0	117.4	S1159	S1159-G1161 PolarHBondContact O-N 3.16Å
1162	G	46.2	Very low	63.9	Low	59 Å²	59	74.1 Å²	74.1	61%	0.608	50%	0.497	S	S	*	.			trans	-82.6	146.1	171.4	0	0	0	0	0	112.5	G1160	G1160-G1162 PolarHBondContact O-N 2.8Å
1163	G	51.8	Low	63.7	Low	54 Å²	54	67.6 Å²	67.6	56%	0.557	47%	0.466	S	S	*	.			trans	-70.3	170.1	172.8	0	0	0	0	0	113.3	S1165	G1163-S1165 PolarHBondContact O-N 3.37Å
1164	L	52.8	Low	63.6	Low	64 Å²	64	66.6 Å²	66.6	34%	0.335	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	5.2	-177.4	-97	128.9	0	0	0	116.1	V1100 S1166 S1169 L1173	V1100-L1164 HydrophobicContact CG1-CD2 4.34Å; L1164-S1166 VanDerWaalsContact C-N 3.33Å; L1164-S1166 PolarHBondContact O-N 3.36Å; L1164-S1169 PolarHBondContact O-OG 3.22Å; L1164-L1173 HydrophobicContact CD2-CD1 3.94Å
1165	S	47.8	Very low	63.8	Low	117 Å²	117	70.1 Å²	70.1	82%	0.818	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	14.1	-179.7	51.8	0	0	0	0	114.6	G1163	G1163-S1165 PolarHBondContact O-N 3.37Å
1166	S	53.2	Low	63.9	Low	76 Å²	76	62.7 Å²	62.7	53%	0.531	46%	0.455	S	S	.	.	S	Bend	trans	-76.2	143.3	171.8	-175.3	0	0	0	0	111.1	L1164 G1168 S1169	L1164-S1166 VanDerWaalsContact C-N 3.33Å; L1164-S1166 PolarHBondContact O-N 3.36Å; S1166-G1168 PolarHBondContact O-N 2.97Å; S1166-S1169 PolarHBondContact O-N 3.02Å; S1166-S1169 VanDerWaalsContact O-N 3.12Å; S1166-S1169 PolarHBondContact O-OG 3.33Å
1167	V	48.8	Very low	64.4	Low	135 Å²	135	63.1 Å²	63.1	82%	0.818	45%	0.446	S	S	*	.	H	α-helix	trans	-60.8	-23	-179.1	179.2	0	0	0	0	112.5
1168	G	53.9	Low	65.4	Low	37 Å²	37	64.2 Å²	64.2	38%	0.381	45%	0.447	S	S	.	.	H	α-helix	trans	-83.9	-19.1	177.2	0	0	0	0	0	116.2	S1166 T1171	S1166-G1168 PolarHBondContact O-N 2.97Å; G1168-T1171 PolarHBondContact O-OG1 3.34Å
1169	S	59.3	Low	66.6	Low	11 Å²	11	61.7 Å²	61.7	8%	0.077	43%	0.429	C	S	.	.	H	α-helix	trans	-72.8	-36.2	-178.5	29.2	0	0	0	0	112.2	L1164 S1166 T1171 V1172 L1173	L1164-S1169 PolarHBondContact O-OG 3.22Å; S1166-S1169 PolarHBondContact O-N 3.02Å; S1166-S1169 VanDerWaalsContact O-N 3.12Å; S1166-S1169 PolarHBondContact O-OG 3.33Å; S1169-T1171 VanDerWaalsContact C-N 3.35Å; S1169-T1171 PolarHBondContact O-N 2.91Å; S1169-V1172 PolarHBondContact O-N 2.95Å; S1169-V1172 VanDerWaalsContact O-N 3.16Å; S1169-L1173 WeakPolarHBondContact O-CG 3.44Å; S1169-L1173 PolarHBondContact O-N 3.5Å; S1169-L1173 VanDerWaalsContact O-N 3.1Å
1170	N	67.3	Low	68.1	Low	84 Å²	84	57 Å²	57	45%	0.449	40%	0.396	S	S	.	.	H	α-helix	trans	-60.2	-42.9	179.8	-67.7	-4.6	0	0	0	112	V1172 L1173 D1174	N1170-V1172 VanDerWaalsContact C-N 3.26Å; N1170-V1172 PolarHBondContact O-N 2.94Å; N1170-L1173 PolarHBondContact O-N 3.08Å; N1170-L1173 VanDerWaalsContact O-N 3.1Å; N1170-D1174 PolarHBondContact O-N 2.89Å
1171	T	77.2	Confident	69.7	Low	77 Å²	77	59.6 Å²	59.6	47%	0.472	39%	0.389	S	S	.	.	H	α-helix	trans	-63.7	-30.7	178.4	49.3	0	0	0	0	113.2	G1168 S1169 N1175	G1168-T1171 PolarHBondContact O-OG1 3.34Å; S1169-T1171 VanDerWaalsContact C-N 3.35Å; S1169-T1171 PolarHBondContact O-N 2.91Å; T1171-N1175 WeakPolarHBondContact O-CB 3.39Å; T1171-N1175 PolarHBondContact O-N 3.38Å; T1171-N1175 PolarHBondContact O-ND2 3.23Å
1172	V	80.3	Confident	71.7	Confident	10 Å²	10	59.3 Å²	59.3	6%	0.061	37%	0.366	C	S	.	.	H	α-helix	trans	-73.1	-38	174.8	-179.7	0	0	0	0	110.8	S1150 E1153 L1154 S1169 N1170 L1176	S1150-V1172 WeakPolarHBondContact O-CG1 3.44Å; E1153-V1172 HydrophobicContact CB-CG1 4.24Å; E1153-V1172 HydrophobicContact CB-CG2 4.34Å; L1154-V1172 HydrophobicContact CB-CG1 3.95Å; S1169-V1172 PolarHBondContact O-N 2.95Å; S1169-V1172 VanDerWaalsContact O-N 3.16Å; N1170-V1172 VanDerWaalsContact C-N 3.26Å; N1170-V1172 PolarHBondContact O-N 2.94Å; V1172-L1176 VanDerWaalsContact O-CB 3.25Å; V1172-L1176 WeakPolarHBondContact O-CB 3.37Å; V1172-L1176 PolarHBondContact O-N 3.27Å
1173	L	82.3	Confident	73.7	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.01	34%	0.337	C	S	.	.	H	α-helix	trans	-67.5	-40.7	174.8	-61.7	171	0	0	0	112	L1097 V1100 L1101 L1154 L1164 S1169 N1170 L1176 H1177	L1097-L1173 HydrophobicContact CD2-CB 4.49Å; L1097-L1173 HydrophobicContact CD2-CD2 3.57Å; V1100-L1173 HydrophobicContact CG1-CD1 3.73Å; L1101-L1173 HydrophobicContact CD2-CD1 4.38Å; L1154-L1173 HydrophobicContact CD1-CD2 4.42Å; L1164-L1173 HydrophobicContact CD2-CD1 3.94Å; S1169-L1173 WeakPolarHBondContact O-CG 3.44Å; S1169-L1173 PolarHBondContact O-N 3.5Å; S1169-L1173 VanDerWaalsContact O-N 3.1Å; N1170-L1173 PolarHBondContact O-N 3.08Å; N1170-L1173 VanDerWaalsContact O-N 3.1Å; L1173-L1176 PolarHBondContact O-N 2.96Å; L1173-H1177 WeakPolarHBondContact O-CB 3.3Å; L1173-H1177 PolarHBondContact O-N 3.08Å
1174	D	83	Confident	75.5	Confident	78 Å²	78	54.8 Å²	54.8	42%	0.417	32%	0.316	S	S	.	.	H	α-helix	trans	-63.4	-44.6	174.6	-69.8	-36.6	0	0	0	111.3	N1170 H1177 N1178	N1170-D1174 PolarHBondContact O-N 2.89Å; D1174-H1177 PolarHBondContact O-N 2.72Å; D1174-N1178 PolarHBondContact O-N 2.85Å; D1174-N1178 PolarHBondContact O-ND2 2.82Å
1175	N	85.7	Confident	77	Confident	79 Å²	79	55 Å²	55	42%	0.422	32%	0.318	S	S	.	.	H	α-helix	trans	-58.9	-47	173.4	-75.6	-14.9	0	0	0	111.2	T1171 H1177 N1178 C1179	T1171-N1175 WeakPolarHBondContact O-CB 3.39Å; T1171-N1175 PolarHBondContact O-N 3.38Å; T1171-N1175 PolarHBondContact O-ND2 3.23Å; N1175-H1177 PolarHBondContact O-N 3.47Å; N1175-N1178 PolarHBondContact O-N 3.12Å; N1175-C1179 PolarHBondContact O-N 3.48Å; N1175-C1179 PolarHBondContact O-SG 3.09Å
1176	L	87.1	Confident	78.8	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-61.9	-43.3	179.7	-174.1	58.6	0	0	0	111.9	L1097 V1113 L1147 L1151 L1154 V1172 L1173 N1178 C1179 I1180	L1097-L1176 HydrophobicContact CD1-CB 4.39Å; L1097-L1176 HydrophobicContact CD1-CD2 4.21Å; L1097-L1176 HydrophobicContact CD1-CG 3.97Å; L1097-L1176 HydrophobicContact CD2-CD2 4.01Å; V1113-L1176 HydrophobicContact CG1-CD2 3.78Å; L1147-L1176 HydrophobicContact CD1-CD1 3.25Å; L1151-L1176 HydrophobicContact CD2-CD1 4.04Å; L1151-L1176 HydrophobicContact CD2-CD2 3.98Å; L1151-L1176 HydrophobicContact CG-CD1 4.07Å; L1154-L1176 HydrophobicContact CD2-CD2 4.35Å; V1172-L1176 VanDerWaalsContact O-CB 3.25Å; V1172-L1176 WeakPolarHBondContact O-CB 3.37Å; V1172-L1176 PolarHBondContact O-N 3.27Å; L1173-L1176 PolarHBondContact O-N 2.96Å; L1176-N1178 PolarHBondContact O-N 2.68Å; L1176-C1179 PolarHBondContact O-N 3.37Å; L1176-I1180 HydrophobicContact CG-CD1 4.44Å; L1176-I1180 WeakPolarHBondContact O-CD1 3.25Å; L1176-I1180 VanDerWaalsContact O-CG1 3.29Å; L1176-I1180 WeakPolarHBondContact O-CG1 3.49Å; L1176-I1180 PolarHBondContact O-N 3.18Å; L1176-I1180 VanDerWaalsContact O-N 3.08Å
1177	H	86.4	Confident	80.2	Confident	69 Å²	69	46.3 Å²	46.3	32%	0.319	26%	0.257	S	S	.	.	H	α-helix	trans	-61.2	-41.2	174	-177.1	-92	0	0	0	112.4	L1097 L1173 D1174 N1175 I1180 K1181	L1097-H1177 HydrophobicContact CD1-CB 4.25Å; L1173-H1177 WeakPolarHBondContact O-CB 3.3Å; L1173-H1177 PolarHBondContact O-N 3.08Å; D1174-H1177 PolarHBondContact O-N 2.72Å; N1175-H1177 PolarHBondContact O-N 3.47Å; H1177-I1180 PolarHBondContact O-N 2.75Å; H1177-K1181 PolarHBondContact O-N 3.07Å
1178	N	88.1	Confident	81.8	Confident	89 Å²	89	45.5 Å²	45.5	48%	0.476	24%	0.244	S	C	.	.	H	α-helix	trans	-65.6	-38.3	174.3	-72.9	-50	0	0	0	112.6	D1174 N1175 L1176 K1181 E1182	D1174-N1178 PolarHBondContact O-N 2.85Å; D1174-N1178 PolarHBondContact O-ND2 2.82Å; N1175-N1178 PolarHBondContact O-N 3.12Å; L1176-N1178 PolarHBondContact O-N 2.68Å; N1178-K1181 PolarHBondContact O-N 3.45Å; N1178-E1182 PolarHBondContact O-N 3.05Å
1179	C	88.4	Confident	82.9	Confident	7 Å²	7	52.3 Å²	52.3	5%	0.047	26%	0.258	C	S	.	.	H	α-helix	trans	-63.2	-43.4	176.3	-62.8	0	0	0	0	112.1	K1146 L1147 N1175 L1176 K1181 E1182 I1183	K1146-C1179 WeakPolarHBondContact CB-SG 3.4Å; L1147-C1179 HydrophobicContact CB-CB 4.28Å; N1175-C1179 PolarHBondContact O-N 3.48Å; N1175-C1179 PolarHBondContact O-SG 3.09Å; L1176-C1179 PolarHBondContact O-N 3.37Å; C1179-K1181 VanDerWaalsContact C-N 3.25Å; C1179-K1181 PolarHBondContact O-N 3.24Å; C1179-E1182 PolarHBondContact O-N 3.13Å; C1179-I1183 WeakPolarHBondContact O-CB 3.33Å; C1179-I1183 VanDerWaalsContact O-CG1 3.31Å; C1179-I1183 WeakPolarHBondContact O-CG1 3.09Å; C1179-I1183 PolarHBondContact O-N 2.99Å
1180	I	90.2	Very high	84	Confident	5 Å²	5	54.4 Å²	54.4	3%	0.026	27%	0.267	C	S	.	.	H	α-helix	trans	-59.9	-39.9	176.3	-65.3	158.9	0	0	0	110.6	A1090 L1093 L1097 L1120 L1176 H1177 S1184	A1090-I1180 HydrophobicContact CB-CG2 4.01Å; A1090-I1180 WeakPolarHBondContact O-CG2 3.48Å; L1093-I1180 HydrophobicContact CB-CD1 4.07Å; L1093-I1180 HydrophobicContact CD2-CD1 3.5Å; L1093-I1180 HydrophobicContact CD2-CG1 3.86Å; L1093-I1180 HydrophobicContact CG-CD1 3.51Å; L1093-I1180 HydrophobicContact CG-CG1 4.34Å; L1097-I1180 HydrophobicContact CD1-CD1 3.42Å; L1097-I1180 VanDerWaalsContact CD1-CD1 3.42Å; L1120-I1180 HydrophobicContact CD2-CG1 4.12Å; L1176-I1180 HydrophobicContact CG-CD1 4.44Å; L1176-I1180 WeakPolarHBondContact O-CD1 3.25Å; L1176-I1180 VanDerWaalsContact O-CG1 3.29Å; L1176-I1180 WeakPolarHBondContact O-CG1 3.49Å; L1176-I1180 PolarHBondContact O-N 3.18Å; L1176-I1180 VanDerWaalsContact O-N 3.08Å; H1177-I1180 PolarHBondContact O-N 2.75Å; I1180-S1184 WeakPolarHBondContact O-CB 3.01Å; I1180-S1184 PolarHBondContact O-N 3.35Å; I1180-S1184 PolarHBondContact O-OG 3.35Å
1181	K	87	Confident	84.9	Confident	118 Å²	118	52.8 Å²	52.8	51%	0.513	26%	0.258	S	S	.	.	H	α-helix	trans	-67.6	-45.7	175.4	-170.9	178.5	176.8	-176.6	0	112.2	H1177 N1178 C1179 I1183 S1184 D1185	H1177-K1181 PolarHBondContact O-N 3.07Å; N1178-K1181 PolarHBondContact O-N 3.45Å; C1179-K1181 VanDerWaalsContact C-N 3.25Å; C1179-K1181 PolarHBondContact O-N 3.24Å; K1181-I1183 VanDerWaalsContact C-N 3.33Å; K1181-I1183 PolarHBondContact O-N 2.68Å; K1181-S1184 PolarHBondContact O-N 2.87Å; K1181-D1185 VanDerWaalsContact O-CB 3.32Å; K1181-D1185 WeakPolarHBondContact O-CB 3.22Å; K1181-D1185 PolarHBondContact O-N 2.93Å
1182	E	88.1	Confident	85.3	Confident	75 Å²	75	51.5 Å²	51.5	35%	0.35	25%	0.246	S	C	.	.	H	α-helix	trans	-57.7	-44.8	174.7	-75.6	-171.6	-178.9	0	0	111.9	A1143 K1146 N1178 C1179 D1185 V1186	A1143-E1182 HydrophobicContact CB-CB 3.76Å; K1146-E1182 WeakPolarHBondContact CD-OE2 3.49Å; K1146-E1182 IonicContact NZ-OE1 2.69Å; K1146-E1182 PolarHBondContact NZ-OE1 2.87Å; K1146-E1182 IonicContact NZ-OE2 2.92Å; K1146-E1182 PolarHBondContact NZ-OE2 3.05Å; N1178-E1182 PolarHBondContact O-N 3.05Å; C1179-E1182 PolarHBondContact O-N 3.13Å; E1182-D1185 PolarHBondContact O-N 2.81Å; E1182-V1186 WeakPolarHBondContact O-CB 3.37Å; E1182-V1186 WeakPolarHBondContact O-CG2 3.21Å; E1182-V1186 PolarHBondContact O-N 3.14Å
1183	I	89.3	Confident	85.6	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-58.7	-49.8	175.6	-71.8	170.1	0	0	0	110.4	L1086 F1140 A1143 V1144 L1147 C1179 K1181 V1186 V1187	L1086-I1183 HydrophobicContact CD2-CG2 3.96Å; F1140-I1183 HydrophobicContact CE2-CG2 3.98Å; A1143-I1183 HydrophobicContact CB-CG1 3.66Å; V1144-I1183 HydrophobicContact CG2-CD1 4.21Å; V1144-I1183 HydrophobicContact CG2-CG1 4.45Å; L1147-I1183 HydrophobicContact CB-CD1 4.15Å; L1147-I1183 HydrophobicContact CD2-CD1 3.55Å; L1147-I1183 HydrophobicContact CG-CD1 4.44Å; C1179-I1183 WeakPolarHBondContact O-CB 3.33Å; C1179-I1183 VanDerWaalsContact O-CG1 3.31Å; C1179-I1183 WeakPolarHBondContact O-CG1 3.09Å; C1179-I1183 PolarHBondContact O-N 2.99Å; K1181-I1183 VanDerWaalsContact C-N 3.33Å; K1181-I1183 PolarHBondContact O-N 2.68Å; I1183-V1186 PolarHBondContact O-N 3.02Å; I1183-V1187 WeakPolarHBondContact O-CG2 3.15Å; I1183-V1187 PolarHBondContact O-N 3.09Å
1184	S	88.9	Confident	85.8	Confident	17 Å²	17	57.2 Å²	57.2	12%	0.119	27%	0.272	C	S	.	.	H	α-helix	trans	-62.2	-47.6	179.6	-57.2	0	0	0	0	111.9	I1180 K1181 V1186 V1187 Q1188	I1180-S1184 WeakPolarHBondContact O-CB 3.01Å; I1180-S1184 PolarHBondContact O-N 3.35Å; I1180-S1184 PolarHBondContact O-OG 3.35Å; K1181-S1184 PolarHBondContact O-N 2.87Å; S1184-V1186 VanDerWaalsContact C-N 3.26Å; S1184-V1186 PolarHBondContact O-N 3.07Å; S1184-V1187 PolarHBondContact O-N 2.77Å; S1184-V1187 VanDerWaalsContact O-N 3.14Å; S1184-Q1188 WeakPolarHBondContact O-CB 3.36Å; S1184-Q1188 VanDerWaalsContact O-CG 3.31Å; S1184-Q1188 WeakPolarHBondContact O-CG 3.36Å; S1184-Q1188 PolarHBondContact O-N 2.9Å
1185	D	85.6	Confident	86	Confident	70 Å²	70	55.8 Å²	55.8	37%	0.374	26%	0.263	S	S	.	.	H	α-helix	trans	-63.4	-29.6	178.4	-74.7	-12.7	0	0	0	111.7	K1181 E1182 R1189	K1181-D1185 VanDerWaalsContact O-CB 3.32Å; K1181-D1185 WeakPolarHBondContact O-CB 3.22Å; K1181-D1185 PolarHBondContact O-N 2.93Å; E1182-D1185 PolarHBondContact O-N 2.81Å; D1185-R1189 WeakPolarHBondContact O-CG 3.4Å; D1185-R1189 PolarHBondContact O-NE 3.04Å; D1185-R1189 PolarHBondContact O-NH2 2.97Å
1186	V	83.6	Confident	86.1	Confident	8 Å²	8	54.1 Å²	54.1	5%	0.048	25%	0.251	C	S	.	.	H	α-helix	trans	-78.2	-33.7	173.8	174.7	0	0	0	0	112.3	N1136 A1139 F1140 E1182 I1183 S1184	N1136-V1186 HydrophobicContact CB-CG1 4.34Å; N1136-V1186 WeakPolarHBondContact O-CG1 3.28Å; A1139-V1186 HydrophobicContact CB-CG2 3.88Å; F1140-V1186 HydrophobicContact CB-CG1 3.77Å; F1140-V1186 HydrophobicContact CD2-CG1 4.18Å; F1140-V1186 HydrophobicContact CG-CG1 4.46Å; E1182-V1186 WeakPolarHBondContact O-CB 3.37Å; E1182-V1186 WeakPolarHBondContact O-CG2 3.21Å; E1182-V1186 PolarHBondContact O-N 3.14Å; I1183-V1186 PolarHBondContact O-N 3.02Å; S1184-V1186 VanDerWaalsContact C-N 3.26Å; S1184-V1186 PolarHBondContact O-N 3.07Å
1187	V	84.4	Confident	86	Confident	2 Å²	2	58.3 Å²	58.3	1%	0.012	27%	0.27	C	S	.	.	H	α-helix	trans	-81.1	-25.2	178.9	173.5	0	0	0	0	112.6	R1083 L1086 L1087 Y1127 F1140 I1183 S1184 R1189	R1083-V1187 HydrophobicContact CG-CG1 3.62Å; R1083-V1187 VanDerWaalsContact CZ-O 3.24Å; R1083-V1187 PolarHBondContact NE-O 3.41Å; R1083-V1187 PolarHBondContact NH2-O 2.98Å; L1086-V1187 HydrophobicContact CD2-CB 4.46Å; L1086-V1187 HydrophobicContact CD2-CG1 4.36Å; L1086-V1187 HydrophobicContact CD2-CG2 3.94Å; L1087-V1187 HydrophobicContact CD1-CG1 4.39Å; L1087-V1187 HydrophobicContact CD2-CB 4.38Å; L1087-V1187 HydrophobicContact CD2-CG1 4.16Å; L1087-V1187 HydrophobicContact CG-CG1 4.13Å; Y1127-V1187 HydrophobicContact CD1-CG2 4.24Å; Y1127-V1187 HydrophobicContact CE1-CG1 4.1Å; Y1127-V1187 HydrophobicContact CE1-CG2 3.88Å; F1140-V1187 HydrophobicContact CD2-CG2 3.83Å; F1140-V1187 HydrophobicContact CE2-CG2 3.41Å; F1140-V1187 VanDerWaalsContact CE2-CG2 3.41Å; F1140-V1187 HydrophobicContact CZ-CG2 4.39Å; I1183-V1187 WeakPolarHBondContact O-CG2 3.15Å; I1183-V1187 PolarHBondContact O-N 3.09Å; S1184-V1187 PolarHBondContact O-N 2.77Å; S1184-V1187 VanDerWaalsContact O-N 3.14Å; V1187-R1189 VanDerWaalsContact C-N 3.35Å
1188	Q	82.3	Confident	85.9	Confident	117 Å²	117	57.4 Å²	57.4	55%	0.547	27%	0.266	S	S	.	.			trans	-76.1	-19.7	173.3	-72	-176.7	24	0	0	113.5	R1083 L1087 S1184	R1083-Q1188 VanDerWaalsContact NH2-CA 3.33Å; R1083-Q1188 PolarHBondContact NH2-O 2.95Å; L1087-Q1188 HydrophobicContact CD1-CG 4.48Å; L1087-Q1188 HydrophobicContact CD2-CG 4.34Å; S1184-Q1188 WeakPolarHBondContact O-CB 3.36Å; S1184-Q1188 VanDerWaalsContact O-CG 3.31Å; S1184-Q1188 WeakPolarHBondContact O-CG 3.36Å; S1184-Q1188 PolarHBondContact O-N 2.9Å
1189	R	75.3	Confident	85.7	Confident	181 Å²	181	54.5 Å²	54.5	68%	0.683	25%	0.247	S	C	*	.			trans	-89.3	0	175.6	-80.2	179.9	-74.6	153.1	-4.9	114.2	D1185 V1187	D1185-R1189 WeakPolarHBondContact O-CG 3.4Å; D1185-R1189 PolarHBondContact O-NE 3.04Å; D1185-R1189 PolarHBondContact O-NH2 2.97Å; V1187-R1189 VanDerWaalsContact C-N 3.35Å

Retrieved 1,189 of 1,189 residues in 718.9 ms (Link to these results)

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