A0A096NBV8_PAPAN Loading...

Erythroid differentiation regulatory factor 1

AlphaFold DB , UniProt , Accession A0A096NBV8, Species PAPAN (Papio anubis, Olive baboon), Gene EDRF1, Length 1,238 aa.

						>A0A096NBV8_PAPAN|A0A096NBV8|EDRF1
MGDPKEARAEGPPAGAAARGGLSLLSQGESEEPSAQGSALFLGGNEVKSRAVVKYSSAPPRTAFARLEEKTDLKLPPANWLRESAKLGPAGTTILGNSKKSKPFSSFGMAYDFIDSVGNDVDVVSDSENIKKLLKIPYSKSHVSMAVHRIGRTLLLDELDIQELFMRSSQTGDWTWLKEFYQRLIDQKWQRKKKSKEHWYQKAILSKFLYYSINGDGAAQPVSSTAEQQESSSSDQTNDSEGASWPAPFEMPSSVSEDPSASSQGSEPLEPSYIVGHVASAPKEQNLTTLFNDGEHSQGLKNDFVRNILWTFEDIHMLVGSNMPIFGGGRYPAVSLRLRDNNKPINVLTGIDYWLDNLICNVPELVMCFHVNGIVQKYEMIKTEEIPNLENSNFSTKVIKDIAQNILSFLKSNCTKEGHTYWLFKASGSDIVKLYDLTTLCEETEDKYQNPFTMPVAILLYKVACNMMMKKNQNKKHYGTIRTLLLNCLKLLDKSRHPQIIASANYMLSELFQLDEPKKEENSESPLNENSDESYSEEEEEMPDSDENGSYSTSSDPSDDSKAVAIIKSVGELSVPEKYKSIHQIRPSCAFPVCHDTEERCRLVLSYVLEGLKSVDSSMKKESDLPAADPSTPIPLKYEDESTRGGPEGLEKQMALFLDKMGSLQKGNYSSQSGMIPGSWQHKMKLQLILKSSKAYYVLSDAAMSLQKYGRALRYIKLALQSHDTYCCLCTNMLSEVLLFLSQYLTLCGDIQLMLAQNANNRAAHLEEFHYQTKEDQEILHSLHRESSCQGFAWATDLSTDLESQLSVSCKCYEAANEILQFSDLKSQNPEHYVQVLKRMGNIRNEIGVFYMNQAAALQSERVVSKSVSAAEQQLWKKSFSCFEKGIHNFESIEDATNAALLLCNTGRLMRICAQAHCGAGDEFKREFSPEEGLYYNKAIDYYLKALRSLGTRDIHPAVWDSVNWELSTTYFTMATLQQDYAPLSRKAQEQIEKEVSEAMMKSLKYCDVDSMSARQPLCQYRAATIHHRLASMYHSCLRNQVGDEHLRKQHRVLADLHYSKAAKLFQLLRDAPCELLRVQLERVAFAEFQMTSQNSNVGKLKTLSGALDIMVRTEHAFQLIQKELVEEFGQPKSGDAAPAADASPSLNREEVMKLLSIFESRLSFLLLQSIKLLSSTKKKTSNNIEDDAVLKTNKHIYSQLLRATANKTATLLERINVIVHLLGQLAAGSAASSSAVQ
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.3	Very low	34.3	Very low	255 Å²	255	151.2 Å²	151.2	100%	1.256	84%	0.843	S	S	*	*				0	114.6	0	-69.9	-165.5	-159.9	0	0	107.1
2	G	36.7	Very low	35.5	Very low	73 Å²	73	149.2 Å²	149.2	75%	0.753	84%	0.841	S	S	*	*			cis	-149.9	129.2	-5.8	0	0	0	0	0	108.9
3	D	33	Very low	36.5	Very low	165 Å²	165	146.5 Å²	146.5	88%	0.882	83%	0.834	S	S	*	*				45.3	153.7	126.7	-85.6	6.2	0	0	0	125
4	P	66.5	Low	35.8	Very low	108 Å²	108	143.6 Å²	143.6	70%	0.701	84%	0.837	S	S	*	*			trans	-124.2	-164.8	-142.2	39.2	-19	0	0	0	112.3
5	K	30.5	Very low	35.2	Very low	193 Å²	193	138.6 Å²	138.6	84%	0.839	83%	0.828	S	S	*	*			trans	-176.7	111.4	154.1	-104.5	164.2	-176.8	-175	0	109.6
6	E	33.4	Very low	34.7	Very low	186 Å²	186	136.9 Å²	136.9	87%	0.869	83%	0.834	S	S	*	*				66.8	123.2	75.1	-91.1	-162.6	154.5	0	0	117.2
7	A	30.4	Very low	34.2	Very low	90 Å²	90	134.3 Å²	134.3	74%	0.744	83%	0.83	S	S	*	*			trans	141.8	111.2	130.8	0	0	0	0	0	111.8
8	R	29.3	Very low	33.8	Very low	251 Å²	251	131.9 Å²	131.9	95%	0.947	83%	0.826	S	S	*	*				62.4	140.9	91.6	-86	-172.6	174.8	178.1	-0.6	113.3
9	A	29.5	Very low	33.6	Very low	77 Å²	77	138.3 Å²	138.3	64%	0.636	83%	0.833	S	S	*	*			cis	-174.2	162.8	1	0	0	0	0	0	108.1
10	E	28.1	Very low	33.3	Very low	193 Å²	193	135.3 Å²	135.3	90%	0.902	83%	0.831	S	S	*	*			trans	66.8	113.5	144.7	-73.7	177.1	-172.2	0	0	122.6
11	G	26.6	Very low	32.9	Very low	72 Å²	72	132.5 Å²	132.5	74%	0.742	83%	0.829	S	S	*	*				103	151.8	103.4	0	0	0	0	0	119.4
12	P	49.2	Very low	32.6	Very low	127 Å²	127	128.9 Å²	128.9	83%	0.825	81%	0.814	S	S	*	*			trans	-110	-153.9	-146.3	42.7	-28.5	0	0	0	111.7
13	P	47.8	Very low	32.1	Very low	115 Å²	115	131.1 Å²	131.1	75%	0.747	82%	0.818	S	S	*	*			cis	-142.7	-177.3	-2.7	39.9	-18.3	0	0	0	117.2
14	A	27.5	Very low	31.9	Very low	105 Å²	105	131.4 Å²	131.4	87%	0.868	82%	0.818	S	S	*	*			trans	59.5	140.7	146.5	0	0	0	0	0	120.5
15	G	26.3	Very low	30	Very low	69 Å²	69	134.3 Å²	134.3	71%	0.711	83%	0.827	S	S	*	*			cis	163.7	166.9	6.8	0	0	0	0	0	110.1
16	A	26.7	Very low	29.8	Very low	112 Å²	112	130.6 Å²	130.6	93%	0.926	83%	0.826	S	S	*	*			trans	74	140.3	168	0	0	0	0	0	117.4
17	A	26.9	Very low	29.5	Very low	92 Å²	92	131.1 Å²	131.1	76%	0.76	83%	0.828	S	S	*	*			cis	-166.9	133.9	0.3	0	0	0	0	0	105
18	A	27.8	Very low	29.3	Very low	91 Å²	91	129.9 Å²	129.9	75%	0.752	83%	0.825	S	S	*	*				104.8	128.7	67.6	0	0	0	0	0	113.7
19	R	29.1	Very low	29.1	Very low	254 Å²	254	127.6 Å²	127.6	96%	0.958	83%	0.825	S	S	*	*			trans	77.3	131.8	159	-63.7	-177.1	172	-174.1	-2.7	118.7
20	G	26.8	Very low	29	Very low	77 Å²	77	129.2 Å²	129.2	79%	0.794	83%	0.831	S	S	*	*			cis	171.9	160.1	-1.2	0	0	0	0	0	114.2
21	G	26.3	Very low	29	Very low	77 Å²	77	129.3 Å²	129.3	79%	0.794	83%	0.832	S	S	*	*			trans	75	140.2	154.4	0	0	0	0	0	118.1
22	L	26.6	Very low	28.9	Very low	179 Å²	179	134.7 Å²	134.7	94%	0.937	84%	0.837	S	S	*	*			cis	-168.2	137	8	-101.5	149.5	0	0	0	107.5
23	S	26.1	Very low	27.9	Very low	120 Å²	120	133.9 Å²	133.9	84%	0.839	83%	0.832	S	S	*	*			trans	-164.3	142.2	158.8	179.9	0	0	0	0	110.5
24	L	28.8	Very low	26.8	Very low	171 Å²	171	133.5 Å²	133.5	90%	0.895	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-71.5	148.4	-157	-89.1	78.6	0	0	0	116.3
25	L	27.2	Very low	26.7	Very low	169 Å²	169	133.3 Å²	133.3	89%	0.885	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-75	127.5	176.7	-71.2	151.3	0	0	0	112.8
26	S	26	Very low	26.8	Very low	116 Å²	116	139 Å²	139	81%	0.811	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-92.2	122.5	149.6	51.4	0	0	0	0	108.3	G28	S26-G28 PolarHBondContact O-N 3.33Å
27	Q	27.4	Very low	26.8	Very low	196 Å²	196	137.1 Å²	137.1	92%	0.916	83%	0.83	S	S	*	*			trans	-75.7	113.4	174.9	-82.7	179.4	-26.1	0	0	109.4
28	G	26.5	Very low	27	Very low	65 Å²	65	138.6 Å²	138.6	67%	0.67	84%	0.835	S	S	*	*			trans	-74.9	141.5	161.2	0	0	0	0	0	110.5	S26 S30	S26-G28 PolarHBondContact O-N 3.33Å; G28-S30 PolarHBondContact O-N 2.72Å
29	E	24.9	Very low	26.9	Very low	203 Å²	203	138.1 Å²	138.1	95%	0.949	83%	0.831	S	S	*	*			trans	-56.3	126.1	169.3	-66.4	175.4	142.5	0	0	109.6
30	S	25.8	Very low	26.7	Very low	110 Å²	110	134.7 Å²	134.7	77%	0.769	83%	0.831	S	S	*	*			trans	-106.8	115.1	169.6	20.8	0	0	0	0	107.7	G28	G28-S30 PolarHBondContact O-N 2.72Å
31	E	29.2	Very low	26.7	Very low	196 Å²	196	140.4 Å²	140.4	92%	0.916	83%	0.834	S	S	*	*			trans	-53.5	130.3	156.1	-68	-179.8	138.1	0	0	109.1
32	E	25.1	Very low	26.8	Very low	185 Å²	185	145.4 Å²	145.4	86%	0.864	84%	0.842	S	S	*	*			trans	-131.1	151.8	161.7	-100	-153.7	165.9	0	0	110.5
33	P	26.5	Very low	26.8	Very low	109 Å²	109	139.7 Å²	139.7	71%	0.708	83%	0.826	S	S	*	*			trans	-93.2	151.7	-134.9	33.8	-35.1	0	0	0	114	A35	P33-A35 PolarHBondContact O-N 3.33Å
34	S	25.4	Very low	27	Very low	108 Å²	108	137.5 Å²	137.5	76%	0.755	82%	0.822	S	S	*	*			trans	-63.7	100.8	165.3	56.5	0	0	0	0	110.8	Q36	S34-Q36 VanDerWaalsContact C-N 3.3Å; S34-Q36 PolarHBondContact O-N 3.13Å
35	A	25.8	Very low	27.9	Very low	101 Å²	101	134.8 Å²	134.8	84%	0.835	81%	0.808	S	S	*	*			trans	-75.5	84.8	163.2	0	0	0	0	0	109.5	P33 G37	P33-A35 PolarHBondContact O-N 3.33Å; A35-G37 VanDerWaalsContact C-N 3.3Å; A35-G37 PolarHBondContact O-N 2.75Å; A35-G37 VanDerWaalsContact O-N 3.09Å
36	Q	28.7	Very low	29.5	Very low	188 Å²	188	134.5 Å²	134.5	88%	0.879	80%	0.803	S	S	*	*			trans	-71.9	88.6	158.5	-79.4	-178.1	-15.2	0	0	108.5	S34	S34-Q36 VanDerWaalsContact C-N 3.3Å; S34-Q36 PolarHBondContact O-N 3.13Å
37	G	25.3	Very low	31.9	Very low	72 Å²	72	130.3 Å²	130.3	74%	0.742	77%	0.772	S	S	*	*			trans	-90.2	102.9	163.2	0	0	0	0	0	109.5	A35 A39	A35-G37 VanDerWaalsContact C-N 3.3Å; A35-G37 PolarHBondContact O-N 2.75Å; A35-G37 VanDerWaalsContact O-N 3.09Å; G37-A39 PolarHBondContact O-N 3.45Å; G37-A39 VanDerWaalsContact O-N 3.09Å
38	S	31	Very low	34.5	Very low	123 Å²	123	128.6 Å²	128.6	86%	0.86	76%	0.762	S	S	*	*			trans	-63.4	101.6	171.5	54.5	0	0	0	0	110.9
39	A	26.7	Very low	37.2	Very low	82 Å²	82	127.5 Å²	127.5	68%	0.678	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-95	119.2	160.4	0	0	0	0	0	108.4	G37 F41	G37-A39 PolarHBondContact O-N 3.45Å; G37-A39 VanDerWaalsContact O-N 3.09Å; A39-F41 PolarHBondContact O-N 3.45Å
40	L	24.8	Very low	40.1	Very low	182 Å²	182	125.5 Å²	125.5	95%	0.953	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-52.4	120.1	176.2	-84.6	138.7	0	0	0	111	L42	L40-L42 PolarHBondContact O-N 3.09Å
41	F	27.8	Very low	43	Very low	196 Å²	196	120.8 Å²	120.8	86%	0.86	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-71.2	117	176.5	-83.4	-92.6	0	0	0	111.5	A39	A39-F41 PolarHBondContact O-N 3.45Å
42	L	26.5	Very low	45.4	Very low	183 Å²	183	114.8 Å²	114.8	96%	0.958	67%	0.671	S	S	*	*			trans	-134.4	97.6	154.7	-81.8	167.6	0	0	0	107.9	L40	L40-L42 PolarHBondContact O-N 3.09Å
43	G	26.5	Very low	48.1	Very low	59 Å²	59	109.6 Å²	109.6	61%	0.608	65%	0.653	S	S	*	*			trans	142.3	89.1	168.7	0	0	0	0	0	115.8	N45	G43-N45 VanDerWaalsContact C-N 3.27Å; G43-N45 PolarHBondContact O-N 3.21Å
44	G	32	Very low	50.3	Low	73 Å²	73	109.9 Å²	109.9	75%	0.753	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	45.9	-179	0	0	0	0	0	116.7	K397	G44-K397 WeakPolarHBondContact O-CE 3.14Å; G44-K397 PolarHBondContact O-NZ 3.36Å
45	N	46	Very low	52.6	Low	114 Å²	114	110.4 Å²	110.4	61%	0.61	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.5	1.1	-176.1	-84.6	-11.6	0	0	0	116.2	G43 K397	G43-N45 VanDerWaalsContact C-N 3.27Å; G43-N45 PolarHBondContact O-N 3.21Å; N45-K397 WeakPolarHBondContact OD1-CE 3.36Å; N45-K397 PolarHBondContact OD1-NZ 3.02Å
46	E	62	Low	54.7	Low	164 Å²	164	108.1 Å²	108.1	77%	0.766	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-91.4	130.9	-176	-73.7	179.4	173.3	0	0	113.3
47	V	75.4	Confident	56	Low	27 Å²	27	101.2 Å²	101.2	16%	0.164	58%	0.579	C	S	.	*	P	Polyproline II helix	trans	-82	128.5	173.4	174.2	0	0	0	0	109	S49 F312 E313	V47-S49 PolarHBondContact O-N 3.37Å; V47-F312 HydrophobicContact CG1-CD2 4.09Å; V47-F312 HydrophobicContact CG1-CE1 4.47Å; V47-F312 HydrophobicContact CG1-CE2 3.35Å; V47-F312 HydrophobicContact CG1-CZ 3.59Å; V47-E313 VanDerWaalsContact CA-OE1 3.24Å; V47-E313 WeakPolarHBondContact CA-OE1 3.41Å; V47-E313 HydrophobicContact CG1-CG 3.95Å; V47-E313 WeakPolarHBondContact CG1-OE1 3.48Å
48	K	81.9	Confident	57.7	Low	161 Å²	161	98.7 Å²	98.7	70%	0.7	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-75.3	120	178	-66.1	-179.8	-178.4	177.3	0	110	E313	K48-E313 PolarHBondContact N-OE1 2.91Å; K48-E313 PolarHBondContact O-N 3.27Å
49	S	84.9	Confident	58.9	Low	41 Å²	41	95.7 Å²	95.7	29%	0.287	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	130.8	177.2	176.5	0	0	0	0	110	V47 W310 T311	V47-S49 PolarHBondContact O-N 3.37Å; S49-W310 PolarHBondContact OG-NE1 3.36Å; S49-T311 WeakPolarHBondContact CA-O 3.43Å
50	R	85.5	Confident	60.5	Low	161 Å²	161	97.4 Å²	97.4	61%	0.608	53%	0.533	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.7	120	175.7	-177.3	177.7	69.4	172.7	0.6	109.5	T311	R50-T311 PolarHBondContact N-O 3.13Å; R50-T311 PolarHBondContact O-N 2.61Å
51	A	85.8	Confident	62.5	Low	11 Å²	11	95.8 Å²	95.8	9%	0.091	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	127.7	177.8	0	0	0	0	0	111.1	I308 I359 N361	A51-I308 HydrophobicContact CB-CG2 3.77Å; A51-I359 WeakPolarHBondContact CB-O 3.3Å; A51-N361 HydrophobicContact CB-CB 3.92Å
52	V	80.8	Confident	64.1	Low	70 Å²	70	89.7 Å²	89.7	42%	0.424	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	120.2	-179.7	-178.2	0	0	0	0	109.2	K54 L309	V52-K54 PolarHBondContact O-N 3.06Å; V52-L309 PolarHBondContact N-O 3.41Å; V52-L309 PolarHBondContact O-N 2.99Å
53	V	80.2	Confident	66	Low	77 Å²	77	83.9 Å²	83.9	47%	0.467	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	119.5	-179.9	-176.4	0	0	0	0	109.5	Y55 I308	V53-Y55 WeakPolarHBondContact CG1-O 3.15Å; V53-I308 HydrophobicContact CG2-CG1 4.43Å
54	K	74.1	Confident	68.3	Low	114 Å²	114	83.4 Å²	83.4	50%	0.496	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	-36.9	176.2	-77.6	-75.5	-173	172.6	0	112.1	V52 F113 N307 L309	V52-K54 PolarHBondContact O-N 3.06Å; K54-F113 HydrophobicContact CB-CD1 4.32Å; K54-F113 HydrophobicContact CB-CE1 3.8Å; K54-F113 HydrophobicContact CB-CZ 4.34Å; K54-N307 PolarHBondContact N-O 3.25Å; K54-L309 HydrophobicContact CG-CB 4.27Å
55	Y	73.5	Confident	70.4	Confident	119 Å²	119	81.4 Å²	81.4	47%	0.467	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	143.6	177.3	174.4	-92.9	0	0	0	110.5	V53 R306 N307	V53-Y55 WeakPolarHBondContact CG1-O 3.15Å; Y55-R306 CarbonylContact O-C 3.54Å; Y55-R306 VanDerWaalsContact O-CA 3.28Å; Y55-R306 WeakPolarHBondContact O-CA 3.47Å; Y55-N307 PolarHBondContact N-O 3.49Å; Y55-N307 PolarHBondContact O-N 2.74Å
56	S	69.9	Low	71.9	Confident	53 Å²	53	83.2 Å²	83.2	37%	0.371	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	118.1	174.7	176.1	0	0	0	0	109.1	A58	S56-A58 WeakPolarHBondContact OG-CB 3.49Å; S56-A58 PolarHBondContact OG-N 3.42Å
57	S	56.2	Low	72.7	Confident	44 Å²	44	76 Å²	76	31%	0.308	40%	0.395	S	S	.	.			trans	-81.1	-4.7	164.7	67.9	0	0	0	0	112	N302 V305	S57-N302 PolarHBondContact OG-O 3.2Å; S57-V305 PolarHBondContact N-O 2.62Å; S57-V305 WeakPolarHBondContact OG-CB 3.28Å; S57-V305 PolarHBondContact OG-N 3.05Å; S57-V305 PolarHBondContact OG-O 2.68Å
58	A	59.6	Low	72.8	Confident	18 Å²	18	80.9 Å²	80.9	15%	0.149	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-69.5	139	-173.7	0	0	0	0	0	112.6	S56 D303	S56-A58 WeakPolarHBondContact OG-CB 3.49Å; S56-A58 PolarHBondContact OG-N 3.42Å; A58-D303 VanDerWaalsContact CA-O 3.25Å; A58-D303 WeakPolarHBondContact CA-O 3.28Å
59	P	58	Low	72.7	Confident	61 Å²	61	78.6 Å²	78.6	40%	0.396	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-62.3	163.3	173.6	26	-30.5	0	0	0	110.8	R61 D303	P59-R61 PolarHBondContact O-N 3.22Å; P59-D303 WeakPolarHBondContact CD-O 3.37Å
60	P	59.8	Low	72.5	Confident	117 Å²	117	81.9 Å²	81.9	76%	0.76	42%	0.416	S	S	*	.	S	Bend	trans	-48.3	143.7	173.5	-23.5	31.6	0	0	0	110.6	T62	P60-T62 PolarHBondContact O-N 3.44Å; P60-T62 PolarHBondContact O-OG1 3.23Å
61	R	65.6	Low	72.3	Confident	149 Å²	149	74.3 Å²	74.3	56%	0.562	39%	0.388	S	S	*	.			trans	-50.1	115.7	-178.8	-66.5	-178.7	-178	164.7	1.7	109.2	P59 G327 P332	P59-R61 PolarHBondContact O-N 3.22Å; R61-G327 CarbonylContact C-O 3.5Å; R61-G327 VanDerWaalsContact C-O 3.23Å; R61-P332 WeakPolarHBondContact CD-O 3.24Å; R61-P332 PolarHBondContact NH1-O 3.28Å
62	T	62	Low	72.1	Confident	67 Å²	67	75.2 Å²	75.2	41%	0.411	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-88.1	137.5	176.8	-41.4	0	0	0	0	108.4	P60 F64 G327	P60-T62 PolarHBondContact O-N 3.44Å; P60-T62 PolarHBondContact O-OG1 3.23Å; T62-F64 PolarHBondContact O-N 3.05Å; T62-G327 CarbonylContact C-O 3.59Å; T62-G327 PolarHBondContact O-N 3.5Å
63	A	65.9	Low	72.1	Confident	62 Å²	62	71.9 Å²	71.9	51%	0.512	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-61.4	135.4	167	0	0	0	0	0	108.8	G327	A63-G327 PolarHBondContact N-O 2.91Å
64	F	75	Confident	72.1	Confident	48 Å²	48	72.7 Å²	72.7	21%	0.211	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-87.3	142.5	174.9	72.7	-83.6	0	0	0	110.6	T62 R66 S212 F326 V334 L336 V366	T62-F64 PolarHBondContact O-N 3.05Å; F64-R66 HydrophobicContact CE2-CB 4.42Å; F64-S212 WeakPolarHBondContact CA-O 3.49Å; F64-F326 HydrophobicContact CB-CB 4.1Å; F64-F326 HydrophobicContact CB-CD1 3.69Å; F64-F326 HydrophobicContact CB-CE1 4.32Å; F64-F326 HydrophobicContact CB-CG 3.97Å; F64-F326 HydrophobicContact CD1-CB 4.09Å; F64-V334 HydrophobicContact CD1-CG2 3.84Å; F64-V334 HydrophobicContact CE1-CG2 3.66Å; F64-L336 HydrophobicContact CB-CD1 3.69Å; F64-L336 HydrophobicContact CD2-CD1 4.05Å; F64-L336 HydrophobicContact CD2-CD2 3.84Å; F64-L336 HydrophobicContact CE2-CD2 3.97Å; F64-L336 HydrophobicContact CG-CD1 3.91Å; F64-L336 HydrophobicContact CG-CD2 4.18Å; F64-L336 HydrophobicContact CG-CG 4.44Å; F64-L336 HydrophobicContact CZ-CD2 4.42Å; F64-V366 HydrophobicContact CE2-CG1 4.22Å; F64-V366 HydrophobicContact CZ-CG1 4.13Å; F64-V366 HydrophobicContact CZ-CG2 4.18Å
65	A	75.4	Confident	72.1	Confident	32 Å²	32	72.2 Å²	72.2	26%	0.264	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-81.6	121.7	170.8	0	0	0	0	0	109.7	L67 S212	A65-L67 PolarHBondContact O-N 3.09Å; A65-S212 PolarHBondContact N-O 3.38Å
66	R	77.9	Confident	71.7	Confident	152 Å²	152	70.3 Å²	70.3	57%	0.574	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-75.4	122.3	171	-176.4	177.2	170.7	170.3	-2.8	108.3	F64 Y378	F64-R66 HydrophobicContact CE2-CB 4.42Å; R66-Y378 HydrophobicContact CG-CD1 4.23Å; R66-Y378 HydrophobicContact CG-CD2 3.65Å; R66-Y378 HydrophobicContact CG-CE1 4.23Å; R66-Y378 HydrophobicContact CG-CE2 3.65Å; R66-Y378 HydrophobicContact CG-CG 3.94Å
67	L	79.4	Confident	71.6	Confident	13 Å²	13	68.1 Å²	68.1	7%	0.068	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-69.1	141.6	174.9	-66.9	171.4	0	0	0	110.3	A65 T71 L73 F208 Y211 A219 V375 Y378	A65-L67 PolarHBondContact O-N 3.09Å; L67-T71 HydrophobicContact CD1-CG2 4.42Å; L67-T71 HydrophobicContact CD2-CG2 4.19Å; L67-L73 HydrophobicContact CD1-CD2 3.71Å; L67-F208 HydrophobicContact CD1-CD2 3.81Å; L67-F208 HydrophobicContact CD1-CE2 4.27Å; L67-Y211 HydrophobicContact CD2-CD1 4.49Å; L67-Y211 HydrophobicContact CD2-CG 4.08Å; L67-A219 HydrophobicContact CD2-CB 4.29Å; L67-V375 HydrophobicContact CB-CG1 4.4Å; L67-V375 HydrophobicContact CB-CG2 4.23Å; L67-V375 HydrophobicContact CD1-CG2 3.92Å; L67-Y378 HydrophobicContact CB-CE2 4.19Å; L67-Y378 WeakPolarHBondContact CB-OH 3.41Å; L67-Y378 PolarHBondContact N-OH 2.88Å; L67-Y378 WeakPolarHBondContact O-CE2 3.32Å
68	E	77.4	Confident	71.8	Confident	128 Å²	128	69 Å²	69	60%	0.598	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-65	147.2	172.5	-66.9	-171.7	174.1	0	0	110.6	T71	E68-T71 WeakPolarHBondContact O-CB 3.35Å; E68-T71 PolarHBondContact O-N 3.19Å; E68-T71 PolarHBondContact O-OG1 3.01Å
69	E	80.5	Confident	71.7	Confident	113 Å²	113	73.1 Å²	73.1	53%	0.528	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	140.5	173.4	-56.3	-174.3	174.2	0	0	109.1	Q376	E69-Q376 VanDerWaalsContact CD-O 3.3Å; E69-Q376 VanDerWaalsContact CG-O 3.23Å; E69-Q376 WeakPolarHBondContact CG-O 3.21Å
70	K	79.5	Confident	71.7	Confident	111 Å²	111	73.4 Å²	73.4	48%	0.483	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	12.7	-172.3	-47.6	173.9	-179.2	174.9	0	116.6	D72 I374 V375	K70-D72 PolarHBondContact O-N 3.16Å; K70-I374 HydrophobicContact CB-CG2 4.45Å; K70-V375 PolarHBondContact N-O 2.87Å
71	T	81.5	Confident	71.4	Confident	1 Å²	1	75.8 Å²	75.8	1%	0.006	39%	0.385	C	S	.	.	B	Isolated β-bridge	trans	-64.5	126.7	168.6	-61.6	0	0	0	0	111.1	L67 E68 A219 I374 V375	L67-T71 HydrophobicContact CD1-CG2 4.42Å; L67-T71 HydrophobicContact CD2-CG2 4.19Å; E68-T71 WeakPolarHBondContact O-CB 3.35Å; E68-T71 PolarHBondContact O-N 3.19Å; E68-T71 PolarHBondContact O-OG1 3.01Å; T71-A219 HydrophobicContact CG2-CB 3.68Å; T71-I374 WeakPolarHBondContact O-CA 3.37Å; T71-V375 PolarHBondContact O-N 3.03Å
72	D	82.3	Confident	70.8	Confident	31 Å²	31	78.1 Å²	78.1	17%	0.166	39%	0.394	C	S	.	.	B	Isolated β-bridge	trans	-89.6	104.7	176.6	-172.9	2.8	0	0	0	112.4	K70 K74 L75 V222	K70-D72 PolarHBondContact O-N 3.16Å; D72-K74 PolarHBondContact O-N 3.31Å; D72-K74 WeakPolarHBondContact OD1-CB 3.12Å; D72-K74 VanDerWaalsContact OD1-CG 3.25Å; D72-K74 WeakPolarHBondContact OD1-CG 3.37Å; D72-K74 PolarHBondContact OD1-N 2.97Å; D72-L75 HydrophobicContact CB-CD1 4.34Å; D72-L75 HydrophobicContact CB-CG 4.43Å; D72-L75 PolarHBondContact O-N 3.37Å; D72-V222 HydrophobicContact CB-CG2 4.41Å
73	L	79.6	Confident	70	Confident	0 Å²	0	82.7 Å²	82.7	0%	0	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-2.5	176.9	-59.1	169.2	0	0	0	113.5	L67 L75 I204 K207 F208 Y211 L338 G373 V375	L67-L73 HydrophobicContact CD1-CD2 3.71Å; L73-L75 VanDerWaalsContact C-N 3.32Å; L73-I204 HydrophobicContact CB-CG2 3.65Å; L73-I204 HydrophobicContact CD1-CG2 3.75Å; L73-I204 HydrophobicContact CG-CG2 4.35Å; L73-K207 WeakPolarHBondContact O-CD 3.37Å; L73-F208 HydrophobicContact CD1-CB 4.11Å; L73-F208 HydrophobicContact CD1-CD2 4.46Å; L73-F208 HydrophobicContact CD2-CB 4.03Å; L73-Y211 HydrophobicContact CD2-CD2 3.82Å; L73-Y211 HydrophobicContact CD2-CE2 4.23Å; L73-L338 HydrophobicContact CD1-CD1 3.81Å; L73-L338 HydrophobicContact CD1-CD2 4.01Å; L73-G373 WeakPolarHBondContact CB-O 3.49Å; L73-G373 VanDerWaalsContact CG-O 3.26Å; L73-G373 WeakPolarHBondContact CG-O 3.15Å; L73-G373 PolarHBondContact N-O 2.73Å; L73-V375 HydrophobicContact CD1-CG2 3.93Å; L73-V375 HydrophobicContact CD2-CG2 4.35Å; L73-V375 HydrophobicContact CG-CG2 4.02Å
74	K	80	Confident	68.8	Low	94 Å²	94	81 Å²	81	41%	0.409	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-29.8	170.8	-61.9	-179.1	-158.7	-179.7	0	111.3	D72 Y200 K207 N372	D72-K74 PolarHBondContact O-N 3.31Å; D72-K74 WeakPolarHBondContact OD1-CB 3.12Å; D72-K74 VanDerWaalsContact OD1-CG 3.25Å; D72-K74 WeakPolarHBondContact OD1-CG 3.37Å; D72-K74 PolarHBondContact OD1-N 2.97Å; K74-Y200 VanDerWaalsContact CE-OH 3.23Å; K74-Y200 WeakPolarHBondContact CE-OH 3.16Å; K74-K207 PolarHBondContact O-NZ 3.32Å; K74-N372 WeakPolarHBondContact CE-O 3.37Å; K74-N372 PolarHBondContact NZ-O 3.04Å
75	L	75.1	Confident	67.3	Low	103 Å²	103	84.1 Å²	84.1	54%	0.539	43%	0.43	S	S	.	.	S	Bend	trans	-71.7	134.6	177.5	-61.7	175.3	0	0	0	109.8	D72 L73 Y211	D72-L75 HydrophobicContact CB-CD1 4.34Å; D72-L75 HydrophobicContact CB-CG 4.43Å; D72-L75 PolarHBondContact O-N 3.37Å; L73-L75 VanDerWaalsContact C-N 3.32Å; L75-Y211 PolarHBondContact O-OH 2.97Å
76	P	65.7	Low	65.8	Low	79 Å²	79	90.4 Å²	90.4	51%	0.513	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-72.6	136.5	173.9	29.5	-31.8	0	0	0	110.2	W80	P76-W80 HydrophobicContact CB-CB 4.14Å; P76-W80 HydrophobicContact CB-CG 4.11Å
77	P	66.8	Low	64.2	Low	7 Å²	7	83.5 Å²	83.5	5%	0.045	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-55.5	154.1	170.1	-23.5	29.4	0	0	0	113.4	N79 W80 Y210 Y211	P77-N79 PolarHBondContact O-N 3.01Å; P77-W80 HydrophobicContact CB-CB 4.42Å; P77-W80 HydrophobicContact CB-CE3 4.29Å; P77-W80 VanDerWaalsContact CD-CE3 3.45Å; P77-W80 HydrophobicContact CG-CD2 4.3Å; P77-W80 HydrophobicContact CG-CE3 3.51Å; P77-W80 HydrophobicContact CG-CZ3 4.08Å; P77-W80 WeakPolarHBondContact O-CB 3.06Å; P77-W80 PolarHBondContact O-N 3.46Å; P77-W80 VanDerWaalsContact O-N 3.1Å; P77-Y210 HydrophobicContact CB-CD1 3.43Å; P77-Y210 VanDerWaalsContact CB-CD1 3.43Å; P77-Y210 HydrophobicContact CB-CE1 3.41Å; P77-Y210 VanDerWaalsContact CB-CE1 3.41Å; P77-Y210 HydrophobicContact CB-CG 4.48Å; P77-Y210 HydrophobicContact CG-CD1 3.49Å; P77-Y210 VanDerWaalsContact CG-CD1 3.49Å; P77-Y210 HydrophobicContact CG-CE1 4.02Å; P77-Y210 HydrophobicContact CG-CG 4.2Å; P77-Y211 HydrophobicContact CB-CD1 4.39Å; P77-Y211 HydrophobicContact CB-CE1 3.88Å; P77-Y211 HydrophobicContact CG-CD1 4.17Å; P77-Y211 HydrophobicContact CG-CD2 4.07Å; P77-Y211 HydrophobicContact CG-CE1 3.8Å; P77-Y211 HydrophobicContact CG-CE2 3.67Å; P77-Y211 HydrophobicContact CG-CG 4.29Å
78	A	60	Low	62.8	Low	63 Å²	63	84.1 Å²	84.1	52%	0.521	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	129.4	168.2	0	0	0	0	0	109.6	Y210 A218	A78-Y210 PolarHBondContact O-OH 2.99Å; A78-A218 HydrophobicContact CB-CB 4.14Å
79	N	57.7	Low	61.1	Low	105 Å²	105	79.4 Å²	79.4	56%	0.561	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.8	17.8	-174.1	-51.7	-51.7	0	0	0	116.6	P77 L81 R82	P77-N79 PolarHBondContact O-N 3.01Å; N79-L81 PolarHBondContact O-N 3.01Å; N79-R82 HydrophobicContact CB-CB 4.43Å; N79-R82 PolarHBondContact O-N 3.14Å
80	W	58.2	Low	59.2	Low	67 Å²	67	74.2 Å²	74.2	25%	0.254	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-29.3	176.8	178.6	-105.7	0	0	0	115.6	P76 P77 S206 K207 Y210	P76-W80 HydrophobicContact CB-CB 4.14Å; P76-W80 HydrophobicContact CB-CG 4.11Å; P77-W80 HydrophobicContact CB-CB 4.42Å; P77-W80 HydrophobicContact CB-CE3 4.29Å; P77-W80 VanDerWaalsContact CD-CE3 3.45Å; P77-W80 HydrophobicContact CG-CD2 4.3Å; P77-W80 HydrophobicContact CG-CE3 3.51Å; P77-W80 HydrophobicContact CG-CZ3 4.08Å; P77-W80 WeakPolarHBondContact O-CB 3.06Å; P77-W80 PolarHBondContact O-N 3.46Å; P77-W80 VanDerWaalsContact O-N 3.1Å; W80-S206 WeakPolarHBondContact CH2-OG 3.41Å; W80-K207 HydrophobicContact CD2-CG 4.28Å; W80-K207 HydrophobicContact CE3-CG 4.21Å; W80-K207 HydrophobicContact CH2-CB 3.99Å; W80-K207 HydrophobicContact CH2-CG 3.38Å; W80-K207 HydrophobicContact CZ2-CG 3.47Å; W80-K207 VanDerWaalsContact CZ2-CG 3.47Å; W80-K207 VanDerWaalsContact CZ3-CA 3.43Å; W80-K207 HydrophobicContact CZ3-CB 4.15Å; W80-K207 HydrophobicContact CZ3-CG 3.76Å; W80-Y210 HydrophobicContact CE3-CD1 4.27Å; W80-Y210 HydrophobicContact CE3-CD2 4.05Å; W80-Y210 AromaticContact CE3-CG 3.87Å; W80-Y210 HydrophobicContact CE3-CG 3.87Å; W80-Y210 VanDerWaalsContact CZ3-CB 3.46Å; W80-Y210 HydrophobicContact CZ3-CD2 4.09Å; W80-Y210 AromaticContact CZ3-CG 3.8Å; W80-Y210 HydrophobicContact CZ3-CG 3.8Å
81	L	54.5	Low	57.5	Low	166 Å²	166	69.9 Å²	69.9	87%	0.869	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	-0	-178.5	-64.8	172.1	0	0	0	114	N79	N79-L81 PolarHBondContact O-N 3.01Å
82	R	52.1	Low	55.5	Low	198 Å²	198	74.3 Å²	74.3	75%	0.747	41%	0.407	S	S	*	.	S	Bend	trans	-99.4	135	174.8	-72.3	-169.1	-176	-149.4	3.2	109.6	N79 S84	N79-R82 HydrophobicContact CB-CB 4.43Å; N79-R82 PolarHBondContact O-N 3.14Å; R82-S84 PolarHBondContact O-N 2.92Å
83	E	46.4	Very low	53.6	Low	163 Å²	163	74.6 Å²	74.6	76%	0.762	41%	0.41	S	S	*	.			trans	-56.2	98	170.3	-101.6	174.2	166.1	0	0	109.6
84	S	40.6	Very low	51.9	Low	28 Å²	28	76.7 Å²	76.7	20%	0.196	42%	0.42	C	S	.	.			trans	-79	130.2	175.2	66.8	0	0	0	0	109.4	R82 K86 L87 G88	R82-S84 PolarHBondContact O-N 2.92Å; S84-K86 PolarHBondContact O-N 3.48Å; S84-L87 PolarHBondContact O-N 2.88Å; S84-L87 VanDerWaalsContact O-N 3.11Å; S84-L87 WeakPolarHBondContact OG-CB 3.45Å; S84-G88 PolarHBondContact O-N 3.39Å
85	A	42.1	Very low	50	Low	113 Å²	113	73.6 Å²	73.6	93%	0.934	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-9.1	-179.1	0	0	0	0	0	115.5
86	K	44.4	Very low	48.2	Very low	164 Å²	164	71.5 Å²	71.5	71%	0.713	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	-15.8	178.8	-70	-174.9	178.2	178.8	0	114.9	S84	S84-K86 PolarHBondContact O-N 3.48Å
87	L	44.8	Very low	46.7	Very low	6 Å²	6	71.8 Å²	71.8	3%	0.031	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.5	-8.4	-170.9	-133.6	137.7	0	0	0	113.5	S84 A90 Y210 I213 N214	S84-L87 PolarHBondContact O-N 2.88Å; S84-L87 VanDerWaalsContact O-N 3.11Å; S84-L87 WeakPolarHBondContact OG-CB 3.45Å; L87-A90 HydrophobicContact CD2-CB 4.46Å; L87-A90 WeakPolarHBondContact O-CB 3.46Å; L87-A90 PolarHBondContact O-N 3.1Å; L87-Y210 HydrophobicContact CD1-CD2 4.05Å; L87-I213 HydrophobicContact CD1-CB 3.89Å; L87-I213 HydrophobicContact CD1-CD1 3.71Å; L87-I213 HydrophobicContact CD1-CG1 4.39Å; L87-I213 HydrophobicContact CD1-CG2 3.71Å; L87-I213 HydrophobicContact CG-CD1 4.19Å; L87-N214 VanDerWaalsContact CD1-OD1 3.27Å; L87-N214 WeakPolarHBondContact CD1-OD1 3.47Å
88	G	49.4	Very low	45.2	Very low	27 Å²	27	74.5 Å²	74.5	28%	0.278	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.9	-155.4	175.5	0	0	0	0	0	114.2	S84 A90 D303	S84-G88 PolarHBondContact O-N 3.39Å; G88-A90 PolarHBondContact O-N 2.85Å; G88-A90 VanDerWaalsContact O-N 3.1Å; G88-D303 PolarHBondContact N-OD2 3.41Å
89	P	41.9	Very low	44.1	Very low	29 Å²	29	81.4 Å²	81.4	19%	0.188	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-0.1	168	-16.7	30.3	0	0	0	114.1	G91 T92 T93 L300 K301	P89-G91 VanDerWaalsContact C-N 3.31Å; P89-G91 PolarHBondContact O-N 3.14Å; P89-T92 PolarHBondContact O-N 3.32Å; P89-T92 PolarHBondContact O-OG1 2.65Å; P89-T93 PolarHBondContact O-N 2.98Å; P89-T93 VanDerWaalsContact O-N 3.15Å; P89-T93 PolarHBondContact O-OG1 2.93Å; P89-L300 HydrophobicContact CG-CB 4.44Å; P89-L300 HydrophobicContact CG-CD2 3.74Å; P89-K301 WeakPolarHBondContact CD-O 3.4Å
90	A	41.2	Very low	43.4	Very low	3 Å²	3	85.9 Å²	85.9	3%	0.025	46%	0.46	C	S	.	.	H	α-helix	trans	-66.3	-31.5	-175.6	0	0	0	0	0	112.6	L87 G88 T92 T93 I94 D303 F304	L87-A90 HydrophobicContact CD2-CB 4.46Å; L87-A90 WeakPolarHBondContact O-CB 3.46Å; L87-A90 PolarHBondContact O-N 3.1Å; G88-A90 PolarHBondContact O-N 2.85Å; G88-A90 VanDerWaalsContact O-N 3.1Å; A90-T92 PolarHBondContact O-N 3.31Å; A90-T93 WeakPolarHBondContact CA-OG1 3.47Å; A90-T93 PolarHBondContact O-N 3.16Å; A90-I94 WeakPolarHBondContact O-CD1 3.39Å; A90-I94 VanDerWaalsContact O-CG1 3.25Å; A90-I94 WeakPolarHBondContact O-CG1 3.49Å; A90-I94 PolarHBondContact O-N 3.22Å; A90-D303 HydrophobicContact CB-CB 4.31Å; A90-F304 HydrophobicContact CB-CD2 4.1Å; A90-F304 HydrophobicContact CB-CE2 4.03Å
91	G	43.6	Very low	42.7	Very low	21 Å²	21	86.1 Å²	86.1	22%	0.216	47%	0.473	C	S	.	.	H	α-helix	trans	-59.2	-30.9	177.2	0	0	0	0	0	113.3	P89 S206	P89-G91 VanDerWaalsContact C-N 3.31Å; P89-G91 PolarHBondContact O-N 3.14Å; G91-S206 PolarHBondContact O-OG 3.24Å
92	T	39.7	Very low	42.9	Very low	94 Å²	94	83.8 Å²	83.8	58%	0.577	46%	0.455	S	S	*	.	H	α-helix	trans	-98.1	-21.4	178.1	35.2	0	0	0	0	113.9	P89 A90 L95	P89-T92 PolarHBondContact O-N 3.32Å; P89-T92 PolarHBondContact O-OG1 2.65Å; A90-T92 PolarHBondContact O-N 3.31Å; T92-L95 CarbonylContact O-C 3.59Å; T92-L95 VanDerWaalsContact O-CB 3.24Å; T92-L95 WeakPolarHBondContact O-CB 3.37Å; T92-L95 PolarHBondContact O-N 2.69Å
93	T	42.4	Very low	43.3	Very low	36 Å²	36	77.4 Å²	77.4	22%	0.221	44%	0.439	C	S	.	.	H	α-helix	trans	-88.6	-28	178.6	36.4	0	0	0	0	114.6	P89 A90 L95 G96	P89-T93 PolarHBondContact O-N 2.98Å; P89-T93 VanDerWaalsContact O-N 3.15Å; P89-T93 PolarHBondContact O-OG1 2.93Å; A90-T93 WeakPolarHBondContact CA-OG1 3.47Å; A90-T93 PolarHBondContact O-N 3.16Å; T93-L95 PolarHBondContact O-N 3.46Å; T93-L95 VanDerWaalsContact O-N 3.1Å; T93-G96 PolarHBondContact O-N 2.87Å
94	I	42.5	Very low	44.7	Very low	44 Å²	44	70.1 Å²	70.1	23%	0.226	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-25.4	163.2	-63.2	163	0	0	0	110.1	A90 L209 F304 P324	A90-I94 WeakPolarHBondContact O-CD1 3.39Å; A90-I94 VanDerWaalsContact O-CG1 3.25Å; A90-I94 WeakPolarHBondContact O-CG1 3.49Å; A90-I94 PolarHBondContact O-N 3.22Å; I94-L209 HydrophobicContact CD1-CD1 4.17Å; I94-L209 HydrophobicContact CG2-CD1 3.69Å; I94-F304 HydrophobicContact CD1-CE2 4.42Å; I94-P324 HydrophobicContact CD1-CG 4.34Å
95	L	40.9	Very low	46.7	Very low	29 Å²	29	71.4 Å²	71.4	15%	0.152	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	18	176.5	-93.8	166.7	0	0	0	114.1	T92 T93 N97 K202 S206	T92-L95 CarbonylContact O-C 3.59Å; T92-L95 VanDerWaalsContact O-CB 3.24Å; T92-L95 WeakPolarHBondContact O-CB 3.37Å; T92-L95 PolarHBondContact O-N 2.69Å; T93-L95 PolarHBondContact O-N 3.46Å; T93-L95 VanDerWaalsContact O-N 3.1Å; L95-N97 VanDerWaalsContact O-CB 3.26Å; L95-N97 WeakPolarHBondContact O-CB 3.21Å; L95-N97 PolarHBondContact O-N 3.43Å; L95-N97 PolarHBondContact O-OD1 2.98Å; L95-N97 VanDerWaalsContact O-OD1 3.11Å; L95-K202 HydrophobicContact CD2-CB 3.47Å; L95-K202 VanDerWaalsContact CD2-CB 3.47Å; L95-K202 HydrophobicContact CD2-CD 3.39Å; L95-K202 HydrophobicContact CD2-CG 3.26Å; L95-K202 WeakPolarHBondContact O-CE 3.39Å; L95-K202 PolarHBondContact O-NZ 2.9Å; L95-S206 WeakPolarHBondContact CD1-OG 3.36Å
96	G	37.4	Very low	48.7	Very low	59 Å²	59	66 Å²	66	61%	0.608	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	38.1	42.2	166	0	0	0	0	0	116.1	T93 K202	T93-G96 PolarHBondContact O-N 2.87Å; G96-K202 PolarHBondContact O-NZ 2.84Å
97	N	33.7	Very low	50.6	Low	86 Å²	86	59.7 Å²	59.7	46%	0.46	34%	0.342	S	S	.	.			trans	-122.8	-6.7	-168.8	-106.4	48.9	0	0	0	113.8	L95 K99 W199 K202	L95-N97 VanDerWaalsContact O-CB 3.26Å; L95-N97 WeakPolarHBondContact O-CB 3.21Å; L95-N97 PolarHBondContact O-N 3.43Å; L95-N97 PolarHBondContact O-OD1 2.98Å; L95-N97 VanDerWaalsContact O-OD1 3.11Å; N97-K99 PolarHBondContact O-N 3.04Å; N97-W199 WeakPolarHBondContact ND2-CH2 3.39Å; N97-W199 WeakPolarHBondContact ND2-CZ3 3.38Å; N97-W199 WeakPolarHBondContact OD1-CH2 3.08Å; N97-W199 WeakPolarHBondContact OD1-CZ3 3.3Å; N97-K202 PolarHBondContact OD1-NZ 3.34Å
98	S	34.6	Very low	52.3	Low	63 Å²	63	61 Å²	61	44%	0.441	36%	0.357	S	S	.	.			trans	-80.4	109	168.8	173.7	0	0	0	0	108.7	K100	S98-K100 PolarHBondContact O-N 3.14Å; S98-K100 VanDerWaalsContact O-N 3.09Å; S98-K100 PolarHBondContact OG-N 3.26Å; S98-K100 VanDerWaalsContact OG-N 3.15Å
99	K	38.9	Very low	53.9	Low	209 Å²	209	60 Å²	60	91%	0.909	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	4.4	166.4	-72	-177.7	176.9	178.8	0	112.9	N97	N97-K99 PolarHBondContact O-N 3.04Å
100	K	41	Very low	56	Low	198 Å²	198	58.6 Å²	58.6	86%	0.861	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.8	-5.6	-169.4	-74.5	-168.1	173.7	-173.1	0	116.2	S98	S98-K100 PolarHBondContact O-N 3.14Å; S98-K100 VanDerWaalsContact O-N 3.09Å; S98-K100 PolarHBondContact OG-N 3.26Å; S98-K100 VanDerWaalsContact OG-N 3.15Å
101	S	44.8	Very low	57.9	Low	73 Å²	73	64.1 Å²	64.1	51%	0.51	36%	0.357	S	S	.	.			trans	-162.1	123.9	163	57.5	0	0	0	0	112.8
102	K	58.6	Low	59.6	Low	116 Å²	116	68.3 Å²	68.3	50%	0.504	38%	0.375	S	S	.	.			trans	-72.9	130.6	159.2	-69.7	-178.1	-176.9	178.3	0	106.8	F104	K102-F104 VanDerWaalsContact C-N 3.28Å; K102-F104 PolarHBondContact O-N 2.81Å
103	P	61.5	Low	61.6	Low	64 Å²	64	65.5 Å²	65.5	42%	0.416	35%	0.354	S	S	.	.	S	Bend	trans	-71	-22.2	-173.3	26.5	-33.4	0	0	0	113.7
104	F	74.1	Confident	63.5	Low	10 Å²	10	65.3 Å²	65.3	4%	0.044	35%	0.352	C	S	.	.			trans	-128	132.3	178.8	-56.6	-76.2	0	0	0	109.8	K102 M109 D126 V305 G320 S321 N322	K102-F104 VanDerWaalsContact C-N 3.28Å; K102-F104 PolarHBondContact O-N 2.81Å; F104-M109 HydrophobicContact CB-SD 4.12Å; F104-M109 HydrophobicContact CD1-SD 4.09Å; F104-D126 HydrophobicContact CB-CB 4.02Å; F104-V305 HydrophobicContact CE1-CG1 3.52Å; F104-V305 HydrophobicContact CZ-CB 4.23Å; F104-V305 HydrophobicContact CZ-CG1 3.7Å; F104-V305 HydrophobicContact CZ-CG2 4.22Å; F104-G320 VanDerWaalsContact CD1-CA 3.45Å; F104-G320 VanDerWaalsContact CE1-CA 3.47Å; F104-S321 VanDerWaalsContact CZ-N 3.28Å; F104-S321 VanDerWaalsContact CZ-O 3.31Å; F104-S321 WeakPolarHBondContact CZ-O 3.45Å; F104-N322 HydrophobicContact CE2-CB 3.83Å; F104-N322 HydrophobicContact CZ-CB 4.33Å
105	S	83.2	Confident	65	Low	55 Å²	55	67.4 Å²	67.4	39%	0.385	36%	0.363	S	S	.	.			trans	-127	133.6	168.6	163	0	0	0	0	107.2	F107 G108 M109	S105-F107 PolarHBondContact O-N 3.09Å; S105-G108 PolarHBondContact O-N 3.09Å; S105-G108 VanDerWaalsContact O-N 3.1Å; S105-M109 WeakPolarHBondContact O-CG 3.17Å; S105-M109 PolarHBondContact O-N 3.19Å
106	S	84.4	Confident	66.7	Low	0 Å²	0	66.7 Å²	66.7	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-59.2	-36.8	-178.6	73.6	0	0	0	0	112	A110 D157	S106-A110 WeakPolarHBondContact O-CB 3.26Å; S106-A110 PolarHBondContact O-N 2.81Å; S106-D157 WeakPolarHBondContact CB-OD1 3.37Å; S106-D157 WeakPolarHBondContact CB-OD2 3.33Å; S106-D157 PolarHBondContact N-OD1 2.8Å; S106-D157 PolarHBondContact N-OD2 3.02Å; S106-D157 PolarHBondContact OG-OD2 2.68Å
107	F	83.2	Confident	68.7	Low	32 Å²	32	64.2 Å²	64.2	14%	0.14	33%	0.334	C	S	.	.	H	α-helix	trans	-65.3	-44.4	173.8	-73.1	-75.9	0	0	0	112.6	S105 A110 Y111 H148 L155 F452 P455 V456 L459	S105-F107 PolarHBondContact O-N 3.09Å; F107-A110 PolarHBondContact O-N 3.21Å; F107-Y111 VanDerWaalsContact O-CB 3.3Å; F107-Y111 WeakPolarHBondContact O-CB 3.45Å; F107-Y111 PolarHBondContact O-N 2.85Å; F107-H148 AromaticContact CE2-CD2 3.57Å; F107-H148 AromaticContact CE2-CE1 3.72Å; F107-H148 AromaticContact CE2-NE2 3.4Å; F107-H148 WeakPolarHBondContact CE2-NE2 3.37Å; F107-H148 HydrophobicContact CZ-CB 4.21Å; F107-H148 AromaticContact CZ-CD2 3.59Å; F107-H148 AromaticContact CZ-CE1 3.75Å; F107-H148 AromaticContact CZ-CG 3.54Å; F107-H148 AromaticContact CZ-ND1 3.64Å; F107-H148 AromaticContact CZ-NE2 3.74Å; F107-L155 HydrophobicContact CD1-CD2 3.94Å; F107-L155 HydrophobicContact CE1-CD2 4.19Å; F107-L155 HydrophobicContact CG-CD2 4.35Å; F107-F452 HydrophobicContact CE2-CD1 4.24Å; F107-P455 HydrophobicContact CD1-CB 4.04Å; F107-P455 HydrophobicContact CE1-CB 3.87Å; F107-P455 HydrophobicContact CE2-CB 4.47Å; F107-P455 HydrophobicContact CG-CB 4.43Å; F107-P455 HydrophobicContact CZ-CB 4.1Å; F107-V456 HydrophobicContact CE1-CG2 3.77Å; F107-V456 HydrophobicContact CZ-CG2 3.69Å; F107-L459 HydrophobicContact CD1-CD2 3.98Å; F107-L459 HydrophobicContact CE1-CD2 4.34Å
108	G	80.7	Confident	70.2	Confident	32 Å²	32	60.3 Å²	60.3	33%	0.33	31%	0.314	S	S	.	.	H	α-helix	trans	-64	-43.5	178.8	0	0	0	0	0	111.8	S105 Y111 D112	S105-G108 PolarHBondContact O-N 3.09Å; S105-G108 VanDerWaalsContact O-N 3.1Å; G108-Y111 VanDerWaalsContact O-CB 3.3Å; G108-Y111 WeakPolarHBondContact O-CB 3.46Å; G108-Y111 PolarHBondContact O-N 3.37Å; G108-D112 PolarHBondContact O-N 3.27Å
109	M	84.3	Confident	71.7	Confident	6 Å²	6	60 Å²	60	3%	0.03	31%	0.308	C	S	.	.	H	α-helix	trans	-65.4	-42.4	175	-70.2	174.4	61.3	0	0	112.6	F104 S105 Y111 D112 F113 V124 L318	F104-M109 HydrophobicContact CB-SD 4.12Å; F104-M109 HydrophobicContact CD1-SD 4.09Å; S105-M109 WeakPolarHBondContact O-CG 3.17Å; S105-M109 PolarHBondContact O-N 3.19Å; M109-Y111 PolarHBondContact O-N 3.04Å; M109-D112 PolarHBondContact O-N 3.49Å; M109-F113 WeakPolarHBondContact O-CD2 3.44Å; M109-F113 PolarHBondContact O-N 3.36Å; M109-V124 HydrophobicContact CB-CG1 3.83Å; M109-V124 HydrophobicContact CE-CG1 4.29Å; M109-L318 HydrophobicContact CE-CD2 4.48Å; M109-L318 HydrophobicContact CE-CG 3.91Å; M109-L318 WeakPolarHBondContact CE-O 3.42Å
110	A	84.8	Confident	73.5	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-63.3	-31.2	175.7	0	0	0	0	0	111.9	S106 F107 F113 I114 V117 V124 L155 L459	S106-A110 WeakPolarHBondContact O-CB 3.26Å; S106-A110 PolarHBondContact O-N 2.81Å; F107-A110 PolarHBondContact O-N 3.21Å; A110-F113 CarbonylContact O-C 3.56Å; A110-I114 VanDerWaalsContact O-CA 3.24Å; A110-I114 WeakPolarHBondContact O-CA 3.13Å; A110-I114 PolarHBondContact O-N 2.94Å; A110-V117 HydrophobicContact CB-CG2 3.92Å; A110-V124 HydrophobicContact CB-CG1 4.5Å; A110-L155 HydrophobicContact CB-CD2 3.79Å; A110-L155 HydrophobicContact CB-CG 4.37Å; A110-L459 HydrophobicContact CB-CD1 4.21Å; A110-L459 HydrophobicContact CB-CD2 3.95Å
111	Y	80.9	Confident	75.6	Confident	119 Å²	119	46.2 Å²	46.2	47%	0.467	25%	0.253	S	S	.	.	H	α-helix	trans	-69.2	-49.4	174.5	-169.7	-88.9	0	0	0	112.3	F107 G108 M109 F113 K462	F107-Y111 VanDerWaalsContact O-CB 3.3Å; F107-Y111 WeakPolarHBondContact O-CB 3.45Å; F107-Y111 PolarHBondContact O-N 2.85Å; G108-Y111 VanDerWaalsContact O-CB 3.3Å; G108-Y111 WeakPolarHBondContact O-CB 3.46Å; G108-Y111 PolarHBondContact O-N 3.37Å; M109-Y111 PolarHBondContact O-N 3.04Å; Y111-F113 VanDerWaalsContact C-N 3.28Å; Y111-F113 PolarHBondContact O-N 3.47Å; Y111-K462 HydrophobicContact CD2-CD 4.1Å; Y111-K462 HydrophobicContact CE2-CD 3.42Å; Y111-K462 VanDerWaalsContact CE2-CD 3.42Å; Y111-K462 VanDerWaalsContact CZ-NZ 3.33Å; Y111-K462 PolarHBondContact OH-NZ 3.39Å
112	D	80.6	Confident	77.7	Confident	110 Å²	110	44.2 Å²	44.2	59%	0.588	24%	0.237	S	C	*	.	H	α-helix	trans	-65.6	-31.6	-179	-68.1	-15.5	0	0	0	112.4	G108 M109	G108-D112 PolarHBondContact O-N 3.27Å; M109-D112 PolarHBondContact O-N 3.49Å
113	F	82.2	Confident	79.3	Confident	35 Å²	35	38.9 Å²	38.9	15%	0.154	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.7	44.6	-179.4	-57.3	-79	0	0	0	112.4	K54 M109 A110 Y111 D115 S116 N307 L318	K54-F113 HydrophobicContact CB-CD1 4.32Å; K54-F113 HydrophobicContact CB-CE1 3.8Å; K54-F113 HydrophobicContact CB-CZ 4.34Å; M109-F113 WeakPolarHBondContact O-CD2 3.44Å; M109-F113 PolarHBondContact O-N 3.36Å; A110-F113 CarbonylContact O-C 3.56Å; Y111-F113 VanDerWaalsContact C-N 3.28Å; Y111-F113 PolarHBondContact O-N 3.47Å; F113-D115 PolarHBondContact O-N 2.92Å; F113-S116 PolarHBondContact O-N 3.5Å; F113-N307 HydrophobicContact CD2-CB 4.48Å; F113-N307 HydrophobicContact CE2-CB 3.59Å; F113-N307 WeakPolarHBondContact CE2-ND2 3.31Å; F113-N307 HydrophobicContact CZ-CB 3.85Å; F113-L318 HydrophobicContact CB-CD2 3.77Å; F113-L318 HydrophobicContact CD2-CD1 4.42Å; F113-L318 HydrophobicContact CD2-CD2 3.92Å; F113-L318 HydrophobicContact CG-CD2 4.09Å
114	I	81.3	Confident	80.7	Confident	32 Å²	32	35.8 Å²	35.8	16%	0.164	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-58.4	-23.8	-176.2	-157.2	160.1	0	0	0	113.8	A110 S116 V117 K462 V463 N466	A110-I114 VanDerWaalsContact O-CA 3.24Å; A110-I114 WeakPolarHBondContact O-CA 3.13Å; A110-I114 PolarHBondContact O-N 2.94Å; I114-S116 PolarHBondContact O-N 3.17Å; I114-V117 PolarHBondContact O-N 3.01Å; I114-K462 VanDerWaalsContact CD1-C 3.47Å; I114-K462 HydrophobicContact CD1-CB 3.37Å; I114-V463 HydrophobicContact CD1-CG2 4.2Å; I114-V463 HydrophobicContact CG1-CG2 3.85Å; I114-N466 HydrophobicContact CG2-CB 4.27Å
115	D	75.1	Confident	81.6	Confident	87 Å²	87	35.3 Å²	35.3	47%	0.465	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-62.5	-27.4	173.9	-77.8	-42.7	0	0	0	114.7	F113 N466 K470	F113-D115 PolarHBondContact O-N 2.92Å; D115-N466 WeakPolarHBondContact CA-ND2 3.25Å; D115-N466 PolarHBondContact OD1-ND2 3.17Å; D115-N466 PolarHBondContact OD1-OD1 3.03Å; D115-K470 WeakPolarHBondContact OD1-CE 3.38Å; D115-K470 IonicContact OD1-NZ 2.64Å; D115-K470 PolarHBondContact OD1-NZ 3.13Å
116	S	76.1	Confident	81.9	Confident	15 Å²	15	34 Å²	34	11%	0.105	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-94	-12.7	-176.7	-52.6	0	0	0	0	112.4	F113 I114 V121	F113-S116 PolarHBondContact O-N 3.5Å; I114-S116 PolarHBondContact O-N 3.17Å; S116-V121 WeakPolarHBondContact O-CB 3.43Å; S116-V121 WeakPolarHBondContact O-CG2 3.19Å; S116-V121 PolarHBondContact O-N 3.36Å
117	V	78.6	Confident	82.1	Confident	7 Å²	7	34.2 Å²	34.2	4%	0.042	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	136.6	-174.3	-178.8	0	0	0	0	110.5	A110 I114 V124 I150 T153 V463	A110-V117 HydrophobicContact CB-CG2 3.92Å; I114-V117 PolarHBondContact O-N 3.01Å; V117-V124 HydrophobicContact CG2-CG2 4.45Å; V117-I150 HydrophobicContact CG1-CG2 4.13Å; V117-T153 HydrophobicContact CG1-CG2 4.37Å; V117-V463 HydrophobicContact CB-CG2 4.33Å; V117-V463 HydrophobicContact CG1-CG2 3.98Å
118	G	65.7	Low	82.3	Confident	4 Å²	4	36.3 Å²	36.3	4%	0.041	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	102.3	-29.7	173.4	0	0	0	0	0	114.9	R152 T153	G118-R152 WeakPolarHBondContact O-CB 3.12Å; G118-T153 PolarHBondContact N-OG1 2.78Å
119	N	66.8	Low	82.8	Confident	57 Å²	57	35 Å²	35	31%	0.305	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-129	-45.1	-178.6	-85.9	-11.2	0	0	0	114.5	H477	N119-H477 PolarHBondContact ND2-NE2 2.94Å
120	D	74.9	Confident	83.1	Confident	114 Å²	114	35 Å²	35	61%	0.61	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-21.5	-166.1	-61.6	-23.1	0	0	0	114.2
121	V	87.1	Confident	83.3	Confident	3 Å²	3	35.1 Å²	35.1	2%	0.018	18%	0.178	C	C	.	.			trans	-118.2	133	-176	177.5	0	0	0	0	110.8	S116 V123 V124 T153 L309 L318	S116-V121 WeakPolarHBondContact O-CB 3.43Å; S116-V121 WeakPolarHBondContact O-CG2 3.19Å; S116-V121 PolarHBondContact O-N 3.36Å; V121-V123 WeakPolarHBondContact CG1-O 3.29Å; V121-V124 HydrophobicContact CG1-CG2 4.18Å; V121-T153 HydrophobicContact CG1-CG2 4.44Å; V121-T153 WeakPolarHBondContact O-CB 3.5Å; V121-T153 WeakPolarHBondContact O-CG2 3.26Å; V121-T153 PolarHBondContact O-OG1 3.08Å; V121-L309 HydrophobicContact CG2-CD1 3.7Å; V121-L318 HydrophobicContact CG1-CB 4Å
122	D	87.9	Confident	83.7	Confident	30 Å²	30	32.6 Å²	32.6	16%	0.16	17%	0.169	C	C	.	.	S	Bend	trans	-81	-40.1	177.2	-61.9	-63.6	0	0	0	112.5	L154 I315 H316 L407 K411	D122-L154 PolarHBondContact O-N 3.25Å; D122-I315 HydrophobicContact CB-CG2 4.42Å; D122-H316 WeakPolarHBondContact CA-O 3.24Å; D122-H316 WeakPolarHBondContact CB-O 3.44Å; D122-H316 PolarHBondContact N-O 2.68Å; D122-H316 PolarHBondContact OD2-N 2.94Å; D122-L407 HydrophobicContact CB-CD2 4.32Å; D122-K411 IonicContact OD1-NZ 2.8Å; D122-K411 PolarHBondContact OD1-NZ 3.2Å
123	V	91.4	Very high	84.1	Confident	4 Å²	4	27.8 Å²	27.8	2%	0.024	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	136	-171.8	-177.5	0	0	0	0	112	V121 I130 L154 L156 H316 M317 L318 L407	V121-V123 WeakPolarHBondContact CG1-O 3.29Å; V123-I130 HydrophobicContact CG1-CD1 3.95Å; V123-L154 CarbonylContact C-O 3.23Å; V123-L154 VanDerWaalsContact CA-O 3.28Å; V123-L154 WeakPolarHBondContact CA-O 3.41Å; V123-L156 HydrophobicContact CG1-CD1 3.44Å; V123-L156 VanDerWaalsContact CG1-CD1 3.44Å; V123-L156 HydrophobicContact CG1-CG 4Å; V123-H316 PolarHBondContact N-O 2.83Å; V123-M317 HydrophobicContact CB-CG 4.18Å; V123-M317 CarbonylContact O-C 3.13Å; V123-M317 VanDerWaalsContact O-CA 3.29Å; V123-M317 WeakPolarHBondContact O-CA 3.31Å; V123-L318 PolarHBondContact O-N 2.77Å; V123-L407 HydrophobicContact CG2-CD1 3.48Å; V123-L407 VanDerWaalsContact CG2-CD1 3.48Å
124	V	92.1	Very high	84.5	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	122	170.7	-175.3	0	0	0	0	109.3	M109 A110 V117 V121 T153 L154 L155 L156 L318	M109-V124 HydrophobicContact CB-CG1 3.83Å; M109-V124 HydrophobicContact CE-CG1 4.29Å; A110-V124 HydrophobicContact CB-CG1 4.5Å; V117-V124 HydrophobicContact CG2-CG2 4.45Å; V121-V124 HydrophobicContact CG1-CG2 4.18Å; V124-T153 HydrophobicContact CG2-CG2 3.7Å; V124-L154 PolarHBondContact N-O 3.2Å; V124-L155 HydrophobicContact CB-CG 4.28Å; V124-L155 WeakPolarHBondContact O-CA 3.27Å; V124-L156 PolarHBondContact O-N 3.11Å; V124-L318 WeakPolarHBondContact CA-O 3.43Å; V124-L318 HydrophobicContact CG1-CB 4.42Å; V124-L318 HydrophobicContact CG1-CD2 4.11Å; V124-L318 HydrophobicContact CG1-CG 4.44Å; V124-L318 HydrophobicContact CG2-CB 4.18Å; V124-L318 HydrophobicContact CG2-CD2 4.35Å
125	S	92.7	Very high	84.9	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	167.5	-178.9	-157.6	0	0	0	0	114.2	N129 L156 L318 V319 G320	S125-N129 VanDerWaalsContact OG-CB 3.27Å; S125-N129 WeakPolarHBondContact OG-CB 3.38Å; S125-N129 PolarHBondContact OG-ND2 2.73Å; S125-L156 WeakPolarHBondContact CB-O 3.2Å; S125-L156 WeakPolarHBondContact OG-CB 3.26Å; S125-L156 PolarHBondContact OG-O 3.36Å; S125-L318 PolarHBondContact N-O 3.25Å; S125-L318 VanDerWaalsContact N-O 3.09Å; S125-V319 VanDerWaalsContact O-CA 3.3Å; S125-V319 WeakPolarHBondContact O-CA 3.03Å; S125-G320 PolarHBondContact O-N 3.36Å; S125-G320 VanDerWaalsContact O-N 3.08Å
126	D	89.8	Confident	85.5	Confident	28 Å²	28	22.6 Å²	22.6	15%	0.15	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	141	162.9	-174.8	3.5	0	0	0	110.8	F104 E128 N129 I130 G320	F104-D126 HydrophobicContact CB-CB 4.02Å; D126-E128 PolarHBondContact O-N 3.44Å; D126-E128 PolarHBondContact OD1-N 3.13Å; D126-N129 WeakPolarHBondContact O-CB 3.43Å; D126-N129 PolarHBondContact O-N 2.86Å; D126-I130 PolarHBondContact O-N 3.31Å; D126-G320 VanDerWaalsContact OD1-O 3.13Å
127	S	88.5	Confident	85.9	Confident	4 Å²	4	23.8 Å²	23.8	3%	0.028	12%	0.124	C	C	.	.	H	α-helix	trans	-49.3	-39.3	173.5	57.5	0	0	0	0	113.1	N129 I130 K131 V319 G320	S127-N129 VanDerWaalsContact C-N 3.3Å; S127-N129 PolarHBondContact O-N 3.47Å; S127-I130 PolarHBondContact O-N 2.94Å; S127-K131 WeakPolarHBondContact O-CG 3.36Å; S127-K131 PolarHBondContact O-N 3.36Å; S127-V319 VanDerWaalsContact CA-CG1 3.42Å; S127-G320 WeakPolarHBondContact CB-O 3.19Å; S127-G320 PolarHBondContact N-O 2.82Å; S127-G320 PolarHBondContact OG-O 3.13Å
128	E	88	Confident	86.1	Confident	76 Å²	76	26.9 Å²	26.9	36%	0.355	14%	0.135	S	C	.	.	H	α-helix	trans	-64.2	-34.2	178.6	-70.5	-59.6	151	0	0	112.9	D126 K131 K132	D126-E128 PolarHBondContact O-N 3.44Å; D126-E128 PolarHBondContact OD1-N 3.13Å; E128-K131 VanDerWaalsContact CD-CE 3.43Å; E128-K131 VanDerWaalsContact OE1-CE 3.28Å; E128-K131 WeakPolarHBondContact OE1-CE 3.28Å; E128-K131 IonicContact OE1-NZ 3.88Å; E128-K131 PolarHBondContact OE1-NZ 2.99Å; E128-K131 WeakPolarHBondContact OE2-CE 3.34Å; E128-K131 IonicContact OE2-NZ 3.16Å; E128-K131 PolarHBondContact OE2-NZ 2.87Å; E128-K132 WeakPolarHBondContact O-CB 3.39Å; E128-K132 VanDerWaalsContact O-CG 3.24Å; E128-K132 WeakPolarHBondContact O-CG 3.49Å; E128-K132 PolarHBondContact O-N 2.74Å
129	N	89.5	Confident	87	Confident	4 Å²	4	27.9 Å²	27.9	2%	0.021	14%	0.141	C	C	.	.	H	α-helix	trans	-71.6	-43.4	178.2	-69.5	-18.9	0	0	0	111.2	S125 D126 S127 K131 K132 L133 M145 E158	S125-N129 VanDerWaalsContact OG-CB 3.27Å; S125-N129 WeakPolarHBondContact OG-CB 3.38Å; S125-N129 PolarHBondContact OG-ND2 2.73Å; D126-N129 WeakPolarHBondContact O-CB 3.43Å; D126-N129 PolarHBondContact O-N 2.86Å; S127-N129 VanDerWaalsContact C-N 3.3Å; S127-N129 PolarHBondContact O-N 3.47Å; N129-K131 PolarHBondContact O-N 2.97Å; N129-K132 WeakPolarHBondContact O-CB 3.27Å; N129-K132 PolarHBondContact O-N 2.93Å; N129-L133 WeakPolarHBondContact O-CG 3.15Å; N129-L133 PolarHBondContact O-N 2.84Å; N129-M145 HydrophobicContact CB-CE 3.7Å; N129-E158 PolarHBondContact ND2-N 2.76Å
130	I	90.4	Very high	87.7	Confident	7 Å²	7	33.3 Å²	33.3	4%	0.036	16%	0.162	C	C	.	.	H	α-helix	trans	-60.7	-46.3	174.5	-57.7	-58.6	0	0	0	110.5	V123 D126 S127 K132 L133 L134 L156 W310 M317 V319	V123-I130 HydrophobicContact CG1-CD1 3.95Å; D126-I130 PolarHBondContact O-N 3.31Å; S127-I130 PolarHBondContact O-N 2.94Å; I130-K132 VanDerWaalsContact C-N 3.34Å; I130-K132 PolarHBondContact O-N 3.09Å; I130-L133 PolarHBondContact O-N 3.48Å; I130-L134 HydrophobicContact CG2-CD1 4.09Å; I130-L134 HydrophobicContact CG2-CG 4.43Å; I130-L134 WeakPolarHBondContact O-CG 3.34Å; I130-L134 PolarHBondContact O-N 3.32Å; I130-L156 HydrophobicContact CD1-CD1 4.11Å; I130-W310 HydrophobicContact CG2-CZ3 4.01Å; I130-M317 HydrophobicContact CD1-SD 4.25Å; I130-M317 HydrophobicContact CG2-SD 4.17Å; I130-V319 HydrophobicContact CG1-CG2 4.42Å
131	K	90.2	Very high	88	Confident	1 Å²	1	30.4 Å²	30.4	0%	0.004	15%	0.151	C	C	.	.	H	α-helix	trans	-60	-41.9	174.9	-70.4	-171.9	-57.2	174.9	0	112	S127 E128 N129 L133 L134 K135 D352 L355 D356	S127-K131 WeakPolarHBondContact O-CG 3.36Å; S127-K131 PolarHBondContact O-N 3.36Å; E128-K131 VanDerWaalsContact CD-CE 3.43Å; E128-K131 VanDerWaalsContact OE1-CE 3.28Å; E128-K131 WeakPolarHBondContact OE1-CE 3.28Å; E128-K131 IonicContact OE1-NZ 3.88Å; E128-K131 PolarHBondContact OE1-NZ 2.99Å; E128-K131 WeakPolarHBondContact OE2-CE 3.34Å; E128-K131 IonicContact OE2-NZ 3.16Å; E128-K131 PolarHBondContact OE2-NZ 2.87Å; N129-K131 PolarHBondContact O-N 2.97Å; K131-L133 VanDerWaalsContact C-N 3.34Å; K131-L133 PolarHBondContact O-N 2.85Å; K131-L134 PolarHBondContact O-N 3.21Å; K131-K135 VanDerWaalsContact O-CB 3.28Å; K131-K135 WeakPolarHBondContact O-CB 3.15Å; K131-K135 WeakPolarHBondContact O-CE 3.06Å; K131-K135 VanDerWaalsContact O-CG 3.23Å; K131-K135 WeakPolarHBondContact O-CG 3.34Å; K131-K135 PolarHBondContact O-N 2.71Å; K131-D352 WeakPolarHBondContact CD-OD1 3.12Å; K131-D352 WeakPolarHBondContact CE-OD1 3.48Å; K131-D352 IonicContact NZ-OD1 3.68Å; K131-D352 PolarHBondContact NZ-OD1 3.4Å; K131-D352 IonicContact NZ-OD2 3.73Å; K131-L355 HydrophobicContact CB-CD1 4.39Å; K131-L355 HydrophobicContact CD-CB 4.16Å; K131-L355 HydrophobicContact CG-CB 3.98Å; K131-L355 HydrophobicContact CG-CD1 3.93Å; K131-D356 VanDerWaalsContact CD-OD1 3.28Å; K131-D356 WeakPolarHBondContact CD-OD1 3.28Å; K131-D356 VanDerWaalsContact CE-OD1 3.24Å; K131-D356 WeakPolarHBondContact CE-OD1 3.42Å; K131-D356 IonicContact NZ-OD1 3.23Å; K131-D356 PolarHBondContact NZ-OD1 3.36Å; K131-D356 IonicContact NZ-OD2 3.96Å; K131-D356 PolarHBondContact NZ-OD2 3.23Å
132	K	89.1	Confident	87.9	Confident	66 Å²	66	34.2 Å²	34.2	29%	0.287	17%	0.169	S	C	.	.	H	α-helix	trans	-60	-43.1	176	-78.9	171	-169.1	168.4	0	111.6	E128 N129 I130 K135 I136 E158	E128-K132 WeakPolarHBondContact O-CB 3.39Å; E128-K132 VanDerWaalsContact O-CG 3.24Å; E128-K132 WeakPolarHBondContact O-CG 3.49Å; E128-K132 PolarHBondContact O-N 2.74Å; N129-K132 WeakPolarHBondContact O-CB 3.27Å; N129-K132 PolarHBondContact O-N 2.93Å; I130-K132 VanDerWaalsContact C-N 3.34Å; I130-K132 PolarHBondContact O-N 3.09Å; K132-K135 PolarHBondContact O-N 3.1Å; K132-I136 WeakPolarHBondContact O-CG1 3.48Å; K132-I136 PolarHBondContact O-N 2.84Å; K132-E158 IonicContact NZ-OE1 3.05Å; K132-E158 PolarHBondContact NZ-OE1 3.44Å; K132-E158 IonicContact NZ-OE2 2.76Å; K132-E158 PolarHBondContact NZ-OE2 2.84Å
133	L	89.5	Confident	87.9	Confident	9 Å²	9	33.2 Å²	33.2	5%	0.047	16%	0.163	C	C	.	.	H	α-helix	trans	-63.1	-48	176.9	-72.1	178.6	0	0	0	112.4	N129 I130 K131 K135 I136 M145 L156 I406 L423	N129-L133 WeakPolarHBondContact O-CG 3.15Å; N129-L133 PolarHBondContact O-N 2.84Å; I130-L133 PolarHBondContact O-N 3.48Å; K131-L133 VanDerWaalsContact C-N 3.34Å; K131-L133 PolarHBondContact O-N 2.85Å; L133-K135 PolarHBondContact O-N 2.94Å; L133-I136 HydrophobicContact CD2-CD1 3.8Å; L133-I136 WeakPolarHBondContact O-CB 3.3Å; L133-I136 WeakPolarHBondContact O-CG1 3.44Å; L133-I136 PolarHBondContact O-N 2.86Å; L133-M145 HydrophobicContact CD1-CE 3.77Å; L133-M145 HydrophobicContact CD1-SD 4.17Å; L133-M145 HydrophobicContact CD2-CE 4.15Å; L133-M145 HydrophobicContact CD2-SD 3.47Å; L133-M145 WeakPolarHBondContact CD2-SD 3.15Å; L133-M145 HydrophobicContact CG-CE 3.86Å; L133-M145 HydrophobicContact CG-SD 3.6Å; L133-M145 VanDerWaalsContact CG-SD 3.6Å; L133-L156 HydrophobicContact CD1-CD1 3.69Å; L133-I406 HydrophobicContact CB-CD1 4.33Å; L133-I406 VanDerWaalsContact O-CD1 3.24Å; L133-I406 WeakPolarHBondContact O-CD1 3.07Å; L133-L423 HydrophobicContact CD2-CD2 3.59Å
134	L	90	Very high	87.7	Confident	6 Å²	6	33.7 Å²	33.7	3%	0.031	17%	0.167	C	C	.	.	H	α-helix	trans	-68.7	-24.1	-179.3	-61.7	-178.8	0	0	0	112.8	I130 K131 L355 I399 I402 A403	I130-L134 HydrophobicContact CG2-CD1 4.09Å; I130-L134 HydrophobicContact CG2-CG 4.43Å; I130-L134 WeakPolarHBondContact O-CG 3.34Å; I130-L134 PolarHBondContact O-N 3.32Å; K131-L134 PolarHBondContact O-N 3.21Å; L134-L355 HydrophobicContact CB-CD1 4.13Å; L134-L355 HydrophobicContact CD1-CD1 3.92Å; L134-L355 HydrophobicContact CD1-CD2 3.8Å; L134-I399 HydrophobicContact CB-CG2 4.27Å; L134-I399 HydrophobicContact CD1-CG2 4.22Å; L134-I402 HydrophobicContact CD2-CG2 4.35Å; L134-A403 HydrophobicContact CD2-CB 3.45Å; L134-A403 VanDerWaalsContact CD2-CB 3.45Å
135	K	89.4	Confident	87.6	Confident	33 Å²	33	33.8 Å²	33.8	14%	0.143	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-2.1	176.7	-70.6	-178.9	-63.7	-168.1	0	114	K131 K132 L133 P137 Y138 S139 L348 I351 D352	K131-K135 VanDerWaalsContact O-CB 3.28Å; K131-K135 WeakPolarHBondContact O-CB 3.15Å; K131-K135 WeakPolarHBondContact O-CE 3.06Å; K131-K135 VanDerWaalsContact O-CG 3.23Å; K131-K135 WeakPolarHBondContact O-CG 3.34Å; K131-K135 PolarHBondContact O-N 2.71Å; K132-K135 PolarHBondContact O-N 3.1Å; L133-K135 PolarHBondContact O-N 2.94Å; K135-P137 VanDerWaalsContact C-N 3.33Å; K135-Y138 PolarHBondContact O-N 2.85Å; K135-S139 WeakPolarHBondContact O-CB 3.36Å; K135-S139 PolarHBondContact O-N 3.06Å; K135-L348 HydrophobicContact CB-CD2 4.19Å; K135-L348 HydrophobicContact CD-CD2 4.25Å; K135-L348 HydrophobicContact CG-CD2 4.29Å; K135-I351 HydrophobicContact CD-CG2 4.31Å; K135-I351 HydrophobicContact CG-CG2 3.84Å; K135-D352 IonicContact NZ-OD1 3.8Å; K135-D352 PolarHBondContact NZ-OD1 3.16Å
136	I	87.3	Confident	87.5	Confident	6 Å²	6	33.8 Å²	33.8	3%	0.031	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-50.6	-45.9	-177.4	-67.4	177.2	0	0	0	112.4	K132 L133 Y138 S139 V143 I406 K425 V432 V570 L573	K132-I136 WeakPolarHBondContact O-CG1 3.48Å; K132-I136 PolarHBondContact O-N 2.84Å; L133-I136 HydrophobicContact CD2-CD1 3.8Å; L133-I136 WeakPolarHBondContact O-CB 3.3Å; L133-I136 WeakPolarHBondContact O-CG1 3.44Å; L133-I136 PolarHBondContact O-N 2.86Å; I136-Y138 VanDerWaalsContact C-N 3.27Å; I136-Y138 PolarHBondContact O-N 2.89Å; I136-S139 PolarHBondContact O-N 3.32Å; I136-V143 HydrophobicContact CD1-CG1 4.43Å; I136-V143 HydrophobicContact CD1-CG2 4.48Å; I136-V143 HydrophobicContact CG1-CG2 4.07Å; I136-I406 HydrophobicContact CD1-CD1 4.32Å; I136-K425 HydrophobicContact CG2-CD 3.68Å; I136-V432 HydrophobicContact CG2-CG2 4.18Å; I136-V570 HydrophobicContact CB-CG1 4.4Å; I136-V570 HydrophobicContact CG2-CG1 3.56Å; I136-V570 HydrophobicContact CG2-CG2 4.34Å; I136-L573 HydrophobicContact CG2-CD1 4.43Å
137	P	84.3	Confident	87.6	Confident	40 Å²	40	32.5 Å²	32.5	26%	0.26	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	-68.5	-22.6	-179.5	-21.7	37	0	0	0	115.3	K135 I402 V570 L573	K135-P137 VanDerWaalsContact C-N 3.33Å; P137-I402 HydrophobicContact CB-CD1 4.23Å; P137-I402 HydrophobicContact CG-CD1 3.59Å; P137-I402 HydrophobicContact CG-CG1 3.88Å; P137-I402 HydrophobicContact CG-CG2 4.2Å; P137-V570 HydrophobicContact CB-CG1 3.79Å; P137-V570 HydrophobicContact CG-CG1 3.72Å; P137-L573 HydrophobicContact CG-CB 4.25Å; P137-L573 HydrophobicContact CG-CD1 4.44Å
138	Y	84.2	Confident	87.6	Confident	72 Å²	72	32.3 Å²	32.3	28%	0.282	16%	0.159	S	C	.	.	G	3₁₀ helix	trans	-98.4	-13	-178.1	-57.5	-81.7	0	0	0	112.2	K135 I136 V347 L348 I351 V398 I399 I402	K135-Y138 PolarHBondContact O-N 2.85Å; I136-Y138 VanDerWaalsContact C-N 3.27Å; I136-Y138 PolarHBondContact O-N 2.89Å; Y138-V347 HydrophobicContact CD1-CG1 3.96Å; Y138-V347 HydrophobicContact CE1-CG1 4.26Å; Y138-L348 VanDerWaalsContact CB-CD2 3.47Å; Y138-I351 HydrophobicContact CD1-CD1 4.35Å; Y138-I351 HydrophobicContact CD2-CD1 3.71Å; Y138-I351 HydrophobicContact CE2-CD1 3.91Å; Y138-I351 HydrophobicContact CG-CD1 3.94Å; Y138-V398 WeakPolarHBondContact OH-CG1 3.4Å; Y138-I399 HydrophobicContact CD2-CD1 4.32Å; Y138-I399 HydrophobicContact CE2-CD1 3.47Å; Y138-I399 VanDerWaalsContact CE2-CD1 3.47Å; Y138-I402 HydrophobicContact CE2-CD1 3.72Å
139	S	84.4	Confident	87.6	Confident	25 Å²	25	30.4 Å²	30.4	18%	0.175	15%	0.149	C	C	.	.			trans	-112.9	127.3	-172.9	-170.9	0	0	0	0	113.1	K135 I136 S141 K425	K135-S139 WeakPolarHBondContact O-CB 3.36Å; K135-S139 PolarHBondContact O-N 3.06Å; I136-S139 PolarHBondContact O-N 3.32Å; S139-S141 PolarHBondContact O-N 2.85Å; S139-S141 VanDerWaalsContact OG-CB 3.28Å; S139-S141 WeakPolarHBondContact OG-CB 3.49Å; S139-S141 PolarHBondContact OG-N 2.86Å; S139-S141 VanDerWaalsContact OG-N 3.1Å; S139-S141 PolarHBondContact OG-OG 3.26Å; S139-K425 PolarHBondContact O-NZ 3.27Å; S139-K425 VanDerWaalsContact O-NZ 3.14Å
140	K	81.1	Confident	87.4	Confident	171 Å²	171	30.2 Å²	30.2	74%	0.743	15%	0.148	S	C	*	.			trans	-79.4	1.1	168	-61.8	-169.6	178.7	-171.5	0	113.1	S427 G428	K140-S427 PolarHBondContact O-OG 3.21Å; K140-G428 PolarHBondContact O-N 3.1Å
141	S	81.8	Confident	86.8	Confident	53 Å²	53	30 Å²	30	37%	0.371	15%	0.147	S	C	.	.	S	Bend	trans	-65.3	153.5	177.3	66.1	0	0	0	0	111.6	S139	S139-S141 PolarHBondContact O-N 2.85Å; S139-S141 VanDerWaalsContact OG-CB 3.28Å; S139-S141 WeakPolarHBondContact OG-CB 3.49Å; S139-S141 PolarHBondContact OG-N 2.86Å; S139-S141 VanDerWaalsContact OG-N 3.1Å; S139-S141 PolarHBondContact OG-OG 3.26Å
142	H	84.1	Confident	86.3	Confident	84 Å²	84	35.6 Å²	35.6	39%	0.389	17%	0.168	S	C	.	.			trans	-63.5	152.6	164	75.8	-54.9	0	0	0	111.1	K425	H142-K425 CarbonylContact C-O 3.14Å; H142-K425 WeakPolarHBondContact CA-O 3.48Å; H142-K425 WeakPolarHBondContact CB-O 3.31Å
143	V	87.2	Confident	86.2	Confident	9 Å²	9	32.4 Å²	32.4	6%	0.055	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	132.7	171.1	179.1	0	0	0	0	108	I136 M145 F424 K425	I136-V143 HydrophobicContact CD1-CG1 4.43Å; I136-V143 HydrophobicContact CD1-CG2 4.48Å; I136-V143 HydrophobicContact CG1-CG2 4.07Å; V143-M145 HydrophobicContact CG1-CG 4.12Å; V143-M145 HydrophobicContact CG1-SD 4.14Å; V143-F424 CarbonylContact O-C 3.51Å; V143-F424 WeakPolarHBondContact O-CA 3.35Å; V143-F424 WeakPolarHBondContact O-CD2 3.42Å; V143-K425 HydrophobicContact CB-CB 4.03Å; V143-K425 HydrophobicContact CG2-CB 4.49Å; V143-K425 PolarHBondContact N-O 3.3Å; V143-K425 PolarHBondContact O-N 3.21Å
144	S	88.4	Confident	86.3	Confident	13 Å²	13	32 Å²	32	9%	0.091	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	108.6	177.8	179.9	0	0	0	0	108.3	L159 I161 W422 L423	S144-L159 WeakPolarHBondContact CB-O 3.24Å; S144-L159 PolarHBondContact O-N 2.77Å; S144-L159 VanDerWaalsContact O-N 3.09Å; S144-L159 PolarHBondContact OG-O 3.07Å; S144-I161 WeakPolarHBondContact OG-CD1 3.31Å; S144-W422 PolarHBondContact OG-NE1 3.22Å; S144-L423 WeakPolarHBondContact CA-O 3.21Å
145	M	89.9	Confident	86.4	Confident	2 Å²	2	31.7 Å²	31.7	1%	0.01	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	137.9	-176.1	-67.7	-179.5	59.9	0	0	111.2	N129 L133 V143 L156 D157 W422 L423	N129-M145 HydrophobicContact CB-CE 3.7Å; L133-M145 HydrophobicContact CD1-CE 3.77Å; L133-M145 HydrophobicContact CD1-SD 4.17Å; L133-M145 HydrophobicContact CD2-CE 4.15Å; L133-M145 HydrophobicContact CD2-SD 3.47Å; L133-M145 WeakPolarHBondContact CD2-SD 3.15Å; L133-M145 HydrophobicContact CG-CE 3.86Å; L133-M145 HydrophobicContact CG-SD 3.6Å; L133-M145 VanDerWaalsContact CG-SD 3.6Å; V143-M145 HydrophobicContact CG1-CG 4.12Å; V143-M145 HydrophobicContact CG1-SD 4.14Å; M145-L156 HydrophobicContact CE-CB 3.84Å; M145-L156 HydrophobicContact CE-CD1 4.4Å; M145-D157 CarbonylContact C-O 3.51Å; M145-D157 VanDerWaalsContact CA-O 3.28Å; M145-D157 WeakPolarHBondContact CA-O 3.3Å; M145-W422 WeakPolarHBondContact O-CA 3.45Å; M145-L423 HydrophobicContact CB-CB 4.49Å; M145-L423 PolarHBondContact N-O 3.02Å; M145-L423 PolarHBondContact O-N 2.87Å
146	A	89.7	Confident	86.5	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.008	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	136.8	167.6	0	0	0	0	0	109.2	L156 D157 L159 T420 Y421	A146-L156 WeakPolarHBondContact O-CA 3.35Å; A146-D157 PolarHBondContact N-O 2.76Å; A146-D157 PolarHBondContact O-N 3.46Å; A146-L159 HydrophobicContact CB-CB 4.33Å; A146-L159 HydrophobicContact CB-CD1 4.3Å; A146-T420 HydrophobicContact CB-CG2 4.36Å; A146-Y421 CarbonylContact C-O 3.54Å; A146-Y421 WeakPolarHBondContact CA-O 3.4Å
147	V	91.5	Very high	86.6	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	110.1	179.5	-175.8	0	0	0	0	107.8	L154 L155 L156 L410 Y421 L423	V147-L154 HydrophobicContact CG1-CB 4.48Å; V147-L154 HydrophobicContact CG1-CD2 4.05Å; V147-L155 CarbonylContact C-O 3.51Å; V147-L155 WeakPolarHBondContact CA-O 3.43Å; V147-L156 HydrophobicContact CB-CD2 3.92Å; V147-L156 HydrophobicContact CG1-CD2 3.66Å; V147-L156 HydrophobicContact CG2-CD2 3.5Å; V147-L156 VanDerWaalsContact CG2-CD2 3.5Å; V147-L410 HydrophobicContact CG2-CD2 4.25Å; V147-Y421 PolarHBondContact N-O 2.86Å; V147-Y421 PolarHBondContact O-N 2.96Å; V147-L423 HydrophobicContact CG2-CB 4.31Å
148	H	90.2	Very high	86.7	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	132.1	179	-42.4	-84.9	0	0	0	110.2	F107 L155 T420 F452 V456	F107-H148 AromaticContact CE2-CD2 3.57Å; F107-H148 AromaticContact CE2-CE1 3.72Å; F107-H148 AromaticContact CE2-NE2 3.4Å; F107-H148 WeakPolarHBondContact CE2-NE2 3.37Å; F107-H148 HydrophobicContact CZ-CB 4.21Å; F107-H148 AromaticContact CZ-CD2 3.59Å; F107-H148 AromaticContact CZ-CE1 3.75Å; F107-H148 AromaticContact CZ-CG 3.54Å; F107-H148 AromaticContact CZ-ND1 3.64Å; F107-H148 AromaticContact CZ-NE2 3.74Å; H148-L155 HydrophobicContact CB-CB 4.1Å; H148-L155 PolarHBondContact N-O 2.89Å; H148-L155 PolarHBondContact O-N 2.86Å; H148-T420 WeakPolarHBondContact CE1-CG2 3.46Å; H148-T420 VanDerWaalsContact ND1-CG2 3.3Å; H148-T420 WeakPolarHBondContact ND1-CG2 3.38Å; H148-T420 PolarHBondContact ND1-OG1 3.26Å; H148-F452 AromaticContact CE1-CD1 3.46Å; H148-F452 VanDerWaalsContact CE1-CD1 3.46Å; H148-F452 WeakPolarHBondContact CE1-CD1 3.3Å; H148-F452 AromaticContact CE1-CE1 3.9Å; H148-F452 AromaticContact CE1-CG 3.58Å; H148-V456 HydrophobicContact CB-CG2 4.2Å
149	R	87.9	Confident	86.6	Confident	36 Å²	36	30.2 Å²	30.2	14%	0.136	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	113.7	-179.6	-175.6	65.8	179.6	170.1	0.9	111.3	G151 R152 L154 C414 E417 G418 H419 Y421	R149-G151 PolarHBondContact NE-O 3.42Å; R149-G151 PolarHBondContact NH2-O 3.41Å; R149-G151 VanDerWaalsContact NH2-O 3.17Å; R149-R152 VanDerWaalsContact NH1-C 3.34Å; R149-R152 PolarHBondContact NH1-O 3.17Å; R149-L154 HydrophobicContact CB-CD2 4.49Å; R149-L154 VanDerWaalsContact CD-CD2 3.45Å; R149-C414 WeakPolarHBondContact CD-O 3.36Å; R149-E417 HydrophobicContact CG-CG 4.47Å; R149-G418 PolarHBondContact O-N 3.49Å; R149-H419 PolarHBondContact N-O 3.16Å; R149-H419 VanDerWaalsContact N-O 3.14Å; R149-Y421 HydrophobicContact CB-CE2 4.47Å
150	I	85.3	Confident	86.2	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	100.3	179.5	-55.2	-67	0	0	0	109.2	V117 R152 T153 L155 V456 L459 L460 V463	V117-I150 HydrophobicContact CG1-CG2 4.13Å; I150-R152 PolarHBondContact O-N 2.95Å; I150-T153 PolarHBondContact N-O 2.83Å; I150-T153 PolarHBondContact O-N 2.88Å; I150-L155 HydrophobicContact CB-CD1 4.01Å; I150-L155 HydrophobicContact CG1-CD1 3.67Å; I150-L155 HydrophobicContact CG1-CD2 4.5Å; I150-V456 HydrophobicContact CD1-CB 4.48Å; I150-V456 HydrophobicContact CD1-CG1 3.76Å; I150-L459 HydrophobicContact CD1-CB 4.45Å; I150-L459 HydrophobicContact CD1-CD2 4.11Å; I150-L459 HydrophobicContact CD1-CG 4.45Å; I150-L459 HydrophobicContact CG1-CD2 3.86Å; I150-L459 HydrophobicContact CG2-CD2 4.39Å; I150-L459 HydrophobicContact CG2-CG 4.34Å; I150-L460 HydrophobicContact CD1-CD2 3.97Å; I150-L460 HydrophobicContact CD1-CG 4.01Å; I150-L460 HydrophobicContact CG2-CD2 4.15Å; I150-V463 HydrophobicContact CG2-CG2 4.26Å
151	G	77.5	Confident	85.7	Confident	3 Å²	3	24.4 Å²	24.4	3%	0.031	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	-120.9	-171.8	0	0	0	0	0	111	R149	R149-G151 PolarHBondContact NE-O 3.42Å; R149-G151 PolarHBondContact NH2-O 3.41Å; R149-G151 VanDerWaalsContact NH2-O 3.17Å
152	R	78.8	Confident	84.8	Confident	118 Å²	118	25.2 Å²	25.2	45%	0.445	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-15.7	175	-66.5	-176.5	176	156.5	5.6	115.1	G118 R149 I150	G118-R152 WeakPolarHBondContact O-CB 3.12Å; R149-R152 VanDerWaalsContact NH1-C 3.34Å; R149-R152 PolarHBondContact NH1-O 3.17Å; I150-R152 PolarHBondContact O-N 2.95Å
153	T	88.6	Confident	84	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	140.6	-172.2	-51.8	0	0	0	0	111.3	V117 G118 V121 V124 I150 L155	V117-T153 HydrophobicContact CG1-CG2 4.37Å; G118-T153 PolarHBondContact N-OG1 2.78Å; V121-T153 HydrophobicContact CG1-CG2 4.44Å; V121-T153 WeakPolarHBondContact O-CB 3.5Å; V121-T153 WeakPolarHBondContact O-CG2 3.26Å; V121-T153 PolarHBondContact O-OG1 3.08Å; V124-T153 HydrophobicContact CG2-CG2 3.7Å; I150-T153 PolarHBondContact N-O 2.83Å; I150-T153 PolarHBondContact O-N 2.88Å; T153-L155 HydrophobicContact CG2-CD1 4.25Å
154	L	91.2	Very high	83	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	124.8	173.4	-63.8	174.5	0	0	0	110.1	D122 V123 V124 V147 R149 L407 L410 K411 C414	D122-L154 PolarHBondContact O-N 3.25Å; V123-L154 CarbonylContact C-O 3.23Å; V123-L154 VanDerWaalsContact CA-O 3.28Å; V123-L154 WeakPolarHBondContact CA-O 3.41Å; V124-L154 PolarHBondContact N-O 3.2Å; V147-L154 HydrophobicContact CG1-CB 4.48Å; V147-L154 HydrophobicContact CG1-CD2 4.05Å; R149-L154 HydrophobicContact CB-CD2 4.49Å; R149-L154 VanDerWaalsContact CD-CD2 3.45Å; L154-L407 HydrophobicContact CD1-CD1 3.99Å; L154-L410 HydrophobicContact CD1-CB 3.8Å; L154-K411 HydrophobicContact CD1-CG 4.03Å; L154-C414 HydrophobicContact CD2-CB 4.24Å
155	L	91.4	Very high	81.9	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	126.1	173.9	-78.4	71.5	0	0	0	108.5	F107 A110 V124 V147 H148 I150 T153 L459	F107-L155 HydrophobicContact CD1-CD2 3.94Å; F107-L155 HydrophobicContact CE1-CD2 4.19Å; F107-L155 HydrophobicContact CG-CD2 4.35Å; A110-L155 HydrophobicContact CB-CD2 3.79Å; A110-L155 HydrophobicContact CB-CG 4.37Å; V124-L155 HydrophobicContact CB-CG 4.28Å; V124-L155 WeakPolarHBondContact O-CA 3.27Å; V147-L155 CarbonylContact C-O 3.51Å; V147-L155 WeakPolarHBondContact CA-O 3.43Å; H148-L155 HydrophobicContact CB-CB 4.1Å; H148-L155 PolarHBondContact N-O 2.89Å; H148-L155 PolarHBondContact O-N 2.86Å; I150-L155 HydrophobicContact CB-CD1 4.01Å; I150-L155 HydrophobicContact CG1-CD1 3.67Å; I150-L155 HydrophobicContact CG1-CD2 4.5Å; T153-L155 HydrophobicContact CG2-CD1 4.25Å; L155-L459 HydrophobicContact CD1-CD2 4.48Å; L155-L459 HydrophobicContact CD2-CD2 3.47Å; L155-L459 VanDerWaalsContact CD2-CD2 3.47Å
156	L	91.8	Very high	80.6	Confident	4 Å²	4	33.7 Å²	33.7	2%	0.021	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	120.8	-175.1	-58.1	173.7	0	0	0	110.6	V123 V124 S125 I130 L133 M145 A146 V147 L410	V123-L156 HydrophobicContact CG1-CD1 3.44Å; V123-L156 VanDerWaalsContact CG1-CD1 3.44Å; V123-L156 HydrophobicContact CG1-CG 4Å; V124-L156 PolarHBondContact O-N 3.11Å; S125-L156 WeakPolarHBondContact CB-O 3.2Å; S125-L156 WeakPolarHBondContact OG-CB 3.26Å; S125-L156 PolarHBondContact OG-O 3.36Å; I130-L156 HydrophobicContact CD1-CD1 4.11Å; L133-L156 HydrophobicContact CD1-CD1 3.69Å; M145-L156 HydrophobicContact CE-CB 3.84Å; M145-L156 HydrophobicContact CE-CD1 4.4Å; A146-L156 WeakPolarHBondContact O-CA 3.35Å; V147-L156 HydrophobicContact CB-CD2 3.92Å; V147-L156 HydrophobicContact CG1-CD2 3.66Å; V147-L156 HydrophobicContact CG2-CD2 3.5Å; V147-L156 VanDerWaalsContact CG2-CD2 3.5Å; L156-L410 HydrophobicContact CD2-CD1 4.27Å
157	D	89.1	Confident	79	Confident	26 Å²	26	41.6 Å²	41.6	14%	0.139	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	151.6	175.5	-83.8	-37.9	0	0	0	112	S106 M145 A146 L159	S106-D157 WeakPolarHBondContact CB-OD1 3.37Å; S106-D157 WeakPolarHBondContact CB-OD2 3.33Å; S106-D157 PolarHBondContact N-OD1 2.8Å; S106-D157 PolarHBondContact N-OD2 3.02Å; S106-D157 PolarHBondContact OG-OD2 2.68Å; M145-D157 CarbonylContact C-O 3.51Å; M145-D157 VanDerWaalsContact CA-O 3.28Å; M145-D157 WeakPolarHBondContact CA-O 3.3Å; A146-D157 PolarHBondContact N-O 2.76Å; A146-D157 PolarHBondContact O-N 3.46Å; D157-L159 PolarHBondContact O-N 2.8Å
158	E	86	Confident	77.3	Confident	79 Å²	79	42 Å²	42	37%	0.369	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	119.1	173.2	178.7	167.9	-143.5	0	0	110	N129 K132 D160	N129-E158 PolarHBondContact ND2-N 2.76Å; K132-E158 IonicContact NZ-OE1 3.05Å; K132-E158 PolarHBondContact NZ-OE1 3.44Å; K132-E158 IonicContact NZ-OE2 2.76Å; K132-E158 PolarHBondContact NZ-OE2 2.84Å; E158-D160 PolarHBondContact O-N 2.91Å
159	L	83.3	Confident	75.6	Confident	10 Å²	10	46.4 Å²	46.4	5%	0.052	22%	0.221	C	C	.	.			trans	-92.3	90.8	177.3	-168.9	72	0	0	0	109.3	S144 A146 D157 I161 L164 W422 L437 F452	S144-L159 WeakPolarHBondContact CB-O 3.24Å; S144-L159 PolarHBondContact O-N 2.77Å; S144-L159 VanDerWaalsContact O-N 3.09Å; S144-L159 PolarHBondContact OG-O 3.07Å; A146-L159 HydrophobicContact CB-CB 4.33Å; A146-L159 HydrophobicContact CB-CD1 4.3Å; D157-L159 PolarHBondContact O-N 2.8Å; L159-I161 HydrophobicContact CD2-CG1 4.42Å; L159-I161 HydrophobicContact CG-CG1 4.35Å; L159-I161 PolarHBondContact O-N 2.9Å; L159-I161 VanDerWaalsContact O-N 3.13Å; L159-L164 HydrophobicContact CD1-CD1 3.59Å; L159-L164 HydrophobicContact CG-CD1 4.1Å; L159-W422 HydrophobicContact CD2-CD2 4.49Å; L159-W422 HydrophobicContact CD2-CG 3.99Å; L159-L437 HydrophobicContact CD2-CD1 4.39Å; L159-F452 HydrophobicContact CD1-CE2 3.99Å; L159-F452 HydrophobicContact CD1-CZ 3.72Å
160	D	76.3	Confident	73.7	Confident	67 Å²	67	52.7 Å²	52.7	36%	0.358	25%	0.252	S	S	.	.			trans	-78.9	92.8	173.9	-170	-17.1	0	0	0	110.4	E158 Q162 E163 L164	E158-D160 PolarHBondContact O-N 2.91Å; D160-Q162 PolarHBondContact O-N 3.44Å; D160-Q162 WeakPolarHBondContact OD1-CB 2.74Å; D160-Q162 PolarHBondContact OD1-N 2.94Å; D160-E163 HydrophobicContact CB-CB 3.97Å; D160-E163 PolarHBondContact O-N 3.42Å; D160-E163 PolarHBondContact OD1-N 2.81Å; D160-L164 WeakPolarHBondContact O-CG 3.42Å; D160-L164 PolarHBondContact O-N 3.2Å; D160-L164 VanDerWaalsContact O-N 3.11Å
161	I	69.9	Low	72	Confident	7 Å²	7	57 Å²	57	4%	0.036	28%	0.278	C	S	.	.	H	α-helix	trans	-60.6	-28.2	-178.4	-63.7	169.2	0	0	0	111.7	S144 L159 F165 Y181 W422	S144-I161 WeakPolarHBondContact OG-CD1 3.31Å; L159-I161 HydrophobicContact CD2-CG1 4.42Å; L159-I161 HydrophobicContact CG-CG1 4.35Å; L159-I161 PolarHBondContact O-N 2.9Å; L159-I161 VanDerWaalsContact O-N 3.13Å; I161-F165 HydrophobicContact CG2-CD1 4.37Å; I161-F165 HydrophobicContact CG2-CD2 4.05Å; I161-F165 HydrophobicContact CG2-CE1 3.66Å; I161-F165 HydrophobicContact CG2-CE2 3.33Å; I161-F165 HydrophobicContact CG2-CZ 3.08Å; I161-F165 WeakPolarHBondContact O-CD1 3.46Å; I161-F165 WeakPolarHBondContact O-CD2 3.37Å; I161-F165 WeakPolarHBondContact O-CG 3.23Å; I161-F165 PolarHBondContact O-N 2.91Å; I161-Y181 HydrophobicContact CB-CE2 4.37Å; I161-Y181 HydrophobicContact CD1-CD2 3.52Å; I161-Y181 HydrophobicContact CD1-CE2 3.31Å; I161-Y181 HydrophobicContact CG1-CE2 4.41Å; I161-Y181 HydrophobicContact CG2-CD1 4.13Å; I161-Y181 HydrophobicContact CG2-CD2 3.87Å; I161-Y181 HydrophobicContact CG2-CE1 4.22Å; I161-Y181 HydrophobicContact CG2-CE2 3.97Å; I161-Y181 HydrophobicContact CG2-CG 3.93Å; I161-W422 HydrophobicContact CD1-CH2 4.15Å; I161-W422 HydrophobicContact CD1-CZ2 3.31Å
162	Q	63.6	Low	70.9	Confident	70 Å²	70	58.8 Å²	58.8	33%	0.327	30%	0.296	S	S	.	.	H	α-helix	trans	-75.3	-39.4	178.5	-62.7	178.8	13.2	0	0	111.8	D160 L164 F165 M166	D160-Q162 PolarHBondContact O-N 3.44Å; D160-Q162 WeakPolarHBondContact OD1-CB 2.74Å; D160-Q162 PolarHBondContact OD1-N 2.94Å; Q162-L164 VanDerWaalsContact C-N 3.28Å; Q162-F165 PolarHBondContact O-N 3.32Å; Q162-M166 VanDerWaalsContact O-CG 3.28Å; Q162-M166 WeakPolarHBondContact O-CG 3.23Å; Q162-M166 PolarHBondContact O-N 2.98Å
163	E	66.9	Low	69.7	Low	87 Å²	87	56.7 Å²	56.7	41%	0.407	29%	0.294	S	S	.	.	H	α-helix	trans	-60.9	-43.1	173.3	-172.2	175.3	-174.6	0	0	110.5	D160 F165 M166 R167	D160-E163 HydrophobicContact CB-CB 3.97Å; D160-E163 PolarHBondContact O-N 3.42Å; D160-E163 PolarHBondContact OD1-N 2.81Å; E163-F165 PolarHBondContact O-N 2.96Å; E163-M166 PolarHBondContact O-N 3.4Å; E163-R167 PolarHBondContact O-N 3.19Å
164	L	65.9	Low	68.5	Low	28 Å²	28	57.5 Å²	57.5	15%	0.147	30%	0.297	C	S	.	.	H	α-helix	trans	-61.2	-42.2	174.8	-66.5	176.7	0	0	0	112.1	L159 D160 Q162 R167 S168 W174	L159-L164 HydrophobicContact CD1-CD1 3.59Å; L159-L164 HydrophobicContact CG-CD1 4.1Å; D160-L164 WeakPolarHBondContact O-CG 3.42Å; D160-L164 PolarHBondContact O-N 3.2Å; D160-L164 VanDerWaalsContact O-N 3.11Å; Q162-L164 VanDerWaalsContact C-N 3.28Å; L164-R167 PolarHBondContact O-N 3.18Å; L164-S168 WeakPolarHBondContact O-CB 3.39Å; L164-S168 PolarHBondContact O-N 2.9Å; L164-W174 HydrophobicContact CD1-CH2 4.12Å; L164-W174 HydrophobicContact CD1-CZ2 3.87Å; L164-W174 HydrophobicContact CD2-CZ2 3.62Å; L164-W174 HydrophobicContact CG-CZ2 4.31Å
165	F	65.9	Low	67.3	Low	36 Å²	36	60.9 Å²	60.9	16%	0.158	32%	0.318	C	S	.	.	H	α-helix	trans	-66.6	-37.7	176.3	-64	-18.7	0	0	0	113.4	I161 Q162 E163 R167 S168 S169 K178 Y181	I161-F165 HydrophobicContact CG2-CD1 4.37Å; I161-F165 HydrophobicContact CG2-CD2 4.05Å; I161-F165 HydrophobicContact CG2-CE1 3.66Å; I161-F165 HydrophobicContact CG2-CE2 3.33Å; I161-F165 HydrophobicContact CG2-CZ 3.08Å; I161-F165 WeakPolarHBondContact O-CD1 3.46Å; I161-F165 WeakPolarHBondContact O-CD2 3.37Å; I161-F165 WeakPolarHBondContact O-CG 3.23Å; I161-F165 PolarHBondContact O-N 2.91Å; Q162-F165 PolarHBondContact O-N 3.32Å; E163-F165 PolarHBondContact O-N 2.96Å; F165-R167 VanDerWaalsContact C-N 3.32Å; F165-S168 VanDerWaalsContact CA-OG 3.32Å; F165-S168 WeakPolarHBondContact CA-OG 3.13Å; F165-S168 PolarHBondContact O-N 2.72Å; F165-S168 PolarHBondContact O-OG 2.76Å; F165-S169 PolarHBondContact O-N 3.15Å; F165-S169 PolarHBondContact O-OG 3.48Å; F165-K178 HydrophobicContact CD1-CB 3.8Å; F165-K178 HydrophobicContact CD1-CD 4.29Å; F165-K178 HydrophobicContact CD1-CG 3.93Å; F165-K178 HydrophobicContact CD2-CG 4.37Å; F165-K178 HydrophobicContact CE1-CB 3.41Å; F165-K178 VanDerWaalsContact CE1-CB 3.41Å; F165-K178 HydrophobicContact CE1-CG 3.76Å; F165-K178 HydrophobicContact CE2-CG 4.18Å; F165-K178 HydrophobicContact CG-CD 4.44Å; F165-K178 HydrophobicContact CG-CG 4.26Å; F165-K178 HydrophobicContact CZ-CB 3.88Å; F165-K178 HydrophobicContact CZ-CG 3.88Å; F165-Y181 AromaticContact CE2-CD1 3.69Å; F165-Y181 HydrophobicContact CE2-CD1 3.69Å; F165-Y181 HydrophobicContact CE2-CE1 4.13Å; F165-Y181 HydrophobicContact CE2-CG 4.29Å; F165-Y181 AromaticContact CZ-CD1 3.8Å; F165-Y181 HydrophobicContact CZ-CD1 3.8Å; F165-Y181 AromaticContact CZ-CG 3.95Å; F165-Y181 HydrophobicContact CZ-CG 3.95Å
166	M	61	Low	66.4	Low	135 Å²	135	62.1 Å²	62.1	67%	0.665	32%	0.322	S	S	*	.	H	α-helix	trans	-67.6	-33.7	176.3	-68.1	-69.2	-61.7	0	0	112	Q162 E163 S169	Q162-M166 VanDerWaalsContact O-CG 3.28Å; Q162-M166 WeakPolarHBondContact O-CG 3.23Å; Q162-M166 PolarHBondContact O-N 2.98Å; E163-M166 PolarHBondContact O-N 3.4Å; M166-S169 PolarHBondContact O-OG 2.73Å
167	R	57.7	Low	65.4	Low	167 Å²	167	62 Å²	62	63%	0.63	32%	0.322	S	S	*	.	H	α-helix	trans	-73.5	-40	172.7	-113.8	175.5	174.8	174.8	-3.8	112.3	E163 L164 F165 S169 Q170 T171	E163-R167 PolarHBondContact O-N 3.19Å; L164-R167 PolarHBondContact O-N 3.18Å; F165-R167 VanDerWaalsContact C-N 3.32Å; R167-S169 VanDerWaalsContact C-N 3.27Å; R167-S169 PolarHBondContact O-N 3.49Å; R167-Q170 PolarHBondContact O-N 3.17Å; R167-T171 PolarHBondContact O-N 3.04Å; R167-T171 PolarHBondContact O-OG1 3Å
168	S	55	Low	64.5	Low	9 Å²	9	64.7 Å²	64.7	6%	0.063	33%	0.332	C	S	.	.	H	α-helix	trans	-58.4	-35.8	179.6	71.9	0	0	0	0	113	L164 F165 Q170 T171 G172 D173	L164-S168 WeakPolarHBondContact O-CB 3.39Å; L164-S168 PolarHBondContact O-N 2.9Å; F165-S168 VanDerWaalsContact CA-OG 3.32Å; F165-S168 WeakPolarHBondContact CA-OG 3.13Å; F165-S168 PolarHBondContact O-N 2.72Å; F165-S168 PolarHBondContact O-OG 2.76Å; S168-Q170 PolarHBondContact O-N 2.88Å; S168-Q170 VanDerWaalsContact O-N 3.07Å; S168-T171 PolarHBondContact O-N 2.82Å; S168-G172 PolarHBondContact O-N 3.32Å; S168-D173 WeakPolarHBondContact CA-O 3.39Å; S168-D173 WeakPolarHBondContact CB-O 3.23Å
169	S	53.8	Low	63.8	Low	93 Å²	93	65.8 Å²	65.8	65%	0.65	34%	0.337	S	S	*	.	H	α-helix	trans	-63.8	-13.8	176.9	38.9	0	0	0	0	114.3	F165 M166 R167	F165-S169 PolarHBondContact O-N 3.15Å; F165-S169 PolarHBondContact O-OG 3.48Å; M166-S169 PolarHBondContact O-OG 2.73Å; R167-S169 VanDerWaalsContact C-N 3.27Å; R167-S169 PolarHBondContact O-N 3.49Å
170	Q	49.6	Very low	63.3	Low	168 Å²	168	66.2 Å²	66.2	79%	0.785	34%	0.339	S	S	*	.	H	α-helix	trans	-103.1	-21.3	177.1	-66.2	175.1	-11.7	0	0	113.3	R167 S168	R167-Q170 PolarHBondContact O-N 3.17Å; S168-Q170 PolarHBondContact O-N 2.88Å; S168-Q170 VanDerWaalsContact O-N 3.07Å
171	T	49.4	Very low	63.2	Low	90 Å²	90	64.5 Å²	64.5	55%	0.552	33%	0.327	S	S	*	.	H	α-helix	trans	-122.8	-16.3	-169.6	35.7	0	0	0	0	114.5	R167 S168 D173	R167-T171 PolarHBondContact O-N 3.04Å; R167-T171 PolarHBondContact O-OG1 3Å; S168-T171 PolarHBondContact O-N 2.82Å; T171-D173 PolarHBondContact O-N 3.46Å
172	G	53.5	Low	63.2	Low	40 Å²	40	69.9 Å²	69.9	41%	0.412	35%	0.352	S	S	.	.			trans	78.3	-19.3	-176.2	0	0	0	0	0	114.4	S168	S168-G172 PolarHBondContact O-N 3.32Å
173	D	54.3	Low	63.4	Low	75 Å²	75	75.6 Å²	75.6	40%	0.401	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	137	174	-60.1	-34.6	0	0	0	110.4	S168 T171	S168-D173 WeakPolarHBondContact CA-O 3.39Å; S168-D173 WeakPolarHBondContact CB-O 3.23Å; T171-D173 PolarHBondContact O-N 3.46Å
174	W	63.4	Low	63.5	Low	16 Å²	16	74.1 Å²	74.1	6%	0.061	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.8	12	175	-48.7	100.7	0	0	0	119.3	L164 W176 L177 K178 P451 F452	L164-W174 HydrophobicContact CD1-CH2 4.12Å; L164-W174 HydrophobicContact CD1-CZ2 3.87Å; L164-W174 HydrophobicContact CD2-CZ2 3.62Å; L164-W174 HydrophobicContact CG-CZ2 4.31Å; W174-W176 VanDerWaalsContact C-N 3.27Å; W174-W176 HydrophobicContact CE3-CZ2 4.31Å; W174-W176 HydrophobicContact CZ3-CZ2 4.4Å; W174-W176 PolarHBondContact O-N 3.31Å; W174-L177 HydrophobicContact CB-CB 4.48Å; W174-L177 HydrophobicContact CD2-CD2 4.42Å; W174-L177 HydrophobicContact CE3-CB 3.99Å; W174-L177 HydrophobicContact CE3-CD2 3.5Å; W174-L177 VanDerWaalsContact CE3-CD2 3.5Å; W174-L177 HydrophobicContact CE3-CG 4.38Å; W174-L177 HydrophobicContact CH2-CD2 4.35Å; W174-L177 HydrophobicContact CZ3-CD2 3.53Å; W174-L177 PolarHBondContact O-N 3.2Å; W174-L177 VanDerWaalsContact O-N 3.16Å; W174-K178 PolarHBondContact O-N 3.4Å; W174-P451 HydrophobicContact CH2-CG 3.33Å; W174-P451 HydrophobicContact CZ2-CB 4.21Å; W174-P451 HydrophobicContact CZ2-CG 3.08Å; W174-P451 HydrophobicContact CZ3-CG 4.28Å; W174-F452 HydrophobicContact CH2-CD2 4.27Å; W174-F452 AromaticContact CH2-CE2 3.71Å; W174-F452 HydrophobicContact CH2-CE2 3.71Å; W174-F452 HydrophobicContact CH2-CZ 4.37Å; W174-F452 HydrophobicContact CZ2-CE2 4.46Å
175	T	65.4	Low	63.4	Low	71 Å²	71	74.7 Å²	74.7	44%	0.436	37%	0.369	S	S	.	.	H	α-helix	trans	-56.3	-42.4	174.4	46.5	0	0	0	0	112.2	L177 K178 E179	T175-L177 VanDerWaalsContact C-N 3.35Å; T175-L177 PolarHBondContact O-N 2.97Å; T175-K178 WeakPolarHBondContact O-CB 3.37Å; T175-K178 PolarHBondContact O-N 3.42Å; T175-E179 PolarHBondContact O-N 3.21Å
176	W	72.1	Confident	62.7	Low	26 Å²	26	79.4 Å²	79.4	10%	0.098	40%	0.395	C	S	.	.	H	α-helix	trans	-60.5	-40.8	176.6	74.5	-91	0	0	0	112.6	W174 K178 E179 F180 L437 L440 C441 T444 Q449	W174-W176 VanDerWaalsContact C-N 3.27Å; W174-W176 HydrophobicContact CE3-CZ2 4.31Å; W174-W176 HydrophobicContact CZ3-CZ2 4.4Å; W174-W176 PolarHBondContact O-N 3.31Å; W176-K178 VanDerWaalsContact C-N 3.3Å; W176-K178 PolarHBondContact O-N 3.02Å; W176-E179 PolarHBondContact O-N 2.91Å; W176-F180 VanDerWaalsContact O-CB 3.3Å; W176-F180 WeakPolarHBondContact O-CB 3.47Å; W176-F180 PolarHBondContact O-N 2.88Å; W176-L437 HydrophobicContact CH2-CD2 4.09Å; W176-L440 HydrophobicContact CH2-CB 4.34Å; W176-L440 HydrophobicContact CZ3-CB 4.02Å; W176-C441 VanDerWaalsContact CE2-SG 3.59Å; W176-C441 WeakPolarHBondContact CZ2-SG 3.35Å; W176-T444 HydrophobicContact CB-CG2 4.03Å; W176-T444 HydrophobicContact CG-CG2 4.26Å; W176-Q449 VanDerWaalsContact CD1-OE1 3.25Å
177	L	71.7	Confident	62.2	Low	1 Å²	1	82.4 Å²	82.4	1%	0.005	41%	0.408	C	S	.	.	H	α-helix	trans	-70.1	-34	-179.4	-177.4	64.6	0	0	0	110.2	W174 T175 F180 Y181 L437	W174-L177 HydrophobicContact CB-CB 4.48Å; W174-L177 HydrophobicContact CD2-CD2 4.42Å; W174-L177 HydrophobicContact CE3-CB 3.99Å; W174-L177 HydrophobicContact CE3-CD2 3.5Å; W174-L177 VanDerWaalsContact CE3-CD2 3.5Å; W174-L177 HydrophobicContact CE3-CG 4.38Å; W174-L177 HydrophobicContact CH2-CD2 4.35Å; W174-L177 HydrophobicContact CZ3-CD2 3.53Å; W174-L177 PolarHBondContact O-N 3.2Å; W174-L177 VanDerWaalsContact O-N 3.16Å; T175-L177 VanDerWaalsContact C-N 3.35Å; T175-L177 PolarHBondContact O-N 2.97Å; L177-F180 HydrophobicContact CD1-CD1 4.36Å; L177-F180 PolarHBondContact O-N 3.49Å; L177-Y181 WeakPolarHBondContact O-CB 3.17Å; L177-Y181 PolarHBondContact O-N 3.33Å; L177-L437 HydrophobicContact CD1-CD2 4.17Å
178	K	69.9	Low	61.5	Low	83 Å²	83	82.9 Å²	82.9	36%	0.361	41%	0.414	S	S	.	.	H	α-helix	trans	-64.3	-46.3	173.1	-173	-178.9	175.9	-174.1	0	111.8	F165 W174 T175 W176 Y181 Q182	F165-K178 HydrophobicContact CD1-CB 3.8Å; F165-K178 HydrophobicContact CD1-CD 4.29Å; F165-K178 HydrophobicContact CD1-CG 3.93Å; F165-K178 HydrophobicContact CD2-CG 4.37Å; F165-K178 HydrophobicContact CE1-CB 3.41Å; F165-K178 VanDerWaalsContact CE1-CB 3.41Å; F165-K178 HydrophobicContact CE1-CG 3.76Å; F165-K178 HydrophobicContact CE2-CG 4.18Å; F165-K178 HydrophobicContact CG-CD 4.44Å; F165-K178 HydrophobicContact CG-CG 4.26Å; F165-K178 HydrophobicContact CZ-CB 3.88Å; F165-K178 HydrophobicContact CZ-CG 3.88Å; W174-K178 PolarHBondContact O-N 3.4Å; T175-K178 WeakPolarHBondContact O-CB 3.37Å; T175-K178 PolarHBondContact O-N 3.42Å; W176-K178 VanDerWaalsContact C-N 3.3Å; W176-K178 PolarHBondContact O-N 3.02Å; K178-Y181 PolarHBondContact O-N 3.09Å; K178-Q182 WeakPolarHBondContact O-CB 3.36Å; K178-Q182 VanDerWaalsContact O-CG 3.22Å; K178-Q182 WeakPolarHBondContact O-CG 3.24Å; K178-Q182 PolarHBondContact O-N 3.23Å
179	E	70.9	Confident	61.2	Low	102 Å²	102	88.1 Å²	88.1	48%	0.477	43%	0.433	S	S	.	.	H	α-helix	trans	-62.7	-43.3	174.6	-70.5	-178.8	-169.5	0	0	111.6	T175 W176 Q182 R183	T175-E179 PolarHBondContact O-N 3.21Å; W176-E179 PolarHBondContact O-N 2.91Å; E179-Q182 PolarHBondContact O-N 3.02Å; E179-R183 WeakPolarHBondContact O-CG 3.24Å; E179-R183 PolarHBondContact O-N 2.71Å; E179-R183 IonicContact OE2-NH2 2.68Å
180	F	73.6	Confident	60.9	Low	20 Å²	20	91.6 Å²	91.6	9%	0.088	44%	0.439	C	S	.	.	H	α-helix	trans	-62.4	-46.4	177.2	-175.2	-116.1	0	0	0	111.8	W176 L177 Q182 R183 L184 W422 Y435 L440 K562	W176-F180 VanDerWaalsContact O-CB 3.3Å; W176-F180 WeakPolarHBondContact O-CB 3.47Å; W176-F180 PolarHBondContact O-N 2.88Å; L177-F180 HydrophobicContact CD1-CD1 4.36Å; L177-F180 PolarHBondContact O-N 3.49Å; F180-Q182 PolarHBondContact O-N 3.44Å; F180-R183 PolarHBondContact O-N 2.91Å; F180-L184 HydrophobicContact CD1-CD1 3.82Å; F180-L184 HydrophobicContact CE1-CD1 3.49Å; F180-L184 VanDerWaalsContact CE1-CD1 3.49Å; F180-L184 HydrophobicContact CE1-CG 4.49Å; F180-L184 HydrophobicContact CE2-CD1 4.34Å; F180-L184 HydrophobicContact CG-CD1 4.41Å; F180-L184 HydrophobicContact CZ-CD1 3.77Å; F180-L184 HydrophobicContact CZ-CG 4.4Å; F180-L184 WeakPolarHBondContact O-CG 3.38Å; F180-L184 PolarHBondContact O-N 2.9Å; F180-L184 VanDerWaalsContact O-N 3.1Å; F180-W422 HydrophobicContact CD1-CZ3 4Å; F180-W422 HydrophobicContact CE1-CE3 4.29Å; F180-W422 AromaticContact CE1-CZ3 3.79Å; F180-W422 HydrophobicContact CE1-CZ3 3.79Å; F180-Y435 HydrophobicContact CE1-CD1 4.04Å; F180-Y435 HydrophobicContact CE1-CE1 4.25Å; F180-Y435 HydrophobicContact CE1-CG 4.37Å; F180-Y435 AromaticContact CZ-CD1 3.75Å; F180-Y435 HydrophobicContact CZ-CD1 3.75Å; F180-Y435 AromaticContact CZ-CE1 3.77Å; F180-Y435 HydrophobicContact CZ-CE1 3.77Å; F180-L440 HydrophobicContact CE1-CD1 4.02Å; F180-L440 HydrophobicContact CZ-CD1 4.09Å; F180-K562 HydrophobicContact CD2-CD 4.45Å; F180-K562 HydrophobicContact CE2-CB 4.03Å; F180-K562 HydrophobicContact CE2-CD 3.79Å; F180-K562 HydrophobicContact CE2-CG 4.45Å; F180-K562 HydrophobicContact CZ-CB 4.17Å
181	Y	73.4	Confident	60.5	Low	30 Å²	30	92.7 Å²	92.7	12%	0.118	44%	0.436	C	S	.	.	H	α-helix	trans	-63.3	-39.3	175.6	-176.5	-98.1	0	0	0	112.6	I161 F165 L177 K178 R183 L184 I185 W422 F424	I161-Y181 HydrophobicContact CB-CE2 4.37Å; I161-Y181 HydrophobicContact CD1-CD2 3.52Å; I161-Y181 HydrophobicContact CD1-CE2 3.31Å; I161-Y181 HydrophobicContact CG1-CE2 4.41Å; I161-Y181 HydrophobicContact CG2-CD1 4.13Å; I161-Y181 HydrophobicContact CG2-CD2 3.87Å; I161-Y181 HydrophobicContact CG2-CE1 4.22Å; I161-Y181 HydrophobicContact CG2-CE2 3.97Å; I161-Y181 HydrophobicContact CG2-CG 3.93Å; F165-Y181 AromaticContact CE2-CD1 3.69Å; F165-Y181 HydrophobicContact CE2-CD1 3.69Å; F165-Y181 HydrophobicContact CE2-CE1 4.13Å; F165-Y181 HydrophobicContact CE2-CG 4.29Å; F165-Y181 AromaticContact CZ-CD1 3.8Å; F165-Y181 HydrophobicContact CZ-CD1 3.8Å; F165-Y181 AromaticContact CZ-CG 3.95Å; F165-Y181 HydrophobicContact CZ-CG 3.95Å; L177-Y181 WeakPolarHBondContact O-CB 3.17Å; L177-Y181 PolarHBondContact O-N 3.33Å; K178-Y181 PolarHBondContact O-N 3.09Å; Y181-R183 VanDerWaalsContact C-N 3.32Å; Y181-L184 PolarHBondContact O-N 3.4Å; Y181-I185 HydrophobicContact CD1-CD1 4.3Å; Y181-I185 HydrophobicContact CD2-CD1 4.09Å; Y181-I185 HydrophobicContact CE1-CD1 3.62Å; Y181-I185 HydrophobicContact CE2-CD1 3.37Å; Y181-I185 HydrophobicContact CE2-CG1 4.43Å; Y181-I185 PolarHBondContact O-N 3.49Å; Y181-I185 WeakPolarHBondContact OH-CD1 3.49Å; Y181-W422 AromaticContact CD2-CH2 3.84Å; Y181-W422 HydrophobicContact CD2-CH2 3.84Å; Y181-W422 HydrophobicContact CD2-CZ2 4.11Å; Y181-W422 HydrophobicContact CE2-CH2 4.48Å; Y181-W422 HydrophobicContact CE2-CZ2 4.38Å; Y181-F424 HydrophobicContact CE2-CE2 4.18Å; Y181-F424 HydrophobicContact CE2-CZ 4.43Å
182	Q	69.8	Low	60.6	Low	120 Å²	120	97.8 Å²	97.8	56%	0.561	45%	0.45	S	S	*	.	H	α-helix	trans	-65.9	-32.9	175.3	-78.1	177	-0.9	0	0	112.6	K178 E179 F180 L184	K178-Q182 WeakPolarHBondContact O-CB 3.36Å; K178-Q182 VanDerWaalsContact O-CG 3.22Å; K178-Q182 WeakPolarHBondContact O-CG 3.24Å; K178-Q182 PolarHBondContact O-N 3.23Å; E179-Q182 PolarHBondContact O-N 3.02Å; F180-Q182 PolarHBondContact O-N 3.44Å; Q182-L184 VanDerWaalsContact C-N 3.35Å
183	R	69.1	Low	60.2	Low	191 Å²	191	105 Å²	105	72%	0.721	47%	0.47	S	S	*	.	H	α-helix	trans	-70	-32	172.1	-70.2	175.9	-162.8	171.7	9.3	112.4	E179 F180 Y181	E179-R183 WeakPolarHBondContact O-CG 3.24Å; E179-R183 PolarHBondContact O-N 2.71Å; E179-R183 IonicContact OE2-NH2 2.68Å; F180-R183 PolarHBondContact O-N 2.91Å; Y181-R183 VanDerWaalsContact C-N 3.32Å
184	L	67.1	Low	60.4	Low	56 Å²	56	107.5 Å²	107.5	29%	0.293	48%	0.477	S	S	.	.	H	α-helix	trans	-80.4	-17.5	-177.2	-73.3	172.5	0	0	0	114.9	F180 Y181 Q182 W422 Y435	F180-L184 HydrophobicContact CD1-CD1 3.82Å; F180-L184 HydrophobicContact CE1-CD1 3.49Å; F180-L184 VanDerWaalsContact CE1-CD1 3.49Å; F180-L184 HydrophobicContact CE1-CG 4.49Å; F180-L184 HydrophobicContact CE2-CD1 4.34Å; F180-L184 HydrophobicContact CG-CD1 4.41Å; F180-L184 HydrophobicContact CZ-CD1 3.77Å; F180-L184 HydrophobicContact CZ-CG 4.4Å; F180-L184 WeakPolarHBondContact O-CG 3.38Å; F180-L184 PolarHBondContact O-N 2.9Å; F180-L184 VanDerWaalsContact O-N 3.1Å; Y181-L184 PolarHBondContact O-N 3.4Å; Q182-L184 VanDerWaalsContact C-N 3.35Å; L184-W422 HydrophobicContact CD1-CH2 3.89Å; L184-W422 HydrophobicContact CD1-CZ3 3.7Å; L184-Y435 HydrophobicContact CD1-CE1 4.48Å; L184-Y435 HydrophobicContact CD1-CE2 4.4Å; L184-Y435 WeakPolarHBondContact CD2-OH 3.5Å
185	I	64.1	Low	60.1	Low	40 Å²	40	110.2 Å²	110.2	21%	0.205	50%	0.499	C	S	.	.	S	Bend	trans	-124.8	131.4	-173.7	-62.8	-176.3	0	0	0	111.5	Y181 W189 F424	Y181-I185 HydrophobicContact CD1-CD1 4.3Å; Y181-I185 HydrophobicContact CD2-CD1 4.09Å; Y181-I185 HydrophobicContact CE1-CD1 3.62Å; Y181-I185 HydrophobicContact CE2-CD1 3.37Å; Y181-I185 HydrophobicContact CE2-CG1 4.43Å; Y181-I185 PolarHBondContact O-N 3.49Å; Y181-I185 WeakPolarHBondContact OH-CD1 3.49Å; I185-W189 HydrophobicContact CG2-CB 4.44Å; I185-F424 HydrophobicContact CD1-CZ 3.85Å; I185-F424 HydrophobicContact CG1-CZ 4.25Å
186	D	52.3	Low	60.2	Low	135 Å²	135	115.7 Å²	115.7	72%	0.722	52%	0.517	S	S	*	.			trans	-57.1	136.2	171.7	-164.1	5.3	0	0	0	111.3	K188	D186-K188 PolarHBondContact O-N 3.49Å
187	Q	50.9	Low	60	Low	197 Å²	197	118.5 Å²	118.5	92%	0.921	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	4.7	-161.7	-67.5	-177	-5.2	0	0	116.6
188	K	43	Very low	59.9	Low	178 Å²	178	122.4 Å²	122.4	77%	0.774	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	18.7	-170.2	-68.9	-177	179.6	171.9	0	115.6	D186 Q190	D186-K188 PolarHBondContact O-N 3.49Å; K188-Q190 PolarHBondContact O-N 2.86Å
189	W	47.7	Very low	59.9	Low	118 Å²	118	123.7 Å²	123.7	45%	0.447	55%	0.552	S	S	.	*			trans	-74.6	93.3	172.5	-174	-96.7	0	0	0	111.7	I185	I185-W189 HydrophobicContact CG2-CB 4.44Å
190	Q	47.3	Very low	60.1	Low	167 Å²	167	122.7 Å²	122.7	78%	0.78	54%	0.544	S	S	*	.			trans	-93.5	134.9	170.2	-75.4	-84.4	-19.6	0	0	110.1	K188 K192	K188-Q190 PolarHBondContact O-N 2.86Å; Q190-K192 PolarHBondContact O-N 2.79Å
191	R	42.5	Very low	60.1	Low	190 Å²	190	125.3 Å²	125.3	72%	0.717	56%	0.557	S	S	*	*			trans	-52.9	114.1	176.7	-163.2	-179.6	-156.8	138.9	9.1	109.5	K193	R191-K193 PolarHBondContact O-N 3.34Å
192	K	49.8	Very low	60	Low	197 Å²	197	125.4 Å²	125.4	86%	0.857	56%	0.558	S	S	*	*			trans	-63.1	103.1	162.7	-80.7	-174.6	178.1	177.7	0	107.1	Q190 K194	Q190-K192 PolarHBondContact O-N 2.79Å; K192-K194 PolarHBondContact O-N 3.14Å; K192-K194 VanDerWaalsContact O-N 3.12Å
193	K	47	Very low	60.2	Low	192 Å²	192	121.5 Å²	121.5	84%	0.835	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-51.3	121.8	166.7	-89.3	-178.8	176.1	175.8	0	106.6	R191 S195	R191-K193 PolarHBondContact O-N 3.34Å; K193-S195 PolarHBondContact O-N 3.04Å
194	K	56.6	Low	60.8	Low	127 Å²	127	112.6 Å²	112.6	55%	0.552	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-52.8	120	173.6	-71.3	-174.6	179.7	-179.3	0	106.8	K192	K192-K194 PolarHBondContact O-N 3.14Å; K192-K194 VanDerWaalsContact O-N 3.12Å
195	S	58.3	Low	61.4	Low	73 Å²	73	113 Å²	113	51%	0.51	52%	0.515	S	S	.	.	P	Polyproline II helix	trans	-54.4	147	-176.1	174	0	0	0	0	110.4	K193 E197 H198 W199	K193-S195 PolarHBondContact O-N 3.04Å; S195-E197 PolarHBondContact O-N 2.85Å; S195-E197 VanDerWaalsContact O-N 3.09Å; S195-E197 WeakPolarHBondContact OG-CB 3.42Å; S195-E197 PolarHBondContact OG-N 2.91Å; S195-H198 WeakPolarHBondContact O-CB 3.44Å; S195-H198 PolarHBondContact O-N 2.81Å; S195-W199 PolarHBondContact O-N 3.47Å
196	K	66.2	Low	61.9	Low	187 Å²	187	111.6 Å²	111.6	81%	0.813	51%	0.508	S	S	*	.	H	α-helix	trans	-50.9	-31.9	170.9	-166.9	176.4	179.9	-179.6	0	111	W199 Y200	K196-W199 PolarHBondContact O-N 3.12Å; K196-Y200 WeakPolarHBondContact O-CB 3.25Å; K196-Y200 PolarHBondContact O-N 2.97Å
197	E	68.4	Low	63.1	Low	84 Å²	84	106.7 Å²	106.7	39%	0.393	48%	0.481	S	S	.	.	H	α-helix	trans	-62.5	-39.8	173.5	-178.3	57.9	-160.5	0	0	113.8	S195 Y200 Q201 K343	S195-E197 PolarHBondContact O-N 2.85Å; S195-E197 VanDerWaalsContact O-N 3.09Å; S195-E197 WeakPolarHBondContact OG-CB 3.42Å; S195-E197 PolarHBondContact OG-N 2.91Å; E197-Y200 WeakPolarHBondContact O-CB 3.39Å; E197-Y200 PolarHBondContact O-N 3.12Å; E197-Q201 WeakPolarHBondContact O-CG 3.36Å; E197-Q201 PolarHBondContact O-N 3.47Å; E197-Q201 PolarHBondContact OE1-NE2 2.91Å; E197-K343 IonicContact OE1-NZ 2.65Å
198	H	69.8	Low	64.6	Low	83 Å²	83	97.3 Å²	97.3	38%	0.384	44%	0.437	S	S	.	.	H	α-helix	trans	-67.3	-40.8	178.9	179	-71.5	0	0	0	110.9	S195 Y200 K202	S195-H198 WeakPolarHBondContact O-CB 3.44Å; S195-H198 PolarHBondContact O-N 2.81Å; H198-Y200 VanDerWaalsContact C-N 3.34Å; H198-K202 WeakPolarHBondContact O-CB 3.47Å; H198-K202 PolarHBondContact O-N 2.89Å
199	W	70.3	Confident	66.2	Low	111 Å²	111	89.5 Å²	89.5	42%	0.42	40%	0.403	S	S	.	.	H	α-helix	trans	-64.8	-40.5	174.6	-75.9	105.9	0	0	0	112	N97 S195 K196 K202 A203	N97-W199 WeakPolarHBondContact ND2-CH2 3.39Å; N97-W199 WeakPolarHBondContact ND2-CZ3 3.38Å; N97-W199 WeakPolarHBondContact OD1-CH2 3.08Å; N97-W199 WeakPolarHBondContact OD1-CZ3 3.3Å; S195-W199 PolarHBondContact O-N 3.47Å; K196-W199 PolarHBondContact O-N 3.12Å; W199-K202 WeakPolarHBondContact O-CB 3.14Å; W199-K202 PolarHBondContact O-N 3.47Å; W199-A203 WeakPolarHBondContact O-CB 3.46Å; W199-A203 PolarHBondContact O-N 2.98Å
200	Y	75.5	Confident	67.5	Low	81 Å²	81	85.1 Å²	85.1	32%	0.318	39%	0.387	S	S	.	.	H	α-helix	trans	-60.5	-49.6	175.2	-179.4	-111.4	0	0	0	112.1	K74 K196 E197 H198 K202 A203 I204	K74-Y200 VanDerWaalsContact CE-OH 3.23Å; K74-Y200 WeakPolarHBondContact CE-OH 3.16Å; K196-Y200 WeakPolarHBondContact O-CB 3.25Å; K196-Y200 PolarHBondContact O-N 2.97Å; E197-Y200 WeakPolarHBondContact O-CB 3.39Å; E197-Y200 PolarHBondContact O-N 3.12Å; H198-Y200 VanDerWaalsContact C-N 3.34Å; Y200-K202 VanDerWaalsContact C-N 3.34Å; Y200-K202 PolarHBondContact O-N 3.33Å; Y200-A203 PolarHBondContact O-N 3.09Å; Y200-I204 HydrophobicContact CD1-CD1 3.95Å; Y200-I204 HydrophobicContact CD2-CD1 4.35Å; Y200-I204 HydrophobicContact CE1-CD1 3.42Å; Y200-I204 VanDerWaalsContact CE1-CD1 3.42Å; Y200-I204 HydrophobicContact CE2-CD1 3.88Å; Y200-I204 HydrophobicContact CE2-CG1 4.43Å; Y200-I204 HydrophobicContact CG-CD1 4.38Å; Y200-I204 WeakPolarHBondContact O-CG1 3.45Å; Y200-I204 PolarHBondContact O-N 3.12Å
201	Q	72.6	Confident	68.8	Low	75 Å²	75	78.3 Å²	78.3	35%	0.35	35%	0.354	S	S	.	.	H	α-helix	trans	-61.5	-40.1	176.9	-74.9	175.2	-10.7	0	0	112.6	E197 I204 L205	E197-Q201 WeakPolarHBondContact O-CG 3.36Å; E197-Q201 PolarHBondContact O-N 3.47Å; E197-Q201 PolarHBondContact OE1-NE2 2.91Å; Q201-I204 PolarHBondContact O-N 2.72Å; Q201-L205 WeakPolarHBondContact O-CB 3.5Å; Q201-L205 PolarHBondContact O-N 2.79Å
202	K	72.6	Confident	70.5	Confident	32 Å²	32	69.3 Å²	69.3	14%	0.139	32%	0.32	C	S	.	.	H	α-helix	trans	-59.5	-46.6	174	-123.6	-174.7	164.6	179.6	0	111.9	L95 G96 N97 H198 W199 Y200 L205 S206	L95-K202 HydrophobicContact CD2-CB 3.47Å; L95-K202 VanDerWaalsContact CD2-CB 3.47Å; L95-K202 HydrophobicContact CD2-CD 3.39Å; L95-K202 HydrophobicContact CD2-CG 3.26Å; L95-K202 WeakPolarHBondContact O-CE 3.39Å; L95-K202 PolarHBondContact O-NZ 2.9Å; G96-K202 PolarHBondContact O-NZ 2.84Å; N97-K202 PolarHBondContact OD1-NZ 3.34Å; H198-K202 WeakPolarHBondContact O-CB 3.47Å; H198-K202 PolarHBondContact O-N 2.89Å; W199-K202 WeakPolarHBondContact O-CB 3.14Å; W199-K202 PolarHBondContact O-N 3.47Å; Y200-K202 VanDerWaalsContact C-N 3.34Å; Y200-K202 PolarHBondContact O-N 3.33Å; K202-L205 PolarHBondContact O-N 3.2Å; K202-S206 PolarHBondContact O-N 2.69Å
203	A	73.8	Confident	71.6	Confident	38 Å²	38	61.2 Å²	61.2	31%	0.314	29%	0.286	S	S	.	.	H	α-helix	trans	-63.9	-41.9	-178.5	0	0	0	0	0	111.6	W199 Y200 K207	W199-A203 WeakPolarHBondContact O-CB 3.46Å; W199-A203 PolarHBondContact O-N 2.98Å; Y200-A203 PolarHBondContact O-N 3.09Å; A203-K207 VanDerWaalsContact O-CG 3.31Å; A203-K207 WeakPolarHBondContact O-CG 3.47Å; A203-K207 PolarHBondContact O-N 2.82Å; A203-K207 VanDerWaalsContact O-N 3.12Å
204	I	81.1	Confident	72.5	Confident	4 Å²	4	54.1 Å²	54.1	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-66.2	-44.1	176.4	-64.3	175.5	0	0	0	111	L73 Y200 Q201 S206 K207 F208 L338	L73-I204 HydrophobicContact CB-CG2 3.65Å; L73-I204 HydrophobicContact CD1-CG2 3.75Å; L73-I204 HydrophobicContact CG-CG2 4.35Å; Y200-I204 HydrophobicContact CD1-CD1 3.95Å; Y200-I204 HydrophobicContact CD2-CD1 4.35Å; Y200-I204 HydrophobicContact CE1-CD1 3.42Å; Y200-I204 VanDerWaalsContact CE1-CD1 3.42Å; Y200-I204 HydrophobicContact CE2-CD1 3.88Å; Y200-I204 HydrophobicContact CE2-CG1 4.43Å; Y200-I204 HydrophobicContact CG-CD1 4.38Å; Y200-I204 WeakPolarHBondContact O-CG1 3.45Å; Y200-I204 PolarHBondContact O-N 3.12Å; Q201-I204 PolarHBondContact O-N 2.72Å; I204-S206 VanDerWaalsContact C-N 3.32Å; I204-S206 PolarHBondContact O-N 2.89Å; I204-K207 PolarHBondContact O-N 2.8Å; I204-F208 WeakPolarHBondContact O-CB 3.43Å; I204-F208 PolarHBondContact O-N 3.04Å; I204-L338 HydrophobicContact CB-CD2 4.44Å; I204-L338 HydrophobicContact CG2-CD2 3.56Å
205	L	79.8	Confident	72.7	Confident	65 Å²	65	50.4 Å²	50.4	34%	0.34	26%	0.255	S	S	.	.	H	α-helix	trans	-59.2	-43.7	178	175.7	64.7	0	0	0	112	Q201 K202 K207 F208 L209 L338	Q201-L205 WeakPolarHBondContact O-CB 3.5Å; Q201-L205 PolarHBondContact O-N 2.79Å; K202-L205 PolarHBondContact O-N 3.2Å; L205-K207 VanDerWaalsContact C-N 3.34Å; L205-F208 HydrophobicContact CD1-CD1 4.29Å; L205-F208 WeakPolarHBondContact O-CB 3.23Å; L205-F208 PolarHBondContact O-N 2.93Å; L205-L209 HydrophobicContact CD1-CD1 4.39Å; L205-L209 HydrophobicContact CD1-CG 4.49Å; L205-L209 HydrophobicContact CG-CD1 4.32Å; L205-L209 WeakPolarHBondContact O-CG 3.3Å; L205-L209 PolarHBondContact O-N 3.37Å; L205-L338 HydrophobicContact CB-CD2 4.45Å; L205-L338 HydrophobicContact CD1-CB 3.77Å
206	S	73.7	Confident	72.1	Confident	9 Å²	9	54.3 Å²	54.3	6%	0.063	27%	0.27	C	S	.	.	H	α-helix	trans	-62.3	-43.4	176.7	-176.4	0	0	0	0	111	W80 G91 L95 K202 I204 F208 L209 Y210	W80-S206 WeakPolarHBondContact CH2-OG 3.41Å; G91-S206 PolarHBondContact O-OG 3.24Å; L95-S206 WeakPolarHBondContact CD1-OG 3.36Å; K202-S206 PolarHBondContact O-N 2.69Å; I204-S206 VanDerWaalsContact C-N 3.32Å; I204-S206 PolarHBondContact O-N 2.89Å; S206-F208 VanDerWaalsContact C-N 3.35Å; S206-F208 PolarHBondContact O-N 3.22Å; S206-L209 PolarHBondContact O-N 3.02Å; S206-Y210 PolarHBondContact O-N 3.43Å
207	K	78.6	Confident	71.5	Confident	33 Å²	33	49.5 Å²	49.5	14%	0.143	27%	0.274	C	S	.	.	H	α-helix	trans	-62.2	-44	177.9	-72	172.5	-177.2	178.7	0	111.5	L73 K74 W80 A203 I204 L205 L209 Y210 Y211	L73-K207 WeakPolarHBondContact O-CD 3.37Å; K74-K207 PolarHBondContact O-NZ 3.32Å; W80-K207 HydrophobicContact CD2-CG 4.28Å; W80-K207 HydrophobicContact CE3-CG 4.21Å; W80-K207 HydrophobicContact CH2-CB 3.99Å; W80-K207 HydrophobicContact CH2-CG 3.38Å; W80-K207 HydrophobicContact CZ2-CG 3.47Å; W80-K207 VanDerWaalsContact CZ2-CG 3.47Å; W80-K207 VanDerWaalsContact CZ3-CA 3.43Å; W80-K207 HydrophobicContact CZ3-CB 4.15Å; W80-K207 HydrophobicContact CZ3-CG 3.76Å; A203-K207 VanDerWaalsContact O-CG 3.31Å; A203-K207 WeakPolarHBondContact O-CG 3.47Å; A203-K207 PolarHBondContact O-N 2.82Å; A203-K207 VanDerWaalsContact O-N 3.12Å; I204-K207 PolarHBondContact O-N 2.8Å; L205-K207 VanDerWaalsContact C-N 3.34Å; K207-L209 PolarHBondContact O-N 2.8Å; K207-Y210 PolarHBondContact O-N 2.9Å; K207-Y211 HydrophobicContact CB-CE2 4.5Å; K207-Y211 WeakPolarHBondContact O-CD2 3.22Å; K207-Y211 PolarHBondContact O-N 3.11Å
208	F	82.3	Confident	70.5	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-56.4	-46.8	174	166	-102.3	0	0	0	112.7	L67 L73 I204 L205 S206 Y211 S212 L336 L338 C368 Y378	L67-F208 HydrophobicContact CD1-CD2 3.81Å; L67-F208 HydrophobicContact CD1-CE2 4.27Å; L73-F208 HydrophobicContact CD1-CB 4.11Å; L73-F208 HydrophobicContact CD1-CD2 4.46Å; L73-F208 HydrophobicContact CD2-CB 4.03Å; I204-F208 WeakPolarHBondContact O-CB 3.43Å; I204-F208 PolarHBondContact O-N 3.04Å; L205-F208 HydrophobicContact CD1-CD1 4.29Å; L205-F208 WeakPolarHBondContact O-CB 3.23Å; L205-F208 PolarHBondContact O-N 2.93Å; S206-F208 VanDerWaalsContact C-N 3.35Å; S206-F208 PolarHBondContact O-N 3.22Å; F208-Y211 PolarHBondContact O-N 3.35Å; F208-S212 WeakPolarHBondContact O-CB 3.33Å; F208-S212 PolarHBondContact O-N 2.66Å; F208-S212 PolarHBondContact O-OG 3.19Å; F208-L336 HydrophobicContact CE1-CB 4.19Å; F208-L336 HydrophobicContact CZ-CB 4.42Å; F208-L338 HydrophobicContact CB-CD1 4.41Å; F208-L338 HydrophobicContact CB-CD2 3.9Å; F208-L338 HydrophobicContact CD1-CB 3.85Å; F208-L338 HydrophobicContact CD1-CD1 4.5Å; F208-L338 HydrophobicContact CD2-CD1 3.93Å; F208-L338 HydrophobicContact CE1-CB 4.14Å; F208-L338 HydrophobicContact CE2-CD1 4.33Å; F208-L338 HydrophobicContact CG-CB 4.17Å; F208-L338 HydrophobicContact CG-CD1 4.02Å; F208-L338 HydrophobicContact CG-CD2 4.22Å; F208-L338 HydrophobicContact CG-CG 4.35Å; F208-C368 HydrophobicContact CD2-CB 4.47Å; F208-C368 HydrophobicContact CE2-CB 3.52Å; F208-C368 HydrophobicContact CZ-CB 3.65Å; F208-Y378 HydrophobicContact CE2-CE1 4.35Å; F208-Y378 WeakPolarHBondContact CE2-OH 3.41Å
209	L	76.8	Confident	69.6	Low	14 Å²	14	45.3 Å²	45.3	7%	0.073	27%	0.268	C	S	.	.	H	α-helix	trans	-65.5	-40.3	179.4	-71.3	170.6	0	0	0	112	I94 L205 S206 K207 S212 I213 F326	I94-L209 HydrophobicContact CD1-CD1 4.17Å; I94-L209 HydrophobicContact CG2-CD1 3.69Å; L205-L209 HydrophobicContact CD1-CD1 4.39Å; L205-L209 HydrophobicContact CD1-CG 4.49Å; L205-L209 HydrophobicContact CG-CD1 4.32Å; L205-L209 WeakPolarHBondContact O-CG 3.3Å; L205-L209 PolarHBondContact O-N 3.37Å; S206-L209 PolarHBondContact O-N 3.02Å; K207-L209 PolarHBondContact O-N 2.8Å; L209-S212 PolarHBondContact O-N 2.93Å; L209-I213 WeakPolarHBondContact O-CD1 3.17Å; L209-I213 VanDerWaalsContact O-CG1 3.25Å; L209-I213 WeakPolarHBondContact O-CG1 3.23Å; L209-I213 PolarHBondContact O-N 3.03Å; L209-F326 HydrophobicContact CD2-CZ 4.41Å
210	Y	74	Confident	68.7	Low	26 Å²	26	48.2 Å²	48.2	10%	0.102	29%	0.287	C	S	.	.	H	α-helix	trans	-63.3	-46.6	175.8	-174	-81	0	0	0	112.4	P77 A78 W80 L87 S206 K207 S212 I213 N214	P77-Y210 HydrophobicContact CB-CD1 3.43Å; P77-Y210 VanDerWaalsContact CB-CD1 3.43Å; P77-Y210 HydrophobicContact CB-CE1 3.41Å; P77-Y210 VanDerWaalsContact CB-CE1 3.41Å; P77-Y210 HydrophobicContact CB-CG 4.48Å; P77-Y210 HydrophobicContact CG-CD1 3.49Å; P77-Y210 VanDerWaalsContact CG-CD1 3.49Å; P77-Y210 HydrophobicContact CG-CE1 4.02Å; P77-Y210 HydrophobicContact CG-CG 4.2Å; A78-Y210 PolarHBondContact O-OH 2.99Å; W80-Y210 HydrophobicContact CE3-CD1 4.27Å; W80-Y210 HydrophobicContact CE3-CD2 4.05Å; W80-Y210 AromaticContact CE3-CG 3.87Å; W80-Y210 HydrophobicContact CE3-CG 3.87Å; W80-Y210 VanDerWaalsContact CZ3-CB 3.46Å; W80-Y210 HydrophobicContact CZ3-CD2 4.09Å; W80-Y210 AromaticContact CZ3-CG 3.8Å; W80-Y210 HydrophobicContact CZ3-CG 3.8Å; L87-Y210 HydrophobicContact CD1-CD2 4.05Å; S206-Y210 PolarHBondContact O-N 3.43Å; K207-Y210 PolarHBondContact O-N 2.9Å; Y210-S212 PolarHBondContact O-N 2.89Å; Y210-I213 PolarHBondContact O-N 2.64Å; Y210-N214 HydrophobicContact CE1-CB 4.28Å; Y210-N214 PolarHBondContact O-N 2.82Å
211	Y	76.3	Confident	67.4	Low	24 Å²	24	47.3 Å²	47.3	9%	0.094	29%	0.291	C	S	.	.	H	α-helix	trans	-58.8	-38.8	174.3	-78.9	-59.3	0	0	0	111.8	L67 L73 L75 P77 K207 F208 I213 A219	L67-Y211 HydrophobicContact CD2-CD1 4.49Å; L67-Y211 HydrophobicContact CD2-CG 4.08Å; L73-Y211 HydrophobicContact CD2-CD2 3.82Å; L73-Y211 HydrophobicContact CD2-CE2 4.23Å; L75-Y211 PolarHBondContact O-OH 2.97Å; P77-Y211 HydrophobicContact CB-CD1 4.39Å; P77-Y211 HydrophobicContact CB-CE1 3.88Å; P77-Y211 HydrophobicContact CG-CD1 4.17Å; P77-Y211 HydrophobicContact CG-CD2 4.07Å; P77-Y211 HydrophobicContact CG-CE1 3.8Å; P77-Y211 HydrophobicContact CG-CE2 3.67Å; P77-Y211 HydrophobicContact CG-CG 4.29Å; K207-Y211 HydrophobicContact CB-CE2 4.5Å; K207-Y211 WeakPolarHBondContact O-CD2 3.22Å; K207-Y211 PolarHBondContact O-N 3.11Å; F208-Y211 PolarHBondContact O-N 3.35Å; Y211-I213 VanDerWaalsContact C-N 3.34Å; Y211-I213 PolarHBondContact O-N 2.98Å; Y211-A219 HydrophobicContact CD1-CB 4.35Å; Y211-A219 HydrophobicContact CE1-CB 4.17Å
212	S	76.7	Confident	66	Low	0 Å²	0	47.7 Å²	47.7	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-71.1	-25.8	179.9	-55.9	0	0	0	0	113.3	F64 A65 F208 L209 Y210	F64-S212 WeakPolarHBondContact CA-O 3.49Å; A65-S212 PolarHBondContact N-O 3.38Å; F208-S212 WeakPolarHBondContact O-CB 3.33Å; F208-S212 PolarHBondContact O-N 2.66Å; F208-S212 PolarHBondContact O-OG 3.19Å; L209-S212 PolarHBondContact O-N 2.93Å; Y210-S212 PolarHBondContact O-N 2.89Å
213	I	72.9	Confident	64.1	Low	28 Å²	28	51.6 Å²	51.6	14%	0.144	33%	0.329	C	S	.	.	H	α-helix	trans	-90.8	-40.5	-179.3	-67.4	160.7	0	0	0	112.1	L87 L209 Y210 Y211 F304 F326	L87-I213 HydrophobicContact CD1-CB 3.89Å; L87-I213 HydrophobicContact CD1-CD1 3.71Å; L87-I213 HydrophobicContact CD1-CG1 4.39Å; L87-I213 HydrophobicContact CD1-CG2 3.71Å; L87-I213 HydrophobicContact CG-CD1 4.19Å; L209-I213 WeakPolarHBondContact O-CD1 3.17Å; L209-I213 VanDerWaalsContact O-CG1 3.25Å; L209-I213 WeakPolarHBondContact O-CG1 3.23Å; L209-I213 PolarHBondContact O-N 3.03Å; Y210-I213 PolarHBondContact O-N 2.64Å; Y211-I213 VanDerWaalsContact C-N 3.34Å; Y211-I213 PolarHBondContact O-N 2.98Å; I213-F304 HydrophobicContact CD1-CZ 4.25Å; I213-F326 HydrophobicContact CD1-CE1 4.39Å; I213-F326 HydrophobicContact CD1-CZ 4.33Å; I213-F326 HydrophobicContact CG1-CE1 3.61Å; I213-F326 HydrophobicContact CG1-CZ 3.98Å
214	N	67.4	Low	62.3	Low	42 Å²	42	53.9 Å²	53.9	23%	0.225	34%	0.343	C	S	.	.	H	α-helix	trans	-91	-13.7	-165.5	-75.8	47.9	0	0	0	115.2	L87 Y210 D216	L87-N214 VanDerWaalsContact CD1-OD1 3.27Å; L87-N214 WeakPolarHBondContact CD1-OD1 3.47Å; Y210-N214 HydrophobicContact CE1-CB 4.28Å; Y210-N214 PolarHBondContact O-N 2.82Å; N214-D216 PolarHBondContact O-N 3.38Å
215	G	59.7	Low	60	Low	50 Å²	50	60.4 Å²	60.4	52%	0.515	38%	0.383	S	S	.	.			trans	60.5	-18.5	162	0	0	0	0	0	119.7
216	D	46.7	Very low	57.7	Low	154 Å²	154	61 Å²	61	82%	0.824	40%	0.398	S	S	*	.	S	Bend	trans	-108.9	103.8	-170.8	-81.8	-28.9	0	0	0	112.3	N214	N214-D216 PolarHBondContact O-N 3.38Å
217	G	52.2	Low	55.6	Low	87 Å²	87	69 Å²	69	90%	0.897	43%	0.434	S	S	*	.	S	Bend	trans	79	22.2	137.5	0	0	0	0	0	121.5
218	A	49	Very low	53.4	Low	45 Å²	45	75.5 Å²	75.5	37%	0.372	47%	0.465	S	S	.	.			trans	-141.1	15.5	-176.5	0	0	0	0	0	118	A78	A78-A218 HydrophobicContact CB-CB 4.14Å
219	A	50.6	Low	50.8	Low	34 Å²	34	84.2 Å²	84.2	28%	0.281	51%	0.506	S	S	.	.			trans	-104.4	87	171.3	0	0	0	0	0	109.2	L67 T71 Y211	L67-A219 HydrophobicContact CD2-CB 4.29Å; T71-A219 HydrophobicContact CG2-CB 3.68Å; Y211-A219 HydrophobicContact CD1-CB 4.35Å; Y211-A219 HydrophobicContact CE1-CB 4.17Å
220	Q	49.8	Very low	48.5	Very low	172 Å²	172	92.1 Å²	92.1	80%	0.804	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-75.4	127.4	172.9	-72.9	-158	-5.4	0	0	109.8
221	P	49.1	Very low	46.2	Very low	62 Å²	62	96.4 Å²	96.4	40%	0.403	58%	0.576	S	S	.	*	B	Isolated β-bridge	trans	-67.5	143.2	173.7	26.2	-31.7	0	0	0	110.4	S223	P221-S223 PolarHBondContact O-N 2.98Å
222	V	44.2	Very low	43.8	Very low	82 Å²	82	100.1 Å²	100.1	50%	0.497	61%	0.606	S	S	.	*	P	Polyproline II helix	trans	-65.4	120.1	176.7	-174.9	0	0	0	0	109.2	D72	D72-V222 HydrophobicContact CB-CG2 4.41Å
223	S	32.7	Very low	41.5	Very low	114 Å²	114	105.5 Å²	105.5	80%	0.797	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-66.6	137.4	175.2	48	0	0	0	0	111.2	P221	P221-S223 PolarHBondContact O-N 2.98Å
224	S	35.3	Very low	39.4	Very low	86 Å²	86	109.1 Å²	109.1	60%	0.601	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-90	135.9	178	46.2	0	0	0	0	112.1
225	T	32.3	Very low	37.5	Very low	141 Å²	141	114.5 Å²	114.5	87%	0.865	70%	0.699	S	S	*	*			trans	69.1	143.9	162.1	43.3	0	0	0	0	117.7
226	A	31.8	Very low	36.1	Very low	79 Å²	79	120.4 Å²	120.4	65%	0.653	71%	0.714	S	S	*	*			cis	-170.5	162	-4.2	0	0	0	0	0	109.9
227	E	30	Very low	35.3	Very low	176 Å²	176	118.9 Å²	118.9	82%	0.822	71%	0.71	S	S	*	*			trans	72.5	110.9	145.7	-73.5	166.6	-166.6	0	0	124.2
228	Q	32.4	Very low	34	Very low	170 Å²	170	121.6 Å²	121.6	79%	0.794	70%	0.704	S	S	*	*				37	125.3	128.9	-60.4	-176.9	-8	0	0	121.4
229	Q	27.2	Very low	32.9	Very low	183 Å²	183	126 Å²	126	86%	0.855	72%	0.721	S	S	*	*				172.9	159.1	96.9	-113.9	174.8	1.2	0	0	113.5
230	E	28	Very low	32	Very low	179 Å²	179	129.6 Å²	129.6	84%	0.836	74%	0.744	S	S	*	*			trans	-89.8	177.7	-158.1	-61.6	170.7	133	0	0	117.1
231	S	26	Very low	31.1	Very low	117 Å²	117	130.3 Å²	130.3	82%	0.818	75%	0.748	S	S	*	*			trans	114.7	133.8	146.7	73.5	0	0	0	0	115.3
232	S	26.3	Very low	30.3	Very low	102 Å²	102	130.9 Å²	130.9	71%	0.713	77%	0.765	S	S	*	*			cis	-170.3	139.1	5.5	44.3	0	0	0	0	112
233	S	27	Very low	29.4	Very low	113 Å²	113	131.8 Å²	131.8	79%	0.79	78%	0.781	S	S	*	*			trans	42.5	143.5	140.9	63.8	0	0	0	0	122.2
234	S	29.4	Very low	29.1	Very low	103 Å²	103	131 Å²	131	72%	0.72	78%	0.775	S	S	*	*				-164.3	135.5	50.5	54.2	0	0	0	0	116.9
235	D	28.8	Very low	28.6	Very low	155 Å²	155	138 Å²	138	83%	0.829	79%	0.789	S	S	*	*			trans	38.4	140.2	140.1	-62.1	-15.3	0	0	0	123.1
236	Q	30.1	Very low	28.6	Very low	174 Å²	174	137.4 Å²	137.4	81%	0.813	79%	0.787	S	S	*	*				-155	138.2	51.7	-77.7	-179.6	0.5	0	0	116.9
237	T	28.6	Very low	28.3	Very low	122 Å²	122	138 Å²	138	75%	0.748	79%	0.792	S	S	*	*			trans	61.2	117.4	139.4	64.6	0	0	0	0	126.1
238	N	26.5	Very low	28.4	Very low	144 Å²	144	135.1 Å²	135.1	77%	0.77	79%	0.788	S	S	*	*			trans	87.6	108	140.7	-78.7	21.7	0	0	0	123.8
239	D	25.3	Very low	28	Very low	137 Å²	137	137.3 Å²	137.3	73%	0.733	80%	0.796	S	S	*	*			trans	77	105.5	136.5	-71.5	-17.3	0	0	0	123
240	S	32.3	Very low	27.9	Very low	110 Å²	110	137.2 Å²	137.2	77%	0.769	80%	0.795	S	S	*	*			trans	58.9	93.7	138.2	52.3	0	0	0	0	119.4
241	E	29.1	Very low	27.9	Very low	188 Å²	188	137 Å²	137	88%	0.879	80%	0.796	S	S	*	*			trans	-136.5	118.2	153.6	-78.4	-168.2	145.7	0	0	111.6
242	G	32.4	Very low	28	Very low	73 Å²	73	137.3 Å²	137.3	75%	0.753	80%	0.796	S	S	*	*			trans	-71.5	129.4	155.7	0	0	0	0	0	108.9	S244	G242-S244 VanDerWaalsContact C-N 3.34Å; G242-S244 PolarHBondContact O-N 2.87Å
243	A	26.6	Very low	27.8	Very low	101 Å²	101	137.2 Å²	137.2	84%	0.835	80%	0.795	S	S	*	*			trans	-69.6	90.7	-176.7	0	0	0	0	0	111.9
244	S	26.8	Very low	27.8	Very low	97 Å²	97	136.9 Å²	136.9	68%	0.678	79%	0.793	S	S	*	*			trans	-9	122.4	141.6	39.8	0	0	0	0	117.7	G242	G242-S244 VanDerWaalsContact C-N 3.34Å; G242-S244 PolarHBondContact O-N 2.87Å
245	W	24.4	Very low	27.6	Very low	234 Å²	234	138 Å²	138	89%	0.886	80%	0.795	S	S	*	*			trans	-60.5	145.1	146.8	-71.5	77.6	0	0	0	109.7
246	P	31	Very low	27.5	Very low	128 Å²	128	135 Å²	135	83%	0.831	79%	0.787	S	S	*	*			trans	-70.4	134.4	167	-9.8	25.9	0	0	0	110.2
247	A	26.2	Very low	27.4	Very low	91 Å²	91	136.1 Å²	136.1	75%	0.752	79%	0.791	S	S	*	*			trans	-89.3	-161.1	-177.3	0	0	0	0	0	111.4
248	P	32.4	Very low	27.1	Very low	116 Å²	116	137.9 Å²	137.9	75%	0.753	80%	0.796	S	S	*	*				-113.9	161.4	-111.4	24.5	-2.5	0	0	0	114	E250	P248-E250 PolarHBondContact O-N 3.17Å
249	F	24.3	Very low	27.8	Very low	217 Å²	217	136.2 Å²	136.2	95%	0.952	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-72.5	116.4	167.4	-96.4	-92.9	0	0	0	110.4
250	E	25	Very low	27.8	Very low	181 Å²	181	134.9 Å²	134.9	85%	0.846	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-75.3	137.3	163.7	-75.2	178.6	151.7	0	0	110.5	P248	P248-E250 PolarHBondContact O-N 3.17Å
251	M	26.9	Very low	27.4	Very low	173 Å²	173	134.2 Å²	134.2	85%	0.852	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-75.1	154.3	163	-76.3	-92.1	-68.4	0	0	110.1
252	P	28.5	Very low	27.3	Very low	125 Å²	125	130.3 Å²	130.3	81%	0.812	79%	0.79	S	S	*	*			trans	-116.2	142	143.6	8.9	11	0	0	0	112.5
253	S	23.1	Very low	26.9	Very low	99 Å²	99	131.6 Å²	131.6	69%	0.692	79%	0.787	S	S	*	*			trans	-100.5	146	168.5	48.7	0	0	0	0	111.1
254	S	26.4	Very low	26.9	Very low	107 Å²	107	135.9 Å²	135.9	75%	0.748	79%	0.79	S	S	*	*			trans	50.4	139.1	147.3	66.1	0	0	0	0	119
255	V	25.6	Very low	26.7	Very low	125 Å²	125	134.6 Å²	134.6	76%	0.758	79%	0.791	S	S	*	*				-170.6	152.2	51.8	-159.1	0	0	0	0	109.2
256	S	26.1	Very low	26.7	Very low	94 Å²	94	129.5 Å²	129.5	66%	0.657	79%	0.791	S	S	*	*			trans	67.7	128.1	139.2	48	0	0	0	0	125.2
257	E	27.7	Very low	26.3	Very low	196 Å²	196	131.7 Å²	131.7	92%	0.916	79%	0.791	S	S	*	*			trans	81.1	114.4	132.8	-67.6	179.6	-178.9	0	0	121.7
258	D	23.7	Very low	26.4	Very low	159 Å²	159	132.4 Å²	132.4	85%	0.85	79%	0.788	S	S	*	*			trans	-50.2	178.4	157.6	-102.3	-26.4	0	0	0	114.2
259	P	39.7	Very low	25.9	Very low	109 Å²	109	134 Å²	134	71%	0.708	79%	0.789	S	S	*	*			cis	-140.3	179.7	8.4	26.2	-0.5	0	0	0	116.9
260	S	25.1	Very low	25.9	Very low	109 Å²	109	131.8 Å²	131.8	76%	0.762	78%	0.782	S	S	*	*			trans	110.1	120.7	136.8	74.5	0	0	0	0	121.5
261	A	24.9	Very low	25.9	Very low	97 Å²	97	128.6 Å²	128.6	80%	0.802	78%	0.777	S	S	*	*			trans	56.5	137.7	141.5	0	0	0	0	0	119.3
262	S	26.6	Very low	25.6	Very low	106 Å²	106	125 Å²	125	74%	0.741	77%	0.769	S	S	*	*			cis	-175.6	147.8	34.3	46	0	0	0	0	111.1
263	S	24.5	Very low	25.3	Very low	99 Å²	99	128.2 Å²	128.2	69%	0.692	77%	0.766	S	S	*	*			trans	26.3	126.8	140.5	68.4	0	0	0	0	122.5
264	Q	27.1	Very low	25.3	Very low	192 Å²	192	132 Å²	132	90%	0.897	78%	0.776	S	S	*	*				160.2	135.5	98.7	-85.2	-161.5	-19.4	0	0	109.8
265	G	22.1	Very low	25.2	Very low	69 Å²	69	132.7 Å²	132.7	71%	0.711	78%	0.776	S	S	*	*			trans	-93.4	179.8	-175	0	0	0	0	0	114.6
266	S	24.3	Very low	25.1	Very low	127 Å²	127	129.8 Å²	129.8	89%	0.888	77%	0.772	S	S	*	*			trans	-167	135.2	141.5	-7.3	0	0	0	0	110.2
267	E	22	Very low	25	Very low	174 Å²	174	133.8 Å²	133.8	81%	0.813	78%	0.78	S	S	*	*			trans	-31.6	161.8	163.6	-108.2	-176.5	-144.6	0	0	117.5
268	P	27.8	Very low	24.9	Very low	107 Å²	107	130.9 Å²	130.9	70%	0.695	78%	0.775	S	S	*	*				-154	150.3	77.5	31.4	-7.3	0	0	0	120.1
269	L	23.1	Very low	24.8	Very low	149 Å²	149	127.8 Å²	127.8	78%	0.78	77%	0.771	S	S	*	*			trans	68.9	111.5	134.6	-60.7	165.2	0	0	0	120.5
270	E	22.8	Very low	24.1	Very low	171 Å²	171	128.1 Å²	128.1	80%	0.799	78%	0.776	S	S	*	*			trans	-75.7	157.1	140.6	-81	-156.9	163.4	0	0	110.5
271	P	26.1	Very low	24	Very low	113 Å²	113	127.2 Å²	127.2	73%	0.734	78%	0.775	S	S	*	*				-143.8	140	108.9	32.5	-15.6	0	0	0	116.3
272	S	20.8	Very low	24	Very low	98 Å²	98	128.9 Å²	128.9	69%	0.685	78%	0.778	S	S	*	*				88.6	113.8	129.2	71.9	0	0	0	0	121.5
273	Y	21.8	Very low	23.8	Very low	193 Å²	193	133.6 Å²	133.6	76%	0.757	79%	0.785	S	S	*	*			trans	-33.2	141.2	151.9	-74	-96.7	0	0	0	117.8	V275	Y273-V275 HydrophobicContact CD1-CG2 4.02Å
274	I	23.7	Very low	24	Very low	177 Å²	177	136.3 Å²	136.3	91%	0.908	79%	0.787	S	S	*	*			trans	-134.7	121	131.2	-65.8	-175.3	0	0	0	108.9
275	V	24.9	Very low	24	Very low	122 Å²	122	135.1 Å²	135.1	74%	0.739	78%	0.781	S	S	*	*			trans	-89.1	143.1	171.1	168.6	0	0	0	0	109.4	Y273	Y273-V275 HydrophobicContact CD1-CG2 4.02Å
276	G	23	Very low	24.1	Very low	65 Å²	65	138.3 Å²	138.3	67%	0.67	78%	0.782	S	S	*	*			trans	175.6	83.3	165.8	0	0	0	0	0	118
277	H	23.8	Very low	24.2	Very low	178 Å²	178	138.9 Å²	138.9	82%	0.824	78%	0.775	S	S	*	*			trans	76.2	96.8	145.2	-73.2	91.1	0	0	0	123.4
278	V	24.5	Very low	24.3	Very low	135 Å²	135	135 Å²	135	82%	0.818	76%	0.763	S	S	*	*				41.6	113.2	114.9	-172.3	0	0	0	0	120.2
279	A	22.7	Very low	24.3	Very low	94 Å²	94	134.1 Å²	134.1	78%	0.777	76%	0.755	S	S	*	*			trans	-159.7	101.2	133.3	0	0	0	0	0	112
280	S	24.5	Very low	24.5	Very low	116 Å²	116	134.4 Å²	134.4	81%	0.811	76%	0.757	S	S	*	*			trans	31.1	110.5	143.4	59.6	0	0	0	0	123
281	A	23.6	Very low	24.8	Very low	89 Å²	89	132.7 Å²	132.7	74%	0.736	75%	0.747	S	S	*	*				-167.8	135.2	128.5	0	0	0	0	0	109.2	K283	A281-K283 PolarHBondContact O-N 2.84Å
282	P	23.9	Very low	24.8	Very low	133 Å²	133	129.7 Å²	129.7	86%	0.864	73%	0.725	S	S	*	*			trans	-77.3	115.7	-173.4	31.2	-31	0	0	0	110.5	E284	P282-E284 PolarHBondContact O-N 3.41Å
283	K	23.8	Very low	25.1	Very low	205 Å²	205	133.5 Å²	133.5	89%	0.891	74%	0.738	S	S	*	*			trans	-75.1	115.8	167.5	-79.2	178.9	174.7	178.9	0	109.2	A281	A281-K283 PolarHBondContact O-N 2.84Å
284	E	28.3	Very low	25.5	Very low	155 Å²	155	126.6 Å²	126.6	72%	0.724	73%	0.725	S	S	*	*			trans	-59.7	160.9	150	-67.2	-175.4	150.2	0	0	109.7	P282	P282-E284 PolarHBondContact O-N 3.41Å
285	Q	26.5	Very low	25.6	Very low	167 Å²	167	124.8 Å²	124.8	78%	0.78	71%	0.713	S	S	*	*			trans	94.6	124.3	176.5	-50.9	167.1	2.4	0	0	113.4
286	N	23.4	Very low	25.5	Very low	136 Å²	136	128.3 Å²	128.3	73%	0.727	72%	0.721	S	S	*	*				-142.8	119.3	65	-70.9	-51.1	0	0	0	114.2
287	L	27.6	Very low	25.7	Very low	140 Å²	140	128.8 Å²	128.8	73%	0.733	71%	0.713	S	S	*	*			trans	-109.9	78.3	150.6	-104.9	159.8	0	0	0	106.3
288	T	24.2	Very low	25.9	Very low	92 Å²	92	130.1 Å²	130.1	56%	0.564	72%	0.72	S	S	*	*			trans	-86.8	137.2	162.8	17.4	0	0	0	0	106.5
289	T	27.5	Very low	26	Very low	88 Å²	88	126.9 Å²	126.9	54%	0.54	71%	0.714	S	S	.	*			cis	-166.2	111.6	13.4	33.5	0	0	0	0	106	N292	T289-N292 HydrophobicContact CG2-CB 3.51Å
290	L	27.1	Very low	26.3	Very low	155 Å²	155	128 Å²	128	81%	0.812	71%	0.707	S	S	*	*	S	Bend	trans	-128.6	-5.4	166	-89.8	168.4	0	0	0	113.1
291	F	29.6	Very low	27	Very low	136 Å²	136	130.5 Å²	130.5	60%	0.596	70%	0.703	S	S	*	*	S	Bend	trans	-128.9	17.8	172.2	-69.1	-81.6	0	0	0	112.3	D293 M454 P455 I458	F291-D293 VanDerWaalsContact C-N 3.35Å; F291-D293 PolarHBondContact O-N 2.95Å; F291-M454 HydrophobicContact CZ-CG 3.94Å; F291-P455 HydrophobicContact CE1-CG 4.43Å; F291-I458 HydrophobicContact CD2-CD1 4.13Å; F291-I458 HydrophobicContact CE2-CD1 3.19Å; F291-I458 HydrophobicContact CZ-CD1 3.68Å
292	N	26.5	Very low	28.2	Very low	49 Å²	49	128.6 Å²	128.6	26%	0.262	68%	0.68	S	S	.	*			trans	-98.2	50.1	-176.8	-136.7	4.5	0	0	0	112.8	T289 G294 E295	T289-N292 HydrophobicContact CG2-CB 3.51Å; N292-G294 PolarHBondContact O-N 3.36Å; N292-E295 WeakPolarHBondContact ND2-CB 3.45Å; N292-E295 PolarHBondContact ND2-OE2 3.44Å; N292-E295 VanDerWaalsContact OD1-CB 3.24Å; N292-E295 WeakPolarHBondContact OD1-CB 3.32Å; N292-E295 WeakPolarHBondContact OD1-CG 3.32Å; N292-E295 PolarHBondContact OD1-N 3.38Å; N292-E295 PolarHBondContact OD1-OE2 3.45Å
293	D	25.7	Very low	29.7	Very low	179 Å²	179	123.4 Å²	123.4	96%	0.957	65%	0.645	S	S	*	*	S	Bend	trans	-79.9	20.6	160.3	-82	-19	0	0	0	111.6	F291	F291-D293 VanDerWaalsContact C-N 3.35Å; F291-D293 PolarHBondContact O-N 2.95Å
294	G	30.4	Very low	31.7	Very low	47 Å²	47	114.7 Å²	114.7	49%	0.485	61%	0.607	S	S	.	*	S	Bend	trans	-115.3	-30.7	175.2	0	0	0	0	0	115	N292 H296 S297	N292-G294 PolarHBondContact O-N 3.36Å; G294-H296 PolarHBondContact O-N 2.77Å; G294-S297 PolarHBondContact O-OG 2.74Å
295	E	25.7	Very low	34.1	Very low	140 Å²	140	108.3 Å²	108.3	65%	0.654	58%	0.579	S	S	*	*	S	Bend	trans	-103.9	49.8	-172.7	-61.5	179.7	156.1	0	0	113.9	N292	N292-E295 WeakPolarHBondContact ND2-CB 3.45Å; N292-E295 PolarHBondContact ND2-OE2 3.44Å; N292-E295 VanDerWaalsContact OD1-CB 3.24Å; N292-E295 WeakPolarHBondContact OD1-CB 3.32Å; N292-E295 WeakPolarHBondContact OD1-CG 3.32Å; N292-E295 PolarHBondContact OD1-N 3.38Å; N292-E295 PolarHBondContact OD1-OE2 3.45Å
296	H	23.6	Very low	36.7	Very low	196 Å²	196	101.3 Å²	101.3	91%	0.907	55%	0.545	S	S	*	.	S	Bend	trans	-128.5	56	144.1	-82.4	-64.4	0	0	0	108.9	G294	G294-H296 PolarHBondContact O-N 2.77Å
297	S	27.7	Very low	39.7	Very low	74 Å²	74	95.1 Å²	95.1	52%	0.517	51%	0.512	S	S	.	.			trans	-132.6	83.2	157.7	53.7	0	0	0	0	108.4	G294 G299	G294-S297 PolarHBondContact O-OG 2.74Å; S297-G299 VanDerWaalsContact C-N 3.34Å; S297-G299 PolarHBondContact O-N 3.06Å
298	Q	26.4	Very low	42.6	Very low	207 Å²	207	88.5 Å²	88.5	97%	0.967	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	105.4	156.2	-85.7	177.5	-23.8	0	0	107.4
299	G	26.4	Very low	45.7	Very low	67 Å²	67	86.1 Å²	86.1	69%	0.691	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.5	57	156.9	0	0	0	0	0	118.6	S297	S297-G299 VanDerWaalsContact C-N 3.34Å; S297-G299 PolarHBondContact O-N 3.06Å
300	L	30.7	Very low	48.8	Very low	118 Å²	118	81.9 Å²	81.9	62%	0.618	44%	0.435	S	S	*	.			trans	-127.7	89.1	160.4	-71.1	170.4	0	0	0	110.9	P89	P89-L300 HydrophobicContact CG-CB 4.44Å; P89-L300 HydrophobicContact CG-CD2 3.74Å
301	K	39.2	Very low	51.7	Low	167 Å²	167	75.1 Å²	75.1	73%	0.726	40%	0.4	S	S	*	.			trans	-68.8	125.1	177.5	-70.4	178.9	175.7	179.3	0	110.7	P89 D303	P89-K301 WeakPolarHBondContact CD-O 3.4Å; K301-D303 WeakPolarHBondContact CB-OD1 3.46Å
302	N	48.1	Very low	54.5	Low	50 Å²	50	68.8 Å²	68.8	27%	0.267	37%	0.372	S	S	.	.			trans	-86.9	110.3	160.8	-79.2	-30.2	0	0	0	108.3	S57 F304 V305	S57-N302 PolarHBondContact OG-O 3.2Å; N302-F304 VanDerWaalsContact C-N 3.33Å; N302-F304 PolarHBondContact O-N 2.98Å; N302-V305 HydrophobicContact CB-CG2 3.66Å
303	D	56.5	Low	57.3	Low	23 Å²	23	68.6 Å²	68.6	12%	0.123	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	4	-163.5	-64.4	-28.6	0	0	0	115.7	A58 P59 G88 A90 K301	A58-D303 VanDerWaalsContact CA-O 3.25Å; A58-D303 WeakPolarHBondContact CA-O 3.28Å; P59-D303 WeakPolarHBondContact CD-O 3.37Å; G88-D303 PolarHBondContact N-OD2 3.41Å; A90-D303 HydrophobicContact CB-CB 4.31Å; K301-D303 WeakPolarHBondContact CB-OD1 3.46Å
304	F	65.3	Low	60	Low	23 Å²	23	64.9 Å²	64.9	10%	0.101	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-136.3	11.3	-178.8	-59.4	-71.8	0	0	0	115.4	A90 I94 I213 N302 R306 N322 P324	A90-F304 HydrophobicContact CB-CD2 4.1Å; A90-F304 HydrophobicContact CB-CE2 4.03Å; I94-F304 HydrophobicContact CD1-CE2 4.42Å; I213-F304 HydrophobicContact CD1-CZ 4.25Å; N302-F304 VanDerWaalsContact C-N 3.33Å; N302-F304 PolarHBondContact O-N 2.98Å; F304-R306 PolarHBondContact O-N 3.41Å; F304-N322 VanDerWaalsContact CB-O 3.26Å; F304-N322 WeakPolarHBondContact CB-O 3.4Å; F304-P324 HydrophobicContact CD1-CB 4.39Å; F304-P324 HydrophobicContact CD2-CG 4.45Å; F304-P324 HydrophobicContact CE1-CB 4.46Å; F304-P324 HydrophobicContact CG-CG 4.49Å
305	V	77.2	Confident	62.8	Low	20 Å²	20	62.9 Å²	62.9	12%	0.121	33%	0.328	C	S	.	.			trans	-71.4	127.6	-176.5	170.6	0	0	0	0	110.5	S57 F104 N302	S57-V305 PolarHBondContact N-O 2.62Å; S57-V305 WeakPolarHBondContact OG-CB 3.28Å; S57-V305 PolarHBondContact OG-N 3.05Å; S57-V305 PolarHBondContact OG-O 2.68Å; F104-V305 HydrophobicContact CE1-CG1 3.52Å; F104-V305 HydrophobicContact CZ-CB 4.23Å; F104-V305 HydrophobicContact CZ-CG1 3.7Å; F104-V305 HydrophobicContact CZ-CG2 4.22Å; N302-V305 HydrophobicContact CB-CG2 3.66Å
306	R	82.7	Confident	65.8	Low	20 Å²	20	59.5 Å²	59.5	8%	0.075	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	140.1	174.7	-56.3	-171.8	-168.1	85.4	0.2	111	Y55 F304 I308 G320 S321 M323	Y55-R306 CarbonylContact O-C 3.54Å; Y55-R306 VanDerWaalsContact O-CA 3.28Å; Y55-R306 WeakPolarHBondContact O-CA 3.47Å; F304-R306 PolarHBondContact O-N 3.41Å; R306-I308 HydrophobicContact CB-CD1 4.31Å; R306-I308 HydrophobicContact CB-CG1 4.17Å; R306-G320 WeakPolarHBondContact O-CA 3.25Å; R306-S321 PolarHBondContact N-O 3.02Å; R306-S321 PolarHBondContact O-N 3.09Å; R306-M323 PolarHBondContact NH1-O 2.76Å
307	N	85.9	Confident	69	Low	7 Å²	7	50.7 Å²	50.7	4%	0.037	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	123.1	168.8	-64.3	-48.2	0	0	0	108.4	K54 Y55 F113	K54-N307 PolarHBondContact N-O 3.25Å; Y55-N307 PolarHBondContact N-O 3.49Å; Y55-N307 PolarHBondContact O-N 2.74Å; F113-N307 HydrophobicContact CD2-CB 4.48Å; F113-N307 HydrophobicContact CE2-CB 3.59Å; F113-N307 WeakPolarHBondContact CE2-ND2 3.31Å; F113-N307 HydrophobicContact CZ-CB 3.85Å
308	I	88.9	Confident	72.1	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	127.2	-166.2	-55	162.2	0	0	0	109.2	A51 V53 R306 W310 V319 I359	A51-I308 HydrophobicContact CB-CG2 3.77Å; V53-I308 HydrophobicContact CG2-CG1 4.43Å; R306-I308 HydrophobicContact CB-CD1 4.31Å; R306-I308 HydrophobicContact CB-CG1 4.17Å; I308-W310 PolarHBondContact O-N 3.41Å; I308-V319 PolarHBondContact N-O 3.35Å; I308-V319 PolarHBondContact O-N 2.83Å; I308-I359 HydrophobicContact CD1-CG2 4.19Å; I308-I359 WeakPolarHBondContact CG2-O 3.34Å
309	L	88.7	Confident	75.1	Confident	41 Å²	41	37.4 Å²	37.4	22%	0.215	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	101.8	167.2	-171	74.2	0	0	0	108.1	V52 K54 V121 M317	V52-L309 PolarHBondContact N-O 3.41Å; V52-L309 PolarHBondContact O-N 2.99Å; K54-L309 HydrophobicContact CG-CB 4.27Å; V121-L309 HydrophobicContact CG2-CD1 3.7Å; L309-M317 CarbonylContact C-O 3.54Å; L309-M317 WeakPolarHBondContact CA-O 3.47Å
310	W	92.1	Very high	78.1	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	117.9	-177.8	-175.8	40.5	0	0	0	110.3	S49 I130 I308 F312 M317 V319 L355 L358 I359	S49-W310 PolarHBondContact OG-NE1 3.36Å; I130-W310 HydrophobicContact CG2-CZ3 4.01Å; I308-W310 PolarHBondContact O-N 3.41Å; W310-F312 HydrophobicContact CD2-CB 4.23Å; W310-F312 HydrophobicContact CE3-CB 4.46Å; W310-F312 HydrophobicContact CH2-CB 4.07Å; W310-F312 AromaticContact CH2-CD2 3.91Å; W310-F312 HydrophobicContact CH2-CD2 3.91Å; W310-F312 HydrophobicContact CH2-CE2 4.47Å; W310-F312 AromaticContact CH2-CG 3.95Å; W310-F312 HydrophobicContact CH2-CG 3.95Å; W310-F312 HydrophobicContact CZ2-CB 3.8Å; W310-F312 AromaticContact CZ2-CD2 3.34Å; W310-F312 HydrophobicContact CZ2-CD2 3.34Å; W310-F312 HydrophobicContact CZ2-CE2 4.06Å; W310-F312 AromaticContact CZ2-CG 3.74Å; W310-F312 HydrophobicContact CZ2-CG 3.74Å; W310-F312 HydrophobicContact CZ3-CB 4.38Å; W310-M317 HydrophobicContact CE3-SD 3.8Å; W310-M317 HydrophobicContact CZ3-SD 3.92Å; W310-M317 PolarHBondContact N-O 3.29Å; W310-M317 PolarHBondContact O-N 3.32Å; W310-V319 HydrophobicContact CB-CG2 4.39Å; W310-V319 HydrophobicContact CE3-CG2 4.22Å; W310-L355 HydrophobicContact CH2-CD2 4.18Å; W310-L358 HydrophobicContact CZ2-CB 4.22Å; W310-I359 HydrophobicContact CD2-CG1 3.86Å; W310-I359 HydrophobicContact CE3-CD1 4.48Å; W310-I359 HydrophobicContact CE3-CG1 3.69Å; W310-I359 HydrophobicContact CH2-CD1 4.46Å; W310-I359 HydrophobicContact CH2-CG1 3.84Å; W310-I359 HydrophobicContact CZ2-CG1 4Å; W310-I359 HydrophobicContact CZ3-CD1 4.18Å; W310-I359 HydrophobicContact CZ3-CG1 3.69Å
311	T	89.5	Confident	80.8	Confident	13 Å²	13	28.7 Å²	28.7	8%	0.08	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	111.4	168.6	-54.9	0	0	0	0	108.2	S49 R50 E313 I315 H316	S49-T311 WeakPolarHBondContact CA-O 3.43Å; R50-T311 PolarHBondContact N-O 3.13Å; R50-T311 PolarHBondContact O-N 2.61Å; T311-E313 WeakPolarHBondContact CG2-O 3.12Å; T311-I315 WeakPolarHBondContact CA-O 3.3Å; T311-H316 WeakPolarHBondContact CG2-ND1 3.49Å; T311-H316 PolarHBondContact OG1-ND1 3.43Å; T311-H316 VanDerWaalsContact OG1-ND1 3.13Å
312	F	88	Confident	82.7	Confident	2 Å²	2	23 Å²	23	1%	0.009	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	105.1	174.2	-173.3	-112.1	0	0	0	107.6	V47 W310 D314 I315 W354 L358 K400 A403	V47-F312 HydrophobicContact CG1-CD2 4.09Å; V47-F312 HydrophobicContact CG1-CE1 4.47Å; V47-F312 HydrophobicContact CG1-CE2 3.35Å; V47-F312 HydrophobicContact CG1-CZ 3.59Å; W310-F312 HydrophobicContact CD2-CB 4.23Å; W310-F312 HydrophobicContact CE3-CB 4.46Å; W310-F312 HydrophobicContact CH2-CB 4.07Å; W310-F312 AromaticContact CH2-CD2 3.91Å; W310-F312 HydrophobicContact CH2-CD2 3.91Å; W310-F312 HydrophobicContact CH2-CE2 4.47Å; W310-F312 AromaticContact CH2-CG 3.95Å; W310-F312 HydrophobicContact CH2-CG 3.95Å; W310-F312 HydrophobicContact CZ2-CB 3.8Å; W310-F312 AromaticContact CZ2-CD2 3.34Å; W310-F312 HydrophobicContact CZ2-CD2 3.34Å; W310-F312 HydrophobicContact CZ2-CE2 4.06Å; W310-F312 AromaticContact CZ2-CG 3.74Å; W310-F312 HydrophobicContact CZ2-CG 3.74Å; W310-F312 HydrophobicContact CZ3-CB 4.38Å; F312-D314 PolarHBondContact O-N 2.81Å; F312-D314 VanDerWaalsContact O-N 3.11Å; F312-I315 PolarHBondContact N-O 3.02Å; F312-I315 WeakPolarHBondContact O-CB 3.26Å; F312-I315 PolarHBondContact O-N 3.38Å; F312-W354 HydrophobicContact CE2-CH2 4.17Å; F312-W354 HydrophobicContact CZ-CH2 4.16Å; F312-L358 HydrophobicContact CE2-CD1 4.2Å; F312-K400 HydrophobicContact CE1-CB 4.36Å; F312-A403 HydrophobicContact CD1-CB 4.16Å; F312-A403 HydrophobicContact CE1-CB 3.98Å
313	E	85.3	Confident	84.3	Confident	45 Å²	45	21.3 Å²	21.3	21%	0.21	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	-106.4	-168.6	-63.9	-81.6	162.8	0	0	112.1	V47 K48 T311 K400	V47-E313 VanDerWaalsContact CA-OE1 3.24Å; V47-E313 WeakPolarHBondContact CA-OE1 3.41Å; V47-E313 HydrophobicContact CG1-CG 3.95Å; V47-E313 WeakPolarHBondContact CG1-OE1 3.48Å; K48-E313 PolarHBondContact N-OE1 2.91Å; K48-E313 PolarHBondContact O-N 3.27Å; T311-E313 WeakPolarHBondContact CG2-O 3.12Å; E313-K400 VanDerWaalsContact CD-NZ 3.26Å; E313-K400 HydrophobicContact CG-CD 3.7Å; E313-K400 HydrophobicContact CG-CG 4.05Å; E313-K400 IonicContact OE1-NZ 3.45Å; E313-K400 IonicContact OE2-NZ 2.7Å; E313-K400 PolarHBondContact OE2-NZ 3.42Å
314	D	82.6	Confident	85.3	Confident	101 Å²	101	21.2 Å²	21.2	54%	0.54	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	3.7	-179.8	60.4	-36.4	0	0	0	112.9	F312 Q404	F312-D314 PolarHBondContact O-N 2.81Å; F312-D314 VanDerWaalsContact O-N 3.11Å; D314-Q404 PolarHBondContact OD1-NE2 3.2Å
315	I	87.4	Confident	86	Confident	6 Å²	6	20.9 Å²	20.9	3%	0.031	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	123.2	-177.5	-52.6	173.9	0	0	0	110.3	D122 T311 F312 M317 A403 Q404 L407	D122-I315 HydrophobicContact CB-CG2 4.42Å; T311-I315 WeakPolarHBondContact CA-O 3.3Å; F312-I315 PolarHBondContact N-O 3.02Å; F312-I315 WeakPolarHBondContact O-CB 3.26Å; F312-I315 PolarHBondContact O-N 3.38Å; I315-M317 HydrophobicContact CB-CE 4.07Å; I315-M317 HydrophobicContact CD1-CE 4.32Å; I315-M317 HydrophobicContact CG2-CE 3.38Å; I315-M317 HydrophobicContact CG2-CG 3.84Å; I315-M317 HydrophobicContact CG2-SD 4.48Å; I315-A403 HydrophobicContact CD1-CB 4.08Å; I315-Q404 HydrophobicContact CD1-CG 4.12Å; I315-L407 HydrophobicContact CB-CD2 4.23Å; I315-L407 HydrophobicContact CD1-CD2 3.94Å; I315-L407 HydrophobicContact CG1-CD2 3.87Å; I315-L407 HydrophobicContact CG2-CD2 3.4Å
316	H	89.7	Confident	86.1	Confident	69 Å²	69	20.2 Å²	20.2	32%	0.319	10%	0.103	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	116.6	177.1	-59.8	-52.7	0	0	0	111.2	D122 V123 T311	D122-H316 WeakPolarHBondContact CA-O 3.24Å; D122-H316 WeakPolarHBondContact CB-O 3.44Å; D122-H316 PolarHBondContact N-O 2.68Å; D122-H316 PolarHBondContact OD2-N 2.94Å; V123-H316 PolarHBondContact N-O 2.83Å; T311-H316 WeakPolarHBondContact CG2-ND1 3.49Å; T311-H316 PolarHBondContact OG1-ND1 3.43Å; T311-H316 VanDerWaalsContact OG1-ND1 3.13Å
317	M	91.4	Very high	85.6	Confident	10 Å²	10	19.4 Å²	19.4	5%	0.049	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	142	-177.5	-51	-173.6	-175.9	0	0	111.5	V123 I130 L309 W310 I315 V319	V123-M317 HydrophobicContact CB-CG 4.18Å; V123-M317 CarbonylContact O-C 3.13Å; V123-M317 VanDerWaalsContact O-CA 3.29Å; V123-M317 WeakPolarHBondContact O-CA 3.31Å; I130-M317 HydrophobicContact CD1-SD 4.25Å; I130-M317 HydrophobicContact CG2-SD 4.17Å; L309-M317 CarbonylContact C-O 3.54Å; L309-M317 WeakPolarHBondContact CA-O 3.47Å; W310-M317 HydrophobicContact CE3-SD 3.8Å; W310-M317 HydrophobicContact CZ3-SD 3.92Å; W310-M317 PolarHBondContact N-O 3.29Å; W310-M317 PolarHBondContact O-N 3.32Å; I315-M317 HydrophobicContact CB-CE 4.07Å; I315-M317 HydrophobicContact CD1-CE 4.32Å; I315-M317 HydrophobicContact CG2-CE 3.38Å; I315-M317 HydrophobicContact CG2-CG 3.84Å; I315-M317 HydrophobicContact CG2-SD 4.48Å; M317-V319 HydrophobicContact CB-CG2 3.69Å
318	L	91.8	Very high	84.6	Confident	1 Å²	1	21.3 Å²	21.3	1%	0.005	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	109.9	164.8	178.7	66	0	0	0	108.4	M109 F113 V121 V123 V124 S125	M109-L318 HydrophobicContact CE-CD2 4.48Å; M109-L318 HydrophobicContact CE-CG 3.91Å; M109-L318 WeakPolarHBondContact CE-O 3.42Å; F113-L318 HydrophobicContact CB-CD2 3.77Å; F113-L318 HydrophobicContact CD2-CD1 4.42Å; F113-L318 HydrophobicContact CD2-CD2 3.92Å; F113-L318 HydrophobicContact CG-CD2 4.09Å; V121-L318 HydrophobicContact CG1-CB 4Å; V123-L318 PolarHBondContact O-N 2.77Å; V124-L318 WeakPolarHBondContact CA-O 3.43Å; V124-L318 HydrophobicContact CG1-CB 4.42Å; V124-L318 HydrophobicContact CG1-CD2 4.11Å; V124-L318 HydrophobicContact CG1-CG 4.44Å; V124-L318 HydrophobicContact CG2-CB 4.18Å; V124-L318 HydrophobicContact CG2-CD2 4.35Å; S125-L318 PolarHBondContact N-O 3.25Å; S125-L318 VanDerWaalsContact N-O 3.09Å
319	V	90.7	Very high	83.3	Confident	1 Å²	1	25.3 Å²	25.3	1%	0.006	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	128.3	-169.3	-173.4	0	0	0	0	111.5	S125 S127 I130 I308 W310 M317 I359	S125-V319 VanDerWaalsContact O-CA 3.3Å; S125-V319 WeakPolarHBondContact O-CA 3.03Å; S127-V319 VanDerWaalsContact CA-CG1 3.42Å; I130-V319 HydrophobicContact CG1-CG2 4.42Å; I308-V319 PolarHBondContact N-O 3.35Å; I308-V319 PolarHBondContact O-N 2.83Å; W310-V319 HydrophobicContact CB-CG2 4.39Å; W310-V319 HydrophobicContact CE3-CG2 4.22Å; M317-V319 HydrophobicContact CB-CG2 3.69Å; V319-I359 HydrophobicContact CB-CG2 4.22Å; V319-I359 HydrophobicContact CG1-CG2 3.88Å
320	G	88.6	Confident	81.5	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	128.8	173.2	0	0	0	0	0	110.5	F104 S125 D126 S127 R306	F104-G320 VanDerWaalsContact CD1-CA 3.45Å; F104-G320 VanDerWaalsContact CE1-CA 3.47Å; S125-G320 PolarHBondContact O-N 3.36Å; S125-G320 VanDerWaalsContact O-N 3.08Å; D126-G320 VanDerWaalsContact OD1-O 3.13Å; S127-G320 WeakPolarHBondContact CB-O 3.19Å; S127-G320 PolarHBondContact N-O 2.82Å; S127-G320 PolarHBondContact OG-O 3.13Å; R306-G320 WeakPolarHBondContact O-CA 3.25Å
321	S	86.4	Confident	80	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.014	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	136.9	176.2	-175.6	0	0	0	0	112.2	F104 R306 M323	F104-S321 VanDerWaalsContact CZ-N 3.28Å; F104-S321 VanDerWaalsContact CZ-O 3.31Å; F104-S321 WeakPolarHBondContact CZ-O 3.45Å; R306-S321 PolarHBondContact N-O 3.02Å; R306-S321 PolarHBondContact O-N 3.09Å; S321-M323 WeakPolarHBondContact OG-CB 3.28Å; S321-M323 PolarHBondContact OG-N 3.07Å
322	N	79.6	Confident	78.9	Confident	49 Å²	49	43.2 Å²	43.2	26%	0.262	24%	0.24	S	C	.	.			trans	-98.8	0.3	176.1	131.4	-39.9	0	0	0	112.5	F104 F304 P324	F104-N322 HydrophobicContact CE2-CB 3.83Å; F104-N322 HydrophobicContact CZ-CB 4.33Å; F304-N322 VanDerWaalsContact CB-O 3.26Å; F304-N322 WeakPolarHBondContact CB-O 3.4Å; N322-P324 WeakPolarHBondContact O-CD 3.32Å
323	M	81.8	Confident	78.8	Confident	14 Å²	14	43.2 Å²	43.2	7%	0.069	24%	0.24	C	C	.	.			trans	-55.6	124.2	-170.1	-174.6	-175.8	-178.7	0	0	112.6	R306 S321 I325 D356 N357 C360	R306-M323 PolarHBondContact NH1-O 2.76Å; S321-M323 WeakPolarHBondContact OG-CB 3.28Å; S321-M323 PolarHBondContact OG-N 3.07Å; M323-I325 PolarHBondContact O-N 3.4Å; M323-D356 HydrophobicContact CE-CB 4.04Å; M323-D356 HydrophobicContact SD-CB 3.67Å; M323-N357 WeakPolarHBondContact CE-OD1 3.29Å; M323-C360 HydrophobicContact SD-CB 4.42Å
324	P	77	Confident	78.9	Confident	20 Å²	20	41.1 Å²	41.1	13%	0.13	23%	0.231	C	C	.	.			trans	-64.2	128.8	173.2	-23.5	34.7	0	0	0	111.4	I94 F304 N322 F326	I94-P324 HydrophobicContact CD1-CG 4.34Å; F304-P324 HydrophobicContact CD1-CB 4.39Å; F304-P324 HydrophobicContact CD2-CG 4.45Å; F304-P324 HydrophobicContact CE1-CB 4.46Å; F304-P324 HydrophobicContact CG-CG 4.49Å; N322-P324 WeakPolarHBondContact O-CD 3.32Å; P324-F326 HydrophobicContact CB-CE2 3.72Å; P324-F326 HydrophobicContact CB-CZ 4.08Å
325	I	79.7	Confident	79.1	Confident	17 Å²	17	36.3 Å²	36.3	9%	0.087	21%	0.205	C	C	.	.			trans	-120.6	125.4	177.2	-55.9	172.7	0	0	0	107.3	M323 A333 C360 V362	M323-I325 PolarHBondContact O-N 3.4Å; I325-A333 HydrophobicContact CG2-CB 4.11Å; I325-C360 HydrophobicContact CD1-CB 3.83Å; I325-V362 HydrophobicContact CD1-CG2 3.97Å; I325-V362 HydrophobicContact CG1-CG2 4.06Å; I325-V362 HydrophobicContact CG2-CG2 4.17Å
326	F	80.8	Confident	79.1	Confident	5 Å²	5	36.7 Å²	36.7	2%	0.022	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	155.5	-179.7	-60.7	-91.3	0	0	0	109.7	F64 L209 I213 P324 A333 V334 L336	F64-F326 HydrophobicContact CB-CB 4.1Å; F64-F326 HydrophobicContact CB-CD1 3.69Å; F64-F326 HydrophobicContact CB-CE1 4.32Å; F64-F326 HydrophobicContact CB-CG 3.97Å; F64-F326 HydrophobicContact CD1-CB 4.09Å; L209-F326 HydrophobicContact CD2-CZ 4.41Å; I213-F326 HydrophobicContact CD1-CE1 4.39Å; I213-F326 HydrophobicContact CD1-CZ 4.33Å; I213-F326 HydrophobicContact CG1-CE1 3.61Å; I213-F326 HydrophobicContact CG1-CZ 3.98Å; P324-F326 HydrophobicContact CB-CE2 3.72Å; P324-F326 HydrophobicContact CB-CZ 4.08Å; F326-A333 CarbonylContact O-C 3.52Å; F326-A333 WeakPolarHBondContact O-CA 3.28Å; F326-V334 HydrophobicContact CB-CG2 3.92Å; F326-V334 PolarHBondContact N-O 3.11Å; F326-V334 PolarHBondContact O-N 3.25Å; F326-L336 HydrophobicContact CD1-CD1 4.23Å; F326-L336 HydrophobicContact CD2-CB 4.21Å; F326-L336 HydrophobicContact CD2-CD1 3.54Å; F326-L336 HydrophobicContact CD2-CG 3.73Å; F326-L336 HydrophobicContact CE1-CD1 4.15Å; F326-L336 HydrophobicContact CE2-CB 4.05Å; F326-L336 HydrophobicContact CE2-CD1 3.5Å; F326-L336 VanDerWaalsContact CE2-CD1 3.5Å; F326-L336 HydrophobicContact CE2-CG 3.95Å; F326-L336 HydrophobicContact CG-CD1 3.93Å; F326-L336 HydrophobicContact CG-CG 4.38Å; F326-L336 HydrophobicContact CZ-CD1 3.81Å
327	G	72.3	Confident	79	Confident	4 Å²	4	35.7 Å²	35.7	4%	0.041	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175.8	158.1	179	0	0	0	0	0	112.8	R61 T62 A63	R61-G327 CarbonylContact C-O 3.5Å; R61-G327 VanDerWaalsContact C-O 3.23Å; T62-G327 CarbonylContact C-O 3.59Å; T62-G327 PolarHBondContact O-N 3.5Å; A63-G327 PolarHBondContact N-O 2.91Å
328	G	63.8	Low	78.7	Confident	46 Å²	46	36.1 Å²	36.1	47%	0.474	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	135.9	140.1	-176.9	0	0	0	0	0	112.3	Y331	G328-Y331 PolarHBondContact N-O 3.2Å
329	G	61.9	Low	78.5	Confident	86 Å²	86	38.9 Å²	38.9	89%	0.887	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.3	-122.2	-177.4	0	0	0	0	0	113.2	Y331	G329-Y331 PolarHBondContact O-N 2.97Å
330	R	51.9	Low	78.2	Confident	236 Å²	236	39.8 Å²	39.8	89%	0.891	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-10.9	-175.1	-77.2	-167.6	-100.7	-163.1	-4.8	115.3
331	Y	59.6	Low	78	Confident	105 Å²	105	43.4 Å²	43.4	41%	0.412	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	128.8	-177.6	-56.2	-78	0	0	0	110.9	G328 G329 E364 M380	G328-Y331 PolarHBondContact N-O 3.2Å; G329-Y331 PolarHBondContact O-N 2.97Å; Y331-E364 WeakPolarHBondContact CD1-OE2 3.41Å; Y331-M380 HydrophobicContact CD1-CE 3.61Å; Y331-M380 HydrophobicContact CD1-SD 4.08Å; Y331-M380 HydrophobicContact CD2-CE 4.24Å; Y331-M380 HydrophobicContact CE1-CE 3.3Å; Y331-M380 HydrophobicContact CE1-SD 3.55Å; Y331-M380 VanDerWaalsContact CE1-SD 3.55Å; Y331-M380 HydrophobicContact CE2-CE 3.96Å; Y331-M380 HydrophobicContact CG-CE 4.08Å; Y331-M380 VanDerWaalsContact CZ-CE 3.49Å
332	P	66.8	Low	77.6	Confident	88 Å²	88	48.6 Å²	48.6	57%	0.571	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.7	-41	-172.2	26.3	-31.9	0	0	0	113.6	R61	R61-P332 WeakPolarHBondContact CD-O 3.24Å; R61-P332 PolarHBondContact NH1-O 3.28Å
333	A	85.1	Confident	77.7	Confident	3 Å²	3	50.7 Å²	50.7	3%	0.025	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	132.3	175.7	0	0	0	0	0	111.7	I325 F326 P363	I325-A333 HydrophobicContact CG2-CB 4.11Å; F326-A333 CarbonylContact O-C 3.52Å; F326-A333 WeakPolarHBondContact O-CA 3.28Å; A333-P363 WeakPolarHBondContact O-CD 3.47Å; A333-P363 WeakPolarHBondContact O-CG 3.43Å
334	V	87.3	Confident	77.5	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.006	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	149.6	178.5	-55.2	0	0	0	0	112.1	F64 F326 E364 V366	F64-V334 HydrophobicContact CD1-CG2 3.84Å; F64-V334 HydrophobicContact CE1-CG2 3.66Å; F326-V334 HydrophobicContact CB-CG2 3.92Å; F326-V334 PolarHBondContact N-O 3.11Å; F326-V334 PolarHBondContact O-N 3.25Å; V334-E364 WeakPolarHBondContact CA-O 3.08Å; V334-E364 HydrophobicContact CG1-CB 4.09Å; V334-V366 HydrophobicContact CB-CG2 4.09Å; V334-V366 HydrophobicContact CG1-CG2 4.27Å; V334-V366 HydrophobicContact CG2-CG2 4.27Å
335	S	88.4	Confident	77.7	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	144.5	167.5	60.2	0	0	0	0	111.4	N357 E364 L365 V366	S335-N357 VanDerWaalsContact CB-OD1 3.28Å; S335-N357 WeakPolarHBondContact CB-OD1 3.42Å; S335-N357 PolarHBondContact OG-ND2 2.94Å; S335-N357 PolarHBondContact OG-OD1 2.73Å; S335-E364 PolarHBondContact N-O 3.28Å; S335-L365 VanDerWaalsContact OG-CD1 3.3Å; S335-L365 WeakPolarHBondContact OG-CD1 3.35Å; S335-V366 PolarHBondContact O-N 3.46Å
336	L	86.3	Confident	78	Confident	13 Å²	13	57.3 Å²	57.3	7%	0.068	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	131.8	177.6	-73.2	174.4	0	0	0	111.2	F64 F208 F326 V366	F64-L336 HydrophobicContact CB-CD1 3.69Å; F64-L336 HydrophobicContact CD2-CD1 4.05Å; F64-L336 HydrophobicContact CD2-CD2 3.84Å; F64-L336 HydrophobicContact CE2-CD2 3.97Å; F64-L336 HydrophobicContact CG-CD1 3.91Å; F64-L336 HydrophobicContact CG-CD2 4.18Å; F64-L336 HydrophobicContact CG-CG 4.44Å; F64-L336 HydrophobicContact CZ-CD2 4.42Å; F208-L336 HydrophobicContact CE1-CB 4.19Å; F208-L336 HydrophobicContact CZ-CB 4.42Å; F326-L336 HydrophobicContact CD1-CD1 4.23Å; F326-L336 HydrophobicContact CD2-CB 4.21Å; F326-L336 HydrophobicContact CD2-CD1 3.54Å; F326-L336 HydrophobicContact CD2-CG 3.73Å; F326-L336 HydrophobicContact CE1-CD1 4.15Å; F326-L336 HydrophobicContact CE2-CB 4.05Å; F326-L336 HydrophobicContact CE2-CD1 3.5Å; F326-L336 VanDerWaalsContact CE2-CD1 3.5Å; F326-L336 HydrophobicContact CE2-CG 3.95Å; F326-L336 HydrophobicContact CG-CD1 3.93Å; F326-L336 HydrophobicContact CG-CG 4.38Å; F326-L336 HydrophobicContact CZ-CD1 3.81Å; L336-V366 HydrophobicContact CD2-CB 3.69Å; L336-V366 HydrophobicContact CD2-CG1 3.59Å
337	R	87.6	Confident	78.2	Confident	48 Å²	48	59.1 Å²	59.1	18%	0.181	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	141.4	174.1	-62.4	-63.6	-178.8	162.2	7.5	111	Y353 D356 L365 V366 M367 C368	R337-Y353 HydrophobicContact CB-CE1 4.46Å; R337-Y353 HydrophobicContact CB-CE2 4.29Å; R337-Y353 VanDerWaalsContact CD-CE1 3.44Å; R337-Y353 HydrophobicContact CG-CD1 4.14Å; R337-Y353 HydrophobicContact CG-CD2 4.47Å; R337-Y353 HydrophobicContact CG-CE1 3.78Å; R337-Y353 HydrophobicContact CG-CE2 4.15Å; R337-Y353 HydrophobicContact CG-CG 4.45Å; R337-D356 IonicContact CZ-OD2 3.16Å; R337-D356 IonicContact NH1-OD2 3.81Å; R337-D356 VanDerWaalsContact NH2-CG 3.31Å; R337-D356 IonicContact NH2-OD2 3.03Å; R337-D356 PolarHBondContact NH2-OD2 3.43Å; R337-L365 HydrophobicContact CB-CD1 4Å; R337-L365 HydrophobicContact CG-CD1 3.36Å; R337-V366 PolarHBondContact N-O 3.27Å; R337-M367 HydrophobicContact CB-CE 3.72Å; R337-M367 HydrophobicContact CB-SD 3.62Å; R337-M367 HydrophobicContact CG-CE 4.23Å; R337-C368 PolarHBondContact O-N 3.01Å
338	L	85.9	Confident	78.9	Confident	20 Å²	20	61.5 Å²	61.5	11%	0.105	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	128.1	174.1	-176.9	70.7	0	0	0	109.4	L73 I204 L205 F208 C368 H370	L73-L338 HydrophobicContact CD1-CD1 3.81Å; L73-L338 HydrophobicContact CD1-CD2 4.01Å; I204-L338 HydrophobicContact CB-CD2 4.44Å; I204-L338 HydrophobicContact CG2-CD2 3.56Å; L205-L338 HydrophobicContact CB-CD2 4.45Å; L205-L338 HydrophobicContact CD1-CB 3.77Å; F208-L338 HydrophobicContact CB-CD1 4.41Å; F208-L338 HydrophobicContact CB-CD2 3.9Å; F208-L338 HydrophobicContact CD1-CB 3.85Å; F208-L338 HydrophobicContact CD1-CD1 4.5Å; F208-L338 HydrophobicContact CD2-CD1 3.93Å; F208-L338 HydrophobicContact CE1-CB 4.14Å; F208-L338 HydrophobicContact CE2-CD1 4.33Å; F208-L338 HydrophobicContact CG-CB 4.17Å; F208-L338 HydrophobicContact CG-CD1 4.02Å; F208-L338 HydrophobicContact CG-CD2 4.22Å; F208-L338 HydrophobicContact CG-CG 4.35Å; L338-C368 WeakPolarHBondContact CA-O 3.28Å; L338-C368 HydrophobicContact CD1-CB 4.15Å; L338-H370 HydrophobicContact CD1-CB 4.33Å
339	R	86.1	Confident	80	Confident	58 Å²	58	60.1 Å²	60.1	22%	0.219	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	146.8	-179.5	-82.6	-72.3	158.9	163.1	-5.2	112.9	T349 Y353 M367 C368 F369 H370	R339-T349 PolarHBondContact NH1-OG1 2.98Å; R339-T349 PolarHBondContact NH2-OG1 2.97Å; R339-Y353 VanDerWaalsContact CZ-OH 3.26Å; R339-Y353 PolarHBondContact NE-OH 3.04Å; R339-Y353 PolarHBondContact NH2-OH 3.09Å; R339-M367 HydrophobicContact CB-CG 4.44Å; R339-M367 HydrophobicContact CB-SD 3.86Å; R339-M367 HydrophobicContact CG-CG 4.48Å; R339-M367 HydrophobicContact CG-SD 3.38Å; R339-M367 WeakPolarHBondContact CG-SD 3.32Å; R339-C368 PolarHBondContact N-O 3.49Å; R339-F369 HydrophobicContact CB-CD1 4.2Å; R339-F369 HydrophobicContact CB-CE1 4.35Å; R339-F369 CarbonylContact O-C 3.56Å; R339-F369 VanDerWaalsContact O-CA 3.27Å; R339-F369 WeakPolarHBondContact O-CA 3.38Å; R339-H370 VanDerWaalsContact C-CD2 3.42Å; R339-H370 PolarHBondContact O-CD2 3.18Å; R339-H370 PolarHBondContact O-N 3.39Å
340	D	85.3	Confident	81.3	Confident	20 Å²	20	56 Å²	56	11%	0.107	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	124.3	170.4	-173.3	-11.7	0	0	0	109.2	N342 K343 H370	D340-N342 PolarHBondContact O-N 3.45Å; D340-N342 WeakPolarHBondContact OD1-CB 3.42Å; D340-N342 PolarHBondContact OD1-N 3.09Å; D340-K343 HydrophobicContact CB-CB 4.26Å; D340-K343 HydrophobicContact CB-CD 4.15Å; D340-K343 HydrophobicContact CB-CG 4.1Å; D340-K343 PolarHBondContact O-N 3.33Å; D340-K343 VanDerWaalsContact O-N 3.09Å; D340-K343 WeakPolarHBondContact OD2-CE 3.4Å; D340-H370 CarbonylContact C-O 3.43Å; D340-H370 VanDerWaalsContact CA-O 3.3Å; D340-H370 WeakPolarHBondContact CA-O 3.44Å
341	N	83.8	Confident	83.1	Confident	77 Å²	77	44.8 Å²	44.8	41%	0.412	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-24.1	179.7	-164.2	63.8	0	0	0	112.2	K343 F369 H370 V371	N341-K343 VanDerWaalsContact C-N 3.31Å; N341-F369 HydrophobicContact CB-CB 4.26Å; N341-H370 PolarHBondContact N-O 3.16Å; N341-V371 HydrophobicContact CB-CG2 3.73Å
342	N	79.8	Confident	84.5	Confident	110 Å²	110	41.2 Å²	41.2	59%	0.588	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	-2.6	179.8	-62.1	-26.6	0	0	0	113.3	D340	D340-N342 PolarHBondContact O-N 3.45Å; D340-N342 WeakPolarHBondContact OD1-CB 3.42Å; D340-N342 PolarHBondContact OD1-N 3.09Å
343	K	80.5	Confident	85.6	Confident	94 Å²	94	37.6 Å²	37.6	41%	0.409	20%	0.195	S	C	.	.	S	Bend	trans	-118.7	112.6	-178.4	-63.7	-175.8	-171.2	179.3	0	110.2	E197 D340 N341	E197-K343 IonicContact OE1-NZ 2.65Å; D340-K343 HydrophobicContact CB-CB 4.26Å; D340-K343 HydrophobicContact CB-CD 4.15Å; D340-K343 HydrophobicContact CB-CG 4.1Å; D340-K343 PolarHBondContact O-N 3.33Å; D340-K343 VanDerWaalsContact O-N 3.09Å; D340-K343 WeakPolarHBondContact OD2-CE 3.4Å; N341-K343 VanDerWaalsContact C-N 3.31Å
344	P	76.9	Confident	85.9	Confident	89 Å²	89	38 Å²	38	58%	0.578	20%	0.196	S	C	*	.			trans	-64.2	151.6	177	26.7	-33.4	0	0	0	111.2	N346 N391	P344-N346 PolarHBondContact O-N 3.44Å; P344-N346 VanDerWaalsContact O-N 3.13Å; P344-N391 HydrophobicContact CB-CB 3.99Å
345	I	81.6	Confident	86.1	Confident	19 Å²	19	38 Å²	38	10%	0.097	20%	0.195	C	C	.	.			trans	-71.8	106.6	177	-58	178.3	0	0	0	107.7	T349 L389 N391 S392	I345-T349 HydrophobicContact CG2-CG2 3.68Å; I345-L389 HydrophobicContact CD1-CD1 4.21Å; I345-N391 CarbonylContact O-C 3.53Å; I345-S392 WeakPolarHBondContact CG2-OG 3.2Å; I345-S392 WeakPolarHBondContact O-CA 3.3Å; I345-S392 WeakPolarHBondContact O-CB 3.21Å; I345-S392 PolarHBondContact O-N 2.96Å
346	N	85.9	Confident	86.1	Confident	82 Å²	82	38.4 Å²	38.4	44%	0.439	20%	0.197	S	C	.	.			trans	-73	162.9	174.5	65.4	14.4	0	0	0	111.5	P344 L348 T349 G350 S392	P344-N346 PolarHBondContact O-N 3.44Å; P344-N346 VanDerWaalsContact O-N 3.13Å; N346-L348 VanDerWaalsContact C-N 3.28Å; N346-L348 PolarHBondContact O-N 3.09Å; N346-T349 WeakPolarHBondContact O-CB 3.45Å; N346-T349 PolarHBondContact O-N 3.43Å; N346-T349 VanDerWaalsContact O-N 3.08Å; N346-T349 WeakPolarHBondContact OD1-CB 3.27Å; N346-T349 PolarHBondContact OD1-N 3Å; N346-T349 PolarHBondContact OD1-OG1 3.29Å; N346-G350 PolarHBondContact O-N 3.17Å; N346-S392 PolarHBondContact O-OG 3.02Å
347	V	86.4	Confident	86.3	Confident	42 Å²	42	37.8 Å²	37.8	26%	0.255	19%	0.194	S	C	.	.	H	α-helix	trans	-51.8	-44.4	179.3	172.3	0	0	0	0	112.5	Y138 T349 G350 I351 F394	Y138-V347 HydrophobicContact CD1-CG1 3.96Å; Y138-V347 HydrophobicContact CE1-CG1 4.26Å; V347-T349 VanDerWaalsContact C-N 3.32Å; V347-T349 PolarHBondContact O-N 3.22Å; V347-G350 PolarHBondContact O-N 3.47Å; V347-G350 VanDerWaalsContact O-N 3.17Å; V347-I351 HydrophobicContact CG1-CD1 3.71Å; V347-I351 HydrophobicContact CG1-CG1 4.33Å; V347-I351 WeakPolarHBondContact O-CG1 3.24Å; V347-I351 PolarHBondContact O-N 3.34Å; V347-F394 HydrophobicContact CG1-CB 4Å; V347-F394 HydrophobicContact CG1-CD1 4.49Å
348	L	86.6	Confident	86.4	Confident	55 Å²	55	36.9 Å²	36.9	29%	0.288	19%	0.193	S	C	.	.	H	α-helix	trans	-61.1	-38.7	179.3	-76	172.4	0	0	0	113.3	K135 Y138 N346 D352	K135-L348 HydrophobicContact CB-CD2 4.19Å; K135-L348 HydrophobicContact CD-CD2 4.25Å; K135-L348 HydrophobicContact CG-CD2 4.29Å; Y138-L348 VanDerWaalsContact CB-CD2 3.47Å; N346-L348 VanDerWaalsContact C-N 3.28Å; N346-L348 PolarHBondContact O-N 3.09Å; L348-D352 WeakPolarHBondContact O-CB 3.39Å; L348-D352 PolarHBondContact O-N 3.48Å
349	T	86.8	Confident	86.6	Confident	16 Å²	16	36 Å²	36	10%	0.098	19%	0.188	C	C	.	.	H	α-helix	trans	-68.7	-43.8	174.7	-65.9	0	0	0	0	110.9	R339 I345 N346 V347 I351 D352 Y353	R339-T349 PolarHBondContact NH1-OG1 2.98Å; R339-T349 PolarHBondContact NH2-OG1 2.97Å; I345-T349 HydrophobicContact CG2-CG2 3.68Å; N346-T349 WeakPolarHBondContact O-CB 3.45Å; N346-T349 PolarHBondContact O-N 3.43Å; N346-T349 VanDerWaalsContact O-N 3.08Å; N346-T349 WeakPolarHBondContact OD1-CB 3.27Å; N346-T349 PolarHBondContact OD1-N 3Å; N346-T349 PolarHBondContact OD1-OG1 3.29Å; V347-T349 VanDerWaalsContact C-N 3.32Å; V347-T349 PolarHBondContact O-N 3.22Å; T349-I351 VanDerWaalsContact C-N 3.35Å; T349-I351 PolarHBondContact O-N 3.37Å; T349-D352 WeakPolarHBondContact O-CB 3.47Å; T349-D352 PolarHBondContact O-N 3.2Å; T349-Y353 HydrophobicContact CG2-CD1 4.44Å; T349-Y353 HydrophobicContact CG2-CD2 3.74Å; T349-Y353 HydrophobicContact CG2-CE1 4.15Å; T349-Y353 HydrophobicContact CG2-CE2 3.37Å; T349-Y353 HydrophobicContact CG2-CG 4.29Å; T349-Y353 PolarHBondContact O-N 3.35Å
350	G	88.1	Confident	86.6	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-59.6	-46.8	179.7	0	0	0	0	0	111.6	N346 V347 D352 Y353 W354 I386 S392 F394	N346-G350 PolarHBondContact O-N 3.17Å; V347-G350 PolarHBondContact O-N 3.47Å; V347-G350 VanDerWaalsContact O-N 3.17Å; G350-D352 VanDerWaalsContact C-N 3.3Å; G350-D352 PolarHBondContact O-N 3.05Å; G350-Y353 PolarHBondContact O-N 3.45Å; G350-W354 VanDerWaalsContact O-CB 3.31Å; G350-W354 WeakPolarHBondContact O-CB 3.48Å; G350-W354 PolarHBondContact O-N 2.8Å; G350-I386 WeakPolarHBondContact O-CG2 3.48Å; G350-S392 VanDerWaalsContact CA-OG 3.26Å; G350-S392 WeakPolarHBondContact CA-OG 3.5Å; G350-S392 PolarHBondContact N-OG 2.94Å; G350-F394 VanDerWaalsContact C-CE1 3.45Å
351	I	90.3	Very high	86.7	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-58.6	-43.5	175	-66	166.5	0	0	0	110.7	K135 Y138 V347 T349 W354 L355 F394 I399	K135-I351 HydrophobicContact CD-CG2 4.31Å; K135-I351 HydrophobicContact CG-CG2 3.84Å; Y138-I351 HydrophobicContact CD1-CD1 4.35Å; Y138-I351 HydrophobicContact CD2-CD1 3.71Å; Y138-I351 HydrophobicContact CE2-CD1 3.91Å; Y138-I351 HydrophobicContact CG-CD1 3.94Å; V347-I351 HydrophobicContact CG1-CD1 3.71Å; V347-I351 HydrophobicContact CG1-CG1 4.33Å; V347-I351 WeakPolarHBondContact O-CG1 3.24Å; V347-I351 PolarHBondContact O-N 3.34Å; T349-I351 VanDerWaalsContact C-N 3.35Å; T349-I351 PolarHBondContact O-N 3.37Å; I351-W354 PolarHBondContact O-N 3.04Å; I351-L355 HydrophobicContact CG2-CD1 3.64Å; I351-L355 HydrophobicContact CG2-CG 4.16Å; I351-L355 WeakPolarHBondContact O-CB 3.42Å; I351-L355 VanDerWaalsContact O-CG 3.3Å; I351-L355 WeakPolarHBondContact O-CG 3.28Å; I351-L355 PolarHBondContact O-N 2.75Å; I351-F394 HydrophobicContact CD1-CG 4.35Å; I351-F394 HydrophobicContact CG1-CB 4.45Å; I351-F394 HydrophobicContact CG1-CD1 3.68Å; I351-F394 HydrophobicContact CG1-CD2 3.86Å; I351-F394 HydrophobicContact CG1-CE1 3.84Å; I351-F394 HydrophobicContact CG1-CE2 3.97Å; I351-F394 HydrophobicContact CG1-CG 3.73Å; I351-F394 HydrophobicContact CG1-CZ 3.98Å; I351-I399 HydrophobicContact CD1-CD1 3.87Å; I351-I399 HydrophobicContact CG1-CD1 4.23Å; I351-I399 HydrophobicContact CG2-CD1 4.38Å
352	D	89.2	Confident	87	Confident	30 Å²	30	34.4 Å²	34.4	16%	0.16	19%	0.185	C	C	.	.	H	α-helix	trans	-61.6	-45.4	179.9	-160.9	63	0	0	0	112.2	K131 K135 L348 T349 G350 D356	K131-D352 WeakPolarHBondContact CD-OD1 3.12Å; K131-D352 WeakPolarHBondContact CE-OD1 3.48Å; K131-D352 IonicContact NZ-OD1 3.68Å; K131-D352 PolarHBondContact NZ-OD1 3.4Å; K131-D352 IonicContact NZ-OD2 3.73Å; K135-D352 IonicContact NZ-OD1 3.8Å; K135-D352 PolarHBondContact NZ-OD1 3.16Å; L348-D352 WeakPolarHBondContact O-CB 3.39Å; L348-D352 PolarHBondContact O-N 3.48Å; T349-D352 WeakPolarHBondContact O-CB 3.47Å; T349-D352 PolarHBondContact O-N 3.2Å; G350-D352 VanDerWaalsContact C-N 3.3Å; G350-D352 PolarHBondContact O-N 3.05Å; D352-D356 VanDerWaalsContact O-CB 3.31Å; D352-D356 WeakPolarHBondContact O-CB 3.47Å; D352-D356 PolarHBondContact O-N 2.86Å
353	Y	90.2	Very high	87.3	Confident	13 Å²	13	32.1 Å²	32.1	5%	0.051	18%	0.176	C	C	.	.	H	α-helix	trans	-67.9	-40.7	178.5	-67.5	-11	0	0	0	112.7	R337 R339 T349 G350 N357 L365 M367	R337-Y353 HydrophobicContact CB-CE1 4.46Å; R337-Y353 HydrophobicContact CB-CE2 4.29Å; R337-Y353 VanDerWaalsContact CD-CE1 3.44Å; R337-Y353 HydrophobicContact CG-CD1 4.14Å; R337-Y353 HydrophobicContact CG-CD2 4.47Å; R337-Y353 HydrophobicContact CG-CE1 3.78Å; R337-Y353 HydrophobicContact CG-CE2 4.15Å; R337-Y353 HydrophobicContact CG-CG 4.45Å; R339-Y353 VanDerWaalsContact CZ-OH 3.26Å; R339-Y353 PolarHBondContact NE-OH 3.04Å; R339-Y353 PolarHBondContact NH2-OH 3.09Å; T349-Y353 HydrophobicContact CG2-CD1 4.44Å; T349-Y353 HydrophobicContact CG2-CD2 3.74Å; T349-Y353 HydrophobicContact CG2-CE1 4.15Å; T349-Y353 HydrophobicContact CG2-CE2 3.37Å; T349-Y353 HydrophobicContact CG2-CG 4.29Å; T349-Y353 PolarHBondContact O-N 3.35Å; G350-Y353 PolarHBondContact O-N 3.45Å; Y353-N357 PolarHBondContact O-N 2.83Å; Y353-L365 HydrophobicContact CD2-CD2 4.04Å; Y353-L365 HydrophobicContact CG-CD2 4.33Å; Y353-M367 HydrophobicContact CD2-CE 3.82Å; Y353-M367 HydrophobicContact CE2-CE 3.54Å; Y353-M367 HydrophobicContact CE2-SD 4.22Å
354	W	91.2	Very high	87.7	Confident	12 Å²	12	29.5 Å²	29.5	5%	0.045	17%	0.165	C	C	.	.	H	α-helix	trans	-63.9	-48.9	176.6	179.6	69.9	0	0	0	111.7	F312 G350 I351 N357 L358 I386 P387 F394 T396 I399	F312-W354 HydrophobicContact CE2-CH2 4.17Å; F312-W354 HydrophobicContact CZ-CH2 4.16Å; G350-W354 VanDerWaalsContact O-CB 3.31Å; G350-W354 WeakPolarHBondContact O-CB 3.48Å; G350-W354 PolarHBondContact O-N 2.8Å; I351-W354 PolarHBondContact O-N 3.04Å; W354-N357 PolarHBondContact O-N 3.48Å; W354-L358 HydrophobicContact CD2-CD1 3.78Å; W354-L358 HydrophobicContact CD2-CG 4.41Å; W354-L358 HydrophobicContact CE3-CD1 4.13Å; W354-L358 HydrophobicContact CG-CD1 4.47Å; W354-L358 HydrophobicContact CH2-CD1 3.68Å; W354-L358 HydrophobicContact CZ2-CD1 3.29Å; W354-L358 HydrophobicContact CZ2-CG 4.46Å; W354-L358 HydrophobicContact CZ3-CD1 4.07Å; W354-L358 WeakPolarHBondContact O-CG 3.18Å; W354-L358 PolarHBondContact O-N 2.96Å; W354-I386 HydrophobicContact CB-CB 4.4Å; W354-I386 HydrophobicContact CB-CG2 4Å; W354-P387 HydrophobicContact CG-CG 4.26Å; W354-F394 HydrophobicContact CB-CZ 3.86Å; W354-F394 HydrophobicContact CD2-CE2 4.08Å; W354-F394 HydrophobicContact CD2-CZ 4.13Å; W354-F394 AromaticContact CE3-CE2 3.91Å; W354-F394 HydrophobicContact CE3-CE2 3.91Å; W354-F394 HydrophobicContact CE3-CZ 4.22Å; W354-F394 HydrophobicContact CG-CE2 4.43Å; W354-F394 HydrophobicContact CG-CZ 4Å; W354-F394 HydrophobicContact CZ3-CE2 4.41Å; W354-T396 HydrophobicContact CH2-CG2 3.99Å; W354-T396 HydrophobicContact CZ2-CG2 3.48Å; W354-T396 VanDerWaalsContact CZ2-CG2 3.48Å; W354-I399 HydrophobicContact CZ3-CB 4.06Å; W354-I399 HydrophobicContact CZ3-CG1 4.25Å; W354-I399 HydrophobicContact CZ3-CG2 3.89Å
355	L	91.1	Very high	88.3	Confident	1 Å²	1	25.3 Å²	25.3	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-64.3	-42.9	179.1	-71.8	174.8	0	0	0	112.5	K131 L134 W310 I351 N357 L358 I359	K131-L355 HydrophobicContact CB-CD1 4.39Å; K131-L355 HydrophobicContact CD-CB 4.16Å; K131-L355 HydrophobicContact CG-CB 3.98Å; K131-L355 HydrophobicContact CG-CD1 3.93Å; L134-L355 HydrophobicContact CB-CD1 4.13Å; L134-L355 HydrophobicContact CD1-CD1 3.92Å; L134-L355 HydrophobicContact CD1-CD2 3.8Å; W310-L355 HydrophobicContact CH2-CD2 4.18Å; I351-L355 HydrophobicContact CG2-CD1 3.64Å; I351-L355 HydrophobicContact CG2-CG 4.16Å; I351-L355 WeakPolarHBondContact O-CB 3.42Å; I351-L355 VanDerWaalsContact O-CG 3.3Å; I351-L355 WeakPolarHBondContact O-CG 3.28Å; I351-L355 PolarHBondContact O-N 2.75Å; L355-N357 VanDerWaalsContact C-N 3.29Å; L355-N357 PolarHBondContact O-N 3Å; L355-L358 PolarHBondContact O-N 3.44Å; L355-I359 WeakPolarHBondContact O-CB 3.45Å; L355-I359 WeakPolarHBondContact O-CD1 3.37Å; L355-I359 VanDerWaalsContact O-CG1 3.24Å; L355-I359 WeakPolarHBondContact O-CG1 3.41Å; L355-I359 PolarHBondContact O-N 3.26Å
356	D	89.5	Confident	88.7	Confident	7 Å²	7	24.7 Å²	24.7	4%	0.037	14%	0.135	C	C	.	.	H	α-helix	trans	-58.8	-42.1	177.6	-87.2	-19.4	0	0	0	111.8	K131 M323 R337 D352 C360	K131-D356 VanDerWaalsContact CD-OD1 3.28Å; K131-D356 WeakPolarHBondContact CD-OD1 3.28Å; K131-D356 VanDerWaalsContact CE-OD1 3.24Å; K131-D356 WeakPolarHBondContact CE-OD1 3.42Å; K131-D356 IonicContact NZ-OD1 3.23Å; K131-D356 PolarHBondContact NZ-OD1 3.36Å; K131-D356 IonicContact NZ-OD2 3.96Å; K131-D356 PolarHBondContact NZ-OD2 3.23Å; M323-D356 HydrophobicContact CE-CB 4.04Å; M323-D356 HydrophobicContact SD-CB 3.67Å; R337-D356 IonicContact CZ-OD2 3.16Å; R337-D356 IonicContact NH1-OD2 3.81Å; R337-D356 VanDerWaalsContact NH2-CG 3.31Å; R337-D356 IonicContact NH2-OD2 3.03Å; R337-D356 PolarHBondContact NH2-OD2 3.43Å; D352-D356 VanDerWaalsContact O-CB 3.31Å; D352-D356 WeakPolarHBondContact O-CB 3.47Å; D352-D356 PolarHBondContact O-N 2.86Å; D356-C360 WeakPolarHBondContact O-CB 3.45Å; D356-C360 PolarHBondContact O-N 3.13Å; D356-C360 PolarHBondContact O-SG 2.8Å
357	N	90.4	Very high	88.8	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-69.5	-41.3	175.7	-78.6	9.4	0	0	0	112.4	M323 S335 Y353 W354 L355 C360 N361 V362 T383	M323-N357 WeakPolarHBondContact CE-OD1 3.29Å; S335-N357 VanDerWaalsContact CB-OD1 3.28Å; S335-N357 WeakPolarHBondContact CB-OD1 3.42Å; S335-N357 PolarHBondContact OG-ND2 2.94Å; S335-N357 PolarHBondContact OG-OD1 2.73Å; Y353-N357 PolarHBondContact O-N 2.83Å; W354-N357 PolarHBondContact O-N 3.48Å; L355-N357 VanDerWaalsContact C-N 3.29Å; L355-N357 PolarHBondContact O-N 3Å; N357-C360 PolarHBondContact O-N 3.43Å; N357-N361 PolarHBondContact O-N 2.76Å; N357-V362 HydrophobicContact CB-CB 4.18Å; N357-V362 PolarHBondContact O-N 3.33Å; N357-T383 HydrophobicContact CB-CG2 3.66Å; N357-T383 WeakPolarHBondContact CB-OG1 3.46Å; N357-T383 PolarHBondContact ND2-OG1 2.86Å
358	L	89.6	Confident	88.9	Confident	29 Å²	29	18.8 Å²	18.8	15%	0.152	10%	0.102	C	C	.	.	H	α-helix	trans	-64.9	-46.2	178.8	-76.4	-172.8	0	0	0	112.9	W310 F312 W354 L355 C360 N361 T383	W310-L358 HydrophobicContact CZ2-CB 4.22Å; F312-L358 HydrophobicContact CE2-CD1 4.2Å; W354-L358 HydrophobicContact CD2-CD1 3.78Å; W354-L358 HydrophobicContact CD2-CG 4.41Å; W354-L358 HydrophobicContact CE3-CD1 4.13Å; W354-L358 HydrophobicContact CG-CD1 4.47Å; W354-L358 HydrophobicContact CH2-CD1 3.68Å; W354-L358 HydrophobicContact CZ2-CD1 3.29Å; W354-L358 HydrophobicContact CZ2-CG 4.46Å; W354-L358 HydrophobicContact CZ3-CD1 4.07Å; W354-L358 WeakPolarHBondContact O-CG 3.18Å; W354-L358 PolarHBondContact O-N 2.96Å; L355-L358 PolarHBondContact O-N 3.44Å; L358-C360 PolarHBondContact O-N 3.35Å; L358-N361 PolarHBondContact O-N 3.33Å; L358-T383 HydrophobicContact CD2-CG2 4.22Å; L358-T383 HydrophobicContact CG-CG2 4.49Å
359	I	89.2	Confident	88.9	Confident	1 Å²	1	17.2 Å²	17.2	1%	0.005	9%	0.093	C	C	.	.	H	α-helix	trans	-59.2	-41	178.2	-68.2	164.4	0	0	0	109.8	A51 I308 W310 V319 L355	A51-I359 WeakPolarHBondContact CB-O 3.3Å; I308-I359 HydrophobicContact CD1-CG2 4.19Å; I308-I359 WeakPolarHBondContact CG2-O 3.34Å; W310-I359 HydrophobicContact CD2-CG1 3.86Å; W310-I359 HydrophobicContact CE3-CD1 4.48Å; W310-I359 HydrophobicContact CE3-CG1 3.69Å; W310-I359 HydrophobicContact CH2-CD1 4.46Å; W310-I359 HydrophobicContact CH2-CG1 3.84Å; W310-I359 HydrophobicContact CZ2-CG1 4Å; W310-I359 HydrophobicContact CZ3-CD1 4.18Å; W310-I359 HydrophobicContact CZ3-CG1 3.69Å; V319-I359 HydrophobicContact CB-CG2 4.22Å; V319-I359 HydrophobicContact CG1-CG2 3.88Å; L355-I359 WeakPolarHBondContact O-CB 3.45Å; L355-I359 WeakPolarHBondContact O-CD1 3.37Å; L355-I359 VanDerWaalsContact O-CG1 3.24Å; L355-I359 WeakPolarHBondContact O-CG1 3.41Å; L355-I359 PolarHBondContact O-N 3.26Å
360	C	87.1	Confident	89	Confident	11 Å²	11	17.3 Å²	17.3	7%	0.074	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	3	-177.5	-65	0	0	0	0	114.9	M323 I325 D356 N357 L358 V362	M323-C360 HydrophobicContact SD-CB 4.42Å; I325-C360 HydrophobicContact CD1-CB 3.83Å; D356-C360 WeakPolarHBondContact O-CB 3.45Å; D356-C360 PolarHBondContact O-N 3.13Å; D356-C360 PolarHBondContact O-SG 2.8Å; N357-C360 PolarHBondContact O-N 3.43Å; L358-C360 PolarHBondContact O-N 3.35Å; C360-V362 VanDerWaalsContact C-N 3.34Å; C360-V362 HydrophobicContact CB-CG2 3.74Å; C360-V362 PolarHBondContact O-N 3.49Å
361	N	87.5	Confident	88.9	Confident	107 Å²	107	19.1 Å²	19.1	57%	0.572	10%	0.103	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.7	47.9	-173.1	-162.2	23	0	0	0	113.6	A51 N357 L358	A51-N361 HydrophobicContact CB-CB 3.92Å; N357-N361 PolarHBondContact O-N 2.76Å; L358-N361 PolarHBondContact O-N 3.33Å
362	V	88.3	Confident	88.5	Confident	4 Å²	4	23.8 Å²	23.8	2%	0.024	13%	0.128	C	C	.	.			trans	-99.1	119	-179.8	-178.6	0	0	0	0	109.6	I325 N357 C360 E364 T383	I325-V362 HydrophobicContact CD1-CG2 3.97Å; I325-V362 HydrophobicContact CG1-CG2 4.06Å; I325-V362 HydrophobicContact CG2-CG2 4.17Å; N357-V362 HydrophobicContact CB-CB 4.18Å; N357-V362 PolarHBondContact O-N 3.33Å; C360-V362 VanDerWaalsContact C-N 3.34Å; C360-V362 HydrophobicContact CB-CG2 3.74Å; C360-V362 PolarHBondContact O-N 3.49Å; V362-E364 WeakPolarHBondContact CG1-O 3.36Å; V362-T383 PolarHBondContact O-OG1 3.41Å
363	P	87.1	Confident	88.1	Confident	62 Å²	62	22.4 Å²	22.4	40%	0.403	12%	0.12	S	C	.	.			trans	-75.7	-26.6	-174.5	29	-35.5	0	0	0	114	A333 T383	A333-P363 WeakPolarHBondContact O-CD 3.47Å; A333-P363 WeakPolarHBondContact O-CG 3.43Å; P363-T383 VanDerWaalsContact C-OG1 3.28Å; P363-T383 WeakPolarHBondContact O-CB 3.41Å; P363-T383 PolarHBondContact O-N 2.55Å; P363-T383 PolarHBondContact O-OG1 2.98Å; P363-T383 VanDerWaalsContact O-OG1 3.12Å
364	E	89.5	Confident	87.8	Confident	40 Å²	40	24.4 Å²	24.4	19%	0.187	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	143.7	-170.8	-68.2	174.9	166.2	0	0	112.4	Y331 V334 S335 V362	Y331-E364 WeakPolarHBondContact CD1-OE2 3.41Å; V334-E364 WeakPolarHBondContact CA-O 3.08Å; V334-E364 HydrophobicContact CG1-CB 4.09Å; S335-E364 PolarHBondContact N-O 3.28Å; V362-E364 WeakPolarHBondContact CG1-O 3.36Å
365	L	89.6	Confident	87.5	Confident	1 Å²	1	23.8 Å²	23.8	1%	0.005	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	128	174.9	168.9	60.9	0	0	0	109.4	S335 R337 Y353 M367 M380 I381 I386	S335-L365 VanDerWaalsContact OG-CD1 3.3Å; S335-L365 WeakPolarHBondContact OG-CD1 3.35Å; R337-L365 HydrophobicContact CB-CD1 4Å; R337-L365 HydrophobicContact CG-CD1 3.36Å; Y353-L365 HydrophobicContact CD2-CD2 4.04Å; Y353-L365 HydrophobicContact CG-CD2 4.33Å; L365-M367 HydrophobicContact CD1-CE 4.02Å; L365-M367 HydrophobicContact CD2-CE 3.48Å; L365-M367 VanDerWaalsContact CD2-CE 3.48Å; L365-M367 HydrophobicContact CG-CE 3.86Å; L365-M380 WeakPolarHBondContact O-CA 3.42Å; L365-I381 PolarHBondContact N-O 3.19Å; L365-I381 PolarHBondContact O-N 3.4Å; L365-I386 HydrophobicContact CB-CD1 4.25Å; L365-I386 HydrophobicContact CD2-CD1 3.79Å; L365-I386 HydrophobicContact CD2-CG1 4.31Å
366	V	89.1	Confident	87.3	Confident	5 Å²	5	27.2 Å²	27.2	3%	0.03	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	110.6	172.1	174.7	0	0	0	0	108.9	F64 V334 S335 L336 R337 Y378 M380	F64-V366 HydrophobicContact CE2-CG1 4.22Å; F64-V366 HydrophobicContact CZ-CG1 4.13Å; F64-V366 HydrophobicContact CZ-CG2 4.18Å; V334-V366 HydrophobicContact CB-CG2 4.09Å; V334-V366 HydrophobicContact CG1-CG2 4.27Å; V334-V366 HydrophobicContact CG2-CG2 4.27Å; S335-V366 PolarHBondContact O-N 3.46Å; L336-V366 HydrophobicContact CD2-CB 3.69Å; L336-V366 HydrophobicContact CD2-CG1 3.59Å; R337-V366 PolarHBondContact N-O 3.27Å; V366-Y378 HydrophobicContact CG1-CD1 3.62Å; V366-Y378 HydrophobicContact CG1-CE1 4.27Å; V366-M380 HydrophobicContact CG2-CE 4.01Å
367	M	87.4	Confident	87.1	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	119.1	178.9	-162.9	61.1	52.5	0	0	110.6	R337 R339 Y353 L365 F369 Y378 E379 I381	R337-M367 HydrophobicContact CB-CE 3.72Å; R337-M367 HydrophobicContact CB-SD 3.62Å; R337-M367 HydrophobicContact CG-CE 4.23Å; R339-M367 HydrophobicContact CB-CG 4.44Å; R339-M367 HydrophobicContact CB-SD 3.86Å; R339-M367 HydrophobicContact CG-CG 4.48Å; R339-M367 HydrophobicContact CG-SD 3.38Å; R339-M367 WeakPolarHBondContact CG-SD 3.32Å; Y353-M367 HydrophobicContact CD2-CE 3.82Å; Y353-M367 HydrophobicContact CE2-CE 3.54Å; Y353-M367 HydrophobicContact CE2-SD 4.22Å; L365-M367 HydrophobicContact CD1-CE 4.02Å; L365-M367 HydrophobicContact CD2-CE 3.48Å; L365-M367 VanDerWaalsContact CD2-CE 3.48Å; L365-M367 HydrophobicContact CG-CE 3.86Å; M367-F369 HydrophobicContact CB-CE2 4.01Å; M367-F369 HydrophobicContact CB-CZ 4.4Å; M367-F369 HydrophobicContact CG-CD2 4.14Å; M367-F369 HydrophobicContact CG-CE1 4.11Å; M367-F369 HydrophobicContact CG-CE2 3.63Å; M367-F369 HydrophobicContact CG-CZ 3.62Å; M367-Y378 CarbonylContact O-C 3.53Å; M367-Y378 VanDerWaalsContact O-CA 3.3Å; M367-Y378 WeakPolarHBondContact O-CA 3.13Å; M367-E379 HydrophobicContact CB-CB 4.4Å; M367-E379 PolarHBondContact N-O 3.49Å; M367-E379 PolarHBondContact O-N 2.62Å; M367-I381 HydrophobicContact CB-CD1 4.4Å
368	C	88.3	Confident	87	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	115.9	170.4	-179.9	0	0	0	0	109.4	F208 R337 L338 R339 Y378	F208-C368 HydrophobicContact CD2-CB 4.47Å; F208-C368 HydrophobicContact CE2-CB 3.52Å; F208-C368 HydrophobicContact CZ-CB 3.65Å; R337-C368 PolarHBondContact O-N 3.01Å; L338-C368 WeakPolarHBondContact CA-O 3.28Å; L338-C368 HydrophobicContact CD1-CB 4.15Å; R339-C368 PolarHBondContact N-O 3.49Å; C368-Y378 HydrophobicContact CB-CD1 4.07Å; C368-Y378 HydrophobicContact CB-CE1 3.75Å; C368-Y378 HydrophobicContact CB-CE2 4.43Å
369	F	87.5	Confident	86.9	Confident	23 Å²	23	34.1 Å²	34.1	10%	0.101	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	137.4	176.3	-68	-84.5	0	0	0	110.6	R339 N341 M367 Q376 K377 E379	R339-F369 HydrophobicContact CB-CD1 4.2Å; R339-F369 HydrophobicContact CB-CE1 4.35Å; R339-F369 CarbonylContact O-C 3.56Å; R339-F369 VanDerWaalsContact O-CA 3.27Å; R339-F369 WeakPolarHBondContact O-CA 3.38Å; N341-F369 HydrophobicContact CB-CB 4.26Å; M367-F369 HydrophobicContact CB-CE2 4.01Å; M367-F369 HydrophobicContact CB-CZ 4.4Å; M367-F369 HydrophobicContact CG-CD2 4.14Å; M367-F369 HydrophobicContact CG-CE1 4.11Å; M367-F369 HydrophobicContact CG-CE2 3.63Å; M367-F369 HydrophobicContact CG-CZ 3.62Å; F369-Q376 WeakPolarHBondContact O-CB 3.43Å; F369-Q376 PolarHBondContact O-N 3.29Å; F369-K377 HydrophobicContact CB-CG 4Å; F369-K377 HydrophobicContact CD2-CD 4.23Å; F369-K377 VanDerWaalsContact CD2-CE 3.48Å; F369-K377 HydrophobicContact CD2-CG 3.8Å; F369-K377 HydrophobicContact CG-CG 4.27Å; F369-K377 PolarHBondContact N-O 2.66Å; F369-E379 HydrophobicContact CD2-CB 4.49Å; F369-E379 HydrophobicContact CE2-CB 3.88Å; F369-E379 WeakPolarHBondContact CE2-OE2 3.42Å
370	H	88.6	Confident	86.8	Confident	18 Å²	18	37.6 Å²	37.6	8%	0.083	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	157.3	175.4	75.3	78.1	0	0	0	111.7	L338 R339 D340 N341 G373 I374	L338-H370 HydrophobicContact CD1-CB 4.33Å; R339-H370 VanDerWaalsContact C-CD2 3.42Å; R339-H370 PolarHBondContact O-CD2 3.18Å; R339-H370 PolarHBondContact O-N 3.39Å; D340-H370 CarbonylContact C-O 3.43Å; D340-H370 VanDerWaalsContact CA-O 3.3Å; D340-H370 WeakPolarHBondContact CA-O 3.44Å; N341-H370 PolarHBondContact N-O 3.16Å; H370-G373 PolarHBondContact ND1-N 3.32Å; H370-G373 VanDerWaalsContact ND1-N 3.15Å; H370-I374 CarbonylContact C-O 3.55Å; H370-I374 WeakPolarHBondContact CA-O 3.45Å; H370-I374 WeakPolarHBondContact CB-O 3.35Å
371	V	87.3	Confident	86.9	Confident	38 Å²	38	37.3 Å²	37.3	23%	0.23	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	119	166.2	174.3	0	0	0	0	107.1	N341 G373 I374 Q376	N341-V371 HydrophobicContact CB-CG2 3.73Å; V371-G373 VanDerWaalsContact C-N 3.27Å; V371-G373 PolarHBondContact O-N 3.12Å; V371-I374 PolarHBondContact N-O 2.92Å; V371-I374 WeakPolarHBondContact O-CB 3.11Å; V371-I374 PolarHBondContact O-N 3.31Å; V371-Q376 HydrophobicContact CB-CG 4.39Å; V371-Q376 HydrophobicContact CG2-CG 3.91Å
372	N	81.8	Confident	87	Confident	98 Å²	98	36.5 Å²	36.5	52%	0.524	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.5	42.9	-177	-67.2	-24.4	0	0	0	113.8	K74 I374	K74-N372 WeakPolarHBondContact CE-O 3.37Å; K74-N372 PolarHBondContact NZ-O 3.04Å; N372-I374 VanDerWaalsContact C-N 3.3Å; N372-I374 PolarHBondContact O-N 2.82Å
373	G	79.2	Confident	87.1	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.7	-3.7	-177.4	0	0	0	0	0	115.6	L73 H370 V371	L73-G373 WeakPolarHBondContact CB-O 3.49Å; L73-G373 VanDerWaalsContact CG-O 3.26Å; L73-G373 WeakPolarHBondContact CG-O 3.15Å; L73-G373 PolarHBondContact N-O 2.73Å; H370-G373 PolarHBondContact ND1-N 3.32Å; H370-G373 VanDerWaalsContact ND1-N 3.15Å; V371-G373 VanDerWaalsContact C-N 3.27Å; V371-G373 PolarHBondContact O-N 3.12Å
374	I	84.5	Confident	87.1	Confident	55 Å²	55	39.2 Å²	39.2	28%	0.282	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	118.6	176.8	-57.9	173.7	0	0	0	109.9	K70 T71 H370 V371 N372 Q376	K70-I374 HydrophobicContact CB-CG2 4.45Å; T71-I374 WeakPolarHBondContact O-CA 3.37Å; H370-I374 CarbonylContact C-O 3.55Å; H370-I374 WeakPolarHBondContact CA-O 3.45Å; H370-I374 WeakPolarHBondContact CB-O 3.35Å; V371-I374 PolarHBondContact N-O 2.92Å; V371-I374 WeakPolarHBondContact O-CB 3.11Å; V371-I374 PolarHBondContact O-N 3.31Å; N372-I374 VanDerWaalsContact C-N 3.3Å; N372-I374 PolarHBondContact O-N 2.82Å; I374-Q376 PolarHBondContact O-N 3.02Å; I374-Q376 PolarHBondContact O-NE2 2.84Å; I374-Q376 VanDerWaalsContact O-NE2 3.11Å
375	V	85.5	Confident	87.1	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	129.6	179.2	176.7	0	0	0	0	110.6	L67 K70 T71 L73 Y378	L67-V375 HydrophobicContact CB-CG1 4.4Å; L67-V375 HydrophobicContact CB-CG2 4.23Å; L67-V375 HydrophobicContact CD1-CG2 3.92Å; K70-V375 PolarHBondContact N-O 2.87Å; T71-V375 PolarHBondContact O-N 3.03Å; L73-V375 HydrophobicContact CD1-CG2 3.93Å; L73-V375 HydrophobicContact CD2-CG2 4.35Å; L73-V375 HydrophobicContact CG-CG2 4.02Å; V375-Y378 HydrophobicContact CG1-CD2 4.44Å; V375-Y378 HydrophobicContact CG1-CE2 3.87Å
376	Q	86.3	Confident	87	Confident	73 Å²	73	41.6 Å²	41.6	34%	0.341	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	-60.9	-179.1	-61.1	-57.6	-50.4	0	0	111.6	E69 F369 V371 I374	E69-Q376 VanDerWaalsContact CD-O 3.3Å; E69-Q376 VanDerWaalsContact CG-O 3.23Å; E69-Q376 WeakPolarHBondContact CG-O 3.21Å; F369-Q376 WeakPolarHBondContact O-CB 3.43Å; F369-Q376 PolarHBondContact O-N 3.29Å; V371-Q376 HydrophobicContact CB-CG 4.39Å; V371-Q376 HydrophobicContact CG2-CG 3.91Å; I374-Q376 PolarHBondContact O-N 3.02Å; I374-Q376 PolarHBondContact O-NE2 2.84Å; I374-Q376 VanDerWaalsContact O-NE2 3.11Å
377	K	85.9	Confident	87	Confident	85 Å²	85	41.6 Å²	41.6	37%	0.37	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	159	-174.7	66	170.1	-175.3	152.6	0	111.2	F369 E379	F369-K377 HydrophobicContact CB-CG 4Å; F369-K377 HydrophobicContact CD2-CD 4.23Å; F369-K377 VanDerWaalsContact CD2-CE 3.48Å; F369-K377 HydrophobicContact CD2-CG 3.8Å; F369-K377 HydrophobicContact CG-CG 4.27Å; F369-K377 PolarHBondContact N-O 2.66Å; K377-E379 IonicContact NZ-OE2 3.37Å; K377-E379 PolarHBondContact NZ-OE2 3.09Å
378	Y	87.1	Confident	86.9	Confident	26 Å²	26	47.1 Å²	47.1	10%	0.102	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	136.3	168.6	-78.2	-105.4	0	0	0	109.5	R66 L67 F208 V366 M367 C368 V375	R66-Y378 HydrophobicContact CG-CD1 4.23Å; R66-Y378 HydrophobicContact CG-CD2 3.65Å; R66-Y378 HydrophobicContact CG-CE1 4.23Å; R66-Y378 HydrophobicContact CG-CE2 3.65Å; R66-Y378 HydrophobicContact CG-CG 3.94Å; L67-Y378 HydrophobicContact CB-CE2 4.19Å; L67-Y378 WeakPolarHBondContact CB-OH 3.41Å; L67-Y378 PolarHBondContact N-OH 2.88Å; L67-Y378 WeakPolarHBondContact O-CE2 3.32Å; F208-Y378 HydrophobicContact CE2-CE1 4.35Å; F208-Y378 WeakPolarHBondContact CE2-OH 3.41Å; V366-Y378 HydrophobicContact CG1-CD1 3.62Å; V366-Y378 HydrophobicContact CG1-CE1 4.27Å; M367-Y378 CarbonylContact O-C 3.53Å; M367-Y378 VanDerWaalsContact O-CA 3.3Å; M367-Y378 WeakPolarHBondContact O-CA 3.13Å; C368-Y378 HydrophobicContact CB-CD1 4.07Å; C368-Y378 HydrophobicContact CB-CE1 3.75Å; C368-Y378 HydrophobicContact CB-CE2 4.43Å; V375-Y378 HydrophobicContact CG1-CD2 4.44Å; V375-Y378 HydrophobicContact CG1-CE2 3.87Å
379	E	88.6	Confident	86.7	Confident	70 Å²	70	48.7 Å²	48.7	33%	0.327	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	129.7	179	-167.3	171.1	149.2	0	0	109.1	M367 F369 K377 I381	M367-E379 HydrophobicContact CB-CB 4.4Å; M367-E379 PolarHBondContact N-O 3.49Å; M367-E379 PolarHBondContact O-N 2.62Å; F369-E379 HydrophobicContact CD2-CB 4.49Å; F369-E379 HydrophobicContact CE2-CB 3.88Å; F369-E379 WeakPolarHBondContact CE2-OE2 3.42Å; K377-E379 IonicContact NZ-OE2 3.37Å; K377-E379 PolarHBondContact NZ-OE2 3.09Å; E379-I381 HydrophobicContact CG-CG1 4.18Å
380	M	86.2	Confident	85.9	Confident	74 Å²	74	56 Å²	56	37%	0.365	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	125	176.7	-177.7	176.3	-79.5	0	0	108.1	Y331 L365 V366	Y331-M380 HydrophobicContact CD1-CE 3.61Å; Y331-M380 HydrophobicContact CD1-SD 4.08Å; Y331-M380 HydrophobicContact CD2-CE 4.24Å; Y331-M380 HydrophobicContact CE1-CE 3.3Å; Y331-M380 HydrophobicContact CE1-SD 3.55Å; Y331-M380 VanDerWaalsContact CE1-SD 3.55Å; Y331-M380 HydrophobicContact CE2-CE 3.96Å; Y331-M380 HydrophobicContact CG-CE 4.08Å; Y331-M380 VanDerWaalsContact CZ-CE 3.49Å; L365-M380 WeakPolarHBondContact O-CA 3.42Å; V366-M380 HydrophobicContact CG2-CE 4.01Å
381	I	90.1	Very high	85.2	Confident	5 Å²	5	60.7 Å²	60.7	3%	0.026	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	127.9	-175.6	-56.4	171.3	0	0	0	106.6	L365 M367 E379 E385 I386 L389	L365-I381 PolarHBondContact N-O 3.19Å; L365-I381 PolarHBondContact O-N 3.4Å; M367-I381 HydrophobicContact CB-CD1 4.4Å; E379-I381 HydrophobicContact CG-CG1 4.18Å; I381-E385 HydrophobicContact CG2-CB 4.23Å; I381-I386 HydrophobicContact CG2-CG1 4.01Å; I381-L389 HydrophobicContact CD1-CD1 4.15Å; I381-L389 HydrophobicContact CD1-CD2 4.16Å; I381-L389 HydrophobicContact CG2-CD1 4.36Å; I381-L389 HydrophobicContact CG2-CD2 4.17Å
382	K	89.4	Confident	84.9	Confident	89 Å²	89	58.9 Å²	58.9	39%	0.387	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	146.7	174.2	-62	-175.2	-176.5	170.6	0	110.4	E384 E385 I386	K382-E384 HydrophobicContact CB-CG 3.89Å; K382-E384 HydrophobicContact CD-CG 4.22Å; K382-E384 WeakPolarHBondContact CD-OE1 3.33Å; K382-E384 IonicContact NZ-OE1 3.49Å; K382-E384 PolarHBondContact NZ-OE1 2.81Å; K382-E384 VanDerWaalsContact NZ-OE1 3.16Å; K382-E384 PolarHBondContact O-N 3.11Å; K382-E384 VanDerWaalsContact O-N 3.17Å; K382-E385 HydrophobicContact CB-CB 4.46Å; K382-E385 HydrophobicContact CB-CG 4.1Å; K382-E385 PolarHBondContact O-N 3.47Å; K382-I386 PolarHBondContact O-N 3.22Å
383	T	89.8	Confident	84.9	Confident	11 Å²	11	59.5 Å²	59.5	7%	0.067	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-33.9	179.4	-64	0	0	0	0	112.3	N357 L358 V362 P363 E385 I386	N357-T383 HydrophobicContact CB-CG2 3.66Å; N357-T383 WeakPolarHBondContact CB-OG1 3.46Å; N357-T383 PolarHBondContact ND2-OG1 2.86Å; L358-T383 HydrophobicContact CD2-CG2 4.22Å; L358-T383 HydrophobicContact CG-CG2 4.49Å; V362-T383 PolarHBondContact O-OG1 3.41Å; P363-T383 VanDerWaalsContact C-OG1 3.28Å; P363-T383 WeakPolarHBondContact O-CB 3.41Å; P363-T383 PolarHBondContact O-N 2.55Å; P363-T383 PolarHBondContact O-OG1 2.98Å; P363-T383 VanDerWaalsContact O-OG1 3.12Å; T383-E385 VanDerWaalsContact C-N 3.28Å; T383-E385 PolarHBondContact O-N 3.1Å; T383-I386 PolarHBondContact O-N 2.68Å
384	E	88.1	Confident	85.3	Confident	112 Å²	112	60 Å²	60	52%	0.523	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-23.8	176.2	67.2	-162.5	-178.7	0	0	114	K382 P387	K382-E384 HydrophobicContact CB-CG 3.89Å; K382-E384 HydrophobicContact CD-CG 4.22Å; K382-E384 WeakPolarHBondContact CD-OE1 3.33Å; K382-E384 IonicContact NZ-OE1 3.49Å; K382-E384 PolarHBondContact NZ-OE1 2.81Å; K382-E384 VanDerWaalsContact NZ-OE1 3.16Å; K382-E384 PolarHBondContact O-N 3.11Å; K382-E384 VanDerWaalsContact O-N 3.17Å; E384-P387 WeakPolarHBondContact O-CD 3.31Å
385	E	88.4	Confident	85.4	Confident	91 Å²	91	60 Å²	60	43%	0.425	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-19.2	-177.7	-66.4	170.2	-175.8	0	0	112.6	I381 K382 T383 P387 N388	I381-E385 HydrophobicContact CG2-CB 4.23Å; K382-E385 HydrophobicContact CB-CB 4.46Å; K382-E385 HydrophobicContact CB-CG 4.1Å; K382-E385 PolarHBondContact O-N 3.47Å; T383-E385 VanDerWaalsContact C-N 3.28Å; T383-E385 PolarHBondContact O-N 3.1Å; E385-P387 VanDerWaalsContact C-CD 3.47Å; E385-N388 PolarHBondContact O-N 2.79Å
386	I	88.7	Confident	85.5	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-52.5	-45.6	-178.3	-61.1	173.5	0	0	0	113.3	G350 W354 L365 I381 K382 T383 N388 L389	G350-I386 WeakPolarHBondContact O-CG2 3.48Å; W354-I386 HydrophobicContact CB-CB 4.4Å; W354-I386 HydrophobicContact CB-CG2 4Å; L365-I386 HydrophobicContact CB-CD1 4.25Å; L365-I386 HydrophobicContact CD2-CD1 3.79Å; L365-I386 HydrophobicContact CD2-CG1 4.31Å; I381-I386 HydrophobicContact CG2-CG1 4.01Å; K382-I386 PolarHBondContact O-N 3.22Å; T383-I386 PolarHBondContact O-N 2.68Å; I386-N388 PolarHBondContact O-N 3.17Å; I386-N388 VanDerWaalsContact O-N 3.14Å; I386-L389 HydrophobicContact CB-CD1 4.42Å; I386-L389 HydrophobicContact CG2-CD1 4.21Å; I386-L389 WeakPolarHBondContact O-CG 3.29Å; I386-L389 PolarHBondContact O-N 2.95Å
387	P	87.4	Confident	85.4	Confident	5 Å²	5	62 Å²	62	3%	0.032	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-63.6	-18.3	-179.3	-22.1	34.6	0	0	0	114.7	W354 E384 E385 N393 F394 T396	W354-P387 HydrophobicContact CG-CG 4.26Å; E384-P387 WeakPolarHBondContact O-CD 3.31Å; E385-P387 VanDerWaalsContact C-CD 3.47Å; P387-N393 VanDerWaalsContact O-CA 3.3Å; P387-N393 WeakPolarHBondContact O-CA 3.36Å; P387-F394 HydrophobicContact CB-CD2 4.22Å; P387-F394 HydrophobicContact CB-CE1 4.15Å; P387-F394 HydrophobicContact CB-CE2 3.82Å; P387-F394 HydrophobicContact CB-CZ 3.76Å; P387-F394 HydrophobicContact CG-CE2 3.97Å; P387-F394 HydrophobicContact CG-CZ 3.79Å; P387-F394 PolarHBondContact O-N 2.97Å; P387-F394 VanDerWaalsContact O-N 3.09Å; P387-T396 HydrophobicContact CB-CG2 3.85Å; P387-T396 HydrophobicContact CG-CG2 3.55Å
388	N	85.9	Confident	85.4	Confident	116 Å²	116	59.5 Å²	59.5	62%	0.62	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-103.8	5.6	-176.9	-64.1	-46	0	0	0	113.3	E385 I386	E385-N388 PolarHBondContact O-N 2.79Å; I386-N388 PolarHBondContact O-N 3.17Å; I386-N388 VanDerWaalsContact O-N 3.14Å
389	L	84.4	Confident	85.5	Confident	34 Å²	34	58.3 Å²	58.3	18%	0.178	29%	0.294	C	S	.	.	S	Bend	trans	-62.7	144.9	179.2	-70.3	171.6	0	0	0	112.5	I345 I381 I386 N391 S392 N393	I345-L389 HydrophobicContact CD1-CD1 4.21Å; I381-L389 HydrophobicContact CD1-CD1 4.15Å; I381-L389 HydrophobicContact CD1-CD2 4.16Å; I381-L389 HydrophobicContact CG2-CD1 4.36Å; I381-L389 HydrophobicContact CG2-CD2 4.17Å; I386-L389 HydrophobicContact CB-CD1 4.42Å; I386-L389 HydrophobicContact CG2-CD1 4.21Å; I386-L389 WeakPolarHBondContact O-CG 3.29Å; I386-L389 PolarHBondContact O-N 2.95Å; L389-N391 PolarHBondContact O-N 3.01Å; L389-S392 CarbonylContact O-C 3.44Å; L389-S392 PolarHBondContact O-N 2.84Å; L389-N393 PolarHBondContact O-N 3.39Å
390	E	71.8	Confident	85.4	Confident	175 Å²	175	57.3 Å²	57.3	82%	0.818	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	129.9	177.6	-66.3	-175.9	176.2	0	0	111.2	S392	E390-S392 PolarHBondContact O-N 2.91Å
391	N	73.2	Confident	85.4	Confident	118 Å²	118	55 Å²	55	63%	0.631	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.2	1	-175.4	-48.5	-69	0	0	0	116.2	P344 I345 L389	P344-N391 HydrophobicContact CB-CB 3.99Å; I345-N391 CarbonylContact O-C 3.53Å; L389-N391 PolarHBondContact O-N 3.01Å
392	S	80.4	Confident	85.3	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.276	C	S	.	.			trans	-122.7	17.1	177.2	-149.9	0	0	0	0	113.4	I345 N346 G350 L389 E390 F394	I345-S392 WeakPolarHBondContact CG2-OG 3.2Å; I345-S392 WeakPolarHBondContact O-CA 3.3Å; I345-S392 WeakPolarHBondContact O-CB 3.21Å; I345-S392 PolarHBondContact O-N 2.96Å; N346-S392 PolarHBondContact O-OG 3.02Å; G350-S392 VanDerWaalsContact CA-OG 3.26Å; G350-S392 WeakPolarHBondContact CA-OG 3.5Å; G350-S392 PolarHBondContact N-OG 2.94Å; L389-S392 CarbonylContact O-C 3.44Å; L389-S392 PolarHBondContact O-N 2.84Å; E390-S392 PolarHBondContact O-N 2.91Å; S392-F394 WeakPolarHBondContact O-CD1 3.21Å; S392-F394 PolarHBondContact O-N 2.96Å
393	N	82.4	Confident	85.2	Confident	110 Å²	110	50.8 Å²	50.8	59%	0.588	26%	0.26	S	S	*	.			trans	-61.4	122.4	-174.8	-169.4	-79.9	0	0	0	112	P387 L389	P387-N393 VanDerWaalsContact O-CA 3.3Å; P387-N393 WeakPolarHBondContact O-CA 3.36Å; L389-N393 PolarHBondContact O-N 3.39Å
394	F	87.8	Confident	85	Confident	11 Å²	11	52.3 Å²	52.3	5%	0.048	27%	0.266	C	S	.	.			trans	-142.5	151.4	172.4	64.8	-93.8	0	0	0	112	V347 G350 I351 W354 P387 S392 T396 I399	V347-F394 HydrophobicContact CG1-CB 4Å; V347-F394 HydrophobicContact CG1-CD1 4.49Å; G350-F394 VanDerWaalsContact C-CE1 3.45Å; I351-F394 HydrophobicContact CD1-CG 4.35Å; I351-F394 HydrophobicContact CG1-CB 4.45Å; I351-F394 HydrophobicContact CG1-CD1 3.68Å; I351-F394 HydrophobicContact CG1-CD2 3.86Å; I351-F394 HydrophobicContact CG1-CE1 3.84Å; I351-F394 HydrophobicContact CG1-CE2 3.97Å; I351-F394 HydrophobicContact CG1-CG 3.73Å; I351-F394 HydrophobicContact CG1-CZ 3.98Å; W354-F394 HydrophobicContact CB-CZ 3.86Å; W354-F394 HydrophobicContact CD2-CE2 4.08Å; W354-F394 HydrophobicContact CD2-CZ 4.13Å; W354-F394 AromaticContact CE3-CE2 3.91Å; W354-F394 HydrophobicContact CE3-CE2 3.91Å; W354-F394 HydrophobicContact CE3-CZ 4.22Å; W354-F394 HydrophobicContact CG-CE2 4.43Å; W354-F394 HydrophobicContact CG-CZ 4Å; W354-F394 HydrophobicContact CZ3-CE2 4.41Å; P387-F394 HydrophobicContact CB-CD2 4.22Å; P387-F394 HydrophobicContact CB-CE1 4.15Å; P387-F394 HydrophobicContact CB-CE2 3.82Å; P387-F394 HydrophobicContact CB-CZ 3.76Å; P387-F394 HydrophobicContact CG-CE2 3.97Å; P387-F394 HydrophobicContact CG-CZ 3.79Å; P387-F394 PolarHBondContact O-N 2.97Å; P387-F394 VanDerWaalsContact O-N 3.09Å; S392-F394 WeakPolarHBondContact O-CD1 3.21Å; S392-F394 PolarHBondContact O-N 2.96Å; F394-T396 HydrophobicContact CE2-CG2 4.3Å; F394-I399 HydrophobicContact CD2-CG1 4.16Å; F394-I399 HydrophobicContact CE2-CG1 4.43Å
395	S	86.2	Confident	85	Confident	54 Å²	54	47.2 Å²	47.2	38%	0.378	24%	0.242	S	C	.	.			trans	-84	119.6	176.6	176.8	0	0	0	0	110.8	K397 V398 I399	S395-K397 PolarHBondContact O-N 2.8Å; S395-K397 PolarHBondContact OG-N 2.9Å; S395-V398 PolarHBondContact O-N 3.05Å; S395-V398 PolarHBondContact OG-N 3.14Å; S395-I399 PolarHBondContact O-N 3.43Å
396	T	87	Confident	85	Confident	25 Å²	25	43.4 Å²	43.4	15%	0.153	23%	0.225	C	C	.	.	H	α-helix	trans	-63	-31.4	173.9	55.5	0	0	0	0	112	W354 P387 F394 I399 K400	W354-T396 HydrophobicContact CH2-CG2 3.99Å; W354-T396 HydrophobicContact CZ2-CG2 3.48Å; W354-T396 VanDerWaalsContact CZ2-CG2 3.48Å; P387-T396 HydrophobicContact CB-CG2 3.85Å; P387-T396 HydrophobicContact CG-CG2 3.55Å; F394-T396 HydrophobicContact CE2-CG2 4.3Å; T396-I399 PolarHBondContact O-N 2.91Å; T396-K400 PolarHBondContact O-N 3.29Å
397	K	84.3	Confident	84.9	Confident	90 Å²	90	44.2 Å²	44.2	39%	0.391	23%	0.229	S	C	.	.	H	α-helix	trans	-61.9	-42.7	173.4	-69.6	178.2	175.3	168.6	0	111.7	G44 N45 S395 I399 K400 D401	G44-K397 WeakPolarHBondContact O-CE 3.14Å; G44-K397 PolarHBondContact O-NZ 3.36Å; N45-K397 WeakPolarHBondContact OD1-CE 3.36Å; N45-K397 PolarHBondContact OD1-NZ 3.02Å; S395-K397 PolarHBondContact O-N 2.8Å; S395-K397 PolarHBondContact OG-N 2.9Å; K397-I399 VanDerWaalsContact C-N 3.3Å; K397-I399 PolarHBondContact O-N 3.36Å; K397-K400 CarbonylContact O-C 3.54Å; K397-K400 WeakPolarHBondContact O-CA 3.2Å; K397-K400 VanDerWaalsContact O-CB 3.3Å; K397-K400 WeakPolarHBondContact O-CB 3.28Å; K397-K400 PolarHBondContact O-N 3.31Å; K397-K400 VanDerWaalsContact O-N 3.09Å; K397-D401 VanDerWaalsContact O-CG 3.23Å; K397-D401 PolarHBondContact O-N 2.87Å; K397-D401 VanDerWaalsContact O-OD2 3.11Å
398	V	87	Confident	84.8	Confident	34 Å²	34	45.9 Å²	45.9	21%	0.206	24%	0.241	C	C	.	.	H	α-helix	trans	-63	-39	177.3	175.7	0	0	0	0	111	Y138 S395 K400 D401 I402	Y138-V398 WeakPolarHBondContact OH-CG1 3.4Å; S395-V398 PolarHBondContact O-N 3.05Å; S395-V398 PolarHBondContact OG-N 3.14Å; V398-K400 VanDerWaalsContact C-N 3.32Å; V398-K400 PolarHBondContact O-N 2.98Å; V398-D401 PolarHBondContact O-N 3.47Å; V398-I402 HydrophobicContact CG1-CD1 3.78Å; V398-I402 HydrophobicContact CG1-CG1 4.36Å; V398-I402 WeakPolarHBondContact O-CB 3.26Å; V398-I402 VanDerWaalsContact O-CD1 3.29Å; V398-I402 WeakPolarHBondContact O-CD1 3.37Å; V398-I402 WeakPolarHBondContact O-CG1 3.36Å; V398-I402 PolarHBondContact O-N 2.82Å
399	I	88	Confident	84.9	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.9	-37.9	175.2	-53.3	-59.1	0	0	0	111.6	L134 Y138 I351 W354 F394 S395 T396 K397 I402 A403	L134-I399 HydrophobicContact CB-CG2 4.27Å; L134-I399 HydrophobicContact CD1-CG2 4.22Å; Y138-I399 HydrophobicContact CD2-CD1 4.32Å; Y138-I399 HydrophobicContact CE2-CD1 3.47Å; Y138-I399 VanDerWaalsContact CE2-CD1 3.47Å; I351-I399 HydrophobicContact CD1-CD1 3.87Å; I351-I399 HydrophobicContact CG1-CD1 4.23Å; I351-I399 HydrophobicContact CG2-CD1 4.38Å; W354-I399 HydrophobicContact CZ3-CB 4.06Å; W354-I399 HydrophobicContact CZ3-CG1 4.25Å; W354-I399 HydrophobicContact CZ3-CG2 3.89Å; F394-I399 HydrophobicContact CD2-CG1 4.16Å; F394-I399 HydrophobicContact CE2-CG1 4.43Å; S395-I399 PolarHBondContact O-N 3.43Å; T396-I399 PolarHBondContact O-N 2.91Å; K397-I399 VanDerWaalsContact C-N 3.3Å; K397-I399 PolarHBondContact O-N 3.36Å; I399-I402 HydrophobicContact CD1-CD1 4.26Å; I399-I402 PolarHBondContact O-N 3.39Å; I399-A403 PolarHBondContact O-N 3.02Å
400	K	86.5	Confident	85.1	Confident	50 Å²	50	39.2 Å²	39.2	22%	0.217	21%	0.205	C	C	.	.	H	α-helix	trans	-59.8	-50.2	171.1	170.7	-174.3	176.7	167.2	0	111.6	F312 E313 T396 K397 V398 I402 A403 Q404	F312-K400 HydrophobicContact CE1-CB 4.36Å; E313-K400 VanDerWaalsContact CD-NZ 3.26Å; E313-K400 HydrophobicContact CG-CD 3.7Å; E313-K400 HydrophobicContact CG-CG 4.05Å; E313-K400 IonicContact OE1-NZ 3.45Å; E313-K400 IonicContact OE2-NZ 2.7Å; E313-K400 PolarHBondContact OE2-NZ 3.42Å; T396-K400 PolarHBondContact O-N 3.29Å; K397-K400 CarbonylContact O-C 3.54Å; K397-K400 WeakPolarHBondContact O-CA 3.2Å; K397-K400 VanDerWaalsContact O-CB 3.3Å; K397-K400 WeakPolarHBondContact O-CB 3.28Å; K397-K400 PolarHBondContact O-N 3.31Å; K397-K400 VanDerWaalsContact O-N 3.09Å; V398-K400 VanDerWaalsContact C-N 3.32Å; V398-K400 PolarHBondContact O-N 2.98Å; K400-I402 VanDerWaalsContact C-N 3.27Å; K400-I402 PolarHBondContact O-N 3.3Å; K400-A403 WeakPolarHBondContact O-CB 3.4Å; K400-A403 PolarHBondContact O-N 2.82Å; K400-A403 VanDerWaalsContact O-N 3.09Å; K400-Q404 PolarHBondContact O-N 3.39Å
401	D	86.4	Confident	85.7	Confident	24 Å²	24	33.8 Å²	33.8	13%	0.128	18%	0.179	C	C	.	.	H	α-helix	trans	-60.2	-40.7	-179.6	-61.4	-37.3	0	0	0	110.8	K397 V398 Q404 N405 L573	K397-D401 VanDerWaalsContact O-CG 3.23Å; K397-D401 PolarHBondContact O-N 2.87Å; K397-D401 VanDerWaalsContact O-OD2 3.11Å; V398-D401 PolarHBondContact O-N 3.47Å; D401-Q404 PolarHBondContact O-N 3.33Å; D401-N405 WeakPolarHBondContact O-CB 3.46Å; D401-N405 PolarHBondContact O-N 3.02Å; D401-N405 PolarHBondContact O-ND2 3.29Å; D401-N405 VanDerWaalsContact O-ND2 3.13Å; D401-L573 CarbonylContact C-O 3.53Å
402	I	88.8	Confident	86.2	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-60.9	-46.2	174.2	-66.3	159.7	0	0	0	111.2	L134 P137 Y138 V398 I399 K400 I406 L573	L134-I402 HydrophobicContact CD2-CG2 4.35Å; P137-I402 HydrophobicContact CB-CD1 4.23Å; P137-I402 HydrophobicContact CG-CD1 3.59Å; P137-I402 HydrophobicContact CG-CG1 3.88Å; P137-I402 HydrophobicContact CG-CG2 4.2Å; Y138-I402 HydrophobicContact CE2-CD1 3.72Å; V398-I402 HydrophobicContact CG1-CD1 3.78Å; V398-I402 HydrophobicContact CG1-CG1 4.36Å; V398-I402 WeakPolarHBondContact O-CB 3.26Å; V398-I402 VanDerWaalsContact O-CD1 3.29Å; V398-I402 WeakPolarHBondContact O-CD1 3.37Å; V398-I402 WeakPolarHBondContact O-CG1 3.36Å; V398-I402 PolarHBondContact O-N 2.82Å; I399-I402 HydrophobicContact CD1-CD1 4.26Å; I399-I402 PolarHBondContact O-N 3.39Å; K400-I402 VanDerWaalsContact C-N 3.27Å; K400-I402 PolarHBondContact O-N 3.3Å; I402-I406 HydrophobicContact CG2-CD1 3.6Å; I402-I406 HydrophobicContact CG2-CG1 4.27Å; I402-I406 WeakPolarHBondContact O-CB 3.24Å; I402-I406 VanDerWaalsContact O-CG1 3.26Å; I402-I406 WeakPolarHBondContact O-CG1 3.15Å; I402-I406 PolarHBondContact O-N 2.74Å; I402-L573 VanDerWaalsContact CA-O 3.26Å; I402-L573 WeakPolarHBondContact CA-O 2.92Å; I402-L573 HydrophobicContact CG1-CB 4.31Å; I402-L573 WeakPolarHBondContact CG1-O 3.49Å; I402-L573 PolarHBondContact N-O 2.66Å
403	A	87.3	Confident	86.5	Confident	6 Å²	6	32.1 Å²	32.1	5%	0.05	17%	0.173	C	C	.	.	H	α-helix	trans	-60	-48.9	178.9	0	0	0	0	0	111.6	L134 F312 I315 I399 K400 L407	L134-A403 HydrophobicContact CD2-CB 3.45Å; L134-A403 VanDerWaalsContact CD2-CB 3.45Å; F312-A403 HydrophobicContact CD1-CB 4.16Å; F312-A403 HydrophobicContact CE1-CB 3.98Å; I315-A403 HydrophobicContact CD1-CB 4.08Å; I399-A403 PolarHBondContact O-N 3.02Å; K400-A403 WeakPolarHBondContact O-CB 3.4Å; K400-A403 PolarHBondContact O-N 2.82Å; K400-A403 VanDerWaalsContact O-N 3.09Å; A403-L407 WeakPolarHBondContact O-CB 3.15Å; A403-L407 PolarHBondContact O-N 3.28Å
404	Q	85.9	Confident	86.7	Confident	44 Å²	44	26.9 Å²	26.9	21%	0.206	15%	0.145	C	C	.	.	H	α-helix	trans	-66.1	-43.3	-179.6	-72.4	-176.8	-29.6	0	0	111.8	D314 I315 K400 D401 L407 S408	D314-Q404 PolarHBondContact OD1-NE2 3.2Å; I315-Q404 HydrophobicContact CD1-CG 4.12Å; K400-Q404 PolarHBondContact O-N 3.39Å; D401-Q404 PolarHBondContact O-N 3.33Å; Q404-L407 PolarHBondContact O-N 3.01Å; Q404-S408 VanDerWaalsContact O-CB 3.23Å; Q404-S408 WeakPolarHBondContact O-CB 3.3Å; Q404-S408 PolarHBondContact O-N 3.49Å; Q404-S408 PolarHBondContact O-OG 2.73Å
405	N	88.4	Confident	86.4	Confident	4 Å²	4	30.5 Å²	30.5	2%	0.021	17%	0.168	C	C	.	.	H	α-helix	trans	-66.4	-44.5	179.1	-76.7	-31.5	0	0	0	112.4	D401 S408 F409 L573 V575 Y579	D401-N405 WeakPolarHBondContact O-CB 3.46Å; D401-N405 PolarHBondContact O-N 3.02Å; D401-N405 PolarHBondContact O-ND2 3.29Å; D401-N405 VanDerWaalsContact O-ND2 3.13Å; N405-S408 PolarHBondContact O-N 2.84Å; N405-F409 WeakPolarHBondContact O-CB 3.43Å; N405-F409 PolarHBondContact O-N 3.19Å; N405-L573 HydrophobicContact CB-CD2 4.15Å; N405-L573 PolarHBondContact ND2-O 3.07Å; N405-V575 PolarHBondContact ND2-O 3.21Å; N405-Y579 HydrophobicContact CB-CD2 3.84Å; N405-Y579 HydrophobicContact CB-CE2 4.38Å
406	I	88	Confident	86.2	Confident	12 Å²	12	32.5 Å²	32.5	6%	0.062	17%	0.17	C	C	.	.	H	α-helix	trans	-63.1	-46.2	176.8	-69.5	173.8	0	0	0	110.2	L133 I136 I402 F409 L410 L573	L133-I406 HydrophobicContact CB-CD1 4.33Å; L133-I406 VanDerWaalsContact O-CD1 3.24Å; L133-I406 WeakPolarHBondContact O-CD1 3.07Å; I136-I406 HydrophobicContact CD1-CD1 4.32Å; I402-I406 HydrophobicContact CG2-CD1 3.6Å; I402-I406 HydrophobicContact CG2-CG1 4.27Å; I402-I406 WeakPolarHBondContact O-CB 3.24Å; I402-I406 VanDerWaalsContact O-CG1 3.26Å; I402-I406 WeakPolarHBondContact O-CG1 3.15Å; I402-I406 PolarHBondContact O-N 2.74Å; I406-F409 PolarHBondContact O-N 3.03Å; I406-L410 HydrophobicContact CG2-CD1 4.01Å; I406-L410 HydrophobicContact CG2-CG 4.38Å; I406-L410 WeakPolarHBondContact O-CG 3.43Å; I406-L410 PolarHBondContact O-N 2.87Å; I406-L573 HydrophobicContact CD1-CD1 4.09Å; I406-L573 HydrophobicContact CG1-CD1 3.9Å; I406-L573 HydrophobicContact CG1-CD2 3.83Å; I406-L573 HydrophobicContact CG1-CG 4.41Å
407	L	85.3	Confident	85.9	Confident	16 Å²	16	33.3 Å²	33.3	8%	0.084	17%	0.172	C	C	.	.	H	α-helix	trans	-65.5	-41.5	-179.5	-175.6	61.9	0	0	0	111.8	D122 V123 L154 I315 A403 Q404 L410 K411	D122-L407 HydrophobicContact CB-CD2 4.32Å; V123-L407 HydrophobicContact CG2-CD1 3.48Å; V123-L407 VanDerWaalsContact CG2-CD1 3.48Å; L154-L407 HydrophobicContact CD1-CD1 3.99Å; I315-L407 HydrophobicContact CB-CD2 4.23Å; I315-L407 HydrophobicContact CD1-CD2 3.94Å; I315-L407 HydrophobicContact CG1-CD2 3.87Å; I315-L407 HydrophobicContact CG2-CD2 3.4Å; A403-L407 WeakPolarHBondContact O-CB 3.15Å; A403-L407 PolarHBondContact O-N 3.28Å; Q404-L407 PolarHBondContact O-N 3.01Å; L407-L410 PolarHBondContact O-N 3.07Å; L407-K411 HydrophobicContact CD1-CD 4.3Å; L407-K411 HydrophobicContact CD1-CG 4.21Å; L407-K411 HydrophobicContact CG-CD 4.06Å; L407-K411 HydrophobicContact CG-CG 4.36Å; L407-K411 WeakPolarHBondContact O-CB 3.18Å; L407-K411 WeakPolarHBondContact O-CG 3.38Å; L407-K411 PolarHBondContact O-N 3.05Å
408	S	85.8	Confident	85.6	Confident	40 Å²	40	29.1 Å²	29.1	28%	0.28	15%	0.154	S	C	.	.	H	α-helix	trans	-64.7	-41	176.1	-57.3	0	0	0	0	111.2	Q404 N405 K411 S412	Q404-S408 VanDerWaalsContact O-CB 3.23Å; Q404-S408 WeakPolarHBondContact O-CB 3.3Å; Q404-S408 PolarHBondContact O-N 3.49Å; Q404-S408 PolarHBondContact O-OG 2.73Å; N405-S408 PolarHBondContact O-N 2.84Å; S408-K411 PolarHBondContact O-N 3.2Å; S408-S412 VanDerWaalsContact O-CB 3.25Å; S408-S412 WeakPolarHBondContact O-CB 3.49Å; S408-S412 PolarHBondContact O-N 3.24Å; S408-S412 PolarHBondContact O-OG 2.98Å
409	F	88.6	Confident	85.5	Confident	7 Å²	7	28.7 Å²	28.7	3%	0.031	15%	0.15	C	C	.	.	H	α-helix	trans	-60.3	-46.7	172.5	175.5	-96.5	0	0	0	111.9	N405 I406 S412 N413 L423 L434 A565 I567 Y579	N405-F409 WeakPolarHBondContact O-CB 3.43Å; N405-F409 PolarHBondContact O-N 3.19Å; I406-F409 PolarHBondContact O-N 3.03Å; F409-S412 WeakPolarHBondContact CA-OG 3.39Å; F409-S412 PolarHBondContact O-N 3.34Å; F409-S412 PolarHBondContact O-OG 3.21Å; F409-N413 WeakPolarHBondContact CD2-ND2 3.46Å; F409-N413 WeakPolarHBondContact CE2-ND2 3.37Å; F409-N413 WeakPolarHBondContact O-CB 3.4Å; F409-N413 PolarHBondContact O-N 3.47Å; F409-N413 VanDerWaalsContact O-N 3.14Å; F409-N413 PolarHBondContact O-ND2 2.87Å; F409-L423 HydrophobicContact CE1-CD1 4.29Å; F409-L434 HydrophobicContact CE1-CB 4.27Å; F409-L434 HydrophobicContact CE1-CD2 4.33Å; F409-L434 HydrophobicContact CZ-CB 4.34Å; F409-A565 HydrophobicContact CE2-CB 3.9Å; F409-A565 HydrophobicContact CZ-CB 3.66Å; F409-I567 HydrophobicContact CD1-CD1 3.85Å; F409-I567 HydrophobicContact CD1-CG1 4.43Å; F409-I567 HydrophobicContact CD2-CD1 4.11Å; F409-I567 HydrophobicContact CD2-CG1 3.89Å; F409-I567 HydrophobicContact CE1-CD1 3.89Å; F409-I567 HydrophobicContact CE1-CG1 4.23Å; F409-I567 HydrophobicContact CE2-CD1 4.14Å; F409-I567 HydrophobicContact CE2-CG1 3.65Å; F409-I567 HydrophobicContact CG-CD1 3.97Å; F409-I567 HydrophobicContact CG-CG1 4.27Å; F409-I567 HydrophobicContact CZ-CD1 4.03Å; F409-I567 HydrophobicContact CZ-CG1 3.83Å; F409-Y579 HydrophobicContact CD2-CD1 4.37Å; F409-Y579 AromaticContact CD2-CE1 3.97Å; F409-Y579 HydrophobicContact CD2-CE1 3.97Å
410	L	88.8	Confident	85.5	Confident	3 Å²	3	28.8 Å²	28.8	2%	0.016	15%	0.15	C	C	.	.	H	α-helix	trans	-67.3	-44.4	178.2	-68.8	175.9	0	0	0	111.7	V147 L154 L156 I406 L407 S412 N413 C414 L423 L434	V147-L410 HydrophobicContact CG2-CD2 4.25Å; L154-L410 HydrophobicContact CD1-CB 3.8Å; L156-L410 HydrophobicContact CD2-CD1 4.27Å; I406-L410 HydrophobicContact CG2-CD1 4.01Å; I406-L410 HydrophobicContact CG2-CG 4.38Å; I406-L410 WeakPolarHBondContact O-CG 3.43Å; I406-L410 PolarHBondContact O-N 2.87Å; L407-L410 PolarHBondContact O-N 3.07Å; L410-S412 VanDerWaalsContact C-N 3.31Å; L410-S412 PolarHBondContact O-N 2.97Å; L410-N413 PolarHBondContact O-N 3.37Å; L410-C414 WeakPolarHBondContact O-CA 3.46Å; L410-C414 WeakPolarHBondContact O-CB 3.49Å; L410-C414 PolarHBondContact O-N 3Å; L410-C414 PolarHBondContact O-SG 3.48Å; L410-C414 VanDerWaalsContact O-SG 3.42Å; L410-L423 HydrophobicContact CD2-CD1 4.29Å; L410-L434 HydrophobicContact CD2-CD1 4.14Å
411	K	84.3	Confident	85.7	Confident	62 Å²	62	26.4 Å²	26.4	27%	0.27	14%	0.14	S	C	.	.	H	α-helix	trans	-64.2	-33.9	178.1	-75.5	-179.3	173.3	-179.5	0	112.8	D122 L154 L407 S408	D122-K411 IonicContact OD1-NZ 2.8Å; D122-K411 PolarHBondContact OD1-NZ 3.2Å; L154-K411 HydrophobicContact CD1-CG 4.03Å; L407-K411 HydrophobicContact CD1-CD 4.3Å; L407-K411 HydrophobicContact CD1-CG 4.21Å; L407-K411 HydrophobicContact CG-CD 4.06Å; L407-K411 HydrophobicContact CG-CG 4.36Å; L407-K411 WeakPolarHBondContact O-CB 3.18Å; L407-K411 WeakPolarHBondContact O-CG 3.38Å; L407-K411 PolarHBondContact O-N 3.05Å; S408-K411 PolarHBondContact O-N 3.2Å
412	S	83.8	Confident	85.8	Confident	37 Å²	37	25.3 Å²	25.3	26%	0.259	13%	0.134	S	C	.	.	H	α-helix	trans	-75.6	-30	178.1	51.9	0	0	0	0	114.4	S408 F409 L410 T415	S408-S412 VanDerWaalsContact O-CB 3.25Å; S408-S412 WeakPolarHBondContact O-CB 3.49Å; S408-S412 PolarHBondContact O-N 3.24Å; S408-S412 PolarHBondContact O-OG 2.98Å; F409-S412 WeakPolarHBondContact CA-OG 3.39Å; F409-S412 PolarHBondContact O-N 3.34Å; F409-S412 PolarHBondContact O-OG 3.21Å; L410-S412 VanDerWaalsContact C-N 3.31Å; L410-S412 PolarHBondContact O-N 2.97Å; S412-T415 WeakPolarHBondContact O-CG2 3.46Å
413	N	86.5	Confident	85.9	Confident	45 Å²	45	25.6 Å²	25.6	24%	0.241	14%	0.135	C	C	.	.	H	α-helix	trans	-106.2	-25.4	-174.3	-65.1	-78.9	0	0	0	113.2	F409 L410 T415 L434 A565	F409-N413 WeakPolarHBondContact CD2-ND2 3.46Å; F409-N413 WeakPolarHBondContact CE2-ND2 3.37Å; F409-N413 WeakPolarHBondContact O-CB 3.4Å; F409-N413 PolarHBondContact O-N 3.47Å; F409-N413 VanDerWaalsContact O-N 3.14Å; F409-N413 PolarHBondContact O-ND2 2.87Å; L410-N413 PolarHBondContact O-N 3.37Å; N413-T415 VanDerWaalsContact C-N 3.25Å; N413-T415 PolarHBondContact O-N 2.8Å; N413-T415 VanDerWaalsContact O-N 3.12Å; N413-L434 HydrophobicContact CB-CD2 3.68Å; N413-A565 HydrophobicContact CB-CB 3.92Å; N413-A565 VanDerWaalsContact CG-CB 3.5Å; N413-A565 VanDerWaalsContact OD1-CB 3.27Å; N413-A565 WeakPolarHBondContact OD1-CB 3.35Å
414	C	87.1	Confident	85.9	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.136	C	C	.	.			trans	-86.3	58.8	173.3	-60.7	0	0	0	0	111.5	R149 L154 L410 Y421	R149-C414 WeakPolarHBondContact CD-O 3.36Å; L154-C414 HydrophobicContact CD2-CB 4.24Å; L410-C414 WeakPolarHBondContact O-CA 3.46Å; L410-C414 WeakPolarHBondContact O-CB 3.49Å; L410-C414 PolarHBondContact O-N 3Å; L410-C414 PolarHBondContact O-SG 3.48Å; L410-C414 VanDerWaalsContact O-SG 3.42Å; C414-Y421 HydrophobicContact CB-CD2 3.66Å; C414-Y421 HydrophobicContact CB-CE2 3.53Å; C414-Y421 HydrophobicContact CB-CG 4.29Å; C414-Y421 WeakPolarHBondContact SG-CD2 3.43Å; C414-Y421 VanDerWaalsContact SG-CG 3.56Å
415	T	80.3	Confident	86	Confident	87 Å²	87	24 Å²	24	53%	0.534	13%	0.127	S	C	.	.			trans	-80	-26.2	-169.2	55.2	0	0	0	0	114.5	S412 N413 Y421	S412-T415 WeakPolarHBondContact O-CG2 3.46Å; N413-T415 VanDerWaalsContact C-N 3.25Å; N413-T415 PolarHBondContact O-N 2.8Å; N413-T415 VanDerWaalsContact O-N 3.12Å; T415-Y421 PolarHBondContact N-OH 3.39Å
416	K	81.6	Confident	85.7	Confident	97 Å²	97	25.4 Å²	25.4	42%	0.422	14%	0.139	S	C	.	.	S	Bend	trans	-86.2	118.5	-176.9	-58.4	178.9	-176	171.4	0	110.1	H419 Y421 D436 T439	K416-H419 HydrophobicContact CB-CB 4.12Å; K416-H419 VanDerWaalsContact CB-CD2 3.46Å; K416-H419 WeakPolarHBondContact CB-CD2 2.9Å; K416-H419 WeakPolarHBondContact CD-CE1 3.36Å; K416-H419 WeakPolarHBondContact O-CB 3.41Å; K416-H419 PolarHBondContact O-N 3.1Å; K416-Y421 WeakPolarHBondContact CB-OH 3.26Å; K416-Y421 PolarHBondContact N-OH 2.71Å; K416-Y421 VanDerWaalsContact N-OH 3.07Å; K416-D436 IonicContact NZ-OD2 3.74Å; K416-T439 PolarHBondContact NZ-OG1 3.29Å
417	E	81.3	Confident	85.5	Confident	42 Å²	42	27.9 Å²	27.9	20%	0.196	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	141.5	173.9	-73	-173.9	179.4	0	0	111.5	R149 H419 T483 N487	R149-E417 HydrophobicContact CG-CG 4.47Å; E417-H419 PolarHBondContact O-N 3.47Å; E417-T483 WeakPolarHBondContact OE2-CG2 3.38Å; E417-N487 WeakPolarHBondContact CB-ND2 3.35Å; E417-N487 PolarHBondContact OE2-ND2 3.32Å; E417-N487 VanDerWaalsContact OE2-ND2 3.11Å
418	G	78.1	Confident	85.2	Confident	2 Å²	2	29.5 Å²	29.5	2%	0.021	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.3	-2.9	-178.3	0	0	0	0	0	114.7	R149 V456	R149-G418 PolarHBondContact O-N 3.49Å; G418-V456 WeakPolarHBondContact O-CG1 3.34Å
419	H	85.1	Confident	85.1	Confident	25 Å²	25	29.3 Å²	29.3	12%	0.116	18%	0.177	C	C	.	.			trans	-82.5	152.8	175.1	-78.1	-128.9	0	0	0	112.2	R149 K416 E417 Y421 D436	R149-H419 PolarHBondContact N-O 3.16Å; R149-H419 VanDerWaalsContact N-O 3.14Å; K416-H419 HydrophobicContact CB-CB 4.12Å; K416-H419 VanDerWaalsContact CB-CD2 3.46Å; K416-H419 WeakPolarHBondContact CB-CD2 2.9Å; K416-H419 WeakPolarHBondContact CD-CE1 3.36Å; K416-H419 WeakPolarHBondContact O-CB 3.41Å; K416-H419 PolarHBondContact O-N 3.1Å; E417-H419 PolarHBondContact O-N 3.47Å; H419-Y421 HydrophobicContact CB-CD2 4.34Å; H419-Y421 HydrophobicContact CB-CE2 3.61Å; H419-D436 IonicContact CE1-OD1 3.71Å; H419-D436 IonicContact CE1-OD2 2.7Å; H419-D436 IonicContact CG-OD1 2.89Å; H419-D436 IonicContact CG-OD2 3.17Å; H419-D436 VanDerWaalsContact ND1-CG 3.35Å; H419-D436 IonicContact ND1-OD1 2.73Å; H419-D436 PolarHBondContact ND1-OD1 3.23Å; H419-D436 IonicContact ND1-OD2 3.84Å; H419-D436 PolarHBondContact ND1-OD2 2.82Å
420	T	87.9	Confident	84.8	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.006	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	122.6	169.7	-60.5	0	0	0	0	109.3	A146 H148 L437 T438 F452	A146-T420 HydrophobicContact CB-CG2 4.36Å; H148-T420 WeakPolarHBondContact CE1-CG2 3.46Å; H148-T420 VanDerWaalsContact ND1-CG2 3.3Å; H148-T420 WeakPolarHBondContact ND1-CG2 3.38Å; H148-T420 PolarHBondContact ND1-OG1 3.26Å; T420-L437 HydrophobicContact CG2-CD1 4.23Å; T420-L437 WeakPolarHBondContact O-CB 3.4Å; T420-L437 PolarHBondContact O-N 2.85Å; T420-T438 PolarHBondContact N-OG1 3.08Å; T420-T438 PolarHBondContact O-N 2.81Å; T420-F452 HydrophobicContact CG2-CB 4.37Å; T420-F452 HydrophobicContact CG2-CD2 3.8Å; T420-F452 HydrophobicContact CG2-CE2 4.33Å; T420-F452 HydrophobicContact CG2-CG 4.22Å; T420-F452 WeakPolarHBondContact OG1-CB 3.25Å
421	Y	89.9	Confident	84.7	Confident	1 Å²	1	37.2 Å²	37.2	0%	0.004	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	151.2	177.9	-57.1	-94.4	0	0	0	110.7	A146 V147 R149 C414 T415 K416 H419 L434 Y435 D436	A146-Y421 CarbonylContact C-O 3.54Å; A146-Y421 WeakPolarHBondContact CA-O 3.4Å; V147-Y421 PolarHBondContact N-O 2.86Å; V147-Y421 PolarHBondContact O-N 2.96Å; R149-Y421 HydrophobicContact CB-CE2 4.47Å; C414-Y421 HydrophobicContact CB-CD2 3.66Å; C414-Y421 HydrophobicContact CB-CE2 3.53Å; C414-Y421 HydrophobicContact CB-CG 4.29Å; C414-Y421 WeakPolarHBondContact SG-CD2 3.43Å; C414-Y421 VanDerWaalsContact SG-CG 3.56Å; T415-Y421 PolarHBondContact N-OH 3.39Å; K416-Y421 WeakPolarHBondContact CB-OH 3.26Å; K416-Y421 PolarHBondContact N-OH 2.71Å; K416-Y421 VanDerWaalsContact N-OH 3.07Å; H419-Y421 HydrophobicContact CB-CD2 4.34Å; H419-Y421 HydrophobicContact CB-CE2 3.61Å; Y421-L434 HydrophobicContact CD1-CD2 4.48Å; Y421-Y435 CarbonylContact C-O 3.6Å; Y421-Y435 WeakPolarHBondContact CA-O 3.49Å; Y421-D436 HydrophobicContact CD1-CB 3.92Å; Y421-D436 HydrophobicContact CE1-CB 3.85Å
422	W	89.6	Confident	84.9	Confident	1 Å²	1	34.4 Å²	34.4	0%	0.004	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	112	176.2	176.4	37	0	0	0	110.2	S144 M145 L159 I161 F180 Y181 L184 F424 L434 Y435 L437	S144-W422 PolarHBondContact OG-NE1 3.22Å; M145-W422 WeakPolarHBondContact O-CA 3.45Å; L159-W422 HydrophobicContact CD2-CD2 4.49Å; L159-W422 HydrophobicContact CD2-CG 3.99Å; I161-W422 HydrophobicContact CD1-CH2 4.15Å; I161-W422 HydrophobicContact CD1-CZ2 3.31Å; F180-W422 HydrophobicContact CD1-CZ3 4Å; F180-W422 HydrophobicContact CE1-CE3 4.29Å; F180-W422 AromaticContact CE1-CZ3 3.79Å; F180-W422 HydrophobicContact CE1-CZ3 3.79Å; Y181-W422 AromaticContact CD2-CH2 3.84Å; Y181-W422 HydrophobicContact CD2-CH2 3.84Å; Y181-W422 HydrophobicContact CD2-CZ2 4.11Å; Y181-W422 HydrophobicContact CE2-CH2 4.48Å; Y181-W422 HydrophobicContact CE2-CZ2 4.38Å; L184-W422 HydrophobicContact CD1-CH2 3.89Å; L184-W422 HydrophobicContact CD1-CZ3 3.7Å; W422-F424 HydrophobicContact CD2-CB 4.22Å; W422-F424 AromaticContact CE2-CD2 3.86Å; W422-F424 AromaticContact CE2-CG 4Å; W422-F424 HydrophobicContact CH2-CB 4.38Å; W422-F424 HydrophobicContact CH2-CD1 4.47Å; W422-F424 HydrophobicContact CH2-CD2 4.13Å; W422-F424 HydrophobicContact CH2-CG 4.07Å; W422-F424 HydrophobicContact CZ2-CB 3.81Å; W422-F424 HydrophobicContact CZ2-CD1 4.36Å; W422-F424 AromaticContact CZ2-CD2 3.31Å; W422-F424 HydrophobicContact CZ2-CD2 3.31Å; W422-F424 AromaticContact CZ2-CE2 3.93Å; W422-F424 HydrophobicContact CZ2-CE2 3.93Å; W422-F424 AromaticContact CZ2-CG 3.56Å; W422-F424 HydrophobicContact CZ2-CG 3.56Å; W422-L434 WeakPolarHBondContact O-CA 3.38Å; W422-Y435 HydrophobicContact CD2-CD2 4.23Å; W422-Y435 AromaticContact CE3-CD2 3.65Å; W422-Y435 HydrophobicContact CE3-CD2 3.65Å; W422-Y435 HydrophobicContact CE3-CE2 4.28Å; W422-Y435 HydrophobicContact CE3-CG 4.12Å; W422-Y435 HydrophobicContact CZ3-CD2 4.08Å; W422-Y435 HydrophobicContact CZ3-CE2 4.27Å; W422-Y435 PolarHBondContact N-O 3.24Å; W422-Y435 PolarHBondContact O-N 2.92Å; W422-L437 HydrophobicContact CB-CD1 3.8Å; W422-L437 HydrophobicContact CB-CD2 3.78Å; W422-L437 HydrophobicContact CB-CG 3.66Å; W422-L437 HydrophobicContact CE3-CD2 4.14Å; W422-L437 HydrophobicContact CG-CD2 4.44Å
423	L	90.7	Very high	85.1	Confident	5 Å²	5	34.7 Å²	34.7	3%	0.026	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	116.4	173.5	-173.9	74.3	0	0	0	108.9	L133 S144 M145 V147 F409 L410 V432 L434	L133-L423 HydrophobicContact CD2-CD2 3.59Å; S144-L423 WeakPolarHBondContact CA-O 3.21Å; M145-L423 HydrophobicContact CB-CB 4.49Å; M145-L423 PolarHBondContact N-O 3.02Å; M145-L423 PolarHBondContact O-N 2.87Å; V147-L423 HydrophobicContact CG2-CB 4.31Å; F409-L423 HydrophobicContact CE1-CD1 4.29Å; L410-L423 HydrophobicContact CD2-CD1 4.29Å; L423-V432 HydrophobicContact CD1-CG1 3.52Å; L423-V432 HydrophobicContact CG-CG1 4Å; L423-L434 HydrophobicContact CB-CD1 4.06Å; L423-L434 HydrophobicContact CD1-CD1 3.97Å
424	F	88.3	Confident	85.3	Confident	13 Å²	13	32.5 Å²	32.5	6%	0.057	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	133	-173.2	-177.5	-109.5	0	0	0	112.9	V143 Y181 I185 W422 A426 K433 Y435	V143-F424 CarbonylContact O-C 3.51Å; V143-F424 WeakPolarHBondContact O-CA 3.35Å; V143-F424 WeakPolarHBondContact O-CD2 3.42Å; Y181-F424 HydrophobicContact CE2-CE2 4.18Å; Y181-F424 HydrophobicContact CE2-CZ 4.43Å; I185-F424 HydrophobicContact CD1-CZ 3.85Å; I185-F424 HydrophobicContact CG1-CZ 4.25Å; W422-F424 HydrophobicContact CD2-CB 4.22Å; W422-F424 AromaticContact CE2-CD2 3.86Å; W422-F424 AromaticContact CE2-CG 4Å; W422-F424 HydrophobicContact CH2-CB 4.38Å; W422-F424 HydrophobicContact CH2-CD1 4.47Å; W422-F424 HydrophobicContact CH2-CD2 4.13Å; W422-F424 HydrophobicContact CH2-CG 4.07Å; W422-F424 HydrophobicContact CZ2-CB 3.81Å; W422-F424 HydrophobicContact CZ2-CD1 4.36Å; W422-F424 AromaticContact CZ2-CD2 3.31Å; W422-F424 HydrophobicContact CZ2-CD2 3.31Å; W422-F424 AromaticContact CZ2-CE2 3.93Å; W422-F424 HydrophobicContact CZ2-CE2 3.93Å; W422-F424 AromaticContact CZ2-CG 3.56Å; W422-F424 HydrophobicContact CZ2-CG 3.56Å; F424-A426 HydrophobicContact CE1-CB 4.06Å; F424-A426 HydrophobicContact CZ-CB 4.13Å; F424-K433 PolarHBondContact N-O 3.29Å; F424-K433 PolarHBondContact O-N 3.17Å; F424-Y435 HydrophobicContact CB-CD2 4.47Å; F424-Y435 HydrophobicContact CB-CE2 4.16Å
425	K	87.8	Confident	85.3	Confident	4 Å²	4	32.7 Å²	32.7	2%	0.017	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	121.5	168.8	-179.5	-179.6	-176.7	-76.2	0	108.7	I136 S139 H142 V143 S429 V432 V570	I136-K425 HydrophobicContact CG2-CD 3.68Å; S139-K425 PolarHBondContact O-NZ 3.27Å; S139-K425 VanDerWaalsContact O-NZ 3.14Å; H142-K425 CarbonylContact C-O 3.14Å; H142-K425 WeakPolarHBondContact CA-O 3.48Å; H142-K425 WeakPolarHBondContact CB-O 3.31Å; V143-K425 HydrophobicContact CB-CB 4.03Å; V143-K425 HydrophobicContact CG2-CB 4.49Å; V143-K425 PolarHBondContact N-O 3.3Å; V143-K425 PolarHBondContact O-N 3.21Å; K425-S429 WeakPolarHBondContact CE-O 3.45Å; K425-S429 PolarHBondContact NZ-O 2.9Å; K425-V432 HydrophobicContact CB-CG2 4.26Å; K425-V432 HydrophobicContact CD-CG2 4.1Å; K425-V432 HydrophobicContact CG-CG2 4.33Å; K425-V570 HydrophobicContact CD-CG2 4.41Å
426	A	82.3	Confident	85.6	Confident	33 Å²	33	28.9 Å²	28.9	27%	0.273	17%	0.169	S	C	.	.			trans	-70.5	153.9	175.4	0	0	0	0	0	111.7	F424 G428 S429	F424-A426 HydrophobicContact CE1-CB 4.06Å; F424-A426 HydrophobicContact CZ-CB 4.13Å; A426-G428 PolarHBondContact O-N 3.38Å; A426-S429 WeakPolarHBondContact O-CB 3.25Å; A426-S429 PolarHBondContact O-N 2.82Å; A426-S429 VanDerWaalsContact O-N 3.14Å
427	S	81.9	Confident	85.5	Confident	64 Å²	64	24.3 Å²	24.3	45%	0.448	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	127	177.1	-173.4	0	0	0	0	110.5	K140 S429	K140-S427 PolarHBondContact O-OG 3.21Å; S427-S429 PolarHBondContact O-N 3.15Å
428	G	79.4	Confident	85.5	Confident	51 Å²	51	22.6 Å²	22.6	53%	0.526	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.1	-0.6	-177.4	0	0	0	0	0	115.5	K140 A426	K140-G428 PolarHBondContact O-N 3.1Å; A426-G428 PolarHBondContact O-N 3.38Å
429	S	83.1	Confident	85.5	Confident	36 Å²	36	24.4 Å²	24.4	25%	0.252	15%	0.152	S	C	.	.			trans	-83.9	146.2	172.3	179.6	0	0	0	0	111.2	K425 A426 S427 I431	K425-S429 WeakPolarHBondContact CE-O 3.45Å; K425-S429 PolarHBondContact NZ-O 2.9Å; A426-S429 WeakPolarHBondContact O-CB 3.25Å; A426-S429 PolarHBondContact O-N 2.82Å; A426-S429 VanDerWaalsContact O-N 3.14Å; S427-S429 PolarHBondContact O-N 3.15Å; S429-I431 PolarHBondContact OG-N 3.16Å; S429-I431 VanDerWaalsContact OG-N 3.16Å
430	D	83.8	Confident	85.1	Confident	109 Å²	109	24 Å²	24	58%	0.583	15%	0.151	S	C	*	.	S	Bend	trans	-98.1	6.9	173.7	-67.8	-29.2	0	0	0	112.9	S569 V570	D430-S569 CarbonylContact O-C 3.52Å; D430-S569 WeakPolarHBondContact O-CA 3.15Å; D430-V570 WeakPolarHBondContact O-CG2 3.45Å; D430-V570 PolarHBondContact O-N 3.18Å
431	I	85.8	Confident	84.2	Confident	66 Å²	66	24.4 Å²	24.4	34%	0.338	15%	0.153	S	C	.	.			trans	-107.8	133.4	-179.8	-58.6	172.8	0	0	0	109.7	S429 K433 I566 I567	S429-I431 PolarHBondContact OG-N 3.16Å; S429-I431 VanDerWaalsContact OG-N 3.16Å; I431-K433 HydrophobicContact CG2-CG 3.93Å; I431-I566 HydrophobicContact CG2-CG2 3.53Å; I431-I567 WeakPolarHBondContact CA-O 3.44Å
432	V	88	Confident	83.1	Confident	3 Å²	3	30.2 Å²	30.2	2%	0.018	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	127.1	170.2	-171.5	0	0	0	0	108.7	I136 L423 K425 I566 I567 V570	I136-V432 HydrophobicContact CG2-CG2 4.18Å; L423-V432 HydrophobicContact CD1-CG1 3.52Å; L423-V432 HydrophobicContact CG-CG1 4Å; K425-V432 HydrophobicContact CB-CG2 4.26Å; K425-V432 HydrophobicContact CD-CG2 4.1Å; K425-V432 HydrophobicContact CG-CG2 4.33Å; V432-I566 WeakPolarHBondContact O-CA 3.47Å; V432-I567 HydrophobicContact CB-CB 4.17Å; V432-I567 HydrophobicContact CB-CD1 4.15Å; V432-I567 HydrophobicContact CG1-CD1 4.49Å; V432-I567 PolarHBondContact N-O 3.5Å; V432-I567 VanDerWaalsContact N-O 3.1Å; V432-I567 PolarHBondContact O-N 3.44Å; V432-V570 HydrophobicContact CG2-CG2 4.19Å
433	K	88.6	Confident	81.7	Confident	43 Å²	43	36.3 Å²	36.3	19%	0.187	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	142.9	-179.5	-59.8	-172.1	179.9	-168.2	0	110.1	F424 I431 Y435 D560 A563 I566	F424-K433 PolarHBondContact N-O 3.29Å; F424-K433 PolarHBondContact O-N 3.17Å; I431-K433 HydrophobicContact CG2-CG 3.93Å; K433-Y435 HydrophobicContact CB-CD2 4.43Å; K433-Y435 HydrophobicContact CB-CE2 3.61Å; K433-Y435 WeakPolarHBondContact CD-OH 3.31Å; K433-D560 IonicContact NZ-OD1 2.61Å; K433-D560 PolarHBondContact NZ-OD1 2.55Å; K433-A563 HydrophobicContact CB-CB 4.43Å; K433-A563 HydrophobicContact CD-CB 4.46Å; K433-I566 HydrophobicContact CG-CG1 4.3Å; K433-I566 HydrophobicContact CG-CG2 4.4Å
434	L	90.3	Very high	80.3	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126.5	174.5	-171.7	72.9	0	0	0	109.3	F409 L410 N413 Y421 W422 L423 V564 A565	F409-L434 HydrophobicContact CE1-CB 4.27Å; F409-L434 HydrophobicContact CE1-CD2 4.33Å; F409-L434 HydrophobicContact CZ-CB 4.34Å; L410-L434 HydrophobicContact CD2-CD1 4.14Å; N413-L434 HydrophobicContact CB-CD2 3.68Å; Y421-L434 HydrophobicContact CD1-CD2 4.48Å; W422-L434 WeakPolarHBondContact O-CA 3.38Å; L423-L434 HydrophobicContact CB-CD1 4.06Å; L423-L434 HydrophobicContact CD1-CD1 3.97Å; L434-V564 PolarHBondContact O-N 3.39Å; L434-A565 HydrophobicContact CB-CB 4.25Å; L434-A565 HydrophobicContact CD2-CB 4.45Å; L434-A565 PolarHBondContact N-O 2.86Å; L434-A565 PolarHBondContact O-N 2.89Å
435	Y	87.3	Confident	78.6	Confident	4 Å²	4	46.9 Å²	46.9	2%	0.016	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	138.7	179.7	-58.8	-86.6	0	0	0	110.2	F180 L184 Y421 W422 F424 K433 L437 K562 A563	F180-Y435 HydrophobicContact CE1-CD1 4.04Å; F180-Y435 HydrophobicContact CE1-CE1 4.25Å; F180-Y435 HydrophobicContact CE1-CG 4.37Å; F180-Y435 AromaticContact CZ-CD1 3.75Å; F180-Y435 HydrophobicContact CZ-CD1 3.75Å; F180-Y435 AromaticContact CZ-CE1 3.77Å; F180-Y435 HydrophobicContact CZ-CE1 3.77Å; L184-Y435 HydrophobicContact CD1-CE1 4.48Å; L184-Y435 HydrophobicContact CD1-CE2 4.4Å; L184-Y435 WeakPolarHBondContact CD2-OH 3.5Å; Y421-Y435 CarbonylContact C-O 3.6Å; Y421-Y435 WeakPolarHBondContact CA-O 3.49Å; W422-Y435 HydrophobicContact CD2-CD2 4.23Å; W422-Y435 AromaticContact CE3-CD2 3.65Å; W422-Y435 HydrophobicContact CE3-CD2 3.65Å; W422-Y435 HydrophobicContact CE3-CE2 4.28Å; W422-Y435 HydrophobicContact CE3-CG 4.12Å; W422-Y435 HydrophobicContact CZ3-CD2 4.08Å; W422-Y435 HydrophobicContact CZ3-CE2 4.27Å; W422-Y435 PolarHBondContact N-O 3.24Å; W422-Y435 PolarHBondContact O-N 2.92Å; F424-Y435 HydrophobicContact CB-CD2 4.47Å; F424-Y435 HydrophobicContact CB-CE2 4.16Å; K433-Y435 HydrophobicContact CB-CD2 4.43Å; K433-Y435 HydrophobicContact CB-CE2 3.61Å; K433-Y435 WeakPolarHBondContact CD-OH 3.31Å; Y435-L437 PolarHBondContact O-N 2.93Å; Y435-K562 WeakPolarHBondContact CD1-O 3.49Å; Y435-A563 HydrophobicContact CD1-CB 4.25Å; Y435-A563 HydrophobicContact CE1-CB 3.8Å
436	D	87.3	Confident	77.1	Confident	6 Å²	6	51.4 Å²	51.4	3%	0.032	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	99.9	170.5	-174.9	-18.7	0	0	0	108.7	K416 H419 Y421 T438 T439 L440 V564	K416-D436 IonicContact NZ-OD2 3.74Å; H419-D436 IonicContact CE1-OD1 3.71Å; H419-D436 IonicContact CE1-OD2 2.7Å; H419-D436 IonicContact CG-OD1 2.89Å; H419-D436 IonicContact CG-OD2 3.17Å; H419-D436 VanDerWaalsContact ND1-CG 3.35Å; H419-D436 IonicContact ND1-OD1 2.73Å; H419-D436 PolarHBondContact ND1-OD1 3.23Å; H419-D436 IonicContact ND1-OD2 3.84Å; H419-D436 PolarHBondContact ND1-OD2 2.82Å; Y421-D436 HydrophobicContact CD1-CB 3.92Å; Y421-D436 HydrophobicContact CE1-CB 3.85Å; D436-T438 VanDerWaalsContact C-N 3.26Å; D436-T438 PolarHBondContact O-N 2.79Å; D436-T438 WeakPolarHBondContact OD1-CB 3.22Å; D436-T438 PolarHBondContact OD1-N 3.1Å; D436-T438 VanDerWaalsContact OD1-N 3.09Å; D436-T439 PolarHBondContact OD1-N 2.94Å; D436-T439 VanDerWaalsContact OD1-N 3.16Å; D436-T439 PolarHBondContact OD2-OG1 3.49Å; D436-L440 WeakPolarHBondContact O-CB 3.34Å; D436-L440 WeakPolarHBondContact O-CD1 3.4Å; D436-L440 VanDerWaalsContact O-CG 3.23Å; D436-L440 WeakPolarHBondContact O-CG 3.42Å; D436-L440 PolarHBondContact O-N 3.24Å; D436-L440 VanDerWaalsContact O-N 3.09Å; D436-V564 HydrophobicContact CB-CG2 3.78Å
437	L	79.9	Confident	75.6	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-67.1	-31.5	-177.9	-65.1	-178.7	0	0	0	111.5	L159 W176 L177 T420 W422 Y435 L440 C441	L159-L437 HydrophobicContact CD2-CD1 4.39Å; W176-L437 HydrophobicContact CH2-CD2 4.09Å; L177-L437 HydrophobicContact CD1-CD2 4.17Å; T420-L437 HydrophobicContact CG2-CD1 4.23Å; T420-L437 WeakPolarHBondContact O-CB 3.4Å; T420-L437 PolarHBondContact O-N 2.85Å; W422-L437 HydrophobicContact CB-CD1 3.8Å; W422-L437 HydrophobicContact CB-CD2 3.78Å; W422-L437 HydrophobicContact CB-CG 3.66Å; W422-L437 HydrophobicContact CE3-CD2 4.14Å; W422-L437 HydrophobicContact CG-CD2 4.44Å; Y435-L437 PolarHBondContact O-N 2.93Å; L437-L440 PolarHBondContact O-N 2.95Å; L437-C441 PolarHBondContact O-N 3.09Å; L437-C441 PolarHBondContact O-SG 3.34Å
438	T	79.6	Confident	74.2	Confident	7 Å²	7	61.2 Å²	61.2	4%	0.043	31%	0.311	C	S	.	.	H	α-helix	trans	-64.3	-48.6	180	-59.6	0	0	0	0	110.5	T420 D436 C441 E442	T420-T438 PolarHBondContact N-OG1 3.08Å; T420-T438 PolarHBondContact O-N 2.81Å; D436-T438 VanDerWaalsContact C-N 3.26Å; D436-T438 PolarHBondContact O-N 2.79Å; D436-T438 WeakPolarHBondContact OD1-CB 3.22Å; D436-T438 PolarHBondContact OD1-N 3.1Å; D436-T438 VanDerWaalsContact OD1-N 3.09Å; T438-C441 PolarHBondContact O-N 3.11Å; T438-E442 PolarHBondContact O-N 3.36Å
439	T	79.9	Confident	73.2	Confident	40 Å²	40	60.1 Å²	60.1	25%	0.245	29%	0.292	C	S	.	.	H	α-helix	trans	-67.8	-36.9	176.7	-64.1	0	0	0	0	112.5	K416 D436 C441 E442 E443	K416-T439 PolarHBondContact NZ-OG1 3.29Å; D436-T439 PolarHBondContact OD1-N 2.94Å; D436-T439 VanDerWaalsContact OD1-N 3.16Å; D436-T439 PolarHBondContact OD2-OG1 3.49Å; T439-C441 VanDerWaalsContact C-N 3.26Å; T439-C441 PolarHBondContact O-N 3.41Å; T439-E442 PolarHBondContact O-N 3.26Å; T439-E443 PolarHBondContact O-N 3.33Å
440	L	75.1	Confident	72.5	Confident	17 Å²	17	59 Å²	59	9%	0.089	28%	0.284	C	S	.	.	H	α-helix	trans	-63.8	-30.9	175.8	-72.6	169	0	0	0	113	W176 F180 D436 L437 K562	W176-L440 HydrophobicContact CH2-CB 4.34Å; W176-L440 HydrophobicContact CZ3-CB 4.02Å; F180-L440 HydrophobicContact CE1-CD1 4.02Å; F180-L440 HydrophobicContact CZ-CD1 4.09Å; D436-L440 WeakPolarHBondContact O-CB 3.34Å; D436-L440 WeakPolarHBondContact O-CD1 3.4Å; D436-L440 VanDerWaalsContact O-CG 3.23Å; D436-L440 WeakPolarHBondContact O-CG 3.42Å; D436-L440 PolarHBondContact O-N 3.24Å; D436-L440 VanDerWaalsContact O-N 3.09Å; L437-L440 PolarHBondContact O-N 2.95Å; L440-K562 HydrophobicContact CD2-CB 4.35Å; L440-K562 HydrophobicContact CD2-CD 3.84Å; L440-K562 HydrophobicContact CD2-CG 4.49Å
441	C	70.3	Confident	71.8	Confident	8 Å²	8	56.6 Å²	56.6	5%	0.054	27%	0.274	C	S	.	.	H	α-helix	trans	-71.7	-35.2	173.2	-73.1	0	0	0	0	113.1	W176 L437 T438 T439 E443 T444 N450	W176-C441 VanDerWaalsContact CE2-SG 3.59Å; W176-C441 WeakPolarHBondContact CZ2-SG 3.35Å; L437-C441 PolarHBondContact O-N 3.09Å; L437-C441 PolarHBondContact O-SG 3.34Å; T438-C441 PolarHBondContact O-N 3.11Å; T439-C441 VanDerWaalsContact C-N 3.26Å; T439-C441 PolarHBondContact O-N 3.41Å; C441-E443 VanDerWaalsContact C-N 3.26Å; C441-E443 PolarHBondContact O-N 3.22Å; C441-T444 PolarHBondContact O-N 3.32Å; C441-T444 PolarHBondContact O-OG1 3.37Å; C441-N450 HydrophobicContact CB-CB 4.29Å
442	E	66.9	Low	71.4	Confident	124 Å²	124	55.1 Å²	55.1	58%	0.579	27%	0.265	S	S	*	.	H	α-helix	trans	-66.2	-27.2	-179	-71.9	171.5	171	0	0	113.2	T438 T439 T444	T438-E442 PolarHBondContact O-N 3.36Å; T439-E442 PolarHBondContact O-N 3.26Å; E442-T444 VanDerWaalsContact C-N 3.26Å; E442-T444 PolarHBondContact O-N 3.26Å
443	E	60.1	Low	70.9	Confident	128 Å²	128	56.7 Å²	56.7	60%	0.598	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-12.7	176.1	-67.9	-177	172.3	0	0	113.7	T439 C441 K562	T439-E443 PolarHBondContact O-N 3.33Å; C441-E443 VanDerWaalsContact C-N 3.26Å; C441-E443 PolarHBondContact O-N 3.22Å; E443-K562 IonicContact OE2-NZ 2.81Å; E443-K562 PolarHBondContact OE2-NZ 3.05Å
444	T	59.8	Low	70.4	Confident	39 Å²	39	56.7 Å²	56.7	24%	0.239	28%	0.276	C	S	.	.	S	Bend	trans	-93.2	145.7	-179.6	63.3	0	0	0	0	111.1	W176 C441 E442 D446	W176-T444 HydrophobicContact CB-CG2 4.03Å; W176-T444 HydrophobicContact CG-CG2 4.26Å; C441-T444 PolarHBondContact O-N 3.32Å; C441-T444 PolarHBondContact O-OG1 3.37Å; E442-T444 VanDerWaalsContact C-N 3.26Å; E442-T444 PolarHBondContact O-N 3.26Å; T444-D446 PolarHBondContact O-N 3.41Å
445	E	53.3	Low	70	Confident	201 Å²	201	58.3 Å²	58.3	94%	0.939	29%	0.287	S	S	*	.	S	Bend	trans	-58.3	-21.2	-173.7	-66.9	-174.4	161.9	0	0	113.5
446	D	56.2	Low	69.8	Low	100 Å²	100	58.1 Å²	58.1	54%	0.535	29%	0.286	S	S	.	.			trans	-103.1	87.5	177.9	-71.7	-31.1	0	0	0	112.6	T444 Y448 Q449	T444-D446 PolarHBondContact O-N 3.41Å; D446-Y448 PolarHBondContact O-N 3.26Å; D446-Q449 HydrophobicContact CB-CG 4.07Å; D446-Q449 PolarHBondContact OD2-NE2 2.81Å
447	K	50.8	Low	69.7	Low	164 Å²	164	57.9 Å²	57.9	71%	0.713	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-2.8	-178.6	-69.2	-177.4	178	-179.3	0	116.9
448	Y	53.7	Low	69.9	Low	139 Å²	139	59.1 Å²	59.1	55%	0.545	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.9	11.9	-168.8	-64.5	-68.3	0	0	0	115.7	D446 D493	D446-Y448 PolarHBondContact O-N 3.26Å; Y448-D493 HydrophobicContact CE1-CB 3.92Å; Y448-D493 PolarHBondContact OH-OD2 2.96Å
449	Q	58.4	Low	70.1	Confident	28 Å²	28	59.1 Å²	59.1	13%	0.131	29%	0.29	C	S	.	.			trans	-92.2	0.8	-173.4	-67.8	-170.9	13	0	0	115.9	W176 D446 P451	W176-Q449 VanDerWaalsContact CD1-OE1 3.25Å; D446-Q449 HydrophobicContact CB-CG 4.07Å; D446-Q449 PolarHBondContact OD2-NE2 2.81Å; Q449-P451 WeakPolarHBondContact O-CD 3.16Å
450	N	67.1	Low	70.4	Confident	12 Å²	12	57.2 Å²	57.2	6%	0.064	28%	0.279	C	S	.	.			trans	-83.5	109.9	173.3	-174.7	-10.2	0	0	0	110	C441 F452 T453	C441-N450 HydrophobicContact CB-CB 4.29Å; N450-F452 PolarHBondContact O-N 2.91Å; N450-F452 WeakPolarHBondContact OD1-CB 3.24Å; N450-F452 WeakPolarHBondContact OD1-CD2 3.41Å; N450-F452 PolarHBondContact OD1-N 3.19Å; N450-T453 WeakPolarHBondContact CB-OG1 3.33Å; N450-T453 PolarHBondContact O-N 3.49Å; N450-T453 PolarHBondContact O-OG1 3.25Å
451	P	70.3	Confident	71	Confident	58 Å²	58	58.4 Å²	58.4	38%	0.377	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-14.5	-177.4	38.3	-46.1	0	0	0	113.4	W174 Q449 P455	W174-P451 HydrophobicContact CH2-CG 3.33Å; W174-P451 HydrophobicContact CZ2-CB 4.21Å; W174-P451 HydrophobicContact CZ2-CG 3.08Å; W174-P451 HydrophobicContact CZ3-CG 4.28Å; Q449-P451 WeakPolarHBondContact O-CD 3.16Å; P451-P455 WeakPolarHBondContact O-CD 3.37Å
452	F	76.6	Confident	71.8	Confident	35 Å²	35	61 Å²	61	15%	0.154	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-17.3	-177.2	-58.2	-65.6	0	0	0	111.5	F107 H148 L159 W174 T420 N450 M454 P455 V456	F107-F452 HydrophobicContact CE2-CD1 4.24Å; H148-F452 AromaticContact CE1-CD1 3.46Å; H148-F452 VanDerWaalsContact CE1-CD1 3.46Å; H148-F452 WeakPolarHBondContact CE1-CD1 3.3Å; H148-F452 AromaticContact CE1-CE1 3.9Å; H148-F452 AromaticContact CE1-CG 3.58Å; L159-F452 HydrophobicContact CD1-CE2 3.99Å; L159-F452 HydrophobicContact CD1-CZ 3.72Å; W174-F452 HydrophobicContact CH2-CD2 4.27Å; W174-F452 AromaticContact CH2-CE2 3.71Å; W174-F452 HydrophobicContact CH2-CE2 3.71Å; W174-F452 HydrophobicContact CH2-CZ 4.37Å; W174-F452 HydrophobicContact CZ2-CE2 4.46Å; T420-F452 HydrophobicContact CG2-CB 4.37Å; T420-F452 HydrophobicContact CG2-CD2 3.8Å; T420-F452 HydrophobicContact CG2-CE2 4.33Å; T420-F452 HydrophobicContact CG2-CG 4.22Å; T420-F452 WeakPolarHBondContact OG1-CB 3.25Å; N450-F452 PolarHBondContact O-N 2.91Å; N450-F452 WeakPolarHBondContact OD1-CB 3.24Å; N450-F452 WeakPolarHBondContact OD1-CD2 3.41Å; N450-F452 PolarHBondContact OD1-N 3.19Å; F452-M454 VanDerWaalsContact C-N 3.31Å; F452-M454 PolarHBondContact O-N 3.41Å; F452-P455 WeakPolarHBondContact O-CD 3.39Å; F452-V456 VanDerWaalsContact O-CB 3.24Å; F452-V456 WeakPolarHBondContact O-CB 3.45Å; F452-V456 WeakPolarHBondContact O-CG2 3.28Å; F452-V456 PolarHBondContact O-N 3Å
453	T	77.6	Confident	72.6	Confident	37 Å²	37	55.2 Å²	55.2	23%	0.227	27%	0.266	C	S	.	.	H	α-helix	trans	-54.1	-46.9	178.8	-58.7	0	0	0	0	111.8	N450 A457 L491	N450-T453 WeakPolarHBondContact CB-OG1 3.33Å; N450-T453 PolarHBondContact O-N 3.49Å; N450-T453 PolarHBondContact O-OG1 3.25Å; T453-A457 VanDerWaalsContact O-CB 3.27Å; T453-A457 WeakPolarHBondContact O-CB 3.25Å; T453-A457 PolarHBondContact O-N 3.39Å; T453-L491 HydrophobicContact CG2-CB 3.96Å; T453-L491 HydrophobicContact CG2-CD2 4.25Å; T453-L491 WeakPolarHBondContact CG2-O 3.09Å
454	M	78	Confident	73.8	Confident	43 Å²	43	49.1 Å²	49.1	21%	0.212	24%	0.237	C	C	.	.	H	α-helix	trans	-69.2	-53.4	-178.4	179.8	59.4	48.4	0	0	113.1	F291 F452 V456 A457 I458 L492 H497	F291-M454 HydrophobicContact CZ-CG 3.94Å; F452-M454 VanDerWaalsContact C-N 3.31Å; F452-M454 PolarHBondContact O-N 3.41Å; M454-V456 VanDerWaalsContact C-N 3.28Å; M454-V456 PolarHBondContact O-N 2.97Å; M454-A457 PolarHBondContact O-N 3.32Å; M454-I458 HydrophobicContact CG-CD1 3.95Å; M454-I458 WeakPolarHBondContact O-CG1 3.37Å; M454-I458 PolarHBondContact O-N 3.46Å; M454-I458 HydrophobicContact SD-CD1 3.64Å; M454-I458 HydrophobicContact SD-CG1 3.98Å; M454-L492 HydrophobicContact CE-CD2 3.43Å; M454-L492 VanDerWaalsContact CE-CD2 3.43Å; M454-L492 HydrophobicContact SD-CD2 3.86Å; M454-H497 WeakPolarHBondContact CE-CD2 3.17Å; M454-H497 WeakPolarHBondContact CE-CE1 3.34Å; M454-H497 WeakPolarHBondContact CE-NE2 3.27Å
455	P	81.1	Confident	75	Confident	34 Å²	34	48.5 Å²	48.5	22%	0.221	23%	0.234	C	C	.	.	H	α-helix	trans	-54.3	-41.8	173.7	-27.7	34.3	0	0	0	113.8	F107 F291 P451 F452 L459	F107-P455 HydrophobicContact CD1-CB 4.04Å; F107-P455 HydrophobicContact CE1-CB 3.87Å; F107-P455 HydrophobicContact CE2-CB 4.47Å; F107-P455 HydrophobicContact CG-CB 4.43Å; F107-P455 HydrophobicContact CZ-CB 4.1Å; F291-P455 HydrophobicContact CE1-CG 4.43Å; P451-P455 WeakPolarHBondContact O-CD 3.37Å; F452-P455 WeakPolarHBondContact O-CD 3.39Å; P455-L459 WeakPolarHBondContact O-CB 2.92Å; P455-L459 PolarHBondContact O-N 3.26Å
456	V	84.3	Confident	76.4	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-66.2	-46.7	179	169.9	0	0	0	0	111	F107 H148 I150 G418 F452 M454 I458 L459 L460 L491	F107-V456 HydrophobicContact CE1-CG2 3.77Å; F107-V456 HydrophobicContact CZ-CG2 3.69Å; H148-V456 HydrophobicContact CB-CG2 4.2Å; I150-V456 HydrophobicContact CD1-CB 4.48Å; I150-V456 HydrophobicContact CD1-CG1 3.76Å; G418-V456 WeakPolarHBondContact O-CG1 3.34Å; F452-V456 VanDerWaalsContact O-CB 3.24Å; F452-V456 WeakPolarHBondContact O-CB 3.45Å; F452-V456 WeakPolarHBondContact O-CG2 3.28Å; F452-V456 PolarHBondContact O-N 3Å; M454-V456 VanDerWaalsContact C-N 3.28Å; M454-V456 PolarHBondContact O-N 2.97Å; V456-I458 VanDerWaalsContact C-N 3.34Å; V456-I458 PolarHBondContact O-N 2.71Å; V456-L459 PolarHBondContact O-N 2.92Å; V456-L460 HydrophobicContact CG1-CD1 4.1Å; V456-L460 HydrophobicContact CG1-CG 4.4Å; V456-L460 VanDerWaalsContact O-CG 3.32Å; V456-L460 WeakPolarHBondContact O-CG 3.37Å; V456-L460 PolarHBondContact O-N 2.93Å; V456-L491 HydrophobicContact CG1-CD1 3.96Å
457	A	84.4	Confident	77.5	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60.2	-42.7	178	0	0	0	0	0	112.5	T453 M454 L460 Y461 C488 L491 L492	T453-A457 VanDerWaalsContact O-CB 3.27Å; T453-A457 WeakPolarHBondContact O-CB 3.25Å; T453-A457 PolarHBondContact O-N 3.39Å; M454-A457 PolarHBondContact O-N 3.32Å; A457-L460 PolarHBondContact O-N 3.4Å; A457-Y461 PolarHBondContact O-N 3.25Å; A457-C488 PolarHBondContact O-SG 3.28Å; A457-L491 HydrophobicContact CB-CB 4Å; A457-L491 HydrophobicContact CB-CD1 4.35Å; A457-L492 HydrophobicContact CB-CD1 4.36Å; A457-L492 HydrophobicContact CB-CD2 3.61Å; A457-L492 HydrophobicContact CB-CG 3.78Å
458	I	84.5	Confident	78.8	Confident	28 Å²	28	30.9 Å²	30.9	14%	0.144	15%	0.153	C	C	.	.	H	α-helix	trans	-65.5	-41.6	177.6	-69.3	169.4	0	0	0	111.2	F291 M454 V456 Y461 K462 I500	F291-I458 HydrophobicContact CD2-CD1 4.13Å; F291-I458 HydrophobicContact CE2-CD1 3.19Å; F291-I458 HydrophobicContact CZ-CD1 3.68Å; M454-I458 HydrophobicContact CG-CD1 3.95Å; M454-I458 WeakPolarHBondContact O-CG1 3.37Å; M454-I458 PolarHBondContact O-N 3.46Å; M454-I458 HydrophobicContact SD-CD1 3.64Å; M454-I458 HydrophobicContact SD-CG1 3.98Å; V456-I458 VanDerWaalsContact C-N 3.34Å; V456-I458 PolarHBondContact O-N 2.71Å; I458-Y461 PolarHBondContact O-N 3.33Å; I458-K462 HydrophobicContact CG2-CD 4.14Å; I458-K462 HydrophobicContact CG2-CG 4.36Å; I458-K462 WeakPolarHBondContact O-CG 3.1Å; I458-K462 PolarHBondContact O-N 3.4Å; I458-I500 HydrophobicContact CD1-CD1 4.37Å; I458-I500 HydrophobicContact CG1-CD1 3.85Å
459	L	84.1	Confident	79.8	Confident	6 Å²	6	31.1 Å²	31.1	3%	0.031	16%	0.161	C	C	.	.	H	α-helix	trans	-66.5	-42.5	179.3	-173.1	61.6	0	0	0	111.3	F107 A110 I150 L155 P455 V456 Y461 K462 V463	F107-L459 HydrophobicContact CD1-CD2 3.98Å; F107-L459 HydrophobicContact CE1-CD2 4.34Å; A110-L459 HydrophobicContact CB-CD1 4.21Å; A110-L459 HydrophobicContact CB-CD2 3.95Å; I150-L459 HydrophobicContact CD1-CB 4.45Å; I150-L459 HydrophobicContact CD1-CD2 4.11Å; I150-L459 HydrophobicContact CD1-CG 4.45Å; I150-L459 HydrophobicContact CG1-CD2 3.86Å; I150-L459 HydrophobicContact CG2-CD2 4.39Å; I150-L459 HydrophobicContact CG2-CG 4.34Å; L155-L459 HydrophobicContact CD1-CD2 4.48Å; L155-L459 HydrophobicContact CD2-CD2 3.47Å; L155-L459 VanDerWaalsContact CD2-CD2 3.47Å; P455-L459 WeakPolarHBondContact O-CB 2.92Å; P455-L459 PolarHBondContact O-N 3.26Å; V456-L459 PolarHBondContact O-N 2.92Å; L459-Y461 VanDerWaalsContact C-N 3.32Å; L459-Y461 PolarHBondContact O-N 2.8Å; L459-K462 PolarHBondContact O-N 3.18Å; L459-V463 HydrophobicContact CD1-CG2 4.21Å; L459-V463 HydrophobicContact CG-CG2 4.34Å; L459-V463 WeakPolarHBondContact O-CB 3.2Å; L459-V463 VanDerWaalsContact O-CG2 3.25Å; L459-V463 WeakPolarHBondContact O-CG2 3.24Å; L459-V463 PolarHBondContact O-N 3.07Å
460	L	86.2	Confident	80.3	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-55.6	-46.9	172.7	-70.9	170.9	0	0	0	111.5	I150 V456 A457 A464 L484 N487 C488 L491	I150-L460 HydrophobicContact CD1-CD2 3.97Å; I150-L460 HydrophobicContact CD1-CG 4.01Å; I150-L460 HydrophobicContact CG2-CD2 4.15Å; V456-L460 HydrophobicContact CG1-CD1 4.1Å; V456-L460 HydrophobicContact CG1-CG 4.4Å; V456-L460 VanDerWaalsContact O-CG 3.32Å; V456-L460 WeakPolarHBondContact O-CG 3.37Å; V456-L460 PolarHBondContact O-N 2.93Å; A457-L460 PolarHBondContact O-N 3.4Å; L460-A464 WeakPolarHBondContact O-CB 3.47Å; L460-A464 PolarHBondContact O-N 3Å; L460-L484 HydrophobicContact CD2-CD2 3.51Å; L460-N487 HydrophobicContact CD1-CB 4.16Å; L460-C488 HydrophobicContact CB-CB 4.15Å; L460-L491 HydrophobicContact CD1-CD1 3.89Å
461	Y	87.8	Confident	79.7	Confident	43 Å²	43	39.6 Å²	39.6	17%	0.169	20%	0.197	C	C	.	.	H	α-helix	trans	-60.7	-48.7	176.4	169	-92.7	0	0	0	112	A457 I458 L459 A464 C465 L485 I500 S503 A504 M507	A457-Y461 PolarHBondContact O-N 3.25Å; I458-Y461 PolarHBondContact O-N 3.33Å; L459-Y461 VanDerWaalsContact C-N 3.32Å; L459-Y461 PolarHBondContact O-N 2.8Å; Y461-A464 WeakPolarHBondContact O-CB 3.37Å; Y461-A464 PolarHBondContact O-N 3.03Å; Y461-C465 WeakPolarHBondContact CE1-SG 3.37Å; Y461-C465 PolarHBondContact O-N 3.19Å; Y461-C465 PolarHBondContact O-SG 3.22Å; Y461-L485 HydrophobicContact CD2-CD2 4.3Å; Y461-I500 HydrophobicContact CD2-CG2 3.93Å; Y461-I500 HydrophobicContact CE2-CG2 4.36Å; Y461-I500 HydrophobicContact CG-CG2 4.02Å; Y461-S503 WeakPolarHBondContact OH-CB 3.37Å; Y461-S503 PolarHBondContact OH-OG 3.43Å; Y461-A504 HydrophobicContact CD2-CB 4.12Å; Y461-A504 HydrophobicContact CE2-CB 4.39Å; Y461-M507 HydrophobicContact CD2-CE 3.51Å; Y461-M507 HydrophobicContact CE2-CE 3.15Å
462	K	86.1	Confident	78.8	Confident	63 Å²	63	44.5 Å²	44.5	27%	0.274	22%	0.22	S	C	.	.	H	α-helix	trans	-68.3	-37.8	-177.1	-71.7	-170.7	169.9	-171.7	0	112.8	Y111 I114 I458 L459 A464 C465 N466	Y111-K462 HydrophobicContact CD2-CD 4.1Å; Y111-K462 HydrophobicContact CE2-CD 3.42Å; Y111-K462 VanDerWaalsContact CE2-CD 3.42Å; Y111-K462 VanDerWaalsContact CZ-NZ 3.33Å; Y111-K462 PolarHBondContact OH-NZ 3.39Å; I114-K462 VanDerWaalsContact CD1-C 3.47Å; I114-K462 HydrophobicContact CD1-CB 3.37Å; I458-K462 HydrophobicContact CG2-CD 4.14Å; I458-K462 HydrophobicContact CG2-CG 4.36Å; I458-K462 WeakPolarHBondContact O-CG 3.1Å; I458-K462 PolarHBondContact O-N 3.4Å; L459-K462 PolarHBondContact O-N 3.18Å; K462-A464 VanDerWaalsContact C-N 3.32Å; K462-C465 WeakPolarHBondContact O-CB 3.45Å; K462-C465 PolarHBondContact O-N 3.1Å; K462-N466 WeakPolarHBondContact O-CB 3.26Å; K462-N466 PolarHBondContact O-N 3.15Å
463	V	84.4	Confident	77.6	Confident	1 Å²	1	50 Å²	50	1%	0.006	25%	0.246	C	C	.	.	H	α-helix	trans	-61.6	-45.2	173.3	172.1	0	0	0	0	109.3	I114 V117 I150 L459 C465 N466 M467 L484	I114-V463 HydrophobicContact CD1-CG2 4.2Å; I114-V463 HydrophobicContact CG1-CG2 3.85Å; V117-V463 HydrophobicContact CB-CG2 4.33Å; V117-V463 HydrophobicContact CG1-CG2 3.98Å; I150-V463 HydrophobicContact CG2-CG2 4.26Å; L459-V463 HydrophobicContact CD1-CG2 4.21Å; L459-V463 HydrophobicContact CG-CG2 4.34Å; L459-V463 WeakPolarHBondContact O-CB 3.2Å; L459-V463 VanDerWaalsContact O-CG2 3.25Å; L459-V463 WeakPolarHBondContact O-CG2 3.24Å; L459-V463 PolarHBondContact O-N 3.07Å; V463-C465 PolarHBondContact O-N 2.86Å; V463-N466 PolarHBondContact O-N 2.89Å; V463-M467 HydrophobicContact CG1-CG 4.45Å; V463-M467 HydrophobicContact CG1-SD 4Å; V463-M467 VanDerWaalsContact O-CG 3.26Å; V463-M467 WeakPolarHBondContact O-CG 3.43Å; V463-M467 PolarHBondContact O-N 3.39Å; V463-L484 HydrophobicContact CG1-CD1 3.98Å
464	A	85.9	Confident	76.5	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.7	-44.2	175	0	0	0	0	0	112.8	L460 Y461 K462 N466 M467 M468 I481 L484 L485	L460-A464 WeakPolarHBondContact O-CB 3.47Å; L460-A464 PolarHBondContact O-N 3Å; Y461-A464 WeakPolarHBondContact O-CB 3.37Å; Y461-A464 PolarHBondContact O-N 3.03Å; K462-A464 VanDerWaalsContact C-N 3.32Å; A464-N466 PolarHBondContact O-N 3.23Å; A464-M467 PolarHBondContact O-N 3.03Å; A464-M468 WeakPolarHBondContact O-CB 3.5Å; A464-M468 PolarHBondContact O-N 3.36Å; A464-I481 HydrophobicContact CB-CG2 4.16Å; A464-L484 HydrophobicContact CB-CB 4.13Å; A464-L484 HydrophobicContact CB-CD1 4.44Å; A464-L485 HydrophobicContact CB-CD1 4.46Å; A464-L485 HydrophobicContact CB-CD2 3.53Å; A464-L485 HydrophobicContact CB-CG 3.74Å
465	C	83.5	Confident	75.9	Confident	27 Å²	27	56.3 Å²	56.3	18%	0.182	27%	0.273	C	S	.	.	H	α-helix	trans	-56.8	-48.7	174.4	-66.5	0	0	0	0	111.8	Y461 K462 V463 M467 M468 M469 M507	Y461-C465 WeakPolarHBondContact CE1-SG 3.37Å; Y461-C465 PolarHBondContact O-N 3.19Å; Y461-C465 PolarHBondContact O-SG 3.22Å; K462-C465 WeakPolarHBondContact O-CB 3.45Å; K462-C465 PolarHBondContact O-N 3.1Å; V463-C465 PolarHBondContact O-N 2.86Å; C465-M467 PolarHBondContact O-N 3.37Å; C465-M468 WeakPolarHBondContact O-CB 3.3Å; C465-M468 PolarHBondContact O-N 3.02Å; C465-M468 VanDerWaalsContact O-N 3.15Å; C465-M469 WeakPolarHBondContact O-CG 3.3Å; C465-M469 PolarHBondContact O-N 3.31Å; C465-M507 HydrophobicContact CB-SD 4.26Å; C465-M507 WeakPolarHBondContact SG-CE 3.41Å; C465-M507 PolarHBondContact SG-SD 3.23Å
466	N	83.1	Confident	75.1	Confident	35 Å²	35	63.1 Å²	63.1	19%	0.187	30%	0.299	C	S	.	.	H	α-helix	trans	-64.1	-42.5	-178.2	-172.4	40.6	0	0	0	111.8	I114 D115 K462 V463 A464 M468 M469 K470	I114-N466 HydrophobicContact CG2-CB 4.27Å; D115-N466 WeakPolarHBondContact CA-ND2 3.25Å; D115-N466 PolarHBondContact OD1-ND2 3.17Å; D115-N466 PolarHBondContact OD1-OD1 3.03Å; K462-N466 WeakPolarHBondContact O-CB 3.26Å; K462-N466 PolarHBondContact O-N 3.15Å; V463-N466 PolarHBondContact O-N 2.89Å; A464-N466 PolarHBondContact O-N 3.23Å; N466-M468 VanDerWaalsContact C-N 3.26Å; N466-M468 PolarHBondContact O-N 3.39Å; N466-M469 PolarHBondContact O-N 3.35Å; N466-K470 PolarHBondContact O-N 2.93Å
467	M	79.8	Confident	74.5	Confident	29 Å²	29	66.1 Å²	66.1	14%	0.143	31%	0.313	C	S	.	.	H	α-helix	trans	-61.5	-35.7	174.3	-69.1	177.9	80.9	0	0	112.1	V463 A464 C465 H477 T480 I481 L484	V463-M467 HydrophobicContact CG1-CG 4.45Å; V463-M467 HydrophobicContact CG1-SD 4Å; V463-M467 VanDerWaalsContact O-CG 3.26Å; V463-M467 WeakPolarHBondContact O-CG 3.43Å; V463-M467 PolarHBondContact O-N 3.39Å; A464-M467 PolarHBondContact O-N 3.03Å; C465-M467 PolarHBondContact O-N 3.37Å; M467-H477 HydrophobicContact CE-CB 3.99Å; M467-T480 HydrophobicContact CE-CG2 4.2Å; M467-I481 HydrophobicContact CB-CD1 3.85Å; M467-I481 HydrophobicContact CB-CG1 3.79Å; M467-I481 HydrophobicContact CE-CG1 4.32Å; M467-I481 HydrophobicContact SD-CG1 4.31Å; M467-L484 HydrophobicContact SD-CD1 3.86Å
468	M	78.1	Confident	74.3	Confident	31 Å²	31	67.5 Å²	67.5	15%	0.153	32%	0.319	C	S	.	.	H	α-helix	trans	-72.6	-32.5	178.4	-172.1	175.2	156.4	0	0	113	A464 C465 N466 K470 K471 M507 E510	A464-M468 WeakPolarHBondContact O-CB 3.5Å; A464-M468 PolarHBondContact O-N 3.36Å; C465-M468 WeakPolarHBondContact O-CB 3.3Å; C465-M468 PolarHBondContact O-N 3.02Å; C465-M468 VanDerWaalsContact O-N 3.15Å; N466-M468 VanDerWaalsContact C-N 3.26Å; N466-M468 PolarHBondContact O-N 3.39Å; M468-K470 VanDerWaalsContact C-N 3.33Å; M468-K470 PolarHBondContact O-N 3.22Å; M468-K471 WeakPolarHBondContact O-CB 3.32Å; M468-K471 PolarHBondContact O-N 2.96Å; M468-M507 HydrophobicContact CE-CB 4.46Å; M468-M507 HydrophobicContact CE-CG 4.21Å; M468-M507 HydrophobicContact SD-CB 3.76Å; M468-M507 HydrophobicContact SD-CG 3.63Å; M468-M507 HydrophobicContact SD-SD 3.89Å; M468-E510 HydrophobicContact CE-CB 3.34Å; M468-E510 HydrophobicContact CE-CG 3.83Å
469	M	73.5	Confident	74	Confident	143 Å²	143	66.3 Å²	66.3	70%	0.704	31%	0.313	S	S	*	.	H	α-helix	trans	-70.6	-24.9	176.5	-70.5	-59.6	-175	0	0	113.3	C465 N466 K471	C465-M469 WeakPolarHBondContact O-CG 3.3Å; C465-M469 PolarHBondContact O-N 3.31Å; N466-M469 PolarHBondContact O-N 3.35Å; M469-K471 PolarHBondContact O-N 3.22Å
470	K	70.8	Confident	73.7	Confident	102 Å²	102	67.1 Å²	67.1	44%	0.443	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	31.2	171.5	-63.5	178.6	-175.8	178	0	112.7	D115 N466 M468 N472 Q473	D115-K470 WeakPolarHBondContact OD1-CE 3.38Å; D115-K470 IonicContact OD1-NZ 2.64Å; D115-K470 PolarHBondContact OD1-NZ 3.13Å; N466-K470 PolarHBondContact O-N 2.93Å; M468-K470 VanDerWaalsContact C-N 3.33Å; M468-K470 PolarHBondContact O-N 3.22Å; K470-N472 PolarHBondContact O-N 2.9Å; K470-Q473 PolarHBondContact O-N 3.38Å
471	K	53.2	Low	73.6	Confident	116 Å²	116	67.2 Å²	67.2	50%	0.504	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-21.7	-162.9	-147	173.3	-177.1	177.1	0	115.3	M468 M469 E510	M468-K471 WeakPolarHBondContact O-CB 3.32Å; M468-K471 PolarHBondContact O-N 2.96Å; M469-K471 PolarHBondContact O-N 3.22Å; K471-E510 IonicContact NZ-OE2 2.94Å
472	N	52.2	Low	73.5	Confident	162 Å²	162	67.1 Å²	67.1	87%	0.866	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-8.7	-178.2	-70.6	-9.9	0	0	0	114.8	K470	K470-N472 PolarHBondContact O-N 2.9Å
473	Q	51.3	Low	73.3	Confident	150 Å²	150	66.2 Å²	66.2	70%	0.701	32%	0.318	S	S	*	.	S	Bend	trans	-123.3	74.9	-175.5	-67.8	-173.2	-2.5	0	0	113.4	K470	K470-Q473 PolarHBondContact O-N 3.38Å
474	N	54.1	Low	73.4	Confident	87 Å²	87	66.2 Å²	66.2	47%	0.465	32%	0.318	S	S	.	.			trans	103.8	103.4	157.4	-49.2	-61.7	0	0	0	117	K476 H477	N474-K476 HydrophobicContact CB-CB 3.9Å; N474-K476 HydrophobicContact CB-CD 4.25Å; N474-K476 HydrophobicContact CB-CG 4Å; N474-K476 PolarHBondContact O-N 3.15Å; N474-H477 PolarHBondContact O-N 3.42Å
475	K	65	Low	73.5	Confident	125 Å²	125	66.2 Å²	66.2	54%	0.543	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-46.9	-18.1	158.2	-68.6	-177.1	172.1	-172.9	0	113.3	H477 Y478 E516	K475-H477 PolarHBondContact O-N 3.05Å; K475-H477 VanDerWaalsContact O-N 3.15Å; K475-Y478 HydrophobicContact CG-CE2 4.4Å; K475-Y478 PolarHBondContact O-N 3.08Å; K475-E516 IonicContact NZ-OE1 2.82Å; K475-E516 PolarHBondContact NZ-OE1 3.46Å
476	K	65.9	Low	73.7	Confident	177 Å²	177	67.6 Å²	67.6	77%	0.77	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-53.8	-27.7	174.8	-60.4	-178.1	179.7	-177.5	0	114.2	N474	N474-K476 HydrophobicContact CB-CB 3.9Å; N474-K476 HydrophobicContact CB-CD 4.25Å; N474-K476 HydrophobicContact CB-CG 4Å; N474-K476 PolarHBondContact O-N 3.15Å
477	H	71.6	Confident	73.8	Confident	63 Å²	63	67.1 Å²	67.1	29%	0.292	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-94.1	-3.7	-176.9	-63.3	130.3	0	0	0	114.7	N119 M467 N474 K475 G479 T480 I481	N119-H477 PolarHBondContact ND2-NE2 2.94Å; M467-H477 HydrophobicContact CE-CB 3.99Å; N474-H477 PolarHBondContact O-N 3.42Å; K475-H477 PolarHBondContact O-N 3.05Å; K475-H477 VanDerWaalsContact O-N 3.15Å; H477-G479 VanDerWaalsContact C-N 3.31Å; H477-G479 PolarHBondContact O-N 3.36Å; H477-T480 WeakPolarHBondContact O-CB 3.35Å; H477-T480 PolarHBondContact O-N 3.4Å; H477-T480 VanDerWaalsContact O-N 3.13Å; H477-I481 HydrophobicContact CB-CD1 4.47Å; H477-I481 WeakPolarHBondContact O-CG1 3.34Å; H477-I481 PolarHBondContact O-N 3.04Å
478	Y	79.3	Confident	74.2	Confident	30 Å²	30	65.7 Å²	65.7	12%	0.118	31%	0.314	C	S	.	.	H	α-helix	trans	-62.7	-36.4	-174.3	-77.6	10.9	0	0	0	113	K475 I481 R482 L511 Q513 F591	K475-Y478 HydrophobicContact CG-CE2 4.4Å; K475-Y478 PolarHBondContact O-N 3.08Å; Y478-I481 HydrophobicContact CD1-CD1 4.34Å; Y478-I481 PolarHBondContact O-N 2.92Å; Y478-R482 WeakPolarHBondContact O-CB 3.31Å; Y478-R482 PolarHBondContact O-N 3.4Å; Y478-L511 HydrophobicContact CD1-CD2 4.16Å; Y478-L511 HydrophobicContact CD2-CD2 4.44Å; Y478-L511 HydrophobicContact CG-CD2 4.1Å; Y478-Q513 PolarHBondContact OH-NE2 2.92Å; Y478-F591 HydrophobicContact CD2-CE2 4.47Å; Y478-F591 HydrophobicContact CD2-CZ 4.44Å
479	G	77.1	Confident	74.6	Confident	3 Å²	3	66 Å²	66	3%	0.031	32%	0.316	C	S	.	.	H	α-helix	trans	-65.5	-38.3	175.6	0	0	0	0	0	113.1	H477 T483 C589	H477-G479 VanDerWaalsContact C-N 3.31Å; H477-G479 PolarHBondContact O-N 3.36Å; G479-T483 PolarHBondContact O-N 2.96Å; G479-T483 VanDerWaalsContact O-N 3.08Å; G479-T483 PolarHBondContact O-OG1 3.25Å; G479-C589 VanDerWaalsContact CA-O 3.31Å; G479-C589 WeakPolarHBondContact CA-O 3.34Å
480	T	79.4	Confident	75.1	Confident	22 Å²	22	67.1 Å²	67.1	14%	0.135	32%	0.317	C	S	.	.	H	α-helix	trans	-65.6	-47.7	173.2	-49.5	0	0	0	0	111.1	M467 H477 R482 T483 L484	M467-T480 HydrophobicContact CE-CG2 4.2Å; H477-T480 WeakPolarHBondContact O-CB 3.35Å; H477-T480 PolarHBondContact O-N 3.4Å; H477-T480 VanDerWaalsContact O-N 3.13Å; T480-R482 VanDerWaalsContact C-N 3.33Å; T480-R482 PolarHBondContact O-N 3.39Å; T480-T483 PolarHBondContact O-N 3.35Å; T480-T483 VanDerWaalsContact O-N 3.12Å; T480-L484 HydrophobicContact CG2-CD1 4.26Å; T480-L484 HydrophobicContact CG2-CG 4.47Å; T480-L484 WeakPolarHBondContact O-CG 3.32Å; T480-L484 PolarHBondContact O-N 3.32Å
481	I	82.7	Confident	75.6	Confident	3 Å²	3	63.9 Å²	63.9	2%	0.015	30%	0.304	C	S	.	.	H	α-helix	trans	-58.1	-46.1	178.1	-64.2	167.5	0	0	0	110.7	A464 M467 H477 Y478 T483 L484 L485 L511	A464-I481 HydrophobicContact CB-CG2 4.16Å; M467-I481 HydrophobicContact CB-CD1 3.85Å; M467-I481 HydrophobicContact CB-CG1 3.79Å; M467-I481 HydrophobicContact CE-CG1 4.32Å; M467-I481 HydrophobicContact SD-CG1 4.31Å; H477-I481 HydrophobicContact CB-CD1 4.47Å; H477-I481 WeakPolarHBondContact O-CG1 3.34Å; H477-I481 PolarHBondContact O-N 3.04Å; Y478-I481 HydrophobicContact CD1-CD1 4.34Å; Y478-I481 PolarHBondContact O-N 2.92Å; I481-T483 VanDerWaalsContact C-N 3.32Å; I481-T483 PolarHBondContact O-N 3.06Å; I481-L484 PolarHBondContact O-N 2.91Å; I481-L485 HydrophobicContact CG2-CD1 3.92Å; I481-L485 HydrophobicContact CG2-CG 4.41Å; I481-L485 WeakPolarHBondContact O-CG 3.38Å; I481-L485 PolarHBondContact O-N 3.12Å; I481-L511 HydrophobicContact CB-CD2 4.29Å; I481-L511 HydrophobicContact CG2-CD1 4.3Å; I481-L511 HydrophobicContact CG2-CD2 3.95Å
482	R	85.7	Confident	76.9	Confident	40 Å²	40	58.9 Å²	58.9	15%	0.151	28%	0.283	C	S	.	.	H	α-helix	trans	-56.1	-47.2	175.5	-178.1	-173.4	174.1	106.3	-2	111.6	Y478 T480 L485 L486 L508 L511 F512 Y607	Y478-R482 WeakPolarHBondContact O-CB 3.31Å; Y478-R482 PolarHBondContact O-N 3.4Å; T480-R482 VanDerWaalsContact C-N 3.33Å; T480-R482 PolarHBondContact O-N 3.39Å; R482-L485 PolarHBondContact O-N 3.01Å; R482-L486 HydrophobicContact CG-CD1 3.93Å; R482-L486 HydrophobicContact CG-CG 4.36Å; R482-L486 WeakPolarHBondContact O-CB 3.42Å; R482-L486 VanDerWaalsContact O-CG 3.31Å; R482-L486 WeakPolarHBondContact O-CG 3.27Å; R482-L486 PolarHBondContact O-N 3.33Å; R482-L508 HydrophobicContact CB-CD2 4.41Å; R482-L508 HydrophobicContact CG-CD2 3.98Å; R482-L511 HydrophobicContact CB-CD1 3.82Å; R482-F512 VanDerWaalsContact NH1-CZ 3.31Å; R482-Y607 PolarHBondContact NH2-OH 3.41Å
483	T	83.8	Confident	78	Confident	44 Å²	44	52.8 Å²	52.8	27%	0.27	25%	0.25	S	S	.	.	H	α-helix	trans	-63.5	-45.6	-178	-54.3	0	0	0	0	111.2	E417 G479 T480 I481 L485 L486 N487	E417-T483 WeakPolarHBondContact OE2-CG2 3.38Å; G479-T483 PolarHBondContact O-N 2.96Å; G479-T483 VanDerWaalsContact O-N 3.08Å; G479-T483 PolarHBondContact O-OG1 3.25Å; T480-T483 PolarHBondContact O-N 3.35Å; T480-T483 VanDerWaalsContact O-N 3.12Å; I481-T483 VanDerWaalsContact C-N 3.32Å; I481-T483 PolarHBondContact O-N 3.06Å; T483-L485 VanDerWaalsContact C-N 3.35Å; T483-L485 PolarHBondContact O-N 3.48Å; T483-L486 PolarHBondContact O-N 2.94Å; T483-N487 WeakPolarHBondContact O-CB 3.47Å; T483-N487 VanDerWaalsContact O-CG 3.29Å; T483-N487 PolarHBondContact O-N 3.26Å; T483-N487 PolarHBondContact O-ND2 3.01Å
484	L	85.1	Confident	79.1	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-58.4	-44.5	175.8	-66.7	173.1	0	0	0	112	L460 V463 A464 M467 T480 I481 C488	L460-L484 HydrophobicContact CD2-CD2 3.51Å; V463-L484 HydrophobicContact CG1-CD1 3.98Å; A464-L484 HydrophobicContact CB-CB 4.13Å; A464-L484 HydrophobicContact CB-CD1 4.44Å; M467-L484 HydrophobicContact SD-CD1 3.86Å; T480-L484 HydrophobicContact CG2-CD1 4.26Å; T480-L484 HydrophobicContact CG2-CG 4.47Å; T480-L484 WeakPolarHBondContact O-CG 3.32Å; T480-L484 PolarHBondContact O-N 3.32Å; I481-L484 PolarHBondContact O-N 2.91Å; L484-C488 WeakPolarHBondContact O-CB 3.4Å; L484-C488 PolarHBondContact O-N 3.41Å
485	L	88.1	Confident	79.8	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-69.5	-40.8	179.3	-67.9	175.5	0	0	0	112.8	Y461 A464 I481 R482 T483 N487 C488 L489 A504 M507 L508	Y461-L485 HydrophobicContact CD2-CD2 4.3Å; A464-L485 HydrophobicContact CB-CD1 4.46Å; A464-L485 HydrophobicContact CB-CD2 3.53Å; A464-L485 HydrophobicContact CB-CG 3.74Å; I481-L485 HydrophobicContact CG2-CD1 3.92Å; I481-L485 HydrophobicContact CG2-CG 4.41Å; I481-L485 WeakPolarHBondContact O-CG 3.38Å; I481-L485 PolarHBondContact O-N 3.12Å; R482-L485 PolarHBondContact O-N 3.01Å; T483-L485 VanDerWaalsContact C-N 3.35Å; T483-L485 PolarHBondContact O-N 3.48Å; L485-N487 VanDerWaalsContact C-N 3.35Å; L485-C488 WeakPolarHBondContact O-CB 3Å; L485-C488 PolarHBondContact O-N 3.02Å; L485-L489 WeakPolarHBondContact O-CG 3.4Å; L485-L489 PolarHBondContact O-N 3.34Å; L485-A504 HydrophobicContact CD2-CB 4.26Å; L485-M507 HydrophobicContact CD1-CB 3.8Å; L485-M507 HydrophobicContact CD1-CE 4.33Å; L485-M507 HydrophobicContact CD2-CE 3.49Å; L485-M507 VanDerWaalsContact CD2-CE 3.49Å; L485-L508 HydrophobicContact CB-CD1 4.23Å; L485-L508 HydrophobicContact CB-CD2 3.79Å; L485-L508 HydrophobicContact CB-CG 3.88Å; L485-L508 HydrophobicContact CD1-CD2 3.99Å; L485-L508 HydrophobicContact CD1-CG 3.91Å
486	L	87.7	Confident	80.3	Confident	55 Å²	55	53.2 Å²	53.2	29%	0.288	25%	0.252	S	S	.	.	H	α-helix	trans	-65	-39.8	175.7	-71.4	175.6	0	0	0	111.6	R482 T483 L489 K490 L508 Y607	R482-L486 HydrophobicContact CG-CD1 3.93Å; R482-L486 HydrophobicContact CG-CG 4.36Å; R482-L486 WeakPolarHBondContact O-CB 3.42Å; R482-L486 VanDerWaalsContact O-CG 3.31Å; R482-L486 WeakPolarHBondContact O-CG 3.27Å; R482-L486 PolarHBondContact O-N 3.33Å; T483-L486 PolarHBondContact O-N 2.94Å; L486-L489 PolarHBondContact O-N 2.94Å; L486-K490 WeakPolarHBondContact O-CG 3.28Å; L486-K490 PolarHBondContact O-N 3.33Å; L486-L508 HydrophobicContact CD2-CD1 4.05Å; L486-L508 HydrophobicContact CG-CD2 4.45Å; L486-Y607 HydrophobicContact CD2-CE1 4.49Å
487	N	85.3	Confident	81	Confident	25 Å²	25	47.2 Å²	47.2	13%	0.134	23%	0.227	C	C	.	.	H	α-helix	trans	-67.8	-38.1	175.5	-70.1	-24.9	0	0	0	111.5	E417 L460 T483 L485 L489 K490 L491	E417-N487 WeakPolarHBondContact CB-ND2 3.35Å; E417-N487 PolarHBondContact OE2-ND2 3.32Å; E417-N487 VanDerWaalsContact OE2-ND2 3.11Å; L460-N487 HydrophobicContact CD1-CB 4.16Å; T483-N487 WeakPolarHBondContact O-CB 3.47Å; T483-N487 VanDerWaalsContact O-CG 3.29Å; T483-N487 PolarHBondContact O-N 3.26Å; T483-N487 PolarHBondContact O-ND2 3.01Å; L485-N487 VanDerWaalsContact C-N 3.35Å; N487-L489 PolarHBondContact O-N 2.93Å; N487-K490 PolarHBondContact O-N 2.98Å; N487-L491 WeakPolarHBondContact O-CG 3.41Å; N487-L491 PolarHBondContact O-N 3.17Å
488	C	88.4	Confident	81.6	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-56.4	-49.2	170.2	176.8	0	0	0	0	111.7	A457 L460 L484 L485 K490 L491 L492	A457-C488 PolarHBondContact O-SG 3.28Å; L460-C488 HydrophobicContact CB-CB 4.15Å; L484-C488 WeakPolarHBondContact O-CB 3.4Å; L484-C488 PolarHBondContact O-N 3.41Å; L485-C488 WeakPolarHBondContact O-CB 3Å; L485-C488 PolarHBondContact O-N 3.02Å; C488-K490 VanDerWaalsContact C-N 3.34Å; C488-K490 PolarHBondContact O-N 3.03Å; C488-L491 PolarHBondContact O-N 3.4Å; C488-L492 WeakPolarHBondContact O-CG 3.27Å; C488-L492 PolarHBondContact O-N 3.35Å
489	L	86.6	Confident	82	Confident	36 Å²	36	46.3 Å²	46.3	19%	0.188	23%	0.226	C	C	.	.	H	α-helix	trans	-64.3	-33.9	179.7	-72.1	177.1	0	0	0	113.5	L485 L486 N487 L491 I501 A504 L508	L485-L489 WeakPolarHBondContact O-CG 3.4Å; L485-L489 PolarHBondContact O-N 3.34Å; L486-L489 PolarHBondContact O-N 2.94Å; N487-L489 PolarHBondContact O-N 2.93Å; L489-L491 VanDerWaalsContact C-N 3.32Å; L489-I501 HydrophobicContact CD2-CB 4.08Å; L489-I501 HydrophobicContact CD2-CG1 4.02Å; L489-I501 HydrophobicContact CD2-CG2 3.8Å; L489-A504 HydrophobicContact CD2-CB 3.89Å; L489-A504 HydrophobicContact CG-CB 4.14Å; L489-L508 HydrophobicContact CD1-CD1 3.67Å
490	K	84.8	Confident	82.4	Confident	168 Å²	168	47.7 Å²	47.7	73%	0.73	23%	0.232	S	C	*	.	H	α-helix	trans	-66.3	-33.2	175.7	-75.2	174.5	-177.3	176.1	0	112.9	L486 N487 C488	L486-K490 WeakPolarHBondContact O-CG 3.28Å; L486-K490 PolarHBondContact O-N 3.33Å; N487-K490 PolarHBondContact O-N 2.98Å; C488-K490 VanDerWaalsContact C-N 3.34Å; C488-K490 PolarHBondContact O-N 3.03Å
491	L	79.8	Confident	82.8	Confident	34 Å²	34	46.8 Å²	46.8	18%	0.178	23%	0.226	C	C	.	.	H	α-helix	trans	-82.7	-22.3	-177.1	-68.2	173.3	0	0	0	113.3	T453 V456 A457 L460 N487 C488 L489	T453-L491 HydrophobicContact CG2-CB 3.96Å; T453-L491 HydrophobicContact CG2-CD2 4.25Å; T453-L491 WeakPolarHBondContact CG2-O 3.09Å; V456-L491 HydrophobicContact CG1-CD1 3.96Å; A457-L491 HydrophobicContact CB-CB 4Å; A457-L491 HydrophobicContact CB-CD1 4.35Å; L460-L491 HydrophobicContact CD1-CD1 3.89Å; N487-L491 WeakPolarHBondContact O-CG 3.41Å; N487-L491 PolarHBondContact O-N 3.17Å; C488-L491 PolarHBondContact O-N 3.4Å; L489-L491 VanDerWaalsContact C-N 3.32Å
492	L	81.6	Confident	83.1	Confident	10 Å²	10	46.7 Å²	46.7	5%	0.052	23%	0.226	C	C	.	.	S	Bend	trans	-92	137.2	-175.6	-67	174	0	0	0	112.3	M454 A457 C488 K494 H497 I500 I501	M454-L492 HydrophobicContact CE-CD2 3.43Å; M454-L492 VanDerWaalsContact CE-CD2 3.43Å; M454-L492 HydrophobicContact SD-CD2 3.86Å; A457-L492 HydrophobicContact CB-CD1 4.36Å; A457-L492 HydrophobicContact CB-CD2 3.61Å; A457-L492 HydrophobicContact CB-CG 3.78Å; C488-L492 WeakPolarHBondContact O-CG 3.27Å; C488-L492 PolarHBondContact O-N 3.35Å; L492-K494 PolarHBondContact O-N 3.29Å; L492-H497 HydrophobicContact CD2-CB 4.36Å; L492-I500 HydrophobicContact CD1-CB 4.02Å; L492-I500 HydrophobicContact CD1-CG2 3.58Å; L492-I501 HydrophobicContact CB-CD1 4.21Å; L492-I501 HydrophobicContact CB-CG1 4.25Å; L492-I501 HydrophobicContact CD1-CG1 4.21Å
493	D	73.9	Confident	83.3	Confident	34 Å²	34	45.5 Å²	45.5	18%	0.182	22%	0.224	C	C	.	.			trans	-72.2	125.4	167.3	-176.4	-11.6	0	0	0	110.2	Y448 S495 R496 H497	Y448-D493 HydrophobicContact CE1-CB 3.92Å; Y448-D493 PolarHBondContact OH-OD2 2.96Å; D493-S495 VanDerWaalsContact CG-OG 3.23Å; D493-S495 PolarHBondContact O-N 3.49Å; D493-S495 VanDerWaalsContact O-N 3.16Å; D493-S495 PolarHBondContact OD1-N 3.28Å; D493-S495 PolarHBondContact OD1-OG 3.04Å; D493-S495 PolarHBondContact OD2-OG 3.31Å; D493-R496 HydrophobicContact CB-CB 4.3Å; D493-R496 HydrophobicContact CB-CG 4.32Å; D493-R496 PolarHBondContact O-N 2.91Å; D493-R496 IonicContact OD2-NE 3.7Å; D493-H497 PolarHBondContact O-N 2.89Å
494	K	74.3	Confident	83.7	Confident	130 Å²	130	43.4 Å²	43.4	57%	0.565	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54	-32.5	177.8	-63.1	-167.8	-179.8	-161.7	0	113.4	L492 I501 E610	L492-K494 PolarHBondContact O-N 3.29Å; K494-I501 VanDerWaalsContact CA-CD1 3.47Å; K494-I501 HydrophobicContact CB-CD1 4.44Å; K494-I501 HydrophobicContact CG-CD1 4.48Å; K494-E610 VanDerWaalsContact CE-OE1 3.31Å; K494-E610 WeakPolarHBondContact CE-OE1 3.25Å; K494-E610 IonicContact NZ-OE1 3.91Å; K494-E610 PolarHBondContact NZ-OE1 2.8Å; K494-E610 IonicContact NZ-OE2 2.71Å
495	S	70.4	Confident	84	Confident	86 Å²	86	43.6 Å²	43.6	60%	0.601	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-29.3	-175.2	67.3	0	0	0	0	114.1	D493	D493-S495 VanDerWaalsContact CG-OG 3.23Å; D493-S495 PolarHBondContact O-N 3.49Å; D493-S495 VanDerWaalsContact O-N 3.16Å; D493-S495 PolarHBondContact OD1-N 3.28Å; D493-S495 PolarHBondContact OD1-OG 3.04Å; D493-S495 PolarHBondContact OD2-OG 3.31Å
496	R	74.1	Confident	84.2	Confident	155 Å²	155	45.8 Å²	45.8	59%	0.585	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-27.5	-170.4	-65.3	-179.1	-179.4	-154.9	-1.9	113.7	D493 P498	D493-R496 HydrophobicContact CB-CB 4.3Å; D493-R496 HydrophobicContact CB-CG 4.32Å; D493-R496 PolarHBondContact O-N 2.91Å; D493-R496 IonicContact OD2-NE 3.7Å; R496-P498 WeakPolarHBondContact O-CD 3.47Å
497	H	81.1	Confident	84.2	Confident	51 Å²	51	43.8 Å²	43.8	24%	0.236	21%	0.21	C	C	.	.			trans	-129	53.5	-172.1	-55.9	-73.4	0	0	0	114.1	M454 L492 D493 Q499 I500 I501	M454-H497 WeakPolarHBondContact CE-CD2 3.17Å; M454-H497 WeakPolarHBondContact CE-CE1 3.34Å; M454-H497 WeakPolarHBondContact CE-NE2 3.27Å; L492-H497 HydrophobicContact CD2-CB 4.36Å; D493-H497 PolarHBondContact O-N 2.89Å; H497-Q499 VanDerWaalsContact C-N 3.26Å; H497-Q499 PolarHBondContact O-N 3.11Å; H497-I500 PolarHBondContact O-N 2.92Å; H497-I501 WeakPolarHBondContact O-CG1 3.39Å; H497-I501 PolarHBondContact O-N 3.31Å
498	P	84.9	Confident	84.4	Confident	20 Å²	20	42.6 Å²	42.6	13%	0.13	20%	0.203	C	C	.	.	H	α-helix	trans	-62.1	-30.3	-172.9	25.1	-34.9	0	0	0	113.7	R496 A502 S614 W680	R496-P498 WeakPolarHBondContact O-CD 3.47Å; P498-A502 VanDerWaalsContact O-CB 3.26Å; P498-A502 WeakPolarHBondContact O-CB 3.48Å; P498-A502 PolarHBondContact O-N 3.39Å; P498-S614 VanDerWaalsContact CB-O 3.25Å; P498-S614 WeakPolarHBondContact CB-O 2.89Å; P498-W680 HydrophobicContact CB-CH2 4.17Å; P498-W680 HydrophobicContact CG-CH2 4.26Å; P498-W680 HydrophobicContact CG-CZ2 4.39Å
499	Q	86.3	Confident	84.4	Confident	55 Å²	55	42.6 Å²	42.6	26%	0.257	20%	0.203	S	C	.	.	H	α-helix	trans	-65.4	-47.4	-179.8	-177.9	174.2	16.2	0	0	113.2	H497 I501 S503 W680	H497-Q499 VanDerWaalsContact C-N 3.26Å; H497-Q499 PolarHBondContact O-N 3.11Å; Q499-I501 VanDerWaalsContact C-N 3.34Å; Q499-S503 WeakPolarHBondContact O-CB 3.49Å; Q499-S503 PolarHBondContact O-N 3.29Å; Q499-S503 VanDerWaalsContact O-N 3.08Å; Q499-W680 VanDerWaalsContact CA-CZ3 3.44Å; Q499-W680 HydrophobicContact CB-CD2 3.9Å; Q499-W680 HydrophobicContact CB-CE3 3.82Å; Q499-W680 HydrophobicContact CB-CH2 3.82Å; Q499-W680 HydrophobicContact CB-CZ2 3.87Å; Q499-W680 HydrophobicContact CB-CZ3 3.79Å; Q499-W680 HydrophobicContact CG-CD2 3.67Å; Q499-W680 HydrophobicContact CG-CE3 3.61Å; Q499-W680 HydrophobicContact CG-CG 4.13Å; Q499-W680 HydrophobicContact CG-CZ3 4.08Å
500	I	86.3	Confident	84.4	Confident	31 Å²	31	42.8 Å²	42.8	16%	0.159	20%	0.203	C	C	.	.	H	α-helix	trans	-68.9	-40.8	-179	-59.9	173.2	0	0	0	109.3	I458 Y461 L492 H497 S503 A504	I458-I500 HydrophobicContact CD1-CD1 4.37Å; I458-I500 HydrophobicContact CG1-CD1 3.85Å; Y461-I500 HydrophobicContact CD2-CG2 3.93Å; Y461-I500 HydrophobicContact CE2-CG2 4.36Å; Y461-I500 HydrophobicContact CG-CG2 4.02Å; L492-I500 HydrophobicContact CD1-CB 4.02Å; L492-I500 HydrophobicContact CD1-CG2 3.58Å; H497-I500 PolarHBondContact O-N 2.92Å; I500-S503 PolarHBondContact O-N 2.75Å; I500-A504 VanDerWaalsContact O-CB 3.27Å; I500-A504 WeakPolarHBondContact O-CB 3.48Å; I500-A504 PolarHBondContact O-N 2.76Å
501	I	88.3	Confident	84.4	Confident	4 Å²	4	35 Å²	35	2%	0.021	17%	0.17	C	C	.	.	H	α-helix	trans	-63.4	-46.4	179	-65.4	174.1	0	0	0	111.2	L489 L492 K494 H497 Q499 S503 A504 N505 S614	L489-I501 HydrophobicContact CD2-CB 4.08Å; L489-I501 HydrophobicContact CD2-CG1 4.02Å; L489-I501 HydrophobicContact CD2-CG2 3.8Å; L492-I501 HydrophobicContact CB-CD1 4.21Å; L492-I501 HydrophobicContact CB-CG1 4.25Å; L492-I501 HydrophobicContact CD1-CG1 4.21Å; K494-I501 VanDerWaalsContact CA-CD1 3.47Å; K494-I501 HydrophobicContact CB-CD1 4.44Å; K494-I501 HydrophobicContact CG-CD1 4.48Å; H497-I501 WeakPolarHBondContact O-CG1 3.39Å; H497-I501 PolarHBondContact O-N 3.31Å; Q499-I501 VanDerWaalsContact C-N 3.34Å; I501-S503 VanDerWaalsContact C-N 3.34Å; I501-S503 PolarHBondContact O-N 3.37Å; I501-A504 PolarHBondContact O-N 2.95Å; I501-N505 WeakPolarHBondContact O-CB 3.42Å; I501-N505 PolarHBondContact O-N 3.15Å; I501-N505 PolarHBondContact O-ND2 2.96Å; I501-S614 WeakPolarHBondContact CG2-OG 3.16Å
502	A	89.2	Confident	84.4	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-61.2	-44	177.1	0	0	0	0	0	111.5	P498 N505 Y506 V615 M684	P498-A502 VanDerWaalsContact O-CB 3.26Å; P498-A502 WeakPolarHBondContact O-CB 3.48Å; P498-A502 PolarHBondContact O-N 3.39Å; A502-N505 PolarHBondContact O-N 3.39Å; A502-Y506 PolarHBondContact O-N 3.49Å; A502-V615 HydrophobicContact CB-CG2 3.74Å; A502-M684 HydrophobicContact CB-CG 3.65Å; A502-M684 HydrophobicContact CB-SD 4.4Å
503	S	90	Very high	84.1	Confident	16 Å²	16	37 Å²	37	11%	0.112	18%	0.177	C	C	.	.	H	α-helix	trans	-68.3	-39.5	178.6	-174.5	0	0	0	0	113.6	Y461 Q499 I500 I501 Y506 M507	Y461-S503 WeakPolarHBondContact OH-CB 3.37Å; Y461-S503 PolarHBondContact OH-OG 3.43Å; Q499-S503 WeakPolarHBondContact O-CB 3.49Å; Q499-S503 PolarHBondContact O-N 3.29Å; Q499-S503 VanDerWaalsContact O-N 3.08Å; I500-S503 PolarHBondContact O-N 2.75Å; I501-S503 VanDerWaalsContact C-N 3.34Å; I501-S503 PolarHBondContact O-N 3.37Å; S503-Y506 PolarHBondContact O-N 3.47Å; S503-M507 PolarHBondContact O-N 3.3Å
504	A	90.6	Very high	84	Confident	0 Å²	0	36 Å²	36	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63.6	-42.7	176.7	0	0	0	0	0	111.4	Y461 L485 L489 I500 I501 M507 L508	Y461-A504 HydrophobicContact CD2-CB 4.12Å; Y461-A504 HydrophobicContact CE2-CB 4.39Å; L485-A504 HydrophobicContact CD2-CB 4.26Å; L489-A504 HydrophobicContact CD2-CB 3.89Å; L489-A504 HydrophobicContact CG-CB 4.14Å; I500-A504 VanDerWaalsContact O-CB 3.27Å; I500-A504 WeakPolarHBondContact O-CB 3.48Å; I500-A504 PolarHBondContact O-N 2.76Å; I501-A504 PolarHBondContact O-N 2.95Å; A504-M507 PolarHBondContact O-N 2.97Å; A504-L508 WeakPolarHBondContact O-CG 3.43Å; A504-L508 PolarHBondContact O-N 3.49Å
505	N	92.4	Very high	83.2	Confident	5 Å²	5	35 Å²	35	3%	0.027	17%	0.173	C	C	.	.	H	α-helix	trans	-65.2	-40.1	174.5	-81.2	-67.2	0	0	0	112.5	I501 A502 L508 S509 Y607	I501-N505 WeakPolarHBondContact O-CB 3.42Å; I501-N505 PolarHBondContact O-N 3.15Å; I501-N505 PolarHBondContact O-ND2 2.96Å; A502-N505 PolarHBondContact O-N 3.39Å; N505-L508 PolarHBondContact O-N 2.89Å; N505-S509 PolarHBondContact O-N 2.85Å; N505-Y607 WeakPolarHBondContact CB-O 3.32Å
506	Y	91.5	Very high	81.8	Confident	47 Å²	47	36.6 Å²	36.6	18%	0.184	17%	0.171	C	C	.	.	H	α-helix	trans	-59.3	-47	172.5	175	-106.8	0	0	0	111.7	A502 S503 L508 S509 E510 M684 Q687 L688	A502-Y506 PolarHBondContact O-N 3.49Å; S503-Y506 PolarHBondContact O-N 3.47Å; Y506-L508 PolarHBondContact O-N 3.32Å; Y506-S509 WeakPolarHBondContact O-CB 3.38Å; Y506-S509 PolarHBondContact O-N 2.89Å; Y506-S509 VanDerWaalsContact O-N 3.12Å; Y506-S509 PolarHBondContact O-OG 3.21Å; Y506-E510 HydrophobicContact CD1-CG 4.48Å; Y506-E510 HydrophobicContact CE1-CG 3.98Å; Y506-E510 HydrophobicContact CE2-CG 4.24Å; Y506-E510 PolarHBondContact O-N 3.36Å; Y506-M684 HydrophobicContact CG-SD 4.28Å; Y506-Q687 HydrophobicContact CD2-CB 4.07Å; Y506-Q687 HydrophobicContact CE2-CB 3.71Å; Y506-Q687 HydrophobicContact CE2-CG 4.5Å; Y506-L688 HydrophobicContact CD2-CD2 4.25Å
507	M	87.8	Confident	80.1	Confident	13 Å²	13	34.7 Å²	34.7	6%	0.064	18%	0.179	C	C	.	.	H	α-helix	trans	-64.1	-38.7	176.8	-73	-169.7	-63.8	0	0	113.2	Y461 C465 M468 L485 S503 A504 S509 E510 L511	Y461-M507 HydrophobicContact CD2-CE 3.51Å; Y461-M507 HydrophobicContact CE2-CE 3.15Å; C465-M507 HydrophobicContact CB-SD 4.26Å; C465-M507 WeakPolarHBondContact SG-CE 3.41Å; C465-M507 PolarHBondContact SG-SD 3.23Å; M468-M507 HydrophobicContact CE-CB 4.46Å; M468-M507 HydrophobicContact CE-CG 4.21Å; M468-M507 HydrophobicContact SD-CB 3.76Å; M468-M507 HydrophobicContact SD-CG 3.63Å; M468-M507 HydrophobicContact SD-SD 3.89Å; L485-M507 HydrophobicContact CD1-CB 3.8Å; L485-M507 HydrophobicContact CD1-CE 4.33Å; L485-M507 HydrophobicContact CD2-CE 3.49Å; L485-M507 VanDerWaalsContact CD2-CE 3.49Å; S503-M507 PolarHBondContact O-N 3.3Å; A504-M507 PolarHBondContact O-N 2.97Å; M507-S509 PolarHBondContact O-N 2.95Å; M507-E510 WeakPolarHBondContact O-CB 3.25Å; M507-E510 PolarHBondContact O-N 3.04Å; M507-E510 VanDerWaalsContact O-N 3.08Å; M507-L511 PolarHBondContact O-N 3.28Å
508	L	89.1	Confident	78.1	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-58.5	-38.7	172.7	-78	168.9	0	0	0	111.5	R482 L485 L486 L489 A504 N505 Y506 E510 L511 F512 Y607	R482-L508 HydrophobicContact CB-CD2 4.41Å; R482-L508 HydrophobicContact CG-CD2 3.98Å; L485-L508 HydrophobicContact CB-CD1 4.23Å; L485-L508 HydrophobicContact CB-CD2 3.79Å; L485-L508 HydrophobicContact CB-CG 3.88Å; L485-L508 HydrophobicContact CD1-CD2 3.99Å; L485-L508 HydrophobicContact CD1-CG 3.91Å; L486-L508 HydrophobicContact CD2-CD1 4.05Å; L486-L508 HydrophobicContact CG-CD2 4.45Å; L489-L508 HydrophobicContact CD1-CD1 3.67Å; A504-L508 WeakPolarHBondContact O-CG 3.43Å; A504-L508 PolarHBondContact O-N 3.49Å; N505-L508 PolarHBondContact O-N 2.89Å; Y506-L508 PolarHBondContact O-N 3.32Å; L508-E510 VanDerWaalsContact C-N 3.33Å; L508-L511 HydrophobicContact CD2-CD1 4.2Å; L508-L511 PolarHBondContact O-N 3.32Å; L508-F512 WeakPolarHBondContact O-CD2 3.15Å; L508-Y607 HydrophobicContact CB-CD1 4.07Å; L508-Y607 HydrophobicContact CB-CD2 3.96Å; L508-Y607 HydrophobicContact CB-CE1 4.23Å; L508-Y607 HydrophobicContact CB-CE2 4.09Å; L508-Y607 HydrophobicContact CB-CG 3.96Å; L508-Y607 HydrophobicContact CD1-CD1 3.97Å; L508-Y607 HydrophobicContact CD1-CE1 3.77Å; L508-Y607 HydrophobicContact CG-CE1 4.5Å
509	S	90.1	Very high	75.4	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-68.7	-30	175.3	87.4	0	0	0	0	113.1	N505 Y506 M507 F512 K691	N505-S509 PolarHBondContact O-N 2.85Å; Y506-S509 WeakPolarHBondContact O-CB 3.38Å; Y506-S509 PolarHBondContact O-N 2.89Å; Y506-S509 VanDerWaalsContact O-N 3.12Å; Y506-S509 PolarHBondContact O-OG 3.21Å; M507-S509 PolarHBondContact O-N 2.95Å; S509-F512 PolarHBondContact O-N 3.3Å; S509-K691 WeakPolarHBondContact O-CE 3.27Å; S509-K691 PolarHBondContact O-NZ 3.42Å
510	E	86.7	Confident	72.7	Confident	39 Å²	39	53 Å²	53	18%	0.182	26%	0.258	C	S	.	.	H	α-helix	trans	-74.5	-23.5	178.3	-79.1	-68.5	104.6	0	0	113.6	M468 K471 Y506 M507 L508 F512 K691	M468-E510 HydrophobicContact CE-CB 3.34Å; M468-E510 HydrophobicContact CE-CG 3.83Å; K471-E510 IonicContact NZ-OE2 2.94Å; Y506-E510 HydrophobicContact CD1-CG 4.48Å; Y506-E510 HydrophobicContact CE1-CG 3.98Å; Y506-E510 HydrophobicContact CE2-CG 4.24Å; Y506-E510 PolarHBondContact O-N 3.36Å; M507-E510 WeakPolarHBondContact O-CB 3.25Å; M507-E510 PolarHBondContact O-N 3.04Å; M507-E510 VanDerWaalsContact O-N 3.08Å; L508-E510 VanDerWaalsContact C-N 3.33Å; E510-F512 PolarHBondContact O-N 3.4Å; E510-K691 WeakPolarHBondContact OE1-CD 3.43Å; E510-K691 WeakPolarHBondContact OE1-CE 3.27Å; E510-K691 IonicContact OE1-NZ 3.59Å; E510-K691 PolarHBondContact OE1-NZ 2.88Å
511	L	84	Confident	70.1	Confident	5 Å²	5	60.8 Å²	60.8	3%	0.026	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-25.6	173.8	-64.8	177	0	0	0	112.2	Y478 I481 R482 M507 L508 F591	Y478-L511 HydrophobicContact CD1-CD2 4.16Å; Y478-L511 HydrophobicContact CD2-CD2 4.44Å; Y478-L511 HydrophobicContact CG-CD2 4.1Å; I481-L511 HydrophobicContact CB-CD2 4.29Å; I481-L511 HydrophobicContact CG2-CD1 4.3Å; I481-L511 HydrophobicContact CG2-CD2 3.95Å; R482-L511 HydrophobicContact CB-CD1 3.82Å; M507-L511 PolarHBondContact O-N 3.28Å; L508-L511 HydrophobicContact CD2-CD1 4.2Å; L508-L511 PolarHBondContact O-N 3.32Å; L511-F591 HydrophobicContact CB-CE2 3.88Å; L511-F591 HydrophobicContact CB-CZ 4.02Å; L511-F591 HydrophobicContact CD1-CE2 4.19Å
512	F	80.6	Confident	67.1	Low	6 Å²	6	67.3 Å²	67.3	3%	0.026	33%	0.328	C	S	.	.	S	Bend	trans	-92.3	100.7	173.8	-61.5	-79.6	0	0	0	109.1	R482 L508 S509 E510 L514 F591 R600 L603 V604 Y607	R482-F512 VanDerWaalsContact NH1-CZ 3.31Å; L508-F512 WeakPolarHBondContact O-CD2 3.15Å; S509-F512 PolarHBondContact O-N 3.3Å; E510-F512 PolarHBondContact O-N 3.4Å; F512-L514 PolarHBondContact O-N 3.47Å; F512-F591 HydrophobicContact CD1-CE1 4.32Å; F512-F591 HydrophobicContact CD1-CZ 4.05Å; F512-F591 AromaticContact CE1-CE1 3.92Å; F512-F591 HydrophobicContact CE1-CE1 3.92Å; F512-F591 AromaticContact CE1-CZ 3.67Å; F512-F591 HydrophobicContact CE1-CZ 3.67Å; F512-F591 HydrophobicContact CE2-CZ 4.37Å; F512-F591 HydrophobicContact CZ-CE1 4.45Å; F512-F591 HydrophobicContact CZ-CE2 4.43Å; F512-F591 AromaticContact CZ-CZ 3.84Å; F512-F591 HydrophobicContact CZ-CZ 3.84Å; F512-R600 HydrophobicContact CB-CG 4.05Å; F512-R600 HydrophobicContact CD1-CG 3.73Å; F512-R600 HydrophobicContact CG-CG 4.19Å; F512-L603 HydrophobicContact CE1-CD2 4.1Å; F512-L603 HydrophobicContact CE2-CD2 3.78Å; F512-L603 HydrophobicContact CE2-CG 4.35Å; F512-L603 HydrophobicContact CZ-CD2 3.38Å; F512-L603 HydrophobicContact CZ-CG 4.39Å; F512-V604 HydrophobicContact CB-CG2 3.51Å; F512-V604 HydrophobicContact CD2-CG2 4.03Å; F512-V604 HydrophobicContact CG-CG2 3.96Å; F512-Y607 HydrophobicContact CE2-CE2 4.04Å
513	Q	74.3	Confident	64.7	Low	79 Å²	79	72.5 Å²	72.5	37%	0.369	37%	0.365	S	S	.	.			trans	-66.8	122.3	173.2	-63.8	-177.5	8.8	0	0	108.4	Y478 R600	Y478-Q513 PolarHBondContact OH-NE2 2.92Å; Q513-R600 PolarHBondContact O-NH1 2.93Å
514	L	72.7	Confident	62	Low	14 Å²	14	81 Å²	81	7%	0.073	40%	0.402	C	S	.	.	S	Bend	trans	-88.5	-17.5	179.3	-66.9	177.4	0	0	0	112.4	F512 V604 K691 K694 A695 V698	F512-L514 PolarHBondContact O-N 3.47Å; L514-V604 HydrophobicContact CD1-CG1 4.48Å; L514-V604 HydrophobicContact CD2-CG2 4.39Å; L514-K691 HydrophobicContact CD1-CD 4.27Å; L514-K694 HydrophobicContact CD1-CB 3.95Å; L514-A695 HydrophobicContact CD1-CB 4.03Å; L514-V698 HydrophobicContact CB-CG2 4.26Å
515	D	56.1	Low	58.9	Low	110 Å²	110	86.5 Å²	86.5	59%	0.588	44%	0.441	S	S	*	.			trans	-103.6	19.6	-166.8	-56.5	-33.9	0	0	0	114	P517	D515-P517 WeakPolarHBondContact O-CD 3.38Å
516	E	42.2	Very low	56	Low	119 Å²	119	92.1 Å²	92.1	56%	0.556	48%	0.478	S	S	*	.			trans	-67.4	121.6	176.6	-77.7	-165.7	164.1	0	0	110.1	K475 K518	K475-E516 IonicContact NZ-OE1 2.82Å; K475-E516 PolarHBondContact NZ-OE1 3.46Å; E516-K518 PolarHBondContact O-N 3.34Å
517	P	37.2	Very low	53.2	Low	115 Å²	115	98 Å²	98	75%	0.747	51%	0.511	S	S	*	.			trans	-63.1	134.8	177.3	24.7	-31.8	0	0	0	109.6	D515 K519	D515-P517 WeakPolarHBondContact O-CD 3.38Å; P517-K519 PolarHBondContact O-N 3.33Å
518	K	39.5	Very low	50.2	Low	143 Å²	143	105.1 Å²	105.1	62%	0.622	55%	0.55	S	S	*	.			trans	-54.2	112	171.3	-66.3	178.6	-175.4	169.9	0	107	E516 E520 D701	E516-K518 PolarHBondContact O-N 3.34Å; K518-E520 PolarHBondContact O-N 2.93Å; K518-D701 WeakPolarHBondContact CE-OD2 3.31Å; K518-D701 IonicContact NZ-OD1 3.82Å; K518-D701 IonicContact NZ-OD2 2.68Å; K518-D701 PolarHBondContact NZ-OD2 3.35Å
519	K	29.4	Very low	47.7	Very low	202 Å²	202	112.9 Å²	112.9	88%	0.878	59%	0.586	S	S	*	*			trans	-64	108.1	166.8	-76.2	-175.5	177.1	-178.9	0	106	P517 E521	P517-K519 PolarHBondContact O-N 3.33Å; K519-E521 PolarHBondContact O-N 2.65Å
520	E	28.4	Very low	44.8	Very low	166 Å²	166	120.6 Å²	120.6	78%	0.776	63%	0.627	S	S	*	*			trans	-57.1	119.7	169.5	-71.5	-179.3	162.1	0	0	107.8	K518 N522	K518-E520 PolarHBondContact O-N 2.93Å; E520-N522 PolarHBondContact O-N 3.16Å
521	E	31.7	Very low	42	Very low	194 Å²	194	124.3 Å²	124.3	91%	0.907	66%	0.657	S	S	*	*			trans	-68.1	73.7	165.2	-71.9	-175.4	161.1	0	0	108.3	K519 S523	K519-E521 PolarHBondContact O-N 2.65Å; E521-S523 PolarHBondContact O-N 3.23Å
522	N	25.6	Very low	39.6	Very low	140 Å²	140	131.7 Å²	131.7	75%	0.749	70%	0.697	S	S	*	*			trans	-86	99.9	162.5	-113.8	-4.3	0	0	0	107.5	E520 E524	E520-N522 PolarHBondContact O-N 3.16Å; N522-E524 PolarHBondContact O-N 3.49Å; N522-E524 VanDerWaalsContact O-N 3.08Å
523	S	39	Very low	37	Very low	110 Å²	110	139.6 Å²	139.6	77%	0.769	73%	0.734	S	S	*	*			trans	-53.4	105.2	161.8	50	0	0	0	0	109.8	E521	E521-S523 PolarHBondContact O-N 3.23Å
524	E	32.9	Very low	34.8	Very low	194 Å²	194	141.1 Å²	141.1	91%	0.907	75%	0.753	S	S	*	*			trans	163.8	98.7	139	-91.6	-178.5	-172.5	0	0	109.2	N522	N522-E524 PolarHBondContact O-N 3.49Å; N522-E524 VanDerWaalsContact O-N 3.08Å
525	S	25.6	Very low	32.7	Very low	115 Å²	115	150.9 Å²	150.9	80%	0.804	79%	0.791	S	S	*	*			trans	-147.6	143.7	149.7	59	0	0	0	0	110.1
526	P	31.4	Very low	31.3	Very low	124 Å²	124	149.7 Å²	149.7	81%	0.805	79%	0.791	S	S	*	*			trans	-80.1	145.7	-169.7	17.9	-5	0	0	0	111.1	N528	P526-N528 PolarHBondContact O-N 2.87Å
527	L	33.4	Very low	30.9	Very low	169 Å²	169	153.1 Å²	153.1	89%	0.885	81%	0.807	S	S	*	*			trans	-39.8	122.4	170.2	-64	160.3	0	0	0	111.7
528	N	24.8	Very low	30.3	Very low	163 Å²	163	155.5 Å²	155.5	87%	0.872	81%	0.808	S	S	*	*			trans	-133.6	98.9	151.5	-149.6	15.7	0	0	0	108.1	P526 N530	P526-N528 PolarHBondContact O-N 2.87Å; N528-N530 PolarHBondContact O-N 3.28Å
529	E	36.2	Very low	30	Very low	163 Å²	163	157.7 Å²	157.7	76%	0.762	82%	0.82	S	S	*	*			trans	-57.3	124.9	167.7	-69.5	170.2	144.5	0	0	109.4
530	N	29.3	Very low	29.9	Very low	162 Å²	162	156.5 Å²	156.5	87%	0.866	82%	0.818	S	S	*	*			trans	157.2	84.2	136.8	-78.3	-25	0	0	0	110.8	N528	N528-N530 PolarHBondContact O-N 3.28Å
531	S	27.4	Very low	29.9	Very low	117 Å²	117	157.3 Å²	157.3	82%	0.818	82%	0.822	S	S	*	*			trans	-152.9	100.5	142.5	70.1	0	0	0	0	108.8	E533	S531-E533 PolarHBondContact O-N 3.35Å
532	D	33.2	Very low	29.7	Very low	160 Å²	160	156.4 Å²	156.4	86%	0.856	82%	0.82	S	S	*	*			trans	-59.6	104.3	172.8	-124	-11	0	0	0	110.2
533	E	27.3	Very low	30	Very low	173 Å²	173	155.4 Å²	155.4	81%	0.808	82%	0.821	S	S	*	*			trans	-156.1	70.9	158.8	-81.3	-60.6	165.7	0	0	107.1	S531	S531-E533 PolarHBondContact O-N 3.35Å
534	S	26.8	Very low	29.6	Very low	110 Å²	110	157.9 Å²	157.9	77%	0.769	83%	0.825	S	S	*	*			trans	-97.4	103.9	164.8	-164.9	0	0	0	0	107.6
535	Y	29	Very low	29.7	Very low	220 Å²	220	153.2 Å²	153.2	86%	0.863	81%	0.814	S	S	*	*			trans	-89.3	99.6	167.3	-135.8	-91.6	0	0	0	106.7
536	S	27.2	Very low	29.9	Very low	85 Å²	85	155.6 Å²	155.6	59%	0.594	82%	0.818	S	S	*	*			trans	-69.3	122.7	171.7	46.5	0	0	0	0	109.7	E538	S536-E538 PolarHBondContact O-N 3.18Å
537	E	33.5	Very low	30.1	Very low	191 Å²	191	158 Å²	158	89%	0.893	82%	0.818	S	S	*	*			trans	-69.4	106.9	161	-70.6	-178.6	160.7	0	0	108
538	E	25.2	Very low	29.9	Very low	165 Å²	165	157.8 Å²	157.8	77%	0.771	82%	0.818	S	S	*	*			trans	-104.8	105.8	157.8	-71.2	-172.3	173.8	0	0	107	S536 E540	S536-E538 PolarHBondContact O-N 3.18Å; E538-E540 PolarHBondContact O-N 2.7Å
539	E	32.8	Very low	29.9	Very low	188 Å²	188	152.9 Å²	152.9	88%	0.879	81%	0.806	S	S	*	*			trans	-66.2	108.4	160.1	-69.2	-173.3	149.2	0	0	107.7
540	E	27.8	Very low	29.3	Very low	178 Å²	178	150.6 Å²	150.6	83%	0.832	81%	0.808	S	S	*	*			trans	-93.2	109.1	158.5	-79.1	-156.4	160.6	0	0	109	E538	E538-E540 PolarHBondContact O-N 2.7Å
541	E	28.5	Very low	29.4	Very low	182 Å²	182	152.8 Å²	152.8	85%	0.85	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-58.2	132.7	162.5	-72.8	-178.5	143.1	0	0	110.3
542	M	26.7	Very low	29.4	Very low	176 Å²	176	152.4 Å²	152.4	87%	0.867	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-63.3	133.7	170.6	-68	-76.4	-65.7	0	0	111
543	P	32.3	Very low	29.5	Very low	118 Å²	118	150.6 Å²	150.6	77%	0.766	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-89.6	124.9	158.2	32	-25.3	0	0	0	110
544	D	29.8	Very low	29.4	Very low	162 Å²	162	147.7 Å²	147.7	87%	0.866	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-66.5	150.3	164	-96.2	-30	0	0	0	111.8
545	S	35.3	Very low	30.1	Very low	96 Å²	96	147.8 Å²	147.8	67%	0.671	80%	0.797	S	S	*	*			trans	71.8	119.4	155.4	-170.1	0	0	0	0	119.5
546	D	30	Very low	30.1	Very low	165 Å²	165	145 Å²	145	88%	0.882	80%	0.797	S	S	*	*				-148.8	117	123.4	-96.6	-23.9	0	0	0	110.7
547	E	36.8	Very low	31.1	Very low	175 Å²	175	146.8 Å²	146.8	82%	0.818	81%	0.807	S	S	*	*			trans	-60.7	142.2	156.8	-68.3	-164.7	147.3	0	0	110
548	N	28.3	Very low	31.2	Very low	165 Å²	165	142.8 Å²	142.8	88%	0.882	80%	0.8	S	S	*	*				170.9	135.4	108.1	-151.6	-1.5	0	0	0	112.3
549	G	24.5	Very low	31.9	Very low	59 Å²	59	142 Å²	142	61%	0.608	80%	0.801	S	S	*	*			trans	101.7	87.8	145.1	0	0	0	0	0	119.1
550	S	24.4	Very low	32.6	Very low	115 Å²	115	137.6 Å²	137.6	80%	0.804	78%	0.784	S	S	*	*				166.5	133.5	86.2	53	0	0	0	0	112.6
551	Y	31.1	Very low	33.7	Very low	209 Å²	209	133.6 Å²	133.6	82%	0.82	78%	0.775	S	S	*	*			trans	-63.6	130.6	172.2	-136.9	-103.3	0	0	0	109.9	T553	Y551-T553 HydrophobicContact CE1-CG2 4.12Å
552	S	27.1	Very low	35.3	Very low	109 Å²	109	129.3 Å²	129.3	76%	0.762	75%	0.754	S	S	*	*			trans	-142.7	96.1	158.1	-68.3	0	0	0	0	108	S554	S552-S554 PolarHBondContact O-N 3.16Å
553	T	34.1	Very low	37.1	Very low	122 Å²	122	122.2 Å²	122.2	75%	0.748	72%	0.723	S	S	*	*			trans	-62.4	113	164.5	5.4	0	0	0	0	109.3	Y551	Y551-T553 HydrophobicContact CE1-CG2 4.12Å
554	S	27.1	Very low	39.3	Very low	111 Å²	111	120.5 Å²	120.5	78%	0.776	71%	0.71	S	S	*	*			trans	-147.2	113.5	152	61.3	0	0	0	0	109.1	S552	S552-S554 PolarHBondContact O-N 3.16Å
555	S	39.9	Very low	41.9	Very low	112 Å²	112	113.3 Å²	113.3	78%	0.783	67%	0.673	S	S	*	*			trans	-61.8	128.4	173.1	45.4	0	0	0	0	112.6
556	D	30.6	Very low	44.2	Very low	161 Å²	161	111.7 Å²	111.7	86%	0.861	66%	0.657	S	S	*	*			trans	-155.2	132.1	142.8	-97.2	-25.7	0	0	0	109.1
557	P	47.6	Very low	46.9	Very low	124 Å²	124	104 Å²	104	81%	0.805	62%	0.616	S	S	*	*			trans	-99	132.6	-178.9	34.7	-27.4	0	0	0	112.4
558	S	35.5	Very low	49	Very low	106 Å²	106	103.4 Å²	103.4	74%	0.741	61%	0.61	S	S	*	*			trans	-179.1	109.3	135.2	61.8	0	0	0	0	113.5	D560	S558-D560 PolarHBondContact O-N 3.37Å; S558-D560 VanDerWaalsContact O-N 3.13Å
559	D	39.6	Very low	51.7	Low	148 Å²	148	97.9 Å²	97.9	79%	0.791	59%	0.585	S	S	*	*			trans	47.2	41.1	134.3	-114.2	-9.9	0	0	0	122.1	S561	D559-S561 PolarHBondContact O-N 3.28Å; D559-S561 PolarHBondContact OD1-OG 3.42Å
560	D	47.9	Very low	54.4	Low	97 Å²	97	95.4 Å²	95.4	52%	0.519	56%	0.558	S	S	.	*			trans	-77.5	16.1	169.1	-98.1	-24.4	0	0	0	114.8	K433 S558 K562	K433-D560 IonicContact NZ-OD1 2.61Å; K433-D560 PolarHBondContact NZ-OD1 2.55Å; S558-D560 PolarHBondContact O-N 3.37Å; S558-D560 VanDerWaalsContact O-N 3.13Å; D560-K562 VanDerWaalsContact C-N 3.3Å; D560-K562 PolarHBondContact O-N 3.08Å
561	S	50.1	Low	57.1	Low	94 Å²	94	91.7 Å²	91.7	66%	0.657	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	4.3	-154.6	59.1	0	0	0	0	118.4	D559	D559-S561 PolarHBondContact O-N 3.28Å; D559-S561 PolarHBondContact OD1-OG 3.42Å
562	K	62	Low	59.5	Low	91 Å²	91	83.9 Å²	83.9	40%	0.396	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.9	6.9	-175.6	-68.7	-165	172.7	-135.7	0	117.1	F180 Y435 L440 E443 D560	F180-K562 HydrophobicContact CD2-CD 4.45Å; F180-K562 HydrophobicContact CE2-CB 4.03Å; F180-K562 HydrophobicContact CE2-CD 3.79Å; F180-K562 HydrophobicContact CE2-CG 4.45Å; F180-K562 HydrophobicContact CZ-CB 4.17Å; Y435-K562 WeakPolarHBondContact CD1-O 3.49Å; L440-K562 HydrophobicContact CD2-CB 4.35Å; L440-K562 HydrophobicContact CD2-CD 3.84Å; L440-K562 HydrophobicContact CD2-CG 4.49Å; E443-K562 IonicContact OE2-NZ 2.81Å; E443-K562 PolarHBondContact OE2-NZ 3.05Å; D560-K562 VanDerWaalsContact C-N 3.3Å; D560-K562 PolarHBondContact O-N 3.08Å
563	A	65.7	Low	62.2	Low	28 Å²	28	78.8 Å²	78.8	23%	0.231	47%	0.472	C	S	.	.			trans	-85.6	134.8	178.3	0	0	0	0	0	111.6	K433 Y435 I566	K433-A563 HydrophobicContact CB-CB 4.43Å; K433-A563 HydrophobicContact CD-CB 4.46Å; Y435-A563 HydrophobicContact CD1-CB 4.25Å; Y435-A563 HydrophobicContact CE1-CB 3.8Å; A563-I566 HydrophobicContact CB-CD1 4.06Å; A563-I566 HydrophobicContact CB-CG1 3.92Å
564	V	78.3	Confident	64.4	Low	81 Å²	81	75 Å²	75	49%	0.491	45%	0.451	S	S	.	.	S	Bend	trans	-82.2	-31.7	-179.7	179.7	0	0	0	0	111.6	L434 D436	L434-V564 PolarHBondContact O-N 3.39Å; D436-V564 HydrophobicContact CB-CG2 3.78Å
565	A	84.5	Confident	67.1	Low	11 Å²	11	73.2 Å²	73.2	9%	0.091	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	149.8	173.3	0	0	0	0	0	111.5	F409 N413 L434	F409-A565 HydrophobicContact CE2-CB 3.9Å; F409-A565 HydrophobicContact CZ-CB 3.66Å; N413-A565 HydrophobicContact CB-CB 3.92Å; N413-A565 VanDerWaalsContact CG-CB 3.5Å; N413-A565 VanDerWaalsContact OD1-CB 3.27Å; N413-A565 WeakPolarHBondContact OD1-CB 3.35Å; L434-A565 HydrophobicContact CB-CB 4.25Å; L434-A565 HydrophobicContact CD2-CB 4.45Å; L434-A565 PolarHBondContact N-O 2.86Å; L434-A565 PolarHBondContact O-N 2.89Å
566	I	84.1	Confident	68.8	Low	63 Å²	63	71.3 Å²	71.3	32%	0.323	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	130.3	-176.3	-54.9	178.4	0	0	0	110.5	I431 V432 K433 A563	I431-I566 HydrophobicContact CG2-CG2 3.53Å; V432-I566 WeakPolarHBondContact O-CA 3.47Å; K433-I566 HydrophobicContact CG-CG1 4.3Å; K433-I566 HydrophobicContact CG-CG2 4.4Å; A563-I566 HydrophobicContact CB-CD1 4.06Å; A563-I566 HydrophobicContact CB-CG1 3.92Å
567	I	85.9	Confident	70.6	Confident	4 Å²	4	69 Å²	69	2%	0.021	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	110.8	163.6	-59.4	160.9	0	0	0	106.9	F409 I431 V432 S569 L573	F409-I567 HydrophobicContact CD1-CD1 3.85Å; F409-I567 HydrophobicContact CD1-CG1 4.43Å; F409-I567 HydrophobicContact CD2-CD1 4.11Å; F409-I567 HydrophobicContact CD2-CG1 3.89Å; F409-I567 HydrophobicContact CE1-CD1 3.89Å; F409-I567 HydrophobicContact CE1-CG1 4.23Å; F409-I567 HydrophobicContact CE2-CD1 4.14Å; F409-I567 HydrophobicContact CE2-CG1 3.65Å; F409-I567 HydrophobicContact CG-CD1 3.97Å; F409-I567 HydrophobicContact CG-CG1 4.27Å; F409-I567 HydrophobicContact CZ-CD1 4.03Å; F409-I567 HydrophobicContact CZ-CG1 3.83Å; I431-I567 WeakPolarHBondContact CA-O 3.44Å; V432-I567 HydrophobicContact CB-CB 4.17Å; V432-I567 HydrophobicContact CB-CD1 4.15Å; V432-I567 HydrophobicContact CG1-CD1 4.49Å; V432-I567 PolarHBondContact N-O 3.5Å; V432-I567 VanDerWaalsContact N-O 3.1Å; V432-I567 PolarHBondContact O-N 3.44Å; I567-S569 VanDerWaalsContact C-N 3.33Å; I567-S569 WeakPolarHBondContact CG2-O 3.24Å; I567-S569 PolarHBondContact O-N 2.91Å; I567-L573 HydrophobicContact CD1-CD2 3.91Å; I567-L573 HydrophobicContact CG2-CG 4.49Å
568	K	81	Confident	71.7	Confident	162 Å²	162	67.6 Å²	67.6	70%	0.704	39%	0.386	S	S	*	.	S	Bend	trans	-69.7	-29.5	-172.1	-67.3	-177	179.2	-180	0	113.2
569	S	84.1	Confident	73.3	Confident	49 Å²	49	65 Å²	65	34%	0.343	36%	0.36	S	S	.	.			trans	-143.5	130	176.3	166.2	0	0	0	0	110.3	D430 I567 G571 E572	D430-S569 CarbonylContact O-C 3.52Å; D430-S569 WeakPolarHBondContact O-CA 3.15Å; I567-S569 VanDerWaalsContact C-N 3.33Å; I567-S569 WeakPolarHBondContact CG2-O 3.24Å; I567-S569 PolarHBondContact O-N 2.91Å; S569-G571 PolarHBondContact O-N 2.7Å; S569-G571 PolarHBondContact OG-N 3.25Å; S569-E572 WeakPolarHBondContact O-CB 3.45Å; S569-E572 WeakPolarHBondContact O-CG 3.44Å; S569-E572 PolarHBondContact O-N 3Å
570	V	82	Confident	73.9	Confident	7 Å²	7	64.7 Å²	64.7	4%	0.042	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-60.9	-26.9	177.2	-170.4	0	0	0	0	112.6	I136 P137 K425 D430 V432 E572 L573	I136-V570 HydrophobicContact CB-CG1 4.4Å; I136-V570 HydrophobicContact CG2-CG1 3.56Å; I136-V570 HydrophobicContact CG2-CG2 4.34Å; P137-V570 HydrophobicContact CB-CG1 3.79Å; P137-V570 HydrophobicContact CG-CG1 3.72Å; K425-V570 HydrophobicContact CD-CG2 4.41Å; D430-V570 WeakPolarHBondContact O-CG2 3.45Å; D430-V570 PolarHBondContact O-N 3.18Å; V432-V570 HydrophobicContact CG2-CG2 4.19Å; V570-E572 PolarHBondContact O-N 2.74Å; V570-E572 VanDerWaalsContact O-N 3.16Å; V570-L573 HydrophobicContact CG1-CD1 4.12Å; V570-L573 WeakPolarHBondContact O-CB 3.48Å; V570-L573 PolarHBondContact O-N 3.42Å; V570-L573 VanDerWaalsContact O-N 3.09Å
571	G	80.4	Confident	74.1	Confident	37 Å²	37	64.3 Å²	64.3	38%	0.381	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-59.5	-25.4	174.7	0	0	0	0	0	112.9	S569 L573 S574	S569-G571 PolarHBondContact O-N 2.7Å; S569-G571 PolarHBondContact OG-N 3.25Å; G571-L573 PolarHBondContact O-N 2.75Å; G571-S574 PolarHBondContact O-N 3.44Å; G571-S574 PolarHBondContact O-OG 2.78Å
572	E	82.2	Confident	73.9	Confident	45 Å²	45	62.3 Å²	62.3	21%	0.21	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-63.8	-25	177.4	-59.5	179.4	175.3	0	0	113.3	S569 V570 S574 V575 K578	S569-E572 WeakPolarHBondContact O-CB 3.45Å; S569-E572 WeakPolarHBondContact O-CG 3.44Å; S569-E572 PolarHBondContact O-N 3Å; V570-E572 PolarHBondContact O-N 2.74Å; V570-E572 VanDerWaalsContact O-N 3.16Å; E572-S574 PolarHBondContact O-N 3.36Å; E572-V575 PolarHBondContact O-N 3.3Å; E572-K578 HydrophobicContact CB-CD 3.8Å; E572-K578 VanDerWaalsContact CB-NZ 3.33Å; E572-K578 HydrophobicContact CG-CD 4.45Å; E572-K578 IonicContact OE1-NZ 3.33Å; E572-K578 PolarHBondContact OE1-NZ 3.3Å; E572-K578 IonicContact OE2-NZ 2.72Å; E572-K578 PolarHBondContact OE2-NZ 3.4Å
573	L	83.1	Confident	73	Confident	1 Å²	1	67.6 Å²	67.6	1%	0.005	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-71	-22.7	175.9	-64	176.4	0	0	0	112.5	I136 P137 D401 I402 N405 I406 I567 V570 G571 V575 Y579	I136-L573 HydrophobicContact CG2-CD1 4.43Å; P137-L573 HydrophobicContact CG-CB 4.25Å; P137-L573 HydrophobicContact CG-CD1 4.44Å; D401-L573 CarbonylContact C-O 3.53Å; I402-L573 VanDerWaalsContact CA-O 3.26Å; I402-L573 WeakPolarHBondContact CA-O 2.92Å; I402-L573 HydrophobicContact CG1-CB 4.31Å; I402-L573 WeakPolarHBondContact CG1-O 3.49Å; I402-L573 PolarHBondContact N-O 2.66Å; N405-L573 HydrophobicContact CB-CD2 4.15Å; N405-L573 PolarHBondContact ND2-O 3.07Å; I406-L573 HydrophobicContact CD1-CD1 4.09Å; I406-L573 HydrophobicContact CG1-CD1 3.9Å; I406-L573 HydrophobicContact CG1-CD2 3.83Å; I406-L573 HydrophobicContact CG1-CG 4.41Å; I567-L573 HydrophobicContact CD1-CD2 3.91Å; I567-L573 HydrophobicContact CG2-CG 4.49Å; V570-L573 HydrophobicContact CG1-CD1 4.12Å; V570-L573 WeakPolarHBondContact O-CB 3.48Å; V570-L573 PolarHBondContact O-N 3.42Å; V570-L573 VanDerWaalsContact O-N 3.09Å; G571-L573 PolarHBondContact O-N 2.75Å; L573-V575 VanDerWaalsContact C-N 3.35Å; L573-Y579 HydrophobicContact CD2-CE2 4.29Å
574	S	81.8	Confident	71.8	Confident	44 Å²	44	74.8 Å²	74.8	31%	0.308	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-85.4	-7.8	178.9	67.4	0	0	0	0	113.9	G571 E572	G571-S574 PolarHBondContact O-N 3.44Å; G571-S574 PolarHBondContact O-OG 2.78Å; E572-S574 PolarHBondContact O-N 3.36Å
575	V	82.8	Confident	70	Confident	73 Å²	73	75.8 Å²	75.8	44%	0.442	39%	0.394	S	S	.	.	S	Bend	trans	-85.2	122.9	-179.9	-178.1	0	0	0	0	108.7	N405 E572 L573 E577	N405-V575 PolarHBondContact ND2-O 3.21Å; E572-V575 PolarHBondContact O-N 3.3Å; L573-V575 VanDerWaalsContact C-N 3.35Å; V575-E577 PolarHBondContact O-N 3.48Å
576	P	75.9	Confident	68	Low	71 Å²	71	84.8 Å²	84.8	46%	0.461	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	138.9	177.5	-23.4	30.3	0	0	0	111.3	K578	P576-K578 PolarHBondContact O-N 3.44Å
577	E	67.8	Low	66	Low	114 Å²	114	85.6 Å²	85.6	53%	0.533	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	13.2	161.7	-54.3	-173.7	142.2	0	0	116.5	V575 Y579 K580	V575-E577 PolarHBondContact O-N 3.48Å; E577-Y579 VanDerWaalsContact C-N 3.29Å; E577-Y579 PolarHBondContact O-N 3.22Å; E577-K580 HydrophobicContact CB-CD 3.64Å; E577-K580 VanDerWaalsContact CB-CE 3.48Å; E577-K580 HydrophobicContact CB-CG 3.79Å; E577-K580 HydrophobicContact CG-CD 4.17Å; E577-K580 VanDerWaalsContact CG-CE 3.42Å; E577-K580 HydrophobicContact CG-CG 4.47Å; E577-K580 WeakPolarHBondContact O-CB 3.39Å; E577-K580 VanDerWaalsContact O-CG 3.31Å; E577-K580 WeakPolarHBondContact O-CG 3.37Å; E577-K580 PolarHBondContact O-N 3.08Å; E577-K580 WeakPolarHBondContact OE1-CE 3.49Å; E577-K580 IonicContact OE1-NZ 2.92Å; E577-K580 PolarHBondContact OE1-NZ 3.36Å; E577-K580 VanDerWaalsContact OE2-CE 3.28Å; E577-K580 WeakPolarHBondContact OE2-CE 3.16Å; E577-K580 IonicContact OE2-NZ 3.98Å; E577-K580 PolarHBondContact OE2-NZ 3.42Å
578	K	71	Confident	63.9	Low	94 Å²	94	90.6 Å²	90.6	41%	0.409	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-34.7	-175.3	-168.9	178.1	-175.5	-177.6	0	113.6	E572 P576	E572-K578 HydrophobicContact CB-CD 3.8Å; E572-K578 VanDerWaalsContact CB-NZ 3.33Å; E572-K578 HydrophobicContact CG-CD 4.45Å; E572-K578 IonicContact OE1-NZ 3.33Å; E572-K578 PolarHBondContact OE1-NZ 3.3Å; E572-K578 IonicContact OE2-NZ 2.72Å; E572-K578 PolarHBondContact OE2-NZ 3.4Å; P576-K578 PolarHBondContact O-N 3.44Å
579	Y	68.3	Low	62.5	Low	51 Å²	51	85.2 Å²	85.2	20%	0.2	45%	0.452	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	37.2	180	-60.8	-84.2	0	0	0	111.8	N405 F409 L573 E577 S581	N405-Y579 HydrophobicContact CB-CD2 3.84Å; N405-Y579 HydrophobicContact CB-CE2 4.38Å; F409-Y579 HydrophobicContact CD2-CD1 4.37Å; F409-Y579 AromaticContact CD2-CE1 3.97Å; F409-Y579 HydrophobicContact CD2-CE1 3.97Å; L573-Y579 HydrophobicContact CD2-CE2 4.29Å; E577-Y579 VanDerWaalsContact C-N 3.29Å; E577-Y579 PolarHBondContact O-N 3.22Å; Y579-S581 PolarHBondContact O-N 3.16Å
580	K	53.1	Low	61	Low	141 Å²	141	86.2 Å²	86.2	61%	0.613	46%	0.464	S	S	*	.			trans	-67.5	88.3	174.2	-92.1	-172.9	170.3	173	0	111.7	E577	E577-K580 HydrophobicContact CB-CD 3.64Å; E577-K580 VanDerWaalsContact CB-CE 3.48Å; E577-K580 HydrophobicContact CB-CG 3.79Å; E577-K580 HydrophobicContact CG-CD 4.17Å; E577-K580 VanDerWaalsContact CG-CE 3.42Å; E577-K580 HydrophobicContact CG-CG 4.47Å; E577-K580 WeakPolarHBondContact O-CB 3.39Å; E577-K580 VanDerWaalsContact O-CG 3.31Å; E577-K580 WeakPolarHBondContact O-CG 3.37Å; E577-K580 PolarHBondContact O-N 3.08Å; E577-K580 WeakPolarHBondContact OE1-CE 3.49Å; E577-K580 IonicContact OE1-NZ 2.92Å; E577-K580 PolarHBondContact OE1-NZ 3.36Å; E577-K580 VanDerWaalsContact OE2-CE 3.28Å; E577-K580 WeakPolarHBondContact OE2-CE 3.16Å; E577-K580 IonicContact OE2-NZ 3.98Å; E577-K580 PolarHBondContact OE2-NZ 3.42Å
581	S	51.2	Low	60	Low	90 Å²	90	88.4 Å²	88.4	63%	0.629	47%	0.473	S	S	*	.			trans	-161.5	159.8	151.7	-172.9	0	0	0	0	108.4	Y579	Y579-S581 PolarHBondContact O-N 3.16Å
582	I	47.8	Very low	58.9	Low	51 Å²	51	89 Å²	89	26%	0.262	47%	0.471	S	S	.	.			trans	99.3	52.7	175.2	-43.3	161.3	0	0	0	114.9	Q584 I585	I582-Q584 VanDerWaalsContact C-N 3.28Å; I582-I585 HydrophobicContact CB-CD1 4.49Å; I582-I585 HydrophobicContact CB-CG1 4.4Å; I582-I585 HydrophobicContact CD1-CD1 3.72Å; I582-I585 HydrophobicContact CG1-CD1 3.58Å; I582-I585 HydrophobicContact CG1-CG1 3.89Å; I582-I585 HydrophobicContact CG2-CB 3.57Å; I582-I585 HydrophobicContact CG2-CD1 4.04Å; I582-I585 HydrophobicContact CG2-CG1 3.74Å
583	H	41.4	Very low	57.7	Low	202 Å²	202	91.9 Å²	91.9	94%	0.935	49%	0.491	S	S	*	.	S	Bend	trans	-87.5	-2	135.8	-74.2	-51.1	0	0	0	112.2
584	Q	40.3	Very low	56.5	Low	179 Å²	179	93.7 Å²	93.7	84%	0.836	50%	0.503	S	S	*	.	S	Bend	trans	-110.7	-12.5	-172.5	-79	-179.6	-13	0	0	116.6	I582 R586	I582-Q584 VanDerWaalsContact C-N 3.28Å; Q584-R586 PolarHBondContact O-N 3.22Å
585	I	42.4	Very low	55.5	Low	102 Å²	102	99.9 Å²	99.9	52%	0.523	53%	0.527	S	S	.	.			trans	-82.7	69.1	167.5	-45.5	175.7	0	0	0	107.5	I582 P587	I582-I585 HydrophobicContact CB-CD1 4.49Å; I582-I585 HydrophobicContact CB-CG1 4.4Å; I582-I585 HydrophobicContact CD1-CD1 3.72Å; I582-I585 HydrophobicContact CG1-CD1 3.58Å; I582-I585 HydrophobicContact CG1-CG1 3.89Å; I582-I585 HydrophobicContact CG2-CB 3.57Å; I582-I585 HydrophobicContact CG2-CD1 4.04Å; I582-I585 HydrophobicContact CG2-CG1 3.74Å; I585-P587 VanDerWaalsContact O-CD 3.24Å; I585-P587 WeakPolarHBondContact O-CD 3.43Å
586	R	41.2	Very low	55.3	Low	200 Å²	200	99.8 Å²	99.8	76%	0.755	52%	0.524	S	S	*	.			trans	-71.8	110.4	142.6	-103.1	-178.4	178.4	176.6	0.1	103.4	Q584 S588	Q584-R586 PolarHBondContact O-N 3.22Å; R586-S588 PolarHBondContact O-N 3.48Å
587	P	43.2	Very low	55.7	Low	80 Å²	80	99.3 Å²	99.3	52%	0.519	52%	0.52	S	S	.	.			trans	-52.5	122.3	152.8	-11.7	26.3	0	0	0	104.2	I585 C589	I585-P587 VanDerWaalsContact O-CD 3.24Å; I585-P587 WeakPolarHBondContact O-CD 3.43Å; P587-C589 PolarHBondContact O-N 3.03Å; P587-C589 PolarHBondContact O-SG 3.39Å
588	S	41.5	Very low	56.6	Low	110 Å²	110	95.8 Å²	95.8	77%	0.769	50%	0.503	S	S	*	.			trans	-61	87	168.3	-177.2	0	0	0	0	105.9	R586 A590	R586-S588 PolarHBondContact O-N 3.48Å; S588-A590 PolarHBondContact O-N 3.05Å
589	C	52.1	Low	57.3	Low	48 Å²	48	96.8 Å²	96.8	32%	0.324	51%	0.509	S	S	.	.			trans	-79.5	49	168.9	29.5	0	0	0	0	106.8	G479 P587 F591	G479-C589 VanDerWaalsContact CA-O 3.31Å; G479-C589 WeakPolarHBondContact CA-O 3.34Å; P587-C589 PolarHBondContact O-N 3.03Å; P587-C589 PolarHBondContact O-SG 3.39Å; C589-F591 PolarHBondContact O-N 2.62Å; C589-F591 VanDerWaalsContact O-N 3.16Å
590	A	51.6	Low	58.2	Low	71 Å²	71	96.3 Å²	96.3	59%	0.587	51%	0.507	S	S	*	.			trans	-60.9	118.6	174.1	0	0	0	0	0	106.7	S588	S588-A590 PolarHBondContact O-N 3.05Å
591	F	60.6	Low	60	Low	52 Å²	52	89.6 Å²	89.6	23%	0.228	48%	0.478	C	S	.	.			trans	-64.8	130.9	168.1	-171.9	-101.2	0	0	0	106.8	Y478 L511 F512 C589 V593	Y478-F591 HydrophobicContact CD2-CE2 4.47Å; Y478-F591 HydrophobicContact CD2-CZ 4.44Å; L511-F591 HydrophobicContact CB-CE2 3.88Å; L511-F591 HydrophobicContact CB-CZ 4.02Å; L511-F591 HydrophobicContact CD1-CE2 4.19Å; F512-F591 HydrophobicContact CD1-CE1 4.32Å; F512-F591 HydrophobicContact CD1-CZ 4.05Å; F512-F591 AromaticContact CE1-CE1 3.92Å; F512-F591 HydrophobicContact CE1-CE1 3.92Å; F512-F591 AromaticContact CE1-CZ 3.67Å; F512-F591 HydrophobicContact CE1-CZ 3.67Å; F512-F591 HydrophobicContact CE2-CZ 4.37Å; F512-F591 HydrophobicContact CZ-CE1 4.45Å; F512-F591 HydrophobicContact CZ-CE2 4.43Å; F512-F591 AromaticContact CZ-CZ 3.84Å; F512-F591 HydrophobicContact CZ-CZ 3.84Å; C589-F591 PolarHBondContact O-N 2.62Å; C589-F591 VanDerWaalsContact O-N 3.16Å; F591-V593 PolarHBondContact O-N 3.12Å
592	P	58.7	Low	61.8	Low	51 Å²	51	90.6 Å²	90.6	33%	0.331	47%	0.468	S	S	.	.			trans	-58.8	112.9	177.4	-20.4	31.1	0	0	0	108.8	C594	P592-C594 VanDerWaalsContact C-N 3.26Å; P592-C594 PolarHBondContact O-N 2.96Å
593	V	56.4	Low	63.8	Low	105 Å²	105	90.2 Å²	90.2	64%	0.636	47%	0.466	S	S	*	.			trans	-79.3	85.4	169.6	-174	0	0	0	0	105.5	F591 H595	F591-V593 PolarHBondContact O-N 3.12Å; V593-H595 PolarHBondContact O-CD2 2.97Å; V593-H595 PolarHBondContact O-N 3.01Å
594	C	58.1	Low	66.2	Low	38 Å²	38	80.6 Å²	80.6	26%	0.257	42%	0.421	S	S	.	.			trans	-66.7	105.1	165.3	-97.2	0	0	0	0	106.9	P592 R600	P592-C594 VanDerWaalsContact C-N 3.26Å; P592-C594 PolarHBondContact O-N 2.96Å; C594-R600 HydrophobicContact CB-CB 4.09Å
595	H	60	Low	68.8	Low	175 Å²	175	72.3 Å²	72.3	81%	0.81	38%	0.383	S	S	*	.			trans	-68.7	-28.1	172.8	-66.5	-75.4	0	0	0	111.3	V593	V593-H595 PolarHBondContact O-CD2 2.97Å; V593-H595 PolarHBondContact O-N 3.01Å
596	D	79.3	Confident	71.2	Confident	71 Å²	71	69.7 Å²	69.7	38%	0.38	37%	0.373	S	S	.	.	S	Bend	trans	-90.2	132.3	178.1	-174.4	27.6	0	0	0	112.9	E598 E599 R600	D596-E598 VanDerWaalsContact C-N 3.3Å; D596-E598 PolarHBondContact O-N 3.33Å; D596-E598 PolarHBondContact OD1-N 3.49Å; D596-E598 VanDerWaalsContact OD2-CB 3.25Å; D596-E598 WeakPolarHBondContact OD2-CB 3.42Å; D596-E599 HydrophobicContact CB-CB 4.4Å; D596-E599 HydrophobicContact CB-CG 4.17Å; D596-R600 PolarHBondContact O-N 2.9Å
597	T	84.1	Confident	73.7	Confident	61 Å²	61	61.2 Å²	61.2	37%	0.374	34%	0.342	S	S	.	.	H	α-helix	trans	-65.6	-32.7	176.8	59.6	0	0	0	0	112.3	C601	T597-C601 PolarHBondContact O-N 2.95Å; T597-C601 VanDerWaalsContact O-N 3.16Å; T597-C601 PolarHBondContact O-SG 3.37Å; T597-C601 VanDerWaalsContact O-SG 3.4Å
598	E	86.1	Confident	76.1	Confident	39 Å²	39	57.4 Å²	57.4	18%	0.182	32%	0.317	C	S	.	.	H	α-helix	trans	-69.5	-49.3	-179.1	-161.1	-169.3	134.3	0	0	111.4	D596 R600 C601 R602 L699 R711	D596-E598 VanDerWaalsContact C-N 3.3Å; D596-E598 PolarHBondContact O-N 3.33Å; D596-E598 PolarHBondContact OD1-N 3.49Å; D596-E598 VanDerWaalsContact OD2-CB 3.25Å; D596-E598 WeakPolarHBondContact OD2-CB 3.42Å; E598-R600 VanDerWaalsContact C-N 3.31Å; E598-R600 PolarHBondContact O-N 3.3Å; E598-C601 PolarHBondContact O-N 3.31Å; E598-R602 HydrophobicContact CG-CG 4.49Å; E598-R602 WeakPolarHBondContact O-CG 3.15Å; E598-R602 PolarHBondContact O-N 3.02Å; E598-R602 IonicContact OE1-CZ 2.63Å; E598-R602 IonicContact OE1-NE 2.74Å; E598-R602 PolarHBondContact OE1-NE 2.8Å; E598-R602 IonicContact OE1-NH2 3.89Å; E598-R602 PolarHBondContact OE1-NH2 3.41Å; E598-L699 HydrophobicContact CB-CD2 4.28Å; E598-L699 HydrophobicContact CG-CD2 3.6Å; E598-R711 IonicContact OE1-CZ 3.55Å; E598-R711 IonicContact OE1-NH1 3.44Å; E598-R711 IonicContact OE1-NH2 2.77Å; E598-R711 PolarHBondContact OE1-NH2 2.89Å; E598-R711 IonicContact OE2-CZ 2.98Å; E598-R711 VanDerWaalsContact OE2-CZ 3.26Å; E598-R711 IonicContact OE2-NH1 2.74Å; E598-R711 PolarHBondContact OE2-NH1 2.91Å; E598-R711 IonicContact OE2-NH2 3.6Å; E598-R711 PolarHBondContact OE2-NH2 3.26Å
599	E	85.6	Confident	78.6	Confident	116 Å²	116	52.8 Å²	52.8	54%	0.542	28%	0.284	S	S	.	.	H	α-helix	trans	-57.9	-43.5	177.4	-68.3	-175.2	166.1	0	0	112.2	D596 C601 R602 L603	D596-E599 HydrophobicContact CB-CB 4.4Å; D596-E599 HydrophobicContact CB-CG 4.17Å; E599-C601 PolarHBondContact O-N 3.25Å; E599-R602 PolarHBondContact O-N 2.63Å; E599-L603 WeakPolarHBondContact O-CB 3.35Å; E599-L603 PolarHBondContact O-N 3.34Å
600	R	87.2	Confident	80.6	Confident	41 Å²	41	52.7 Å²	52.7	16%	0.155	28%	0.279	C	S	.	.	H	α-helix	trans	-58.5	-48.6	176.1	176.5	173	54.9	88.9	13.9	111.7	F512 Q513 C594 D596 E598 L603 V604	F512-R600 HydrophobicContact CB-CG 4.05Å; F512-R600 HydrophobicContact CD1-CG 3.73Å; F512-R600 HydrophobicContact CG-CG 4.19Å; Q513-R600 PolarHBondContact O-NH1 2.93Å; C594-R600 HydrophobicContact CB-CB 4.09Å; D596-R600 PolarHBondContact O-N 2.9Å; E598-R600 VanDerWaalsContact C-N 3.31Å; E598-R600 PolarHBondContact O-N 3.3Å; R600-L603 PolarHBondContact O-N 2.92Å; R600-V604 WeakPolarHBondContact O-CG2 3.26Å; R600-V604 PolarHBondContact O-N 3.32Å
601	C	90.6	Very high	82.5	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-67.3	-37.5	179.2	-71.7	0	0	0	0	112.5	T597 E598 E599 L603 V604 L605 V698 L699	T597-C601 PolarHBondContact O-N 2.95Å; T597-C601 VanDerWaalsContact O-N 3.16Å; T597-C601 PolarHBondContact O-SG 3.37Å; T597-C601 VanDerWaalsContact O-SG 3.4Å; E598-C601 PolarHBondContact O-N 3.31Å; E599-C601 PolarHBondContact O-N 3.25Å; C601-L603 VanDerWaalsContact C-N 3.35Å; C601-V604 WeakPolarHBondContact O-CB 3.39Å; C601-V604 PolarHBondContact O-N 3.08Å; C601-L605 WeakPolarHBondContact O-CG 3.35Å; C601-L605 PolarHBondContact O-N 3.05Å; C601-V698 VanDerWaalsContact SG-CG1 3.59Å; C601-L699 HydrophobicContact CB-CD1 3.91Å; C601-L699 HydrophobicContact CB-CD2 3.6Å; C601-L699 HydrophobicContact CB-CG 3.47Å; C601-L699 VanDerWaalsContact CB-CG 3.47Å
602	R	90.4	Very high	83.9	Confident	110 Å²	110	46.9 Å²	46.9	42%	0.415	24%	0.24	S	C	.	.	H	α-helix	trans	-61.2	-43.6	174.2	-67.2	-102.8	-157.6	128.8	9.8	111.6	E598 E599 L605 S606	E598-R602 HydrophobicContact CG-CG 4.49Å; E598-R602 WeakPolarHBondContact O-CG 3.15Å; E598-R602 PolarHBondContact O-N 3.02Å; E598-R602 IonicContact OE1-CZ 2.63Å; E598-R602 IonicContact OE1-NE 2.74Å; E598-R602 PolarHBondContact OE1-NE 2.8Å; E598-R602 IonicContact OE1-NH2 3.89Å; E598-R602 PolarHBondContact OE1-NH2 3.41Å; E599-R602 PolarHBondContact O-N 2.63Å; R602-L605 PolarHBondContact O-N 2.64Å; R602-S606 PolarHBondContact O-N 2.97Å
603	L	89.8	Confident	85.5	Confident	43 Å²	43	48.5 Å²	48.5	23%	0.225	24%	0.242	C	C	.	.	H	α-helix	trans	-64.5	-42.2	177.2	-174.5	63.6	0	0	0	111.3	F512 E599 R600 C601 L605 S606 Y607	F512-L603 HydrophobicContact CE1-CD2 4.1Å; F512-L603 HydrophobicContact CE2-CD2 3.78Å; F512-L603 HydrophobicContact CE2-CG 4.35Å; F512-L603 HydrophobicContact CZ-CD2 3.38Å; F512-L603 HydrophobicContact CZ-CG 4.39Å; E599-L603 WeakPolarHBondContact O-CB 3.35Å; E599-L603 PolarHBondContact O-N 3.34Å; R600-L603 PolarHBondContact O-N 2.92Å; C601-L603 VanDerWaalsContact C-N 3.35Å; L603-L605 PolarHBondContact O-N 3.33Å; L603-S606 PolarHBondContact O-N 3.42Å; L603-S606 PolarHBondContact O-OG 2.73Å; L603-Y607 HydrophobicContact CD1-CE2 3.85Å; L603-Y607 HydrophobicContact CD2-CE2 4.18Å; L603-Y607 HydrophobicContact CG-CD2 4.26Å; L603-Y607 HydrophobicContact CG-CE2 3.64Å; L603-Y607 VanDerWaalsContact O-CD2 3.27Å; L603-Y607 WeakPolarHBondContact O-CD2 3.43Å; L603-Y607 PolarHBondContact O-N 3.46Å; L603-Y607 VanDerWaalsContact O-N 3.16Å
604	V	91.9	Very high	87.1	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-57.2	-48.8	172.3	166.4	0	0	0	0	111.3	F512 L514 R600 C601 S606 Y607 V608 K691 A695	F512-V604 HydrophobicContact CB-CG2 3.51Å; F512-V604 HydrophobicContact CD2-CG2 4.03Å; F512-V604 HydrophobicContact CG-CG2 3.96Å; L514-V604 HydrophobicContact CD1-CG1 4.48Å; L514-V604 HydrophobicContact CD2-CG2 4.39Å; R600-V604 WeakPolarHBondContact O-CG2 3.26Å; R600-V604 PolarHBondContact O-N 3.32Å; C601-V604 WeakPolarHBondContact O-CB 3.39Å; C601-V604 PolarHBondContact O-N 3.08Å; V604-S606 VanDerWaalsContact C-N 3.29Å; V604-S606 PolarHBondContact O-N 2.92Å; V604-Y607 PolarHBondContact O-N 2.73Å; V604-V608 HydrophobicContact CG1-CG2 4.4Å; V604-V608 WeakPolarHBondContact O-CG2 3.45Å; V604-V608 PolarHBondContact O-N 3.15Å; V604-K691 HydrophobicContact CG1-CG 4.17Å; V604-A695 HydrophobicContact CG1-CB 3.9Å
605	L	93.2	Very high	88.5	Confident	6 Å²	6	42 Å²	42	3%	0.031	20%	0.201	C	C	.	.	H	α-helix	trans	-61.8	-35.9	178.2	-71.7	169.6	0	0	0	112.2	C601 R602 L603 V608 L609 A695 Y696 L699 I779	C601-L605 WeakPolarHBondContact O-CG 3.35Å; C601-L605 PolarHBondContact O-N 3.05Å; R602-L605 PolarHBondContact O-N 2.64Å; L603-L605 PolarHBondContact O-N 3.33Å; L605-V608 PolarHBondContact O-N 2.93Å; L605-L609 VanDerWaalsContact O-CB 3.32Å; L605-L609 WeakPolarHBondContact O-CB 3.48Å; L605-L609 PolarHBondContact O-N 3.41Å; L605-A695 HydrophobicContact CD2-CB 3.97Å; L605-A695 HydrophobicContact CG-CB 4.05Å; L605-Y696 HydrophobicContact CD1-CD1 3.9Å; L605-Y696 HydrophobicContact CD1-CE1 3.47Å; L605-Y696 VanDerWaalsContact CD1-CE1 3.47Å; L605-Y696 HydrophobicContact CD2-CD1 4.46Å; L605-Y696 HydrophobicContact CD2-CD2 4.07Å; L605-Y696 HydrophobicContact CD2-CE1 4.11Å; L605-Y696 HydrophobicContact CD2-CE2 3.68Å; L605-Y696 HydrophobicContact CD2-CG 4.43Å; L605-Y696 HydrophobicContact CG-CE1 4.46Å; L605-L699 HydrophobicContact CD1-CD1 3.68Å; L605-I779 HydrophobicContact CB-CD1 4.21Å; L605-I779 HydrophobicContact CD2-CD1 3.96Å
606	S	93.6	Very high	89.8	Confident	46 Å²	46	34.8 Å²	34.8	32%	0.322	17%	0.168	S	C	.	.	H	α-helix	trans	-63.7	-42	176.2	78.5	0	0	0	0	112.8	R602 L603 V604 L609 E610	R602-S606 PolarHBondContact O-N 2.97Å; L603-S606 PolarHBondContact O-N 3.42Å; L603-S606 PolarHBondContact O-OG 2.73Å; V604-S606 VanDerWaalsContact C-N 3.29Å; V604-S606 PolarHBondContact O-N 2.92Å; S606-L609 PolarHBondContact O-N 3.22Å; S606-E610 PolarHBondContact O-N 2.93Å; S606-E610 VanDerWaalsContact O-N 3.15Å
607	Y	93.7	Very high	90	Very high	23 Å²	23	35.1 Å²	35.1	9%	0.09	18%	0.176	C	C	.	.	H	α-helix	trans	-67.7	-41.7	174.1	-67	-51.9	0	0	0	111.2	R482 L486 N505 L508 F512 L603 V604 L609 E610 G611	R482-Y607 PolarHBondContact NH2-OH 3.41Å; L486-Y607 HydrophobicContact CD2-CE1 4.49Å; N505-Y607 WeakPolarHBondContact CB-O 3.32Å; L508-Y607 HydrophobicContact CB-CD1 4.07Å; L508-Y607 HydrophobicContact CB-CD2 3.96Å; L508-Y607 HydrophobicContact CB-CE1 4.23Å; L508-Y607 HydrophobicContact CB-CE2 4.09Å; L508-Y607 HydrophobicContact CB-CG 3.96Å; L508-Y607 HydrophobicContact CD1-CD1 3.97Å; L508-Y607 HydrophobicContact CD1-CE1 3.77Å; L508-Y607 HydrophobicContact CG-CE1 4.5Å; F512-Y607 HydrophobicContact CE2-CE2 4.04Å; L603-Y607 HydrophobicContact CD1-CE2 3.85Å; L603-Y607 HydrophobicContact CD2-CE2 4.18Å; L603-Y607 HydrophobicContact CG-CD2 4.26Å; L603-Y607 HydrophobicContact CG-CE2 3.64Å; L603-Y607 VanDerWaalsContact O-CD2 3.27Å; L603-Y607 WeakPolarHBondContact O-CD2 3.43Å; L603-Y607 PolarHBondContact O-N 3.46Å; L603-Y607 VanDerWaalsContact O-N 3.16Å; V604-Y607 PolarHBondContact O-N 2.73Å; Y607-L609 VanDerWaalsContact C-N 3.32Å; Y607-L609 PolarHBondContact O-N 3.34Å; Y607-E610 PolarHBondContact O-N 3.48Å; Y607-G611 PolarHBondContact O-N 2.85Å
608	V	94.2	Very high	89.9	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-60	-43.9	176.8	171.7	0	0	0	0	111.2	V604 L605 G611 L612 L688 K691	V604-V608 HydrophobicContact CG1-CG2 4.4Å; V604-V608 WeakPolarHBondContact O-CG2 3.45Å; V604-V608 PolarHBondContact O-N 3.15Å; L605-V608 PolarHBondContact O-N 2.93Å; V608-G611 PolarHBondContact O-N 3.1Å; V608-L612 HydrophobicContact CG1-CD1 3.99Å; V608-L612 HydrophobicContact CG1-CG 4.26Å; V608-L612 WeakPolarHBondContact O-CG 3.49Å; V608-L612 PolarHBondContact O-N 3.24Å; V608-L688 HydrophobicContact CB-CD2 4.42Å; V608-L688 HydrophobicContact CG1-CB 4.15Å; V608-L688 HydrophobicContact CG1-CD2 4.23Å; V608-L688 WeakPolarHBondContact CG1-O 3.49Å; V608-L688 HydrophobicContact CG2-CD2 4.33Å; V608-K691 HydrophobicContact CG2-CB 4.13Å; V608-K691 HydrophobicContact CG2-CG 3.95Å
609	L	94.4	Very high	89.5	Confident	13 Å²	13	32.9 Å²	32.9	7%	0.068	17%	0.166	C	C	.	.	H	α-helix	trans	-59.4	-47.4	177	173.7	57.9	0	0	0	112.4	L605 S606 Y607 G611 L612 K613 E775 E778 I779	L605-L609 VanDerWaalsContact O-CB 3.32Å; L605-L609 WeakPolarHBondContact O-CB 3.48Å; L605-L609 PolarHBondContact O-N 3.41Å; S606-L609 PolarHBondContact O-N 3.22Å; Y607-L609 VanDerWaalsContact C-N 3.32Å; Y607-L609 PolarHBondContact O-N 3.34Å; L609-G611 VanDerWaalsContact C-N 3.27Å; L609-G611 PolarHBondContact O-N 3.32Å; L609-L612 PolarHBondContact O-N 3.23Å; L609-K613 HydrophobicContact CD1-CD 4.46Å; L609-K613 HydrophobicContact CD1-CG 4.35Å; L609-K613 WeakPolarHBondContact O-CG 3.44Å; L609-K613 PolarHBondContact O-N 3.3Å; L609-E775 HydrophobicContact CD2-CB 4.07Å; L609-E775 HydrophobicContact CD2-CG 4.1Å; L609-E778 HydrophobicContact CD1-CB 3.59Å; L609-E778 HydrophobicContact CD2-CB 4.35Å; L609-E778 WeakPolarHBondContact CD2-OE2 3.38Å; L609-I779 HydrophobicContact CB-CD1 4.26Å; L609-I779 HydrophobicContact CB-CG1 4.01Å; L609-I779 HydrophobicContact CD1-CG1 3.94Å; L609-I779 HydrophobicContact CG-CG1 4.44Å
610	E	92.3	Very high	88.4	Confident	46 Å²	46	35.2 Å²	35.2	22%	0.215	17%	0.174	C	C	.	.	H	α-helix	trans	-64.3	-35.6	177.4	-169.3	65.3	-169.5	0	0	111.7	K494 S606 Y607 S614	K494-E610 VanDerWaalsContact CE-OE1 3.31Å; K494-E610 WeakPolarHBondContact CE-OE1 3.25Å; K494-E610 IonicContact NZ-OE1 3.91Å; K494-E610 PolarHBondContact NZ-OE1 2.8Å; K494-E610 IonicContact NZ-OE2 2.71Å; S606-E610 PolarHBondContact O-N 2.93Å; S606-E610 VanDerWaalsContact O-N 3.15Å; Y607-E610 PolarHBondContact O-N 3.48Å; E610-S614 WeakPolarHBondContact O-CB 3.46Å; E610-S614 PolarHBondContact O-N 3.43Å; E610-S614 VanDerWaalsContact O-N 3.1Å; E610-S614 PolarHBondContact O-OG 3.14Å
611	G	91.6	Very high	86.9	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.7	-46.6	171.9	0	0	0	0	0	112.8	Y607 V608 L609 S614 V615	Y607-G611 PolarHBondContact O-N 2.85Å; V608-G611 PolarHBondContact O-N 3.1Å; L609-G611 VanDerWaalsContact C-N 3.27Å; L609-G611 PolarHBondContact O-N 3.32Å; G611-S614 WeakPolarHBondContact O-CB 3.47Å; G611-S614 PolarHBondContact O-N 3.28Å; G611-V615 WeakPolarHBondContact O-CG2 3.36Å; G611-V615 PolarHBondContact O-N 3.32Å
612	L	91.5	Very high	84.7	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-63.4	-45	178.4	-73.1	173.8	0	0	0	111.5	V608 L609 S614 V615 D616 K685 L688 I689 I779	V608-L612 HydrophobicContact CG1-CD1 3.99Å; V608-L612 HydrophobicContact CG1-CG 4.26Å; V608-L612 WeakPolarHBondContact O-CG 3.49Å; V608-L612 PolarHBondContact O-N 3.24Å; L609-L612 PolarHBondContact O-N 3.23Å; L612-S614 VanDerWaalsContact C-N 3.27Å; L612-S614 PolarHBondContact O-N 3.06Å; L612-V615 PolarHBondContact O-N 2.62Å; L612-D616 VanDerWaalsContact O-CB 3.32Å; L612-D616 WeakPolarHBondContact O-CB 3.46Å; L612-D616 PolarHBondContact O-N 3.35Å; L612-K685 HydrophobicContact CD2-CG 4.07Å; L612-L688 HydrophobicContact CD2-CB 3.84Å; L612-L688 HydrophobicContact CD2-CD1 4.16Å; L612-L688 HydrophobicContact CG-CB 4.19Å; L612-L688 HydrophobicContact CG-CD1 4.36Å; L612-I689 HydrophobicContact CD2-CG1 4.24Å; L612-I779 HydrophobicContact CD1-CG2 4.34Å
613	K	91.1	Very high	82.5	Confident	85 Å²	85	47.1 Å²	47.1	37%	0.37	25%	0.245	S	C	.	.	H	α-helix	trans	-55.4	-43	173.6	-75.7	177.7	178.5	173.3	0	112.1	L609 D616 S617 E778	L609-K613 HydrophobicContact CD1-CD 4.46Å; L609-K613 HydrophobicContact CD1-CG 4.35Å; L609-K613 WeakPolarHBondContact O-CG 3.44Å; L609-K613 PolarHBondContact O-N 3.3Å; K613-D616 PolarHBondContact O-N 2.82Å; K613-S617 VanDerWaalsContact O-CB 3.26Å; K613-S617 WeakPolarHBondContact O-CB 3.45Å; K613-S617 PolarHBondContact O-N 2.84Å; K613-S617 PolarHBondContact O-OG 3.07Å; K613-E778 WeakPolarHBondContact CE-OE2 3.49Å; K613-E778 IonicContact NZ-OE1 2.68Å; K613-E778 IonicContact NZ-OE2 3.85Å; K613-E778 PolarHBondContact NZ-OE2 3.45Å
614	S	89.5	Confident	80.3	Confident	5 Å²	5	50.6 Å²	50.6	4%	0.035	26%	0.263	C	S	.	.	H	α-helix	trans	-64.3	-45.1	179.2	-58.8	0	0	0	0	111.4	P498 I501 E610 G611 L612 S617 S618	P498-S614 VanDerWaalsContact CB-O 3.25Å; P498-S614 WeakPolarHBondContact CB-O 2.89Å; I501-S614 WeakPolarHBondContact CG2-OG 3.16Å; E610-S614 WeakPolarHBondContact O-CB 3.46Å; E610-S614 PolarHBondContact O-N 3.43Å; E610-S614 VanDerWaalsContact O-N 3.1Å; E610-S614 PolarHBondContact O-OG 3.14Å; G611-S614 WeakPolarHBondContact O-CB 3.47Å; G611-S614 PolarHBondContact O-N 3.28Å; L612-S614 VanDerWaalsContact C-N 3.27Å; L612-S614 PolarHBondContact O-N 3.06Å; S614-S617 PolarHBondContact O-OG 3.22Å; S614-S618 PolarHBondContact O-N 2.67Å
615	V	87.8	Confident	78.2	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-62.7	-49.3	174.8	179.2	0	0	0	0	110.9	A502 G611 L612 S617 S618 M619 W680 Q681 M684 K685 L688	A502-V615 HydrophobicContact CB-CG2 3.74Å; G611-V615 WeakPolarHBondContact O-CG2 3.36Å; G611-V615 PolarHBondContact O-N 3.32Å; L612-V615 PolarHBondContact O-N 2.62Å; V615-S617 VanDerWaalsContact C-N 3.3Å; V615-S617 PolarHBondContact O-N 2.9Å; V615-S618 WeakPolarHBondContact O-CB 3.37Å; V615-S618 PolarHBondContact O-N 3.22Å; V615-S618 PolarHBondContact O-OG 3.42Å; V615-M619 HydrophobicContact CG1-SD 4.11Å; V615-M619 WeakPolarHBondContact O-CG 3.26Å; V615-W680 HydrophobicContact CG2-CZ3 4.24Å; V615-Q681 HydrophobicContact CG1-CB 3.93Å; V615-Q681 HydrophobicContact CG1-CG 4.4Å; V615-M684 HydrophobicContact CG2-CB 4.2Å; V615-M684 HydrophobicContact CG2-CG 3.91Å; V615-K685 HydrophobicContact CG1-CB 4.23Å; V615-K685 HydrophobicContact CG1-CD 4.31Å; V615-L688 HydrophobicContact CG2-CD1 4.23Å
616	D	87.3	Confident	75.9	Confident	24 Å²	24	61.4 Å²	61.4	13%	0.128	33%	0.327	C	S	.	.	H	α-helix	trans	-62.6	-34.1	-177.3	-77.8	-19.7	0	0	0	113.3	L612 K613 S618 K685 S782 R785	L612-D616 VanDerWaalsContact O-CB 3.32Å; L612-D616 WeakPolarHBondContact O-CB 3.46Å; L612-D616 PolarHBondContact O-N 3.35Å; K613-D616 PolarHBondContact O-N 2.82Å; D616-S618 VanDerWaalsContact C-N 3.34Å; D616-K685 IonicContact OD1-NZ 2.87Å; D616-K685 PolarHBondContact OD1-NZ 3.42Å; D616-S782 WeakPolarHBondContact OD2-CB 3.5Å; D616-S782 PolarHBondContact OD2-OG 2.99Å; D616-R785 PolarHBondContact O-NH1 3.01Å; D616-R785 IonicContact OD1-NH1 3.05Å
617	S	85	Confident	73.8	Confident	78 Å²	78	63.9 Å²	63.9	55%	0.545	35%	0.35	S	S	.	.	H	α-helix	trans	-72	-26.6	175.6	71.9	0	0	0	0	113.3	K613 S614 V615 M619	K613-S617 VanDerWaalsContact O-CB 3.26Å; K613-S617 WeakPolarHBondContact O-CB 3.45Å; K613-S617 PolarHBondContact O-N 2.84Å; K613-S617 PolarHBondContact O-OG 3.07Å; S614-S617 PolarHBondContact O-OG 3.22Å; V615-S617 VanDerWaalsContact C-N 3.3Å; V615-S617 PolarHBondContact O-N 2.9Å; S617-M619 VanDerWaalsContact C-N 3.25Å; S617-M619 PolarHBondContact O-N 2.72Å
618	S	82.1	Confident	71.6	Confident	33 Å²	33	66.6 Å²	66.6	23%	0.231	38%	0.377	C	S	.	.	H	α-helix	trans	-78	-12.6	178	79.1	0	0	0	0	113.4	S614 V615 D616 W680	S614-S618 PolarHBondContact O-N 2.67Å; V615-S618 WeakPolarHBondContact O-CB 3.37Å; V615-S618 PolarHBondContact O-N 3.22Å; V615-S618 PolarHBondContact O-OG 3.42Å; D616-S618 VanDerWaalsContact C-N 3.34Å; S618-W680 WeakPolarHBondContact OG-CH2 3.45Å
619	M	77.4	Confident	69.4	Low	21 Å²	21	70.6 Å²	70.6	10%	0.103	40%	0.399	C	S	.	.	S	Bend	trans	-89.4	122.3	-177.4	-65.3	166.2	54.5	0	0	109.3	V615 S617 K621 S673 M675	V615-M619 HydrophobicContact CG1-SD 4.11Å; V615-M619 WeakPolarHBondContact O-CG 3.26Å; S617-M619 VanDerWaalsContact C-N 3.25Å; S617-M619 PolarHBondContact O-N 2.72Å; M619-K621 PolarHBondContact O-N 2.71Å; M619-S673 WeakPolarHBondContact CE-OG 3.43Å; M619-M675 HydrophobicContact CE-CG 3.19Å; M619-M675 HydrophobicContact CE-SD 3.48Å; M619-M675 WeakPolarHBondContact CE-SD 3.42Å; M619-M675 HydrophobicContact SD-CE 4.28Å; M619-M675 HydrophobicContact SD-CG 3.86Å; M619-M675 HydrophobicContact SD-SD 3.67Å; M619-M675 VanDerWaalsContact SD-SD 3.67Å
620	K	61.1	Low	67.6	Low	165 Å²	165	76.4 Å²	76.4	72%	0.717	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-59.2	135.7	178.1	-65.5	-175.9	178.5	-176.4	0	109.7
621	K	55.7	Low	66	Low	147 Å²	147	78.7 Å²	78.7	64%	0.639	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-64.4	139.9	172.4	-70.5	179.1	178.3	177.6	0	108.4	M619 S623 D624	M619-K621 PolarHBondContact O-N 2.71Å; K621-S623 PolarHBondContact O-N 3.24Å; K621-D624 PolarHBondContact O-N 2.89Å
622	E	44.9	Very low	64.1	Low	158 Å²	158	82.9 Å²	82.9	74%	0.738	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-51.9	-22.2	177.5	-91.3	178.3	139.2	0	0	113.6	D624	E622-D624 VanDerWaalsContact C-N 3.27Å; E622-D624 PolarHBondContact O-N 3.37Å
623	S	44.8	Very low	62	Low	96 Å²	96	88.4 Å²	88.4	67%	0.671	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-67.5	-17.9	176.1	59	0	0	0	0	115.4	K621	K621-S623 PolarHBondContact O-N 3.24Å
624	D	44	Very low	60	Low	116 Å²	116	90.9 Å²	90.9	62%	0.62	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-107.9	5.8	-173	-62.1	-15.1	0	0	0	113.1	K621 E622	K621-D624 PolarHBondContact O-N 2.89Å; E622-D624 VanDerWaalsContact C-N 3.27Å; E622-D624 PolarHBondContact O-N 3.37Å
625	L	47.9	Very low	57.5	Low	111 Å²	111	96.2 Å²	96.2	58%	0.581	57%	0.57	S	S	*	*	S	Bend	trans	-78.8	129.1	170.9	-66.6	173.7	0	0	0	108.5	A627	L625-A627 PolarHBondContact O-N 2.99Å; L625-A627 VanDerWaalsContact O-N 3.14Å
626	P	43.8	Very low	55.2	Low	121 Å²	121	102.4 Å²	102.4	79%	0.786	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-56.5	124.7	173.2	-15.9	27	0	0	0	108.3	A628	P626-A628 PolarHBondContact O-N 2.98Å; P626-A628 VanDerWaalsContact O-N 3.12Å
627	A	49.3	Very low	52.7	Low	98 Å²	98	110.1 Å²	110.1	81%	0.81	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-53.1	122.9	168.8	0	0	0	0	0	107.8	L625 D629	L625-A627 PolarHBondContact O-N 2.99Å; L625-A627 VanDerWaalsContact O-N 3.14Å; A627-D629 PolarHBondContact O-N 3.41Å
628	A	48.4	Very low	50.5	Low	80 Å²	80	115.6 Å²	115.6	66%	0.661	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-58	130	177.6	0	0	0	0	0	108.9	P626 P630	P626-A628 PolarHBondContact O-N 2.98Å; P626-A628 VanDerWaalsContact O-N 3.12Å; A628-P630 WeakPolarHBondContact O-CD 3.35Å
629	D	48.2	Very low	48.3	Very low	85 Å²	85	121.8 Å²	121.8	46%	0.455	67%	0.671	S	S	.	*	P	Polyproline II helix	trans	-61.7	124.4	178.5	168	38.7	0	0	0	109.6	A627 S631 T632	A627-D629 PolarHBondContact O-N 3.41Å; D629-S631 PolarHBondContact O-N 3.45Å; D629-S631 PolarHBondContact OD1-N 3.01Å; D629-S631 PolarHBondContact OD1-OG 3.4Å; D629-S631 PolarHBondContact OD2-OG 3Å; D629-T632 WeakPolarHBondContact CB-OG1 3.46Å; D629-T632 PolarHBondContact O-N 3.21Å; D629-T632 PolarHBondContact O-OG1 3.3Å; D629-T632 PolarHBondContact OD2-OG1 3.17Å
630	P	56.8	Low	46.1	Very low	135 Å²	135	127.2 Å²	127.2	88%	0.877	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.6	-17.6	-178.7	-25.2	33.3	0	0	0	114.7	A628	A628-P630 WeakPolarHBondContact O-CD 3.35Å
631	S	57.5	Low	44.9	Very low	93 Å²	93	128.5 Å²	128.5	65%	0.65	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-8.2	178.6	16.6	0	0	0	0	115.3	D629 P633	D629-S631 PolarHBondContact O-N 3.45Å; D629-S631 PolarHBondContact OD1-N 3.01Å; D629-S631 PolarHBondContact OD1-OG 3.4Å; D629-S631 PolarHBondContact OD2-OG 3Å; S631-P633 WeakPolarHBondContact O-CD 3.47Å
632	T	51.8	Low	44	Very low	89 Å²	89	126.2 Å²	126.2	55%	0.546	71%	0.711	S	S	.	*	S	Bend	trans	-95.3	114.6	177.5	3.5	0	0	0	0	110.5	D629 I634	D629-T632 WeakPolarHBondContact CB-OG1 3.46Å; D629-T632 PolarHBondContact O-N 3.21Å; D629-T632 PolarHBondContact O-OG1 3.3Å; D629-T632 PolarHBondContact OD2-OG1 3.17Å; T632-I634 PolarHBondContact O-N 3.28Å
633	P	48.2	Very low	43.5	Very low	117 Å²	117	124.7 Å²	124.7	76%	0.76	71%	0.713	S	S	*	*			trans	-63.5	121.3	176.5	23.8	-30.7	0	0	0	109.7	S631 P635	S631-P633 WeakPolarHBondContact O-CD 3.47Å; P633-P635 VanDerWaalsContact O-CD 3.28Å; P633-P635 WeakPolarHBondContact O-CD 3.44Å
634	I	47.9	Very low	43	Very low	136 Å²	136	127.2 Å²	127.2	70%	0.697	71%	0.708	S	S	*	*			trans	-66.2	119.2	173.9	-61.3	166.6	0	0	0	107.5	T632 L636	T632-I634 PolarHBondContact O-N 3.28Å; I634-L636 PolarHBondContact O-N 3.28Å
635	P	38.5	Very low	42.6	Very low	117 Å²	117	125.9 Å²	125.9	76%	0.76	72%	0.722	S	S	*	*			trans	-67.1	102.4	176.3	-16.4	30.4	0	0	0	109.5	P633 K637	P633-P635 VanDerWaalsContact O-CD 3.28Å; P633-P635 WeakPolarHBondContact O-CD 3.44Å; P635-K637 PolarHBondContact O-N 3.12Å; P635-K637 VanDerWaalsContact O-N 3.08Å
636	L	38.7	Very low	42.6	Very low	130 Å²	130	123.2 Å²	123.2	68%	0.681	72%	0.721	S	S	*	*			trans	-69.8	98.4	166.1	-83.4	151.7	0	0	0	107.8	I634 Y638	I634-L636 PolarHBondContact O-N 3.28Å; L636-Y638 HydrophobicContact CB-CD2 4.26Å; L636-Y638 HydrophobicContact CB-CE2 3.84Å; L636-Y638 PolarHBondContact O-N 3.25Å; L636-Y638 VanDerWaalsContact O-N 3.1Å
637	K	34.7	Very low	42.6	Very low	187 Å²	187	121.3 Å²	121.3	81%	0.813	71%	0.709	S	S	*	*			trans	-70.4	99.3	161.5	-73.9	-171.7	177.5	-175	0	107.3	P635 E639	P635-K637 PolarHBondContact O-N 3.12Å; P635-K637 VanDerWaalsContact O-N 3.08Å; K637-E639 PolarHBondContact O-N 3.02Å
638	Y	39.3	Very low	42.6	Very low	192 Å²	192	119.5 Å²	119.5	75%	0.753	68%	0.683	S	S	*	*			trans	-71.5	106.3	157.5	-66	-87	0	0	0	105.9	L636	L636-Y638 HydrophobicContact CB-CD2 4.26Å; L636-Y638 HydrophobicContact CB-CE2 3.84Å; L636-Y638 PolarHBondContact O-N 3.25Å; L636-Y638 VanDerWaalsContact O-N 3.1Å
639	E	35	Very low	43	Very low	163 Å²	163	117.8 Å²	117.8	76%	0.762	67%	0.673	S	S	*	*			trans	-73.9	126	162.1	-70.8	-150.2	164.7	0	0	107.7	K637 E641	K637-E639 PolarHBondContact O-N 3.02Å; E639-E641 PolarHBondContact O-N 3.46Å
640	D	32.2	Very low	43.4	Very low	135 Å²	135	115.3 Å²	115.3	72%	0.722	66%	0.66	S	S	*	*			trans	-62.5	113.8	174.1	-83.8	-41.6	0	0	0	109.6	S642	D640-S642 PolarHBondContact O-N 2.96Å
641	E	36.3	Very low	43.5	Very low	192 Å²	192	111.7 Å²	111.7	90%	0.897	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	10.9	175.3	-71.4	-172.1	148	0	0	114.3	E639	E639-E641 PolarHBondContact O-N 3.46Å
642	S	35.6	Very low	43.8	Very low	99 Å²	99	113.2 Å²	113.2	69%	0.692	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.9	4.3	-168.4	66.2	0	0	0	0	115.8	D640	D640-S642 PolarHBondContact O-N 2.96Å
643	T	34.6	Very low	44.3	Very low	126 Å²	126	113.1 Å²	113.1	77%	0.773	62%	0.62	S	S	*	*			trans	-124.9	17.5	-179.1	49.4	0	0	0	0	116.3	G645	T643-G645 PolarHBondContact O-N 3.25Å
644	R	34.8	Very low	45.1	Very low	149 Å²	149	108.5 Å²	108.5	56%	0.562	59%	0.588	S	S	*	*			trans	-92.1	78.4	169.9	-76.8	-171.1	-178.9	-154.8	2.1	112.4	G646 E648	R644-G646 PolarHBondContact O-N 2.91Å; R644-G646 VanDerWaalsContact O-N 3.15Å; R644-E648 HydrophobicContact CB-CG 4.29Å; R644-E648 VanDerWaalsContact CB-OE1 3.22Å; R644-E648 WeakPolarHBondContact CB-OE1 3.41Å
645	G	35.5	Very low	45.9	Very low	89 Å²	89	103.6 Å²	103.6	92%	0.918	57%	0.568	S	S	*	*			trans	-78.1	83.9	164.6	0	0	0	0	0	111.7	T643	T643-G645 PolarHBondContact O-N 3.25Å
646	G	46.8	Very low	47.3	Very low	55 Å²	55	103.5 Å²	103.5	57%	0.567	56%	0.56	S	S	*	*	S	Bend	trans	95.8	152.1	176.4	0	0	0	0	0	113.9	R644	R644-G646 PolarHBondContact O-N 2.91Å; R644-G646 VanDerWaalsContact O-N 3.15Å
647	P	45.5	Very low	48.8	Very low	81 Å²	81	97.7 Å²	97.7	53%	0.526	53%	0.529	S	S	.	.	S	Bend	cis	-102.5	54.9	-13.3	39.5	-27	0	0	0	111.9	G649 L650	P647-G649 PolarHBondContact O-N 3.04Å; P647-G649 VanDerWaalsContact O-N 3.11Å; P647-L650 PolarHBondContact O-N 3.37Å
648	E	48	Very low	50.3	Low	60 Å²	60	89.6 Å²	89.6	28%	0.28	50%	0.495	S	S	.	.	H	α-helix	trans	-63.3	-17.9	-176.9	-65.6	-168.6	167.7	0	0	115.3	R644 K652	R644-E648 HydrophobicContact CB-CG 4.29Å; R644-E648 VanDerWaalsContact CB-OE1 3.22Å; R644-E648 WeakPolarHBondContact CB-OE1 3.41Å; E648-K652 WeakPolarHBondContact O-CB 3.48Å; E648-K652 WeakPolarHBondContact O-CG 3.38Å; E648-K652 PolarHBondContact O-N 2.95Å; E648-K652 IonicContact OE2-NZ 2.62Å; E648-K652 PolarHBondContact OE2-NZ 2.89Å
649	G	57	Low	51.5	Low	43 Å²	43	85 Å²	85	44%	0.443	48%	0.483	S	S	.	.	H	α-helix	trans	-66.2	-40	-179.7	0	0	0	0	0	113	P647 Q653	P647-G649 PolarHBondContact O-N 3.04Å; P647-G649 VanDerWaalsContact O-N 3.11Å; G649-Q653 VanDerWaalsContact O-CB 3.31Å; G649-Q653 WeakPolarHBondContact O-CB 3.39Å; G649-Q653 WeakPolarHBondContact O-CG 3.32Å; G649-Q653 PolarHBondContact O-N 3.41Å
650	L	57.2	Low	52.8	Low	34 Å²	34	83.6 Å²	83.6	18%	0.178	48%	0.475	C	S	.	.	H	α-helix	trans	-72.4	-41.9	-175.5	-172.6	67.1	0	0	0	111.5	P647 Q653 M654 L738 F822	P647-L650 PolarHBondContact O-N 3.37Å; L650-Q653 PolarHBondContact O-N 3.49Å; L650-M654 WeakPolarHBondContact O-CB 3.24Å; L650-M654 PolarHBondContact O-N 3.08Å; L650-L738 HydrophobicContact CD1-CD1 4.04Å; L650-L738 HydrophobicContact CD2-CD1 3.94Å; L650-L738 HydrophobicContact CG-CD1 4.31Å; L650-F822 HydrophobicContact CD1-CB 4.32Å
651	E	58.9	Low	54	Low	58 Å²	58	78.8 Å²	78.8	27%	0.271	45%	0.448	S	S	.	.	H	α-helix	trans	-63.5	-45.5	175.8	-76.7	166.5	-146.7	0	0	111.7	Q653 M654 A655	E651-Q653 PolarHBondContact O-N 2.96Å; E651-M654 PolarHBondContact O-N 3.34Å; E651-A655 WeakPolarHBondContact O-CB 3.46Å; E651-A655 PolarHBondContact O-N 3.45Å
652	K	64.3	Low	54.6	Low	126 Å²	126	73 Å²	73	55%	0.548	44%	0.44	S	S	.	.	H	α-helix	trans	-63.2	-40.5	175.8	-74.9	169.7	179.4	158.8	0	111.5	E648 L656	E648-K652 WeakPolarHBondContact O-CB 3.48Å; E648-K652 WeakPolarHBondContact O-CG 3.38Å; E648-K652 PolarHBondContact O-N 2.95Å; E648-K652 IonicContact OE2-NZ 2.62Å; E648-K652 PolarHBondContact OE2-NZ 2.89Å; K652-L656 WeakPolarHBondContact O-CB 3.47Å; K652-L656 VanDerWaalsContact O-CG 3.24Å; K652-L656 WeakPolarHBondContact O-CG 3.4Å; K652-L656 PolarHBondContact O-N 2.83Å
653	Q	61.7	Low	55.5	Low	87 Å²	87	69.5 Å²	69.5	41%	0.407	42%	0.416	S	S	.	.	H	α-helix	trans	-69.5	-39.5	176.6	-76.9	175.7	-7.6	0	0	113.1	G649 L650 E651 L656 F657 F822	G649-Q653 VanDerWaalsContact O-CB 3.31Å; G649-Q653 WeakPolarHBondContact O-CB 3.39Å; G649-Q653 WeakPolarHBondContact O-CG 3.32Å; G649-Q653 PolarHBondContact O-N 3.41Å; L650-Q653 PolarHBondContact O-N 3.49Å; E651-Q653 PolarHBondContact O-N 2.96Å; Q653-L656 WeakPolarHBondContact O-CB 3.29Å; Q653-L656 PolarHBondContact O-N 3.25Å; Q653-F657 WeakPolarHBondContact O-CB 3.45Å; Q653-F657 PolarHBondContact O-N 3.18Å; Q653-F822 HydrophobicContact CB-CD1 4.5Å
654	M	65.9	Low	55.7	Low	20 Å²	20	66.9 Å²	66.9	10%	0.099	40%	0.397	C	S	.	.	H	α-helix	trans	-64.5	-42.8	173.2	-96.7	-178.9	70.7	0	0	112.2	L650 E651 L656 F657 L658 M733 L738	L650-M654 WeakPolarHBondContact O-CB 3.24Å; L650-M654 PolarHBondContact O-N 3.08Å; E651-M654 PolarHBondContact O-N 3.34Å; M654-L656 VanDerWaalsContact C-N 3.29Å; M654-L656 PolarHBondContact O-N 3.43Å; M654-F657 WeakPolarHBondContact O-CB 3.38Å; M654-F657 PolarHBondContact O-N 3.03Å; M654-F657 VanDerWaalsContact O-N 3.15Å; M654-L658 WeakPolarHBondContact O-CG 3.5Å; M654-L658 PolarHBondContact O-N 3.32Å; M654-M733 HydrophobicContact CE-CB 4.44Å; M654-M733 HydrophobicContact CE-CE 3.56Å; M654-M733 HydrophobicContact CE-CG 3.65Å; M654-M733 HydrophobicContact CE-SD 4.06Å; M654-M733 HydrophobicContact SD-CB 3.76Å; M654-M733 HydrophobicContact SD-CE 4.17Å; M654-M733 HydrophobicContact SD-CG 3.56Å; M654-M733 VanDerWaalsContact SD-CG 3.56Å; M654-L738 HydrophobicContact CE-CD2 4.29Å; M654-L738 HydrophobicContact CG-CD2 4.26Å; M654-L738 HydrophobicContact SD-CD1 4.4Å; M654-L738 HydrophobicContact SD-CD2 3.67Å; M654-L738 HydrophobicContact SD-CG 4.44Å
655	A	64.3	Low	55.8	Low	33 Å²	33	68.9 Å²	68.9	27%	0.273	41%	0.412	S	S	.	.	H	α-helix	trans	-60.5	-42.2	175	0	0	0	0	0	110.8	E651 D659	E651-A655 WeakPolarHBondContact O-CB 3.46Å; E651-A655 PolarHBondContact O-N 3.45Å; A655-D659 VanDerWaalsContact O-CB 3.25Å; A655-D659 WeakPolarHBondContact O-CB 3.44Å; A655-D659 PolarHBondContact O-N 2.84Å
656	L	67	Low	55.9	Low	114 Å²	114	75 Å²	75	60%	0.597	41%	0.414	S	S	*	.	H	α-helix	trans	-65	-36.7	172.9	-72.8	167.8	0	0	0	112.9	K652 Q653 M654 K660	K652-L656 WeakPolarHBondContact O-CB 3.47Å; K652-L656 VanDerWaalsContact O-CG 3.24Å; K652-L656 WeakPolarHBondContact O-CG 3.4Å; K652-L656 PolarHBondContact O-N 2.83Å; Q653-L656 WeakPolarHBondContact O-CB 3.29Å; Q653-L656 PolarHBondContact O-N 3.25Å; M654-L656 VanDerWaalsContact C-N 3.29Å; M654-L656 PolarHBondContact O-N 3.43Å; L656-K660 VanDerWaalsContact O-CB 3.26Å; L656-K660 WeakPolarHBondContact O-CB 3.34Å; L656-K660 PolarHBondContact O-N 3.21Å
657	F	69.9	Low	55.4	Low	8 Å²	8	74.7 Å²	74.7	4%	0.035	41%	0.41	C	S	.	.	H	α-helix	trans	-66.1	-47.1	175.7	168.7	-95.5	0	0	0	111.6	Q653 M654 D659 K660 M661 A815 E818 I819 F822	Q653-F657 WeakPolarHBondContact O-CB 3.45Å; Q653-F657 PolarHBondContact O-N 3.18Å; M654-F657 WeakPolarHBondContact O-CB 3.38Å; M654-F657 PolarHBondContact O-N 3.03Å; M654-F657 VanDerWaalsContact O-N 3.15Å; F657-D659 VanDerWaalsContact C-N 3.33Å; F657-K660 PolarHBondContact O-N 2.65Å; F657-M661 HydrophobicContact CD2-CE 4.31Å; F657-M661 HydrophobicContact CD2-CG 4.46Å; F657-M661 HydrophobicContact CE1-CG 4.26Å; F657-M661 HydrophobicContact CE2-CE 3.59Å; F657-M661 HydrophobicContact CE2-CG 4.15Å; F657-M661 HydrophobicContact CZ-CE 4.03Å; F657-M661 HydrophobicContact CZ-CG 4.05Å; F657-M661 WeakPolarHBondContact O-CB 3.35Å; F657-M661 VanDerWaalsContact O-CG 3.3Å; F657-M661 WeakPolarHBondContact O-CG 3.38Å; F657-M661 PolarHBondContact O-N 3.06Å; F657-A815 HydrophobicContact CE2-CB 4.18Å; F657-A815 HydrophobicContact CZ-CB 3.96Å; F657-E818 HydrophobicContact CD2-CB 4.34Å; F657-E818 HydrophobicContact CE2-CB 4.12Å; F657-I819 HydrophobicContact CE1-CD1 4.1Å; F657-I819 HydrophobicContact CE1-CG1 4.2Å; F657-I819 HydrophobicContact CE2-CG1 4.17Å; F657-I819 HydrophobicContact CZ-CD1 3.78Å; F657-I819 HydrophobicContact CZ-CG1 3.82Å; F657-F822 HydrophobicContact CB-CE2 3.92Å; F657-F822 HydrophobicContact CB-CZ 4.06Å; F657-F822 AromaticContact CD2-CE2 3.63Å; F657-F822 HydrophobicContact CD2-CE2 3.63Å; F657-F822 AromaticContact CD2-CZ 3.97Å; F657-F822 HydrophobicContact CD2-CZ 3.97Å; F657-F822 HydrophobicContact CE2-CE2 4.34Å; F657-F822 AromaticContact CG-CE2 3.9Å; F657-F822 HydrophobicContact CG-CE2 3.9Å; F657-F822 HydrophobicContact CG-CZ 4.35Å
658	L	66.4	Low	55.1	Low	17 Å²	17	78.2 Å²	78.2	9%	0.089	43%	0.425	C	S	.	.	H	α-helix	trans	-64	-39.8	176	-68.6	172.5	0	0	0	111.1	M654 M661 G662 S663 F792	M654-L658 WeakPolarHBondContact O-CG 3.5Å; M654-L658 PolarHBondContact O-N 3.32Å; L658-M661 CarbonylContact O-C 3.59Å; L658-M661 PolarHBondContact O-N 3.39Å; L658-G662 PolarHBondContact O-N 3.39Å; L658-S663 VanDerWaalsContact O-CB 3.24Å; L658-S663 WeakPolarHBondContact O-CB 3.32Å; L658-S663 PolarHBondContact O-N 3.45Å; L658-F792 HydrophobicContact CD2-CE1 4.36Å; L658-F792 HydrophobicContact CD2-CZ 3.98Å
659	D	64	Low	55	Low	96 Å²	96	82.4 Å²	82.4	51%	0.513	44%	0.439	S	S	.	.	H	α-helix	trans	-60.7	-47.1	173.2	-171.7	50.5	0	0	0	111.6	A655 F657 M661 G662	A655-D659 VanDerWaalsContact O-CB 3.25Å; A655-D659 WeakPolarHBondContact O-CB 3.44Å; A655-D659 PolarHBondContact O-N 2.84Å; F657-D659 VanDerWaalsContact C-N 3.33Å; D659-M661 VanDerWaalsContact C-N 3.28Å; D659-M661 PolarHBondContact O-N 3.23Å; D659-G662 PolarHBondContact O-N 2.94Å
660	K	64.1	Low	54.8	Low	134 Å²	134	84.7 Å²	84.7	58%	0.583	45%	0.448	S	S	*	.	H	α-helix	trans	-61.4	-33.8	175.1	-178	-178.1	169.2	-162.8	0	112.9	L656 F657 G662 E818	L656-K660 VanDerWaalsContact O-CB 3.26Å; L656-K660 WeakPolarHBondContact O-CB 3.34Å; L656-K660 PolarHBondContact O-N 3.21Å; F657-K660 PolarHBondContact O-N 2.65Å; K660-G662 PolarHBondContact O-N 2.85Å; K660-E818 IonicContact NZ-OE1 2.59Å; K660-E818 PolarHBondContact NZ-OE1 3.2Å; K660-E818 IonicContact NZ-OE2 3.43Å; K660-E818 PolarHBondContact NZ-OE2 3.28Å
661	M	55.7	Low	54.9	Low	33 Å²	33	84 Å²	84	16%	0.163	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	4.7	176	-68.6	-64.6	172.6	0	0	113.3	F657 L658 D659 W794 A815	F657-M661 HydrophobicContact CD2-CE 4.31Å; F657-M661 HydrophobicContact CD2-CG 4.46Å; F657-M661 HydrophobicContact CE1-CG 4.26Å; F657-M661 HydrophobicContact CE2-CE 3.59Å; F657-M661 HydrophobicContact CE2-CG 4.15Å; F657-M661 HydrophobicContact CZ-CE 4.03Å; F657-M661 HydrophobicContact CZ-CG 4.05Å; F657-M661 WeakPolarHBondContact O-CB 3.35Å; F657-M661 VanDerWaalsContact O-CG 3.3Å; F657-M661 WeakPolarHBondContact O-CG 3.38Å; F657-M661 PolarHBondContact O-N 3.06Å; L658-M661 CarbonylContact O-C 3.59Å; L658-M661 PolarHBondContact O-N 3.39Å; D659-M661 VanDerWaalsContact C-N 3.28Å; D659-M661 PolarHBondContact O-N 3.23Å; M661-W794 HydrophobicContact CG-CZ2 4.41Å; M661-W794 HydrophobicContact SD-CH2 4.2Å; M661-W794 HydrophobicContact SD-CZ2 3.64Å; M661-A815 HydrophobicContact CE-CB 3.38Å; M661-A815 HydrophobicContact SD-CB 4.3Å
662	G	50.7	Low	55.2	Low	71 Å²	71	87.1 Å²	87.1	73%	0.732	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.4	20.1	174.4	0	0	0	0	0	114.4	L658 D659 K660	L658-G662 PolarHBondContact O-N 3.39Å; D659-G662 PolarHBondContact O-N 2.94Å; K660-G662 PolarHBondContact O-N 2.85Å
663	S	53.8	Low	55.3	Low	26 Å²	26	82.1 Å²	82.1	18%	0.182	44%	0.442	C	S	.	.			trans	-101	1.1	-165.1	173.9	0	0	0	0	116.4	L658 G791	L658-S663 VanDerWaalsContact O-CB 3.24Å; L658-S663 WeakPolarHBondContact O-CB 3.32Å; L658-S663 PolarHBondContact O-N 3.45Å; S663-G791 WeakPolarHBondContact OG-CA 3.29Å
664	L	38.5	Very low	55.4	Low	71 Å²	71	80.9 Å²	80.9	37%	0.372	45%	0.453	S	S	.	.			trans	-139.4	118.1	-173.8	-143.5	74.5	0	0	0	116.6
665	Q	37.8	Very low	55.9	Low	190 Å²	190	80.7 Å²	80.7	89%	0.888	45%	0.452	S	S	*	.			trans	-78.3	126.5	146.6	-80.9	-177.5	-11.3	0	0	108.4	G667	Q665-G667 PolarHBondContact O-N 2.78Å
666	K	36.3	Very low	56.4	Low	219 Å²	219	85.2 Å²	85.2	95%	0.952	47%	0.47	S	S	*	.			trans	-51.7	99.3	175.9	-139.6	177.3	-171.7	179	0	110.7
667	G	36.9	Very low	56.8	Low	47 Å²	47	84.3 Å²	84.3	49%	0.485	47%	0.471	S	S	.	.			trans	-139.1	133.7	174.9	0	0	0	0	0	109.5	Q665 Y669	Q665-G667 PolarHBondContact O-N 2.78Å; G667-Y669 PolarHBondContact O-N 2.65Å
668	N	39.8	Very low	56.9	Low	156 Å²	156	86 Å²	86	83%	0.834	49%	0.49	S	S	*	.			trans	-52.1	130	-179.4	-70.5	-21.5	0	0	0	110.7	S670	N668-S670 PolarHBondContact O-N 3.32Å
669	Y	45.8	Very low	57.7	Low	147 Å²	147	86.4 Å²	86.4	58%	0.576	50%	0.495	S	S	*	.			trans	-67.3	78.1	176.9	-64.5	-85.6	0	0	0	110.9	G667	G667-Y669 PolarHBondContact O-N 2.65Å
670	S	51.2	Low	58.8	Low	91 Å²	91	85 Å²	85	64%	0.636	48%	0.483	S	S	*	.			trans	-125.7	130.3	167.1	59.3	0	0	0	0	108.4	N668 Q672	N668-S670 PolarHBondContact O-N 3.32Å; S670-Q672 PolarHBondContact O-N 3Å
671	S	60.4	Low	59.9	Low	21 Å²	21	80.8 Å²	80.8	15%	0.147	47%	0.465	C	S	.	.			trans	-46.6	127.6	173.3	60.8	0	0	0	0	110.1	S673 G674 M675 E786	S671-S673 PolarHBondContact O-N 2.99Å; S671-S673 VanDerWaalsContact O-N 3.1Å; S671-G674 PolarHBondContact O-N 3.33Å; S671-G674 VanDerWaalsContact O-N 3.11Å; S671-G674 PolarHBondContact OG-N 3.39Å; S671-M675 PolarHBondContact OG-N 3.33Å; S671-M675 PolarHBondContact OG-O 3.45Å; S671-E786 VanDerWaalsContact CB-OE2 3.3Å; S671-E786 WeakPolarHBondContact CB-OE2 3.36Å
672	Q	65.2	Low	61.3	Low	122 Å²	122	80.2 Å²	80.2	57%	0.57	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-23	176.6	-68.6	-177.4	-1	0	0	111.7	S670 G674 R785	S670-Q672 PolarHBondContact O-N 3Å; Q672-G674 VanDerWaalsContact C-N 3.35Å; Q672-G674 PolarHBondContact O-N 3.09Å; Q672-R785 WeakPolarHBondContact CB-O 3.3Å
673	S	65.5	Low	63	Low	21 Å²	21	82.8 Å²	82.8	15%	0.147	45%	0.453	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	10.4	179.9	-159.7	0	0	0	0	115.5	M619 S671 M675 R785 E786	M619-S673 WeakPolarHBondContact CE-OG 3.43Å; S671-S673 PolarHBondContact O-N 2.99Å; S671-S673 VanDerWaalsContact O-N 3.1Å; S673-M675 VanDerWaalsContact C-N 3.34Å; S673-M675 PolarHBondContact O-N 2.62Å; S673-R785 PolarHBondContact OG-NE 3.09Å; S673-R785 PolarHBondContact OG-NH2 3.34Å; S673-E786 WeakPolarHBondContact CB-OE1 3.47Å
674	G	65.1	Low	64.7	Low	62 Å²	62	82.4 Å²	82.4	64%	0.639	45%	0.448	S	S	*	.			trans	69.3	23	173.4	0	0	0	0	0	115.5	S671 Q672	S671-G674 PolarHBondContact O-N 3.33Å; S671-G674 VanDerWaalsContact O-N 3.11Å; S671-G674 PolarHBondContact OG-N 3.39Å; Q672-G674 VanDerWaalsContact C-N 3.35Å; Q672-G674 PolarHBondContact O-N 3.09Å
675	M	75.4	Confident	67.2	Low	16 Å²	16	79 Å²	79	8%	0.079	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-71.4	132.2	179.1	-65	175.2	65.6	0	0	111.3	M619 S671 S673 P677 Q681 H682 K685	M619-M675 HydrophobicContact CE-CG 3.19Å; M619-M675 HydrophobicContact CE-SD 3.48Å; M619-M675 WeakPolarHBondContact CE-SD 3.42Å; M619-M675 HydrophobicContact SD-CE 4.28Å; M619-M675 HydrophobicContact SD-CG 3.86Å; M619-M675 HydrophobicContact SD-SD 3.67Å; M619-M675 VanDerWaalsContact SD-SD 3.67Å; S671-M675 PolarHBondContact OG-N 3.33Å; S671-M675 PolarHBondContact OG-O 3.45Å; S673-M675 VanDerWaalsContact C-N 3.34Å; S673-M675 PolarHBondContact O-N 2.62Å; M675-P677 WeakPolarHBondContact O-CD 3.3Å; M675-Q681 HydrophobicContact CE-CB 3.67Å; M675-Q681 WeakPolarHBondContact CE-O 3.26Å; M675-H682 HydrophobicContact CE-CB 4Å; M675-K685 HydrophobicContact CE-CB 4.09Å; M675-K685 HydrophobicContact CE-CD 4.03Å; M675-K685 HydrophobicContact SD-CD 3.77Å
676	I	74.8	Confident	69.6	Low	127 Å²	127	71 Å²	71	65%	0.651	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-74.3	122.9	176.1	-57	171.7	0	0	0	108.9	G678 S679	I676-G678 PolarHBondContact O-N 3.46Å; I676-S679 WeakPolarHBondContact O-CB 3.5Å; I676-S679 PolarHBondContact O-N 3.03Å; I676-S679 VanDerWaalsContact O-N 3.16Å; I676-S679 PolarHBondContact O-OG 3.25Å
677	P	75.1	Confident	72.2	Confident	95 Å²	95	64.3 Å²	64.3	62%	0.617	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	137.4	174.4	-26.4	35.5	0	0	0	111.6	M675 S679	M675-P677 WeakPolarHBondContact O-CD 3.3Å; P677-S679 VanDerWaalsContact C-N 3.28Å; P677-S679 PolarHBondContact O-N 3.06Å
678	G	71.9	Confident	74.8	Confident	43 Å²	43	62.1 Å²	62.1	44%	0.443	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.6	-8.8	-177.8	0	0	0	0	0	116.2	I676 H682 K683	I676-G678 PolarHBondContact O-N 3.46Å; G678-H682 PolarHBondContact N-CD2 3.41Å; G678-K683 VanDerWaalsContact O-CE 3.27Å; G678-K683 WeakPolarHBondContact O-CE 3.34Å
679	S	84.1	Confident	77.4	Confident	26 Å²	26	54.7 Å²	54.7	18%	0.182	30%	0.303	C	S	.	.	S	Bend	trans	-61.4	161.6	170.8	65.8	0	0	0	0	112.4	I676 P677 Q681 H682 K683	I676-S679 WeakPolarHBondContact O-CB 3.5Å; I676-S679 PolarHBondContact O-N 3.03Å; I676-S679 VanDerWaalsContact O-N 3.16Å; I676-S679 PolarHBondContact O-OG 3.25Å; P677-S679 VanDerWaalsContact C-N 3.28Å; P677-S679 PolarHBondContact O-N 3.06Å; S679-Q681 VanDerWaalsContact C-N 3.27Å; S679-Q681 PolarHBondContact O-N 3.47Å; S679-Q681 PolarHBondContact OG-OE1 3.36Å; S679-H682 PolarHBondContact O-N 3.29Å; S679-H682 WeakPolarHBondContact OG-CB 2.85Å; S679-H682 PolarHBondContact OG-N 3.41Å; S679-K683 WeakPolarHBondContact O-CG 3.45Å; S679-K683 PolarHBondContact O-N 3.07Å
680	W	86.1	Confident	79.5	Confident	68 Å²	68	49.3 Å²	49.3	26%	0.258	28%	0.284	S	S	.	.	H	α-helix	trans	-64.1	-35.8	177.2	75.2	-97.6	0	0	0	111.4	P498 Q499 V615 S618 H682 K683 M684	P498-W680 HydrophobicContact CB-CH2 4.17Å; P498-W680 HydrophobicContact CG-CH2 4.26Å; P498-W680 HydrophobicContact CG-CZ2 4.39Å; Q499-W680 VanDerWaalsContact CA-CZ3 3.44Å; Q499-W680 HydrophobicContact CB-CD2 3.9Å; Q499-W680 HydrophobicContact CB-CE3 3.82Å; Q499-W680 HydrophobicContact CB-CH2 3.82Å; Q499-W680 HydrophobicContact CB-CZ2 3.87Å; Q499-W680 HydrophobicContact CB-CZ3 3.79Å; Q499-W680 HydrophobicContact CG-CD2 3.67Å; Q499-W680 HydrophobicContact CG-CE3 3.61Å; Q499-W680 HydrophobicContact CG-CG 4.13Å; Q499-W680 HydrophobicContact CG-CZ3 4.08Å; V615-W680 HydrophobicContact CG2-CZ3 4.24Å; S618-W680 WeakPolarHBondContact OG-CH2 3.45Å; W680-H682 VanDerWaalsContact C-N 3.32Å; W680-H682 PolarHBondContact O-N 3.08Å; W680-K683 PolarHBondContact O-N 3.48Å; W680-M684 HydrophobicContact CE3-CB 4.47Å; W680-M684 VanDerWaalsContact O-CB 3.24Å; W680-M684 WeakPolarHBondContact O-CB 3.46Å; W680-M684 PolarHBondContact O-N 3.26Å
681	Q	87.5	Confident	81.5	Confident	45 Å²	45	45.7 Å²	45.7	21%	0.21	26%	0.257	C	S	.	.	H	α-helix	trans	-60.5	-46.6	176.4	-62.4	91.3	-25.3	0	0	109.9	V615 M675 S679 M684 K685	V615-Q681 HydrophobicContact CG1-CB 3.93Å; V615-Q681 HydrophobicContact CG1-CG 4.4Å; M675-Q681 HydrophobicContact CE-CB 3.67Å; M675-Q681 WeakPolarHBondContact CE-O 3.26Å; S679-Q681 VanDerWaalsContact C-N 3.27Å; S679-Q681 PolarHBondContact O-N 3.47Å; S679-Q681 PolarHBondContact OG-OE1 3.36Å; Q681-M684 PolarHBondContact O-N 3.47Å; Q681-K685 WeakPolarHBondContact O-CB 3.45Å; Q681-K685 PolarHBondContact O-N 3.23Å
682	H	85.4	Confident	83.1	Confident	20 Å²	20	44.7 Å²	44.7	9%	0.093	25%	0.25	C	C	.	.	H	α-helix	trans	-61.6	-50.4	179	178.8	81.1	0	0	0	112.4	M675 G678 S679 W680 M684 K685 L686 L729	M675-H682 HydrophobicContact CE-CB 4Å; G678-H682 PolarHBondContact N-CD2 3.41Å; S679-H682 PolarHBondContact O-N 3.29Å; S679-H682 WeakPolarHBondContact OG-CB 2.85Å; S679-H682 PolarHBondContact OG-N 3.41Å; W680-H682 VanDerWaalsContact C-N 3.32Å; W680-H682 PolarHBondContact O-N 3.08Å; H682-M684 PolarHBondContact O-N 3.41Å; H682-K685 PolarHBondContact O-N 3.03Å; H682-L686 WeakPolarHBondContact NE2-CD1 3.4Å; H682-L686 WeakPolarHBondContact O-CB 3.44Å; H682-L686 WeakPolarHBondContact O-CG 3.36Å; H682-L686 PolarHBondContact O-N 3.27Å; H682-L729 PolarHBondContact CE1-O 2.95Å
683	K	86.3	Confident	84.5	Confident	125 Å²	125	38.9 Å²	38.9	54%	0.543	22%	0.223	S	C	.	.	H	α-helix	trans	-60.7	-44.2	178.6	-70.1	175.4	179.1	172.4	0	112.2	G678 S679 W680 Q687	G678-K683 VanDerWaalsContact O-CE 3.27Å; G678-K683 WeakPolarHBondContact O-CE 3.34Å; S679-K683 WeakPolarHBondContact O-CG 3.45Å; S679-K683 PolarHBondContact O-N 3.07Å; W680-K683 PolarHBondContact O-N 3.48Å; K683-Q687 WeakPolarHBondContact O-CG 3.4Å; K683-Q687 PolarHBondContact O-N 3.16Å; K683-Q687 VanDerWaalsContact O-N 3.16Å
684	M	89.4	Confident	85.8	Confident	18 Å²	18	39.8 Å²	39.8	9%	0.089	22%	0.224	C	C	.	.	H	α-helix	trans	-69.1	-42.4	-179.1	-171.2	54.9	56.6	0	0	111.8	A502 Y506 V615 W680 Q681 H682 L686 Q687 L688	A502-M684 HydrophobicContact CB-CG 3.65Å; A502-M684 HydrophobicContact CB-SD 4.4Å; Y506-M684 HydrophobicContact CG-SD 4.28Å; V615-M684 HydrophobicContact CG2-CB 4.2Å; V615-M684 HydrophobicContact CG2-CG 3.91Å; W680-M684 HydrophobicContact CE3-CB 4.47Å; W680-M684 VanDerWaalsContact O-CB 3.24Å; W680-M684 WeakPolarHBondContact O-CB 3.46Å; W680-M684 PolarHBondContact O-N 3.26Å; Q681-M684 PolarHBondContact O-N 3.47Å; H682-M684 PolarHBondContact O-N 3.41Å; M684-L686 PolarHBondContact O-N 3.12Å; M684-Q687 PolarHBondContact O-N 2.86Å; M684-L688 HydrophobicContact CG-CD1 3.89Å; M684-L688 HydrophobicContact CG-CG 4.46Å; M684-L688 WeakPolarHBondContact O-CB 3.27Å; M684-L688 VanDerWaalsContact O-CG 3.29Å; M684-L688 WeakPolarHBondContact O-CG 3.19Å; M684-L688 PolarHBondContact O-N 3.44Å; M684-L688 HydrophobicContact SD-CD1 4.32Å; M684-L688 HydrophobicContact SD-CG 4.34Å
685	K	90.3	Very high	87.1	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.5	-43.1	177.6	-162.8	162.1	-174.3	169.5	0	111.5	L612 V615 D616 M675 Q681 H682 Q687 L688 I689 E786	L612-K685 HydrophobicContact CD2-CG 4.07Å; V615-K685 HydrophobicContact CG1-CB 4.23Å; V615-K685 HydrophobicContact CG1-CD 4.31Å; D616-K685 IonicContact OD1-NZ 2.87Å; D616-K685 PolarHBondContact OD1-NZ 3.42Å; M675-K685 HydrophobicContact CE-CB 4.09Å; M675-K685 HydrophobicContact CE-CD 4.03Å; M675-K685 HydrophobicContact SD-CD 3.77Å; Q681-K685 WeakPolarHBondContact O-CB 3.45Å; Q681-K685 PolarHBondContact O-N 3.23Å; H682-K685 PolarHBondContact O-N 3.03Å; K685-Q687 PolarHBondContact O-N 2.76Å; K685-L688 PolarHBondContact O-N 3.05Å; K685-I689 HydrophobicContact CG-CD1 3.79Å; K685-I689 HydrophobicContact CG-CG1 4.36Å; K685-I689 WeakPolarHBondContact O-CB 3.25Å; K685-I689 WeakPolarHBondContact O-CG1 3.34Å; K685-I689 PolarHBondContact O-N 2.99Å; K685-E786 HydrophobicContact CD-CG 4.35Å; K685-E786 IonicContact NZ-OE1 4Å; K685-E786 PolarHBondContact NZ-OE1 3.47Å
686	L	89.3	Confident	88.1	Confident	21 Å²	21	36 Å²	36	11%	0.11	19%	0.19	C	C	.	.	H	α-helix	trans	-57	-48	173.3	-79.1	172	0	0	0	112.5	H682 M684 I689 L690 Y726 L729 C730	H682-L686 WeakPolarHBondContact NE2-CD1 3.4Å; H682-L686 WeakPolarHBondContact O-CB 3.44Å; H682-L686 WeakPolarHBondContact O-CG 3.36Å; H682-L686 PolarHBondContact O-N 3.27Å; M684-L686 PolarHBondContact O-N 3.12Å; L686-I689 PolarHBondContact O-N 2.86Å; L686-L690 WeakPolarHBondContact O-CB 3.44Å; L686-L690 PolarHBondContact O-N 3.37Å; L686-Y726 HydrophobicContact CB-CD2 4.48Å; L686-Y726 HydrophobicContact CB-CE2 4.17Å; L686-Y726 HydrophobicContact CD2-CD2 3.75Å; L686-Y726 HydrophobicContact CD2-CE2 3.84Å; L686-Y726 HydrophobicContact CD2-CG 4.35Å; L686-L729 HydrophobicContact CD2-CB 3.57Å; L686-L729 HydrophobicContact CD2-CD1 4.41Å; L686-L729 HydrophobicContact CG-CB 4.4Å; L686-C730 HydrophobicContact CD2-CB 4.32Å
687	Q	90.3	Very high	89.1	Confident	80 Å²	80	32.7 Å²	32.7	37%	0.374	17%	0.169	S	C	.	.	H	α-helix	trans	-62.4	-43.4	179.3	-76	178.2	-16.4	0	0	112.4	Y506 K683 M684 K685 K691	Y506-Q687 HydrophobicContact CD2-CB 4.07Å; Y506-Q687 HydrophobicContact CE2-CB 3.71Å; Y506-Q687 HydrophobicContact CE2-CG 4.5Å; K683-Q687 WeakPolarHBondContact O-CG 3.4Å; K683-Q687 PolarHBondContact O-N 3.16Å; K683-Q687 VanDerWaalsContact O-N 3.16Å; M684-Q687 PolarHBondContact O-N 2.86Å; K685-Q687 PolarHBondContact O-N 2.76Å; Q687-K691 WeakPolarHBondContact O-CB 3.41Å; Q687-K691 PolarHBondContact O-N 3.48Å
688	L	92.9	Very high	90	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-65.9	-44.8	178.4	-72.7	167.5	0	0	0	112	Y506 V608 L612 V615 M684 K685 K691 S692	Y506-L688 HydrophobicContact CD2-CD2 4.25Å; V608-L688 HydrophobicContact CB-CD2 4.42Å; V608-L688 HydrophobicContact CG1-CB 4.15Å; V608-L688 HydrophobicContact CG1-CD2 4.23Å; V608-L688 WeakPolarHBondContact CG1-O 3.49Å; V608-L688 HydrophobicContact CG2-CD2 4.33Å; L612-L688 HydrophobicContact CD2-CB 3.84Å; L612-L688 HydrophobicContact CD2-CD1 4.16Å; L612-L688 HydrophobicContact CG-CB 4.19Å; L612-L688 HydrophobicContact CG-CD1 4.36Å; V615-L688 HydrophobicContact CG2-CD1 4.23Å; M684-L688 HydrophobicContact CG-CD1 3.89Å; M684-L688 HydrophobicContact CG-CG 4.46Å; M684-L688 WeakPolarHBondContact O-CB 3.27Å; M684-L688 VanDerWaalsContact O-CG 3.29Å; M684-L688 WeakPolarHBondContact O-CG 3.19Å; M684-L688 PolarHBondContact O-N 3.44Å; M684-L688 HydrophobicContact SD-CD1 4.32Å; M684-L688 HydrophobicContact SD-CG 4.34Å; K685-L688 PolarHBondContact O-N 3.05Å; L688-K691 PolarHBondContact O-N 2.92Å; L688-S692 PolarHBondContact O-N 3.43Å
689	I	92.6	Very high	91	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-64.3	-41.9	177.8	-69.2	173.2	0	0	0	111.2	L612 K685 L686 K691 S692 S693 S722 T725 L729 L783	L612-I689 HydrophobicContact CD2-CG1 4.24Å; K685-I689 HydrophobicContact CG-CD1 3.79Å; K685-I689 HydrophobicContact CG-CG1 4.36Å; K685-I689 WeakPolarHBondContact O-CB 3.25Å; K685-I689 WeakPolarHBondContact O-CG1 3.34Å; K685-I689 PolarHBondContact O-N 2.99Å; L686-I689 PolarHBondContact O-N 2.86Å; I689-K691 VanDerWaalsContact C-N 3.29Å; I689-K691 PolarHBondContact O-N 3.36Å; I689-S692 PolarHBondContact O-N 3.48Å; I689-S692 PolarHBondContact O-OG 2.94Å; I689-S693 WeakPolarHBondContact O-CB 3.43Å; I689-S693 PolarHBondContact O-N 3.03Å; I689-S722 WeakPolarHBondContact CG2-O 3.43Å; I689-T725 HydrophobicContact CD1-CG2 3.86Å; I689-L729 HydrophobicContact CD1-CD1 3.86Å; I689-L783 HydrophobicContact CB-CD2 4.42Å; I689-L783 HydrophobicContact CD1-CD2 3.93Å; I689-L783 HydrophobicContact CG1-CD2 3.74Å; I689-L783 HydrophobicContact CG2-CD2 3.92Å
690	L	90.8	Very high	91.5	Very high	34 Å²	34	26.2 Å²	26.2	18%	0.178	12%	0.118	C	C	.	.	H	α-helix	trans	-63.9	-38.7	175.9	-174.7	60.8	0	0	0	111.1	L686 S693 K694 Y726	L686-L690 WeakPolarHBondContact O-CB 3.44Å; L686-L690 PolarHBondContact O-N 3.37Å; L690-S693 WeakPolarHBondContact O-CB 3.49Å; L690-S693 PolarHBondContact O-N 2.98Å; L690-K694 PolarHBondContact O-N 3.49Å; L690-K694 VanDerWaalsContact O-N 3.12Å; L690-Y726 HydrophobicContact CB-CD2 3.85Å; L690-Y726 HydrophobicContact CB-CE2 3.87Å; L690-Y726 HydrophobicContact CD1-CD2 4.42Å; L690-Y726 HydrophobicContact CD1-CE2 4.43Å; L690-Y726 HydrophobicContact CD2-CE2 4.09Å; L690-Y726 HydrophobicContact CG-CE2 4.35Å
691	K	92.1	Very high	91.9	Very high	15 Å²	15	25.2 Å²	25.2	7%	0.065	12%	0.118	C	C	.	.	H	α-helix	trans	-67.3	-42.1	177.1	-168.8	71.7	172.9	-172.5	0	112.4	S509 E510 L514 V604 V608 Q687 L688 I689 S693 K694 A695	S509-K691 WeakPolarHBondContact O-CE 3.27Å; S509-K691 PolarHBondContact O-NZ 3.42Å; E510-K691 WeakPolarHBondContact OE1-CD 3.43Å; E510-K691 WeakPolarHBondContact OE1-CE 3.27Å; E510-K691 IonicContact OE1-NZ 3.59Å; E510-K691 PolarHBondContact OE1-NZ 2.88Å; L514-K691 HydrophobicContact CD1-CD 4.27Å; V604-K691 HydrophobicContact CG1-CG 4.17Å; V608-K691 HydrophobicContact CG2-CB 4.13Å; V608-K691 HydrophobicContact CG2-CG 3.95Å; Q687-K691 WeakPolarHBondContact O-CB 3.41Å; Q687-K691 PolarHBondContact O-N 3.48Å; L688-K691 PolarHBondContact O-N 2.92Å; I689-K691 VanDerWaalsContact C-N 3.29Å; I689-K691 PolarHBondContact O-N 3.36Å; K691-S693 VanDerWaalsContact C-N 3.33Å; K691-K694 PolarHBondContact O-N 3.02Å; K691-A695 PolarHBondContact O-N 3.49Å
692	S	94.6	Very high	92.1	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-62	-42.8	173.9	59.7	0	0	0	0	111.3	L688 I689 K694 A695 Y696 S722	L688-S692 PolarHBondContact O-N 3.43Å; I689-S692 PolarHBondContact O-N 3.48Å; I689-S692 PolarHBondContact O-OG 2.94Å; S692-K694 VanDerWaalsContact C-N 3.35Å; S692-K694 PolarHBondContact O-N 3.25Å; S692-A695 PolarHBondContact O-N 3.28Å; S692-Y696 WeakPolarHBondContact O-CD2 3.16Å; S692-Y696 PolarHBondContact O-N 3.3Å; S692-S722 PolarHBondContact OG-OG 3.47Å
693	S	94.1	Very high	92.5	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-55.1	-49.2	177.2	-174.6	0	0	0	0	111.7	I689 L690 K691 Y696 Y697 A719 Y744	I689-S693 WeakPolarHBondContact O-CB 3.43Å; I689-S693 PolarHBondContact O-N 3.03Å; L690-S693 WeakPolarHBondContact O-CB 3.49Å; L690-S693 PolarHBondContact O-N 2.98Å; K691-S693 VanDerWaalsContact C-N 3.33Å; S693-Y696 PolarHBondContact O-N 3.14Å; S693-Y697 PolarHBondContact O-N 3.4Å; S693-A719 WeakPolarHBondContact O-CB 3.01Å; S693-A719 PolarHBondContact OG-O 3.4Å; S693-Y744 WeakPolarHBondContact OG-CE2 3.46Å; S693-Y744 PolarHBondContact OG-OH 3Å
694	K	92.9	Very high	92.8	Very high	40 Å²	40	18.6 Å²	18.6	17%	0.174	9%	0.093	C	C	.	.	H	α-helix	trans	-63.8	-42.1	176.5	-70.2	-176.3	176.2	-165.7	0	113	L514 L690 K691 S692 Y696 Y697 V698 F740 Y744	L514-K694 HydrophobicContact CD1-CB 3.95Å; L690-K694 PolarHBondContact O-N 3.49Å; L690-K694 VanDerWaalsContact O-N 3.12Å; K691-K694 PolarHBondContact O-N 3.02Å; S692-K694 VanDerWaalsContact C-N 3.35Å; S692-K694 PolarHBondContact O-N 3.25Å; K694-Y696 PolarHBondContact O-N 3.42Å; K694-Y697 WeakPolarHBondContact O-CB 3.2Å; K694-Y697 PolarHBondContact O-N 2.69Å; K694-V698 WeakPolarHBondContact O-CG2 3.22Å; K694-V698 PolarHBondContact O-N 2.92Å; K694-V698 VanDerWaalsContact O-N 3.08Å; K694-F740 VanDerWaalsContact CE-CZ 3.47Å; K694-Y744 PolarHBondContact N-OH 3.28Å
695	A	93.9	Very high	92.9	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-63.1	-41.7	179.2	0	0	0	0	0	112	L514 V604 L605 K691 S692 V698 L699	L514-A695 HydrophobicContact CD1-CB 4.03Å; V604-A695 HydrophobicContact CG1-CB 3.9Å; L605-A695 HydrophobicContact CD2-CB 3.97Å; L605-A695 HydrophobicContact CG-CB 4.05Å; K691-A695 PolarHBondContact O-N 3.49Å; S692-A695 PolarHBondContact O-N 3.28Å; A695-V698 PolarHBondContact O-N 3.38Å; A695-L699 WeakPolarHBondContact O-CG 3.41Å; A695-L699 PolarHBondContact O-N 3.31Å
696	Y	95.8	Very high	93	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-66.9	-35.8	174.7	-76.2	-55.4	0	0	0	113	L605 S692 S693 K694 L699 S700 Y715 L718 D776 I779	L605-Y696 HydrophobicContact CD1-CD1 3.9Å; L605-Y696 HydrophobicContact CD1-CE1 3.47Å; L605-Y696 VanDerWaalsContact CD1-CE1 3.47Å; L605-Y696 HydrophobicContact CD2-CD1 4.46Å; L605-Y696 HydrophobicContact CD2-CD2 4.07Å; L605-Y696 HydrophobicContact CD2-CE1 4.11Å; L605-Y696 HydrophobicContact CD2-CE2 3.68Å; L605-Y696 HydrophobicContact CD2-CG 4.43Å; L605-Y696 HydrophobicContact CG-CE1 4.46Å; S692-Y696 WeakPolarHBondContact O-CD2 3.16Å; S692-Y696 PolarHBondContact O-N 3.3Å; S693-Y696 PolarHBondContact O-N 3.14Å; K694-Y696 PolarHBondContact O-N 3.42Å; Y696-L699 HydrophobicContact CD1-CD1 4.18Å; Y696-L699 PolarHBondContact O-N 3.14Å; Y696-S700 WeakPolarHBondContact O-CB 3.49Å; Y696-S700 PolarHBondContact O-N 3.41Å; Y696-Y715 HydrophobicContact CD1-CD1 4.05Å; Y696-Y715 HydrophobicContact CE1-CD1 4.44Å; Y696-L718 HydrophobicContact CD1-CB 3.97Å; Y696-L718 HydrophobicContact CD1-CD1 4.11Å; Y696-L718 HydrophobicContact CD2-CB 3.78Å; Y696-L718 HydrophobicContact CE1-CB 4.07Å; Y696-L718 HydrophobicContact CE1-CD1 3.61Å; Y696-L718 HydrophobicContact CE1-CG 4.48Å; Y696-L718 HydrophobicContact CE2-CB 3.88Å; Y696-L718 HydrophobicContact CG-CB 3.84Å; Y696-D776 WeakPolarHBondContact CE1-OD1 3.27Å; Y696-D776 PolarHBondContact OH-OD1 2.92Å; Y696-D776 VanDerWaalsContact OH-OD1 3.08Å; Y696-I779 HydrophobicContact CE2-CG2 4.35Å; Y696-I779 WeakPolarHBondContact OH-CD1 2.96Å
697	Y	95.3	Very high	93.1	Very high	56 Å²	56	32.1 Å²	32.1	22%	0.22	17%	0.167	C	C	.	.	H	α-helix	trans	-59.7	-48.4	172.7	171	-101.5	0	0	0	111.8	S693 K694 L699 S700 D701 I716 Q743 Y744 L747	S693-Y697 PolarHBondContact O-N 3.4Å; K694-Y697 WeakPolarHBondContact O-CB 3.2Å; K694-Y697 PolarHBondContact O-N 2.69Å; Y697-L699 VanDerWaalsContact C-N 3.33Å; Y697-L699 PolarHBondContact O-N 3.19Å; Y697-S700 WeakPolarHBondContact O-CB 3.39Å; Y697-S700 PolarHBondContact O-N 3.36Å; Y697-S700 VanDerWaalsContact O-N 3.07Å; Y697-D701 PolarHBondContact O-N 3.45Å; Y697-I716 HydrophobicContact CD2-CD1 4Å; Y697-Q743 HydrophobicContact CE2-CB 4.44Å; Y697-Y744 HydrophobicContact CD1-CE1 4.12Å; Y697-Y744 AromaticContact CD2-CD1 3.24Å; Y697-Y744 HydrophobicContact CD2-CD1 3.24Å; Y697-Y744 AromaticContact CD2-CE1 3.61Å; Y697-Y744 HydrophobicContact CD2-CE1 3.61Å; Y697-Y744 HydrophobicContact CD2-CG 4.28Å; Y697-Y744 AromaticContact CE2-CD1 3.8Å; Y697-Y744 HydrophobicContact CE2-CD1 3.8Å; Y697-Y744 HydrophobicContact CE2-CE1 4.34Å; Y697-Y744 AromaticContact CG-CD1 3.65Å; Y697-Y744 HydrophobicContact CG-CD1 3.65Å; Y697-Y744 AromaticContact CG-CE1 3.47Å; Y697-Y744 HydrophobicContact CG-CE1 3.47Å; Y697-Y744 VanDerWaalsContact CG-CE1 3.47Å; Y697-L747 HydrophobicContact CD2-CD2 3.63Å; Y697-L747 HydrophobicContact CE2-CB 3.9Å; Y697-L747 HydrophobicContact CE2-CD2 3.43Å; Y697-L747 VanDerWaalsContact CE2-CD2 3.43Å; Y697-L747 HydrophobicContact CE2-CG 4.29Å
698	V	93.9	Very high	93.2	Very high	25 Å²	25	32.5 Å²	32.5	15%	0.152	17%	0.167	C	C	.	.	H	α-helix	trans	-62.5	-39.6	177.6	176.3	0	0	0	0	111.6	L514 C601 K694 A695 S700 D701 A702	L514-V698 HydrophobicContact CB-CG2 4.26Å; C601-V698 VanDerWaalsContact SG-CG1 3.59Å; K694-V698 WeakPolarHBondContact O-CG2 3.22Å; K694-V698 PolarHBondContact O-N 2.92Å; K694-V698 VanDerWaalsContact O-N 3.08Å; A695-V698 PolarHBondContact O-N 3.38Å; V698-S700 VanDerWaalsContact C-N 3.3Å; V698-S700 PolarHBondContact O-N 2.91Å; V698-D701 PolarHBondContact O-N 3.42Å; V698-A702 WeakPolarHBondContact O-CB 3.19Å; V698-A702 PolarHBondContact O-N 3.23Å
699	L	93.6	Very high	93.3	Very high	4 Å²	4	33.2 Å²	33.2	2%	0.021	17%	0.17	C	C	.	.	H	α-helix	trans	-62.3	-37.7	173.1	-77.3	171.6	0	0	0	112.6	E598 C601 L605 A695 Y696 Y697 A703 Y715	E598-L699 HydrophobicContact CB-CD2 4.28Å; E598-L699 HydrophobicContact CG-CD2 3.6Å; C601-L699 HydrophobicContact CB-CD1 3.91Å; C601-L699 HydrophobicContact CB-CD2 3.6Å; C601-L699 HydrophobicContact CB-CG 3.47Å; C601-L699 VanDerWaalsContact CB-CG 3.47Å; L605-L699 HydrophobicContact CD1-CD1 3.68Å; A695-L699 WeakPolarHBondContact O-CG 3.41Å; A695-L699 PolarHBondContact O-N 3.31Å; Y696-L699 HydrophobicContact CD1-CD1 4.18Å; Y696-L699 PolarHBondContact O-N 3.14Å; Y697-L699 VanDerWaalsContact C-N 3.33Å; Y697-L699 PolarHBondContact O-N 3.19Å; L699-A703 WeakPolarHBondContact O-CB 3.43Å; L699-A703 PolarHBondContact O-N 3.37Å; L699-Y715 HydrophobicContact CB-CD1 4.32Å; L699-Y715 HydrophobicContact CB-CD2 3.75Å; L699-Y715 HydrophobicContact CB-CE2 4.07Å; L699-Y715 HydrophobicContact CB-CG 3.89Å; L699-Y715 HydrophobicContact CD1-CD1 4.38Å; L699-Y715 HydrophobicContact CD1-CE1 4.23Å
700	S	95.2	Very high	93.3	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-66.9	-44.8	177.2	-171.2	0	0	0	0	111.7	Y696 Y697 V698 A703 M704 A712 I751	Y696-S700 WeakPolarHBondContact O-CB 3.49Å; Y696-S700 PolarHBondContact O-N 3.41Å; Y697-S700 WeakPolarHBondContact O-CB 3.39Å; Y697-S700 PolarHBondContact O-N 3.36Å; Y697-S700 VanDerWaalsContact O-N 3.07Å; V698-S700 VanDerWaalsContact C-N 3.3Å; V698-S700 PolarHBondContact O-N 2.91Å; S700-A703 PolarHBondContact O-N 2.94Å; S700-M704 PolarHBondContact O-N 3.4Å; S700-A712 PolarHBondContact OG-O 2.94Å; S700-I751 WeakPolarHBondContact OG-CD1 3.39Å
701	D	93.8	Very high	93.4	Very high	47 Å²	47	33.2 Å²	33.2	25%	0.251	17%	0.168	S	C	.	.	H	α-helix	trans	-64	-40.6	176.7	-176.1	60.7	0	0	0	112.4	K518 Y697 V698 M704 S705 L747	K518-D701 WeakPolarHBondContact CE-OD2 3.31Å; K518-D701 IonicContact NZ-OD1 3.82Å; K518-D701 IonicContact NZ-OD2 2.68Å; K518-D701 PolarHBondContact NZ-OD2 3.35Å; Y697-D701 PolarHBondContact O-N 3.45Å; V698-D701 PolarHBondContact O-N 3.42Å; D701-M704 WeakPolarHBondContact O-CB 3.33Å; D701-M704 PolarHBondContact O-N 3.21Å; D701-S705 PolarHBondContact O-N 3.1Å; D701-S705 PolarHBondContact O-OG 2.99Å; D701-L747 HydrophobicContact CB-CD2 4.15Å
702	A	92.4	Very high	93.6	Very high	20 Å²	20	32.5 Å²	32.5	17%	0.165	17%	0.165	C	C	.	.	H	α-helix	trans	-62.6	-44.8	173	0	0	0	0	0	111.6	V698 M704 S705 L706	V698-A702 WeakPolarHBondContact O-CB 3.19Å; V698-A702 PolarHBondContact O-N 3.23Å; A702-M704 VanDerWaalsContact C-N 3.34Å; A702-M704 PolarHBondContact O-N 3.07Å; A702-S705 WeakPolarHBondContact O-CB 3.5Å; A702-S705 PolarHBondContact O-N 3.31Å; A702-L706 WeakPolarHBondContact O-CG 3.34Å; A702-L706 PolarHBondContact O-N 2.83Å; A702-L706 VanDerWaalsContact O-N 3.12Å
703	A	92.9	Very high	93.6	Very high	3 Å²	3	32.5 Å²	32.5	3%	0.025	17%	0.165	C	C	.	.	H	α-helix	trans	-65.5	-35.5	177	0	0	0	0	0	112.9	L699 S700 L706 Q707 K708 R711 A712 Y715	L699-A703 WeakPolarHBondContact O-CB 3.43Å; L699-A703 PolarHBondContact O-N 3.37Å; S700-A703 PolarHBondContact O-N 2.94Å; A703-L706 CarbonylContact O-C 3.53Å; A703-L706 PolarHBondContact O-N 2.67Å; A703-Q707 PolarHBondContact O-N 3.48Å; A703-K708 PolarHBondContact O-N 3.26Å; A703-R711 HydrophobicContact CB-CB 4.45Å; A703-R711 HydrophobicContact CB-CG 4.44Å; A703-A712 HydrophobicContact CB-CB 3.85Å; A703-Y715 HydrophobicContact CB-CD2 4.28Å
704	M	93.1	Very high	93.6	Very high	28 Å²	28	33.1 Å²	33.1	14%	0.138	17%	0.167	C	C	.	.	H	α-helix	trans	-60.4	-46.3	171.4	-86.8	-66.4	-85	0	0	111.8	S700 D701 A702 L706 Q707 Y709 A712 L747 D750 I751 M754	S700-M704 PolarHBondContact O-N 3.4Å; D701-M704 WeakPolarHBondContact O-CB 3.33Å; D701-M704 PolarHBondContact O-N 3.21Å; A702-M704 VanDerWaalsContact C-N 3.34Å; A702-M704 PolarHBondContact O-N 3.07Å; M704-L706 PolarHBondContact O-N 2.7Å; M704-Q707 PolarHBondContact O-N 3.22Å; M704-Y709 HydrophobicContact SD-CD1 3.52Å; M704-Y709 VanDerWaalsContact SD-CD1 3.52Å; M704-Y709 HydrophobicContact SD-CE1 3.91Å; M704-A712 HydrophobicContact CG-CB 3.75Å; M704-A712 HydrophobicContact SD-CB 4.16Å; M704-L747 HydrophobicContact CG-CD1 3.96Å; M704-D750 HydrophobicContact CE-CB 3.87Å; M704-I751 HydrophobicContact CE-CB 4.44Å; M704-I751 HydrophobicContact CE-CG1 3.87Å; M704-I751 HydrophobicContact CG-CD1 4.17Å; M704-I751 HydrophobicContact CG-CG1 3.51Å; M704-I751 HydrophobicContact SD-CB 4.01Å; M704-I751 HydrophobicContact SD-CD1 4.46Å; M704-I751 HydrophobicContact SD-CG1 3.25Å; M704-I751 WeakPolarHBondContact SD-CG1 3.43Å; M704-I751 HydrophobicContact SD-CG2 4.47Å; M704-M754 HydrophobicContact CE-CG 3.87Å
705	S	91.4	Very high	93.7	Very high	76 Å²	76	31.4 Å²	31.4	53%	0.531	16%	0.16	S	C	.	.	H	α-helix	trans	-61.3	-31	177.9	-55.8	0	0	0	0	111.9	D701 A702 Q707	D701-S705 PolarHBondContact O-N 3.1Å; D701-S705 PolarHBondContact O-OG 2.99Å; A702-S705 WeakPolarHBondContact O-CB 3.5Å; A702-S705 PolarHBondContact O-N 3.31Å; S705-Q707 VanDerWaalsContact C-N 3.33Å
706	L	91.3	Very high	93.8	Very high	108 Å²	108	31.4 Å²	31.4	57%	0.565	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.5	6.9	175.7	-64.7	174.5	0	0	0	114.4	A702 A703 M704 K708	A702-L706 WeakPolarHBondContact O-CG 3.34Å; A702-L706 PolarHBondContact O-N 2.83Å; A702-L706 VanDerWaalsContact O-N 3.12Å; A703-L706 CarbonylContact O-C 3.53Å; A703-L706 PolarHBondContact O-N 2.67Å; M704-L706 PolarHBondContact O-N 2.7Å; L706-K708 HydrophobicContact CB-CG 4.44Å; L706-K708 PolarHBondContact O-N 3.07Å
707	Q	92.6	Very high	93.8	Very high	138 Å²	138	34 Å²	34	65%	0.645	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.8	20.5	-178.1	-52	-179.5	3.7	0	0	114.9	A703 M704 S705 Y709	A703-Q707 PolarHBondContact O-N 3.48Å; M704-Q707 PolarHBondContact O-N 3.22Å; S705-Q707 VanDerWaalsContact C-N 3.33Å; Q707-Y709 HydrophobicContact CB-CE1 4.44Å; Q707-Y709 HydrophobicContact CB-CE2 4.29Å; Q707-Y709 PolarHBondContact O-N 3.34Å
708	K	92.9	Very high	93.8	Very high	88 Å²	88	31.7 Å²	31.7	38%	0.383	16%	0.162	S	C	.	.			trans	-92.7	68.8	176.6	-64.8	-174.8	179.9	178	0	110.4	A703 L706 G710 R711 A712	A703-K708 PolarHBondContact O-N 3.26Å; L706-K708 HydrophobicContact CB-CG 4.44Å; L706-K708 PolarHBondContact O-N 3.07Å; K708-G710 PolarHBondContact O-N 3.23Å; K708-R711 HydrophobicContact CB-CB 3.98Å; K708-R711 WeakPolarHBondContact O-CB 3.32Å; K708-R711 PolarHBondContact O-N 3.28Å; K708-A712 PolarHBondContact O-N 3.28Å
709	Y	93.9	Very high	93.8	Very high	16 Å²	16	30.5 Å²	30.5	6%	0.063	16%	0.155	C	C	.	.	H	α-helix	trans	-65.1	-34	-167.6	-53.5	-53.8	0	0	0	114.4	M704 Q707 A712 L713 M754 N758 H765	M704-Y709 HydrophobicContact SD-CD1 3.52Å; M704-Y709 VanDerWaalsContact SD-CD1 3.52Å; M704-Y709 HydrophobicContact SD-CE1 3.91Å; Q707-Y709 HydrophobicContact CB-CE1 4.44Å; Q707-Y709 HydrophobicContact CB-CE2 4.29Å; Q707-Y709 PolarHBondContact O-N 3.34Å; Y709-A712 PolarHBondContact O-N 3.41Å; Y709-L713 WeakPolarHBondContact O-CB 3.46Å; Y709-L713 PolarHBondContact O-N 3.23Å; Y709-M754 HydrophobicContact CD1-CB 3.7Å; Y709-M754 HydrophobicContact CD1-CG 4.36Å; Y709-M754 HydrophobicContact CD2-CB 4.25Å; Y709-M754 HydrophobicContact CE1-CB 3.58Å; Y709-M754 HydrophobicContact CE1-CE 4.27Å; Y709-M754 HydrophobicContact CE1-CG 3.88Å; Y709-M754 HydrophobicContact CE2-CB 4.14Å; Y709-M754 HydrophobicContact CE2-CE 4.4Å; Y709-M754 HydrophobicContact CG-CB 4.05Å; Y709-M754 WeakPolarHBondContact OH-CE 3.48Å; Y709-N758 HydrophobicContact CD2-CB 4.46Å; Y709-N758 HydrophobicContact CE2-CB 4.32Å; Y709-N758 WeakPolarHBondContact CE2-ND2 3.4Å; Y709-H765 AromaticContact CD2-CE1 3.71Å; Y709-H765 AromaticContact CD2-NE2 3.76Å
710	G	93.1	Very high	93.8	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-65	-42.1	174.9	0	0	0	0	0	111.9	K708 L713 R714 H765 E768 F769	K708-G710 PolarHBondContact O-N 3.23Å; G710-L713 PolarHBondContact O-N 3.07Å; G710-R714 PolarHBondContact O-N 2.99Å; G710-R714 VanDerWaalsContact O-N 3.14Å; G710-H765 WeakPolarHBondContact CA-O 3.41Å; G710-E768 PolarHBondContact N-OE2 2.99Å; G710-F769 WeakPolarHBondContact O-CA 3.3Å
711	R	93.3	Very high	93.6	Very high	33 Å²	33	31.6 Å²	31.6	13%	0.125	16%	0.16	C	C	.	.	H	α-helix	trans	-64.5	-43.5	174.4	-166.6	-175.8	-174.1	-172.7	4.9	111.7	E598 A703 K708 L713 R714 Y715 E768	E598-R711 IonicContact OE1-CZ 3.55Å; E598-R711 IonicContact OE1-NH1 3.44Å; E598-R711 IonicContact OE1-NH2 2.77Å; E598-R711 PolarHBondContact OE1-NH2 2.89Å; E598-R711 IonicContact OE2-CZ 2.98Å; E598-R711 VanDerWaalsContact OE2-CZ 3.26Å; E598-R711 IonicContact OE2-NH1 2.74Å; E598-R711 PolarHBondContact OE2-NH1 2.91Å; E598-R711 IonicContact OE2-NH2 3.6Å; E598-R711 PolarHBondContact OE2-NH2 3.26Å; A703-R711 HydrophobicContact CB-CB 4.45Å; A703-R711 HydrophobicContact CB-CG 4.44Å; K708-R711 HydrophobicContact CB-CB 3.98Å; K708-R711 WeakPolarHBondContact O-CB 3.32Å; K708-R711 PolarHBondContact O-N 3.28Å; R711-L713 VanDerWaalsContact C-N 3.35Å; R711-R714 WeakPolarHBondContact O-CB 3.25Å; R711-R714 PolarHBondContact O-N 3.28Å; R711-Y715 HydrophobicContact CG-CD2 4.11Å; R711-Y715 HydrophobicContact CG-CE2 3.6Å; R711-Y715 PolarHBondContact NE-OH 3.34Å; R711-Y715 PolarHBondContact NH2-OH 3.48Å; R711-Y715 WeakPolarHBondContact O-CD2 3.16Å; R711-Y715 PolarHBondContact O-N 3.39Å; R711-Y715 VanDerWaalsContact O-N 3.1Å; R711-E768 HydrophobicContact CB-CB 4.13Å
712	A	95.4	Very high	93.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.5	-42.9	176.8	0	0	0	0	0	111.9	S700 A703 M704 K708 Y709 R714 Y715 I716 I751	S700-A712 PolarHBondContact OG-O 2.94Å; A703-A712 HydrophobicContact CB-CB 3.85Å; M704-A712 HydrophobicContact CG-CB 3.75Å; M704-A712 HydrophobicContact SD-CB 4.16Å; K708-A712 PolarHBondContact O-N 3.28Å; Y709-A712 PolarHBondContact O-N 3.41Å; A712-R714 VanDerWaalsContact C-N 3.31Å; A712-R714 PolarHBondContact O-N 3.07Å; A712-Y715 PolarHBondContact O-N 3.42Å; A712-I716 PolarHBondContact O-N 3.03Å; A712-I751 HydrophobicContact CB-CD1 4.01Å; A712-I751 HydrophobicContact CB-CG1 4.03Å; A712-I751 HydrophobicContact CB-CG2 4.5Å
713	L	95.1	Very high	93.4	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.6	-39	177.3	-171.3	63.2	0	0	0	111.8	Y709 G710 R711 I716 K717 I751 Q752 L755 F769 L798	Y709-L713 WeakPolarHBondContact O-CB 3.46Å; Y709-L713 PolarHBondContact O-N 3.23Å; G710-L713 PolarHBondContact O-N 3.07Å; R711-L713 VanDerWaalsContact C-N 3.35Å; L713-I716 HydrophobicContact CD1-CG2 4.14Å; L713-I716 VanDerWaalsContact O-CG2 3.29Å; L713-I716 WeakPolarHBondContact O-CG2 3.48Å; L713-K717 VanDerWaalsContact O-CB 3.31Å; L713-K717 WeakPolarHBondContact O-CB 3.46Å; L713-K717 PolarHBondContact O-N 3.23Å; L713-I751 HydrophobicContact CB-CG2 3.74Å; L713-I751 HydrophobicContact CD1-CG2 3.94Å; L713-I751 HydrophobicContact CG-CG2 4.39Å; L713-Q752 HydrophobicContact CD1-CG 4.49Å; L713-L755 HydrophobicContact CB-CD1 4.39Å; L713-L755 HydrophobicContact CD2-CD1 3.79Å; L713-F769 HydrophobicContact CB-CD2 4.03Å; L713-F769 HydrophobicContact CB-CE2 4.31Å; L713-F769 HydrophobicContact CD2-CD2 3.92Å; L713-F769 HydrophobicContact CD2-CE2 3.82Å; L713-F769 HydrophobicContact CG-CD2 3.97Å; L713-F769 HydrophobicContact CG-CE2 3.78Å; L713-L798 HydrophobicContact CD2-CB 4.15Å; L713-L798 HydrophobicContact CD2-CD1 3.96Å
714	R	94.2	Very high	93.1	Very high	14 Å²	14	28.8 Å²	28.8	5%	0.053	14%	0.142	C	C	.	.	H	α-helix	trans	-63	-46.9	173.9	-178	-171.2	69.7	-145.1	0.2	112	G710 R711 A712 K717 L718 E768 F769 Y771	G710-R714 PolarHBondContact O-N 2.99Å; G710-R714 VanDerWaalsContact O-N 3.14Å; R711-R714 WeakPolarHBondContact O-CB 3.25Å; R711-R714 PolarHBondContact O-N 3.28Å; A712-R714 VanDerWaalsContact C-N 3.31Å; A712-R714 PolarHBondContact O-N 3.07Å; R714-K717 WeakPolarHBondContact O-CB 3.47Å; R714-K717 PolarHBondContact O-N 3.3Å; R714-L718 PolarHBondContact O-N 2.95Å; R714-E768 PolarHBondContact NH1-O 3.36Å; R714-F769 HydrophobicContact CB-CD2 4.16Å; R714-F769 WeakPolarHBondContact CD-O 3.44Å; R714-Y771 WeakPolarHBondContact CD-O 3.38Å; R714-Y771 VanDerWaalsContact CZ-O 3.25Å; R714-Y771 PolarHBondContact NE-O 2.9Å; R714-Y771 PolarHBondContact NH1-O 3Å
715	Y	95.4	Very high	92.8	Very high	4 Å²	4	27.5 Å²	27.5	2%	0.016	14%	0.135	C	C	.	.	H	α-helix	trans	-66.1	-41.7	-179.1	-69.2	-41.9	0	0	0	112.2	Y696 L699 A703 R711 A712 K717 L718 A719	Y696-Y715 HydrophobicContact CD1-CD1 4.05Å; Y696-Y715 HydrophobicContact CE1-CD1 4.44Å; L699-Y715 HydrophobicContact CB-CD1 4.32Å; L699-Y715 HydrophobicContact CB-CD2 3.75Å; L699-Y715 HydrophobicContact CB-CE2 4.07Å; L699-Y715 HydrophobicContact CB-CG 3.89Å; L699-Y715 HydrophobicContact CD1-CD1 4.38Å; L699-Y715 HydrophobicContact CD1-CE1 4.23Å; A703-Y715 HydrophobicContact CB-CD2 4.28Å; R711-Y715 HydrophobicContact CG-CD2 4.11Å; R711-Y715 HydrophobicContact CG-CE2 3.6Å; R711-Y715 PolarHBondContact NE-OH 3.34Å; R711-Y715 PolarHBondContact NH2-OH 3.48Å; R711-Y715 WeakPolarHBondContact O-CD2 3.16Å; R711-Y715 PolarHBondContact O-N 3.39Å; R711-Y715 VanDerWaalsContact O-N 3.1Å; A712-Y715 PolarHBondContact O-N 3.42Å; Y715-K717 VanDerWaalsContact C-N 3.26Å; Y715-K717 PolarHBondContact O-N 2.74Å; Y715-L718 PolarHBondContact O-N 3.07Å; Y715-A719 PolarHBondContact O-N 3.19Å
716	I	96.3	Very high	92.6	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-66.2	-31.8	175.5	-160.5	59.9	0	0	0	111.6	Y697 A712 L713 A719 L720 Y744 L747 C748 I751	Y697-I716 HydrophobicContact CD2-CD1 4Å; A712-I716 PolarHBondContact O-N 3.03Å; L713-I716 HydrophobicContact CD1-CG2 4.14Å; L713-I716 VanDerWaalsContact O-CG2 3.29Å; L713-I716 WeakPolarHBondContact O-CG2 3.48Å; I716-A719 HydrophobicContact CD1-CB 4.22Å; I716-A719 WeakPolarHBondContact O-CB 3.47Å; I716-A719 PolarHBondContact O-N 3.31Å; I716-L720 HydrophobicContact CG1-CD1 4.24Å; I716-L720 HydrophobicContact CG1-CG 4.48Å; I716-L720 WeakPolarHBondContact O-CB 2.86Å; I716-L720 WeakPolarHBondContact O-CG 2.96Å; I716-L720 PolarHBondContact O-N 2.98Å; I716-Y744 HydrophobicContact CD1-CG 4.5Å; I716-L747 HydrophobicContact CD1-CB 4.47Å; I716-L747 HydrophobicContact CD1-CD2 4.14Å; I716-C748 HydrophobicContact CG1-CB 4Å; I716-C748 HydrophobicContact CG2-CB 4.35Å; I716-I751 HydrophobicContact CB-CD1 3.95Å; I716-I751 HydrophobicContact CG1-CD1 4.5Å; I716-I751 HydrophobicContact CG2-CD1 3.66Å
717	K	94.8	Very high	92	Very high	55 Å²	55	20.4 Å²	20.4	24%	0.239	9%	0.092	C	C	.	.	H	α-helix	trans	-58.8	-51	171.4	-178.7	172	179.3	165.1	0	111.5	L713 R714 Y715 A719 L720 Q721 F769 T796	L713-K717 VanDerWaalsContact O-CB 3.31Å; L713-K717 WeakPolarHBondContact O-CB 3.46Å; L713-K717 PolarHBondContact O-N 3.23Å; R714-K717 WeakPolarHBondContact O-CB 3.47Å; R714-K717 PolarHBondContact O-N 3.3Å; Y715-K717 VanDerWaalsContact C-N 3.26Å; Y715-K717 PolarHBondContact O-N 2.74Å; K717-A719 VanDerWaalsContact C-N 3.3Å; K717-A719 PolarHBondContact O-N 3Å; K717-L720 PolarHBondContact O-N 2.86Å; K717-Q721 HydrophobicContact CG-CG 4.5Å; K717-Q721 WeakPolarHBondContact O-CB 3.08Å; K717-Q721 VanDerWaalsContact O-CG 3.26Å; K717-Q721 WeakPolarHBondContact O-CG 3.46Å; K717-Q721 PolarHBondContact O-N 3.32Å; K717-F769 HydrophobicContact CD-CE2 4.24Å; K717-F769 HydrophobicContact CD-CZ 4.08Å; K717-T796 HydrophobicContact CB-CG2 3.94Å; K717-T796 HydrophobicContact CG-CG2 4.23Å
718	L	94.5	Very high	91.3	Very high	7 Å²	7	15.8 Å²	15.8	4%	0.037	7%	0.074	C	C	.	.	H	α-helix	trans	-63.9	-35	177.3	-66.3	171.1	0	0	0	112.5	Y696 R714 Y715 S722 D776 L780	Y696-L718 HydrophobicContact CD1-CB 3.97Å; Y696-L718 HydrophobicContact CD1-CD1 4.11Å; Y696-L718 HydrophobicContact CD2-CB 3.78Å; Y696-L718 HydrophobicContact CE1-CB 4.07Å; Y696-L718 HydrophobicContact CE1-CD1 3.61Å; Y696-L718 HydrophobicContact CE1-CG 4.48Å; Y696-L718 HydrophobicContact CE2-CB 3.88Å; Y696-L718 HydrophobicContact CG-CB 3.84Å; R714-L718 PolarHBondContact O-N 2.95Å; Y715-L718 PolarHBondContact O-N 3.07Å; L718-S722 WeakPolarHBondContact O-CB 3.43Å; L718-S722 PolarHBondContact O-N 3.05Å; L718-S722 PolarHBondContact O-OG 3.28Å; L718-D776 HydrophobicContact CD1-CB 4Å; L718-L780 HydrophobicContact CD2-CD1 4.34Å
719	A	95.1	Very high	90.6	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-63.8	-46.8	174.9	0	0	0	0	0	112.1	S693 Y715 I716 K717 S722 H723	S693-A719 WeakPolarHBondContact O-CB 3.01Å; S693-A719 PolarHBondContact OG-O 3.4Å; Y715-A719 PolarHBondContact O-N 3.19Å; I716-A719 HydrophobicContact CD1-CB 4.22Å; I716-A719 WeakPolarHBondContact O-CB 3.47Å; I716-A719 PolarHBondContact O-N 3.31Å; K717-A719 VanDerWaalsContact C-N 3.3Å; K717-A719 PolarHBondContact O-N 3Å; A719-S722 PolarHBondContact O-N 2.93Å; A719-H723 WeakPolarHBondContact O-CB 3.12Å; A719-H723 PolarHBondContact O-N 3.23Å
720	L	92.5	Very high	89.7	Confident	1 Å²	1	12.5 Å²	12.5	1%	0.005	6%	0.064	C	C	.	.	H	α-helix	trans	-68.9	-37.3	178.5	-75.7	168.9	0	0	0	112.1	I716 K717 H723 D724 L741 Y744 L745 C748 F792 T796	I716-L720 HydrophobicContact CG1-CD1 4.24Å; I716-L720 HydrophobicContact CG1-CG 4.48Å; I716-L720 WeakPolarHBondContact O-CB 2.86Å; I716-L720 WeakPolarHBondContact O-CG 2.96Å; I716-L720 PolarHBondContact O-N 2.98Å; K717-L720 PolarHBondContact O-N 2.86Å; L720-H723 WeakPolarHBondContact O-CB 3.39Å; L720-H723 PolarHBondContact O-N 3.33Å; L720-D724 WeakPolarHBondContact O-CB 3.43Å; L720-D724 PolarHBondContact O-N 3.47Å; L720-L741 HydrophobicContact CD2-CD1 3.81Å; L720-Y744 HydrophobicContact CD2-CD2 4.31Å; L720-L745 HydrophobicContact CD2-CD2 4.36Å; L720-C748 HydrophobicContact CD1-CB 4.45Å; L720-F792 HydrophobicContact CB-CB 4.09Å; L720-F792 HydrophobicContact CB-CD2 4.25Å; L720-F792 HydrophobicContact CB-CG 4.39Å; L720-F792 HydrophobicContact CD1-CB 4.18Å; L720-F792 HydrophobicContact CD2-CB 4.47Å; L720-F792 HydrophobicContact CD2-CD2 4.24Å; L720-F792 HydrophobicContact CD2-CG 4.17Å; L720-F792 HydrophobicContact CG-CB 4.49Å; L720-T796 HydrophobicContact CD1-CG2 3.67Å
721	Q	92.2	Very high	88.3	Confident	26 Å²	26	16.8 Å²	16.8	12%	0.121	9%	0.09	C	C	.	.	H	α-helix	trans	-64.4	-43.2	173.4	-72.4	-177.5	-54.5	0	0	111.7	K717 H723 D724 T725 C789	K717-Q721 HydrophobicContact CG-CG 4.5Å; K717-Q721 WeakPolarHBondContact O-CB 3.08Å; K717-Q721 VanDerWaalsContact O-CG 3.26Å; K717-Q721 WeakPolarHBondContact O-CG 3.46Å; K717-Q721 PolarHBondContact O-N 3.32Å; Q721-H723 VanDerWaalsContact C-N 3.28Å; Q721-H723 PolarHBondContact O-N 2.69Å; Q721-D724 PolarHBondContact O-N 3.24Å; Q721-T725 PolarHBondContact O-N 3.34Å; Q721-T725 VanDerWaalsContact O-N 3.07Å; Q721-T725 PolarHBondContact O-OG1 2.91Å; Q721-T725 VanDerWaalsContact O-OG1 3.05Å; Q721-C789 HydrophobicContact CB-CB 3.98Å; Q721-C789 HydrophobicContact CG-CB 3.95Å; Q721-C789 PolarHBondContact NE2-O 3.27Å
722	S	92.1	Very high	87	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-60.4	-41.1	172.6	-57.2	0	0	0	0	111.2	I689 S692 L718 A719 T725 Y726 L783	I689-S722 WeakPolarHBondContact CG2-O 3.43Å; S692-S722 PolarHBondContact OG-OG 3.47Å; L718-S722 WeakPolarHBondContact O-CB 3.43Å; L718-S722 PolarHBondContact O-N 3.05Å; L718-S722 PolarHBondContact O-OG 3.28Å; A719-S722 PolarHBondContact O-N 2.93Å; S722-T725 PolarHBondContact O-N 3.14Å; S722-Y726 PolarHBondContact O-N 3.4Å; S722-L783 WeakPolarHBondContact OG-CD1 3.38Å
723	H	89.3	Confident	85.6	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-67.1	-41.3	178.3	-166.1	95.3	0	0	0	112.6	A719 L720 Q721 T725 Y726 C727 V737 Y744	A719-H723 WeakPolarHBondContact O-CB 3.12Å; A719-H723 PolarHBondContact O-N 3.23Å; L720-H723 WeakPolarHBondContact O-CB 3.39Å; L720-H723 PolarHBondContact O-N 3.33Å; Q721-H723 VanDerWaalsContact C-N 3.28Å; Q721-H723 PolarHBondContact O-N 2.69Å; H723-T725 VanDerWaalsContact C-N 3.35Å; H723-T725 PolarHBondContact O-N 3.05Å; H723-Y726 WeakPolarHBondContact O-CB 3.39Å; H723-Y726 PolarHBondContact O-N 3.49Å; H723-Y726 VanDerWaalsContact O-N 3.15Å; H723-C727 PolarHBondContact CD2-SG 3.22Å; H723-C727 PolarHBondContact NE2-SG 3.02Å; H723-C727 PolarHBondContact O-N 2.99Å; H723-C727 PolarHBondContact O-SG 3.32Å; H723-C727 VanDerWaalsContact O-SG 3.34Å; H723-V737 WeakPolarHBondContact CE1-CG1 2.99Å; H723-V737 PolarHBondContact CE1-O 3.47Å; H723-Y744 HydrophobicContact CB-CD2 4.35Å; H723-Y744 HydrophobicContact CB-CE2 4.2Å; H723-Y744 AromaticContact ND1-CE2 3.65Å
724	D	86.1	Confident	84.5	Confident	11 Å²	11	25.3 Å²	25.3	6%	0.059	14%	0.137	C	C	.	.	H	α-helix	trans	-56.8	-49.2	174.6	-169.8	29.8	0	0	0	110.5	L720 Q721 Y726 C727 C728 C789 Q790 G791 F792	L720-D724 WeakPolarHBondContact O-CB 3.43Å; L720-D724 PolarHBondContact O-N 3.47Å; Q721-D724 PolarHBondContact O-N 3.24Å; D724-Y726 VanDerWaalsContact C-N 3.31Å; D724-Y726 PolarHBondContact O-N 3.39Å; D724-C727 WeakPolarHBondContact O-CB 3.32Å; D724-C727 PolarHBondContact O-N 3.46Å; D724-C727 VanDerWaalsContact O-N 3.16Å; D724-C728 PolarHBondContact O-N 2.85Å; D724-C728 PolarHBondContact O-SG 3.33Å; D724-C789 VanDerWaalsContact OD2-CA 3.28Å; D724-C789 WeakPolarHBondContact OD2-CA 3.25Å; D724-Q790 PolarHBondContact OD2-N 3.24Å; D724-G791 PolarHBondContact OD2-N 2.96Å; D724-F792 HydrophobicContact CB-CD2 4.12Å; D724-F792 HydrophobicContact CB-CE2 4.14Å
725	T	86.9	Confident	83.7	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-60.4	-40	175.1	-47.9	0	0	0	0	112.5	I689 Q721 S722 H723 C728 L729 L783 E786 S787 C789	I689-T725 HydrophobicContact CD1-CG2 3.86Å; Q721-T725 PolarHBondContact O-N 3.34Å; Q721-T725 VanDerWaalsContact O-N 3.07Å; Q721-T725 PolarHBondContact O-OG1 2.91Å; Q721-T725 VanDerWaalsContact O-OG1 3.05Å; S722-T725 PolarHBondContact O-N 3.14Å; H723-T725 VanDerWaalsContact C-N 3.35Å; H723-T725 PolarHBondContact O-N 3.05Å; T725-C728 PolarHBondContact O-N 3.43Å; T725-L729 HydrophobicContact CG2-CD1 4.12Å; T725-L729 WeakPolarHBondContact O-CG 3.24Å; T725-L729 PolarHBondContact O-N 3.34Å; T725-L729 VanDerWaalsContact O-N 3.14Å; T725-L783 HydrophobicContact CG2-CD2 4.11Å; T725-E786 HydrophobicContact CG2-CB 3.72Å; T725-E786 HydrophobicContact CG2-CG 4.45Å; T725-S787 WeakPolarHBondContact CA-OG 3.44Å; T725-S787 WeakPolarHBondContact CB-OG 3.36Å; T725-S787 PolarHBondContact OG1-OG 3.31Å; T725-C789 PolarHBondContact OG1-SG 3.47Å
726	Y	87	Confident	82.9	Confident	18 Å²	18	33.4 Å²	33.4	7%	0.071	18%	0.181	C	C	.	.	H	α-helix	trans	-60.2	-46.8	175.3	-178.9	-84.5	0	0	0	111.4	L686 L690 S722 H723 D724 C728 L729 C730 M733 V737	L686-Y726 HydrophobicContact CB-CD2 4.48Å; L686-Y726 HydrophobicContact CB-CE2 4.17Å; L686-Y726 HydrophobicContact CD2-CD2 3.75Å; L686-Y726 HydrophobicContact CD2-CE2 3.84Å; L686-Y726 HydrophobicContact CD2-CG 4.35Å; L690-Y726 HydrophobicContact CB-CD2 3.85Å; L690-Y726 HydrophobicContact CB-CE2 3.87Å; L690-Y726 HydrophobicContact CD1-CD2 4.42Å; L690-Y726 HydrophobicContact CD1-CE2 4.43Å; L690-Y726 HydrophobicContact CD2-CE2 4.09Å; L690-Y726 HydrophobicContact CG-CE2 4.35Å; S722-Y726 PolarHBondContact O-N 3.4Å; H723-Y726 WeakPolarHBondContact O-CB 3.39Å; H723-Y726 PolarHBondContact O-N 3.49Å; H723-Y726 VanDerWaalsContact O-N 3.15Å; D724-Y726 VanDerWaalsContact C-N 3.31Å; D724-Y726 PolarHBondContact O-N 3.39Å; Y726-C728 VanDerWaalsContact C-N 3.33Å; Y726-C728 PolarHBondContact O-N 2.95Å; Y726-L729 PolarHBondContact O-N 2.81Å; Y726-C730 HydrophobicContact CD1-CB 4.29Å; Y726-C730 HydrophobicContact CE1-CB 3.92Å; Y726-C730 VanDerWaalsContact O-CB 3.27Å; Y726-C730 WeakPolarHBondContact O-CB 3.39Å; Y726-C730 PolarHBondContact O-N 2.88Å; Y726-M733 HydrophobicContact CE1-SD 4.47Å; Y726-V737 HydrophobicContact CD1-CG1 3.91Å; Y726-V737 HydrophobicContact CE1-CB 4.39Å; Y726-V737 HydrophobicContact CE1-CG1 3.7Å; Y726-V737 HydrophobicContact CE1-CG2 3.93Å
727	C	80.4	Confident	82.3	Confident	17 Å²	17	33.6 Å²	33.6	12%	0.115	18%	0.182	C	C	.	.	H	α-helix	trans	-61.8	-38.3	176.8	-68.9	0	0	0	0	112.3	H723 D724 L729 M733	H723-C727 PolarHBondContact CD2-SG 3.22Å; H723-C727 PolarHBondContact NE2-SG 3.02Å; H723-C727 PolarHBondContact O-N 2.99Å; H723-C727 PolarHBondContact O-SG 3.32Å; H723-C727 VanDerWaalsContact O-SG 3.34Å; D724-C727 WeakPolarHBondContact O-CB 3.32Å; D724-C727 PolarHBondContact O-N 3.46Å; D724-C727 VanDerWaalsContact O-N 3.16Å; C727-L729 VanDerWaalsContact C-N 3.3Å; C727-L729 PolarHBondContact O-N 3.34Å; C727-M733 HydrophobicContact CB-CE 4.47Å; C727-M733 WeakPolarHBondContact SG-CE 3.45Å
728	C	77.8	Confident	81.7	Confident	41 Å²	41	31.1 Å²	31.1	28%	0.277	17%	0.172	S	C	.	.	H	α-helix	trans	-64.8	-33.1	176.1	-66.3	0	0	0	0	113.1	D724 T725 Y726	D724-C728 PolarHBondContact O-N 2.85Å; D724-C728 PolarHBondContact O-SG 3.33Å; T725-C728 PolarHBondContact O-N 3.43Å; Y726-C728 VanDerWaalsContact C-N 3.33Å; Y726-C728 PolarHBondContact O-N 2.95Å
729	L	76.4	Confident	81.3	Confident	13 Å²	13	32 Å²	32	7%	0.068	18%	0.176	C	C	.	.	H	α-helix	trans	-88.9	-27.6	-177.3	-68.3	173.7	0	0	0	112.8	H682 L686 I689 T725 Y726 C727 E786	H682-L729 PolarHBondContact CE1-O 2.95Å; L686-L729 HydrophobicContact CD2-CB 3.57Å; L686-L729 HydrophobicContact CD2-CD1 4.41Å; L686-L729 HydrophobicContact CG-CB 4.4Å; I689-L729 HydrophobicContact CD1-CD1 3.86Å; T725-L729 HydrophobicContact CG2-CD1 4.12Å; T725-L729 WeakPolarHBondContact O-CG 3.24Å; T725-L729 PolarHBondContact O-N 3.34Å; T725-L729 VanDerWaalsContact O-N 3.14Å; Y726-L729 PolarHBondContact O-N 2.81Å; C727-L729 VanDerWaalsContact C-N 3.3Å; C727-L729 PolarHBondContact O-N 3.34Å; L729-E786 HydrophobicContact CD1-CB 4.4Å; L729-E786 HydrophobicContact CD1-CG 4.33Å; L729-E786 HydrophobicContact CD2-CB 4.36Å
730	C	75.6	Confident	80.9	Confident	23 Å²	23	33.6 Å²	33.6	16%	0.155	18%	0.183	C	C	.	.			trans	-85.5	125.4	-173.5	-163.1	0	0	0	0	111.5	L686 Y726 N732 M733	L686-C730 HydrophobicContact CD2-CB 4.32Å; Y726-C730 HydrophobicContact CD1-CB 4.29Å; Y726-C730 HydrophobicContact CE1-CB 3.92Å; Y726-C730 VanDerWaalsContact O-CB 3.27Å; Y726-C730 WeakPolarHBondContact O-CB 3.39Å; Y726-C730 PolarHBondContact O-N 2.88Å; C730-N732 PolarHBondContact SG-O 3.49Å; C730-M733 HydrophobicContact CB-SD 4.1Å
731	T	63.9	Low	80.8	Confident	90 Å²	90	33.7 Å²	33.7	55%	0.552	18%	0.184	S	C	*	.	S	Bend	trans	-79.7	-34	177.5	61	0	0	0	0	112.6
732	N	65.1	Low	80.7	Confident	85 Å²	85	32.5 Å²	32.5	46%	0.455	18%	0.178	S	C	.	.	S	Bend	trans	-121.2	113.9	-178.2	-66.3	19.1	0	0	0	109.9	C730	C730-N732 PolarHBondContact SG-O 3.49Å
733	M	67.5	Low	80.7	Confident	24 Å²	24	34.9 Å²	34.9	12%	0.118	19%	0.189	C	C	.	.			trans	-82.2	122.8	-176.6	-69.4	-68.7	-65.1	0	0	111.8	M654 Y726 C727 C730 V737 L738	M654-M733 HydrophobicContact CE-CB 4.44Å; M654-M733 HydrophobicContact CE-CE 3.56Å; M654-M733 HydrophobicContact CE-CG 3.65Å; M654-M733 HydrophobicContact CE-SD 4.06Å; M654-M733 HydrophobicContact SD-CB 3.76Å; M654-M733 HydrophobicContact SD-CE 4.17Å; M654-M733 HydrophobicContact SD-CG 3.56Å; M654-M733 VanDerWaalsContact SD-CG 3.56Å; Y726-M733 HydrophobicContact CE1-SD 4.47Å; C727-M733 HydrophobicContact CB-CE 4.47Å; C727-M733 WeakPolarHBondContact SG-CE 3.45Å; C730-M733 HydrophobicContact CB-SD 4.1Å; M733-V737 HydrophobicContact CE-CB 4.4Å; M733-V737 HydrophobicContact CE-CG1 3.72Å; M733-L738 HydrophobicContact CE-CD2 4.39Å
734	L	72.4	Confident	81	Confident	102 Å²	102	34.9 Å²	34.9	53%	0.534	19%	0.189	S	C	.	.			trans	-79.6	141.8	177	-64	171.1	0	0	0	110.7	E736 V737 L738	L734-E736 PolarHBondContact O-N 2.91Å; L734-V737 HydrophobicContact CB-CG2 4.12Å; L734-V737 WeakPolarHBondContact O-CB 3.5Å; L734-V737 PolarHBondContact O-N 3.42Å; L734-L738 PolarHBondContact O-N 3.01Å
735	S	76.1	Confident	81.4	Confident	50 Å²	50	34.3 Å²	34.3	35%	0.35	19%	0.186	S	C	.	.	H	α-helix	trans	-56.3	-35.5	178.2	-56.1	0	0	0	0	113.2	V737 L738 L739	S735-V737 VanDerWaalsContact C-N 3.34Å; S735-V737 PolarHBondContact O-N 3.25Å; S735-L738 PolarHBondContact O-N 3.35Å; S735-L739 PolarHBondContact O-N 3.21Å
736	E	79.5	Confident	81.8	Confident	138 Å²	138	34.5 Å²	34.5	65%	0.645	19%	0.188	S	C	*	.	H	α-helix	trans	-62.6	-38.6	175.3	-67	177.3	-173	0	0	112.5	L734 L739 F740	L734-E736 PolarHBondContact O-N 2.91Å; E736-L739 WeakPolarHBondContact O-CB 3.37Å; E736-L739 PolarHBondContact O-N 3.15Å; E736-F740 HydrophobicContact CB-CE2 4.37Å; E736-F740 WeakPolarHBondContact O-CD2 3.38Å; E736-F740 PolarHBondContact O-N 3.47Å
737	V	82.1	Confident	82.2	Confident	4 Å²	4	34 Å²	34	2%	0.024	19%	0.186	C	C	.	.	H	α-helix	trans	-67.9	-40.3	179.1	178.1	0	0	0	0	110.6	H723 Y726 M733 L734 S735 L739 F740 L741	H723-V737 WeakPolarHBondContact CE1-CG1 2.99Å; H723-V737 PolarHBondContact CE1-O 3.47Å; Y726-V737 HydrophobicContact CD1-CG1 3.91Å; Y726-V737 HydrophobicContact CE1-CB 4.39Å; Y726-V737 HydrophobicContact CE1-CG1 3.7Å; Y726-V737 HydrophobicContact CE1-CG2 3.93Å; M733-V737 HydrophobicContact CE-CB 4.4Å; M733-V737 HydrophobicContact CE-CG1 3.72Å; L734-V737 HydrophobicContact CB-CG2 4.12Å; L734-V737 WeakPolarHBondContact O-CB 3.5Å; L734-V737 PolarHBondContact O-N 3.42Å; S735-V737 VanDerWaalsContact C-N 3.34Å; S735-V737 PolarHBondContact O-N 3.25Å; V737-L739 VanDerWaalsContact C-N 3.33Å; V737-F740 PolarHBondContact O-N 3.41Å; V737-L741 PolarHBondContact O-N 3.03Å
738	L	82.8	Confident	83	Confident	4 Å²	4	33.2 Å²	33.2	2%	0.021	18%	0.181	C	C	.	.	H	α-helix	trans	-64.2	-38	174.1	-73	176.4	0	0	0	112.6	L650 M654 M733 L734 S735 L741 S742 I819 L825	L650-L738 HydrophobicContact CD1-CD1 4.04Å; L650-L738 HydrophobicContact CD2-CD1 3.94Å; L650-L738 HydrophobicContact CG-CD1 4.31Å; M654-L738 HydrophobicContact CE-CD2 4.29Å; M654-L738 HydrophobicContact CG-CD2 4.26Å; M654-L738 HydrophobicContact SD-CD1 4.4Å; M654-L738 HydrophobicContact SD-CD2 3.67Å; M654-L738 HydrophobicContact SD-CG 4.44Å; M733-L738 HydrophobicContact CE-CD2 4.39Å; L734-L738 PolarHBondContact O-N 3.01Å; S735-L738 PolarHBondContact O-N 3.35Å; L738-L741 PolarHBondContact O-N 3.06Å; L738-S742 PolarHBondContact O-N 3.44Å; L738-I819 HydrophobicContact CB-CG2 4.1Å; L738-I819 HydrophobicContact CD2-CG2 4.37Å; L738-I819 WeakPolarHBondContact O-CG2 3.42Å; L738-L825 HydrophobicContact CB-CD1 4.11Å
739	L	85.6	Confident	83.8	Confident	24 Å²	24	31.3 Å²	31.3	13%	0.126	17%	0.168	C	C	.	.	H	α-helix	trans	-61.6	-44.2	174	-175.7	64.5	0	0	0	111.2	S735 E736 V737 L741 S742 Q743 L820 N829	S735-L739 PolarHBondContact O-N 3.21Å; E736-L739 WeakPolarHBondContact O-CB 3.37Å; E736-L739 PolarHBondContact O-N 3.15Å; V737-L739 VanDerWaalsContact C-N 3.33Å; L739-L741 VanDerWaalsContact C-N 3.34Å; L739-L741 PolarHBondContact O-N 3.41Å; L739-S742 WeakPolarHBondContact O-CB 3.31Å; L739-S742 PolarHBondContact O-N 3.16Å; L739-Q743 WeakPolarHBondContact O-CG 3.38Å; L739-Q743 PolarHBondContact O-N 3.36Å; L739-L820 HydrophobicContact CD1-CD2 4.01Å; L739-N829 HydrophobicContact CD1-CB 4.38Å
740	F	87.8	Confident	84.7	Confident	34 Å²	34	32.1 Å²	32.1	15%	0.149	17%	0.172	C	C	.	.	H	α-helix	trans	-60.1	-41.7	174.4	-68	-54.6	0	0	0	112	K694 E736 V737 S742 Q743 Y744	K694-F740 VanDerWaalsContact CE-CZ 3.47Å; E736-F740 HydrophobicContact CB-CE2 4.37Å; E736-F740 WeakPolarHBondContact O-CD2 3.38Å; E736-F740 PolarHBondContact O-N 3.47Å; V737-F740 PolarHBondContact O-N 3.41Å; F740-S742 VanDerWaalsContact C-N 3.33Å; F740-S742 PolarHBondContact O-N 3.34Å; F740-Q743 WeakPolarHBondContact O-CB 3.45Å; F740-Q743 PolarHBondContact O-N 3.49Å; F740-Q743 VanDerWaalsContact O-N 3.14Å; F740-Y744 HydrophobicContact CB-CE1 4.15Å; F740-Y744 HydrophobicContact CB-CE2 4.38Å; F740-Y744 WeakPolarHBondContact O-CD1 3.36Å; F740-Y744 PolarHBondContact O-N 3.4Å
741	L	89.8	Confident	85.6	Confident	4 Å²	4	31 Å²	31	2%	0.021	17%	0.165	C	C	.	.	H	α-helix	trans	-60.6	-42.3	176.1	-175.2	55	0	0	0	112.3	L720 V737 L738 L739 Q743 Y744 L745 F792 I819	L720-L741 HydrophobicContact CD2-CD1 3.81Å; V737-L741 PolarHBondContact O-N 3.03Å; L738-L741 PolarHBondContact O-N 3.06Å; L739-L741 VanDerWaalsContact C-N 3.34Å; L739-L741 PolarHBondContact O-N 3.41Å; L741-Q743 VanDerWaalsContact C-N 3.31Å; L741-Q743 PolarHBondContact O-N 3.43Å; L741-Y744 PolarHBondContact O-N 3.43Å; L741-L745 HydrophobicContact CD1-CD1 4.21Å; L741-L745 HydrophobicContact CD1-CG 4.24Å; L741-L745 HydrophobicContact CG-CD1 4.07Å; L741-L745 WeakPolarHBondContact O-CG 3.29Å; L741-L745 PolarHBondContact O-N 2.91Å; L741-F792 HydrophobicContact CD1-CE1 4.13Å; L741-F792 HydrophobicContact CD1-CE2 4.22Å; L741-F792 HydrophobicContact CD1-CZ 3.77Å; L741-F792 HydrophobicContact CD2-CE1 4.49Å; L741-F792 HydrophobicContact CD2-CZ 3.98Å; L741-F792 HydrophobicContact CG-CZ 4.49Å; L741-I819 HydrophobicContact CB-CD1 4.34Å; L741-I819 HydrophobicContact CD2-CD1 3.72Å; L741-I819 HydrophobicContact CG-CD1 3.73Å
742	S	91.2	Very high	87.1	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-59.1	-42.6	174.4	179.4	0	0	0	0	111.5	L738 L739 F740 T746 A816 L820 H832	L738-S742 PolarHBondContact O-N 3.44Å; L739-S742 WeakPolarHBondContact O-CB 3.31Å; L739-S742 PolarHBondContact O-N 3.16Å; F740-S742 VanDerWaalsContact C-N 3.33Å; F740-S742 PolarHBondContact O-N 3.34Å; S742-T746 WeakPolarHBondContact O-CB 3.47Å; S742-T746 PolarHBondContact O-N 2.89Å; S742-T746 PolarHBondContact O-OG1 3.28Å; S742-A816 PolarHBondContact OG-O 3.03Å; S742-L820 WeakPolarHBondContact OG-CG 3.41Å; S742-H832 PolarHBondContact OG-NE2 3.49Å; S742-H832 VanDerWaalsContact OG-NE2 3.14Å
743	Q	92.4	Very high	88.5	Confident	50 Å²	50	23.9 Å²	23.9	23%	0.234	12%	0.123	C	C	.	.	H	α-helix	trans	-64.8	-40.8	175.5	-68.5	171.7	-13.6	0	0	112.2	Y697 L739 F740 L741 T746 L747	Y697-Q743 HydrophobicContact CE2-CB 4.44Å; L739-Q743 WeakPolarHBondContact O-CG 3.38Å; L739-Q743 PolarHBondContact O-N 3.36Å; F740-Q743 WeakPolarHBondContact O-CB 3.45Å; F740-Q743 PolarHBondContact O-N 3.49Å; F740-Q743 VanDerWaalsContact O-N 3.14Å; L741-Q743 VanDerWaalsContact C-N 3.31Å; L741-Q743 PolarHBondContact O-N 3.43Å; Q743-T746 PolarHBondContact O-N 2.92Å; Q743-L747 PolarHBondContact O-N 2.87Å
744	Y	94.6	Very high	89.7	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-65.1	-44.7	179.4	-61.4	-8.2	0	0	0	111.7	S693 K694 Y697 I716 L720 H723 F740 L741 T746 L747 C748	S693-Y744 WeakPolarHBondContact OG-CE2 3.46Å; S693-Y744 PolarHBondContact OG-OH 3Å; K694-Y744 PolarHBondContact N-OH 3.28Å; Y697-Y744 HydrophobicContact CD1-CE1 4.12Å; Y697-Y744 AromaticContact CD2-CD1 3.24Å; Y697-Y744 HydrophobicContact CD2-CD1 3.24Å; Y697-Y744 AromaticContact CD2-CE1 3.61Å; Y697-Y744 HydrophobicContact CD2-CE1 3.61Å; Y697-Y744 HydrophobicContact CD2-CG 4.28Å; Y697-Y744 AromaticContact CE2-CD1 3.8Å; Y697-Y744 HydrophobicContact CE2-CD1 3.8Å; Y697-Y744 HydrophobicContact CE2-CE1 4.34Å; Y697-Y744 AromaticContact CG-CD1 3.65Å; Y697-Y744 HydrophobicContact CG-CD1 3.65Å; Y697-Y744 AromaticContact CG-CE1 3.47Å; Y697-Y744 HydrophobicContact CG-CE1 3.47Å; Y697-Y744 VanDerWaalsContact CG-CE1 3.47Å; I716-Y744 HydrophobicContact CD1-CG 4.5Å; L720-Y744 HydrophobicContact CD2-CD2 4.31Å; H723-Y744 HydrophobicContact CB-CD2 4.35Å; H723-Y744 HydrophobicContact CB-CE2 4.2Å; H723-Y744 AromaticContact ND1-CE2 3.65Å; F740-Y744 HydrophobicContact CB-CE1 4.15Å; F740-Y744 HydrophobicContact CB-CE2 4.38Å; F740-Y744 WeakPolarHBondContact O-CD1 3.36Å; F740-Y744 PolarHBondContact O-N 3.4Å; L741-Y744 PolarHBondContact O-N 3.43Å; Y744-T746 VanDerWaalsContact C-N 3.32Å; Y744-L747 PolarHBondContact O-N 3.07Å; Y744-C748 VanDerWaalsContact O-CB 3.32Å; Y744-C748 WeakPolarHBondContact O-CB 3.26Å; Y744-C748 PolarHBondContact O-N 3.37Å
745	L	94.5	Very high	90.6	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-66.1	-36.9	176.4	-70.7	169.2	0	0	0	111.4	L720 L741 C748 G749 F792 C812 A815 A816 I819	L720-L745 HydrophobicContact CD2-CD2 4.36Å; L741-L745 HydrophobicContact CD1-CD1 4.21Å; L741-L745 HydrophobicContact CD1-CG 4.24Å; L741-L745 HydrophobicContact CG-CD1 4.07Å; L741-L745 WeakPolarHBondContact O-CG 3.29Å; L741-L745 PolarHBondContact O-N 2.91Å; L745-C748 PolarHBondContact O-N 3.47Å; L745-G749 PolarHBondContact O-N 3.33Å; L745-F792 HydrophobicContact CD2-CD1 4.19Å; L745-C812 WeakPolarHBondContact O-CB 3.42Å; L745-A815 HydrophobicContact CD1-CB 3.88Å; L745-A816 HydrophobicContact CB-CB 4.13Å; L745-I819 HydrophobicContact CD1-CD1 3.57Å
746	T	95.1	Very high	91.3	Very high	4 Å²	4	18.6 Å²	18.6	3%	0.025	9%	0.092	C	C	.	.	H	α-helix	trans	-62.7	-48.2	174.7	-56.2	0	0	0	0	111.2	S742 Q743 Y744 C748 G749 D750 Y813 V836	S742-T746 WeakPolarHBondContact O-CB 3.47Å; S742-T746 PolarHBondContact O-N 2.89Å; S742-T746 PolarHBondContact O-OG1 3.28Å; Q743-T746 PolarHBondContact O-N 2.92Å; Y744-T746 VanDerWaalsContact C-N 3.32Å; T746-C748 VanDerWaalsContact C-N 3.34Å; T746-C748 PolarHBondContact O-N 2.89Å; T746-G749 PolarHBondContact O-N 3.3Å; T746-D750 PolarHBondContact O-N 3.05Å; T746-Y813 HydrophobicContact CG2-CD1 4.26Å; T746-Y813 HydrophobicContact CG2-CE1 4.15Å; T746-Y813 WeakPolarHBondContact O-CE1 3.37Å; T746-V836 HydrophobicContact CG2-CG2 4.29Å; T746-V836 WeakPolarHBondContact OG1-CG2 3.29Å
747	L	95.8	Very high	91.8	Very high	8 Å²	8	17 Å²	17	4%	0.042	8%	0.084	C	C	.	.	H	α-helix	trans	-63.7	-39.4	176.7	-177.7	61.3	0	0	0	111.9	Y697 D701 M704 I716 Q743 Y744 G749 D750 I751	Y697-L747 HydrophobicContact CD2-CD2 3.63Å; Y697-L747 HydrophobicContact CE2-CB 3.9Å; Y697-L747 HydrophobicContact CE2-CD2 3.43Å; Y697-L747 VanDerWaalsContact CE2-CD2 3.43Å; Y697-L747 HydrophobicContact CE2-CG 4.29Å; D701-L747 HydrophobicContact CB-CD2 4.15Å; M704-L747 HydrophobicContact CG-CD1 3.96Å; I716-L747 HydrophobicContact CD1-CB 4.47Å; I716-L747 HydrophobicContact CD1-CD2 4.14Å; Q743-L747 PolarHBondContact O-N 2.87Å; Y744-L747 PolarHBondContact O-N 3.07Å; L747-G749 VanDerWaalsContact C-N 3.32Å; L747-G749 PolarHBondContact O-N 3.39Å; L747-D750 PolarHBondContact O-N 2.93Å; L747-I751 HydrophobicContact CD1-CD1 4.5Å; L747-I751 HydrophobicContact CG-CD1 4Å; L747-I751 WeakPolarHBondContact O-CD1 3.28Å; L747-I751 VanDerWaalsContact O-CG1 3.24Å; L747-I751 WeakPolarHBondContact O-CG1 3.47Å; L747-I751 PolarHBondContact O-N 2.98Å
748	C	96.1	Very high	92	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-59.8	-43.3	174	-166.4	0	0	0	0	111.5	I716 L720 Y744 L745 T746 I751 Q752 A795	I716-C748 HydrophobicContact CG1-CB 4Å; I716-C748 HydrophobicContact CG2-CB 4.35Å; L720-C748 HydrophobicContact CD1-CB 4.45Å; Y744-C748 VanDerWaalsContact O-CB 3.32Å; Y744-C748 WeakPolarHBondContact O-CB 3.26Å; Y744-C748 PolarHBondContact O-N 3.37Å; L745-C748 PolarHBondContact O-N 3.47Å; T746-C748 VanDerWaalsContact C-N 3.34Å; T746-C748 PolarHBondContact O-N 2.89Å; C748-I751 PolarHBondContact O-N 3.33Å; C748-Q752 VanDerWaalsContact O-CG 3.3Å; C748-Q752 WeakPolarHBondContact O-CG 3.3Å; C748-Q752 PolarHBondContact O-N 2.99Å; C748-A795 PolarHBondContact SG-O 2.99Å
749	G	95.4	Very high	92	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-60.2	-43.6	173.6	0	0	0	0	0	112.8	L745 T746 L747 Q752 L753 S809 Y813	L745-G749 PolarHBondContact O-N 3.33Å; T746-G749 PolarHBondContact O-N 3.3Å; L747-G749 VanDerWaalsContact C-N 3.32Å; L747-G749 PolarHBondContact O-N 3.39Å; G749-Q752 PolarHBondContact O-N 3.39Å; G749-L753 PolarHBondContact O-N 3.25Å; G749-S809 WeakPolarHBondContact O-CB 3.4Å; G749-S809 PolarHBondContact O-OG 2.97Å; G749-Y813 PolarHBondContact O-OH 3.26Å
750	D	95.5	Very high	91.9	Very high	31 Å²	31	28.1 Å²	28.1	17%	0.166	15%	0.151	C	C	.	.	H	α-helix	trans	-61.8	-46.2	177	-73	-24.2	0	0	0	110.1	M704 T746 L747 Q752 L753 M754 Y813 R839	M704-D750 HydrophobicContact CE-CB 3.87Å; T746-D750 PolarHBondContact O-N 3.05Å; L747-D750 PolarHBondContact O-N 2.93Å; D750-Q752 PolarHBondContact O-N 3.44Å; D750-L753 PolarHBondContact O-N 3.15Å; D750-M754 WeakPolarHBondContact O-CG 3.49Å; D750-M754 PolarHBondContact O-N 3.1Å; D750-Y813 VanDerWaalsContact CA-OH 3.3Å; D750-Y813 WeakPolarHBondContact CA-OH 3.43Å; D750-Y813 PolarHBondContact N-OH 3.24Å; D750-Y813 PolarHBondContact OD1-OH 2.87Å; D750-R839 VanDerWaalsContact OD1-CD 3.26Å; D750-R839 WeakPolarHBondContact OD1-CD 3.46Å; D750-R839 IonicContact OD1-CZ 3.58Å; D750-R839 IonicContact OD1-NE 3.94Å; D750-R839 PolarHBondContact OD1-NE 3.17Å; D750-R839 IonicContact OD2-CZ 2.75Å; D750-R839 IonicContact OD2-NE 3.5Å; D750-R839 PolarHBondContact OD2-NE 3.08Å; D750-R839 IonicContact OD2-NH2 3.96Å; D750-R839 PolarHBondContact OD2-NH2 3.38Å
751	I	95.1	Very high	91.8	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-59.2	-47.9	177.4	-66.5	156.1	0	0	0	111.3	S700 M704 A712 L713 I716 L747 C748 L753 M754 L755	S700-I751 WeakPolarHBondContact OG-CD1 3.39Å; M704-I751 HydrophobicContact CE-CB 4.44Å; M704-I751 HydrophobicContact CE-CG1 3.87Å; M704-I751 HydrophobicContact CG-CD1 4.17Å; M704-I751 HydrophobicContact CG-CG1 3.51Å; M704-I751 HydrophobicContact SD-CB 4.01Å; M704-I751 HydrophobicContact SD-CD1 4.46Å; M704-I751 HydrophobicContact SD-CG1 3.25Å; M704-I751 WeakPolarHBondContact SD-CG1 3.43Å; M704-I751 HydrophobicContact SD-CG2 4.47Å; A712-I751 HydrophobicContact CB-CD1 4.01Å; A712-I751 HydrophobicContact CB-CG1 4.03Å; A712-I751 HydrophobicContact CB-CG2 4.5Å; L713-I751 HydrophobicContact CB-CG2 3.74Å; L713-I751 HydrophobicContact CD1-CG2 3.94Å; L713-I751 HydrophobicContact CG-CG2 4.39Å; I716-I751 HydrophobicContact CB-CD1 3.95Å; I716-I751 HydrophobicContact CG1-CD1 4.5Å; I716-I751 HydrophobicContact CG2-CD1 3.66Å; L747-I751 HydrophobicContact CD1-CD1 4.5Å; L747-I751 HydrophobicContact CG-CD1 4Å; L747-I751 WeakPolarHBondContact O-CD1 3.28Å; L747-I751 VanDerWaalsContact O-CG1 3.24Å; L747-I751 WeakPolarHBondContact O-CG1 3.47Å; L747-I751 PolarHBondContact O-N 2.98Å; C748-I751 PolarHBondContact O-N 3.33Å; I751-L753 VanDerWaalsContact C-N 3.32Å; I751-L753 PolarHBondContact O-N 3.24Å; I751-M754 PolarHBondContact O-N 3.48Å; I751-L755 HydrophobicContact CG2-CD1 3.95Å; I751-L755 HydrophobicContact CG2-CG 4.46Å; I751-L755 WeakPolarHBondContact O-CG 3.15Å; I751-L755 PolarHBondContact O-N 2.7Å
752	Q	94.4	Very high	91.4	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-64.1	-37	-179.3	-69.6	-73.5	9.3	0	0	112	L713 C748 G749 D750 A756 A795 V808	L713-Q752 HydrophobicContact CD1-CG 4.49Å; C748-Q752 VanDerWaalsContact O-CG 3.3Å; C748-Q752 WeakPolarHBondContact O-CG 3.3Å; C748-Q752 PolarHBondContact O-N 2.99Å; G749-Q752 PolarHBondContact O-N 3.39Å; D750-Q752 PolarHBondContact O-N 3.44Å; Q752-A756 WeakPolarHBondContact O-CB 3.49Å; Q752-A756 PolarHBondContact O-N 3.12Å; Q752-A795 PolarHBondContact NE2-O 3.48Å; Q752-V808 HydrophobicContact CG-CG1 4.17Å
753	L	93.8	Very high	91.2	Very high	23 Å²	23	38.1 Å²	38.1	12%	0.12	21%	0.212	C	C	.	.	H	α-helix	trans	-65.5	-45.1	173.4	174	56.5	0	0	0	111.5	G749 D750 I751 L755 A756 Q757 L806 I843	G749-L753 PolarHBondContact O-N 3.25Å; D750-L753 PolarHBondContact O-N 3.15Å; I751-L753 VanDerWaalsContact C-N 3.32Å; I751-L753 PolarHBondContact O-N 3.24Å; L753-L755 VanDerWaalsContact C-N 3.32Å; L753-L755 PolarHBondContact O-N 3.34Å; L753-A756 WeakPolarHBondContact O-CB 3.4Å; L753-A756 PolarHBondContact O-N 3.14Å; L753-A756 VanDerWaalsContact O-N 3.17Å; L753-Q757 HydrophobicContact CD1-CG 4.23Å; L753-Q757 WeakPolarHBondContact O-CG 3.49Å; L753-Q757 PolarHBondContact O-N 3.36Å; L753-L806 HydrophobicContact CD1-CD2 3.99Å; L753-I843 HydrophobicContact CB-CD1 4.45Å; L753-I843 HydrophobicContact CD1-CD1 3.71Å; L753-I843 HydrophobicContact CD2-CD1 4.4Å; L753-I843 HydrophobicContact CG-CD1 4.4Å
754	M	93.4	Very high	91	Very high	50 Å²	50	38 Å²	38	25%	0.246	22%	0.22	C	C	.	.	H	α-helix	trans	-64.8	-36.4	178.3	-67.7	-49.5	-62	0	0	112.4	M704 Y709 D750 I751 Q757 N758	M704-M754 HydrophobicContact CE-CG 3.87Å; Y709-M754 HydrophobicContact CD1-CB 3.7Å; Y709-M754 HydrophobicContact CD1-CG 4.36Å; Y709-M754 HydrophobicContact CD2-CB 4.25Å; Y709-M754 HydrophobicContact CE1-CB 3.58Å; Y709-M754 HydrophobicContact CE1-CE 4.27Å; Y709-M754 HydrophobicContact CE1-CG 3.88Å; Y709-M754 HydrophobicContact CE2-CB 4.14Å; Y709-M754 HydrophobicContact CE2-CE 4.4Å; Y709-M754 HydrophobicContact CG-CB 4.05Å; Y709-M754 WeakPolarHBondContact OH-CE 3.48Å; D750-M754 WeakPolarHBondContact O-CG 3.49Å; D750-M754 PolarHBondContact O-N 3.1Å; I751-M754 PolarHBondContact O-N 3.48Å; M754-Q757 PolarHBondContact O-N 3.11Å; M754-N758 WeakPolarHBondContact O-CB 3.45Å; M754-N758 PolarHBondContact O-N 2.85Å; M754-N758 PolarHBondContact O-ND2 3.06Å
755	L	91.4	Very high	90.8	Very high	7 Å²	7	38.7 Å²	38.7	4%	0.037	22%	0.222	C	C	.	.	H	α-helix	trans	-63.8	-39.6	172.5	-75.2	168.1	0	0	0	112.2	L713 I751 L753 N758 H765 L798	L713-L755 HydrophobicContact CB-CD1 4.39Å; L713-L755 HydrophobicContact CD2-CD1 3.79Å; I751-L755 HydrophobicContact CG2-CD1 3.95Å; I751-L755 HydrophobicContact CG2-CG 4.46Å; I751-L755 WeakPolarHBondContact O-CG 3.15Å; I751-L755 PolarHBondContact O-N 2.7Å; L753-L755 VanDerWaalsContact C-N 3.32Å; L753-L755 PolarHBondContact O-N 3.34Å; L755-N758 PolarHBondContact O-N 2.89Å; L755-H765 HydrophobicContact CD2-CB 3.87Å; L755-L798 HydrophobicContact CD1-CD1 3.91Å
756	A	90.5	Very high	90.5	Very high	8 Å²	8	41.3 Å²	41.3	7%	0.066	24%	0.236	C	C	.	.	H	α-helix	trans	-64.4	-40.9	176	0	0	0	0	0	112	Q752 L753 L802 Q805 L806	Q752-A756 WeakPolarHBondContact O-CB 3.49Å; Q752-A756 PolarHBondContact O-N 3.12Å; L753-A756 WeakPolarHBondContact O-CB 3.4Å; L753-A756 PolarHBondContact O-N 3.14Å; L753-A756 VanDerWaalsContact O-N 3.17Å; A756-L802 HydrophobicContact CB-CD1 3.51Å; A756-L802 VanDerWaalsContact O-CD1 3.29Å; A756-L802 WeakPolarHBondContact O-CD1 3.36Å; A756-Q805 HydrophobicContact CB-CB 4.22Å; A756-L806 HydrophobicContact CB-CD2 3.71Å; A756-L806 HydrophobicContact CB-CG 4.08Å
757	Q	89.9	Confident	90.3	Very high	105 Å²	105	48.4 Å²	48.4	49%	0.491	27%	0.269	S	S	.	.	H	α-helix	trans	-71.8	-29.6	178	-70.4	179.7	-15.6	0	0	113.2	L753 M754	L753-Q757 HydrophobicContact CD1-CG 4.23Å; L753-Q757 WeakPolarHBondContact O-CG 3.49Å; L753-Q757 PolarHBondContact O-N 3.36Å; M754-Q757 PolarHBondContact O-N 3.11Å
758	N	87.7	Confident	90.1	Very high	54 Å²	54	50.3 Å²	50.3	29%	0.289	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	42.9	-177.1	-67.3	-77.9	0	0	0	113.1	Y709 M754 L755 N760 N761	Y709-N758 HydrophobicContact CD2-CB 4.46Å; Y709-N758 HydrophobicContact CE2-CB 4.32Å; Y709-N758 WeakPolarHBondContact CE2-ND2 3.4Å; M754-N758 WeakPolarHBondContact O-CB 3.45Å; M754-N758 PolarHBondContact O-N 2.85Å; M754-N758 PolarHBondContact O-ND2 3.06Å; L755-N758 PolarHBondContact O-N 2.89Å; N758-N760 PolarHBondContact O-N 3.41Å; N758-N761 PolarHBondContact O-N 3.25Å
759	A	82.3	Confident	89.9	Confident	51 Å²	51	51.4 Å²	51.4	42%	0.421	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-57.8	-19.7	-178.7	0	0	0	0	0	114.4	N761 R762	A759-N761 PolarHBondContact O-N 2.94Å; A759-R762 WeakPolarHBondContact O-CB 3.42Å
760	N	83.6	Confident	89.6	Confident	161 Å²	161	57.7 Å²	57.7	86%	0.861	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-69.6	-27.9	-179.2	-63	-19.6	0	0	0	113.7	N758	N758-N760 PolarHBondContact O-N 3.41Å
761	N	85	Confident	89.3	Confident	102 Å²	102	63.3 Å²	63.3	55%	0.545	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-100.7	24.8	-177.3	-74.8	-18.3	0	0	0	113.4	N758 A759 A763 A764 H765	N758-N761 PolarHBondContact O-N 3.25Å; A759-N761 PolarHBondContact O-N 2.94Å; N761-A763 VanDerWaalsContact C-N 3.35Å; N761-A763 PolarHBondContact O-N 3.42Å; N761-A764 PolarHBondContact O-N 3.39Å; N761-H765 PolarHBondContact O-CD2 3.44Å; N761-H765 PolarHBondContact O-N 2.92Å
762	R	82.6	Confident	88.9	Confident	68 Å²	68	66.5 Å²	66.5	26%	0.257	35%	0.347	S	S	.	.	H	α-helix	trans	-55.9	-40.5	-169.8	-171	178.9	-173.2	89.6	50.6	115.1	A759 H765 L766 S799 T800	A759-R762 WeakPolarHBondContact O-CB 3.42Å; R762-H765 PolarHBondContact O-N 3.14Å; R762-L766 HydrophobicContact CG-CD1 4.15Å; R762-L766 WeakPolarHBondContact O-CG 3.46Å; R762-L766 PolarHBondContact O-N 3.33Å; R762-S799 PolarHBondContact NH2-O 3.48Å; R762-T800 VanDerWaalsContact CZ-CA 3.42Å; R762-T800 PolarHBondContact NH1-O 3.32Å
763	A	86.4	Confident	88.7	Confident	78 Å²	78	67.2 Å²	67.2	65%	0.645	35%	0.351	S	S	*	.	H	α-helix	trans	-64.9	-42.3	-177.8	0	0	0	0	0	112	N761 L766 E767	N761-A763 VanDerWaalsContact C-N 3.35Å; N761-A763 PolarHBondContact O-N 3.42Å; A763-L766 PolarHBondContact O-N 3.28Å; A763-E767 PolarHBondContact O-N 3.1Å
764	A	88.3	Confident	88.5	Confident	48 Å²	48	73.8 Å²	73.8	40%	0.397	38%	0.378	S	S	.	.	H	α-helix	trans	-63.1	-44.9	176.6	0	0	0	0	0	111.1	N761 L766 E767 E768	N761-A764 PolarHBondContact O-N 3.39Å; A764-L766 VanDerWaalsContact C-N 3.32Å; A764-L766 PolarHBondContact O-N 3.48Å; A764-E767 PolarHBondContact O-N 3.02Å; A764-E768 WeakPolarHBondContact O-CB 3.44Å; A764-E768 VanDerWaalsContact O-CG 3.3Å; A764-E768 WeakPolarHBondContact O-CG 3.26Å; A764-E768 PolarHBondContact O-N 3.45Å
765	H	89.8	Confident	88.3	Confident	13 Å²	13	75.6 Å²	75.6	6%	0.06	39%	0.386	C	S	.	.	H	α-helix	trans	-64	-35.4	177.2	-62.6	-39.3	0	0	0	113.1	Y709 G710 L755 N761 R762 E768 F769	Y709-H765 AromaticContact CD2-CE1 3.71Å; Y709-H765 AromaticContact CD2-NE2 3.76Å; G710-H765 WeakPolarHBondContact CA-O 3.41Å; L755-H765 HydrophobicContact CD2-CB 3.87Å; N761-H765 PolarHBondContact O-CD2 3.44Å; N761-H765 PolarHBondContact O-N 2.92Å; R762-H765 PolarHBondContact O-N 3.14Å; H765-E768 IonicContact ND1-OE2 2.74Å; H765-E768 PolarHBondContact ND1-OE2 3.27Å; H765-F769 VanDerWaalsContact O-CB 3.25Å; H765-F769 WeakPolarHBondContact O-CB 3.35Å; H765-F769 PolarHBondContact O-N 3.22Å
766	L	89.5	Confident	88.3	Confident	56 Å²	56	75.5 Å²	75.5	29%	0.293	39%	0.386	S	S	.	.	H	α-helix	trans	-64	-44.3	173.9	-82.2	163.3	0	0	0	111.7	R762 A763 A764 F769 H770 L798	R762-L766 HydrophobicContact CG-CD1 4.15Å; R762-L766 WeakPolarHBondContact O-CG 3.46Å; R762-L766 PolarHBondContact O-N 3.33Å; A763-L766 PolarHBondContact O-N 3.28Å; A764-L766 VanDerWaalsContact C-N 3.32Å; A764-L766 PolarHBondContact O-N 3.48Å; L766-F769 PolarHBondContact O-N 3.46Å; L766-H770 PolarHBondContact O-N 3.04Å; L766-H770 PolarHBondContact O-ND1 3.22Å; L766-L798 HydrophobicContact CD2-CD2 3.38Å; L766-L798 HydrophobicContact CD2-CG 4.15Å; L766-L798 HydrophobicContact CG-CD2 3.88Å
767	E	90.4	Very high	88.4	Confident	153 Å²	153	80 Å²	80	72%	0.715	41%	0.406	S	S	*	.	H	α-helix	trans	-63.6	-47.6	177.2	-173.5	178	-177.6	0	0	111.5	A763 A764 F769 H770 Y771	A763-E767 PolarHBondContact O-N 3.1Å; A764-E767 PolarHBondContact O-N 3.02Å; E767-F769 VanDerWaalsContact C-N 3.25Å; E767-F769 PolarHBondContact O-N 2.99Å; E767-H770 PolarHBondContact O-N 3.01Å; E767-Y771 PolarHBondContact O-N 3.22Å
768	E	91.1	Very high	88.5	Confident	48 Å²	48	79 Å²	79	22%	0.224	40%	0.401	C	S	.	.	H	α-helix	trans	-59	-35.3	176.9	-72.2	179.6	152.1	0	0	113.1	G710 R711 R714 A764 H765	G710-E768 PolarHBondContact N-OE2 2.99Å; R711-E768 HydrophobicContact CB-CB 4.13Å; R714-E768 PolarHBondContact NH1-O 3.36Å; A764-E768 WeakPolarHBondContact O-CB 3.44Å; A764-E768 VanDerWaalsContact O-CG 3.3Å; A764-E768 WeakPolarHBondContact O-CG 3.26Å; A764-E768 PolarHBondContact O-N 3.45Å; H765-E768 IonicContact ND1-OE2 2.74Å; H765-E768 PolarHBondContact ND1-OE2 3.27Å
769	F	91.7	Very high	88.7	Confident	23 Å²	23	76.5 Å²	76.5	10%	0.101	39%	0.387	C	S	.	.	H	α-helix	trans	-70.3	-40.7	178.9	178.4	-105	0	0	0	112.5	G710 L713 R714 K717 H765 L766 E767 L798	G710-F769 WeakPolarHBondContact O-CA 3.3Å; L713-F769 HydrophobicContact CB-CD2 4.03Å; L713-F769 HydrophobicContact CB-CE2 4.31Å; L713-F769 HydrophobicContact CD2-CD2 3.92Å; L713-F769 HydrophobicContact CD2-CE2 3.82Å; L713-F769 HydrophobicContact CG-CD2 3.97Å; L713-F769 HydrophobicContact CG-CE2 3.78Å; R714-F769 HydrophobicContact CB-CD2 4.16Å; R714-F769 WeakPolarHBondContact CD-O 3.44Å; K717-F769 HydrophobicContact CD-CE2 4.24Å; K717-F769 HydrophobicContact CD-CZ 4.08Å; H765-F769 VanDerWaalsContact O-CB 3.25Å; H765-F769 WeakPolarHBondContact O-CB 3.35Å; H765-F769 PolarHBondContact O-N 3.22Å; L766-F769 PolarHBondContact O-N 3.46Å; E767-F769 VanDerWaalsContact C-N 3.25Å; E767-F769 PolarHBondContact O-N 2.99Å; F769-L798 HydrophobicContact CB-CD2 4.22Å; F769-L798 HydrophobicContact CD1-CB 4.44Å; F769-L798 HydrophobicContact CD1-CD2 4.29Å; F769-L798 HydrophobicContact CE1-CB 4.33Å; F769-L798 HydrophobicContact CG-CD2 4.24Å
770	H	89.8	Confident	89.1	Confident	131 Å²	131	75.3 Å²	75.3	61%	0.606	37%	0.374	S	S	*	.	H	α-helix	trans	-83.2	-19.4	-177.6	-68.7	98.6	0	0	0	114	L766 E767 Q772	L766-H770 PolarHBondContact O-N 3.04Å; L766-H770 PolarHBondContact O-ND1 3.22Å; E767-H770 PolarHBondContact O-N 3.01Å; H770-Q772 PolarHBondContact O-N 3.34Å
771	Y	89.5	Confident	89.4	Confident	150 Å²	150	74.3 Å²	74.3	59%	0.588	36%	0.364	S	S	*	.			trans	-60.4	130.8	175.2	-178.3	-92	0	0	0	110	R714 E767 T773	R714-Y771 WeakPolarHBondContact CD-O 3.38Å; R714-Y771 VanDerWaalsContact CZ-O 3.25Å; R714-Y771 PolarHBondContact NE-O 2.9Å; R714-Y771 PolarHBondContact NH1-O 3Å; E767-Y771 PolarHBondContact O-N 3.22Å; Y771-T773 HydrophobicContact CE1-CG2 4.06Å
772	Q	86.3	Confident	89.6	Confident	67 Å²	67	69.7 Å²	69.7	31%	0.313	34%	0.339	S	S	.	.			trans	-139	132.7	178.6	-164.9	175.7	17.9	0	0	109.6	H770 D776 Q777	H770-Q772 PolarHBondContact O-N 3.34Å; Q772-D776 HydrophobicContact CG-CB 3.56Å; Q772-Q777 HydrophobicContact CB-CG 4.39Å; Q772-Q777 VanDerWaalsContact CD-CG 3.47Å; Q772-Q777 HydrophobicContact CG-CG 3.8Å
773	T	89.1	Confident	90	Very high	15 Å²	15	66.5 Å²	66.5	9%	0.092	33%	0.327	C	S	.	.			trans	-77.5	163.1	177	67.9	0	0	0	0	110.7	Y771 E775 D776 Q777	Y771-T773 HydrophobicContact CE1-CG2 4.06Å; T773-E775 VanDerWaalsContact C-N 3.25Å; T773-E775 WeakPolarHBondContact CB-OE2 3.39Å; T773-E775 PolarHBondContact O-N 3.37Å; T773-D776 WeakPolarHBondContact CB-OD2 3.4Å; T773-D776 PolarHBondContact N-OD2 3.33Å; T773-D776 PolarHBondContact O-N 3.3Å; T773-D776 PolarHBondContact OG1-N 3.34Å; T773-D776 PolarHBondContact OG1-OD1 2.83Å; T773-D776 PolarHBondContact OG1-OD2 3.09Å; T773-Q777 WeakPolarHBondContact O-CG 3.4Å; T773-Q777 PolarHBondContact O-N 3.08Å; T773-Q777 VanDerWaalsContact O-N 3.14Å
774	K	90.1	Very high	90	Very high	161 Å²	161	66.7 Å²	66.7	70%	0.7	32%	0.315	S	S	*	.	H	α-helix	trans	-63.1	-38.8	177.8	-68.6	-176.9	-180	179.5	0	110.6	Q777 E778	K774-Q777 PolarHBondContact O-N 2.98Å; K774-E778 WeakPolarHBondContact O-CG 3.38Å; K774-E778 PolarHBondContact O-N 3.45Å
775	E	89.3	Confident	89.8	Confident	88 Å²	88	67.9 Å²	67.9	41%	0.411	31%	0.309	S	S	.	.	H	α-helix	trans	-62.1	-45.6	177.4	-62.8	75.3	-168.8	0	0	111.1	L609 T773 Q777 E778 I779	L609-E775 HydrophobicContact CD2-CB 4.07Å; L609-E775 HydrophobicContact CD2-CG 4.1Å; T773-E775 VanDerWaalsContact C-N 3.25Å; T773-E775 WeakPolarHBondContact CB-OE2 3.39Å; T773-E775 PolarHBondContact O-N 3.37Å; E775-Q777 VanDerWaalsContact C-N 3.3Å; E775-Q777 PolarHBondContact O-N 3.07Å; E775-E778 PolarHBondContact O-N 3.27Å; E775-I779 WeakPolarHBondContact O-CG1 3.2Å; E775-I779 PolarHBondContact O-N 2.96Å
776	D	91.3	Very high	89.4	Confident	6 Å²	6	67.6 Å²	67.6	3%	0.032	31%	0.308	C	S	.	.	H	α-helix	trans	-60	-40.7	176.6	-59.9	-34.8	0	0	0	111.5	Y696 L718 Q772 T773 L780	Y696-D776 WeakPolarHBondContact CE1-OD1 3.27Å; Y696-D776 PolarHBondContact OH-OD1 2.92Å; Y696-D776 VanDerWaalsContact OH-OD1 3.08Å; L718-D776 HydrophobicContact CD1-CB 4Å; Q772-D776 HydrophobicContact CG-CB 3.56Å; T773-D776 WeakPolarHBondContact CB-OD2 3.4Å; T773-D776 PolarHBondContact N-OD2 3.33Å; T773-D776 PolarHBondContact O-N 3.3Å; T773-D776 PolarHBondContact OG1-N 3.34Å; T773-D776 PolarHBondContact OG1-OD1 2.83Å; T773-D776 PolarHBondContact OG1-OD2 3.09Å; D776-L780 VanDerWaalsContact O-CB 3.26Å; D776-L780 WeakPolarHBondContact O-CB 3.37Å; D776-L780 PolarHBondContact O-N 2.91Å
777	Q	92	Very high	89	Confident	103 Å²	103	65.2 Å²	65.2	48%	0.481	30%	0.296	S	S	.	.	H	α-helix	trans	-65.8	-43.3	179.1	-72.6	176	-6.8	0	0	112.1	Q772 T773 K774 E775 L780 H781	Q772-Q777 HydrophobicContact CB-CG 4.39Å; Q772-Q777 VanDerWaalsContact CD-CG 3.47Å; Q772-Q777 HydrophobicContact CG-CG 3.8Å; T773-Q777 WeakPolarHBondContact O-CG 3.4Å; T773-Q777 PolarHBondContact O-N 3.08Å; T773-Q777 VanDerWaalsContact O-N 3.14Å; K774-Q777 PolarHBondContact O-N 2.98Å; E775-Q777 VanDerWaalsContact C-N 3.3Å; E775-Q777 PolarHBondContact O-N 3.07Å; Q777-L780 PolarHBondContact O-N 3.04Å; Q777-H781 WeakPolarHBondContact O-CB 3.39Å; Q777-H781 PolarHBondContact O-N 3.33Å
778	E	92.1	Very high	88.3	Confident	83 Å²	83	61.5 Å²	61.5	39%	0.388	29%	0.287	S	S	.	.	H	α-helix	trans	-70.9	-38.7	-179.8	-68.6	-177.9	178.9	0	0	112.3	L609 K613 K774 E775 H781 S782	L609-E778 HydrophobicContact CD1-CB 3.59Å; L609-E778 HydrophobicContact CD2-CB 4.35Å; L609-E778 WeakPolarHBondContact CD2-OE2 3.38Å; K613-E778 WeakPolarHBondContact CE-OE2 3.49Å; K613-E778 IonicContact NZ-OE1 2.68Å; K613-E778 IonicContact NZ-OE2 3.85Å; K613-E778 PolarHBondContact NZ-OE2 3.45Å; K774-E778 WeakPolarHBondContact O-CG 3.38Å; K774-E778 PolarHBondContact O-N 3.45Å; E775-E778 PolarHBondContact O-N 3.27Å; E778-H781 PolarHBondContact O-N 2.7Å; E778-S782 PolarHBondContact O-N 3.19Å; E778-S782 VanDerWaalsContact O-N 3.09Å
779	I	92.9	Very high	87.7	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-61.2	-47.8	172.4	-67.8	172.5	0	0	0	109.4	L605 L609 L612 Y696 E775 H781 S782 L783	L605-I779 HydrophobicContact CB-CD1 4.21Å; L605-I779 HydrophobicContact CD2-CD1 3.96Å; L609-I779 HydrophobicContact CB-CD1 4.26Å; L609-I779 HydrophobicContact CB-CG1 4.01Å; L609-I779 HydrophobicContact CD1-CG1 3.94Å; L609-I779 HydrophobicContact CG-CG1 4.44Å; L612-I779 HydrophobicContact CD1-CG2 4.34Å; Y696-I779 HydrophobicContact CE2-CG2 4.35Å; Y696-I779 WeakPolarHBondContact OH-CD1 2.96Å; E775-I779 WeakPolarHBondContact O-CG1 3.2Å; E775-I779 PolarHBondContact O-N 2.96Å; I779-H781 VanDerWaalsContact C-N 3.28Å; I779-H781 PolarHBondContact O-N 3.48Å; I779-S782 WeakPolarHBondContact O-CB 3.36Å; I779-S782 PolarHBondContact O-N 2.97Å; I779-S782 VanDerWaalsContact O-N 3.07Å; I779-L783 HydrophobicContact CG2-CD1 4.24Å; I779-L783 HydrophobicContact CG2-CG 4.44Å; I779-L783 WeakPolarHBondContact O-CG 3.48Å; I779-L783 PolarHBondContact O-N 3.44Å
780	L	90.6	Very high	87.1	Confident	26 Å²	26	65 Å²	65	14%	0.136	30%	0.304	C	S	.	.	H	α-helix	trans	-60.5	-37.8	178.5	-173.1	65.7	0	0	0	112.2	L718 D776 Q777 S782 L783 H784	L718-L780 HydrophobicContact CD2-CD1 4.34Å; D776-L780 VanDerWaalsContact O-CB 3.26Å; D776-L780 WeakPolarHBondContact O-CB 3.37Å; D776-L780 PolarHBondContact O-N 2.91Å; Q777-L780 PolarHBondContact O-N 3.04Å; L780-S782 VanDerWaalsContact C-N 3.34Å; L780-S782 PolarHBondContact O-N 2.95Å; L780-L783 PolarHBondContact O-N 3.27Å; L780-H784 WeakPolarHBondContact O-CB 3.26Å; L780-H784 PolarHBondContact O-N 3.04Å
781	H	90.1	Very high	86.4	Confident	141 Å²	141	58.9 Å²	58.9	65%	0.653	28%	0.276	S	S	*	.	H	α-helix	trans	-61.8	-40.4	173.9	-177.7	-83.5	0	0	0	112.3	Q777 E778 I779 R785	Q777-H781 WeakPolarHBondContact O-CB 3.39Å; Q777-H781 PolarHBondContact O-N 3.33Å; E778-H781 PolarHBondContact O-N 2.7Å; I779-H781 VanDerWaalsContact C-N 3.28Å; I779-H781 PolarHBondContact O-N 3.48Å; H781-R785 PolarHBondContact O-N 3.14Å
782	S	89.6	Confident	86.3	Confident	4 Å²	4	52.1 Å²	52.1	3%	0.028	25%	0.25	C	S	.	.	H	α-helix	trans	-66.1	-36.1	175.1	-171.3	0	0	0	0	112.6	D616 E778 I779 L780 R785	D616-S782 WeakPolarHBondContact OD2-CB 3.5Å; D616-S782 PolarHBondContact OD2-OG 2.99Å; E778-S782 PolarHBondContact O-N 3.19Å; E778-S782 VanDerWaalsContact O-N 3.09Å; I779-S782 WeakPolarHBondContact O-CB 3.36Å; I779-S782 PolarHBondContact O-N 2.97Å; I779-S782 VanDerWaalsContact O-N 3.07Å; L780-S782 VanDerWaalsContact C-N 3.34Å; L780-S782 PolarHBondContact O-N 2.95Å; S782-R785 WeakPolarHBondContact O-CB 3.47Å
783	L	89.4	Confident	86.3	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-69.1	-44.5	175.5	-62.8	175.3	0	0	0	112.3	I689 S722 T725 I779 L780 R785 E786 S787	I689-L783 HydrophobicContact CB-CD2 4.42Å; I689-L783 HydrophobicContact CD1-CD2 3.93Å; I689-L783 HydrophobicContact CG1-CD2 3.74Å; I689-L783 HydrophobicContact CG2-CD2 3.92Å; S722-L783 WeakPolarHBondContact OG-CD1 3.38Å; T725-L783 HydrophobicContact CG2-CD2 4.11Å; I779-L783 HydrophobicContact CG2-CD1 4.24Å; I779-L783 HydrophobicContact CG2-CG 4.44Å; I779-L783 WeakPolarHBondContact O-CG 3.48Å; I779-L783 PolarHBondContact O-N 3.44Å; L780-L783 PolarHBondContact O-N 3.27Å; L783-R785 PolarHBondContact O-N 3.31Å; L783-E786 PolarHBondContact O-N 3.37Å; L783-S787 PolarHBondContact O-N 3.38Å; L783-S787 VanDerWaalsContact O-N 3.08Å
784	H	87.6	Confident	86.2	Confident	83 Å²	83	52.5 Å²	52.5	38%	0.384	25%	0.254	S	S	.	.	H	α-helix	trans	-63.4	-23.6	177.8	-74.4	164.3	0	0	0	113.6	L780 E786 S787 C789	L780-H784 WeakPolarHBondContact O-CB 3.26Å; L780-H784 PolarHBondContact O-N 3.04Å; H784-E786 PolarHBondContact O-N 2.92Å; H784-S787 VanDerWaalsContact CA-O 3.28Å; H784-S787 WeakPolarHBondContact CA-O 3.23Å; H784-C789 VanDerWaalsContact CD2-SG 3.54Å
785	R	83.4	Confident	86.1	Confident	72 Å²	72	44.9 Å²	44.9	27%	0.272	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-22.4	172.3	-168.9	-179.9	176.2	178.1	2.4	112.7	D616 Q672 S673 H781 S782 L783	D616-R785 PolarHBondContact O-NH1 3.01Å; D616-R785 IonicContact OD1-NH1 3.05Å; Q672-R785 WeakPolarHBondContact CB-O 3.3Å; S673-R785 PolarHBondContact OG-NE 3.09Å; S673-R785 PolarHBondContact OG-NH2 3.34Å; H781-R785 PolarHBondContact O-N 3.14Å; S782-R785 WeakPolarHBondContact O-CB 3.47Å; L783-R785 PolarHBondContact O-N 3.31Å
786	E	81.3	Confident	86.1	Confident	7 Å²	7	40.9 Å²	40.9	3%	0.033	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.6	-35.2	-176.5	-58.5	-55.2	155.8	0	0	113.5	S671 S673 K685 T725 L729 L783 H784	S671-E786 VanDerWaalsContact CB-OE2 3.3Å; S671-E786 WeakPolarHBondContact CB-OE2 3.36Å; S673-E786 WeakPolarHBondContact CB-OE1 3.47Å; K685-E786 HydrophobicContact CD-CG 4.35Å; K685-E786 IonicContact NZ-OE1 4Å; K685-E786 PolarHBondContact NZ-OE1 3.47Å; T725-E786 HydrophobicContact CG2-CB 3.72Å; T725-E786 HydrophobicContact CG2-CG 4.45Å; L729-E786 HydrophobicContact CD1-CB 4.4Å; L729-E786 HydrophobicContact CD1-CG 4.33Å; L729-E786 HydrophobicContact CD2-CB 4.36Å; L783-E786 PolarHBondContact O-N 3.37Å; H784-E786 PolarHBondContact O-N 2.92Å
787	S	81.1	Confident	85.9	Confident	6 Å²	6	44.7 Å²	44.7	4%	0.042	22%	0.222	C	C	.	.			trans	-147	155.5	-177.1	69.2	0	0	0	0	111.4	T725 L783 H784 C789	T725-S787 WeakPolarHBondContact CA-OG 3.44Å; T725-S787 WeakPolarHBondContact CB-OG 3.36Å; T725-S787 PolarHBondContact OG1-OG 3.31Å; L783-S787 PolarHBondContact O-N 3.38Å; L783-S787 VanDerWaalsContact O-N 3.08Å; H784-S787 VanDerWaalsContact CA-O 3.28Å; H784-S787 WeakPolarHBondContact CA-O 3.23Å; S787-C789 PolarHBondContact O-N 3.21Å; S787-C789 VanDerWaalsContact O-N 3.15Å; S787-C789 PolarHBondContact O-SG 2.85Å; S787-C789 PolarHBondContact OG-SG 3.41Å
788	S	76.4	Confident	85.4	Confident	76 Å²	76	41.4 Å²	41.4	53%	0.531	21%	0.208	S	C	.	.			trans	-66.9	-13	175.8	58	0	0	0	0	113.7	Q790	S788-Q790 WeakPolarHBondContact O-CG 3.49Å; S788-Q790 PolarHBondContact O-N 2.98Å
789	C	77.8	Confident	84.9	Confident	5 Å²	5	39 Å²	39	3%	0.034	20%	0.2	C	C	.	.			trans	54.4	33.2	-179.6	-58.8	0	0	0	0	113.6	Q721 D724 T725 H784 S787	Q721-C789 HydrophobicContact CB-CB 3.98Å; Q721-C789 HydrophobicContact CG-CB 3.95Å; Q721-C789 PolarHBondContact NE2-O 3.27Å; D724-C789 VanDerWaalsContact OD2-CA 3.28Å; D724-C789 WeakPolarHBondContact OD2-CA 3.25Å; T725-C789 PolarHBondContact OG1-SG 3.47Å; H784-C789 VanDerWaalsContact CD2-SG 3.54Å; S787-C789 PolarHBondContact O-N 3.21Å; S787-C789 VanDerWaalsContact O-N 3.15Å; S787-C789 PolarHBondContact O-SG 2.85Å; S787-C789 PolarHBondContact OG-SG 3.41Å
790	Q	79.2	Confident	84.1	Confident	139 Å²	139	44.3 Å²	44.3	65%	0.65	23%	0.233	S	C	*	.			trans	-102.8	-3.3	-176.8	-68.5	-170	-8	0	0	113.4	D724 S788 F792 A793	D724-Q790 PolarHBondContact OD2-N 3.24Å; S788-Q790 WeakPolarHBondContact O-CG 3.49Å; S788-Q790 PolarHBondContact O-N 2.98Å; Q790-F792 PolarHBondContact O-N 3.48Å; Q790-F792 VanDerWaalsContact O-N 3.1Å; Q790-A793 WeakPolarHBondContact O-CB 3.4Å; Q790-A793 PolarHBondContact O-N 3.41Å; Q790-A793 VanDerWaalsContact O-N 3.1Å
791	G	76.3	Confident	84	Confident	2 Å²	2	46.8 Å²	46.8	2%	0.021	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-23.1	-166.9	0	0	0	0	0	115.9	S663 D724	S663-G791 WeakPolarHBondContact OG-CA 3.29Å; D724-G791 PolarHBondContact OD2-N 2.96Å
792	F	86.1	Confident	83.9	Confident	9 Å²	9	43 Å²	43	4%	0.039	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119	19.3	176.8	-55.6	-75.5	0	0	0	113.2	L658 L720 D724 L741 L745 Q790 W794 A795 T796	L658-F792 HydrophobicContact CD2-CE1 4.36Å; L658-F792 HydrophobicContact CD2-CZ 3.98Å; L720-F792 HydrophobicContact CB-CB 4.09Å; L720-F792 HydrophobicContact CB-CD2 4.25Å; L720-F792 HydrophobicContact CB-CG 4.39Å; L720-F792 HydrophobicContact CD1-CB 4.18Å; L720-F792 HydrophobicContact CD2-CB 4.47Å; L720-F792 HydrophobicContact CD2-CD2 4.24Å; L720-F792 HydrophobicContact CD2-CG 4.17Å; L720-F792 HydrophobicContact CG-CB 4.49Å; D724-F792 HydrophobicContact CB-CD2 4.12Å; D724-F792 HydrophobicContact CB-CE2 4.14Å; L741-F792 HydrophobicContact CD1-CE1 4.13Å; L741-F792 HydrophobicContact CD1-CE2 4.22Å; L741-F792 HydrophobicContact CD1-CZ 3.77Å; L741-F792 HydrophobicContact CD2-CE1 4.49Å; L741-F792 HydrophobicContact CD2-CZ 3.98Å; L741-F792 HydrophobicContact CG-CZ 4.49Å; L745-F792 HydrophobicContact CD2-CD1 4.19Å; Q790-F792 PolarHBondContact O-N 3.48Å; Q790-F792 VanDerWaalsContact O-N 3.1Å; F792-W794 VanDerWaalsContact C-N 3.25Å; F792-W794 PolarHBondContact O-N 2.71Å; F792-A795 WeakPolarHBondContact O-CB 3.47Å; F792-A795 PolarHBondContact O-N 3.26Å; F792-T796 PolarHBondContact O-OG1 3.03Å
793	A	86	Confident	83.9	Confident	31 Å²	31	45.5 Å²	45.5	26%	0.256	24%	0.242	S	C	.	.	H	α-helix	trans	-56	-42.4	179	0	0	0	0	0	111.6	Q790 A795 T796 D797	Q790-A793 WeakPolarHBondContact O-CB 3.4Å; Q790-A793 PolarHBondContact O-N 3.41Å; Q790-A793 VanDerWaalsContact O-N 3.1Å; A793-A795 PolarHBondContact O-N 2.89Å; A793-T796 PolarHBondContact O-N 3.43Å; A793-T796 PolarHBondContact O-OG1 3.2Å; A793-D797 VanDerWaalsContact O-CG 3.22Å; A793-D797 PolarHBondContact O-N 3.14Å
794	W	87.8	Confident	83.9	Confident	59 Å²	59	47.3 Å²	47.3	22%	0.223	26%	0.255	C	S	.	.	H	α-helix	trans	-54.2	-27.9	177.3	69.5	-97.5	0	0	0	114.4	M661 F792 V808 K811 A815	M661-W794 HydrophobicContact CG-CZ2 4.41Å; M661-W794 HydrophobicContact SD-CH2 4.2Å; M661-W794 HydrophobicContact SD-CZ2 3.64Å; F792-W794 VanDerWaalsContact C-N 3.25Å; F792-W794 PolarHBondContact O-N 2.71Å; W794-V808 HydrophobicContact CE3-CG1 4.43Å; W794-V808 HydrophobicContact CZ3-CG1 4.45Å; W794-K811 HydrophobicContact CE3-CB 4.41Å; W794-K811 HydrophobicContact CH2-CB 3.98Å; W794-K811 HydrophobicContact CZ3-CB 3.51Å; W794-K811 HydrophobicContact CZ3-CD 4.4Å; W794-A815 HydrophobicContact CH2-CB 4.37Å
795	A	88.5	Confident	84.1	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-86	-25.2	-179	0	0	0	0	0	112.6	C748 Q752 F792 A793	C748-A795 PolarHBondContact SG-O 2.99Å; Q752-A795 PolarHBondContact NE2-O 3.48Å; F792-A795 WeakPolarHBondContact O-CB 3.47Å; F792-A795 PolarHBondContact O-N 3.26Å; A793-A795 PolarHBondContact O-N 2.89Å
796	T	89.3	Confident	84.5	Confident	4 Å²	4	40.9 Å²	40.9	3%	0.025	23%	0.228	C	C	.	.	H	α-helix	trans	-112.3	-8.5	-166.2	62.5	0	0	0	0	113.6	K717 L720 F792 A793	K717-T796 HydrophobicContact CB-CG2 3.94Å; K717-T796 HydrophobicContact CG-CG2 4.23Å; L720-T796 HydrophobicContact CD1-CG2 3.67Å; F792-T796 PolarHBondContact O-OG1 3.03Å; A793-T796 PolarHBondContact O-N 3.43Å; A793-T796 PolarHBondContact O-OG1 3.2Å
797	D	86.1	Confident	85.1	Confident	87 Å²	87	42.7 Å²	42.7	47%	0.465	24%	0.241	S	C	.	.			trans	-70.7	132.6	176	-71.9	-22	0	0	0	111.2	A793 S799	A793-D797 VanDerWaalsContact O-CG 3.22Å; A793-D797 PolarHBondContact O-N 3.14Å; D797-S799 PolarHBondContact O-N 3.45Å
798	L	82.4	Confident	85.7	Confident	33 Å²	33	43.2 Å²	43.2	17%	0.173	25%	0.245	C	C	.	.			trans	-88	95.9	-177.1	-174.6	58.7	0	0	0	110.2	L713 L755 L766 F769	L713-L798 HydrophobicContact CD2-CB 4.15Å; L713-L798 HydrophobicContact CD2-CD1 3.96Å; L755-L798 HydrophobicContact CD1-CD1 3.91Å; L766-L798 HydrophobicContact CD2-CD2 3.38Å; L766-L798 HydrophobicContact CD2-CG 4.15Å; L766-L798 HydrophobicContact CG-CD2 3.88Å; F769-L798 HydrophobicContact CB-CD2 4.22Å; F769-L798 HydrophobicContact CD1-CB 4.44Å; F769-L798 HydrophobicContact CD1-CD2 4.29Å; F769-L798 HydrophobicContact CE1-CB 4.33Å; F769-L798 HydrophobicContact CG-CD2 4.24Å
799	S	81.1	Confident	86.6	Confident	32 Å²	32	39.6 Å²	39.6	22%	0.224	22%	0.219	C	C	.	.			trans	-77.7	147.1	178.6	-178.6	0	0	0	0	113.1	R762 D797 D801 S804	R762-S799 PolarHBondContact NH2-O 3.48Å; D797-S799 PolarHBondContact O-N 3.45Å; S799-D801 VanDerWaalsContact C-N 3.35Å; S799-D801 PolarHBondContact OG-N 2.94Å; S799-S804 VanDerWaalsContact CB-OG 3.28Å; S799-S804 WeakPolarHBondContact CB-OG 3.4Å; S799-S804 VanDerWaalsContact OG-CB 3.27Å; S799-S804 WeakPolarHBondContact OG-CB 3.28Å; S799-S804 PolarHBondContact OG-OG 3.21Å
800	T	76.5	Confident	87.3	Confident	113 Å²	113	40 Å²	40	69%	0.693	22%	0.222	S	C	*	.	S	Bend	trans	-77.9	-17.3	171.8	53.1	0	0	0	0	115.5	R762	R762-T800 VanDerWaalsContact CZ-CA 3.42Å; R762-T800 PolarHBondContact NH1-O 3.32Å
801	D	87.5	Confident	88	Confident	78 Å²	78	38.2 Å²	38.2	42%	0.417	21%	0.212	S	C	.	.			trans	-97.4	131.2	-174.8	173.3	47.2	0	0	0	111.7	S799 E803 S804 Q805	S799-D801 VanDerWaalsContact C-N 3.35Å; S799-D801 PolarHBondContact OG-N 2.94Å; D801-E803 PolarHBondContact OD1-N 3.38Å; D801-E803 WeakPolarHBondContact OD2-CB 2.88Å; D801-S804 WeakPolarHBondContact O-CB 3.49Å; D801-S804 PolarHBondContact O-N 3.46Å; D801-S804 WeakPolarHBondContact OD2-CB 3.31Å; D801-S804 PolarHBondContact OD2-N 3.25Å; D801-Q805 WeakPolarHBondContact O-CG 3.42Å; D801-Q805 PolarHBondContact O-N 3.16Å
802	L	88.3	Confident	88.9	Confident	63 Å²	63	38.1 Å²	38.1	33%	0.33	21%	0.211	S	C	.	.	H	α-helix	trans	-66.7	-38.5	-178.5	-177	63.5	0	0	0	111.6	A756 S804 Q805 L806 F850	A756-L802 HydrophobicContact CB-CD1 3.51Å; A756-L802 VanDerWaalsContact O-CD1 3.29Å; A756-L802 WeakPolarHBondContact O-CD1 3.36Å; L802-S804 VanDerWaalsContact C-N 3.35Å; L802-Q805 PolarHBondContact O-N 2.92Å; L802-L806 HydrophobicContact CD1-CG 4.49Å; L802-L806 HydrophobicContact CG-CD1 4.27Å; L802-L806 WeakPolarHBondContact O-CG 3.42Å; L802-L806 PolarHBondContact O-N 3.34Å; L802-F850 HydrophobicContact CD2-CD2 4.1Å; L802-F850 HydrophobicContact CD2-CE2 3.86Å; L802-F850 HydrophobicContact CG-CE2 4.31Å
803	E	90.1	Very high	89.3	Confident	55 Å²	55	37.7 Å²	37.7	26%	0.257	21%	0.209	S	C	.	.	H	α-helix	trans	-62.4	-45.3	176.9	178.8	177.7	-179.5	0	0	110.3	D801 S807 F850 Y851 K878	D801-E803 PolarHBondContact OD1-N 3.38Å; D801-E803 WeakPolarHBondContact OD2-CB 2.88Å; E803-S807 VanDerWaalsContact O-CB 3.28Å; E803-S807 WeakPolarHBondContact O-CB 3.5Å; E803-S807 PolarHBondContact O-N 3.31Å; E803-F850 HydrophobicContact CB-CE1 3.83Å; E803-F850 HydrophobicContact CB-CZ 4.08Å; E803-F850 HydrophobicContact CG-CE1 4.18Å; E803-Y851 VanDerWaalsContact CD-OH 3.26Å; E803-Y851 HydrophobicContact CG-CE1 4.08Å; E803-Y851 WeakPolarHBondContact CG-OH 3.33Å; E803-Y851 VanDerWaalsContact OE1-CE1 3.26Å; E803-Y851 WeakPolarHBondContact OE1-CE1 3.24Å; E803-Y851 VanDerWaalsContact OE1-CZ 3.3Å; E803-Y851 PolarHBondContact OE1-OH 2.95Å; E803-K878 IonicContact OE1-NZ 3.65Å; E803-K878 PolarHBondContact OE1-NZ 2.99Å
804	S	89.9	Confident	89.7	Confident	40 Å²	40	38.7 Å²	38.7	28%	0.28	21%	0.208	S	C	.	.	H	α-helix	trans	-58.7	-46.7	174.1	173.1	0	0	0	0	112.8	S799 D801 L802 S807 V808	S799-S804 VanDerWaalsContact CB-OG 3.28Å; S799-S804 WeakPolarHBondContact CB-OG 3.4Å; S799-S804 VanDerWaalsContact OG-CB 3.27Å; S799-S804 WeakPolarHBondContact OG-CB 3.28Å; S799-S804 PolarHBondContact OG-OG 3.21Å; D801-S804 WeakPolarHBondContact O-CB 3.49Å; D801-S804 PolarHBondContact O-N 3.46Å; D801-S804 WeakPolarHBondContact OD2-CB 3.31Å; D801-S804 PolarHBondContact OD2-N 3.25Å; L802-S804 VanDerWaalsContact C-N 3.35Å; S804-S807 PolarHBondContact O-N 2.7Å; S804-V808 VanDerWaalsContact O-CG2 3.32Å; S804-V808 WeakPolarHBondContact O-CG2 3.45Å; S804-V808 PolarHBondContact O-N 3.25Å
805	Q	90.7	Very high	89.8	Confident	6 Å²	6	35.9 Å²	35.9	3%	0.028	20%	0.198	C	C	.	.	H	α-helix	trans	-63.6	-46.2	180	-71.4	-179.4	-61.2	0	0	112.6	A756 D801 L802 S807 V808 S809	A756-Q805 HydrophobicContact CB-CB 4.22Å; D801-Q805 WeakPolarHBondContact O-CG 3.42Å; D801-Q805 PolarHBondContact O-N 3.16Å; L802-Q805 PolarHBondContact O-N 2.92Å; Q805-S807 VanDerWaalsContact C-N 3.31Å; Q805-S807 PolarHBondContact O-N 3.45Å; Q805-V808 PolarHBondContact O-N 2.9Å; Q805-S809 PolarHBondContact O-N 3Å
806	L	93.2	Very high	90	Very high	13 Å²	13	35.9 Å²	35.9	7%	0.068	20%	0.198	C	C	.	.	H	α-helix	trans	-62.8	-39.9	176	-67.2	172.6	0	0	0	111.3	L753 A756 L802 S809 C810 I843 I847 F850	L753-L806 HydrophobicContact CD1-CD2 3.99Å; A756-L806 HydrophobicContact CB-CD2 3.71Å; A756-L806 HydrophobicContact CB-CG 4.08Å; L802-L806 HydrophobicContact CD1-CG 4.49Å; L802-L806 HydrophobicContact CG-CD1 4.27Å; L802-L806 WeakPolarHBondContact O-CG 3.42Å; L802-L806 PolarHBondContact O-N 3.34Å; L806-S809 PolarHBondContact O-N 3.17Å; L806-C810 PolarHBondContact O-N 3.06Å; L806-I843 HydrophobicContact CD2-CD1 3.82Å; L806-I847 HydrophobicContact CB-CD1 4.35Å; L806-I847 HydrophobicContact CB-CG1 3.77Å; L806-F850 HydrophobicContact CD1-CB 4.26Å; L806-F850 HydrophobicContact CD1-CG 4.27Å
807	S	92.6	Very high	90	Very high	45 Å²	45	36.6 Å²	36.6	32%	0.315	20%	0.201	S	C	.	.	H	α-helix	trans	-63.5	-42.2	176.1	-179.9	0	0	0	0	112.4	E803 S804 Q805 C810 K811	E803-S807 VanDerWaalsContact O-CB 3.28Å; E803-S807 WeakPolarHBondContact O-CB 3.5Å; E803-S807 PolarHBondContact O-N 3.31Å; S804-S807 PolarHBondContact O-N 2.7Å; Q805-S807 VanDerWaalsContact C-N 3.31Å; Q805-S807 PolarHBondContact O-N 3.45Å; S807-C810 PolarHBondContact O-N 3.03Å; S807-K811 WeakPolarHBondContact O-CG 3.03Å; S807-K811 PolarHBondContact O-N 3.44Å
808	V	93.4	Very high	90.1	Very high	18 Å²	18	34.6 Å²	34.6	11%	0.109	19%	0.189	C	C	.	.	H	α-helix	trans	-63.8	-45.7	176.3	172.1	0	0	0	0	110.5	Q752 W794 S804 Q805 C810 K811 C812	Q752-V808 HydrophobicContact CG-CG1 4.17Å; W794-V808 HydrophobicContact CE3-CG1 4.43Å; W794-V808 HydrophobicContact CZ3-CG1 4.45Å; S804-V808 VanDerWaalsContact O-CG2 3.32Å; S804-V808 WeakPolarHBondContact O-CG2 3.45Å; S804-V808 PolarHBondContact O-N 3.25Å; Q805-V808 PolarHBondContact O-N 2.9Å; V808-C810 VanDerWaalsContact C-N 3.32Å; V808-C810 PolarHBondContact O-N 3.3Å; V808-K811 PolarHBondContact O-N 3.1Å; V808-K811 VanDerWaalsContact O-N 3.13Å; V808-C812 PolarHBondContact O-N 2.94Å; V808-C812 PolarHBondContact O-SG 3.45Å
809	S	95.1	Very high	90.3	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-54.5	-47.1	174.8	179.4	0	0	0	0	111.9	G749 Q805 L806 K811 C812 Y813	G749-S809 WeakPolarHBondContact O-CB 3.4Å; G749-S809 PolarHBondContact O-OG 2.97Å; Q805-S809 PolarHBondContact O-N 3Å; L806-S809 PolarHBondContact O-N 3.17Å; S809-K811 PolarHBondContact O-N 3.06Å; S809-C812 WeakPolarHBondContact O-CB 3.42Å; S809-C812 PolarHBondContact O-N 2.87Å; S809-Y813 WeakPolarHBondContact O-CD2 3.43Å; S809-Y813 PolarHBondContact O-N 3.27Å; S809-Y813 WeakPolarHBondContact OG-CE2 3.26Å
810	C	94.3	Very high	90.4	Very high	12 Å²	12	31.6 Å²	31.6	8%	0.081	17%	0.171	C	C	.	.	H	α-helix	trans	-61.4	-44.1	176.5	-173.5	0	0	0	0	112.6	L806 S807 V808 C812 Y813 E814 I843 I847	L806-C810 PolarHBondContact O-N 3.06Å; S807-C810 PolarHBondContact O-N 3.03Å; V808-C810 VanDerWaalsContact C-N 3.32Å; V808-C810 PolarHBondContact O-N 3.3Å; C810-C812 VanDerWaalsContact C-N 3.32Å; C810-C812 PolarHBondContact O-N 3.29Å; C810-Y813 PolarHBondContact O-N 3.29Å; C810-E814 WeakPolarHBondContact O-CG 3.37Å; C810-E814 PolarHBondContact O-N 3.3Å; C810-I843 HydrophobicContact CB-CG1 4.02Å; C810-I843 HydrophobicContact CB-CG2 4.05Å; C810-I847 HydrophobicContact CB-CD1 3.67Å
811	K	93.3	Very high	90.7	Very high	102 Å²	102	31.6 Å²	31.6	44%	0.443	16%	0.163	S	C	.	.	H	α-helix	trans	-62.3	-37.9	177.1	-74.6	176	-178.2	-179.4	0	112.2	W794 S807 V808 S809 E814 A815	W794-K811 HydrophobicContact CE3-CB 4.41Å; W794-K811 HydrophobicContact CH2-CB 3.98Å; W794-K811 HydrophobicContact CZ3-CB 3.51Å; W794-K811 HydrophobicContact CZ3-CD 4.4Å; S807-K811 WeakPolarHBondContact O-CG 3.03Å; S807-K811 PolarHBondContact O-N 3.44Å; V808-K811 PolarHBondContact O-N 3.1Å; V808-K811 VanDerWaalsContact O-N 3.13Å; S809-K811 PolarHBondContact O-N 3.06Å; K811-E814 PolarHBondContact O-N 3.47Å; K811-A815 VanDerWaalsContact O-CB 3.25Å; K811-A815 WeakPolarHBondContact O-CB 3.49Å; K811-A815 PolarHBondContact O-N 3.28Å
812	C	94.8	Very high	89.8	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60.8	-44	176.1	-68.2	0	0	0	0	111.9	L745 V808 S809 C810 A815 A816	L745-C812 WeakPolarHBondContact O-CB 3.42Å; V808-C812 PolarHBondContact O-N 2.94Å; V808-C812 PolarHBondContact O-SG 3.45Å; S809-C812 WeakPolarHBondContact O-CB 3.42Å; S809-C812 PolarHBondContact O-N 2.87Å; C810-C812 VanDerWaalsContact C-N 3.32Å; C810-C812 PolarHBondContact O-N 3.29Å; C812-A815 WeakPolarHBondContact O-CB 3.49Å; C812-A815 PolarHBondContact O-N 2.87Å; C812-A816 WeakPolarHBondContact O-CB 3.38Å; C812-A816 PolarHBondContact O-N 2.76Å
813	Y	95.6	Very high	88.3	Confident	1 Å²	1	28.9 Å²	28.9	0%	0.004	15%	0.148	C	C	.	.	H	α-helix	trans	-71.7	-36.5	176.4	-54.9	-54.7	0	0	0	113.1	T746 G749 D750 S809 C810 A815 A816 N817 R839 M840 I843	T746-Y813 HydrophobicContact CG2-CD1 4.26Å; T746-Y813 HydrophobicContact CG2-CE1 4.15Å; T746-Y813 WeakPolarHBondContact O-CE1 3.37Å; G749-Y813 PolarHBondContact O-OH 3.26Å; D750-Y813 VanDerWaalsContact CA-OH 3.3Å; D750-Y813 WeakPolarHBondContact CA-OH 3.43Å; D750-Y813 PolarHBondContact N-OH 3.24Å; D750-Y813 PolarHBondContact OD1-OH 2.87Å; S809-Y813 WeakPolarHBondContact O-CD2 3.43Å; S809-Y813 PolarHBondContact O-N 3.27Å; S809-Y813 WeakPolarHBondContact OG-CE2 3.26Å; C810-Y813 PolarHBondContact O-N 3.29Å; Y813-A815 VanDerWaalsContact C-N 3.31Å; Y813-A815 PolarHBondContact O-N 3.04Å; Y813-A816 PolarHBondContact O-N 3.1Å; Y813-N817 WeakPolarHBondContact O-CB 3.22Å; Y813-N817 PolarHBondContact O-N 3.23Å; Y813-R839 HydrophobicContact CD1-CB 4.08Å; Y813-R839 HydrophobicContact CD2-CB 4.46Å; Y813-R839 HydrophobicContact CE1-CB 3.86Å; Y813-R839 HydrophobicContact CE1-CG 4.32Å; Y813-R839 HydrophobicContact CE2-CB 4.26Å; Y813-R839 HydrophobicContact CG-CB 4.37Å; Y813-M840 HydrophobicContact CG-CG 4.26Å; Y813-I843 HydrophobicContact CD2-CB 4.29Å; Y813-I843 HydrophobicContact CD2-CG2 3.77Å; Y813-I843 HydrophobicContact CE2-CB 4.03Å; Y813-I843 HydrophobicContact CE2-CG1 4.46Å; Y813-I843 HydrophobicContact CE2-CG2 4.02Å
814	E	92.5	Very high	87	Confident	52 Å²	52	32.4 Å²	32.4	24%	0.243	17%	0.169	C	C	.	.	H	α-helix	trans	-59.2	-44.9	172.6	-75	176.3	167	0	0	110.8	C810 K811 N817 E818 M840 R844	C810-E814 WeakPolarHBondContact O-CG 3.37Å; C810-E814 PolarHBondContact O-N 3.3Å; K811-E814 PolarHBondContact O-N 3.47Å; E814-N817 PolarHBondContact O-N 2.86Å; E814-E818 WeakPolarHBondContact O-CG 3.4Å; E814-E818 PolarHBondContact O-N 3.41Å; E814-M840 HydrophobicContact CB-CE 4.45Å; E814-M840 HydrophobicContact CG-CE 3.69Å; E814-R844 IonicContact OE1-CZ 3.78Å; E814-R844 IonicContact OE1-NE 2.73Å; E814-R844 IonicContact OE1-NH2 3.44Å; E814-R844 PolarHBondContact OE1-NH2 2.88Å
815	A	90.8	Very high	86	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60.1	-46.1	174.6	0	0	0	0	0	112.1	F657 M661 L745 W794 K811 C812 Y813 N817 E818 I819	F657-A815 HydrophobicContact CE2-CB 4.18Å; F657-A815 HydrophobicContact CZ-CB 3.96Å; M661-A815 HydrophobicContact CE-CB 3.38Å; M661-A815 HydrophobicContact SD-CB 4.3Å; L745-A815 HydrophobicContact CD1-CB 3.88Å; W794-A815 HydrophobicContact CH2-CB 4.37Å; K811-A815 VanDerWaalsContact O-CB 3.25Å; K811-A815 WeakPolarHBondContact O-CB 3.49Å; K811-A815 PolarHBondContact O-N 3.28Å; C812-A815 WeakPolarHBondContact O-CB 3.49Å; C812-A815 PolarHBondContact O-N 2.87Å; Y813-A815 VanDerWaalsContact C-N 3.31Å; Y813-A815 PolarHBondContact O-N 3.04Å; A815-N817 VanDerWaalsContact C-N 3.33Å; A815-N817 PolarHBondContact O-N 3.46Å; A815-E818 PolarHBondContact O-N 3.15Å; A815-I819 WeakPolarHBondContact O-CG1 3.35Å; A815-I819 PolarHBondContact O-N 3.41Å
816	A	91.8	Very high	85	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-61.8	-39.3	177.2	0	0	0	0	0	112.5	S742 L745 C812 Y813 L820 V836	S742-A816 PolarHBondContact OG-O 3.03Å; L745-A816 HydrophobicContact CB-CB 4.13Å; C812-A816 WeakPolarHBondContact O-CB 3.38Å; C812-A816 PolarHBondContact O-N 2.76Å; Y813-A816 PolarHBondContact O-N 3.1Å; A816-L820 WeakPolarHBondContact O-CG 3.43Å; A816-L820 PolarHBondContact O-N 2.6Å; A816-V836 HydrophobicContact CB-CG1 4.19Å
817	N	90.9	Very high	83.8	Confident	18 Å²	18	38.5 Å²	38.5	10%	0.096	20%	0.2	C	C	.	.	H	α-helix	trans	-71	-39.6	176.6	172.9	58.2	0	0	0	112.4	Y813 E814 A815 I819 L820 Q821 Y833 V836 M840	Y813-N817 WeakPolarHBondContact O-CB 3.22Å; Y813-N817 PolarHBondContact O-N 3.23Å; E814-N817 PolarHBondContact O-N 2.86Å; A815-N817 VanDerWaalsContact C-N 3.33Å; A815-N817 PolarHBondContact O-N 3.46Å; N817-I819 VanDerWaalsContact C-N 3.3Å; N817-I819 PolarHBondContact O-N 3.14Å; N817-L820 PolarHBondContact O-N 3.3Å; N817-Q821 PolarHBondContact ND2-NE2 3.27Å; N817-Q821 VanDerWaalsContact O-CG 3.29Å; N817-Q821 WeakPolarHBondContact O-CG 3.41Å; N817-Q821 PolarHBondContact O-N 3.16Å; N817-Q821 VanDerWaalsContact O-N 3.17Å; N817-Q821 PolarHBondContact OD1-NE2 3.29Å; N817-Y833 WeakPolarHBondContact OD1-CE2 3.49Å; N817-V836 HydrophobicContact CB-CG1 3.96Å; N817-M840 HydrophobicContact CB-CE 4.44Å; N817-M840 HydrophobicContact CB-SD 3.54Å; N817-M840 VanDerWaalsContact CB-SD 3.54Å
818	E	88.3	Confident	82.9	Confident	45 Å²	45	42 Å²	42	21%	0.21	21%	0.211	C	C	.	.	H	α-helix	trans	-58.4	-42.9	172.8	-75.4	-178.2	-161.9	0	0	111	F657 K660 E814 A815 L820 Q821 F822	F657-E818 HydrophobicContact CD2-CB 4.34Å; F657-E818 HydrophobicContact CE2-CB 4.12Å; K660-E818 IonicContact NZ-OE1 2.59Å; K660-E818 PolarHBondContact NZ-OE1 3.2Å; K660-E818 IonicContact NZ-OE2 3.43Å; K660-E818 PolarHBondContact NZ-OE2 3.28Å; E814-E818 WeakPolarHBondContact O-CG 3.4Å; E814-E818 PolarHBondContact O-N 3.41Å; A815-E818 PolarHBondContact O-N 3.15Å; E818-L820 PolarHBondContact O-N 3.03Å; E818-Q821 PolarHBondContact O-N 2.99Å; E818-Q821 VanDerWaalsContact O-N 3.14Å; E818-F822 HydrophobicContact CB-CE2 4.08Å; E818-F822 HydrophobicContact CB-CZ 4.09Å; E818-F822 WeakPolarHBondContact O-CD2 3.22Å; E818-F822 WeakPolarHBondContact O-CE2 3.33Å; E818-F822 WeakPolarHBondContact O-CG 3.5Å; E818-F822 PolarHBondContact O-N 3.3Å
819	I	84.9	Confident	82.2	Confident	3 Å²	3	43.7 Å²	43.7	2%	0.015	22%	0.22	C	C	.	.	H	α-helix	trans	-60.3	-44.7	176.7	-67.3	163.2	0	0	0	112.4	F657 L738 L741 L745 A815 N817 Q821 F822	F657-I819 HydrophobicContact CE1-CD1 4.1Å; F657-I819 HydrophobicContact CE1-CG1 4.2Å; F657-I819 HydrophobicContact CE2-CG1 4.17Å; F657-I819 HydrophobicContact CZ-CD1 3.78Å; F657-I819 HydrophobicContact CZ-CG1 3.82Å; L738-I819 HydrophobicContact CB-CG2 4.1Å; L738-I819 HydrophobicContact CD2-CG2 4.37Å; L738-I819 WeakPolarHBondContact O-CG2 3.42Å; L741-I819 HydrophobicContact CB-CD1 4.34Å; L741-I819 HydrophobicContact CD2-CD1 3.72Å; L741-I819 HydrophobicContact CG-CD1 3.73Å; L745-I819 HydrophobicContact CD1-CD1 3.57Å; A815-I819 WeakPolarHBondContact O-CG1 3.35Å; A815-I819 PolarHBondContact O-N 3.41Å; N817-I819 VanDerWaalsContact C-N 3.3Å; N817-I819 PolarHBondContact O-N 3.14Å; I819-Q821 PolarHBondContact O-N 3.18Å; I819-F822 PolarHBondContact O-N 2.95Å
820	L	84.8	Confident	81.6	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-66.6	-22.5	179.2	-67.3	170.7	0	0	0	113	L739 S742 A816 N817 E818 L825 K826 Y833 V836	L739-L820 HydrophobicContact CD1-CD2 4.01Å; S742-L820 WeakPolarHBondContact OG-CG 3.41Å; A816-L820 WeakPolarHBondContact O-CG 3.43Å; A816-L820 PolarHBondContact O-N 2.6Å; N817-L820 PolarHBondContact O-N 3.3Å; E818-L820 PolarHBondContact O-N 3.03Å; L820-L825 HydrophobicContact CD2-CB 4.27Å; L820-K826 PolarHBondContact O-N 3.32Å; L820-Y833 HydrophobicContact CB-CD2 4.36Å; L820-Y833 HydrophobicContact CD1-CD2 4.34Å; L820-V836 HydrophobicContact CD1-CB 4.44Å; L820-V836 HydrophobicContact CD1-CG2 4.09Å
821	Q	81.3	Confident	81.2	Confident	112 Å²	112	54.7 Å²	54.7	52%	0.523	28%	0.277	S	S	.	.	H	α-helix	trans	-84.2	-21.6	176.5	-68.6	177.6	19.9	0	0	113.3	N817 E818 I819 S823	N817-Q821 PolarHBondContact ND2-NE2 3.27Å; N817-Q821 VanDerWaalsContact O-CG 3.29Å; N817-Q821 WeakPolarHBondContact O-CG 3.41Å; N817-Q821 PolarHBondContact O-N 3.16Å; N817-Q821 VanDerWaalsContact O-N 3.17Å; N817-Q821 PolarHBondContact OD1-NE2 3.29Å; E818-Q821 PolarHBondContact O-N 2.99Å; E818-Q821 VanDerWaalsContact O-N 3.14Å; I819-Q821 PolarHBondContact O-N 3.18Å; Q821-S823 VanDerWaalsContact C-N 3.35Å; Q821-S823 PolarHBondContact O-N 3.32Å
822	F	69.4	Low	80.9	Confident	62 Å²	62	51 Å²	51	27%	0.272	26%	0.261	S	S	.	.	S	Bend	trans	-71.4	-17.3	-174.6	-69.8	-46.3	0	0	0	115.5	L650 Q653 F657 E818 I819	L650-F822 HydrophobicContact CD1-CB 4.32Å; Q653-F822 HydrophobicContact CB-CD1 4.5Å; F657-F822 HydrophobicContact CB-CE2 3.92Å; F657-F822 HydrophobicContact CB-CZ 4.06Å; F657-F822 AromaticContact CD2-CE2 3.63Å; F657-F822 HydrophobicContact CD2-CE2 3.63Å; F657-F822 AromaticContact CD2-CZ 3.97Å; F657-F822 HydrophobicContact CD2-CZ 3.97Å; F657-F822 HydrophobicContact CE2-CE2 4.34Å; F657-F822 AromaticContact CG-CE2 3.9Å; F657-F822 HydrophobicContact CG-CE2 3.9Å; F657-F822 HydrophobicContact CG-CZ 4.35Å; E818-F822 HydrophobicContact CB-CE2 4.08Å; E818-F822 HydrophobicContact CB-CZ 4.09Å; E818-F822 WeakPolarHBondContact O-CD2 3.22Å; E818-F822 WeakPolarHBondContact O-CE2 3.33Å; E818-F822 WeakPolarHBondContact O-CG 3.5Å; E818-F822 PolarHBondContact O-N 3.3Å; I819-F822 PolarHBondContact O-N 2.95Å
823	S	56.8	Low	80.6	Confident	23 Å²	23	52 Å²	52	16%	0.161	27%	0.265	C	S	.	.	S	Bend	trans	-149.3	34.6	-161.1	49.9	0	0	0	0	117	Q821 L825	Q821-S823 VanDerWaalsContact C-N 3.35Å; Q821-S823 PolarHBondContact O-N 3.32Å; S823-L825 PolarHBondContact O-N 2.89Å; S823-L825 WeakPolarHBondContact OG-CD1 3.3Å; S823-L825 WeakPolarHBondContact OG-CG 3.47Å
824	D	63	Low	80.4	Confident	129 Å²	129	55.1 Å²	55.1	69%	0.69	28%	0.284	S	S	*	.	S	Bend	trans	52.1	8.6	-173.3	-85.2	-22.3	0	0	0	114.4	K826 S827 Q828	D824-K826 PolarHBondContact O-N 2.8Å; D824-S827 WeakPolarHBondContact O-CB 3.35Å; D824-S827 PolarHBondContact O-N 2.9Å; D824-S827 PolarHBondContact O-OG 3.15Å; D824-Q828 PolarHBondContact O-N 2.65Å
825	L	68.4	Low	80.4	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.01	29%	0.293	C	S	.	.	H	α-helix	trans	-59.6	-29.6	177.8	-79.4	175.4	0	0	0	112	L738 L820 S823 S827 Q828 N829	L738-L825 HydrophobicContact CB-CD1 4.11Å; L820-L825 HydrophobicContact CD2-CB 4.27Å; S823-L825 PolarHBondContact O-N 2.89Å; S823-L825 WeakPolarHBondContact OG-CD1 3.3Å; S823-L825 WeakPolarHBondContact OG-CG 3.47Å; L825-S827 PolarHBondContact O-N 3.43Å; L825-Q828 PolarHBondContact O-N 3.19Å; L825-Q828 VanDerWaalsContact O-N 3.15Å; L825-N829 PolarHBondContact O-N 3.43Å
826	K	70.1	Confident	80.5	Confident	97 Å²	97	57.1 Å²	57.1	42%	0.422	29%	0.293	S	S	.	.	H	α-helix	trans	-53.4	-40.3	170.1	176.5	176.4	174	171	0	112.3	L820 D824 P830 Y833	L820-K826 PolarHBondContact O-N 3.32Å; D824-K826 PolarHBondContact O-N 2.8Å; K826-P830 WeakPolarHBondContact O-CA 3.08Å; K826-Y833 HydrophobicContact CD-CD1 4.1Å; K826-Y833 HydrophobicContact CD-CD2 4.2Å; K826-Y833 HydrophobicContact CD-CE1 3.8Å; K826-Y833 HydrophobicContact CD-CE2 3.92Å; K826-Y833 HydrophobicContact CD-CG 4.27Å; K826-Y833 HydrophobicContact CG-CD1 4.01Å; K826-Y833 HydrophobicContact CG-CD2 4.13Å; K826-Y833 HydrophobicContact CG-CE1 4.25Å; K826-Y833 HydrophobicContact CG-CE2 4.36Å; K826-Y833 HydrophobicContact CG-CG 3.93Å; K826-Y833 PolarHBondContact NZ-OH 3.28Å; K826-Y833 VanDerWaalsContact NZ-OH 3.08Å
827	S	67.5	Low	80.6	Confident	87 Å²	87	57.3 Å²	57.3	61%	0.608	29%	0.294	S	S	*	.	H	α-helix	trans	-74.8	-32.8	178.9	72.3	0	0	0	0	112.3	D824 L825	D824-S827 WeakPolarHBondContact O-CB 3.35Å; D824-S827 PolarHBondContact O-N 2.9Å; D824-S827 PolarHBondContact O-OG 3.15Å; L825-S827 PolarHBondContact O-N 3.43Å
828	Q	74.2	Confident	80.8	Confident	118 Å²	118	60.9 Å²	60.9	55%	0.551	31%	0.309	S	S	*	.	H	α-helix	trans	-78	-32.8	-179.3	-62.2	179.9	6.8	0	0	112.5	D824 L825	D824-Q828 PolarHBondContact O-N 2.65Å; L825-Q828 PolarHBondContact O-N 3.19Å; L825-Q828 VanDerWaalsContact O-N 3.15Å
829	N	78.4	Confident	81.1	Confident	55 Å²	55	61.2 Å²	61.2	29%	0.294	31%	0.308	S	S	.	.			trans	-133.9	68.3	-177	-65.8	-84.9	0	0	0	111.5	L739 L825 E831 H832 Y833	L739-N829 HydrophobicContact CD1-CB 4.38Å; L825-N829 PolarHBondContact O-N 3.43Å; N829-E831 VanDerWaalsContact C-N 3.3Å; N829-E831 PolarHBondContact O-N 3.11Å; N829-H832 HydrophobicContact CB-CB 4.39Å; N829-H832 PolarHBondContact O-N 3.5Å; N829-Y833 PolarHBondContact O-N 3.04Å
830	P	83.2	Confident	81.5	Confident	73 Å²	73	61.3 Å²	61.3	47%	0.474	31%	0.308	S	S	.	.	H	α-helix	trans	-64.9	-33.1	-175.8	26.2	-34.3	0	0	0	112.7	K826 Y833 V834	K826-P830 WeakPolarHBondContact O-CA 3.08Å; P830-Y833 PolarHBondContact O-N 3.22Å; P830-V834 WeakPolarHBondContact O-CG2 3.46Å; P830-V834 PolarHBondContact O-N 3.41Å
831	E	86.2	Confident	82	Confident	169 Å²	169	61.3 Å²	61.3	79%	0.79	31%	0.308	S	S	*	.	H	α-helix	trans	-63.5	-48.2	179.8	-65.2	-177.8	177.8	0	0	112.2	N829 Y833 V834 Q835	N829-E831 VanDerWaalsContact C-N 3.3Å; N829-E831 PolarHBondContact O-N 3.11Å; E831-Y833 VanDerWaalsContact C-N 3.31Å; E831-Y833 PolarHBondContact O-N 3.36Å; E831-V834 PolarHBondContact O-N 3.48Å; E831-Q835 WeakPolarHBondContact O-CB 3.25Å; E831-Q835 PolarHBondContact O-N 3.5Å
832	H	86.2	Confident	82.6	Confident	25 Å²	25	59 Å²	59	12%	0.116	30%	0.3	C	S	.	.	H	α-helix	trans	-62.6	-40.1	178.2	-174.4	60.6	0	0	0	111.2	S742 N829 Q835 V836	S742-H832 PolarHBondContact OG-NE2 3.49Å; S742-H832 VanDerWaalsContact OG-NE2 3.14Å; N829-H832 HydrophobicContact CB-CB 4.39Å; N829-H832 PolarHBondContact O-N 3.5Å; H832-Q835 PolarHBondContact O-N 3.1Å; H832-V836 WeakPolarHBondContact O-CG2 3.37Å; H832-V836 PolarHBondContact O-N 3.46Å
833	Y	89.3	Confident	83.9	Confident	22 Å²	22	56 Å²	56	9%	0.086	29%	0.287	C	S	.	.	H	α-helix	trans	-60.5	-47.5	174.9	174.8	-101.6	0	0	0	112.9	N817 L820 K826 N829 P830 E831 Q835 V836 L837	N817-Y833 WeakPolarHBondContact OD1-CE2 3.49Å; L820-Y833 HydrophobicContact CB-CD2 4.36Å; L820-Y833 HydrophobicContact CD1-CD2 4.34Å; K826-Y833 HydrophobicContact CD-CD1 4.1Å; K826-Y833 HydrophobicContact CD-CD2 4.2Å; K826-Y833 HydrophobicContact CD-CE1 3.8Å; K826-Y833 HydrophobicContact CD-CE2 3.92Å; K826-Y833 HydrophobicContact CD-CG 4.27Å; K826-Y833 HydrophobicContact CG-CD1 4.01Å; K826-Y833 HydrophobicContact CG-CD2 4.13Å; K826-Y833 HydrophobicContact CG-CE1 4.25Å; K826-Y833 HydrophobicContact CG-CE2 4.36Å; K826-Y833 HydrophobicContact CG-CG 3.93Å; K826-Y833 PolarHBondContact NZ-OH 3.28Å; K826-Y833 VanDerWaalsContact NZ-OH 3.08Å; N829-Y833 PolarHBondContact O-N 3.04Å; P830-Y833 PolarHBondContact O-N 3.22Å; E831-Y833 VanDerWaalsContact C-N 3.31Å; E831-Y833 PolarHBondContact O-N 3.36Å; Y833-Q835 VanDerWaalsContact C-N 3.28Å; Y833-Q835 PolarHBondContact O-N 3.33Å; Y833-V836 PolarHBondContact O-N 3.08Å; Y833-L837 HydrophobicContact CD1-CD1 4.26Å; Y833-L837 HydrophobicContact CE1-CD1 3.49Å; Y833-L837 VanDerWaalsContact CE1-CD1 3.49Å; Y833-L837 HydrophobicContact CE1-CG 4.36Å; Y833-L837 HydrophobicContact CE2-CD1 4.09Å; Y833-L837 HydrophobicContact CE2-CG 4.29Å; Y833-L837 VanDerWaalsContact CZ-CD1 3.41Å; Y833-L837 PolarHBondContact O-N 3.46Å
834	V	90.9	Very high	85.7	Confident	66 Å²	66	56.1 Å²	56.1	40%	0.4	28%	0.284	S	S	.	.	H	α-helix	trans	-60	-41.7	175.8	170.6	0	0	0	0	110.5	P830 E831 L837 K838 I893	P830-V834 WeakPolarHBondContact O-CG2 3.46Å; P830-V834 PolarHBondContact O-N 3.41Å; E831-V834 PolarHBondContact O-N 3.48Å; V834-L837 PolarHBondContact O-N 2.87Å; V834-K838 WeakPolarHBondContact O-CB 3.32Å; V834-K838 PolarHBondContact O-N 3.45Å; V834-I893 HydrophobicContact CG1-CB 4.41Å; V834-I893 HydrophobicContact CG1-CD1 4.32Å; V834-I893 HydrophobicContact CG1-CG2 4.4Å; V834-I893 HydrophobicContact CG2-CG2 4.26Å
835	Q	92.4	Very high	87.3	Confident	94 Å²	94	51.2 Å²	51.2	44%	0.439	26%	0.258	S	S	.	.	H	α-helix	trans	-64.9	-41.3	179.4	-146.3	-168.7	13.4	0	0	112.4	E831 H832 Y833 K838 R839	E831-Q835 WeakPolarHBondContact O-CB 3.25Å; E831-Q835 PolarHBondContact O-N 3.5Å; H832-Q835 PolarHBondContact O-N 3.1Å; Y833-Q835 VanDerWaalsContact C-N 3.28Å; Y833-Q835 PolarHBondContact O-N 3.33Å; Q835-K838 PolarHBondContact O-N 2.75Å; Q835-R839 WeakPolarHBondContact O-CG 3.29Å; Q835-R839 PolarHBondContact O-N 3.07Å
836	V	93.1	Very high	88.5	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-63.6	-47.4	175.5	172.9	0	0	0	0	110.7	T746 A816 N817 L820 H832 Y833 K838 R839 M840	T746-V836 HydrophobicContact CG2-CG2 4.29Å; T746-V836 WeakPolarHBondContact OG1-CG2 3.29Å; A816-V836 HydrophobicContact CB-CG1 4.19Å; N817-V836 HydrophobicContact CB-CG1 3.96Å; L820-V836 HydrophobicContact CD1-CB 4.44Å; L820-V836 HydrophobicContact CD1-CG2 4.09Å; H832-V836 WeakPolarHBondContact O-CG2 3.37Å; H832-V836 PolarHBondContact O-N 3.46Å; Y833-V836 PolarHBondContact O-N 3.08Å; V836-K838 VanDerWaalsContact C-N 3.32Å; V836-K838 PolarHBondContact O-N 3.32Å; V836-R839 PolarHBondContact O-N 3.06Å; V836-M840 HydrophobicContact CG1-CG 4.36Å; V836-M840 HydrophobicContact CG1-SD 4.12Å; V836-M840 VanDerWaalsContact O-CG 3.3Å; V836-M840 WeakPolarHBondContact O-CG 3.41Å; V836-M840 PolarHBondContact O-N 2.94Å
837	L	93.2	Very high	89.7	Confident	4 Å²	4	50.8 Å²	50.8	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-62.9	-37.6	178	-77.5	-175.6	0	0	0	112.7	Y833 V834 M840 G841 I893	Y833-L837 HydrophobicContact CD1-CD1 4.26Å; Y833-L837 HydrophobicContact CE1-CD1 3.49Å; Y833-L837 VanDerWaalsContact CE1-CD1 3.49Å; Y833-L837 HydrophobicContact CE1-CG 4.36Å; Y833-L837 HydrophobicContact CE2-CD1 4.09Å; Y833-L837 HydrophobicContact CE2-CG 4.29Å; Y833-L837 VanDerWaalsContact CZ-CD1 3.41Å; Y833-L837 PolarHBondContact O-N 3.46Å; V834-L837 PolarHBondContact O-N 2.87Å; L837-M840 HydrophobicContact CD2-SD 3.95Å; L837-M840 WeakPolarHBondContact O-CB 3.15Å; L837-M840 PolarHBondContact O-N 3.4Å; L837-G841 PolarHBondContact O-N 3Å; L837-I893 HydrophobicContact CB-CG2 3.82Å; L837-I893 HydrophobicContact CD1-CG2 3.49Å; L837-I893 VanDerWaalsContact CD1-CG2 3.49Å; L837-I893 HydrophobicContact CG-CG2 4.31Å
838	K	94.5	Very high	91	Very high	93 Å²	93	46.7 Å²	46.7	40%	0.404	23%	0.228	S	C	.	.	H	α-helix	trans	-62.1	-46.5	174.4	-168.9	174.6	-174.3	172.9	0	111.5	V834 Q835 V836 M840 G841 N842 F890 I893	V834-K838 WeakPolarHBondContact O-CB 3.32Å; V834-K838 PolarHBondContact O-N 3.45Å; Q835-K838 PolarHBondContact O-N 2.75Å; V836-K838 VanDerWaalsContact C-N 3.32Å; V836-K838 PolarHBondContact O-N 3.32Å; K838-M840 PolarHBondContact O-N 3.03Å; K838-G841 PolarHBondContact O-N 3.32Å; K838-N842 VanDerWaalsContact O-CG 3.28Å; K838-N842 PolarHBondContact O-N 2.79Å; K838-N842 PolarHBondContact O-ND2 2.88Å; K838-F890 HydrophobicContact CG-CE1 4.21Å; K838-I893 HydrophobicContact CB-CD1 4.06Å
839	R	94.6	Very high	92	Very high	52 Å²	52	42.5 Å²	42.5	20%	0.196	21%	0.211	C	C	.	.	H	α-helix	trans	-60.7	-42.2	173.7	-73.5	177.2	171.2	104.9	-3.7	112.3	D750 Y813 Q835 V836 G841 N842 I843	D750-R839 VanDerWaalsContact OD1-CD 3.26Å; D750-R839 WeakPolarHBondContact OD1-CD 3.46Å; D750-R839 IonicContact OD1-CZ 3.58Å; D750-R839 IonicContact OD1-NE 3.94Å; D750-R839 PolarHBondContact OD1-NE 3.17Å; D750-R839 IonicContact OD2-CZ 2.75Å; D750-R839 IonicContact OD2-NE 3.5Å; D750-R839 PolarHBondContact OD2-NE 3.08Å; D750-R839 IonicContact OD2-NH2 3.96Å; D750-R839 PolarHBondContact OD2-NH2 3.38Å; Y813-R839 HydrophobicContact CD1-CB 4.08Å; Y813-R839 HydrophobicContact CD2-CB 4.46Å; Y813-R839 HydrophobicContact CE1-CB 3.86Å; Y813-R839 HydrophobicContact CE1-CG 4.32Å; Y813-R839 HydrophobicContact CE2-CB 4.26Å; Y813-R839 HydrophobicContact CG-CB 4.37Å; Q835-R839 WeakPolarHBondContact O-CG 3.29Å; Q835-R839 PolarHBondContact O-N 3.07Å; V836-R839 PolarHBondContact O-N 3.06Å; R839-G841 PolarHBondContact O-N 3.16Å; R839-N842 PolarHBondContact O-N 3.41Å; R839-I843 PolarHBondContact O-N 3.01Å
840	M	94.3	Very high	92.7	Very high	4 Å²	4	42.2 Å²	42.2	2%	0.02	21%	0.207	C	C	.	.	H	α-helix	trans	-60.8	-42	174.7	-71.5	178.3	64.9	0	0	112.5	Y813 E814 N817 V836 L837 K838 I843 R844 N889	Y813-M840 HydrophobicContact CG-CG 4.26Å; E814-M840 HydrophobicContact CB-CE 4.45Å; E814-M840 HydrophobicContact CG-CE 3.69Å; N817-M840 HydrophobicContact CB-CE 4.44Å; N817-M840 HydrophobicContact CB-SD 3.54Å; N817-M840 VanDerWaalsContact CB-SD 3.54Å; V836-M840 HydrophobicContact CG1-CG 4.36Å; V836-M840 HydrophobicContact CG1-SD 4.12Å; V836-M840 VanDerWaalsContact O-CG 3.3Å; V836-M840 WeakPolarHBondContact O-CG 3.41Å; V836-M840 PolarHBondContact O-N 2.94Å; L837-M840 HydrophobicContact CD2-SD 3.95Å; L837-M840 WeakPolarHBondContact O-CB 3.15Å; L837-M840 PolarHBondContact O-N 3.4Å; K838-M840 PolarHBondContact O-N 3.03Å; M840-I843 VanDerWaalsContact O-CG2 3.26Å; M840-I843 WeakPolarHBondContact O-CG2 3.35Å; M840-R844 WeakPolarHBondContact O-CB 3.45Å; M840-R844 WeakPolarHBondContact O-CG 3.33Å; M840-R844 PolarHBondContact O-N 3.21Å; M840-N889 WeakPolarHBondContact CB-ND2 3.34Å
841	G	94.6	Very high	93.3	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.8	-43.5	175.5	0	0	0	0	0	111.9	L837 K838 R839 R844 N845 F890	L837-G841 PolarHBondContact O-N 3Å; K838-G841 PolarHBondContact O-N 3.32Å; R839-G841 PolarHBondContact O-N 3.16Å; G841-R844 PolarHBondContact O-N 3.24Å; G841-N845 PolarHBondContact O-N 3.46Å; G841-F890 VanDerWaalsContact C-CE2 3.46Å; G841-F890 VanDerWaalsContact CA-CE2 3.43Å; G841-F890 VanDerWaalsContact CA-CZ 3.41Å
842	N	94.9	Very high	93.7	Very high	64 Å²	64	31.8 Å²	31.8	34%	0.342	15%	0.151	S	C	.	.	H	α-helix	trans	-63.2	-49.8	178.4	-70.7	-17.1	0	0	0	112.3	K838 R839 R844 N845 E846 F890	K838-N842 VanDerWaalsContact O-CG 3.28Å; K838-N842 PolarHBondContact O-N 2.79Å; K838-N842 PolarHBondContact O-ND2 2.88Å; R839-N842 PolarHBondContact O-N 3.41Å; N842-R844 VanDerWaalsContact C-N 3.27Å; N842-R844 PolarHBondContact O-N 3.43Å; N842-N845 VanDerWaalsContact O-CB 3.29Å; N842-N845 WeakPolarHBondContact O-CB 3.43Å; N842-N845 PolarHBondContact O-N 3.05Å; N842-N845 VanDerWaalsContact O-N 3.11Å; N842-E846 PolarHBondContact O-N 3.36Å; N842-F890 WeakPolarHBondContact OD1-CZ 3.45Å
843	I	95.6	Very high	94.1	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.3	-35.5	178.8	-170.7	64.9	0	0	0	111.8	L753 L806 C810 Y813 R839 M840 N845 E846 I847	L753-I843 HydrophobicContact CB-CD1 4.45Å; L753-I843 HydrophobicContact CD1-CD1 3.71Å; L753-I843 HydrophobicContact CD2-CD1 4.4Å; L753-I843 HydrophobicContact CG-CD1 4.4Å; L806-I843 HydrophobicContact CD2-CD1 3.82Å; C810-I843 HydrophobicContact CB-CG1 4.02Å; C810-I843 HydrophobicContact CB-CG2 4.05Å; Y813-I843 HydrophobicContact CD2-CB 4.29Å; Y813-I843 HydrophobicContact CD2-CG2 3.77Å; Y813-I843 HydrophobicContact CE2-CB 4.03Å; Y813-I843 HydrophobicContact CE2-CG1 4.46Å; Y813-I843 HydrophobicContact CE2-CG2 4.02Å; R839-I843 PolarHBondContact O-N 3.01Å; M840-I843 VanDerWaalsContact O-CG2 3.26Å; M840-I843 WeakPolarHBondContact O-CG2 3.35Å; I843-N845 VanDerWaalsContact C-N 3.29Å; I843-N845 PolarHBondContact O-N 3.37Å; I843-E846 PolarHBondContact O-N 3.04Å; I843-I847 HydrophobicContact CG1-CD1 3.97Å; I843-I847 HydrophobicContact CG1-CG1 4.37Å; I843-I847 WeakPolarHBondContact O-CG1 3.34Å; I843-I847 PolarHBondContact O-N 2.98Å
844	R	95.4	Very high	94.2	Very high	25 Å²	25	36.8 Å²	36.8	9%	0.094	18%	0.178	C	C	.	.	H	α-helix	trans	-66.4	-34	176.5	-78	179.2	177.6	179.8	-3.6	111.5	E814 M840 G841 N842 G848 C882 K885 N889	E814-R844 IonicContact OE1-CZ 3.78Å; E814-R844 IonicContact OE1-NE 2.73Å; E814-R844 IonicContact OE1-NH2 3.44Å; E814-R844 PolarHBondContact OE1-NH2 2.88Å; M840-R844 WeakPolarHBondContact O-CB 3.45Å; M840-R844 WeakPolarHBondContact O-CG 3.33Å; M840-R844 PolarHBondContact O-N 3.21Å; G841-R844 PolarHBondContact O-N 3.24Å; N842-R844 VanDerWaalsContact C-N 3.27Å; N842-R844 PolarHBondContact O-N 3.43Å; R844-G848 PolarHBondContact O-N 3.49Å; R844-C882 WeakPolarHBondContact O-CB 3.37Å; R844-K885 VanDerWaalsContact NH1-CB 3.31Å; R844-K885 PolarHBondContact NH1-O 3.31Å; R844-N889 PolarHBondContact NH1-ND2 3.38Å; R844-N889 PolarHBondContact NH1-OD1 3.5Å; R844-N889 VanDerWaalsContact NH1-OD1 3.14Å
845	N	95.3	Very high	94.1	Very high	26 Å²	26	33.6 Å²	33.6	14%	0.139	16%	0.159	C	C	.	.	H	α-helix	trans	-63.6	-48.7	169.8	-174.8	61	0	0	0	111.7	G841 N842 I843 I847 G848 V849 L902 N905	G841-N845 PolarHBondContact O-N 3.46Å; N842-N845 VanDerWaalsContact O-CB 3.29Å; N842-N845 WeakPolarHBondContact O-CB 3.43Å; N842-N845 PolarHBondContact O-N 3.05Å; N842-N845 VanDerWaalsContact O-N 3.11Å; I843-N845 VanDerWaalsContact C-N 3.29Å; I843-N845 PolarHBondContact O-N 3.37Å; N845-I847 PolarHBondContact O-N 3.27Å; N845-G848 PolarHBondContact O-N 3.23Å; N845-V849 WeakPolarHBondContact O-CB 3.49Å; N845-V849 VanDerWaalsContact O-CG2 3.31Å; N845-V849 WeakPolarHBondContact O-CG2 3.45Å; N845-V849 PolarHBondContact O-N 2.87Å; N845-L902 HydrophobicContact CB-CD1 3.86Å; N845-L902 HydrophobicContact CB-CD2 4.46Å; N845-L902 HydrophobicContact CB-CG 4.1Å; N845-N905 PolarHBondContact OD1-ND2 3.47Å
846	E	94.5	Very high	94	Very high	77 Å²	77	30.8 Å²	30.8	36%	0.36	15%	0.151	S	C	.	.	H	α-helix	trans	-60.2	-47.1	178.9	-65.8	-54	125.7	0	0	112.3	N842 I843 G848 V849 F850	N842-E846 PolarHBondContact O-N 3.36Å; I843-E846 PolarHBondContact O-N 3.04Å; E846-G848 VanDerWaalsContact C-N 3.33Å; E846-G848 PolarHBondContact O-N 2.86Å; E846-V849 PolarHBondContact O-N 3.24Å; E846-F850 WeakPolarHBondContact O-CB 3.47Å; E846-F850 PolarHBondContact O-N 2.93Å
847	I	94.4	Very high	93.8	Very high	13 Å²	13	32.9 Å²	32.9	7%	0.067	17%	0.168	C	C	.	.	H	α-helix	trans	-62	-42.8	175.2	-65.6	167.4	0	0	0	110.8	L806 C810 I843 N845 V849 F850 Y851 C882	L806-I847 HydrophobicContact CB-CD1 4.35Å; L806-I847 HydrophobicContact CB-CG1 3.77Å; C810-I847 HydrophobicContact CB-CD1 3.67Å; I843-I847 HydrophobicContact CG1-CD1 3.97Å; I843-I847 HydrophobicContact CG1-CG1 4.37Å; I843-I847 WeakPolarHBondContact O-CG1 3.34Å; I843-I847 PolarHBondContact O-N 2.98Å; N845-I847 PolarHBondContact O-N 3.27Å; I847-V849 VanDerWaalsContact C-N 3.34Å; I847-V849 PolarHBondContact O-N 2.85Å; I847-F850 WeakPolarHBondContact O-CB 3.45Å; I847-F850 PolarHBondContact O-N 3.29Å; I847-Y851 HydrophobicContact CG2-CD2 3.7Å; I847-Y851 HydrophobicContact CG2-CE2 3.33Å; I847-Y851 VanDerWaalsContact O-CD2 3.28Å; I847-Y851 WeakPolarHBondContact O-CD2 3.25Å; I847-Y851 PolarHBondContact O-N 3.44Å; I847-Y851 VanDerWaalsContact O-N 3.08Å; I847-C882 HydrophobicContact CG2-CB 4.45Å; I847-C882 VanDerWaalsContact CG2-SG 3.51Å
848	G	95.5	Very high	93.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-60.3	-44.4	177.8	0	0	0	0	0	112	R844 N845 E846 M852 S879	R844-G848 PolarHBondContact O-N 3.49Å; N845-G848 PolarHBondContact O-N 3.23Å; E846-G848 VanDerWaalsContact C-N 3.33Å; E846-G848 PolarHBondContact O-N 2.86Å; G848-M852 VanDerWaalsContact O-CB 3.3Å; G848-M852 WeakPolarHBondContact O-CB 3.41Å; G848-M852 PolarHBondContact O-N 3.39Å; G848-S879 WeakPolarHBondContact O-CB 3.4Å; G848-S879 PolarHBondContact O-OG 3.32Å
849	V	95.1	Very high	92.7	Very high	30 Å²	30	33.4 Å²	33.4	18%	0.182	17%	0.174	C	C	.	.	H	α-helix	trans	-68.1	-39.8	176.8	171.8	0	0	0	0	111.4	N845 E846 I847 M852 N853 F883	N845-V849 WeakPolarHBondContact O-CB 3.49Å; N845-V849 VanDerWaalsContact O-CG2 3.31Å; N845-V849 WeakPolarHBondContact O-CG2 3.45Å; N845-V849 PolarHBondContact O-N 2.87Å; E846-V849 PolarHBondContact O-N 3.24Å; I847-V849 VanDerWaalsContact C-N 3.34Å; I847-V849 PolarHBondContact O-N 2.85Å; V849-M852 HydrophobicContact CB-CE 4.47Å; V849-M852 HydrophobicContact CG1-CE 4.32Å; V849-M852 HydrophobicContact CG2-CE 4.16Å; V849-M852 PolarHBondContact O-N 3.42Å; V849-N853 WeakPolarHBondContact CG1-ND2 3.43Å; V849-N853 WeakPolarHBondContact O-CB 3.45Å; V849-N853 VanDerWaalsContact O-CG 3.29Å; V849-N853 PolarHBondContact O-N 2.95Å; V849-N853 PolarHBondContact O-ND2 3.03Å; V849-F883 HydrophobicContact CG2-CE1 4.16Å; V849-F883 HydrophobicContact CG2-CZ 4.14Å
850	F	94	Very high	91.9	Very high	50 Å²	50	35.2 Å²	35.2	22%	0.219	19%	0.194	C	C	.	.	H	α-helix	trans	-55.3	-54	174.9	171.2	-98.8	0	0	0	111.5	L802 E803 L806 E846 I847 M852 N853 Q854	L802-F850 HydrophobicContact CD2-CD2 4.1Å; L802-F850 HydrophobicContact CD2-CE2 3.86Å; L802-F850 HydrophobicContact CG-CE2 4.31Å; E803-F850 HydrophobicContact CB-CE1 3.83Å; E803-F850 HydrophobicContact CB-CZ 4.08Å; E803-F850 HydrophobicContact CG-CE1 4.18Å; L806-F850 HydrophobicContact CD1-CB 4.26Å; L806-F850 HydrophobicContact CD1-CG 4.27Å; E846-F850 WeakPolarHBondContact O-CB 3.47Å; E846-F850 PolarHBondContact O-N 2.93Å; I847-F850 WeakPolarHBondContact O-CB 3.45Å; I847-F850 PolarHBondContact O-N 3.29Å; F850-M852 VanDerWaalsContact C-N 3.34Å; F850-M852 PolarHBondContact O-N 3.4Å; F850-N853 PolarHBondContact O-N 2.89Å; F850-Q854 WeakPolarHBondContact O-CB 3.4Å; F850-Q854 PolarHBondContact O-N 3.22Å
851	Y	95.2	Very high	91	Very high	22 Å²	22	41.9 Å²	41.9	9%	0.086	23%	0.226	C	C	.	.	H	α-helix	trans	-66.6	-34.1	178.1	-68.8	-51.3	0	0	0	113.1	E803 I847 Q854 A855 L875 K878	E803-Y851 VanDerWaalsContact CD-OH 3.26Å; E803-Y851 HydrophobicContact CG-CE1 4.08Å; E803-Y851 WeakPolarHBondContact CG-OH 3.33Å; E803-Y851 VanDerWaalsContact OE1-CE1 3.26Å; E803-Y851 WeakPolarHBondContact OE1-CE1 3.24Å; E803-Y851 VanDerWaalsContact OE1-CZ 3.3Å; E803-Y851 PolarHBondContact OE1-OH 2.95Å; I847-Y851 HydrophobicContact CG2-CD2 3.7Å; I847-Y851 HydrophobicContact CG2-CE2 3.33Å; I847-Y851 VanDerWaalsContact O-CD2 3.28Å; I847-Y851 WeakPolarHBondContact O-CD2 3.25Å; I847-Y851 PolarHBondContact O-N 3.44Å; I847-Y851 VanDerWaalsContact O-N 3.08Å; Y851-Q854 PolarHBondContact O-N 3.2Å; Y851-A855 WeakPolarHBondContact O-CB 3.36Å; Y851-A855 PolarHBondContact O-N 3.27Å; Y851-L875 HydrophobicContact CD1-CD2 3.7Å; Y851-L875 HydrophobicContact CE1-CD2 4.38Å; Y851-L875 HydrophobicContact CG-CD2 4.48Å; Y851-K878 HydrophobicContact CD1-CB 4.48Å; Y851-K878 HydrophobicContact CD1-CD 4.14Å; Y851-K878 HydrophobicContact CD2-CB 3.64Å; Y851-K878 HydrophobicContact CD2-CD 4.37Å; Y851-K878 HydrophobicContact CE1-CD 3.68Å; Y851-K878 HydrophobicContact CE2-CB 3.79Å; Y851-K878 HydrophobicContact CE2-CD 3.92Å; Y851-K878 HydrophobicContact CE2-CG 4.42Å; Y851-K878 HydrophobicContact CG-CB 4Å; Y851-K878 HydrophobicContact CG-CD 4.46Å
852	M	94.6	Very high	89.7	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.2	-45.1	175.6	-179.6	178.1	63.5	0	0	111.3	G848 V849 F850 A855 A856 R908 L909 I912	G848-M852 VanDerWaalsContact O-CB 3.3Å; G848-M852 WeakPolarHBondContact O-CB 3.41Å; G848-M852 PolarHBondContact O-N 3.39Å; V849-M852 HydrophobicContact CB-CE 4.47Å; V849-M852 HydrophobicContact CG1-CE 4.32Å; V849-M852 HydrophobicContact CG2-CE 4.16Å; V849-M852 PolarHBondContact O-N 3.42Å; F850-M852 VanDerWaalsContact C-N 3.34Å; F850-M852 PolarHBondContact O-N 3.4Å; M852-A855 PolarHBondContact O-N 2.89Å; M852-A856 PolarHBondContact O-N 3.17Å; M852-R908 HydrophobicContact CE-CG 4.38Å; M852-R908 HydrophobicContact SD-CB 4.13Å; M852-R908 HydrophobicContact SD-CG 3.97Å; M852-L909 HydrophobicContact CB-CD1 4.22Å; M852-L909 HydrophobicContact CG-CB 4.34Å; M852-L909 HydrophobicContact CG-CD1 3.96Å; M852-L909 HydrophobicContact SD-CB 3.96Å; M852-I912 HydrophobicContact CG-CD1 3.38Å; M852-I912 HydrophobicContact SD-CD1 3.93Å
853	N	93.9	Very high	87.8	Confident	75 Å²	75	48.4 Å²	48.4	40%	0.401	26%	0.259	S	S	.	.	H	α-helix	trans	-68.4	-38.2	178.1	-71.1	-20	0	0	0	111.5	V849 F850 A855 A856 A857	V849-N853 WeakPolarHBondContact CG1-ND2 3.43Å; V849-N853 WeakPolarHBondContact O-CB 3.45Å; V849-N853 VanDerWaalsContact O-CG 3.29Å; V849-N853 PolarHBondContact O-N 2.95Å; V849-N853 PolarHBondContact O-ND2 3.03Å; F850-N853 PolarHBondContact O-N 2.89Å; N853-A855 VanDerWaalsContact C-N 3.32Å; N853-A855 PolarHBondContact O-N 3.18Å; N853-A856 PolarHBondContact O-N 3.15Å; N853-A857 PolarHBondContact O-N 3.37Å
854	Q	91.3	Very high	85.8	Confident	77 Å²	77	54.9 Å²	54.9	36%	0.36	30%	0.299	S	S	.	.	H	α-helix	trans	-62.3	-40.1	173.8	-166.7	177.3	32.2	0	0	111.7	F850 Y851 A857 L858 L875	F850-Q854 WeakPolarHBondContact O-CB 3.4Å; F850-Q854 PolarHBondContact O-N 3.22Å; Y851-Q854 PolarHBondContact O-N 3.2Å; Q854-A857 PolarHBondContact O-N 2.99Å; Q854-L858 WeakPolarHBondContact O-CG 3.47Å; Q854-L858 PolarHBondContact O-N 3.11Å; Q854-L858 VanDerWaalsContact O-N 3.1Å; Q854-L875 HydrophobicContact CB-CD1 4.23Å; Q854-L875 HydrophobicContact CG-CD1 3.95Å
855	A	90.3	Very high	83.8	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-64.1	-42.7	174.1	0	0	0	0	0	112	Y851 M852 N853 A857 L858 Q859 L875	Y851-A855 WeakPolarHBondContact O-CB 3.36Å; Y851-A855 PolarHBondContact O-N 3.27Å; M852-A855 PolarHBondContact O-N 2.89Å; N853-A855 VanDerWaalsContact C-N 3.32Å; N853-A855 PolarHBondContact O-N 3.18Å; A855-A857 PolarHBondContact O-N 2.94Å; A855-L858 PolarHBondContact O-N 3.33Å; A855-Q859 PolarHBondContact O-N 3.03Å; A855-Q859 VanDerWaalsContact O-N 3.09Å; A855-L875 HydrophobicContact CB-CB 4.04Å; A855-L875 HydrophobicContact CB-CD1 4.27Å
856	A	89.4	Confident	82.1	Confident	34 Å²	34	63.8 Å²	63.8	28%	0.281	34%	0.343	S	S	.	.	H	α-helix	trans	-64.3	-38.2	176.6	0	0	0	0	0	112.8	M852 N853 Q859 S860 I912	M852-A856 PolarHBondContact O-N 3.17Å; N853-A856 PolarHBondContact O-N 3.15Å; A856-Q859 WeakPolarHBondContact O-CB 3.27Å; A856-Q859 PolarHBondContact O-N 3.27Å; A856-S860 PolarHBondContact O-N 3.36Å; A856-S860 VanDerWaalsContact O-N 3.1Å; A856-I912 HydrophobicContact CB-CD1 4.22Å; A856-I912 HydrophobicContact CB-CG2 4.43Å
857	A	88.8	Confident	80.8	Confident	44 Å²	44	64.2 Å²	64.2	36%	0.364	36%	0.355	S	S	.	.	H	α-helix	trans	-63.5	-48	175.8	0	0	0	0	0	111.5	N853 Q854 A855 Q859 S860 E861	N853-A857 PolarHBondContact O-N 3.37Å; Q854-A857 PolarHBondContact O-N 2.99Å; A855-A857 PolarHBondContact O-N 2.94Å; A857-Q859 PolarHBondContact O-N 3.48Å; A857-S860 PolarHBondContact O-N 2.97Å; A857-S860 PolarHBondContact O-OG 3.48Å; A857-E861 PolarHBondContact O-N 2.92Å
858	L	85.3	Confident	80.1	Confident	63 Å²	63	64.8 Å²	64.8	33%	0.33	36%	0.359	S	S	.	.	H	α-helix	trans	-58.7	-32.9	175.2	-73.4	175.7	0	0	0	112.6	Q854 A855 R862 L875	Q854-L858 WeakPolarHBondContact O-CG 3.47Å; Q854-L858 PolarHBondContact O-N 3.11Å; Q854-L858 VanDerWaalsContact O-N 3.1Å; A855-L858 PolarHBondContact O-N 3.33Å; L858-R862 WeakPolarHBondContact O-CD 3.32Å; L858-R862 WeakPolarHBondContact O-CG 3.28Å; L858-L875 HydrophobicContact CD1-CD1 3.5Å; L858-L875 VanDerWaalsContact CD1-CD1 3.5Å
859	Q	80	Confident	79.5	Confident	45 Å²	45	66.9 Å²	66.9	21%	0.21	37%	0.374	C	S	.	.	H	α-helix	trans	-68.1	-39.9	175	-166	-170.6	-12.5	0	0	112	A855 A856 A857 E861 R862 Q915	A855-Q859 PolarHBondContact O-N 3.03Å; A855-Q859 VanDerWaalsContact O-N 3.09Å; A856-Q859 WeakPolarHBondContact O-CB 3.27Å; A856-Q859 PolarHBondContact O-N 3.27Å; A857-Q859 PolarHBondContact O-N 3.48Å; Q859-E861 VanDerWaalsContact C-N 3.32Å; Q859-E861 PolarHBondContact O-N 3.29Å; Q859-R862 WeakPolarHBondContact O-CB 3.41Å; Q859-R862 PolarHBondContact O-N 3.07Å; Q859-Q915 PolarHBondContact NE2-O 3.06Å; Q859-Q915 VanDerWaalsContact NE2-O 3.1Å
860	S	77.8	Confident	79	Confident	90 Å²	90	68.6 Å²	68.6	63%	0.629	39%	0.391	S	S	*	.	H	α-helix	trans	-67.8	-30.1	178.6	71	0	0	0	0	113.6	A856 A857 R862	A856-S860 PolarHBondContact O-N 3.36Å; A856-S860 VanDerWaalsContact O-N 3.1Å; A857-S860 PolarHBondContact O-N 2.97Å; A857-S860 PolarHBondContact O-OG 3.48Å; S860-R862 VanDerWaalsContact C-N 3.29Å; S860-R862 PolarHBondContact O-N 3.43Å
861	E	75.1	Confident	78.6	Confident	145 Å²	145	68.5 Å²	68.5	68%	0.678	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-13.4	177.7	-67.2	176.5	179.7	0	0	113.1	A857 Q859 V863	A857-E861 PolarHBondContact O-N 2.92Å; Q859-E861 VanDerWaalsContact C-N 3.32Å; Q859-E861 PolarHBondContact O-N 3.29Å; E861-V863 VanDerWaalsContact C-N 3.31Å; E861-V863 PolarHBondContact O-N 3.34Å
862	R	67.4	Low	78.2	Confident	73 Å²	73	67.5 Å²	67.5	28%	0.275	40%	0.396	S	S	.	.			trans	-79.4	72.9	-179.6	-80.7	164.6	154.3	-125.7	-36.3	112	L858 Q859 S860 V864 S865 S867 V868 E872	L858-R862 WeakPolarHBondContact O-CD 3.32Å; L858-R862 WeakPolarHBondContact O-CG 3.28Å; Q859-R862 WeakPolarHBondContact O-CB 3.41Å; Q859-R862 PolarHBondContact O-N 3.07Å; S860-R862 VanDerWaalsContact C-N 3.29Å; S860-R862 PolarHBondContact O-N 3.43Å; R862-V864 VanDerWaalsContact C-N 3.33Å; R862-S865 PolarHBondContact NH2-OG 3.08Å; R862-S867 VanDerWaalsContact CZ-O 3.26Å; R862-S867 PolarHBondContact NH1-O 3.31Å; R862-S867 PolarHBondContact NH2-O 2.95Å; R862-V868 VanDerWaalsContact NH1-CA 3.31Å; R862-E872 IonicContact CZ-OE2 3.38Å; R862-E872 IonicContact NE-OE2 3.71Å; R862-E872 IonicContact NH1-OE2 2.73Å; R862-E872 PolarHBondContact NH1-OE2 3.38Å
863	V	54.3	Low	77.9	Confident	127 Å²	127	71.4 Å²	71.4	77%	0.77	41%	0.414	S	S	*	.	S	Bend	trans	-79.9	-13.3	173.6	-177.5	0	0	0	0	112.4	E861	E861-V863 VanDerWaalsContact C-N 3.31Å; E861-V863 PolarHBondContact O-N 3.34Å
864	V	53.2	Low	77.9	Confident	136 Å²	136	73.8 Å²	73.8	82%	0.824	42%	0.423	S	S	*	.	S	Bend	trans	-130.1	-17.7	-167.5	-172.6	0	0	0	0	116.3	R862	R862-V864 VanDerWaalsContact C-N 3.33Å
865	S	54	Low	78	Confident	54 Å²	54	70.9 Å²	70.9	38%	0.378	41%	0.41	S	S	.	.			trans	-97	132	-172.8	88.5	0	0	0	0	114.1	R862 S867	R862-S865 PolarHBondContact NH2-OG 3.08Å; S865-S867 PolarHBondContact O-N 3.06Å
866	K	59.8	Low	78.1	Confident	184 Å²	184	71.7 Å²	71.7	80%	0.8	41%	0.413	S	S	*	.	S	Bend	trans	-80.8	-5.5	-174.9	-70.1	179.5	177.9	176.6	0	116.2
867	S	68	Low	78.4	Confident	87 Å²	87	77.1 Å²	77.1	61%	0.608	43%	0.43	S	S	*	.	S	Bend	trans	-139.5	153.9	-173.3	58.4	0	0	0	0	113.6	R862 S865 S869	R862-S867 VanDerWaalsContact CZ-O 3.26Å; R862-S867 PolarHBondContact NH1-O 3.31Å; R862-S867 PolarHBondContact NH2-O 2.95Å; S865-S867 PolarHBondContact O-N 3.06Å; S867-S869 PolarHBondContact O-N 3.5Å
868	V	78.7	Confident	78.7	Confident	25 Å²	25	79.1 Å²	79.1	15%	0.152	43%	0.43	C	S	.	.			trans	-59.3	130.5	174.8	-176.4	0	0	0	0	110.6	R862 E872 Q873 W876 A916	R862-V868 VanDerWaalsContact NH1-CA 3.31Å; V868-E872 HydrophobicContact CG1-CB 4.4Å; V868-Q873 HydrophobicContact CG1-CG 3.62Å; V868-W876 HydrophobicContact CB-CH2 4.4Å; V868-W876 HydrophobicContact CG1-CH2 3.37Å; V868-W876 HydrophobicContact CG1-CZ2 4.05Å; V868-W876 HydrophobicContact CG1-CZ3 3.83Å; V868-W876 HydrophobicContact CG2-CH2 4.1Å; V868-A916 HydrophobicContact CG2-CB 4.33Å
869	S	82.9	Confident	79.2	Confident	43 Å²	43	76.1 Å²	76.1	30%	0.301	42%	0.415	S	S	.	.			trans	-77.8	147.6	178.5	172.8	0	0	0	0	110.7	S867 A871 E872 Q873	S867-S869 PolarHBondContact O-N 3.5Å; S869-A871 PolarHBondContact O-N 2.89Å; S869-A871 PolarHBondContact OG-N 3.32Å; S869-A871 VanDerWaalsContact OG-N 3.13Å; S869-E872 WeakPolarHBondContact O-CB 3.45Å; S869-E872 PolarHBondContact O-N 3.45Å; S869-Q873 PolarHBondContact O-N 3.01Å; S869-Q873 VanDerWaalsContact O-N 3.14Å
870	A	84.9	Confident	80	Confident	67 Å²	67	76.6 Å²	76.6	55%	0.554	42%	0.416	S	S	*	.	H	α-helix	trans	-58.2	-34.1	170.4	0	0	0	0	0	112.2	Q873 Q874	A870-Q873 PolarHBondContact O-N 3.35Å; A870-Q874 WeakPolarHBondContact O-CG 3.28Å; A870-Q874 PolarHBondContact O-N 3.24Å
871	A	85.4	Confident	80.8	Confident	47 Å²	47	74.4 Å²	74.4	39%	0.388	40%	0.401	S	S	.	.	H	α-helix	trans	-65.8	-40.3	177.1	0	0	0	0	0	112	S869 Q874 L875	S869-A871 PolarHBondContact O-N 2.89Å; S869-A871 PolarHBondContact OG-N 3.32Å; S869-A871 VanDerWaalsContact OG-N 3.13Å; A871-Q874 WeakPolarHBondContact O-CB 3.15Å; A871-Q874 PolarHBondContact O-N 3.27Å; A871-L875 WeakPolarHBondContact O-CG 3.46Å; A871-L875 PolarHBondContact O-N 3.29Å; A871-L875 VanDerWaalsContact O-N 3.11Å
872	E	86.4	Confident	81.8	Confident	1 Å²	1	68.5 Å²	68.5	1%	0.005	38%	0.375	C	S	.	.	H	α-helix	trans	-65.3	-43.9	177.7	-164.6	-178.6	177.5	0	0	111.1	R862 V868 S869 Q874 L875 W876 A916	R862-E872 IonicContact CZ-OE2 3.38Å; R862-E872 IonicContact NE-OE2 3.71Å; R862-E872 IonicContact NH1-OE2 2.73Å; R862-E872 PolarHBondContact NH1-OE2 3.38Å; V868-E872 HydrophobicContact CG1-CB 4.4Å; S869-E872 WeakPolarHBondContact O-CB 3.45Å; S869-E872 PolarHBondContact O-N 3.45Å; E872-Q874 VanDerWaalsContact C-N 3.29Å; E872-Q874 PolarHBondContact O-N 2.84Å; E872-L875 PolarHBondContact O-N 3.22Å; E872-W876 HydrophobicContact CG-CZ2 3.65Å; E872-W876 VanDerWaalsContact O-CD1 3.29Å; E872-W876 VanDerWaalsContact O-CG 3.28Å; E872-W876 PolarHBondContact O-N 2.91Å; E872-W876 WeakPolarHBondContact OE1-CZ2 3.33Å; E872-A916 WeakPolarHBondContact OE1-CB 3.26Å
873	Q	89.6	Confident	83.2	Confident	82 Å²	82	65 Å²	65	38%	0.383	36%	0.362	S	S	.	.	H	α-helix	trans	-63.3	-33.9	174.8	-66.4	-179.9	4.1	0	0	113	V868 S869 A870 W876 K877	V868-Q873 HydrophobicContact CG1-CG 3.62Å; S869-Q873 PolarHBondContact O-N 3.01Å; S869-Q873 VanDerWaalsContact O-N 3.14Å; A870-Q873 PolarHBondContact O-N 3.35Å; Q873-W876 HydrophobicContact CB-CE3 4.39Å; Q873-W876 HydrophobicContact CG-CE3 4.04Å; Q873-W876 HydrophobicContact CG-CZ3 3.94Å; Q873-W876 PolarHBondContact O-N 2.87Å; Q873-K877 WeakPolarHBondContact O-CG 3.46Å; Q873-K877 PolarHBondContact O-N 2.98Å; Q873-K877 VanDerWaalsContact O-N 3.08Å
874	Q	92.8	Very high	85.2	Confident	126 Å²	126	64.3 Å²	64.3	59%	0.589	35%	0.35	S	S	*	.	H	α-helix	trans	-65.4	-42.7	174.5	-76.9	177.6	-8.3	0	0	111.3	A870 A871 E872 W876 K877 K878	A870-Q874 WeakPolarHBondContact O-CG 3.28Å; A870-Q874 PolarHBondContact O-N 3.24Å; A871-Q874 WeakPolarHBondContact O-CB 3.15Å; A871-Q874 PolarHBondContact O-N 3.27Å; E872-Q874 VanDerWaalsContact C-N 3.29Å; E872-Q874 PolarHBondContact O-N 2.84Å; Q874-W876 PolarHBondContact O-N 3.13Å; Q874-K877 PolarHBondContact O-N 3.18Å; Q874-K878 WeakPolarHBondContact O-CG 3.3Å; Q874-K878 PolarHBondContact O-N 3.46Å
875	L	92.9	Very high	87.2	Confident	16 Å²	16	62.6 Å²	62.6	8%	0.084	33%	0.332	C	S	.	.	H	α-helix	trans	-62.8	-40.7	175.6	-67.1	173.4	0	0	0	112.1	Y851 Q854 A855 L858 A871 E872 K877 K878 S879	Y851-L875 HydrophobicContact CD1-CD2 3.7Å; Y851-L875 HydrophobicContact CE1-CD2 4.38Å; Y851-L875 HydrophobicContact CG-CD2 4.48Å; Q854-L875 HydrophobicContact CB-CD1 4.23Å; Q854-L875 HydrophobicContact CG-CD1 3.95Å; A855-L875 HydrophobicContact CB-CB 4.04Å; A855-L875 HydrophobicContact CB-CD1 4.27Å; L858-L875 HydrophobicContact CD1-CD1 3.5Å; L858-L875 VanDerWaalsContact CD1-CD1 3.5Å; A871-L875 WeakPolarHBondContact O-CG 3.46Å; A871-L875 PolarHBondContact O-N 3.29Å; A871-L875 VanDerWaalsContact O-N 3.11Å; E872-L875 PolarHBondContact O-N 3.22Å; L875-K877 PolarHBondContact O-N 3.45Å; L875-K878 PolarHBondContact O-N 3.44Å; L875-S879 WeakPolarHBondContact O-CB 3.03Å; L875-S879 PolarHBondContact O-N 3.49Å
876	W	94	Very high	89.2	Confident	16 Å²	16	60 Å²	60	6%	0.061	31%	0.314	C	S	.	.	H	α-helix	trans	-60.3	-44.7	174.3	-57.5	-18.1	0	0	0	112.2	V868 E872 Q873 Q874 S879 F880 C913 A916	V868-W876 HydrophobicContact CB-CH2 4.4Å; V868-W876 HydrophobicContact CG1-CH2 3.37Å; V868-W876 HydrophobicContact CG1-CZ2 4.05Å; V868-W876 HydrophobicContact CG1-CZ3 3.83Å; V868-W876 HydrophobicContact CG2-CH2 4.1Å; E872-W876 HydrophobicContact CG-CZ2 3.65Å; E872-W876 VanDerWaalsContact O-CD1 3.29Å; E872-W876 VanDerWaalsContact O-CG 3.28Å; E872-W876 PolarHBondContact O-N 2.91Å; E872-W876 WeakPolarHBondContact OE1-CZ2 3.33Å; Q873-W876 HydrophobicContact CB-CE3 4.39Å; Q873-W876 HydrophobicContact CG-CE3 4.04Å; Q873-W876 HydrophobicContact CG-CZ3 3.94Å; Q873-W876 PolarHBondContact O-N 2.87Å; Q874-W876 PolarHBondContact O-N 3.13Å; W876-S879 PolarHBondContact O-N 3.23Å; W876-F880 VanDerWaalsContact O-CB 3.22Å; W876-F880 WeakPolarHBondContact O-CB 3.39Å; W876-F880 PolarHBondContact O-N 3.08Å; W876-C913 HydrophobicContact CD2-CB 4.35Å; W876-C913 HydrophobicContact CE3-CB 4.27Å; W876-C913 HydrophobicContact CH2-CB 4.28Å; W876-C913 HydrophobicContact CZ2-CB 4.37Å; W876-C913 HydrophobicContact CZ3-CB 4.23Å; W876-A916 HydrophobicContact CH2-CB 3.69Å; W876-A916 HydrophobicContact CZ2-CB 3.41Å; W876-A916 VanDerWaalsContact CZ2-CB 3.41Å
877	K	94.7	Very high	90.9	Very high	148 Å²	148	52 Å²	52	64%	0.643	28%	0.28	S	S	*	.	H	α-helix	trans	-63.3	-42.7	177.7	-73.9	175.9	-178.3	179.5	0	111.7	Q873 Q874 L875 S881	Q873-K877 WeakPolarHBondContact O-CG 3.46Å; Q873-K877 PolarHBondContact O-N 2.98Å; Q873-K877 VanDerWaalsContact O-N 3.08Å; Q874-K877 PolarHBondContact O-N 3.18Å; L875-K877 PolarHBondContact O-N 3.45Å; K877-S881 VanDerWaalsContact O-CB 3.31Å; K877-S881 WeakPolarHBondContact O-CB 3.47Å; K877-S881 PolarHBondContact O-N 2.92Å
878	K	94.4	Very high	92.2	Very high	87 Å²	87	53.5 Å²	53.5	38%	0.378	28%	0.277	S	S	.	.	H	α-helix	trans	-61.6	-50.1	175.6	-72.5	-173.4	176.4	-174.3	0	111.1	E803 Y851 Q874 L875 S881 C882	E803-K878 IonicContact OE1-NZ 3.65Å; E803-K878 PolarHBondContact OE1-NZ 2.99Å; Y851-K878 HydrophobicContact CD1-CB 4.48Å; Y851-K878 HydrophobicContact CD1-CD 4.14Å; Y851-K878 HydrophobicContact CD2-CB 3.64Å; Y851-K878 HydrophobicContact CD2-CD 4.37Å; Y851-K878 HydrophobicContact CE1-CD 3.68Å; Y851-K878 HydrophobicContact CE2-CB 3.79Å; Y851-K878 HydrophobicContact CE2-CD 3.92Å; Y851-K878 HydrophobicContact CE2-CG 4.42Å; Y851-K878 HydrophobicContact CG-CB 4Å; Y851-K878 HydrophobicContact CG-CD 4.46Å; Q874-K878 WeakPolarHBondContact O-CG 3.3Å; Q874-K878 PolarHBondContact O-N 3.46Å; L875-K878 PolarHBondContact O-N 3.44Å; K878-S881 PolarHBondContact O-N 3.38Å; K878-C882 PolarHBondContact O-N 3.18Å; K878-C882 VanDerWaalsContact O-N 3.08Å; K878-C882 PolarHBondContact O-SG 3.45Å
879	S	96.3	Very high	92.9	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-58.6	-49.6	178.4	-178.3	0	0	0	0	111.8	G848 L875 W876 S881 C882 F883	G848-S879 WeakPolarHBondContact O-CB 3.4Å; G848-S879 PolarHBondContact O-OG 3.32Å; L875-S879 WeakPolarHBondContact O-CB 3.03Å; L875-S879 PolarHBondContact O-N 3.49Å; W876-S879 PolarHBondContact O-N 3.23Å; S879-S881 PolarHBondContact O-N 3.02Å; S879-C882 WeakPolarHBondContact O-CB 3.31Å; S879-C882 PolarHBondContact O-N 3.02Å; S879-F883 WeakPolarHBondContact O-CD2 3.43Å; S879-F883 PolarHBondContact O-N 3.05Å; S879-F883 WeakPolarHBondContact OG-CE2 3.27Å
880	F	96.4	Very high	93.5	Very high	55 Å²	55	50.6 Å²	50.6	24%	0.241	26%	0.257	C	S	.	.	H	α-helix	trans	-59.9	-47	178.2	-176.1	-94.7	0	0	0	112.4	W876 C882 F883 E884 T906 L909 M910 Y942	W876-F880 VanDerWaalsContact O-CB 3.22Å; W876-F880 WeakPolarHBondContact O-CB 3.39Å; W876-F880 PolarHBondContact O-N 3.08Å; F880-C882 PolarHBondContact O-N 3.21Å; F880-F883 PolarHBondContact O-N 3.4Å; F880-E884 HydrophobicContact CE1-CB 4.37Å; F880-E884 WeakPolarHBondContact O-CB 3.44Å; F880-E884 PolarHBondContact O-N 2.97Å; F880-T906 HydrophobicContact CD2-CG2 3.96Å; F880-T906 HydrophobicContact CE2-CG2 3.82Å; F880-L909 HydrophobicContact CB-CD2 3.98Å; F880-M910 HydrophobicContact CD2-CE 3.86Å; F880-M910 HydrophobicContact CE2-CE 4.35Å; F880-Y942 HydrophobicContact CE2-CE2 4.33Å; F880-Y942 AromaticContact CE2-CZ 3.87Å; F880-Y942 VanDerWaalsContact CE2-OH 3.25Å; F880-Y942 WeakPolarHBondContact CE2-OH 3.48Å; F880-Y942 WeakPolarHBondContact CZ-OH 3.3Å
881	S	96.3	Very high	94	Very high	43 Å²	43	53 Å²	53	30%	0.301	26%	0.257	S	S	.	.	H	α-helix	trans	-60.4	-37.1	178.6	-175.4	0	0	0	0	111.7	K877 K878 S879 K885	K877-S881 VanDerWaalsContact O-CB 3.31Å; K877-S881 WeakPolarHBondContact O-CB 3.47Å; K877-S881 PolarHBondContact O-N 2.92Å; K878-S881 PolarHBondContact O-N 3.38Å; S879-S881 PolarHBondContact O-N 3.02Å; S881-K885 WeakPolarHBondContact O-CB 3.31Å; S881-K885 VanDerWaalsContact O-CG 3.23Å; S881-K885 WeakPolarHBondContact O-CG 3.39Å; S881-K885 PolarHBondContact O-N 3.3Å; S881-K885 VanDerWaalsContact O-N 3.12Å
882	C	95.6	Very high	94.2	Very high	22 Å²	22	53.7 Å²	53.7	15%	0.149	26%	0.259	C	S	.	.	H	α-helix	trans	-66.4	-46.6	176.1	-63.9	0	0	0	0	111.6	R844 I847 K878 S879 F880 K885 G886	R844-C882 WeakPolarHBondContact O-CB 3.37Å; I847-C882 HydrophobicContact CG2-CB 4.45Å; I847-C882 VanDerWaalsContact CG2-SG 3.51Å; K878-C882 PolarHBondContact O-N 3.18Å; K878-C882 VanDerWaalsContact O-N 3.08Å; K878-C882 PolarHBondContact O-SG 3.45Å; S879-C882 WeakPolarHBondContact O-CB 3.31Å; S879-C882 PolarHBondContact O-N 3.02Å; F880-C882 PolarHBondContact O-N 3.21Å; C882-K885 PolarHBondContact O-N 2.91Å; C882-G886 PolarHBondContact O-N 2.93Å
883	F	97	Very high	94.5	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-63.6	-45.9	178	-63.6	-42.9	0	0	0	112.8	V849 S879 F880 K885 G886 I887 L902 N905 T906 L909	V849-F883 HydrophobicContact CG2-CE1 4.16Å; V849-F883 HydrophobicContact CG2-CZ 4.14Å; S879-F883 WeakPolarHBondContact O-CD2 3.43Å; S879-F883 PolarHBondContact O-N 3.05Å; S879-F883 WeakPolarHBondContact OG-CE2 3.27Å; F880-F883 PolarHBondContact O-N 3.4Å; F883-K885 VanDerWaalsContact C-N 3.35Å; F883-K885 PolarHBondContact O-N 3.44Å; F883-G886 PolarHBondContact O-N 2.79Å; F883-G886 VanDerWaalsContact O-N 3.1Å; F883-I887 VanDerWaalsContact O-CG1 3.27Å; F883-I887 WeakPolarHBondContact O-CG1 3.45Å; F883-I887 PolarHBondContact O-N 2.74Å; F883-L902 HydrophobicContact CD1-CG 4.4Å; F883-N905 HydrophobicContact CD1-CB 4.4Å; F883-N905 HydrophobicContact CE1-CB 3.83Å; F883-N905 HydrophobicContact CE2-CB 4.25Å; F883-N905 HydrophobicContact CZ-CB 3.75Å; F883-T906 VanDerWaalsContact CB-OG1 3.28Å; F883-T906 WeakPolarHBondContact CB-OG1 3.43Å; F883-L909 HydrophobicContact CD2-CD2 4.33Å; F883-L909 HydrophobicContact CE2-CB 4.33Å; F883-L909 HydrophobicContact CE2-CD2 4.31Å
884	E	96.1	Very high	94.5	Very high	111 Å²	111	59.9 Å²	59.9	52%	0.519	29%	0.288	S	S	.	.	H	α-helix	trans	-58	-48.3	178.1	-179.4	179.1	-124.2	0	0	111.5	F880 G886 I887 H888	F880-E884 HydrophobicContact CE1-CB 4.37Å; F880-E884 WeakPolarHBondContact O-CB 3.44Å; F880-E884 PolarHBondContact O-N 2.97Å; E884-G886 VanDerWaalsContact C-N 3.3Å; E884-G886 PolarHBondContact O-N 3.34Å; E884-I887 PolarHBondContact O-N 3.23Å; E884-H888 PolarHBondContact O-N 3.23Å; E884-H888 VanDerWaalsContact O-N 3.13Å
885	K	95.1	Very high	94.5	Very high	100 Å²	100	55.3 Å²	55.3	44%	0.435	27%	0.268	S	S	.	.	H	α-helix	trans	-62.3	-35	174.9	-83.9	-174.9	-178.9	-176.5	0	113	R844 S881 C882 F883 N889	R844-K885 VanDerWaalsContact NH1-CB 3.31Å; R844-K885 PolarHBondContact NH1-O 3.31Å; S881-K885 WeakPolarHBondContact O-CB 3.31Å; S881-K885 VanDerWaalsContact O-CG 3.23Å; S881-K885 WeakPolarHBondContact O-CG 3.39Å; S881-K885 PolarHBondContact O-N 3.3Å; S881-K885 VanDerWaalsContact O-N 3.12Å; C882-K885 PolarHBondContact O-N 2.91Å; F883-K885 VanDerWaalsContact C-N 3.35Å; F883-K885 PolarHBondContact O-N 3.44Å; K885-N889 VanDerWaalsContact O-CG 3.28Å; K885-N889 PolarHBondContact O-N 3.45Å; K885-N889 PolarHBondContact O-ND2 2.92Å; K885-N889 PolarHBondContact O-OD1 3.34Å
886	G	95.6	Very high	94.4	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-72.5	-39.7	177.2	0	0	0	0	0	112.4	C882 F883 E884 H888 N889 F890 L902	C882-G886 PolarHBondContact O-N 2.93Å; F883-G886 PolarHBondContact O-N 2.79Å; F883-G886 VanDerWaalsContact O-N 3.1Å; E884-G886 VanDerWaalsContact C-N 3.3Å; E884-G886 PolarHBondContact O-N 3.34Å; G886-H888 PolarHBondContact O-N 3.08Å; G886-N889 WeakPolarHBondContact O-CB 3.33Å; G886-N889 PolarHBondContact O-N 3.11Å; G886-N889 VanDerWaalsContact O-N 3.15Å; G886-F890 WeakPolarHBondContact O-CD2 3.44Å; G886-F890 PolarHBondContact O-N 3.04Å; G886-F890 VanDerWaalsContact O-N 3.13Å; G886-L902 VanDerWaalsContact C-CD2 3.43Å
887	I	95.7	Very high	94.2	Very high	17 Å²	17	56.8 Å²	56.8	9%	0.087	28%	0.283	C	S	.	.	H	α-helix	trans	-58.9	-48.2	174.9	-69.7	160.1	0	0	0	109.8	F883 E884 N889 F890 E891 L902 L903	F883-I887 VanDerWaalsContact O-CG1 3.27Å; F883-I887 WeakPolarHBondContact O-CG1 3.45Å; F883-I887 PolarHBondContact O-N 2.74Å; E884-I887 PolarHBondContact O-N 3.23Å; I887-N889 VanDerWaalsContact C-N 3.26Å; I887-N889 PolarHBondContact O-N 3.4Å; I887-F890 PolarHBondContact O-N 2.96Å; I887-F890 VanDerWaalsContact O-N 3.13Å; I887-E891 HydrophobicContact CG2-CG 4.07Å; I887-E891 WeakPolarHBondContact CG2-OE1 3.44Å; I887-E891 WeakPolarHBondContact O-CB 3.27Å; I887-E891 WeakPolarHBondContact O-CG 3.3Å; I887-E891 PolarHBondContact O-N 3.02Å; I887-L902 HydrophobicContact CD1-CB 4.26Å; I887-L902 HydrophobicContact CG1-CB 3.63Å; I887-L902 HydrophobicContact CG1-CD2 4.28Å; I887-L903 HydrophobicContact CD1-CD2 3.66Å; I887-L903 HydrophobicContact CD1-CG 3.88Å; I887-L903 HydrophobicContact CG1-CG 4.32Å
888	H	95.2	Very high	94.2	Very high	117 Å²	117	51.3 Å²	51.3	54%	0.542	26%	0.261	S	S	.	.	H	α-helix	trans	-57.2	-38.3	176.5	-177.3	-74.1	0	0	0	112.7	E884 G886 S892	E884-H888 PolarHBondContact O-N 3.23Å; E884-H888 VanDerWaalsContact O-N 3.13Å; G886-H888 PolarHBondContact O-N 3.08Å; H888-S892 WeakPolarHBondContact O-CB 3.48Å; H888-S892 PolarHBondContact O-N 3.48Å; H888-S892 PolarHBondContact O-OG 3.46Å
889	N	94.3	Very high	94.2	Very high	8 Å²	8	47.2 Å²	47.2	4%	0.043	24%	0.244	C	C	.	.	H	α-helix	trans	-64.8	-43.5	177.5	-67.1	-15.8	0	0	0	111.8	M840 R844 K885 G886 I887 S892	M840-N889 WeakPolarHBondContact CB-ND2 3.34Å; R844-N889 PolarHBondContact NH1-ND2 3.38Å; R844-N889 PolarHBondContact NH1-OD1 3.5Å; R844-N889 VanDerWaalsContact NH1-OD1 3.14Å; K885-N889 VanDerWaalsContact O-CG 3.28Å; K885-N889 PolarHBondContact O-N 3.45Å; K885-N889 PolarHBondContact O-ND2 2.92Å; K885-N889 PolarHBondContact O-OD1 3.34Å; G886-N889 WeakPolarHBondContact O-CB 3.33Å; G886-N889 PolarHBondContact O-N 3.11Å; G886-N889 VanDerWaalsContact O-N 3.15Å; I887-N889 VanDerWaalsContact C-N 3.26Å; I887-N889 PolarHBondContact O-N 3.4Å; N889-S892 PolarHBondContact O-N 3.3Å
890	F	95.4	Very high	94	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-71.8	-38.1	178.6	-70.1	-58.1	0	0	0	112.7	K838 G841 N842 G886 I887 S892 I893 E894 D895 N898 A899 L902	K838-F890 HydrophobicContact CG-CE1 4.21Å; G841-F890 VanDerWaalsContact C-CE2 3.46Å; G841-F890 VanDerWaalsContact CA-CE2 3.43Å; G841-F890 VanDerWaalsContact CA-CZ 3.41Å; N842-F890 WeakPolarHBondContact OD1-CZ 3.45Å; G886-F890 WeakPolarHBondContact O-CD2 3.44Å; G886-F890 PolarHBondContact O-N 3.04Å; G886-F890 VanDerWaalsContact O-N 3.13Å; I887-F890 PolarHBondContact O-N 2.96Å; I887-F890 VanDerWaalsContact O-N 3.13Å; F890-S892 VanDerWaalsContact C-N 3.26Å; F890-S892 PolarHBondContact O-N 3.17Å; F890-I893 HydrophobicContact CD1-CD1 4.27Å; F890-I893 CarbonylContact O-C 3.57Å; F890-I893 VanDerWaalsContact O-CG1 3.31Å; F890-I893 WeakPolarHBondContact O-CG1 3.35Å; F890-I893 PolarHBondContact O-N 2.96Å; F890-E894 PolarHBondContact O-N 2.94Å; F890-E894 VanDerWaalsContact O-N 3.1Å; F890-D895 HydrophobicContact CB-CB 4.32Å; F890-D895 HydrophobicContact CD1-CB 4.02Å; F890-D895 PolarHBondContact O-N 3.47Å; F890-N898 HydrophobicContact CD1-CB 3.53Å; F890-N898 HydrophobicContact CD2-CB 3.85Å; F890-N898 HydrophobicContact CE1-CB 3.43Å; F890-N898 VanDerWaalsContact CE1-CB 3.43Å; F890-N898 HydrophobicContact CE2-CB 3.76Å; F890-N898 HydrophobicContact CG-CB 3.75Å; F890-N898 HydrophobicContact CZ-CB 3.53Å; F890-A899 HydrophobicContact CB-CB 3.96Å; F890-L902 HydrophobicContact CD2-CD1 4Å; F890-L902 HydrophobicContact CD2-CD2 4.12Å; F890-L902 HydrophobicContact CE2-CD1 3.52Å; F890-L902 HydrophobicContact CE2-CD2 3.97Å; F890-L902 HydrophobicContact CE2-CG 4.42Å
891	E	93.8	Very high	93.9	Very high	118 Å²	118	47.7 Å²	47.7	55%	0.551	25%	0.248	S	C	*	.	H	α-helix	trans	-61.6	-35.9	173.2	-73	176.2	163.8	0	0	111.6	I887 I893 E894	I887-E891 HydrophobicContact CG2-CG 4.07Å; I887-E891 WeakPolarHBondContact CG2-OE1 3.44Å; I887-E891 WeakPolarHBondContact O-CB 3.27Å; I887-E891 WeakPolarHBondContact O-CG 3.3Å; I887-E891 PolarHBondContact O-N 3.02Å; E891-I893 PolarHBondContact O-N 3.31Å; E891-E894 PolarHBondContact O-N 2.66Å
892	S	90.9	Very high	93.9	Very high	60 Å²	60	45.8 Å²	45.8	42%	0.42	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-18.3	177.6	-60.5	0	0	0	0	114.2	H888 N889 F890	H888-S892 WeakPolarHBondContact O-CB 3.48Å; H888-S892 PolarHBondContact O-N 3.48Å; H888-S892 PolarHBondContact O-OG 3.46Å; N889-S892 PolarHBondContact O-N 3.3Å; F890-S892 VanDerWaalsContact C-N 3.26Å; F890-S892 PolarHBondContact O-N 3.17Å
893	I	92.6	Very high	93.9	Very high	31 Å²	31	45.4 Å²	45.4	16%	0.159	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.1	12	177.1	63.6	171.1	0	0	0	112.6	V834 L837 K838 F890 E891 D895	V834-I893 HydrophobicContact CG1-CB 4.41Å; V834-I893 HydrophobicContact CG1-CD1 4.32Å; V834-I893 HydrophobicContact CG1-CG2 4.4Å; V834-I893 HydrophobicContact CG2-CG2 4.26Å; L837-I893 HydrophobicContact CB-CG2 3.82Å; L837-I893 HydrophobicContact CD1-CG2 3.49Å; L837-I893 VanDerWaalsContact CD1-CG2 3.49Å; L837-I893 HydrophobicContact CG-CG2 4.31Å; K838-I893 HydrophobicContact CB-CD1 4.06Å; F890-I893 HydrophobicContact CD1-CD1 4.27Å; F890-I893 CarbonylContact O-C 3.57Å; F890-I893 VanDerWaalsContact O-CG1 3.31Å; F890-I893 WeakPolarHBondContact O-CG1 3.35Å; F890-I893 PolarHBondContact O-N 2.96Å; E891-I893 PolarHBondContact O-N 3.31Å; I893-D895 HydrophobicContact CD1-CB 4.05Å; I893-D895 HydrophobicContact CG1-CB 3.92Å; I893-D895 PolarHBondContact O-N 3.19Å
894	E	89.9	Confident	93.8	Very high	183 Å²	183	46 Å²	46	86%	0.855	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.8	26.4	-179.6	-55.8	-178.5	-179.4	0	0	114.7	F890 E891 A896	F890-E894 PolarHBondContact O-N 2.94Å; F890-E894 VanDerWaalsContact O-N 3.1Å; E891-E894 PolarHBondContact O-N 2.66Å; E894-A896 PolarHBondContact O-N 3.11Å; E894-A896 VanDerWaalsContact O-N 3.09Å
895	D	91.8	Very high	93.8	Very high	30 Å²	30	42.3 Å²	42.3	16%	0.16	22%	0.219	C	C	.	.			trans	-85.6	78.1	175.9	-169.6	-24.6	0	0	0	110.7	F890 I893 T897 N898 A899	F890-D895 HydrophobicContact CB-CB 4.32Å; F890-D895 HydrophobicContact CD1-CB 4.02Å; F890-D895 PolarHBondContact O-N 3.47Å; I893-D895 HydrophobicContact CD1-CB 4.05Å; I893-D895 HydrophobicContact CG1-CB 3.92Å; I893-D895 PolarHBondContact O-N 3.19Å; D895-T897 PolarHBondContact O-N 2.9Å; D895-T897 PolarHBondContact OD1-N 3.03Å; D895-N898 PolarHBondContact OD1-N 3.24Å; D895-N898 PolarHBondContact OD1-ND2 3.2Å; D895-N898 PolarHBondContact OD2-ND2 2.76Å; D895-A899 WeakPolarHBondContact O-CB 3.5Å; D895-A899 PolarHBondContact O-N 2.82Å; D895-A899 VanDerWaalsContact O-N 3.11Å
896	A	90.6	Very high	93.8	Very high	37 Å²	37	37.6 Å²	37.6	31%	0.306	20%	0.198	S	C	.	.	H	α-helix	trans	-59.7	-30.2	-178	0	0	0	0	0	113.4	E894 A900 S949	E894-A896 PolarHBondContact O-N 3.11Å; E894-A896 VanDerWaalsContact O-N 3.09Å; A896-A900 VanDerWaalsContact O-CB 3.27Å; A896-A900 WeakPolarHBondContact O-CB 3.35Å; A896-A900 PolarHBondContact O-N 3.38Å; A896-S949 PolarHBondContact O-OG 3.16Å
897	T	91.5	Very high	93.9	Very high	26 Å²	26	37.6 Å²	37.6	16%	0.16	20%	0.198	C	C	.	.	H	α-helix	trans	-71.7	-49	-175.3	-53.8	0	0	0	0	111.3	D895 A900 L901 H956 V959	D895-T897 PolarHBondContact O-N 2.9Å; D895-T897 PolarHBondContact OD1-N 3.03Å; T897-A900 PolarHBondContact O-N 3.09Å; T897-L901 PolarHBondContact O-N 3.1Å; T897-L901 VanDerWaalsContact O-N 3.11Å; T897-H956 PolarHBondContact OG1-CD2 3.4Å; T897-H956 PolarHBondContact OG1-NE2 2.81Å; T897-V959 HydrophobicContact CG2-CG2 4.05Å
898	N	92.9	Very high	93.9	Very high	32 Å²	32	42.5 Å²	42.5	17%	0.171	22%	0.216	C	C	.	.	H	α-helix	trans	-70.3	-36.5	176.5	-72.8	-45.2	0	0	0	111.5	F890 D895 A900 L901 L902	F890-N898 HydrophobicContact CD1-CB 3.53Å; F890-N898 HydrophobicContact CD2-CB 3.85Å; F890-N898 HydrophobicContact CE1-CB 3.43Å; F890-N898 VanDerWaalsContact CE1-CB 3.43Å; F890-N898 HydrophobicContact CE2-CB 3.76Å; F890-N898 HydrophobicContact CG-CB 3.75Å; F890-N898 HydrophobicContact CZ-CB 3.53Å; D895-N898 PolarHBondContact OD1-N 3.24Å; D895-N898 PolarHBondContact OD1-ND2 3.2Å; D895-N898 PolarHBondContact OD2-ND2 2.76Å; N898-A900 VanDerWaalsContact C-N 3.3Å; N898-A900 PolarHBondContact O-N 3.15Å; N898-L901 PolarHBondContact O-N 3.29Å; N898-L902 WeakPolarHBondContact O-CD1 3.37Å; N898-L902 PolarHBondContact O-N 3.4Å; N898-L902 VanDerWaalsContact O-N 3.1Å
899	A	94.4	Very high	93.9	Very high	2 Å²	2	36.9 Å²	36.9	2%	0.017	19%	0.19	C	C	.	.	H	α-helix	trans	-57.1	-43.4	171.1	0	0	0	0	0	112.1	F890 D895 L901 L902 L903	F890-A899 HydrophobicContact CB-CB 3.96Å; D895-A899 WeakPolarHBondContact O-CB 3.5Å; D895-A899 PolarHBondContact O-N 2.82Å; D895-A899 VanDerWaalsContact O-N 3.11Å; A899-L901 PolarHBondContact O-N 3.4Å; A899-L902 PolarHBondContact O-N 3.29Å; A899-L903 WeakPolarHBondContact O-CG 3.48Å; A899-L903 PolarHBondContact O-N 3.04Å
900	A	93.8	Very high	93.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64.2	-36.6	176.6	0	0	0	0	0	113.1	A896 T897 N898 L903 C904 A946 L950	A896-A900 VanDerWaalsContact O-CB 3.27Å; A896-A900 WeakPolarHBondContact O-CB 3.35Å; A896-A900 PolarHBondContact O-N 3.38Å; T897-A900 PolarHBondContact O-N 3.09Å; N898-A900 VanDerWaalsContact C-N 3.3Å; N898-A900 PolarHBondContact O-N 3.15Å; A900-L903 PolarHBondContact O-N 3.05Å; A900-C904 WeakPolarHBondContact O-CB 3.35Å; A900-C904 PolarHBondContact O-N 3.25Å; A900-A946 HydrophobicContact CB-CB 4.24Å; A900-L950 HydrophobicContact CB-CD1 4.03Å; A900-L950 HydrophobicContact CB-CD2 3.68Å; A900-L950 HydrophobicContact CB-CG 3.61Å
901	L	94.1	Very high	93.9	Very high	65 Å²	65	38.8 Å²	38.8	34%	0.34	20%	0.197	S	C	.	.	H	α-helix	trans	-63.6	-42.5	174.2	-71.6	172.8	0	0	0	112	T897 N898 A899 C904 N905 V959	T897-L901 PolarHBondContact O-N 3.1Å; T897-L901 VanDerWaalsContact O-N 3.11Å; N898-L901 PolarHBondContact O-N 3.29Å; A899-L901 PolarHBondContact O-N 3.4Å; L901-C904 WeakPolarHBondContact O-CB 3.21Å; L901-C904 PolarHBondContact O-N 3.04Å; L901-N905 PolarHBondContact O-N 3.26Å; L901-V959 HydrophobicContact CD2-CG1 3.8Å; L901-V959 HydrophobicContact CD2-CG2 4.34Å; L901-V959 HydrophobicContact CG-CG1 4.19Å
902	L	95.1	Very high	93.8	Very high	3 Å²	3	33.7 Å²	33.7	2%	0.016	17%	0.174	C	C	.	.	H	α-helix	trans	-69.2	-36.7	176.7	-84.1	71.6	0	0	0	112	N845 F883 G886 I887 F890 N898 A899 C904 N905 T906	N845-L902 HydrophobicContact CB-CD1 3.86Å; N845-L902 HydrophobicContact CB-CD2 4.46Å; N845-L902 HydrophobicContact CB-CG 4.1Å; F883-L902 HydrophobicContact CD1-CG 4.4Å; G886-L902 VanDerWaalsContact C-CD2 3.43Å; I887-L902 HydrophobicContact CD1-CB 4.26Å; I887-L902 HydrophobicContact CG1-CB 3.63Å; I887-L902 HydrophobicContact CG1-CD2 4.28Å; F890-L902 HydrophobicContact CD2-CD1 4Å; F890-L902 HydrophobicContact CD2-CD2 4.12Å; F890-L902 HydrophobicContact CE2-CD1 3.52Å; F890-L902 HydrophobicContact CE2-CD2 3.97Å; F890-L902 HydrophobicContact CE2-CG 4.42Å; N898-L902 WeakPolarHBondContact O-CD1 3.37Å; N898-L902 PolarHBondContact O-N 3.4Å; N898-L902 VanDerWaalsContact O-N 3.1Å; A899-L902 PolarHBondContact O-N 3.29Å; L902-C904 VanDerWaalsContact C-N 3.31Å; L902-C904 PolarHBondContact O-N 3.5Å; L902-N905 PolarHBondContact O-N 3.07Å; L902-T906 WeakPolarHBondContact O-CB 3.41Å; L902-T906 PolarHBondContact O-N 3.3Å; L902-T906 PolarHBondContact O-OG1 3.35Å
903	L	96	Very high	93.8	Very high	14 Å²	14	31 Å²	31	7%	0.073	15%	0.154	C	C	.	.	H	α-helix	trans	-62.1	-40.1	171.7	-73.5	166.5	0	0	0	111.3	I887 A899 A900 T906 G907 Y942 K945 A946	I887-L903 HydrophobicContact CD1-CD2 3.66Å; I887-L903 HydrophobicContact CD1-CG 3.88Å; I887-L903 HydrophobicContact CG1-CG 4.32Å; A899-L903 WeakPolarHBondContact O-CG 3.48Å; A899-L903 PolarHBondContact O-N 3.04Å; A900-L903 PolarHBondContact O-N 3.05Å; L903-T906 WeakPolarHBondContact O-CB 3.16Å; L903-T906 PolarHBondContact O-N 3.09Å; L903-G907 PolarHBondContact O-N 2.98Å; L903-Y942 HydrophobicContact CD2-CD1 3.81Å; L903-Y942 HydrophobicContact CD2-CE1 4.42Å; L903-K945 HydrophobicContact CD1-CB 4.22Å; L903-K945 HydrophobicContact CD2-CB 4.25Å; L903-A946 HydrophobicContact CB-CB 3.77Å; L903-A946 HydrophobicContact CD1-CB 4.36Å
904	C	95	Very high	93.7	Very high	13 Å²	13	29.5 Å²	29.5	9%	0.088	15%	0.147	C	C	.	.	H	α-helix	trans	-62.3	-46.2	174	-169.3	0	0	0	0	111.6	A900 L901 L902 T906 G907 R908 Y943 V963	A900-C904 WeakPolarHBondContact O-CB 3.35Å; A900-C904 PolarHBondContact O-N 3.25Å; L901-C904 WeakPolarHBondContact O-CB 3.21Å; L901-C904 PolarHBondContact O-N 3.04Å; L902-C904 VanDerWaalsContact C-N 3.31Å; L902-C904 PolarHBondContact O-N 3.5Å; C904-T906 VanDerWaalsContact C-N 3.33Å; C904-T906 PolarHBondContact O-N 3.37Å; C904-G907 PolarHBondContact O-N 3.17Å; C904-G907 VanDerWaalsContact O-N 3.16Å; C904-R908 PolarHBondContact O-N 3.11Å; C904-Y943 HydrophobicContact CB-CE1 4.36Å; C904-Y943 VanDerWaalsContact O-CE1 3.32Å; C904-Y943 WeakPolarHBondContact O-CE1 3.46Å; C904-V963 HydrophobicContact CB-CG2 4.19Å
905	N	96	Very high	93.6	Very high	32 Å²	32	24.3 Å²	24.3	17%	0.171	12%	0.122	C	C	.	.	H	α-helix	trans	-64.5	-36.2	175.7	-74.8	-21.7	0	0	0	112.5	N845 F883 L901 L902 G907 R908 L909	N845-N905 PolarHBondContact OD1-ND2 3.47Å; F883-N905 HydrophobicContact CD1-CB 4.4Å; F883-N905 HydrophobicContact CE1-CB 3.83Å; F883-N905 HydrophobicContact CE2-CB 4.25Å; F883-N905 HydrophobicContact CZ-CB 3.75Å; L901-N905 PolarHBondContact O-N 3.26Å; L902-N905 PolarHBondContact O-N 3.07Å; N905-G907 VanDerWaalsContact C-N 3.34Å; N905-G907 PolarHBondContact O-N 3.33Å; N905-R908 WeakPolarHBondContact O-CB 3.42Å; N905-R908 PolarHBondContact O-N 3.24Å; N905-L909 PolarHBondContact O-N 3.5Å
906	T	96.1	Very high	93.3	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.006	12%	0.12	C	C	.	.	H	α-helix	trans	-63.1	-41.3	172.6	-54.4	0	0	0	0	111.1	F880 F883 L902 L903 C904 R908 L909 M910 Y942	F880-T906 HydrophobicContact CD2-CG2 3.96Å; F880-T906 HydrophobicContact CE2-CG2 3.82Å; F883-T906 VanDerWaalsContact CB-OG1 3.28Å; F883-T906 WeakPolarHBondContact CB-OG1 3.43Å; L902-T906 WeakPolarHBondContact O-CB 3.41Å; L902-T906 PolarHBondContact O-N 3.3Å; L902-T906 PolarHBondContact O-OG1 3.35Å; L903-T906 WeakPolarHBondContact O-CB 3.16Å; L903-T906 PolarHBondContact O-N 3.09Å; C904-T906 VanDerWaalsContact C-N 3.33Å; C904-T906 PolarHBondContact O-N 3.37Å; T906-R908 VanDerWaalsContact C-N 3.33Å; T906-R908 PolarHBondContact O-N 3.42Å; T906-L909 WeakPolarHBondContact O-CB 3.29Å; T906-L909 PolarHBondContact O-N 2.91Å; T906-M910 WeakPolarHBondContact O-CG 3.12Å; T906-M910 PolarHBondContact O-N 3.11Å; T906-Y942 HydrophobicContact CG2-CD1 3.89Å; T906-Y942 HydrophobicContact CG2-CD2 3.78Å; T906-Y942 HydrophobicContact CG2-CE1 3.84Å; T906-Y942 HydrophobicContact CG2-CE2 3.72Å; T906-Y942 HydrophobicContact CG2-CG 3.89Å
907	G	96.1	Very high	93	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-60.1	-40.9	172.3	0	0	0	0	0	112.5	L903 C904 N905 M910 R911 A939	L903-G907 PolarHBondContact O-N 2.98Å; C904-G907 PolarHBondContact O-N 3.17Å; C904-G907 VanDerWaalsContact O-N 3.16Å; N905-G907 VanDerWaalsContact C-N 3.34Å; N905-G907 PolarHBondContact O-N 3.33Å; G907-M910 PolarHBondContact O-N 2.92Å; G907-R911 PolarHBondContact O-N 3.37Å; G907-R911 VanDerWaalsContact O-N 3.16Å; G907-A939 WeakPolarHBondContact O-CB 3.47Å
908	R	95.4	Very high	92.3	Very high	120 Å²	120	25.3 Å²	25.3	45%	0.453	13%	0.126	S	C	.	.	H	α-helix	trans	-64.3	-43.1	175.2	-176.5	177.7	174.3	-179.4	-1.2	112	M852 C904 N905 T906 M910 R911 I912 Y943	M852-R908 HydrophobicContact CE-CG 4.38Å; M852-R908 HydrophobicContact SD-CB 4.13Å; M852-R908 HydrophobicContact SD-CG 3.97Å; C904-R908 PolarHBondContact O-N 3.11Å; N905-R908 WeakPolarHBondContact O-CB 3.42Å; N905-R908 PolarHBondContact O-N 3.24Å; T906-R908 VanDerWaalsContact C-N 3.33Å; T906-R908 PolarHBondContact O-N 3.42Å; R908-M910 VanDerWaalsContact C-N 3.32Å; R908-M910 PolarHBondContact O-N 2.97Å; R908-R911 WeakPolarHBondContact O-CB 3.19Å; R908-R911 PolarHBondContact O-N 2.85Å; R908-R911 VanDerWaalsContact O-N 3.12Å; R908-I912 HydrophobicContact CG-CD1 4.48Å; R908-I912 PolarHBondContact O-N 3.4Å; R908-I912 VanDerWaalsContact O-N 3.1Å; R908-Y943 WeakPolarHBondContact CA-OH 3.46Å; R908-Y943 PolarHBondContact N-OH 3.05Å
909	L	95.4	Very high	90.9	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-57.3	-45.5	173.9	176.8	67	0	0	0	111.2	M852 F880 F883 N905 T906 R911 I912 C913	M852-L909 HydrophobicContact CB-CD1 4.22Å; M852-L909 HydrophobicContact CG-CB 4.34Å; M852-L909 HydrophobicContact CG-CD1 3.96Å; M852-L909 HydrophobicContact SD-CB 3.96Å; F880-L909 HydrophobicContact CB-CD2 3.98Å; F883-L909 HydrophobicContact CD2-CD2 4.33Å; F883-L909 HydrophobicContact CE2-CB 4.33Å; F883-L909 HydrophobicContact CE2-CD2 4.31Å; N905-L909 PolarHBondContact O-N 3.5Å; T906-L909 WeakPolarHBondContact O-CB 3.29Å; T906-L909 PolarHBondContact O-N 2.91Å; L909-R911 VanDerWaalsContact C-N 3.26Å; L909-R911 PolarHBondContact O-N 3.15Å; L909-I912 WeakPolarHBondContact O-CB 3.37Å; L909-I912 PolarHBondContact O-N 3.38Å; L909-I912 VanDerWaalsContact O-N 3.09Å; L909-C913 PolarHBondContact O-N 3.18Å; L909-C913 PolarHBondContact O-SG 3.26Å
910	M	95.9	Very high	89	Confident	13 Å²	13	28.6 Å²	28.6	6%	0.064	16%	0.161	C	C	.	.	H	α-helix	trans	-60.6	-35.3	177.3	-66.2	-56.9	109.6	0	0	112.3	F880 T906 G907 R908 C913 A914 Y935 K938 A939 Y942	F880-M910 HydrophobicContact CD2-CE 3.86Å; F880-M910 HydrophobicContact CE2-CE 4.35Å; T906-M910 WeakPolarHBondContact O-CG 3.12Å; T906-M910 PolarHBondContact O-N 3.11Å; G907-M910 PolarHBondContact O-N 2.92Å; R908-M910 VanDerWaalsContact C-N 3.32Å; R908-M910 PolarHBondContact O-N 2.97Å; M910-C913 WeakPolarHBondContact O-CB 3.22Å; M910-C913 PolarHBondContact O-N 3.44Å; M910-A914 PolarHBondContact O-N 3.08Å; M910-Y935 WeakPolarHBondContact O-CB 3.47Å; M910-Y935 HydrophobicContact SD-CD1 3.98Å; M910-Y935 HydrophobicContact SD-CE1 4.34Å; M910-K938 HydrophobicContact CB-CB 4.48Å; M910-K938 HydrophobicContact CG-CB 4.02Å; M910-K938 HydrophobicContact SD-CB 4.11Å; M910-K938 HydrophobicContact SD-CD 4.21Å; M910-A939 HydrophobicContact CB-CB 3.73Å; M910-Y942 HydrophobicContact CG-CD2 3.96Å; M910-Y942 HydrophobicContact CG-CE2 4.08Å; M910-Y942 HydrophobicContact SD-CE2 4.46Å
911	R	94.1	Very high	87.2	Confident	35 Å²	35	30.9 Å²	30.9	13%	0.132	18%	0.184	C	C	.	.	H	α-helix	trans	-65.5	-41	173.6	-67.4	171.8	62.9	-164	-7.7	112.2	G907 R908 L909 C913 A914 Q915 Y936 A939 E966 T970	G907-R911 PolarHBondContact O-N 3.37Å; G907-R911 VanDerWaalsContact O-N 3.16Å; R908-R911 WeakPolarHBondContact O-CB 3.19Å; R908-R911 PolarHBondContact O-N 2.85Å; R908-R911 VanDerWaalsContact O-N 3.12Å; L909-R911 VanDerWaalsContact C-N 3.26Å; L909-R911 PolarHBondContact O-N 3.15Å; R911-C913 VanDerWaalsContact C-N 3.34Å; R911-A914 WeakPolarHBondContact O-CB 3.39Å; R911-A914 PolarHBondContact O-N 3.37Å; R911-Q915 VanDerWaalsContact O-CG 3.29Å; R911-Q915 WeakPolarHBondContact O-CG 3.21Å; R911-Q915 PolarHBondContact O-N 3Å; R911-Y936 HydrophobicContact CB-CE1 4.46Å; R911-Y936 HydrophobicContact CG-CD1 4.32Å; R911-Y936 HydrophobicContact CG-CE1 4.23Å; R911-A939 HydrophobicContact CG-CB 3.92Å; R911-E966 IonicContact NH1-OE2 3.67Å; R911-E966 PolarHBondContact NH1-OE2 3.2Å; R911-T970 WeakPolarHBondContact CD-OG1 3.28Å; R911-T970 HydrophobicContact CG-CG2 4.21Å
912	I	91.1	Very high	85.4	Confident	11 Å²	11	33 Å²	33	6%	0.056	20%	0.196	C	C	.	.	H	α-helix	trans	-61.7	-44.9	175.2	-67.5	162.2	0	0	0	109.8	M852 A856 R908 L909 A914 Q915 A916	M852-I912 HydrophobicContact CG-CD1 3.38Å; M852-I912 HydrophobicContact SD-CD1 3.93Å; A856-I912 HydrophobicContact CB-CD1 4.22Å; A856-I912 HydrophobicContact CB-CG2 4.43Å; R908-I912 HydrophobicContact CG-CD1 4.48Å; R908-I912 PolarHBondContact O-N 3.4Å; R908-I912 VanDerWaalsContact O-N 3.1Å; L909-I912 WeakPolarHBondContact O-CB 3.37Å; L909-I912 PolarHBondContact O-N 3.38Å; L909-I912 VanDerWaalsContact O-N 3.09Å; I912-A914 VanDerWaalsContact C-N 3.31Å; I912-A914 PolarHBondContact O-N 3Å; I912-Q915 PolarHBondContact O-N 3.38Å; I912-Q915 VanDerWaalsContact O-N 3.17Å; I912-A916 PolarHBondContact O-N 3.22Å
913	C	91.4	Very high	83.7	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.014	23%	0.229	C	C	.	.	H	α-helix	trans	-56.9	-44.2	173.2	-59.2	0	0	0	0	111.8	W876 L909 M910 R911 A916 H917 Y935	W876-C913 HydrophobicContact CD2-CB 4.35Å; W876-C913 HydrophobicContact CE3-CB 4.27Å; W876-C913 HydrophobicContact CH2-CB 4.28Å; W876-C913 HydrophobicContact CZ2-CB 4.37Å; W876-C913 HydrophobicContact CZ3-CB 4.23Å; L909-C913 PolarHBondContact O-N 3.18Å; L909-C913 PolarHBondContact O-SG 3.26Å; M910-C913 WeakPolarHBondContact O-CB 3.22Å; M910-C913 PolarHBondContact O-N 3.44Å; R911-C913 VanDerWaalsContact C-N 3.34Å; C913-A916 PolarHBondContact O-N 3.1Å; C913-H917 PolarHBondContact O-CD2 2.94Å; C913-H917 PolarHBondContact O-N 3.27Å; C913-Y935 HydrophobicContact CB-CD1 3.5Å; C913-Y935 VanDerWaalsContact CB-CD1 3.5Å; C913-Y935 HydrophobicContact CB-CD2 4.25Å; C913-Y935 HydrophobicContact CB-CE1 3.65Å; C913-Y935 HydrophobicContact CB-CE2 4.41Å; C913-Y935 HydrophobicContact CB-CG 3.82Å
914	A	90.8	Very high	81.8	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59.7	-47.9	176.3	0	0	0	0	0	111.3	M910 R911 I912 A916 H917 E932 Y936	M910-A914 PolarHBondContact O-N 3.08Å; R911-A914 WeakPolarHBondContact O-CB 3.39Å; R911-A914 PolarHBondContact O-N 3.37Å; I912-A914 VanDerWaalsContact C-N 3.31Å; I912-A914 PolarHBondContact O-N 3Å; A914-A916 VanDerWaalsContact C-N 3.26Å; A914-A916 PolarHBondContact O-N 3.5Å; A914-H917 PolarHBondContact O-N 3.16Å; A914-E932 VanDerWaalsContact O-CG 3.25Å; A914-E932 WeakPolarHBondContact O-CG 3.39Å; A914-Y936 HydrophobicContact CB-CD1 4.24Å; A914-Y936 HydrophobicContact CB-CD2 3.77Å; A914-Y936 HydrophobicContact CB-CE1 4.15Å; A914-Y936 HydrophobicContact CB-CE2 3.65Å; A914-Y936 HydrophobicContact CB-CG 4.05Å
915	Q	88.2	Confident	80.4	Confident	74 Å²	74	56 Å²	56	35%	0.346	30%	0.296	S	S	.	.	H	α-helix	trans	-62.5	-32.1	-179.8	-67.8	170.4	-27.8	0	0	112.4	Q859 R911 I912 H917 C918	Q859-Q915 PolarHBondContact NE2-O 3.06Å; Q859-Q915 VanDerWaalsContact NE2-O 3.1Å; R911-Q915 VanDerWaalsContact O-CG 3.29Å; R911-Q915 WeakPolarHBondContact O-CG 3.21Å; R911-Q915 PolarHBondContact O-N 3Å; I912-Q915 PolarHBondContact O-N 3.38Å; I912-Q915 VanDerWaalsContact O-N 3.17Å; Q915-H917 PolarHBondContact O-N 3.22Å; Q915-C918 WeakPolarHBondContact O-CB 3.34Å; Q915-C918 PolarHBondContact O-N 3.44Å; Q915-C918 VanDerWaalsContact O-N 3.08Å
916	A	85.5	Confident	79.7	Confident	13 Å²	13	56.6 Å²	56.6	11%	0.107	30%	0.296	C	S	.	.	H	α-helix	trans	-68.6	-21.9	176.8	0	0	0	0	0	113.5	V868 E872 W876 I912 C913 A914 C918	V868-A916 HydrophobicContact CG2-CB 4.33Å; E872-A916 WeakPolarHBondContact OE1-CB 3.26Å; W876-A916 HydrophobicContact CH2-CB 3.69Å; W876-A916 HydrophobicContact CZ2-CB 3.41Å; W876-A916 VanDerWaalsContact CZ2-CB 3.41Å; I912-A916 PolarHBondContact O-N 3.22Å; C913-A916 PolarHBondContact O-N 3.1Å; A914-A916 VanDerWaalsContact C-N 3.26Å; A914-A916 PolarHBondContact O-N 3.5Å; A916-C918 VanDerWaalsContact C-N 3.27Å
917	H	83.9	Confident	79.3	Confident	50 Å²	50	59.6 Å²	59.6	23%	0.231	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	1.1	172.5	-74	-75.3	0	0	0	113.3	C913 A914 Q915 G919 E931 E932 Y935	C913-H917 PolarHBondContact O-CD2 2.94Å; C913-H917 PolarHBondContact O-N 3.27Å; A914-H917 PolarHBondContact O-N 3.16Å; Q915-H917 PolarHBondContact O-N 3.22Å; H917-G919 PolarHBondContact O-N 3Å; H917-G919 VanDerWaalsContact O-N 3.16Å; H917-E931 HydrophobicContact CB-CB 4.1Å; H917-E932 HydrophobicContact CB-CG 4.06Å; H917-Y935 AromaticContact CD2-CD2 3.78Å; H917-Y935 AromaticContact CD2-CE2 3.59Å; H917-Y935 AromaticContact NE2-CE2 3.46Å; H917-Y935 WeakPolarHBondContact NE2-CE2 3.46Å
918	C	76.7	Confident	79	Confident	52 Å²	52	60 Å²	60	35%	0.351	31%	0.312	S	S	.	.			trans	-62.7	113	171.5	174.1	0	0	0	0	110.4	Q915 A916 A920 R926	Q915-C918 WeakPolarHBondContact O-CB 3.34Å; Q915-C918 PolarHBondContact O-N 3.44Å; Q915-C918 VanDerWaalsContact O-N 3.08Å; A916-C918 VanDerWaalsContact C-N 3.27Å; C918-A920 PolarHBondContact O-N 2.78Å; C918-R926 PolarHBondContact SG-NH2 3.44Å
919	G	63.7	Low	78.6	Confident	35 Å²	35	55.2 Å²	55.2	36%	0.361	30%	0.296	S	S	.	.			trans	-69.9	125.5	-179.4	0	0	0	0	0	113.3	H917 G921	H917-G919 PolarHBondContact O-N 3Å; H917-G919 VanDerWaalsContact O-N 3.16Å; G919-G921 PolarHBondContact O-N 3.33Å
920	A	55.7	Low	78.2	Confident	68 Å²	68	58.5 Å²	58.5	56%	0.562	32%	0.318	S	S	*	.			trans	-76.3	53.9	170	0	0	0	0	0	112	C918	C918-A920 PolarHBondContact O-N 2.78Å
921	G	55.2	Low	77.9	Confident	48 Å²	48	62 Å²	62	50%	0.495	33%	0.334	S	S	.	.			trans	-85.3	163.3	172.8	0	0	0	0	0	111.8	G919 E923	G919-G921 PolarHBondContact O-N 3.33Å; G921-E923 PolarHBondContact O-N 2.92Å
922	D	56.4	Low	77.7	Confident	109 Å²	109	60.4 Å²	60.4	58%	0.583	33%	0.328	S	S	*	.			trans	-45.5	123	163.7	-164.4	6.1	0	0	0	108.5	F924 K925	D922-F924 PolarHBondContact O-N 3.37Å; D922-K925 PolarHBondContact O-N 2.81Å
923	E	58.2	Low	77.7	Confident	153 Å²	153	60.3 Å²	60.3	72%	0.715	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-51.7	-27.7	-170.5	-78.1	-173.4	151.7	0	0	112.2	G921 K925	G921-E923 PolarHBondContact O-N 2.92Å; E923-K925 VanDerWaalsContact C-N 3.35Å; E923-K925 PolarHBondContact O-N 2.93Å
924	F	57.7	Low	77.8	Confident	184 Å²	184	64.7 Å²	64.7	81%	0.807	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-74.3	-11.5	179.2	-66.1	-77.8	0	0	0	115.7	D922	D922-F924 PolarHBondContact O-N 3.37Å
925	K	64.3	Low	78	Confident	177 Å²	177	67.1 Å²	67.1	77%	0.77	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-126	6.8	-177.7	-67.8	-173.8	-178.3	176.7	0	114.5	D922 E923	D922-K925 PolarHBondContact O-N 2.81Å; E923-K925 VanDerWaalsContact C-N 3.35Å; E923-K925 PolarHBondContact O-N 2.93Å
926	R	83.1	Confident	78.3	Confident	44 Å²	44	63.7 Å²	63.7	17%	0.166	35%	0.346	C	S	.	.			trans	-74.8	133.1	179.6	178.3	-178.5	169.4	-153.6	-2.6	110.8	C918 E932 Y981	C918-R926 PolarHBondContact SG-NH2 3.44Å; R926-E932 IonicContact NH2-OE1 3.16Å; R926-E932 PolarHBondContact NH2-OE1 2.92Å; R926-E932 VanDerWaalsContact NH2-OE1 3.16Å; R926-Y981 HydrophobicContact CB-CD1 3.79Å; R926-Y981 HydrophobicContact CB-CE1 4.14Å; R926-Y981 HydrophobicContact CG-CD1 3.77Å; R926-Y981 HydrophobicContact CG-CE1 4.23Å; R926-Y981 HydrophobicContact CG-CG 4.13Å; R926-Y981 VanDerWaalsContact NH1-CZ 3.26Å; R926-Y981 PolarHBondContact NH1-OH 3.38Å
927	E	86.8	Confident	78.8	Confident	64 Å²	64	67 Å²	67	30%	0.299	36%	0.362	S	S	.	.			trans	-121.9	147.6	169.9	-67.6	-170.2	168.8	0	0	110.6	S929 Y981 P983 L984 S985	E927-S929 PolarHBondContact O-N 3.32Å; E927-Y981 CarbonylContact C-O 3.48Å; E927-P983 HydrophobicContact CB-CB 4.35Å; E927-L984 PolarHBondContact OE1-N 2.94Å; E927-S985 VanDerWaalsContact OE1-CB 3.31Å; E927-S985 WeakPolarHBondContact OE1-CB 3.41Å; E927-S985 PolarHBondContact OE1-N 3.49Å; E927-S985 PolarHBondContact OE1-OG 2.89Å; E927-S985 WeakPolarHBondContact OE2-CB 3.5Å; E927-S985 PolarHBondContact OE2-OG 3.5Å
928	F	89.2	Confident	79.4	Confident	9 Å²	9	68.7 Å²	68.7	4%	0.039	37%	0.369	C	S	.	.			trans	-62.5	120.6	174.4	-176.9	-103.3	0	0	0	110.6	E932 Y936 M974 L977 Q978 Y981 R986	F928-E932 HydrophobicContact CD2-CB 4.08Å; F928-E932 HydrophobicContact CE2-CB 3.59Å; F928-E932 HydrophobicContact CE2-CG 4.45Å; F928-E932 HydrophobicContact CZ-CB 3.85Å; F928-Y936 HydrophobicContact CE2-CD2 4.15Å; F928-Y936 HydrophobicContact CE2-CE2 4.13Å; F928-Y936 HydrophobicContact CZ-CD2 4.05Å; F928-Y936 HydrophobicContact CZ-CE2 4.5Å; F928-M974 HydrophobicContact CZ-CG 4.04Å; F928-L977 HydrophobicContact CD2-CB 3.74Å; F928-L977 HydrophobicContact CE2-CB 3.93Å; F928-L977 HydrophobicContact CE2-CD1 4.31Å; F928-Q978 HydrophobicContact CD1-CG 3.6Å; F928-Q978 HydrophobicContact CD2-CG 4.37Å; F928-Q978 HydrophobicContact CE1-CG 3.65Å; F928-Q978 HydrophobicContact CE2-CG 4.41Å; F928-Q978 HydrophobicContact CG-CG 3.97Å; F928-Q978 HydrophobicContact CZ-CG 4.06Å; F928-Y981 WeakPolarHBondContact CB-O 3.4Å; F928-Y981 PolarHBondContact N-O 2.54Å; F928-R986 PolarHBondContact O-NH2 3.4Å
929	S	87.6	Confident	80.4	Confident	18 Å²	18	66.2 Å²	66.2	13%	0.126	35%	0.352	C	S	.	.			trans	-81	151.8	-173.9	66.3	0	0	0	0	113	E927 E931 E932 G933	E927-S929 PolarHBondContact O-N 3.32Å; S929-E931 WeakPolarHBondContact CB-OE2 3.35Å; S929-E931 PolarHBondContact O-N 3.28Å; S929-E932 WeakPolarHBondContact CB-OE2 3.43Å; S929-E932 PolarHBondContact N-OE2 3.47Å; S929-E932 PolarHBondContact O-N 2.87Å; S929-E932 VanDerWaalsContact OG-CB 3.26Å; S929-E932 WeakPolarHBondContact OG-CB 3.21Å; S929-E932 VanDerWaalsContact OG-CD 3.29Å; S929-E932 WeakPolarHBondContact OG-CG 3.45Å; S929-E932 PolarHBondContact OG-N 3.02Å; S929-E932 VanDerWaalsContact OG-N 3.08Å; S929-E932 PolarHBondContact OG-OE2 3.18Å; S929-G933 PolarHBondContact O-N 2.9Å; S929-G933 VanDerWaalsContact O-N 3.11Å
930	P	87.5	Confident	82	Confident	69 Å²	69	64.8 Å²	64.8	45%	0.448	34%	0.336	S	S	.	.	H	α-helix	trans	-66.8	-27.8	175.2	26	-33	0	0	0	111	G933 L934	P930-G933 PolarHBondContact O-N 3.41Å; P930-L934 WeakPolarHBondContact O-CB 3.31Å; P930-L934 PolarHBondContact O-N 3Å
931	E	88.2	Confident	83.9	Confident	88 Å²	88	65.8 Å²	65.8	41%	0.411	33%	0.332	S	S	.	.	H	α-helix	trans	-65.6	-47.6	173	-63.2	75.3	-164.1	0	0	111.3	H917 S929 G933 L934 Y935	H917-E931 HydrophobicContact CB-CB 4.1Å; S929-E931 WeakPolarHBondContact CB-OE2 3.35Å; S929-E931 PolarHBondContact O-N 3.28Å; E931-G933 VanDerWaalsContact C-N 3.31Å; E931-G933 PolarHBondContact O-N 3.3Å; E931-L934 PolarHBondContact O-N 3.13Å; E931-Y935 VanDerWaalsContact O-CD2 3.26Å; E931-Y935 WeakPolarHBondContact O-CD2 3.45Å; E931-Y935 PolarHBondContact O-N 3.49Å; E931-Y935 VanDerWaalsContact O-N 3.12Å
932	E	90	Very high	85.9	Confident	1 Å²	1	65.7 Å²	65.7	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-53.7	-50	171.5	-81	165	120.5	0	0	110.5	A914 H917 R926 F928 S929 L934 Y935 Y936	A914-E932 VanDerWaalsContact O-CG 3.25Å; A914-E932 WeakPolarHBondContact O-CG 3.39Å; H917-E932 HydrophobicContact CB-CG 4.06Å; R926-E932 IonicContact NH2-OE1 3.16Å; R926-E932 PolarHBondContact NH2-OE1 2.92Å; R926-E932 VanDerWaalsContact NH2-OE1 3.16Å; F928-E932 HydrophobicContact CD2-CB 4.08Å; F928-E932 HydrophobicContact CE2-CB 3.59Å; F928-E932 HydrophobicContact CE2-CG 4.45Å; F928-E932 HydrophobicContact CZ-CB 3.85Å; S929-E932 WeakPolarHBondContact CB-OE2 3.43Å; S929-E932 PolarHBondContact N-OE2 3.47Å; S929-E932 PolarHBondContact O-N 2.87Å; S929-E932 VanDerWaalsContact OG-CB 3.26Å; S929-E932 WeakPolarHBondContact OG-CB 3.21Å; S929-E932 VanDerWaalsContact OG-CD 3.29Å; S929-E932 WeakPolarHBondContact OG-CG 3.45Å; S929-E932 PolarHBondContact OG-N 3.02Å; S929-E932 VanDerWaalsContact OG-N 3.08Å; S929-E932 PolarHBondContact OG-OE2 3.18Å; E932-L934 PolarHBondContact O-N 3.36Å; E932-Y935 PolarHBondContact O-N 3.32Å; E932-Y936 HydrophobicContact CB-CE2 4.49Å; E932-Y936 WeakPolarHBondContact O-CD2 3.32Å; E932-Y936 PolarHBondContact O-N 3.25Å
933	G	90.8	Very high	87.9	Confident	8 Å²	8	60.5 Å²	60.5	8%	0.082	29%	0.289	C	S	.	.	H	α-helix	trans	-59.3	-42.6	178	0	0	0	0	0	113.6	S929 P930 E931 Y935 N937	S929-G933 PolarHBondContact O-N 2.9Å; S929-G933 VanDerWaalsContact O-N 3.11Å; P930-G933 PolarHBondContact O-N 3.41Å; E931-G933 VanDerWaalsContact C-N 3.31Å; E931-G933 PolarHBondContact O-N 3.3Å; G933-Y935 PolarHBondContact O-N 3.1Å; G933-N937 WeakPolarHBondContact O-CB 3.37Å; G933-N937 PolarHBondContact O-N 2.97Å; G933-N937 PolarHBondContact O-ND2 3.13Å
934	L	94.1	Very high	89.6	Confident	94 Å²	94	55.5 Å²	55.5	49%	0.492	27%	0.267	S	S	.	.	H	α-helix	trans	-59.8	-48	178.4	178.1	67.9	0	0	0	111.4	P930 E931 E932 N937 K938	P930-L934 WeakPolarHBondContact O-CB 3.31Å; P930-L934 PolarHBondContact O-N 3Å; E931-L934 PolarHBondContact O-N 3.13Å; E932-L934 PolarHBondContact O-N 3.36Å; L934-N937 PolarHBondContact O-N 3.15Å; L934-K938 WeakPolarHBondContact O-CG 3.42Å; L934-K938 PolarHBondContact O-N 3.14Å
935	Y	94.6	Very high	91.4	Very high	51 Å²	51	51.1 Å²	51.1	20%	0.2	25%	0.247	C	C	.	.	H	α-helix	trans	-71.4	-36.7	-177.9	-79.4	-71	0	0	0	112.8	M910 C913 H917 E931 E932 G933 K938 A939	M910-Y935 WeakPolarHBondContact O-CB 3.47Å; M910-Y935 HydrophobicContact SD-CD1 3.98Å; M910-Y935 HydrophobicContact SD-CE1 4.34Å; C913-Y935 HydrophobicContact CB-CD1 3.5Å; C913-Y935 VanDerWaalsContact CB-CD1 3.5Å; C913-Y935 HydrophobicContact CB-CD2 4.25Å; C913-Y935 HydrophobicContact CB-CE1 3.65Å; C913-Y935 HydrophobicContact CB-CE2 4.41Å; C913-Y935 HydrophobicContact CB-CG 3.82Å; H917-Y935 AromaticContact CD2-CD2 3.78Å; H917-Y935 AromaticContact CD2-CE2 3.59Å; H917-Y935 AromaticContact NE2-CE2 3.46Å; H917-Y935 WeakPolarHBondContact NE2-CE2 3.46Å; E931-Y935 VanDerWaalsContact O-CD2 3.26Å; E931-Y935 WeakPolarHBondContact O-CD2 3.45Å; E931-Y935 PolarHBondContact O-N 3.49Å; E931-Y935 VanDerWaalsContact O-N 3.12Å; E932-Y935 PolarHBondContact O-N 3.32Å; G933-Y935 PolarHBondContact O-N 3.1Å; Y935-K938 HydrophobicContact CD1-CD 4.44Å; Y935-K938 PolarHBondContact O-N 3.05Å; Y935-A939 PolarHBondContact O-N 3.07Å
936	Y	96	Very high	92.9	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.008	21%	0.211	C	C	.	.	H	α-helix	trans	-62.9	-40.6	171.5	-78.9	-60.5	0	0	0	112.6	R911 A914 F928 E932 A939 I940 T970 T973 M974 L977	R911-Y936 HydrophobicContact CB-CE1 4.46Å; R911-Y936 HydrophobicContact CG-CD1 4.32Å; R911-Y936 HydrophobicContact CG-CE1 4.23Å; A914-Y936 HydrophobicContact CB-CD1 4.24Å; A914-Y936 HydrophobicContact CB-CD2 3.77Å; A914-Y936 HydrophobicContact CB-CE1 4.15Å; A914-Y936 HydrophobicContact CB-CE2 3.65Å; A914-Y936 HydrophobicContact CB-CG 4.05Å; F928-Y936 HydrophobicContact CE2-CD2 4.15Å; F928-Y936 HydrophobicContact CE2-CE2 4.13Å; F928-Y936 HydrophobicContact CZ-CD2 4.05Å; F928-Y936 HydrophobicContact CZ-CE2 4.5Å; E932-Y936 HydrophobicContact CB-CE2 4.49Å; E932-Y936 WeakPolarHBondContact O-CD2 3.32Å; E932-Y936 PolarHBondContact O-N 3.25Å; Y936-A939 WeakPolarHBondContact O-CB 3.41Å; Y936-A939 PolarHBondContact O-N 3.17Å; Y936-I940 WeakPolarHBondContact O-CG1 3.48Å; Y936-I940 PolarHBondContact O-N 3.43Å; Y936-T970 HydrophobicContact CD1-CG2 3.92Å; Y936-T973 HydrophobicContact CE1-CG2 4.36Å; Y936-T973 WeakPolarHBondContact OH-CG2 3.34Å; Y936-M974 VanDerWaalsContact CB-SD 3.56Å; Y936-M974 HydrophobicContact CD1-CB 4.39Å; Y936-M974 HydrophobicContact CD2-CB 4.2Å; Y936-M974 HydrophobicContact CD2-CG 4.12Å; Y936-M974 HydrophobicContact CG-CB 4.03Å; Y936-M974 HydrophobicContact CG-CG 4.15Å; Y936-M974 HydrophobicContact CG-SD 4.33Å; Y936-L977 HydrophobicContact CE2-CD1 3.83Å; Y936-L977 WeakPolarHBondContact OH-CD1 3.27Å
937	N	95.6	Very high	93.3	Very high	84 Å²	84	41.4 Å²	41.4	45%	0.449	21%	0.207	S	C	.	.	H	α-helix	trans	-64.1	-41.1	174.8	-77.3	-62	0	0	0	111.8	G933 L934 A939 I940 D941	G933-N937 WeakPolarHBondContact O-CB 3.37Å; G933-N937 PolarHBondContact O-N 2.97Å; G933-N937 PolarHBondContact O-ND2 3.13Å; L934-N937 PolarHBondContact O-N 3.15Å; N937-A939 VanDerWaalsContact C-N 3.32Å; N937-A939 PolarHBondContact O-N 3.36Å; N937-I940 WeakPolarHBondContact O-CB 3.31Å; N937-I940 PolarHBondContact O-N 3.35Å; N937-D941 PolarHBondContact O-N 3.11Å
938	K	96.4	Very high	93.6	Very high	85 Å²	85	47 Å²	47	37%	0.37	23%	0.226	S	C	.	.	H	α-helix	trans	-60.2	-41.2	172.1	-73.6	179.4	177.3	-179	0	112.3	M910 L934 Y935 I940 D941 Y942	M910-K938 HydrophobicContact CB-CB 4.48Å; M910-K938 HydrophobicContact CG-CB 4.02Å; M910-K938 HydrophobicContact SD-CB 4.11Å; M910-K938 HydrophobicContact SD-CD 4.21Å; L934-K938 WeakPolarHBondContact O-CG 3.42Å; L934-K938 PolarHBondContact O-N 3.14Å; Y935-K938 HydrophobicContact CD1-CD 4.44Å; Y935-K938 PolarHBondContact O-N 3.05Å; K938-I940 VanDerWaalsContact C-N 3.34Å; K938-I940 PolarHBondContact O-N 3.22Å; K938-D941 PolarHBondContact O-N 3.33Å; K938-Y942 WeakPolarHBondContact O-CD2 3.5Å; K938-Y942 PolarHBondContact O-N 2.93Å; K938-Y942 VanDerWaalsContact O-N 3.15Å
939	A	97.1	Very high	93.6	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-58.7	-47.2	176.2	0	0	0	0	0	111.3	G907 M910 R911 Y935 Y936 N937 D941 Y942 Y943 T970	G907-A939 WeakPolarHBondContact O-CB 3.47Å; M910-A939 HydrophobicContact CB-CB 3.73Å; R911-A939 HydrophobicContact CG-CB 3.92Å; Y935-A939 PolarHBondContact O-N 3.07Å; Y936-A939 WeakPolarHBondContact O-CB 3.41Å; Y936-A939 PolarHBondContact O-N 3.17Å; N937-A939 VanDerWaalsContact C-N 3.32Å; N937-A939 PolarHBondContact O-N 3.36Å; A939-D941 VanDerWaalsContact C-N 3.33Å; A939-D941 PolarHBondContact O-N 3.48Å; A939-Y942 PolarHBondContact O-N 3.14Å; A939-Y943 HydrophobicContact CB-CE2 4.14Å; A939-Y943 WeakPolarHBondContact O-CD2 3.3Å; A939-Y943 PolarHBondContact O-N 3.11Å; A939-T970 HydrophobicContact CB-CG2 3.98Å
940	I	96.9	Very high	93.6	Very high	5 Å²	5	48.4 Å²	48.4	3%	0.026	24%	0.236	C	C	.	.	H	α-helix	trans	-56.1	-46.9	175.7	-72	159.1	0	0	0	111.1	Y936 N937 K938 Y942 Y943 L944 L967 T970 Y971 M974	Y936-I940 WeakPolarHBondContact O-CG1 3.48Å; Y936-I940 PolarHBondContact O-N 3.43Å; N937-I940 WeakPolarHBondContact O-CB 3.31Å; N937-I940 PolarHBondContact O-N 3.35Å; K938-I940 VanDerWaalsContact C-N 3.34Å; K938-I940 PolarHBondContact O-N 3.22Å; I940-Y942 VanDerWaalsContact C-N 3.29Å; I940-Y942 PolarHBondContact O-N 3.42Å; I940-Y943 PolarHBondContact O-N 2.68Å; I940-L944 HydrophobicContact CG2-CD1 3.79Å; I940-L944 HydrophobicContact CG2-CG 4.3Å; I940-L944 WeakPolarHBondContact O-CB 3.25Å; I940-L944 WeakPolarHBondContact O-CG 3.41Å; I940-L944 PolarHBondContact O-N 2.96Å; I940-L967 HydrophobicContact CB-CD1 4.39Å; I940-L967 HydrophobicContact CG1-CD1 4.18Å; I940-L967 HydrophobicContact CG2-CD1 4.22Å; I940-T970 HydrophobicContact CD1-CG2 4.47Å; I940-T970 HydrophobicContact CG1-CG2 3.91Å; I940-Y971 HydrophobicContact CD1-CD1 3.74Å; I940-Y971 HydrophobicContact CD1-CE1 3.38Å; I940-Y971 HydrophobicContact CD1-CG 4.45Å; I940-Y971 HydrophobicContact CG1-CD1 4.41Å; I940-Y971 HydrophobicContact CG1-CE1 4.01Å; I940-Y971 HydrophobicContact CG1-CE2 4.34Å; I940-Y971 HydrophobicContact CG2-CE1 4.31Å; I940-Y971 HydrophobicContact CG2-CE2 4.33Å; I940-Y971 WeakPolarHBondContact CG2-OH 3.47Å; I940-M974 HydrophobicContact CD1-CE 4.04Å; I940-M974 HydrophobicContact CD1-SD 4.45Å
941	D	96.9	Very high	93.6	Very high	89 Å²	89	47.3 Å²	47.3	48%	0.476	24%	0.237	S	C	.	.	H	α-helix	trans	-59.1	-40.6	179.6	-71.9	-21.6	0	0	0	112.2	N937 K938 A939 K945	N937-D941 PolarHBondContact O-N 3.11Å; K938-D941 PolarHBondContact O-N 3.33Å; A939-D941 VanDerWaalsContact C-N 3.33Å; A939-D941 PolarHBondContact O-N 3.48Å; D941-K945 VanDerWaalsContact O-CG 3.27Å; D941-K945 WeakPolarHBondContact O-CG 3.38Å; D941-K945 PolarHBondContact O-N 3.33Å
942	Y	97.4	Very high	93.5	Very high	45 Å²	45	46.7 Å²	46.7	18%	0.176	24%	0.239	C	C	.	.	H	α-helix	trans	-68.3	-42.8	177.2	-77.1	-65	0	0	0	112.9	F880 L903 T906 M910 K938 A939 I940 L944 K945 A946	F880-Y942 HydrophobicContact CE2-CE2 4.33Å; F880-Y942 AromaticContact CE2-CZ 3.87Å; F880-Y942 VanDerWaalsContact CE2-OH 3.25Å; F880-Y942 WeakPolarHBondContact CE2-OH 3.48Å; F880-Y942 WeakPolarHBondContact CZ-OH 3.3Å; L903-Y942 HydrophobicContact CD2-CD1 3.81Å; L903-Y942 HydrophobicContact CD2-CE1 4.42Å; T906-Y942 HydrophobicContact CG2-CD1 3.89Å; T906-Y942 HydrophobicContact CG2-CD2 3.78Å; T906-Y942 HydrophobicContact CG2-CE1 3.84Å; T906-Y942 HydrophobicContact CG2-CE2 3.72Å; T906-Y942 HydrophobicContact CG2-CG 3.89Å; M910-Y942 HydrophobicContact CG-CD2 3.96Å; M910-Y942 HydrophobicContact CG-CE2 4.08Å; M910-Y942 HydrophobicContact SD-CE2 4.46Å; K938-Y942 WeakPolarHBondContact O-CD2 3.5Å; K938-Y942 PolarHBondContact O-N 2.93Å; K938-Y942 VanDerWaalsContact O-N 3.15Å; A939-Y942 PolarHBondContact O-N 3.14Å; I940-Y942 VanDerWaalsContact C-N 3.29Å; I940-Y942 PolarHBondContact O-N 3.42Å; Y942-L944 VanDerWaalsContact C-N 3.34Å; Y942-L944 PolarHBondContact O-N 3.44Å; Y942-K945 HydrophobicContact CD1-CD 4.32Å; Y942-K945 WeakPolarHBondContact O-CB 3.44Å; Y942-K945 PolarHBondContact O-N 3.02Å; Y942-A946 PolarHBondContact O-N 3.41Å
943	Y	97.1	Very high	93.2	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-64.5	-38.6	175	-65.8	-55.1	0	0	0	112.3	C904 R908 A939 I940 K945 A946 L947 V963 E966 L967 T970	C904-Y943 HydrophobicContact CB-CE1 4.36Å; C904-Y943 VanDerWaalsContact O-CE1 3.32Å; C904-Y943 WeakPolarHBondContact O-CE1 3.46Å; R908-Y943 WeakPolarHBondContact CA-OH 3.46Å; R908-Y943 PolarHBondContact N-OH 3.05Å; A939-Y943 HydrophobicContact CB-CE2 4.14Å; A939-Y943 WeakPolarHBondContact O-CD2 3.3Å; A939-Y943 PolarHBondContact O-N 3.11Å; I940-Y943 PolarHBondContact O-N 2.68Å; Y943-K945 VanDerWaalsContact C-N 3.33Å; Y943-A946 WeakPolarHBondContact O-CB 3.45Å; Y943-A946 PolarHBondContact O-N 3.18Å; Y943-L947 PolarHBondContact O-N 3.49Å; Y943-V963 HydrophobicContact CD1-CG1 4.32Å; Y943-E966 HydrophobicContact CD1-CB 4.21Å; Y943-E966 HydrophobicContact CE1-CB 3.61Å; Y943-E966 HydrophobicContact CE1-CG 4.41Å; Y943-E966 HydrophobicContact CE2-CB 4.48Å; Y943-L967 HydrophobicContact CD2-CD1 4.25Å; Y943-L967 HydrophobicContact CG-CB 4.39Å; Y943-T970 HydrophobicContact CE2-CG2 4.5Å; Y943-T970 WeakPolarHBondContact CE2-OG1 3.42Å
944	L	95.4	Very high	92.7	Very high	48 Å²	48	57.8 Å²	57.8	25%	0.251	29%	0.29	S	S	.	.	H	α-helix	trans	-67.3	-33.7	174.4	-70.2	175.1	0	0	0	112.2	I940 Y942 R948 L967	I940-L944 HydrophobicContact CG2-CD1 3.79Å; I940-L944 HydrophobicContact CG2-CG 4.3Å; I940-L944 WeakPolarHBondContact O-CB 3.25Å; I940-L944 WeakPolarHBondContact O-CG 3.41Å; I940-L944 PolarHBondContact O-N 2.96Å; Y942-L944 VanDerWaalsContact C-N 3.34Å; Y942-L944 PolarHBondContact O-N 3.44Å; L944-R948 WeakPolarHBondContact O-CG 3.31Å; L944-R948 PolarHBondContact O-N 3.13Å; L944-R948 VanDerWaalsContact O-N 3.11Å; L944-R948 PolarHBondContact O-NE 2.91Å; L944-L967 HydrophobicContact CD2-CD2 3.82Å; L944-L967 HydrophobicContact CG-CD2 4.41Å
945	K	95.2	Very high	92.1	Very high	92 Å²	92	58.2 Å²	58.2	40%	0.4	29%	0.291	S	S	.	.	H	α-helix	trans	-63.5	-43.7	169	-75.3	172.4	-177.9	-176.4	0	111.2	L903 D941 Y942 Y943 L947 R948 S949	L903-K945 HydrophobicContact CD1-CB 4.22Å; L903-K945 HydrophobicContact CD2-CB 4.25Å; D941-K945 VanDerWaalsContact O-CG 3.27Å; D941-K945 WeakPolarHBondContact O-CG 3.38Å; D941-K945 PolarHBondContact O-N 3.33Å; Y942-K945 HydrophobicContact CD1-CD 4.32Å; Y942-K945 WeakPolarHBondContact O-CB 3.44Å; Y942-K945 PolarHBondContact O-N 3.02Å; Y943-K945 VanDerWaalsContact C-N 3.33Å; K945-L947 PolarHBondContact O-N 3.49Å; K945-R948 VanDerWaalsContact CG-NH2 3.26Å; K945-R948 PolarHBondContact O-N 3.35Å; K945-S949 PolarHBondContact O-N 2.7Å
946	A	94.4	Very high	91.5	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-59.9	-46.3	177.2	0	0	0	0	0	112	A900 L903 Y942 Y943 R948 S949 L950 V963	A900-A946 HydrophobicContact CB-CB 4.24Å; L903-A946 HydrophobicContact CB-CB 3.77Å; L903-A946 HydrophobicContact CD1-CB 4.36Å; Y942-A946 PolarHBondContact O-N 3.41Å; Y943-A946 WeakPolarHBondContact O-CB 3.45Å; Y943-A946 PolarHBondContact O-N 3.18Å; A946-R948 VanDerWaalsContact C-N 3.34Å; A946-R948 PolarHBondContact O-N 3.42Å; A946-S949 PolarHBondContact O-N 2.8Å; A946-L950 WeakPolarHBondContact O-CG 3.39Å; A946-L950 PolarHBondContact O-N 3.03Å; A946-V963 HydrophobicContact CB-CG1 3.96Å; A946-V963 HydrophobicContact CB-CG2 4.25Å
947	L	92.7	Very high	91	Very high	17 Å²	17	62.3 Å²	62.3	9%	0.089	32%	0.318	C	S	.	.	H	α-helix	trans	-62.3	-39.4	175.8	-70	175.5	0	0	0	112.6	Y943 K945 S949 L950 G951 W960 V963 L967 Y1006	Y943-L947 PolarHBondContact O-N 3.49Å; K945-L947 PolarHBondContact O-N 3.49Å; L947-S949 VanDerWaalsContact C-N 3.31Å; L947-S949 PolarHBondContact O-N 3.32Å; L947-L950 PolarHBondContact O-N 3.46Å; L947-G951 PolarHBondContact O-N 3.39Å; L947-G951 VanDerWaalsContact O-N 3.14Å; L947-W960 HydrophobicContact CB-CZ3 4.44Å; L947-W960 HydrophobicContact CD2-CD2 3.92Å; L947-W960 HydrophobicContact CD2-CE3 3.88Å; L947-W960 HydrophobicContact CD2-CH2 4.16Å; L947-W960 HydrophobicContact CD2-CZ2 4.19Å; L947-W960 HydrophobicContact CD2-CZ3 4Å; L947-W960 WeakPolarHBondContact O-CZ3 3.28Å; L947-V963 HydrophobicContact CD1-CG1 4.47Å; L947-V963 HydrophobicContact CD2-CB 4.02Å; L947-V963 HydrophobicContact CD2-CG1 3.75Å; L947-V963 HydrophobicContact CG-CB 4.49Å; L947-V963 HydrophobicContact CG-CG1 3.68Å; L947-L967 HydrophobicContact CD1-CD2 3.84Å; L947-Y1006 HydrophobicContact CD1-CE1 4.26Å
948	R	92.1	Very high	90.6	Very high	183 Å²	183	62 Å²	62	69%	0.691	33%	0.327	S	S	*	.	H	α-helix	trans	-63.1	-38.1	174.9	-78.1	-174.6	-70.6	174.5	-4.7	112.3	L944 K945 A946 G951	L944-R948 WeakPolarHBondContact O-CG 3.31Å; L944-R948 PolarHBondContact O-N 3.13Å; L944-R948 VanDerWaalsContact O-N 3.11Å; L944-R948 PolarHBondContact O-NE 2.91Å; K945-R948 VanDerWaalsContact CG-NH2 3.26Å; K945-R948 PolarHBondContact O-N 3.35Å; A946-R948 VanDerWaalsContact C-N 3.34Å; A946-R948 PolarHBondContact O-N 3.42Å; R948-G951 PolarHBondContact O-N 3.18Å
949	S	89.4	Confident	90.2	Very high	47 Å²	47	59.1 Å²	59.1	33%	0.329	32%	0.316	S	S	.	.	H	α-helix	trans	-68.4	-37.6	177.5	-179.2	0	0	0	0	112.4	A896 K945 A946 L947 G951	A896-S949 PolarHBondContact O-OG 3.16Å; K945-S949 PolarHBondContact O-N 2.7Å; A946-S949 PolarHBondContact O-N 2.8Å; L947-S949 VanDerWaalsContact C-N 3.31Å; L947-S949 PolarHBondContact O-N 3.32Å; S949-G951 VanDerWaalsContact C-N 3.32Å
950	L	88.9	Confident	89.9	Confident	9 Å²	9	61.5 Å²	61.5	5%	0.047	33%	0.326	C	S	.	.	H	α-helix	trans	-72.5	-23	176.8	-67.7	169.4	0	0	0	113.4	A900 A946 L947 T952 H956 V959 W960 V963	A900-L950 HydrophobicContact CB-CD1 4.03Å; A900-L950 HydrophobicContact CB-CD2 3.68Å; A900-L950 HydrophobicContact CB-CG 3.61Å; A946-L950 WeakPolarHBondContact O-CG 3.39Å; A946-L950 PolarHBondContact O-N 3.03Å; L947-L950 PolarHBondContact O-N 3.46Å; L950-T952 PolarHBondContact O-N 3.48Å; L950-H956 HydrophobicContact CD2-CB 4.46Å; L950-V959 HydrophobicContact CD1-CG1 3.99Å; L950-V959 HydrophobicContact CD2-CG1 4.21Å; L950-W960 HydrophobicContact CB-CE3 3.76Å; L950-W960 HydrophobicContact CB-CZ3 4.02Å; L950-W960 HydrophobicContact CD1-CE3 4.18Å; L950-V963 HydrophobicContact CD1-CG2 4.29Å
951	G	86.6	Confident	89.5	Confident	46 Å²	46	63.1 Å²	63.1	47%	0.474	33%	0.334	S	S	.	.			trans	74.1	-83.8	178.7	0	0	0	0	0	113.1	L947 R948 S949 W960	L947-G951 PolarHBondContact O-N 3.39Å; L947-G951 VanDerWaalsContact O-N 3.14Å; R948-G951 PolarHBondContact O-N 3.18Å; S949-G951 VanDerWaalsContact C-N 3.32Å; G951-W960 WeakPolarHBondContact O-CH2 3.16Å; G951-W960 WeakPolarHBondContact O-CZ3 3.43Å
952	T	85.5	Confident	89.1	Confident	75 Å²	75	60.5 Å²	60.5	46%	0.46	32%	0.323	S	S	.	.	S	Bend	trans	-124.8	156	-176.6	62.7	0	0	0	0	111.9	L950 D954	L950-T952 PolarHBondContact O-N 3.48Å; T952-D954 PolarHBondContact O-N 2.71Å
953	R	84	Confident	88.9	Confident	95 Å²	95	58.4 Å²	58.4	36%	0.358	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-30.2	-179.7	-175.9	174.6	-178.8	-125.9	-0.1	113.1	I955 P957 W960 D961	R953-I955 VanDerWaalsContact C-N 3.26Å; R953-I955 PolarHBondContact O-N 2.82Å; R953-P957 HydrophobicContact CG-CB 4.48Å; R953-P957 WeakPolarHBondContact O-CA 3.5Å; R953-W960 HydrophobicContact CB-CD2 4.15Å; R953-W960 HydrophobicContact CB-CG 4.01Å; R953-W960 HydrophobicContact CG-CB 4.44Å; R953-W960 HydrophobicContact CG-CG 3.99Å; R953-D961 IonicContact CZ-OD1 2.66Å; R953-D961 IonicContact CZ-OD2 2.7Å; R953-D961 IonicContact NE-OD1 2.91Å; R953-D961 PolarHBondContact NE-OD1 3.49Å; R953-D961 IonicContact NE-OD2 3.62Å; R953-D961 IonicContact NH2-OD1 3.19Å; R953-D961 IonicContact NH2-OD2 3.26Å; R953-D961 PolarHBondContact NH2-OD2 3.08Å; R953-D961 VanDerWaalsContact NH2-OD2 3.16Å
954	D	80.7	Confident	88.6	Confident	147 Å²	147	59.4 Å²	59.4	79%	0.786	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-23.2	-170.4	-58.7	-32.4	0	0	0	113.7	T952	T952-D954 PolarHBondContact O-N 2.71Å
955	I	81.1	Confident	88.5	Confident	103 Å²	103	59.1 Å²	59.1	53%	0.528	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-48.6	-176.5	-49.2	177	0	0	0	110.8	R953	R953-I955 VanDerWaalsContact C-N 3.26Å; R953-I955 PolarHBondContact O-N 2.82Å
956	H	82.1	Confident	88.4	Confident	74 Å²	74	56.8 Å²	56.8	34%	0.343	31%	0.306	S	S	.	.			trans	-140.5	75.2	-177.1	-64.9	-60.4	0	0	0	111.8	T897 L950 A958 V959 W960	T897-H956 PolarHBondContact OG1-CD2 3.4Å; T897-H956 PolarHBondContact OG1-NE2 2.81Å; L950-H956 HydrophobicContact CD2-CB 4.46Å; H956-A958 PolarHBondContact O-N 2.63Å; H956-V959 HydrophobicContact CB-CB 4.36Å; H956-V959 HydrophobicContact CB-CG2 4.48Å; H956-V959 PolarHBondContact O-N 2.9Å; H956-W960 WeakPolarHBondContact O-CB 3.41Å; H956-W960 PolarHBondContact O-N 2.82Å
957	P	86	Confident	88.4	Confident	64 Å²	64	56.8 Å²	56.8	42%	0.416	31%	0.306	S	S	.	.	H	α-helix	trans	-62.5	-38.6	-170.7	21.4	-32.3	0	0	0	113.1	R953 V959 W960 D961	R953-P957 HydrophobicContact CG-CB 4.48Å; R953-P957 WeakPolarHBondContact O-CA 3.5Å; P957-V959 PolarHBondContact O-N 3.34Å; P957-W960 PolarHBondContact O-N 3.37Å; P957-D961 VanDerWaalsContact O-CB 3.26Å; P957-D961 WeakPolarHBondContact O-CB 3.31Å; P957-D961 PolarHBondContact O-N 3.48Å
958	A	86.6	Confident	88.5	Confident	78 Å²	78	56 Å²	56	65%	0.645	30%	0.302	S	S	*	.	H	α-helix	trans	-64.2	-43.3	179.8	0	0	0	0	0	113	H956 S962	H956-A958 PolarHBondContact O-N 2.63Å; A958-S962 WeakPolarHBondContact O-CB 3.48Å; A958-S962 PolarHBondContact O-N 2.97Å; A958-S962 VanDerWaalsContact O-N 3.1Å
959	V	88	Confident	88.6	Confident	25 Å²	25	47.9 Å²	47.9	15%	0.152	27%	0.273	C	S	.	.	H	α-helix	trans	-70.9	-43.6	178.6	-175.6	0	0	0	0	109.9	T897 L901 L950 H956 P957 D961 S962 V963	T897-V959 HydrophobicContact CG2-CG2 4.05Å; L901-V959 HydrophobicContact CD2-CG1 3.8Å; L901-V959 HydrophobicContact CD2-CG2 4.34Å; L901-V959 HydrophobicContact CG-CG1 4.19Å; L950-V959 HydrophobicContact CD1-CG1 3.99Å; L950-V959 HydrophobicContact CD2-CG1 4.21Å; H956-V959 HydrophobicContact CB-CB 4.36Å; H956-V959 HydrophobicContact CB-CG2 4.48Å; H956-V959 PolarHBondContact O-N 2.9Å; P957-V959 PolarHBondContact O-N 3.34Å; V959-D961 PolarHBondContact O-N 3.26Å; V959-S962 WeakPolarHBondContact O-CB 3.28Å; V959-S962 PolarHBondContact O-N 2.92Å; V959-S962 VanDerWaalsContact O-N 3.17Å; V959-V963 HydrophobicContact CG1-CG2 4.43Å; V959-V963 WeakPolarHBondContact O-CG2 3.4Å; V959-V963 PolarHBondContact O-N 3.25Å
960	W	90.5	Very high	88.9	Confident	50 Å²	50	45.7 Å²	45.7	19%	0.189	26%	0.257	C	S	.	.	H	α-helix	trans	-56.9	-49.1	175.9	-176.7	-87.9	0	0	0	112.5	L947 L950 G951 R953 H956 P957 S962 V963 N964	L947-W960 HydrophobicContact CB-CZ3 4.44Å; L947-W960 HydrophobicContact CD2-CD2 3.92Å; L947-W960 HydrophobicContact CD2-CE3 3.88Å; L947-W960 HydrophobicContact CD2-CH2 4.16Å; L947-W960 HydrophobicContact CD2-CZ2 4.19Å; L947-W960 HydrophobicContact CD2-CZ3 4Å; L947-W960 WeakPolarHBondContact O-CZ3 3.28Å; L950-W960 HydrophobicContact CB-CE3 3.76Å; L950-W960 HydrophobicContact CB-CZ3 4.02Å; L950-W960 HydrophobicContact CD1-CE3 4.18Å; G951-W960 WeakPolarHBondContact O-CH2 3.16Å; G951-W960 WeakPolarHBondContact O-CZ3 3.43Å; R953-W960 HydrophobicContact CB-CD2 4.15Å; R953-W960 HydrophobicContact CB-CG 4.01Å; R953-W960 HydrophobicContact CG-CB 4.44Å; R953-W960 HydrophobicContact CG-CG 3.99Å; H956-W960 WeakPolarHBondContact O-CB 3.41Å; H956-W960 PolarHBondContact O-N 2.82Å; P957-W960 PolarHBondContact O-N 3.37Å; W960-S962 VanDerWaalsContact C-N 3.25Å; W960-S962 PolarHBondContact O-N 2.94Å; W960-V963 PolarHBondContact O-N 2.89Å; W960-N964 PolarHBondContact NE1-ND2 3.24Å; W960-N964 PolarHBondContact O-N 3.44Å; W960-N964 PolarHBondContact O-ND2 2.74Å; W960-N964 VanDerWaalsContact O-ND2 3.09Å
961	D	88.5	Confident	89.2	Confident	38 Å²	38	46.1 Å²	46.1	20%	0.203	26%	0.258	C	S	.	.	H	α-helix	trans	-66.6	-30.1	179.7	-67.6	-7.3	0	0	0	111	R953 P957 V959 W965 R1015	R953-D961 IonicContact CZ-OD1 2.66Å; R953-D961 IonicContact CZ-OD2 2.7Å; R953-D961 IonicContact NE-OD1 2.91Å; R953-D961 PolarHBondContact NE-OD1 3.49Å; R953-D961 IonicContact NE-OD2 3.62Å; R953-D961 IonicContact NH2-OD1 3.19Å; R953-D961 IonicContact NH2-OD2 3.26Å; R953-D961 PolarHBondContact NH2-OD2 3.08Å; R953-D961 VanDerWaalsContact NH2-OD2 3.16Å; P957-D961 VanDerWaalsContact O-CB 3.26Å; P957-D961 WeakPolarHBondContact O-CB 3.31Å; P957-D961 PolarHBondContact O-N 3.48Å; V959-D961 PolarHBondContact O-N 3.26Å; D961-W965 VanDerWaalsContact O-CB 3.31Å; D961-W965 WeakPolarHBondContact O-CB 3.26Å; D961-W965 PolarHBondContact O-N 3.39Å; D961-R1015 PolarHBondContact O-NH1 3.07Å
962	S	89.8	Confident	89.7	Confident	34 Å²	34	45.7 Å²	45.7	24%	0.238	24%	0.244	C	C	.	.	H	α-helix	trans	-70	-45.1	172.1	-153.1	0	0	0	0	113.7	A958 V959 W960 N964 W965 E966	A958-S962 WeakPolarHBondContact O-CB 3.48Å; A958-S962 PolarHBondContact O-N 2.97Å; A958-S962 VanDerWaalsContact O-N 3.1Å; V959-S962 WeakPolarHBondContact O-CB 3.28Å; V959-S962 PolarHBondContact O-N 2.92Å; V959-S962 VanDerWaalsContact O-N 3.17Å; W960-S962 VanDerWaalsContact C-N 3.25Å; W960-S962 PolarHBondContact O-N 2.94Å; S962-N964 PolarHBondContact O-N 3.22Å; S962-W965 PolarHBondContact O-N 2.84Å; S962-E966 WeakPolarHBondContact O-CG 3.44Å; S962-E966 PolarHBondContact O-N 2.7Å
963	V	92.3	Very high	90.1	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.006	23%	0.231	C	C	.	.	H	α-helix	trans	-64.9	-41	177.5	177.6	0	0	0	0	110.8	C904 Y943 A946 L947 L950 V959 W960 E966 L967	C904-V963 HydrophobicContact CB-CG2 4.19Å; Y943-V963 HydrophobicContact CD1-CG1 4.32Å; A946-V963 HydrophobicContact CB-CG1 3.96Å; A946-V963 HydrophobicContact CB-CG2 4.25Å; L947-V963 HydrophobicContact CD1-CG1 4.47Å; L947-V963 HydrophobicContact CD2-CB 4.02Å; L947-V963 HydrophobicContact CD2-CG1 3.75Å; L947-V963 HydrophobicContact CG-CB 4.49Å; L947-V963 HydrophobicContact CG-CG1 3.68Å; L950-V963 HydrophobicContact CD1-CG2 4.29Å; V959-V963 HydrophobicContact CG1-CG2 4.43Å; V959-V963 WeakPolarHBondContact O-CG2 3.4Å; V959-V963 PolarHBondContact O-N 3.25Å; W960-V963 PolarHBondContact O-N 2.89Å; V963-E966 PolarHBondContact O-N 3.02Å; V963-L967 VanDerWaalsContact O-CB 3.31Å; V963-L967 WeakPolarHBondContact O-CB 3.37Å; V963-L967 PolarHBondContact O-N 2.93Å
964	N	91.4	Very high	90.6	Very high	22 Å²	22	39.6 Å²	39.6	12%	0.118	22%	0.217	C	C	.	.	H	α-helix	trans	-63.2	-41.6	175.3	-80.7	-51.8	0	0	0	112.6	W960 S962 L967 S968 Y1006	W960-N964 PolarHBondContact NE1-ND2 3.24Å; W960-N964 PolarHBondContact O-N 3.44Å; W960-N964 PolarHBondContact O-ND2 2.74Å; W960-N964 VanDerWaalsContact O-ND2 3.09Å; S962-N964 PolarHBondContact O-N 3.22Å; N964-L967 PolarHBondContact O-N 2.85Å; N964-S968 VanDerWaalsContact O-CB 3.27Å; N964-S968 WeakPolarHBondContact O-CB 3.41Å; N964-S968 PolarHBondContact O-N 3.15Å; N964-Y1006 VanDerWaalsContact OD1-CD1 3.28Å; N964-Y1006 WeakPolarHBondContact OD1-CD1 3.22Å
965	W	92	Very high	91.3	Very high	42 Å²	42	32.6 Å²	32.6	16%	0.159	18%	0.179	C	C	.	.	H	α-helix	trans	-59.9	-46.5	175.2	175.6	-103.2	0	0	0	112.1	D961 S962 S968 T969 L1018 R1022	D961-W965 VanDerWaalsContact O-CB 3.31Å; D961-W965 WeakPolarHBondContact O-CB 3.26Å; D961-W965 PolarHBondContact O-N 3.39Å; S962-W965 PolarHBondContact O-N 2.84Å; W965-S968 PolarHBondContact O-N 3.45Å; W965-T969 WeakPolarHBondContact O-CB 3.42Å; W965-T969 PolarHBondContact O-N 3.17Å; W965-T969 PolarHBondContact O-OG1 3.47Å; W965-L1018 HydrophobicContact CH2-CB 3.59Å; W965-L1018 HydrophobicContact CZ2-CB 4.3Å; W965-L1018 HydrophobicContact CZ3-CB 4.13Å; W965-R1022 VanDerWaalsContact CE3-NH1 3.26Å; W965-R1022 VanDerWaalsContact CH2-NH1 3.33Å
966	E	93.8	Very high	91.9	Very high	42 Å²	42	28.8 Å²	28.8	20%	0.196	16%	0.16	C	C	.	.	H	α-helix	trans	-66.7	-39.5	178.2	-70.8	-56.1	138	0	0	112.2	R911 Y943 S962 V963 T969 T970	R911-E966 IonicContact NH1-OE2 3.67Å; R911-E966 PolarHBondContact NH1-OE2 3.2Å; Y943-E966 HydrophobicContact CD1-CB 4.21Å; Y943-E966 HydrophobicContact CE1-CB 3.61Å; Y943-E966 HydrophobicContact CE1-CG 4.41Å; Y943-E966 HydrophobicContact CE2-CB 4.48Å; S962-E966 WeakPolarHBondContact O-CG 3.44Å; S962-E966 PolarHBondContact O-N 2.7Å; V963-E966 PolarHBondContact O-N 3.02Å; E966-T969 WeakPolarHBondContact O-CB 3.43Å; E966-T969 PolarHBondContact O-N 2.77Å; E966-T970 WeakPolarHBondContact O-CB 3.38Å; E966-T970 PolarHBondContact O-N 2.95Å; E966-T970 PolarHBondContact O-OG1 3.31Å
967	L	94.6	Very high	92.3	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-63.7	-46.4	175	-178	54.6	0	0	0	111.7	I940 Y943 L944 L947 V963 N964 T969 T970 Y971 Y1006	I940-L967 HydrophobicContact CB-CD1 4.39Å; I940-L967 HydrophobicContact CG1-CD1 4.18Å; I940-L967 HydrophobicContact CG2-CD1 4.22Å; Y943-L967 HydrophobicContact CD2-CD1 4.25Å; Y943-L967 HydrophobicContact CG-CB 4.39Å; L944-L967 HydrophobicContact CD2-CD2 3.82Å; L944-L967 HydrophobicContact CG-CD2 4.41Å; L947-L967 HydrophobicContact CD1-CD2 3.84Å; V963-L967 VanDerWaalsContact O-CB 3.31Å; V963-L967 WeakPolarHBondContact O-CB 3.37Å; V963-L967 PolarHBondContact O-N 2.93Å; N964-L967 PolarHBondContact O-N 2.85Å; L967-T969 VanDerWaalsContact C-N 3.32Å; L967-T969 PolarHBondContact O-N 2.93Å; L967-T970 WeakPolarHBondContact O-CB 3.16Å; L967-T970 PolarHBondContact O-N 2.91Å; L967-Y971 HydrophobicContact CD1-CD2 3.88Å; L967-Y971 HydrophobicContact CD1-CE2 3.48Å; L967-Y971 VanDerWaalsContact CD1-CE2 3.48Å; L967-Y971 HydrophobicContact CG-CD2 4.09Å; L967-Y971 HydrophobicContact CG-CE2 3.88Å; L967-Y971 WeakPolarHBondContact O-CD2 3.37Å; L967-Y971 PolarHBondContact O-N 3.3Å; L967-Y971 VanDerWaalsContact O-N 3.08Å; L967-Y1006 HydrophobicContact CD2-CD1 3.86Å; L967-Y1006 HydrophobicContact CD2-CD2 3.66Å; L967-Y1006 HydrophobicContact CD2-CE1 3.82Å; L967-Y1006 HydrophobicContact CD2-CE2 3.62Å; L967-Y1006 HydrophobicContact CD2-CG 3.79Å; L967-Y1006 HydrophobicContact CG-CD2 3.81Å; L967-Y1006 HydrophobicContact CG-CE2 4.11Å; L967-Y1006 HydrophobicContact CG-CG 4.11Å
968	S	94.4	Very high	92.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-58.5	-44.4	174	177.2	0	0	0	0	111.3	N964 W965 T970 Y971 F972 S1003	N964-S968 VanDerWaalsContact O-CB 3.27Å; N964-S968 WeakPolarHBondContact O-CB 3.41Å; N964-S968 PolarHBondContact O-N 3.15Å; W965-S968 PolarHBondContact O-N 3.45Å; S968-T970 VanDerWaalsContact C-N 3.31Å; S968-T970 PolarHBondContact O-N 3.03Å; S968-Y971 PolarHBondContact O-N 2.91Å; S968-F972 WeakPolarHBondContact O-CB 3.31Å; S968-F972 PolarHBondContact O-N 3.28Å; S968-S1003 PolarHBondContact O-OG 3.1Å; S968-S1003 PolarHBondContact OG-O 3.01Å; S968-S1003 PolarHBondContact OG-OG 3.48Å
969	T	94.1	Very high	92.8	Very high	14 Å²	14	22.9 Å²	22.9	9%	0.086	12%	0.115	C	C	.	.	H	α-helix	trans	-60.9	-40.7	177.1	-55.9	0	0	0	0	111.5	W965 E966 L967 F972 T973 R1022	W965-T969 WeakPolarHBondContact O-CB 3.42Å; W965-T969 PolarHBondContact O-N 3.17Å; W965-T969 PolarHBondContact O-OG1 3.47Å; E966-T969 WeakPolarHBondContact O-CB 3.43Å; E966-T969 PolarHBondContact O-N 2.77Å; L967-T969 VanDerWaalsContact C-N 3.32Å; L967-T969 PolarHBondContact O-N 2.93Å; T969-F972 PolarHBondContact O-N 3.34Å; T969-T973 WeakPolarHBondContact O-CB 3.34Å; T969-T973 PolarHBondContact O-N 3.23Å; T969-T973 PolarHBondContact O-OG1 2.74Å; T969-R1022 VanDerWaalsContact OG1-CZ 3.25Å; T969-R1022 PolarHBondContact OG1-NH1 3.46Å; T969-R1022 PolarHBondContact OG1-NH2 2.83Å
970	T	95.7	Very high	92.9	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-65.5	-50	-179.4	-54.6	0	0	0	0	111.3	R911 Y936 A939 I940 Y943 E966 L967 S968 F972 T973 M974	R911-T970 WeakPolarHBondContact CD-OG1 3.28Å; R911-T970 HydrophobicContact CG-CG2 4.21Å; Y936-T970 HydrophobicContact CD1-CG2 3.92Å; A939-T970 HydrophobicContact CB-CG2 3.98Å; I940-T970 HydrophobicContact CD1-CG2 4.47Å; I940-T970 HydrophobicContact CG1-CG2 3.91Å; Y943-T970 HydrophobicContact CE2-CG2 4.5Å; Y943-T970 WeakPolarHBondContact CE2-OG1 3.42Å; E966-T970 WeakPolarHBondContact O-CB 3.38Å; E966-T970 PolarHBondContact O-N 2.95Å; E966-T970 PolarHBondContact O-OG1 3.31Å; L967-T970 WeakPolarHBondContact O-CB 3.16Å; L967-T970 PolarHBondContact O-N 2.91Å; S968-T970 VanDerWaalsContact C-N 3.31Å; S968-T970 PolarHBondContact O-N 3.03Å; T970-F972 VanDerWaalsContact C-N 3.34Å; T970-F972 PolarHBondContact O-N 3.46Å; T970-T973 PolarHBondContact O-N 3.48Å; T970-M974 WeakPolarHBondContact O-CB 3.36Å; T970-M974 PolarHBondContact O-N 3.2Å
971	Y	96.4	Very high	92.8	Very high	18 Å²	18	26.4 Å²	26.4	7%	0.071	13%	0.132	C	C	.	.	H	α-helix	trans	-60.5	-43.6	175.4	-80.7	-62.2	0	0	0	112.1	I940 L967 S968 M974 A975 A999 K1002 Y1006	I940-Y971 HydrophobicContact CD1-CD1 3.74Å; I940-Y971 HydrophobicContact CD1-CE1 3.38Å; I940-Y971 HydrophobicContact CD1-CG 4.45Å; I940-Y971 HydrophobicContact CG1-CD1 4.41Å; I940-Y971 HydrophobicContact CG1-CE1 4.01Å; I940-Y971 HydrophobicContact CG1-CE2 4.34Å; I940-Y971 HydrophobicContact CG2-CE1 4.31Å; I940-Y971 HydrophobicContact CG2-CE2 4.33Å; I940-Y971 WeakPolarHBondContact CG2-OH 3.47Å; L967-Y971 HydrophobicContact CD1-CD2 3.88Å; L967-Y971 HydrophobicContact CD1-CE2 3.48Å; L967-Y971 VanDerWaalsContact CD1-CE2 3.48Å; L967-Y971 HydrophobicContact CG-CD2 4.09Å; L967-Y971 HydrophobicContact CG-CE2 3.88Å; L967-Y971 WeakPolarHBondContact O-CD2 3.37Å; L967-Y971 PolarHBondContact O-N 3.3Å; L967-Y971 VanDerWaalsContact O-N 3.08Å; S968-Y971 PolarHBondContact O-N 2.91Å; Y971-M974 HydrophobicContact CD1-CE 4.27Å; Y971-A975 VanDerWaalsContact O-CB 3.24Å; Y971-A975 WeakPolarHBondContact O-CB 3.4Å; Y971-A975 PolarHBondContact O-N 3Å; Y971-A999 HydrophobicContact CD1-CB 4.41Å; Y971-K1002 HydrophobicContact CD1-CB 4.04Å; Y971-K1002 HydrophobicContact CD1-CD 4.35Å; Y971-K1002 HydrophobicContact CD2-CB 4.04Å; Y971-K1002 HydrophobicContact CE1-CB 4.04Å; Y971-K1002 HydrophobicContact CE1-CD 3.68Å; Y971-K1002 HydrophobicContact CE1-CG 4.5Å; Y971-K1002 HydrophobicContact CE2-CB 4.01Å; Y971-K1002 HydrophobicContact CG-CB 4.05Å; Y971-Y1006 HydrophobicContact CD2-CD2 4.16Å; Y971-Y1006 HydrophobicContact CD2-CE2 4.42Å; Y971-Y1006 AromaticContact CE2-CD2 3.97Å; Y971-Y1006 HydrophobicContact CE2-CD2 3.97Å; Y971-Y1006 AromaticContact CE2-CE2 3.79Å; Y971-Y1006 HydrophobicContact CE2-CE2 3.79Å
972	F	95.8	Very high	92.9	Very high	38 Å²	38	25.5 Å²	25.5	17%	0.167	13%	0.13	C	C	.	.	H	α-helix	trans	-62.2	-46.8	179.7	178.3	-113.7	0	0	0	112.2	S968 T969 T970 A975 T976 M1000 S1003 R1022 T1025 I1026	S968-F972 WeakPolarHBondContact O-CB 3.31Å; S968-F972 PolarHBondContact O-N 3.28Å; T969-F972 PolarHBondContact O-N 3.34Å; T970-F972 VanDerWaalsContact C-N 3.34Å; T970-F972 PolarHBondContact O-N 3.46Å; F972-A975 PolarHBondContact O-N 2.82Å; F972-T976 WeakPolarHBondContact O-CB 3.35Å; F972-T976 PolarHBondContact O-N 3.49Å; F972-T976 PolarHBondContact O-OG1 2.85Å; F972-M1000 HydrophobicContact CD2-CE 4.29Å; F972-M1000 HydrophobicContact CD2-SD 3.91Å; F972-M1000 HydrophobicContact CE2-CE 4.32Å; F972-M1000 HydrophobicContact CE2-SD 4.31Å; F972-S1003 WeakPolarHBondContact CB-OG 3.48Å; F972-R1022 HydrophobicContact CD1-CG 4.44Å; F972-R1022 HydrophobicContact CD2-CG 4.3Å; F972-R1022 HydrophobicContact CG-CG 4.2Å; F972-T1025 HydrophobicContact CE2-CG2 4.21Å; F972-T1025 HydrophobicContact CZ-CG2 3.85Å; F972-I1026 HydrophobicContact CD2-CD1 3.91Å; F972-I1026 HydrophobicContact CD2-CG1 3.42Å; F972-I1026 VanDerWaalsContact CD2-CG1 3.42Å; F972-I1026 HydrophobicContact CE2-CG1 3.62Å
973	T	94.6	Very high	92.8	Very high	32 Å²	32	24.3 Å²	24.3	20%	0.196	12%	0.122	C	C	.	.	H	α-helix	trans	-64.6	-47	-179.5	-53.4	0	0	0	0	110.4	Y936 T969 T970 A975 T976 L977	Y936-T973 HydrophobicContact CE1-CG2 4.36Å; Y936-T973 WeakPolarHBondContact OH-CG2 3.34Å; T969-T973 WeakPolarHBondContact O-CB 3.34Å; T969-T973 PolarHBondContact O-N 3.23Å; T969-T973 PolarHBondContact O-OG1 2.74Å; T970-T973 PolarHBondContact O-N 3.48Å; T973-A975 PolarHBondContact O-N 3.4Å; T973-T976 PolarHBondContact O-N 3.24Å; T973-L977 HydrophobicContact CG2-CD1 4.08Å; T973-L977 VanDerWaalsContact O-CG 3.31Å; T973-L977 WeakPolarHBondContact O-CG 3.5Å; T973-L977 PolarHBondContact O-N 3Å
974	M	94.5	Very high	92.6	Very high	10 Å²	10	28.8 Å²	28.8	5%	0.049	15%	0.145	C	C	.	.	H	α-helix	trans	-60.7	-46.9	178.3	-175.7	179.9	70.1	0	0	111.5	F928 Y936 I940 T970 Y971 T976 L977 Q978 A999	F928-M974 HydrophobicContact CZ-CG 4.04Å; Y936-M974 VanDerWaalsContact CB-SD 3.56Å; Y936-M974 HydrophobicContact CD1-CB 4.39Å; Y936-M974 HydrophobicContact CD2-CB 4.2Å; Y936-M974 HydrophobicContact CD2-CG 4.12Å; Y936-M974 HydrophobicContact CG-CB 4.03Å; Y936-M974 HydrophobicContact CG-CG 4.15Å; Y936-M974 HydrophobicContact CG-SD 4.33Å; I940-M974 HydrophobicContact CD1-CE 4.04Å; I940-M974 HydrophobicContact CD1-SD 4.45Å; T970-M974 WeakPolarHBondContact O-CB 3.36Å; T970-M974 PolarHBondContact O-N 3.2Å; Y971-M974 HydrophobicContact CD1-CE 4.27Å; M974-T976 VanDerWaalsContact C-N 3.35Å; M974-T976 PolarHBondContact O-N 3.33Å; M974-L977 PolarHBondContact O-N 3.03Å; M974-Q978 WeakPolarHBondContact O-CB 3.5Å; M974-Q978 VanDerWaalsContact O-CG 3.29Å; M974-Q978 WeakPolarHBondContact O-CG 3.42Å; M974-Q978 PolarHBondContact O-N 3.4Å; M974-A999 HydrophobicContact CE-CB 4.21Å
975	A	94.5	Very high	92.3	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-65	-39.1	179.6	0	0	0	0	0	112.4	Y971 F972 T973 Q978 Q979 V996 A999 M1000	Y971-A975 VanDerWaalsContact O-CB 3.24Å; Y971-A975 WeakPolarHBondContact O-CB 3.4Å; Y971-A975 PolarHBondContact O-N 3Å; F972-A975 PolarHBondContact O-N 2.82Å; T973-A975 PolarHBondContact O-N 3.4Å; A975-Q978 PolarHBondContact O-N 3.4Å; A975-Q979 VanDerWaalsContact O-CB 3.29Å; A975-Q979 WeakPolarHBondContact O-CB 3.34Å; A975-Q979 PolarHBondContact O-N 2.88Å; A975-V996 HydrophobicContact CB-CG1 4.47Å; A975-A999 HydrophobicContact CB-CB 3.76Å; A975-M1000 HydrophobicContact CB-CE 3.64Å; A975-M1000 HydrophobicContact CB-CG 3.79Å; A975-M1000 HydrophobicContact CB-SD 3.78Å
976	T	93.4	Very high	92.1	Very high	22 Å²	22	36.4 Å²	36.4	14%	0.135	19%	0.185	C	C	.	.	H	α-helix	trans	-60.9	-49.6	174.7	-69.8	0	0	0	0	111.2	F972 T973 M974 Q978 Q979 D980 R1029	F972-T976 WeakPolarHBondContact O-CB 3.35Å; F972-T976 PolarHBondContact O-N 3.49Å; F972-T976 PolarHBondContact O-OG1 2.85Å; T973-T976 PolarHBondContact O-N 3.24Å; M974-T976 VanDerWaalsContact C-N 3.35Å; M974-T976 PolarHBondContact O-N 3.33Å; T976-Q978 PolarHBondContact O-N 3.26Å; T976-Q979 PolarHBondContact O-N 2.97Å; T976-Q979 VanDerWaalsContact O-N 3.15Å; T976-D980 WeakPolarHBondContact CG2-OD2 3.4Å; T976-D980 WeakPolarHBondContact O-CB 3.2Å; T976-D980 PolarHBondContact O-N 3.33Å; T976-R1029 PolarHBondContact O-NH2 3.39Å
977	L	91.6	Very high	91.9	Very high	26 Å²	26	38.2 Å²	38.2	14%	0.136	19%	0.193	C	C	.	.	H	α-helix	trans	-64	-39.7	178.4	-69.7	172.7	0	0	0	112.3	F928 Y936 T973 M974 Q979 Y981	F928-L977 HydrophobicContact CD2-CB 3.74Å; F928-L977 HydrophobicContact CE2-CB 3.93Å; F928-L977 HydrophobicContact CE2-CD1 4.31Å; Y936-L977 HydrophobicContact CE2-CD1 3.83Å; Y936-L977 WeakPolarHBondContact OH-CD1 3.27Å; T973-L977 HydrophobicContact CG2-CD1 4.08Å; T973-L977 VanDerWaalsContact O-CG 3.31Å; T973-L977 WeakPolarHBondContact O-CG 3.5Å; T973-L977 PolarHBondContact O-N 3Å; M974-L977 PolarHBondContact O-N 3.03Å; L977-Q979 VanDerWaalsContact C-N 3.28Å; L977-Q979 PolarHBondContact O-N 3.08Å; L977-Y981 HydrophobicContact CD2-CD2 4.03Å; L977-Y981 HydrophobicContact CD2-CE2 4.04Å; L977-Y981 WeakPolarHBondContact O-CA 3.39Å; L977-Y981 WeakPolarHBondContact O-CB 3.25Å; L977-Y981 PolarHBondContact O-N 3.43Å
978	Q	90.4	Very high	91.6	Very high	20 Å²	20	41.5 Å²	41.5	9%	0.093	22%	0.22	C	C	.	.	H	α-helix	trans	-65.1	-31.6	174.6	-76.4	179	-30.2	0	0	112.9	F928 M974 A975 T976 A982 V996	F928-Q978 HydrophobicContact CD1-CG 3.6Å; F928-Q978 HydrophobicContact CD2-CG 4.37Å; F928-Q978 HydrophobicContact CE1-CG 3.65Å; F928-Q978 HydrophobicContact CE2-CG 4.41Å; F928-Q978 HydrophobicContact CG-CG 3.97Å; F928-Q978 HydrophobicContact CZ-CG 4.06Å; M974-Q978 WeakPolarHBondContact O-CB 3.5Å; M974-Q978 VanDerWaalsContact O-CG 3.29Å; M974-Q978 WeakPolarHBondContact O-CG 3.42Å; M974-Q978 PolarHBondContact O-N 3.4Å; A975-Q978 PolarHBondContact O-N 3.4Å; T976-Q978 PolarHBondContact O-N 3.26Å; Q978-A982 VanDerWaalsContact O-CA 3.24Å; Q978-A982 WeakPolarHBondContact O-CA 3.32Å; Q978-A982 PolarHBondContact O-N 2.99Å; Q978-V996 HydrophobicContact CB-CG2 3.76Å
979	Q	92	Very high	91.2	Very high	47 Å²	47	45.7 Å²	45.7	22%	0.22	24%	0.239	C	C	.	.	H	α-helix	trans	-78.8	-44.2	178.3	-171.3	179	25.5	0	0	112.1	A975 T976 L977 V996 R1029	A975-Q979 VanDerWaalsContact O-CB 3.29Å; A975-Q979 WeakPolarHBondContact O-CB 3.34Å; A975-Q979 PolarHBondContact O-N 2.88Å; T976-Q979 PolarHBondContact O-N 2.97Å; T976-Q979 VanDerWaalsContact O-N 3.15Å; L977-Q979 VanDerWaalsContact C-N 3.28Å; L977-Q979 PolarHBondContact O-N 3.08Å; Q979-V996 HydrophobicContact CB-CG1 4.07Å; Q979-V996 HydrophobicContact CB-CG2 4.15Å; Q979-V996 HydrophobicContact CG-CG1 4.4Å; Q979-R1029 PolarHBondContact NE2-O 2.98Å
980	D	90.1	Very high	90.9	Very high	90 Å²	90	51.7 Å²	51.7	48%	0.481	27%	0.266	S	S	.	.	H	α-helix	trans	-79.1	-33.8	-175.7	-65.3	-22.8	0	0	0	112.1	T976 R1029	T976-D980 WeakPolarHBondContact CG2-OD2 3.4Å; T976-D980 WeakPolarHBondContact O-CB 3.2Å; T976-D980 PolarHBondContact O-N 3.33Å; D980-R1029 IonicContact OD1-CZ 3.74Å; D980-R1029 IonicContact OD1-NH2 3.92Å; D980-R1029 PolarHBondContact OD1-NH2 3.38Å; D980-R1029 IonicContact OD2-CZ 2.7Å; D980-R1029 IonicContact OD2-NH1 3Å; D980-R1029 PolarHBondContact OD2-NH1 3.28Å; D980-R1029 IonicContact OD2-NH2 3.07Å; D980-R1029 PolarHBondContact OD2-NH2 2.98Å
981	Y	89.7	Confident	90.6	Very high	58 Å²	58	55.9 Å²	55.9	23%	0.227	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.5	53.3	179.6	-53.4	-73.6	0	0	0	110.5	R926 E927 F928 L977	R926-Y981 HydrophobicContact CB-CD1 3.79Å; R926-Y981 HydrophobicContact CB-CE1 4.14Å; R926-Y981 HydrophobicContact CG-CD1 3.77Å; R926-Y981 HydrophobicContact CG-CE1 4.23Å; R926-Y981 HydrophobicContact CG-CG 4.13Å; R926-Y981 VanDerWaalsContact NH1-CZ 3.26Å; R926-Y981 PolarHBondContact NH1-OH 3.38Å; E927-Y981 CarbonylContact C-O 3.48Å; F928-Y981 WeakPolarHBondContact CB-O 3.4Å; F928-Y981 PolarHBondContact N-O 2.54Å; L977-Y981 HydrophobicContact CD2-CD2 4.03Å; L977-Y981 HydrophobicContact CD2-CE2 4.04Å; L977-Y981 WeakPolarHBondContact O-CA 3.39Å; L977-Y981 WeakPolarHBondContact O-CB 3.25Å; L977-Y981 PolarHBondContact O-N 3.43Å
982	A	89.1	Confident	90.3	Very high	19 Å²	19	55.2 Å²	55.2	16%	0.157	28%	0.284	C	S	.	.			trans	-54.7	125.7	-176.8	0	0	0	0	0	112.2	Q978 L984 I992	Q978-A982 VanDerWaalsContact O-CA 3.24Å; Q978-A982 WeakPolarHBondContact O-CA 3.32Å; Q978-A982 PolarHBondContact O-N 2.99Å; A982-L984 HydrophobicContact CB-CD2 4.09Å; A982-L984 HydrophobicContact CB-CG 4.07Å; A982-L984 PolarHBondContact O-N 2.94Å; A982-I992 HydrophobicContact CB-CD1 4.23Å; A982-I992 HydrophobicContact CB-CG2 4.21Å
983	P	88.3	Confident	90	Very high	9 Å²	9	55 Å²	55	6%	0.058	28%	0.283	C	S	.	.			trans	-80.1	64.5	-177.4	33.1	-36.1	0	0	0	112.1	E927 S985 R986 K987 I992	E927-P983 HydrophobicContact CB-CB 4.35Å; P983-S985 PolarHBondContact O-N 3.27Å; P983-R986 PolarHBondContact O-N 3.33Å; P983-K987 PolarHBondContact O-N 3.25Å; P983-I992 HydrophobicContact CG-CD1 4.23Å; P983-I992 HydrophobicContact CG-CG1 4.44Å
984	L	87.8	Confident	89.8	Confident	96 Å²	96	59.1 Å²	59.1	50%	0.503	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-21.1	-174.8	-59.3	176.6	0	0	0	113	E927 A982 R986 Q989 I992	E927-L984 PolarHBondContact OE1-N 2.94Å; A982-L984 HydrophobicContact CB-CD2 4.09Å; A982-L984 HydrophobicContact CB-CG 4.07Å; A982-L984 PolarHBondContact O-N 2.94Å; L984-R986 PolarHBondContact O-N 3.36Å; L984-Q989 HydrophobicContact CD2-CB 4.33Å; L984-I992 HydrophobicContact CD2-CD1 3.7Å
985	S	85.8	Confident	89.7	Confident	86 Å²	86	60.8 Å²	60.8	60%	0.601	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-22.5	171.5	72.1	0	0	0	0	113.9	E927 P983	E927-S985 VanDerWaalsContact OE1-CB 3.31Å; E927-S985 WeakPolarHBondContact OE1-CB 3.41Å; E927-S985 PolarHBondContact OE1-N 3.49Å; E927-S985 PolarHBondContact OE1-OG 2.89Å; E927-S985 WeakPolarHBondContact OE2-CB 3.5Å; E927-S985 PolarHBondContact OE2-OG 3.5Å; P983-S985 PolarHBondContact O-N 3.27Å
986	R	87.1	Confident	89.7	Confident	137 Å²	137	60.8 Å²	60.8	52%	0.517	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.6	-27.7	-172.3	-68.7	177.5	-65.6	-151.1	0.8	114.5	F928 P983 L984	F928-R986 PolarHBondContact O-NH2 3.4Å; P983-R986 PolarHBondContact O-N 3.33Å; L984-R986 PolarHBondContact O-N 3.36Å
987	K	89.5	Confident	89.7	Confident	81 Å²	81	60.6 Å²	60.6	35%	0.352	31%	0.306	S	S	.	.	S	Bend	trans	-127.3	144.8	-176.6	-65.4	-169.1	-180	-166.3	0	110.9	P983 I992 E995	P983-K987 PolarHBondContact O-N 3.25Å; K987-I992 HydrophobicContact CB-CD1 3.81Å; K987-I992 HydrophobicContact CB-CG1 3.76Å; K987-I992 HydrophobicContact CD-CG1 4.28Å; K987-E995 IonicContact NZ-OE1 2.79Å; K987-E995 PolarHBondContact NZ-OE1 3.19Å; K987-E995 IonicContact NZ-OE2 2.66Å; K987-E995 PolarHBondContact NZ-OE2 2.97Å
988	A	88.8	Confident	89.8	Confident	68 Å²	68	63.7 Å²	63.7	56%	0.562	32%	0.319	S	S	*	.			trans	-66	144.7	170.9	0	0	0	0	0	110.7	E990 Q991 I992	A988-E990 VanDerWaalsContact C-N 3.29Å; A988-E990 PolarHBondContact O-N 3.47Å; A988-Q991 WeakPolarHBondContact O-CB 3.31Å; A988-Q991 PolarHBondContact O-N 3.25Å; A988-Q991 VanDerWaalsContact O-N 3.08Å; A988-I992 PolarHBondContact O-N 2.93Å; A988-I992 VanDerWaalsContact O-N 3.15Å
989	Q	87	Confident	90	Very high	89 Å²	89	63 Å²	63	42%	0.416	32%	0.317	S	S	.	.	H	α-helix	trans	-51.6	-46	178.9	179.4	65.5	23.8	0	0	112.1	L984 Q991 I992 E993	L984-Q989 HydrophobicContact CD2-CB 4.33Å; Q989-Q991 VanDerWaalsContact C-N 3.3Å; Q989-Q991 PolarHBondContact O-N 3.43Å; Q989-I992 PolarHBondContact O-N 2.9Å; Q989-I992 VanDerWaalsContact O-N 3.15Å; Q989-E993 HydrophobicContact CG-CG 4.43Å; Q989-E993 WeakPolarHBondContact CG-OE1 3.32Å; Q989-E993 PolarHBondContact NE2-OE1 3.35Å; Q989-E993 WeakPolarHBondContact O-CG 3.37Å; Q989-E993 PolarHBondContact O-N 2.69Å
990	E	86.2	Confident	90.2	Very high	139 Å²	139	60.8 Å²	60.8	65%	0.65	31%	0.307	S	S	*	.	H	α-helix	trans	-61.3	-37.5	-179.5	-62.9	-179.8	172.1	0	0	112.7	A988 K994	A988-E990 VanDerWaalsContact C-N 3.29Å; A988-E990 PolarHBondContact O-N 3.47Å; E990-K994 WeakPolarHBondContact O-CB 3.27Å; E990-K994 PolarHBondContact O-N 3.45Å
991	Q	89.4	Confident	90.4	Very high	88 Å²	88	61 Å²	61	41%	0.411	31%	0.306	S	S	.	.	H	α-helix	trans	-69.4	-38.5	177.8	-179.7	58.8	32.9	0	0	111.1	A988 Q989 K994 E995	A988-Q991 WeakPolarHBondContact O-CB 3.31Å; A988-Q991 PolarHBondContact O-N 3.25Å; A988-Q991 VanDerWaalsContact O-N 3.08Å; Q989-Q991 VanDerWaalsContact C-N 3.3Å; Q989-Q991 PolarHBondContact O-N 3.43Å; Q991-K994 PolarHBondContact O-N 3.14Å; Q991-E995 PolarHBondContact NE2-OE1 2.89Å; Q991-E995 WeakPolarHBondContact O-CG 3.01Å; Q991-E995 PolarHBondContact O-N 3.04Å
992	I	89.8	Confident	90.6	Very high	5 Å²	5	62.7 Å²	62.7	3%	0.026	31%	0.314	C	S	.	.	H	α-helix	trans	-65.8	-46.4	175.7	-66.8	155.9	0	0	0	110.3	A982 P983 L984 K987 A988 Q989 K994 E995 V996	A982-I992 HydrophobicContact CB-CD1 4.23Å; A982-I992 HydrophobicContact CB-CG2 4.21Å; P983-I992 HydrophobicContact CG-CD1 4.23Å; P983-I992 HydrophobicContact CG-CG1 4.44Å; L984-I992 HydrophobicContact CD2-CD1 3.7Å; K987-I992 HydrophobicContact CB-CD1 3.81Å; K987-I992 HydrophobicContact CB-CG1 3.76Å; K987-I992 HydrophobicContact CD-CG1 4.28Å; A988-I992 PolarHBondContact O-N 2.93Å; A988-I992 VanDerWaalsContact O-N 3.15Å; Q989-I992 PolarHBondContact O-N 2.9Å; Q989-I992 VanDerWaalsContact O-N 3.15Å; I992-K994 VanDerWaalsContact C-N 3.27Å; I992-K994 PolarHBondContact O-N 3.38Å; I992-E995 PolarHBondContact O-N 3.47Å; I992-V996 HydrophobicContact CG2-CG2 4.17Å; I992-V996 WeakPolarHBondContact O-CB 3.5Å; I992-V996 VanDerWaalsContact O-CG2 3.29Å; I992-V996 WeakPolarHBondContact O-CG2 3.27Å; I992-V996 PolarHBondContact O-N 3.11Å
993	E	90.3	Very high	90.9	Very high	32 Å²	32	61.8 Å²	61.8	15%	0.15	31%	0.307	C	S	.	.	H	α-helix	trans	-59.4	-38.6	178	-71.1	171.9	176.4	0	0	112.2	Q989 S997 M1033 C1037	Q989-E993 HydrophobicContact CG-CG 4.43Å; Q989-E993 WeakPolarHBondContact CG-OE1 3.32Å; Q989-E993 PolarHBondContact NE2-OE1 3.35Å; Q989-E993 WeakPolarHBondContact O-CG 3.37Å; Q989-E993 PolarHBondContact O-N 2.69Å; E993-S997 VanDerWaalsContact O-CB 3.32Å; E993-S997 WeakPolarHBondContact O-CB 3.11Å; E993-S997 PolarHBondContact O-N 3.18Å; E993-M1033 HydrophobicContact CB-CE 4.36Å; E993-M1033 HydrophobicContact CB-SD 4.03Å; E993-M1033 HydrophobicContact CG-CG 4.24Å; E993-M1033 HydrophobicContact CG-SD 4Å; E993-C1037 PolarHBondContact OE1-SG 3.43Å; E993-C1037 PolarHBondContact OE2-SG 3.49Å
994	K	90.8	Very high	91.2	Very high	120 Å²	120	62.7 Å²	62.7	52%	0.522	31%	0.311	S	S	.	.	H	α-helix	trans	-64.7	-49.1	173.8	-175	179.5	175.1	-176.4	0	112	E990 Q991 I992 V996 S997 E998	E990-K994 WeakPolarHBondContact O-CB 3.27Å; E990-K994 PolarHBondContact O-N 3.45Å; Q991-K994 PolarHBondContact O-N 3.14Å; I992-K994 VanDerWaalsContact C-N 3.27Å; I992-K994 PolarHBondContact O-N 3.38Å; K994-V996 PolarHBondContact O-N 3.43Å; K994-S997 PolarHBondContact O-N 2.65Å; K994-E998 WeakPolarHBondContact CE-OE1 3.28Å; K994-E998 WeakPolarHBondContact O-CG 3.33Å; K994-E998 PolarHBondContact O-N 3.25Å
995	E	92.2	Very high	91.4	Very high	44 Å²	44	65.6 Å²	65.6	21%	0.206	32%	0.32	C	S	.	.	H	α-helix	trans	-61.1	-43.4	178.6	-74	174.5	-162.6	0	0	112	K987 Q991 I992 E998 A999	K987-E995 IonicContact NZ-OE1 2.79Å; K987-E995 PolarHBondContact NZ-OE1 3.19Å; K987-E995 IonicContact NZ-OE2 2.66Å; K987-E995 PolarHBondContact NZ-OE2 2.97Å; Q991-E995 PolarHBondContact NE2-OE1 2.89Å; Q991-E995 WeakPolarHBondContact O-CG 3.01Å; Q991-E995 PolarHBondContact O-N 3.04Å; I992-E995 PolarHBondContact O-N 3.47Å; E995-E998 PolarHBondContact O-N 2.96Å; E995-A999 WeakPolarHBondContact O-CB 3.4Å; E995-A999 PolarHBondContact O-N 3Å
996	V	94.4	Very high	91.5	Very high	1 Å²	1	63.6 Å²	63.6	1%	0.006	30%	0.3	C	S	.	.	H	α-helix	trans	-61.3	-46.3	175	169.3	0	0	0	0	110.4	A975 Q978 Q979 I992 K994 E998 A999 M1000 M1033	A975-V996 HydrophobicContact CB-CG1 4.47Å; Q978-V996 HydrophobicContact CB-CG2 3.76Å; Q979-V996 HydrophobicContact CB-CG1 4.07Å; Q979-V996 HydrophobicContact CB-CG2 4.15Å; Q979-V996 HydrophobicContact CG-CG1 4.4Å; I992-V996 HydrophobicContact CG2-CG2 4.17Å; I992-V996 WeakPolarHBondContact O-CB 3.5Å; I992-V996 VanDerWaalsContact O-CG2 3.29Å; I992-V996 WeakPolarHBondContact O-CG2 3.27Å; I992-V996 PolarHBondContact O-N 3.11Å; K994-V996 PolarHBondContact O-N 3.43Å; V996-E998 PolarHBondContact O-N 3.01Å; V996-A999 PolarHBondContact O-N 3.23Å; V996-M1000 HydrophobicContact CG1-CG 4.16Å; V996-M1000 VanDerWaalsContact O-CB 3.28Å; V996-M1000 WeakPolarHBondContact O-CB 3.33Å; V996-M1000 WeakPolarHBondContact O-CG 3.37Å; V996-M1000 PolarHBondContact O-N 3.41Å; V996-M1033 HydrophobicContact CG1-SD 4.17Å
997	S	92.9	Very high	91.5	Very high	18 Å²	18	57.5 Å²	57.5	13%	0.126	28%	0.278	C	S	.	.	H	α-helix	trans	-60.7	-46.5	178.1	-174.4	0	0	0	0	112.2	E993 K994 A999 M1000 M1001 Y1034	E993-S997 VanDerWaalsContact O-CB 3.32Å; E993-S997 WeakPolarHBondContact O-CB 3.11Å; E993-S997 PolarHBondContact O-N 3.18Å; K994-S997 PolarHBondContact O-N 2.65Å; S997-A999 PolarHBondContact O-N 3.18Å; S997-M1000 PolarHBondContact O-N 2.66Å; S997-M1001 WeakPolarHBondContact O-CB 3.28Å; S997-M1001 VanDerWaalsContact O-CG 3.27Å; S997-M1001 WeakPolarHBondContact O-CG 3.32Å; S997-M1001 PolarHBondContact O-N 3.33Å; S997-Y1034 PolarHBondContact OG-OH 3.06Å
998	E	94.6	Very high	91.2	Very high	90 Å²	90	56.7 Å²	56.7	42%	0.421	28%	0.277	S	S	.	.	H	α-helix	trans	-61.6	-43.7	177.3	-73	178.3	-166.5	0	0	112.2	K994 E995 V996 M1001 K1002	K994-E998 WeakPolarHBondContact CE-OE1 3.28Å; K994-E998 WeakPolarHBondContact O-CG 3.33Å; K994-E998 PolarHBondContact O-N 3.25Å; E995-E998 PolarHBondContact O-N 2.96Å; V996-E998 PolarHBondContact O-N 3.01Å; E998-M1001 PolarHBondContact O-N 3.38Å; E998-K1002 VanDerWaalsContact O-CG 3.31Å; E998-K1002 WeakPolarHBondContact O-CG 3.36Å; E998-K1002 PolarHBondContact O-N 3.44Å
999	A	94.3	Very high	90.7	Very high	6 Å²	6	54.8 Å²	54.8	5%	0.05	26%	0.258	C	S	.	.	H	α-helix	trans	-67.8	-42.1	178.4	0	0	0	0	0	112.2	Y971 M974 A975 E995 V996 S997 K1002 S1003	Y971-A999 HydrophobicContact CD1-CB 4.41Å; M974-A999 HydrophobicContact CE-CB 4.21Å; A975-A999 HydrophobicContact CB-CB 3.76Å; E995-A999 WeakPolarHBondContact O-CB 3.4Å; E995-A999 PolarHBondContact O-N 3Å; V996-A999 PolarHBondContact O-N 3.23Å; S997-A999 PolarHBondContact O-N 3.18Å; A999-K1002 PolarHBondContact O-N 3.48Å; A999-S1003 PolarHBondContact O-N 3.25Å
1000	M	95.4	Very high	90.2	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-61.8	-42.5	174.5	-76.3	-61.2	-175.2	0	0	112	F972 A975 V996 S997 S1003 L1004 I1026 L1030	F972-M1000 HydrophobicContact CD2-CE 4.29Å; F972-M1000 HydrophobicContact CD2-SD 3.91Å; F972-M1000 HydrophobicContact CE2-CE 4.32Å; F972-M1000 HydrophobicContact CE2-SD 4.31Å; A975-M1000 HydrophobicContact CB-CE 3.64Å; A975-M1000 HydrophobicContact CB-CG 3.79Å; A975-M1000 HydrophobicContact CB-SD 3.78Å; V996-M1000 HydrophobicContact CG1-CG 4.16Å; V996-M1000 VanDerWaalsContact O-CB 3.28Å; V996-M1000 WeakPolarHBondContact O-CB 3.33Å; V996-M1000 WeakPolarHBondContact O-CG 3.37Å; V996-M1000 PolarHBondContact O-N 3.41Å; S997-M1000 PolarHBondContact O-N 2.66Å; M1000-S1003 WeakPolarHBondContact O-CB 3.44Å; M1000-S1003 PolarHBondContact O-N 3Å; M1000-L1004 PolarHBondContact O-N 3.46Å; M1000-I1026 HydrophobicContact CB-CG2 3.73Å; M1000-I1026 HydrophobicContact CG-CG2 4.18Å; M1000-I1026 HydrophobicContact SD-CB 4.29Å; M1000-I1026 HydrophobicContact SD-CG1 3.84Å; M1000-I1026 HydrophobicContact SD-CG2 3.85Å; M1000-L1030 HydrophobicContact CB-CD1 4.05Å; M1000-L1030 HydrophobicContact CB-CD2 3.94Å; M1000-L1030 HydrophobicContact CB-CG 4.12Å; M1000-L1030 HydrophobicContact CG-CD2 4.14Å; M1000-L1030 HydrophobicContact CG-CG 4.37Å
1001	M	94.9	Very high	89.7	Confident	94 Å²	94	52.5 Å²	52.5	46%	0.463	26%	0.256	S	S	.	.	H	α-helix	trans	-66.3	-37.4	175.5	-72.3	-61.2	-62.3	0	0	112.3	S997 E998 L1004 K1005 L1030	S997-M1001 WeakPolarHBondContact O-CB 3.28Å; S997-M1001 VanDerWaalsContact O-CG 3.27Å; S997-M1001 WeakPolarHBondContact O-CG 3.32Å; S997-M1001 PolarHBondContact O-N 3.33Å; E998-M1001 PolarHBondContact O-N 3.38Å; M1001-L1004 PolarHBondContact O-N 3.08Å; M1001-L1004 HydrophobicContact SD-CD1 3.95Å; M1001-K1005 PolarHBondContact O-N 2.85Å; M1001-L1030 HydrophobicContact SD-CD1 4.38Å
1002	K	95	Very high	88.9	Confident	93 Å²	93	56.7 Å²	56.7	40%	0.404	28%	0.278	S	S	.	.	H	α-helix	trans	-64.5	-39.3	171.2	-73.9	172.6	-174.8	171.7	0	111.7	Y971 E998 A999 L1004 K1005 Y1006	Y971-K1002 HydrophobicContact CD1-CB 4.04Å; Y971-K1002 HydrophobicContact CD1-CD 4.35Å; Y971-K1002 HydrophobicContact CD2-CB 4.04Å; Y971-K1002 HydrophobicContact CE1-CB 4.04Å; Y971-K1002 HydrophobicContact CE1-CD 3.68Å; Y971-K1002 HydrophobicContact CE1-CG 4.5Å; Y971-K1002 HydrophobicContact CE2-CB 4.01Å; Y971-K1002 HydrophobicContact CG-CB 4.05Å; E998-K1002 VanDerWaalsContact O-CG 3.31Å; E998-K1002 WeakPolarHBondContact O-CG 3.36Å; E998-K1002 PolarHBondContact O-N 3.44Å; A999-K1002 PolarHBondContact O-N 3.48Å; K1002-L1004 VanDerWaalsContact C-N 3.33Å; K1002-L1004 PolarHBondContact O-N 3.27Å; K1002-K1005 WeakPolarHBondContact O-CB 3.38Å; K1002-K1005 PolarHBondContact O-N 3.37Å; K1002-Y1006 WeakPolarHBondContact O-CD2 3.5Å; K1002-Y1006 PolarHBondContact O-N 2.95Å
1003	S	95	Very high	88.2	Confident	0 Å²	0	59 Å²	59	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-60.8	-42.4	175.2	-177	0	0	0	0	112.1	S968 F972 A999 M1000 Y1006 C1007 I1026	S968-S1003 PolarHBondContact O-OG 3.1Å; S968-S1003 PolarHBondContact OG-O 3.01Å; S968-S1003 PolarHBondContact OG-OG 3.48Å; F972-S1003 WeakPolarHBondContact CB-OG 3.48Å; A999-S1003 PolarHBondContact O-N 3.25Å; M1000-S1003 WeakPolarHBondContact O-CB 3.44Å; M1000-S1003 PolarHBondContact O-N 3Å; S1003-Y1006 PolarHBondContact O-N 2.97Å; S1003-C1007 WeakPolarHBondContact O-CB 3.47Å; S1003-C1007 PolarHBondContact O-N 3.49Å; S1003-I1026 WeakPolarHBondContact OG-CD1 3.26Å
1004	L	93.2	Very high	87.4	Confident	28 Å²	28	62.3 Å²	62.3	15%	0.147	33%	0.327	C	S	.	.	H	α-helix	trans	-62.9	-40.2	174.2	-74.6	169.7	0	0	0	112.5	M1000 M1001 K1002 Y1006 C1007 A1023 I1026 H1027	M1000-L1004 PolarHBondContact O-N 3.46Å; M1001-L1004 PolarHBondContact O-N 3.08Å; M1001-L1004 HydrophobicContact SD-CD1 3.95Å; K1002-L1004 VanDerWaalsContact C-N 3.33Å; K1002-L1004 PolarHBondContact O-N 3.27Å; L1004-Y1006 PolarHBondContact O-N 3.21Å; L1004-C1007 PolarHBondContact O-N 3.38Å; L1004-C1007 VanDerWaalsContact O-N 3.08Å; L1004-A1023 HydrophobicContact CD2-CB 3.64Å; L1004-I1026 HydrophobicContact CD1-CG2 3.74Å; L1004-I1026 HydrophobicContact CD2-CB 4.17Å; L1004-I1026 HydrophobicContact CD2-CD1 3.98Å; L1004-I1026 HydrophobicContact CD2-CG2 4.21Å; L1004-I1026 HydrophobicContact CG-CB 4.27Å; L1004-I1026 HydrophobicContact CG-CD1 3.99Å; L1004-I1026 HydrophobicContact CG-CG2 3.78Å; L1004-H1027 WeakPolarHBondContact CD1-CE1 3.24Å
1005	K	92.1	Very high	86.9	Confident	157 Å²	157	60.8 Å²	60.8	68%	0.683	32%	0.319	S	S	*	.	H	α-helix	trans	-56.8	-37.9	178.3	-177.7	-172.3	174.1	-169.6	0	112.5	M1001 K1002	M1001-K1005 PolarHBondContact O-N 2.85Å; K1002-K1005 WeakPolarHBondContact O-CB 3.38Å; K1002-K1005 PolarHBondContact O-N 3.37Å
1006	Y	88.8	Confident	86.5	Confident	45 Å²	45	60.4 Å²	60.4	18%	0.176	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	5.3	-179.4	-60.7	-66.4	0	0	0	113.2	L947 N964 L967 Y971 K1002 S1003 L1004	L947-Y1006 HydrophobicContact CD1-CE1 4.26Å; N964-Y1006 VanDerWaalsContact OD1-CD1 3.28Å; N964-Y1006 WeakPolarHBondContact OD1-CD1 3.22Å; L967-Y1006 HydrophobicContact CD2-CD1 3.86Å; L967-Y1006 HydrophobicContact CD2-CD2 3.66Å; L967-Y1006 HydrophobicContact CD2-CE1 3.82Å; L967-Y1006 HydrophobicContact CD2-CE2 3.62Å; L967-Y1006 HydrophobicContact CD2-CG 3.79Å; L967-Y1006 HydrophobicContact CG-CD2 3.81Å; L967-Y1006 HydrophobicContact CG-CE2 4.11Å; L967-Y1006 HydrophobicContact CG-CG 4.11Å; Y971-Y1006 HydrophobicContact CD2-CD2 4.16Å; Y971-Y1006 HydrophobicContact CD2-CE2 4.42Å; Y971-Y1006 AromaticContact CE2-CD2 3.97Å; Y971-Y1006 HydrophobicContact CE2-CD2 3.97Å; Y971-Y1006 AromaticContact CE2-CE2 3.79Å; Y971-Y1006 HydrophobicContact CE2-CE2 3.79Å; K1002-Y1006 WeakPolarHBondContact O-CD2 3.5Å; K1002-Y1006 PolarHBondContact O-N 2.95Å; S1003-Y1006 PolarHBondContact O-N 2.97Å; L1004-Y1006 PolarHBondContact O-N 3.21Å
1007	C	87.6	Confident	86	Confident	9 Å²	9	63.6 Å²	63.6	6%	0.061	34%	0.337	C	S	.	.			trans	-100.6	108.3	177.1	-166.4	0	0	0	0	108.7	S1003 L1004 V1009 C1019	S1003-C1007 WeakPolarHBondContact O-CB 3.47Å; S1003-C1007 PolarHBondContact O-N 3.49Å; L1004-C1007 PolarHBondContact O-N 3.38Å; L1004-C1007 VanDerWaalsContact O-N 3.08Å; C1007-V1009 PolarHBondContact O-N 2.9Å; C1007-C1019 WeakPolarHBondContact SG-CA 3.26Å; C1007-C1019 VanDerWaalsContact SG-CB 3.52Å; C1007-C1019 PolarHBondContact SG-O 3.44Å
1008	D	82	Confident	85.7	Confident	63 Å²	63	67.4 Å²	67.4	34%	0.337	36%	0.356	S	S	.	.			trans	-81.6	106	-180	-168.7	-10.8	0	0	0	110.7	D1010 S1011 C1019	D1008-D1010 PolarHBondContact OD1-N 2.71Å; D1008-D1010 VanDerWaalsContact OD1-N 3.16Å; D1008-S1011 VanDerWaalsContact CG-OG 3.31Å; D1008-S1011 PolarHBondContact OD1-N 3.03Å; D1008-S1011 PolarHBondContact OD1-OG 3.1Å; D1008-S1011 WeakPolarHBondContact OD2-CB 3.43Å; D1008-S1011 PolarHBondContact OD2-OG 2.97Å; D1008-C1019 WeakPolarHBondContact O-CB 3.45Å; D1008-C1019 PolarHBondContact O-SG 3.21Å; D1008-C1019 VanDerWaalsContact O-SG 3.35Å
1009	V	79	Confident	85.4	Confident	28 Å²	28	63.6 Å²	63.6	17%	0.17	34%	0.339	C	S	.	.	S	Bend	trans	-93.7	-22.6	-178	-176.7	0	0	0	0	111.5	C1007 Q1016 Q1020 A1023 L1065	C1007-V1009 PolarHBondContact O-N 2.9Å; V1009-Q1016 PolarHBondContact O-NE2 2.87Å; V1009-Q1020 HydrophobicContact CG1-CG 3.72Å; V1009-A1023 HydrophobicContact CG2-CB 3.73Å; V1009-L1065 HydrophobicContact CG1-CD2 3.87Å
1010	D	76.2	Confident	85.2	Confident	145 Å²	145	64.6 Å²	64.6	78%	0.775	34%	0.343	S	S	*	.	S	Bend	trans	-99.3	-35.4	-166	-63.4	-37.8	0	0	0	112.2	D1008	D1008-D1010 PolarHBondContact OD1-N 2.71Å; D1008-D1010 VanDerWaalsContact OD1-N 3.16Å
1011	S	76.7	Confident	85	Confident	35 Å²	35	69.3 Å²	69.3	25%	0.245	36%	0.361	C	S	.	.	S	Bend	trans	-70.7	133.5	178.4	-59.3	0	0	0	0	111.9	D1008 S1013 Q1016	D1008-S1011 VanDerWaalsContact CG-OG 3.31Å; D1008-S1011 PolarHBondContact OD1-N 3.03Å; D1008-S1011 PolarHBondContact OD1-OG 3.1Å; D1008-S1011 WeakPolarHBondContact OD2-CB 3.43Å; D1008-S1011 PolarHBondContact OD2-OG 2.97Å; S1011-S1013 PolarHBondContact O-N 3.48Å; S1011-Q1016 PolarHBondContact O-NE2 2.86Å
1012	M	72.3	Confident	84.9	Confident	176 Å²	176	66 Å²	66	87%	0.867	34%	0.344	S	S	*	.			trans	-71	111.5	172.1	-66.5	-146.8	163.4	0	0	110.3
1013	S	74.7	Confident	84.8	Confident	53 Å²	53	61.7 Å²	61.7	37%	0.371	33%	0.325	S	S	.	.			trans	-148.5	156.3	-178.9	173.3	0	0	0	0	109.6	S1011 R1015 Q1016	S1011-S1013 PolarHBondContact O-N 3.48Å; S1013-R1015 PolarHBondContact O-N 3.19Å; S1013-R1015 PolarHBondContact OG-N 3.47Å; S1013-Q1016 WeakPolarHBondContact O-CB 3.44Å; S1013-Q1016 PolarHBondContact O-N 2.95Å
1014	A	74.2	Confident	84.7	Confident	102 Å²	102	61.7 Å²	61.7	84%	0.843	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-25.6	173.3	0	0	0	0	0	112.8
1015	R	79.2	Confident	84.8	Confident	89 Å²	89	61.5 Å²	61.5	34%	0.336	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-5.6	177	-65.3	-179	-179	159.6	-2.7	114.1	D961 S1013 L1018 C1019	D961-R1015 PolarHBondContact O-NH1 3.07Å; S1013-R1015 PolarHBondContact O-N 3.19Å; S1013-R1015 PolarHBondContact OG-N 3.47Å; R1015-L1018 WeakPolarHBondContact O-CB 3.14Å; R1015-L1018 PolarHBondContact O-N 2.85Å; R1015-C1019 PolarHBondContact O-N 2.99Å
1016	Q	83.5	Confident	84.9	Confident	35 Å²	35	54 Å²	54	16%	0.164	29%	0.293	C	S	.	.	H	α-helix	trans	-54.9	-44.3	-175.4	-176.6	-177.8	39	0	0	113.4	V1009 S1011 S1013 L1018 C1019 Q1020	V1009-Q1016 PolarHBondContact O-NE2 2.87Å; S1011-Q1016 PolarHBondContact O-NE2 2.86Å; S1013-Q1016 WeakPolarHBondContact O-CB 3.44Å; S1013-Q1016 PolarHBondContact O-N 2.95Å; Q1016-L1018 VanDerWaalsContact C-N 3.31Å; Q1016-L1018 PolarHBondContact O-N 3.24Å; Q1016-C1019 PolarHBondContact O-N 3.3Å; Q1016-Q1020 HydrophobicContact CG-CG 4.43Å; Q1016-Q1020 WeakPolarHBondContact O-CB 3.28Å; Q1016-Q1020 WeakPolarHBondContact O-CG 3.32Å; Q1016-Q1020 PolarHBondContact O-N 2.98Å
1017	P	85	Confident	85.2	Confident	68 Å²	68	52.7 Å²	52.7	44%	0.442	29%	0.288	S	S	.	.	H	α-helix	trans	-62.8	-36.7	176.8	-23.2	35.1	0	0	0	112.8	Q1020 Y1021 L1069	P1017-Q1020 PolarHBondContact O-N 3.3Å; P1017-Y1021 WeakPolarHBondContact O-CB 3.23Å; P1017-Y1021 PolarHBondContact O-N 3.45Å; P1017-L1069 HydrophobicContact CB-CD2 4.28Å
1018	L	87	Confident	85.6	Confident	98 Å²	98	53.1 Å²	53.1	51%	0.513	29%	0.289	S	S	.	.	H	α-helix	trans	-68.7	-39.5	176.8	-61.5	173.1	0	0	0	111.5	W965 R1015 Q1016 Y1021 R1022	W965-L1018 HydrophobicContact CH2-CB 3.59Å; W965-L1018 HydrophobicContact CZ2-CB 4.3Å; W965-L1018 HydrophobicContact CZ3-CB 4.13Å; R1015-L1018 WeakPolarHBondContact O-CB 3.14Å; R1015-L1018 PolarHBondContact O-N 2.85Å; Q1016-L1018 VanDerWaalsContact C-N 3.31Å; Q1016-L1018 PolarHBondContact O-N 3.24Å; L1018-Y1021 PolarHBondContact O-N 3.32Å; L1018-R1022 WeakPolarHBondContact O-CB 3.33Å; L1018-R1022 PolarHBondContact O-N 3.47Å
1019	C	87.4	Confident	86.2	Confident	11 Å²	11	52.2 Å²	52.2	7%	0.074	28%	0.281	C	S	.	.	H	α-helix	trans	-64.1	-46.7	173.5	-70.4	0	0	0	0	111.5	C1007 D1008 R1015 Q1016 Y1021 R1022 A1023	C1007-C1019 WeakPolarHBondContact SG-CA 3.26Å; C1007-C1019 VanDerWaalsContact SG-CB 3.52Å; C1007-C1019 PolarHBondContact SG-O 3.44Å; D1008-C1019 WeakPolarHBondContact O-CB 3.45Å; D1008-C1019 PolarHBondContact O-SG 3.21Å; D1008-C1019 VanDerWaalsContact O-SG 3.35Å; R1015-C1019 PolarHBondContact O-N 2.99Å; Q1016-C1019 PolarHBondContact O-N 3.3Å; C1019-Y1021 VanDerWaalsContact C-N 3.34Å; C1019-Y1021 PolarHBondContact O-N 2.9Å; C1019-R1022 PolarHBondContact O-N 3.43Å; C1019-A1023 WeakPolarHBondContact O-CB 3.37Å; C1019-A1023 PolarHBondContact O-N 3.02Å
1020	Q	89.6	Confident	87	Confident	27 Å²	27	51 Å²	51	13%	0.126	27%	0.273	C	S	.	.	H	α-helix	trans	-58.8	-44.2	175.7	-77.8	170.4	-4.4	0	0	111.7	V1009 Q1016 P1017 A1023 A1024 L1069	V1009-Q1020 HydrophobicContact CG1-CG 3.72Å; Q1016-Q1020 HydrophobicContact CG-CG 4.43Å; Q1016-Q1020 WeakPolarHBondContact O-CB 3.28Å; Q1016-Q1020 WeakPolarHBondContact O-CG 3.32Å; Q1016-Q1020 PolarHBondContact O-N 2.98Å; P1017-Q1020 PolarHBondContact O-N 3.3Å; Q1020-A1023 PolarHBondContact O-N 3.01Å; Q1020-A1024 VanDerWaalsContact O-CB 3.3Å; Q1020-A1024 WeakPolarHBondContact O-CB 3.18Å; Q1020-A1024 PolarHBondContact O-N 3.45Å; Q1020-L1069 HydrophobicContact CB-CD1 4.42Å; Q1020-L1069 HydrophobicContact CB-CD2 3.89Å; Q1020-L1069 HydrophobicContact CB-CG 4.38Å
1021	Y	91.7	Very high	87.9	Confident	99 Å²	99	44 Å²	44	39%	0.388	24%	0.236	S	C	.	.	H	α-helix	trans	-62.6	-46.1	177.2	-176	-90.9	0	0	0	112.1	P1017 L1018 C1019 A1024 T1025 F1066 L1069 A1072 E1075	P1017-Y1021 WeakPolarHBondContact O-CB 3.23Å; P1017-Y1021 PolarHBondContact O-N 3.45Å; L1018-Y1021 PolarHBondContact O-N 3.32Å; C1019-Y1021 VanDerWaalsContact C-N 3.34Å; C1019-Y1021 PolarHBondContact O-N 2.9Å; Y1021-A1024 PolarHBondContact O-N 3.2Å; Y1021-T1025 WeakPolarHBondContact O-CB 3.26Å; Y1021-T1025 PolarHBondContact O-N 2.79Å; Y1021-T1025 PolarHBondContact O-OG1 2.96Å; Y1021-F1066 AromaticContact CD2-CE1 3.99Å; Y1021-F1066 HydrophobicContact CD2-CE1 3.99Å; Y1021-F1066 AromaticContact CE2-CE1 3.93Å; Y1021-F1066 HydrophobicContact CE2-CE1 3.93Å; Y1021-L1069 HydrophobicContact CD2-CD1 3.98Å; Y1021-L1069 HydrophobicContact CG-CD1 4.39Å; Y1021-A1072 HydrophobicContact CD2-CB 4.17Å; Y1021-A1072 HydrophobicContact CE2-CB 3.97Å; Y1021-E1075 HydrophobicContact CE2-CG 4.46Å
1022	R	92.4	Very high	88.7	Confident	26 Å²	26	43.9 Å²	43.9	10%	0.098	24%	0.235	C	C	.	.	H	α-helix	trans	-62.9	-45.6	176.3	-177.4	177.2	-65.7	152.5	-0.8	111.4	W965 T969 F972 L1018 C1019 A1024 T1025 I1026	W965-R1022 VanDerWaalsContact CE3-NH1 3.26Å; W965-R1022 VanDerWaalsContact CH2-NH1 3.33Å; T969-R1022 VanDerWaalsContact OG1-CZ 3.25Å; T969-R1022 PolarHBondContact OG1-NH1 3.46Å; T969-R1022 PolarHBondContact OG1-NH2 2.83Å; F972-R1022 HydrophobicContact CD1-CG 4.44Å; F972-R1022 HydrophobicContact CD2-CG 4.3Å; F972-R1022 HydrophobicContact CG-CG 4.2Å; L1018-R1022 WeakPolarHBondContact O-CB 3.33Å; L1018-R1022 PolarHBondContact O-N 3.47Å; C1019-R1022 PolarHBondContact O-N 3.43Å; R1022-A1024 VanDerWaalsContact C-N 3.32Å; R1022-A1024 PolarHBondContact O-N 2.89Å; R1022-T1025 PolarHBondContact O-N 2.93Å; R1022-I1026 HydrophobicContact CG-CD1 3.86Å; R1022-I1026 HydrophobicContact CG-CG1 4.35Å; R1022-I1026 VanDerWaalsContact O-CG1 3.27Å; R1022-I1026 WeakPolarHBondContact O-CG1 3.49Å; R1022-I1026 PolarHBondContact O-N 3.35Å
1023	A	93.3	Very high	89.6	Confident	2 Å²	2	36.1 Å²	36.1	2%	0.017	20%	0.197	C	C	.	.	H	α-helix	trans	-61.9	-40.5	178.5	0	0	0	0	0	112	L1004 V1009 C1019 Q1020 I1026 H1027 L1065	L1004-A1023 HydrophobicContact CD2-CB 3.64Å; V1009-A1023 HydrophobicContact CG2-CB 3.73Å; C1019-A1023 WeakPolarHBondContact O-CB 3.37Å; C1019-A1023 PolarHBondContact O-N 3.02Å; Q1020-A1023 PolarHBondContact O-N 3.01Å; A1023-I1026 PolarHBondContact O-N 3.13Å; A1023-H1027 WeakPolarHBondContact O-CB 3.4Å; A1023-H1027 PolarHBondContact O-CD2 3.37Å; A1023-H1027 PolarHBondContact O-N 3.39Å; A1023-L1065 HydrophobicContact CB-CD1 3.85Å
1024	A	93.4	Very high	90.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-61.7	-46.5	174.3	0	0	0	0	0	111.5	Q1020 Y1021 R1022 H1027 H1028 L1065 F1066	Q1020-A1024 VanDerWaalsContact O-CB 3.3Å; Q1020-A1024 WeakPolarHBondContact O-CB 3.18Å; Q1020-A1024 PolarHBondContact O-N 3.45Å; Y1021-A1024 PolarHBondContact O-N 3.2Å; R1022-A1024 VanDerWaalsContact C-N 3.32Å; R1022-A1024 PolarHBondContact O-N 2.89Å; A1024-H1027 PolarHBondContact O-N 2.68Å; A1024-H1028 PolarHBondContact O-N 3.5Å; A1024-L1065 HydrophobicContact CB-CB 3.61Å; A1024-L1065 HydrophobicContact CB-CD1 4.34Å; A1024-F1066 HydrophobicContact CB-CD1 3.73Å; A1024-F1066 HydrophobicContact CB-CD2 3.69Å; A1024-F1066 HydrophobicContact CB-CE1 3.6Å; A1024-F1066 HydrophobicContact CB-CE2 3.56Å; A1024-F1066 HydrophobicContact CB-CG 3.76Å; A1024-F1066 HydrophobicContact CB-CZ 3.51Å
1025	T	94.2	Very high	91.3	Very high	23 Å²	23	31 Å²	31	14%	0.141	15%	0.149	C	C	.	.	H	α-helix	trans	-62.6	-43.5	177.6	-55	0	0	0	0	111.9	F972 Y1021 R1022 H1027 H1028 R1029	F972-T1025 HydrophobicContact CE2-CG2 4.21Å; F972-T1025 HydrophobicContact CZ-CG2 3.85Å; Y1021-T1025 WeakPolarHBondContact O-CB 3.26Å; Y1021-T1025 PolarHBondContact O-N 2.79Å; Y1021-T1025 PolarHBondContact O-OG1 2.96Å; R1022-T1025 PolarHBondContact O-N 2.93Å; T1025-H1027 PolarHBondContact O-N 3.35Å; T1025-H1028 PolarHBondContact O-N 3.42Å; T1025-R1029 HydrophobicContact CG2-CG 4.47Å; T1025-R1029 WeakPolarHBondContact O-CG 3.48Å; T1025-R1029 PolarHBondContact O-N 3.22Å
1026	I	95.2	Very high	91.8	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-59.8	-47.8	176	-70	166.3	0	0	0	110.4	F972 M1000 S1003 L1004 R1022 A1023 H1028 R1029 L1030	F972-I1026 HydrophobicContact CD2-CD1 3.91Å; F972-I1026 HydrophobicContact CD2-CG1 3.42Å; F972-I1026 VanDerWaalsContact CD2-CG1 3.42Å; F972-I1026 HydrophobicContact CE2-CG1 3.62Å; M1000-I1026 HydrophobicContact CB-CG2 3.73Å; M1000-I1026 HydrophobicContact CG-CG2 4.18Å; M1000-I1026 HydrophobicContact SD-CB 4.29Å; M1000-I1026 HydrophobicContact SD-CG1 3.84Å; M1000-I1026 HydrophobicContact SD-CG2 3.85Å; S1003-I1026 WeakPolarHBondContact OG-CD1 3.26Å; L1004-I1026 HydrophobicContact CD1-CG2 3.74Å; L1004-I1026 HydrophobicContact CD2-CB 4.17Å; L1004-I1026 HydrophobicContact CD2-CD1 3.98Å; L1004-I1026 HydrophobicContact CD2-CG2 4.21Å; L1004-I1026 HydrophobicContact CG-CB 4.27Å; L1004-I1026 HydrophobicContact CG-CD1 3.99Å; L1004-I1026 HydrophobicContact CG-CG2 3.78Å; R1022-I1026 HydrophobicContact CG-CD1 3.86Å; R1022-I1026 HydrophobicContact CG-CG1 4.35Å; R1022-I1026 VanDerWaalsContact O-CG1 3.27Å; R1022-I1026 WeakPolarHBondContact O-CG1 3.49Å; R1022-I1026 PolarHBondContact O-N 3.35Å; A1023-I1026 PolarHBondContact O-N 3.13Å; I1026-H1028 VanDerWaalsContact C-N 3.34Å; I1026-H1028 PolarHBondContact O-N 3.47Å; I1026-R1029 PolarHBondContact O-N 3.26Å; I1026-L1030 HydrophobicContact CG2-CD1 3.9Å; I1026-L1030 HydrophobicContact CG2-CG 4.36Å; I1026-L1030 WeakPolarHBondContact O-CB 3.35Å; I1026-L1030 WeakPolarHBondContact O-CG 3.5Å; I1026-L1030 PolarHBondContact O-N 3.41Å
1027	H	95.4	Very high	92	Very high	17 Å²	17	27.5 Å²	27.5	8%	0.079	14%	0.142	C	C	.	.	H	α-helix	trans	-63.5	-39.2	178	-78	-33	0	0	0	112.5	L1004 A1023 A1024 T1025 A1031 H1058 K1061 A1062	L1004-H1027 WeakPolarHBondContact CD1-CE1 3.24Å; A1023-H1027 WeakPolarHBondContact O-CB 3.4Å; A1023-H1027 PolarHBondContact O-CD2 3.37Å; A1023-H1027 PolarHBondContact O-N 3.39Å; A1024-H1027 PolarHBondContact O-N 2.68Å; T1025-H1027 PolarHBondContact O-N 3.35Å; H1027-A1031 VanDerWaalsContact O-CB 3.29Å; H1027-A1031 WeakPolarHBondContact O-CB 3.38Å; H1027-A1031 PolarHBondContact O-N 2.84Å; H1027-H1058 AromaticContact CE1-CE1 3.98Å; H1027-H1058 AromaticContact CE1-ND1 3.61Å; H1027-H1058 AromaticContact CG-ND1 3.96Å; H1027-H1058 AromaticContact ND1-CE1 3.68Å; H1027-H1058 AromaticContact ND1-ND1 3.01Å; H1027-H1058 PolarHBondContact ND1-ND1 3.47Å; H1027-H1058 WeakPolarHBondContact O-CB 3.48Å; H1027-K1061 HydrophobicContact CB-CB 4.43Å; H1027-A1062 HydrophobicContact CB-CB 3.8Å
1028	H	95.2	Very high	92.2	Very high	19 Å²	19	24.5 Å²	24.5	9%	0.088	12%	0.122	C	C	.	.	H	α-helix	trans	-60.5	-51.5	173.7	170.8	-138.1	0	0	0	111.2	A1024 T1025 I1026 L1030 A1031 S1032 A1062 F1066 V1079 E1082	A1024-H1028 PolarHBondContact O-N 3.5Å; T1025-H1028 PolarHBondContact O-N 3.42Å; I1026-H1028 VanDerWaalsContact C-N 3.34Å; I1026-H1028 PolarHBondContact O-N 3.47Å; H1028-L1030 PolarHBondContact O-N 2.92Å; H1028-A1031 WeakPolarHBondContact O-CB 3.32Å; H1028-A1031 PolarHBondContact O-N 2.87Å; H1028-A1031 VanDerWaalsContact O-N 3.08Å; H1028-S1032 PolarHBondContact CD2-OG 3.07Å; H1028-S1032 PolarHBondContact NE2-OG 2.97Å; H1028-S1032 PolarHBondContact O-N 2.98Å; H1028-S1032 PolarHBondContact O-OG 2.9Å; H1028-A1062 HydrophobicContact CB-CB 4.1Å; H1028-F1066 HydrophobicContact CB-CE2 4.29Å; H1028-V1079 HydrophobicContact CB-CG2 3.91Å; H1028-E1082 IonicContact CD2-OE2 3.31Å; H1028-E1082 IonicContact CE1-OE1 2.67Å; H1028-E1082 VanDerWaalsContact NE2-CD 3.3Å; H1028-E1082 IonicContact NE2-OE1 3.39Å; H1028-E1082 PolarHBondContact NE2-OE1 2.95Å; H1028-E1082 IonicContact NE2-OE2 2.72Å; H1028-E1082 PolarHBondContact NE2-OE2 3.42Å
1029	R	95.3	Very high	92.1	Very high	44 Å²	44	27 Å²	27	17%	0.166	13%	0.125	C	C	.	.	H	α-helix	trans	-60.4	-40.9	179.9	-69.6	-177.4	72.9	121.4	7.7	113.2	T976 Q979 D980 T1025 I1026 M1033	T976-R1029 PolarHBondContact O-NH2 3.39Å; Q979-R1029 PolarHBondContact NE2-O 2.98Å; D980-R1029 IonicContact OD1-CZ 3.74Å; D980-R1029 IonicContact OD1-NH2 3.92Å; D980-R1029 PolarHBondContact OD1-NH2 3.38Å; D980-R1029 IonicContact OD2-CZ 2.7Å; D980-R1029 IonicContact OD2-NH1 3Å; D980-R1029 PolarHBondContact OD2-NH1 3.28Å; D980-R1029 IonicContact OD2-NH2 3.07Å; D980-R1029 PolarHBondContact OD2-NH2 2.98Å; T1025-R1029 HydrophobicContact CG2-CG 4.47Å; T1025-R1029 WeakPolarHBondContact O-CG 3.48Å; T1025-R1029 PolarHBondContact O-N 3.22Å; I1026-R1029 PolarHBondContact O-N 3.26Å; R1029-M1033 WeakPolarHBondContact O-CB 3.45Å; R1029-M1033 PolarHBondContact O-N 3.18Å
1030	L	94.9	Very high	91.9	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-64.4	-41.9	174.1	-73.6	173.8	0	0	0	111.6	M1000 M1001 I1026 H1028 M1033 Y1034 H1058	M1000-L1030 HydrophobicContact CB-CD1 4.05Å; M1000-L1030 HydrophobicContact CB-CD2 3.94Å; M1000-L1030 HydrophobicContact CB-CG 4.12Å; M1000-L1030 HydrophobicContact CG-CD2 4.14Å; M1000-L1030 HydrophobicContact CG-CG 4.37Å; M1001-L1030 HydrophobicContact SD-CD1 4.38Å; I1026-L1030 HydrophobicContact CG2-CD1 3.9Å; I1026-L1030 HydrophobicContact CG2-CG 4.36Å; I1026-L1030 WeakPolarHBondContact O-CB 3.35Å; I1026-L1030 WeakPolarHBondContact O-CG 3.5Å; I1026-L1030 PolarHBondContact O-N 3.41Å; H1028-L1030 PolarHBondContact O-N 2.92Å; L1030-M1033 HydrophobicContact CD2-CE 4.13Å; L1030-M1033 PolarHBondContact O-N 2.93Å; L1030-Y1034 HydrophobicContact CB-CE2 4.44Å; L1030-Y1034 WeakPolarHBondContact O-CD2 3.38Å; L1030-Y1034 PolarHBondContact O-N 3.3Å; L1030-H1058 HydrophobicContact CB-CB 4.43Å
1031	A	94.8	Very high	91.3	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-64.2	-47.4	179	0	0	0	0	0	111.9	H1027 H1028 M1033 Y1034 H1035 H1058 Y1059	H1027-A1031 VanDerWaalsContact O-CB 3.29Å; H1027-A1031 WeakPolarHBondContact O-CB 3.38Å; H1027-A1031 PolarHBondContact O-N 2.84Å; H1028-A1031 WeakPolarHBondContact O-CB 3.32Å; H1028-A1031 PolarHBondContact O-N 2.87Å; H1028-A1031 VanDerWaalsContact O-N 3.08Å; A1031-M1033 VanDerWaalsContact C-N 3.31Å; A1031-M1033 PolarHBondContact O-N 2.91Å; A1031-Y1034 PolarHBondContact O-N 3.45Å; A1031-H1035 VanDerWaalsContact O-CB 3.23Å; A1031-H1035 WeakPolarHBondContact O-CB 3.44Å; A1031-H1035 PolarHBondContact O-N 2.72Å; A1031-H1058 HydrophobicContact CB-CB 3.7Å; A1031-Y1059 HydrophobicContact CB-CD1 3.48Å; A1031-Y1059 VanDerWaalsContact CB-CD1 3.48Å; A1031-Y1059 HydrophobicContact CB-CD2 3.65Å; A1031-Y1059 HydrophobicContact CB-CE1 3.7Å; A1031-Y1059 HydrophobicContact CB-CE2 3.86Å; A1031-Y1059 HydrophobicContact CB-CG 3.44Å; A1031-Y1059 VanDerWaalsContact CB-CG 3.44Å
1032	S	93.5	Very high	90.2	Very high	31 Å²	31	33.9 Å²	33.9	22%	0.217	17%	0.171	C	C	.	.	H	α-helix	trans	-64.2	-36.3	178	-48.3	0	0	0	0	111.7	H1028 S1036 Y1059 E1082	H1028-S1032 PolarHBondContact CD2-OG 3.07Å; H1028-S1032 PolarHBondContact NE2-OG 2.97Å; H1028-S1032 PolarHBondContact O-N 2.98Å; H1028-S1032 PolarHBondContact O-OG 2.9Å; S1032-S1036 WeakPolarHBondContact O-CB 3.34Å; S1032-S1036 PolarHBondContact O-N 2.71Å; S1032-Y1059 WeakPolarHBondContact CA-OH 3.15Å; S1032-Y1059 PolarHBondContact OG-OH 3.47Å; S1032-E1082 PolarHBondContact OG-OE2 2.94Å
1033	M	92.4	Very high	88.9	Confident	14 Å²	14	36.3 Å²	36.3	7%	0.069	21%	0.205	C	C	.	.	H	α-helix	trans	-61	-58.2	172.3	-172.3	-176.7	74.5	0	0	111.1	E993 V996 R1029 L1030 A1031 H1035 S1036 C1037	E993-M1033 HydrophobicContact CB-CE 4.36Å; E993-M1033 HydrophobicContact CB-SD 4.03Å; E993-M1033 HydrophobicContact CG-CG 4.24Å; E993-M1033 HydrophobicContact CG-SD 4Å; V996-M1033 HydrophobicContact CG1-SD 4.17Å; R1029-M1033 WeakPolarHBondContact O-CB 3.45Å; R1029-M1033 PolarHBondContact O-N 3.18Å; L1030-M1033 HydrophobicContact CD2-CE 4.13Å; L1030-M1033 PolarHBondContact O-N 2.93Å; A1031-M1033 VanDerWaalsContact C-N 3.31Å; A1031-M1033 PolarHBondContact O-N 2.91Å; M1033-H1035 PolarHBondContact O-N 3.45Å; M1033-S1036 CarbonylContact O-C 3.59Å; M1033-S1036 WeakPolarHBondContact O-CA 3.43Å; M1033-S1036 VanDerWaalsContact O-CB 3.31Å; M1033-S1036 WeakPolarHBondContact O-CB 3.48Å; M1033-S1036 PolarHBondContact O-N 2.83Å; M1033-C1037 PolarHBondContact O-N 2.87Å; M1033-C1037 PolarHBondContact O-SG 3.12Å
1034	Y	92.4	Very high	88.1	Confident	25 Å²	25	39.8 Å²	39.8	10%	0.098	22%	0.223	C	C	.	.	H	α-helix	trans	-61.5	-32.4	-179.4	-71.1	-52.9	0	0	0	113.1	S997 L1030 A1031 C1037 L1038 H1051 L1054 H1058	S997-Y1034 PolarHBondContact OG-OH 3.06Å; L1030-Y1034 HydrophobicContact CB-CE2 4.44Å; L1030-Y1034 WeakPolarHBondContact O-CD2 3.38Å; L1030-Y1034 PolarHBondContact O-N 3.3Å; A1031-Y1034 PolarHBondContact O-N 3.45Å; Y1034-C1037 PolarHBondContact O-N 3.16Å; Y1034-L1038 VanDerWaalsContact O-CB 3.31Å; Y1034-L1038 WeakPolarHBondContact O-CB 3.47Å; Y1034-L1038 PolarHBondContact O-N 2.92Å; Y1034-H1051 AromaticContact CD1-CD2 3.48Å; Y1034-H1051 VanDerWaalsContact CD1-CD2 3.48Å; Y1034-H1051 WeakPolarHBondContact CD1-CD2 3.24Å; Y1034-H1051 AromaticContact CE1-CD2 3.9Å; Y1034-L1054 HydrophobicContact CD1-CD1 4.4Å; Y1034-L1054 HydrophobicContact CD2-CB 3.69Å; Y1034-L1054 HydrophobicContact CE1-CD1 3.96Å; Y1034-L1054 HydrophobicContact CE2-CB 3.91Å; Y1034-L1054 HydrophobicContact CE2-CD1 4.11Å; Y1034-L1054 HydrophobicContact CG-CB 4.03Å; Y1034-H1058 AromaticContact CD2-CD2 3.98Å; Y1034-H1058 AromaticContact CE2-CD2 3.88Å
1035	H	92	Very high	87.5	Confident	22 Å²	22	46.5 Å²	46.5	10%	0.102	25%	0.254	C	S	.	.	H	α-helix	trans	-64.6	-42.9	171.6	-178.5	-171	0	0	0	111.5	A1031 M1033 L1038 R1039 A1055 Y1059 F1086	A1031-H1035 VanDerWaalsContact O-CB 3.23Å; A1031-H1035 WeakPolarHBondContact O-CB 3.44Å; A1031-H1035 PolarHBondContact O-N 2.72Å; M1033-H1035 PolarHBondContact O-N 3.45Å; H1035-L1038 WeakPolarHBondContact O-CB 3.41Å; H1035-L1038 PolarHBondContact O-N 3.22Å; H1035-R1039 PolarHBondContact O-N 3.49Å; H1035-R1039 VanDerWaalsContact O-N 3.1Å; H1035-A1055 HydrophobicContact CB-CB 4.45Å; H1035-Y1059 HydrophobicContact CB-CE2 4.11Å; H1035-Y1059 AromaticContact ND1-CE2 3.94Å; H1035-Y1059 PolarHBondContact ND1-OH 2.87Å; H1035-F1086 HydrophobicContact CB-CD2 4.49Å; H1035-F1086 AromaticContact CD2-CD2 3.62Å; H1035-F1086 AromaticContact CG-CD2 3.89Å; H1035-F1086 AromaticContact NE2-CD2 3.84Å
1036	S	90	Very high	86.9	Confident	43 Å²	43	52 Å²	52	30%	0.301	28%	0.278	S	S	.	.	H	α-helix	trans	-63.2	-46.2	173.4	-169.7	0	0	0	0	112	S1032 M1033 L1038 R1039 N1040	S1032-S1036 WeakPolarHBondContact O-CB 3.34Å; S1032-S1036 PolarHBondContact O-N 2.71Å; M1033-S1036 CarbonylContact O-C 3.59Å; M1033-S1036 WeakPolarHBondContact O-CA 3.43Å; M1033-S1036 VanDerWaalsContact O-CB 3.31Å; M1033-S1036 WeakPolarHBondContact O-CB 3.48Å; M1033-S1036 PolarHBondContact O-N 2.83Å; S1036-L1038 VanDerWaalsContact C-N 3.29Å; S1036-L1038 PolarHBondContact O-N 3.05Å; S1036-R1039 PolarHBondContact O-N 2.9Å; S1036-N1040 VanDerWaalsContact O-CG 3.31Å; S1036-N1040 PolarHBondContact O-N 2.76Å; S1036-N1040 PolarHBondContact O-ND2 3.41Å; S1036-N1040 PolarHBondContact OG-ND2 3.1Å
1037	C	87.9	Confident	86.3	Confident	8 Å²	8	54.1 Å²	54.1	5%	0.054	29%	0.289	C	S	.	.	H	α-helix	trans	-55.4	-46.5	174.9	-53.1	0	0	0	0	110.5	E993 M1033 Y1034 R1039 N1040 Q1041	E993-C1037 PolarHBondContact OE1-SG 3.43Å; E993-C1037 PolarHBondContact OE2-SG 3.49Å; M1033-C1037 PolarHBondContact O-N 2.87Å; M1033-C1037 PolarHBondContact O-SG 3.12Å; Y1034-C1037 PolarHBondContact O-N 3.16Å; C1037-R1039 VanDerWaalsContact C-N 3.28Å; C1037-R1039 PolarHBondContact O-N 2.85Å; C1037-N1040 PolarHBondContact O-N 2.91Å; C1037-Q1041 WeakPolarHBondContact O-CB 3.33Å; C1037-Q1041 PolarHBondContact O-N 2.84Å
1038	L	87.8	Confident	85.7	Confident	4 Å²	4	56.2 Å²	56.2	2%	0.021	30%	0.296	C	S	.	.	H	α-helix	trans	-59.9	-36.4	177.9	-175.9	73.4	0	0	0	113.1	Y1034 H1035 S1036 R1048 H1051 R1052 F1086 F1089	Y1034-L1038 VanDerWaalsContact O-CB 3.31Å; Y1034-L1038 WeakPolarHBondContact O-CB 3.47Å; Y1034-L1038 PolarHBondContact O-N 2.92Å; H1035-L1038 WeakPolarHBondContact O-CB 3.41Å; H1035-L1038 PolarHBondContact O-N 3.22Å; S1036-L1038 VanDerWaalsContact C-N 3.29Å; S1036-L1038 PolarHBondContact O-N 3.05Å; L1038-R1048 HydrophobicContact CD1-CB 4.28Å; L1038-R1048 HydrophobicContact CD1-CG 3.37Å; L1038-R1048 WeakPolarHBondContact CD1-O 3.47Å; L1038-R1048 PolarHBondContact O-NH1 3.22Å; L1038-H1051 HydrophobicContact CB-CB 4.38Å; L1038-H1051 HydrophobicContact CD1-CB 4.4Å; L1038-R1052 HydrophobicContact CD1-CB 4.18Å; L1038-R1052 HydrophobicContact CD2-CB 4.18Å; L1038-R1052 HydrophobicContact CD2-CG 4.47Å; L1038-F1086 HydrophobicContact CD2-CD2 4.48Å; L1038-F1086 HydrophobicContact CD2-CE2 3.65Å; L1038-F1089 HydrophobicContact CD2-CD1 4.2Å; L1038-F1089 HydrophobicContact CD2-CE1 3.94Å; L1038-F1089 HydrophobicContact CG-CE1 4.01Å
1039	R	85.2	Confident	85.3	Confident	152 Å²	152	61.5 Å²	61.5	57%	0.574	32%	0.319	S	S	*	.	H	α-helix	trans	-73.9	-36.1	179.8	-172.2	175.7	67.7	-163.4	-0.6	112.2	H1035 S1036 C1037 F1089	H1035-R1039 PolarHBondContact O-N 3.49Å; H1035-R1039 VanDerWaalsContact O-N 3.1Å; S1036-R1039 PolarHBondContact O-N 2.9Å; C1037-R1039 VanDerWaalsContact C-N 3.28Å; C1037-R1039 PolarHBondContact O-N 2.85Å; R1039-F1089 HydrophobicContact CB-CE2 4.42Å; R1039-F1089 HydrophobicContact CB-CZ 4.35Å; R1039-F1089 HydrophobicContact CG-CE2 4Å; R1039-F1089 HydrophobicContact CG-CZ 4.37Å
1040	N	82.7	Confident	84.9	Confident	103 Å²	103	63.8 Å²	63.8	55%	0.551	33%	0.332	S	S	*	.	H	α-helix	trans	-94.5	-17.1	-172.7	-58.5	-22.9	0	0	0	113.4	S1036 C1037	S1036-N1040 VanDerWaalsContact O-CG 3.31Å; S1036-N1040 PolarHBondContact O-N 2.76Å; S1036-N1040 PolarHBondContact O-ND2 3.41Å; S1036-N1040 PolarHBondContact OG-ND2 3.1Å; C1037-N1040 PolarHBondContact O-N 2.91Å
1041	Q	78.3	Confident	84.7	Confident	38 Å²	38	64.6 Å²	64.6	18%	0.178	34%	0.336	C	S	.	.			trans	-77.1	132.2	-176.2	-175	157.9	43.8	0	0	113.2	C1037 H1051	C1037-Q1041 WeakPolarHBondContact O-CB 3.33Å; C1037-Q1041 PolarHBondContact O-N 2.84Å; Q1041-H1051 PolarHBondContact OE1-CE1 3.05Å; Q1041-H1051 PolarHBondContact OE1-ND1 3.18Å
1042	V	67.7	Low	84.4	Confident	139 Å²	139	69.7 Å²	69.7	84%	0.842	36%	0.355	S	S	*	.			trans	-119.2	124.5	-179	-175.4	0	0	0	0	109.8
1043	G	64.6	Low	84.4	Confident	77 Å²	77	72.3 Å²	72.3	79%	0.794	37%	0.369	S	S	*	.	S	Bend	trans	98.5	-22.7	161.3	0	0	0	0	0	118.8
1044	D	77.9	Confident	84.4	Confident	75 Å²	75	73.5 Å²	73.5	40%	0.401	38%	0.375	S	S	.	.			trans	-100.9	96.3	177.4	-172.3	-14.3	0	0	0	112.2	H1046 L1047 R1048	D1044-H1046 VanDerWaalsContact C-N 3.32Å; D1044-H1046 PolarHBondContact O-N 2.84Å; D1044-H1046 PolarHBondContact OD1-N 3.28Å; D1044-L1047 HydrophobicContact CB-CB 4.1Å; D1044-L1047 PolarHBondContact O-N 3.38Å; D1044-L1047 PolarHBondContact OD1-N 3.35Å; D1044-L1047 VanDerWaalsContact OD1-N 3.15Å; D1044-L1047 WeakPolarHBondContact OD2-CB 3.49Å; D1044-R1048 VanDerWaalsContact O-CB 3.23Å; D1044-R1048 WeakPolarHBondContact O-CB 3.37Å; D1044-R1048 PolarHBondContact O-N 2.89Å
1045	E	79.3	Confident	84.4	Confident	141 Å²	141	72.3 Å²	72.3	66%	0.659	37%	0.371	S	S	*	.	H	α-helix	trans	-64.8	-30.1	-179.8	-78	-63.5	132.8	0	0	113.7	K1049	E1045-K1049 WeakPolarHBondContact O-CB 3.33Å; E1045-K1049 PolarHBondContact O-N 2.84Å
1046	H	82.8	Confident	84.4	Confident	139 Å²	139	75 Å²	75	64%	0.644	39%	0.386	S	S	*	.	H	α-helix	trans	-70.3	-48.1	179.2	-179.7	-87	0	0	0	110.3	D1044 K1049 Q1050	D1044-H1046 VanDerWaalsContact C-N 3.32Å; D1044-H1046 PolarHBondContact O-N 2.84Å; D1044-H1046 PolarHBondContact OD1-N 3.28Å; H1046-K1049 PolarHBondContact O-N 2.94Å; H1046-Q1050 PolarHBondContact O-N 3.16Å
1047	L	82.3	Confident	84.6	Confident	44 Å²	44	76.6 Å²	76.6	23%	0.23	39%	0.391	C	S	.	.	H	α-helix	trans	-68.2	-37	178.8	-169.4	50.4	0	0	0	111.8	D1044 K1049 Q1050 H1051	D1044-L1047 HydrophobicContact CB-CB 4.1Å; D1044-L1047 PolarHBondContact O-N 3.38Å; D1044-L1047 PolarHBondContact OD1-N 3.35Å; D1044-L1047 VanDerWaalsContact OD1-N 3.15Å; D1044-L1047 WeakPolarHBondContact OD2-CB 3.49Å; L1047-K1049 PolarHBondContact O-N 3.31Å; L1047-Q1050 WeakPolarHBondContact O-CB 3.41Å; L1047-Q1050 PolarHBondContact O-N 2.59Å; L1047-H1051 PolarHBondContact O-N 2.71Å
1048	R	83.1	Confident	85	Confident	61 Å²	61	76.7 Å²	76.7	23%	0.23	39%	0.39	C	S	.	.	H	α-helix	trans	-59	-44.1	171.4	-168.6	-177.5	170.7	76.3	4.6	111.7	L1038 D1044 R1052	L1038-R1048 HydrophobicContact CD1-CB 4.28Å; L1038-R1048 HydrophobicContact CD1-CG 3.37Å; L1038-R1048 WeakPolarHBondContact CD1-O 3.47Å; L1038-R1048 PolarHBondContact O-NH1 3.22Å; D1044-R1048 VanDerWaalsContact O-CB 3.23Å; D1044-R1048 WeakPolarHBondContact O-CB 3.37Å; D1044-R1048 PolarHBondContact O-N 2.89Å; R1048-R1052 WeakPolarHBondContact O-CB 3.39Å; R1048-R1052 PolarHBondContact O-N 3.1Å; R1048-R1052 VanDerWaalsContact O-N 3.09Å
1049	K	86.2	Confident	85.3	Confident	130 Å²	130	76.5 Å²	76.5	57%	0.565	39%	0.389	S	S	*	.	H	α-helix	trans	-64.4	-40	175.6	-174	178.4	177.1	-175	0	111.6	E1045 H1046 L1047 V1053	E1045-K1049 WeakPolarHBondContact O-CB 3.33Å; E1045-K1049 PolarHBondContact O-N 2.84Å; H1046-K1049 PolarHBondContact O-N 2.94Å; L1047-K1049 PolarHBondContact O-N 3.31Å; K1049-V1053 WeakPolarHBondContact O-CG2 3.43Å; K1049-V1053 PolarHBondContact O-N 3.43Å; K1049-V1053 VanDerWaalsContact O-N 3.17Å
1050	Q	88	Confident	85.7	Confident	92 Å²	92	70.7 Å²	70.7	43%	0.43	37%	0.372	S	S	.	.	H	α-helix	trans	-64.7	-51	177.5	-177	178	-5	0	0	112.1	H1046 L1047 R1052 V1053 L1054	H1046-Q1050 PolarHBondContact O-N 3.16Å; L1047-Q1050 WeakPolarHBondContact O-CB 3.41Å; L1047-Q1050 PolarHBondContact O-N 2.59Å; Q1050-R1052 VanDerWaalsContact C-N 3.26Å; Q1050-R1052 PolarHBondContact O-N 3.12Å; Q1050-V1053 PolarHBondContact O-N 3.32Å; Q1050-V1053 VanDerWaalsContact O-N 3.11Å; Q1050-L1054 HydrophobicContact CG-CD1 3.98Å; Q1050-L1054 WeakPolarHBondContact O-CG 3.44Å; Q1050-L1054 PolarHBondContact O-N 2.85Å
1051	H	89.4	Confident	86.3	Confident	19 Å²	19	70.2 Å²	70.2	9%	0.088	37%	0.365	C	S	.	.	H	α-helix	trans	-58.5	-38.2	176.7	-71.4	158.5	0	0	0	112.3	Y1034 L1038 Q1041 L1047 L1054 A1055	Y1034-H1051 AromaticContact CD1-CD2 3.48Å; Y1034-H1051 VanDerWaalsContact CD1-CD2 3.48Å; Y1034-H1051 WeakPolarHBondContact CD1-CD2 3.24Å; Y1034-H1051 AromaticContact CE1-CD2 3.9Å; L1038-H1051 HydrophobicContact CB-CB 4.38Å; L1038-H1051 HydrophobicContact CD1-CB 4.4Å; Q1041-H1051 PolarHBondContact OE1-CE1 3.05Å; Q1041-H1051 PolarHBondContact OE1-ND1 3.18Å; L1047-H1051 PolarHBondContact O-N 2.71Å; H1051-L1054 PolarHBondContact O-N 3.47Å; H1051-A1055 VanDerWaalsContact O-CB 3.28Å; H1051-A1055 WeakPolarHBondContact O-CB 3.38Å; H1051-A1055 PolarHBondContact O-N 3.2Å
1052	R	89.4	Confident	87.1	Confident	107 Å²	107	68.4 Å²	68.4	40%	0.404	36%	0.357	S	S	.	.	H	α-helix	trans	-60.9	-46.2	174.2	-176.2	-174.5	63.8	169.6	0.3	112.4	L1038 R1048 Q1050 D1056 F1086	L1038-R1052 HydrophobicContact CD1-CB 4.18Å; L1038-R1052 HydrophobicContact CD2-CB 4.18Å; L1038-R1052 HydrophobicContact CD2-CG 4.47Å; R1048-R1052 WeakPolarHBondContact O-CB 3.39Å; R1048-R1052 PolarHBondContact O-N 3.1Å; R1048-R1052 VanDerWaalsContact O-N 3.09Å; Q1050-R1052 VanDerWaalsContact C-N 3.26Å; Q1050-R1052 PolarHBondContact O-N 3.12Å; R1052-D1056 PolarHBondContact O-N 3.08Å; R1052-D1056 VanDerWaalsContact O-N 3.14Å; R1052-F1086 HydrophobicContact CG-CZ 3.99Å
1053	V	92.6	Very high	88.2	Confident	85 Å²	85	62 Å²	62	52%	0.515	32%	0.318	S	S	.	.	H	α-helix	trans	-65.9	-41.5	179.3	172.3	0	0	0	0	110.9	K1049 Q1050 L1057	K1049-V1053 WeakPolarHBondContact O-CG2 3.43Å; K1049-V1053 PolarHBondContact O-N 3.43Å; K1049-V1053 VanDerWaalsContact O-N 3.17Å; Q1050-V1053 PolarHBondContact O-N 3.32Å; Q1050-V1053 VanDerWaalsContact O-N 3.11Å; V1053-L1057 VanDerWaalsContact O-CB 3.29Å; V1053-L1057 WeakPolarHBondContact O-CB 3.34Å; V1053-L1057 PolarHBondContact O-N 3.38Å
1054	L	92.4	Very high	89.5	Confident	39 Å²	39	65.3 Å²	65.3	20%	0.204	31%	0.311	C	S	.	.	H	α-helix	trans	-67.4	-42.8	178.8	-69.3	172.7	0	0	0	112.4	Y1034 Q1050 H1051 L1057 H1058	Y1034-L1054 HydrophobicContact CD1-CD1 4.4Å; Y1034-L1054 HydrophobicContact CD2-CB 3.69Å; Y1034-L1054 HydrophobicContact CE1-CD1 3.96Å; Y1034-L1054 HydrophobicContact CE2-CB 3.91Å; Y1034-L1054 HydrophobicContact CE2-CD1 4.11Å; Y1034-L1054 HydrophobicContact CG-CB 4.03Å; Q1050-L1054 HydrophobicContact CG-CD1 3.98Å; Q1050-L1054 WeakPolarHBondContact O-CG 3.44Å; Q1050-L1054 PolarHBondContact O-N 2.85Å; H1051-L1054 PolarHBondContact O-N 3.47Å; L1054-L1057 PolarHBondContact O-N 2.88Å; L1054-H1058 WeakPolarHBondContact O-CB 3.27Å; L1054-H1058 PolarHBondContact O-CD2 2.96Å; L1054-H1058 PolarHBondContact O-N 3.34Å
1055	A	93.1	Very high	90.1	Very high	0 Å²	0	63 Å²	63	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-60	-47.7	175.9	0	0	0	0	0	111.4	H1035 H1051 L1057 H1058 Y1059 F1086	H1035-A1055 HydrophobicContact CB-CB 4.45Å; H1051-A1055 VanDerWaalsContact O-CB 3.28Å; H1051-A1055 WeakPolarHBondContact O-CB 3.38Å; H1051-A1055 PolarHBondContact O-N 3.2Å; A1055-L1057 PolarHBondContact O-N 3.03Å; A1055-H1058 PolarHBondContact O-N 3.01Å; A1055-Y1059 VanDerWaalsContact O-CB 3.31Å; A1055-Y1059 WeakPolarHBondContact O-CB 3.37Å; A1055-Y1059 VanDerWaalsContact O-CD2 3.26Å; A1055-Y1059 WeakPolarHBondContact O-CD2 3.15Å; A1055-Y1059 PolarHBondContact O-N 3.15Å; A1055-F1086 HydrophobicContact CB-CE1 4.46Å; A1055-F1086 HydrophobicContact CB-CE2 4.03Å; A1055-F1086 HydrophobicContact CB-CZ 3.88Å
1056	D	91.9	Very high	90.7	Very high	80 Å²	80	56.3 Å²	56.3	43%	0.428	27%	0.267	S	S	.	.	H	α-helix	trans	-62.8	-43.1	178.6	-170.3	57.5	0	0	0	112.6	R1052 S1060 F1086	R1052-D1056 PolarHBondContact O-N 3.08Å; R1052-D1056 VanDerWaalsContact O-N 3.14Å; D1056-S1060 VanDerWaalsContact O-CB 3.24Å; D1056-S1060 WeakPolarHBondContact O-CB 3.31Å; D1056-S1060 PolarHBondContact O-N 3.42Å; D1056-S1060 PolarHBondContact O-OG 3Å; D1056-F1086 HydrophobicContact CB-CE1 3.97Å
1057	L	94.6	Very high	91	Very high	75 Å²	75	54.5 Å²	54.5	39%	0.393	26%	0.259	S	S	.	.	H	α-helix	trans	-59	-52.4	176.7	176.8	65.8	0	0	0	111.4	V1053 L1054 A1055 S1060 K1061	V1053-L1057 VanDerWaalsContact O-CB 3.29Å; V1053-L1057 WeakPolarHBondContact O-CB 3.34Å; V1053-L1057 PolarHBondContact O-N 3.38Å; L1054-L1057 PolarHBondContact O-N 2.88Å; A1055-L1057 PolarHBondContact O-N 3.03Å; L1057-S1060 PolarHBondContact O-N 3.46Å; L1057-K1061 WeakPolarHBondContact O-CG 3.46Å; L1057-K1061 PolarHBondContact O-N 3.1Å
1058	H	95.1	Very high	91.2	Very high	10 Å²	10	58 Å²	58	5%	0.046	28%	0.277	C	S	.	.	H	α-helix	trans	-70.8	-40.2	-175.1	-76.3	-59.4	0	0	0	112.3	H1027 L1030 A1031 Y1034 L1054 A1055 S1060 K1061 A1062	H1027-H1058 AromaticContact CE1-CE1 3.98Å; H1027-H1058 AromaticContact CE1-ND1 3.61Å; H1027-H1058 AromaticContact CG-ND1 3.96Å; H1027-H1058 AromaticContact ND1-CE1 3.68Å; H1027-H1058 AromaticContact ND1-ND1 3.01Å; H1027-H1058 PolarHBondContact ND1-ND1 3.47Å; H1027-H1058 WeakPolarHBondContact O-CB 3.48Å; L1030-H1058 HydrophobicContact CB-CB 4.43Å; A1031-H1058 HydrophobicContact CB-CB 3.7Å; Y1034-H1058 AromaticContact CD2-CD2 3.98Å; Y1034-H1058 AromaticContact CE2-CD2 3.88Å; L1054-H1058 WeakPolarHBondContact O-CB 3.27Å; L1054-H1058 PolarHBondContact O-CD2 2.96Å; L1054-H1058 PolarHBondContact O-N 3.34Å; A1055-H1058 PolarHBondContact O-N 3.01Å; H1058-S1060 VanDerWaalsContact C-N 3.31Å; H1058-S1060 PolarHBondContact O-N 3.33Å; H1058-K1061 PolarHBondContact O-N 3.28Å; H1058-A1062 WeakPolarHBondContact O-CB 3.42Å; H1058-A1062 PolarHBondContact O-N 3.22Å
1059	Y	95.5	Very high	91.3	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-59.7	-42.8	172.7	-90.4	-47.1	0	0	0	112	A1031 S1032 H1035 A1055 K1061 A1062 A1063 V1079 E1082 R1083 F1086	A1031-Y1059 HydrophobicContact CB-CD1 3.48Å; A1031-Y1059 VanDerWaalsContact CB-CD1 3.48Å; A1031-Y1059 HydrophobicContact CB-CD2 3.65Å; A1031-Y1059 HydrophobicContact CB-CE1 3.7Å; A1031-Y1059 HydrophobicContact CB-CE2 3.86Å; A1031-Y1059 HydrophobicContact CB-CG 3.44Å; A1031-Y1059 VanDerWaalsContact CB-CG 3.44Å; S1032-Y1059 WeakPolarHBondContact CA-OH 3.15Å; S1032-Y1059 PolarHBondContact OG-OH 3.47Å; H1035-Y1059 HydrophobicContact CB-CE2 4.11Å; H1035-Y1059 AromaticContact ND1-CE2 3.94Å; H1035-Y1059 PolarHBondContact ND1-OH 2.87Å; A1055-Y1059 VanDerWaalsContact O-CB 3.31Å; A1055-Y1059 WeakPolarHBondContact O-CB 3.37Å; A1055-Y1059 VanDerWaalsContact O-CD2 3.26Å; A1055-Y1059 WeakPolarHBondContact O-CD2 3.15Å; A1055-Y1059 PolarHBondContact O-N 3.15Å; Y1059-K1061 VanDerWaalsContact C-N 3.35Å; Y1059-A1062 PolarHBondContact O-N 3.43Å; Y1059-A1063 WeakPolarHBondContact O-CB 3.34Å; Y1059-A1063 PolarHBondContact O-N 3.1Å; Y1059-V1079 HydrophobicContact CD1-CG1 4.2Å; Y1059-E1082 HydrophobicContact CE1-CB 3.77Å; Y1059-E1082 PolarHBondContact OH-OE2 2.89Å; Y1059-R1083 VanDerWaalsContact CB-CG 3.48Å; Y1059-R1083 HydrophobicContact CD1-CG 3.65Å; Y1059-R1083 HydrophobicContact CD2-CG 4.1Å; Y1059-R1083 HydrophobicContact CE1-CG 4.43Å; Y1059-R1083 HydrophobicContact CG-CG 3.47Å; Y1059-R1083 VanDerWaalsContact CG-CG 3.47Å; Y1059-F1086 HydrophobicContact CD2-CD1 4.41Å; Y1059-F1086 HydrophobicContact CE2-CB 4.28Å; Y1059-F1086 HydrophobicContact CE2-CG 4.43Å
1060	S	93.5	Very high	90.8	Very high	31 Å²	31	59.4 Å²	59.4	22%	0.217	28%	0.28	C	S	.	.	H	α-helix	trans	-65.7	-37.5	178.6	-63.8	0	0	0	0	112.2	D1056 L1057 H1058 K1064 R1083	D1056-S1060 VanDerWaalsContact O-CB 3.24Å; D1056-S1060 WeakPolarHBondContact O-CB 3.31Å; D1056-S1060 PolarHBondContact O-N 3.42Å; D1056-S1060 PolarHBondContact O-OG 3Å; L1057-S1060 PolarHBondContact O-N 3.46Å; H1058-S1060 VanDerWaalsContact C-N 3.31Å; H1058-S1060 PolarHBondContact O-N 3.33Å; S1060-K1064 VanDerWaalsContact O-CG 3.3Å; S1060-K1064 WeakPolarHBondContact O-CG 3.38Å; S1060-K1064 PolarHBondContact O-N 3.47Å; S1060-R1083 PolarHBondContact OG-NH2 3.32Å
1061	K	94.1	Very high	90.4	Very high	92 Å²	92	61.8 Å²	61.8	40%	0.4	30%	0.296	S	S	.	.	H	α-helix	trans	-69.1	-44.9	174.1	-73	-175.5	176.6	-172.7	0	112.3	H1027 L1057 H1058 Y1059 A1063 K1064 L1065	H1027-K1061 HydrophobicContact CB-CB 4.43Å; L1057-K1061 WeakPolarHBondContact O-CG 3.46Å; L1057-K1061 PolarHBondContact O-N 3.1Å; H1058-K1061 PolarHBondContact O-N 3.28Å; Y1059-K1061 VanDerWaalsContact C-N 3.35Å; K1061-A1063 PolarHBondContact O-N 3.09Å; K1061-K1064 PolarHBondContact O-N 3.3Å; K1061-L1065 PolarHBondContact O-N 2.94Å
1062	A	94.6	Very high	90.2	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-58.1	-48.4	177.4	0	0	0	0	0	111.4	H1027 H1028 H1058 Y1059 K1064 L1065 F1066 V1079	H1027-A1062 HydrophobicContact CB-CB 3.8Å; H1028-A1062 HydrophobicContact CB-CB 4.1Å; H1058-A1062 WeakPolarHBondContact O-CB 3.42Å; H1058-A1062 PolarHBondContact O-N 3.22Å; Y1059-A1062 PolarHBondContact O-N 3.43Å; A1062-K1064 VanDerWaalsContact C-N 3.35Å; A1062-K1064 PolarHBondContact O-N 3.46Å; A1062-L1065 PolarHBondContact O-N 3.46Å; A1062-F1066 HydrophobicContact CB-CD2 4.49Å; A1062-F1066 VanDerWaalsContact O-CD2 3.25Å; A1062-F1066 WeakPolarHBondContact O-CD2 3.26Å; A1062-F1066 PolarHBondContact O-N 3.46Å; A1062-V1079 HydrophobicContact CB-CG1 4.06Å
1063	A	92.2	Very high	90.1	Very high	4 Å²	4	56.5 Å²	56.5	3%	0.033	28%	0.278	C	S	.	.	H	α-helix	trans	-60.3	-42	178.5	0	0	0	0	0	112.5	Y1059 K1061 Q1067 V1079	Y1059-A1063 WeakPolarHBondContact O-CB 3.34Å; Y1059-A1063 PolarHBondContact O-N 3.1Å; K1061-A1063 PolarHBondContact O-N 3.09Å; A1063-Q1067 VanDerWaalsContact O-CB 3.27Å; A1063-Q1067 WeakPolarHBondContact O-CB 3.45Å; A1063-Q1067 PolarHBondContact O-N 2.81Å; A1063-V1079 HydrophobicContact CB-CG1 4.1Å
1064	K	91.8	Very high	89.9	Confident	148 Å²	148	53.1 Å²	53.1	64%	0.643	26%	0.258	S	S	*	.	H	α-helix	trans	-62.7	-44.3	176.6	-75.9	176.6	-179.8	-173.7	0	112.2	S1060 K1061 A1062 Q1067 L1068	S1060-K1064 VanDerWaalsContact O-CG 3.3Å; S1060-K1064 WeakPolarHBondContact O-CG 3.38Å; S1060-K1064 PolarHBondContact O-N 3.47Å; K1061-K1064 PolarHBondContact O-N 3.3Å; A1062-K1064 VanDerWaalsContact C-N 3.35Å; A1062-K1064 PolarHBondContact O-N 3.46Å; K1064-Q1067 PolarHBondContact O-N 3.18Å; K1064-L1068 PolarHBondContact O-N 3.05Å
1065	L	91.1	Very high	89.9	Confident	25 Å²	25	53 Å²	53	13%	0.131	26%	0.256	C	S	.	.	H	α-helix	trans	-69.6	-43.7	-179.6	-70.2	170.8	0	0	0	111.9	V1009 A1023 A1024 K1061 A1062 Q1067 L1068	V1009-L1065 HydrophobicContact CG1-CD2 3.87Å; A1023-L1065 HydrophobicContact CB-CD1 3.85Å; A1024-L1065 HydrophobicContact CB-CB 3.61Å; A1024-L1065 HydrophobicContact CB-CD1 4.34Å; K1061-L1065 PolarHBondContact O-N 2.94Å; A1062-L1065 PolarHBondContact O-N 3.46Å; L1065-Q1067 PolarHBondContact O-N 3.45Å; L1065-L1068 HydrophobicContact CD2-CD1 4.39Å; L1065-L1068 WeakPolarHBondContact O-CB 3.4Å; L1065-L1068 PolarHBondContact O-N 3.44Å; L1065-L1068 VanDerWaalsContact O-N 3.08Å
1066	F	91.7	Very high	89.8	Confident	1 Å²	1	53.1 Å²	53.1	0%	0.004	26%	0.257	C	S	.	.	H	α-helix	trans	-63.9	-29.1	174.6	-77.1	-57.3	0	0	0	112.8	Y1021 A1024 H1028 A1062 L1068 L1069 A1072 E1075 L1076 V1079	Y1021-F1066 AromaticContact CD2-CE1 3.99Å; Y1021-F1066 HydrophobicContact CD2-CE1 3.99Å; Y1021-F1066 AromaticContact CE2-CE1 3.93Å; Y1021-F1066 HydrophobicContact CE2-CE1 3.93Å; A1024-F1066 HydrophobicContact CB-CD1 3.73Å; A1024-F1066 HydrophobicContact CB-CD2 3.69Å; A1024-F1066 HydrophobicContact CB-CE1 3.6Å; A1024-F1066 HydrophobicContact CB-CE2 3.56Å; A1024-F1066 HydrophobicContact CB-CG 3.76Å; A1024-F1066 HydrophobicContact CB-CZ 3.51Å; H1028-F1066 HydrophobicContact CB-CE2 4.29Å; A1062-F1066 HydrophobicContact CB-CD2 4.49Å; A1062-F1066 VanDerWaalsContact O-CD2 3.25Å; A1062-F1066 WeakPolarHBondContact O-CD2 3.26Å; A1062-F1066 PolarHBondContact O-N 3.46Å; F1066-L1068 VanDerWaalsContact C-N 3.29Å; F1066-L1068 PolarHBondContact O-N 3.21Å; F1066-L1069 HydrophobicContact CD1-CD1 4.12Å; F1066-L1069 PolarHBondContact O-N 3.38Å; F1066-A1072 HydrophobicContact CD1-CB 4.06Å; F1066-A1072 HydrophobicContact CE1-CB 4.46Å; F1066-E1075 HydrophobicContact CD1-CB 3.94Å; F1066-E1075 HydrophobicContact CE1-CB 3.67Å; F1066-E1075 HydrophobicContact CE1-CG 4.25Å; F1066-E1075 HydrophobicContact CE2-CB 4.31Å; F1066-E1075 HydrophobicContact CG-CB 4.4Å; F1066-E1075 HydrophobicContact CZ-CB 3.87Å; F1066-E1075 HydrophobicContact CZ-CG 4.47Å; F1066-L1076 HydrophobicContact CB-CB 4.01Å; F1066-L1076 HydrophobicContact CB-CD1 3.98Å; F1066-V1079 HydrophobicContact CD2-CG2 3.84Å; F1066-V1079 HydrophobicContact CE2-CG2 3.76Å
1067	Q	88.7	Confident	89.7	Confident	102 Å²	102	49.3 Å²	49.3	48%	0.477	24%	0.236	S	C	.	.	H	α-helix	trans	-68.9	-24.9	173.7	-174.1	175	8.5	0	0	113.3	A1063 K1064 L1065 L1069 L1076	A1063-Q1067 VanDerWaalsContact O-CB 3.27Å; A1063-Q1067 WeakPolarHBondContact O-CB 3.45Å; A1063-Q1067 PolarHBondContact O-N 2.81Å; K1064-Q1067 PolarHBondContact O-N 3.18Å; L1065-Q1067 PolarHBondContact O-N 3.45Å; Q1067-L1069 VanDerWaalsContact C-N 3.3Å; Q1067-L1076 HydrophobicContact CB-CD1 4.45Å; Q1067-L1076 HydrophobicContact CB-CD2 4.35Å
1068	L	87.2	Confident	89.7	Confident	117 Å²	117	49.1 Å²	49.1	61%	0.613	23%	0.231	S	C	*	.	H	α-helix	trans	-76.2	-21.4	173.8	-64.3	171.9	0	0	0	112.3	K1064 L1065 F1066	K1064-L1068 PolarHBondContact O-N 3.05Å; L1065-L1068 HydrophobicContact CD2-CD1 4.39Å; L1065-L1068 WeakPolarHBondContact O-CB 3.4Å; L1065-L1068 PolarHBondContact O-N 3.44Å; L1065-L1068 VanDerWaalsContact O-N 3.08Å; F1066-L1068 VanDerWaalsContact C-N 3.29Å; F1066-L1068 PolarHBondContact O-N 3.21Å
1069	L	84.9	Confident	89.7	Confident	16 Å²	16	48.7 Å²	48.7	8%	0.084	23%	0.228	C	C	.	.			trans	-91.5	126.3	-176.8	-63.5	169.9	0	0	0	110.4	P1017 Q1020 Y1021 F1066 Q1067 A1072	P1017-L1069 HydrophobicContact CB-CD2 4.28Å; Q1020-L1069 HydrophobicContact CB-CD1 4.42Å; Q1020-L1069 HydrophobicContact CB-CD2 3.89Å; Q1020-L1069 HydrophobicContact CB-CG 4.38Å; Y1021-L1069 HydrophobicContact CD2-CD1 3.98Å; Y1021-L1069 HydrophobicContact CG-CD1 4.39Å; F1066-L1069 HydrophobicContact CD1-CD1 4.12Å; F1066-L1069 PolarHBondContact O-N 3.38Å; Q1067-L1069 VanDerWaalsContact C-N 3.3Å; L1069-A1072 HydrophobicContact CB-CB 4.37Å
1070	R	76.1	Confident	89.5	Confident	204 Å²	204	48.9 Å²	48.9	77%	0.77	23%	0.229	S	C	*	.	S	Bend	trans	-76.2	-30.4	179	-65.8	-174.7	178.4	-172.1	0.5	112.8
1071	D	77.7	Confident	89.5	Confident	143 Å²	143	48 Å²	48	77%	0.765	22%	0.222	S	C	*	.	S	Bend	trans	-98.3	12.1	-166.5	-48	-35.6	0	0	0	113.4	P1073	D1071-P1073 VanDerWaalsContact C-CD 3.41Å
1072	A	85.3	Confident	89.5	Confident	9 Å²	9	46 Å²	46	7%	0.074	21%	0.214	C	C	.	.			trans	-128.3	46	-177.4	0	0	0	0	0	114.7	Y1021 F1066 L1069 C1074 E1075 L1076	Y1021-A1072 HydrophobicContact CD2-CB 4.17Å; Y1021-A1072 HydrophobicContact CE2-CB 3.97Å; F1066-A1072 HydrophobicContact CD1-CB 4.06Å; F1066-A1072 HydrophobicContact CE1-CB 4.46Å; L1069-A1072 HydrophobicContact CB-CB 4.37Å; A1072-C1074 PolarHBondContact O-N 2.85Å; A1072-E1075 HydrophobicContact CB-CB 4.42Å; A1072-E1075 PolarHBondContact O-N 3.3Å; A1072-L1076 PolarHBondContact O-N 3.49Å; A1072-L1076 VanDerWaalsContact O-N 3.13Å
1073	P	87.4	Confident	89.5	Confident	6 Å²	6	47.2 Å²	47.2	4%	0.039	22%	0.219	C	C	.	.	H	α-helix	trans	-69	-31.2	-175.2	29.9	-36.4	0	0	0	113.5	D1071 L1076 L1077 A1117 L1120 I1121	D1071-P1073 VanDerWaalsContact C-CD 3.41Å; P1073-L1076 PolarHBondContact O-N 3.45Å; P1073-L1077 WeakPolarHBondContact O-CB 3.42Å; P1073-L1077 PolarHBondContact O-N 3.41Å; P1073-A1117 HydrophobicContact CB-CB 4.43Å; P1073-L1120 HydrophobicContact CB-CB 4.02Å; P1073-L1120 HydrophobicContact CB-CD1 4.4Å; P1073-L1120 HydrophobicContact CG-CB 4.48Å; P1073-I1121 HydrophobicContact CB-CD1 4.16Å; P1073-I1121 HydrophobicContact CB-CG1 3.71Å; P1073-I1121 HydrophobicContact CG-CG1 3.78Å
1074	C	89.8	Confident	89.5	Confident	14 Å²	14	47 Å²	47	10%	0.095	22%	0.217	C	C	.	.	H	α-helix	trans	-64.8	-41.9	175.3	-68.9	0	0	0	0	112.1	A1072 L1077 R1078 V1152 L1155	A1072-C1074 PolarHBondContact O-N 2.85Å; C1074-L1077 PolarHBondContact O-N 3.39Å; C1074-R1078 WeakPolarHBondContact O-CB 3.29Å; C1074-R1078 PolarHBondContact O-N 3.44Å; C1074-V1152 VanDerWaalsContact SG-CG2 3.6Å; C1074-L1155 HydrophobicContact CB-CD1 4.04Å; C1074-L1155 WeakPolarHBondContact O-CD1 3.26Å
1075	E	90.8	Very high	89.5	Confident	36 Å²	36	41.8 Å²	41.8	17%	0.168	20%	0.201	C	C	.	.	H	α-helix	trans	-68.2	-41	177.8	-63.3	-57.5	161.2	0	0	111.6	Y1021 F1066 A1072 L1077 R1078 V1079	Y1021-E1075 HydrophobicContact CE2-CG 4.46Å; F1066-E1075 HydrophobicContact CD1-CB 3.94Å; F1066-E1075 HydrophobicContact CE1-CB 3.67Å; F1066-E1075 HydrophobicContact CE1-CG 4.25Å; F1066-E1075 HydrophobicContact CE2-CB 4.31Å; F1066-E1075 HydrophobicContact CG-CB 4.4Å; F1066-E1075 HydrophobicContact CZ-CB 3.87Å; F1066-E1075 HydrophobicContact CZ-CG 4.47Å; A1072-E1075 HydrophobicContact CB-CB 4.42Å; A1072-E1075 PolarHBondContact O-N 3.3Å; E1075-L1077 VanDerWaalsContact C-N 3.33Å; E1075-L1077 PolarHBondContact O-N 3.01Å; E1075-R1078 PolarHBondContact O-N 3.39Å; E1075-R1078 IonicContact OE1-CZ 2.71Å; E1075-R1078 IonicContact OE1-NH1 3.69Å; E1075-R1078 PolarHBondContact OE1-NH1 3.02Å; E1075-R1078 IonicContact OE2-CZ 3.8Å; E1075-R1078 IonicContact OE2-NH1 3.96Å; E1075-R1078 PolarHBondContact OE2-NH1 3.47Å; E1075-V1079 WeakPolarHBondContact O-CB 3.47Å; E1075-V1079 VanDerWaalsContact O-CG2 3.32Å; E1075-V1079 WeakPolarHBondContact O-CG2 3.4Å; E1075-V1079 PolarHBondContact O-N 3.23Å
1076	L	91.5	Very high	89.6	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.01	20%	0.196	C	C	.	.	H	α-helix	trans	-57.6	-47.6	171.9	-179.3	56.6	0	0	0	111	F1066 Q1067 A1072 P1073 R1078 V1079 Q1080 A1117	F1066-L1076 HydrophobicContact CB-CB 4.01Å; F1066-L1076 HydrophobicContact CB-CD1 3.98Å; Q1067-L1076 HydrophobicContact CB-CD1 4.45Å; Q1067-L1076 HydrophobicContact CB-CD2 4.35Å; A1072-L1076 PolarHBondContact O-N 3.49Å; A1072-L1076 VanDerWaalsContact O-N 3.13Å; P1073-L1076 PolarHBondContact O-N 3.45Å; L1076-R1078 PolarHBondContact O-N 2.91Å; L1076-V1079 PolarHBondContact O-N 2.81Å; L1076-Q1080 HydrophobicContact CD1-CG 4.18Å; L1076-Q1080 WeakPolarHBondContact O-CG 3.35Å; L1076-Q1080 PolarHBondContact O-N 3.01Å; L1076-A1117 HydrophobicContact CB-CB 4.4Å; L1076-A1117 HydrophobicContact CD2-CB 4.01Å; L1076-A1117 HydrophobicContact CG-CB 4.22Å
1077	L	91.2	Very high	89.5	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62.6	-42.9	179	-176.6	60	0	0	0	111.7	P1073 C1074 E1075 Q1080 L1081 T1114 A1117 F1118 L1155 F1159	P1073-L1077 WeakPolarHBondContact O-CB 3.42Å; P1073-L1077 PolarHBondContact O-N 3.41Å; C1074-L1077 PolarHBondContact O-N 3.39Å; E1075-L1077 VanDerWaalsContact C-N 3.33Å; E1075-L1077 PolarHBondContact O-N 3.01Å; L1077-Q1080 PolarHBondContact O-N 2.97Å; L1077-L1081 HydrophobicContact CD1-CD1 4.34Å; L1077-L1081 HydrophobicContact CD1-CG 4.38Å; L1077-L1081 HydrophobicContact CG-CD1 4.13Å; L1077-L1081 WeakPolarHBondContact O-CB 3.5Å; L1077-L1081 VanDerWaalsContact O-CG 3.28Å; L1077-L1081 WeakPolarHBondContact O-CG 3.35Å; L1077-L1081 PolarHBondContact O-N 2.94Å; L1077-T1114 HydrophobicContact CD1-CG2 3.88Å; L1077-A1117 HydrophobicContact CB-CB 4.38Å; L1077-F1118 HydrophobicContact CD1-CE2 3.76Å; L1077-F1118 HydrophobicContact CD1-CZ 3.81Å; L1077-F1118 HydrophobicContact CD2-CE1 3.89Å; L1077-F1118 HydrophobicContact CD2-CE2 4.45Å; L1077-F1118 HydrophobicContact CD2-CZ 3.74Å; L1077-F1118 HydrophobicContact CG-CZ 4.47Å; L1077-L1155 HydrophobicContact CB-CD1 4.45Å; L1077-L1155 HydrophobicContact CD2-CB 3.67Å; L1077-L1155 HydrophobicContact CD2-CD1 4.24Å; L1077-L1155 HydrophobicContact CG-CB 4.25Å; L1077-L1155 HydrophobicContact CG-CD1 4.49Å; L1077-F1159 HydrophobicContact CD1-CD2 4.13Å
1078	R	93.6	Very high	89.6	Confident	72 Å²	72	37.3 Å²	37.3	27%	0.272	18%	0.182	S	C	.	.	H	α-helix	trans	-58.8	-51.2	175.6	179	-179	-69.3	142.3	0.1	111.6	C1074 E1075 L1076 Q1080 L1081 E1082 E1151 L1155	C1074-R1078 WeakPolarHBondContact O-CB 3.29Å; C1074-R1078 PolarHBondContact O-N 3.44Å; E1075-R1078 PolarHBondContact O-N 3.39Å; E1075-R1078 IonicContact OE1-CZ 2.71Å; E1075-R1078 IonicContact OE1-NH1 3.69Å; E1075-R1078 PolarHBondContact OE1-NH1 3.02Å; E1075-R1078 IonicContact OE2-CZ 3.8Å; E1075-R1078 IonicContact OE2-NH1 3.96Å; E1075-R1078 PolarHBondContact OE2-NH1 3.47Å; L1076-R1078 PolarHBondContact O-N 2.91Å; R1078-Q1080 VanDerWaalsContact C-N 3.32Å; R1078-Q1080 PolarHBondContact O-N 2.92Å; R1078-L1081 PolarHBondContact O-N 2.95Å; R1078-E1082 PolarHBondContact O-N 3.02Å; R1078-E1151 IonicContact CZ-OE1 3.72Å; R1078-E1151 IonicContact NH1-OE1 2.71Å; R1078-E1151 IonicContact NH2-OE1 2.72Å; R1078-E1151 PolarHBondContact NH2-OE1 3.05Å; R1078-L1155 HydrophobicContact CB-CD2 4.21Å
1079	V	94.3	Very high	89.7	Confident	0 Å²	0	34 Å²	34	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.2	-43.4	179.5	170.5	0	0	0	0	111	H1028 Y1059 A1062 A1063 F1066 E1075 L1076 E1082 R1083	H1028-V1079 HydrophobicContact CB-CG2 3.91Å; Y1059-V1079 HydrophobicContact CD1-CG1 4.2Å; A1062-V1079 HydrophobicContact CB-CG1 4.06Å; A1063-V1079 HydrophobicContact CB-CG1 4.1Å; F1066-V1079 HydrophobicContact CD2-CG2 3.84Å; F1066-V1079 HydrophobicContact CE2-CG2 3.76Å; E1075-V1079 WeakPolarHBondContact O-CB 3.47Å; E1075-V1079 VanDerWaalsContact O-CG2 3.32Å; E1075-V1079 WeakPolarHBondContact O-CG2 3.4Å; E1075-V1079 PolarHBondContact O-N 3.23Å; L1076-V1079 PolarHBondContact O-N 2.81Å; V1079-E1082 PolarHBondContact O-N 2.97Å; V1079-R1083 VanDerWaalsContact O-CG 3.26Å; V1079-R1083 WeakPolarHBondContact O-CG 3.33Å; V1079-R1083 PolarHBondContact O-N 3.28Å
1080	Q	93.1	Very high	89.7	Confident	4 Å²	4	35.3 Å²	35.3	2%	0.019	17%	0.168	C	C	.	.	H	α-helix	trans	-67.3	-38.8	178.7	-63.5	-71.3	23.9	0	0	112.5	L1076 L1077 R1078 R1083 V1084 I1110 T1114	L1076-Q1080 HydrophobicContact CD1-CG 4.18Å; L1076-Q1080 WeakPolarHBondContact O-CG 3.35Å; L1076-Q1080 PolarHBondContact O-N 3.01Å; L1077-Q1080 PolarHBondContact O-N 2.97Å; R1078-Q1080 VanDerWaalsContact C-N 3.32Å; R1078-Q1080 PolarHBondContact O-N 2.92Å; Q1080-R1083 WeakPolarHBondContact O-CB 3.16Å; Q1080-R1083 PolarHBondContact O-N 3.47Å; Q1080-V1084 WeakPolarHBondContact O-CG2 3.48Å; Q1080-V1084 PolarHBondContact O-N 3.22Å; Q1080-I1110 HydrophobicContact CB-CG2 4.26Å; Q1080-T1114 HydrophobicContact CB-CG2 3.53Å; Q1080-T1114 HydrophobicContact CG-CG2 4Å
1081	L	93.4	Very high	90.3	Very high	13 Å²	13	26.4 Å²	26.4	7%	0.068	14%	0.135	C	C	.	.	H	α-helix	trans	-65.5	-39.4	175.3	-74.5	173.9	0	0	0	112.3	L1077 R1078 R1083 V1084 A1085 M1111 L1155 I1158 F1159	L1077-L1081 HydrophobicContact CD1-CD1 4.34Å; L1077-L1081 HydrophobicContact CD1-CG 4.38Å; L1077-L1081 HydrophobicContact CG-CD1 4.13Å; L1077-L1081 WeakPolarHBondContact O-CB 3.5Å; L1077-L1081 VanDerWaalsContact O-CG 3.28Å; L1077-L1081 WeakPolarHBondContact O-CG 3.35Å; L1077-L1081 PolarHBondContact O-N 2.94Å; R1078-L1081 PolarHBondContact O-N 2.95Å; L1081-R1083 VanDerWaalsContact C-N 3.34Å; L1081-V1084 WeakPolarHBondContact O-CB 3.33Å; L1081-V1084 PolarHBondContact O-N 2.88Å; L1081-A1085 PolarHBondContact O-N 2.94Å; L1081-M1111 HydrophobicContact CD2-SD 4.22Å; L1081-L1155 HydrophobicContact CD1-CB 4.47Å; L1081-L1155 HydrophobicContact CD1-CD2 4.11Å; L1081-I1158 HydrophobicContact CD1-CB 4.34Å; L1081-I1158 HydrophobicContact CD1-CG2 4.05Å; L1081-I1158 HydrophobicContact CD2-CG2 4.42Å; L1081-F1159 HydrophobicContact CD1-CB 4.43Å; L1081-F1159 HydrophobicContact CD2-CB 4.06Å; L1081-F1159 HydrophobicContact CD2-CD2 3.85Å; L1081-F1159 HydrophobicContact CD2-CG 4.42Å
1082	E	94.1	Very high	90.6	Very high	51 Å²	51	24.2 Å²	24.2	24%	0.238	13%	0.128	C	C	.	.	H	α-helix	trans	-65.8	-36.7	173.4	-76.3	-173.9	-147.4	0	0	112.5	H1028 S1032 Y1059 R1078 V1079 V1084 A1085 F1086	H1028-E1082 IonicContact CD2-OE2 3.31Å; H1028-E1082 IonicContact CE1-OE1 2.67Å; H1028-E1082 VanDerWaalsContact NE2-CD 3.3Å; H1028-E1082 IonicContact NE2-OE1 3.39Å; H1028-E1082 PolarHBondContact NE2-OE1 2.95Å; H1028-E1082 IonicContact NE2-OE2 2.72Å; H1028-E1082 PolarHBondContact NE2-OE2 3.42Å; S1032-E1082 PolarHBondContact OG-OE2 2.94Å; Y1059-E1082 HydrophobicContact CE1-CB 3.77Å; Y1059-E1082 PolarHBondContact OH-OE2 2.89Å; R1078-E1082 PolarHBondContact O-N 3.02Å; V1079-E1082 PolarHBondContact O-N 2.97Å; E1082-V1084 VanDerWaalsContact C-N 3.3Å; E1082-V1084 PolarHBondContact O-N 3.24Å; E1082-A1085 WeakPolarHBondContact O-CB 3.4Å; E1082-A1085 PolarHBondContact O-N 3.28Å; E1082-F1086 WeakPolarHBondContact O-CB 3.45Å; E1082-F1086 PolarHBondContact O-N 2.7Å
1083	R	93.5	Very high	90.3	Very high	24 Å²	24	26.7 Å²	26.7	9%	0.091	14%	0.144	C	C	.	.	H	α-helix	trans	-62.3	-37.8	171.8	-73.7	176.3	78.8	-145.6	2.3	112.5	Y1059 S1060 V1079 Q1080 L1081 F1086 A1087 I1110	Y1059-R1083 VanDerWaalsContact CB-CG 3.48Å; Y1059-R1083 HydrophobicContact CD1-CG 3.65Å; Y1059-R1083 HydrophobicContact CD2-CG 4.1Å; Y1059-R1083 HydrophobicContact CE1-CG 4.43Å; Y1059-R1083 HydrophobicContact CG-CG 3.47Å; Y1059-R1083 VanDerWaalsContact CG-CG 3.47Å; S1060-R1083 PolarHBondContact OG-NH2 3.32Å; V1079-R1083 VanDerWaalsContact O-CG 3.26Å; V1079-R1083 WeakPolarHBondContact O-CG 3.33Å; V1079-R1083 PolarHBondContact O-N 3.28Å; Q1080-R1083 WeakPolarHBondContact O-CB 3.16Å; Q1080-R1083 PolarHBondContact O-N 3.47Å; L1081-R1083 VanDerWaalsContact C-N 3.34Å; R1083-F1086 WeakPolarHBondContact O-CB 3.49Å; R1083-F1086 PolarHBondContact O-N 3.28Å; R1083-A1087 PolarHBondContact O-N 3.38Å; R1083-I1110 HydrophobicContact CB-CD1 4.29Å; R1083-I1110 HydrophobicContact CB-CG2 4.13Å
1084	V	93.3	Very high	90.2	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-65	-44.8	173.4	168.2	0	0	0	0	110.6	Q1080 L1081 E1082 F1086 A1087 E1088 I1110 M1111 L1166	Q1080-V1084 WeakPolarHBondContact O-CG2 3.48Å; Q1080-V1084 PolarHBondContact O-N 3.22Å; L1081-V1084 WeakPolarHBondContact O-CB 3.33Å; L1081-V1084 PolarHBondContact O-N 2.88Å; E1082-V1084 VanDerWaalsContact C-N 3.3Å; E1082-V1084 PolarHBondContact O-N 3.24Å; V1084-F1086 VanDerWaalsContact C-N 3.28Å; V1084-F1086 PolarHBondContact O-N 3.35Å; V1084-A1087 PolarHBondContact O-N 2.95Å; V1084-A1087 VanDerWaalsContact O-N 3.14Å; V1084-E1088 WeakPolarHBondContact O-CG 3.37Å; V1084-E1088 PolarHBondContact O-N 3.23Å; V1084-I1110 HydrophobicContact CG2-CB 4.04Å; V1084-I1110 HydrophobicContact CG2-CG2 3.68Å; V1084-M1111 HydrophobicContact CB-SD 4.4Å; V1084-M1111 HydrophobicContact CG1-SD 4.26Å; V1084-M1111 HydrophobicContact CG2-CG 3.82Å; V1084-M1111 HydrophobicContact CG2-SD 3.68Å; V1084-L1166 HydrophobicContact CG1-CD1 3.76Å
1085	A	91.9	Very high	89.6	Confident	38 Å²	38	35.7 Å²	35.7	31%	0.314	19%	0.19	S	C	.	.	H	α-helix	trans	-60.3	-38.1	174.5	0	0	0	0	0	112.2	L1081 E1082 E1088 F1089	L1081-A1085 PolarHBondContact O-N 2.94Å; E1082-A1085 WeakPolarHBondContact O-CB 3.4Å; E1082-A1085 PolarHBondContact O-N 3.28Å; A1085-E1088 PolarHBondContact O-N 2.87Å; A1085-F1089 PolarHBondContact O-N 3.08Å
1086	F	91.9	Very high	89.3	Confident	5 Å²	5	37.2 Å²	37.2	2%	0.022	20%	0.204	C	C	.	.	H	α-helix	trans	-64	-42.1	173.7	177.4	-121.8	0	0	0	112.3	H1035 L1038 R1052 A1055 D1056 Y1059 E1082 R1083 V1084 F1089 Q1090	H1035-F1086 HydrophobicContact CB-CD2 4.49Å; H1035-F1086 AromaticContact CD2-CD2 3.62Å; H1035-F1086 AromaticContact CG-CD2 3.89Å; H1035-F1086 AromaticContact NE2-CD2 3.84Å; L1038-F1086 HydrophobicContact CD2-CD2 4.48Å; L1038-F1086 HydrophobicContact CD2-CE2 3.65Å; R1052-F1086 HydrophobicContact CG-CZ 3.99Å; A1055-F1086 HydrophobicContact CB-CE1 4.46Å; A1055-F1086 HydrophobicContact CB-CE2 4.03Å; A1055-F1086 HydrophobicContact CB-CZ 3.88Å; D1056-F1086 HydrophobicContact CB-CE1 3.97Å; Y1059-F1086 HydrophobicContact CD2-CD1 4.41Å; Y1059-F1086 HydrophobicContact CE2-CB 4.28Å; Y1059-F1086 HydrophobicContact CE2-CG 4.43Å; E1082-F1086 WeakPolarHBondContact O-CB 3.45Å; E1082-F1086 PolarHBondContact O-N 2.7Å; R1083-F1086 WeakPolarHBondContact O-CB 3.49Å; R1083-F1086 PolarHBondContact O-N 3.28Å; V1084-F1086 VanDerWaalsContact C-N 3.28Å; V1084-F1086 PolarHBondContact O-N 3.35Å; F1086-F1089 PolarHBondContact O-N 3.48Å; F1086-Q1090 VanDerWaalsContact CD1-NE2 3.29Å; F1086-Q1090 WeakPolarHBondContact O-CG 3.49Å; F1086-Q1090 PolarHBondContact O-N 2.96Å
1087	A	90.4	Very high	88.7	Confident	11 Å²	11	40.4 Å²	40.4	9%	0.091	22%	0.221	C	C	.	.	H	α-helix	trans	-65.5	-39.1	174.2	0	0	0	0	0	112.2	R1083 V1084 F1089 Q1090 M1091 T1103 A1107	R1083-A1087 PolarHBondContact O-N 3.38Å; V1084-A1087 PolarHBondContact O-N 2.95Å; V1084-A1087 VanDerWaalsContact O-N 3.14Å; A1087-F1089 VanDerWaalsContact C-N 3.35Å; A1087-F1089 PolarHBondContact O-N 3.37Å; A1087-Q1090 PolarHBondContact O-N 3.47Å; A1087-M1091 WeakPolarHBondContact O-CB 3.47Å; A1087-M1091 PolarHBondContact O-N 3.36Å; A1087-T1103 HydrophobicContact CB-CG2 4.3Å; A1087-T1103 VanDerWaalsContact O-CG2 3.29Å; A1087-T1103 WeakPolarHBondContact O-CG2 3.49Å; A1087-A1107 HydrophobicContact CB-CB 3.94Å
1088	E	90.3	Very high	88.2	Confident	19 Å²	19	45.8 Å²	45.8	9%	0.089	25%	0.254	C	S	.	.	H	α-helix	trans	-59.5	-44.4	173.3	-73.5	179.6	178.6	0	0	111.3	V1084 A1085 Q1090 M1091 T1092 R1162 F1165 L1166	V1084-E1088 WeakPolarHBondContact O-CG 3.37Å; V1084-E1088 PolarHBondContact O-N 3.23Å; A1085-E1088 PolarHBondContact O-N 2.87Å; E1088-Q1090 PolarHBondContact O-N 3.43Å; E1088-M1091 WeakPolarHBondContact O-CB 3.36Å; E1088-M1091 PolarHBondContact O-N 3.27Å; E1088-T1092 PolarHBondContact O-N 3.03Å; E1088-T1092 PolarHBondContact O-OG1 3.48Å; E1088-R1162 WeakPolarHBondContact OE1-CD 3.42Å; E1088-R1162 IonicContact OE1-NH1 2.95Å; E1088-R1162 IonicContact OE2-CZ 3.85Å; E1088-R1162 IonicContact OE2-NH1 2.82Å; E1088-R1162 PolarHBondContact OE2-NH1 3.22Å; E1088-F1165 HydrophobicContact CG-CE1 4.38Å; E1088-F1165 WeakPolarHBondContact OE1-CD1 3.44Å; E1088-L1166 HydrophobicContact CG-CD2 4.08Å
1089	F	88.9	Confident	87.6	Confident	46 Å²	46	43.2 Å²	43.2	20%	0.202	25%	0.25	C	C	.	.	H	α-helix	trans	-64.7	-37	176.4	-179.6	-99.4	0	0	0	113	L1038 R1039 A1085 F1086 A1087 T1092 S1093	L1038-F1089 HydrophobicContact CD2-CD1 4.2Å; L1038-F1089 HydrophobicContact CD2-CE1 3.94Å; L1038-F1089 HydrophobicContact CG-CE1 4.01Å; R1039-F1089 HydrophobicContact CB-CE2 4.42Å; R1039-F1089 HydrophobicContact CB-CZ 4.35Å; R1039-F1089 HydrophobicContact CG-CE2 4Å; R1039-F1089 HydrophobicContact CG-CZ 4.37Å; A1085-F1089 PolarHBondContact O-N 3.08Å; F1086-F1089 PolarHBondContact O-N 3.48Å; A1087-F1089 VanDerWaalsContact C-N 3.35Å; A1087-F1089 PolarHBondContact O-N 3.37Å; F1089-T1092 PolarHBondContact O-OG1 3.28Å; F1089-S1093 PolarHBondContact O-N 3.22Å; F1089-S1093 PolarHBondContact O-OG 3.07Å
1090	Q	86.4	Confident	87.1	Confident	44 Å²	44	45.8 Å²	45.8	21%	0.206	26%	0.261	C	S	.	.	H	α-helix	trans	-67	-39.8	173.1	-72	-176.6	56.7	0	0	111.8	F1086 A1087 E1088 S1093 Q1094 T1103	F1086-Q1090 VanDerWaalsContact CD1-NE2 3.29Å; F1086-Q1090 WeakPolarHBondContact O-CG 3.49Å; F1086-Q1090 PolarHBondContact O-N 2.96Å; A1087-Q1090 PolarHBondContact O-N 3.47Å; E1088-Q1090 PolarHBondContact O-N 3.43Å; Q1090-S1093 PolarHBondContact O-N 3.15Å; Q1090-Q1094 WeakPolarHBondContact O-CG 3.21Å; Q1090-Q1094 PolarHBondContact O-N 3.01Å; Q1090-T1103 HydrophobicContact CB-CG2 4.27Å
1091	M	86.7	Confident	86.7	Confident	17 Å²	17	47.2 Å²	47.2	8%	0.084	27%	0.269	C	S	.	.	H	α-helix	trans	-63.5	-40.7	179	-177.5	-172.1	63.5	0	0	111.8	A1087 E1088 S1093 Q1094 K1100 T1103 L1104 F1165	A1087-M1091 WeakPolarHBondContact O-CB 3.47Å; A1087-M1091 PolarHBondContact O-N 3.36Å; E1088-M1091 WeakPolarHBondContact O-CB 3.36Å; E1088-M1091 PolarHBondContact O-N 3.27Å; M1091-S1093 VanDerWaalsContact C-N 3.26Å; M1091-S1093 PolarHBondContact O-N 3.35Å; M1091-Q1094 PolarHBondContact O-N 3.25Å; M1091-K1100 HydrophobicContact CG-CB 3.98Å; M1091-K1100 HydrophobicContact CG-CG 3.88Å; M1091-T1103 HydrophobicContact CB-CG2 4.01Å; M1091-L1104 HydrophobicContact SD-CB 4.14Å; M1091-L1104 HydrophobicContact SD-CD1 3.97Å; M1091-F1165 HydrophobicContact CE-CE1 4.45Å
1092	T	84.3	Confident	86.3	Confident	98 Å²	98	54.7 Å²	54.7	60%	0.601	30%	0.3	S	S	*	.	H	α-helix	trans	-65.9	-30.2	176.8	53	0	0	0	0	112.4	E1088 F1089 Q1094	E1088-T1092 PolarHBondContact O-N 3.03Å; E1088-T1092 PolarHBondContact O-OG1 3.48Å; F1089-T1092 PolarHBondContact O-OG1 3.28Å; T1092-Q1094 VanDerWaalsContact C-N 3.28Å; T1092-Q1094 PolarHBondContact O-N 2.99Å
1093	S	79.5	Confident	86	Confident	61 Å²	61	53.4 Å²	53.4	43%	0.427	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-8.6	177.4	-57.5	0	0	0	0	114	F1089 Q1090 M1091	F1089-S1093 PolarHBondContact O-N 3.22Å; F1089-S1093 PolarHBondContact O-OG 3.07Å; Q1090-S1093 PolarHBondContact O-N 3.15Å; M1091-S1093 VanDerWaalsContact C-N 3.26Å; M1091-S1093 PolarHBondContact O-N 3.35Å
1094	Q	84.8	Confident	85.6	Confident	49 Å²	49	52.3 Å²	52.3	23%	0.229	29%	0.292	C	S	.	.			trans	-92.9	143.9	-179.2	-71.3	169	8.6	0	0	111.8	Q1090 M1091 T1092 G1099 K1100 T1103	Q1090-Q1094 WeakPolarHBondContact O-CG 3.21Å; Q1090-Q1094 PolarHBondContact O-N 3.01Å; M1091-Q1094 PolarHBondContact O-N 3.25Å; T1092-Q1094 VanDerWaalsContact C-N 3.28Å; T1092-Q1094 PolarHBondContact O-N 2.99Å; Q1094-G1099 PolarHBondContact OE1-O 3.47Å; Q1094-K1100 HydrophobicContact CB-CG 4.16Å; Q1094-K1100 WeakPolarHBondContact O-CE 3.34Å; Q1094-K1100 PolarHBondContact O-NZ 2.89Å; Q1094-K1100 VanDerWaalsContact OE1-N 3.12Å; Q1094-T1103 PolarHBondContact NE2-OG1 2.63Å; Q1094-T1103 PolarHBondContact OE1-OG1 3.21Å; Q1094-T1103 VanDerWaalsContact OE1-OG1 3.05Å
1095	N	78.3	Confident	85.3	Confident	160 Å²	160	56 Å²	56	86%	0.856	32%	0.318	S	S	*	.			trans	-98.5	-20.2	177.6	-68.8	-26.1	0	0	0	113.5
1096	S	84.4	Confident	85.1	Confident	68 Å²	68	55.8 Å²	55.8	48%	0.476	32%	0.319	S	S	.	.			trans	-91.9	134.3	-177.1	68.3	0	0	0	0	112.7	V1098 G1099 K1100	S1096-V1098 VanDerWaalsContact C-N 3.28Å; S1096-V1098 PolarHBondContact O-N 2.93Å; S1096-G1099 PolarHBondContact O-N 3.28Å; S1096-G1099 PolarHBondContact OG-N 3Å; S1096-K1100 WeakPolarHBondContact O-CG 3.24Å; S1096-K1100 PolarHBondContact O-N 3.49Å
1097	N	79.4	Confident	85.1	Confident	68 Å²	68	55.6 Å²	55.6	36%	0.364	32%	0.319	S	S	.	.	H	α-helix	trans	-64.4	-32.7	177.4	-73.8	-13.5	0	0	0	112.6	K1100 L1101	N1097-K1100 PolarHBondContact O-N 3.37Å; N1097-L1101 WeakPolarHBondContact O-CB 3.38Å; N1097-L1101 WeakPolarHBondContact O-CG 3.39Å; N1097-L1101 PolarHBondContact O-N 3.22Å
1098	V	80.5	Confident	85.1	Confident	114 Å²	114	56 Å²	56	69%	0.691	32%	0.319	S	S	*	.	H	α-helix	trans	-68.1	-41.7	176.2	179.6	0	0	0	0	111.2	S1096 L1101 K1102	S1096-V1098 VanDerWaalsContact C-N 3.28Å; S1096-V1098 PolarHBondContact O-N 2.93Å; V1098-L1101 PolarHBondContact O-N 3.46Å; V1098-K1102 PolarHBondContact O-N 3.5Å
1099	G	81.1	Confident	85	Confident	17 Å²	17	57.8 Å²	57.8	18%	0.175	33%	0.329	C	S	.	.	H	α-helix	trans	-63.7	-43.3	174.1	0	0	0	0	0	112.1	Q1094 S1096 L1101 K1102 T1103	Q1094-G1099 PolarHBondContact OE1-O 3.47Å; S1096-G1099 PolarHBondContact O-N 3.28Å; S1096-G1099 PolarHBondContact OG-N 3Å; G1099-L1101 PolarHBondContact O-N 3.36Å; G1099-K1102 PolarHBondContact O-N 3.47Å; G1099-T1103 PolarHBondContact O-N 3.25Å; G1099-T1103 PolarHBondContact O-OG1 3.36Å
1100	K	83.9	Confident	85.1	Confident	55 Å²	55	56.5 Å²	56.5	24%	0.239	32%	0.324	C	S	.	.	H	α-helix	trans	-60.8	-44.5	176.4	-72	-179.2	-176.4	179.7	0	111.9	M1091 Q1094 S1096 N1097 T1103 L1104 L1173	M1091-K1100 HydrophobicContact CG-CB 3.98Å; M1091-K1100 HydrophobicContact CG-CG 3.88Å; Q1094-K1100 HydrophobicContact CB-CG 4.16Å; Q1094-K1100 WeakPolarHBondContact O-CE 3.34Å; Q1094-K1100 PolarHBondContact O-NZ 2.89Å; Q1094-K1100 VanDerWaalsContact OE1-N 3.12Å; S1096-K1100 WeakPolarHBondContact O-CG 3.24Å; S1096-K1100 PolarHBondContact O-N 3.49Å; N1097-K1100 PolarHBondContact O-N 3.37Å; K1100-T1103 PolarHBondContact O-N 2.86Å; K1100-L1104 WeakPolarHBondContact O-CB 3.37Å; K1100-L1104 PolarHBondContact O-N 3.32Å; K1100-L1173 HydrophobicContact CB-CD1 3.95Å
1101	L	83.3	Confident	85.4	Confident	34 Å²	34	54.4 Å²	54.4	18%	0.178	32%	0.315	C	S	.	.	H	α-helix	trans	-61.3	-43.2	175.6	-79.2	171.1	0	0	0	112	N1097 V1098 G1099 L1104 S1105 L1173 L1174	N1097-L1101 WeakPolarHBondContact O-CB 3.38Å; N1097-L1101 WeakPolarHBondContact O-CG 3.39Å; N1097-L1101 PolarHBondContact O-N 3.22Å; V1098-L1101 PolarHBondContact O-N 3.46Å; G1099-L1101 PolarHBondContact O-N 3.36Å; L1101-L1104 PolarHBondContact O-N 3.23Å; L1101-S1105 WeakPolarHBondContact O-CB 3.12Å; L1101-S1105 PolarHBondContact O-N 2.96Å; L1101-L1173 HydrophobicContact CD2-CB 3.52Å; L1101-L1173 HydrophobicContact CD2-CD1 4.2Å; L1101-L1173 HydrophobicContact CG-CB 4.01Å; L1101-L1173 HydrophobicContact CG-CD1 4.35Å; L1101-L1174 HydrophobicContact CD1-CD2 4.4Å; L1101-L1174 HydrophobicContact CD2-CD2 3.98Å; L1101-L1174 HydrophobicContact CD2-CG 3.96Å
1102	K	85.6	Confident	85.6	Confident	169 Å²	169	54.7 Å²	54.7	74%	0.735	32%	0.317	S	S	*	.	H	α-helix	trans	-62.6	-44.5	176.6	-173.1	176.4	-178.5	176	0	112.4	V1098 G1099 S1105 G1106	V1098-K1102 PolarHBondContact O-N 3.5Å; G1099-K1102 PolarHBondContact O-N 3.47Å; K1102-S1105 PolarHBondContact O-N 3.47Å; K1102-G1106 PolarHBondContact O-N 2.9Å
1103	T	86.8	Confident	85.8	Confident	24 Å²	24	56.3 Å²	56.3	15%	0.147	31%	0.312	C	S	.	.	H	α-helix	trans	-65.9	-40	178.2	-50.6	0	0	0	0	111.3	A1087 Q1090 M1091 Q1094 G1099 K1100 G1106 A1107	A1087-T1103 HydrophobicContact CB-CG2 4.3Å; A1087-T1103 VanDerWaalsContact O-CG2 3.29Å; A1087-T1103 WeakPolarHBondContact O-CG2 3.49Å; Q1090-T1103 HydrophobicContact CB-CG2 4.27Å; M1091-T1103 HydrophobicContact CB-CG2 4.01Å; Q1094-T1103 PolarHBondContact NE2-OG1 2.63Å; Q1094-T1103 PolarHBondContact OE1-OG1 3.21Å; Q1094-T1103 VanDerWaalsContact OE1-OG1 3.05Å; G1099-T1103 PolarHBondContact O-N 3.25Å; G1099-T1103 PolarHBondContact O-OG1 3.36Å; K1100-T1103 PolarHBondContact O-N 2.86Å; T1103-G1106 PolarHBondContact O-N 2.84Å; T1103-A1107 PolarHBondContact O-N 2.84Å
1104	L	87	Confident	86.3	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.01	29%	0.292	C	S	.	.	H	α-helix	trans	-68.2	-39.7	177.4	-172.9	146	0	0	0	112.3	M1091 K1100 L1101 G1106 A1107 L1108 Q1169 S1170	M1091-L1104 HydrophobicContact SD-CB 4.14Å; M1091-L1104 HydrophobicContact SD-CD1 3.97Å; K1100-L1104 WeakPolarHBondContact O-CB 3.37Å; K1100-L1104 PolarHBondContact O-N 3.32Å; L1101-L1104 PolarHBondContact O-N 3.23Å; L1104-G1106 VanDerWaalsContact C-N 3.3Å; L1104-G1106 PolarHBondContact O-N 2.91Å; L1104-A1107 PolarHBondContact O-N 3.03Å; L1104-L1108 HydrophobicContact CD2-CD1 3.75Å; L1104-L1108 HydrophobicContact CD2-CG 4.31Å; L1104-L1108 PolarHBondContact O-N 3.44Å; L1104-Q1169 HydrophobicContact CD1-CB 3.54Å; L1104-S1170 WeakPolarHBondContact CD2-OG 3.45Å
1105	S	86.1	Confident	86.5	Confident	78 Å²	78	53.4 Å²	53.4	55%	0.545	29%	0.292	S	S	.	.	H	α-helix	trans	-60.9	-41.7	172	-170.3	0	0	0	0	111.1	L1101 K1102 L1108 D1109	L1101-S1105 WeakPolarHBondContact O-CB 3.12Å; L1101-S1105 PolarHBondContact O-N 2.96Å; K1102-S1105 PolarHBondContact O-N 3.47Å; S1105-L1108 PolarHBondContact O-N 2.92Å; S1105-D1109 PolarHBondContact O-N 2.9Å
1106	G	88.4	Confident	86.9	Confident	33 Å²	33	49 Å²	49	34%	0.34	27%	0.266	S	S	.	.	H	α-helix	trans	-63.5	-39.6	173.4	0	0	0	0	0	113.1	K1102 T1103 L1104 D1109 I1110	K1102-G1106 PolarHBondContact O-N 2.9Å; T1103-G1106 PolarHBondContact O-N 2.84Å; L1104-G1106 VanDerWaalsContact C-N 3.3Å; L1104-G1106 PolarHBondContact O-N 2.91Å; G1106-D1109 PolarHBondContact O-N 3.48Å; G1106-I1110 VanDerWaalsContact O-CG1 3.31Å; G1106-I1110 WeakPolarHBondContact O-CG1 3.38Å; G1106-I1110 PolarHBondContact O-N 3Å
1107	A	90.6	Very high	87.2	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.008	24%	0.243	C	C	.	.	H	α-helix	trans	-65.4	-40.5	175.8	0	0	0	0	0	112.3	A1087 T1103 L1104 I1110 M1111 L1166	A1087-A1107 HydrophobicContact CB-CB 3.94Å; T1103-A1107 PolarHBondContact O-N 2.84Å; L1104-A1107 PolarHBondContact O-N 3.03Å; A1107-I1110 PolarHBondContact O-N 2.94Å; A1107-M1111 WeakPolarHBondContact O-CG 3.25Å; A1107-M1111 PolarHBondContact O-N 3.22Å; A1107-L1166 HydrophobicContact CB-CD1 4.01Å; A1107-L1166 HydrophobicContact CB-CD2 3.97Å
1108	L	90.2	Very high	87.8	Confident	19 Å²	19	42.5 Å²	42.5	10%	0.099	23%	0.226	C	C	.	.	H	α-helix	trans	-64.9	-38.1	173.8	-73.6	172.7	0	0	0	112	L1104 S1105 I1110 M1111 V1112 L1163 L1166 L1167	L1104-L1108 HydrophobicContact CD2-CD1 3.75Å; L1104-L1108 HydrophobicContact CD2-CG 4.31Å; L1104-L1108 PolarHBondContact O-N 3.44Å; S1105-L1108 PolarHBondContact O-N 2.92Å; L1108-I1110 VanDerWaalsContact C-N 3.34Å; L1108-M1111 WeakPolarHBondContact O-CB 3.45Å; L1108-M1111 PolarHBondContact O-N 3.46Å; L1108-V1112 WeakPolarHBondContact O-CG2 3.42Å; L1108-V1112 PolarHBondContact O-N 3.33Å; L1108-L1163 HydrophobicContact CD2-CD1 4.11Å; L1108-L1166 HydrophobicContact CD2-CB 3.8Å; L1108-L1166 HydrophobicContact CD2-CD1 4.28Å; L1108-L1166 HydrophobicContact CG-CB 4.36Å; L1108-L1167 HydrophobicContact CD2-CD2 4.06Å; L1108-L1167 HydrophobicContact CD2-CG 4.32Å
1109	D	89.5	Confident	88.2	Confident	56 Å²	56	40.8 Å²	40.8	30%	0.299	21%	0.21	S	C	.	.	H	α-helix	trans	-63.3	-39.4	173.5	-175.1	56.7	0	0	0	111.9	S1105 G1106 M1111 V1112 R1113	S1105-D1109 PolarHBondContact O-N 2.9Å; G1106-D1109 PolarHBondContact O-N 3.48Å; D1109-M1111 VanDerWaalsContact C-N 3.33Å; D1109-M1111 PolarHBondContact O-N 2.91Å; D1109-V1112 PolarHBondContact O-N 3.03Å; D1109-R1113 WeakPolarHBondContact O-CG 3.41Å; D1109-R1113 PolarHBondContact O-N 3.04Å; D1109-R1113 VanDerWaalsContact O-N 3.1Å; D1109-R1113 IonicContact OD2-CZ 3.75Å; D1109-R1113 IonicContact OD2-NE 2.73Å; D1109-R1113 PolarHBondContact OD2-NE 3.41Å; D1109-R1113 IonicContact OD2-NH2 3.34Å; D1109-R1113 PolarHBondContact OD2-NH2 3.31Å
1110	I	91.1	Very high	88.5	Confident	20 Å²	20	41.7 Å²	41.7	10%	0.103	21%	0.211	C	C	.	.	H	α-helix	trans	-62.6	-40.9	172.5	-65.4	166.6	0	0	0	111.2	Q1080 R1083 V1084 G1106 A1107 L1108 V1112 R1113	Q1080-I1110 HydrophobicContact CB-CG2 4.26Å; R1083-I1110 HydrophobicContact CB-CD1 4.29Å; R1083-I1110 HydrophobicContact CB-CG2 4.13Å; V1084-I1110 HydrophobicContact CG2-CB 4.04Å; V1084-I1110 HydrophobicContact CG2-CG2 3.68Å; G1106-I1110 VanDerWaalsContact O-CG1 3.31Å; G1106-I1110 WeakPolarHBondContact O-CG1 3.38Å; G1106-I1110 PolarHBondContact O-N 3Å; A1107-I1110 PolarHBondContact O-N 2.94Å; L1108-I1110 VanDerWaalsContact C-N 3.34Å; I1110-V1112 VanDerWaalsContact C-N 3.34Å; I1110-V1112 PolarHBondContact O-N 3.31Å; I1110-R1113 PolarHBondContact O-N 2.95Å
1111	M	91.5	Very high	88.7	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62.9	-39.2	175.4	-67.5	-71.1	-81	0	0	111.8	L1081 V1084 A1107 L1108 D1109 R1113 T1114 F1159 R1162 L1163 L1166 L1223	L1081-M1111 HydrophobicContact CD2-SD 4.22Å; V1084-M1111 HydrophobicContact CB-SD 4.4Å; V1084-M1111 HydrophobicContact CG1-SD 4.26Å; V1084-M1111 HydrophobicContact CG2-CG 3.82Å; V1084-M1111 HydrophobicContact CG2-SD 3.68Å; A1107-M1111 WeakPolarHBondContact O-CG 3.25Å; A1107-M1111 PolarHBondContact O-N 3.22Å; L1108-M1111 WeakPolarHBondContact O-CB 3.45Å; L1108-M1111 PolarHBondContact O-N 3.46Å; D1109-M1111 VanDerWaalsContact C-N 3.33Å; D1109-M1111 PolarHBondContact O-N 2.91Å; M1111-R1113 VanDerWaalsContact C-N 3.3Å; M1111-R1113 PolarHBondContact O-N 2.72Å; M1111-T1114 PolarHBondContact O-N 2.95Å; M1111-T1114 PolarHBondContact O-OG1 3.16Å; M1111-F1159 HydrophobicContact CB-CE2 4.36Å; M1111-F1159 HydrophobicContact CE-CD1 4.3Å; M1111-F1159 HydrophobicContact CE-CD2 3.5Å; M1111-F1159 VanDerWaalsContact CE-CD2 3.5Å; M1111-F1159 HydrophobicContact CE-CE1 4.12Å; M1111-F1159 HydrophobicContact CE-CE2 3.26Å; M1111-F1159 HydrophobicContact CE-CG 4Å; M1111-F1159 HydrophobicContact CE-CZ 3.61Å; M1111-F1159 HydrophobicContact SD-CD2 3.94Å; M1111-F1159 HydrophobicContact SD-CE2 3.64Å; M1111-F1159 HydrophobicContact SD-CZ 4.42Å; M1111-R1162 HydrophobicContact CE-CB 4.41Å; M1111-L1163 HydrophobicContact CB-CD1 4.37Å; M1111-L1163 HydrophobicContact CE-CB 3.47Å; M1111-L1163 VanDerWaalsContact CE-CB 3.47Å; M1111-L1163 HydrophobicContact CE-CD1 3.98Å; M1111-L1163 HydrophobicContact CE-CG 4.23Å; M1111-L1166 HydrophobicContact CG-CD1 3.79Å; M1111-L1223 WeakPolarHBondContact O-CD2 3.3Å
1112	V	90.7	Very high	88.9	Confident	22 Å²	22	40.2 Å²	40.2	13%	0.133	20%	0.204	C	C	.	.	H	α-helix	trans	-62.3	-39.2	174.8	170.8	0	0	0	0	111.2	L1108 D1109 I1110 T1114 E1115 L1226 A1227	L1108-V1112 WeakPolarHBondContact O-CG2 3.42Å; L1108-V1112 PolarHBondContact O-N 3.33Å; D1109-V1112 PolarHBondContact O-N 3.03Å; I1110-V1112 VanDerWaalsContact C-N 3.34Å; I1110-V1112 PolarHBondContact O-N 3.31Å; V1112-T1114 PolarHBondContact O-N 3.09Å; V1112-E1115 VanDerWaalsContact O-CB 3.22Å; V1112-E1115 WeakPolarHBondContact O-CB 3.31Å; V1112-E1115 PolarHBondContact O-N 3.19Å; V1112-L1226 HydrophobicContact CG2-CB 3.65Å; V1112-A1227 HydrophobicContact CG1-CB 3.72Å
1113	R	88.4	Confident	88.9	Confident	132 Å²	132	38.1 Å²	38.1	50%	0.498	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-8.6	178.2	-65.6	171.5	-166.2	-158.1	5.2	114.4	D1109 I1110 M1111 E1115	D1109-R1113 WeakPolarHBondContact O-CG 3.41Å; D1109-R1113 PolarHBondContact O-N 3.04Å; D1109-R1113 VanDerWaalsContact O-N 3.1Å; D1109-R1113 IonicContact OD2-CZ 3.75Å; D1109-R1113 IonicContact OD2-NE 2.73Å; D1109-R1113 PolarHBondContact OD2-NE 3.41Å; D1109-R1113 IonicContact OD2-NH2 3.34Å; D1109-R1113 PolarHBondContact OD2-NH2 3.31Å; I1110-R1113 PolarHBondContact O-N 2.95Å; M1111-R1113 VanDerWaalsContact C-N 3.3Å; M1111-R1113 PolarHBondContact O-N 2.72Å; R1113-E1115 VanDerWaalsContact C-N 3.27Å
1114	T	91.1	Very high	88.8	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-9.2	171.2	70.9	0	0	0	0	113.2	L1077 Q1080 M1111 V1112 H1116 A1117 F1118 F1159	L1077-T1114 HydrophobicContact CD1-CG2 3.88Å; Q1080-T1114 HydrophobicContact CB-CG2 3.53Å; Q1080-T1114 HydrophobicContact CG-CG2 4Å; M1111-T1114 PolarHBondContact O-N 2.95Å; M1111-T1114 PolarHBondContact O-OG1 3.16Å; V1112-T1114 PolarHBondContact O-N 3.09Å; T1114-H1116 PolarHBondContact O-N 2.91Å; T1114-A1117 WeakPolarHBondContact O-CB 3.49Å; T1114-A1117 PolarHBondContact O-N 3.31Å; T1114-F1118 WeakPolarHBondContact O-CD2 3.29Å; T1114-F1118 PolarHBondContact O-N 2.94Å; T1114-F1118 VanDerWaalsContact O-N 3.15Å; T1114-F1159 HydrophobicContact CG2-CE2 4.1Å; T1114-F1159 WeakPolarHBondContact OG1-CE2 3.45Å
1115	E	89.2	Confident	88.6	Confident	49 Å²	49	39.9 Å²	39.9	23%	0.229	20%	0.201	C	C	.	.	H	α-helix	trans	-51.5	-43.9	179.1	-174.4	-174.5	175.8	0	0	111.5	V1112 R1113 A1117 F1118 Q1119 V1220 L1223	V1112-E1115 VanDerWaalsContact O-CB 3.22Å; V1112-E1115 WeakPolarHBondContact O-CB 3.31Å; V1112-E1115 PolarHBondContact O-N 3.19Å; R1113-E1115 VanDerWaalsContact C-N 3.27Å; E1115-A1117 VanDerWaalsContact C-N 3.33Å; E1115-A1117 PolarHBondContact O-N 2.94Å; E1115-F1118 PolarHBondContact O-N 3.27Å; E1115-Q1119 HydrophobicContact CG-CG 4.45Å; E1115-Q1119 WeakPolarHBondContact O-CG 3.48Å; E1115-Q1119 PolarHBondContact O-N 2.95Å; E1115-Q1119 PolarHBondContact OE1-NE2 3.17Å; E1115-Q1119 VanDerWaalsContact OE1-NE2 3.1Å; E1115-V1220 HydrophobicContact CG-CG1 4.49Å; E1115-L1223 HydrophobicContact CB-CB 4.23Å; E1115-L1223 HydrophobicContact CB-CD1 3.96Å; E1115-L1223 HydrophobicContact CG-CB 4.32Å
1116	H	87.3	Confident	88.5	Confident	67 Å²	67	39.9 Å²	39.9	31%	0.31	20%	0.198	S	C	.	.	H	α-helix	trans	-59.1	-41.6	178.1	-174	57.6	0	0	0	112.9	T1114 Q1119 L1120	T1114-H1116 PolarHBondContact O-N 2.91Å; H1116-Q1119 PolarHBondContact O-N 3.08Å; H1116-L1120 WeakPolarHBondContact O-CG 3.49Å; H1116-L1120 PolarHBondContact O-N 2.98Å; H1116-L1120 VanDerWaalsContact O-N 3.09Å
1117	A	89.3	Confident	88	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-64.9	-42.3	177.2	0	0	0	0	0	111.3	P1073 L1076 L1077 T1114 E1115 L1120 I1121	P1073-A1117 HydrophobicContact CB-CB 4.43Å; L1076-A1117 HydrophobicContact CB-CB 4.4Å; L1076-A1117 HydrophobicContact CD2-CB 4.01Å; L1076-A1117 HydrophobicContact CG-CB 4.22Å; L1077-A1117 HydrophobicContact CB-CB 4.38Å; T1114-A1117 WeakPolarHBondContact O-CB 3.49Å; T1114-A1117 PolarHBondContact O-N 3.31Å; E1115-A1117 VanDerWaalsContact C-N 3.33Å; E1115-A1117 PolarHBondContact O-N 2.94Å; A1117-L1120 PolarHBondContact O-N 3.31Å; A1117-I1121 VanDerWaalsContact O-CG1 3.29Å; A1117-I1121 WeakPolarHBondContact O-CG1 3.39Å; A1117-I1121 PolarHBondContact O-N 3.39Å
1118	F	91.4	Very high	87.1	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-67.2	-34.7	176.9	-76.5	-63.6	0	0	0	113	L1077 T1114 E1115 I1121 Q1122 L1156 F1159 I1216 I1219 V1220 L1223	L1077-F1118 HydrophobicContact CD1-CE2 3.76Å; L1077-F1118 HydrophobicContact CD1-CZ 3.81Å; L1077-F1118 HydrophobicContact CD2-CE1 3.89Å; L1077-F1118 HydrophobicContact CD2-CE2 4.45Å; L1077-F1118 HydrophobicContact CD2-CZ 3.74Å; L1077-F1118 HydrophobicContact CG-CZ 4.47Å; T1114-F1118 WeakPolarHBondContact O-CD2 3.29Å; T1114-F1118 PolarHBondContact O-N 2.94Å; T1114-F1118 VanDerWaalsContact O-N 3.15Å; E1115-F1118 PolarHBondContact O-N 3.27Å; F1118-I1121 PolarHBondContact O-N 3.3Å; F1118-Q1122 WeakPolarHBondContact O-CB 3.31Å; F1118-Q1122 PolarHBondContact O-N 3.27Å; F1118-L1156 HydrophobicContact CE1-CD1 3.88Å; F1118-L1156 HydrophobicContact CZ-CD1 4.15Å; F1118-F1159 HydrophobicContact CE2-CD1 4.04Å; F1118-F1159 AromaticContact CE2-CD2 3.85Å; F1118-F1159 HydrophobicContact CE2-CD2 3.85Å; F1118-F1159 HydrophobicContact CE2-CE1 4.05Å; F1118-F1159 AromaticContact CE2-CE2 3.87Å; F1118-F1159 HydrophobicContact CE2-CE2 3.87Å; F1118-F1159 AromaticContact CE2-CG 3.96Å; F1118-F1159 HydrophobicContact CE2-CG 3.96Å; F1118-F1159 AromaticContact CE2-CZ 3.97Å; F1118-F1159 HydrophobicContact CE2-CZ 3.97Å; F1118-F1159 HydrophobicContact CZ-CB 4.26Å; F1118-F1159 HydrophobicContact CZ-CD1 4.02Å; F1118-F1159 HydrophobicContact CZ-CD2 4.14Å; F1118-F1159 HydrophobicContact CZ-CE1 4.46Å; F1118-F1159 AromaticContact CZ-CG 3.86Å; F1118-F1159 HydrophobicContact CZ-CG 3.86Å; F1118-I1216 HydrophobicContact CB-CG2 4.28Å; F1118-I1216 HydrophobicContact CD1-CG1 4.34Å; F1118-I1216 HydrophobicContact CD1-CG2 4.23Å; F1118-I1219 HydrophobicContact CD2-CG2 3.87Å; F1118-I1219 HydrophobicContact CE2-CG2 3.78Å; F1118-I1219 HydrophobicContact CG-CG2 4.3Å; F1118-I1219 HydrophobicContact CZ-CG2 4.17Å; F1118-V1220 HydrophobicContact CB-CG2 3.77Å; F1118-L1223 HydrophobicContact CD2-CD1 4.01Å; F1118-L1223 HydrophobicContact CE2-CD1 4.48Å
1119	Q	89.4	Confident	85.8	Confident	79 Å²	79	53.7 Å²	53.7	37%	0.369	25%	0.251	S	S	.	.	H	α-helix	trans	-64.7	-40.2	173.3	-72.3	171.9	-4.3	0	0	112	E1115 H1116 Q1122 K1123 V1220	E1115-Q1119 HydrophobicContact CG-CG 4.45Å; E1115-Q1119 WeakPolarHBondContact O-CG 3.48Å; E1115-Q1119 PolarHBondContact O-N 2.95Å; E1115-Q1119 PolarHBondContact OE1-NE2 3.17Å; E1115-Q1119 VanDerWaalsContact OE1-NE2 3.1Å; H1116-Q1119 PolarHBondContact O-N 3.08Å; Q1119-Q1122 PolarHBondContact O-N 3.1Å; Q1119-K1123 WeakPolarHBondContact O-CB 3Å; Q1119-K1123 PolarHBondContact O-N 3.36Å; Q1119-V1220 HydrophobicContact CG-CG1 4.3Å
1120	L	87.6	Confident	84.2	Confident	36 Å²	36	53.9 Å²	53.9	19%	0.188	27%	0.266	C	S	.	.	H	α-helix	trans	-64.2	-47.7	174.7	-70.2	173.6	0	0	0	111.4	P1073 H1116 A1117 Q1122 K1123 E1124	P1073-L1120 HydrophobicContact CB-CB 4.02Å; P1073-L1120 HydrophobicContact CB-CD1 4.4Å; P1073-L1120 HydrophobicContact CG-CB 4.48Å; H1116-L1120 WeakPolarHBondContact O-CG 3.49Å; H1116-L1120 PolarHBondContact O-N 2.98Å; H1116-L1120 VanDerWaalsContact O-N 3.09Å; A1117-L1120 PolarHBondContact O-N 3.31Å; L1120-Q1122 VanDerWaalsContact C-N 3.31Å; L1120-Q1122 PolarHBondContact O-N 3.08Å; L1120-K1123 PolarHBondContact O-N 2.96Å; L1120-E1124 PolarHBondContact O-N 3.14Å
1121	I	88.2	Confident	82.3	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-60.6	-41.9	176.2	-65.3	166	0	0	0	110.9	P1073 A1117 F1118 E1124 L1125 L1147 V1152 I1216	P1073-I1121 HydrophobicContact CB-CD1 4.16Å; P1073-I1121 HydrophobicContact CB-CG1 3.71Å; P1073-I1121 HydrophobicContact CG-CG1 3.78Å; A1117-I1121 VanDerWaalsContact O-CG1 3.29Å; A1117-I1121 WeakPolarHBondContact O-CG1 3.39Å; A1117-I1121 PolarHBondContact O-N 3.39Å; F1118-I1121 PolarHBondContact O-N 3.3Å; I1121-E1124 PolarHBondContact O-N 3.48Å; I1121-L1125 HydrophobicContact CG2-CD1 3.88Å; I1121-L1125 HydrophobicContact CG2-CG 4.35Å; I1121-L1125 WeakPolarHBondContact O-CB 3.46Å; I1121-L1125 VanDerWaalsContact O-CG 3.26Å; I1121-L1125 WeakPolarHBondContact O-CG 3.22Å; I1121-L1125 PolarHBondContact O-N 3.36Å; I1121-L1147 HydrophobicContact CG1-CD1 4.44Å; I1121-L1147 HydrophobicContact CG2-CD2 3.99Å; I1121-V1152 HydrophobicContact CG2-CG1 3.94Å; I1121-V1152 HydrophobicContact CG2-CG2 4.39Å; I1121-I1216 HydrophobicContact CG2-CD1 3.62Å
1122	Q	87.2	Confident	80.1	Confident	57 Å²	57	66.2 Å²	66.2	27%	0.266	33%	0.334	S	S	.	.	H	α-helix	trans	-60.1	-45.9	176.8	-176.8	-168.8	22.5	0	0	111.1	F1118 Q1119 L1120 L1125 V1126 L1213 I1216 N1217	F1118-Q1122 WeakPolarHBondContact O-CB 3.31Å; F1118-Q1122 PolarHBondContact O-N 3.27Å; Q1119-Q1122 PolarHBondContact O-N 3.1Å; L1120-Q1122 VanDerWaalsContact C-N 3.31Å; L1120-Q1122 PolarHBondContact O-N 3.08Å; Q1122-L1125 PolarHBondContact O-N 3.49Å; Q1122-V1126 VanDerWaalsContact O-CG2 3.25Å; Q1122-V1126 WeakPolarHBondContact O-CG2 3.36Å; Q1122-V1126 PolarHBondContact O-N 3.49Å; Q1122-L1213 HydrophobicContact CG-CD1 4.02Å; Q1122-I1216 HydrophobicContact CB-CG2 4.03Å; Q1122-N1217 PolarHBondContact NE2-OD1 3.03Å
1123	K	85.9	Confident	78.2	Confident	126 Å²	126	75.6 Å²	75.6	55%	0.548	37%	0.372	S	S	.	.	H	α-helix	trans	-62.5	-46.6	179.5	-175.9	179.4	171.9	-174.3	0	111.7	Q1119 L1120 V1126 E1127	Q1119-K1123 WeakPolarHBondContact O-CB 3Å; Q1119-K1123 PolarHBondContact O-N 3.36Å; L1120-K1123 PolarHBondContact O-N 2.96Å; K1123-V1126 PolarHBondContact O-N 2.73Å; K1123-E1127 WeakPolarHBondContact CE-OE1 3.41Å; K1123-E1127 IonicContact NZ-OE1 3.93Å; K1123-E1127 WeakPolarHBondContact O-CG 3.17Å; K1123-E1127 PolarHBondContact O-N 3.05Å
1124	E	84.4	Confident	75.8	Confident	59 Å²	59	74.5 Å²	74.5	28%	0.276	39%	0.385	S	S	.	.	H	α-helix	trans	-64.7	-42	179.4	-166.4	177.9	176.3	0	0	112.1	L1120 I1121 V1126 E1127 E1128 L1147	L1120-E1124 PolarHBondContact O-N 3.14Å; I1121-E1124 PolarHBondContact O-N 3.48Å; E1124-V1126 VanDerWaalsContact C-N 3.32Å; E1124-V1126 PolarHBondContact O-N 3.18Å; E1124-E1127 PolarHBondContact O-N 3.22Å; E1124-E1128 PolarHBondContact O-N 2.97Å; E1124-L1147 HydrophobicContact CG-CB 4.5Å
1125	L	83.8	Confident	73.6	Confident	3 Å²	3	77.8 Å²	77.8	2%	0.016	42%	0.419	C	S	.	.	H	α-helix	trans	-60.5	-41.1	174	-74.5	171.4	0	0	0	111.7	I1121 Q1122 E1128 F1129 L1147 L1212 L1213 I1216	I1121-L1125 HydrophobicContact CG2-CD1 3.88Å; I1121-L1125 HydrophobicContact CG2-CG 4.35Å; I1121-L1125 WeakPolarHBondContact O-CB 3.46Å; I1121-L1125 VanDerWaalsContact O-CG 3.26Å; I1121-L1125 WeakPolarHBondContact O-CG 3.22Å; I1121-L1125 PolarHBondContact O-N 3.36Å; Q1122-L1125 PolarHBondContact O-N 3.49Å; L1125-E1128 PolarHBondContact O-N 3.18Å; L1125-F1129 WeakPolarHBondContact O-CD2 3.47Å; L1125-F1129 PolarHBondContact O-N 3.36Å; L1125-L1147 HydrophobicContact CD2-CD2 3.74Å; L1125-L1147 HydrophobicContact CG-CD2 3.8Å; L1125-L1212 HydrophobicContact CD1-CD2 4.09Å; L1125-L1212 HydrophobicContact CD1-CG 4.09Å; L1125-L1212 HydrophobicContact CD2-CD2 4.33Å; L1125-L1213 HydrophobicContact CB-CD1 4.26Å; L1125-I1216 HydrophobicContact CD1-CD1 3.6Å
1126	V	82.9	Confident	71.3	Confident	78 Å²	78	83.7 Å²	83.7	47%	0.473	45%	0.452	S	S	.	.	H	α-helix	trans	-67.8	-39.7	178.6	169.9	0	0	0	0	111.9	Q1122 K1123 E1124 F1129 G1130 L1213	Q1122-V1126 VanDerWaalsContact O-CG2 3.25Å; Q1122-V1126 WeakPolarHBondContact O-CG2 3.36Å; Q1122-V1126 PolarHBondContact O-N 3.49Å; K1123-V1126 PolarHBondContact O-N 2.73Å; E1124-V1126 VanDerWaalsContact C-N 3.32Å; E1124-V1126 PolarHBondContact O-N 3.18Å; V1126-F1129 PolarHBondContact O-N 3.11Å; V1126-G1130 PolarHBondContact O-N 3.27Å; V1126-L1213 HydrophobicContact CG2-CD1 4.05Å; V1126-L1213 HydrophobicContact CG2-CD2 4.17Å
1127	E	79.3	Confident	68.8	Low	115 Å²	115	85.2 Å²	85.2	54%	0.537	48%	0.477	S	S	.	.	H	α-helix	trans	-65.1	-37.9	176.6	-73.5	174.3	-178.2	0	0	111.8	K1123 E1124 F1129 G1130	K1123-E1127 WeakPolarHBondContact CE-OE1 3.41Å; K1123-E1127 IonicContact NZ-OE1 3.93Å; K1123-E1127 WeakPolarHBondContact O-CG 3.17Å; K1123-E1127 PolarHBondContact O-N 3.05Å; E1124-E1127 PolarHBondContact O-N 3.22Å; E1127-F1129 VanDerWaalsContact C-N 3.32Å; E1127-F1129 PolarHBondContact O-N 2.76Å; E1127-G1130 PolarHBondContact O-N 3.47Å; E1127-G1130 VanDerWaalsContact O-N 3.14Å
1128	E	71.2	Confident	66.3	Low	88 Å²	88	89.5 Å²	89.5	41%	0.411	51%	0.512	S	S	.	.	H	α-helix	trans	-61	-35.1	173.1	-119.1	-169.2	158.2	0	0	113.1	E1124 L1125 G1130 R1149	E1124-E1128 PolarHBondContact O-N 2.97Å; L1125-E1128 PolarHBondContact O-N 3.18Å; E1128-G1130 VanDerWaalsContact C-N 3.33Å; E1128-R1149 IonicContact OE1-NH2 2.7Å; E1128-R1149 IonicContact OE2-CZ 2.95Å; E1128-R1149 IonicContact OE2-NE 2.65Å; E1128-R1149 PolarHBondContact OE2-NE 3.13Å; E1128-R1149 IonicContact OE2-NH2 2.89Å; E1128-R1149 PolarHBondContact OE2-NH2 3.11Å
1129	F	62.8	Low	63.6	Low	141 Å²	141	95.9 Å²	95.9	62%	0.618	55%	0.553	S	S	*	*	H	α-helix	trans	-80.3	-12.2	177.3	-75.3	-70.3	0	0	0	113.5	L1125 V1126 E1127	L1125-F1129 WeakPolarHBondContact O-CD2 3.47Å; L1125-F1129 PolarHBondContact O-N 3.36Å; V1126-F1129 PolarHBondContact O-N 3.11Å; E1127-F1129 VanDerWaalsContact C-N 3.32Å; E1127-F1129 PolarHBondContact O-N 2.76Å
1130	G	54.8	Low	60.7	Low	60 Å²	60	96.3 Å²	96.3	62%	0.619	57%	0.57	S	S	*	*	H	α-helix	trans	-92.5	-13.2	-175.2	0	0	0	0	0	116	V1126 E1127 E1128	V1126-G1130 PolarHBondContact O-N 3.27Å; E1127-G1130 PolarHBondContact O-N 3.47Å; E1127-G1130 VanDerWaalsContact O-N 3.14Å; E1128-G1130 VanDerWaalsContact C-N 3.33Å
1131	Q	52.8	Low	58.2	Low	164 Å²	164	99.5 Å²	99.5	77%	0.766	60%	0.602	S	S	*	*	S	Bend	trans	-83.3	124.8	178.4	-74.9	-170.2	-11.5	0	0	111.9	K1133	Q1131-K1133 PolarHBondContact O-N 2.87Å
1132	P	44.7	Very low	55.6	Low	115 Å²	115	107.2 Å²	107.2	75%	0.747	64%	0.643	S	S	*	*			trans	-66.8	131.3	168.5	26.7	-29.8	0	0	0	109.3	S1134	P1132-S1134 VanDerWaalsContact C-N 3.33Å; P1132-S1134 PolarHBondContact O-N 3.13Å
1133	K	49.8	Very low	52.9	Low	218 Å²	218	108.8 Å²	108.8	95%	0.948	67%	0.666	S	S	*	*			trans	-64.6	88.9	173.1	-70.2	-177.9	176.5	-178.6	0	110	Q1131	Q1131-K1133 PolarHBondContact O-N 2.87Å
1134	S	38.2	Very low	50.6	Low	109 Å²	109	107.7 Å²	107.7	76%	0.762	67%	0.674	S	S	*	*			trans	-89.8	116	161.8	55	0	0	0	0	108.7	P1132	P1132-S1134 VanDerWaalsContact C-N 3.33Å; P1132-S1134 PolarHBondContact O-N 3.13Å
1135	G	44.8	Very low	48.9	Very low	69 Å²	69	109.9 Å²	109.9	71%	0.711	69%	0.693	S	S	*	*			trans	-64.1	156.9	166.8	0	0	0	0	0	111.4
1136	D	42.4	Very low	47.7	Very low	173 Å²	173	114.4 Å²	114.4	93%	0.925	73%	0.725	S	S	*	*			trans	72.5	77.9	173.5	-60.5	-19.9	0	0	0	117.2
1137	A	34.1	Very low	47.1	Very low	100 Å²	100	111.5 Å²	111.5	83%	0.826	71%	0.707	S	S	*	*			trans	-141.5	133	147.1	0	0	0	0	0	109.9
1138	A	37.4	Very low	47.1	Very low	90 Å²	90	109.8 Å²	109.8	74%	0.744	70%	0.701	S	S	*	*			trans	-59.6	151.2	179.2	0	0	0	0	0	112.1	A1140	A1138-A1140 PolarHBondContact O-N 3.03Å; A1138-A1140 VanDerWaalsContact O-N 3.07Å
1139	P	33.5	Very low	47.6	Very low	134 Å²	134	111.1 Å²	111.1	87%	0.87	70%	0.703	S	S	*	*			trans	-70	108.7	-172.8	28	-32.3	0	0	0	110.8
1140	A	29.5	Very low	48.6	Very low	87 Å²	87	110.9 Å²	110.9	72%	0.719	70%	0.703	S	S	*	*			trans	-73.7	133	164.4	0	0	0	0	0	109.3	A1138 D1142	A1138-A1140 PolarHBondContact O-N 3.03Å; A1138-A1140 VanDerWaalsContact O-N 3.07Å; A1140-D1142 PolarHBondContact O-N 2.71Å
1141	A	34.6	Very low	50.1	Low	103 Å²	103	109.9 Å²	109.9	85%	0.851	68%	0.683	S	S	*	*	S	Bend	trans	-76.1	15.4	-167.9	0	0	0	0	0	116.2
1142	D	33.9	Very low	51.8	Low	162 Å²	162	102.1 Å²	102.1	87%	0.866	65%	0.646	S	S	*	*			trans	-130.6	54.6	177.1	-77.5	-38.1	0	0	0	110.8	A1140 S1144	A1140-D1142 PolarHBondContact O-N 2.71Å; D1142-S1144 PolarHBondContact O-N 3.44Å
1143	A	30.7	Very low	53.8	Low	91 Å²	91	100.4 Å²	100.4	75%	0.752	63%	0.629	S	S	*	*			trans	-69.9	117.9	166.8	0	0	0	0	0	108.8
1144	S	37.9	Very low	55.7	Low	102 Å²	102	96.1 Å²	96.1	71%	0.713	61%	0.611	S	S	*	*			trans	-46.9	141.1	166.1	49.5	0	0	0	0	110	D1142 S1146	D1142-S1144 PolarHBondContact O-N 3.44Å; S1144-S1146 PolarHBondContact O-N 2.96Å
1145	P	47.9	Very low	58.2	Low	105 Å²	105	91.5 Å²	91.5	68%	0.682	58%	0.578	S	S	*	*			trans	-59.5	110.3	-177.5	25	-32.4	0	0	0	108.8	L1147	P1145-L1147 PolarHBondContact O-N 3.48Å
1146	S	58.4	Low	60.4	Low	98 Å²	98	88.2 Å²	88.2	69%	0.685	54%	0.544	S	S	*	.			trans	-54.2	125.8	174.9	55.6	0	0	0	0	109.6	S1144 N1148	S1144-S1146 PolarHBondContact O-N 2.96Å; S1146-N1148 PolarHBondContact O-N 3.47Å
1147	L	71	Confident	62.7	Low	17 Å²	17	83.2 Å²	83.2	9%	0.089	52%	0.522	C	S	.	.			trans	-44.3	119.7	177	-175.3	72.4	0	0	0	112.5	I1121 E1124 L1125 P1145 R1149 V1152	I1121-L1147 HydrophobicContact CG1-CD1 4.44Å; I1121-L1147 HydrophobicContact CG2-CD2 3.99Å; E1124-L1147 HydrophobicContact CG-CB 4.5Å; L1125-L1147 HydrophobicContact CD2-CD2 3.74Å; L1125-L1147 HydrophobicContact CG-CD2 3.8Å; P1145-L1147 PolarHBondContact O-N 3.48Å; L1147-R1149 PolarHBondContact O-N 3.03Å; L1147-V1152 HydrophobicContact CD1-CG2 3.82Å; L1147-V1152 HydrophobicContact CD2-CG2 4.23Å; L1147-V1152 HydrophobicContact CG-CG2 3.95Å
1148	N	79.3	Confident	65.4	Low	79 Å²	79	82.2 Å²	82.2	42%	0.422	50%	0.502	S	S	.	.			trans	-72.7	92	178.3	-173.7	-12.1	0	0	0	111.3	S1146 E1150 E1151 V1152	S1146-N1148 PolarHBondContact O-N 3.47Å; N1148-E1150 VanDerWaalsContact C-N 3.25Å; N1148-E1150 PolarHBondContact O-N 2.89Å; N1148-E1150 PolarHBondContact OD1-N 2.89Å; N1148-E1151 HydrophobicContact CB-CB 3.91Å; N1148-E1151 PolarHBondContact ND2-OE2 3.24Å; N1148-E1151 WeakPolarHBondContact O-CB 3.48Å; N1148-E1151 PolarHBondContact O-N 2.92Å; N1148-E1151 VanDerWaalsContact O-N 3.08Å; N1148-E1151 PolarHBondContact OD1-N 3.39Å; N1148-V1152 WeakPolarHBondContact O-CG2 3.3Å; N1148-V1152 PolarHBondContact O-N 3.05Å
1149	R	81.1	Confident	68.1	Low	117 Å²	117	78 Å²	78	44%	0.442	47%	0.467	S	S	.	.	H	α-helix	trans	-57.2	-33.9	-177.1	-66.2	-176.1	176.8	-174.9	-2	113.8	E1128 L1147 M1153	E1128-R1149 IonicContact OE1-NH2 2.7Å; E1128-R1149 IonicContact OE2-CZ 2.95Å; E1128-R1149 IonicContact OE2-NE 2.65Å; E1128-R1149 PolarHBondContact OE2-NE 3.13Å; E1128-R1149 IonicContact OE2-NH2 2.89Å; E1128-R1149 PolarHBondContact OE2-NH2 3.11Å; L1147-R1149 PolarHBondContact O-N 3.03Å; R1149-M1153 WeakPolarHBondContact O-CB 3.34Å; R1149-M1153 WeakPolarHBondContact O-CG 3.46Å; R1149-M1153 PolarHBondContact O-N 3.49Å
1150	E	84	Confident	70.9	Confident	135 Å²	135	72.4 Å²	72.4	63%	0.631	43%	0.429	S	S	*	.	H	α-helix	trans	-67.5	-40.6	177.5	-67.3	-169.8	178.9	0	0	111.9	N1148 M1153 K1154	N1148-E1150 VanDerWaalsContact C-N 3.25Å; N1148-E1150 PolarHBondContact O-N 2.89Å; N1148-E1150 PolarHBondContact OD1-N 2.89Å; E1150-M1153 PolarHBondContact O-N 3.01Å; E1150-K1154 VanDerWaalsContact O-CG 3.31Å; E1150-K1154 WeakPolarHBondContact O-CG 3.29Å; E1150-K1154 PolarHBondContact O-N 2.95Å
1151	E	86.8	Confident	73.8	Confident	40 Å²	40	71.8 Å²	71.8	19%	0.187	42%	0.419	C	S	.	.	H	α-helix	trans	-68.4	-43	178.5	-172.5	176.2	167.8	0	0	111.5	R1078 N1148 M1153 K1154 L1155	R1078-E1151 IonicContact CZ-OE1 3.72Å; R1078-E1151 IonicContact NH1-OE1 2.71Å; R1078-E1151 IonicContact NH2-OE1 2.72Å; R1078-E1151 PolarHBondContact NH2-OE1 3.05Å; N1148-E1151 HydrophobicContact CB-CB 3.91Å; N1148-E1151 PolarHBondContact ND2-OE2 3.24Å; N1148-E1151 WeakPolarHBondContact O-CB 3.48Å; N1148-E1151 PolarHBondContact O-N 2.92Å; N1148-E1151 VanDerWaalsContact O-N 3.08Å; N1148-E1151 PolarHBondContact OD1-N 3.39Å; E1151-M1153 VanDerWaalsContact C-N 3.3Å; E1151-M1153 PolarHBondContact O-N 3.41Å; E1151-K1154 PolarHBondContact O-N 2.86Å; E1151-L1155 HydrophobicContact CG-CD1 4.19Å; E1151-L1155 WeakPolarHBondContact O-CB 3.19Å; E1151-L1155 WeakPolarHBondContact O-CG 3.29Å; E1151-L1155 PolarHBondContact O-N 2.94Å
1152	V	87.7	Confident	76.6	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-57.2	-45.3	172.8	176.5	0	0	0	0	110.5	C1074 I1121 L1147 N1148 K1154 L1155 L1156 L1212 I1216	C1074-V1152 VanDerWaalsContact SG-CG2 3.6Å; I1121-V1152 HydrophobicContact CG2-CG1 3.94Å; I1121-V1152 HydrophobicContact CG2-CG2 4.39Å; L1147-V1152 HydrophobicContact CD1-CG2 3.82Å; L1147-V1152 HydrophobicContact CD2-CG2 4.23Å; L1147-V1152 HydrophobicContact CG-CG2 3.95Å; N1148-V1152 WeakPolarHBondContact O-CG2 3.3Å; N1148-V1152 PolarHBondContact O-N 3.05Å; V1152-K1154 PolarHBondContact O-N 3.42Å; V1152-L1155 PolarHBondContact O-N 2.92Å; V1152-L1156 WeakPolarHBondContact O-CB 3.31Å; V1152-L1156 PolarHBondContact O-N 3.15Å; V1152-L1212 HydrophobicContact CG1-CD1 4.03Å; V1152-L1212 HydrophobicContact CG1-CD2 4.22Å; V1152-I1216 HydrophobicContact CG1-CD1 4.25Å
1153	M	86.9	Confident	79.4	Confident	79 Å²	79	64 Å²	64	39%	0.389	36%	0.356	S	S	.	.	H	α-helix	trans	-62.5	-41.4	177.5	-79.9	-72.8	-75.1	0	0	112.7	R1149 E1150 E1151 S1157 L1212 R1215	R1149-M1153 WeakPolarHBondContact O-CB 3.34Å; R1149-M1153 WeakPolarHBondContact O-CG 3.46Å; R1149-M1153 PolarHBondContact O-N 3.49Å; E1150-M1153 PolarHBondContact O-N 3.01Å; E1151-M1153 VanDerWaalsContact C-N 3.3Å; E1151-M1153 PolarHBondContact O-N 3.41Å; M1153-S1157 WeakPolarHBondContact O-CB 3.37Å; M1153-S1157 PolarHBondContact O-N 3.49Å; M1153-L1212 HydrophobicContact CG-CD1 4.2Å; M1153-L1212 HydrophobicContact CG-CD2 4.46Å; M1153-L1212 HydrophobicContact SD-CB 4.43Å; M1153-L1212 HydrophobicContact SD-CD1 3.67Å; M1153-L1212 HydrophobicContact SD-CG 4.47Å; M1153-R1215 PolarHBondContact SD-NH1 3.14Å; M1153-R1215 VanDerWaalsContact SD-NH1 3.45Å
1154	K	89.9	Confident	82.3	Confident	129 Å²	129	61 Å²	61	56%	0.561	33%	0.329	S	S	*	.	H	α-helix	trans	-63	-50.2	175.6	-72.9	167.6	-173.2	165.9	0	111	E1150 E1151 V1152 L1156 S1157 I1158	E1150-K1154 VanDerWaalsContact O-CG 3.31Å; E1150-K1154 WeakPolarHBondContact O-CG 3.29Å; E1150-K1154 PolarHBondContact O-N 2.95Å; E1151-K1154 PolarHBondContact O-N 2.86Å; V1152-K1154 PolarHBondContact O-N 3.42Å; K1154-L1156 PolarHBondContact O-N 2.84Å; K1154-S1157 PolarHBondContact O-N 3.21Å; K1154-I1158 WeakPolarHBondContact O-CG1 3.17Å; K1154-I1158 PolarHBondContact O-N 3.07Å
1155	L	91.4	Very high	84.9	Confident	12 Å²	12	59.7 Å²	59.7	6%	0.063	31%	0.311	C	S	.	.	H	α-helix	trans	-64	-40.9	179.8	-68.3	173.7	0	0	0	111.8	C1074 L1077 R1078 L1081 E1151 V1152 I1158 F1159	C1074-L1155 HydrophobicContact CB-CD1 4.04Å; C1074-L1155 WeakPolarHBondContact O-CD1 3.26Å; L1077-L1155 HydrophobicContact CB-CD1 4.45Å; L1077-L1155 HydrophobicContact CD2-CB 3.67Å; L1077-L1155 HydrophobicContact CD2-CD1 4.24Å; L1077-L1155 HydrophobicContact CG-CB 4.25Å; L1077-L1155 HydrophobicContact CG-CD1 4.49Å; R1078-L1155 HydrophobicContact CB-CD2 4.21Å; L1081-L1155 HydrophobicContact CD1-CB 4.47Å; L1081-L1155 HydrophobicContact CD1-CD2 4.11Å; E1151-L1155 HydrophobicContact CG-CD1 4.19Å; E1151-L1155 WeakPolarHBondContact O-CB 3.19Å; E1151-L1155 WeakPolarHBondContact O-CG 3.29Å; E1151-L1155 PolarHBondContact O-N 2.94Å; V1152-L1155 PolarHBondContact O-N 2.92Å; L1155-I1158 PolarHBondContact O-N 2.95Å; L1155-F1159 WeakPolarHBondContact O-CB 3.39Å; L1155-F1159 PolarHBondContact O-N 3.02Å
1156	L	90.4	Very high	86.9	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-61.5	-44.5	175.2	178	63.2	0	0	0	111.6	F1118 V1152 K1154 I1158 F1159 E1160 L1212 R1215 I1216 I1219	F1118-L1156 HydrophobicContact CE1-CD1 3.88Å; F1118-L1156 HydrophobicContact CZ-CD1 4.15Å; V1152-L1156 WeakPolarHBondContact O-CB 3.31Å; V1152-L1156 PolarHBondContact O-N 3.15Å; K1154-L1156 PolarHBondContact O-N 2.84Å; L1156-I1158 VanDerWaalsContact C-N 3.34Å; L1156-I1158 PolarHBondContact O-N 2.91Å; L1156-F1159 WeakPolarHBondContact O-CB 3.46Å; L1156-F1159 PolarHBondContact O-N 2.7Å; L1156-E1160 HydrophobicContact CD1-CG 4.33Å; L1156-E1160 WeakPolarHBondContact O-CG 3.43Å; L1156-E1160 PolarHBondContact O-N 3.5Å; L1156-L1212 HydrophobicContact CD2-CD1 3.76Å; L1156-R1215 HydrophobicContact CD2-CB 3.98Å; L1156-I1216 HydrophobicContact CD2-CG1 4.37Å; L1156-I1219 HydrophobicContact CD1-CG1 3.9Å
1157	S	89.6	Confident	88.4	Confident	67 Å²	67	50.1 Å²	50.1	47%	0.469	25%	0.246	S	C	.	.	H	α-helix	trans	-63.5	-39.7	177.1	-178.1	0	0	0	0	112.2	M1153 K1154 S1161	M1153-S1157 WeakPolarHBondContact O-CB 3.37Å; M1153-S1157 PolarHBondContact O-N 3.49Å; K1154-S1157 PolarHBondContact O-N 3.21Å; S1157-S1161 WeakPolarHBondContact O-CB 3.27Å; S1157-S1161 PolarHBondContact O-N 2.86Å; S1157-S1161 VanDerWaalsContact O-N 3.16Å
1158	I	92.1	Very high	89.3	Confident	80 Å²	80	51.8 Å²	51.8	41%	0.41	26%	0.255	S	S	.	.	H	α-helix	trans	-63.9	-45.2	174.2	-66.3	166	0	0	0	109.8	L1081 K1154 L1155 L1156 S1161 R1162	L1081-I1158 HydrophobicContact CD1-CB 4.34Å; L1081-I1158 HydrophobicContact CD1-CG2 4.05Å; L1081-I1158 HydrophobicContact CD2-CG2 4.42Å; K1154-I1158 WeakPolarHBondContact O-CG1 3.17Å; K1154-I1158 PolarHBondContact O-N 3.07Å; L1155-I1158 PolarHBondContact O-N 2.95Å; L1156-I1158 VanDerWaalsContact C-N 3.34Å; L1156-I1158 PolarHBondContact O-N 2.91Å; I1158-S1161 PolarHBondContact O-N 3.37Å; I1158-R1162 HydrophobicContact CG2-CG 4.2Å; I1158-R1162 WeakPolarHBondContact O-CB 3.39Å; I1158-R1162 VanDerWaalsContact O-CG 3.26Å; I1158-R1162 WeakPolarHBondContact O-CG 3.31Å; I1158-R1162 PolarHBondContact O-N 3.27Å
1159	F	93.9	Very high	89.7	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.1	-51.1	179.2	-178.7	-86.9	0	0	0	112.2	L1077 L1081 M1111 T1114 F1118 L1155 L1156 S1161 R1162 L1163 I1219 L1223	L1077-F1159 HydrophobicContact CD1-CD2 4.13Å; L1081-F1159 HydrophobicContact CD1-CB 4.43Å; L1081-F1159 HydrophobicContact CD2-CB 4.06Å; L1081-F1159 HydrophobicContact CD2-CD2 3.85Å; L1081-F1159 HydrophobicContact CD2-CG 4.42Å; M1111-F1159 HydrophobicContact CB-CE2 4.36Å; M1111-F1159 HydrophobicContact CE-CD1 4.3Å; M1111-F1159 HydrophobicContact CE-CD2 3.5Å; M1111-F1159 VanDerWaalsContact CE-CD2 3.5Å; M1111-F1159 HydrophobicContact CE-CE1 4.12Å; M1111-F1159 HydrophobicContact CE-CE2 3.26Å; M1111-F1159 HydrophobicContact CE-CG 4Å; M1111-F1159 HydrophobicContact CE-CZ 3.61Å; M1111-F1159 HydrophobicContact SD-CD2 3.94Å; M1111-F1159 HydrophobicContact SD-CE2 3.64Å; M1111-F1159 HydrophobicContact SD-CZ 4.42Å; T1114-F1159 HydrophobicContact CG2-CE2 4.1Å; T1114-F1159 WeakPolarHBondContact OG1-CE2 3.45Å; F1118-F1159 HydrophobicContact CE2-CD1 4.04Å; F1118-F1159 AromaticContact CE2-CD2 3.85Å; F1118-F1159 HydrophobicContact CE2-CD2 3.85Å; F1118-F1159 HydrophobicContact CE2-CE1 4.05Å; F1118-F1159 AromaticContact CE2-CE2 3.87Å; F1118-F1159 HydrophobicContact CE2-CE2 3.87Å; F1118-F1159 AromaticContact CE2-CG 3.96Å; F1118-F1159 HydrophobicContact CE2-CG 3.96Å; F1118-F1159 AromaticContact CE2-CZ 3.97Å; F1118-F1159 HydrophobicContact CE2-CZ 3.97Å; F1118-F1159 HydrophobicContact CZ-CB 4.26Å; F1118-F1159 HydrophobicContact CZ-CD1 4.02Å; F1118-F1159 HydrophobicContact CZ-CD2 4.14Å; F1118-F1159 HydrophobicContact CZ-CE1 4.46Å; F1118-F1159 AromaticContact CZ-CG 3.86Å; F1118-F1159 HydrophobicContact CZ-CG 3.86Å; L1155-F1159 WeakPolarHBondContact O-CB 3.39Å; L1155-F1159 PolarHBondContact O-N 3.02Å; L1156-F1159 WeakPolarHBondContact O-CB 3.46Å; L1156-F1159 PolarHBondContact O-N 2.7Å; F1159-S1161 VanDerWaalsContact C-N 3.31Å; F1159-S1161 PolarHBondContact O-N 2.9Å; F1159-R1162 PolarHBondContact O-N 3.49Å; F1159-L1163 HydrophobicContact CE1-CB 4.45Å; F1159-L1163 HydrophobicContact CE1-CD2 3.79Å; F1159-L1163 HydrophobicContact CZ-CD2 4.2Å; F1159-L1163 WeakPolarHBondContact O-CB 3.41Å; F1159-L1163 PolarHBondContact O-N 3.36Å; F1159-I1219 HydrophobicContact CD1-CD1 4.37Å; F1159-I1219 HydrophobicContact CD1-CG2 4.1Å; F1159-I1219 HydrophobicContact CE1-CD1 4.21Å; F1159-I1219 HydrophobicContact CE1-CG2 3.52Å; F1159-I1219 HydrophobicContact CZ-CG2 4.2Å; F1159-L1223 HydrophobicContact CZ-CD1 4.05Å; F1159-L1223 HydrophobicContact CZ-CD2 3.83Å; F1159-L1223 HydrophobicContact CZ-CG 4.3Å
1160	E	91.3	Very high	89.9	Confident	18 Å²	18	45 Å²	45	8%	0.084	23%	0.227	C	C	.	.	H	α-helix	trans	-57.4	-44.6	178	-75.1	170.5	172.7	0	0	111.8	L1156 S1164 L1201 T1205 R1215 I1219	L1156-E1160 HydrophobicContact CD1-CG 4.33Å; L1156-E1160 WeakPolarHBondContact O-CG 3.43Å; L1156-E1160 PolarHBondContact O-N 3.5Å; E1160-S1164 VanDerWaalsContact O-CB 3.32Å; E1160-S1164 WeakPolarHBondContact O-CB 3.49Å; E1160-S1164 PolarHBondContact O-N 3.08Å; E1160-L1201 HydrophobicContact CG-CD1 4.4Å; E1160-T1205 HydrophobicContact CB-CG2 3.87Å; E1160-T1205 HydrophobicContact CG-CG2 3.93Å; E1160-R1215 IonicContact OE1-CZ 3.67Å; E1160-R1215 IonicContact OE1-NE 3.05Å; E1160-R1215 PolarHBondContact OE1-NE 2.66Å; E1160-R1215 IonicContact OE1-NH2 2.9Å; E1160-R1215 PolarHBondContact OE1-NH2 2.94Å; E1160-R1215 IonicContact OE2-CZ 3.93Å; E1160-R1215 IonicContact OE2-NH2 3.21Å; E1160-R1215 PolarHBondContact OE2-NH2 3.33Å; E1160-I1219 HydrophobicContact CG-CD1 4.07Å
1161	S	92.1	Very high	90.1	Very high	73 Å²	73	39.6 Å²	39.6	51%	0.51	20%	0.202	S	C	.	.	H	α-helix	trans	-62.8	-46.5	178.4	-178.6	0	0	0	0	112.1	S1157 I1158 F1159 F1165	S1157-S1161 WeakPolarHBondContact O-CB 3.27Å; S1157-S1161 PolarHBondContact O-N 2.86Å; S1157-S1161 VanDerWaalsContact O-N 3.16Å; I1158-S1161 PolarHBondContact O-N 3.37Å; F1159-S1161 VanDerWaalsContact C-N 3.31Å; F1159-S1161 PolarHBondContact O-N 2.9Å; S1161-F1165 PolarHBondContact O-N 2.98Å
1162	R	92.6	Very high	90.1	Very high	102 Å²	102	42.8 Å²	42.8	39%	0.385	22%	0.215	S	C	.	.	H	α-helix	trans	-70.4	-39.7	-179.9	-64.7	-68.2	158.7	-176.6	-5.9	112.2	E1088 M1111 I1158 F1159 S1164 F1165 L1166	E1088-R1162 WeakPolarHBondContact OE1-CD 3.42Å; E1088-R1162 IonicContact OE1-NH1 2.95Å; E1088-R1162 IonicContact OE2-CZ 3.85Å; E1088-R1162 IonicContact OE2-NH1 2.82Å; E1088-R1162 PolarHBondContact OE2-NH1 3.22Å; M1111-R1162 HydrophobicContact CE-CB 4.41Å; I1158-R1162 HydrophobicContact CG2-CG 4.2Å; I1158-R1162 WeakPolarHBondContact O-CB 3.39Å; I1158-R1162 VanDerWaalsContact O-CG 3.26Å; I1158-R1162 WeakPolarHBondContact O-CG 3.31Å; I1158-R1162 PolarHBondContact O-N 3.27Å; F1159-R1162 PolarHBondContact O-N 3.49Å; R1162-S1164 VanDerWaalsContact C-N 3.34Å; R1162-S1164 PolarHBondContact O-N 3.14Å; R1162-F1165 PolarHBondContact O-N 3.03Å; R1162-L1166 WeakPolarHBondContact O-CG 3.23Å; R1162-L1166 PolarHBondContact O-N 3.42Å
1163	L	92.2	Very high	89.9	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-61.4	-44.7	176	-172.4	56.5	0	0	0	111.3	L1108 M1111 F1159 F1165 L1166 L1167 L1201 L1226	L1108-L1163 HydrophobicContact CD2-CD1 4.11Å; M1111-L1163 HydrophobicContact CB-CD1 4.37Å; M1111-L1163 HydrophobicContact CE-CB 3.47Å; M1111-L1163 VanDerWaalsContact CE-CB 3.47Å; M1111-L1163 HydrophobicContact CE-CD1 3.98Å; M1111-L1163 HydrophobicContact CE-CG 4.23Å; F1159-L1163 HydrophobicContact CE1-CB 4.45Å; F1159-L1163 HydrophobicContact CE1-CD2 3.79Å; F1159-L1163 HydrophobicContact CZ-CD2 4.2Å; F1159-L1163 WeakPolarHBondContact O-CB 3.41Å; F1159-L1163 PolarHBondContact O-N 3.36Å; L1163-F1165 VanDerWaalsContact C-N 3.34Å; L1163-F1165 PolarHBondContact O-N 3.37Å; L1163-L1166 PolarHBondContact O-N 3.44Å; L1163-L1167 HydrophobicContact CD1-CD1 4.15Å; L1163-L1167 HydrophobicContact CD1-CG 4.27Å; L1163-L1167 HydrophobicContact CG-CD1 3.98Å; L1163-L1167 WeakPolarHBondContact O-CB 3.2Å; L1163-L1167 VanDerWaalsContact O-CG 3.28Å; L1163-L1167 WeakPolarHBondContact O-CG 3.28Å; L1163-L1167 PolarHBondContact O-N 2.87Å; L1163-L1201 HydrophobicContact CB-CD2 3.88Å; L1163-L1201 HydrophobicContact CD2-CD1 4.39Å; L1163-L1201 HydrophobicContact CD2-CD2 3.94Å; L1163-L1201 HydrophobicContact CG-CD2 3.8Å; L1163-L1226 HydrophobicContact CD1-CD1 3.95Å
1164	S	91.1	Very high	89.6	Confident	27 Å²	27	40.8 Å²	40.8	19%	0.189	21%	0.205	C	C	.	.	H	α-helix	trans	-58.3	-46.1	174.4	179.3	0	0	0	0	111.4	E1160 R1162 L1168 Y1198	E1160-S1164 VanDerWaalsContact O-CB 3.32Å; E1160-S1164 WeakPolarHBondContact O-CB 3.49Å; E1160-S1164 PolarHBondContact O-N 3.08Å; R1162-S1164 VanDerWaalsContact C-N 3.34Å; R1162-S1164 PolarHBondContact O-N 3.14Å; S1164-L1168 VanDerWaalsContact O-CB 3.3Å; S1164-L1168 WeakPolarHBondContact O-CB 3.36Å; S1164-L1168 PolarHBondContact O-N 2.85Å; S1164-Y1198 VanDerWaalsContact O-CE2 3.26Å; S1164-Y1198 WeakPolarHBondContact O-CE2 3.31Å; S1164-Y1198 WeakPolarHBondContact OG-CE2 3.48Å
1165	F	92.3	Very high	89.2	Confident	76 Å²	76	36.9 Å²	36.9	33%	0.333	19%	0.194	S	C	.	.	H	α-helix	trans	-61	-51	177.1	177.3	-99.9	0	0	0	112.4	E1088 M1091 S1161 R1162 L1163 L1167 L1168 Q1169	E1088-F1165 HydrophobicContact CG-CE1 4.38Å; E1088-F1165 WeakPolarHBondContact OE1-CD1 3.44Å; M1091-F1165 HydrophobicContact CE-CE1 4.45Å; S1161-F1165 PolarHBondContact O-N 2.98Å; R1162-F1165 PolarHBondContact O-N 3.03Å; L1163-F1165 VanDerWaalsContact C-N 3.34Å; L1163-F1165 PolarHBondContact O-N 3.37Å; F1165-L1167 PolarHBondContact O-N 3.41Å; F1165-L1168 PolarHBondContact O-N 3.49Å; F1165-Q1169 HydrophobicContact CD1-CG 4.3Å; F1165-Q1169 HydrophobicContact CD2-CG 4.28Å; F1165-Q1169 HydrophobicContact CE1-CG 3.92Å; F1165-Q1169 HydrophobicContact CE2-CG 3.91Å; F1165-Q1169 HydrophobicContact CG-CG 4.47Å; F1165-Q1169 HydrophobicContact CZ-CG 3.71Å; F1165-Q1169 WeakPolarHBondContact O-CG 3.09Å; F1165-Q1169 PolarHBondContact O-N 2.94Å
1166	L	90.9	Very high	88.3	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-61.5	-44.5	-179.1	-69.1	175.6	0	0	0	112.2	V1084 E1088 A1107 L1108 M1111 R1162 L1163 L1168 Q1169 S1170	V1084-L1166 HydrophobicContact CG1-CD1 3.76Å; E1088-L1166 HydrophobicContact CG-CD2 4.08Å; A1107-L1166 HydrophobicContact CB-CD1 4.01Å; A1107-L1166 HydrophobicContact CB-CD2 3.97Å; L1108-L1166 HydrophobicContact CD2-CB 3.8Å; L1108-L1166 HydrophobicContact CD2-CD1 4.28Å; L1108-L1166 HydrophobicContact CG-CB 4.36Å; M1111-L1166 HydrophobicContact CG-CD1 3.79Å; R1162-L1166 WeakPolarHBondContact O-CG 3.23Å; R1162-L1166 PolarHBondContact O-N 3.42Å; L1163-L1166 PolarHBondContact O-N 3.44Å; L1166-L1168 PolarHBondContact O-N 3.42Å; L1166-Q1169 PolarHBondContact O-N 3.47Å; L1166-S1170 WeakPolarHBondContact O-CB 3.49Å; L1166-S1170 PolarHBondContact O-N 3.42Å
1167	L	89.4	Confident	87	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.9	-43.4	177	-71.5	171.6	0	0	0	111.3	L1108 L1163 F1165 Q1169 S1170 I1171 N1194 I1197 Y1198 L1201 L1226	L1108-L1167 HydrophobicContact CD2-CD2 4.06Å; L1108-L1167 HydrophobicContact CD2-CG 4.32Å; L1163-L1167 HydrophobicContact CD1-CD1 4.15Å; L1163-L1167 HydrophobicContact CD1-CG 4.27Å; L1163-L1167 HydrophobicContact CG-CD1 3.98Å; L1163-L1167 WeakPolarHBondContact O-CB 3.2Å; L1163-L1167 VanDerWaalsContact O-CG 3.28Å; L1163-L1167 WeakPolarHBondContact O-CG 3.28Å; L1163-L1167 PolarHBondContact O-N 2.87Å; F1165-L1167 PolarHBondContact O-N 3.41Å; L1167-Q1169 PolarHBondContact O-N 3.35Å; L1167-S1170 WeakPolarHBondContact O-CB 3.33Å; L1167-S1170 PolarHBondContact O-N 2.99Å; L1167-I1171 WeakPolarHBondContact O-CB 3.29Å; L1167-I1171 WeakPolarHBondContact O-CD1 3.41Å; L1167-I1171 WeakPolarHBondContact O-CG1 3.29Å; L1167-I1171 PolarHBondContact O-N 2.94Å; L1167-N1194 HydrophobicContact CD2-CB 4Å; L1167-I1197 HydrophobicContact CD1-CG2 3.93Å; L1167-Y1198 HydrophobicContact CB-CD2 3.85Å; L1167-Y1198 HydrophobicContact CB-CG 4.38Å; L1167-L1201 HydrophobicContact CD1-CD2 4.46Å; L1167-L1226 HydrophobicContact CD2-CD2 4.04Å
1168	L	90.3	Very high	85.5	Confident	52 Å²	52	42.9 Å²	42.9	27%	0.272	22%	0.22	S	C	.	.	H	α-helix	trans	-63.1	-42.9	177.4	-177.9	62.9	0	0	0	112.1	S1164 F1165 L1166 I1171 K1172 Y1198	S1164-L1168 VanDerWaalsContact O-CB 3.3Å; S1164-L1168 WeakPolarHBondContact O-CB 3.36Å; S1164-L1168 PolarHBondContact O-N 2.85Å; F1165-L1168 PolarHBondContact O-N 3.49Å; L1166-L1168 PolarHBondContact O-N 3.42Å; L1168-I1171 PolarHBondContact O-N 3.35Å; L1168-K1172 HydrophobicContact CG-CD 4.41Å; L1168-K1172 WeakPolarHBondContact O-CG 3.42Å; L1168-K1172 PolarHBondContact O-N 3.48Å; L1168-Y1198 HydrophobicContact CB-CE2 3.92Å; L1168-Y1198 HydrophobicContact CD1-CE1 4.26Å
1169	Q	87.6	Confident	83.8	Confident	50 Å²	50	48.2 Å²	48.2	23%	0.234	24%	0.241	C	C	.	.	H	α-helix	trans	-66.7	-38.9	176.7	-67	-57.9	-22.3	0	0	111.7	L1104 F1165 L1166 L1167 K1172 L1173	L1104-Q1169 HydrophobicContact CD1-CB 3.54Å; F1165-Q1169 HydrophobicContact CD1-CG 4.3Å; F1165-Q1169 HydrophobicContact CD2-CG 4.28Å; F1165-Q1169 HydrophobicContact CE1-CG 3.92Å; F1165-Q1169 HydrophobicContact CE2-CG 3.91Å; F1165-Q1169 HydrophobicContact CG-CG 4.47Å; F1165-Q1169 HydrophobicContact CZ-CG 3.71Å; F1165-Q1169 WeakPolarHBondContact O-CG 3.09Å; F1165-Q1169 PolarHBondContact O-N 2.94Å; L1166-Q1169 PolarHBondContact O-N 3.47Å; L1167-Q1169 PolarHBondContact O-N 3.35Å; Q1169-K1172 PolarHBondContact O-N 2.94Å; Q1169-L1173 WeakPolarHBondContact O-CG 3.49Å; Q1169-L1173 PolarHBondContact O-N 2.94Å
1170	S	86	Confident	81.8	Confident	5 Å²	5	56.5 Å²	56.5	4%	0.035	28%	0.277	C	S	.	.	H	α-helix	trans	-56.3	-51.6	172.4	-163	0	0	0	0	111.2	L1104 L1166 L1167 K1172 L1173 L1174 N1194	L1104-S1170 WeakPolarHBondContact CD2-OG 3.45Å; L1166-S1170 WeakPolarHBondContact O-CB 3.49Å; L1166-S1170 PolarHBondContact O-N 3.42Å; L1167-S1170 WeakPolarHBondContact O-CB 3.33Å; L1167-S1170 PolarHBondContact O-N 2.99Å; S1170-K1172 VanDerWaalsContact C-N 3.33Å; S1170-K1172 PolarHBondContact O-N 2.82Å; S1170-L1173 PolarHBondContact O-N 3.31Å; S1170-L1174 VanDerWaalsContact O-CB 3.31Å; S1170-L1174 WeakPolarHBondContact O-CB 3.45Å; S1170-L1174 WeakPolarHBondContact O-CG 3.48Å; S1170-L1174 PolarHBondContact O-N 3Å; S1170-N1194 PolarHBondContact OG-ND2 3.17Å
1171	I	87.8	Confident	80.1	Confident	21 Å²	21	60.7 Å²	60.7	11%	0.108	30%	0.304	C	S	.	.	H	α-helix	trans	-61	-42.1	-179.5	-67.2	161.1	0	0	0	110.8	L1167 L1168 S1175 L1191 N1194 K1195 Y1198	L1167-I1171 WeakPolarHBondContact O-CB 3.29Å; L1167-I1171 WeakPolarHBondContact O-CD1 3.41Å; L1167-I1171 WeakPolarHBondContact O-CG1 3.29Å; L1167-I1171 PolarHBondContact O-N 2.94Å; L1168-I1171 PolarHBondContact O-N 3.35Å; I1171-S1175 WeakPolarHBondContact O-CB 3.44Å; I1171-S1175 PolarHBondContact O-N 3.36Å; I1171-S1175 PolarHBondContact O-OG 3.36Å; I1171-L1191 HydrophobicContact CB-CD1 4.21Å; I1171-L1191 HydrophobicContact CG1-CD1 4.23Å; I1171-L1191 HydrophobicContact CG2-CD1 3.99Å; I1171-N1194 HydrophobicContact CD1-CB 4.46Å; I1171-N1194 HydrophobicContact CG1-CB 4.05Å; I1171-K1195 HydrophobicContact CD1-CB 4.44Å; I1171-K1195 HydrophobicContact CD1-CG 3.83Å; I1171-K1195 HydrophobicContact CG1-CG 3.95Å; I1171-K1195 HydrophobicContact CG2-CG 4.08Å; I1171-Y1198 HydrophobicContact CD1-CD1 4.29Å; I1171-Y1198 HydrophobicContact CD1-CG 4.18Å
1172	K	86.6	Confident	77.8	Confident	106 Å²	106	62.2 Å²	62.2	46%	0.461	31%	0.314	S	S	.	.	H	α-helix	trans	-63.8	-46.8	177.4	-76.2	175.4	179.3	178.2	0	112	L1168 Q1169 S1170 S1175 S1176	L1168-K1172 HydrophobicContact CG-CD 4.41Å; L1168-K1172 WeakPolarHBondContact O-CG 3.42Å; L1168-K1172 PolarHBondContact O-N 3.48Å; Q1169-K1172 PolarHBondContact O-N 2.94Å; S1170-K1172 VanDerWaalsContact C-N 3.33Å; S1170-K1172 PolarHBondContact O-N 2.82Å; K1172-S1175 PolarHBondContact O-OG 2.78Å; K1172-S1176 WeakPolarHBondContact O-CB 3.49Å; K1172-S1176 PolarHBondContact O-N 3.5Å; K1172-S1176 PolarHBondContact O-OG 3.31Å
1173	L	83.1	Confident	76	Confident	25 Å²	25	64.7 Å²	64.7	13%	0.131	34%	0.335	C	S	.	.	H	α-helix	trans	-68.7	-46.3	-178.9	-71.7	173.5	0	0	0	111.8	K1100 L1101 Q1169 S1170 S1176 T1177	K1100-L1173 HydrophobicContact CB-CD1 3.95Å; L1101-L1173 HydrophobicContact CD2-CB 3.52Å; L1101-L1173 HydrophobicContact CD2-CD1 4.2Å; L1101-L1173 HydrophobicContact CG-CB 4.01Å; L1101-L1173 HydrophobicContact CG-CD1 4.35Å; Q1169-L1173 WeakPolarHBondContact O-CG 3.49Å; Q1169-L1173 PolarHBondContact O-N 2.94Å; S1170-L1173 PolarHBondContact O-N 3.31Å; L1173-S1176 PolarHBondContact O-N 3.02Å; L1173-S1176 PolarHBondContact O-OG 3.01Å; L1173-T1177 PolarHBondContact O-N 3.4Å; L1173-T1177 PolarHBondContact O-OG1 3.45Å
1174	L	81.9	Confident	74.4	Confident	12 Å²	12	69.1 Å²	69.1	6%	0.063	36%	0.359	C	S	.	.	H	α-helix	trans	-64.3	-38.1	177.4	-71	171	0	0	0	112.6	L1101 S1170 S1176 T1177 K1178 D1187 V1190 L1191	L1101-L1174 HydrophobicContact CD1-CD2 4.4Å; L1101-L1174 HydrophobicContact CD2-CD2 3.98Å; L1101-L1174 HydrophobicContact CD2-CG 3.96Å; S1170-L1174 VanDerWaalsContact O-CB 3.31Å; S1170-L1174 WeakPolarHBondContact O-CB 3.45Å; S1170-L1174 WeakPolarHBondContact O-CG 3.48Å; S1170-L1174 PolarHBondContact O-N 3Å; L1174-S1176 VanDerWaalsContact C-N 3.34Å; L1174-T1177 VanDerWaalsContact CA-OG1 3.3Å; L1174-T1177 WeakPolarHBondContact CA-OG1 3.13Å; L1174-T1177 PolarHBondContact O-N 3.45Å; L1174-T1177 PolarHBondContact O-OG1 3.49Å; L1174-K1178 WeakPolarHBondContact O-CB 3.26Å; L1174-K1178 PolarHBondContact O-N 2.93Å; L1174-D1187 HydrophobicContact CD2-CB 4.13Å; L1174-V1190 HydrophobicContact CD1-CG1 4.08Å; L1174-L1191 HydrophobicContact CB-CB 4.45Å; L1174-L1191 HydrophobicContact CB-CD1 3.98Å; L1174-L1191 HydrophobicContact CD1-CB 4.3Å
1175	S	81.1	Confident	73.2	Confident	47 Å²	47	75.1 Å²	75.1	33%	0.329	39%	0.387	S	S	.	.	H	α-helix	trans	-70.7	-28.4	174.8	61.1	0	0	0	0	113.3	I1171 K1172	I1171-S1175 WeakPolarHBondContact O-CB 3.44Å; I1171-S1175 PolarHBondContact O-N 3.36Å; I1171-S1175 PolarHBondContact O-OG 3.36Å; K1172-S1175 PolarHBondContact O-OG 2.78Å
1176	S	71.9	Confident	71.9	Confident	48 Å²	48	75.7 Å²	75.7	34%	0.336	39%	0.391	S	S	.	.	H	α-helix	trans	-76.1	-32.2	174.1	78.8	0	0	0	0	113.1	K1172 L1173 L1174 K1179	K1172-S1176 WeakPolarHBondContact O-CB 3.49Å; K1172-S1176 PolarHBondContact O-N 3.5Å; K1172-S1176 PolarHBondContact O-OG 3.31Å; L1173-S1176 PolarHBondContact O-N 3.02Å; L1173-S1176 PolarHBondContact O-OG 3.01Å; L1174-S1176 VanDerWaalsContact C-N 3.34Å; S1176-K1179 PolarHBondContact O-N 3.15Å
1177	T	63.3	Low	70.8	Confident	33 Å²	33	78.7 Å²	78.7	20%	0.202	41%	0.407	C	S	.	.	H	α-helix	trans	-74.2	-35.2	175.2	14.4	0	0	0	0	111.6	L1173 L1174 K1179 K1180 T1181	L1173-T1177 PolarHBondContact O-N 3.4Å; L1173-T1177 PolarHBondContact O-OG1 3.45Å; L1174-T1177 VanDerWaalsContact CA-OG1 3.3Å; L1174-T1177 WeakPolarHBondContact CA-OG1 3.13Å; L1174-T1177 PolarHBondContact O-N 3.45Å; L1174-T1177 PolarHBondContact O-OG1 3.49Å; T1177-K1179 PolarHBondContact O-N 3.45Å; T1177-K1179 VanDerWaalsContact O-N 3.13Å; T1177-K1180 PolarHBondContact O-N 2.88Å; T1177-T1181 PolarHBondContact O-N 2.93Å; T1177-T1181 VanDerWaalsContact O-N 3.11Å
1178	K	58.8	Low	70.1	Confident	124 Å²	124	80.5 Å²	80.5	54%	0.539	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-23.3	172.5	-161.8	172.6	-176.1	175.1	0	113.8	L1174 D1188 L1191	L1174-K1178 WeakPolarHBondContact O-CB 3.26Å; L1174-K1178 PolarHBondContact O-N 2.93Å; K1178-D1188 IonicContact NZ-OD1 3.6Å; K1178-D1188 PolarHBondContact NZ-OD1 2.8Å; K1178-L1191 HydrophobicContact CD-CD2 4.4Å
1179	K	55.3	Low	69.5	Low	192 Å²	192	80.5 Å²	80.5	84%	0.835	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-13.7	172.8	-71.7	-175.2	177.7	-177.6	0	114	S1176 T1177	S1176-K1179 PolarHBondContact O-N 3.15Å; T1177-K1179 PolarHBondContact O-N 3.45Å; T1177-K1179 VanDerWaalsContact O-N 3.13Å
1180	K	53.2	Low	69.1	Low	175 Å²	175	80.4 Å²	80.4	76%	0.761	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.2	-23	-175.9	-74.7	-173.2	174.6	-175	0	114.5	T1177	T1177-K1180 PolarHBondContact O-N 2.88Å
1181	T	53.6	Low	69	Low	106 Å²	106	80.5 Å²	80.5	65%	0.65	43%	0.427	S	S	*	.			trans	-143.2	107.2	-179.3	-5.1	0	0	0	0	109.5	T1177 N1183	T1177-T1181 PolarHBondContact O-N 2.93Å; T1177-T1181 VanDerWaalsContact O-N 3.11Å; T1181-N1183 PolarHBondContact O-N 3.43Å
1182	S	45.2	Very low	68.7	Low	104 Å²	104	85.8 Å²	85.8	73%	0.727	45%	0.449	S	S	*	.	S	Bend	trans	-86	105.6	175.4	59.1	0	0	0	0	109.7
1183	N	53.5	Low	68.6	Low	154 Å²	154	82.9 Å²	82.9	82%	0.824	44%	0.44	S	S	*	.			trans	129.9	61.8	161.2	-65.5	-11	0	0	0	113.7	T1181	T1181-N1183 PolarHBondContact O-N 3.43Å
1184	N	60.5	Low	68.8	Low	94 Å²	94	82 Å²	82	50%	0.503	44%	0.436	S	S	.	.			trans	-118.3	103.2	159.5	-138.1	12.2	0	0	0	108.3	E1186 D1187 D1188	N1184-E1186 VanDerWaalsContact C-N 3.32Å; N1184-D1187 HydrophobicContact CB-CB 4.22Å; N1184-D1187 WeakPolarHBondContact CB-OD2 3.26Å; N1184-D1187 PolarHBondContact ND2-OD2 3.16Å; N1184-D1188 PolarHBondContact O-N 3.02Å
1185	I	64	Low	69	Low	152 Å²	152	86.6 Å²	86.6	78%	0.779	46%	0.455	S	S	*	.	H	α-helix	trans	-67.7	-34.7	-172.8	-65.8	170.9	0	0	0	110.8	D1188 A1189	I1185-D1188 PolarHBondContact O-N 3.35Å; I1185-A1189 PolarHBondContact O-N 3.12Å
1186	E	65.4	Low	69.3	Low	89 Å²	89	88.8 Å²	88.8	42%	0.416	46%	0.46	S	S	.	.	H	α-helix	trans	-64.4	-47.1	178.4	-66.3	-180	174.3	0	0	112.1	N1184 D1188 A1189 V1190	N1184-E1186 VanDerWaalsContact C-N 3.32Å; E1186-D1188 PolarHBondContact O-N 3.08Å; E1186-A1189 PolarHBondContact O-N 3.07Å; E1186-V1190 WeakPolarHBondContact O-CG2 3.46Å; E1186-V1190 PolarHBondContact O-N 2.93Å
1187	D	69	Low	70.1	Confident	64 Å²	64	86.5 Å²	86.5	34%	0.342	44%	0.444	S	S	.	.	H	α-helix	trans	-62.2	-30.6	178	-70.9	-29.5	0	0	0	112.3	L1174 N1184 L1191	L1174-D1187 HydrophobicContact CD2-CB 4.13Å; N1184-D1187 HydrophobicContact CB-CB 4.22Å; N1184-D1187 WeakPolarHBondContact CB-OD2 3.26Å; N1184-D1187 PolarHBondContact ND2-OD2 3.16Å; D1187-L1191 WeakPolarHBondContact O-CB 3.33Å; D1187-L1191 PolarHBondContact O-N 3.48Å
1188	D	74.3	Confident	71.3	Confident	38 Å²	38	87.2 Å²	87.2	20%	0.203	44%	0.443	C	S	.	.	H	α-helix	trans	-74.7	-36.2	177.2	-164.6	58.4	0	0	0	112.5	K1178 N1184 I1185 E1186 K1192	K1178-D1188 IonicContact NZ-OD1 3.6Å; K1178-D1188 PolarHBondContact NZ-OD1 2.8Å; N1184-D1188 PolarHBondContact O-N 3.02Å; I1185-D1188 PolarHBondContact O-N 3.35Å; E1186-D1188 PolarHBondContact O-N 3.08Å; D1188-K1192 WeakPolarHBondContact O-CG 3.25Å; D1188-K1192 PolarHBondContact O-N 2.65Å; D1188-K1192 WeakPolarHBondContact OD2-CE 3.38Å; D1188-K1192 IonicContact OD2-NZ 2.64Å; D1188-K1192 PolarHBondContact OD2-NZ 3.48Å
1189	A	77.6	Confident	72.7	Confident	52 Å²	52	83 Å²	83	43%	0.43	43%	0.429	S	S	.	.	H	α-helix	trans	-67.4	-44.4	174.2	0	0	0	0	0	111.4	I1185 E1186 K1192 T1193	I1185-A1189 PolarHBondContact O-N 3.12Å; E1186-A1189 PolarHBondContact O-N 3.07Å; A1189-K1192 PolarHBondContact O-N 3.19Å; A1189-T1193 WeakPolarHBondContact O-CB 3.14Å; A1189-T1193 PolarHBondContact O-N 3.48Å; A1189-T1193 PolarHBondContact O-OG1 3.43Å
1190	V	80.1	Confident	74.3	Confident	47 Å²	47	76.2 Å²	76.2	29%	0.285	40%	0.401	S	S	.	.	H	α-helix	trans	-63.8	-41.6	175.2	175.5	0	0	0	0	110.9	L1174 E1186 K1192 T1193 N1194	L1174-V1190 HydrophobicContact CD1-CG1 4.08Å; E1186-V1190 WeakPolarHBondContact O-CG2 3.46Å; E1186-V1190 PolarHBondContact O-N 2.93Å; V1190-K1192 PolarHBondContact O-N 3.44Å; V1190-T1193 PolarHBondContact O-N 3.46Å; V1190-N1194 WeakPolarHBondContact O-CB 3.43Å; V1190-N1194 PolarHBondContact O-N 3.01Å
1191	L	82.2	Confident	76	Confident	8 Å²	8	68 Å²	68	4%	0.042	37%	0.365	C	S	.	.	H	α-helix	trans	-62.3	-41.9	176.7	179.1	61.1	0	0	0	112.9	I1171 L1174 K1178 D1187 K1195	I1171-L1191 HydrophobicContact CB-CD1 4.21Å; I1171-L1191 HydrophobicContact CG1-CD1 4.23Å; I1171-L1191 HydrophobicContact CG2-CD1 3.99Å; L1174-L1191 HydrophobicContact CB-CB 4.45Å; L1174-L1191 HydrophobicContact CB-CD1 3.98Å; L1174-L1191 HydrophobicContact CD1-CB 4.3Å; K1178-L1191 HydrophobicContact CD-CD2 4.4Å; D1187-L1191 WeakPolarHBondContact O-CB 3.33Å; D1187-L1191 PolarHBondContact O-N 3.48Å; L1191-K1195 WeakPolarHBondContact O-CB 3.39Å; L1191-K1195 WeakPolarHBondContact O-CG 3.4Å; L1191-K1195 PolarHBondContact O-N 3.16Å; L1191-K1195 VanDerWaalsContact O-N 3.1Å
1192	K	83.3	Confident	77.6	Confident	131 Å²	131	66.5 Å²	66.5	57%	0.57	35%	0.353	S	S	*	.	H	α-helix	trans	-65.2	-45.5	176.5	-76	171.9	-170.8	156.2	0	111.3	D1188 A1189 V1190 K1195 H1196	D1188-K1192 WeakPolarHBondContact O-CG 3.25Å; D1188-K1192 PolarHBondContact O-N 2.65Å; D1188-K1192 WeakPolarHBondContact OD2-CE 3.38Å; D1188-K1192 IonicContact OD2-NZ 2.64Å; D1188-K1192 PolarHBondContact OD2-NZ 3.48Å; A1189-K1192 PolarHBondContact O-N 3.19Å; V1190-K1192 PolarHBondContact O-N 3.44Å; K1192-K1195 PolarHBondContact O-N 3.3Å; K1192-H1196 PolarHBondContact O-N 3.21Å
1193	T	84.4	Confident	79.5	Confident	45 Å²	45	69.9 Å²	69.9	28%	0.276	35%	0.35	S	S	.	.	H	α-helix	trans	-61.6	-47.8	178.5	-54.1	0	0	0	0	111	A1189 V1190 K1195 H1196 I1197	A1189-T1193 WeakPolarHBondContact O-CB 3.14Å; A1189-T1193 PolarHBondContact O-N 3.48Å; A1189-T1193 PolarHBondContact O-OG1 3.43Å; V1190-T1193 PolarHBondContact O-N 3.46Å; T1193-K1195 PolarHBondContact O-N 3.23Å; T1193-H1196 WeakPolarHBondContact O-CB 3.42Å; T1193-H1196 PolarHBondContact O-N 3.29Å; T1193-H1196 VanDerWaalsContact O-N 3.16Å; T1193-I1197 HydrophobicContact CG2-CD1 3.69Å; T1193-I1197 WeakPolarHBondContact O-CG1 3.28Å; T1193-I1197 PolarHBondContact O-N 3.38Å
1194	N	85.9	Confident	80.9	Confident	8 Å²	8	63.9 Å²	63.9	4%	0.043	32%	0.321	C	S	.	.	H	α-helix	trans	-62.6	-39.6	178.5	-71	-8.3	0	0	0	112.5	L1167 S1170 I1171 V1190 Y1198	L1167-N1194 HydrophobicContact CD2-CB 4Å; S1170-N1194 PolarHBondContact OG-ND2 3.17Å; I1171-N1194 HydrophobicContact CD1-CB 4.46Å; I1171-N1194 HydrophobicContact CG1-CB 4.05Å; V1190-N1194 WeakPolarHBondContact O-CB 3.43Å; V1190-N1194 PolarHBondContact O-N 3.01Å; N1194-Y1198 WeakPolarHBondContact O-CB 3.4Å; N1194-Y1198 PolarHBondContact O-N 3.23Å
1195	K	86.3	Confident	81.9	Confident	108 Å²	108	62 Å²	62	47%	0.47	31%	0.313	S	S	.	.	H	α-helix	trans	-64.2	-41.5	174.4	-77.6	179.7	179.5	-176.9	0	112.4	I1171 L1191 K1192 T1193 S1199	I1171-K1195 HydrophobicContact CD1-CB 4.44Å; I1171-K1195 HydrophobicContact CD1-CG 3.83Å; I1171-K1195 HydrophobicContact CG1-CG 3.95Å; I1171-K1195 HydrophobicContact CG2-CG 4.08Å; L1191-K1195 WeakPolarHBondContact O-CB 3.39Å; L1191-K1195 WeakPolarHBondContact O-CG 3.4Å; L1191-K1195 PolarHBondContact O-N 3.16Å; L1191-K1195 VanDerWaalsContact O-N 3.1Å; K1192-K1195 PolarHBondContact O-N 3.3Å; T1193-K1195 PolarHBondContact O-N 3.23Å; K1195-S1199 WeakPolarHBondContact O-CB 3.11Å; K1195-S1199 PolarHBondContact O-N 3.11Å
1196	H	87.8	Confident	82.8	Confident	93 Å²	93	58.3 Å²	58.3	43%	0.431	31%	0.305	S	S	.	.	H	α-helix	trans	-61.7	-52.2	178.9	-174.6	70.7	0	0	0	110.9	K1192 T1193 Y1198 S1199 Q1200	K1192-H1196 PolarHBondContact O-N 3.21Å; T1193-H1196 WeakPolarHBondContact O-CB 3.42Å; T1193-H1196 PolarHBondContact O-N 3.29Å; T1193-H1196 VanDerWaalsContact O-N 3.16Å; H1196-Y1198 PolarHBondContact O-N 3.05Å; H1196-S1199 PolarHBondContact O-N 3.09Å; H1196-S1199 PolarHBondContact O-OG 3.31Å; H1196-Q1200 PolarHBondContact CE1-NE2 2.86Å; H1196-Q1200 PolarHBondContact NE2-NE2 2.92Å; H1196-Q1200 PolarHBondContact O-N 2.85Å; H1196-Q1200 VanDerWaalsContact O-N 3.11Å
1197	I	87.9	Confident	83.5	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-66.3	-40.6	-177.9	-63.9	173.4	0	0	0	110.9	L1167 T1193 S1199 Q1200 L1201 L1222 Q1225 L1226	L1167-I1197 HydrophobicContact CD1-CG2 3.93Å; T1193-I1197 HydrophobicContact CG2-CD1 3.69Å; T1193-I1197 WeakPolarHBondContact O-CG1 3.28Å; T1193-I1197 PolarHBondContact O-N 3.38Å; I1197-S1199 VanDerWaalsContact C-N 3.32Å; I1197-S1199 PolarHBondContact O-N 3.23Å; I1197-Q1200 PolarHBondContact O-N 3.23Å; I1197-L1201 WeakPolarHBondContact O-CB 3.37Å; I1197-L1201 PolarHBondContact O-N 3.35Å; I1197-L1222 HydrophobicContact CG2-CB 4.33Å; I1197-L1222 HydrophobicContact CG2-CD2 4.12Å; I1197-Q1225 HydrophobicContact CD1-CB 3.73Å; I1197-Q1225 HydrophobicContact CG1-CB 4.24Å; I1197-L1226 HydrophobicContact CD1-CB 4.35Å; I1197-L1226 HydrophobicContact CD1-CD2 3.5Å; I1197-L1226 HydrophobicContact CD1-CG 3.58Å; I1197-L1226 HydrophobicContact CG2-CD1 4.19Å; I1197-L1226 HydrophobicContact CG2-CD2 4.2Å; I1197-L1226 HydrophobicContact CG2-CG 4.03Å
1198	Y	89.6	Confident	83.7	Confident	48 Å²	48	64.5 Å²	64.5	19%	0.188	33%	0.331	C	S	.	.	H	α-helix	trans	-58.3	-42.9	173.5	-177	-110.7	0	0	0	112.3	S1164 L1167 L1168 I1171 N1194 H1196 L1201 L1202	S1164-Y1198 VanDerWaalsContact O-CE2 3.26Å; S1164-Y1198 WeakPolarHBondContact O-CE2 3.31Å; S1164-Y1198 WeakPolarHBondContact OG-CE2 3.48Å; L1167-Y1198 HydrophobicContact CB-CD2 3.85Å; L1167-Y1198 HydrophobicContact CB-CG 4.38Å; L1168-Y1198 HydrophobicContact CB-CE2 3.92Å; L1168-Y1198 HydrophobicContact CD1-CE1 4.26Å; I1171-Y1198 HydrophobicContact CD1-CD1 4.29Å; I1171-Y1198 HydrophobicContact CD1-CG 4.18Å; N1194-Y1198 WeakPolarHBondContact O-CB 3.4Å; N1194-Y1198 PolarHBondContact O-N 3.23Å; H1196-Y1198 PolarHBondContact O-N 3.05Å; Y1198-L1201 PolarHBondContact O-N 3.24Å; Y1198-L1202 HydrophobicContact CD1-CD1 3.96Å; Y1198-L1202 HydrophobicContact CE1-CD1 3.45Å; Y1198-L1202 VanDerWaalsContact CE1-CD1 3.45Å; Y1198-L1202 HydrophobicContact CE1-CG 4.3Å; Y1198-L1202 HydrophobicContact CE2-CD1 4.34Å; Y1198-L1202 HydrophobicContact CE2-CG 4.39Å; Y1198-L1202 WeakPolarHBondContact O-CG 2.75Å; Y1198-L1202 PolarHBondContact O-N 3.41Å
1199	S	88.4	Confident	83.9	Confident	35 Å²	35	68.8 Å²	68.8	25%	0.245	36%	0.359	C	S	.	.	H	α-helix	trans	-66.3	-37.3	178.4	78.1	0	0	0	0	113	K1195 H1196 I1197 R1203	K1195-S1199 WeakPolarHBondContact O-CB 3.11Å; K1195-S1199 PolarHBondContact O-N 3.11Å; H1196-S1199 PolarHBondContact O-N 3.09Å; H1196-S1199 PolarHBondContact O-OG 3.31Å; I1197-S1199 VanDerWaalsContact C-N 3.32Å; I1197-S1199 PolarHBondContact O-N 3.23Å; S1199-R1203 WeakPolarHBondContact O-CG 3.48Å; S1199-R1203 PolarHBondContact O-N 3.36Å
1200	Q	88.1	Confident	84	Confident	50 Å²	50	67.4 Å²	67.4	23%	0.234	35%	0.348	C	S	.	.	H	α-helix	trans	-70.9	-42.5	177.4	-71.1	-177	-12.5	0	0	111.5	H1196 I1197 L1202 R1203 A1204 L1222	H1196-Q1200 PolarHBondContact CE1-NE2 2.86Å; H1196-Q1200 PolarHBondContact NE2-NE2 2.92Å; H1196-Q1200 PolarHBondContact O-N 2.85Å; H1196-Q1200 VanDerWaalsContact O-N 3.11Å; I1197-Q1200 PolarHBondContact O-N 3.23Å; Q1200-L1202 VanDerWaalsContact C-N 3.35Å; Q1200-L1202 PolarHBondContact O-N 3.39Å; Q1200-R1203 PolarHBondContact O-N 3.49Å; Q1200-A1204 WeakPolarHBondContact O-CB 3.32Å; Q1200-A1204 PolarHBondContact O-N 3.02Å; Q1200-L1222 HydrophobicContact CB-CD2 3.67Å
1201	L	89	Confident	84.3	Confident	1 Å²	1	68.8 Å²	68.8	1%	0.005	36%	0.356	C	S	.	.	H	α-helix	trans	-59.6	-42.8	175.3	-176.6	66.3	0	0	0	112	E1160 L1163 L1167 I1197 Y1198 R1203 A1204 T1205 I1219 L1222	E1160-L1201 HydrophobicContact CG-CD1 4.4Å; L1163-L1201 HydrophobicContact CB-CD2 3.88Å; L1163-L1201 HydrophobicContact CD2-CD1 4.39Å; L1163-L1201 HydrophobicContact CD2-CD2 3.94Å; L1163-L1201 HydrophobicContact CG-CD2 3.8Å; L1167-L1201 HydrophobicContact CD1-CD2 4.46Å; I1197-L1201 WeakPolarHBondContact O-CB 3.37Å; I1197-L1201 PolarHBondContact O-N 3.35Å; Y1198-L1201 PolarHBondContact O-N 3.24Å; L1201-R1203 PolarHBondContact O-N 3.24Å; L1201-A1204 PolarHBondContact O-N 2.95Å; L1201-T1205 HydrophobicContact CD1-CG2 4.2Å; L1201-T1205 HydrophobicContact CG-CG2 4.4Å; L1201-T1205 WeakPolarHBondContact O-CB 3.29Å; L1201-T1205 VanDerWaalsContact O-CG2 3.31Å; L1201-T1205 WeakPolarHBondContact O-CG2 3.41Å; L1201-T1205 PolarHBondContact O-N 2.85Å; L1201-T1205 PolarHBondContact O-OG1 3.05Å; L1201-I1219 HydrophobicContact CD1-CD1 3.77Å; L1201-L1222 HydrophobicContact CB-CD1 4.1Å; L1201-L1222 HydrophobicContact CD1-CD1 3.98Å
1202	L	86.9	Confident	84.4	Confident	75 Å²	75	69.9 Å²	69.9	39%	0.393	36%	0.362	S	S	.	.	H	α-helix	trans	-64	-37.5	176.7	-74.2	178.3	0	0	0	113.1	Y1198 Q1200 T1205 A1206	Y1198-L1202 HydrophobicContact CD1-CD1 3.96Å; Y1198-L1202 HydrophobicContact CE1-CD1 3.45Å; Y1198-L1202 VanDerWaalsContact CE1-CD1 3.45Å; Y1198-L1202 HydrophobicContact CE1-CG 4.3Å; Y1198-L1202 HydrophobicContact CE2-CD1 4.34Å; Y1198-L1202 HydrophobicContact CE2-CG 4.39Å; Y1198-L1202 WeakPolarHBondContact O-CG 2.75Å; Y1198-L1202 PolarHBondContact O-N 3.41Å; Q1200-L1202 VanDerWaalsContact C-N 3.35Å; Q1200-L1202 PolarHBondContact O-N 3.39Å; L1202-T1205 WeakPolarHBondContact CA-OG1 3.43Å; L1202-T1205 PolarHBondContact O-OG1 3.19Å; L1202-A1206 WeakPolarHBondContact O-CB 3.31Å; L1202-A1206 PolarHBondContact O-N 3.38Å
1203	R	86.1	Confident	84.5	Confident	176 Å²	176	65.5 Å²	65.5	66%	0.664	35%	0.345	S	S	*	.	H	α-helix	trans	-69.6	-39.9	175.3	-70	179.2	-165.3	135.4	2.5	111.8	S1199 Q1200 L1201 A1206	S1199-R1203 WeakPolarHBondContact O-CG 3.48Å; S1199-R1203 PolarHBondContact O-N 3.36Å; Q1200-R1203 PolarHBondContact O-N 3.49Å; L1201-R1203 PolarHBondContact O-N 3.24Å; R1203-A1206 PolarHBondContact O-N 3.5Å
1204	A	82.6	Confident	84.6	Confident	27 Å²	27	68.1 Å²	68.1	22%	0.223	35%	0.354	C	S	.	.	H	α-helix	trans	-66.3	-46.2	179.1	0	0	0	0	0	112	Q1200 L1201 A1206 N1207 V1218	Q1200-A1204 WeakPolarHBondContact O-CB 3.32Å; Q1200-A1204 PolarHBondContact O-N 3.02Å; L1201-A1204 PolarHBondContact O-N 2.95Å; A1204-A1206 VanDerWaalsContact C-N 3.29Å; A1204-A1206 PolarHBondContact O-N 3.26Å; A1204-N1207 WeakPolarHBondContact O-CB 3.35Å; A1204-N1207 PolarHBondContact O-N 3.48Å; A1204-V1218 HydrophobicContact CB-CG1 3.69Å
1205	T	81.5	Confident	84.7	Confident	56 Å²	56	69.8 Å²	69.8	34%	0.344	36%	0.36	S	S	.	.	H	α-helix	trans	-67.1	-25.8	178.1	49.5	0	0	0	0	113.6	E1160 L1201 L1202 N1207	E1160-T1205 HydrophobicContact CB-CG2 3.87Å; E1160-T1205 HydrophobicContact CG-CG2 3.93Å; L1201-T1205 HydrophobicContact CD1-CG2 4.2Å; L1201-T1205 HydrophobicContact CG-CG2 4.4Å; L1201-T1205 WeakPolarHBondContact O-CB 3.29Å; L1201-T1205 VanDerWaalsContact O-CG2 3.31Å; L1201-T1205 WeakPolarHBondContact O-CG2 3.41Å; L1201-T1205 PolarHBondContact O-N 2.85Å; L1201-T1205 PolarHBondContact O-OG1 3.05Å; L1202-T1205 WeakPolarHBondContact CA-OG1 3.43Å; L1202-T1205 PolarHBondContact O-OG1 3.19Å; T1205-N1207 VanDerWaalsContact C-N 3.31Å
1206	A	81.6	Confident	84.8	Confident	74 Å²	74	64.7 Å²	64.7	61%	0.612	34%	0.337	S	S	*	.	H	α-helix	trans	-73.7	-19.6	174.5	0	0	0	0	0	113.6	L1202 R1203 A1204 K1208	L1202-A1206 WeakPolarHBondContact O-CB 3.31Å; L1202-A1206 PolarHBondContact O-N 3.38Å; R1203-A1206 PolarHBondContact O-N 3.5Å; A1204-A1206 VanDerWaalsContact C-N 3.29Å; A1204-A1206 PolarHBondContact O-N 3.26Å; A1206-K1208 PolarHBondContact O-N 3.48Å; A1206-K1208 VanDerWaalsContact O-N 3.11Å
1207	N	81.6	Confident	84.8	Confident	77 Å²	77	63.1 Å²	63.1	41%	0.412	33%	0.332	S	S	.	.			trans	-80.9	88.7	-179.2	-174.8	1.7	0	0	0	111.5	A1204 T1205 T1209 A1210	A1204-N1207 WeakPolarHBondContact O-CB 3.35Å; A1204-N1207 PolarHBondContact O-N 3.48Å; T1205-N1207 VanDerWaalsContact C-N 3.31Å; N1207-T1209 PolarHBondContact O-N 3.48Å; N1207-T1209 PolarHBondContact OD1-N 3.33Å; N1207-T1209 PolarHBondContact OD1-OG1 3.06Å; N1207-A1210 PolarHBondContact O-N 3.02Å
1208	K	73.3	Confident	84.9	Confident	205 Å²	205	65.9 Å²	65.9	89%	0.891	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-12.1	-179.7	-64.6	-174.9	179.3	-178.6	0	114.7	A1206	A1206-K1208 PolarHBondContact O-N 3.48Å; A1206-K1208 VanDerWaalsContact O-N 3.11Å
1209	T	76.9	Confident	85	Confident	129 Å²	129	63.7 Å²	63.7	79%	0.791	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-5.6	-179.5	45.8	0	0	0	0	113.9	N1207	N1207-T1209 PolarHBondContact O-N 3.48Å; N1207-T1209 PolarHBondContact OD1-N 3.33Å; N1207-T1209 PolarHBondContact OD1-OG1 3.06Å
1210	A	81.1	Confident	85	Confident	23 Å²	23	63 Å²	63	19%	0.19	34%	0.335	C	S	.	.			trans	-69.8	137	-178.5	0	0	0	0	0	112.3	N1207 E1214 R1215	N1207-A1210 PolarHBondContact O-N 3.02Å; A1210-E1214 VanDerWaalsContact CA-OE2 3.31Å; A1210-E1214 WeakPolarHBondContact CA-OE2 3.37Å; A1210-E1214 HydrophobicContact CB-CB 4.42Å; A1210-R1215 HydrophobicContact CB-CG 3.82Å
1211	T	85.2	Confident	85.1	Confident	75 Å²	75	66.4 Å²	66.4	46%	0.46	35%	0.35	S	S	.	.			trans	-69.1	160.2	175	67.2	0	0	0	0	111.3	L1213 E1214 R1215	T1211-L1213 PolarHBondContact O-N 3.07Å; T1211-E1214 PolarHBondContact N-OE2 3.09Å; T1211-E1214 PolarHBondContact O-N 2.95Å; T1211-E1214 WeakPolarHBondContact OG1-CB 3.24Å; T1211-E1214 VanDerWaalsContact OG1-CD 3.32Å; T1211-E1214 VanDerWaalsContact OG1-CG 3.23Å; T1211-E1214 WeakPolarHBondContact OG1-CG 3.33Å; T1211-E1214 PolarHBondContact OG1-N 3.1Å; T1211-E1214 PolarHBondContact OG1-OE2 3.1Å; T1211-R1215 WeakPolarHBondContact O-CG 3.48Å; T1211-R1215 PolarHBondContact O-N 3.29Å
1212	L	84.8	Confident	85.1	Confident	31 Å²	31	66.4 Å²	66.4	16%	0.162	35%	0.35	C	S	.	.	H	α-helix	trans	-55.8	-42.1	176.5	173.6	58.8	0	0	0	111.5	L1125 V1152 M1153 L1156 R1215 I1216	L1125-L1212 HydrophobicContact CD1-CD2 4.09Å; L1125-L1212 HydrophobicContact CD1-CG 4.09Å; L1125-L1212 HydrophobicContact CD2-CD2 4.33Å; V1152-L1212 HydrophobicContact CG1-CD1 4.03Å; V1152-L1212 HydrophobicContact CG1-CD2 4.22Å; M1153-L1212 HydrophobicContact CG-CD1 4.2Å; M1153-L1212 HydrophobicContact CG-CD2 4.46Å; M1153-L1212 HydrophobicContact SD-CB 4.43Å; M1153-L1212 HydrophobicContact SD-CD1 3.67Å; M1153-L1212 HydrophobicContact SD-CG 4.47Å; L1156-L1212 HydrophobicContact CD2-CD1 3.76Å; L1212-R1215 PolarHBondContact O-N 2.87Å; L1212-I1216 HydrophobicContact CD1-CD1 3.78Å; L1212-I1216 HydrophobicContact CD1-CG1 4.17Å; L1212-I1216 HydrophobicContact CG-CD1 3.96Å; L1212-I1216 WeakPolarHBondContact O-CG1 3.36Å; L1212-I1216 PolarHBondContact O-N 3.37Å
1213	L	85.6	Confident	85.3	Confident	40 Å²	40	62.8 Å²	62.8	21%	0.209	33%	0.332	C	S	.	.	H	α-helix	trans	-64.8	-43.7	178.3	-175.4	62.5	0	0	0	111.8	Q1122 L1125 V1126 T1211 R1215 I1216 N1217	Q1122-L1213 HydrophobicContact CG-CD1 4.02Å; L1125-L1213 HydrophobicContact CB-CD1 4.26Å; V1126-L1213 HydrophobicContact CG2-CD1 4.05Å; V1126-L1213 HydrophobicContact CG2-CD2 4.17Å; T1211-L1213 PolarHBondContact O-N 3.07Å; L1213-R1215 VanDerWaalsContact C-N 3.34Å; L1213-R1215 PolarHBondContact O-N 2.92Å; L1213-I1216 PolarHBondContact O-N 3.31Å; L1213-N1217 WeakPolarHBondContact O-CB 3.15Å; L1213-N1217 PolarHBondContact O-N 3.45Å; L1213-N1217 PolarHBondContact O-ND2 3.11Å; L1213-N1217 PolarHBondContact O-OD1 3.4Å
1214	E	85.7	Confident	85.2	Confident	99 Å²	99	55.8 Å²	55.8	46%	0.463	31%	0.314	S	S	.	.	H	α-helix	trans	-61.3	-42	175.9	-75.3	165.9	178.2	0	0	112.2	A1210 T1211 N1217 V1218	A1210-E1214 VanDerWaalsContact CA-OE2 3.31Å; A1210-E1214 WeakPolarHBondContact CA-OE2 3.37Å; A1210-E1214 HydrophobicContact CB-CB 4.42Å; T1211-E1214 PolarHBondContact N-OE2 3.09Å; T1211-E1214 PolarHBondContact O-N 2.95Å; T1211-E1214 WeakPolarHBondContact OG1-CB 3.24Å; T1211-E1214 VanDerWaalsContact OG1-CD 3.32Å; T1211-E1214 VanDerWaalsContact OG1-CG 3.23Å; T1211-E1214 WeakPolarHBondContact OG1-CG 3.33Å; T1211-E1214 PolarHBondContact OG1-N 3.1Å; T1211-E1214 PolarHBondContact OG1-OE2 3.1Å; E1214-N1217 PolarHBondContact O-N 3.43Å; E1214-V1218 WeakPolarHBondContact O-CG2 3.23Å; E1214-V1218 PolarHBondContact O-N 3.34Å; E1214-V1218 VanDerWaalsContact O-N 3.09Å
1215	R	88.4	Confident	85.4	Confident	44 Å²	44	56.7 Å²	56.7	17%	0.166	31%	0.314	C	S	.	.	H	α-helix	trans	-63.9	-44.3	177.1	-69.6	175.8	63.3	-163.9	2.7	111.6	M1153 L1156 E1160 A1210 T1211 L1212 L1213 V1218 I1219	M1153-R1215 PolarHBondContact SD-NH1 3.14Å; M1153-R1215 VanDerWaalsContact SD-NH1 3.45Å; L1156-R1215 HydrophobicContact CD2-CB 3.98Å; E1160-R1215 IonicContact OE1-CZ 3.67Å; E1160-R1215 IonicContact OE1-NE 3.05Å; E1160-R1215 PolarHBondContact OE1-NE 2.66Å; E1160-R1215 IonicContact OE1-NH2 2.9Å; E1160-R1215 PolarHBondContact OE1-NH2 2.94Å; E1160-R1215 IonicContact OE2-CZ 3.93Å; E1160-R1215 IonicContact OE2-NH2 3.21Å; E1160-R1215 PolarHBondContact OE2-NH2 3.33Å; A1210-R1215 HydrophobicContact CB-CG 3.82Å; T1211-R1215 WeakPolarHBondContact O-CG 3.48Å; T1211-R1215 PolarHBondContact O-N 3.29Å; L1212-R1215 PolarHBondContact O-N 2.87Å; L1213-R1215 VanDerWaalsContact C-N 3.34Å; L1213-R1215 PolarHBondContact O-N 2.92Å; R1215-V1218 PolarHBondContact O-N 3.08Å; R1215-I1219 WeakPolarHBondContact O-CG1 3.08Å; R1215-I1219 PolarHBondContact O-N 2.85Å
1216	I	88.9	Confident	85.5	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-62.6	-43.4	176.5	-69.6	169.6	0	0	0	110.8	F1118 I1121 Q1122 L1125 V1152 L1156 L1212 L1213 V1218 I1219 V1220	F1118-I1216 HydrophobicContact CB-CG2 4.28Å; F1118-I1216 HydrophobicContact CD1-CG1 4.34Å; F1118-I1216 HydrophobicContact CD1-CG2 4.23Å; I1121-I1216 HydrophobicContact CG2-CD1 3.62Å; Q1122-I1216 HydrophobicContact CB-CG2 4.03Å; L1125-I1216 HydrophobicContact CD1-CD1 3.6Å; V1152-I1216 HydrophobicContact CG1-CD1 4.25Å; L1156-I1216 HydrophobicContact CD2-CG1 4.37Å; L1212-I1216 HydrophobicContact CD1-CD1 3.78Å; L1212-I1216 HydrophobicContact CD1-CG1 4.17Å; L1212-I1216 HydrophobicContact CG-CD1 3.96Å; L1212-I1216 WeakPolarHBondContact O-CG1 3.36Å; L1212-I1216 PolarHBondContact O-N 3.37Å; L1213-I1216 PolarHBondContact O-N 3.31Å; I1216-V1218 VanDerWaalsContact C-N 3.3Å; I1216-V1218 PolarHBondContact O-N 3.4Å; I1216-I1219 PolarHBondContact O-N 3.23Å; I1216-I1219 VanDerWaalsContact O-N 3.08Å; I1216-V1220 HydrophobicContact CG2-CG2 4.25Å; I1216-V1220 WeakPolarHBondContact O-CG2 3.48Å; I1216-V1220 PolarHBondContact O-N 2.77Å
1217	N	88.4	Confident	85.4	Confident	61 Å²	61	52.7 Å²	52.7	33%	0.326	28%	0.284	S	S	.	.	H	α-helix	trans	-57.3	-42.9	177	-69	-17.7	0	0	0	112.1	Q1122 L1213 E1214 H1221	Q1122-N1217 PolarHBondContact NE2-OD1 3.03Å; L1213-N1217 WeakPolarHBondContact O-CB 3.15Å; L1213-N1217 PolarHBondContact O-N 3.45Å; L1213-N1217 PolarHBondContact O-ND2 3.11Å; L1213-N1217 PolarHBondContact O-OD1 3.4Å; E1214-N1217 PolarHBondContact O-N 3.43Å; N1217-H1221 PolarHBondContact O-N 3.32Å; N1217-H1221 VanDerWaalsContact O-N 3.08Å
1218	V	89.7	Confident	85.1	Confident	57 Å²	57	52 Å²	52	35%	0.345	29%	0.289	S	S	.	.	H	α-helix	trans	-64	-43.3	176.1	173.7	0	0	0	0	110.8	A1204 E1214 R1215 I1216 H1221 L1222	A1204-V1218 HydrophobicContact CB-CG1 3.69Å; E1214-V1218 WeakPolarHBondContact O-CG2 3.23Å; E1214-V1218 PolarHBondContact O-N 3.34Å; E1214-V1218 VanDerWaalsContact O-N 3.09Å; R1215-V1218 PolarHBondContact O-N 3.08Å; I1216-V1218 VanDerWaalsContact C-N 3.3Å; I1216-V1218 PolarHBondContact O-N 3.4Å; V1218-H1221 PolarHBondContact O-N 2.8Å; V1218-L1222 HydrophobicContact CG1-CD1 3.87Å; V1218-L1222 HydrophobicContact CG1-CG 4.24Å; V1218-L1222 VanDerWaalsContact O-CG 3.25Å; V1218-L1222 WeakPolarHBondContact O-CG 3.35Å; V1218-L1222 PolarHBondContact O-N 3.26Å
1219	I	90.6	Very high	84.5	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-62.7	-46.6	177.8	-67.6	-55.8	0	0	0	111.8	F1118 L1156 F1159 E1160 L1201 R1215 I1216 H1221 L1222 L1223	F1118-I1219 HydrophobicContact CD2-CG2 3.87Å; F1118-I1219 HydrophobicContact CE2-CG2 3.78Å; F1118-I1219 HydrophobicContact CG-CG2 4.3Å; F1118-I1219 HydrophobicContact CZ-CG2 4.17Å; L1156-I1219 HydrophobicContact CD1-CG1 3.9Å; F1159-I1219 HydrophobicContact CD1-CD1 4.37Å; F1159-I1219 HydrophobicContact CD1-CG2 4.1Å; F1159-I1219 HydrophobicContact CE1-CD1 4.21Å; F1159-I1219 HydrophobicContact CE1-CG2 3.52Å; F1159-I1219 HydrophobicContact CZ-CG2 4.2Å; E1160-I1219 HydrophobicContact CG-CD1 4.07Å; L1201-I1219 HydrophobicContact CD1-CD1 3.77Å; R1215-I1219 WeakPolarHBondContact O-CG1 3.08Å; R1215-I1219 PolarHBondContact O-N 2.85Å; I1216-I1219 PolarHBondContact O-N 3.23Å; I1216-I1219 VanDerWaalsContact O-N 3.08Å; I1219-H1221 VanDerWaalsContact C-N 3.26Å; I1219-H1221 PolarHBondContact O-N 2.85Å; I1219-L1222 HydrophobicContact CD1-CD1 4.41Å; I1219-L1222 PolarHBondContact O-N 3.18Å; I1219-L1223 HydrophobicContact CG2-CD1 3.91Å; I1219-L1223 HydrophobicContact CG2-CG 4.23Å; I1219-L1223 WeakPolarHBondContact O-CB 3.47Å; I1219-L1223 WeakPolarHBondContact O-CG 3.46Å; I1219-L1223 PolarHBondContact O-N 3.44Å
1220	V	90.1	Very high	83.5	Confident	22 Å²	22	40 Å²	40	13%	0.133	24%	0.24	C	C	.	.	H	α-helix	trans	-57	-42.9	176.4	174.5	0	0	0	0	110.6	E1115 F1118 Q1119 I1216 L1223 G1224	E1115-V1220 HydrophobicContact CG-CG1 4.49Å; F1118-V1220 HydrophobicContact CB-CG2 3.77Å; Q1119-V1220 HydrophobicContact CG-CG1 4.3Å; I1216-V1220 HydrophobicContact CG2-CG2 4.25Å; I1216-V1220 WeakPolarHBondContact O-CG2 3.48Å; I1216-V1220 PolarHBondContact O-N 2.77Å; V1220-L1223 PolarHBondContact O-N 3.01Å; V1220-G1224 PolarHBondContact O-N 3.44Å
1221	H	89.1	Confident	81.9	Confident	120 Å²	120	41.3 Å²	41.3	56%	0.556	25%	0.251	S	S	*	.	H	α-helix	trans	-64	-43.6	176.7	-174.1	67.8	0	0	0	113.3	N1217 V1218 I1219 L1223 G1224 Q1225	N1217-H1221 PolarHBondContact O-N 3.32Å; N1217-H1221 VanDerWaalsContact O-N 3.08Å; V1218-H1221 PolarHBondContact O-N 2.8Å; I1219-H1221 VanDerWaalsContact C-N 3.26Å; I1219-H1221 PolarHBondContact O-N 2.85Å; H1221-L1223 VanDerWaalsContact C-N 3.34Å; H1221-G1224 PolarHBondContact O-N 2.93Å; H1221-Q1225 PolarHBondContact CD2-NE2 2.89Å; H1221-Q1225 VanDerWaalsContact CD2-NE2 3.34Å; H1221-Q1225 PolarHBondContact NE2-NE2 2.99Å; H1221-Q1225 PolarHBondContact O-N 2.89Å; H1221-Q1225 VanDerWaalsContact O-N 3.16Å
1222	L	89.8	Confident	80.1	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-65.9	-37	178	-67.8	173.6	0	0	0	112	I1197 Q1200 L1201 V1218 I1219 Q1225 L1226	I1197-L1222 HydrophobicContact CG2-CB 4.33Å; I1197-L1222 HydrophobicContact CG2-CD2 4.12Å; Q1200-L1222 HydrophobicContact CB-CD2 3.67Å; L1201-L1222 HydrophobicContact CB-CD1 4.1Å; L1201-L1222 HydrophobicContact CD1-CD1 3.98Å; V1218-L1222 HydrophobicContact CG1-CD1 3.87Å; V1218-L1222 HydrophobicContact CG1-CG 4.24Å; V1218-L1222 VanDerWaalsContact O-CG 3.25Å; V1218-L1222 WeakPolarHBondContact O-CG 3.35Å; V1218-L1222 PolarHBondContact O-N 3.26Å; I1219-L1222 HydrophobicContact CD1-CD1 4.41Å; I1219-L1222 PolarHBondContact O-N 3.18Å; L1222-Q1225 PolarHBondContact O-N 2.93Å; L1222-L1226 PolarHBondContact O-N 3.26Å
1223	L	89.6	Confident	78.1	Confident	0 Å²	0	42 Å²	42	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-65.6	-41.3	175.2	-71.3	178.2	0	0	0	111.8	M1111 E1115 F1118 F1159 I1219 V1220 H1221 Q1225 L1226 A1227	M1111-L1223 WeakPolarHBondContact O-CD2 3.3Å; E1115-L1223 HydrophobicContact CB-CB 4.23Å; E1115-L1223 HydrophobicContact CB-CD1 3.96Å; E1115-L1223 HydrophobicContact CG-CB 4.32Å; F1118-L1223 HydrophobicContact CD2-CD1 4.01Å; F1118-L1223 HydrophobicContact CE2-CD1 4.48Å; F1159-L1223 HydrophobicContact CZ-CD1 4.05Å; F1159-L1223 HydrophobicContact CZ-CD2 3.83Å; F1159-L1223 HydrophobicContact CZ-CG 4.3Å; I1219-L1223 HydrophobicContact CG2-CD1 3.91Å; I1219-L1223 HydrophobicContact CG2-CG 4.23Å; I1219-L1223 WeakPolarHBondContact O-CB 3.47Å; I1219-L1223 WeakPolarHBondContact O-CG 3.46Å; I1219-L1223 PolarHBondContact O-N 3.44Å; V1220-L1223 PolarHBondContact O-N 3.01Å; H1221-L1223 VanDerWaalsContact C-N 3.34Å; L1223-Q1225 VanDerWaalsContact C-N 3.33Å; L1223-Q1225 PolarHBondContact O-N 2.89Å; L1223-L1226 HydrophobicContact CD2-CD1 4.25Å; L1223-L1226 WeakPolarHBondContact O-CB 3.31Å; L1223-L1226 PolarHBondContact O-N 3.31Å; L1223-A1227 WeakPolarHBondContact O-CB 3.37Å; L1223-A1227 PolarHBondContact O-N 2.96Å
1224	G	84.9	Confident	75.8	Confident	29 Å²	29	44.1 Å²	44.1	30%	0.299	28%	0.284	S	S	.	.	H	α-helix	trans	-60.3	-39.1	173.7	0	0	0	0	0	113.2	V1220 H1221 A1227 A1228	V1220-G1224 PolarHBondContact O-N 3.44Å; H1221-G1224 PolarHBondContact O-N 2.93Å; G1224-A1227 PolarHBondContact O-N 3.36Å; G1224-A1228 PolarHBondContact O-N 3.28Å
1225	Q	85.8	Confident	73.2	Confident	46 Å²	46	44 Å²	44	22%	0.215	29%	0.294	C	S	.	.	H	α-helix	trans	-66.9	-39.1	174.1	-67.5	-178.2	17.6	0	0	112.6	I1197 H1221 L1222 L1223 A1228 G1229	I1197-Q1225 HydrophobicContact CD1-CB 3.73Å; I1197-Q1225 HydrophobicContact CG1-CB 4.24Å; H1221-Q1225 PolarHBondContact CD2-NE2 2.89Å; H1221-Q1225 VanDerWaalsContact CD2-NE2 3.34Å; H1221-Q1225 PolarHBondContact NE2-NE2 2.99Å; H1221-Q1225 PolarHBondContact O-N 2.89Å; H1221-Q1225 VanDerWaalsContact O-N 3.16Å; L1222-Q1225 PolarHBondContact O-N 2.93Å; L1223-Q1225 VanDerWaalsContact C-N 3.33Å; L1223-Q1225 PolarHBondContact O-N 2.89Å; Q1225-A1228 PolarHBondContact O-N 3.15Å; Q1225-G1229 PolarHBondContact O-N 3.15Å; Q1225-G1229 VanDerWaalsContact O-N 3.11Å
1226	L	83.6	Confident	70.7	Confident	13 Å²	13	45.2 Å²	45.2	7%	0.068	31%	0.314	C	S	.	.	H	α-helix	trans	-64.6	-40.4	174.6	-76.9	169.5	0	0	0	111.7	V1112 L1163 L1167 I1197 L1222 L1223 G1229 S1230	V1112-L1226 HydrophobicContact CG2-CB 3.65Å; L1163-L1226 HydrophobicContact CD1-CD1 3.95Å; L1167-L1226 HydrophobicContact CD2-CD2 4.04Å; I1197-L1226 HydrophobicContact CD1-CB 4.35Å; I1197-L1226 HydrophobicContact CD1-CD2 3.5Å; I1197-L1226 HydrophobicContact CD1-CG 3.58Å; I1197-L1226 HydrophobicContact CG2-CD1 4.19Å; I1197-L1226 HydrophobicContact CG2-CD2 4.2Å; I1197-L1226 HydrophobicContact CG2-CG 4.03Å; L1222-L1226 PolarHBondContact O-N 3.26Å; L1223-L1226 HydrophobicContact CD2-CD1 4.25Å; L1223-L1226 WeakPolarHBondContact O-CB 3.31Å; L1223-L1226 PolarHBondContact O-N 3.31Å; L1226-G1229 PolarHBondContact O-N 3.08Å; L1226-S1230 PolarHBondContact O-N 3.24Å; L1226-S1230 VanDerWaalsContact O-N 3.15Å
1227	A	81.1	Confident	68.2	Low	32 Å²	32	50.8 Å²	50.8	26%	0.264	35%	0.348	S	S	.	.	H	α-helix	trans	-63.5	-43.8	176.6	0	0	0	0	0	112	V1112 L1223 G1224 G1229 S1230 A1231	V1112-A1227 HydrophobicContact CG1-CB 3.72Å; L1223-A1227 WeakPolarHBondContact O-CB 3.37Å; L1223-A1227 PolarHBondContact O-N 2.96Å; G1224-A1227 PolarHBondContact O-N 3.36Å; A1227-G1229 PolarHBondContact O-N 2.79Å; A1227-S1230 WeakPolarHBondContact O-CB 3.42Å; A1227-S1230 PolarHBondContact O-N 2.79Å; A1227-A1231 PolarHBondContact O-N 2.97Å
1228	A	74.4	Confident	65.3	Low	63 Å²	63	60.5 Å²	60.5	52%	0.521	39%	0.391	S	S	.	.	H	α-helix	trans	-64.8	-37.3	177.5	0	0	0	0	0	112.8	G1224 Q1225 S1230 A1231 A1232	G1224-A1228 PolarHBondContact O-N 3.28Å; Q1225-A1228 PolarHBondContact O-N 3.15Å; A1228-S1230 VanDerWaalsContact C-N 3.32Å; A1228-S1230 PolarHBondContact O-N 3.33Å; A1228-A1231 PolarHBondContact O-N 3.04Å; A1228-A1232 PolarHBondContact O-N 3.41Å
1229	G	61.8	Low	64	Low	23 Å²	23	60.7 Å²	60.7	24%	0.237	39%	0.393	C	S	.	.	H	α-helix	trans	-66.9	-30.3	174.1	0	0	0	0	0	113.9	Q1225 L1226 A1227	Q1225-G1229 PolarHBondContact O-N 3.15Å; Q1225-G1229 VanDerWaalsContact O-N 3.11Å; L1226-G1229 PolarHBondContact O-N 3.08Å; A1227-G1229 PolarHBondContact O-N 2.79Å
1230	S	55.5	Low	62.6	Low	59 Å²	59	63.7 Å²	63.7	41%	0.413	41%	0.413	S	S	.	.	H	α-helix	trans	-72.8	-44.2	173	163.9	0	0	0	0	112.2	L1226 A1227 A1228 A1232 S1233	L1226-S1230 PolarHBondContact O-N 3.24Å; L1226-S1230 VanDerWaalsContact O-N 3.15Å; A1227-S1230 WeakPolarHBondContact O-CB 3.42Å; A1227-S1230 PolarHBondContact O-N 2.79Å; A1228-S1230 VanDerWaalsContact C-N 3.32Å; A1228-S1230 PolarHBondContact O-N 3.33Å; S1230-A1232 PolarHBondContact O-N 2.99Å; S1230-S1233 PolarHBondContact O-N 3.39Å; S1230-S1233 VanDerWaalsContact O-N 3.11Å; S1230-S1233 PolarHBondContact O-OG 2.54Å
1231	A	47.8	Very low	61.1	Low	51 Å²	51	66.1 Å²	66.1	42%	0.421	43%	0.429	S	S	.	.	H	α-helix	trans	-66.1	-32.6	179.7	0	0	0	0	0	113.9	A1227 A1228 S1233 S1234 S1235	A1227-A1231 PolarHBondContact O-N 2.97Å; A1228-A1231 PolarHBondContact O-N 3.04Å; A1231-S1233 PolarHBondContact O-N 2.85Å; A1231-S1234 PolarHBondContact O-N 3.15Å; A1231-S1234 PolarHBondContact O-OG 3.49Å; A1231-S1235 PolarHBondContact O-N 3.03Å; A1231-S1235 PolarHBondContact O-OG 3.41Å
1232	A	45.6	Very low	59.5	Low	73 Å²	73	62.9 Å²	62.9	60%	0.603	42%	0.421	S	S	*	.	H	α-helix	trans	-67	-17.4	174	0	0	0	0	0	113.6	A1228 S1230	A1228-A1232 PolarHBondContact O-N 3.41Å; S1230-A1232 PolarHBondContact O-N 2.99Å
1233	S	44	Very low	57.6	Low	46 Å²	46	66.8 Å²	66.8	32%	0.322	45%	0.447	S	S	.	.	H	α-helix	trans	-91.3	-16.8	176.2	72.4	0	0	0	0	114.4	S1230 A1231	S1230-S1233 PolarHBondContact O-N 3.39Å; S1230-S1233 VanDerWaalsContact O-N 3.11Å; S1230-S1233 PolarHBondContact O-OG 2.54Å; A1231-S1233 PolarHBondContact O-N 2.85Å
1234	S	36.1	Very low	55.4	Low	85 Å²	85	71.2 Å²	71.2	59%	0.594	48%	0.477	S	S	*	.	H	α-helix	trans	-99.2	-18.7	-177.8	54.5	0	0	0	0	114.5	A1231 A1236	A1231-S1234 PolarHBondContact O-N 3.15Å; A1231-S1234 PolarHBondContact O-OG 3.49Å; S1234-A1236 VanDerWaalsContact C-N 3.33Å; S1234-A1236 PolarHBondContact O-N 3.31Å
1235	S	32.7	Very low	53.3	Low	97 Å²	97	74.2 Å²	74.2	68%	0.678	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	1.3	-179.9	46.3	0	0	0	0	114.8	A1231	A1231-S1235 PolarHBondContact O-N 3.03Å; A1231-S1235 PolarHBondContact O-OG 3.41Å
1236	A	34.8	Very low	50.8	Low	70 Å²	70	76.4 Å²	76.4	58%	0.579	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	6.5	177.7	0	0	0	0	0	114.1	S1234	S1234-A1236 VanDerWaalsContact C-N 3.33Å; S1234-A1236 PolarHBondContact O-N 3.31Å
1237	V	36.1	Very low	48.1	Very low	117 Å²	117	81.7 Å²	81.7	71%	0.709	55%	0.548	S	S	*	.			trans	-116.8	44.9	176.2	-164.4	0	0	0	0	111.3
1238	Q	27.3	Very low	45.1	Very low	264 Å²	264	86.2 Å²	86.2	100%	1.234	57%	0.574	S	S	*	*			trans	-118.7	0	157.2	-95.6	-171.5	-10	0	0	110

Retrieved 1,238 of 1,238 residues in 350.9 ms (Link to these results)

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