A0A087XM48_POEFO Loading...

Importin-5

AlphaFold DB , UniProt , Accession A0A087XM48, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,169 aa.

						>A0A087XM48_POEFO|A0A087XM48
MQTIYSRFCVALANKDMESLLANSERPLLSPWSNNRWVELLEPANGAVSKLCGQSCVCRVHFAASPPGWSFLDLTAMAEQQQFYLLLGNLMNADNNVRKQAEETYDNIPGQNKITFLLQAIRDASAAEEVRQMAAVLLRRLLSSSFEEIYPGLTLAMQTAIKTELLSSIQQEASPNIRKKVCDIAAELCRNLIDDDGNNQWPEVLKFLFDSVNSDNVGLREAALHIFWNFPGIFGNQQQHYLEVIKRMLVQCMQDQANPHIRTLAARAAASFVLSNEGNTALLKHFADLLPGILQAVNESCYQGDDSVLKSLVEIADTAPKYLRPNLEATLQLCLKLCADTNLTNMQRQLALEVIVTLSETAAAMLRKHTAIVAQSVPQMLTMMVDLEDDDEWAMADELEDDDFDSNAVAGESALDRIACGLGGKIILPMIKQHIMQMLQNPDWKYRHAGLMALSAIGEGCHQQMEAILQEIVSFVLLFCSDPHPRVRYAACNAIGQMATDFAPTFQKKFHDKVISALLQTMEDQSNPRVQAHAAAALINFTEDCPKSLLIPYLDSLVQHLHVIMVAKLQELIQKGTKLVLEQVVTSIASVADTAEEKFVPYYDLFMPSLKHIVENAVQKELRLLRGKTIECISLIGLAVGKDKFMPDASAVMQLLLKTQTDFNDLEDDDPQISYMISAWARMCKILGKEFQQYLPVVMGPLMKTASIKPEVALLDTQDMENISEEEGWEFVNLGDQQSFGIKTAGLEEKATACQMLVCYAKELKEGFVEYTEQVVKLMVPLLKFYFHDGVRVAAAESMPLLLECARVRGPEYLTQMWHFMCDALIKAIGTEPDSDVLSEIMHSFAKCVELMGDGCLNNEHFEELGGILKGKLEEHFKNQELRQAKRQDEDYDEQVEETLQDEDENDVYVLTKVSDILHSVFSSYKEKVLPWFEQLLQLIVQLICPNRPWADRQWGLCIFDDVIEHCSPSSFKYAEYFLRPMLQSLCDTSPEVRQAAAYGVGVMAQYGGDSYRPFCTEALPLLVAVIQAADSRSKENVNATENCISAVGKLMRFRPECINVNEVLPHWLSWLPLKEDKEEAVHTFDFLCDLIESNNPIVLGPENSNLPKIFLIIADGVANESVKTEDACTKRLANVIRQVQVSAGLWTQCVSTLNETQQKAIQDLLNTA
					

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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	30	Very low	31.5	Very low	111 Å²	111	77 Å²	77	55%	0.547	41%	0.411	S	S	.	.				0	-43.6	0	-88	-169.8	-84.3	0	0	115.8	T3 I4 Y5 E730 V732	M1-T3 VanDerWaalsContact C-N 3.32Å; M1-T3 PolarHBondContact O-N 2.67Å; M1-I4 HydrophobicContact CG-CD1 4.44Å; M1-I4 WeakPolarHBondContact O-CA 3.25Å; M1-I4 VanDerWaalsContact O-CB 3.23Å; M1-I4 WeakPolarHBondContact O-CB 3.21Å; M1-I4 PolarHBondContact O-N 3.31Å; M1-Y5 PolarHBondContact O-N 3.04Å; M1-E730 HydrophobicContact CE-CB 4.3Å; M1-E730 WeakPolarHBondContact CE-OE2 3.5Å; M1-V732 HydrophobicContact CB-CG2 4.11Å; M1-V732 HydrophobicContact CG-CG2 4.21Å; M1-V732 HydrophobicContact SD-CG2 3.36Å; M1-V732 WeakPolarHBondContact SD-CG2 3.47Å
2	Q	29.1	Very low	31.5	Very low	110 Å²	110	78.4 Å²	78.4	51%	0.514	42%	0.418	S	S	.	.	H	α-helix	trans	-61.6	-31.1	-177.2	-80.1	176.1	-26.6	0	0	115.5	I4 Y5 S6 D317	Q2-I4 PolarHBondContact O-N 3.15Å; Q2-Y5 WeakPolarHBondContact O-CB 3.48Å; Q2-Y5 PolarHBondContact O-N 3.13Å; Q2-Y5 VanDerWaalsContact O-N 3.08Å; Q2-S6 PolarHBondContact O-N 3.01Å; Q2-D317 PolarHBondContact NE2-OD2 3.49Å
3	T	29.4	Very low	31.5	Very low	91 Å²	91	78.9 Å²	78.9	56%	0.558	44%	0.44	S	S	*	.	H	α-helix	trans	-59.4	-33.6	171.7	-33.1	0	0	0	0	112	M1	M1-T3 VanDerWaalsContact C-N 3.32Å; M1-T3 PolarHBondContact O-N 2.67Å
4	I	31.8	Very low	31.4	Very low	41 Å²	41	82.5 Å²	82.5	21%	0.21	46%	0.457	C	S	.	.	H	α-helix	trans	-69.9	-45.8	173.9	-54.6	165.8	0	0	0	109.1	M1 Q2 R7 F8	M1-I4 HydrophobicContact CG-CD1 4.44Å; M1-I4 WeakPolarHBondContact O-CA 3.25Å; M1-I4 VanDerWaalsContact O-CB 3.23Å; M1-I4 WeakPolarHBondContact O-CB 3.21Å; M1-I4 PolarHBondContact O-N 3.31Å; Q2-I4 PolarHBondContact O-N 3.15Å; I4-R7 PolarHBondContact O-N 2.78Å; I4-F8 WeakPolarHBondContact O-CB 3.46Å; I4-F8 PolarHBondContact O-N 3.23Å
5	Y	34.9	Very low	31.4	Very low	76 Å²	76	87.4 Å²	87.4	30%	0.298	47%	0.472	S	S	.	.	H	α-helix	trans	-56.2	-54.2	178.1	169.3	-113.3	0	0	0	113.1	M1 Q2 R7 F8 C9 L734	M1-Y5 PolarHBondContact O-N 3.04Å; Q2-Y5 WeakPolarHBondContact O-CB 3.48Å; Q2-Y5 PolarHBondContact O-N 3.13Å; Q2-Y5 VanDerWaalsContact O-N 3.08Å; Y5-R7 PolarHBondContact O-N 3Å; Y5-R7 VanDerWaalsContact O-N 3.16Å; Y5-F8 PolarHBondContact O-N 3.05Å; Y5-C9 PolarHBondContact O-N 3.36Å; Y5-C9 VanDerWaalsContact O-N 3.13Å; Y5-L734 HydrophobicContact CD2-CD2 3.75Å; Y5-L734 VanDerWaalsContact CE2-CA 3.47Å; Y5-L734 HydrophobicContact CE2-CB 4.12Å; Y5-L734 HydrophobicContact CE2-CD2 3.93Å; Y5-L734 WeakPolarHBondContact CE2-O 3.18Å; Y5-L734 VanDerWaalsContact OH-C 3.24Å; Y5-L734 PolarHBondContact OH-O 3.36Å
6	S	31	Very low	31.3	Very low	77 Å²	77	92.2 Å²	92.2	54%	0.538	50%	0.497	S	S	.	.	H	α-helix	trans	-52.3	-41.1	179.4	175.3	0	0	0	0	112.6	Q2	Q2-S6 PolarHBondContact O-N 3.01Å
7	R	35.6	Very low	31.1	Very low	94 Å²	94	95.9 Å²	95.9	36%	0.355	51%	0.513	S	S	.	.	H	α-helix	trans	-90.2	-24.6	-176	-62.2	-176.7	178.6	-152	-5.8	112.9	I4 Y5 V10 A11 P833	I4-R7 PolarHBondContact O-N 2.78Å; Y5-R7 PolarHBondContact O-N 3Å; Y5-R7 VanDerWaalsContact O-N 3.16Å; R7-V10 WeakPolarHBondContact O-CB 3.21Å; R7-V10 PolarHBondContact O-N 2.88Å; R7-A11 PolarHBondContact O-N 3.04Å; R7-P833 HydrophobicContact CB-CB 3.64Å; R7-P833 VanDerWaalsContact CD-CB 3.47Å; R7-P833 VanDerWaalsContact CD-O 3.29Å; R7-P833 WeakPolarHBondContact CD-O 3.48Å; R7-P833 HydrophobicContact CG-CB 4.13Å; R7-P833 PolarHBondContact NH1-O 2.97Å
8	F	31.9	Very low	31	Very low	68 Å²	68	102 Å²	102	30%	0.298	54%	0.538	S	S	.	.	H	α-helix	trans	-68.1	-34.7	172.3	-167.3	-98	0	0	0	111.8	I4 Y5 V10 A11 L12 Y786	I4-F8 WeakPolarHBondContact O-CB 3.46Å; I4-F8 PolarHBondContact O-N 3.23Å; Y5-F8 PolarHBondContact O-N 3.05Å; F8-V10 VanDerWaalsContact C-N 3.3Å; F8-V10 PolarHBondContact O-N 3.16Å; F8-A11 WeakPolarHBondContact O-CB 3.41Å; F8-A11 PolarHBondContact O-N 3.39Å; F8-A11 VanDerWaalsContact O-N 3.15Å; F8-L12 HydrophobicContact CD1-CD1 3.78Å; F8-L12 HydrophobicContact CD1-CG 4.25Å; F8-L12 HydrophobicContact CE1-CD1 3.75Å; F8-L12 HydrophobicContact CE1-CG 4.14Å; F8-L12 PolarHBondContact O-N 2.95Å; F8-Y786 HydrophobicContact CD2-CD2 4.38Å; F8-Y786 HydrophobicContact CE2-CD2 4.44Å
9	C	31.7	Very low	30.9	Very low	55 Å²	55	101.8 Å²	101.8	37%	0.372	55%	0.546	S	S	.	.	H	α-helix	trans	-61	-37.1	169.5	-69.1	0	0	0	0	112.4	Y5 L12 A13	Y5-C9 PolarHBondContact O-N 3.36Å; Y5-C9 VanDerWaalsContact O-N 3.13Å; C9-L12 PolarHBondContact O-N 2.95Å; C9-A13 WeakPolarHBondContact O-CB 3.31Å; C9-A13 PolarHBondContact O-N 3.26Å
10	V	31.1	Very low	30.7	Very low	89 Å²	89	105 Å²	105	54%	0.539	56%	0.562	S	S	.	*	H	α-helix	trans	-68.7	-33.6	173.6	-179	0	0	0	0	111.7	R7 F8 N14	R7-V10 WeakPolarHBondContact O-CB 3.21Å; R7-V10 PolarHBondContact O-N 2.88Å; F8-V10 VanDerWaalsContact C-N 3.3Å; F8-V10 PolarHBondContact O-N 3.16Å; V10-N14 PolarHBondContact O-ND2 3.28Å
11	A	30.3	Very low	30.5	Very low	35 Å²	35	108.7 Å²	108.7	29%	0.289	58%	0.581	S	S	.	*	H	α-helix	trans	-71.4	-32.3	173.8	0	0	0	0	0	113.2	R7 F8	R7-A11 PolarHBondContact O-N 3.04Å; F8-A11 WeakPolarHBondContact O-CB 3.41Å; F8-A11 PolarHBondContact O-N 3.39Å; F8-A11 VanDerWaalsContact O-N 3.15Å
12	L	31.8	Very low	30.5	Very low	94 Å²	94	107.5 Å²	107.5	49%	0.492	59%	0.589	S	S	.	*	H	α-helix	trans	-71.1	-41.2	172.6	-78.3	167.7	0	0	0	112	F8 C9 N14 K15	F8-L12 HydrophobicContact CD1-CD1 3.78Å; F8-L12 HydrophobicContact CD1-CG 4.25Å; F8-L12 HydrophobicContact CE1-CD1 3.75Å; F8-L12 HydrophobicContact CE1-CG 4.14Å; F8-L12 PolarHBondContact O-N 2.95Å; C9-L12 PolarHBondContact O-N 2.95Å; L12-N14 PolarHBondContact O-N 3.49Å; L12-K15 PolarHBondContact O-N 3.13Å; L12-K15 VanDerWaalsContact O-N 3.12Å
13	A	31.2	Very low	30.3	Very low	85 Å²	85	110.5 Å²	110.5	70%	0.702	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	-14.6	176.8	0	0	0	0	0	114.4	C9	C9-A13 WeakPolarHBondContact O-CB 3.31Å; C9-A13 PolarHBondContact O-N 3.26Å
14	N	29.3	Very low	30	Very low	129 Å²	129	111.8 Å²	111.8	69%	0.69	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	10.5	178.6	-74.8	-64.2	0	0	0	114	V10 L12 D16	V10-N14 PolarHBondContact O-ND2 3.28Å; L12-N14 PolarHBondContact O-N 3.49Å; N14-D16 PolarHBondContact O-N 3.14Å
15	K	32.5	Very low	29.8	Very low	156 Å²	156	118.9 Å²	118.9	68%	0.678	65%	0.653	S	S	*	*			trans	-93.7	78.8	-175.6	-97.4	-172.5	175.6	-178.6	0	114.3	L12	L12-K15 PolarHBondContact O-N 3.13Å; L12-K15 VanDerWaalsContact O-N 3.12Å
16	D	29.4	Very low	29.3	Very low	164 Å²	164	126.9 Å²	126.9	88%	0.877	68%	0.683	S	S	*	*			trans	-100.3	55.4	160.3	-140.9	-0.9	0	0	0	109.9	N14	N14-D16 PolarHBondContact O-N 3.14Å
17	M	28.3	Very low	29.2	Very low	156 Å²	156	129.6 Å²	129.6	77%	0.768	70%	0.698	S	S	*	*			trans	-160.1	57	179	-137.9	-179.1	-70.3	0	0	117.1	S19	M17-S19 PolarHBondContact O-N 3.22Å
18	E	27.9	Very low	28.8	Very low	205 Å²	205	133.4 Å²	133.4	96%	0.958	73%	0.725	S	S	*	*			trans	-79.1	86.5	161.9	-75.7	-150.7	137.1	0	0	112.1
19	S	29.6	Very low	28.4	Very low	98 Å²	98	138.7 Å²	138.7	69%	0.685	76%	0.755	S	S	*	*			trans	-152	33	169.4	64.3	0	0	0	0	115.8	M17	M17-S19 PolarHBondContact O-N 3.22Å
20	L	26.6	Very low	28	Very low	165 Å²	165	141.1 Å²	141.1	86%	0.864	77%	0.773	S	S	*	*	S	Bend	trans	-130	18.8	-177.6	-93.5	170.3	0	0	0	116.5
21	L	27.1	Very low	28.6	Very low	184 Å²	184	141.8 Å²	141.8	96%	0.963	78%	0.779	S	S	*	*	S	Bend	trans	-117.4	10.1	174.6	-79.8	174.9	0	0	0	115.7
22	A	29.4	Very low	28.3	Very low	86 Å²	86	151.2 Å²	151.2	71%	0.711	81%	0.807	S	S	*	*	S	Bend	trans	-141.1	89.9	175.6	0	0	0	0	0	112.7
23	N	25.6	Very low	28	Very low	173 Å²	173	151 Å²	151	93%	0.925	81%	0.814	S	S	*	*			trans	178.1	97.2	146.4	-96.3	-41.5	0	0	0	113.2
24	S	23.5	Very low	27.7	Very low	118 Å²	118	153.5 Å²	153.5	83%	0.825	82%	0.815	S	S	*	*			trans	-163.5	74.2	151.1	64.4	0	0	0	0	113.6
25	E	26.8	Very low	27.5	Very low	189 Å²	189	153.9 Å²	153.9	88%	0.883	82%	0.817	S	S	*	*			trans	-162.6	104.7	152.2	-120.6	180	-138.5	0	0	113.5
26	R	24.8	Very low	27.2	Very low	245 Å²	245	157.8 Å²	157.8	93%	0.925	83%	0.828	S	S	*	*			trans	177.1	122.8	147.5	-102	168.5	-149.7	-142.7	6.8	111.5
27	P	29.8	Very low	26.9	Very low	133 Å²	133	160.9 Å²	160.9	86%	0.864	83%	0.827	S	S	*	*			trans	-83.9	147.1	170.1	32.5	-32.3	0	0	0	112.5
28	L	25.2	Very low	26.8	Very low	175 Å²	175	158.2 Å²	158.2	92%	0.916	82%	0.82	S	S	*	*			trans	-78.2	126	176.5	-78.6	156.8	0	0	0	112.5
29	L	25.4	Very low	26.7	Very low	179 Å²	179	156.7 Å²	156.7	94%	0.937	81%	0.812	S	S	*	*			trans	-151.8	145.6	149.8	-93.1	179.7	0	0	0	110.7
30	S	23.3	Very low	26.5	Very low	106 Å²	106	159 Å²	159	74%	0.741	82%	0.817	S	S	*	*			trans	-149.1	178.6	177	75.5	0	0	0	0	109
31	P	43	Very low	26.4	Very low	103 Å²	103	159.5 Å²	159.5	67%	0.669	82%	0.819	S	S	*	*			cis	-124	-172.4	-19.5	32.3	-14.6	0	0	0	112
32	W	24.1	Very low	26.3	Very low	233 Å²	233	158.9 Å²	158.9	88%	0.883	81%	0.811	S	S	*	*			trans	168.5	118.4	130.4	-98.4	54	0	0	0	114.4
33	S	24.3	Very low	27.4	Very low	89 Å²	89	160 Å²	160	62%	0.622	81%	0.811	S	S	*	*			trans	34.5	133.2	144	68.9	0	0	0	0	125.4
34	N	25.3	Very low	27.4	Very low	138 Å²	138	156 Å²	156	74%	0.738	80%	0.802	S	S	*	*				96.3	126	128	-86	-15.7	0	0	0	123.6
35	N	25.7	Very low	27.5	Very low	137 Å²	137	158.5 Å²	158.5	73%	0.733	81%	0.806	S	S	*	*			trans	71.5	143.4	151.6	-63.9	-38	0	0	0	117.7
36	R	25.5	Very low	27.4	Very low	237 Å²	237	153.5 Å²	153.5	89%	0.894	81%	0.805	S	S	*	*			cis	-153.6	170.1	24.8	-139.4	173.8	-150.3	-174.1	5.7	113
37	W	24.2	Very low	27.5	Very low	229 Å²	229	146.4 Å²	146.4	87%	0.867	80%	0.8	S	S	*	*			trans	-100.3	150.1	-172.7	-85	58.2	0	0	0	115.2
38	V	25.4	Very low	27.4	Very low	100 Å²	100	146.3 Å²	146.3	61%	0.606	80%	0.796	S	S	*	*			trans	50.9	129.6	134.4	172.9	0	0	0	0	122.5
39	E	25.8	Very low	27.5	Very low	173 Å²	173	142 Å²	142	81%	0.808	78%	0.781	S	S	*	*				173.3	117.4	116.7	-119.8	142.6	-139.6	0	0	109.6
40	L	25.5	Very low	27.6	Very low	148 Å²	148	142.3 Å²	142.3	78%	0.775	78%	0.775	S	S	*	*				59.8	122.8	93.9	-88.2	164.8	0	0	0	117
41	L	25.3	Very low	27.8	Very low	174 Å²	174	144.3 Å²	144.3	91%	0.911	78%	0.776	S	S	*	*				175.3	128.3	121.2	-93.4	162.5	0	0	0	114.6
42	E	23.8	Very low	27	Very low	171 Å²	171	145 Å²	145	80%	0.799	78%	0.782	S	S	*	*			trans	-93.5	-174.5	158.6	-106.6	-165.5	170.3	0	0	109.5
43	P	52.4	Low	27	Very low	109 Å²	109	136.9 Å²	136.9	71%	0.708	77%	0.771	S	S	*	*			cis	-133.9	-173.7	-42.5	37.7	-21.1	0	0	0	111.4
44	A	25.5	Very low	27.2	Very low	90 Å²	90	141.8 Å²	141.8	74%	0.744	78%	0.784	S	S	*	*			trans	163.3	128.8	131.1	0	0	0	0	0	116.8
45	N	26.6	Very low	27.2	Very low	170 Å²	170	140.4 Å²	140.4	91%	0.909	79%	0.785	S	S	*	*			trans	27.9	129.3	139	-65.7	-24	0	0	0	123
46	G	25.2	Very low	27.2	Very low	84 Å²	84	138.9 Å²	138.9	87%	0.866	78%	0.784	S	S	*	*			trans	-174.8	129.8	154.3	0	0	0	0	0	112.2
47	A	26.9	Very low	27.3	Very low	97 Å²	97	133.6 Å²	133.6	80%	0.802	78%	0.778	S	S	*	*			trans	-120.5	-173.8	-167.6	0	0	0	0	0	114.3
48	V	26.7	Very low	27.4	Very low	130 Å²	130	129 Å²	129	79%	0.788	78%	0.78	S	S	*	*			trans	110.3	79.7	152.3	-168.9	0	0	0	0	118.8
49	S	27.7	Very low	27.5	Very low	86 Å²	86	134.4 Å²	134.4	60%	0.601	79%	0.789	S	S	*	*				71.9	149	113.7	92.7	0	0	0	0	125
50	K	28.3	Very low	27.5	Very low	185 Å²	185	133.4 Å²	133.4	80%	0.804	79%	0.794	S	S	*	*			trans	79.5	145.5	145.3	-81.2	171.1	-177.9	174.9	0	117.2
51	L	26.8	Very low	27.6	Very low	147 Å²	147	133.4 Å²	133.4	77%	0.77	79%	0.79	S	S	*	*			cis	-155.5	159	26.3	-119.6	144.2	0	0	0	113.1
52	C	25.3	Very low	27.6	Very low	117 Å²	117	134.7 Å²	134.7	79%	0.791	79%	0.789	S	S	*	*			trans	11.9	152.1	159.6	-72.7	0	0	0	0	123.7
53	G	25.3	Very low	27.8	Very low	63 Å²	63	131 Å²	131	65%	0.649	79%	0.788	S	S	*	*			cis	150	161	-5.5	0	0	0	0	0	115
54	Q	27.5	Very low	26.7	Very low	192 Å²	192	130.9 Å²	130.9	90%	0.897	80%	0.796	S	S	*	*			trans	55.8	142.7	156.2	-64.3	177.9	-18.7	0	0	119.2
55	S	26.3	Very low	26.8	Very low	109 Å²	109	131.8 Å²	131.8	76%	0.762	80%	0.796	S	S	*	*			cis	-172.1	-173.3	-6.1	57.4	0	0	0	0	107.5
56	C	25.7	Very low	27.1	Very low	106 Å²	106	129.4 Å²	129.4	72%	0.716	79%	0.79	S	S	*	*			cis	-162.2	134.6	9.3	-149.5	0	0	0	0	113
57	V	27.9	Very low	27.7	Very low	125 Å²	125	131.8 Å²	131.8	76%	0.758	79%	0.79	S	S	*	*			trans	36.4	123.7	138.7	-177.8	0	0	0	0	121.8
58	C	25.3	Very low	27.9	Very low	134 Å²	134	130.3 Å²	130.3	91%	0.905	79%	0.785	S	S	*	*				-159.5	149.7	124.4	-124.4	0	0	0	0	113.6
59	R	27.1	Very low	28.2	Very low	213 Å²	213	136.3 Å²	136.3	80%	0.804	79%	0.794	S	S	*	*			trans	-105.5	147.6	-174.4	-71.8	173.9	166.9	178.2	-5.2	112.9
60	V	25.9	Very low	28.6	Very low	152 Å²	152	137.5 Å²	137.5	92%	0.921	80%	0.802	S	S	*	*			trans	-142.2	163.5	142.2	-172.2	0	0	0	0	109.2
61	H	27.8	Very low	28.7	Very low	147 Å²	147	138.7 Å²	138.7	68%	0.681	81%	0.807	S	S	*	*			trans	-113.3	173.8	-161.3	-98.5	-24.3	0	0	0	116.4
62	F	26.3	Very low	29.3	Very low	202 Å²	202	139 Å²	139	89%	0.886	81%	0.809	S	S	*	*			trans	88.1	140.6	168.3	-62.4	-80	0	0	0	116.5
63	A	27.8	Very low	30.3	Very low	94 Å²	94	138.7 Å²	138.7	78%	0.777	80%	0.799	S	S	*	*			cis	-138	179.2	0.7	0	0	0	0	0	112
64	A	28.8	Very low	31.2	Very low	106 Å²	106	142.6 Å²	142.6	88%	0.876	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-86.5	142.8	-165.3	0	0	0	0	0	116
65	S	28	Very low	32.5	Very low	109 Å²	109	137.2 Å²	137.2	76%	0.762	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-95.4	155.3	171.4	-43.5	0	0	0	0	112.3
66	P	31.5	Very low	34.3	Very low	120 Å²	120	134.2 Å²	134.2	78%	0.779	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-73.5	154.5	162.7	31	-30.6	0	0	0	111.1
67	P	39.3	Very low	36.2	Very low	133 Å²	133	134.6 Å²	134.6	86%	0.864	76%	0.759	S	S	*	*	S	Bend	trans	-85.8	140.5	-170.4	33.8	-34.4	0	0	0	112.5
68	G	31.4	Very low	38.3	Very low	67 Å²	67	131 Å²	131	69%	0.691	74%	0.743	S	S	*	*			trans	170.6	-17.3	171.5	0	0	0	0	0	118.1
69	W	32.6	Very low	41.1	Very low	256 Å²	256	129.5 Å²	129.5	97%	0.97	72%	0.723	S	S	*	*			trans	-132.1	98.3	-176.7	-67.9	74	0	0	0	110.6
70	S	34.8	Very low	43.8	Very low	110 Å²	110	119.6 Å²	119.6	77%	0.769	69%	0.686	S	S	*	*			trans	-143.5	58.4	178.2	69.6	0	0	0	0	112.7
71	F	31.5	Very low	46.5	Very low	211 Å²	211	118.9 Å²	118.9	93%	0.925	67%	0.672	S	S	*	*			trans	-165.5	103.8	146.3	-98.7	-72.1	0	0	0	106.1
72	L	38.5	Very low	49.4	Very low	154 Å²	154	118.3 Å²	118.3	81%	0.806	67%	0.67	S	S	*	*			trans	-77	128.2	167.6	-92.9	158	0	0	0	107.5	L74	L72-L74 PolarHBondContact O-N 2.79Å
73	D	46.1	Very low	52.5	Low	109 Å²	109	109 Å²	109	58%	0.583	63%	0.629	S	S	*	*			trans	-79.5	113	-170.1	-143.5	-1	0	0	0	110.6	T75 A76 M77	D73-T75 VanDerWaalsContact CG-OG1 3.31Å; D73-T75 PolarHBondContact O-N 2.92Å; D73-T75 PolarHBondContact OD1-OG1 2.98Å; D73-A76 HydrophobicContact CB-CB 4.23Å; D73-A76 PolarHBondContact O-N 3.23Å; D73-M77 PolarHBondContact O-N 2.85Å
74	L	44.2	Very low	55.5	Low	145 Å²	145	106.6 Å²	106.6	76%	0.759	60%	0.6	S	S	*	*	H	α-helix	trans	-66.4	-24.6	-174.9	-79.2	161.8	0	0	0	112.6	L72 A78	L72-L74 PolarHBondContact O-N 2.79Å; L74-A78 PolarHBondContact O-N 3.08Å
75	T	55.2	Low	58.5	Low	79 Å²	79	107.1 Å²	107.1	49%	0.485	59%	0.588	S	S	.	*	H	α-helix	trans	-67.1	-52.2	173.6	39	0	0	0	0	111.5	D73 M77 A78 E79	D73-T75 VanDerWaalsContact CG-OG1 3.31Å; D73-T75 PolarHBondContact O-N 2.92Å; D73-T75 PolarHBondContact OD1-OG1 2.98Å; T75-M77 VanDerWaalsContact C-N 3.26Å; T75-M77 PolarHBondContact O-N 2.87Å; T75-A78 WeakPolarHBondContact O-CA 3.25Å; T75-A78 WeakPolarHBondContact O-CB 3.48Å; T75-A78 PolarHBondContact O-N 3.12Å; T75-E79 PolarHBondContact O-N 3.38Å
76	A	64.4	Low	61.6	Low	47 Å²	47	102.9 Å²	102.9	39%	0.388	56%	0.556	S	S	.	*	H	α-helix	trans	-59.3	-36.6	179	0	0	0	0	0	112.4	D73 Q80	D73-A76 HydrophobicContact CB-CB 4.23Å; D73-A76 PolarHBondContact O-N 3.23Å; A76-Q80 WeakPolarHBondContact O-CB 3.23Å; A76-Q80 PolarHBondContact O-N 3.43Å
77	M	65.3	Low	64.4	Low	113 Å²	113	97.1 Å²	97.1	56%	0.557	52%	0.519	S	S	*	.	H	α-helix	trans	-66.7	-35.3	173.6	-65.7	-168.9	72.4	0	0	113	D73 T75 Q81	D73-M77 PolarHBondContact O-N 2.85Å; T75-M77 VanDerWaalsContact C-N 3.26Å; T75-M77 PolarHBondContact O-N 2.87Å; M77-Q81 PolarHBondContact O-N 3Å
78	A	73.5	Confident	66.9	Low	51 Å²	51	92.1 Å²	92.1	42%	0.421	49%	0.492	S	S	.	.	H	α-helix	trans	-73.4	-39.3	177.9	0	0	0	0	0	112.1	L74 T75 Q81 Q82	L74-A78 PolarHBondContact O-N 3.08Å; T75-A78 WeakPolarHBondContact O-CA 3.25Å; T75-A78 WeakPolarHBondContact O-CB 3.48Å; T75-A78 PolarHBondContact O-N 3.12Å; A78-Q81 PolarHBondContact O-N 3Å; A78-Q82 WeakPolarHBondContact O-CG 3.5Å; A78-Q82 PolarHBondContact O-N 2.86Å; A78-Q82 VanDerWaalsContact O-N 3.09Å
79	E	82.3	Confident	69.7	Low	101 Å²	101	92.2 Å²	92.2	47%	0.472	48%	0.476	S	S	.	.	H	α-helix	trans	-63.6	-46.6	175.5	-71.6	168.4	-169	0	0	111.2	T75 Q81 Q82 F83 F116	T75-E79 PolarHBondContact O-N 3.38Å; E79-Q81 VanDerWaalsContact C-N 3.3Å; E79-Q81 PolarHBondContact O-N 3.24Å; E79-Q82 WeakPolarHBondContact O-CB 3.44Å; E79-Q82 PolarHBondContact O-N 3.42Å; E79-Q82 VanDerWaalsContact O-N 3.15Å; E79-F83 PolarHBondContact O-N 3.06Å; E79-F116 HydrophobicContact CB-CE1 4.48Å; E79-F116 HydrophobicContact CB-CZ 4.32Å
80	Q	83.8	Confident	72.4	Confident	5 Å²	5	80.8 Å²	80.8	2%	0.023	43%	0.434	C	S	.	.	H	α-helix	trans	-59.4	-39.7	176.1	-172	67	9.1	0	0	112.4	A76 Q82 F83 Y84 F116 Q119	A76-Q80 WeakPolarHBondContact O-CB 3.23Å; A76-Q80 PolarHBondContact O-N 3.43Å; Q80-Q82 VanDerWaalsContact C-N 3.34Å; Q80-F83 WeakPolarHBondContact O-CB 3.35Å; Q80-F83 PolarHBondContact O-N 3.49Å; Q80-Y84 HydrophobicContact CG-CE1 3.92Å; Q80-Y84 PolarHBondContact O-N 2.92Å; Q80-Y84 VanDerWaalsContact O-N 3.09Å; Q80-F116 PolarHBondContact NE2-O 2.71Å; Q80-Q119 HydrophobicContact CG-CG 4.17Å
81	Q	83.8	Confident	75	Confident	137 Å²	137	79.2 Å²	79.2	64%	0.64	42%	0.415	S	S	*	.	H	α-helix	trans	-73.9	-25.5	180	-165.9	153.5	17.4	0	0	113	M77 A78 E79	M77-Q81 PolarHBondContact O-N 3Å; A78-Q81 PolarHBondContact O-N 3Å; E79-Q81 VanDerWaalsContact C-N 3.3Å; E79-Q81 PolarHBondContact O-N 3.24Å
82	Q	88.1	Confident	77.8	Confident	135 Å²	135	72.1 Å²	72.1	63%	0.631	39%	0.387	S	S	*	.	H	α-helix	trans	-70.8	-37.6	166.1	-71.1	178.3	4.3	0	0	111.5	A78 E79 Q80 Y84 L85 L86	A78-Q82 WeakPolarHBondContact O-CG 3.5Å; A78-Q82 PolarHBondContact O-N 2.86Å; A78-Q82 VanDerWaalsContact O-N 3.09Å; E79-Q82 WeakPolarHBondContact O-CB 3.44Å; E79-Q82 PolarHBondContact O-N 3.42Å; E79-Q82 VanDerWaalsContact O-N 3.15Å; Q80-Q82 VanDerWaalsContact C-N 3.34Å; Q82-Y84 VanDerWaalsContact C-N 3.33Å; Q82-Y84 PolarHBondContact O-N 3.18Å; Q82-L85 WeakPolarHBondContact O-CB 3.42Å; Q82-L85 PolarHBondContact O-N 2.9Å; Q82-L85 VanDerWaalsContact O-N 3.14Å; Q82-L86 PolarHBondContact O-N 3.15Å
83	F	92	Very high	80.1	Confident	7 Å²	7	69.8 Å²	69.8	3%	0.031	39%	0.39	C	S	.	.	H	α-helix	trans	-63.1	-35.8	176.9	-167.2	-103.8	0	0	0	112.7	E79 Q80 L85 L86 L87 Y105 I108 F116 L117	E79-F83 PolarHBondContact O-N 3.06Å; Q80-F83 WeakPolarHBondContact O-CB 3.35Å; Q80-F83 PolarHBondContact O-N 3.49Å; F83-L85 VanDerWaalsContact C-N 3.33Å; F83-L85 PolarHBondContact O-N 2.96Å; F83-L86 HydrophobicContact CD2-CD2 4.14Å; F83-L86 HydrophobicContact CE2-CD2 4.27Å; F83-L86 WeakPolarHBondContact O-CB 3.44Å; F83-L86 PolarHBondContact O-N 2.94Å; F83-L87 HydrophobicContact CD1-CD1 3.87Å; F83-L87 HydrophobicContact CD1-CG 4.12Å; F83-L87 HydrophobicContact CE1-CD1 3.69Å; F83-L87 HydrophobicContact CE1-CD2 4.08Å; F83-L87 HydrophobicContact CE1-CG 3.89Å; F83-L87 HydrophobicContact CZ-CD2 4.22Å; F83-L87 HydrophobicContact CZ-CG 4.38Å; F83-L87 WeakPolarHBondContact O-CG 3.43Å; F83-L87 PolarHBondContact O-N 3.44Å; F83-Y105 HydrophobicContact CE2-CD2 4.22Å; F83-Y105 HydrophobicContact CE2-CE2 4.38Å; F83-Y105 HydrophobicContact CZ-CD2 4.43Å; F83-Y105 HydrophobicContact CZ-CE2 4.22Å; F83-I108 HydrophobicContact CD2-CD1 4.03Å; F83-I108 HydrophobicContact CE2-CD1 3.85Å; F83-F116 HydrophobicContact CD1-CB 3.6Å; F83-F116 HydrophobicContact CD2-CB 4.04Å; F83-F116 AromaticContact CD2-CD2 3.94Å; F83-F116 HydrophobicContact CD2-CD2 3.94Å; F83-F116 HydrophobicContact CD2-CG 4.33Å; F83-F116 HydrophobicContact CE1-CB 3.63Å; F83-F116 HydrophobicContact CE2-CB 4.09Å; F83-F116 HydrophobicContact CE2-CD2 4.23Å; F83-F116 HydrophobicContact CG-CB 3.8Å; F83-F116 HydrophobicContact CG-CD2 4.3Å; F83-F116 HydrophobicContact CG-CG 4.26Å; F83-F116 HydrophobicContact CZ-CB 3.89Å; F83-L117 HydrophobicContact CE1-CD2 3.83Å; F83-L117 HydrophobicContact CE1-CG 4.09Å; F83-L117 HydrophobicContact CZ-CD2 3.7Å; F83-L117 HydrophobicContact CZ-CG 3.87Å
84	Y	91.4	Very high	82.1	Confident	44 Å²	44	68.1 Å²	68.1	17%	0.173	38%	0.381	C	S	.	.	H	α-helix	trans	-63.2	-37.1	172.6	-65.6	-8.8	0	0	0	113.2	Q80 Q82 G88 A120 D123	Q80-Y84 HydrophobicContact CG-CE1 3.92Å; Q80-Y84 PolarHBondContact O-N 2.92Å; Q80-Y84 VanDerWaalsContact O-N 3.09Å; Q82-Y84 VanDerWaalsContact C-N 3.33Å; Q82-Y84 PolarHBondContact O-N 3.18Å; Y84-G88 PolarHBondContact O-N 2.95Å; Y84-A120 HydrophobicContact CD1-CB 4.14Å; Y84-A120 HydrophobicContact CE1-CB 3.62Å; Y84-D123 VanDerWaalsContact CE2-OD2 3.28Å; Y84-D123 WeakPolarHBondContact CE2-OD2 3.39Å; Y84-D123 WeakPolarHBondContact OH-CB 3.49Å; Y84-D123 PolarHBondContact OH-OD2 3.28Å
85	L	90.2	Very high	84	Confident	117 Å²	117	66 Å²	66	61%	0.613	37%	0.371	S	S	*	.	H	α-helix	trans	-68.7	-36.9	174.2	-65.7	169.8	0	0	0	111.1	Q82 F83 G88 N89	Q82-L85 WeakPolarHBondContact O-CB 3.42Å; Q82-L85 PolarHBondContact O-N 2.9Å; Q82-L85 VanDerWaalsContact O-N 3.14Å; F83-L85 VanDerWaalsContact C-N 3.33Å; F83-L85 PolarHBondContact O-N 2.96Å; L85-G88 PolarHBondContact O-N 3.25Å; L85-N89 PolarHBondContact O-N 3.38Å; L85-N89 PolarHBondContact O-ND2 2.97Å
86	L	93.3	Very high	85.6	Confident	19 Å²	19	68.1 Å²	68.1	10%	0.099	38%	0.379	C	S	.	.	H	α-helix	trans	-61.9	-49.6	174.3	-176.2	65.1	0	0	0	111.6	Q82 F83 G88 N89 L90 A101 T104 I108	Q82-L86 PolarHBondContact O-N 3.15Å; F83-L86 HydrophobicContact CD2-CD2 4.14Å; F83-L86 HydrophobicContact CE2-CD2 4.27Å; F83-L86 WeakPolarHBondContact O-CB 3.44Å; F83-L86 PolarHBondContact O-N 2.94Å; L86-G88 VanDerWaalsContact C-N 3.29Å; L86-G88 PolarHBondContact O-N 3Å; L86-N89 WeakPolarHBondContact O-CB 3.28Å; L86-N89 PolarHBondContact O-N 2.98Å; L86-L90 PolarHBondContact O-N 3.2Å; L86-A101 HydrophobicContact CD1-CB 3.84Å; L86-T104 HydrophobicContact CD1-CG2 3.82Å; L86-T104 HydrophobicContact CD2-CG2 4.27Å; L86-I108 HydrophobicContact CD2-CD1 3.68Å
87	L	91.9	Very high	86.7	Confident	0 Å²	0	68 Å²	68	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-58.8	-39.1	175.4	-68.8	174.7	0	0	0	112.4	F83 N89 L90 L117 A120 V130 M133 A134 L137	F83-L87 HydrophobicContact CD1-CD1 3.87Å; F83-L87 HydrophobicContact CD1-CG 4.12Å; F83-L87 HydrophobicContact CE1-CD1 3.69Å; F83-L87 HydrophobicContact CE1-CD2 4.08Å; F83-L87 HydrophobicContact CE1-CG 3.89Å; F83-L87 HydrophobicContact CZ-CD2 4.22Å; F83-L87 HydrophobicContact CZ-CG 4.38Å; F83-L87 WeakPolarHBondContact O-CG 3.43Å; F83-L87 PolarHBondContact O-N 3.44Å; L87-N89 VanDerWaalsContact C-N 3.33Å; L87-L90 HydrophobicContact CD2-CD1 4.25Å; L87-L90 PolarHBondContact O-N 3.2Å; L87-L117 HydrophobicContact CD2-CD2 4.18Å; L87-A120 HydrophobicContact CD1-CB 3.86Å; L87-V130 HydrophobicContact CB-CG1 3.9Å; L87-V130 HydrophobicContact CD1-CG1 3.75Å; L87-M133 HydrophobicContact CD2-CG 4.21Å; L87-A134 HydrophobicContact CD1-CB 3.96Å; L87-L137 HydrophobicContact CD2-CD1 3.65Å
88	G	90.4	Very high	87.8	Confident	28 Å²	28	67.5 Å²	67.5	29%	0.289	37%	0.365	S	S	.	.	H	α-helix	trans	-64.1	-35.6	173	0	0	0	0	0	113.4	Y84 L85 L86 M91	Y84-G88 PolarHBondContact O-N 2.95Å; L85-G88 PolarHBondContact O-N 3.25Å; L86-G88 VanDerWaalsContact C-N 3.29Å; L86-G88 PolarHBondContact O-N 3Å; G88-M91 PolarHBondContact O-N 2.85Å
89	N	91	Very high	88.3	Confident	68 Å²	68	71 Å²	71	36%	0.364	37%	0.371	S	S	.	.	H	α-helix	trans	-74	-28.7	178.2	-70.3	-21.4	0	0	0	113.3	L85 L86 L87 M91 N92 V97 A101	L85-N89 PolarHBondContact O-N 3.38Å; L85-N89 PolarHBondContact O-ND2 2.97Å; L86-N89 WeakPolarHBondContact O-CB 3.28Å; L86-N89 PolarHBondContact O-N 2.98Å; L87-N89 VanDerWaalsContact C-N 3.33Å; N89-M91 PolarHBondContact O-N 3.25Å; N89-N92 WeakPolarHBondContact O-CB 3.32Å; N89-N92 PolarHBondContact O-N 2.98Å; N89-N92 VanDerWaalsContact O-N 3.12Å; N89-V97 HydrophobicContact CB-CG1 4.01Å; N89-A101 HydrophobicContact CB-CB 3.69Å
90	L	89.1	Confident	88.7	Confident	17 Å²	17	72.6 Å²	72.6	9%	0.089	38%	0.378	C	S	.	.	H	α-helix	trans	-61.6	-25.8	171.4	-67.6	173.9	0	0	0	112.5	L86 L87 R98 A101 E102 L137	L86-L90 PolarHBondContact O-N 3.2Å; L87-L90 HydrophobicContact CD2-CD1 4.25Å; L87-L90 PolarHBondContact O-N 3.2Å; L90-R98 VanDerWaalsContact O-CD 3.31Å; L90-R98 WeakPolarHBondContact O-CD 3.36Å; L90-R98 WeakPolarHBondContact O-CG 3.28Å; L90-A101 VanDerWaalsContact CD2-C 3.47Å; L90-A101 HydrophobicContact CD2-CB 3.74Å; L90-A101 HydrophobicContact CG-CB 4.11Å; L90-E102 HydrophobicContact CD2-CB 4.28Å; L90-E102 HydrophobicContact CD2-CG 3.63Å; L90-L137 HydrophobicContact CD1-CD1 3.76Å
91	M	89.2	Confident	89	Confident	76 Å²	76	72.5 Å²	72.5	37%	0.374	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	14.1	177.2	-59.4	-177.9	-67.9	0	0	113.1	G88 N89 E129 V130 M133	G88-M91 PolarHBondContact O-N 2.85Å; N89-M91 PolarHBondContact O-N 3.25Å; M91-E129 HydrophobicContact CE-CB 4.05Å; M91-E129 HydrophobicContact SD-CB 4.04Å; M91-V130 HydrophobicContact CE-CB 4.48Å; M91-V130 HydrophobicContact CE-CG2 3.75Å; M91-M133 HydrophobicContact CE-CB 4.47Å; M91-M133 HydrophobicContact CG-CE 3.56Å; M91-M133 HydrophobicContact CG-CG 4.43Å; M91-M133 HydrophobicContact SD-CB 3.92Å; M91-M133 HydrophobicContact SD-CE 4.21Å; M91-M133 HydrophobicContact SD-CG 4.44Å
92	N	90.4	Very high	89.2	Confident	63 Å²	63	69.6 Å²	69.6	34%	0.337	37%	0.365	S	S	.	.			trans	-78.3	139.8	-177.2	-158.2	-53.8	0	0	0	111.8	N89 D94 V97	N89-N92 WeakPolarHBondContact O-CB 3.32Å; N89-N92 PolarHBondContact O-N 2.98Å; N89-N92 VanDerWaalsContact O-N 3.12Å; N92-D94 VanDerWaalsContact C-N 3.27Å; N92-D94 PolarHBondContact O-N 3.37Å; N92-D94 PolarHBondContact OD1-N 3.04Å; N92-V97 HydrophobicContact CB-CB 4.19Å; N92-V97 HydrophobicContact CB-CG1 3.93Å
93	A	86.4	Confident	89.3	Confident	105 Å²	105	68.2 Å²	68.2	87%	0.868	36%	0.359	S	S	*	.	S	Bend	trans	-70.8	-17.9	176.8	0	0	0	0	0	113.7	N95	A93-N95 PolarHBondContact O-N 3.27Å
94	D	88.5	Confident	89.3	Confident	74 Å²	74	71.3 Å²	71.3	40%	0.396	38%	0.378	S	S	.	.	S	Bend	trans	-81.9	110.7	170.4	-174.3	-13.9	0	0	0	110.4	N92 N96 V97 R98	N92-D94 VanDerWaalsContact C-N 3.27Å; N92-D94 PolarHBondContact O-N 3.37Å; N92-D94 PolarHBondContact OD1-N 3.04Å; D94-N96 PolarHBondContact O-N 2.88Å; D94-N96 VanDerWaalsContact O-N 3.1Å; D94-N96 WeakPolarHBondContact OD1-CB 3.45Å; D94-N96 PolarHBondContact OD1-N 3.11Å; D94-N96 PolarHBondContact OD1-ND2 2.61Å; D94-V97 HydrophobicContact CB-CB 4.27Å; D94-V97 HydrophobicContact CB-CG2 4.01Å; D94-V97 PolarHBondContact O-N 3.39Å; D94-R98 PolarHBondContact O-N 3.36Å
95	N	84.7	Confident	89.4	Confident	100 Å²	100	70.1 Å²	70.1	54%	0.535	37%	0.373	S	S	.	.	H	α-helix	trans	-52.1	-30.8	176.8	-78.8	-20.6	0	0	0	113.9	A93 R98 K99	A93-N95 PolarHBondContact O-N 3.27Å; N95-R98 PolarHBondContact OD1-NH2 3.04Å; N95-K99 WeakPolarHBondContact O-CB 3.27Å; N95-K99 PolarHBondContact O-N 3.28Å
96	N	88.4	Confident	89.3	Confident	123 Å²	123	69.5 Å²	69.5	66%	0.658	37%	0.371	S	S	*	.	H	α-helix	trans	-70.2	-40.6	178	-56.8	-79	0	0	0	111.4	D94 Q100	D94-N96 PolarHBondContact O-N 2.88Å; D94-N96 VanDerWaalsContact O-N 3.1Å; D94-N96 WeakPolarHBondContact OD1-CB 3.45Å; D94-N96 PolarHBondContact OD1-N 3.11Å; D94-N96 PolarHBondContact OD1-ND2 2.61Å; N96-Q100 VanDerWaalsContact O-CB 3.29Å; N96-Q100 WeakPolarHBondContact O-CB 3.33Å; N96-Q100 PolarHBondContact O-N 3.47Å; N96-Q100 VanDerWaalsContact O-N 3.08Å
97	V	88.1	Confident	89.2	Confident	45 Å²	45	75.2 Å²	75.2	27%	0.273	40%	0.402	S	S	.	.	H	α-helix	trans	-70.9	-43.1	178.5	178.3	0	0	0	0	110.4	N89 N92 D94 A101	N89-V97 HydrophobicContact CB-CG1 4.01Å; N92-V97 HydrophobicContact CB-CB 4.19Å; N92-V97 HydrophobicContact CB-CG1 3.93Å; D94-V97 HydrophobicContact CB-CB 4.27Å; D94-V97 HydrophobicContact CB-CG2 4.01Å; D94-V97 PolarHBondContact O-N 3.39Å; V97-A101 WeakPolarHBondContact O-CB 3.31Å; V97-A101 PolarHBondContact O-N 2.98Å
98	R	88.5	Confident	89.2	Confident	103 Å²	103	76.7 Å²	76.7	39%	0.389	41%	0.409	S	S	.	.	H	α-helix	trans	-60.8	-52.9	175.9	175	166	63.9	146.4	-0.5	111.5	L90 D94 N95 Q100 A101 E102	L90-R98 VanDerWaalsContact O-CD 3.31Å; L90-R98 WeakPolarHBondContact O-CD 3.36Å; L90-R98 WeakPolarHBondContact O-CG 3.28Å; D94-R98 PolarHBondContact O-N 3.36Å; N95-R98 PolarHBondContact OD1-NH2 3.04Å; R98-Q100 PolarHBondContact O-N 3.46Å; R98-A101 CarbonylContact O-C 3.57Å; R98-A101 WeakPolarHBondContact O-CA 3.31Å; R98-A101 WeakPolarHBondContact O-CB 3.37Å; R98-A101 PolarHBondContact O-N 2.95Å; R98-E102 HydrophobicContact CG-CG 4.45Å; R98-E102 WeakPolarHBondContact CG-OE1 3.36Å; R98-E102 WeakPolarHBondContact O-CG 3.33Å; R98-E102 PolarHBondContact O-N 3.36Å
99	K	83.6	Confident	89.2	Confident	124 Å²	124	79.1 Å²	79.1	54%	0.539	42%	0.42	S	S	.	.	H	α-helix	trans	-61.7	-39.8	179.7	-176.4	167.7	-178.7	166.5	0	113.3	N95 A101 E102 E103	N95-K99 WeakPolarHBondContact O-CB 3.27Å; N95-K99 PolarHBondContact O-N 3.28Å; K99-A101 VanDerWaalsContact C-N 3.28Å; K99-A101 PolarHBondContact O-N 2.96Å; K99-E102 WeakPolarHBondContact CA-OE2 3.46Å; K99-E102 PolarHBondContact O-N 3.1Å; K99-E103 WeakPolarHBondContact CE-OE1 3.43Å; K99-E103 WeakPolarHBondContact O-CG 3.41Å; K99-E103 PolarHBondContact O-N 3.16Å
100	Q	90.1	Very high	88.9	Confident	134 Å²	134	76.7 Å²	76.7	63%	0.626	41%	0.411	S	S	*	.	H	α-helix	trans	-65.4	-33.2	174.4	-172.9	173.4	21	0	0	112.1	N96 R98 T104	N96-Q100 VanDerWaalsContact O-CB 3.29Å; N96-Q100 WeakPolarHBondContact O-CB 3.33Å; N96-Q100 PolarHBondContact O-N 3.47Å; N96-Q100 VanDerWaalsContact O-N 3.08Å; R98-Q100 PolarHBondContact O-N 3.46Å; Q100-T104 VanDerWaalsContact O-CB 3.31Å; Q100-T104 WeakPolarHBondContact O-CB 3.1Å; Q100-T104 PolarHBondContact O-N 3.35Å; Q100-T104 PolarHBondContact O-OG1 3.12Å
101	A	89.8	Confident	88.7	Confident	4 Å²	4	79.9 Å²	79.9	3%	0.033	43%	0.425	C	S	.	.	H	α-helix	trans	-72.3	-37.3	174.1	0	0	0	0	0	112.4	L86 N89 L90 V97 R98 K99 T104 Y105	L86-A101 HydrophobicContact CD1-CB 3.84Å; N89-A101 HydrophobicContact CB-CB 3.69Å; L90-A101 VanDerWaalsContact CD2-C 3.47Å; L90-A101 HydrophobicContact CD2-CB 3.74Å; L90-A101 HydrophobicContact CG-CB 4.11Å; V97-A101 WeakPolarHBondContact O-CB 3.31Å; V97-A101 PolarHBondContact O-N 2.98Å; R98-A101 CarbonylContact O-C 3.57Å; R98-A101 WeakPolarHBondContact O-CA 3.31Å; R98-A101 WeakPolarHBondContact O-CB 3.37Å; R98-A101 PolarHBondContact O-N 2.95Å; K99-A101 VanDerWaalsContact C-N 3.28Å; K99-A101 PolarHBondContact O-N 2.96Å; A101-T104 PolarHBondContact O-N 3.28Å; A101-Y105 WeakPolarHBondContact O-CB 3.4Å; A101-Y105 PolarHBondContact O-N 3.01Å
102	E	88.7	Confident	88.7	Confident	76 Å²	76	79.8 Å²	79.8	36%	0.355	43%	0.426	S	S	.	.	H	α-helix	trans	-60.2	-55.3	172.7	-69.9	161.7	176.7	0	0	110.2	L90 R98 K99 T104 Y105 D106	L90-E102 HydrophobicContact CD2-CB 4.28Å; L90-E102 HydrophobicContact CD2-CG 3.63Å; R98-E102 HydrophobicContact CG-CG 4.45Å; R98-E102 WeakPolarHBondContact CG-OE1 3.36Å; R98-E102 WeakPolarHBondContact O-CG 3.33Å; R98-E102 PolarHBondContact O-N 3.36Å; K99-E102 WeakPolarHBondContact CA-OE2 3.46Å; K99-E102 PolarHBondContact O-N 3.1Å; E102-T104 PolarHBondContact O-N 3.18Å; E102-Y105 WeakPolarHBondContact O-CB 3.42Å; E102-Y105 PolarHBondContact O-N 3Å; E102-D106 PolarHBondContact O-N 3.4Å
103	E	90.2	Very high	88.7	Confident	106 Å²	106	77.8 Å²	77.8	50%	0.495	42%	0.415	S	S	.	.	H	α-helix	trans	-55.1	-38.6	175.1	-71.3	174.4	-167.2	0	0	112.1	K99 N107	K99-E103 WeakPolarHBondContact CE-OE1 3.43Å; K99-E103 WeakPolarHBondContact O-CG 3.41Å; K99-E103 PolarHBondContact O-N 3.16Å; E103-N107 PolarHBondContact O-N 3.22Å; E103-N107 PolarHBondContact O-ND2 3.25Å
104	T	92.3	Very high	88.8	Confident	72 Å²	72	72.9 Å²	72.9	44%	0.442	37%	0.374	S	S	.	.	H	α-helix	trans	-70.1	-40.7	177.5	-59.7	0	0	0	0	111.9	L86 Q100 A101 E102 I108	L86-T104 HydrophobicContact CD1-CG2 3.82Å; L86-T104 HydrophobicContact CD2-CG2 4.27Å; Q100-T104 VanDerWaalsContact O-CB 3.31Å; Q100-T104 WeakPolarHBondContact O-CB 3.1Å; Q100-T104 PolarHBondContact O-N 3.35Å; Q100-T104 PolarHBondContact O-OG1 3.12Å; A101-T104 PolarHBondContact O-N 3.28Å; E102-T104 PolarHBondContact O-N 3.18Å; T104-I108 WeakPolarHBondContact O-CG1 3.43Å
105	Y	92.8	Very high	88.7	Confident	18 Å²	18	72.3 Å²	72.3	7%	0.071	37%	0.373	C	S	.	.	H	α-helix	trans	-65.1	-46.2	177.1	172.2	-98.4	0	0	0	111.1	F83 A101 E102 N107 I108 K113 L117 L137	F83-Y105 HydrophobicContact CE2-CD2 4.22Å; F83-Y105 HydrophobicContact CE2-CE2 4.38Å; F83-Y105 HydrophobicContact CZ-CD2 4.43Å; F83-Y105 HydrophobicContact CZ-CE2 4.22Å; A101-Y105 WeakPolarHBondContact O-CB 3.4Å; A101-Y105 PolarHBondContact O-N 3.01Å; E102-Y105 WeakPolarHBondContact O-CB 3.42Å; E102-Y105 PolarHBondContact O-N 3Å; Y105-N107 VanDerWaalsContact C-N 3.28Å; Y105-N107 PolarHBondContact O-N 3.41Å; Y105-I108 WeakPolarHBondContact O-CB 3.47Å; Y105-I108 PolarHBondContact O-N 2.89Å; Y105-K113 HydrophobicContact CE1-CD 4.36Å; Y105-K113 HydrophobicContact CE2-CD 4.22Å; Y105-K113 HydrophobicContact CE2-CG 4.23Å; Y105-K113 WeakPolarHBondContact O-CE 3.44Å; Y105-K113 PolarHBondContact O-NZ 3.03Å; Y105-L117 HydrophobicContact CE2-CD2 4.47Å; Y105-L137 HydrophobicContact CE1-CD2 4.19Å; Y105-L137 HydrophobicContact CE2-CD1 4.18Å
106	D	88.7	Confident	89.1	Confident	105 Å²	105	69.2 Å²	69.2	56%	0.561	36%	0.355	S	S	*	.	H	α-helix	trans	-59.1	-40.7	-176.9	-71.7	-22.6	0	0	0	112.1	E102 I108 K113	E102-D106 PolarHBondContact O-N 3.4Å; D106-I108 PolarHBondContact O-N 3.33Å; D106-K113 PolarHBondContact O-NZ 3.33Å
107	N	91	Very high	89.3	Confident	139 Å²	139	63.3 Å²	63.3	74%	0.743	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-6.6	176.3	-77.8	-72.4	0	0	0	115.2	E103 Y105	E103-N107 PolarHBondContact O-N 3.22Å; E103-N107 PolarHBondContact O-ND2 3.25Å; Y105-N107 VanDerWaalsContact C-N 3.28Å; Y105-N107 PolarHBondContact O-N 3.41Å
108	I	91.7	Very high	89.5	Confident	31 Å²	31	61.4 Å²	61.4	16%	0.159	31%	0.312	C	S	.	.	S	Bend	trans	-76.2	130	174.1	-58.5	173.2	0	0	0	109.4	F83 L86 T104 Y105 D106 G110 N112 K113 F116	F83-I108 HydrophobicContact CD2-CD1 4.03Å; F83-I108 HydrophobicContact CE2-CD1 3.85Å; L86-I108 HydrophobicContact CD2-CD1 3.68Å; T104-I108 WeakPolarHBondContact O-CG1 3.43Å; Y105-I108 WeakPolarHBondContact O-CB 3.47Å; Y105-I108 PolarHBondContact O-N 2.89Å; D106-I108 PolarHBondContact O-N 3.33Å; I108-G110 PolarHBondContact O-N 3.03Å; I108-N112 HydrophobicContact CG2-CB 4.03Å; I108-K113 HydrophobicContact CB-CG 3.96Å; I108-K113 HydrophobicContact CG2-CG 3.82Å; I108-K113 WeakPolarHBondContact O-CE 3.43Å; I108-K113 PolarHBondContact O-NZ 3.09Å; I108-F116 HydrophobicContact CG2-CD2 4.49Å; I108-F116 HydrophobicContact CG2-CE2 4.42Å
109	P	89.7	Confident	89.5	Confident	78 Å²	78	60.6 Å²	60.6	51%	0.506	31%	0.312	S	S	.	.			trans	-56.1	135.5	175.9	-26.2	34.7	0	0	0	112.6	Q111 N112 K113	P109-Q111 PolarHBondContact O-N 3.19Å; P109-Q111 VanDerWaalsContact O-N 3.14Å; P109-N112 WeakPolarHBondContact O-CA 3.28Å; P109-N112 WeakPolarHBondContact O-CB 3.12Å; P109-N112 PolarHBondContact O-N 3.33Å; P109-K113 PolarHBondContact O-N 3.08Å
110	G	85.2	Confident	90	Very high	17 Å²	17	54.7 Å²	54.7	18%	0.175	29%	0.287	C	S	.	.	H	α-helix	trans	-54	-37.4	-175.6	0	0	0	0	0	114.5	I108 N112 K113 I114 I149	I108-G110 PolarHBondContact O-N 3.03Å; G110-N112 VanDerWaalsContact C-N 3.27Å; G110-N112 PolarHBondContact O-N 3.29Å; G110-K113 WeakPolarHBondContact O-CB 3.44Å; G110-K113 PolarHBondContact O-N 3.37Å; G110-I114 PolarHBondContact O-N 2.94Å; G110-I114 VanDerWaalsContact O-N 3.14Å; G110-I149 VanDerWaalsContact C-CG2 3.46Å
111	Q	85.1	Confident	90.1	Very high	84 Å²	84	48.4 Å²	48.4	39%	0.393	26%	0.257	S	S	.	.	H	α-helix	trans	-60.9	-34.9	176.8	-57.8	-173.9	-9.4	0	0	112.8	P109 T115 I149 G152 L153	P109-Q111 PolarHBondContact O-N 3.19Å; P109-Q111 VanDerWaalsContact O-N 3.14Å; Q111-T115 PolarHBondContact O-OG1 2.85Å; Q111-I149 HydrophobicContact CG-CG2 4.37Å; Q111-G152 PolarHBondContact NE2-O 3.08Å; Q111-L153 HydrophobicContact CB-CD2 3.75Å; Q111-L153 HydrophobicContact CG-CD2 3.76Å
112	N	88.1	Confident	90	Very high	75 Å²	75	54 Å²	54	40%	0.401	28%	0.277	S	S	.	.	H	α-helix	trans	-79.6	-39.9	176.2	-67.4	3.1	0	0	0	110.8	I108 P109 G110 I114 T115 F116	I108-N112 HydrophobicContact CG2-CB 4.03Å; P109-N112 WeakPolarHBondContact O-CA 3.28Å; P109-N112 WeakPolarHBondContact O-CB 3.12Å; P109-N112 PolarHBondContact O-N 3.33Å; G110-N112 VanDerWaalsContact C-N 3.27Å; G110-N112 PolarHBondContact O-N 3.29Å; N112-I114 PolarHBondContact O-N 3.44Å; N112-T115 PolarHBondContact O-N 2.88Å; N112-T115 VanDerWaalsContact O-N 3.15Å; N112-F116 HydrophobicContact CB-CD2 4.26Å; N112-F116 HydrophobicContact CB-CE2 3.9Å; N112-F116 HydrophobicContact CB-CZ 4.4Å; N112-F116 WeakPolarHBondContact O-CD2 3.37Å; N112-F116 WeakPolarHBondContact O-CG 3.32Å; N112-F116 PolarHBondContact O-N 3.2Å
113	K	90.7	Very high	90	Very high	20 Å²	20	52.4 Å²	52.4	9%	0.087	27%	0.271	C	S	.	.	H	α-helix	trans	-51.6	-51.2	176.3	-72.3	177.4	171.9	154.2	0	111.3	Y105 D106 I108 P109 G110 T115 F116 L117 L141	Y105-K113 HydrophobicContact CE1-CD 4.36Å; Y105-K113 HydrophobicContact CE2-CD 4.22Å; Y105-K113 HydrophobicContact CE2-CG 4.23Å; Y105-K113 WeakPolarHBondContact O-CE 3.44Å; Y105-K113 PolarHBondContact O-NZ 3.03Å; D106-K113 PolarHBondContact O-NZ 3.33Å; I108-K113 HydrophobicContact CB-CG 3.96Å; I108-K113 HydrophobicContact CG2-CG 3.82Å; I108-K113 WeakPolarHBondContact O-CE 3.43Å; I108-K113 PolarHBondContact O-NZ 3.09Å; P109-K113 PolarHBondContact O-N 3.08Å; G110-K113 WeakPolarHBondContact O-CB 3.44Å; G110-K113 PolarHBondContact O-N 3.37Å; K113-T115 VanDerWaalsContact C-N 3.31Å; K113-T115 PolarHBondContact O-N 3.29Å; K113-F116 PolarHBondContact O-N 3.26Å; K113-L117 HydrophobicContact CB-CD1 4.24Å; K113-L117 VanDerWaalsContact O-CB 3.29Å; K113-L117 WeakPolarHBondContact O-CB 3.49Å; K113-L117 WeakPolarHBondContact O-CD1 3.41Å; K113-L117 WeakPolarHBondContact O-CG 3.31Å; K113-L117 PolarHBondContact O-N 2.72Å; K113-L141 HydrophobicContact CB-CD2 3.55Å; K113-L141 HydrophobicContact CD-CD1 4.07Å; K113-L141 HydrophobicContact CD-CD2 4.29Å
114	I	89.5	Confident	89.7	Confident	3 Å²	3	51.6 Å²	51.6	2%	0.015	28%	0.283	C	S	.	.	H	α-helix	trans	-53.8	-47.7	179	-69.1	-177.4	0	0	0	111.6	G110 N112 L118 L138 L141 L142 I149 L153 I161	G110-I114 PolarHBondContact O-N 2.94Å; G110-I114 VanDerWaalsContact O-N 3.14Å; N112-I114 PolarHBondContact O-N 3.44Å; I114-L118 VanDerWaalsContact O-CB 3.26Å; I114-L118 WeakPolarHBondContact O-CB 3.46Å; I114-L118 PolarHBondContact O-N 2.92Å; I114-L138 HydrophobicContact CB-CD1 4.34Å; I114-L138 HydrophobicContact CG1-CD1 4.09Å; I114-L138 HydrophobicContact CG2-CD1 4.32Å; I114-L141 HydrophobicContact CG1-CD2 3.69Å; I114-L142 HydrophobicContact CD1-CD2 4.24Å; I114-I149 HydrophobicContact CD1-CB 4.43Å; I114-I149 HydrophobicContact CD1-CG2 3.46Å; I114-I149 VanDerWaalsContact CD1-CG2 3.46Å; I114-I149 HydrophobicContact CG1-CG2 4.17Å; I114-L153 HydrophobicContact CD1-CD1 4.33Å; I114-I161 HydrophobicContact CG2-CD1 3.66Å; I114-I161 HydrophobicContact CG2-CG1 4.1Å
115	T	87.1	Confident	89.4	Confident	62 Å²	62	53.2 Å²	53.2	38%	0.38	30%	0.297	S	S	.	.	H	α-helix	trans	-67	-47.3	-176.8	-52.5	0	0	0	0	111.5	Q111 N112 K113 Q119	Q111-T115 PolarHBondContact O-OG1 2.85Å; N112-T115 PolarHBondContact O-N 2.88Å; N112-T115 VanDerWaalsContact O-N 3.15Å; K113-T115 VanDerWaalsContact C-N 3.31Å; K113-T115 PolarHBondContact O-N 3.29Å; T115-Q119 WeakPolarHBondContact O-CB 3.27Å; T115-Q119 PolarHBondContact O-N 3.17Å
116	F	91.9	Very high	89.2	Confident	34 Å²	34	53.4 Å²	53.4	15%	0.149	30%	0.302	C	S	.	.	H	α-helix	trans	-66.2	-41.2	-178.8	-63.8	-32	0	0	0	112.7	E79 Q80 F83 I108 N112 K113 A120	E79-F116 HydrophobicContact CB-CE1 4.48Å; E79-F116 HydrophobicContact CB-CZ 4.32Å; Q80-F116 PolarHBondContact NE2-O 2.71Å; F83-F116 HydrophobicContact CD1-CB 3.6Å; F83-F116 HydrophobicContact CD2-CB 4.04Å; F83-F116 AromaticContact CD2-CD2 3.94Å; F83-F116 HydrophobicContact CD2-CD2 3.94Å; F83-F116 HydrophobicContact CD2-CG 4.33Å; F83-F116 HydrophobicContact CE1-CB 3.63Å; F83-F116 HydrophobicContact CE2-CB 4.09Å; F83-F116 HydrophobicContact CE2-CD2 4.23Å; F83-F116 HydrophobicContact CG-CB 3.8Å; F83-F116 HydrophobicContact CG-CD2 4.3Å; F83-F116 HydrophobicContact CG-CG 4.26Å; F83-F116 HydrophobicContact CZ-CB 3.89Å; I108-F116 HydrophobicContact CG2-CD2 4.49Å; I108-F116 HydrophobicContact CG2-CE2 4.42Å; N112-F116 HydrophobicContact CB-CD2 4.26Å; N112-F116 HydrophobicContact CB-CE2 3.9Å; N112-F116 HydrophobicContact CB-CZ 4.4Å; N112-F116 WeakPolarHBondContact O-CD2 3.37Å; N112-F116 WeakPolarHBondContact O-CG 3.32Å; N112-F116 PolarHBondContact O-N 3.2Å; K113-F116 PolarHBondContact O-N 3.26Å; F116-A120 WeakPolarHBondContact O-CB 3.44Å; F116-A120 PolarHBondContact O-N 3.46Å
117	L	93.8	Very high	89.2	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-65.4	-47.7	176.8	-67.9	164.5	0	0	0	111.3	F83 L87 Y105 K113 Q119 A120 I121 A134 L137 L138 L141	F83-L117 HydrophobicContact CE1-CD2 3.83Å; F83-L117 HydrophobicContact CE1-CG 4.09Å; F83-L117 HydrophobicContact CZ-CD2 3.7Å; F83-L117 HydrophobicContact CZ-CG 3.87Å; L87-L117 HydrophobicContact CD2-CD2 4.18Å; Y105-L117 HydrophobicContact CE2-CD2 4.47Å; K113-L117 HydrophobicContact CB-CD1 4.24Å; K113-L117 VanDerWaalsContact O-CB 3.29Å; K113-L117 WeakPolarHBondContact O-CB 3.49Å; K113-L117 WeakPolarHBondContact O-CD1 3.41Å; K113-L117 WeakPolarHBondContact O-CG 3.31Å; K113-L117 PolarHBondContact O-N 2.72Å; L117-Q119 VanDerWaalsContact C-N 3.3Å; L117-Q119 PolarHBondContact O-N 3.36Å; L117-A120 WeakPolarHBondContact O-CB 3.46Å; L117-A120 PolarHBondContact O-N 2.9Å; L117-A120 VanDerWaalsContact O-N 3.12Å; L117-I121 VanDerWaalsContact O-CG1 3.29Å; L117-I121 WeakPolarHBondContact O-CG1 3.3Å; L117-I121 PolarHBondContact O-N 3.2Å; L117-A134 HydrophobicContact CD2-CB 4.08Å; L117-L137 HydrophobicContact CD1-CB 4.28Å; L117-L137 HydrophobicContact CD2-CB 3.81Å; L117-L137 HydrophobicContact CD2-CD1 4.23Å; L117-L138 HydrophobicContact CB-CB 4.01Å; L117-L138 HydrophobicContact CB-CD1 4.36Å; L117-L138 HydrophobicContact CB-CD2 4.36Å; L117-L138 HydrophobicContact CB-CG 4.48Å; L117-L138 HydrophobicContact CD1-CB 4.08Å; L117-L138 HydrophobicContact CD1-CD1 4.24Å; L117-L141 HydrophobicContact CD1-CD2 4.17Å
118	L	90.4	Very high	89.1	Confident	4 Å²	4	48 Å²	48	2%	0.021	28%	0.278	C	S	.	.	H	α-helix	trans	-61.4	-39.7	178.3	-175.3	60.7	0	0	0	111.8	I114 I121 R122 L138 I161 E164 L165	I114-L118 VanDerWaalsContact O-CB 3.26Å; I114-L118 WeakPolarHBondContact O-CB 3.46Å; I114-L118 PolarHBondContact O-N 2.92Å; L118-I121 PolarHBondContact O-N 3.42Å; L118-R122 VanDerWaalsContact O-CG 3.29Å; L118-R122 WeakPolarHBondContact O-CG 3.39Å; L118-R122 PolarHBondContact O-N 3.25Å; L118-R122 VanDerWaalsContact O-N 3.1Å; L118-L138 HydrophobicContact CB-CD2 4.18Å; L118-L138 HydrophobicContact CD1-CD2 4.38Å; L118-I161 HydrophobicContact CD2-CB 4.41Å; L118-I161 HydrophobicContact CD2-CG1 4.22Å; L118-I161 HydrophobicContact CD2-CG2 4.34Å; L118-E164 HydrophobicContact CD2-CB 4.03Å; L118-L165 HydrophobicContact CD1-CD2 3.66Å; L118-L165 HydrophobicContact CD1-CG 4.04Å
119	Q	90.3	Very high	89	Confident	87 Å²	87	52 Å²	52	41%	0.407	30%	0.296	S	S	.	.	H	α-helix	trans	-68	-36.5	174.8	-177.1	173.9	-6.9	0	0	112.3	Q80 T115 L117 R122 D123	Q80-Q119 HydrophobicContact CG-CG 4.17Å; T115-Q119 WeakPolarHBondContact O-CB 3.27Å; T115-Q119 PolarHBondContact O-N 3.17Å; L117-Q119 VanDerWaalsContact C-N 3.3Å; L117-Q119 PolarHBondContact O-N 3.36Å; Q119-R122 PolarHBondContact O-N 3.34Å; Q119-D123 PolarHBondContact O-N 3.4Å; Q119-D123 VanDerWaalsContact O-N 3.17Å
120	A	92.6	Very high	89.1	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-64.6	-42.6	174.5	0	0	0	0	0	112.3	Y84 L87 F116 L117 R122 D123 A134	Y84-A120 HydrophobicContact CD1-CB 4.14Å; Y84-A120 HydrophobicContact CE1-CB 3.62Å; L87-A120 HydrophobicContact CD1-CB 3.86Å; F116-A120 WeakPolarHBondContact O-CB 3.44Å; F116-A120 PolarHBondContact O-N 3.46Å; L117-A120 WeakPolarHBondContact O-CB 3.46Å; L117-A120 PolarHBondContact O-N 2.9Å; L117-A120 VanDerWaalsContact O-N 3.12Å; A120-R122 VanDerWaalsContact C-N 3.31Å; A120-R122 PolarHBondContact O-N 3.42Å; A120-D123 PolarHBondContact O-N 3.01Å; A120-A134 HydrophobicContact CB-CB 3.77Å
121	I	91.9	Very high	89.5	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-58.9	-44.3	174	-66.2	164	0	0	0	110.4	L117 L118 D123 R131 A134 A135 L138 V181 I184	L117-I121 VanDerWaalsContact O-CG1 3.29Å; L117-I121 WeakPolarHBondContact O-CG1 3.3Å; L117-I121 PolarHBondContact O-N 3.2Å; L118-I121 PolarHBondContact O-N 3.42Å; I121-D123 VanDerWaalsContact C-N 3.31Å; I121-D123 PolarHBondContact O-N 3.03Å; I121-R131 VanDerWaalsContact O-CZ 3.27Å; I121-R131 PolarHBondContact O-NE 3.23Å; I121-R131 PolarHBondContact O-NH2 3.09Å; I121-A134 HydrophobicContact CG1-CB 3.83Å; I121-A135 HydrophobicContact CD1-CB 4.08Å; I121-A135 HydrophobicContact CG1-CB 4.13Å; I121-L138 HydrophobicContact CD1-CB 4.3Å; I121-L138 HydrophobicContact CD1-CD2 3.77Å; I121-V181 HydrophobicContact CG2-CG2 3.48Å; I121-V181 VanDerWaalsContact CG2-CG2 3.48Å; I121-I184 HydrophobicContact CD1-CD1 3.77Å
122	R	88.1	Confident	89.7	Confident	121 Å²	121	48.3 Å²	48.3	46%	0.457	27%	0.268	S	S	.	.	H	α-helix	trans	-70.3	-21.2	-178	-74.5	174.7	64.3	-157.3	2	114.8	L118 Q119 A120 A124 E164 S168	L118-R122 VanDerWaalsContact O-CG 3.29Å; L118-R122 WeakPolarHBondContact O-CG 3.39Å; L118-R122 PolarHBondContact O-N 3.25Å; L118-R122 VanDerWaalsContact O-N 3.1Å; Q119-R122 PolarHBondContact O-N 3.34Å; A120-R122 VanDerWaalsContact C-N 3.31Å; A120-R122 PolarHBondContact O-N 3.42Å; R122-A124 PolarHBondContact O-N 3.44Å; R122-E164 IonicContact CZ-OE1 3.53Å; R122-E164 IonicContact CZ-OE2 3.55Å; R122-E164 IonicContact NE-OE2 3.92Å; R122-E164 IonicContact NH1-OE1 2.73Å; R122-E164 PolarHBondContact NH1-OE1 3.29Å; R122-E164 IonicContact NH1-OE2 2.69Å; R122-E164 PolarHBondContact NH1-OE2 2.92Å; R122-E164 IonicContact NH2-OE1 3.87Å; R122-S168 WeakPolarHBondContact CG-OG 3.29Å
123	D	89	Confident	89.8	Confident	43 Å²	43	47.1 Å²	47.1	23%	0.23	26%	0.261	C	S	.	.			trans	-77.9	90.5	-175.5	-165.7	-19.3	0	0	0	111.5	Y84 Q119 A120 I121 S125 A126 R131	Y84-D123 VanDerWaalsContact CE2-OD2 3.28Å; Y84-D123 WeakPolarHBondContact CE2-OD2 3.39Å; Y84-D123 WeakPolarHBondContact OH-CB 3.49Å; Y84-D123 PolarHBondContact OH-OD2 3.28Å; Q119-D123 PolarHBondContact O-N 3.4Å; Q119-D123 VanDerWaalsContact O-N 3.17Å; A120-D123 PolarHBondContact O-N 3.01Å; I121-D123 VanDerWaalsContact C-N 3.31Å; I121-D123 PolarHBondContact O-N 3.03Å; D123-S125 PolarHBondContact O-N 3.27Å; D123-S125 WeakPolarHBondContact OD1-CA 3.21Å; D123-S125 WeakPolarHBondContact OD1-CB 3.44Å; D123-S125 PolarHBondContact OD1-N 3.03Å; D123-S125 PolarHBondContact OD1-OG 3.11Å; D123-A126 HydrophobicContact CB-CB 4.14Å; D123-A126 WeakPolarHBondContact O-CB 3.3Å; D123-A126 PolarHBondContact O-N 3.31Å; D123-A126 PolarHBondContact OD1-N 2.98Å; D123-R131 WeakPolarHBondContact O-CD 3.23Å
124	A	83.4	Confident	90	Very high	89 Å²	89	46.1 Å²	46.1	74%	0.736	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-2.1	175.4	0	0	0	0	0	114.4	R122	R122-A124 PolarHBondContact O-N 3.44Å
125	S	86.3	Confident	90	Very high	107 Å²	107	46 Å²	46	75%	0.748	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-10.2	170.3	76.8	0	0	0	0	113.8	D123	D123-S125 PolarHBondContact O-N 3.27Å; D123-S125 WeakPolarHBondContact OD1-CA 3.21Å; D123-S125 WeakPolarHBondContact OD1-CB 3.44Å; D123-S125 PolarHBondContact OD1-N 3.03Å; D123-S125 PolarHBondContact OD1-OG 3.11Å
126	A	88.1	Confident	90.1	Very high	21 Å²	21	44.3 Å²	44.3	17%	0.174	25%	0.245	C	C	.	.	S	Bend	trans	-74.5	155.8	170.7	0	0	0	0	0	111.6	D123 R131	D123-A126 HydrophobicContact CB-CB 4.14Å; D123-A126 WeakPolarHBondContact O-CB 3.3Å; D123-A126 PolarHBondContact O-N 3.31Å; D123-A126 PolarHBondContact OD1-N 2.98Å; A126-R131 HydrophobicContact CB-CG 4.12Å
127	A	89.6	Confident	90	Very high	53 Å²	53	43.7 Å²	43.7	44%	0.438	24%	0.244	S	C	.	.			trans	-61.8	142	176	0	0	0	0	0	111	E129 V130 R131	A127-E129 VanDerWaalsContact C-N 3.25Å; A127-E129 WeakPolarHBondContact CB-OE2 3.23Å; A127-E129 PolarHBondContact O-N 3.24Å; A127-V130 HydrophobicContact CB-CB 4.49Å; A127-V130 HydrophobicContact CB-CG2 4.2Å; A127-V130 WeakPolarHBondContact O-CB 3.39Å; A127-V130 PolarHBondContact O-N 3.37Å; A127-V130 VanDerWaalsContact O-N 3.09Å; A127-R131 WeakPolarHBondContact O-CG 3.43Å; A127-R131 PolarHBondContact O-N 2.96Å; A127-R131 VanDerWaalsContact O-N 3.11Å
128	E	89.5	Confident	89.9	Confident	78 Å²	78	43.9 Å²	43.9	36%	0.364	25%	0.245	S	C	.	.	H	α-helix	trans	-63.4	-34.7	-172.9	-172.3	167.8	177.8	0	0	111.7	V130 R131 Q132 S174 I177	E128-V130 VanDerWaalsContact C-N 3.34Å; E128-V130 PolarHBondContact O-N 3.31Å; E128-R131 CarbonylContact O-C 3.55Å; E128-R131 WeakPolarHBondContact O-CB 3.48Å; E128-R131 PolarHBondContact O-N 2.79Å; E128-R131 VanDerWaalsContact O-N 3.16Å; E128-Q132 HydrophobicContact CG-CG 4.46Å; E128-Q132 WeakPolarHBondContact O-CG 3.36Å; E128-Q132 PolarHBondContact O-N 3.45Å; E128-S174 WeakPolarHBondContact OE1-CB 3.38Å; E128-S174 PolarHBondContact OE1-OG 3Å; E128-I177 HydrophobicContact CG-CD1 4.11Å; E128-I177 HydrophobicContact CG-CG1 4.14Å
129	E	89.4	Confident	89.8	Confident	115 Å²	115	45 Å²	45	54%	0.537	25%	0.248	S	C	.	.	H	α-helix	trans	-61.3	-41.4	175.6	-54.2	80.7	179.9	0	0	111.4	M91 A127 R131 Q132 M133	M91-E129 HydrophobicContact CE-CB 4.05Å; M91-E129 HydrophobicContact SD-CB 4.04Å; A127-E129 VanDerWaalsContact C-N 3.25Å; A127-E129 WeakPolarHBondContact CB-OE2 3.23Å; A127-E129 PolarHBondContact O-N 3.24Å; E129-R131 VanDerWaalsContact C-N 3.35Å; E129-Q132 PolarHBondContact O-N 3.11Å; E129-M133 WeakPolarHBondContact O-CB 3.44Å; E129-M133 PolarHBondContact O-N 2.68Å
130	V	91.1	Very high	89.6	Confident	17 Å²	17	45.7 Å²	45.7	10%	0.103	25%	0.247	C	C	.	.	H	α-helix	trans	-66.3	-38.7	175.8	173.3	0	0	0	0	110.8	L87 M91 A127 E128 A134	L87-V130 HydrophobicContact CB-CG1 3.9Å; L87-V130 HydrophobicContact CD1-CG1 3.75Å; M91-V130 HydrophobicContact CE-CB 4.48Å; M91-V130 HydrophobicContact CE-CG2 3.75Å; A127-V130 HydrophobicContact CB-CB 4.49Å; A127-V130 HydrophobicContact CB-CG2 4.2Å; A127-V130 WeakPolarHBondContact O-CB 3.39Å; A127-V130 PolarHBondContact O-N 3.37Å; A127-V130 VanDerWaalsContact O-N 3.09Å; E128-V130 VanDerWaalsContact C-N 3.34Å; E128-V130 PolarHBondContact O-N 3.31Å; V130-A134 WeakPolarHBondContact O-CB 3.25Å; V130-A134 PolarHBondContact O-N 3.05Å
131	R	93.7	Very high	89.4	Confident	21 Å²	21	46.4 Å²	46.4	8%	0.079	25%	0.251	C	S	.	.	H	α-helix	trans	-68.3	-38.6	175.7	-59.1	176.1	73.2	-137.8	-2.2	111.7	I121 D123 A126 A127 E128 E129 A135 E172 I177	I121-R131 VanDerWaalsContact O-CZ 3.27Å; I121-R131 PolarHBondContact O-NE 3.23Å; I121-R131 PolarHBondContact O-NH2 3.09Å; D123-R131 WeakPolarHBondContact O-CD 3.23Å; A126-R131 HydrophobicContact CB-CG 4.12Å; A127-R131 WeakPolarHBondContact O-CG 3.43Å; A127-R131 PolarHBondContact O-N 2.96Å; A127-R131 VanDerWaalsContact O-N 3.11Å; E128-R131 CarbonylContact O-C 3.55Å; E128-R131 WeakPolarHBondContact O-CB 3.48Å; E128-R131 PolarHBondContact O-N 2.79Å; E128-R131 VanDerWaalsContact O-N 3.16Å; E129-R131 VanDerWaalsContact C-N 3.35Å; R131-A135 WeakPolarHBondContact O-CB 3.32Å; R131-A135 PolarHBondContact O-N 2.64Å; R131-E172 IonicContact CZ-OE2 3.45Å; R131-E172 IonicContact NH1-OE1 3.28Å; R131-E172 PolarHBondContact NH1-OE1 3.23Å; R131-E172 IonicContact NH1-OE2 3.4Å; R131-E172 PolarHBondContact NH1-OE2 3.21Å; R131-E172 IonicContact NH2-OE1 3.87Å; R131-E172 IonicContact NH2-OE2 2.66Å; R131-E172 PolarHBondContact NH2-OE2 2.97Å; R131-I177 HydrophobicContact CB-CD1 3.64Å
132	Q	89.8	Confident	89.2	Confident	63 Å²	63	46.7 Å²	46.7	29%	0.294	25%	0.253	S	S	.	.	H	α-helix	trans	-64.8	-48	174.6	-72.8	-179.1	21.8	0	0	111.3	E128 E129 A134 A135 V136 I177 K180	E128-Q132 HydrophobicContact CG-CG 4.46Å; E128-Q132 WeakPolarHBondContact O-CG 3.36Å; E128-Q132 PolarHBondContact O-N 3.45Å; E129-Q132 PolarHBondContact O-N 3.11Å; Q132-A134 PolarHBondContact O-N 3.36Å; Q132-A135 PolarHBondContact O-N 2.92Å; Q132-V136 WeakPolarHBondContact O-CG2 3.47Å; Q132-V136 PolarHBondContact O-N 2.91Å; Q132-I177 HydrophobicContact CB-CD1 4.31Å; Q132-I177 HydrophobicContact CG-CD1 3.48Å; Q132-I177 VanDerWaalsContact CG-CD1 3.48Å; Q132-K180 HydrophobicContact CB-CD 4.42Å; Q132-K180 HydrophobicContact CG-CD 4.5Å
133	M	90.3	Very high	89	Confident	50 Å²	50	42.7 Å²	42.7	25%	0.246	24%	0.243	C	C	.	.	H	α-helix	trans	-59.5	-45.9	176.2	179.7	56	75.1	0	0	111.3	L87 M91 E129 A135 V136 L137	L87-M133 HydrophobicContact CD2-CG 4.21Å; M91-M133 HydrophobicContact CE-CB 4.47Å; M91-M133 HydrophobicContact CG-CE 3.56Å; M91-M133 HydrophobicContact CG-CG 4.43Å; M91-M133 HydrophobicContact SD-CB 3.92Å; M91-M133 HydrophobicContact SD-CE 4.21Å; M91-M133 HydrophobicContact SD-CG 4.44Å; E129-M133 WeakPolarHBondContact O-CB 3.44Å; E129-M133 PolarHBondContact O-N 2.68Å; M133-A135 VanDerWaalsContact C-N 3.28Å; M133-A135 PolarHBondContact O-N 3.08Å; M133-V136 PolarHBondContact O-N 3.15Å; M133-L137 HydrophobicContact CG-CD1 3.87Å; M133-L137 HydrophobicContact CG-CG 4.41Å; M133-L137 WeakPolarHBondContact O-CB 3.44Å; M133-L137 WeakPolarHBondContact O-CG 3.1Å; M133-L137 PolarHBondContact O-N 3.46Å; M133-L137 HydrophobicContact SD-CD1 3.84Å; M133-L137 HydrophobicContact SD-CD2 4.45Å; M133-L137 HydrophobicContact SD-CG 3.88Å
134	A	93.7	Very high	88.6	Confident	0 Å²	0	45 Å²	45	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-59.6	-37.9	175.8	0	0	0	0	0	112.9	L87 L117 A120 I121 V130 Q132 L138	L87-A134 HydrophobicContact CD1-CB 3.96Å; L117-A134 HydrophobicContact CD2-CB 4.08Å; A120-A134 HydrophobicContact CB-CB 3.77Å; I121-A134 HydrophobicContact CG1-CB 3.83Å; V130-A134 WeakPolarHBondContact O-CB 3.25Å; V130-A134 PolarHBondContact O-N 3.05Å; Q132-A134 PolarHBondContact O-N 3.36Å; A134-L138 WeakPolarHBondContact O-CB 3.45Å; A134-L138 PolarHBondContact O-N 3.38Å
135	A	91.2	Very high	88.6	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.008	24%	0.238	C	C	.	.	H	α-helix	trans	-68.7	-43.8	177.5	0	0	0	0	0	112.7	I121 R131 Q132 M133 L138 R139 K180 I184	I121-A135 HydrophobicContact CD1-CB 4.08Å; I121-A135 HydrophobicContact CG1-CB 4.13Å; R131-A135 WeakPolarHBondContact O-CB 3.32Å; R131-A135 PolarHBondContact O-N 2.64Å; Q132-A135 PolarHBondContact O-N 2.92Å; M133-A135 VanDerWaalsContact C-N 3.28Å; M133-A135 PolarHBondContact O-N 3.08Å; A135-L138 PolarHBondContact O-N 3.01Å; A135-R139 PolarHBondContact O-N 2.84Å; A135-K180 HydrophobicContact CB-CB 3.71Å; A135-K180 HydrophobicContact CB-CD 4.44Å; A135-I184 HydrophobicContact CB-CD1 3.98Å; A135-I184 WeakPolarHBondContact O-CD1 3.33Å
136	V	87.7	Confident	88.7	Confident	26 Å²	26	37.9 Å²	37.9	16%	0.158	21%	0.206	C	C	.	.	H	α-helix	trans	-61.9	-48	175.5	173.5	0	0	0	0	110.9	Q132 M133 L138 R139 R140 K180	Q132-V136 WeakPolarHBondContact O-CG2 3.47Å; Q132-V136 PolarHBondContact O-N 2.91Å; M133-V136 PolarHBondContact O-N 3.15Å; V136-L138 VanDerWaalsContact C-N 3.34Å; V136-L138 PolarHBondContact O-N 3.11Å; V136-R139 PolarHBondContact O-N 3.26Å; V136-R140 PolarHBondContact O-N 3.07Å; V136-K180 HydrophobicContact CG2-CD 4.02Å; V136-K180 VanDerWaalsContact CG2-NZ 3.31Å
137	L	89.7	Confident	88.6	Confident	21 Å²	21	43.6 Å²	43.6	11%	0.11	23%	0.228	C	C	.	.	H	α-helix	trans	-63.3	-37.6	179.5	-71.3	173.3	0	0	0	112.6	L87 L90 Y105 L117 M133 L141	L87-L137 HydrophobicContact CD2-CD1 3.65Å; L90-L137 HydrophobicContact CD1-CD1 3.76Å; Y105-L137 HydrophobicContact CE1-CD2 4.19Å; Y105-L137 HydrophobicContact CE2-CD1 4.18Å; L117-L137 HydrophobicContact CD1-CB 4.28Å; L117-L137 HydrophobicContact CD2-CB 3.81Å; L117-L137 HydrophobicContact CD2-CD1 4.23Å; M133-L137 HydrophobicContact CG-CD1 3.87Å; M133-L137 HydrophobicContact CG-CG 4.41Å; M133-L137 WeakPolarHBondContact O-CB 3.44Å; M133-L137 WeakPolarHBondContact O-CG 3.1Å; M133-L137 PolarHBondContact O-N 3.46Å; M133-L137 HydrophobicContact SD-CD1 3.84Å; M133-L137 HydrophobicContact SD-CD2 4.45Å; M133-L137 HydrophobicContact SD-CG 3.88Å; L137-L141 VanDerWaalsContact O-CB 3.27Å; L137-L141 WeakPolarHBondContact O-CB 3.42Å; L137-L141 PolarHBondContact O-N 3.08Å
138	L	92.6	Very high	88.4	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.021	24%	0.243	C	C	.	.	H	α-helix	trans	-69.7	-38.2	176.6	-175.6	54.7	0	0	0	112	I114 L117 L118 I121 A134 A135 V136 L142 I184	I114-L138 HydrophobicContact CB-CD1 4.34Å; I114-L138 HydrophobicContact CG1-CD1 4.09Å; I114-L138 HydrophobicContact CG2-CD1 4.32Å; L117-L138 HydrophobicContact CB-CB 4.01Å; L117-L138 HydrophobicContact CB-CD1 4.36Å; L117-L138 HydrophobicContact CB-CD2 4.36Å; L117-L138 HydrophobicContact CB-CG 4.48Å; L117-L138 HydrophobicContact CD1-CB 4.08Å; L117-L138 HydrophobicContact CD1-CD1 4.24Å; L118-L138 HydrophobicContact CB-CD2 4.18Å; L118-L138 HydrophobicContact CD1-CD2 4.38Å; I121-L138 HydrophobicContact CD1-CB 4.3Å; I121-L138 HydrophobicContact CD1-CD2 3.77Å; A134-L138 WeakPolarHBondContact O-CB 3.45Å; A134-L138 PolarHBondContact O-N 3.38Å; A135-L138 PolarHBondContact O-N 3.01Å; V136-L138 VanDerWaalsContact C-N 3.34Å; V136-L138 PolarHBondContact O-N 3.11Å; L138-L142 WeakPolarHBondContact O-CG 3.41Å; L138-L142 PolarHBondContact O-N 2.69Å; L138-I184 HydrophobicContact CB-CD1 4.08Å; L138-I184 HydrophobicContact CD2-CD1 4.19Å; L138-I184 HydrophobicContact CD2-CG2 4.04Å; L138-I184 HydrophobicContact CG-CD1 4.28Å; L138-I184 HydrophobicContact CG-CG2 3.98Å
139	R	89.1	Confident	88.4	Confident	26 Å²	26	45.2 Å²	45.2	10%	0.098	23%	0.227	C	C	.	.	H	α-helix	trans	-60.1	-55.3	173.4	-166.9	-167.2	66.7	67.3	13.6	110	A135 V136 L141 L142 S143 D183 I184 E187 D716	A135-R139 PolarHBondContact O-N 2.84Å; V136-R139 PolarHBondContact O-N 3.26Å; R139-L141 VanDerWaalsContact C-N 3.31Å; R139-L141 PolarHBondContact O-N 3.41Å; R139-L142 PolarHBondContact O-N 3.1Å; R139-L142 VanDerWaalsContact O-N 3.07Å; R139-S143 PolarHBondContact NH1-OG 2.99Å; R139-S143 PolarHBondContact O-N 3.02Å; R139-S143 PolarHBondContact O-OG 3.14Å; R139-S143 VanDerWaalsContact O-OG 3.05Å; R139-D183 HydrophobicContact CG-CB 4.4Å; R139-I184 HydrophobicContact CB-CG1 3.89Å; R139-E187 HydrophobicContact CG-CB 4.5Å; R139-D716 IonicContact CZ-OD2 2.63Å; R139-D716 VanDerWaalsContact CZ-OD2 3.31Å; R139-D716 IonicContact NE-OD2 2.64Å; R139-D716 VanDerWaalsContact NH2-CB 3.28Å; R139-D716 IonicContact NH2-OD2 3.38Å; R139-D716 PolarHBondContact NH2-OD2 3.35Å
140	R	84.9	Confident	88.4	Confident	103 Å²	103	40.1 Å²	40.1	39%	0.389	20%	0.203	S	C	.	.	H	α-helix	trans	-54.9	-43.2	178.7	-71.9	-174.8	-179.3	173.7	4.5	112.5	V136 L142 S143 S144 D719	V136-R140 PolarHBondContact O-N 3.07Å; R140-L142 VanDerWaalsContact C-N 3.3Å; R140-L142 PolarHBondContact O-N 3.24Å; R140-S143 PolarHBondContact O-N 3.08Å; R140-S144 WeakPolarHBondContact O-CB 3.46Å; R140-S144 PolarHBondContact O-N 2.96Å; R140-S144 PolarHBondContact O-OG 2.84Å; R140-S144 VanDerWaalsContact O-OG 3.09Å; R140-D719 IonicContact CZ-OD2 3.87Å; R140-D719 IonicContact NE-OD2 3.54Å; R140-D719 IonicContact NH2-OD1 3.31Å; R140-D719 PolarHBondContact NH2-OD1 3.33Å; R140-D719 IonicContact NH2-OD2 2.71Å; R140-D719 PolarHBondContact NH2-OD2 2.98Å
141	L	88.1	Confident	88.3	Confident	14 Å²	14	42.6 Å²	42.6	7%	0.073	22%	0.22	C	C	.	.	H	α-helix	trans	-62.2	-35.1	179	-173.4	68.1	0	0	0	113.2	K113 I114 L117 L137 R139 S145 I149	K113-L141 HydrophobicContact CB-CD2 3.55Å; K113-L141 HydrophobicContact CD-CD1 4.07Å; K113-L141 HydrophobicContact CD-CD2 4.29Å; I114-L141 HydrophobicContact CG1-CD2 3.69Å; L117-L141 HydrophobicContact CD1-CD2 4.17Å; L137-L141 VanDerWaalsContact O-CB 3.27Å; L137-L141 WeakPolarHBondContact O-CB 3.42Å; L137-L141 PolarHBondContact O-N 3.08Å; R139-L141 VanDerWaalsContact C-N 3.31Å; R139-L141 PolarHBondContact O-N 3.41Å; L141-S145 PolarHBondContact O-N 3.12Å; L141-I149 HydrophobicContact CD1-CD1 3.46Å; L141-I149 VanDerWaalsContact CD1-CD1 3.46Å; L141-I149 HydrophobicContact CD2-CD1 4.28Å; L141-I149 HydrophobicContact CG-CD1 3.77Å
142	L	88.6	Confident	88	Confident	8 Å²	8	43.7 Å²	43.7	4%	0.042	24%	0.237	C	C	.	.	H	α-helix	trans	-73.8	-44.8	173.1	-65.4	176	0	0	0	110.7	I114 L138 R139 R140 S144 F146 I184 E187 L188	I114-L142 HydrophobicContact CD1-CD2 4.24Å; L138-L142 WeakPolarHBondContact O-CG 3.41Å; L138-L142 PolarHBondContact O-N 2.69Å; R139-L142 PolarHBondContact O-N 3.1Å; R139-L142 VanDerWaalsContact O-N 3.07Å; R140-L142 VanDerWaalsContact C-N 3.3Å; R140-L142 PolarHBondContact O-N 3.24Å; L142-S144 VanDerWaalsContact C-N 3.33Å; L142-S144 PolarHBondContact O-N 3.48Å; L142-F146 HydrophobicContact CD2-CD2 4.45Å; L142-F146 WeakPolarHBondContact O-CB 3.37Å; L142-F146 PolarHBondContact O-N 3.36Å; L142-I184 HydrophobicContact CD1-CG2 3.83Å; L142-E187 HydrophobicContact CB-CG 3.77Å; L142-L188 HydrophobicContact CD1-CB 3.99Å; L142-L188 HydrophobicContact CD2-CD1 4.45Å
143	S	83.6	Confident	87.9	Confident	36 Å²	36	41.3 Å²	41.3	25%	0.252	23%	0.227	S	C	.	.	H	α-helix	trans	-59.8	-38.4	177.9	-46.2	0	0	0	0	113.2	R139 R140 E187	R139-S143 PolarHBondContact NH1-OG 2.99Å; R139-S143 PolarHBondContact O-N 3.02Å; R139-S143 PolarHBondContact O-OG 3.14Å; R139-S143 VanDerWaalsContact O-OG 3.05Å; R140-S143 PolarHBondContact O-N 3.08Å; S143-E187 WeakPolarHBondContact CB-OE2 3.3Å; S143-E187 VanDerWaalsContact OG-CD 3.23Å; S143-E187 PolarHBondContact OG-OE2 3.43Å
144	S	79.9	Confident	88	Confident	91 Å²	91	42.8 Å²	42.8	64%	0.636	24%	0.239	S	C	*	.	H	α-helix	trans	-95.6	-22	-172	70	0	0	0	0	115.4	R140 L142	R140-S144 WeakPolarHBondContact O-CB 3.46Å; R140-S144 PolarHBondContact O-N 2.96Å; R140-S144 PolarHBondContact O-OG 2.84Å; R140-S144 VanDerWaalsContact O-OG 3.09Å; L142-S144 VanDerWaalsContact C-N 3.33Å; L142-S144 PolarHBondContact O-N 3.48Å
145	S	84.3	Confident	87.7	Confident	32 Å²	32	49 Å²	49	22%	0.224	27%	0.271	C	S	.	.	H	α-helix	trans	-148.7	25.6	-161.3	-51	0	0	0	0	113.5	L141 I149	L141-S145 PolarHBondContact O-N 3.12Å; S145-I149 WeakPolarHBondContact O-CB 3.34Å; S145-I149 WeakPolarHBondContact O-CD1 3.43Å; S145-I149 VanDerWaalsContact O-CG1 3.27Å; S145-I149 WeakPolarHBondContact O-CG1 3.43Å; S145-I149 PolarHBondContact O-N 3.09Å
146	F	88.2	Confident	87.7	Confident	16 Å²	16	52.4 Å²	52.4	7%	0.07	30%	0.3	C	S	.	.	H	α-helix	trans	-54.7	-54.8	179.4	179.2	-95	0	0	0	112.6	L142 E148 I149 Y150 P151 L188 N191 L192	L142-F146 HydrophobicContact CD2-CD2 4.45Å; L142-F146 WeakPolarHBondContact O-CB 3.37Å; L142-F146 PolarHBondContact O-N 3.36Å; F146-E148 VanDerWaalsContact C-N 3.34Å; F146-E148 PolarHBondContact O-N 2.81Å; F146-I149 PolarHBondContact O-N 3.25Å; F146-I149 VanDerWaalsContact O-N 3.11Å; F146-Y150 HydrophobicContact CD2-CG 4.08Å; F146-Y150 VanDerWaalsContact CE2-CB 3.49Å; F146-Y150 AromaticContact CE2-CD1 3.5Å; F146-Y150 HydrophobicContact CE2-CD1 3.5Å; F146-Y150 HydrophobicContact CE2-CD2 4.11Å; F146-Y150 HydrophobicContact CE2-CE1 4.22Å; F146-Y150 AromaticContact CE2-CG 3.43Å; F146-Y150 HydrophobicContact CE2-CG 3.43Å; F146-Y150 VanDerWaalsContact CE2-CG 3.43Å; F146-Y150 AromaticContact CZ-CD1 3.5Å; F146-Y150 HydrophobicContact CZ-CD1 3.5Å; F146-Y150 HydrophobicContact CZ-CE1 4.2Å; F146-Y150 AromaticContact CZ-CG 3.9Å; F146-Y150 HydrophobicContact CZ-CG 3.9Å; F146-Y150 PolarHBondContact O-N 3.29Å; F146-P151 WeakPolarHBondContact O-CD 3.37Å; F146-L188 HydrophobicContact CE2-CD1 4.02Å; F146-N191 HydrophobicContact CB-CB 4.23Å; F146-N191 HydrophobicContact CD1-CB 3.67Å; F146-N191 HydrophobicContact CD2-CB 3.44Å; F146-N191 VanDerWaalsContact CD2-CB 3.44Å; F146-N191 HydrophobicContact CE1-CB 3.78Å; F146-N191 VanDerWaalsContact CE1-O 3.22Å; F146-N191 WeakPolarHBondContact CE1-O 3.43Å; F146-N191 HydrophobicContact CE2-CB 3.55Å; F146-N191 HydrophobicContact CG-CB 3.5Å; F146-N191 VanDerWaalsContact CG-CB 3.5Å; F146-N191 HydrophobicContact CZ-CB 3.71Å; F146-N191 WeakPolarHBondContact CZ-O 3.48Å; F146-L192 HydrophobicContact CZ-CD2 4.06Å; F146-L192 HydrophobicContact CZ-CG 4.46Å
147	E	85.2	Confident	87.7	Confident	140 Å²	140	54.5 Å²	54.5	65%	0.654	31%	0.308	S	S	*	.	H	α-helix	trans	-62.2	-34.9	-174.2	-70.5	-55.6	141.4	0	0	113.9	P151	E147-P151 WeakPolarHBondContact O-CD 3.49Å; E147-P151 WeakPolarHBondContact O-CG 3.41Å
148	E	86.6	Confident	87.8	Confident	158 Å²	158	55.2 Å²	55.2	74%	0.738	31%	0.311	S	S	*	.	H	α-helix	trans	-70.1	-39	175.8	-169.2	-164.1	157.5	0	0	111.5	F146	F146-E148 VanDerWaalsContact C-N 3.34Å; F146-E148 PolarHBondContact O-N 2.81Å
149	I	88.6	Confident	87.8	Confident	7 Å²	7	58.1 Å²	58.1	4%	0.036	33%	0.329	C	S	.	.	H	α-helix	trans	-98.6	-55.5	-164.5	-57.2	170.9	0	0	0	112.1	G110 Q111 I114 L141 S145 F146 G152	G110-I149 VanDerWaalsContact C-CG2 3.46Å; Q111-I149 HydrophobicContact CG-CG2 4.37Å; I114-I149 HydrophobicContact CD1-CB 4.43Å; I114-I149 HydrophobicContact CD1-CG2 3.46Å; I114-I149 VanDerWaalsContact CD1-CG2 3.46Å; I114-I149 HydrophobicContact CG1-CG2 4.17Å; L141-I149 HydrophobicContact CD1-CD1 3.46Å; L141-I149 VanDerWaalsContact CD1-CD1 3.46Å; L141-I149 HydrophobicContact CD2-CD1 4.28Å; L141-I149 HydrophobicContact CG-CD1 3.77Å; S145-I149 WeakPolarHBondContact O-CB 3.34Å; S145-I149 WeakPolarHBondContact O-CD1 3.43Å; S145-I149 VanDerWaalsContact O-CG1 3.27Å; S145-I149 WeakPolarHBondContact O-CG1 3.43Å; S145-I149 PolarHBondContact O-N 3.09Å; F146-I149 PolarHBondContact O-N 3.25Å; F146-I149 VanDerWaalsContact O-N 3.11Å; I149-G152 PolarHBondContact O-N 3.41Å
150	Y	90.2	Very high	87.9	Confident	9 Å²	9	58.9 Å²	58.9	4%	0.035	34%	0.341	C	S	.	.	S	Bend	trans	-73.9	-42.6	-165.3	-170.3	-85.4	0	0	0	113.5	F146 G152 L153 Q158 I161 L188 L192	F146-Y150 HydrophobicContact CD2-CG 4.08Å; F146-Y150 VanDerWaalsContact CE2-CB 3.49Å; F146-Y150 AromaticContact CE2-CD1 3.5Å; F146-Y150 HydrophobicContact CE2-CD1 3.5Å; F146-Y150 HydrophobicContact CE2-CD2 4.11Å; F146-Y150 HydrophobicContact CE2-CE1 4.22Å; F146-Y150 AromaticContact CE2-CG 3.43Å; F146-Y150 HydrophobicContact CE2-CG 3.43Å; F146-Y150 VanDerWaalsContact CE2-CG 3.43Å; F146-Y150 AromaticContact CZ-CD1 3.5Å; F146-Y150 HydrophobicContact CZ-CD1 3.5Å; F146-Y150 HydrophobicContact CZ-CE1 4.2Å; F146-Y150 AromaticContact CZ-CG 3.9Å; F146-Y150 HydrophobicContact CZ-CG 3.9Å; F146-Y150 PolarHBondContact O-N 3.29Å; Y150-G152 PolarHBondContact O-N 3.28Å; Y150-L153 HydrophobicContact CD2-CD1 4.05Å; Y150-L153 WeakPolarHBondContact O-CB 3.49Å; Y150-L153 PolarHBondContact O-N 2.95Å; Y150-L153 VanDerWaalsContact O-N 3.13Å; Y150-Q158 HydrophobicContact CD1-CG 4.29Å; Y150-Q158 HydrophobicContact CE1-CB 4.2Å; Y150-Q158 HydrophobicContact CE1-CG 3.73Å; Y150-Q158 HydrophobicContact CE2-CB 4.47Å; Y150-Q158 HydrophobicContact CE2-CG 4.24Å; Y150-Q158 PolarHBondContact O-NE2 3.5Å; Y150-I161 HydrophobicContact CE2-CD1 4.48Å; Y150-L188 HydrophobicContact CD2-CD1 3.99Å; Y150-L188 HydrophobicContact CE2-CD1 3.61Å; Y150-L192 HydrophobicContact CE1-CD2 3.82Å
151	P	89.3	Confident	88.2	Confident	69 Å²	69	54.8 Å²	54.8	45%	0.448	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-29.3	169.8	-25.7	36	0	0	0	113.5	F146 E147 L153	F146-P151 WeakPolarHBondContact O-CD 3.37Å; E147-P151 WeakPolarHBondContact O-CD 3.49Å; E147-P151 WeakPolarHBondContact O-CG 3.41Å; P151-L153 VanDerWaalsContact C-N 3.28Å; P151-L153 PolarHBondContact O-N 3.07Å
152	G	86.1	Confident	88.5	Confident	44 Å²	44	55.6 Å²	55.6	45%	0.454	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-10.5	176.8	0	0	0	0	0	115.2	Q111 I149 Y150	Q111-G152 PolarHBondContact NE2-O 3.08Å; I149-G152 PolarHBondContact O-N 3.41Å; Y150-G152 PolarHBondContact O-N 3.28Å
153	L	89.4	Confident	88.8	Confident	13 Å²	13	59.4 Å²	59.4	7%	0.068	35%	0.353	C	S	.	.	S	Bend	trans	-79.5	153.4	178.1	-60.2	-179	0	0	0	112.2	Q111 I114 Y150 P151 M157 Q158 I161	Q111-L153 HydrophobicContact CB-CD2 3.75Å; Q111-L153 HydrophobicContact CG-CD2 3.76Å; I114-L153 HydrophobicContact CD1-CD1 4.33Å; Y150-L153 HydrophobicContact CD2-CD1 4.05Å; Y150-L153 WeakPolarHBondContact O-CB 3.49Å; Y150-L153 PolarHBondContact O-N 2.95Å; Y150-L153 VanDerWaalsContact O-N 3.13Å; P151-L153 VanDerWaalsContact C-N 3.28Å; P151-L153 PolarHBondContact O-N 3.07Å; L153-M157 HydrophobicContact CB-CB 4.41Å; L153-M157 HydrophobicContact CD2-CE 3.95Å; L153-Q158 HydrophobicContact CB-CG 3.9Å; L153-I161 HydrophobicContact CD1-CD1 3.5Å; L153-I161 VanDerWaalsContact CD1-CD1 3.5Å
154	T	90.6	Very high	89.1	Confident	81 Å²	81	60.7 Å²	60.7	50%	0.497	36%	0.355	S	S	.	.			trans	-68	146	171.3	72.6	0	0	0	0	110.9	A156 M157 Q158	T154-A156 PolarHBondContact O-N 2.71Å; T154-M157 HydrophobicContact CG2-SD 4.12Å; T154-M157 WeakPolarHBondContact O-CA 3.45Å; T154-M157 WeakPolarHBondContact O-CB 3.23Å; T154-M157 PolarHBondContact O-N 3.46Å; T154-M157 VanDerWaalsContact OG1-CG 3.25Å; T154-M157 WeakPolarHBondContact OG1-CG 3.45Å; T154-M157 PolarHBondContact OG1-N 3.35Å; T154-M157 PolarHBondContact OG1-SD 3.34Å; T154-M157 VanDerWaalsContact OG1-SD 3.35Å; T154-Q158 PolarHBondContact O-N 3.36Å
155	L	89	Confident	89.8	Confident	129 Å²	129	56.4 Å²	56.4	68%	0.675	33%	0.325	S	S	*	.	H	α-helix	trans	-54	-31	177.5	-175	64.8	0	0	0	113.1	T159	L155-T159 WeakPolarHBondContact O-CB 3.45Å; L155-T159 PolarHBondContact O-N 3.01Å; L155-T159 PolarHBondContact O-OG1 3.09Å
156	A	90.4	Very high	90.3	Very high	74 Å²	74	55.7 Å²	55.7	61%	0.612	32%	0.319	S	S	*	.	H	α-helix	trans	-67.5	-40.9	174.3	0	0	0	0	0	112.4	T154 A160	T154-A156 PolarHBondContact O-N 2.71Å; A156-A160 WeakPolarHBondContact O-CB 3.17Å; A156-A160 PolarHBondContact O-N 3.37Å
157	M	87.6	Confident	90.5	Very high	70 Å²	70	56.8 Å²	56.8	35%	0.345	33%	0.328	S	S	.	.	H	α-helix	trans	-68.8	-45	175.1	-67.2	162.6	76.2	0	0	111.4	L153 T154 T159 A160 I161	L153-M157 HydrophobicContact CB-CB 4.41Å; L153-M157 HydrophobicContact CD2-CE 3.95Å; T154-M157 HydrophobicContact CG2-SD 4.12Å; T154-M157 WeakPolarHBondContact O-CA 3.45Å; T154-M157 WeakPolarHBondContact O-CB 3.23Å; T154-M157 PolarHBondContact O-N 3.46Å; T154-M157 VanDerWaalsContact OG1-CG 3.25Å; T154-M157 WeakPolarHBondContact OG1-CG 3.45Å; T154-M157 PolarHBondContact OG1-N 3.35Å; T154-M157 PolarHBondContact OG1-SD 3.34Å; T154-M157 VanDerWaalsContact OG1-SD 3.35Å; M157-T159 VanDerWaalsContact C-N 3.32Å; M157-T159 PolarHBondContact O-N 3Å; M157-A160 WeakPolarHBondContact O-CB 3.49Å; M157-A160 PolarHBondContact O-N 3.43Å; M157-A160 VanDerWaalsContact O-N 3.12Å; M157-I161 WeakPolarHBondContact O-CD1 3.3Å; M157-I161 WeakPolarHBondContact O-CG1 3.39Å; M157-I161 PolarHBondContact O-N 2.92Å
158	Q	92.1	Very high	90.9	Very high	35 Å²	35	50.7 Å²	50.7	16%	0.164	30%	0.302	C	S	.	.	H	α-helix	trans	-55.1	-47.6	173.6	-67.6	176.4	-15.3	0	0	111.2	Y150 L153 T154 A160 I161 K162	Y150-Q158 HydrophobicContact CD1-CG 4.29Å; Y150-Q158 HydrophobicContact CE1-CB 4.2Å; Y150-Q158 HydrophobicContact CE1-CG 3.73Å; Y150-Q158 HydrophobicContact CE2-CB 4.47Å; Y150-Q158 HydrophobicContact CE2-CG 4.24Å; Y150-Q158 PolarHBondContact O-NE2 3.5Å; L153-Q158 HydrophobicContact CB-CG 3.9Å; T154-Q158 PolarHBondContact O-N 3.36Å; Q158-A160 VanDerWaalsContact C-N 3.34Å; Q158-A160 PolarHBondContact O-N 2.88Å; Q158-I161 PolarHBondContact O-N 3Å; Q158-K162 WeakPolarHBondContact O-CG 3.5Å; Q158-K162 PolarHBondContact O-N 2.99Å; Q158-K162 VanDerWaalsContact O-N 3.1Å
159	T	92.5	Very high	91.3	Very high	65 Å²	65	43.2 Å²	43.2	40%	0.399	27%	0.266	S	S	.	.	H	α-helix	trans	-63.7	-38.4	176.8	-54.8	0	0	0	0	112.3	L155 M157 T163	L155-T159 WeakPolarHBondContact O-CB 3.45Å; L155-T159 PolarHBondContact O-N 3.01Å; L155-T159 PolarHBondContact O-OG1 3.09Å; M157-T159 VanDerWaalsContact C-N 3.32Å; M157-T159 PolarHBondContact O-N 3Å; T159-T163 WeakPolarHBondContact O-CB 3.34Å; T159-T163 PolarHBondContact O-N 3.31Å; T159-T163 PolarHBondContact O-OG1 3.44Å
160	A	90.1	Very high	91.5	Very high	43 Å²	43	47.9 Å²	47.9	36%	0.355	29%	0.288	S	S	.	.	H	α-helix	trans	-64.6	-49.9	176	0	0	0	0	0	111.7	A156 M157 Q158 K162 T163 E164	A156-A160 WeakPolarHBondContact O-CB 3.17Å; A156-A160 PolarHBondContact O-N 3.37Å; M157-A160 WeakPolarHBondContact O-CB 3.49Å; M157-A160 PolarHBondContact O-N 3.43Å; M157-A160 VanDerWaalsContact O-N 3.12Å; Q158-A160 VanDerWaalsContact C-N 3.34Å; Q158-A160 PolarHBondContact O-N 2.88Å; A160-K162 PolarHBondContact O-N 3.34Å; A160-T163 PolarHBondContact O-N 2.93Å; A160-T163 VanDerWaalsContact O-N 3.11Å; A160-E164 WeakPolarHBondContact O-CB 3.22Å; A160-E164 WeakPolarHBondContact O-CG 3.44Å; A160-E164 PolarHBondContact O-N 3.06Å
161	I	92.3	Very high	91.5	Very high	17 Å²	17	54.8 Å²	54.8	9%	0.087	32%	0.321	C	S	.	.	H	α-helix	trans	-54.8	-50.9	177.8	-68.5	156.2	0	0	0	110.7	I114 L118 Y150 L153 M157 Q158 T163 E164 L165 L188	I114-I161 HydrophobicContact CG2-CD1 3.66Å; I114-I161 HydrophobicContact CG2-CG1 4.1Å; L118-I161 HydrophobicContact CD2-CB 4.41Å; L118-I161 HydrophobicContact CD2-CG1 4.22Å; L118-I161 HydrophobicContact CD2-CG2 4.34Å; Y150-I161 HydrophobicContact CE2-CD1 4.48Å; L153-I161 HydrophobicContact CD1-CD1 3.5Å; L153-I161 VanDerWaalsContact CD1-CD1 3.5Å; M157-I161 WeakPolarHBondContact O-CD1 3.3Å; M157-I161 WeakPolarHBondContact O-CG1 3.39Å; M157-I161 PolarHBondContact O-N 2.92Å; Q158-I161 PolarHBondContact O-N 3Å; I161-T163 VanDerWaalsContact C-N 3.33Å; I161-T163 PolarHBondContact O-N 3.45Å; I161-E164 PolarHBondContact O-N 2.79Å; I161-L165 HydrophobicContact CG2-CD1 3.92Å; I161-L165 WeakPolarHBondContact O-CG 3.46Å; I161-L165 PolarHBondContact O-N 2.74Å; I161-L188 HydrophobicContact CG2-CD2 4.08Å
162	K	94.6	Very high	91.7	Very high	31 Å²	31	52.5 Å²	52.5	14%	0.135	30%	0.304	C	S	.	.	H	α-helix	trans	-55.6	-46	176	-71.2	-167.2	-56.5	171.1	0	112.1	Q158 A160 L166 L188 L192 Q200 W201	Q158-K162 WeakPolarHBondContact O-CG 3.5Å; Q158-K162 PolarHBondContact O-N 2.99Å; Q158-K162 VanDerWaalsContact O-N 3.1Å; A160-K162 PolarHBondContact O-N 3.34Å; K162-L166 WeakPolarHBondContact O-CG 3.5Å; K162-L188 HydrophobicContact CG-CD2 4.11Å; K162-L192 HydrophobicContact CD-CD1 3.85Å; K162-Q200 PolarHBondContact NZ-O 2.91Å; K162-W201 HydrophobicContact CB-CD2 4.45Å; K162-W201 HydrophobicContact CB-CZ2 3.91Å; K162-W201 HydrophobicContact CD-CB 4.15Å; K162-W201 HydrophobicContact CD-CD2 3.84Å; K162-W201 HydrophobicContact CD-CG 3.64Å; K162-W201 HydrophobicContact CG-CD2 4.08Å; K162-W201 HydrophobicContact CG-CG 4.37Å; K162-W201 HydrophobicContact CG-CZ2 4.18Å; K162-W201 WeakPolarHBondContact O-CZ2 3.41Å
163	T	93.7	Very high	91.8	Very high	87 Å²	87	54.4 Å²	54.4	53%	0.534	32%	0.316	S	S	.	.	H	α-helix	trans	-68.3	-40.5	-179.8	-54.5	0	0	0	0	112.2	T159 A160 I161 S167	T159-T163 WeakPolarHBondContact O-CB 3.34Å; T159-T163 PolarHBondContact O-N 3.31Å; T159-T163 PolarHBondContact O-OG1 3.44Å; A160-T163 PolarHBondContact O-N 2.93Å; A160-T163 VanDerWaalsContact O-N 3.11Å; I161-T163 VanDerWaalsContact C-N 3.33Å; I161-T163 PolarHBondContact O-N 3.45Å; T163-S167 WeakPolarHBondContact O-CB 3.42Å; T163-S167 PolarHBondContact O-N 2.8Å; T163-S167 VanDerWaalsContact O-N 3.1Å
164	E	91.2	Very high	91.8	Very high	63 Å²	63	54.7 Å²	54.7	29%	0.294	32%	0.319	S	S	.	.	H	α-helix	trans	-73.4	-34.9	-176.6	-73.4	-165.8	167	0	0	113	L118 R122 A160 I161 S167 S168	L118-E164 HydrophobicContact CD2-CB 4.03Å; R122-E164 IonicContact CZ-OE1 3.53Å; R122-E164 IonicContact CZ-OE2 3.55Å; R122-E164 IonicContact NE-OE2 3.92Å; R122-E164 IonicContact NH1-OE1 2.73Å; R122-E164 PolarHBondContact NH1-OE1 3.29Å; R122-E164 IonicContact NH1-OE2 2.69Å; R122-E164 PolarHBondContact NH1-OE2 2.92Å; R122-E164 IonicContact NH2-OE1 3.87Å; A160-E164 WeakPolarHBondContact O-CB 3.22Å; A160-E164 WeakPolarHBondContact O-CG 3.44Å; A160-E164 PolarHBondContact O-N 3.06Å; I161-E164 PolarHBondContact O-N 2.79Å; E164-S167 PolarHBondContact O-N 3.12Å; E164-S168 WeakPolarHBondContact O-CB 3.38Å; E164-S168 PolarHBondContact O-N 2.77Å; E164-S168 PolarHBondContact O-OG 3.35Å
165	L	93.9	Very high	91.8	Very high	2 Å²	2	54.2 Å²	54.2	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-60.2	-51.5	173.4	-77.5	167.5	0	0	0	111.4	L118 I161 S167 S168 I169 V181 I184 L188 W201	L118-L165 HydrophobicContact CD1-CD2 3.66Å; L118-L165 HydrophobicContact CD1-CG 4.04Å; I161-L165 HydrophobicContact CG2-CD1 3.92Å; I161-L165 WeakPolarHBondContact O-CG 3.46Å; I161-L165 PolarHBondContact O-N 2.74Å; L165-S167 VanDerWaalsContact C-N 3.33Å; L165-S167 PolarHBondContact O-N 3.44Å; L165-S168 WeakPolarHBondContact O-CB 3.35Å; L165-S168 PolarHBondContact O-N 3.38Å; L165-S168 VanDerWaalsContact O-N 3.12Å; L165-I169 WeakPolarHBondContact O-CG1 3.5Å; L165-I169 PolarHBondContact O-N 3.07Å; L165-I169 VanDerWaalsContact O-N 3.07Å; L165-V181 HydrophobicContact CD2-CG1 4.09Å; L165-I184 HydrophobicContact CD1-CG2 4.16Å; L165-I184 HydrophobicContact CD2-CB 4.34Å; L165-I184 HydrophobicContact CD2-CG2 3.66Å; L165-L188 HydrophobicContact CD1-CD2 3.46Å; L165-L188 VanDerWaalsContact CD1-CD2 3.46Å; L165-W201 HydrophobicContact CD1-CH2 4.48Å
166	L	95.3	Very high	91.7	Very high	17 Å²	17	52.6 Å²	52.6	9%	0.089	31%	0.309	C	S	.	.	H	α-helix	trans	-62.3	-41.3	178.3	-55.6	177.5	0	0	0	111.7	K162 S168 I169 Q170 W201 E203 V204 F207	K162-L166 WeakPolarHBondContact O-CG 3.5Å; L166-S168 VanDerWaalsContact C-N 3.3Å; L166-S168 PolarHBondContact O-N 3.23Å; L166-I169 PolarHBondContact O-N 3.17Å; L166-Q170 WeakPolarHBondContact O-CG 3.28Å; L166-Q170 PolarHBondContact O-N 2.95Å; L166-W201 HydrophobicContact CD1-CZ2 3.92Å; L166-W201 HydrophobicContact CD2-CH2 4.18Å; L166-W201 HydrophobicContact CD2-CZ2 3.77Å; L166-W201 HydrophobicContact CG-CZ2 3.73Å; L166-E203 HydrophobicContact CD1-CB 4.26Å; L166-V204 HydrophobicContact CD2-CG2 4.07Å; L166-F207 HydrophobicContact CB-CD2 4.33Å; L166-F207 HydrophobicContact CD1-CB 4.12Å; L166-F207 HydrophobicContact CD2-CB 4.11Å; L166-F207 HydrophobicContact CD2-CD1 3.87Å; L166-F207 HydrophobicContact CD2-CD2 4.4Å; L166-F207 HydrophobicContact CD2-CE1 4.46Å; L166-F207 HydrophobicContact CD2-CG 3.84Å
167	S	92.9	Very high	91.8	Very high	38 Å²	38	49.1 Å²	49.1	27%	0.266	28%	0.28	S	S	.	.	H	α-helix	trans	-62.8	-35.7	175.5	-171.5	0	0	0	0	112.6	T163 E164 L165 Q170 Q171	T163-S167 WeakPolarHBondContact O-CB 3.42Å; T163-S167 PolarHBondContact O-N 2.8Å; T163-S167 VanDerWaalsContact O-N 3.1Å; E164-S167 PolarHBondContact O-N 3.12Å; L165-S167 VanDerWaalsContact C-N 3.33Å; L165-S167 PolarHBondContact O-N 3.44Å; S167-Q170 PolarHBondContact O-N 3.31Å; S167-Q171 WeakPolarHBondContact O-CB 3.48Å; S167-Q171 WeakPolarHBondContact O-CG 3.35Å; S167-Q171 PolarHBondContact O-N 3.06Å; S167-Q171 VanDerWaalsContact O-N 3.11Å; S167-Q171 PolarHBondContact OG-NE2 2.97Å
168	S	92.3	Very high	92.1	Very high	13 Å²	13	46.9 Å²	46.9	9%	0.091	27%	0.268	C	S	.	.	H	α-helix	trans	-66.7	-45.9	176.8	-57.6	0	0	0	0	110.9	R122 E164 L165 L166 Q170 Q171 E172	R122-S168 WeakPolarHBondContact CG-OG 3.29Å; E164-S168 WeakPolarHBondContact O-CB 3.38Å; E164-S168 PolarHBondContact O-N 2.77Å; E164-S168 PolarHBondContact O-OG 3.35Å; L165-S168 WeakPolarHBondContact O-CB 3.35Å; L165-S168 PolarHBondContact O-N 3.38Å; L165-S168 VanDerWaalsContact O-N 3.12Å; L166-S168 VanDerWaalsContact C-N 3.3Å; L166-S168 PolarHBondContact O-N 3.23Å; S168-Q170 VanDerWaalsContact C-N 3.26Å; S168-Q170 PolarHBondContact O-N 3.15Å; S168-Q171 PolarHBondContact O-N 3.5Å; S168-E172 WeakPolarHBondContact O-CB 3.24Å; S168-E172 PolarHBondContact O-N 2.86Å
169	I	94.7	Very high	92	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-60	-37.8	174.9	-60.1	168.7	0	0	0	111.2	L165 L166 R178 V181 A185 F207 A222 I226	L165-I169 WeakPolarHBondContact O-CG1 3.5Å; L165-I169 PolarHBondContact O-N 3.07Å; L165-I169 VanDerWaalsContact O-N 3.07Å; L166-I169 PolarHBondContact O-N 3.17Å; I169-R178 HydrophobicContact CG2-CG 4.24Å; I169-V181 HydrophobicContact CD1-CG1 4.23Å; I169-V181 HydrophobicContact CG1-CB 4.14Å; I169-V181 HydrophobicContact CG1-CG1 3.6Å; I169-A185 HydrophobicContact CD1-CB 3.94Å; I169-F207 HydrophobicContact CB-CZ 4.16Å; I169-F207 HydrophobicContact CG2-CE1 4.32Å; I169-F207 HydrophobicContact CG2-CZ 3.66Å; I169-A222 HydrophobicContact CG2-CB 3.55Å; I169-I226 HydrophobicContact CD1-CD1 4.1Å
170	Q	93	Very high	91.9	Very high	105 Å²	105	46.9 Å²	46.9	49%	0.491	26%	0.261	S	S	.	.	H	α-helix	trans	-67.7	-33.6	178.2	-74.5	-178.5	-11.8	0	0	114.2	L166 S167 S168 F207 L219	L166-Q170 WeakPolarHBondContact O-CG 3.28Å; L166-Q170 PolarHBondContact O-N 2.95Å; S167-Q170 PolarHBondContact O-N 3.31Å; S168-Q170 VanDerWaalsContact C-N 3.26Å; S168-Q170 PolarHBondContact O-N 3.15Å; Q170-F207 HydrophobicContact CG-CD2 4.41Å; Q170-F207 HydrophobicContact CG-CE2 3.71Å; Q170-L219 HydrophobicContact CG-CD2 4.46Å
171	Q	90.8	Very high	92.1	Very high	155 Å²	155	44.9 Å²	44.9	72%	0.724	25%	0.245	S	C	*	.	H	α-helix	trans	-98.5	-13.2	-173.6	-65.8	175.8	33.2	0	0	113.3	S167 S168	S167-Q171 WeakPolarHBondContact O-CB 3.48Å; S167-Q171 WeakPolarHBondContact O-CG 3.35Å; S167-Q171 PolarHBondContact O-N 3.06Å; S167-Q171 VanDerWaalsContact O-N 3.11Å; S167-Q171 PolarHBondContact OG-NE2 2.97Å; S168-Q171 PolarHBondContact O-N 3.5Å
172	E	92.9	Very high	92.3	Very high	21 Å²	21	44.1 Å²	44.1	10%	0.098	24%	0.241	C	C	.	.			trans	-63	138.3	-176.1	-173.9	53.4	-114.6	0	0	112.7	R131 S168 S174 I177 R178	R131-E172 IonicContact CZ-OE2 3.45Å; R131-E172 IonicContact NH1-OE1 3.28Å; R131-E172 PolarHBondContact NH1-OE1 3.23Å; R131-E172 IonicContact NH1-OE2 3.4Å; R131-E172 PolarHBondContact NH1-OE2 3.21Å; R131-E172 IonicContact NH2-OE1 3.87Å; R131-E172 IonicContact NH2-OE2 2.66Å; R131-E172 PolarHBondContact NH2-OE2 2.97Å; S168-E172 WeakPolarHBondContact O-CB 3.24Å; S168-E172 PolarHBondContact O-N 2.86Å; E172-S174 VanDerWaalsContact CG-O 3.26Å; E172-S174 WeakPolarHBondContact CG-O 3.46Å; E172-S174 PolarHBondContact OE1-N 3.42Å; E172-I177 HydrophobicContact CG-CB 4.04Å; E172-I177 HydrophobicContact CG-CG2 4.1Å; E172-I177 VanDerWaalsContact OE2-CG2 3.22Å; E172-I177 WeakPolarHBondContact OE2-CG2 3.16Å; E172-R178 HydrophobicContact CB-CB 4.29Å; E172-R178 HydrophobicContact CG-CB 3.9Å; E172-R178 PolarHBondContact O-NH2 3.36Å
173	A	88.1	Confident	92.1	Very high	84 Å²	84	43.2 Å²	43.2	69%	0.694	24%	0.238	S	C	*	.			trans	-98.7	-41.4	174.9	0	0	0	0	0	111.9	P175	A173-P175 WeakPolarHBondContact O-CD 3.19Å
174	S	91	Very high	92.1	Very high	19 Å²	19	39 Å²	39	13%	0.133	21%	0.212	C	C	.	.			trans	-73.6	121.4	179.9	173.6	0	0	0	0	111.3	E128 E172 N176 I177 R178	E128-S174 WeakPolarHBondContact OE1-CB 3.38Å; E128-S174 PolarHBondContact OE1-OG 3Å; E172-S174 VanDerWaalsContact CG-O 3.26Å; E172-S174 WeakPolarHBondContact CG-O 3.46Å; E172-S174 PolarHBondContact OE1-N 3.42Å; S174-N176 PolarHBondContact O-N 2.82Å; S174-N176 PolarHBondContact OG-N 3.02Å; S174-I177 PolarHBondContact O-N 2.97Å; S174-I177 PolarHBondContact OG-N 3.01Å; S174-R178 WeakPolarHBondContact O-CB 3.44Å; S174-R178 PolarHBondContact O-N 3.13Å
175	P	88.9	Confident	92.3	Very high	70 Å²	70	36 Å²	36	46%	0.455	20%	0.198	S	C	.	.	H	α-helix	trans	-58.9	-32.6	173.4	-23.9	35.2	0	0	0	112.9	A173 R178 K179	A173-P175 WeakPolarHBondContact O-CD 3.19Å; P175-R178 PolarHBondContact O-N 3.39Å; P175-K179 WeakPolarHBondContact O-CG 3.48Å; P175-K179 PolarHBondContact O-N 3.32Å
176	N	88.1	Confident	92.3	Very high	96 Å²	96	36 Å²	36	51%	0.513	20%	0.198	S	C	.	.	H	α-helix	trans	-70.5	-46.3	-178.1	-67.6	-10.2	0	0	0	111.6	S174 R178 K180	S174-N176 PolarHBondContact O-N 2.82Å; S174-N176 PolarHBondContact OG-N 3.02Å; N176-R178 VanDerWaalsContact C-N 3.33Å; N176-K180 PolarHBondContact O-N 3.49Å
177	I	91.1	Very high	92.1	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.9	-43.6	172.4	-59.4	-66.1	0	0	0	110	E128 R131 Q132 E172 S174 K179 K180 V181	E128-I177 HydrophobicContact CG-CD1 4.11Å; E128-I177 HydrophobicContact CG-CG1 4.14Å; R131-I177 HydrophobicContact CB-CD1 3.64Å; Q132-I177 HydrophobicContact CB-CD1 4.31Å; Q132-I177 HydrophobicContact CG-CD1 3.48Å; Q132-I177 VanDerWaalsContact CG-CD1 3.48Å; E172-I177 HydrophobicContact CG-CB 4.04Å; E172-I177 HydrophobicContact CG-CG2 4.1Å; E172-I177 VanDerWaalsContact OE2-CG2 3.22Å; E172-I177 WeakPolarHBondContact OE2-CG2 3.16Å; S174-I177 PolarHBondContact O-N 2.97Å; S174-I177 PolarHBondContact OG-N 3.01Å; I177-K179 VanDerWaalsContact C-N 3.33Å; I177-K179 PolarHBondContact O-N 2.93Å; I177-K180 PolarHBondContact O-N 2.9Å; I177-V181 HydrophobicContact CG2-CG2 4.02Å; I177-V181 WeakPolarHBondContact O-CG2 3.38Å; I177-V181 PolarHBondContact O-N 3.27Å
178	R	93.9	Very high	92.1	Very high	23 Å²	23	33.5 Å²	33.5	9%	0.087	18%	0.182	C	C	.	.	H	α-helix	trans	-56.2	-46	-179.4	-167.9	-166.2	-47.6	-110.3	-12.7	111.9	I169 E172 S174 P175 N176 V181 C182 G218 A222	I169-R178 HydrophobicContact CG2-CG 4.24Å; E172-R178 HydrophobicContact CB-CB 4.29Å; E172-R178 HydrophobicContact CG-CB 3.9Å; E172-R178 PolarHBondContact O-NH2 3.36Å; S174-R178 WeakPolarHBondContact O-CB 3.44Å; S174-R178 PolarHBondContact O-N 3.13Å; P175-R178 PolarHBondContact O-N 3.39Å; N176-R178 VanDerWaalsContact C-N 3.33Å; R178-V181 PolarHBondContact O-N 2.91Å; R178-C182 PolarHBondContact O-N 2.88Å; R178-C182 PolarHBondContact O-SG 2.98Å; R178-G218 WeakPolarHBondContact CD-O 3.34Å; R178-G218 VanDerWaalsContact NH1-C 3.28Å; R178-G218 PolarHBondContact NH1-O 3.21Å; R178-G218 VanDerWaalsContact NH1-O 3.1Å; R178-A222 HydrophobicContact CG-CB 4.39Å
179	K	90.9	Very high	92.2	Very high	69 Å²	69	32.9 Å²	32.9	30%	0.3	18%	0.177	S	C	.	.	H	α-helix	trans	-58	-54.1	175.1	-74.2	178.4	177.2	-176.4	0	111.1	P175 I177 V181 C182 D183 H260	P175-K179 WeakPolarHBondContact O-CG 3.48Å; P175-K179 PolarHBondContact O-N 3.32Å; I177-K179 VanDerWaalsContact C-N 3.33Å; I177-K179 PolarHBondContact O-N 2.93Å; K179-V181 VanDerWaalsContact C-N 3.27Å; K179-V181 PolarHBondContact O-N 3.3Å; K179-C182 CarbonylContact O-C 3.59Å; K179-C182 WeakPolarHBondContact O-CA 2.96Å; K179-C182 VanDerWaalsContact O-CB 3.26Å; K179-C182 WeakPolarHBondContact O-CB 3.47Å; K179-C182 PolarHBondContact O-N 2.78Å; K179-D183 PolarHBondContact O-N 3.33Å; K179-D183 VanDerWaalsContact O-OD2 3.07Å; K179-H260 PolarHBondContact NZ-NE2 2.78Å
180	K	91.1	Very high	92	Very high	31 Å²	31	34.6 Å²	34.6	14%	0.135	18%	0.184	C	C	.	.	H	α-helix	trans	-58.7	-33.8	178.7	-67.7	-176	176.3	-71.9	0	113.4	Q132 A135 V136 N176 I177 D183 I184	Q132-K180 HydrophobicContact CB-CD 4.42Å; Q132-K180 HydrophobicContact CG-CD 4.5Å; A135-K180 HydrophobicContact CB-CB 3.71Å; A135-K180 HydrophobicContact CB-CD 4.44Å; V136-K180 HydrophobicContact CG2-CD 4.02Å; V136-K180 VanDerWaalsContact CG2-NZ 3.31Å; N176-K180 PolarHBondContact O-N 3.49Å; I177-K180 PolarHBondContact O-N 2.9Å; K180-D183 WeakPolarHBondContact CA-OD2 3.31Å; K180-D183 PolarHBondContact O-N 2.99Å; K180-I184 VanDerWaalsContact O-CG1 3.31Å; K180-I184 WeakPolarHBondContact O-CG1 3.44Å; K180-I184 PolarHBondContact O-N 2.89Å
181	V	94.6	Very high	91.9	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.012	17%	0.173	C	C	.	.	H	α-helix	trans	-76.2	-29.4	174.1	-175.2	0	0	0	0	112.6	I121 L165 I169 I177 R178 K179 D183 I184 A185	I121-V181 HydrophobicContact CG2-CG2 3.48Å; I121-V181 VanDerWaalsContact CG2-CG2 3.48Å; L165-V181 HydrophobicContact CD2-CG1 4.09Å; I169-V181 HydrophobicContact CD1-CG1 4.23Å; I169-V181 HydrophobicContact CG1-CB 4.14Å; I169-V181 HydrophobicContact CG1-CG1 3.6Å; I177-V181 HydrophobicContact CG2-CG2 4.02Å; I177-V181 WeakPolarHBondContact O-CG2 3.38Å; I177-V181 PolarHBondContact O-N 3.27Å; R178-V181 PolarHBondContact O-N 2.91Å; K179-V181 VanDerWaalsContact C-N 3.27Å; K179-V181 PolarHBondContact O-N 3.3Å; V181-D183 VanDerWaalsContact C-N 3.35Å; V181-I184 PolarHBondContact O-N 3.43Å; V181-A185 PolarHBondContact O-N 2.91Å
182	C	94.8	Very high	92.1	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-65	-38.9	169	-66.4	0	0	0	0	111.5	R178 K179 I184 A185 A186 A222 H225 I226	R178-C182 PolarHBondContact O-N 2.88Å; R178-C182 PolarHBondContact O-SG 2.98Å; K179-C182 CarbonylContact O-C 3.59Å; K179-C182 WeakPolarHBondContact O-CA 2.96Å; K179-C182 VanDerWaalsContact O-CB 3.26Å; K179-C182 WeakPolarHBondContact O-CB 3.47Å; K179-C182 PolarHBondContact O-N 2.78Å; C182-I184 PolarHBondContact O-N 3.47Å; C182-A185 PolarHBondContact O-N 3.07Å; C182-A186 PolarHBondContact O-N 3.25Å; C182-A222 VanDerWaalsContact SG-CB 3.55Å; C182-H225 HydrophobicContact CB-CB 4.33Å; C182-I226 HydrophobicContact CB-CD1 4.44Å; C182-I226 HydrophobicContact CB-CG1 3.66Å
183	D	91.1	Very high	91.9	Very high	12 Å²	12	26.2 Å²	26.2	6%	0.064	15%	0.148	C	C	.	.	H	α-helix	trans	-62.4	-42.4	175.5	-56.5	-44.9	0	0	0	111.6	R139 K179 K180 V181 A185 A186 E187 H225 N229	R139-D183 HydrophobicContact CG-CB 4.4Å; K179-D183 PolarHBondContact O-N 3.33Å; K179-D183 VanDerWaalsContact O-OD2 3.07Å; K180-D183 WeakPolarHBondContact CA-OD2 3.31Å; K180-D183 PolarHBondContact O-N 2.99Å; V181-D183 VanDerWaalsContact C-N 3.35Å; D183-A185 VanDerWaalsContact C-N 3.32Å; D183-A185 PolarHBondContact O-N 2.95Å; D183-A186 PolarHBondContact O-N 3.34Å; D183-E187 WeakPolarHBondContact O-CB 3.26Å; D183-E187 PolarHBondContact O-N 3.17Å; D183-H225 IonicContact OD1-CD2 3.43Å; D183-H225 PolarHBondContact OD1-CD2 3.14Å; D183-H225 IonicContact OD1-CE1 3.01Å; D183-H225 IonicContact OD1-NE2 3.87Å; D183-H225 PolarHBondContact OD1-NE2 3.12Å; D183-H225 IonicContact OD2-NE2 2.61Å; D183-N229 PolarHBondContact OD1-ND2 3.09Å
184	I	93.8	Very high	92	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-62	-39.5	173.4	-60.9	162.4	0	0	0	111.4	I121 A135 L138 R139 L142 L165 K180 V181 C182 L188	I121-I184 HydrophobicContact CD1-CD1 3.77Å; A135-I184 HydrophobicContact CB-CD1 3.98Å; A135-I184 WeakPolarHBondContact O-CD1 3.33Å; L138-I184 HydrophobicContact CB-CD1 4.08Å; L138-I184 HydrophobicContact CD2-CD1 4.19Å; L138-I184 HydrophobicContact CD2-CG2 4.04Å; L138-I184 HydrophobicContact CG-CD1 4.28Å; L138-I184 HydrophobicContact CG-CG2 3.98Å; R139-I184 HydrophobicContact CB-CG1 3.89Å; L142-I184 HydrophobicContact CD1-CG2 3.83Å; L165-I184 HydrophobicContact CD1-CG2 4.16Å; L165-I184 HydrophobicContact CD2-CB 4.34Å; L165-I184 HydrophobicContact CD2-CG2 3.66Å; K180-I184 VanDerWaalsContact O-CG1 3.31Å; K180-I184 WeakPolarHBondContact O-CG1 3.44Å; K180-I184 PolarHBondContact O-N 2.89Å; V181-I184 PolarHBondContact O-N 3.43Å; C182-I184 PolarHBondContact O-N 3.47Å; I184-L188 WeakPolarHBondContact O-CB 3.24Å; I184-L188 PolarHBondContact O-N 3.38Å
185	A	95.3	Very high	91.6	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-70.6	-35.1	178.7	0	0	0	0	0	112.6	I169 V181 C182 D183 C189 W201 I226	I169-A185 HydrophobicContact CD1-CB 3.94Å; V181-A185 PolarHBondContact O-N 2.91Å; C182-A185 PolarHBondContact O-N 3.07Å; D183-A185 VanDerWaalsContact C-N 3.32Å; D183-A185 PolarHBondContact O-N 2.95Å; A185-C189 WeakPolarHBondContact O-CB 3.43Å; A185-C189 PolarHBondContact O-N 3.26Å; A185-C189 VanDerWaalsContact O-N 3.09Å; A185-W201 HydrophobicContact CB-CH2 4.3Å; A185-W201 WeakPolarHBondContact O-CZ3 3.23Å; A185-I226 HydrophobicContact CB-CD1 4.23Å
186	A	92.9	Very high	91.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-65.9	-50.3	172.5	0	0	0	0	0	111	C182 D183 L188 C189 R190 I226 N229 F230	C182-A186 PolarHBondContact O-N 3.25Å; D183-A186 PolarHBondContact O-N 3.34Å; A186-L188 PolarHBondContact O-N 2.49Å; A186-C189 PolarHBondContact O-N 3.36Å; A186-R190 PolarHBondContact O-N 3.46Å; A186-I226 HydrophobicContact CB-CG2 4.33Å; A186-N229 HydrophobicContact CB-CB 3.68Å; A186-F230 HydrophobicContact CB-CB 4.13Å
187	E	91.3	Very high	91.4	Very high	4 Å²	4	31.5 Å²	31.5	2%	0.019	16%	0.163	C	C	.	.	H	α-helix	trans	-58.8	-46	177.6	-170.2	67.7	-93.8	0	0	112.1	R139 L142 S143 D183 C189 R190 N191	R139-E187 HydrophobicContact CG-CB 4.5Å; L142-E187 HydrophobicContact CB-CG 3.77Å; S143-E187 WeakPolarHBondContact CB-OE2 3.3Å; S143-E187 VanDerWaalsContact OG-CD 3.23Å; S143-E187 PolarHBondContact OG-OE2 3.43Å; D183-E187 WeakPolarHBondContact O-CB 3.26Å; D183-E187 PolarHBondContact O-N 3.17Å; E187-C189 VanDerWaalsContact C-N 3.27Å; E187-C189 PolarHBondContact O-N 2.94Å; E187-R190 PolarHBondContact O-N 3.43Å; E187-R190 IonicContact OE1-CZ 2.78Å; E187-R190 IonicContact OE1-NH1 3.18Å; E187-R190 PolarHBondContact OE1-NH1 3.04Å; E187-R190 IonicContact OE2-NH1 3.93Å; E187-R190 PolarHBondContact OE2-NH1 3.04Å; E187-R190 VanDerWaalsContact OE2-NH1 3.14Å; E187-N191 PolarHBondContact O-N 3.44Å; E187-N191 PolarHBondContact O-ND2 2.75Å; E187-N191 PolarHBondContact OE1-ND2 2.93Å
188	L	94.1	Very high	91.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.5	-36.8	175.1	-179.1	58.8	0	0	0	111.8	L142 F146 Y150 I161 K162 L165 I184 A186 L192 W201	L142-L188 HydrophobicContact CD1-CB 3.99Å; L142-L188 HydrophobicContact CD2-CD1 4.45Å; F146-L188 HydrophobicContact CE2-CD1 4.02Å; Y150-L188 HydrophobicContact CD2-CD1 3.99Å; Y150-L188 HydrophobicContact CE2-CD1 3.61Å; I161-L188 HydrophobicContact CG2-CD2 4.08Å; K162-L188 HydrophobicContact CG-CD2 4.11Å; L165-L188 HydrophobicContact CD1-CD2 3.46Å; L165-L188 VanDerWaalsContact CD1-CD2 3.46Å; I184-L188 WeakPolarHBondContact O-CB 3.24Å; I184-L188 PolarHBondContact O-N 3.38Å; A186-L188 PolarHBondContact O-N 2.49Å; L188-L192 HydrophobicContact CD1-CD1 3.98Å; L188-L192 HydrophobicContact CD1-CG 4.39Å; L188-L192 HydrophobicContact CG-CD1 3.91Å; L188-L192 WeakPolarHBondContact O-CD1 3.3Å; L188-L192 WeakPolarHBondContact O-CG 3.29Å; L188-L192 PolarHBondContact O-N 2.71Å; L188-W201 HydrophobicContact CB-CZ3 4.01Å; L188-W201 HydrophobicContact CD2-CE3 4.46Å; L188-W201 HydrophobicContact CD2-CH2 4.02Å; L188-W201 HydrophobicContact CD2-CZ3 3.86Å; L188-W201 HydrophobicContact CG-CE3 4.33Å; L188-W201 HydrophobicContact CG-CZ3 3.91Å
189	C	93.8	Very high	91.3	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-74.6	-32.9	179.9	-163.7	0	0	0	0	113.3	A185 A186 E187 N191 L192 N199 W201 V204 F230 I233	A185-C189 WeakPolarHBondContact O-CB 3.43Å; A185-C189 PolarHBondContact O-N 3.26Å; A185-C189 VanDerWaalsContact O-N 3.09Å; A186-C189 PolarHBondContact O-N 3.36Å; E187-C189 VanDerWaalsContact C-N 3.27Å; E187-C189 PolarHBondContact O-N 2.94Å; C189-N191 VanDerWaalsContact C-N 3.34Å; C189-L192 PolarHBondContact O-N 3.23Å; C189-L192 VanDerWaalsContact O-N 3.08Å; C189-N199 PolarHBondContact SG-ND2 3.15Å; C189-W201 HydrophobicContact CB-CE3 3.85Å; C189-W201 HydrophobicContact CB-CZ3 4.11Å; C189-V204 HydrophobicContact CB-CG1 4.47Å; C189-F230 HydrophobicContact CB-CD1 4.29Å; C189-I233 HydrophobicContact CB-CD1 4.3Å; C189-I233 HydrophobicContact CB-CG1 4.31Å; C189-I233 WeakPolarHBondContact SG-CG1 3.44Å
190	R	90.7	Very high	91.4	Very high	35 Å²	35	35.2 Å²	35.2	13%	0.132	18%	0.184	C	C	.	.	H	α-helix	trans	-57.5	-48.6	174.8	-176.3	-177.6	-63.2	123.4	-2.8	111.1	A186 E187 L192 I193 N229 F230 D736	A186-R190 PolarHBondContact O-N 3.46Å; E187-R190 PolarHBondContact O-N 3.43Å; E187-R190 IonicContact OE1-CZ 2.78Å; E187-R190 IonicContact OE1-NH1 3.18Å; E187-R190 PolarHBondContact OE1-NH1 3.04Å; E187-R190 IonicContact OE2-NH1 3.93Å; E187-R190 PolarHBondContact OE2-NH1 3.04Å; E187-R190 VanDerWaalsContact OE2-NH1 3.14Å; R190-L192 PolarHBondContact O-N 3.09Å; R190-I193 PolarHBondContact O-N 3.3Å; R190-N229 PolarHBondContact NH2-O 2.84Å; R190-N229 VanDerWaalsContact NH2-O 3.07Å; R190-N229 PolarHBondContact NH2-OD1 3.28Å; R190-F230 HydrophobicContact CB-CD1 4.25Å; R190-F230 HydrophobicContact CB-CD2 4.22Å; R190-F230 HydrophobicContact CB-CE1 4.24Å; R190-F230 HydrophobicContact CB-CE2 4.25Å; R190-F230 HydrophobicContact CB-CG 4.25Å; R190-F230 HydrophobicContact CB-CZ 4.27Å; R190-F230 HydrophobicContact CG-CD2 4.21Å; R190-F230 HydrophobicContact CG-CE2 4.04Å; R190-F230 HydrophobicContact CG-CZ 4.37Å; R190-D736 VanDerWaalsContact CZ-CB 3.49Å; R190-D736 VanDerWaalsContact CZ-CG 3.49Å; R190-D736 IonicContact CZ-OD1 3.22Å; R190-D736 IonicContact NE-OD1 3.75Å; R190-D736 PolarHBondContact NE-OD1 3.41Å; R190-D736 IonicContact NE-OD2 2.66Å; R190-D736 PolarHBondContact NE-OD2 3.46Å; R190-D736 PolarHBondContact NH2-O 3.3Å; R190-D736 IonicContact NH2-OD1 2.62Å; R190-D736 PolarHBondContact NH2-OD1 2.94Å
191	N	91.1	Very high	91.6	Very high	49 Å²	49	33.8 Å²	33.8	26%	0.262	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	2.6	176.6	-64.2	-84.2	0	0	0	114	F146 E187 C189	F146-N191 HydrophobicContact CB-CB 4.23Å; F146-N191 HydrophobicContact CD1-CB 3.67Å; F146-N191 HydrophobicContact CD2-CB 3.44Å; F146-N191 VanDerWaalsContact CD2-CB 3.44Å; F146-N191 HydrophobicContact CE1-CB 3.78Å; F146-N191 VanDerWaalsContact CE1-O 3.22Å; F146-N191 WeakPolarHBondContact CE1-O 3.43Å; F146-N191 HydrophobicContact CE2-CB 3.55Å; F146-N191 HydrophobicContact CG-CB 3.5Å; F146-N191 VanDerWaalsContact CG-CB 3.5Å; F146-N191 HydrophobicContact CZ-CB 3.71Å; F146-N191 WeakPolarHBondContact CZ-O 3.48Å; E187-N191 PolarHBondContact O-N 3.44Å; E187-N191 PolarHBondContact O-ND2 2.75Å; E187-N191 PolarHBondContact OE1-ND2 2.93Å; C189-N191 VanDerWaalsContact C-N 3.34Å
192	L	93.8	Very high	91.4	Very high	7 Å²	7	37.4 Å²	37.4	4%	0.037	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.1	23.8	175.5	-71.5	175.4	0	0	0	112.5	F146 Y150 K162 L188 C189 R190 Q200 W201	F146-L192 HydrophobicContact CZ-CD2 4.06Å; F146-L192 HydrophobicContact CZ-CG 4.46Å; Y150-L192 HydrophobicContact CE1-CD2 3.82Å; K162-L192 HydrophobicContact CD-CD1 3.85Å; L188-L192 HydrophobicContact CD1-CD1 3.98Å; L188-L192 HydrophobicContact CD1-CG 4.39Å; L188-L192 HydrophobicContact CG-CD1 3.91Å; L188-L192 WeakPolarHBondContact O-CD1 3.3Å; L188-L192 WeakPolarHBondContact O-CG 3.29Å; L188-L192 PolarHBondContact O-N 2.71Å; C189-L192 PolarHBondContact O-N 3.23Å; C189-L192 VanDerWaalsContact O-N 3.08Å; R190-L192 PolarHBondContact O-N 3.09Å; L192-Q200 HydrophobicContact CB-CB 4.41Å; L192-Q200 WeakPolarHBondContact O-CB 3.5Å; L192-Q200 PolarHBondContact O-N 3.49Å; L192-W201 HydrophobicContact CD1-CB 4.16Å; L192-W201 HydrophobicContact CD1-CE3 4.16Å
193	I	90.8	Very high	91.4	Very high	50 Å²	50	42.2 Å²	42.2	26%	0.256	22%	0.224	S	C	.	.	B	Isolated β-bridge	trans	-91.2	128.8	160.8	-53.7	-52.7	0	0	0	107.9	R190 N198 N199 F230	R190-I193 PolarHBondContact O-N 3.3Å; I193-N198 WeakPolarHBondContact CA-O 3.47Å; I193-N199 HydrophobicContact CD1-CB 3.7Å; I193-F230 HydrophobicContact CD1-CE1 4.24Å; I193-F230 HydrophobicContact CD1-CZ 4.27Å; I193-F230 HydrophobicContact CG1-CE1 4.18Å; I193-F230 HydrophobicContact CG1-CZ 3.84Å
194	D	88.3	Confident	91.6	Very high	50 Å²	50	41.6 Å²	41.6	27%	0.267	22%	0.221	S	C	.	.			trans	-81	168.7	175	57.2	36.7	0	0	0	113.8	D196 G197 N198	D194-D196 PolarHBondContact O-N 2.88Å; D194-D196 VanDerWaalsContact O-N 3.15Å; D194-D196 WeakPolarHBondContact OD1-CB 3.24Å; D194-D196 PolarHBondContact OD1-N 2.94Å; D194-G197 WeakPolarHBondContact O-CA 3.5Å; D194-G197 PolarHBondContact O-N 3.42Å; D194-G197 PolarHBondContact OD1-N 3.18Å; D194-G197 VanDerWaalsContact OD1-N 3.17Å; D194-N198 PolarHBondContact N-O 3.39Å; D194-N198 WeakPolarHBondContact OD1-CA 3.33Å; D194-N198 WeakPolarHBondContact OD1-CB 3.46Å; D194-N198 PolarHBondContact OD1-N 2.82Å; D194-N198 PolarHBondContact OD1-ND2 2.75Å
195	D	84	Confident	91.4	Very high	178 Å²	178	42 Å²	42	95%	0.952	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-30.3	178.4	-51.8	-32.3	0	0	0	113.3	G197	D195-G197 VanDerWaalsContact C-N 3.25Å; D195-G197 PolarHBondContact O-N 2.94Å
196	D	86.5	Confident	91.3	Very high	134 Å²	134	48.4 Å²	48.4	72%	0.717	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-13.6	175.4	-81.4	-39.8	0	0	0	112	D194 N198 N236	D194-D196 PolarHBondContact O-N 2.88Å; D194-D196 VanDerWaalsContact O-N 3.15Å; D194-D196 WeakPolarHBondContact OD1-CB 3.24Å; D194-D196 PolarHBondContact OD1-N 2.94Å; D196-N198 WeakPolarHBondContact CB-ND2 3.4Å; D196-N236 PolarHBondContact O-ND2 2.78Å
197	G	86.8	Confident	91.4	Very high	17 Å²	17	48.8 Å²	48.8	18%	0.175	25%	0.252	C	S	.	.	S	Bend	trans	95.6	22	179.1	0	0	0	0	0	115.2	D194 D195 G235 N236	D194-G197 WeakPolarHBondContact O-CA 3.5Å; D194-G197 PolarHBondContact O-N 3.42Å; D194-G197 PolarHBondContact OD1-N 3.18Å; D194-G197 VanDerWaalsContact OD1-N 3.17Å; D195-G197 VanDerWaalsContact C-N 3.25Å; D195-G197 PolarHBondContact O-N 2.94Å; G197-G235 CarbonylContact O-C 3.6Å; G197-G235 VanDerWaalsContact O-CA 3.27Å; G197-G235 WeakPolarHBondContact O-CA 3.49Å; G197-N236 PolarHBondContact O-N 3.44Å
198	N	90.7	Very high	91.5	Very high	48 Å²	48	48.8 Å²	48.8	26%	0.257	25%	0.252	S	S	.	.			trans	-107.1	140	-175.5	-45.6	-79	0	0	0	112.9	I193 D194 D196 N236	I193-N198 WeakPolarHBondContact CA-O 3.47Å; D194-N198 PolarHBondContact N-O 3.39Å; D194-N198 WeakPolarHBondContact OD1-CA 3.33Å; D194-N198 WeakPolarHBondContact OD1-CB 3.46Å; D194-N198 PolarHBondContact OD1-N 2.82Å; D194-N198 PolarHBondContact OD1-ND2 2.75Å; D196-N198 WeakPolarHBondContact CB-ND2 3.4Å; N198-N236 PolarHBondContact OD1-ND2 3.06Å
199	N	91.5	Very high	91.2	Very high	18 Å²	18	50.5 Å²	50.5	10%	0.096	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-78.7	120.5	177.3	-175.5	-24.7	0	0	0	112	C189 I193 W201 I233	C189-N199 PolarHBondContact SG-ND2 3.15Å; I193-N199 HydrophobicContact CD1-CB 3.7Å; N199-W201 VanDerWaalsContact C-N 3.31Å; N199-W201 PolarHBondContact O-N 3.34Å; N199-W201 WeakPolarHBondContact OD1-CA 3.48Å; N199-W201 WeakPolarHBondContact OD1-CB 3.4Å; N199-W201 PolarHBondContact OD1-N 2.88Å; N199-I233 PolarHBondContact ND2-O 2.85Å
200	Q	92.9	Very high	91.1	Very high	105 Å²	105	55.2 Å²	55.2	49%	0.491	29%	0.285	S	S	.	.	S	Bend	trans	-84.1	5.2	179.2	-57.2	-172.9	-5.4	0	0	114.8	K162 L192	K162-Q200 PolarHBondContact NZ-O 2.91Å; L192-Q200 HydrophobicContact CB-CB 4.41Å; L192-Q200 WeakPolarHBondContact O-CB 3.5Å; L192-Q200 PolarHBondContact O-N 3.49Å
201	W	94.8	Very high	91.3	Very high	1 Å²	1	53.8 Å²	53.8	0%	0.004	28%	0.28	C	S	.	.			trans	-126.7	62.6	-178.5	-169.6	7.8	0	0	0	112.5	K162 L165 L166 A185 L188 C189 L192 N199 E203 V204	K162-W201 HydrophobicContact CB-CD2 4.45Å; K162-W201 HydrophobicContact CB-CZ2 3.91Å; K162-W201 HydrophobicContact CD-CB 4.15Å; K162-W201 HydrophobicContact CD-CD2 3.84Å; K162-W201 HydrophobicContact CD-CG 3.64Å; K162-W201 HydrophobicContact CG-CD2 4.08Å; K162-W201 HydrophobicContact CG-CG 4.37Å; K162-W201 HydrophobicContact CG-CZ2 4.18Å; K162-W201 WeakPolarHBondContact O-CZ2 3.41Å; L165-W201 HydrophobicContact CD1-CH2 4.48Å; L166-W201 HydrophobicContact CD1-CZ2 3.92Å; L166-W201 HydrophobicContact CD2-CH2 4.18Å; L166-W201 HydrophobicContact CD2-CZ2 3.77Å; L166-W201 HydrophobicContact CG-CZ2 3.73Å; A185-W201 HydrophobicContact CB-CH2 4.3Å; A185-W201 WeakPolarHBondContact O-CZ3 3.23Å; L188-W201 HydrophobicContact CB-CZ3 4.01Å; L188-W201 HydrophobicContact CD2-CE3 4.46Å; L188-W201 HydrophobicContact CD2-CH2 4.02Å; L188-W201 HydrophobicContact CD2-CZ3 3.86Å; L188-W201 HydrophobicContact CG-CE3 4.33Å; L188-W201 HydrophobicContact CG-CZ3 3.91Å; C189-W201 HydrophobicContact CB-CE3 3.85Å; C189-W201 HydrophobicContact CB-CZ3 4.11Å; L192-W201 HydrophobicContact CD1-CB 4.16Å; L192-W201 HydrophobicContact CD1-CE3 4.16Å; N199-W201 VanDerWaalsContact C-N 3.31Å; N199-W201 PolarHBondContact O-N 3.34Å; N199-W201 WeakPolarHBondContact OD1-CA 3.48Å; N199-W201 WeakPolarHBondContact OD1-CB 3.4Å; N199-W201 PolarHBondContact OD1-N 2.88Å; W201-E203 PolarHBondContact O-N 2.88Å; W201-V204 HydrophobicContact CB-CG1 4.42Å; W201-V204 HydrophobicContact CD2-CB 3.73Å; W201-V204 HydrophobicContact CD2-CG1 4.14Å; W201-V204 HydrophobicContact CD2-CG2 4.5Å; W201-V204 HydrophobicContact CE3-CB 4.02Å; W201-V204 HydrophobicContact CE3-CG1 4.25Å; W201-V204 HydrophobicContact CE3-CG2 4.39Å; W201-V204 HydrophobicContact CG-CB 4.05Å; W201-V204 HydrophobicContact CG-CG1 4.21Å; W201-V204 HydrophobicContact CH2-CG2 4.42Å; W201-V204 HydrophobicContact CZ2-CB 4.34Å; W201-V204 HydrophobicContact CZ3-CB 4.43Å; W201-V204 HydrophobicContact CZ3-CG2 4.34Å; W201-V204 VanDerWaalsContact O-CG1 3.31Å; W201-V204 WeakPolarHBondContact O-CG1 3.27Å; W201-V204 PolarHBondContact O-N 3.15Å
202	P	90.9	Very high	91.3	Very high	78 Å²	78	51.7 Å²	51.7	51%	0.506	27%	0.269	S	S	.	.	H	α-helix	trans	-58.6	-21.7	-178.5	26	-35.9	0	0	0	114.1	V204 L205 K206	P202-V204 VanDerWaalsContact C-N 3.31Å; P202-V204 PolarHBondContact O-N 3.43Å; P202-L205 PolarHBondContact O-N 2.77Å; P202-K206 PolarHBondContact O-N 3.01Å
203	E	94.9	Very high	91	Very high	100 Å²	100	56.5 Å²	56.5	47%	0.467	30%	0.295	S	S	.	.	H	α-helix	trans	-64.3	-29.5	174.6	-59.6	87.3	166.7	0	0	113.6	L166 W201 F207	L166-E203 HydrophobicContact CD1-CB 4.26Å; W201-E203 PolarHBondContact O-N 2.88Å; E203-F207 WeakPolarHBondContact O-CB 3.42Å; E203-F207 PolarHBondContact O-N 3.01Å
204	V	94.5	Very high	91	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-71.1	-38.5	176	80.9	0	0	0	0	111.5	L166 C189 W201 P202 K206 F207 L208 I233	L166-V204 HydrophobicContact CD2-CG2 4.07Å; C189-V204 HydrophobicContact CB-CG1 4.47Å; W201-V204 HydrophobicContact CB-CG1 4.42Å; W201-V204 HydrophobicContact CD2-CB 3.73Å; W201-V204 HydrophobicContact CD2-CG1 4.14Å; W201-V204 HydrophobicContact CD2-CG2 4.5Å; W201-V204 HydrophobicContact CE3-CB 4.02Å; W201-V204 HydrophobicContact CE3-CG1 4.25Å; W201-V204 HydrophobicContact CE3-CG2 4.39Å; W201-V204 HydrophobicContact CG-CB 4.05Å; W201-V204 HydrophobicContact CG-CG1 4.21Å; W201-V204 HydrophobicContact CH2-CG2 4.42Å; W201-V204 HydrophobicContact CZ2-CB 4.34Å; W201-V204 HydrophobicContact CZ3-CB 4.43Å; W201-V204 HydrophobicContact CZ3-CG2 4.34Å; W201-V204 VanDerWaalsContact O-CG1 3.31Å; W201-V204 WeakPolarHBondContact O-CG1 3.27Å; W201-V204 PolarHBondContact O-N 3.15Å; P202-V204 VanDerWaalsContact C-N 3.31Å; P202-V204 PolarHBondContact O-N 3.43Å; V204-K206 VanDerWaalsContact C-N 3.32Å; V204-K206 PolarHBondContact O-N 2.78Å; V204-F207 WeakPolarHBondContact O-CB 3.29Å; V204-F207 PolarHBondContact O-N 2.73Å; V204-F207 VanDerWaalsContact O-N 3.11Å; V204-L208 WeakPolarHBondContact O-CG 3.37Å; V204-L208 PolarHBondContact O-N 3.28Å; V204-I233 HydrophobicContact CG1-CD1 3.65Å; V204-I233 HydrophobicContact CG1-CG1 4.12Å; V204-I233 HydrophobicContact CG2-CD1 4.14Å
205	L	91	Very high	91.1	Very high	9 Å²	9	61.3 Å²	61.3	5%	0.047	32%	0.324	C	S	.	.	H	α-helix	trans	-62.2	-43.1	176	-59.9	-176.2	0	0	0	110.7	P202 L208 F209 I233 F234	P202-L205 PolarHBondContact O-N 2.77Å; L205-L208 PolarHBondContact O-N 3.33Å; L205-F209 WeakPolarHBondContact O-CD2 3.33Å; L205-F209 PolarHBondContact O-N 3.31Å; L205-I233 HydrophobicContact CD2-CB 4.35Å; L205-I233 HydrophobicContact CD2-CD1 4.33Å; L205-I233 HydrophobicContact CD2-CG1 3.93Å; L205-I233 HydrophobicContact CD2-CG2 3.87Å; L205-F234 HydrophobicContact CD1-CD1 4.34Å; L205-F234 HydrophobicContact CD2-CD1 3.75Å; L205-F234 HydrophobicContact CD2-CE1 3.78Å
206	K	91.4	Very high	91.4	Very high	133 Å²	133	56.4 Å²	56.4	58%	0.578	30%	0.298	S	S	*	.	H	α-helix	trans	-61	-46.1	171.8	178.4	169.1	179.6	172.4	0	111.6	P202 V204 L208 F209 D210	P202-K206 PolarHBondContact O-N 3.01Å; V204-K206 VanDerWaalsContact C-N 3.32Å; V204-K206 PolarHBondContact O-N 2.78Å; K206-L208 VanDerWaalsContact C-N 3.32Å; K206-L208 PolarHBondContact O-N 2.84Å; K206-F209 PolarHBondContact O-N 3.14Å; K206-D210 WeakPolarHBondContact CE-OD2 3.34Å; K206-D210 WeakPolarHBondContact CG-OD2 3.47Å; K206-D210 WeakPolarHBondContact O-CB 3.48Å; K206-D210 PolarHBondContact O-N 2.9Å
207	F	95.3	Very high	91.7	Very high	8 Å²	8	52 Å²	52	4%	0.035	28%	0.276	C	S	.	.	H	α-helix	trans	-58.1	-42.6	178.1	170.7	-95.8	0	0	0	112.3	L166 I169 Q170 E203 V204 S211 I226	L166-F207 HydrophobicContact CB-CD2 4.33Å; L166-F207 HydrophobicContact CD1-CB 4.12Å; L166-F207 HydrophobicContact CD2-CB 4.11Å; L166-F207 HydrophobicContact CD2-CD1 3.87Å; L166-F207 HydrophobicContact CD2-CD2 4.4Å; L166-F207 HydrophobicContact CD2-CE1 4.46Å; L166-F207 HydrophobicContact CD2-CG 3.84Å; I169-F207 HydrophobicContact CB-CZ 4.16Å; I169-F207 HydrophobicContact CG2-CE1 4.32Å; I169-F207 HydrophobicContact CG2-CZ 3.66Å; Q170-F207 HydrophobicContact CG-CD2 4.41Å; Q170-F207 HydrophobicContact CG-CE2 3.71Å; E203-F207 WeakPolarHBondContact O-CB 3.42Å; E203-F207 PolarHBondContact O-N 3.01Å; V204-F207 WeakPolarHBondContact O-CB 3.29Å; V204-F207 PolarHBondContact O-N 2.73Å; V204-F207 VanDerWaalsContact O-N 3.11Å; F207-S211 WeakPolarHBondContact CD2-OG 3.49Å; F207-S211 WeakPolarHBondContact CE2-OG 3.38Å; F207-S211 WeakPolarHBondContact CZ-OG 3.47Å; F207-S211 WeakPolarHBondContact O-CB 3.46Å; F207-S211 PolarHBondContact O-N 3.39Å; F207-S211 PolarHBondContact O-OG 3.44Å; F207-I226 HydrophobicContact CD1-CD1 4.22Å; F207-I226 HydrophobicContact CE1-CD1 3.78Å
208	L	92.9	Very high	92	Very high	4 Å²	4	51.6 Å²	51.6	2%	0.021	27%	0.272	C	S	.	.	H	α-helix	trans	-58.4	-53.7	175.2	-72.2	-176.3	0	0	0	111.7	V204 L205 K206 S211 V212 A223 I226 I233	V204-L208 WeakPolarHBondContact O-CG 3.37Å; V204-L208 PolarHBondContact O-N 3.28Å; L205-L208 PolarHBondContact O-N 3.33Å; K206-L208 VanDerWaalsContact C-N 3.32Å; K206-L208 PolarHBondContact O-N 2.84Å; L208-S211 PolarHBondContact O-N 3.21Å; L208-V212 WeakPolarHBondContact O-CB 3.36Å; L208-V212 WeakPolarHBondContact O-CG1 3.3Å; L208-V212 PolarHBondContact O-N 3.01Å; L208-A223 HydrophobicContact CD2-CB 4.01Å; L208-A223 WeakPolarHBondContact CD2-O 3.42Å; L208-I226 HydrophobicContact CD2-CB 3.95Å; L208-I226 HydrophobicContact CD2-CD1 4.27Å; L208-I226 HydrophobicContact CD2-CG2 4.03Å; L208-I233 HydrophobicContact CD1-CD1 3.74Å; L208-I233 HydrophobicContact CD1-CG2 3.97Å
209	F	88.6	Confident	92.1	Very high	36 Å²	36	50.3 Å²	50.3	16%	0.158	27%	0.265	C	S	.	.	H	α-helix	trans	-67	-38.1	-177.1	-66.4	-51.6	0	0	0	113.2	L205 K206 N213 F234 Y241 V244	L205-F209 WeakPolarHBondContact O-CD2 3.33Å; L205-F209 PolarHBondContact O-N 3.31Å; K206-F209 PolarHBondContact O-N 3.14Å; F209-N213 PolarHBondContact O-ND2 3.39Å; F209-F234 HydrophobicContact CE1-CE1 4.36Å; F209-F234 HydrophobicContact CE1-CZ 4.39Å; F209-F234 AromaticContact CE2-CE1 3.94Å; F209-F234 HydrophobicContact CE2-CE1 3.94Å; F209-F234 AromaticContact CZ-CE1 3.49Å; F209-F234 HydrophobicContact CZ-CE1 3.49Å; F209-F234 VanDerWaalsContact CZ-CE1 3.49Å; F209-F234 AromaticContact CZ-CZ 3.93Å; F209-F234 HydrophobicContact CZ-CZ 3.93Å; F209-Y241 AromaticContact CE2-CD1 3.73Å; F209-Y241 HydrophobicContact CE2-CD1 3.73Å; F209-Y241 AromaticContact CE2-CE1 3.87Å; F209-Y241 HydrophobicContact CE2-CE1 3.87Å; F209-Y241 HydrophobicContact CE2-CG 4.38Å; F209-Y241 AromaticContact CZ-CD1 3.68Å; F209-Y241 HydrophobicContact CZ-CD1 3.68Å; F209-Y241 HydrophobicContact CZ-CE1 4.3Å; F209-Y241 HydrophobicContact CZ-CG 4.1Å; F209-V244 HydrophobicContact CD1-CG1 3.83Å; F209-V244 HydrophobicContact CE1-CB 4.15Å; F209-V244 HydrophobicContact CE1-CG1 3.45Å; F209-V244 VanDerWaalsContact CE1-CG1 3.45Å; F209-V244 HydrophobicContact CZ-CB 4.49Å; F209-V244 HydrophobicContact CZ-CG1 4.13Å
210	D	92.8	Very high	92.2	Very high	100 Å²	100	51.2 Å²	51.2	54%	0.535	27%	0.267	S	S	.	.	H	α-helix	trans	-68.7	-39.3	175.3	-73.9	-16.3	0	0	0	110.9	K206 S214	K206-D210 WeakPolarHBondContact CE-OD2 3.34Å; K206-D210 WeakPolarHBondContact CG-OD2 3.47Å; K206-D210 WeakPolarHBondContact O-CB 3.48Å; K206-D210 PolarHBondContact O-N 2.9Å; D210-S214 PolarHBondContact O-N 3.47Å
211	S	94.4	Very high	92.2	Very high	4 Å²	4	48 Å²	48	3%	0.028	25%	0.252	C	S	.	.	H	α-helix	trans	-74.8	-39.2	-176.2	-63.8	0	0	0	0	113.3	F207 L208 N213 S214 L219 R220	F207-S211 WeakPolarHBondContact CD2-OG 3.49Å; F207-S211 WeakPolarHBondContact CE2-OG 3.38Å; F207-S211 WeakPolarHBondContact CZ-OG 3.47Å; F207-S211 WeakPolarHBondContact O-CB 3.46Å; F207-S211 PolarHBondContact O-N 3.39Å; F207-S211 PolarHBondContact O-OG 3.44Å; L208-S211 PolarHBondContact O-N 3.21Å; S211-N213 PolarHBondContact O-N 3.16Å; S211-S214 WeakPolarHBondContact O-CB 3.25Å; S211-S214 PolarHBondContact O-N 3.41Å; S211-L219 WeakPolarHBondContact CB-O 3.48Å; S211-R220 VanDerWaalsContact O-CG 3.3Å; S211-R220 WeakPolarHBondContact O-CG 3.48Å
212	V	89.6	Confident	92.2	Very high	5 Å²	5	48 Å²	48	3%	0.03	25%	0.252	C	S	.	.	H	α-helix	trans	-69.2	-21.7	178.9	78.8	0	0	0	0	113.2	L208 R220 A223 M248 C252	L208-V212 WeakPolarHBondContact O-CB 3.36Å; L208-V212 WeakPolarHBondContact O-CG1 3.3Å; L208-V212 PolarHBondContact O-N 3.01Å; V212-R220 VanDerWaalsContact O-CD 3.23Å; V212-R220 WeakPolarHBondContact O-CD 3.48Å; V212-R220 WeakPolarHBondContact O-CG 3.47Å; V212-A223 HydrophobicContact CB-CB 4.09Å; V212-M248 HydrophobicContact CB-CG 4.14Å; V212-M248 HydrophobicContact CB-SD 4.14Å; V212-M248 HydrophobicContact CG1-CG 3.77Å; V212-M248 HydrophobicContact CG1-SD 3.86Å; V212-M248 HydrophobicContact CG2-CG 3.51Å; V212-M248 HydrophobicContact CG2-SD 3.95Å; V212-C252 VanDerWaalsContact CG2-SG 3.57Å
213	N	88	Confident	92.4	Very high	108 Å²	108	44.3 Å²	44.3	58%	0.578	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.1	6.7	172.5	-70.1	-74	0	0	0	113.3	F209 S211	F209-N213 PolarHBondContact O-ND2 3.39Å; S211-N213 PolarHBondContact O-N 3.16Å
214	S	91.9	Very high	92.4	Very high	36 Å²	36	39.6 Å²	39.6	25%	0.252	21%	0.206	S	C	.	.	S	Bend	trans	-79.4	143.1	-179.1	-166	0	0	0	0	112.9	D210 S211 N216 R220	D210-S214 PolarHBondContact O-N 3.47Å; S211-S214 WeakPolarHBondContact O-CB 3.25Å; S211-S214 PolarHBondContact O-N 3.41Å; S214-N216 PolarHBondContact O-N 3.46Å; S214-N216 PolarHBondContact OG-N 3.03Å; S214-R220 WeakPolarHBondContact O-CD 3.44Å; S214-R220 WeakPolarHBondContact O-CG 3.3Å; S214-R220 PolarHBondContact O-NE 2.8Å
215	D	89.4	Confident	92.4	Very high	165 Å²	165	40.2 Å²	40.2	88%	0.882	21%	0.209	S	C	*	.	S	Bend	trans	-61.8	-21.5	167.8	-65.1	-46.4	0	0	0	112.3	V217	D215-V217 PolarHBondContact O-N 3.26Å
216	N	91.5	Very high	92.5	Very high	75 Å²	75	39.8 Å²	39.8	40%	0.401	21%	0.207	S	C	.	.			trans	-75.7	107.2	177.5	-172.9	-20.7	0	0	0	110.9	S214 G218 L219 R220	S214-N216 PolarHBondContact O-N 3.46Å; S214-N216 PolarHBondContact OG-N 3.03Å; N216-G218 VanDerWaalsContact C-N 3.26Å; N216-G218 PolarHBondContact O-N 2.94Å; N216-G218 PolarHBondContact OD1-N 3.19Å; N216-L219 HydrophobicContact CB-CB 4.23Å; N216-L219 HydrophobicContact CB-CD1 3.97Å; N216-L219 HydrophobicContact CB-CG 3.96Å; N216-L219 PolarHBondContact O-N 3.41Å; N216-R220 PolarHBondContact O-N 2.7Å
217	V	91.5	Very high	92.7	Very high	43 Å²	43	33.5 Å²	33.5	26%	0.261	18%	0.18	S	C	.	.	H	α-helix	trans	-49.6	-46.1	177.3	-175.7	0	0	0	0	111.5	D215 L219 R220 E221 N258 I261	D215-V217 PolarHBondContact O-N 3.26Å; V217-L219 PolarHBondContact O-N 2.84Å; V217-R220 CarbonylContact O-C 3.59Å; V217-R220 WeakPolarHBondContact O-CA 3.45Å; V217-R220 WeakPolarHBondContact O-CB 3.18Å; V217-R220 PolarHBondContact O-N 3.4Å; V217-E221 HydrophobicContact CG1-CG 4.38Å; V217-E221 WeakPolarHBondContact O-CG 3.47Å; V217-E221 PolarHBondContact O-N 3.09Å; V217-N258 HydrophobicContact CG1-CB 4.47Å; V217-N258 WeakPolarHBondContact CG2-OD1 3.19Å; V217-I261 HydrophobicContact CG1-CD1 4.2Å; V217-I261 HydrophobicContact CG1-CG1 4.07Å
218	G	92.7	Very high	92.5	Very high	8 Å²	8	34.8 Å²	34.8	8%	0.082	18%	0.184	C	C	.	.	H	α-helix	trans	-69.5	-14.8	-178.5	0	0	0	0	0	114.9	R178 N216 A222	R178-G218 WeakPolarHBondContact CD-O 3.34Å; R178-G218 VanDerWaalsContact NH1-C 3.28Å; R178-G218 PolarHBondContact NH1-O 3.21Å; R178-G218 VanDerWaalsContact NH1-O 3.1Å; N216-G218 VanDerWaalsContact C-N 3.26Å; N216-G218 PolarHBondContact O-N 2.94Å; N216-G218 PolarHBondContact OD1-N 3.19Å; G218-A222 WeakPolarHBondContact O-CB 3.43Å; G218-A222 PolarHBondContact O-N 3.07Å
219	L	93.5	Very high	92.4	Very high	21 Å²	21	34.9 Å²	34.9	11%	0.11	19%	0.185	C	C	.	.	H	α-helix	trans	-85.2	-34	168.5	-65.2	-178.6	0	0	0	111.4	Q170 S211 N216 V217 A222 A223	Q170-L219 HydrophobicContact CG-CD2 4.46Å; S211-L219 WeakPolarHBondContact CB-O 3.48Å; N216-L219 HydrophobicContact CB-CB 4.23Å; N216-L219 HydrophobicContact CB-CD1 3.97Å; N216-L219 HydrophobicContact CB-CG 3.96Å; N216-L219 PolarHBondContact O-N 3.41Å; V217-L219 PolarHBondContact O-N 2.84Å; L219-A222 PolarHBondContact O-N 3.49Å; L219-A223 WeakPolarHBondContact O-CB 3.14Å; L219-A223 PolarHBondContact O-N 3.27Å
220	R	93.9	Very high	92.5	Very high	36 Å²	36	34 Å²	34	14%	0.136	18%	0.181	C	C	.	.	H	α-helix	trans	-66	-41	171.8	-61.5	-168.1	-81	131.1	0.1	111.3	S211 V212 S214 N216 V217 A223 L224 D255 N258 I261	S211-R220 VanDerWaalsContact O-CG 3.3Å; S211-R220 WeakPolarHBondContact O-CG 3.48Å; V212-R220 VanDerWaalsContact O-CD 3.23Å; V212-R220 WeakPolarHBondContact O-CD 3.48Å; V212-R220 WeakPolarHBondContact O-CG 3.47Å; S214-R220 WeakPolarHBondContact O-CD 3.44Å; S214-R220 WeakPolarHBondContact O-CG 3.3Å; S214-R220 PolarHBondContact O-NE 2.8Å; N216-R220 PolarHBondContact O-N 2.7Å; V217-R220 CarbonylContact O-C 3.59Å; V217-R220 WeakPolarHBondContact O-CA 3.45Å; V217-R220 WeakPolarHBondContact O-CB 3.18Å; V217-R220 PolarHBondContact O-N 3.4Å; R220-A223 PolarHBondContact O-N 2.71Å; R220-L224 WeakPolarHBondContact O-CG 3.32Å; R220-L224 PolarHBondContact O-N 3.28Å; R220-L224 VanDerWaalsContact O-N 3.12Å; R220-D255 IonicContact CZ-OD2 3.53Å; R220-D255 IonicContact NH1-OD2 3.69Å; R220-D255 PolarHBondContact NH1-OD2 2.89Å; R220-D255 IonicContact NH2-OD2 2.69Å; R220-N258 PolarHBondContact NH2-ND2 3.41Å; R220-I261 HydrophobicContact CB-CD1 3.71Å
221	E	93.1	Very high	92.4	Very high	37 Å²	37	29.3 Å²	29.3	17%	0.173	16%	0.156	C	C	.	.	H	α-helix	trans	-57.8	-52.1	169.6	-70.3	172.7	176.3	0	0	111.2	V217 A223 L224 H225 H260 I261 L264	V217-E221 HydrophobicContact CG1-CG 4.38Å; V217-E221 WeakPolarHBondContact O-CG 3.47Å; V217-E221 PolarHBondContact O-N 3.09Å; E221-A223 VanDerWaalsContact C-N 3.34Å; E221-A223 PolarHBondContact O-N 2.74Å; E221-L224 PolarHBondContact O-N 3.29Å; E221-H225 WeakPolarHBondContact O-CB 3.39Å; E221-H225 PolarHBondContact O-N 3.3Å; E221-H260 IonicContact OE1-CD2 2.66Å; E221-I261 HydrophobicContact CB-CD1 4.39Å; E221-I261 HydrophobicContact CG-CD1 3.56Å; E221-I261 HydrophobicContact CG-CG1 4.47Å; E221-L264 HydrophobicContact CB-CD2 4.45Å; E221-L264 WeakPolarHBondContact O-CD2 3.45Å
222	A	95.1	Very high	92.1	Very high	2 Å²	2	30.2 Å²	30.2	2%	0.017	17%	0.166	C	C	.	.	H	α-helix	trans	-57.4	-43.5	179.6	0	0	0	0	0	113.1	I169 R178 C182 G218 L219 H225 I226	I169-A222 HydrophobicContact CG2-CB 3.55Å; R178-A222 HydrophobicContact CG-CB 4.39Å; C182-A222 VanDerWaalsContact SG-CB 3.55Å; G218-A222 WeakPolarHBondContact O-CB 3.43Å; G218-A222 PolarHBondContact O-N 3.07Å; L219-A222 PolarHBondContact O-N 3.49Å; A222-H225 PolarHBondContact O-N 2.94Å; A222-I226 WeakPolarHBondContact O-CG1 3.48Å; A222-I226 PolarHBondContact O-N 2.92Å
223	A	94.8	Very high	92.2	Very high	1 Å²	1	30 Å²	30	1%	0.008	16%	0.164	C	C	.	.	H	α-helix	trans	-63.2	-45.3	178.2	0	0	0	0	0	112.3	L208 V212 L219 R220 E221 H225 F227	L208-A223 HydrophobicContact CD2-CB 4.01Å; L208-A223 WeakPolarHBondContact CD2-O 3.42Å; V212-A223 HydrophobicContact CB-CB 4.09Å; L219-A223 WeakPolarHBondContact O-CB 3.14Å; L219-A223 PolarHBondContact O-N 3.27Å; R220-A223 PolarHBondContact O-N 2.71Å; E221-A223 VanDerWaalsContact C-N 3.34Å; E221-A223 PolarHBondContact O-N 2.74Å; A223-H225 VanDerWaalsContact C-N 3.33Å; A223-F227 WeakPolarHBondContact O-CB 3.38Å; A223-F227 PolarHBondContact O-N 2.61Å; A223-F227 VanDerWaalsContact O-N 3.13Å
224	L	94.9	Very high	92.2	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-68	-33.5	177.1	-66.4	169.8	0	0	0	112	R220 E221 F227 W228 L249 C252 I261 L264 A265	R220-L224 WeakPolarHBondContact O-CG 3.32Å; R220-L224 PolarHBondContact O-N 3.28Å; R220-L224 VanDerWaalsContact O-N 3.12Å; E221-L224 PolarHBondContact O-N 3.29Å; L224-F227 PolarHBondContact O-N 3.06Å; L224-W228 VanDerWaalsContact O-CB 3.23Å; L224-W228 WeakPolarHBondContact O-CB 3.5Å; L224-W228 PolarHBondContact O-N 2.97Å; L224-L249 HydrophobicContact CD2-CD2 4.42Å; L224-C252 HydrophobicContact CD1-CB 3.99Å; L224-C252 HydrophobicContact CD2-CB 4.37Å; L224-I261 HydrophobicContact CD1-CD1 4.31Å; L224-I261 HydrophobicContact CD1-CG2 4.02Å; L224-L264 HydrophobicContact CB-CD2 3.78Å; L224-L264 HydrophobicContact CB-CG 3.77Å; L224-A265 HydrophobicContact CD1-CB 4.05Å; L224-A265 HydrophobicContact CD2-CB 4.19Å
225	H	93.4	Very high	92	Very high	14 Å²	14	24.3 Å²	24.3	7%	0.065	14%	0.136	C	C	.	.	H	α-helix	trans	-67.9	-45.7	178.3	-166.5	102.5	0	0	0	111.9	C182 D183 E221 A222 A223 F227 W228 N229 L264	C182-H225 HydrophobicContact CB-CB 4.33Å; D183-H225 IonicContact OD1-CD2 3.43Å; D183-H225 PolarHBondContact OD1-CD2 3.14Å; D183-H225 IonicContact OD1-CE1 3.01Å; D183-H225 IonicContact OD1-NE2 3.87Å; D183-H225 PolarHBondContact OD1-NE2 3.12Å; D183-H225 IonicContact OD2-NE2 2.61Å; E221-H225 WeakPolarHBondContact O-CB 3.39Å; E221-H225 PolarHBondContact O-N 3.3Å; A222-H225 PolarHBondContact O-N 2.94Å; A223-H225 VanDerWaalsContact C-N 3.33Å; H225-F227 VanDerWaalsContact C-N 3.34Å; H225-F227 PolarHBondContact O-N 3.43Å; H225-W228 AromaticContact CE1-CE3 4Å; H225-W228 AromaticContact CE1-CZ3 3.61Å; H225-W228 AromaticContact NE2-CZ3 3.9Å; H225-W228 PolarHBondContact O-N 3.08Å; H225-N229 WeakPolarHBondContact O-CB 3.43Å; H225-N229 PolarHBondContact O-N 3.34Å; H225-L264 HydrophobicContact CB-CD2 4.16Å
226	I	94.4	Very high	91.9	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-60.1	-45.9	173.5	-65.3	169.3	0	0	0	110.4	I169 C182 A185 A186 F207 L208 A222 N229 F230 I233	I169-I226 HydrophobicContact CD1-CD1 4.1Å; C182-I226 HydrophobicContact CB-CD1 4.44Å; C182-I226 HydrophobicContact CB-CG1 3.66Å; A185-I226 HydrophobicContact CB-CD1 4.23Å; A186-I226 HydrophobicContact CB-CG2 4.33Å; F207-I226 HydrophobicContact CD1-CD1 4.22Å; F207-I226 HydrophobicContact CE1-CD1 3.78Å; L208-I226 HydrophobicContact CD2-CB 3.95Å; L208-I226 HydrophobicContact CD2-CD1 4.27Å; L208-I226 HydrophobicContact CD2-CG2 4.03Å; A222-I226 WeakPolarHBondContact O-CG1 3.48Å; A222-I226 PolarHBondContact O-N 2.92Å; I226-N229 PolarHBondContact O-N 2.89Å; I226-F230 PolarHBondContact O-N 2.94Å; I226-I233 HydrophobicContact CG2-CD1 4.07Å
227	F	94.3	Very high	91.6	Very high	1 Å²	1	21.6 Å²	21.6	0%	0.004	12%	0.119	C	C	.	.	H	α-helix	trans	-71.1	-29.1	-178	-177.6	-116.7	0	0	0	113.4	A223 L224 H225 F230 P231 I233 F234 I245 M248 L249 A268 F272	A223-F227 WeakPolarHBondContact O-CB 3.38Å; A223-F227 PolarHBondContact O-N 2.61Å; A223-F227 VanDerWaalsContact O-N 3.13Å; L224-F227 PolarHBondContact O-N 3.06Å; H225-F227 VanDerWaalsContact C-N 3.34Å; H225-F227 PolarHBondContact O-N 3.43Å; F227-F230 CarbonylContact O-C 3.46Å; F227-P231 HydrophobicContact CE2-CB 4.22Å; F227-P231 WeakPolarHBondContact CE2-O 3.47Å; F227-P231 VanDerWaalsContact O-CA 3.31Å; F227-P231 WeakPolarHBondContact O-CA 3.45Å; F227-P231 WeakPolarHBondContact O-CG 3.26Å; F227-I233 HydrophobicContact CD2-CG2 4.2Å; F227-F234 HydrophobicContact CD2-CE2 4.14Å; F227-F234 HydrophobicContact CE2-CD2 4.38Å; F227-F234 AromaticContact CE2-CE2 3.64Å; F227-F234 HydrophobicContact CE2-CE2 3.64Å; F227-F234 HydrophobicContact CZ-CE2 4.45Å; F227-I245 HydrophobicContact CE1-CG2 4.01Å; F227-I245 HydrophobicContact CE2-CG2 4.48Å; F227-I245 HydrophobicContact CZ-CG2 3.6Å; F227-M248 HydrophobicContact CD1-CE 3.64Å; F227-M248 HydrophobicContact CE1-CE 3.9Å; F227-M248 HydrophobicContact CG-CE 4.23Å; F227-L249 HydrophobicContact CD1-CD2 4.36Å; F227-L249 HydrophobicContact CE1-CD1 4.2Å; F227-L249 HydrophobicContact CE1-CD2 4.1Å; F227-L249 HydrophobicContact CE1-CG 4.45Å; F227-A268 HydrophobicContact CD1-CB 4.02Å; F227-F272 HydrophobicContact CE1-CB 4.22Å; F227-F272 HydrophobicContact CE1-CD2 4.49Å; F227-F272 HydrophobicContact CE1-CG 4.47Å; F227-F272 AromaticContact CE2-CD2 3.96Å; F227-F272 HydrophobicContact CE2-CD2 3.96Å; F227-F272 HydrophobicContact CE2-CE2 4.49Å; F227-F272 HydrophobicContact CZ-CB 3.94Å; F227-F272 AromaticContact CZ-CD2 3.45Å; F227-F272 HydrophobicContact CZ-CD2 3.45Å; F227-F272 VanDerWaalsContact CZ-CD2 3.45Å; F227-F272 HydrophobicContact CZ-CE2 4.14Å; F227-F272 AromaticContact CZ-CG 3.81Å; F227-F272 HydrophobicContact CZ-CG 3.81Å
228	W	92.4	Very high	91.3	Very high	34 Å²	34	20.6 Å²	20.6	13%	0.129	11%	0.112	C	C	.	.	H	α-helix	trans	-69.2	-38.2	169.2	165.1	59.2	0	0	0	112.3	L224 H225 L264 R267 A268 S271 Q737	L224-W228 VanDerWaalsContact O-CB 3.23Å; L224-W228 WeakPolarHBondContact O-CB 3.5Å; L224-W228 PolarHBondContact O-N 2.97Å; H225-W228 AromaticContact CE1-CE3 4Å; H225-W228 AromaticContact CE1-CZ3 3.61Å; H225-W228 AromaticContact NE2-CZ3 3.9Å; H225-W228 PolarHBondContact O-N 3.08Å; W228-L264 HydrophobicContact CE3-CD1 4.43Å; W228-R267 HydrophobicContact CG-CB 4.42Å; W228-A268 HydrophobicContact CB-CB 3.91Å; W228-S271 PolarHBondContact O-OG 3.08Å; W228-S271 VanDerWaalsContact O-OG 3.05Å; W228-Q737 VanDerWaalsContact CE3-NE2 3.32Å; W228-Q737 VanDerWaalsContact CZ2-NE2 3.29Å
229	N	89.3	Confident	91	Very high	6 Å²	6	26 Å²	26	3%	0.032	14%	0.135	C	C	.	.	H	α-helix	trans	-73.2	-41.3	179.4	-170.5	-41.8	0	0	0	111.8	D183 A186 R190 H225 I226 Q737	D183-N229 PolarHBondContact OD1-ND2 3.09Å; A186-N229 HydrophobicContact CB-CB 3.68Å; R190-N229 PolarHBondContact NH2-O 2.84Å; R190-N229 VanDerWaalsContact NH2-O 3.07Å; R190-N229 PolarHBondContact NH2-OD1 3.28Å; H225-N229 WeakPolarHBondContact O-CB 3.43Å; H225-N229 PolarHBondContact O-N 3.34Å; I226-N229 PolarHBondContact O-N 2.89Å; N229-Q737 VanDerWaalsContact CG-CD 3.5Å; N229-Q737 VanDerWaalsContact ND2-CD 3.31Å; N229-Q737 PolarHBondContact ND2-OE1 2.59Å
230	F	91.5	Very high	90.7	Very high	18 Å²	18	32.1 Å²	32.1	8%	0.079	16%	0.163	C	C	.	.			trans	-133.7	89	175.4	-177.9	-132.6	0	0	0	112	A186 C189 R190 I193 I226 F227 G232 I233	A186-F230 HydrophobicContact CB-CB 4.13Å; C189-F230 HydrophobicContact CB-CD1 4.29Å; R190-F230 HydrophobicContact CB-CD1 4.25Å; R190-F230 HydrophobicContact CB-CD2 4.22Å; R190-F230 HydrophobicContact CB-CE1 4.24Å; R190-F230 HydrophobicContact CB-CE2 4.25Å; R190-F230 HydrophobicContact CB-CG 4.25Å; R190-F230 HydrophobicContact CB-CZ 4.27Å; R190-F230 HydrophobicContact CG-CD2 4.21Å; R190-F230 HydrophobicContact CG-CE2 4.04Å; R190-F230 HydrophobicContact CG-CZ 4.37Å; I193-F230 HydrophobicContact CD1-CE1 4.24Å; I193-F230 HydrophobicContact CD1-CZ 4.27Å; I193-F230 HydrophobicContact CG1-CE1 4.18Å; I193-F230 HydrophobicContact CG1-CZ 3.84Å; I226-F230 PolarHBondContact O-N 2.94Å; F227-F230 CarbonylContact O-C 3.46Å; F230-G232 VanDerWaalsContact C-N 3.29Å; F230-G232 PolarHBondContact O-N 3.38Å; F230-I233 HydrophobicContact CD1-CB 3.85Å; F230-I233 HydrophobicContact CD1-CG1 3.96Å; F230-I233 VanDerWaalsContact CE1-CA 3.47Å; F230-I233 HydrophobicContact CE1-CB 4.07Å; F230-I233 HydrophobicContact CE1-CG1 4.19Å
231	P	90.1	Very high	90.5	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.006	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-70.4	-24.9	179.4	-16.6	29.4	0	0	0	113.5	F227 I233 S271 F272	F227-P231 HydrophobicContact CE2-CB 4.22Å; F227-P231 WeakPolarHBondContact CE2-O 3.47Å; F227-P231 VanDerWaalsContact O-CA 3.31Å; F227-P231 WeakPolarHBondContact O-CA 3.45Å; F227-P231 WeakPolarHBondContact O-CG 3.26Å; P231-I233 PolarHBondContact O-N 3.41Å; P231-S271 WeakPolarHBondContact CG-OG 3.42Å; P231-F272 HydrophobicContact CB-CB 3.99Å; P231-F272 HydrophobicContact CB-CD2 3.86Å; P231-F272 HydrophobicContact CB-CG 4.43Å
232	G	88.6	Confident	90.3	Very high	23 Å²	23	32.3 Å²	32.3	24%	0.237	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-69.3	4.5	178.5	0	0	0	0	0	115.2	F230 F234 G235	F230-G232 VanDerWaalsContact C-N 3.29Å; F230-G232 PolarHBondContact O-N 3.38Å; G232-F234 PolarHBondContact O-N 2.7Å; G232-G235 PolarHBondContact O-N 3.14Å
233	I	91.3	Very high	90.2	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-54.4	-21.8	-170.8	-154.1	172.4	0	0	0	115.2	C189 N199 V204 L205 L208 I226 F227 F230 P231	C189-I233 HydrophobicContact CB-CD1 4.3Å; C189-I233 HydrophobicContact CB-CG1 4.31Å; C189-I233 WeakPolarHBondContact SG-CG1 3.44Å; N199-I233 PolarHBondContact ND2-O 2.85Å; V204-I233 HydrophobicContact CG1-CD1 3.65Å; V204-I233 HydrophobicContact CG1-CG1 4.12Å; V204-I233 HydrophobicContact CG2-CD1 4.14Å; L205-I233 HydrophobicContact CD2-CB 4.35Å; L205-I233 HydrophobicContact CD2-CD1 4.33Å; L205-I233 HydrophobicContact CD2-CG1 3.93Å; L205-I233 HydrophobicContact CD2-CG2 3.87Å; L208-I233 HydrophobicContact CD1-CD1 3.74Å; L208-I233 HydrophobicContact CD1-CG2 3.97Å; I226-I233 HydrophobicContact CG2-CD1 4.07Å; F227-I233 HydrophobicContact CD2-CG2 4.2Å; F230-I233 HydrophobicContact CD1-CB 3.85Å; F230-I233 HydrophobicContact CD1-CG1 3.96Å; F230-I233 VanDerWaalsContact CE1-CA 3.47Å; F230-I233 HydrophobicContact CE1-CB 4.07Å; F230-I233 HydrophobicContact CE1-CG1 4.19Å; P231-I233 PolarHBondContact O-N 3.41Å
234	F	89.3	Confident	90	Very high	3 Å²	3	41.4 Å²	41.4	1%	0.013	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-84.2	-15.7	179.5	-56.7	-76.6	0	0	0	114.3	L205 F209 F227 G232 Q237 Q238 Y241 I245	L205-F234 HydrophobicContact CD1-CD1 4.34Å; L205-F234 HydrophobicContact CD2-CD1 3.75Å; L205-F234 HydrophobicContact CD2-CE1 3.78Å; F209-F234 HydrophobicContact CE1-CE1 4.36Å; F209-F234 HydrophobicContact CE1-CZ 4.39Å; F209-F234 AromaticContact CE2-CE1 3.94Å; F209-F234 HydrophobicContact CE2-CE1 3.94Å; F209-F234 AromaticContact CZ-CE1 3.49Å; F209-F234 HydrophobicContact CZ-CE1 3.49Å; F209-F234 VanDerWaalsContact CZ-CE1 3.49Å; F209-F234 AromaticContact CZ-CZ 3.93Å; F209-F234 HydrophobicContact CZ-CZ 3.93Å; F227-F234 HydrophobicContact CD2-CE2 4.14Å; F227-F234 HydrophobicContact CE2-CD2 4.38Å; F227-F234 AromaticContact CE2-CE2 3.64Å; F227-F234 HydrophobicContact CE2-CE2 3.64Å; F227-F234 HydrophobicContact CZ-CE2 4.45Å; G232-F234 PolarHBondContact O-N 2.7Å; F234-Q237 WeakPolarHBondContact O-CA 3.44Å; F234-Q237 WeakPolarHBondContact O-CB 3.2Å; F234-Q237 PolarHBondContact O-N 3.24Å; F234-Q238 HydrophobicContact CB-CB 3.9Å; F234-Q238 HydrophobicContact CB-CG 4.48Å; F234-Y241 AromaticContact CD1-CD2 3.64Å; F234-Y241 HydrophobicContact CD1-CD2 3.64Å; F234-Y241 HydrophobicContact CD1-CE2 4.37Å; F234-Y241 AromaticContact CD1-CG 3.96Å; F234-Y241 HydrophobicContact CD1-CG 3.96Å; F234-Y241 HydrophobicContact CE1-CD2 4.31Å; F234-Y241 HydrophobicContact CE1-CG 4.22Å; F234-Y241 HydrophobicContact CG-CD2 4.39Å; F234-I245 HydrophobicContact CD2-CD1 3.48Å; F234-I245 VanDerWaalsContact CD2-CD1 3.48Å; F234-I245 HydrophobicContact CD2-CG1 4.24Å; F234-I245 HydrophobicContact CE2-CD1 3.33Å; F234-I245 HydrophobicContact CE2-CG1 3.57Å; F234-I245 HydrophobicContact CG-CD1 4.18Å; F234-I245 HydrophobicContact CZ-CD1 3.94Å; F234-I245 HydrophobicContact CZ-CG1 3.76Å
235	G	87.1	Confident	89.8	Confident	22 Å²	22	41.4 Å²	41.4	23%	0.227	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	48.6	-138.9	-172.5	0	0	0	0	0	112.4	G197 G232 Q237 Q238	G197-G235 CarbonylContact O-C 3.6Å; G197-G235 VanDerWaalsContact O-CA 3.27Å; G197-G235 WeakPolarHBondContact O-CA 3.49Å; G232-G235 PolarHBondContact O-N 3.14Å; G235-Q237 PolarHBondContact O-N 3.15Å; G235-Q238 VanDerWaalsContact O-CB 3.27Å; G235-Q238 WeakPolarHBondContact O-CB 3.49Å; G235-Q238 PolarHBondContact O-N 2.94Å
236	N	86.6	Confident	89.8	Confident	102 Å²	102	42.2 Å²	42.2	55%	0.545	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-53.9	-22	174.4	-73.4	-25.5	0	0	0	115	D196 G197 N198 Q238	D196-N236 PolarHBondContact O-ND2 2.78Å; G197-N236 PolarHBondContact O-N 3.44Å; N198-N236 PolarHBondContact OD1-ND2 3.06Å; N236-Q238 VanDerWaalsContact C-N 3.27Å; N236-Q238 PolarHBondContact O-N 3.01Å
237	Q	84.9	Confident	89.7	Confident	82 Å²	82	50.9 Å²	50.9	38%	0.383	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-81.1	-4.3	179	-53.2	-173.1	13.1	0	0	113	F234 G235 Q239 H240 Y241	F234-Q237 WeakPolarHBondContact O-CA 3.44Å; F234-Q237 WeakPolarHBondContact O-CB 3.2Å; F234-Q237 PolarHBondContact O-N 3.24Å; G235-Q237 PolarHBondContact O-N 3.15Å; Q237-Q239 PolarHBondContact O-N 3.46Å; Q237-Q239 VanDerWaalsContact O-N 3.16Å; Q237-H240 WeakPolarHBondContact O-CA 3.47Å; Q237-H240 WeakPolarHBondContact O-CB 3.32Å; Q237-H240 PolarHBondContact O-N 3.14Å; Q237-Y241 HydrophobicContact CB-CD2 4.04Å; Q237-Y241 HydrophobicContact CB-CE2 3.8Å; Q237-Y241 WeakPolarHBondContact O-CD2 3.4Å; Q237-Y241 PolarHBondContact O-N 3.41Å
238	Q	86.6	Confident	89.6	Confident	22 Å²	22	51.6 Å²	51.6	10%	0.103	25%	0.25	C	C	.	.	H	α-helix	trans	-51.7	-41.3	-178.5	-173.9	173.2	-80.1	0	0	113.1	F234 G235 N236 H240 Y241 L242 I245 F272 N276	F234-Q238 HydrophobicContact CB-CB 3.9Å; F234-Q238 HydrophobicContact CB-CG 4.48Å; G235-Q238 VanDerWaalsContact O-CB 3.27Å; G235-Q238 WeakPolarHBondContact O-CB 3.49Å; G235-Q238 PolarHBondContact O-N 2.94Å; N236-Q238 VanDerWaalsContact C-N 3.27Å; N236-Q238 PolarHBondContact O-N 3.01Å; Q238-H240 PolarHBondContact O-N 3.26Å; Q238-Y241 PolarHBondContact O-N 3.29Å; Q238-Y241 VanDerWaalsContact O-N 3.17Å; Q238-L242 HydrophobicContact CG-CD1 4.45Å; Q238-L242 PolarHBondContact O-N 2.9Å; Q238-I245 HydrophobicContact CG-CD1 4.44Å; Q238-F272 HydrophobicContact CG-CE2 4.31Å; Q238-F272 HydrophobicContact CG-CZ 4.26Å; Q238-N276 PolarHBondContact NE2-OD1 2.7Å
239	Q	85.3	Confident	89.7	Confident	121 Å²	121	50 Å²	50	57%	0.565	24%	0.244	S	C	*	.	H	α-helix	trans	-62.4	-27.2	177.7	-66.7	-64	-19.7	0	0	113.3	Q237	Q237-Q239 PolarHBondContact O-N 3.46Å; Q237-Q239 VanDerWaalsContact O-N 3.16Å
240	H	88.1	Confident	89.9	Confident	150 Å²	150	51.8 Å²	51.8	69%	0.694	26%	0.255	S	S	*	.	H	α-helix	trans	-77.5	-35.3	176.1	-172.5	59.4	0	0	0	112.5	Q237 Q238	Q237-H240 WeakPolarHBondContact O-CA 3.47Å; Q237-H240 WeakPolarHBondContact O-CB 3.32Å; Q237-H240 PolarHBondContact O-N 3.14Å; Q238-H240 PolarHBondContact O-N 3.26Å
241	Y	89.2	Confident	89.9	Confident	56 Å²	56	55.3 Å²	55.3	22%	0.22	27%	0.271	C	S	.	.	H	α-helix	trans	-92.8	-3.5	-176.8	-65.1	-70.3	0	0	0	114.3	F209 F234 Q237 Q238 E243 V244 I245	F209-Y241 AromaticContact CE2-CD1 3.73Å; F209-Y241 HydrophobicContact CE2-CD1 3.73Å; F209-Y241 AromaticContact CE2-CE1 3.87Å; F209-Y241 HydrophobicContact CE2-CE1 3.87Å; F209-Y241 HydrophobicContact CE2-CG 4.38Å; F209-Y241 AromaticContact CZ-CD1 3.68Å; F209-Y241 HydrophobicContact CZ-CD1 3.68Å; F209-Y241 HydrophobicContact CZ-CE1 4.3Å; F209-Y241 HydrophobicContact CZ-CG 4.1Å; F234-Y241 AromaticContact CD1-CD2 3.64Å; F234-Y241 HydrophobicContact CD1-CD2 3.64Å; F234-Y241 HydrophobicContact CD1-CE2 4.37Å; F234-Y241 AromaticContact CD1-CG 3.96Å; F234-Y241 HydrophobicContact CD1-CG 3.96Å; F234-Y241 HydrophobicContact CE1-CD2 4.31Å; F234-Y241 HydrophobicContact CE1-CG 4.22Å; F234-Y241 HydrophobicContact CG-CD2 4.39Å; Q237-Y241 HydrophobicContact CB-CD2 4.04Å; Q237-Y241 HydrophobicContact CB-CE2 3.8Å; Q237-Y241 WeakPolarHBondContact O-CD2 3.4Å; Q237-Y241 PolarHBondContact O-N 3.41Å; Q238-Y241 PolarHBondContact O-N 3.29Å; Q238-Y241 VanDerWaalsContact O-N 3.17Å; Y241-E243 PolarHBondContact O-N 3.25Å; Y241-V244 WeakPolarHBondContact O-CA 3.19Å; Y241-V244 VanDerWaalsContact O-CB 3.31Å; Y241-V244 WeakPolarHBondContact O-CB 3.28Å; Y241-V244 PolarHBondContact O-N 3.22Å; Y241-I245 WeakPolarHBondContact O-CG1 2.92Å; Y241-I245 PolarHBondContact O-N 2.81Å
242	L	90.1	Very high	90	Very high	21 Å²	21	55.5 Å²	55.5	11%	0.11	27%	0.272	C	S	.	.	H	α-helix	trans	-48	-50.7	-170.9	-156.2	75.3	0	0	0	114.5	Q238 V244 I245 K246 F272 L282 F286	Q238-L242 HydrophobicContact CG-CD1 4.45Å; Q238-L242 PolarHBondContact O-N 2.9Å; L242-V244 VanDerWaalsContact C-N 3.3Å; L242-V244 PolarHBondContact O-N 2.56Å; L242-I245 PolarHBondContact O-N 3.49Å; L242-K246 PolarHBondContact O-N 3.47Å; L242-F272 HydrophobicContact CD1-CZ 4.44Å; L242-L282 HydrophobicContact CD1-CD1 3.87Å; L242-L282 HydrophobicContact CD1-CG 4.22Å; L242-F286 HydrophobicContact CD1-CE2 3.57Å; L242-F286 HydrophobicContact CD1-CZ 3.93Å; L242-F286 HydrophobicContact CD2-CE2 4.23Å; L242-F286 HydrophobicContact CG-CE2 3.64Å; L242-F286 HydrophobicContact CG-CZ 4.08Å
243	E	91.6	Very high	90.2	Very high	126 Å²	126	55.2 Å²	55.2	59%	0.589	27%	0.265	S	S	*	.	H	α-helix	trans	-64.4	-32.3	177.3	-68.7	-71	171.4	0	0	112.9	Y241 R247 H285	Y241-E243 PolarHBondContact O-N 3.25Å; E243-R247 VanDerWaalsContact O-CB 3.24Å; E243-R247 WeakPolarHBondContact O-CB 3.21Å; E243-R247 PolarHBondContact O-N 2.75Å; E243-H285 IonicContact OE1-CE1 2.89Å; E243-H285 PolarHBondContact OE1-CE1 3.49Å; E243-H285 IonicContact OE1-NE2 3.71Å
244	V	90.4	Very high	90.2	Very high	68 Å²	68	61.7 Å²	61.7	41%	0.412	30%	0.295	S	S	.	.	H	α-helix	trans	-73.2	-43.2	178.6	-168.9	0	0	0	0	110.1	F209 Y241 L242 R247 M248	F209-V244 HydrophobicContact CD1-CG1 3.83Å; F209-V244 HydrophobicContact CE1-CB 4.15Å; F209-V244 HydrophobicContact CE1-CG1 3.45Å; F209-V244 VanDerWaalsContact CE1-CG1 3.45Å; F209-V244 HydrophobicContact CZ-CB 4.49Å; F209-V244 HydrophobicContact CZ-CG1 4.13Å; Y241-V244 WeakPolarHBondContact O-CA 3.19Å; Y241-V244 VanDerWaalsContact O-CB 3.31Å; Y241-V244 WeakPolarHBondContact O-CB 3.28Å; Y241-V244 PolarHBondContact O-N 3.22Å; L242-V244 VanDerWaalsContact C-N 3.3Å; L242-V244 PolarHBondContact O-N 2.56Å; V244-R247 PolarHBondContact O-N 3.37Å; V244-M248 VanDerWaalsContact O-CB 3.29Å; V244-M248 WeakPolarHBondContact O-CB 3.37Å; V244-M248 PolarHBondContact O-N 2.65Å
245	I	91.9	Very high	90.3	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-60.3	-50.4	174.7	-59.7	163	0	0	0	109.8	F227 F234 Q238 Y241 L242 R247 M248 L249 F272 F286	F227-I245 HydrophobicContact CE1-CG2 4.01Å; F227-I245 HydrophobicContact CE2-CG2 4.48Å; F227-I245 HydrophobicContact CZ-CG2 3.6Å; F234-I245 HydrophobicContact CD2-CD1 3.48Å; F234-I245 VanDerWaalsContact CD2-CD1 3.48Å; F234-I245 HydrophobicContact CD2-CG1 4.24Å; F234-I245 HydrophobicContact CE2-CD1 3.33Å; F234-I245 HydrophobicContact CE2-CG1 3.57Å; F234-I245 HydrophobicContact CG-CD1 4.18Å; F234-I245 HydrophobicContact CZ-CD1 3.94Å; F234-I245 HydrophobicContact CZ-CG1 3.76Å; Q238-I245 HydrophobicContact CG-CD1 4.44Å; Y241-I245 WeakPolarHBondContact O-CG1 2.92Å; Y241-I245 PolarHBondContact O-N 2.81Å; L242-I245 PolarHBondContact O-N 3.49Å; I245-R247 PolarHBondContact O-N 2.77Å; I245-M248 WeakPolarHBondContact O-CB 3.13Å; I245-M248 PolarHBondContact O-N 3.42Å; I245-L249 HydrophobicContact CG2-CD1 4.07Å; I245-L249 WeakPolarHBondContact O-CG 3.44Å; I245-L249 PolarHBondContact O-N 2.9Å; I245-F272 HydrophobicContact CD1-CE2 4.39Å; I245-F272 HydrophobicContact CD1-CZ 4.37Å; I245-F272 HydrophobicContact CG2-CZ 4.44Å; I245-F286 HydrophobicContact CB-CZ 4.5Å; I245-F286 HydrophobicContact CG2-CE1 4.13Å; I245-F286 HydrophobicContact CG2-CZ 4.34Å
246	K	93.3	Very high	90.1	Very high	30 Å²	30	67.7 Å²	67.7	13%	0.13	32%	0.319	C	S	.	.	H	α-helix	trans	-57.7	-48.8	177.3	-178.3	173.3	176.6	176.7	0	111.5	L242 M248 L249 V250 H285 F286 D288 L289	L242-K246 PolarHBondContact O-N 3.47Å; K246-M248 VanDerWaalsContact C-N 3.34Å; K246-M248 PolarHBondContact O-N 3.07Å; K246-L249 PolarHBondContact O-N 2.75Å; K246-V250 WeakPolarHBondContact O-CG2 3.08Å; K246-V250 PolarHBondContact O-N 3.1Å; K246-H285 VanDerWaalsContact CD-NE2 3.3Å; K246-H285 WeakPolarHBondContact CD-NE2 3.3Å; K246-H285 WeakPolarHBondContact CE-O 3.23Å; K246-H285 PolarHBondContact NZ-O 3.22Å; K246-F286 HydrophobicContact CB-CE1 4.1Å; K246-F286 HydrophobicContact CB-CZ 4.04Å; K246-D288 WeakPolarHBondContact CE-OD2 3.43Å; K246-D288 IonicContact NZ-OD2 2.81Å; K246-D288 PolarHBondContact NZ-OD2 3.28Å; K246-L289 HydrophobicContact CG-CD2 4.43Å
247	R	91.4	Very high	90.2	Very high	182 Å²	182	66.8 Å²	66.8	69%	0.687	33%	0.325	S	S	*	.	H	α-helix	trans	-61.2	-40.6	178.6	-178	177.1	175.4	-177.3	-1.8	112.7	E243 V244 I245 Q251	E243-R247 VanDerWaalsContact O-CB 3.24Å; E243-R247 WeakPolarHBondContact O-CB 3.21Å; E243-R247 PolarHBondContact O-N 2.75Å; V244-R247 PolarHBondContact O-N 3.37Å; I245-R247 PolarHBondContact O-N 2.77Å; R247-Q251 WeakPolarHBondContact O-CB 3.34Å; R247-Q251 PolarHBondContact O-N 3.21Å
248	M	92.6	Very high	90.4	Very high	17 Å²	17	64.7 Å²	64.7	8%	0.084	32%	0.317	C	S	.	.	H	α-helix	trans	-57.9	-53.1	175.9	177.7	-172.9	77.1	0	0	111	V212 F227 V244 I245 K246 Q251 C252	V212-M248 HydrophobicContact CB-CG 4.14Å; V212-M248 HydrophobicContact CB-SD 4.14Å; V212-M248 HydrophobicContact CG1-CG 3.77Å; V212-M248 HydrophobicContact CG1-SD 3.86Å; V212-M248 HydrophobicContact CG2-CG 3.51Å; V212-M248 HydrophobicContact CG2-SD 3.95Å; F227-M248 HydrophobicContact CD1-CE 3.64Å; F227-M248 HydrophobicContact CE1-CE 3.9Å; F227-M248 HydrophobicContact CG-CE 4.23Å; V244-M248 VanDerWaalsContact O-CB 3.29Å; V244-M248 WeakPolarHBondContact O-CB 3.37Å; V244-M248 PolarHBondContact O-N 2.65Å; I245-M248 WeakPolarHBondContact O-CB 3.13Å; I245-M248 PolarHBondContact O-N 3.42Å; K246-M248 VanDerWaalsContact C-N 3.34Å; K246-M248 PolarHBondContact O-N 3.07Å; M248-Q251 PolarHBondContact O-N 3.16Å; M248-C252 PolarHBondContact O-N 3.49Å; M248-C252 PolarHBondContact O-SG 2.91Å
249	L	94.6	Very high	90.5	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-63.2	-44.1	-178.9	-65.5	170.3	0	0	0	112.1	L224 F227 I245 K246 Q251 C252 M253 A268 A269 F286 L289	L224-L249 HydrophobicContact CD2-CD2 4.42Å; F227-L249 HydrophobicContact CD1-CD2 4.36Å; F227-L249 HydrophobicContact CE1-CD1 4.2Å; F227-L249 HydrophobicContact CE1-CD2 4.1Å; F227-L249 HydrophobicContact CE1-CG 4.45Å; I245-L249 HydrophobicContact CG2-CD1 4.07Å; I245-L249 WeakPolarHBondContact O-CG 3.44Å; I245-L249 PolarHBondContact O-N 2.9Å; K246-L249 PolarHBondContact O-N 2.75Å; L249-Q251 PolarHBondContact O-N 3.06Å; L249-C252 PolarHBondContact O-N 3.1Å; L249-M253 HydrophobicContact CB-CE 4.48Å; L249-M253 WeakPolarHBondContact O-CG 3.2Å; L249-M253 PolarHBondContact O-N 3.09Å; L249-A268 HydrophobicContact CD2-CB 4.09Å; L249-A269 HydrophobicContact CD1-CB 4.03Å; L249-A269 HydrophobicContact CD2-CB 4.32Å; L249-F286 HydrophobicContact CD1-CE1 4.34Å; L249-L289 HydrophobicContact CB-CD1 4.11Å; L249-L289 HydrophobicContact CB-CD2 4.08Å; L249-L289 HydrophobicContact CD1-CD1 3.74Å
250	V	93.3	Very high	90.6	Very high	43 Å²	43	64.2 Å²	64.2	26%	0.261	32%	0.319	S	S	.	.	H	α-helix	trans	-56.2	-49.4	173.6	172.5	0	0	0	0	111.1	K246 C252 M253 Q254 L289	K246-V250 WeakPolarHBondContact O-CG2 3.08Å; K246-V250 PolarHBondContact O-N 3.1Å; V250-C252 PolarHBondContact O-N 3.22Å; V250-M253 PolarHBondContact O-N 2.98Å; V250-Q254 WeakPolarHBondContact O-CB 3.28Å; V250-Q254 VanDerWaalsContact O-CG 3.28Å; V250-Q254 WeakPolarHBondContact O-CG 3.47Å; V250-Q254 PolarHBondContact O-N 3.32Å; V250-L289 HydrophobicContact CB-CD2 4.46Å; V250-L289 HydrophobicContact CG2-CD2 3.41Å; V250-L289 VanDerWaalsContact CG2-CD2 3.41Å
251	Q	91.6	Very high	90.8	Very high	93 Å²	93	57.1 Å²	57.1	44%	0.435	29%	0.286	S	S	.	.	H	α-helix	trans	-64.5	-40.6	-176.1	-177.5	175.3	-43.5	0	0	111.9	R247 M248 L249 Q254 D255	R247-Q251 WeakPolarHBondContact O-CB 3.34Å; R247-Q251 PolarHBondContact O-N 3.21Å; M248-Q251 PolarHBondContact O-N 3.16Å; L249-Q251 PolarHBondContact O-N 3.06Å; Q251-Q254 PolarHBondContact O-N 2.77Å; Q251-D255 PolarHBondContact O-N 3.04Å
252	C	93.3	Very high	91	Very high	4 Å²	4	55.4 Å²	55.4	3%	0.027	28%	0.279	C	S	.	.	H	α-helix	trans	-70.6	-41.5	178.1	-68.7	0	0	0	0	112.6	V212 L224 M248 L249 V250 Q254 D255 I261 A265	V212-C252 VanDerWaalsContact CG2-SG 3.57Å; L224-C252 HydrophobicContact CD1-CB 3.99Å; L224-C252 HydrophobicContact CD2-CB 4.37Å; M248-C252 PolarHBondContact O-N 3.49Å; M248-C252 PolarHBondContact O-SG 2.91Å; L249-C252 PolarHBondContact O-N 3.1Å; V250-C252 PolarHBondContact O-N 3.22Å; C252-Q254 PolarHBondContact O-N 3.3Å; C252-D255 WeakPolarHBondContact O-CB 3.42Å; C252-D255 PolarHBondContact O-N 3.24Å; C252-D255 VanDerWaalsContact O-N 3.09Å; C252-I261 HydrophobicContact CB-CG2 3.77Å; C252-A265 HydrophobicContact CB-CB 3.53Å
253	M	92.4	Very high	91.1	Very high	18 Å²	18	55.1 Å²	55.1	9%	0.089	28%	0.278	C	S	.	.	H	α-helix	trans	-65.2	-22.9	173.2	-71.7	-171.2	-69.4	0	0	113.2	L249 V250 R262 A265 A266 L289 I293	L249-M253 HydrophobicContact CB-CE 4.48Å; L249-M253 WeakPolarHBondContact O-CG 3.2Å; L249-M253 PolarHBondContact O-N 3.09Å; V250-M253 PolarHBondContact O-N 2.98Å; M253-R262 WeakPolarHBondContact O-CD 3.36Å; M253-R262 WeakPolarHBondContact O-CG 3.29Å; M253-A265 HydrophobicContact CG-CB 3.76Å; M253-A266 HydrophobicContact SD-CB 4.31Å; M253-L289 HydrophobicContact CE-CB 3.94Å; M253-L289 HydrophobicContact CE-CD2 3.63Å; M253-L289 HydrophobicContact CE-CG 4.27Å; M253-I293 HydrophobicContact SD-CG1 4.18Å
254	Q	90.9	Very high	91.2	Very high	135 Å²	135	49.5 Å²	49.5	63%	0.631	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-0.7	174.2	-71.2	177.5	3	0	0	114.1	V250 Q251 C252 Q256	V250-Q254 WeakPolarHBondContact O-CB 3.28Å; V250-Q254 VanDerWaalsContact O-CG 3.28Å; V250-Q254 WeakPolarHBondContact O-CG 3.47Å; V250-Q254 PolarHBondContact O-N 3.32Å; Q251-Q254 PolarHBondContact O-N 2.77Å; C252-Q254 PolarHBondContact O-N 3.3Å; Q254-Q256 PolarHBondContact O-N 3Å
255	D	90.4	Very high	91.4	Very high	24 Å²	24	46.2 Å²	46.2	13%	0.128	23%	0.233	C	C	.	.			trans	-72.2	89.7	178.3	-169.9	-17.8	0	0	0	111.5	R220 Q251 C252 A257 N258 I261 R262	R220-D255 IonicContact CZ-OD2 3.53Å; R220-D255 IonicContact NH1-OD2 3.69Å; R220-D255 PolarHBondContact NH1-OD2 2.89Å; R220-D255 IonicContact NH2-OD2 2.69Å; Q251-D255 PolarHBondContact O-N 3.04Å; C252-D255 WeakPolarHBondContact O-CB 3.42Å; C252-D255 PolarHBondContact O-N 3.24Å; C252-D255 VanDerWaalsContact O-N 3.09Å; D255-A257 PolarHBondContact O-N 3.28Å; D255-A257 WeakPolarHBondContact OD1-CA 3.47Å; D255-A257 WeakPolarHBondContact OD1-CB 3.47Å; D255-A257 PolarHBondContact OD1-N 2.88Å; D255-N258 VanDerWaalsContact CG-ND2 3.33Å; D255-N258 PolarHBondContact O-N 2.88Å; D255-N258 PolarHBondContact OD1-N 3.5Å; D255-N258 VanDerWaalsContact OD1-N 3.09Å; D255-N258 PolarHBondContact OD1-ND2 2.88Å; D255-N258 VanDerWaalsContact OD1-ND2 3.16Å; D255-N258 PolarHBondContact OD2-ND2 3.26Å; D255-I261 HydrophobicContact CB-CG2 4.15Å; D255-R262 WeakPolarHBondContact O-CD 3.41Å; D255-R262 WeakPolarHBondContact O-CG 3.49Å; D255-R262 PolarHBondContact O-NH1 3.14Å
256	Q	84.4	Confident	91.6	Very high	128 Å²	128	46.2 Å²	46.2	60%	0.598	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-23	176.3	-68.3	-62.4	-48.9	0	0	113.3	Q254 R262	Q254-Q256 PolarHBondContact O-N 3Å; Q256-R262 PolarHBondContact O-NH1 3.05Å
257	A	88	Confident	91.7	Very high	83 Å²	83	47.8 Å²	47.8	69%	0.686	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-24.4	-178.1	0	0	0	0	0	112.9	D255	D255-A257 PolarHBondContact O-N 3.28Å; D255-A257 WeakPolarHBondContact OD1-CA 3.47Å; D255-A257 WeakPolarHBondContact OD1-CB 3.47Å; D255-A257 PolarHBondContact OD1-N 2.88Å
258	N	89.8	Confident	91.8	Very high	38 Å²	38	39.1 Å²	39.1	20%	0.203	21%	0.205	C	C	.	.			trans	-128.3	89.8	-173.6	-56.7	-76.9	0	0	0	111.4	V217 R220 D255 H260 I261 R262	V217-N258 HydrophobicContact CG1-CB 4.47Å; V217-N258 WeakPolarHBondContact CG2-OD1 3.19Å; R220-N258 PolarHBondContact NH2-ND2 3.41Å; D255-N258 VanDerWaalsContact CG-ND2 3.33Å; D255-N258 PolarHBondContact O-N 2.88Å; D255-N258 PolarHBondContact OD1-N 3.5Å; D255-N258 VanDerWaalsContact OD1-N 3.09Å; D255-N258 PolarHBondContact OD1-ND2 2.88Å; D255-N258 VanDerWaalsContact OD1-ND2 3.16Å; D255-N258 PolarHBondContact OD2-ND2 3.26Å; N258-H260 VanDerWaalsContact C-N 3.32Å; N258-H260 PolarHBondContact O-N 3.49Å; N258-I261 HydrophobicContact CB-CB 3.98Å; N258-I261 HydrophobicContact CB-CG1 3.65Å; N258-I261 WeakPolarHBondContact O-CB 3.41Å; N258-I261 PolarHBondContact O-N 2.93Å; N258-I261 VanDerWaalsContact O-N 3.13Å; N258-R262 PolarHBondContact O-N 2.87Å
259	P	87.2	Confident	92	Very high	54 Å²	54	38.4 Å²	38.4	35%	0.351	20%	0.201	S	C	.	.	H	α-helix	trans	-55.2	-41	-179.6	-27.2	35.5	0	0	0	114.4	I261 R262 T263	P259-I261 VanDerWaalsContact C-N 3.27Å; P259-I261 PolarHBondContact O-N 3.07Å; P259-R262 WeakPolarHBondContact O-CB 3.23Å; P259-R262 PolarHBondContact O-N 3.48Å; P259-T263 PolarHBondContact O-N 3.22Å; P259-T263 VanDerWaalsContact O-N 3.09Å; P259-T263 PolarHBondContact O-OG1 3.47Å
260	H	88.2	Confident	92	Very high	79 Å²	79	38.4 Å²	38.4	37%	0.366	20%	0.201	S	C	.	.	H	α-helix	trans	-61.9	-33.3	179.5	-163.4	52.4	0	0	0	113	K179 E221 N258 R262 T263 L264	K179-H260 PolarHBondContact NZ-NE2 2.78Å; E221-H260 IonicContact OE1-CD2 2.66Å; N258-H260 VanDerWaalsContact C-N 3.32Å; N258-H260 PolarHBondContact O-N 3.49Å; H260-R262 VanDerWaalsContact C-N 3.33Å; H260-R262 PolarHBondContact O-N 3.31Å; H260-T263 PolarHBondContact O-N 3.14Å; H260-L264 WeakPolarHBondContact O-CB 3.45Å; H260-L264 PolarHBondContact O-N 2.94Å
261	I	92.7	Very high	92	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-64	-38.4	173.6	-66.3	-70.8	0	0	0	110.8	V217 R220 E221 L224 C252 D255 N258 P259 A265	V217-I261 HydrophobicContact CG1-CD1 4.2Å; V217-I261 HydrophobicContact CG1-CG1 4.07Å; R220-I261 HydrophobicContact CB-CD1 3.71Å; E221-I261 HydrophobicContact CB-CD1 4.39Å; E221-I261 HydrophobicContact CG-CD1 3.56Å; E221-I261 HydrophobicContact CG-CG1 4.47Å; L224-I261 HydrophobicContact CD1-CD1 4.31Å; L224-I261 HydrophobicContact CD1-CG2 4.02Å; C252-I261 HydrophobicContact CB-CG2 3.77Å; D255-I261 HydrophobicContact CB-CG2 4.15Å; N258-I261 HydrophobicContact CB-CB 3.98Å; N258-I261 HydrophobicContact CB-CG1 3.65Å; N258-I261 WeakPolarHBondContact O-CB 3.41Å; N258-I261 PolarHBondContact O-N 2.93Å; N258-I261 VanDerWaalsContact O-N 3.13Å; P259-I261 VanDerWaalsContact C-N 3.27Å; P259-I261 PolarHBondContact O-N 3.07Å; I261-A265 WeakPolarHBondContact O-CB 3.39Å; I261-A265 PolarHBondContact O-N 3.22Å
262	R	93	Very high	92.1	Very high	20 Å²	20	33 Å²	33	8%	0.075	18%	0.176	C	C	.	.	H	α-helix	trans	-66.8	-49.2	177	-57.9	-164.1	-64.8	-84.6	7.9	111.3	M253 D255 Q256 N258 P259 H260 L264 A265 A266 E299	M253-R262 WeakPolarHBondContact O-CD 3.36Å; M253-R262 WeakPolarHBondContact O-CG 3.29Å; D255-R262 WeakPolarHBondContact O-CD 3.41Å; D255-R262 WeakPolarHBondContact O-CG 3.49Å; D255-R262 PolarHBondContact O-NH1 3.14Å; Q256-R262 PolarHBondContact O-NH1 3.05Å; N258-R262 PolarHBondContact O-N 2.87Å; P259-R262 WeakPolarHBondContact O-CB 3.23Å; P259-R262 PolarHBondContact O-N 3.48Å; H260-R262 VanDerWaalsContact C-N 3.33Å; H260-R262 PolarHBondContact O-N 3.31Å; R262-L264 PolarHBondContact O-N 2.95Å; R262-A265 PolarHBondContact O-N 3.21Å; R262-A266 WeakPolarHBondContact O-CB 3.4Å; R262-A266 PolarHBondContact O-N 2.68Å; R262-E299 IonicContact CZ-OE2 2.56Å; R262-E299 VanDerWaalsContact CZ-OE2 3.22Å; R262-E299 IonicContact NE-OE2 2.62Å; R262-E299 PolarHBondContact NE-OE2 3.44Å; R262-E299 IonicContact NH2-OE2 3.57Å; R262-E299 PolarHBondContact NH2-OE2 3.28Å
263	T	92.3	Very high	92.1	Very high	15 Å²	15	32.8 Å²	32.8	9%	0.092	17%	0.174	C	C	.	.	H	α-helix	trans	-54.1	-51.1	176.1	-54.2	0	0	0	0	111.2	P259 H260 A266 R267 D305 V308	P259-T263 PolarHBondContact O-N 3.22Å; P259-T263 VanDerWaalsContact O-N 3.09Å; P259-T263 PolarHBondContact O-OG1 3.47Å; H260-T263 PolarHBondContact O-N 3.14Å; T263-A266 PolarHBondContact O-N 3.42Å; T263-R267 WeakPolarHBondContact O-CG 3.32Å; T263-R267 PolarHBondContact O-N 2.93Å; T263-D305 WeakPolarHBondContact CG2-OD2 3.47Å; T263-V308 HydrophobicContact CG2-CG2 3.5Å; T263-V308 VanDerWaalsContact CG2-CG2 3.5Å
264	L	92.9	Very high	92	Very high	8 Å²	8	33.4 Å²	33.4	4%	0.042	18%	0.178	C	C	.	.	H	α-helix	trans	-69.9	-35.6	-177.6	-170.3	60.5	0	0	0	112.4	E221 L224 H225 W228 H260 R262 R267 A268	E221-L264 HydrophobicContact CB-CD2 4.45Å; E221-L264 WeakPolarHBondContact O-CD2 3.45Å; L224-L264 HydrophobicContact CB-CD2 3.78Å; L224-L264 HydrophobicContact CB-CG 3.77Å; H225-L264 HydrophobicContact CB-CD2 4.16Å; W228-L264 HydrophobicContact CE3-CD1 4.43Å; H260-L264 WeakPolarHBondContact O-CB 3.45Å; H260-L264 PolarHBondContact O-N 2.94Å; R262-L264 PolarHBondContact O-N 2.95Å; L264-R267 PolarHBondContact O-N 3.23Å; L264-A268 VanDerWaalsContact O-CB 3.32Å; L264-A268 WeakPolarHBondContact O-CB 3.47Å; L264-A268 PolarHBondContact O-N 3.03Å
265	A	95.7	Very high	92	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-66.9	-34.6	173.3	0	0	0	0	0	112.9	L224 C252 M253 I261 R262 A269	L224-A265 HydrophobicContact CD1-CB 4.05Å; L224-A265 HydrophobicContact CD2-CB 4.19Å; C252-A265 HydrophobicContact CB-CB 3.53Å; M253-A265 HydrophobicContact CG-CB 3.76Å; I261-A265 WeakPolarHBondContact O-CB 3.39Å; I261-A265 PolarHBondContact O-N 3.22Å; R262-A265 PolarHBondContact O-N 3.21Å; A265-A269 VanDerWaalsContact O-CB 3.3Å; A265-A269 WeakPolarHBondContact O-CB 3.28Å; A265-A269 PolarHBondContact O-N 2.93Å
266	A	96.3	Very high	92	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-67.7	-44.4	173.9	0	0	0	0	0	111.7	M253 R262 T263 A269 A270 I293 A296 V308	M253-A266 HydrophobicContact SD-CB 4.31Å; R262-A266 WeakPolarHBondContact O-CB 3.4Å; R262-A266 PolarHBondContact O-N 2.68Å; T263-A266 PolarHBondContact O-N 3.42Å; A266-A269 PolarHBondContact O-N 2.91Å; A266-A270 WeakPolarHBondContact O-CB 3.46Å; A266-A270 PolarHBondContact O-N 3.23Å; A266-I293 HydrophobicContact CB-CG1 4.44Å; A266-A296 HydrophobicContact CB-CB 3.46Å; A266-A296 VanDerWaalsContact CB-CB 3.46Å; A266-V308 HydrophobicContact CB-CG1 3.73Å
267	R	94.6	Very high	92	Very high	63 Å²	63	29.1 Å²	29.1	24%	0.238	17%	0.165	C	C	.	.	H	α-helix	trans	-61.5	-42	172.9	-66.9	-178	75.5	-179.8	3.4	112.3	W228 T263 L264 A270 S271 V308	W228-R267 HydrophobicContact CG-CB 4.42Å; T263-R267 WeakPolarHBondContact O-CG 3.32Å; T263-R267 PolarHBondContact O-N 2.93Å; L264-R267 PolarHBondContact O-N 3.23Å; R267-A270 PolarHBondContact O-N 3.15Å; R267-S271 WeakPolarHBondContact O-CB 3.39Å; R267-S271 PolarHBondContact O-N 3.43Å; R267-V308 HydrophobicContact CG-CG2 4.24Å
268	A	94.8	Very high	91.8	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-64.5	-38.9	175.4	0	0	0	0	0	112.4	F227 W228 L249 L264 F272	F227-A268 HydrophobicContact CD1-CB 4.02Å; W228-A268 HydrophobicContact CB-CB 3.91Å; L249-A268 HydrophobicContact CD2-CB 4.09Å; L264-A268 VanDerWaalsContact O-CB 3.32Å; L264-A268 WeakPolarHBondContact O-CB 3.47Å; L264-A268 PolarHBondContact O-N 3.03Å; A268-F272 WeakPolarHBondContact O-CB 2.99Å; A268-F272 PolarHBondContact O-N 2.87Å
269	A	96	Very high	91.7	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.008	17%	0.171	C	C	.	.	H	α-helix	trans	-66.4	-39.7	174.7	0	0	0	0	0	112.2	L249 A265 A266 V273 L289 I293	L249-A269 HydrophobicContact CD1-CB 4.03Å; L249-A269 HydrophobicContact CD2-CB 4.32Å; A265-A269 VanDerWaalsContact O-CB 3.3Å; A265-A269 WeakPolarHBondContact O-CB 3.28Å; A265-A269 PolarHBondContact O-N 2.93Å; A266-A269 PolarHBondContact O-N 2.91Å; A269-V273 WeakPolarHBondContact O-CG2 3.45Å; A269-V273 PolarHBondContact O-N 3.3Å; A269-L289 HydrophobicContact CB-CD1 4.09Å; A269-I293 HydrophobicContact CB-CD1 3.94Å; A269-I293 HydrophobicContact CB-CG1 4.25Å
270	A	94.6	Very high	91.7	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-63.2	-52.4	174.4	0	0	0	0	0	111.7	A266 R267 F272 V273 L274 I315	A266-A270 WeakPolarHBondContact O-CB 3.46Å; A266-A270 PolarHBondContact O-N 3.23Å; R267-A270 PolarHBondContact O-N 3.15Å; A270-F272 VanDerWaalsContact C-N 3.31Å; A270-F272 PolarHBondContact O-N 3.47Å; A270-V273 WeakPolarHBondContact O-CA 3.43Å; A270-V273 WeakPolarHBondContact O-CB 3.49Å; A270-V273 PolarHBondContact O-N 2.89Å; A270-L274 WeakPolarHBondContact O-CG 3.39Å; A270-L274 PolarHBondContact O-N 2.92Å; A270-I315 HydrophobicContact CB-CD1 3.66Å; A270-I315 HydrophobicContact CB-CG1 4.23Å
271	S	93	Very high	91.7	Very high	22 Å²	22	30.4 Å²	30.4	15%	0.154	19%	0.191	C	C	.	.	H	α-helix	trans	-57.5	-42.2	177.2	-173.6	0	0	0	0	112.3	W228 P231 R267 V273 L274 S275	W228-S271 PolarHBondContact O-OG 3.08Å; W228-S271 VanDerWaalsContact O-OG 3.05Å; P231-S271 WeakPolarHBondContact CG-OG 3.42Å; R267-S271 WeakPolarHBondContact O-CB 3.39Å; R267-S271 PolarHBondContact O-N 3.43Å; S271-V273 VanDerWaalsContact C-N 3.34Å; S271-V273 PolarHBondContact O-N 2.94Å; S271-L274 PolarHBondContact O-N 3.26Å; S271-S275 PolarHBondContact O-N 3.16Å; S271-S275 PolarHBondContact O-OG 3.28Å
272	F	93.9	Very high	91.6	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-64.3	-33.5	174.4	-176.9	-101.2	0	0	0	114	F227 P231 Q238 L242 I245 A268 A270 N276 L282 F286	F227-F272 HydrophobicContact CE1-CB 4.22Å; F227-F272 HydrophobicContact CE1-CD2 4.49Å; F227-F272 HydrophobicContact CE1-CG 4.47Å; F227-F272 AromaticContact CE2-CD2 3.96Å; F227-F272 HydrophobicContact CE2-CD2 3.96Å; F227-F272 HydrophobicContact CE2-CE2 4.49Å; F227-F272 HydrophobicContact CZ-CB 3.94Å; F227-F272 AromaticContact CZ-CD2 3.45Å; F227-F272 HydrophobicContact CZ-CD2 3.45Å; F227-F272 VanDerWaalsContact CZ-CD2 3.45Å; F227-F272 HydrophobicContact CZ-CE2 4.14Å; F227-F272 AromaticContact CZ-CG 3.81Å; F227-F272 HydrophobicContact CZ-CG 3.81Å; P231-F272 HydrophobicContact CB-CB 3.99Å; P231-F272 HydrophobicContact CB-CD2 3.86Å; P231-F272 HydrophobicContact CB-CG 4.43Å; Q238-F272 HydrophobicContact CG-CE2 4.31Å; Q238-F272 HydrophobicContact CG-CZ 4.26Å; L242-F272 HydrophobicContact CD1-CZ 4.44Å; I245-F272 HydrophobicContact CD1-CE2 4.39Å; I245-F272 HydrophobicContact CD1-CZ 4.37Å; I245-F272 HydrophobicContact CG2-CZ 4.44Å; A268-F272 WeakPolarHBondContact O-CB 2.99Å; A268-F272 PolarHBondContact O-N 2.87Å; A270-F272 VanDerWaalsContact C-N 3.31Å; A270-F272 PolarHBondContact O-N 3.47Å; F272-N276 PolarHBondContact O-ND2 3.27Å; F272-L282 HydrophobicContact CE1-CD1 4.2Å; F272-L282 HydrophobicContact CE1-CD2 3.89Å; F272-L282 HydrophobicContact CE1-CG 4.39Å; F272-L282 HydrophobicContact CZ-CD1 4.05Å; F272-F286 AromaticContact CD1-CD1 3.87Å; F272-F286 HydrophobicContact CD1-CD1 3.87Å; F272-F286 AromaticContact CD1-CE1 3.69Å; F272-F286 HydrophobicContact CD1-CE1 3.69Å; F272-F286 HydrophobicContact CD1-CZ 4.23Å; F272-F286 AromaticContact CE1-CD1 3.8Å; F272-F286 HydrophobicContact CE1-CD1 3.8Å; F272-F286 HydrophobicContact CE1-CD2 4.31Å; F272-F286 AromaticContact CE1-CE1 3.35Å; F272-F286 HydrophobicContact CE1-CE1 3.35Å; F272-F286 AromaticContact CE1-CE2 3.89Å; F272-F286 HydrophobicContact CE1-CE2 3.89Å; F272-F286 HydrophobicContact CE1-CG 4.3Å; F272-F286 AromaticContact CE1-CZ 3.42Å; F272-F286 HydrophobicContact CE1-CZ 3.42Å; F272-F286 VanDerWaalsContact CE1-CZ 3.42Å; F272-F286 HydrophobicContact CZ-CE1 4.34Å; F272-F286 HydrophobicContact CZ-CZ 4.1Å
273	V	93.5	Very high	91.5	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-66.6	-46	172.5	158.5	0	0	0	0	110.8	A269 A270 S271 N276 E277 L283 I315 A319 Y322	A269-V273 WeakPolarHBondContact O-CG2 3.45Å; A269-V273 PolarHBondContact O-N 3.3Å; A270-V273 WeakPolarHBondContact O-CA 3.43Å; A270-V273 WeakPolarHBondContact O-CB 3.49Å; A270-V273 PolarHBondContact O-N 2.89Å; S271-V273 VanDerWaalsContact C-N 3.34Å; S271-V273 PolarHBondContact O-N 2.94Å; V273-N276 CarbonylContact O-C 3.47Å; V273-N276 PolarHBondContact O-N 3.08Å; V273-E277 PolarHBondContact O-N 3.05Å; V273-L283 HydrophobicContact CB-CD2 4.44Å; V273-L283 HydrophobicContact CG1-CD2 3.9Å; V273-L283 HydrophobicContact CG2-CD2 4.42Å; V273-I315 HydrophobicContact CG1-CG1 4.44Å; V273-A319 HydrophobicContact CG1-CB 4.06Å; V273-Y322 HydrophobicContact CG1-CD1 3.82Å; V273-Y322 HydrophobicContact CG1-CD2 4.23Å; V273-Y322 HydrophobicContact CG1-CE1 4.31Å; V273-Y322 HydrophobicContact CG1-CG 3.77Å; V273-Y322 HydrophobicContact CG2-CD1 4.21Å; V273-Y322 HydrophobicContact CG2-CD2 4.03Å; V273-Y322 HydrophobicContact CG2-CE1 3.91Å; V273-Y322 HydrophobicContact CG2-CE2 3.73Å; V273-Y322 HydrophobicContact CG2-CG 4.26Å
274	L	90.9	Very high	91.4	Very high	32 Å²	32	36.6 Å²	36.6	17%	0.168	22%	0.218	C	C	.	.	H	α-helix	trans	-61.4	-48.4	179.3	-65.4	166.4	0	0	0	111.5	A270 S271 N276 E277 E314 I315 T318 A319	A270-L274 WeakPolarHBondContact O-CG 3.39Å; A270-L274 PolarHBondContact O-N 2.92Å; S271-L274 PolarHBondContact O-N 3.26Å; L274-N276 PolarHBondContact O-N 3.03Å; L274-E277 PolarHBondContact O-N 2.9Å; L274-E314 HydrophobicContact CD1-CB 3.72Å; L274-E314 HydrophobicContact CD2-CB 4.27Å; L274-E314 WeakPolarHBondContact CD2-O 3.42Å; L274-I315 HydrophobicContact CD2-CG1 4.41Å; L274-I315 HydrophobicContact CG-CG1 4.49Å; L274-T318 HydrophobicContact CD2-CG2 4.15Å; L274-A319 HydrophobicContact CD2-CB 4.44Å
275	S	89.9	Confident	91.4	Very high	68 Å²	68	38.7 Å²	38.7	48%	0.476	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-3.4	174.5	-53.5	0	0	0	0	114.8	S271	S271-S275 PolarHBondContact O-N 3.16Å; S271-S275 PolarHBondContact O-OG 3.28Å
276	N	90.6	Very high	91.4	Very high	19 Å²	19	38.7 Å²	38.7	10%	0.102	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.6	21.8	-178.5	-72.7	-87.2	0	0	0	113.2	Q238 F272 V273 L274 G278 N279 L282	Q238-N276 PolarHBondContact NE2-OD1 2.7Å; F272-N276 PolarHBondContact O-ND2 3.27Å; V273-N276 CarbonylContact O-C 3.47Å; V273-N276 PolarHBondContact O-N 3.08Å; L274-N276 PolarHBondContact O-N 3.03Å; N276-G278 VanDerWaalsContact C-N 3.33Å; N276-G278 PolarHBondContact O-N 3.18Å; N276-N279 WeakPolarHBondContact O-CB 3.45Å; N276-N279 PolarHBondContact O-N 3.21Å; N276-L282 HydrophobicContact CB-CD1 4.05Å; N276-L282 HydrophobicContact CB-CD2 3.77Å; N276-L282 HydrophobicContact CB-CG 4.49Å; N276-L282 WeakPolarHBondContact OD1-CD1 3.45Å
277	E	85.2	Confident	91.2	Very high	109 Å²	109	39.2 Å²	39.2	51%	0.509	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.1	-48.1	-178.5	46.9	149.7	-144.3	0	0	114.3	V273 L274 N279 L283 T318 A319	V273-E277 PolarHBondContact O-N 3.05Å; L274-E277 PolarHBondContact O-N 2.9Å; E277-N279 PolarHBondContact O-N 2.73Å; E277-N279 VanDerWaalsContact O-N 3.15Å; E277-L283 WeakPolarHBondContact O-CD1 3.46Å; E277-T318 VanDerWaalsContact OE2-CG2 3.23Å; E277-T318 WeakPolarHBondContact OE2-CG2 3.24Å; E277-A319 HydrophobicContact CB-CB 4.45Å
278	G	82.9	Confident	91	Very high	72 Å²	72	41.7 Å²	41.7	74%	0.742	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-11.7	179.6	0	0	0	0	0	115	N276 T280	N276-G278 VanDerWaalsContact C-N 3.33Å; N276-G278 PolarHBondContact O-N 3.18Å; G278-T280 PolarHBondContact O-N 3.27Å
279	N	88.2	Confident	91.1	Very high	50 Å²	50	41.8 Å²	41.8	27%	0.267	25%	0.25	S	C	.	.			trans	-97.5	75.7	-175.8	-166.1	-23.3	0	0	0	112.1	N276 E277 A281 L282 L283	N276-N279 WeakPolarHBondContact O-CB 3.45Å; N276-N279 PolarHBondContact O-N 3.21Å; E277-N279 PolarHBondContact O-N 2.73Å; E277-N279 VanDerWaalsContact O-N 3.15Å; N279-A281 PolarHBondContact O-N 2.99Å; N279-A281 PolarHBondContact OD1-N 3.39Å; N279-L282 HydrophobicContact CB-CB 3.93Å; N279-L282 VanDerWaalsContact CG-CB 3.44Å; N279-L282 WeakPolarHBondContact O-CB 3.1Å; N279-L282 PolarHBondContact O-N 3.24Å; N279-L282 WeakPolarHBondContact OD1-CB 2.99Å; N279-L282 PolarHBondContact OD1-N 2.72Å; N279-L282 VanDerWaalsContact OD1-N 3.1Å; N279-L283 PolarHBondContact O-N 2.72Å
280	T	86.7	Confident	91.1	Very high	85 Å²	85	41.7 Å²	41.7	52%	0.521	25%	0.249	S	C	.	.	H	α-helix	trans	-53.6	-31.2	-179.1	-50	0	0	0	0	114	G278 K284	G278-T280 PolarHBondContact O-N 3.27Å; T280-K284 HydrophobicContact CG2-CD 4.42Å; T280-K284 WeakPolarHBondContact O-CG 3.47Å; T280-K284 PolarHBondContact O-N 3.07Å; T280-K284 VanDerWaalsContact O-N 3.13Å
281	A	88.3	Confident	91.1	Very high	74 Å²	74	44.8 Å²	44.8	61%	0.612	27%	0.269	S	S	*	.	H	α-helix	trans	-71	-40.5	177.7	0	0	0	0	0	112.1	N279 H285	N279-A281 PolarHBondContact O-N 2.99Å; N279-A281 PolarHBondContact OD1-N 3.39Å; A281-H285 PolarHBondContact O-N 3.49Å; A281-H285 VanDerWaalsContact O-N 3.13Å
282	L	90.4	Very high	91.2	Very high	3 Å²	3	44.8 Å²	44.8	2%	0.016	27%	0.273	C	S	.	.	H	α-helix	trans	-66	-47.5	173	-178.3	157.9	0	0	0	110.8	L242 F272 N276 N279 K284 H285 F286	L242-L282 HydrophobicContact CD1-CD1 3.87Å; L242-L282 HydrophobicContact CD1-CG 4.22Å; F272-L282 HydrophobicContact CE1-CD1 4.2Å; F272-L282 HydrophobicContact CE1-CD2 3.89Å; F272-L282 HydrophobicContact CE1-CG 4.39Å; F272-L282 HydrophobicContact CZ-CD1 4.05Å; N276-L282 HydrophobicContact CB-CD1 4.05Å; N276-L282 HydrophobicContact CB-CD2 3.77Å; N276-L282 HydrophobicContact CB-CG 4.49Å; N276-L282 WeakPolarHBondContact OD1-CD1 3.45Å; N279-L282 HydrophobicContact CB-CB 3.93Å; N279-L282 VanDerWaalsContact CG-CB 3.44Å; N279-L282 WeakPolarHBondContact O-CB 3.1Å; N279-L282 PolarHBondContact O-N 3.24Å; N279-L282 WeakPolarHBondContact OD1-CB 2.99Å; N279-L282 PolarHBondContact OD1-N 2.72Å; N279-L282 VanDerWaalsContact OD1-N 3.1Å; L282-K284 VanDerWaalsContact C-N 3.28Å; L282-K284 PolarHBondContact O-N 3.05Å; L282-H285 CarbonylContact O-C 3.44Å; L282-H285 WeakPolarHBondContact O-CA 3.36Å; L282-H285 WeakPolarHBondContact O-CB 3.48Å; L282-H285 PolarHBondContact O-N 3.4Å; L282-F286 HydrophobicContact CD2-CD2 3.87Å; L282-F286 HydrophobicContact CD2-CE2 4.3Å; L282-F286 HydrophobicContact CD2-CG 4.3Å; L282-F286 HydrophobicContact CG-CD2 3.99Å; L282-F286 HydrophobicContact CG-CE2 4.1Å; L282-F286 WeakPolarHBondContact O-CD2 3.37Å; L282-F286 PolarHBondContact O-N 3.18Å
283	L	91.3	Very high	91.4	Very high	14 Å²	14	44.8 Å²	44.8	7%	0.073	27%	0.273	C	S	.	.	H	α-helix	trans	-55.1	-44.3	178	-64.5	-174.1	0	0	0	111.9	V273 E277 N279 H285 F286 A287 Y322	V273-L283 HydrophobicContact CB-CD2 4.44Å; V273-L283 HydrophobicContact CG1-CD2 3.9Å; V273-L283 HydrophobicContact CG2-CD2 4.42Å; E277-L283 WeakPolarHBondContact O-CD1 3.46Å; N279-L283 PolarHBondContact O-N 2.72Å; L283-H285 VanDerWaalsContact C-N 3.33Å; L283-H285 PolarHBondContact O-N 2.96Å; L283-F286 PolarHBondContact O-N 2.87Å; L283-A287 PolarHBondContact O-N 3.33Å; L283-A287 VanDerWaalsContact O-N 3.12Å; L283-Y322 HydrophobicContact CB-CD2 4.2Å; L283-Y322 HydrophobicContact CD2-CD2 4.16Å
284	K	90.6	Very high	91.6	Very high	149 Å²	149	45.4 Å²	45.4	65%	0.648	28%	0.276	S	S	*	.	H	α-helix	trans	-62.2	-36.6	173.5	-75.3	175.9	178.7	179.3	0	113.1	T280 L282	T280-K284 HydrophobicContact CG2-CD 4.42Å; T280-K284 WeakPolarHBondContact O-CG 3.47Å; T280-K284 PolarHBondContact O-N 3.07Å; T280-K284 VanDerWaalsContact O-N 3.13Å; L282-K284 VanDerWaalsContact C-N 3.28Å; L282-K284 PolarHBondContact O-N 3.05Å
285	H	92.1	Very high	91.8	Very high	52 Å²	52	48.4 Å²	48.4	24%	0.241	29%	0.289	C	S	.	.	H	α-helix	trans	-70.8	-31.3	176.3	-175.5	86.8	0	0	0	112.7	E243 K246 A281 L282 L283	E243-H285 IonicContact OE1-CE1 2.89Å; E243-H285 PolarHBondContact OE1-CE1 3.49Å; E243-H285 IonicContact OE1-NE2 3.71Å; K246-H285 VanDerWaalsContact CD-NE2 3.3Å; K246-H285 WeakPolarHBondContact CD-NE2 3.3Å; K246-H285 WeakPolarHBondContact CE-O 3.23Å; K246-H285 PolarHBondContact NZ-O 3.22Å; A281-H285 PolarHBondContact O-N 3.49Å; A281-H285 VanDerWaalsContact O-N 3.13Å; L282-H285 CarbonylContact O-C 3.44Å; L282-H285 WeakPolarHBondContact O-CA 3.36Å; L282-H285 WeakPolarHBondContact O-CB 3.48Å; L282-H285 PolarHBondContact O-N 3.4Å; L283-H285 VanDerWaalsContact C-N 3.33Å; L283-H285 PolarHBondContact O-N 2.96Å
286	F	94.9	Very high	92.1	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-89.6	-7.4	-178.5	-80.5	-111.7	0	0	0	114	L242 I245 K246 L249 F272 L282 L283 D288 L289 Y322	L242-F286 HydrophobicContact CD1-CE2 3.57Å; L242-F286 HydrophobicContact CD1-CZ 3.93Å; L242-F286 HydrophobicContact CD2-CE2 4.23Å; L242-F286 HydrophobicContact CG-CE2 3.64Å; L242-F286 HydrophobicContact CG-CZ 4.08Å; I245-F286 HydrophobicContact CB-CZ 4.5Å; I245-F286 HydrophobicContact CG2-CE1 4.13Å; I245-F286 HydrophobicContact CG2-CZ 4.34Å; K246-F286 HydrophobicContact CB-CE1 4.1Å; K246-F286 HydrophobicContact CB-CZ 4.04Å; L249-F286 HydrophobicContact CD1-CE1 4.34Å; F272-F286 AromaticContact CD1-CD1 3.87Å; F272-F286 HydrophobicContact CD1-CD1 3.87Å; F272-F286 AromaticContact CD1-CE1 3.69Å; F272-F286 HydrophobicContact CD1-CE1 3.69Å; F272-F286 HydrophobicContact CD1-CZ 4.23Å; F272-F286 AromaticContact CE1-CD1 3.8Å; F272-F286 HydrophobicContact CE1-CD1 3.8Å; F272-F286 HydrophobicContact CE1-CD2 4.31Å; F272-F286 AromaticContact CE1-CE1 3.35Å; F272-F286 HydrophobicContact CE1-CE1 3.35Å; F272-F286 AromaticContact CE1-CE2 3.89Å; F272-F286 HydrophobicContact CE1-CE2 3.89Å; F272-F286 HydrophobicContact CE1-CG 4.3Å; F272-F286 AromaticContact CE1-CZ 3.42Å; F272-F286 HydrophobicContact CE1-CZ 3.42Å; F272-F286 VanDerWaalsContact CE1-CZ 3.42Å; F272-F286 HydrophobicContact CZ-CE1 4.34Å; F272-F286 HydrophobicContact CZ-CZ 4.1Å; L282-F286 HydrophobicContact CD2-CD2 3.87Å; L282-F286 HydrophobicContact CD2-CE2 4.3Å; L282-F286 HydrophobicContact CD2-CG 4.3Å; L282-F286 HydrophobicContact CG-CD2 3.99Å; L282-F286 HydrophobicContact CG-CE2 4.1Å; L282-F286 WeakPolarHBondContact O-CD2 3.37Å; L282-F286 PolarHBondContact O-N 3.18Å; L283-F286 PolarHBondContact O-N 2.87Å; F286-D288 PolarHBondContact O-N 3.06Å; F286-L289 HydrophobicContact CB-CD1 4.39Å; F286-L289 HydrophobicContact CD1-CD1 3.49Å; F286-L289 VanDerWaalsContact CD1-CD1 3.49Å; F286-L289 HydrophobicContact CD1-CG 4.45Å; F286-L289 HydrophobicContact CE1-CD1 4.2Å; F286-L289 HydrophobicContact CG-CD1 4.36Å; F286-L289 VanDerWaalsContact O-CB 3.3Å; F286-L289 WeakPolarHBondContact O-CB 3.4Å; F286-L289 WeakPolarHBondContact O-CG 3.29Å; F286-L289 PolarHBondContact O-N 3.47Å; F286-Y322 HydrophobicContact CB-CE2 4.14Å; F286-Y322 PolarHBondContact O-OH 3.39Å; F286-Y322 VanDerWaalsContact O-OH 3.11Å
287	A	92.6	Very high	92.4	Very high	11 Å²	11	44.4 Å²	44.4	9%	0.091	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-51.9	-27.9	-179.2	0	0	0	0	0	115.2	L283 L289 L290 P325	L283-A287 PolarHBondContact O-N 3.33Å; L283-A287 VanDerWaalsContact O-N 3.12Å; A287-L289 PolarHBondContact O-N 2.92Å; A287-L290 WeakPolarHBondContact O-CB 3.3Å; A287-L290 PolarHBondContact O-N 2.73Å; A287-P325 HydrophobicContact CB-CB 4.34Å; A287-P325 HydrophobicContact CB-CG 3.92Å
288	D	91.7	Very high	93	Very high	115 Å²	115	41.3 Å²	41.3	62%	0.615	25%	0.25	S	C	*	.	G	3₁₀ helix	trans	-64.1	-17	175.4	-60.2	-37	0	0	0	113.7	K246 F286	K246-D288 WeakPolarHBondContact CE-OD2 3.43Å; K246-D288 IonicContact NZ-OD2 2.81Å; K246-D288 PolarHBondContact NZ-OD2 3.28Å; F286-D288 PolarHBondContact O-N 3.06Å
289	L	95.2	Very high	93.5	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.005	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-78.9	-27.5	175.9	-61.1	-176.4	0	0	0	112.6	K246 L249 V250 M253 A269 F286 A287 G292 I293	K246-L289 HydrophobicContact CG-CD2 4.43Å; L249-L289 HydrophobicContact CB-CD1 4.11Å; L249-L289 HydrophobicContact CB-CD2 4.08Å; L249-L289 HydrophobicContact CD1-CD1 3.74Å; V250-L289 HydrophobicContact CB-CD2 4.46Å; V250-L289 HydrophobicContact CG2-CD2 3.41Å; V250-L289 VanDerWaalsContact CG2-CD2 3.41Å; M253-L289 HydrophobicContact CE-CB 3.94Å; M253-L289 HydrophobicContact CE-CD2 3.63Å; M253-L289 HydrophobicContact CE-CG 4.27Å; A269-L289 HydrophobicContact CB-CD1 4.09Å; F286-L289 HydrophobicContact CB-CD1 4.39Å; F286-L289 HydrophobicContact CD1-CD1 3.49Å; F286-L289 VanDerWaalsContact CD1-CD1 3.49Å; F286-L289 HydrophobicContact CD1-CG 4.45Å; F286-L289 HydrophobicContact CE1-CD1 4.2Å; F286-L289 HydrophobicContact CG-CD1 4.36Å; F286-L289 VanDerWaalsContact O-CB 3.3Å; F286-L289 WeakPolarHBondContact O-CB 3.4Å; F286-L289 WeakPolarHBondContact O-CG 3.29Å; F286-L289 PolarHBondContact O-N 3.47Å; A287-L289 PolarHBondContact O-N 2.92Å; L289-G292 WeakPolarHBondContact O-CA 3.49Å; L289-G292 PolarHBondContact O-N 2.88Å; L289-I293 PolarHBondContact O-N 3Å; L289-I293 VanDerWaalsContact O-N 3.11Å
290	L	95.8	Very high	93.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-56.2	-42.7	-171.4	178.5	57	0	0	0	113.6	A287 G292 I293 L294 Y322 L323 N326	A287-L290 WeakPolarHBondContact O-CB 3.3Å; A287-L290 PolarHBondContact O-N 2.73Å; L290-G292 PolarHBondContact O-N 3.11Å; L290-I293 PolarHBondContact O-N 3.15Å; L290-I293 VanDerWaalsContact O-N 3.1Å; L290-L294 HydrophobicContact CD1-CD1 4.5Å; L290-L294 HydrophobicContact CD1-CD2 4.31Å; L290-L294 HydrophobicContact CD1-CG 4.09Å; L290-L294 HydrophobicContact CG-CD1 4.41Å; L290-L294 HydrophobicContact CG-CG 4.45Å; L290-L294 WeakPolarHBondContact O-CG 3.28Å; L290-L294 PolarHBondContact O-N 3.4Å; L290-Y322 HydrophobicContact CB-CE1 4.12Å; L290-Y322 HydrophobicContact CD1-CE1 4.09Å; L290-Y322 HydrophobicContact CD2-CE1 4.5Å; L290-Y322 HydrophobicContact CG-CE1 4.47Å; L290-L323 HydrophobicContact CD1-CD2 3.65Å; L290-L323 HydrophobicContact CD2-CD2 4.03Å; L290-N326 HydrophobicContact CD2-CB 3.8Å; L290-N326 HydrophobicContact CG-CB 4.2Å
291	P	96	Very high	94.2	Very high	64 Å²	64	33.6 Å²	33.6	42%	0.416	19%	0.188	S	C	.	.	H	α-helix	trans	-58.3	-32	173.6	-25.6	36	0	0	0	114	Q295	P291-Q295 WeakPolarHBondContact O-CB 3.38Å; P291-Q295 PolarHBondContact O-N 2.92Å
292	G	95.2	Very high	94.5	Very high	22 Å²	22	34.7 Å²	34.7	23%	0.227	18%	0.177	C	C	.	.	H	α-helix	trans	-72.1	-38.9	174.8	0	0	0	0	0	112.8	L289 L290 Q295 A296	L289-G292 WeakPolarHBondContact O-CA 3.49Å; L289-G292 PolarHBondContact O-N 2.88Å; L290-G292 PolarHBondContact O-N 3.11Å; G292-Q295 PolarHBondContact O-N 2.81Å; G292-A296 WeakPolarHBondContact O-CB 3.19Å; G292-A296 PolarHBondContact O-N 2.89Å
293	I	97.1	Very high	94.6	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-62	-49	173.1	-60.3	172.6	0	0	0	109.8	M253 A266 A269 L289 L290 Q295 A296 V297 Y322	M253-I293 HydrophobicContact SD-CG1 4.18Å; A266-I293 HydrophobicContact CB-CG1 4.44Å; A269-I293 HydrophobicContact CB-CD1 3.94Å; A269-I293 HydrophobicContact CB-CG1 4.25Å; L289-I293 PolarHBondContact O-N 3Å; L289-I293 VanDerWaalsContact O-N 3.11Å; L290-I293 PolarHBondContact O-N 3.15Å; L290-I293 VanDerWaalsContact O-N 3.1Å; I293-Q295 VanDerWaalsContact C-N 3.32Å; I293-Q295 PolarHBondContact O-N 3.06Å; I293-A296 WeakPolarHBondContact O-CB 3.5Å; I293-A296 PolarHBondContact O-N 3.41Å; I293-A296 VanDerWaalsContact O-N 3.08Å; I293-V297 WeakPolarHBondContact O-CG2 3.14Å; I293-V297 PolarHBondContact O-N 3.47Å; I293-Y322 HydrophobicContact CD1-CE1 4.35Å
294	L	97.7	Very high	94.6	Very high	13 Å²	13	43 Å²	43	7%	0.068	23%	0.232	C	C	.	.	H	α-helix	trans	-60.3	-39.1	177.6	-63.7	179.1	0	0	0	112.4	L290 N298 L312 A329 T330 L333	L290-L294 HydrophobicContact CD1-CD1 4.5Å; L290-L294 HydrophobicContact CD1-CD2 4.31Å; L290-L294 HydrophobicContact CD1-CG 4.09Å; L290-L294 HydrophobicContact CG-CD1 4.41Å; L290-L294 HydrophobicContact CG-CG 4.45Å; L290-L294 WeakPolarHBondContact O-CG 3.28Å; L290-L294 PolarHBondContact O-N 3.4Å; L294-N298 PolarHBondContact O-N 3.03Å; L294-N298 VanDerWaalsContact O-N 3.09Å; L294-L312 HydrophobicContact CD2-CD1 4.26Å; L294-L312 HydrophobicContact CD2-CD2 4.08Å; L294-A329 HydrophobicContact CD1-CB 4.09Å; L294-T330 HydrophobicContact CD2-CG2 4.01Å; L294-L333 HydrophobicContact CB-CD2 4Å; L294-L333 HydrophobicContact CD2-CD2 4.13Å; L294-L333 WeakPolarHBondContact O-CD2 3.27Å
295	Q	95.9	Very high	94.6	Very high	94 Å²	94	38 Å²	38	44%	0.439	21%	0.212	S	C	.	.	H	α-helix	trans	-63.5	-43.1	173.2	-179.8	172.5	-8.1	0	0	111.8	P291 G292 I293 N298 E299	P291-Q295 WeakPolarHBondContact O-CB 3.38Å; P291-Q295 PolarHBondContact O-N 2.92Å; G292-Q295 PolarHBondContact O-N 2.81Å; I293-Q295 VanDerWaalsContact C-N 3.32Å; I293-Q295 PolarHBondContact O-N 3.06Å; Q295-N298 PolarHBondContact O-N 2.8Å; Q295-E299 HydrophobicContact CG-CG 4.42Å; Q295-E299 WeakPolarHBondContact CG-OE1 3.21Å; Q295-E299 PolarHBondContact NE2-OE1 3.32Å; Q295-E299 WeakPolarHBondContact O-CB 3.44Å; Q295-E299 WeakPolarHBondContact O-CG 3.23Å; Q295-E299 PolarHBondContact O-N 3.35Å
296	A	95.9	Very high	94.6	Very high	4 Å²	4	36.9 Å²	36.9	3%	0.033	21%	0.208	C	C	.	.	H	α-helix	trans	-64	-41.2	177.8	0	0	0	0	0	112.5	A266 G292 I293 E299 S300 V308	A266-A296 HydrophobicContact CB-CB 3.46Å; A266-A296 VanDerWaalsContact CB-CB 3.46Å; G292-A296 WeakPolarHBondContact O-CB 3.19Å; G292-A296 PolarHBondContact O-N 2.89Å; I293-A296 WeakPolarHBondContact O-CB 3.5Å; I293-A296 PolarHBondContact O-N 3.41Å; I293-A296 VanDerWaalsContact O-N 3.08Å; A296-E299 PolarHBondContact O-N 3.44Å; A296-S300 WeakPolarHBondContact O-CB 3.31Å; A296-S300 PolarHBondContact O-N 2.99Å; A296-S300 PolarHBondContact O-OG 2.54Å; A296-V308 HydrophobicContact CB-CG1 4.29Å
297	V	97.3	Very high	94.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-56.4	-52.1	172.2	172.2	0	0	0	0	110.6	I293 E299 S300 C301 V308 L309 L312 L333 L337	I293-V297 WeakPolarHBondContact O-CG2 3.14Å; I293-V297 PolarHBondContact O-N 3.47Å; V297-E299 VanDerWaalsContact C-N 3.32Å; V297-E299 PolarHBondContact O-N 3.47Å; V297-S300 PolarHBondContact O-N 3.33Å; V297-S300 PolarHBondContact O-OG 3.26Å; V297-C301 PolarHBondContact O-N 2.99Å; V297-C301 VanDerWaalsContact O-N 3.12Å; V297-C301 PolarHBondContact O-SG 3.41Å; V297-V308 HydrophobicContact CG2-CB 3.93Å; V297-V308 HydrophobicContact CG2-CG1 3.6Å; V297-V308 WeakPolarHBondContact CG2-O 3.4Å; V297-L309 HydrophobicContact CG1-CB 4.17Å; V297-L309 HydrophobicContact CG1-CD1 3.86Å; V297-L312 HydrophobicContact CG1-CD2 4.4Å; V297-L312 HydrophobicContact CG2-CB 4.3Å; V297-L312 HydrophobicContact CG2-CD2 4.27Å; V297-L333 HydrophobicContact CB-CD2 4.13Å; V297-L333 HydrophobicContact CG1-CD2 4.05Å; V297-L337 HydrophobicContact CG1-CD1 3.98Å
298	N	96.8	Very high	94.4	Very high	43 Å²	43	37.7 Å²	37.7	23%	0.23	21%	0.213	C	C	.	.	H	α-helix	trans	-57.7	-45.2	177.6	177.8	94	0	0	0	111.6	L294 Q295 Y302 L333 K336	L294-N298 PolarHBondContact O-N 3.03Å; L294-N298 VanDerWaalsContact O-N 3.09Å; Q295-N298 PolarHBondContact O-N 2.8Å; N298-Y302 WeakPolarHBondContact O-CD2 3.44Å; N298-L333 HydrophobicContact CB-CD1 3.72Å; N298-L333 HydrophobicContact CB-CD2 4.38Å; N298-K336 PolarHBondContact OD1-NZ 3.05Å
299	E	94.6	Very high	94.7	Very high	43 Å²	43	32.2 Å²	32.2	20%	0.201	18%	0.183	C	C	.	.	H	α-helix	trans	-69.6	-35.3	-178.2	-73.6	177.7	-169.2	0	0	113.6	R262 Q295 A296 V297 Q303	R262-E299 IonicContact CZ-OE2 2.56Å; R262-E299 VanDerWaalsContact CZ-OE2 3.22Å; R262-E299 IonicContact NE-OE2 2.62Å; R262-E299 PolarHBondContact NE-OE2 3.44Å; R262-E299 IonicContact NH2-OE2 3.57Å; R262-E299 PolarHBondContact NH2-OE2 3.28Å; Q295-E299 HydrophobicContact CG-CG 4.42Å; Q295-E299 WeakPolarHBondContact CG-OE1 3.21Å; Q295-E299 PolarHBondContact NE2-OE1 3.32Å; Q295-E299 WeakPolarHBondContact O-CB 3.44Å; Q295-E299 WeakPolarHBondContact O-CG 3.23Å; Q295-E299 PolarHBondContact O-N 3.35Å; A296-E299 PolarHBondContact O-N 3.44Å; V297-E299 VanDerWaalsContact C-N 3.32Å; V297-E299 PolarHBondContact O-N 3.47Å; E299-Q303 WeakPolarHBondContact O-CG 3.37Å; E299-Q303 PolarHBondContact O-NE2 3.29Å
300	S	93.9	Very high	94.6	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.007	20%	0.2	C	C	.	.	H	α-helix	trans	-74.8	-41.3	-179.1	78.7	0	0	0	0	111.8	A296 V297 Y302 Q303 G304 D305	A296-S300 WeakPolarHBondContact O-CB 3.31Å; A296-S300 PolarHBondContact O-N 2.99Å; A296-S300 PolarHBondContact O-OG 2.54Å; V297-S300 PolarHBondContact O-N 3.33Å; V297-S300 PolarHBondContact O-OG 3.26Å; S300-Y302 PolarHBondContact O-N 3.3Å; S300-Q303 CarbonylContact O-C 3.46Å; S300-Q303 WeakPolarHBondContact O-CA 3.36Å; S300-Q303 WeakPolarHBondContact O-CB 3.33Å; S300-Q303 PolarHBondContact O-N 2.82Å; S300-G304 PolarHBondContact O-N 2.92Å; S300-D305 CarbonylContact C-O 3.56Å; S300-D305 VanDerWaalsContact CB-O 3.25Å; S300-D305 WeakPolarHBondContact CB-O 3.49Å; S300-D305 PolarHBondContact O-N 3.22Å; S300-D305 PolarHBondContact OG-O 2.68Å
301	C	95.2	Very high	94.5	Very high	2 Å²	2	36 Å²	36	1%	0.014	20%	0.2	C	C	.	.	H	α-helix	trans	-57.7	-46.5	179.7	-66.9	0	0	0	0	111.9	V297 Q303 G304 D305 L337 L343 Q347	V297-C301 PolarHBondContact O-N 2.99Å; V297-C301 VanDerWaalsContact O-N 3.12Å; V297-C301 PolarHBondContact O-SG 3.41Å; C301-Q303 PolarHBondContact O-N 3.06Å; C301-Q303 VanDerWaalsContact O-N 3.14Å; C301-G304 PolarHBondContact O-N 3.09Å; C301-D305 PolarHBondContact N-O 3.22Å; C301-L337 HydrophobicContact CB-CD2 4.04Å; C301-L343 HydrophobicContact CB-CD1 4.47Å; C301-L343 HydrophobicContact CB-CD2 4.45Å; C301-Q347 PolarHBondContact O-NE2 3.09Å
302	Y	95.2	Very high	94.6	Very high	97 Å²	97	33 Å²	33	38%	0.38	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-3.6	175.6	-69.5	-65.8	0	0	0	114.8	N298 S300 K336 L337 D340 L343	N298-Y302 WeakPolarHBondContact O-CD2 3.44Å; S300-Y302 PolarHBondContact O-N 3.3Å; Y302-K336 WeakPolarHBondContact OH-CE 3.29Å; Y302-K336 PolarHBondContact OH-NZ 3.38Å; Y302-L337 HydrophobicContact CE2-CD2 4.15Å; Y302-D340 WeakPolarHBondContact CE1-OD2 3.31Å; Y302-D340 VanDerWaalsContact CZ-OD2 3.31Å; Y302-D340 PolarHBondContact OH-OD2 3.32Å; Y302-L343 HydrophobicContact CD1-CD2 3.83Å; Y302-L343 HydrophobicContact CE1-CD2 4.04Å; Y302-L343 HydrophobicContact CE1-CG 4.38Å
303	Q	92.7	Very high	94.6	Very high	127 Å²	127	33 Å²	33	59%	0.593	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.1	0	169.6	-71.1	171.1	66	0	0	112.6	E299 S300 C301	E299-Q303 WeakPolarHBondContact O-CG 3.37Å; E299-Q303 PolarHBondContact O-NE2 3.29Å; S300-Q303 CarbonylContact O-C 3.46Å; S300-Q303 WeakPolarHBondContact O-CA 3.36Å; S300-Q303 WeakPolarHBondContact O-CB 3.33Å; S300-Q303 PolarHBondContact O-N 2.82Å; C301-Q303 PolarHBondContact O-N 3.06Å; C301-Q303 VanDerWaalsContact O-N 3.14Å
304	G	90.8	Very high	94.4	Very high	63 Å²	63	36.5 Å²	36.5	65%	0.649	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.2	18.9	-175.4	0	0	0	0	0	114.4	S300 C301	S300-G304 PolarHBondContact O-N 2.92Å; C301-G304 PolarHBondContact O-N 3.09Å
305	D	89.9	Confident	94.3	Very high	45 Å²	45	35.9 Å²	35.9	24%	0.241	19%	0.189	C	C	.	.			trans	-114.2	112	-180	176.5	16.2	0	0	0	110.7	T263 S300 C301 S307	T263-D305 WeakPolarHBondContact CG2-OD2 3.47Å; S300-D305 CarbonylContact C-O 3.56Å; S300-D305 VanDerWaalsContact CB-O 3.25Å; S300-D305 WeakPolarHBondContact CB-O 3.49Å; S300-D305 PolarHBondContact O-N 3.22Å; S300-D305 PolarHBondContact OG-O 2.68Å; C301-D305 PolarHBondContact N-O 3.22Å; D305-S307 WeakPolarHBondContact OD1-CB 3.15Å; D305-S307 PolarHBondContact OD1-N 3.15Å; D305-S307 PolarHBondContact OD1-OG 3.29Å
306	D	91.9	Very high	94.3	Very high	29 Å²	29	31.4 Å²	31.4	16%	0.155	17%	0.168	C	C	.	.			trans	-90.4	-2.1	178.7	69.3	5	0	0	0	113.7	V308 L309 K310 Q347 L350	D306-V308 VanDerWaalsContact C-N 3.26Å; D306-V308 PolarHBondContact O-N 2.66Å; D306-V308 VanDerWaalsContact O-N 3.11Å; D306-L309 WeakPolarHBondContact O-CA 3.26Å; D306-L309 WeakPolarHBondContact O-CB 3.27Å; D306-L309 PolarHBondContact O-N 2.95Å; D306-K310 VanDerWaalsContact CG-CE 3.46Å; D306-K310 PolarHBondContact O-N 2.95Å; D306-K310 WeakPolarHBondContact OD1-CE 3.49Å; D306-K310 IonicContact OD1-NZ 3.95Å; D306-K310 PolarHBondContact OD1-NZ 3.3Å; D306-K310 WeakPolarHBondContact OD2-CE 3.43Å; D306-K310 IonicContact OD2-NZ 3.57Å; D306-K310 PolarHBondContact OD2-NZ 3.42Å; D306-Q347 HydrophobicContact CB-CG 4.34Å; D306-L350 HydrophobicContact CB-CD1 4.02Å
307	S	89.5	Confident	94.1	Very high	27 Å²	27	33.1 Å²	33.1	19%	0.189	18%	0.177	C	C	.	.	H	α-helix	trans	-56.3	-36.2	-171.6	-57.9	0	0	0	0	114.1	D305 S311	D305-S307 WeakPolarHBondContact OD1-CB 3.15Å; D305-S307 PolarHBondContact OD1-N 3.15Å; D305-S307 PolarHBondContact OD1-OG 3.29Å; S307-S311 PolarHBondContact O-N 3.46Å; S307-S311 PolarHBondContact O-OG 3.43Å
308	V	94.9	Very high	93.7	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-82.4	-27.6	179.5	-157.9	0	0	0	0	111.2	T263 A266 R267 A296 V297 D306 S311 L312	T263-V308 HydrophobicContact CG2-CG2 3.5Å; T263-V308 VanDerWaalsContact CG2-CG2 3.5Å; A266-V308 HydrophobicContact CB-CG1 3.73Å; R267-V308 HydrophobicContact CG-CG2 4.24Å; A296-V308 HydrophobicContact CB-CG1 4.29Å; V297-V308 HydrophobicContact CG2-CB 3.93Å; V297-V308 HydrophobicContact CG2-CG1 3.6Å; V297-V308 WeakPolarHBondContact CG2-O 3.4Å; D306-V308 VanDerWaalsContact C-N 3.26Å; D306-V308 PolarHBondContact O-N 2.66Å; D306-V308 VanDerWaalsContact O-N 3.11Å; V308-S311 PolarHBondContact O-N 3.12Å; V308-L312 PolarHBondContact O-N 3.03Å
309	L	96.6	Very high	93.5	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-70.9	-41.6	175.5	-178.9	60.5	0	0	0	110.5	V297 D306 S311 L312 V313 Q347 L350 A351 V354	V297-L309 HydrophobicContact CG1-CB 4.17Å; V297-L309 HydrophobicContact CG1-CD1 3.86Å; D306-L309 WeakPolarHBondContact O-CA 3.26Å; D306-L309 WeakPolarHBondContact O-CB 3.27Å; D306-L309 PolarHBondContact O-N 2.95Å; L309-S311 VanDerWaalsContact C-N 3.32Å; L309-S311 PolarHBondContact O-N 3.18Å; L309-L312 HydrophobicContact CD1-CD2 4.43Å; L309-L312 WeakPolarHBondContact O-CA 3.44Å; L309-L312 WeakPolarHBondContact O-CB 3.18Å; L309-L312 PolarHBondContact O-N 3.23Å; L309-V313 PolarHBondContact O-N 2.95Å; L309-Q347 WeakPolarHBondContact CD2-O 3.4Å; L309-L350 HydrophobicContact CD2-CB 3.62Å; L309-L350 HydrophobicContact CG-CB 3.98Å; L309-A351 HydrophobicContact CD2-CB 4.23Å; L309-V354 HydrophobicContact CD1-CG2 4.18Å
310	K	93.7	Very high	93.5	Very high	79 Å²	79	32.7 Å²	32.7	34%	0.343	18%	0.18	S	C	.	.	H	α-helix	trans	-53.9	-48.1	168.6	-72.5	169.5	173.9	154.9	0	111.2	D306 L312 V313 E314 L350	D306-K310 VanDerWaalsContact CG-CE 3.46Å; D306-K310 PolarHBondContact O-N 2.95Å; D306-K310 WeakPolarHBondContact OD1-CE 3.49Å; D306-K310 IonicContact OD1-NZ 3.95Å; D306-K310 PolarHBondContact OD1-NZ 3.3Å; D306-K310 WeakPolarHBondContact OD2-CE 3.43Å; D306-K310 IonicContact OD2-NZ 3.57Å; D306-K310 PolarHBondContact OD2-NZ 3.42Å; K310-L312 PolarHBondContact O-N 3.21Å; K310-V313 WeakPolarHBondContact O-CB 3.43Å; K310-V313 PolarHBondContact O-N 3.04Å; K310-V313 VanDerWaalsContact O-N 3.09Å; K310-E314 WeakPolarHBondContact O-CG 3.42Å; K310-E314 PolarHBondContact O-N 3.33Å; K310-L350 HydrophobicContact CG-CD1 4Å; K310-L350 HydrophobicContact CG-CD2 4.34Å
311	S	94	Very high	93.4	Very high	2 Å²	2	37.9 Å²	37.9	1%	0.014	20%	0.202	C	C	.	.	H	α-helix	trans	-65.7	-17.2	173.4	-65.4	0	0	0	0	115.5	S307 V308 L309 E314 I315	S307-S311 PolarHBondContact O-N 3.46Å; S307-S311 PolarHBondContact O-OG 3.43Å; V308-S311 PolarHBondContact O-N 3.12Å; L309-S311 VanDerWaalsContact C-N 3.32Å; L309-S311 PolarHBondContact O-N 3.18Å; S311-E314 WeakPolarHBondContact CA-OE2 3.43Å; S311-E314 PolarHBondContact OG-OE2 2.96Å; S311-I315 WeakPolarHBondContact O-CD1 3.4Å; S311-I315 VanDerWaalsContact O-CG1 3.24Å; S311-I315 WeakPolarHBondContact O-CG1 3.48Å; S311-I315 PolarHBondContact O-N 2.84Å
312	L	97.5	Very high	93.4	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-81.9	-34.7	170.7	-176.5	62.4	0	0	0	111.7	L294 V297 V308 L309 K310 I315 A316 L323 T330 V354	L294-L312 HydrophobicContact CD2-CD1 4.26Å; L294-L312 HydrophobicContact CD2-CD2 4.08Å; V297-L312 HydrophobicContact CG1-CD2 4.4Å; V297-L312 HydrophobicContact CG2-CB 4.3Å; V297-L312 HydrophobicContact CG2-CD2 4.27Å; V308-L312 PolarHBondContact O-N 3.03Å; L309-L312 HydrophobicContact CD1-CD2 4.43Å; L309-L312 WeakPolarHBondContact O-CA 3.44Å; L309-L312 WeakPolarHBondContact O-CB 3.18Å; L309-L312 PolarHBondContact O-N 3.23Å; K310-L312 PolarHBondContact O-N 3.21Å; L312-I315 PolarHBondContact O-N 3.32Å; L312-A316 WeakPolarHBondContact O-CB 3.38Å; L312-A316 PolarHBondContact O-N 3.49Å; L312-L323 HydrophobicContact CD1-CD2 3.93Å; L312-T330 HydrophobicContact CD1-CG2 4.1Å; L312-T330 HydrophobicContact CD2-CG2 4.21Å; L312-V354 HydrophobicContact CB-CG2 4.47Å; L312-V354 HydrophobicContact CD2-CG1 4.39Å; L312-V354 HydrophobicContact CD2-CG2 4.28Å; L312-V354 HydrophobicContact CG-CG1 4.19Å; L312-V354 HydrophobicContact CG-CG2 4.1Å
313	V	95.9	Very high	93.5	Very high	24 Å²	24	33.3 Å²	33.3	15%	0.145	18%	0.184	C	C	.	.	H	α-helix	trans	-61.6	-48.7	168.8	178	0	0	0	0	109.6	L309 K310 I315 A316 D317 L350 E353 V354	L309-V313 PolarHBondContact O-N 2.95Å; K310-V313 WeakPolarHBondContact O-CB 3.43Å; K310-V313 PolarHBondContact O-N 3.04Å; K310-V313 VanDerWaalsContact O-N 3.09Å; V313-I315 VanDerWaalsContact C-N 3.3Å; V313-I315 PolarHBondContact O-N 3.34Å; V313-A316 CarbonylContact O-C 3.6Å; V313-A316 WeakPolarHBondContact O-CA 3.48Å; V313-A316 WeakPolarHBondContact O-CB 3.5Å; V313-A316 PolarHBondContact O-N 3.23Å; V313-D317 WeakPolarHBondContact O-CB 3.26Å; V313-D317 PolarHBondContact O-N 3.24Å; V313-L350 HydrophobicContact CG2-CD2 4.43Å; V313-E353 HydrophobicContact CG1-CG 3.92Å; V313-E353 HydrophobicContact CG2-CB 4.34Å; V313-E353 HydrophobicContact CG2-CG 4.32Å; V313-V354 HydrophobicContact CB-CG2 4.42Å; V313-V354 HydrophobicContact CG2-CG2 3.51Å
314	E	92.8	Very high	93.5	Very high	73 Å²	73	30.1 Å²	30.1	34%	0.341	17%	0.167	S	C	.	.	H	α-helix	trans	-54	-43.2	175	-66.6	162.1	-170.7	0	0	112.3	L274 K310 S311 D317 T318	L274-E314 HydrophobicContact CD1-CB 3.72Å; L274-E314 HydrophobicContact CD2-CB 4.27Å; L274-E314 WeakPolarHBondContact CD2-O 3.42Å; K310-E314 WeakPolarHBondContact O-CG 3.42Å; K310-E314 PolarHBondContact O-N 3.33Å; S311-E314 WeakPolarHBondContact CA-OE2 3.43Å; S311-E314 PolarHBondContact OG-OE2 2.96Å; E314-D317 PolarHBondContact O-N 3.39Å; E314-T318 WeakPolarHBondContact O-CB 3.33Å; E314-T318 PolarHBondContact O-N 3.18Å; E314-T318 PolarHBondContact O-OG1 3.4Å
315	I	95.5	Very high	93.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-66.7	-40.5	175.9	-69.2	165.5	0	0	0	111.7	A270 V273 L274 S311 L312 V313 D317 A319 P320 Y322 L323	A270-I315 HydrophobicContact CB-CD1 3.66Å; A270-I315 HydrophobicContact CB-CG1 4.23Å; V273-I315 HydrophobicContact CG1-CG1 4.44Å; L274-I315 HydrophobicContact CD2-CG1 4.41Å; L274-I315 HydrophobicContact CG-CG1 4.49Å; S311-I315 WeakPolarHBondContact O-CD1 3.4Å; S311-I315 VanDerWaalsContact O-CG1 3.24Å; S311-I315 WeakPolarHBondContact O-CG1 3.48Å; S311-I315 PolarHBondContact O-N 2.84Å; L312-I315 PolarHBondContact O-N 3.32Å; V313-I315 VanDerWaalsContact C-N 3.3Å; V313-I315 PolarHBondContact O-N 3.34Å; I315-D317 VanDerWaalsContact C-N 3.3Å; I315-A319 CarbonylContact O-C 3.53Å; I315-A319 WeakPolarHBondContact O-CA 3.36Å; I315-A319 PolarHBondContact O-N 2.86Å; I315-P320 VanDerWaalsContact O-N 3.11Å; I315-Y322 HydrophobicContact CG2-CD1 3.92Å; I315-L323 HydrophobicContact CG2-CD1 4.06Å; I315-L323 HydrophobicContact CG2-CD2 3.66Å; I315-L323 HydrophobicContact CG2-CG 3.71Å
316	A	96.4	Very high	93.9	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-65.7	-35	177.8	0	0	0	0	0	112.1	L312 V313 P320 L323 V354 T357 L358 T361	L312-A316 WeakPolarHBondContact O-CB 3.38Å; L312-A316 PolarHBondContact O-N 3.49Å; V313-A316 CarbonylContact O-C 3.6Å; V313-A316 WeakPolarHBondContact O-CA 3.48Å; V313-A316 WeakPolarHBondContact O-CB 3.5Å; V313-A316 PolarHBondContact O-N 3.23Å; A316-P320 WeakPolarHBondContact O-CB 3.41Å; A316-L323 HydrophobicContact CB-CD1 4.08Å; A316-V354 HydrophobicContact CB-CG1 4.08Å; A316-T357 HydrophobicContact CB-CG2 4.34Å; A316-L358 HydrophobicContact CB-CD2 4.18Å; A316-L358 HydrophobicContact CB-CG 3.93Å; A316-T361 PolarHBondContact O-OG1 2.8Å
317	D	91.9	Very high	94.1	Very high	41 Å²	41	30.2 Å²	30.2	22%	0.219	16%	0.157	C	C	.	.	H	α-helix	trans	-70.5	-68.7	175.5	174.2	66.5	0	0	0	111.5	Q2 V313 E314 I315 P320 T357 T361	Q2-D317 PolarHBondContact NE2-OD2 3.49Å; V313-D317 WeakPolarHBondContact O-CB 3.26Å; V313-D317 PolarHBondContact O-N 3.24Å; E314-D317 PolarHBondContact O-N 3.39Å; I315-D317 VanDerWaalsContact C-N 3.3Å; D317-P320 WeakPolarHBondContact O-CD 3.33Å; D317-T357 VanDerWaalsContact CA-CG2 3.43Å; D317-T357 HydrophobicContact CB-CG2 3.66Å; D317-T361 WeakPolarHBondContact O-CG2 3.46Å
318	T	88.1	Confident	94.5	Very high	57 Å²	57	32.9 Å²	32.9	35%	0.35	17%	0.166	S	C	.	.	H	α-helix	trans	-82.9	-36.3	-167	-52.8	0	0	0	0	112.9	L274 E277 E314 P320	L274-T318 HydrophobicContact CD2-CG2 4.15Å; E277-T318 VanDerWaalsContact OE2-CG2 3.23Å; E277-T318 WeakPolarHBondContact OE2-CG2 3.24Å; E314-T318 WeakPolarHBondContact O-CB 3.33Å; E314-T318 PolarHBondContact O-N 3.18Å; E314-T318 PolarHBondContact O-OG1 3.4Å; T318-P320 VanDerWaalsContact C-CD 3.42Å
319	A	92.6	Very high	94.6	Very high	6 Å²	6	35.2 Å²	35.2	5%	0.05	19%	0.186	C	C	.	.			trans	-128	42.1	-171.6	0	0	0	0	0	115.2	V273 L274 E277 I315 K321 Y322	V273-A319 HydrophobicContact CG1-CB 4.06Å; L274-A319 HydrophobicContact CD2-CB 4.44Å; E277-A319 HydrophobicContact CB-CB 4.45Å; I315-A319 CarbonylContact O-C 3.53Å; I315-A319 WeakPolarHBondContact O-CA 3.36Å; I315-A319 PolarHBondContact O-N 2.86Å; A319-K321 VanDerWaalsContact C-N 3.25Å; A319-K321 PolarHBondContact O-N 2.8Å; A319-Y322 VanDerWaalsContact O-CB 3.24Å; A319-Y322 WeakPolarHBondContact O-CB 3.31Å; A319-Y322 PolarHBondContact O-N 3.15Å
320	P	94.1	Very high	94.7	Very high	14 Å²	14	35.2 Å²	35.2	9%	0.091	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-59.6	-30.4	-167.3	20.3	-33.3	0	0	0	114.4	I315 A316 D317 T318 Y322 L323 L358 A362 M365	I315-P320 VanDerWaalsContact O-N 3.11Å; A316-P320 WeakPolarHBondContact O-CB 3.41Å; D317-P320 WeakPolarHBondContact O-CD 3.33Å; T318-P320 VanDerWaalsContact C-CD 3.42Å; P320-Y322 PolarHBondContact O-N 2.87Å; P320-Y322 VanDerWaalsContact O-N 3.12Å; P320-L323 WeakPolarHBondContact O-CB 3.39Å; P320-L323 PolarHBondContact O-N 3.28Å; P320-L358 HydrophobicContact CB-CD2 3.76Å; P320-A362 HydrophobicContact CB-CB 3.53Å; P320-A362 HydrophobicContact CG-CB 3.83Å; P320-M365 WeakPolarHBondContact O-CE 3.32Å
321	K	92.1	Very high	94.9	Very high	109 Å²	109	31.5 Å²	31.5	47%	0.474	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-61.1	-20.3	176.3	-66.6	-171	177.3	-177.2	0	113.1	A319 L323 R324 M365 D889	A319-K321 VanDerWaalsContact C-N 3.25Å; A319-K321 PolarHBondContact O-N 2.8Å; K321-L323 VanDerWaalsContact C-N 3.3Å; K321-R324 WeakPolarHBondContact O-CB 3.41Å; K321-R324 PolarHBondContact O-N 2.97Å; K321-M365 HydrophobicContact CG-SD 4.14Å; K321-D889 IonicContact NZ-OD2 3.52Å; K321-D889 PolarHBondContact NZ-OD2 2.85Å
322	Y	95.8	Very high	95.1	Very high	3 Å²	3	34.9 Å²	34.9	1%	0.012	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-66.1	-31.2	170.3	177.1	-107.4	0	0	0	112.6	V273 L283 F286 L290 I293 I315 A319 P320 R324 P325	V273-Y322 HydrophobicContact CG1-CD1 3.82Å; V273-Y322 HydrophobicContact CG1-CD2 4.23Å; V273-Y322 HydrophobicContact CG1-CE1 4.31Å; V273-Y322 HydrophobicContact CG1-CG 3.77Å; V273-Y322 HydrophobicContact CG2-CD1 4.21Å; V273-Y322 HydrophobicContact CG2-CD2 4.03Å; V273-Y322 HydrophobicContact CG2-CE1 3.91Å; V273-Y322 HydrophobicContact CG2-CE2 3.73Å; V273-Y322 HydrophobicContact CG2-CG 4.26Å; L283-Y322 HydrophobicContact CB-CD2 4.2Å; L283-Y322 HydrophobicContact CD2-CD2 4.16Å; F286-Y322 HydrophobicContact CB-CE2 4.14Å; F286-Y322 PolarHBondContact O-OH 3.39Å; F286-Y322 VanDerWaalsContact O-OH 3.11Å; L290-Y322 HydrophobicContact CB-CE1 4.12Å; L290-Y322 HydrophobicContact CD1-CE1 4.09Å; L290-Y322 HydrophobicContact CD2-CE1 4.5Å; L290-Y322 HydrophobicContact CG-CE1 4.47Å; I293-Y322 HydrophobicContact CD1-CE1 4.35Å; I315-Y322 HydrophobicContact CG2-CD1 3.92Å; A319-Y322 VanDerWaalsContact O-CB 3.24Å; A319-Y322 WeakPolarHBondContact O-CB 3.31Å; A319-Y322 PolarHBondContact O-N 3.15Å; P320-Y322 PolarHBondContact O-N 2.87Å; P320-Y322 VanDerWaalsContact O-N 3.12Å; Y322-R324 VanDerWaalsContact C-N 3.32Å; Y322-R324 PolarHBondContact O-N 3.1Å; Y322-P325 WeakPolarHBondContact O-CD 3.29Å
323	L	96.6	Very high	95.1	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-23.2	179.8	-60.1	173.5	0	0	0	112.8	L290 L312 I315 A316 P320 K321 P325 N326 L327 T330 L358	L290-L323 HydrophobicContact CD1-CD2 3.65Å; L290-L323 HydrophobicContact CD2-CD2 4.03Å; L312-L323 HydrophobicContact CD1-CD2 3.93Å; I315-L323 HydrophobicContact CG2-CD1 4.06Å; I315-L323 HydrophobicContact CG2-CD2 3.66Å; I315-L323 HydrophobicContact CG2-CG 3.71Å; A316-L323 HydrophobicContact CB-CD1 4.08Å; P320-L323 WeakPolarHBondContact O-CB 3.39Å; P320-L323 PolarHBondContact O-N 3.28Å; K321-L323 VanDerWaalsContact C-N 3.3Å; L323-P325 VanDerWaalsContact C-N 3.33Å; L323-P325 WeakPolarHBondContact O-CD 3.33Å; L323-P325 VanDerWaalsContact O-N 3.07Å; L323-N326 CarbonylContact O-C 3.52Å; L323-N326 PolarHBondContact O-N 3.1Å; L323-L327 HydrophobicContact CB-CD1 4.39Å; L323-L327 WeakPolarHBondContact O-CA 3.27Å; L323-L327 PolarHBondContact O-N 3.35Å; L323-T330 HydrophobicContact CD1-CG2 4.38Å; L323-T330 HydrophobicContact CD2-CG2 4.3Å; L323-L358 HydrophobicContact CD1-CD1 4.35Å; L323-L358 HydrophobicContact CD1-CD2 4.18Å
324	R	93.4	Very high	95.2	Very high	61 Å²	61	34.7 Å²	34.7	23%	0.23	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-43.4	-44.2	-174.6	-160.8	-174.9	-71.5	165.5	-4.8	114.5	K321 Y322 N326 M365 D889 E890 D891	K321-R324 WeakPolarHBondContact O-CB 3.41Å; K321-R324 PolarHBondContact O-N 2.97Å; Y322-R324 VanDerWaalsContact C-N 3.32Å; Y322-R324 PolarHBondContact O-N 3.1Å; R324-N326 VanDerWaalsContact C-N 3.3Å; R324-N326 PolarHBondContact O-N 3.02Å; R324-M365 HydrophobicContact CB-CE 3.62Å; R324-M365 HydrophobicContact CB-SD 4.28Å; R324-M365 HydrophobicContact CG-CE 3.94Å; R324-M365 HydrophobicContact CG-SD 4.27Å; R324-D889 IonicContact NH2-OD1 2.71Å; R324-D889 PolarHBondContact NH2-OD1 3.27Å; R324-E890 WeakPolarHBondContact CD-OE1 3.43Å; R324-E890 IonicContact CZ-OE1 3.83Å; R324-E890 IonicContact NE-OE1 3.48Å; R324-E890 IonicContact NH1-OE1 3.33Å; R324-E890 PolarHBondContact NH1-OE1 3.08Å; R324-D891 IonicContact CZ-OD2 3.81Å; R324-D891 IonicContact NE-OD2 2.74Å; R324-D891 PolarHBondContact NE-OD2 3.32Å; R324-D891 IonicContact NH2-OD2 2.61Å; R324-D891 PolarHBondContact NH2-OD2 2.95Å
325	P	94.1	Very high	95.4	Very high	83 Å²	83	31.9 Å²	31.9	54%	0.539	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-67.4	-21.8	-177.9	-22.3	36.8	0	0	0	115.3	A287 Y322 L323	A287-P325 HydrophobicContact CB-CB 4.34Å; A287-P325 HydrophobicContact CB-CG 3.92Å; Y322-P325 WeakPolarHBondContact O-CD 3.29Å; L323-P325 VanDerWaalsContact C-N 3.33Å; L323-P325 WeakPolarHBondContact O-CD 3.33Å; L323-P325 VanDerWaalsContact O-N 3.07Å
326	N	95.4	Very high	95.5	Very high	49 Å²	49	36.4 Å²	36.4	26%	0.262	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-130.4	23.5	178.6	-63.3	-88.5	0	0	0	112.2	L290 L323 R324 E328 A329 T330	L290-N326 HydrophobicContact CD2-CB 3.8Å; L290-N326 HydrophobicContact CG-CB 4.2Å; L323-N326 CarbonylContact O-C 3.52Å; L323-N326 PolarHBondContact O-N 3.1Å; R324-N326 VanDerWaalsContact C-N 3.3Å; R324-N326 PolarHBondContact O-N 3.02Å; N326-E328 VanDerWaalsContact C-N 3.32Å; N326-E328 PolarHBondContact O-N 3.47Å; N326-A329 HydrophobicContact CB-CB 4.44Å; N326-A329 WeakPolarHBondContact O-CA 3.15Å; N326-A329 WeakPolarHBondContact O-CB 3.43Å; N326-A329 PolarHBondContact O-N 3.26Å; N326-T330 PolarHBondContact O-N 3.43Å; N326-T330 PolarHBondContact O-OG1 3.03Å
327	L	96.2	Very high	95.6	Very high	7 Å²	7	36.4 Å²	36.4	4%	0.037	19%	0.19	C	C	.	.	H	α-helix	trans	-54.9	-43.8	-169.6	-179.3	60.2	0	0	0	113.2	L323 A329 T330 L331 L358 M365	L323-L327 HydrophobicContact CB-CD1 4.39Å; L323-L327 WeakPolarHBondContact O-CA 3.27Å; L323-L327 PolarHBondContact O-N 3.35Å; L327-A329 VanDerWaalsContact C-N 3.31Å; L327-A329 PolarHBondContact O-N 3.17Å; L327-T330 WeakPolarHBondContact O-CB 3.25Å; L327-T330 PolarHBondContact O-N 2.87Å; L327-L331 HydrophobicContact CD1-CD1 3.91Å; L327-L331 HydrophobicContact CD1-CG 3.94Å; L327-L331 HydrophobicContact CG-CD1 3.8Å; L327-L331 HydrophobicContact CG-CG 4.28Å; L327-L331 WeakPolarHBondContact O-CB 3.29Å; L327-L331 VanDerWaalsContact O-CG 3.29Å; L327-L331 WeakPolarHBondContact O-CG 3.41Å; L327-L331 PolarHBondContact O-N 2.77Å; L327-L358 HydrophobicContact CD1-CD1 3.9Å; L327-M365 HydrophobicContact CD2-CB 3.95Å; L327-M365 HydrophobicContact CD2-CE 3.89Å
328	E	96.5	Very high	95.9	Very high	82 Å²	82	34.5 Å²	34.5	38%	0.383	18%	0.18	S	C	.	.	H	α-helix	trans	-55.1	-44.9	173.2	-176.9	70.2	-156.6	0	0	111.6	N326 L331 Q332 H369	N326-E328 VanDerWaalsContact C-N 3.32Å; N326-E328 PolarHBondContact O-N 3.47Å; E328-L331 PolarHBondContact O-N 3Å; E328-Q332 HydrophobicContact CG-CG 4.34Å; E328-Q332 VanDerWaalsContact O-CB 3.29Å; E328-Q332 WeakPolarHBondContact O-CB 3.41Å; E328-Q332 WeakPolarHBondContact O-CG 3.44Å; E328-Q332 PolarHBondContact O-N 2.84Å; E328-Q332 PolarHBondContact OE1-NE2 2.97Å; E328-H369 IonicContact OE2-CE1 2.69Å; E328-H369 IonicContact OE2-CG 3.19Å; E328-H369 IonicContact OE2-ND1 3.73Å; E328-H369 PolarHBondContact OE2-ND1 3.35Å
329	A	97.8	Very high	96.3	Very high	50 Å²	50	33.9 Å²	33.9	41%	0.413	18%	0.181	S	C	.	.	H	α-helix	trans	-69.8	-37.3	179.9	0	0	0	0	0	112.4	L294 N326 L327 L333	L294-A329 HydrophobicContact CD1-CB 4.09Å; N326-A329 HydrophobicContact CB-CB 4.44Å; N326-A329 WeakPolarHBondContact O-CA 3.15Å; N326-A329 WeakPolarHBondContact O-CB 3.43Å; N326-A329 PolarHBondContact O-N 3.26Å; L327-A329 VanDerWaalsContact C-N 3.31Å; L327-A329 PolarHBondContact O-N 3.17Å; A329-L333 WeakPolarHBondContact O-CB 3.46Å; A329-L333 PolarHBondContact O-N 2.95Å; A329-L333 VanDerWaalsContact O-N 3.08Å
330	T	98.2	Very high	96.4	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-59.1	-54.1	172.5	-55.4	0	0	0	0	110.6	L294 L312 L323 N326 L327 Q332 L333 C334 V354	L294-T330 HydrophobicContact CD2-CG2 4.01Å; L312-T330 HydrophobicContact CD1-CG2 4.1Å; L312-T330 HydrophobicContact CD2-CG2 4.21Å; L323-T330 HydrophobicContact CD1-CG2 4.38Å; L323-T330 HydrophobicContact CD2-CG2 4.3Å; N326-T330 PolarHBondContact O-N 3.43Å; N326-T330 PolarHBondContact O-OG1 3.03Å; L327-T330 WeakPolarHBondContact O-CB 3.25Å; L327-T330 PolarHBondContact O-N 2.87Å; T330-Q332 PolarHBondContact O-N 3.22Å; T330-L333 PolarHBondContact O-N 3.07Å; T330-C334 PolarHBondContact O-N 2.97Å; T330-C334 PolarHBondContact O-SG 3.27Å; T330-V354 HydrophobicContact CG2-CG1 4.39Å
331	L	98.1	Very high	96.4	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-64.8	-40.5	-177.2	-70.1	173.1	0	0	0	112.3	L327 E328 L333 C334 L335 I355 L358 L366 H369 I372	L327-L331 HydrophobicContact CD1-CD1 3.91Å; L327-L331 HydrophobicContact CD1-CG 3.94Å; L327-L331 HydrophobicContact CG-CD1 3.8Å; L327-L331 HydrophobicContact CG-CG 4.28Å; L327-L331 WeakPolarHBondContact O-CB 3.29Å; L327-L331 VanDerWaalsContact O-CG 3.29Å; L327-L331 WeakPolarHBondContact O-CG 3.41Å; L327-L331 PolarHBondContact O-N 2.77Å; E328-L331 PolarHBondContact O-N 3Å; L331-L333 VanDerWaalsContact C-N 3.34Å; L331-L333 PolarHBondContact O-N 2.9Å; L331-C334 PolarHBondContact O-N 2.89Å; L331-L335 WeakPolarHBondContact O-CB 3.08Å; L331-L335 PolarHBondContact O-N 3.13Å; L331-I355 HydrophobicContact CD2-CG1 4.08Å; L331-I355 HydrophobicContact CD2-CG2 4.37Å; L331-L358 HydrophobicContact CD2-CD1 3.78Å; L331-L366 HydrophobicContact CD1-CD1 3.6Å; L331-L366 HydrophobicContact CD2-CD1 3.87Å; L331-L366 HydrophobicContact CG-CD1 4.42Å; L331-H369 HydrophobicContact CD1-CB 3.95Å; L331-I372 HydrophobicContact CB-CD1 3.36Å; L331-I372 HydrophobicContact CB-CG2 4.03Å; L331-I372 HydrophobicContact CD1-CD1 3.99Å; L331-I372 HydrophobicContact CG-CD1 4.34Å
332	Q	97.9	Very high	96.6	Very high	74 Å²	74	41.3 Å²	41.3	35%	0.346	23%	0.229	S	C	.	.	H	α-helix	trans	-64.4	-36.4	175.3	-68.8	-77.2	-9.5	0	0	112.2	E328 T330 K336 I372	E328-Q332 HydrophobicContact CG-CG 4.34Å; E328-Q332 VanDerWaalsContact O-CB 3.29Å; E328-Q332 WeakPolarHBondContact O-CB 3.41Å; E328-Q332 WeakPolarHBondContact O-CG 3.44Å; E328-Q332 PolarHBondContact O-N 2.84Å; E328-Q332 PolarHBondContact OE1-NE2 2.97Å; T330-Q332 PolarHBondContact O-N 3.22Å; Q332-K336 VanDerWaalsContact O-CB 3.29Å; Q332-K336 WeakPolarHBondContact O-CB 3.48Å; Q332-K336 PolarHBondContact O-N 3.34Å; Q332-I372 HydrophobicContact CG-CD1 3.89Å
333	L	98.3	Very high	96.5	Very high	19 Å²	19	42 Å²	42	10%	0.099	23%	0.232	C	C	.	.	H	α-helix	trans	-66.2	-47.5	173.7	173.4	60.7	0	0	0	111.3	L294 V297 N298 A329 T330 L331 L335 K336 L337	L294-L333 HydrophobicContact CB-CD2 4Å; L294-L333 HydrophobicContact CD2-CD2 4.13Å; L294-L333 WeakPolarHBondContact O-CD2 3.27Å; V297-L333 HydrophobicContact CB-CD2 4.13Å; V297-L333 HydrophobicContact CG1-CD2 4.05Å; N298-L333 HydrophobicContact CB-CD1 3.72Å; N298-L333 HydrophobicContact CB-CD2 4.38Å; A329-L333 WeakPolarHBondContact O-CB 3.46Å; A329-L333 PolarHBondContact O-N 2.95Å; A329-L333 VanDerWaalsContact O-N 3.08Å; T330-L333 PolarHBondContact O-N 3.07Å; L331-L333 VanDerWaalsContact C-N 3.34Å; L331-L333 PolarHBondContact O-N 2.9Å; L333-L335 PolarHBondContact O-N 2.75Å; L333-K336 WeakPolarHBondContact O-CB 3.37Å; L333-K336 PolarHBondContact O-N 3.18Å; L333-L337 HydrophobicContact CD1-CD1 3.88Å; L333-L337 HydrophobicContact CD1-CD2 4.45Å; L333-L337 HydrophobicContact CD1-CG 3.95Å; L333-L337 HydrophobicContact CG-CD1 4Å; L333-L337 HydrophobicContact CG-CG 4.45Å; L333-L337 WeakPolarHBondContact O-CG 3.48Å; L333-L337 PolarHBondContact O-N 3.14Å
334	C	98.3	Very high	96.4	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-60.3	-47.2	-179.7	-65.2	0	0	0	0	111.3	T330 L331 K336 L337 C338 A351 V354 I355	T330-C334 PolarHBondContact O-N 2.97Å; T330-C334 PolarHBondContact O-SG 3.27Å; L331-C334 PolarHBondContact O-N 2.89Å; C334-K336 VanDerWaalsContact C-N 3.33Å; C334-K336 PolarHBondContact O-N 3.41Å; C334-L337 PolarHBondContact O-N 3Å; C334-C338 WeakPolarHBondContact O-CB 3.34Å; C334-C338 PolarHBondContact O-N 3.3Å; C334-A351 WeakPolarHBondContact CB-O 3.44Å; C334-V354 HydrophobicContact CB-CB 4.47Å; C334-V354 VanDerWaalsContact SG-CG1 3.58Å; C334-I355 HydrophobicContact CB-CD1 4.09Å; C334-I355 HydrophobicContact CB-CG1 3.97Å
335	L	97.2	Very high	96.4	Very high	15 Å²	15	46.4 Å²	46.4	8%	0.079	26%	0.264	C	S	.	.	H	α-helix	trans	-58.4	-42.8	174.2	-177.1	71.4	0	0	0	112.4	L331 L333 A339 I355 I372 Q375 Q379	L331-L335 WeakPolarHBondContact O-CB 3.08Å; L331-L335 PolarHBondContact O-N 3.13Å; L333-L335 PolarHBondContact O-N 2.75Å; L335-A339 WeakPolarHBondContact O-CB 3.16Å; L335-A339 PolarHBondContact O-N 3.27Å; L335-A339 VanDerWaalsContact O-N 3.12Å; L335-I355 HydrophobicContact CB-CD1 4.48Å; L335-I372 HydrophobicContact CD2-CG2 4.33Å; L335-Q375 HydrophobicContact CD1-CB 4.19Å; L335-Q375 HydrophobicContact CD2-CB 3.59Å; L335-Q375 HydrophobicContact CD2-CG 4.42Å; L335-Q379 HydrophobicContact CD1-CG 3.71Å
336	K	97.8	Very high	96.3	Very high	95 Å²	95	46.6 Å²	46.6	41%	0.413	26%	0.258	S	S	.	.	H	α-helix	trans	-61.6	-45.7	176.8	179	-153	161.9	-164.6	0	111.6	N298 Y302 Q332 L333 C334 D340	N298-K336 PolarHBondContact OD1-NZ 3.05Å; Y302-K336 WeakPolarHBondContact OH-CE 3.29Å; Y302-K336 PolarHBondContact OH-NZ 3.38Å; Q332-K336 VanDerWaalsContact O-CB 3.29Å; Q332-K336 WeakPolarHBondContact O-CB 3.48Å; Q332-K336 PolarHBondContact O-N 3.34Å; L333-K336 WeakPolarHBondContact O-CB 3.37Å; L333-K336 PolarHBondContact O-N 3.18Å; C334-K336 VanDerWaalsContact C-N 3.33Å; C334-K336 PolarHBondContact O-N 3.41Å; K336-D340 PolarHBondContact O-N 3.02Å
337	L	98	Very high	96.3	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-68.5	-43.9	-178.8	-66.6	172.4	0	0	0	111.2	V297 C301 Y302 L333 C334 A339 D340 L343 A351	V297-L337 HydrophobicContact CG1-CD1 3.98Å; C301-L337 HydrophobicContact CB-CD2 4.04Å; Y302-L337 HydrophobicContact CE2-CD2 4.15Å; L333-L337 HydrophobicContact CD1-CD1 3.88Å; L333-L337 HydrophobicContact CD1-CD2 4.45Å; L333-L337 HydrophobicContact CD1-CG 3.95Å; L333-L337 HydrophobicContact CG-CD1 4Å; L333-L337 HydrophobicContact CG-CG 4.45Å; L333-L337 WeakPolarHBondContact O-CG 3.48Å; L333-L337 PolarHBondContact O-N 3.14Å; C334-L337 PolarHBondContact O-N 3Å; L337-A339 VanDerWaalsContact C-N 3.29Å; L337-A339 PolarHBondContact O-N 2.97Å; L337-D340 PolarHBondContact O-N 3.43Å; L337-D340 VanDerWaalsContact O-N 3.16Å; L337-L343 HydrophobicContact CB-CD1 4.12Å; L337-L343 HydrophobicContact CD2-CD1 3.69Å; L337-A351 HydrophobicContact CB-CB 3.64Å
338	C	97.4	Very high	96.3	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.007	25%	0.25	C	S	.	.	H	α-helix	trans	-55.8	-41.9	174.8	179.2	0	0	0	0	112.7	C334 D340 R348 A351	C334-C338 WeakPolarHBondContact O-CB 3.34Å; C334-C338 PolarHBondContact O-N 3.3Å; C338-D340 VanDerWaalsContact C-N 3.34Å; C338-D340 PolarHBondContact O-N 2.9Å; C338-R348 PolarHBondContact O-NE 2.86Å; C338-A351 HydrophobicContact CB-CB 4.23Å
339	A	96	Very high	96.3	Very high	44 Å²	44	43 Å²	43	36%	0.364	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-10.4	-179.6	0	0	0	0	0	115	L335 L337 T341	L335-A339 WeakPolarHBondContact O-CB 3.16Å; L335-A339 PolarHBondContact O-N 3.27Å; L335-A339 VanDerWaalsContact O-N 3.12Å; L337-A339 VanDerWaalsContact C-N 3.29Å; L337-A339 PolarHBondContact O-N 2.97Å; A339-T341 PolarHBondContact O-N 3.18Å
340	D	96.3	Very high	96.2	Very high	30 Å²	30	41.8 Å²	41.8	16%	0.16	23%	0.225	C	C	.	.			trans	-88.2	99.8	-174	-162.3	-29.3	0	0	0	111.7	Y302 K336 L337 C338 N342 L343	Y302-D340 WeakPolarHBondContact CE1-OD2 3.31Å; Y302-D340 VanDerWaalsContact CZ-OD2 3.31Å; Y302-D340 PolarHBondContact OH-OD2 3.32Å; K336-D340 PolarHBondContact O-N 3.02Å; L337-D340 PolarHBondContact O-N 3.43Å; L337-D340 VanDerWaalsContact O-N 3.16Å; C338-D340 VanDerWaalsContact C-N 3.34Å; C338-D340 PolarHBondContact O-N 2.9Å; D340-N342 PolarHBondContact O-N 3.12Å; D340-N342 WeakPolarHBondContact OD1-CB 3.34Å; D340-N342 PolarHBondContact OD1-N 2.75Å; D340-N342 VanDerWaalsContact OD1-N 3.07Å; D340-N342 PolarHBondContact OD1-ND2 2.65Å; D340-L343 HydrophobicContact CB-CD1 4.16Å; D340-L343 HydrophobicContact CB-CG 4.26Å; D340-L343 PolarHBondContact O-N 3.26Å
341	T	93.6	Very high	96.2	Very high	116 Å²	116	41.8 Å²	41.8	71%	0.712	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.6	4.5	-179.8	66.7	0	0	0	0	114.6	A339	A339-T341 PolarHBondContact O-N 3.18Å
342	N	94.9	Very high	96.2	Very high	139 Å²	139	42 Å²	42	74%	0.743	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-9.7	170.3	-54.8	-82.8	0	0	0	112.8	D340	D340-N342 PolarHBondContact O-N 3.12Å; D340-N342 WeakPolarHBondContact OD1-CB 3.34Å; D340-N342 PolarHBondContact OD1-N 2.75Å; D340-N342 VanDerWaalsContact OD1-N 3.07Å; D340-N342 PolarHBondContact OD1-ND2 2.65Å
343	L	95.6	Very high	96.2	Very high	16 Å²	16	40.9 Å²	40.9	8%	0.084	22%	0.221	C	C	.	.	S	Bend	trans	-91.3	160.1	174.8	-60.8	178.9	0	0	0	110.9	C301 Y302 L337 D340 Q347 R348	C301-L343 HydrophobicContact CB-CD1 4.47Å; C301-L343 HydrophobicContact CB-CD2 4.45Å; Y302-L343 HydrophobicContact CD1-CD2 3.83Å; Y302-L343 HydrophobicContact CE1-CD2 4.04Å; Y302-L343 HydrophobicContact CE1-CG 4.38Å; L337-L343 HydrophobicContact CB-CD1 4.12Å; L337-L343 HydrophobicContact CD2-CD1 3.69Å; D340-L343 HydrophobicContact CB-CD1 4.16Å; D340-L343 HydrophobicContact CB-CG 4.26Å; D340-L343 PolarHBondContact O-N 3.26Å; L343-Q347 HydrophobicContact CB-CB 4.14Å; L343-R348 HydrophobicContact CB-CG 4.04Å
344	T	94.4	Very high	96.1	Very high	83 Å²	83	40 Å²	40	51%	0.509	22%	0.216	S	C	.	.			trans	-71.5	161.5	177.9	66.4	0	0	0	0	111.7	M346 Q347 R348	T344-M346 PolarHBondContact O-N 3.31Å; T344-Q347 PolarHBondContact O-N 2.96Å; T344-Q347 WeakPolarHBondContact OG1-CG 3.45Å; T344-Q347 PolarHBondContact OG1-N 3Å; T344-R348 WeakPolarHBondContact O-CG 3.49Å; T344-R348 PolarHBondContact O-N 2.96Å
345	N	92.2	Very high	96.1	Very high	72 Å²	72	40 Å²	40	39%	0.385	22%	0.217	S	C	.	.	H	α-helix	trans	-54	-52.4	175.7	-72	-2.1	0	0	0	111	Q347 R348 Q349 N407	N345-Q347 VanDerWaalsContact C-N 3.3Å; N345-Q347 PolarHBondContact O-N 3.3Å; N345-R348 CarbonylContact O-C 3.58Å; N345-R348 WeakPolarHBondContact O-CA 3.28Å; N345-R348 PolarHBondContact O-N 3.36Å; N345-Q349 WeakPolarHBondContact O-CB 3.48Å; N345-Q349 VanDerWaalsContact O-CG 3.29Å; N345-Q349 WeakPolarHBondContact O-CG 3.35Å; N345-Q349 PolarHBondContact O-N 3.38Å; N345-Q349 PolarHBondContact O-OE1 3.41Å; N345-N407 VanDerWaalsContact CG-ND2 3.29Å; N345-N407 PolarHBondContact ND2-ND2 3.03Å; N345-N407 PolarHBondContact OD1-ND2 3.12Å; N345-N407 PolarHBondContact OD1-OD1 3.5Å
346	M	91.9	Very high	96.2	Very high	87 Å²	87	39.3 Å²	39.3	43%	0.429	21%	0.213	S	C	.	.	H	α-helix	trans	-50.6	-44.7	175.9	-178.1	57.8	66.3	0	0	113.1	T344 R348 Q349 L350	T344-M346 PolarHBondContact O-N 3.31Å; M346-R348 PolarHBondContact O-N 3.43Å; M346-Q349 VanDerWaalsContact CA-OE1 3.31Å; M346-L350 HydrophobicContact CG-CD1 4Å; M346-L350 VanDerWaalsContact O-CB 3.31Å; M346-L350 WeakPolarHBondContact O-CB 3.46Å; M346-L350 VanDerWaalsContact O-CG 3.27Å; M346-L350 WeakPolarHBondContact O-CG 3.43Å; M346-L350 PolarHBondContact O-N 2.9Å; M346-L350 HydrophobicContact SD-CD1 3.92Å; M346-L350 HydrophobicContact SD-CG 4.02Å
347	Q	95.5	Very high	96.1	Very high	9 Å²	9	35 Å²	35	4%	0.042	20%	0.195	C	C	.	.	H	α-helix	trans	-67.6	-35.5	177.7	-71.7	178.8	-41	0	0	113.2	C301 D306 L309 L343 T344 N345 A351	C301-Q347 PolarHBondContact O-NE2 3.09Å; D306-Q347 HydrophobicContact CB-CG 4.34Å; L309-Q347 WeakPolarHBondContact CD2-O 3.4Å; L343-Q347 HydrophobicContact CB-CB 4.14Å; T344-Q347 PolarHBondContact O-N 2.96Å; T344-Q347 WeakPolarHBondContact OG1-CG 3.45Å; T344-Q347 PolarHBondContact OG1-N 3Å; N345-Q347 VanDerWaalsContact C-N 3.3Å; N345-Q347 PolarHBondContact O-N 3.3Å; Q347-A351 VanDerWaalsContact O-CB 3.32Å; Q347-A351 WeakPolarHBondContact O-CB 3.19Å; Q347-A351 PolarHBondContact O-N 3.07Å; Q347-A351 VanDerWaalsContact O-N 3.15Å
348	R	97.2	Very high	96.1	Very high	22 Å²	22	35.1 Å²	35.1	8%	0.083	20%	0.195	C	C	.	.	H	α-helix	trans	-75.7	-37.9	178.4	-67.9	171.2	58.3	-130.8	-9.2	111.9	C338 L343 T344 N345 M346 A351 L352 N407	C338-R348 PolarHBondContact O-NE 2.86Å; L343-R348 HydrophobicContact CB-CG 4.04Å; T344-R348 WeakPolarHBondContact O-CG 3.49Å; T344-R348 PolarHBondContact O-N 2.96Å; N345-R348 CarbonylContact O-C 3.58Å; N345-R348 WeakPolarHBondContact O-CA 3.28Å; N345-R348 PolarHBondContact O-N 3.36Å; M346-R348 PolarHBondContact O-N 3.43Å; R348-A351 PolarHBondContact O-N 3.04Å; R348-L352 PolarHBondContact O-N 3.39Å; R348-N407 PolarHBondContact NH1-ND2 3.46Å
349	Q	95.8	Very high	96.1	Very high	30 Å²	30	35.1 Å²	35.1	14%	0.14	20%	0.195	C	C	.	.	H	α-helix	trans	-64.4	-52.2	173.5	-71.5	160.7	-32.6	0	0	110.2	N345 M346 A351 L352 E353 M383 D405 S406 A410	N345-Q349 WeakPolarHBondContact O-CB 3.48Å; N345-Q349 VanDerWaalsContact O-CG 3.29Å; N345-Q349 WeakPolarHBondContact O-CG 3.35Å; N345-Q349 PolarHBondContact O-N 3.38Å; N345-Q349 PolarHBondContact O-OE1 3.41Å; M346-Q349 VanDerWaalsContact CA-OE1 3.31Å; Q349-A351 PolarHBondContact O-N 2.99Å; Q349-L352 CarbonylContact O-C 3.38Å; Q349-L352 WeakPolarHBondContact O-CA 3.39Å; Q349-L352 WeakPolarHBondContact O-CB 3.46Å; Q349-L352 PolarHBondContact O-N 3.08Å; Q349-E353 PolarHBondContact O-N 2.85Å; Q349-M383 HydrophobicContact CG-CE 3.87Å; Q349-D405 PolarHBondContact NE2-O 2.99Å; Q349-S406 PolarHBondContact NE2-O 2.9Å; Q349-A410 HydrophobicContact CG-CB 3.84Å
350	L	95.6	Very high	95.9	Very high	26 Å²	26	37.1 Å²	37.1	14%	0.136	20%	0.197	C	C	.	.	H	α-helix	trans	-59.5	-32.5	174.9	-74.5	169.3	0	0	0	113.3	D306 L309 K310 V313 M346 E353 V354	D306-L350 HydrophobicContact CB-CD1 4.02Å; L309-L350 HydrophobicContact CD2-CB 3.62Å; L309-L350 HydrophobicContact CG-CB 3.98Å; K310-L350 HydrophobicContact CG-CD1 4Å; K310-L350 HydrophobicContact CG-CD2 4.34Å; V313-L350 HydrophobicContact CG2-CD2 4.43Å; M346-L350 HydrophobicContact CG-CD1 4Å; M346-L350 VanDerWaalsContact O-CB 3.31Å; M346-L350 WeakPolarHBondContact O-CB 3.46Å; M346-L350 VanDerWaalsContact O-CG 3.27Å; M346-L350 WeakPolarHBondContact O-CG 3.43Å; M346-L350 PolarHBondContact O-N 2.9Å; M346-L350 HydrophobicContact SD-CD1 3.92Å; M346-L350 HydrophobicContact SD-CG 4.02Å; L350-E353 PolarHBondContact O-N 2.7Å; L350-V354 PolarHBondContact O-N 2.92Å
351	A	98	Very high	95.8	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-73.1	-31.4	175.1	0	0	0	0	0	112.8	L309 C334 L337 C338 Q347 R348 Q349	L309-A351 HydrophobicContact CD2-CB 4.23Å; C334-A351 WeakPolarHBondContact CB-O 3.44Å; L337-A351 HydrophobicContact CB-CB 3.64Å; C338-A351 HydrophobicContact CB-CB 4.23Å; Q347-A351 VanDerWaalsContact O-CB 3.32Å; Q347-A351 WeakPolarHBondContact O-CB 3.19Å; Q347-A351 PolarHBondContact O-N 3.07Å; Q347-A351 VanDerWaalsContact O-N 3.15Å; R348-A351 PolarHBondContact O-N 3.04Å; Q349-A351 PolarHBondContact O-N 2.99Å
352	L	97.6	Very high	95.8	Very high	5 Å²	5	33.3 Å²	33.3	3%	0.026	18%	0.176	C	C	.	.	H	α-helix	trans	-70.6	-41.9	169.6	177.5	58.2	0	0	0	110.8	R348 Q349 V354 I355 V356 M380 M383 A414	R348-L352 PolarHBondContact O-N 3.39Å; Q349-L352 CarbonylContact O-C 3.38Å; Q349-L352 WeakPolarHBondContact O-CA 3.39Å; Q349-L352 WeakPolarHBondContact O-CB 3.46Å; Q349-L352 PolarHBondContact O-N 3.08Å; L352-V354 VanDerWaalsContact C-N 3.32Å; L352-V354 PolarHBondContact O-N 2.87Å; L352-I355 WeakPolarHBondContact O-CA 3.46Å; L352-I355 WeakPolarHBondContact O-CB 3.39Å; L352-I355 PolarHBondContact O-N 3.33Å; L352-V356 HydrophobicContact CD1-CG2 4.31Å; L352-V356 HydrophobicContact CG-CG2 4.1Å; L352-V356 PolarHBondContact O-N 3.42Å; L352-V356 VanDerWaalsContact O-N 3.14Å; L352-M380 HydrophobicContact CD1-CG 3.81Å; L352-M380 HydrophobicContact CD1-SD 4.13Å; L352-M380 HydrophobicContact CD2-CG 3.88Å; L352-M380 HydrophobicContact CG-CG 4.48Å; L352-M383 HydrophobicContact CD2-CE 4.17Å; L352-M383 HydrophobicContact CD2-SD 3.84Å; L352-A414 HydrophobicContact CD2-CB 3.56Å; L352-A414 HydrophobicContact CG-CB 3.97Å
353	E	97.7	Very high	95.7	Very high	49 Å²	49	27.3 Å²	27.3	23%	0.229	15%	0.146	C	C	.	.	H	α-helix	trans	-53.1	-45.2	-178.2	-173.3	54.6	-144	0	0	111.7	V313 Q349 L350 I355 V356 T357 R417	V313-E353 HydrophobicContact CG1-CG 3.92Å; V313-E353 HydrophobicContact CG2-CB 4.34Å; V313-E353 HydrophobicContact CG2-CG 4.32Å; Q349-E353 PolarHBondContact O-N 2.85Å; L350-E353 PolarHBondContact O-N 2.7Å; E353-I355 PolarHBondContact O-N 3.2Å; E353-V356 CarbonylContact O-C 3.51Å; E353-V356 WeakPolarHBondContact O-CA 3.17Å; E353-V356 PolarHBondContact O-N 3.3Å; E353-T357 WeakPolarHBondContact O-CB 3.45Å; E353-T357 PolarHBondContact O-N 2.75Å; E353-T357 PolarHBondContact O-OG1 3.3Å; E353-T357 PolarHBondContact OE1-OG1 3.1Å; E353-R417 IonicContact OE1-CZ 3.43Å; E353-R417 IonicContact OE1-NH1 2.72Å; E353-R417 PolarHBondContact OE1-NH1 2.99Å; E353-R417 VanDerWaalsContact OE1-NH1 3.12Å; E353-R417 IonicContact OE1-NH2 3.83Å; E353-R417 PolarHBondContact OE1-NH2 3.2Å; E353-R417 IonicContact OE2-CZ 3.39Å; E353-R417 IonicContact OE2-NH1 2.72Å; E353-R417 PolarHBondContact OE2-NH1 2.83Å; E353-R417 IonicContact OE2-NH2 2.76Å
354	V	98.1	Very high	95.6	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-50.8	-35.3	174.5	-179.8	0	0	0	0	113.1	L309 L312 V313 A316 T330 C334 L350 L352 L358	L309-V354 HydrophobicContact CD1-CG2 4.18Å; L312-V354 HydrophobicContact CB-CG2 4.47Å; L312-V354 HydrophobicContact CD2-CG1 4.39Å; L312-V354 HydrophobicContact CD2-CG2 4.28Å; L312-V354 HydrophobicContact CG-CG1 4.19Å; L312-V354 HydrophobicContact CG-CG2 4.1Å; V313-V354 HydrophobicContact CB-CG2 4.42Å; V313-V354 HydrophobicContact CG2-CG2 3.51Å; A316-V354 HydrophobicContact CB-CG1 4.08Å; T330-V354 HydrophobicContact CG2-CG1 4.39Å; C334-V354 HydrophobicContact CB-CB 4.47Å; C334-V354 VanDerWaalsContact SG-CG1 3.58Å; L350-V354 PolarHBondContact O-N 2.92Å; L352-V354 VanDerWaalsContact C-N 3.32Å; L352-V354 PolarHBondContact O-N 2.87Å; V354-L358 HydrophobicContact CG1-CD1 4.34Å; V354-L358 WeakPolarHBondContact O-CB 3.48Å; V354-L358 WeakPolarHBondContact O-CD1 3.26Å; V354-L358 WeakPolarHBondContact O-CG 3.06Å; V354-L358 PolarHBondContact O-N 2.76Å
355	I	98	Very high	95.6	Very high	2 Å²	2	23.3 Å²	23.3	1%	0.01	12%	0.122	C	C	.	.	H	α-helix	trans	-79.3	-38	178.6	-52.4	178.4	0	0	0	110.8	L331 C334 L335 L352 E353 S359 L366 I418	L331-I355 HydrophobicContact CD2-CG1 4.08Å; L331-I355 HydrophobicContact CD2-CG2 4.37Å; C334-I355 HydrophobicContact CB-CD1 4.09Å; C334-I355 HydrophobicContact CB-CG1 3.97Å; L335-I355 HydrophobicContact CB-CD1 4.48Å; L352-I355 WeakPolarHBondContact O-CA 3.46Å; L352-I355 WeakPolarHBondContact O-CB 3.39Å; L352-I355 PolarHBondContact O-N 3.33Å; E353-I355 PolarHBondContact O-N 3.2Å; I355-S359 PolarHBondContact O-N 3.05Å; I355-L366 HydrophobicContact CG2-CD2 4.35Å; I355-L366 WeakPolarHBondContact O-CD2 3.39Å; I355-I418 HydrophobicContact CG2-CD1 4.32Å
356	V	97.8	Very high	95.8	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-66.1	-53	176.9	-174.8	0	0	0	0	110.3	L352 E353 L358 S359 E360 A414 R417 I418	L352-V356 HydrophobicContact CD1-CG2 4.31Å; L352-V356 HydrophobicContact CG-CG2 4.1Å; L352-V356 PolarHBondContact O-N 3.42Å; L352-V356 VanDerWaalsContact O-N 3.14Å; E353-V356 CarbonylContact O-C 3.51Å; E353-V356 WeakPolarHBondContact O-CA 3.17Å; E353-V356 PolarHBondContact O-N 3.3Å; V356-L358 VanDerWaalsContact C-N 3.29Å; V356-L358 PolarHBondContact O-N 3.44Å; V356-S359 WeakPolarHBondContact O-CA 3.4Å; V356-S359 VanDerWaalsContact O-CB 3.25Å; V356-S359 WeakPolarHBondContact O-CB 3.17Å; V356-S359 PolarHBondContact O-N 3.35Å; V356-S359 PolarHBondContact O-OG 3.18Å; V356-E360 PolarHBondContact O-N 2.84Å; V356-A414 HydrophobicContact CG2-CB 3.57Å; V356-R417 HydrophobicContact CG1-CB 3.47Å; V356-R417 VanDerWaalsContact CG1-CB 3.47Å; V356-R417 HydrophobicContact CG1-CG 4.39Å; V356-I418 HydrophobicContact CB-CD1 4.4Å; V356-I418 HydrophobicContact CB-CG1 4.27Å; V356-I418 HydrophobicContact CG1-CG1 4.24Å; V356-I418 HydrophobicContact CG2-CD1 3.77Å; V356-I418 HydrophobicContact CG2-CG1 4.06Å
357	T	97.1	Very high	95.9	Very high	5 Å²	5	17.2 Å²	17.2	3%	0.031	9%	0.089	C	C	.	.	H	α-helix	trans	-53.3	-45	175.2	-44.1	0	0	0	0	111.5	A316 D317 E353 S359 E360 T361	A316-T357 HydrophobicContact CB-CG2 4.34Å; D317-T357 VanDerWaalsContact CA-CG2 3.43Å; D317-T357 HydrophobicContact CB-CG2 3.66Å; E353-T357 WeakPolarHBondContact O-CB 3.45Å; E353-T357 PolarHBondContact O-N 2.75Å; E353-T357 PolarHBondContact O-OG1 3.3Å; E353-T357 PolarHBondContact OE1-OG1 3.1Å; T357-S359 PolarHBondContact O-N 3.37Å; T357-E360 PolarHBondContact O-N 3.08Å; T357-T361 HydrophobicContact CG2-CG2 4.01Å; T357-T361 PolarHBondContact O-N 3.13Å; T357-T361 PolarHBondContact O-OG1 3Å; T357-T361 VanDerWaalsContact O-OG1 3.11Å
358	L	97.4	Very high	95.8	Very high	2 Å²	2	22.4 Å²	22.4	1%	0.01	11%	0.111	C	C	.	.	H	α-helix	trans	-64.3	-20.6	176.2	-80.1	173.7	0	0	0	114.2	A316 P320 L323 L327 L331 V354 V356 E360 A362 A363 L366	A316-L358 HydrophobicContact CB-CD2 4.18Å; A316-L358 HydrophobicContact CB-CG 3.93Å; P320-L358 HydrophobicContact CB-CD2 3.76Å; L323-L358 HydrophobicContact CD1-CD1 4.35Å; L323-L358 HydrophobicContact CD1-CD2 4.18Å; L327-L358 HydrophobicContact CD1-CD1 3.9Å; L331-L358 HydrophobicContact CD2-CD1 3.78Å; V354-L358 HydrophobicContact CG1-CD1 4.34Å; V354-L358 WeakPolarHBondContact O-CB 3.48Å; V354-L358 WeakPolarHBondContact O-CD1 3.26Å; V354-L358 WeakPolarHBondContact O-CG 3.06Å; V354-L358 PolarHBondContact O-N 2.76Å; V356-L358 VanDerWaalsContact C-N 3.29Å; V356-L358 PolarHBondContact O-N 3.44Å; L358-E360 VanDerWaalsContact C-N 3.33Å; L358-A362 HydrophobicContact CD2-CB 4.13Å; L358-A362 CarbonylContact O-C 3.57Å; L358-A362 PolarHBondContact O-N 3.16Å; L358-A363 PolarHBondContact O-N 3.04Å; L358-L366 HydrophobicContact CB-CD2 4.19Å
359	S	96.4	Very high	95.7	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-76.6	-21.6	172.4	80.3	0	0	0	0	113.2	I355 V356 T357 A363 G421	I355-S359 PolarHBondContact O-N 3.05Å; V356-S359 WeakPolarHBondContact O-CA 3.4Å; V356-S359 VanDerWaalsContact O-CB 3.25Å; V356-S359 WeakPolarHBondContact O-CB 3.17Å; V356-S359 PolarHBondContact O-N 3.35Å; V356-S359 PolarHBondContact O-OG 3.18Å; T357-S359 PolarHBondContact O-N 3.37Å; S359-A363 WeakPolarHBondContact O-CB 3.39Å; S359-G421 CarbonylContact O-C 3.6Å; S359-G421 VanDerWaalsContact O-CA 3.25Å; S359-G421 WeakPolarHBondContact O-CA 3.4Å
360	E	93.8	Very high	95.7	Very high	87 Å²	87	25 Å²	25	41%	0.407	13%	0.129	S	C	.	.	H	α-helix	trans	-95.8	-52.8	-179.8	-61.6	162.4	147.7	0	0	110.2	V356 T357 L358 R417	V356-E360 PolarHBondContact O-N 2.84Å; T357-E360 PolarHBondContact O-N 3.08Å; L358-E360 VanDerWaalsContact C-N 3.33Å; E360-R417 IonicContact OE1-CZ 2.9Å; E360-R417 IonicContact OE1-NE 3.05Å; E360-R417 PolarHBondContact OE1-NE 2.91Å; E360-R417 IonicContact OE1-NH2 2.75Å; E360-R417 PolarHBondContact OE1-NH2 3.39Å; E360-R417 IonicContact OE2-CZ 2.7Å; E360-R417 IonicContact OE2-NE 3.3Å; E360-R417 IonicContact OE2-NH2 3.27Å; E360-R417 PolarHBondContact OE2-NH2 2.96Å
361	T	92.6	Very high	95.6	Very high	54 Å²	54	26.9 Å²	26.9	33%	0.331	15%	0.148	S	C	.	.	H	α-helix	trans	-85.5	-22.5	-171.4	67.9	0	0	0	0	114.2	A316 D317 T357	A316-T361 PolarHBondContact O-OG1 2.8Å; D317-T361 WeakPolarHBondContact O-CG2 3.46Å; T357-T361 HydrophobicContact CG2-CG2 4.01Å; T357-T361 PolarHBondContact O-N 3.13Å; T357-T361 PolarHBondContact O-OG1 3Å; T357-T361 VanDerWaalsContact O-OG1 3.11Å
362	A	93.4	Very high	95.4	Very high	12 Å²	12	27 Å²	27	10%	0.099	15%	0.148	C	C	.	.	S	Bend	trans	-146.1	39.7	-179	0	0	0	0	0	112.8	P320 L358 A364 M365 L366	P320-A362 HydrophobicContact CB-CB 3.53Å; P320-A362 HydrophobicContact CG-CB 3.83Å; L358-A362 HydrophobicContact CD2-CB 4.13Å; L358-A362 CarbonylContact O-C 3.57Å; L358-A362 PolarHBondContact O-N 3.16Å; A362-A364 PolarHBondContact O-N 3.34Å; A362-A364 VanDerWaalsContact O-N 3.07Å; A362-M365 HydrophobicContact CB-CB 4.25Å; A362-M365 HydrophobicContact CB-CG 4.39Å; A362-M365 HydrophobicContact CB-SD 4.12Å; A362-M365 WeakPolarHBondContact O-CA 3.36Å; A362-M365 WeakPolarHBondContact O-CB 3.38Å; A362-M365 PolarHBondContact O-N 3.34Å; A362-L366 PolarHBondContact O-N 3.41Å; A362-L366 VanDerWaalsContact O-N 3.16Å
363	A	94	Very high	95.2	Very high	13 Å²	13	26.8 Å²	26.8	11%	0.107	15%	0.147	C	C	.	.	H	α-helix	trans	-42.2	-48.9	-178.8	0	0	0	0	0	113.1	L358 S359 M365 L366 R367 G421 L422	L358-A363 PolarHBondContact O-N 3.04Å; S359-A363 WeakPolarHBondContact O-CB 3.39Å; A363-M365 VanDerWaalsContact C-N 3.32Å; A363-M365 PolarHBondContact O-N 3.05Å; A363-L366 CarbonylContact O-C 3.55Å; A363-L366 PolarHBondContact O-N 2.87Å; A363-R367 VanDerWaalsContact CB-NH1 3.3Å; A363-R367 VanDerWaalsContact O-CG 3.31Å; A363-R367 WeakPolarHBondContact O-CG 3.47Å; A363-R367 PolarHBondContact O-N 3.22Å; A363-G421 WeakPolarHBondContact CB-O 3.32Å; A363-L422 HydrophobicContact CB-CD2 4.17Å
364	A	93	Very high	95.1	Very high	8 Å²	8	26.4 Å²	26.4	7%	0.066	15%	0.153	C	C	.	.	H	α-helix	trans	-64.8	-27.5	-179.1	0	0	0	0	0	114.9	A362 D891 D893 V896	A362-A364 PolarHBondContact O-N 3.34Å; A362-A364 VanDerWaalsContact O-N 3.07Å; A364-D891 HydrophobicContact CB-CB 4.06Å; A364-D891 WeakPolarHBondContact CB-O 3.5Å; A364-D893 VanDerWaalsContact CB-OD2 3.28Å; A364-D893 WeakPolarHBondContact CB-OD2 3.35Å; A364-V896 HydrophobicContact CB-CG2 3.91Å
365	M	94.1	Very high	95	Very high	6 Å²	6	30.5 Å²	30.5	3%	0.03	17%	0.172	C	C	.	.	H	α-helix	trans	-70.8	-47.1	168.3	-70.7	177.1	37.3	0	0	110.3	P320 K321 R324 L327 A362 A363 R367 K368 D891	P320-M365 WeakPolarHBondContact O-CE 3.32Å; K321-M365 HydrophobicContact CG-SD 4.14Å; R324-M365 HydrophobicContact CB-CE 3.62Å; R324-M365 HydrophobicContact CB-SD 4.28Å; R324-M365 HydrophobicContact CG-CE 3.94Å; R324-M365 HydrophobicContact CG-SD 4.27Å; L327-M365 HydrophobicContact CD2-CB 3.95Å; L327-M365 HydrophobicContact CD2-CE 3.89Å; A362-M365 HydrophobicContact CB-CB 4.25Å; A362-M365 HydrophobicContact CB-CG 4.39Å; A362-M365 HydrophobicContact CB-SD 4.12Å; A362-M365 WeakPolarHBondContact O-CA 3.36Å; A362-M365 WeakPolarHBondContact O-CB 3.38Å; A362-M365 PolarHBondContact O-N 3.34Å; A363-M365 VanDerWaalsContact C-N 3.32Å; A363-M365 PolarHBondContact O-N 3.05Å; M365-R367 VanDerWaalsContact C-N 3.35Å; M365-R367 PolarHBondContact O-N 3.14Å; M365-K368 WeakPolarHBondContact O-CB 3.39Å; M365-K368 PolarHBondContact O-N 2.91Å; M365-K368 VanDerWaalsContact O-N 3.14Å; M365-D891 WeakPolarHBondContact CG-OD2 3.46Å
366	L	96	Very high	94.9	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.01	17%	0.172	C	C	.	.	H	α-helix	trans	-67.4	-33.4	-177.8	-173.1	56.8	0	0	0	112.6	L331 I355 L358 A362 A363 K368 H369 V373 L422	L331-L366 HydrophobicContact CD1-CD1 3.6Å; L331-L366 HydrophobicContact CD2-CD1 3.87Å; L331-L366 HydrophobicContact CG-CD1 4.42Å; I355-L366 HydrophobicContact CG2-CD2 4.35Å; I355-L366 WeakPolarHBondContact O-CD2 3.39Å; L358-L366 HydrophobicContact CB-CD2 4.19Å; A362-L366 PolarHBondContact O-N 3.41Å; A362-L366 VanDerWaalsContact O-N 3.16Å; A363-L366 CarbonylContact O-C 3.55Å; A363-L366 PolarHBondContact O-N 2.87Å; L366-K368 PolarHBondContact O-N 3.25Å; L366-K368 VanDerWaalsContact O-N 3.09Å; L366-H369 WeakPolarHBondContact O-CA 3.33Å; L366-H369 PolarHBondContact O-N 3.37Å; L366-V373 HydrophobicContact CD1-CG2 3.92Å; L366-V373 HydrophobicContact CD2-CG2 4.44Å; L366-V373 HydrophobicContact CG-CG2 3.89Å; L366-L422 HydrophobicContact CB-CD2 4.24Å; L366-L422 HydrophobicContact CD2-CD1 4.09Å; L366-L422 HydrophobicContact CD2-CD2 4.2Å; L366-L422 HydrophobicContact CG-CD1 4.23Å; L366-L422 HydrophobicContact CG-CD2 4.31Å
367	R	94.6	Very high	94.9	Very high	30 Å²	30	30.4 Å²	30.4	11%	0.113	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-57.5	-20.5	172	-74.4	-167.1	-79.9	-94.9	0.9	113.4	A363 M365 H369 T370 G421 L422 I426 D893	A363-R367 VanDerWaalsContact CB-NH1 3.3Å; A363-R367 VanDerWaalsContact O-CG 3.31Å; A363-R367 WeakPolarHBondContact O-CG 3.47Å; A363-R367 PolarHBondContact O-N 3.22Å; M365-R367 VanDerWaalsContact C-N 3.35Å; M365-R367 PolarHBondContact O-N 3.14Å; R367-H369 VanDerWaalsContact C-N 3.35Å; R367-T370 WeakPolarHBondContact O-CG2 3.46Å; R367-G421 PolarHBondContact NH1-O 3.41Å; R367-L422 HydrophobicContact CG-CD2 4.02Å; R367-I426 HydrophobicContact CB-CD1 4.1Å; R367-I426 VanDerWaalsContact CD-CD1 3.4Å; R367-I426 HydrophobicContact CG-CD1 3.45Å; R367-I426 VanDerWaalsContact CG-CD1 3.45Å; R367-D893 IonicContact CZ-OD1 2.94Å; R367-D893 IonicContact CZ-OD2 3.29Å; R367-D893 VanDerWaalsContact CZ-OD2 3.29Å; R367-D893 IonicContact NE-OD1 3.3Å; R367-D893 IonicContact NE-OD2 3.09Å; R367-D893 PolarHBondContact NE-OD2 3.03Å; R367-D893 VanDerWaalsContact NH2-CG 3.33Å; R367-D893 IonicContact NH2-OD1 2.78Å; R367-D893 PolarHBondContact NH2-OD1 3.49Å; R367-D893 IonicContact NH2-OD2 2.72Å; R367-D893 PolarHBondContact NH2-OD2 2.91Å
368	K	94	Very high	94.9	Very high	117 Å²	117	31.8 Å²	31.8	51%	0.509	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-81.1	-13.3	173.8	-61.4	171.1	-178	-178.8	0	113.3	M365 L366 E890 D891	M365-K368 WeakPolarHBondContact O-CB 3.39Å; M365-K368 PolarHBondContact O-N 2.91Å; M365-K368 VanDerWaalsContact O-N 3.14Å; L366-K368 PolarHBondContact O-N 3.25Å; L366-K368 VanDerWaalsContact O-N 3.09Å; K368-E890 PolarHBondContact NZ-O 3.4Å; K368-D891 IonicContact NZ-OD1 3.14Å; K368-D891 PolarHBondContact NZ-OD1 3.16Å
369	H	95.6	Very high	94.8	Very high	46 Å²	46	33.9 Å²	33.9	21%	0.213	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-114.9	39	-177.5	-67.9	-94.3	0	0	0	112.8	E328 L331 L366 R367 A371 I372 V373	E328-H369 IonicContact OE2-CE1 2.69Å; E328-H369 IonicContact OE2-CG 3.19Å; E328-H369 IonicContact OE2-ND1 3.73Å; E328-H369 PolarHBondContact OE2-ND1 3.35Å; L331-H369 HydrophobicContact CD1-CB 3.95Å; L366-H369 WeakPolarHBondContact O-CA 3.33Å; L366-H369 PolarHBondContact O-N 3.37Å; R367-H369 VanDerWaalsContact C-N 3.35Å; H369-A371 PolarHBondContact O-N 3.24Å; H369-I372 PolarHBondContact O-N 2.91Å; H369-V373 PolarHBondContact O-N 3.08Å
370	T	94.2	Very high	94.9	Very high	62 Å²	62	33.9 Å²	33.9	38%	0.38	19%	0.19	S	C	.	.	H	α-helix	trans	-51.5	-27.2	-178.4	54.3	0	0	0	0	115.1	R367 I372 V373 A374 I426 M430	R367-T370 WeakPolarHBondContact O-CG2 3.46Å; T370-I372 VanDerWaalsContact C-N 3.29Å; T370-I372 PolarHBondContact O-N 3.43Å; T370-V373 PolarHBondContact O-N 3.02Å; T370-A374 WeakPolarHBondContact O-CB 3.25Å; T370-A374 PolarHBondContact O-N 2.59Å; T370-I426 HydrophobicContact CG2-CG2 4.38Å; T370-M430 HydrophobicContact CG2-CE 4.13Å
371	A	94.4	Very high	95.1	Very high	65 Å²	65	30.1 Å²	30.1	54%	0.537	17%	0.173	S	C	.	.	H	α-helix	trans	-64.7	-29.5	176.1	0	0	0	0	0	113.3	H369 Q375	H369-A371 PolarHBondContact O-N 3.24Å; A371-Q375 WeakPolarHBondContact O-CG 3.38Å; A371-Q375 PolarHBondContact O-NE2 3.15Å
372	I	93.3	Very high	95.3	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-83.5	-40.5	174.1	-58.9	178.4	0	0	0	110.7	L331 Q332 L335 H369 T370 A374 Q375 S376	L331-I372 HydrophobicContact CB-CD1 3.36Å; L331-I372 HydrophobicContact CB-CG2 4.03Å; L331-I372 HydrophobicContact CD1-CD1 3.99Å; L331-I372 HydrophobicContact CG-CD1 4.34Å; Q332-I372 HydrophobicContact CG-CD1 3.89Å; L335-I372 HydrophobicContact CD2-CG2 4.33Å; H369-I372 PolarHBondContact O-N 2.91Å; T370-I372 VanDerWaalsContact C-N 3.29Å; T370-I372 PolarHBondContact O-N 3.43Å; I372-A374 PolarHBondContact O-N 3.02Å; I372-Q375 CarbonylContact O-C 3.6Å; I372-Q375 WeakPolarHBondContact O-CA 3.39Å; I372-Q375 WeakPolarHBondContact O-CB 3.24Å; I372-Q375 PolarHBondContact O-N 3.3Å; I372-S376 PolarHBondContact O-N 3.42Å
373	V	94.9	Very high	95.4	Very high	1 Å²	1	31 Å²	31	1%	0.006	18%	0.177	C	C	.	.	H	α-helix	trans	-55.6	-42	174.1	-177.6	0	0	0	0	110.9	L366 H369 T370 Q375 S376 V377 L422 I427 M430	L366-V373 HydrophobicContact CD1-CG2 3.92Å; L366-V373 HydrophobicContact CD2-CG2 4.44Å; L366-V373 HydrophobicContact CG-CG2 3.89Å; H369-V373 PolarHBondContact O-N 3.08Å; T370-V373 PolarHBondContact O-N 3.02Å; V373-Q375 PolarHBondContact O-N 3.07Å; V373-S376 PolarHBondContact O-N 3.06Å; V373-S376 PolarHBondContact O-OG 2.89Å; V373-V377 PolarHBondContact O-N 3.49Å; V373-L422 HydrophobicContact CB-CD1 4.4Å; V373-L422 HydrophobicContact CG1-CD1 3.63Å; V373-L422 HydrophobicContact CG2-CD1 3.82Å; V373-I427 HydrophobicContact CG1-CD1 3.58Å; V373-M430 HydrophobicContact CB-CE 4.5Å; V373-M430 HydrophobicContact CB-SD 4.25Å; V373-M430 HydrophobicContact CG1-CE 4.46Å; V373-M430 HydrophobicContact CG1-SD 3.89Å
374	A	95.8	Very high	95.5	Very high	41 Å²	41	30.5 Å²	30.5	34%	0.339	17%	0.173	S	C	.	.	H	α-helix	trans	-64.9	-18.8	174.3	0	0	0	0	0	114.2	T370 I372 P378 M430	T370-A374 WeakPolarHBondContact O-CB 3.25Å; T370-A374 PolarHBondContact O-N 2.59Å; I372-A374 PolarHBondContact O-N 3.02Å; A374-P378 VanDerWaalsContact O-CD 3.23Å; A374-P378 WeakPolarHBondContact O-CD 3.24Å; A374-M430 HydrophobicContact CB-CE 4.48Å; A374-M430 HydrophobicContact CB-CG 4.29Å; A374-M430 HydrophobicContact CB-SD 3.86Å
375	Q	95.9	Very high	95.7	Very high	86 Å²	86	31.1 Å²	31.1	40%	0.402	18%	0.175	S	C	.	.	H	α-helix	trans	-95	-25.3	176	-70	172.1	87	0	0	113.3	L335 A371 I372 V373 P378	L335-Q375 HydrophobicContact CD1-CB 4.19Å; L335-Q375 HydrophobicContact CD2-CB 3.59Å; L335-Q375 HydrophobicContact CD2-CG 4.42Å; A371-Q375 WeakPolarHBondContact O-CG 3.38Å; A371-Q375 PolarHBondContact O-NE2 3.15Å; I372-Q375 CarbonylContact O-C 3.6Å; I372-Q375 WeakPolarHBondContact O-CA 3.39Å; I372-Q375 WeakPolarHBondContact O-CB 3.24Å; I372-Q375 PolarHBondContact O-N 3.3Å; V373-Q375 PolarHBondContact O-N 3.07Å; Q375-P378 WeakPolarHBondContact O-CD 3.04Å
376	S	95.7	Very high	95.6	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.007	20%	0.197	C	C	.	.	H	α-helix	trans	-73.5	-33.8	173.1	61	0	0	0	0	112.1	I372 V373 Q379 M380	I372-S376 PolarHBondContact O-N 3.42Å; V373-S376 PolarHBondContact O-N 3.06Å; V373-S376 PolarHBondContact O-OG 2.89Å; S376-Q379 WeakPolarHBondContact O-CA 3.48Å; S376-Q379 WeakPolarHBondContact O-CB 3.32Å; S376-Q379 PolarHBondContact O-N 3.07Å; S376-M380 PolarHBondContact O-N 3.49Å
377	V	96.6	Very high	95.4	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-50.7	-51.1	175.5	166.1	0	0	0	0	112.6	V373 Q379 M380 L381 I431	V373-V377 PolarHBondContact O-N 3.49Å; V377-Q379 VanDerWaalsContact C-N 3.29Å; V377-Q379 PolarHBondContact O-N 3.04Å; V377-M380 HydrophobicContact CB-CE 4.45Å; V377-M380 HydrophobicContact CG2-CE 3.97Å; V377-M380 PolarHBondContact O-N 3.04Å; V377-L381 HydrophobicContact CG1-CD1 3.94Å; V377-L381 VanDerWaalsContact O-CG 3.3Å; V377-L381 WeakPolarHBondContact O-CG 3.4Å; V377-L381 PolarHBondContact O-N 3.36Å; V377-I431 HydrophobicContact CG1-CB 3.92Å; V377-I431 HydrophobicContact CG1-CD1 4.03Å; V377-I431 HydrophobicContact CG1-CG1 3.75Å
378	P	96.6	Very high	95	Very high	34 Å²	34	42.4 Å²	42.4	22%	0.221	23%	0.233	C	C	.	.	H	α-helix	trans	-60.1	-27.2	171.7	-28.5	35.6	0	0	0	116.1	A374 Q375 T382	A374-P378 VanDerWaalsContact O-CD 3.23Å; A374-P378 WeakPolarHBondContact O-CD 3.24Å; Q375-P378 WeakPolarHBondContact O-CD 3.04Å; P378-T382 WeakPolarHBondContact O-CB 3.33Å; P378-T382 PolarHBondContact O-N 2.91Å; P378-T382 PolarHBondContact O-OG1 2.81Å
379	Q	96.9	Very high	94.6	Very high	46 Å²	46	41.7 Å²	41.7	22%	0.215	23%	0.234	C	C	.	.	H	α-helix	trans	-72	-48.2	176.8	-55.5	-48.6	-48.4	0	0	110.6	L335 S376 V377 L381 T382 M383	L335-Q379 HydrophobicContact CD1-CG 3.71Å; S376-Q379 WeakPolarHBondContact O-CA 3.48Å; S376-Q379 WeakPolarHBondContact O-CB 3.32Å; S376-Q379 PolarHBondContact O-N 3.07Å; V377-Q379 VanDerWaalsContact C-N 3.29Å; V377-Q379 PolarHBondContact O-N 3.04Å; Q379-L381 VanDerWaalsContact C-N 3.34Å; Q379-L381 PolarHBondContact O-N 2.91Å; Q379-T382 WeakPolarHBondContact O-CA 3.32Å; Q379-T382 WeakPolarHBondContact O-CB 3.44Å; Q379-T382 PolarHBondContact O-N 3.11Å; Q379-M383 WeakPolarHBondContact O-CG 3.5Å; Q379-M383 PolarHBondContact O-N 3.06Å
380	M	97.7	Very high	94.1	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-55.8	-49.9	175.1	-61.9	-172.7	-68.5	0	0	110.6	L352 S376 V377 T382 M383 M384 A414 L415 I418	L352-M380 HydrophobicContact CD1-CG 3.81Å; L352-M380 HydrophobicContact CD1-SD 4.13Å; L352-M380 HydrophobicContact CD2-CG 3.88Å; L352-M380 HydrophobicContact CG-CG 4.48Å; S376-M380 PolarHBondContact O-N 3.49Å; V377-M380 HydrophobicContact CB-CE 4.45Å; V377-M380 HydrophobicContact CG2-CE 3.97Å; V377-M380 PolarHBondContact O-N 3.04Å; M380-T382 PolarHBondContact O-N 3.39Å; M380-M383 WeakPolarHBondContact O-CB 3.37Å; M380-M383 PolarHBondContact O-N 3.08Å; M380-M383 VanDerWaalsContact O-N 3.08Å; M380-M384 VanDerWaalsContact O-CG 3.32Å; M380-M384 WeakPolarHBondContact O-CG 3.19Å; M380-M384 PolarHBondContact O-N 3.47Å; M380-A414 HydrophobicContact CG-CB 4.43Å; M380-A414 HydrophobicContact SD-CB 3.87Å; M380-L415 HydrophobicContact CB-CB 4.48Å; M380-L415 HydrophobicContact CE-CB 4.24Å; M380-L415 HydrophobicContact CE-CD1 3.77Å; M380-L415 HydrophobicContact SD-CB 4.01Å; M380-I418 HydrophobicContact CE-CD1 4.08Å; M380-I418 HydrophobicContact SD-CD1 3.88Å
381	L	97.7	Very high	93.6	Very high	7 Å²	7	47.4 Å²	47.4	4%	0.037	26%	0.264	C	S	.	.	H	α-helix	trans	-62.4	-27.7	176	-67.4	175	0	0	0	114.1	V377 Q379 M384 V385 L415 I431 H434 M438 A453	V377-L381 HydrophobicContact CG1-CD1 3.94Å; V377-L381 VanDerWaalsContact O-CG 3.3Å; V377-L381 WeakPolarHBondContact O-CG 3.4Å; V377-L381 PolarHBondContact O-N 3.36Å; Q379-L381 VanDerWaalsContact C-N 3.34Å; Q379-L381 PolarHBondContact O-N 2.91Å; L381-M384 HydrophobicContact CD2-SD 4.21Å; L381-V385 WeakPolarHBondContact O-CG2 3.35Å; L381-V385 PolarHBondContact O-N 3.22Å; L381-L415 HydrophobicContact CD2-CD2 4.41Å; L381-I431 HydrophobicContact CD1-CD1 4.42Å; L381-I431 HydrophobicContact CD1-CG1 4.2Å; L381-I431 HydrophobicContact CD2-CD1 4.24Å; L381-H434 HydrophobicContact CD1-CB 3.52Å; L381-M438 HydrophobicContact CB-CE 4.19Å; L381-M438 HydrophobicContact CB-SD 4Å; L381-M438 HydrophobicContact CD1-SD 3.84Å; L381-M438 HydrophobicContact CD2-CE 4.14Å; L381-M438 HydrophobicContact CD2-SD 3.82Å; L381-M438 HydrophobicContact CG-SD 4.11Å; L381-A453 HydrophobicContact CD2-CB 3.44Å; L381-A453 VanDerWaalsContact CD2-CB 3.44Å
382	T	96.5	Very high	93.1	Very high	83 Å²	83	51.7 Å²	51.7	51%	0.509	27%	0.273	S	S	.	.	H	α-helix	trans	-75.7	-38.5	174.4	-60.3	0	0	0	0	110.8	P378 Q379 M380 V385	P378-T382 WeakPolarHBondContact O-CB 3.33Å; P378-T382 PolarHBondContact O-N 2.91Å; P378-T382 PolarHBondContact O-OG1 2.81Å; Q379-T382 WeakPolarHBondContact O-CA 3.32Å; Q379-T382 WeakPolarHBondContact O-CB 3.44Å; Q379-T382 PolarHBondContact O-N 3.11Å; M380-T382 PolarHBondContact O-N 3.39Å; T382-V385 PolarHBondContact O-N 3.33Å
383	M	95.9	Very high	92.9	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-63.8	-40.7	173.4	-69.2	174.7	60.9	0	0	111.4	Q349 L352 Q379 M380 V385 D386 N407 A408 A410	Q349-M383 HydrophobicContact CG-CE 3.87Å; L352-M383 HydrophobicContact CD2-CE 4.17Å; L352-M383 HydrophobicContact CD2-SD 3.84Å; Q379-M383 WeakPolarHBondContact O-CG 3.5Å; Q379-M383 PolarHBondContact O-N 3.06Å; M380-M383 WeakPolarHBondContact O-CB 3.37Å; M380-M383 PolarHBondContact O-N 3.08Å; M380-M383 VanDerWaalsContact O-N 3.08Å; M383-V385 PolarHBondContact O-N 2.97Å; M383-D386 VanDerWaalsContact O-CB 3.23Å; M383-D386 WeakPolarHBondContact O-CB 3.5Å; M383-D386 PolarHBondContact O-N 3.48Å; M383-N407 HydrophobicContact CB-CB 4.12Å; M383-N407 WeakPolarHBondContact CB-O 3.41Å; M383-N407 HydrophobicContact CE-CB 4.34Å; M383-N407 HydrophobicContact CG-CB 4.42Å; M383-N407 CarbonylContact O-C 3.6Å; M383-A408 WeakPolarHBondContact O-CA 3.32Å; M383-A408 PolarHBondContact O-N 2.92Å; M383-A410 HydrophobicContact CE-CB 4.25Å
384	M	96.1	Very high	92.6	Very high	4 Å²	4	52.7 Å²	52.7	2%	0.02	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-17.8	174.1	-64.9	175.6	79.1	0	0	115	M380 L381 E412 L415 A449 M452 A453	M380-M384 VanDerWaalsContact O-CG 3.32Å; M380-M384 WeakPolarHBondContact O-CG 3.19Å; M380-M384 PolarHBondContact O-N 3.47Å; L381-M384 HydrophobicContact CD2-SD 4.21Å; M384-E412 HydrophobicContact CE-CB 3.74Å; M384-E412 HydrophobicContact CE-CG 3.74Å; M384-E412 HydrophobicContact CG-CB 4.38Å; M384-E412 HydrophobicContact SD-CB 4.36Å; M384-L415 HydrophobicContact SD-CD2 4.08Å; M384-A449 HydrophobicContact CB-CB 3.83Å; M384-A449 WeakPolarHBondContact O-CB 3.13Å; M384-M452 HydrophobicContact CE-CB 3.64Å; M384-A453 HydrophobicContact CE-CB 3.81Å; M384-A453 VanDerWaalsContact CE-N 3.27Å; M384-A453 HydrophobicContact SD-CB 4.01Å
385	V	96.8	Very high	92.1	Very high	21 Å²	21	57 Å²	57	13%	0.127	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-11.8	175.9	170.5	0	0	0	0	112	L381 T382 M383 L387 M438 K445 Y446 A449	L381-V385 WeakPolarHBondContact O-CG2 3.35Å; L381-V385 PolarHBondContact O-N 3.22Å; T382-V385 PolarHBondContact O-N 3.33Å; M383-V385 PolarHBondContact O-N 2.97Å; V385-L387 PolarHBondContact O-N 3.25Å; V385-M438 HydrophobicContact CG2-CE 3.84Å; V385-K445 HydrophobicContact CG1-CB 4.04Å; V385-Y446 HydrophobicContact CG1-CD2 4Å; V385-Y446 HydrophobicContact CG1-CE1 4.37Å; V385-Y446 HydrophobicContact CG1-CE2 3.83Å; V385-Y446 HydrophobicContact CG1-CG 4.39Å; V385-Y446 HydrophobicContact CG2-CD1 3.86Å; V385-Y446 HydrophobicContact CG2-CE1 4.07Å; V385-Y446 HydrophobicContact CG2-CG 4.12Å; V385-A449 HydrophobicContact CG2-CB 3.52Å
386	D	93.2	Very high	91.5	Very high	92 Å²	92	54.2 Å²	54.2	49%	0.492	29%	0.286	S	S	.	.			trans	-78.8	63.4	-178.8	-159.5	25.4	0	0	0	111.5	M383 N407	M383-D386 VanDerWaalsContact O-CB 3.23Å; M383-D386 WeakPolarHBondContact O-CB 3.5Å; M383-D386 PolarHBondContact O-N 3.48Å; D386-N407 HydrophobicContact CB-CB 4.03Å; D386-N407 PolarHBondContact OD2-ND2 2.91Å
387	L	90.3	Very high	90.8	Very high	16 Å²	16	56.1 Å²	56.1	8%	0.084	30%	0.296	C	S	.	.			trans	-105.5	141	-178.2	-62.7	166.7	0	0	0	110.3	V385 A408 W444 K445 H448	V385-L387 PolarHBondContact O-N 3.25Å; L387-A408 HydrophobicContact CD2-CB 3.55Å; L387-A408 HydrophobicContact CG-CB 4.38Å; L387-W444 HydrophobicContact CB-CH2 4.18Å; L387-W444 HydrophobicContact CD1-CH2 4.25Å; L387-W444 HydrophobicContact CD1-CZ3 3.92Å; L387-K445 HydrophobicContact CB-CD 4.34Å; L387-K445 HydrophobicContact CB-CG 4.49Å; L387-K445 HydrophobicContact CD1-CB 4.47Å; L387-K445 VanDerWaalsContact O-CE 3.29Å; L387-K445 WeakPolarHBondContact O-CE 3.35Å; L387-K445 PolarHBondContact O-NZ 3.41Å; L387-H448 HydrophobicContact CD1-CB 4.2Å; L387-H448 WeakPolarHBondContact CD1-ND1 3.45Å
388	E	86.8	Confident	89.6	Confident	167 Å²	167	62 Å²	62	78%	0.78	32%	0.323	S	S	*	.			trans	-75.1	156	169.2	-56.5	-149.1	162.7	0	0	111.8	R486	E388-R486 PolarHBondContact O-NH1 3.06Å
389	D	85.4	Confident	88.1	Confident	102 Å²	102	65.1 Å²	65.1	55%	0.545	34%	0.338	S	S	.	.			trans	-111.5	87	-177.6	-153.2	8.2	0	0	0	108.4	W444	D389-W444 HydrophobicContact CB-CZ2 4.42Å; D389-W444 WeakPolarHBondContact OD1-CZ2 3.35Å; D389-W444 PolarHBondContact OD1-NE1 3.21Å
390	D	84.9	Confident	86.4	Confident	69 Å²	69	68.2 Å²	68.2	37%	0.369	35%	0.352	S	S	.	.			trans	-99.8	126.4	178.5	171.5	38.3	0	0	0	111.2	E392 W393	D390-E392 PolarHBondContact OD1-N 2.92Å; D390-W393 HydrophobicContact CB-CB 4.26Å; D390-W393 VanDerWaalsContact OD2-CA 3.26Å; D390-W393 WeakPolarHBondContact OD2-CA 3.49Å; D390-W393 WeakPolarHBondContact OD2-CB 3.27Å; D390-W393 PolarHBondContact OD2-N 3.35Å
391	D	83.3	Confident	84.2	Confident	158 Å²	158	73.4 Å²	73.4	85%	0.845	38%	0.38	S	S	*	.	S	Bend	trans	-74.8	-24.7	178.8	-80.9	-39.5	0	0	0	112.5
392	E	85.9	Confident	81.9	Confident	156 Å²	156	80.8 Å²	80.8	73%	0.729	42%	0.419	S	S	*	.	S	Bend	trans	-88.7	-20	-177.6	-61.3	-160.8	172.9	0	0	113.1	D390 A394 M395 A396	D390-E392 PolarHBondContact OD1-N 2.92Å; E392-A394 PolarHBondContact O-N 3.21Å; E392-M395 PolarHBondContact O-N 2.91Å; E392-A396 PolarHBondContact O-N 3.18Å
393	W	88.9	Confident	80.1	Confident	9 Å²	9	80 Å²	80	3%	0.034	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-38.7	-48.1	-178.8	-178.6	93.6	0	0	0	113.8	D390 M395 A396 P485 R486 Y489 R529	D390-W393 HydrophobicContact CB-CB 4.26Å; D390-W393 VanDerWaalsContact OD2-CA 3.26Å; D390-W393 WeakPolarHBondContact OD2-CA 3.49Å; D390-W393 WeakPolarHBondContact OD2-CB 3.27Å; D390-W393 PolarHBondContact OD2-N 3.35Å; W393-M395 PolarHBondContact O-N 2.89Å; W393-A396 PolarHBondContact O-N 3.02Å; W393-P485 HydrophobicContact CZ3-CB 4.33Å; W393-R486 HydrophobicContact CD2-CG 3.58Å; W393-R486 HydrophobicContact CE3-CG 3.51Å; W393-R486 HydrophobicContact CG-CG 4.33Å; W393-R486 HydrophobicContact CH2-CB 4.49Å; W393-R486 HydrophobicContact CH2-CG 3.88Å; W393-R486 HydrophobicContact CZ2-CG 3.88Å; W393-R486 HydrophobicContact CZ3-CB 4.49Å; W393-R486 HydrophobicContact CZ3-CG 3.69Å; W393-Y489 HydrophobicContact CH2-CD1 4.49Å; W393-Y489 AromaticContact CH2-CD2 3.75Å; W393-Y489 HydrophobicContact CH2-CD2 3.75Å; W393-Y489 HydrophobicContact CH2-CE2 4.49Å; W393-Y489 AromaticContact CH2-CG 3.75Å; W393-Y489 HydrophobicContact CH2-CG 3.75Å; W393-Y489 HydrophobicContact CZ2-CD1 4.48Å; W393-Y489 HydrophobicContact CZ2-CD2 4.16Å; W393-Y489 HydrophobicContact CZ2-CG 4.14Å; W393-R529 VanDerWaalsContact CD1-NH1 3.32Å; W393-R529 HydrophobicContact CH2-CB 3.94Å; W393-R529 HydrophobicContact CZ3-CB 4.07Å; W393-R529 VanDerWaalsContact NE1-NH1 3.15Å; W393-R529 WeakPolarHBondContact O-CD 3.38Å
394	A	86.7	Confident	78.6	Confident	13 Å²	13	87.1 Å²	87.1	11%	0.107	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-65.8	-22.6	-174.2	0	0	0	0	0	113.9	E392 P485 P528	E392-A394 PolarHBondContact O-N 3.21Å; A394-P485 HydrophobicContact CB-CB 4.31Å; A394-P485 HydrophobicContact CB-CG 4.26Å; A394-P528 WeakPolarHBondContact O-CD 3.39Å
395	M	85.9	Confident	77.5	Confident	131 Å²	131	93.1 Å²	93.1	65%	0.645	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-108.3	-3.5	-174	-60.7	-66.1	-92.7	0	0	113.3	E392 W393 D397 P528	E392-M395 PolarHBondContact O-N 2.91Å; W393-M395 PolarHBondContact O-N 2.89Å; M395-D397 PolarHBondContact O-N 3.14Å; M395-P528 HydrophobicContact SD-CG 4.28Å
396	A	84.6	Confident	77.1	Confident	28 Å²	28	93.1 Å²	93.1	23%	0.231	48%	0.477	C	S	.	.			trans	-59.5	133.1	171.8	0	0	0	0	0	111	E392 W393	E392-A396 PolarHBondContact O-N 3.18Å; W393-A396 PolarHBondContact O-N 3.02Å
397	D	79.8	Confident	77	Confident	41 Å²	41	88.9 Å²	88.9	22%	0.219	45%	0.454	C	S	.	.	S	Bend	trans	-98.2	0.4	178.2	-167.2	58.1	0	0	0	112.2	M395 T577 K578 L579	M395-D397 PolarHBondContact O-N 3.14Å; D397-T577 WeakPolarHBondContact OD2-CA 3.24Å; D397-K578 PolarHBondContact OD1-N 3.11Å; D397-K578 WeakPolarHBondContact OD2-CG 3.5Å; D397-K578 PolarHBondContact OD2-N 2.57Å; D397-K578 IonicContact OD2-NZ 3.54Å; D397-L579 WeakPolarHBondContact OD1-CB 3.33Å; D397-L579 PolarHBondContact OD1-N 2.9Å
398	E	71.6	Confident	77.1	Confident	123 Å²	123	88.6 Å²	88.6	58%	0.575	45%	0.454	S	S	*	.	S	Bend	trans	-130.7	155.4	177.5	-62.1	-174.6	158.8	0	0	108.2	K578	E398-K578 IonicContact OE1-NZ 2.8Å; E398-K578 PolarHBondContact OE1-NZ 2.65Å
399	L	65.1	Low	77.3	Confident	100 Å²	100	83.1 Å²	83.1	52%	0.524	43%	0.432	S	S	.	.			trans	-88.1	145.6	172.6	-60.7	173.1	0	0	0	107.3
400	E	60.5	Low	77.6	Confident	111 Å²	111	79.5 Å²	79.5	52%	0.519	42%	0.416	S	S	.	.			trans	-90.9	119.7	177.1	-68.2	168.2	147.6	0	0	108	D402	E400-D402 PolarHBondContact O-N 3.25Å
401	D	52.3	Low	78.2	Confident	110 Å²	110	76.2 Å²	76.2	59%	0.588	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-75.1	-14.5	-177.6	-59.8	-54.5	0	0	0	112.5	D403 F404	D401-D403 PolarHBondContact O-N 2.93Å; D401-D403 VanDerWaalsContact O-N 3.1Å; D401-F404 WeakPolarHBondContact O-CD2 3.42Å
402	D	48.7	Very low	78.8	Confident	161 Å²	161	71 Å²	71	86%	0.861	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-66.9	-7.8	-179.9	-70.3	-33.9	0	0	0	114.6	E400	E400-D402 PolarHBondContact O-N 3.25Å
403	D	59.9	Low	79.2	Confident	68 Å²	68	66.1 Å²	66.1	36%	0.364	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-82.2	-14.5	-172.1	-121.2	-6.7	0	0	0	113.9	D401 D405 S406 V409	D401-D403 PolarHBondContact O-N 2.93Å; D401-D403 VanDerWaalsContact O-N 3.1Å; D403-D405 PolarHBondContact O-N 2.98Å; D403-S406 WeakPolarHBondContact O-CB 3.28Å; D403-S406 PolarHBondContact O-N 3.32Å; D403-S406 PolarHBondContact O-OG 3.06Å; D403-V409 VanDerWaalsContact O-CG2 3.3Å; D403-V409 WeakPolarHBondContact O-CG2 3.27Å
404	F	63.5	Low	79.6	Confident	150 Å²	150	66 Å²	66	66%	0.658	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-38.9	-173.1	-70.9	-69.3	0	0	0	114.3	D401 S406	D401-F404 WeakPolarHBondContact O-CD2 3.42Å; F404-S406 PolarHBondContact O-N 3.06Å
405	D	73.3	Confident	80.1	Confident	129 Å²	129	65.3 Å²	65.3	69%	0.69	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	1	178	-81.9	-24	0	0	0	113.5	Q349 D403	Q349-D405 PolarHBondContact NE2-O 2.99Å; D403-D405 PolarHBondContact O-N 2.98Å
406	S	88.3	Confident	80.7	Confident	22 Å²	22	61.3 Å²	61.3	15%	0.154	33%	0.329	C	S	.	.	S	Bend	trans	-64.3	153.8	-177.1	71.9	0	0	0	0	112.5	Q349 D403 F404 A408 V409 A410	Q349-S406 PolarHBondContact NE2-O 2.9Å; D403-S406 WeakPolarHBondContact O-CB 3.28Å; D403-S406 PolarHBondContact O-N 3.32Å; D403-S406 PolarHBondContact O-OG 3.06Å; F404-S406 PolarHBondContact O-N 3.06Å; S406-A408 PolarHBondContact O-N 2.78Å; S406-A408 PolarHBondContact OG-N 3.48Å; S406-V409 WeakPolarHBondContact OG-CG2 3.47Å; S406-V409 PolarHBondContact OG-N 3.37Å; S406-V409 VanDerWaalsContact OG-N 3.14Å; S406-A410 WeakPolarHBondContact O-CB 3.23Å; S406-A410 PolarHBondContact O-N 3.1Å; S406-A410 VanDerWaalsContact O-N 3.12Å
407	N	91.8	Very high	81.3	Confident	3 Å²	3	63 Å²	63	2%	0.016	33%	0.329	C	S	.	.	H	α-helix	trans	-58.2	-32.8	169	-80.3	-31.4	0	0	0	110.9	N345 R348 M383 D386 G411	N345-N407 VanDerWaalsContact CG-ND2 3.29Å; N345-N407 PolarHBondContact ND2-ND2 3.03Å; N345-N407 PolarHBondContact OD1-ND2 3.12Å; N345-N407 PolarHBondContact OD1-OD1 3.5Å; R348-N407 PolarHBondContact NH1-ND2 3.46Å; M383-N407 HydrophobicContact CB-CB 4.12Å; M383-N407 WeakPolarHBondContact CB-O 3.41Å; M383-N407 HydrophobicContact CE-CB 4.34Å; M383-N407 HydrophobicContact CG-CB 4.42Å; M383-N407 CarbonylContact O-C 3.6Å; D386-N407 HydrophobicContact CB-CB 4.03Å; D386-N407 PolarHBondContact OD2-ND2 2.91Å; N407-G411 PolarHBondContact O-N 3.11Å
408	A	92.2	Very high	82.1	Confident	9 Å²	9	61 Å²	61	7%	0.074	32%	0.319	C	S	.	.	H	α-helix	trans	-67.2	-50	-175.9	0	0	0	0	0	112.3	M383 L387 S406 G411 E412	M383-A408 WeakPolarHBondContact O-CA 3.32Å; M383-A408 PolarHBondContact O-N 2.92Å; L387-A408 HydrophobicContact CD2-CB 3.55Å; L387-A408 HydrophobicContact CG-CB 4.38Å; S406-A408 PolarHBondContact O-N 2.78Å; S406-A408 PolarHBondContact OG-N 3.48Å; A408-G411 PolarHBondContact O-N 3.42Å; A408-E412 PolarHBondContact O-N 3.34Å
409	V	91.1	Very high	83.3	Confident	53 Å²	53	55.2 Å²	55.2	32%	0.321	29%	0.291	S	S	.	.	H	α-helix	trans	-66	-45.6	177.5	174.1	0	0	0	0	111	D403 S406 G411 E412 S413	D403-V409 VanDerWaalsContact O-CG2 3.3Å; D403-V409 WeakPolarHBondContact O-CG2 3.27Å; S406-V409 WeakPolarHBondContact OG-CG2 3.47Å; S406-V409 PolarHBondContact OG-N 3.37Å; S406-V409 VanDerWaalsContact OG-N 3.14Å; V409-G411 VanDerWaalsContact C-N 3.31Å; V409-G411 PolarHBondContact O-N 2.78Å; V409-E412 PolarHBondContact O-N 3.22Å; V409-E412 VanDerWaalsContact O-N 3.15Å; V409-S413 PolarHBondContact O-N 3.14Å
410	A	92.3	Very high	84.8	Confident	26 Å²	26	52.9 Å²	52.9	22%	0.215	28%	0.283	C	S	.	.	H	α-helix	trans	-61.1	-37.9	176.9	0	0	0	0	0	112.9	Q349 M383 S406 A414	Q349-A410 HydrophobicContact CG-CB 3.84Å; M383-A410 HydrophobicContact CE-CB 4.25Å; S406-A410 WeakPolarHBondContact O-CB 3.23Å; S406-A410 PolarHBondContact O-N 3.1Å; S406-A410 VanDerWaalsContact O-N 3.12Å; A410-A414 WeakPolarHBondContact O-CB 3.44Å; A410-A414 PolarHBondContact O-N 2.61Å
411	G	96.4	Very high	86.3	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-70	-31.2	176.1	0	0	0	0	0	113.6	N407 A408 V409 L415	N407-G411 PolarHBondContact O-N 3.11Å; A408-G411 PolarHBondContact O-N 3.42Å; V409-G411 VanDerWaalsContact C-N 3.31Å; V409-G411 PolarHBondContact O-N 2.78Å; G411-L415 WeakPolarHBondContact O-CB 3.26Å; G411-L415 PolarHBondContact O-N 3.3Å
412	E	95.7	Very high	88.4	Confident	47 Å²	47	43.5 Å²	43.5	22%	0.22	24%	0.242	C	C	.	.	H	α-helix	trans	-72.1	-52.6	175.1	-170.1	171.6	157	0	0	111.5	M384 A408 V409 A414 L415 D416 M452 A456	M384-E412 HydrophobicContact CE-CB 3.74Å; M384-E412 HydrophobicContact CE-CG 3.74Å; M384-E412 HydrophobicContact CG-CB 4.38Å; M384-E412 HydrophobicContact SD-CB 4.36Å; A408-E412 PolarHBondContact O-N 3.34Å; V409-E412 PolarHBondContact O-N 3.22Å; V409-E412 VanDerWaalsContact O-N 3.15Å; E412-A414 VanDerWaalsContact C-N 3.34Å; E412-A414 PolarHBondContact O-N 2.66Å; E412-L415 WeakPolarHBondContact O-CB 3.49Å; E412-L415 PolarHBondContact O-N 3.4Å; E412-D416 PolarHBondContact O-N 3.43Å; E412-D416 VanDerWaalsContact O-N 3.09Å; E412-M452 VanDerWaalsContact OE1-CE 3.27Å; E412-M452 WeakPolarHBondContact OE1-CE 3.45Å; E412-M452 WeakPolarHBondContact OE2-CB 2.89Å; E412-M452 VanDerWaalsContact OE2-CE 3.27Å; E412-M452 WeakPolarHBondContact OE2-CE 3.46Å; E412-A456 HydrophobicContact CG-CB 3.94Å
413	S	95.2	Very high	90.5	Very high	55 Å²	55	36.8 Å²	36.8	39%	0.385	21%	0.21	S	C	.	.	H	α-helix	trans	-60.6	-41.2	178.6	176.1	0	0	0	0	112.4	V409 L415 D416 R417	V409-S413 PolarHBondContact O-N 3.14Å; S413-L415 VanDerWaalsContact C-N 3.27Å; S413-L415 PolarHBondContact O-N 2.88Å; S413-D416 PolarHBondContact O-N 2.78Å; S413-R417 WeakPolarHBondContact O-CB 3.3Å; S413-R417 WeakPolarHBondContact O-CG 3.49Å; S413-R417 PolarHBondContact O-N 3.24Å
414	A	96.9	Very high	92.1	Very high	5 Å²	5	33.7 Å²	33.7	4%	0.041	19%	0.194	C	C	.	.	H	α-helix	trans	-62.2	-33.8	174.7	0	0	0	0	0	113.1	L352 V356 M380 A410 E412 I418	L352-A414 HydrophobicContact CD2-CB 3.56Å; L352-A414 HydrophobicContact CG-CB 3.97Å; V356-A414 HydrophobicContact CG2-CB 3.57Å; M380-A414 HydrophobicContact CG-CB 4.43Å; M380-A414 HydrophobicContact SD-CB 3.87Å; A410-A414 WeakPolarHBondContact O-CB 3.44Å; A410-A414 PolarHBondContact O-N 2.61Å; E412-A414 VanDerWaalsContact C-N 3.34Å; E412-A414 PolarHBondContact O-N 2.66Å; A414-I418 WeakPolarHBondContact O-CB 3.23Å; A414-I418 WeakPolarHBondContact O-CG1 3.09Å; A414-I418 PolarHBondContact O-N 3.19Å; A414-I418 VanDerWaalsContact O-N 3.12Å
415	L	98.1	Very high	93.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-73	-41.7	179.6	171.4	61	0	0	0	111.7	M380 L381 M384 G411 E412 S413 A419 I431 A453 A456 I457	M380-L415 HydrophobicContact CB-CB 4.48Å; M380-L415 HydrophobicContact CE-CB 4.24Å; M380-L415 HydrophobicContact CE-CD1 3.77Å; M380-L415 HydrophobicContact SD-CB 4.01Å; L381-L415 HydrophobicContact CD2-CD2 4.41Å; M384-L415 HydrophobicContact SD-CD2 4.08Å; G411-L415 WeakPolarHBondContact O-CB 3.26Å; G411-L415 PolarHBondContact O-N 3.3Å; E412-L415 WeakPolarHBondContact O-CB 3.49Å; E412-L415 PolarHBondContact O-N 3.4Å; S413-L415 VanDerWaalsContact C-N 3.27Å; S413-L415 PolarHBondContact O-N 2.88Å; L415-A419 WeakPolarHBondContact O-CB 3.25Å; L415-A419 PolarHBondContact O-N 3.08Å; L415-I431 HydrophobicContact CD1-CD1 3.49Å; L415-I431 VanDerWaalsContact CD1-CD1 3.49Å; L415-I431 HydrophobicContact CD2-CD1 3.56Å; L415-I431 HydrophobicContact CG-CD1 4.15Å; L415-A453 HydrophobicContact CD2-CB 3.65Å; L415-A456 HydrophobicContact CB-CB 4.45Å; L415-A456 HydrophobicContact CD2-CB 4.16Å; L415-A456 HydrophobicContact CG-CB 4.22Å; L415-I457 HydrophobicContact CD1-CG2 3.77Å; L415-I457 HydrophobicContact CD2-CG2 4.03Å; L415-I457 HydrophobicContact CG-CG2 3.81Å
416	D	97.8	Very high	94.5	Very high	47 Å²	47	26.9 Å²	26.9	25%	0.251	16%	0.159	S	C	.	.	H	α-helix	trans	-60.9	-56.3	173.9	171.1	42.4	0	0	0	111.4	E412 S413 I418 A419 C420 A456	E412-D416 PolarHBondContact O-N 3.43Å; E412-D416 VanDerWaalsContact O-N 3.09Å; S413-D416 PolarHBondContact O-N 2.78Å; D416-I418 VanDerWaalsContact C-N 3.28Å; D416-I418 PolarHBondContact O-N 3.34Å; D416-A419 CarbonylContact O-C 3.58Å; D416-A419 WeakPolarHBondContact O-CA 3.27Å; D416-A419 VanDerWaalsContact O-CB 3.3Å; D416-A419 WeakPolarHBondContact O-CB 3.48Å; D416-A419 PolarHBondContact O-N 2.82Å; D416-C420 PolarHBondContact O-N 2.92Å; D416-A456 VanDerWaalsContact CA-O 3.27Å; D416-A456 WeakPolarHBondContact CA-O 3.44Å; D416-A456 HydrophobicContact CB-CB 4.07Å; D416-A456 WeakPolarHBondContact CB-O 3.05Å; D416-A456 VanDerWaalsContact OD1-O 3.11Å
417	R	97.3	Very high	94.9	Very high	62 Å²	62	25.8 Å²	25.8	23%	0.234	15%	0.152	C	C	.	.	H	α-helix	trans	-53.5	-41.6	177.2	-71.5	170.8	62.4	-151.8	-3.9	112.9	E353 V356 E360 S413 C420 G421	E353-R417 IonicContact OE1-CZ 3.43Å; E353-R417 IonicContact OE1-NH1 2.72Å; E353-R417 PolarHBondContact OE1-NH1 2.99Å; E353-R417 VanDerWaalsContact OE1-NH1 3.12Å; E353-R417 IonicContact OE1-NH2 3.83Å; E353-R417 PolarHBondContact OE1-NH2 3.2Å; E353-R417 IonicContact OE2-CZ 3.39Å; E353-R417 IonicContact OE2-NH1 2.72Å; E353-R417 PolarHBondContact OE2-NH1 2.83Å; E353-R417 IonicContact OE2-NH2 2.76Å; V356-R417 HydrophobicContact CG1-CB 3.47Å; V356-R417 VanDerWaalsContact CG1-CB 3.47Å; V356-R417 HydrophobicContact CG1-CG 4.39Å; E360-R417 IonicContact OE1-CZ 2.9Å; E360-R417 IonicContact OE1-NE 3.05Å; E360-R417 PolarHBondContact OE1-NE 2.91Å; E360-R417 IonicContact OE1-NH2 2.75Å; E360-R417 PolarHBondContact OE1-NH2 3.39Å; E360-R417 IonicContact OE2-CZ 2.7Å; E360-R417 IonicContact OE2-NE 3.3Å; E360-R417 IonicContact OE2-NH2 3.27Å; E360-R417 PolarHBondContact OE2-NH2 2.96Å; S413-R417 WeakPolarHBondContact O-CB 3.3Å; S413-R417 WeakPolarHBondContact O-CG 3.49Å; S413-R417 PolarHBondContact O-N 3.24Å; R417-C420 PolarHBondContact O-N 3.3Å; R417-G421 PolarHBondContact O-N 3.4Å
418	I	97	Very high	95.1	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-68.8	-35.2	174	-76.6	176.5	0	0	0	112.8	I355 V356 M380 A414 D416 L422 I427	I355-I418 HydrophobicContact CG2-CD1 4.32Å; V356-I418 HydrophobicContact CB-CD1 4.4Å; V356-I418 HydrophobicContact CB-CG1 4.27Å; V356-I418 HydrophobicContact CG1-CG1 4.24Å; V356-I418 HydrophobicContact CG2-CD1 3.77Å; V356-I418 HydrophobicContact CG2-CG1 4.06Å; M380-I418 HydrophobicContact CE-CD1 4.08Å; M380-I418 HydrophobicContact SD-CD1 3.88Å; A414-I418 WeakPolarHBondContact O-CB 3.23Å; A414-I418 WeakPolarHBondContact O-CG1 3.09Å; A414-I418 PolarHBondContact O-N 3.19Å; A414-I418 VanDerWaalsContact O-N 3.12Å; D416-I418 VanDerWaalsContact C-N 3.28Å; D416-I418 PolarHBondContact O-N 3.34Å; I418-L422 HydrophobicContact CG2-CD1 4.27Å; I418-L422 WeakPolarHBondContact O-CB 3.5Å; I418-L422 PolarHBondContact O-N 3.41Å; I418-I427 HydrophobicContact CG2-CD1 3.64Å; I418-I427 HydrophobicContact CG2-CG1 4.17Å
419	A	97	Very high	95.2	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-64.5	-43.7	174.9	0	0	0	0	0	111.4	L415 D416 G423 I427 I457	L415-A419 WeakPolarHBondContact O-CB 3.25Å; L415-A419 PolarHBondContact O-N 3.08Å; D416-A419 CarbonylContact O-C 3.58Å; D416-A419 WeakPolarHBondContact O-CA 3.27Å; D416-A419 VanDerWaalsContact O-CB 3.3Å; D416-A419 WeakPolarHBondContact O-CB 3.48Å; D416-A419 PolarHBondContact O-N 2.82Å; A419-G423 WeakPolarHBondContact O-CA 3.13Å; A419-G423 PolarHBondContact O-N 3.44Å; A419-I427 HydrophobicContact CB-CG2 4.27Å; A419-I457 HydrophobicContact CB-CB 4.33Å; A419-I457 HydrophobicContact CB-CG2 4.24Å
420	C	94.8	Very high	95.4	Very high	52 Å²	52	30 Å²	30	35%	0.351	18%	0.176	S	C	.	.	H	α-helix	trans	-68.6	-49.5	176.5	-67.2	0	0	0	0	111.9	D416 R417 G460	D416-C420 PolarHBondContact O-N 2.92Å; R417-C420 PolarHBondContact O-N 3.3Å; C420-G460 VanDerWaalsContact SG-CA 3.54Å; C420-G460 PolarHBondContact SG-N 3.46Å; C420-G460 VanDerWaalsContact SG-N 3.41Å
421	G	93.6	Very high	95.6	Very high	21 Å²	21	28.8 Å²	28.8	22%	0.216	17%	0.166	C	C	.	.	H	α-helix	trans	-66.1	-39	-178.2	0	0	0	0	0	115.2	S359 A363 R367 R417	S359-G421 CarbonylContact O-C 3.6Å; S359-G421 VanDerWaalsContact O-CA 3.25Å; S359-G421 WeakPolarHBondContact O-CA 3.4Å; A363-G421 WeakPolarHBondContact CB-O 3.32Å; R367-G421 PolarHBondContact NH1-O 3.41Å; R417-G421 PolarHBondContact O-N 3.4Å
422	L	94.6	Very high	95.4	Very high	3 Å²	3	32.8 Å²	32.8	2%	0.016	18%	0.183	C	C	.	.	H	α-helix	trans	-95.3	-17.4	179.1	-58.5	-170.6	0	0	0	114.4	A363 L366 R367 V373 I418 I427	A363-L422 HydrophobicContact CB-CD2 4.17Å; L366-L422 HydrophobicContact CB-CD2 4.24Å; L366-L422 HydrophobicContact CD2-CD1 4.09Å; L366-L422 HydrophobicContact CD2-CD2 4.2Å; L366-L422 HydrophobicContact CG-CD1 4.23Å; L366-L422 HydrophobicContact CG-CD2 4.31Å; R367-L422 HydrophobicContact CG-CD2 4.02Å; V373-L422 HydrophobicContact CB-CD1 4.4Å; V373-L422 HydrophobicContact CG1-CD1 3.63Å; V373-L422 HydrophobicContact CG2-CD1 3.82Å; I418-L422 HydrophobicContact CG2-CD1 4.27Å; I418-L422 WeakPolarHBondContact O-CB 3.5Å; I418-L422 PolarHBondContact O-N 3.41Å; L422-I427 HydrophobicContact CB-CD1 4.34Å; L422-I427 HydrophobicContact CB-CG1 4.11Å; L422-I427 HydrophobicContact CD1-CD1 4.18Å
423	G	93.7	Very high	95.2	Very high	20 Å²	20	36.7 Å²	36.7	21%	0.206	20%	0.201	C	C	.	.			trans	75.5	148.1	-179.9	0	0	0	0	0	114.9	A419 K425 I426 I427	A419-G423 WeakPolarHBondContact O-CA 3.13Å; A419-G423 PolarHBondContact O-N 3.44Å; G423-K425 PolarHBondContact O-N 3.41Å; G423-I426 PolarHBondContact O-N 2.98Å; G423-I427 PolarHBondContact O-N 3.05Å
424	G	93.2	Very high	95.3	Very high	2 Å²	2	37.2 Å²	37.2	2%	0.021	20%	0.197	C	C	.	.	H	α-helix	trans	-63.9	-13.2	-178.1	0	0	0	0	0	116.4	I426 L428 G460 C461 Q464	G424-I426 PolarHBondContact O-N 2.97Å; G424-L428 VanDerWaalsContact O-CB 3.27Å; G424-L428 WeakPolarHBondContact O-CB 3.21Å; G424-L428 PolarHBondContact O-N 2.92Å; G424-G460 PolarHBondContact N-O 2.9Å; G424-C461 WeakPolarHBondContact CA-SG 3.17Å; G424-Q464 VanDerWaalsContact C-OE1 3.26Å
425	K	93.1	Very high	95.2	Very high	100 Å²	100	37.1 Å²	37.1	44%	0.435	20%	0.196	S	C	.	.	H	α-helix	trans	-56.5	-31	166.2	-72.5	174	-179.6	163.5	0	111.8	G423 Q464 E894	G423-K425 PolarHBondContact O-N 3.41Å; K425-Q464 HydrophobicContact CG-CG 4.44Å; K425-E894 IonicContact NZ-OE1 3.44Å; K425-E894 PolarHBondContact NZ-OE1 2.91Å; K425-E894 IonicContact NZ-OE2 3.67Å; K425-E894 PolarHBondContact NZ-OE2 3.27Å
426	I	94	Very high	94.9	Very high	36 Å²	36	40.1 Å²	40.1	19%	0.185	21%	0.211	C	C	.	.	H	α-helix	trans	-105.9	-46.4	-176.2	-65.5	177.8	0	0	0	111.7	R367 T370 G423 G424 P429 M430	R367-I426 HydrophobicContact CB-CD1 4.1Å; R367-I426 VanDerWaalsContact CD-CD1 3.4Å; R367-I426 HydrophobicContact CG-CD1 3.45Å; R367-I426 VanDerWaalsContact CG-CD1 3.45Å; T370-I426 HydrophobicContact CG2-CG2 4.38Å; G423-I426 PolarHBondContact O-N 2.98Å; G424-I426 PolarHBondContact O-N 2.97Å; I426-P429 WeakPolarHBondContact O-CD 3.46Å; I426-M430 HydrophobicContact CG2-CE 3.55Å; I426-M430 HydrophobicContact CG2-SD 4.45Å; I426-M430 WeakPolarHBondContact O-CG 3.24Å
427	I	96.7	Very high	94.8	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-76.2	-45.6	-172.2	-65	-56.1	0	0	0	112.9	V373 I418 A419 L422 G423 M430 I431 I457	V373-I427 HydrophobicContact CG1-CD1 3.58Å; I418-I427 HydrophobicContact CG2-CD1 3.64Å; I418-I427 HydrophobicContact CG2-CG1 4.17Å; A419-I427 HydrophobicContact CB-CG2 4.27Å; L422-I427 HydrophobicContact CB-CD1 4.34Å; L422-I427 HydrophobicContact CB-CG1 4.11Å; L422-I427 HydrophobicContact CD1-CD1 4.18Å; G423-I427 PolarHBondContact O-N 3.05Å; I427-M430 WeakPolarHBondContact O-CB 3.32Å; I427-M430 PolarHBondContact O-N 3.49Å; I427-I431 HydrophobicContact CG2-CG2 4.24Å; I427-I431 WeakPolarHBondContact O-CG2 3.42Å; I427-I431 PolarHBondContact O-N 2.78Å; I427-I457 HydrophobicContact CG2-CG2 4.36Å
428	L	95.6	Very high	94.8	Very high	18 Å²	18	40.9 Å²	40.9	9%	0.094	22%	0.216	C	C	.	.	H	α-helix	trans	-56.2	-44	-176.6	-176.3	67	0	0	0	113.3	G424 M430 K432 I457 C461 Q464 M465 I468	G424-L428 VanDerWaalsContact O-CB 3.27Å; G424-L428 WeakPolarHBondContact O-CB 3.21Å; G424-L428 PolarHBondContact O-N 2.92Å; L428-M430 VanDerWaalsContact C-N 3.29Å; L428-M430 PolarHBondContact O-N 2.89Å; L428-K432 WeakPolarHBondContact O-CB 3.1Å; L428-K432 PolarHBondContact O-N 2.85Å; L428-I457 HydrophobicContact CD1-CD1 4.05Å; L428-C461 HydrophobicContact CB-CB 4.29Å; L428-Q464 HydrophobicContact CD2-CB 3.73Å; L428-M465 HydrophobicContact CD1-CG 3.63Å; L428-M465 HydrophobicContact CD1-SD 4.14Å; L428-M465 HydrophobicContact CD2-CG 3.66Å; L428-M465 HydrophobicContact CG-CG 4.27Å; L428-I468 HydrophobicContact CD2-CD1 4.45Å
429	P	95.1	Very high	94.7	Very high	95 Å²	95	41 Å²	41	62%	0.617	22%	0.216	S	C	*	.	H	α-helix	trans	-60.7	-32	174.3	-25.2	35.1	0	0	0	114.8	I426	I426-P429 WeakPolarHBondContact O-CD 3.46Å
430	M	95.8	Very high	94.6	Very high	41 Å²	41	47.5 Å²	47.5	20%	0.202	25%	0.247	C	C	.	.	H	α-helix	trans	-75.6	-48.8	179.6	-61.9	178.4	-172.1	0	0	110.8	T370 V373 A374 I426 I427 L428 H434	T370-M430 HydrophobicContact CG2-CE 4.13Å; V373-M430 HydrophobicContact CB-CE 4.5Å; V373-M430 HydrophobicContact CB-SD 4.25Å; V373-M430 HydrophobicContact CG1-CE 4.46Å; V373-M430 HydrophobicContact CG1-SD 3.89Å; A374-M430 HydrophobicContact CB-CE 4.48Å; A374-M430 HydrophobicContact CB-CG 4.29Å; A374-M430 HydrophobicContact CB-SD 3.86Å; I426-M430 HydrophobicContact CG2-CE 3.55Å; I426-M430 HydrophobicContact CG2-SD 4.45Å; I426-M430 WeakPolarHBondContact O-CG 3.24Å; I427-M430 WeakPolarHBondContact O-CB 3.32Å; I427-M430 PolarHBondContact O-N 3.49Å; L428-M430 VanDerWaalsContact C-N 3.29Å; L428-M430 PolarHBondContact O-N 2.89Å; M430-H434 PolarHBondContact O-CD2 2.89Å
431	I	95.9	Very high	94.7	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-84.7	-28.8	-170.1	-163.6	166.2	0	0	0	114.4	V377 L381 L415 I427 Q433 H434 I435 I457	V377-I431 HydrophobicContact CG1-CB 3.92Å; V377-I431 HydrophobicContact CG1-CD1 4.03Å; V377-I431 HydrophobicContact CG1-CG1 3.75Å; L381-I431 HydrophobicContact CD1-CD1 4.42Å; L381-I431 HydrophobicContact CD1-CG1 4.2Å; L381-I431 HydrophobicContact CD2-CD1 4.24Å; L415-I431 HydrophobicContact CD1-CD1 3.49Å; L415-I431 VanDerWaalsContact CD1-CD1 3.49Å; L415-I431 HydrophobicContact CD2-CD1 3.56Å; L415-I431 HydrophobicContact CG-CD1 4.15Å; I427-I431 HydrophobicContact CG2-CG2 4.24Å; I427-I431 WeakPolarHBondContact O-CG2 3.42Å; I427-I431 PolarHBondContact O-N 2.78Å; I431-Q433 VanDerWaalsContact C-N 3.27Å; I431-Q433 PolarHBondContact O-N 3.46Å; I431-Q433 VanDerWaalsContact O-N 3.1Å; I431-H434 WeakPolarHBondContact O-CA 3.33Å; I431-H434 WeakPolarHBondContact O-CB 3.42Å; I431-H434 PolarHBondContact O-N 3.09Å; I431-I435 HydrophobicContact CD1-CD1 3.98Å; I431-I435 HydrophobicContact CD1-CG1 4.39Å; I431-I435 HydrophobicContact CG1-CD1 3.76Å; I431-I435 HydrophobicContact CG1-CG1 3.95Å; I431-I435 HydrophobicContact CG2-CD1 4.27Å; I431-I435 PolarHBondContact O-N 3.38Å; I431-I457 HydrophobicContact CD1-CG2 3.96Å; I431-I457 HydrophobicContact CG2-CD1 3.7Å; I431-I457 HydrophobicContact CG2-CG2 4.31Å
432	K	92.8	Very high	94.9	Very high	84 Å²	84	52 Å²	52	37%	0.365	27%	0.269	S	S	.	.	H	α-helix	trans	-51.3	-42.6	-173.1	176.9	175.8	-178.5	175.7	0	113.4	L428 M436 I468	L428-K432 WeakPolarHBondContact O-CB 3.1Å; L428-K432 PolarHBondContact O-N 2.85Å; K432-M436 VanDerWaalsContact O-CG 3.24Å; K432-M436 WeakPolarHBondContact O-CG 3.29Å; K432-M436 PolarHBondContact O-N 2.87Å; K432-I468 HydrophobicContact CD-CD1 4.07Å
433	Q	91.9	Very high	95	Very high	129 Å²	129	55 Å²	55	60%	0.603	29%	0.285	S	S	*	.	H	α-helix	trans	-69.6	-36.9	179.6	-173.9	178.1	-41.4	0	0	112.1	I431 M436 Q437	I431-Q433 VanDerWaalsContact C-N 3.27Å; I431-Q433 PolarHBondContact O-N 3.46Å; I431-Q433 VanDerWaalsContact O-N 3.1Å; Q433-M436 PolarHBondContact O-N 2.79Å; Q433-Q437 WeakPolarHBondContact O-CG 3.41Å; Q433-Q437 PolarHBondContact O-N 3.16Å; Q433-Q437 VanDerWaalsContact O-N 3.11Å
434	H	95.9	Very high	95.2	Very high	65 Å²	65	55.2 Å²	55.2	30%	0.301	28%	0.28	S	S	.	.	H	α-helix	trans	-64.9	-50.1	177.7	-70.4	-78.7	0	0	0	111	L381 M430 I431 M436 Q437 M438	L381-H434 HydrophobicContact CD1-CB 3.52Å; M430-H434 PolarHBondContact O-CD2 2.89Å; I431-H434 WeakPolarHBondContact O-CA 3.33Å; I431-H434 WeakPolarHBondContact O-CB 3.42Å; I431-H434 PolarHBondContact O-N 3.09Å; H434-M436 VanDerWaalsContact C-N 3.32Å; H434-M436 PolarHBondContact O-N 3.05Å; H434-Q437 WeakPolarHBondContact O-CB 3.44Å; H434-Q437 PolarHBondContact O-N 3.32Å; H434-M438 VanDerWaalsContact O-CG 3.25Å; H434-M438 WeakPolarHBondContact O-CG 3.46Å; H434-M438 PolarHBondContact O-N 3.07Å
435	I	94.9	Very high	95.4	Very high	3 Å²	3	57.2 Å²	57.2	2%	0.015	29%	0.288	C	S	.	.	H	α-helix	trans	-54.9	-47.4	176	-70.4	167.1	0	0	0	110.8	I431 Q437 M438 L439 G450 A453 I457	I431-I435 HydrophobicContact CD1-CD1 3.98Å; I431-I435 HydrophobicContact CD1-CG1 4.39Å; I431-I435 HydrophobicContact CG1-CD1 3.76Å; I431-I435 HydrophobicContact CG1-CG1 3.95Å; I431-I435 HydrophobicContact CG2-CD1 4.27Å; I431-I435 PolarHBondContact O-N 3.38Å; I435-Q437 VanDerWaalsContact C-N 3.27Å; I435-Q437 PolarHBondContact O-N 2.84Å; I435-M438 PolarHBondContact O-N 3.19Å; I435-M438 VanDerWaalsContact O-N 3.14Å; I435-L439 HydrophobicContact CG2-CD1 3.75Å; I435-L439 HydrophobicContact CG2-CG 4.07Å; I435-L439 WeakPolarHBondContact O-CB 3.23Å; I435-L439 VanDerWaalsContact O-CG 3.3Å; I435-L439 WeakPolarHBondContact O-CG 3.45Å; I435-L439 PolarHBondContact O-N 3.35Å; I435-G450 WeakPolarHBondContact CG2-O 3.49Å; I435-A453 HydrophobicContact CD1-CB 4.25Å; I435-A453 HydrophobicContact CG1-CB 4.16Å; I435-I457 HydrophobicContact CD1-CD1 3.69Å
436	M	92.1	Very high	95.6	Very high	63 Å²	63	56.8 Å²	56.8	31%	0.31	28%	0.284	S	S	.	.	H	α-helix	trans	-60.9	-32.3	178.2	-68.6	-64.7	104.4	0	0	113.8	K432 Q433 H434 L439 Q440	K432-M436 VanDerWaalsContact O-CG 3.24Å; K432-M436 WeakPolarHBondContact O-CG 3.29Å; K432-M436 PolarHBondContact O-N 2.87Å; Q433-M436 PolarHBondContact O-N 2.79Å; H434-M436 VanDerWaalsContact C-N 3.32Å; H434-M436 PolarHBondContact O-N 3.05Å; M436-L439 HydrophobicContact CE-CD1 3.83Å; M436-Q440 WeakPolarHBondContact O-CG 3.16Å; M436-Q440 PolarHBondContact O-NE2 2.58Å
437	Q	95.4	Very high	95.8	Very high	110 Å²	110	56.3 Å²	56.3	51%	0.514	28%	0.28	S	S	.	.	H	α-helix	trans	-74.9	-40	174.4	-71.7	176.1	-6	0	0	112	Q433 H434 I435 Q440 N441	Q433-Q437 WeakPolarHBondContact O-CG 3.41Å; Q433-Q437 PolarHBondContact O-N 3.16Å; Q433-Q437 VanDerWaalsContact O-N 3.11Å; H434-Q437 WeakPolarHBondContact O-CB 3.44Å; H434-Q437 PolarHBondContact O-N 3.32Å; I435-Q437 VanDerWaalsContact C-N 3.27Å; I435-Q437 PolarHBondContact O-N 2.84Å; Q437-Q440 PolarHBondContact O-N 2.97Å; Q437-N441 PolarHBondContact O-N 2.61Å
438	M	97.3	Very high	95.9	Very high	15 Å²	15	57.1 Å²	57.1	7%	0.074	28%	0.284	C	S	.	.	H	α-helix	trans	-66.2	-45.3	179.9	-68.8	177.1	70.9	0	0	112	L381 V385 H434 I435 Q440 N441 Y446 A449	L381-M438 HydrophobicContact CB-CE 4.19Å; L381-M438 HydrophobicContact CB-SD 4Å; L381-M438 HydrophobicContact CD1-SD 3.84Å; L381-M438 HydrophobicContact CD2-CE 4.14Å; L381-M438 HydrophobicContact CD2-SD 3.82Å; L381-M438 HydrophobicContact CG-SD 4.11Å; V385-M438 HydrophobicContact CG2-CE 3.84Å; H434-M438 VanDerWaalsContact O-CG 3.25Å; H434-M438 WeakPolarHBondContact O-CG 3.46Å; H434-M438 PolarHBondContact O-N 3.07Å; I435-M438 PolarHBondContact O-N 3.19Å; I435-M438 VanDerWaalsContact O-N 3.14Å; M438-Q440 PolarHBondContact O-N 3.18Å; M438-N441 WeakPolarHBondContact O-CB 3.5Å; M438-N441 PolarHBondContact O-N 2.98Å; M438-N441 VanDerWaalsContact O-N 3.07Å; M438-Y446 WeakPolarHBondContact CB-O 3.49Å; M438-Y446 HydrophobicContact CE-CD1 4.29Å; M438-Y446 HydrophobicContact CG-CD1 4.14Å; M438-Y446 CarbonylContact O-C 2.99Å; M438-A449 HydrophobicContact CE-CB 3.47Å; M438-A449 VanDerWaalsContact CE-CB 3.47Å
439	L	95.3	Very high	96	Very high	4 Å²	4	56.2 Å²	56.2	2%	0.021	28%	0.279	C	S	.	.	H	α-helix	trans	-62.2	-24.2	176	-67.1	179	0	0	0	113.7	I435 M436 R447 L451 F475 F479	I435-L439 HydrophobicContact CG2-CD1 3.75Å; I435-L439 HydrophobicContact CG2-CG 4.07Å; I435-L439 WeakPolarHBondContact O-CB 3.23Å; I435-L439 VanDerWaalsContact O-CG 3.3Å; I435-L439 WeakPolarHBondContact O-CG 3.45Å; I435-L439 PolarHBondContact O-N 3.35Å; M436-L439 HydrophobicContact CE-CD1 3.83Å; L439-R447 WeakPolarHBondContact O-CD 3.48Å; L439-L451 HydrophobicContact CD2-CB 4.49Å; L439-L451 HydrophobicContact CD2-CD2 3.76Å; L439-L451 HydrophobicContact CD2-CG 3.58Å; L439-F475 HydrophobicContact CB-CE1 3.88Å; L439-F475 HydrophobicContact CD1-CD1 3.88Å; L439-F475 HydrophobicContact CD1-CE1 3.91Å; L439-F479 HydrophobicContact CB-CE2 4.22Å; L439-F479 HydrophobicContact CB-CZ 3.87Å; L439-F479 HydrophobicContact CD1-CE2 4.37Å; L439-F479 HydrophobicContact CD2-CE2 4.14Å; L439-F479 HydrophobicContact CD2-CZ 4.29Å; L439-F479 HydrophobicContact CG-CE2 4.49Å; L439-F479 WeakPolarHBondContact O-CE1 3.42Å; L439-F479 VanDerWaalsContact O-CZ 3.32Å; L439-F479 WeakPolarHBondContact O-CZ 3.35Å
440	Q	94.7	Very high	96.1	Very high	137 Å²	137	51.7 Å²	51.7	64%	0.64	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95	2.4	177.8	-66.1	178.2	30.9	0	0	113.4	M436 Q437 M438 F475	M436-Q440 WeakPolarHBondContact O-CG 3.16Å; M436-Q440 PolarHBondContact O-NE2 2.58Å; Q437-Q440 PolarHBondContact O-N 2.97Å; M438-Q440 PolarHBondContact O-N 3.18Å; Q440-F475 HydrophobicContact CG-CZ 4.22Å
441	N	97.6	Very high	96.2	Very high	43 Å²	43	49.8 Å²	49.8	23%	0.23	24%	0.24	C	C	.	.			trans	-75.9	135.7	-177.1	-166.6	-35.4	0	0	0	111.3	Q437 M438 D443 Y446 R447	Q437-N441 PolarHBondContact O-N 2.61Å; M438-N441 WeakPolarHBondContact O-CB 3.5Å; M438-N441 PolarHBondContact O-N 2.98Å; M438-N441 VanDerWaalsContact O-N 3.07Å; N441-D443 PolarHBondContact O-N 3.29Å; N441-D443 WeakPolarHBondContact OD1-CB 3.3Å; N441-D443 PolarHBondContact OD1-N 3.42Å; N441-Y446 HydrophobicContact CB-CG 4.25Å; N441-Y446 WeakPolarHBondContact ND2-CD2 3.36Å; N441-R447 VanDerWaalsContact O-CD 3.28Å; N441-R447 WeakPolarHBondContact O-CD 3.23Å; N441-R447 VanDerWaalsContact O-CG 3.25Å; N441-R447 WeakPolarHBondContact O-CG 3.42Å; N441-R447 PolarHBondContact O-NH1 3.31Å
442	P	96.9	Very high	96.3	Very high	123 Å²	123	50.6 Å²	50.6	80%	0.799	24%	0.244	S	C	*	.	S	Bend	trans	-61.4	-26.4	173.4	25	-36.7	0	0	0	114.2	R447	P442-R447 PolarHBondContact O-NH1 3.01Å
443	D	97.6	Very high	96.6	Very high	66 Å²	66	46.6 Å²	46.6	35%	0.353	23%	0.227	S	C	.	.	S	Bend	trans	-72.9	130.1	174.2	-172	-28.8	0	0	0	110.6	N441 K445 Y446 R447	N441-D443 PolarHBondContact O-N 3.29Å; N441-D443 WeakPolarHBondContact OD1-CB 3.3Å; N441-D443 PolarHBondContact OD1-N 3.42Å; D443-K445 VanDerWaalsContact C-N 3.33Å; D443-K445 PolarHBondContact O-N 3.01Å; D443-K445 PolarHBondContact OD1-N 3Å; D443-Y446 HydrophobicContact CB-CD2 3.81Å; D443-R447 VanDerWaalsContact C-NH1 3.31Å; D443-R447 PolarHBondContact O-N 3.46Å; D443-R447 PolarHBondContact O-NH1 2.64Å
444	W	97.1	Very high	96.8	Very high	26 Å²	26	40.8 Å²	40.8	10%	0.098	20%	0.2	C	C	.	.	H	α-helix	trans	-68.3	-31.5	-176.8	75.8	-105.4	0	0	0	112.5	L387 D389 Y446 R447 H448 H484 R486 V487	L387-W444 HydrophobicContact CB-CH2 4.18Å; L387-W444 HydrophobicContact CD1-CH2 4.25Å; L387-W444 HydrophobicContact CD1-CZ3 3.92Å; D389-W444 HydrophobicContact CB-CZ2 4.42Å; D389-W444 WeakPolarHBondContact OD1-CZ2 3.35Å; D389-W444 PolarHBondContact OD1-NE1 3.21Å; W444-Y446 VanDerWaalsContact C-N 3.33Å; W444-Y446 PolarHBondContact O-N 2.82Å; W444-R447 PolarHBondContact O-N 3.39Å; W444-R447 VanDerWaalsContact O-N 3.14Å; W444-H448 HydrophobicContact CE3-CB 4.2Å; W444-H448 HydrophobicContact CZ3-CB 4.26Å; W444-H448 WeakPolarHBondContact O-CB 3.25Å; W444-H448 PolarHBondContact O-N 2.66Å; W444-H484 HydrophobicContact CB-CB 3.85Å; W444-H484 AromaticContact CD1-CD2 3.73Å; W444-H484 AromaticContact CD1-NE2 3.67Å; W444-H484 AromaticContact CD2-CE1 3.25Å; W444-H484 AromaticContact CD2-CG 3.91Å; W444-H484 AromaticContact CD2-ND1 3.38Å; W444-H484 AromaticContact CD2-NE2 3.72Å; W444-H484 AromaticContact CE2-CE1 3.34Å; W444-H484 AromaticContact CE2-ND1 3.99Å; W444-H484 AromaticContact CE2-NE2 3.6Å; W444-H484 AromaticContact CE3-CE1 3.51Å; W444-H484 AromaticContact CE3-ND1 3.41Å; W444-H484 HydrophobicContact CG-CB 4.38Å; W444-H484 AromaticContact CG-CD2 3.71Å; W444-H484 AromaticContact CG-CE1 3.73Å; W444-H484 AromaticContact CG-CG 3.64Å; W444-H484 AromaticContact CG-ND1 3.66Å; W444-H484 AromaticContact CG-NE2 3.79Å; W444-H484 AromaticContact CZ2-CE1 3.73Å; W444-H484 AromaticContact CZ3-CE1 3.89Å; W444-H484 AromaticContact NE1-CE1 3.77Å; W444-H484 AromaticContact NE1-NE2 3.53Å; W444-R486 HydrophobicContact CE3-CB 4.23Å; W444-R486 HydrophobicContact CH2-CB 4.43Å; W444-R486 HydrophobicContact CZ3-CB 3.79Å; W444-R486 HydrophobicContact CZ3-CG 4.35Å; W444-V487 HydrophobicContact CB-CG2 3.96Å; W444-V487 HydrophobicContact CE3-CG2 4.37Å; W444-V487 WeakPolarHBondContact O-CG2 3.33Å
445	K	97.5	Very high	96.8	Very high	44 Å²	44	38 Å²	38	19%	0.191	19%	0.187	C	C	.	.	H	α-helix	trans	-65.7	-39	-177.9	-61.6	-175.3	-178	-172.7	0	111.2	V385 L387 D443 H448 A449	V385-K445 HydrophobicContact CG1-CB 4.04Å; L387-K445 HydrophobicContact CB-CD 4.34Å; L387-K445 HydrophobicContact CB-CG 4.49Å; L387-K445 HydrophobicContact CD1-CB 4.47Å; L387-K445 VanDerWaalsContact O-CE 3.29Å; L387-K445 WeakPolarHBondContact O-CE 3.35Å; L387-K445 PolarHBondContact O-NZ 3.41Å; D443-K445 VanDerWaalsContact C-N 3.33Å; D443-K445 PolarHBondContact O-N 3.01Å; D443-K445 PolarHBondContact OD1-N 3Å; K445-H448 PolarHBondContact O-N 3.46Å; K445-A449 VanDerWaalsContact O-CB 3.28Å; K445-A449 WeakPolarHBondContact O-CB 3.45Å; K445-A449 PolarHBondContact O-N 2.75Å
446	Y	98.1	Very high	96.9	Very high	91 Å²	91	38.2 Å²	38.2	36%	0.357	19%	0.19	S	C	.	.	H	α-helix	trans	-65.5	-39.9	172.2	-77.4	-89	0	0	0	112.7	V385 M438 N441 D443 W444 G450	V385-Y446 HydrophobicContact CG1-CD2 4Å; V385-Y446 HydrophobicContact CG1-CE1 4.37Å; V385-Y446 HydrophobicContact CG1-CE2 3.83Å; V385-Y446 HydrophobicContact CG1-CG 4.39Å; V385-Y446 HydrophobicContact CG2-CD1 3.86Å; V385-Y446 HydrophobicContact CG2-CE1 4.07Å; V385-Y446 HydrophobicContact CG2-CG 4.12Å; M438-Y446 WeakPolarHBondContact CB-O 3.49Å; M438-Y446 HydrophobicContact CE-CD1 4.29Å; M438-Y446 HydrophobicContact CG-CD1 4.14Å; M438-Y446 CarbonylContact O-C 2.99Å; N441-Y446 HydrophobicContact CB-CG 4.25Å; N441-Y446 WeakPolarHBondContact ND2-CD2 3.36Å; D443-Y446 HydrophobicContact CB-CD2 3.81Å; W444-Y446 VanDerWaalsContact C-N 3.33Å; W444-Y446 PolarHBondContact O-N 2.82Å; Y446-G450 PolarHBondContact O-N 3.4Å
447	R	98.2	Very high	97.1	Very high	25 Å²	25	35.2 Å²	35.2	9%	0.094	18%	0.175	C	C	.	.	H	α-helix	trans	-67.8	-40	176.8	-60.8	-163.2	-56.8	-71.9	-0.9	112	L439 N441 P442 D443 W444 G450 L451 D482 V487	L439-R447 WeakPolarHBondContact O-CD 3.48Å; N441-R447 VanDerWaalsContact O-CD 3.28Å; N441-R447 WeakPolarHBondContact O-CD 3.23Å; N441-R447 VanDerWaalsContact O-CG 3.25Å; N441-R447 WeakPolarHBondContact O-CG 3.42Å; N441-R447 PolarHBondContact O-NH1 3.31Å; P442-R447 PolarHBondContact O-NH1 3.01Å; D443-R447 VanDerWaalsContact C-NH1 3.31Å; D443-R447 PolarHBondContact O-N 3.46Å; D443-R447 PolarHBondContact O-NH1 2.64Å; W444-R447 PolarHBondContact O-N 3.39Å; W444-R447 VanDerWaalsContact O-N 3.14Å; R447-G450 PolarHBondContact O-N 3.27Å; R447-L451 WeakPolarHBondContact O-CG 3.42Å; R447-L451 PolarHBondContact O-N 3.14Å; R447-D482 IonicContact CZ-OD1 3.97Å; R447-D482 IonicContact CZ-OD2 3.59Å; R447-D482 IonicContact NE-OD1 2.59Å; R447-D482 IonicContact NE-OD2 3.94Å; R447-D482 PolarHBondContact NE-OD2 3.1Å; R447-D482 IonicContact NH2-OD1 2.7Å; R447-D482 PolarHBondContact NH2-OD1 2.58Å; R447-D482 IonicContact NH2-OD2 2.64Å; R447-D482 PolarHBondContact NH2-OD2 3.14Å; R447-V487 HydrophobicContact CB-CG1 3.9Å; R447-V487 HydrophobicContact CB-CG2 4.05Å
448	H	97.8	Very high	97.1	Very high	17 Å²	17	30 Å²	30	8%	0.079	15%	0.151	C	C	.	.	H	α-helix	trans	-58	-59	171.9	179.7	-76.4	0	0	0	111.1	L387 W444 K445 G450 L451 M452 R486 V487	L387-H448 HydrophobicContact CD1-CB 4.2Å; L387-H448 WeakPolarHBondContact CD1-ND1 3.45Å; W444-H448 HydrophobicContact CE3-CB 4.2Å; W444-H448 HydrophobicContact CZ3-CB 4.26Å; W444-H448 WeakPolarHBondContact O-CB 3.25Å; W444-H448 PolarHBondContact O-N 2.66Å; K445-H448 PolarHBondContact O-N 3.46Å; H448-G450 PolarHBondContact O-N 3.44Å; H448-L451 WeakPolarHBondContact O-CB 3.26Å; H448-L451 PolarHBondContact O-N 2.96Å; H448-M452 WeakPolarHBondContact O-CG 3.34Å; H448-M452 PolarHBondContact O-N 2.71Å; H448-R486 PolarHBondContact CD2-O 2.92Å; H448-R486 VanDerWaalsContact CD2-O 3.31Å; H448-V487 HydrophobicContact CB-CG2 4.33Å
449	A	97.7	Very high	96.9	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-57.6	-35.3	179.6	0	0	0	0	0	112.7	M384 V385 M438 K445 L451 A453	M384-A449 HydrophobicContact CB-CB 3.83Å; M384-A449 WeakPolarHBondContact O-CB 3.13Å; V385-A449 HydrophobicContact CG2-CB 3.52Å; M438-A449 HydrophobicContact CE-CB 3.47Å; M438-A449 VanDerWaalsContact CE-CB 3.47Å; K445-A449 VanDerWaalsContact O-CB 3.28Å; K445-A449 WeakPolarHBondContact O-CB 3.45Å; K445-A449 PolarHBondContact O-N 2.75Å; A449-L451 VanDerWaalsContact C-N 3.33Å; A449-L451 PolarHBondContact O-N 2.94Å; A449-A453 WeakPolarHBondContact O-CB 3.27Å; A449-A453 PolarHBondContact O-N 2.68Å
450	G	97.9	Very high	96.8	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-68.1	-27.6	174.7	0	0	0	0	0	114.4	I435 Y446 R447 H448 L454	I435-G450 WeakPolarHBondContact CG2-O 3.49Å; Y446-G450 PolarHBondContact O-N 3.4Å; R447-G450 PolarHBondContact O-N 3.27Å; H448-G450 PolarHBondContact O-N 3.44Å; G450-L454 PolarHBondContact O-N 2.94Å
451	L	98.3	Very high	96.9	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-80.7	-44.7	173.9	-70.5	163.6	0	0	0	111	L439 R447 H448 A449 A453 L454 S455 V476 F479 V487 A490 A491	L439-L451 HydrophobicContact CD2-CB 4.49Å; L439-L451 HydrophobicContact CD2-CD2 3.76Å; L439-L451 HydrophobicContact CD2-CG 3.58Å; R447-L451 WeakPolarHBondContact O-CG 3.42Å; R447-L451 PolarHBondContact O-N 3.14Å; H448-L451 WeakPolarHBondContact O-CB 3.26Å; H448-L451 PolarHBondContact O-N 2.96Å; A449-L451 VanDerWaalsContact C-N 3.33Å; A449-L451 PolarHBondContact O-N 2.94Å; L451-A453 VanDerWaalsContact C-N 3.34Å; L451-A453 PolarHBondContact O-N 3.06Å; L451-L454 WeakPolarHBondContact O-CA 3.41Å; L451-L454 WeakPolarHBondContact O-CB 3.49Å; L451-L454 PolarHBondContact O-N 3.11Å; L451-S455 PolarHBondContact O-N 3.07Å; L451-S455 PolarHBondContact O-OG 3.43Å; L451-V476 HydrophobicContact CD2-CG1 4.31Å; L451-V476 HydrophobicContact CD2-CG2 4.25Å; L451-F479 HydrophobicContact CD1-CB 3.89Å; L451-F479 HydrophobicContact CD1-CG 4.12Å; L451-F479 HydrophobicContact CD2-CB 4.41Å; L451-F479 HydrophobicContact CD2-CD2 4.01Å; L451-F479 HydrophobicContact CD2-CG 4.35Å; L451-V487 HydrophobicContact CD1-CG1 3.75Å; L451-V487 WeakPolarHBondContact CD1-O 3.4Å; L451-A490 HydrophobicContact CB-CB 3.77Å; L451-A490 HydrophobicContact CD1-CB 4Å; L451-A491 HydrophobicContact CD1-CB 4.05Å
452	M	97.6	Very high	96.7	Very high	17 Å²	17	29.8 Å²	29.8	8%	0.084	15%	0.152	C	C	.	.	H	α-helix	trans	-63.9	-39.7	175.9	-57.7	-53.6	-70.2	0	0	111.7	M384 E412 H448 L454 S455 A456 A490 N493	M384-M452 HydrophobicContact CE-CB 3.64Å; E412-M452 VanDerWaalsContact OE1-CE 3.27Å; E412-M452 WeakPolarHBondContact OE1-CE 3.45Å; E412-M452 WeakPolarHBondContact OE2-CB 2.89Å; E412-M452 VanDerWaalsContact OE2-CE 3.27Å; E412-M452 WeakPolarHBondContact OE2-CE 3.46Å; H448-M452 WeakPolarHBondContact O-CG 3.34Å; H448-M452 PolarHBondContact O-N 2.71Å; M452-L454 PolarHBondContact O-N 3.31Å; M452-S455 WeakPolarHBondContact O-CB 3.21Å; M452-S455 PolarHBondContact O-N 3.44Å; M452-S455 VanDerWaalsContact O-N 3.09Å; M452-A456 PolarHBondContact O-N 3.03Å; M452-A490 HydrophobicContact CG-CB 4.12Å; M452-A490 HydrophobicContact SD-CB 3.62Å; M452-N493 HydrophobicContact CE-CB 4.37Å; M452-N493 WeakPolarHBondContact CE-ND2 3.48Å; M452-N493 HydrophobicContact SD-CB 3.95Å
453	A	97.9	Very high	96.4	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-67	-20.3	174.1	0	0	0	0	0	113.4	L381 M384 L415 I435 A449 L451 I457	L381-A453 HydrophobicContact CD2-CB 3.44Å; L381-A453 VanDerWaalsContact CD2-CB 3.44Å; M384-A453 HydrophobicContact CE-CB 3.81Å; M384-A453 VanDerWaalsContact CE-N 3.27Å; M384-A453 HydrophobicContact SD-CB 4.01Å; L415-A453 HydrophobicContact CD2-CB 3.65Å; I435-A453 HydrophobicContact CD1-CB 4.25Å; I435-A453 HydrophobicContact CG1-CB 4.16Å; A449-A453 WeakPolarHBondContact O-CB 3.27Å; A449-A453 PolarHBondContact O-N 2.68Å; L451-A453 VanDerWaalsContact C-N 3.34Å; L451-A453 PolarHBondContact O-N 3.06Å; A453-I457 WeakPolarHBondContact O-CG1 3.35Å; A453-I457 WeakPolarHBondContact O-CG2 3.47Å; A453-I457 PolarHBondContact O-N 3.38Å
454	L	96.7	Very high	96.3	Very high	8 Å²	8	29.8 Å²	29.8	4%	0.042	14%	0.139	C	C	.	.	H	α-helix	trans	-80.6	-34.8	171.8	179.2	70.4	0	0	0	111.4	G450 L451 M452 M465 I472 V476	G450-L454 PolarHBondContact O-N 2.94Å; L451-L454 WeakPolarHBondContact O-CA 3.41Å; L451-L454 WeakPolarHBondContact O-CB 3.49Å; L451-L454 PolarHBondContact O-N 3.11Å; M452-L454 PolarHBondContact O-N 3.31Å; L454-M465 HydrophobicContact CD1-CE 3.59Å; L454-I472 HydrophobicContact CD1-CD1 4.42Å; L454-I472 HydrophobicContact CD1-CG2 3.98Å; L454-I472 HydrophobicContact CD2-CG2 3.61Å; L454-I472 HydrophobicContact CG-CG2 4.29Å; L454-V476 HydrophobicContact CD2-CG2 3.37Å
455	S	96.2	Very high	96.2	Very high	5 Å²	5	28.5 Å²	28.5	4%	0.035	13%	0.134	C	C	.	.	H	α-helix	trans	-61.4	-54.5	168.1	-56	0	0	0	0	110.7	L451 M452 I457 G458 N493 A494	L451-S455 PolarHBondContact O-N 3.07Å; L451-S455 PolarHBondContact O-OG 3.43Å; M452-S455 WeakPolarHBondContact O-CB 3.21Å; M452-S455 PolarHBondContact O-N 3.44Å; M452-S455 VanDerWaalsContact O-N 3.09Å; S455-I457 VanDerWaalsContact C-N 3.33Å; S455-I457 PolarHBondContact O-N 3.35Å; S455-G458 WeakPolarHBondContact O-CA 3.32Å; S455-G458 PolarHBondContact O-N 2.79Å; S455-N493 PolarHBondContact OG-ND2 2.85Å; S455-A494 VanDerWaalsContact OG-CA 3.27Å; S455-A494 WeakPolarHBondContact OG-CA 3.36Å; S455-A494 PolarHBondContact OG-N 3.37Å
456	A	96.6	Very high	95.9	Very high	8 Å²	8	30.4 Å²	30.4	7%	0.066	14%	0.144	C	C	.	.	H	α-helix	trans	-58.9	-36.8	-174.3	0	0	0	0	0	113.8	E412 L415 D416 M452 G458	E412-A456 HydrophobicContact CG-CB 3.94Å; L415-A456 HydrophobicContact CB-CB 4.45Å; L415-A456 HydrophobicContact CD2-CB 4.16Å; L415-A456 HydrophobicContact CG-CB 4.22Å; D416-A456 VanDerWaalsContact CA-O 3.27Å; D416-A456 WeakPolarHBondContact CA-O 3.44Å; D416-A456 HydrophobicContact CB-CB 4.07Å; D416-A456 WeakPolarHBondContact CB-O 3.05Å; D416-A456 VanDerWaalsContact OD1-O 3.11Å; M452-A456 PolarHBondContact O-N 3.03Å; A456-G458 PolarHBondContact O-N 3.19Å
457	I	97.4	Very high	95.6	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-3.5	176.1	68.5	176.9	0	0	0	113.8	L415 A419 I427 L428 I431 I435 A453 S455 C461 M465	L415-I457 HydrophobicContact CD1-CG2 3.77Å; L415-I457 HydrophobicContact CD2-CG2 4.03Å; L415-I457 HydrophobicContact CG-CG2 3.81Å; A419-I457 HydrophobicContact CB-CB 4.33Å; A419-I457 HydrophobicContact CB-CG2 4.24Å; I427-I457 HydrophobicContact CG2-CG2 4.36Å; L428-I457 HydrophobicContact CD1-CD1 4.05Å; I431-I457 HydrophobicContact CD1-CG2 3.96Å; I431-I457 HydrophobicContact CG2-CD1 3.7Å; I431-I457 HydrophobicContact CG2-CG2 4.31Å; I435-I457 HydrophobicContact CD1-CD1 3.69Å; A453-I457 WeakPolarHBondContact O-CG1 3.35Å; A453-I457 WeakPolarHBondContact O-CG2 3.47Å; A453-I457 PolarHBondContact O-N 3.38Å; S455-I457 VanDerWaalsContact C-N 3.33Å; S455-I457 PolarHBondContact O-N 3.35Å; I457-C461 WeakPolarHBondContact O-CA 3.4Å; I457-C461 WeakPolarHBondContact O-CB 3.38Å; I457-C461 PolarHBondContact O-N 3.27Å; I457-C461 PolarHBondContact O-SG 2.95Å; I457-C461 VanDerWaalsContact O-SG 3.39Å; I457-M465 HydrophobicContact CD1-CE 4.5Å; I457-M465 HydrophobicContact CD1-SD 4.12Å; I457-M465 HydrophobicContact CG1-CE 4.35Å; I457-M465 HydrophobicContact CG1-SD 3.97Å
458	G	94.8	Very high	95.3	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-59.1	-59.1	-171.9	0	0	0	0	0	111.9	S455 A456 C461 H462 D501	S455-G458 WeakPolarHBondContact O-CA 3.32Å; S455-G458 PolarHBondContact O-N 2.79Å; A456-G458 PolarHBondContact O-N 3.19Å; G458-C461 PolarHBondContact O-N 3.18Å; G458-H462 WeakPolarHBondContact O-CA 3.48Å; G458-H462 VanDerWaalsContact O-CB 3.29Å; G458-H462 WeakPolarHBondContact O-CB 3.46Å; G458-H462 PolarHBondContact O-N 3.17Å; G458-D501 VanDerWaalsContact CA-OD2 3.23Å; G458-D501 WeakPolarHBondContact CA-OD2 3.45Å
459	E	93.2	Very high	95.1	Very high	113 Å²	113	30.1 Å²	30.1	53%	0.528	16%	0.164	S	C	.	.	H	α-helix	trans	-54.1	-60.7	178.7	-171.1	176.5	143.6	0	0	111.8	C461 H462	E459-C461 VanDerWaalsContact C-N 3.27Å; E459-C461 PolarHBondContact O-N 3.08Å; E459-H462 PolarHBondContact O-ND1 2.85Å
460	G	92.8	Very high	94.9	Very high	14 Å²	14	36.4 Å²	36.4	14%	0.144	19%	0.193	C	C	.	.	H	α-helix	trans	-68	-15.8	-177.2	0	0	0	0	0	116.2	C420 G424	C420-G460 VanDerWaalsContact SG-CA 3.54Å; C420-G460 PolarHBondContact SG-N 3.46Å; C420-G460 VanDerWaalsContact SG-N 3.41Å; G424-G460 PolarHBondContact N-O 2.9Å
461	C	96.3	Very high	94.6	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-121.2	2.3	-177.4	-52.7	0	0	0	0	115.7	G424 L428 I457 G458 E459 Q463 Q464 M465	G424-C461 WeakPolarHBondContact CA-SG 3.17Å; L428-C461 HydrophobicContact CB-CB 4.29Å; I457-C461 WeakPolarHBondContact O-CA 3.4Å; I457-C461 WeakPolarHBondContact O-CB 3.38Å; I457-C461 PolarHBondContact O-N 3.27Å; I457-C461 PolarHBondContact O-SG 2.95Å; I457-C461 VanDerWaalsContact O-SG 3.39Å; G458-C461 PolarHBondContact O-N 3.18Å; E459-C461 VanDerWaalsContact C-N 3.27Å; E459-C461 PolarHBondContact O-N 3.08Å; C461-Q463 VanDerWaalsContact C-N 3.32Å; C461-Q463 PolarHBondContact O-N 3.18Å; C461-Q464 PolarHBondContact O-N 3.36Å; C461-M465 HydrophobicContact CB-CG 4.04Å; C461-M465 HydrophobicContact CB-SD 3.65Å; C461-M465 WeakPolarHBondContact O-CG 3.31Å; C461-M465 PolarHBondContact O-N 3.17Å
462	H	93.8	Very high	94.3	Very high	67 Å²	67	43.7 Å²	43.7	31%	0.31	23%	0.228	S	C	.	.	H	α-helix	trans	-51.1	-47.3	-170.2	67.4	-84.3	0	0	0	113	G458 E459 Q464 M465 E466 F502	G458-H462 WeakPolarHBondContact O-CA 3.48Å; G458-H462 VanDerWaalsContact O-CB 3.29Å; G458-H462 WeakPolarHBondContact O-CB 3.46Å; G458-H462 PolarHBondContact O-N 3.17Å; E459-H462 PolarHBondContact O-ND1 2.85Å; H462-Q464 VanDerWaalsContact C-N 3.31Å; H462-Q464 PolarHBondContact O-N 3.08Å; H462-M465 CarbonylContact O-C 3.53Å; H462-M465 PolarHBondContact O-N 3.48Å; H462-M465 VanDerWaalsContact O-N 3.08Å; H462-E466 PolarHBondContact O-N 3.41Å; H462-F502 HydrophobicContact CB-CD1 4.01Å; H462-F502 HydrophobicContact CB-CE1 3.72Å; H462-F502 HydrophobicContact CB-CE2 4.33Å; H462-F502 HydrophobicContact CB-CG 4.46Å; H462-F502 HydrophobicContact CB-CZ 3.89Å; H462-F502 VanDerWaalsContact O-CE1 3.29Å; H462-F502 WeakPolarHBondContact O-CE1 3.42Å
463	Q	91.7	Very high	94.2	Very high	131 Å²	131	43 Å²	43	61%	0.612	22%	0.224	S	C	*	.	H	α-helix	trans	-56.7	-40.7	-179.3	-60.1	-173.8	0.7	0	0	113.2	C461	C461-Q463 VanDerWaalsContact C-N 3.32Å; C461-Q463 PolarHBondContact O-N 3.18Å
464	Q	94.3	Very high	93.9	Very high	58 Å²	58	45.3 Å²	45.3	27%	0.271	24%	0.24	S	C	.	.	H	α-helix	trans	-84	-25.2	179.2	-62.1	79.5	36.7	0	0	111.9	G424 K425 L428 C461 H462	G424-Q464 VanDerWaalsContact C-OE1 3.26Å; K425-Q464 HydrophobicContact CG-CG 4.44Å; L428-Q464 HydrophobicContact CD2-CB 3.73Å; C461-Q464 PolarHBondContact O-N 3.36Å; H462-Q464 VanDerWaalsContact C-N 3.31Å; H462-Q464 PolarHBondContact O-N 3.08Å
465	M	94.6	Very high	93.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-74	-26.3	174.6	-73.5	172.8	67.5	0	0	113.1	L428 L454 I457 C461 H462 A467 I468 L469 I472 F502	L428-M465 HydrophobicContact CD1-CG 3.63Å; L428-M465 HydrophobicContact CD1-SD 4.14Å; L428-M465 HydrophobicContact CD2-CG 3.66Å; L428-M465 HydrophobicContact CG-CG 4.27Å; L454-M465 HydrophobicContact CD1-CE 3.59Å; I457-M465 HydrophobicContact CD1-CE 4.5Å; I457-M465 HydrophobicContact CD1-SD 4.12Å; I457-M465 HydrophobicContact CG1-CE 4.35Å; I457-M465 HydrophobicContact CG1-SD 3.97Å; C461-M465 HydrophobicContact CB-CG 4.04Å; C461-M465 HydrophobicContact CB-SD 3.65Å; C461-M465 WeakPolarHBondContact O-CG 3.31Å; C461-M465 PolarHBondContact O-N 3.17Å; H462-M465 CarbonylContact O-C 3.53Å; H462-M465 PolarHBondContact O-N 3.48Å; H462-M465 VanDerWaalsContact O-N 3.08Å; M465-A467 PolarHBondContact O-N 3.31Å; M465-I468 CarbonylContact O-C 3.59Å; M465-I468 VanDerWaalsContact O-CG1 3.23Å; M465-I468 WeakPolarHBondContact O-CG1 3.46Å; M465-I468 PolarHBondContact O-N 3.41Å; M465-L469 PolarHBondContact O-N 3.47Å; M465-I472 HydrophobicContact CB-CD1 4.49Å; M465-I472 HydrophobicContact CE-CD1 3.81Å; M465-F502 HydrophobicContact CB-CE1 3.72Å; M465-F502 HydrophobicContact CB-CZ 3.64Å; M465-F502 HydrophobicContact CE-CZ 3.97Å; M465-F502 HydrophobicContact CG-CZ 4.49Å; M465-F502 HydrophobicContact SD-CZ 4.19Å
466	E	92.8	Very high	93.6	Very high	84 Å²	84	47.7 Å²	47.7	39%	0.393	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.1	-40.4	178.6	-77.6	-141.4	121.5	0	0	113.7	H462 I468 L469 F502	H462-E466 PolarHBondContact O-N 3.41Å; E466-I468 PolarHBondContact O-N 2.99Å; E466-L469 PolarHBondContact O-N 3.21Å; E466-F502 HydrophobicContact CG-CD1 4.45Å
467	A	91.3	Very high	93.6	Very high	95 Å²	95	48.6 Å²	48.6	79%	0.785	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-21.7	-178.2	0	0	0	0	0	113.9	M465	M465-A467 PolarHBondContact O-N 3.31Å
468	I	91	Very high	93.5	Very high	31 Å²	31	53.9 Å²	53.9	16%	0.159	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.6	-1.1	-179.6	56.4	171.1	0	0	0	112.8	L428 K432 M465 E466 Q470 E471 I472	L428-I468 HydrophobicContact CD2-CD1 4.45Å; K432-I468 HydrophobicContact CD-CD1 4.07Å; M465-I468 CarbonylContact O-C 3.59Å; M465-I468 VanDerWaalsContact O-CG1 3.23Å; M465-I468 WeakPolarHBondContact O-CG1 3.46Å; M465-I468 PolarHBondContact O-N 3.41Å; E466-I468 PolarHBondContact O-N 2.99Å; I468-Q470 VanDerWaalsContact C-N 3.25Å; I468-Q470 PolarHBondContact O-N 3.06Å; I468-Q470 VanDerWaalsContact O-N 3.15Å; I468-E471 WeakPolarHBondContact O-CA 3.03Å; I468-E471 WeakPolarHBondContact O-CB 3.44Å; I468-E471 PolarHBondContact O-N 3.29Å; I468-I472 HydrophobicContact CD1-CD1 3.84Å; I468-I472 HydrophobicContact CD1-CG1 4.47Å; I468-I472 HydrophobicContact CG1-CD1 3.74Å; I468-I472 HydrophobicContact CG1-CG1 4.37Å; I468-I472 PolarHBondContact O-N 3.37Å
469	L	93.8	Very high	93.6	Very high	1 Å²	1	54.8 Å²	54.8	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-54.9	-37	-174.6	-174.7	63	0	0	0	113	M465 E466 E471 I472 V473 M498 F502 F510	M465-L469 PolarHBondContact O-N 3.47Å; E466-L469 PolarHBondContact O-N 3.21Å; L469-E471 VanDerWaalsContact C-N 3.33Å; L469-E471 PolarHBondContact O-N 2.86Å; L469-I472 PolarHBondContact O-N 3.24Å; L469-V473 HydrophobicContact CD1-CG2 4.06Å; L469-V473 HydrophobicContact CG-CG2 4.28Å; L469-V473 WeakPolarHBondContact O-CB 3.22Å; L469-V473 VanDerWaalsContact O-CG2 3.31Å; L469-V473 WeakPolarHBondContact O-CG2 3.21Å; L469-V473 PolarHBondContact O-N 3.25Å; L469-M498 HydrophobicContact CD1-SD 4.11Å; L469-F502 HydrophobicContact CD1-CD1 3.97Å; L469-F502 HydrophobicContact CD1-CD2 4.25Å; L469-F502 HydrophobicContact CD1-CE1 3.88Å; L469-F502 HydrophobicContact CD1-CE2 4.21Å; L469-F502 HydrophobicContact CD1-CG 4.15Å; L469-F502 HydrophobicContact CD1-CZ 4.02Å; L469-F502 HydrophobicContact CD2-CB 4.15Å; L469-F502 HydrophobicContact CD2-CD1 3.6Å; L469-F502 HydrophobicContact CD2-CE1 4.17Å; L469-F502 HydrophobicContact CD2-CG 3.97Å; L469-F502 HydrophobicContact CG-CD1 4.37Å; L469-F510 HydrophobicContact CD2-CE2 3.74Å; L469-F510 HydrophobicContact CD2-CZ 4.4Å; L469-F510 HydrophobicContact CG-CE2 3.75Å; L469-F510 HydrophobicContact CG-CZ 4.13Å
470	Q	94.4	Very high	93.7	Very high	131 Å²	131	49.7 Å²	49.7	61%	0.612	26%	0.262	S	S	*	.	H	α-helix	trans	-64	-35.7	176.1	178	174.4	-16.9	0	0	113	I468 S474 F510	I468-Q470 VanDerWaalsContact C-N 3.25Å; I468-Q470 PolarHBondContact O-N 3.06Å; I468-Q470 VanDerWaalsContact O-N 3.15Å; Q470-S474 VanDerWaalsContact O-CB 3.28Å; Q470-S474 WeakPolarHBondContact O-CB 3.21Å; Q470-S474 PolarHBondContact O-N 2.82Å; Q470-S474 PolarHBondContact O-OG 2.94Å; Q470-F510 HydrophobicContact CB-CE1 4.04Å; Q470-F510 HydrophobicContact CB-CZ 4.14Å; Q470-F510 HydrophobicContact CG-CE1 4.22Å
471	E	91.4	Very high	93.7	Very high	139 Å²	139	53.3 Å²	53.3	65%	0.65	29%	0.285	S	S	*	.	H	α-helix	trans	-72.2	-45.7	175.2	-62	-177.6	173.6	0	0	110	I468 L469 S474 F475	I468-E471 WeakPolarHBondContact O-CA 3.03Å; I468-E471 WeakPolarHBondContact O-CB 3.44Å; I468-E471 PolarHBondContact O-N 3.29Å; L469-E471 VanDerWaalsContact C-N 3.33Å; L469-E471 PolarHBondContact O-N 2.86Å; E471-S474 PolarHBondContact O-N 3.22Å; E471-F475 WeakPolarHBondContact O-CB 3.02Å; E471-F475 PolarHBondContact O-N 3.3Å
472	I	92.8	Very high	93.7	Very high	15 Å²	15	54 Å²	54	8%	0.077	29%	0.289	C	S	.	.	H	α-helix	trans	-55.2	-58.4	177.1	-65.7	173.8	0	0	0	110.5	L454 M465 I468 L469 S474 F475 V476 M498	L454-I472 HydrophobicContact CD1-CD1 4.42Å; L454-I472 HydrophobicContact CD1-CG2 3.98Å; L454-I472 HydrophobicContact CD2-CG2 3.61Å; L454-I472 HydrophobicContact CG-CG2 4.29Å; M465-I472 HydrophobicContact CB-CD1 4.49Å; M465-I472 HydrophobicContact CE-CD1 3.81Å; I468-I472 HydrophobicContact CD1-CD1 3.84Å; I468-I472 HydrophobicContact CD1-CG1 4.47Å; I468-I472 HydrophobicContact CG1-CD1 3.74Å; I468-I472 HydrophobicContact CG1-CG1 4.37Å; I468-I472 PolarHBondContact O-N 3.37Å; L469-I472 PolarHBondContact O-N 3.24Å; I472-S474 VanDerWaalsContact C-N 3.31Å; I472-S474 PolarHBondContact O-N 2.8Å; I472-F475 WeakPolarHBondContact O-CA 3.41Å; I472-F475 WeakPolarHBondContact O-CB 3.49Å; I472-F475 PolarHBondContact O-N 3.28Å; I472-V476 HydrophobicContact CG2-CG2 4.1Å; I472-V476 WeakPolarHBondContact O-CG2 3.44Å; I472-V476 PolarHBondContact O-N 3.49Å; I472-M498 HydrophobicContact CG2-SD 3.74Å
473	V	95.1	Very high	93.8	Very high	2 Å²	2	56.5 Å²	56.5	1%	0.012	31%	0.311	C	S	.	.	H	α-helix	trans	-58.1	-43.6	-179.4	172	0	0	0	0	111.2	L469 F475 V476 L477 M498 F506 F510 V514	L469-V473 HydrophobicContact CD1-CG2 4.06Å; L469-V473 HydrophobicContact CG-CG2 4.28Å; L469-V473 WeakPolarHBondContact O-CB 3.22Å; L469-V473 VanDerWaalsContact O-CG2 3.31Å; L469-V473 WeakPolarHBondContact O-CG2 3.21Å; L469-V473 PolarHBondContact O-N 3.25Å; V473-F475 PolarHBondContact O-N 2.91Å; V473-V476 PolarHBondContact O-N 2.92Å; V473-L477 HydrophobicContact CG1-CD1 3.72Å; V473-L477 HydrophobicContact CG1-CG 4.24Å; V473-L477 WeakPolarHBondContact O-CB 3.41Å; V473-L477 WeakPolarHBondContact O-CD1 3.49Å; V473-L477 WeakPolarHBondContact O-CG 3.34Å; V473-L477 PolarHBondContact O-N 3.42Å; V473-L477 VanDerWaalsContact O-N 3.08Å; V473-M498 HydrophobicContact CG2-CE 4.24Å; V473-M498 HydrophobicContact CG2-SD 4.11Å; V473-F506 HydrophobicContact CG2-CD2 4.24Å; V473-F506 HydrophobicContact CG2-CE2 3.46Å; V473-F506 VanDerWaalsContact CG2-CE2 3.46Å; V473-F506 HydrophobicContact CG2-CZ 4.22Å; V473-F510 HydrophobicContact CG1-CB 4.26Å; V473-F510 HydrophobicContact CG1-CD1 4.21Å; V473-F510 HydrophobicContact CG1-CD2 4.45Å; V473-F510 HydrophobicContact CG1-CG 4.05Å; V473-F510 HydrophobicContact CG2-CD2 4.08Å; V473-F510 HydrophobicContact CG2-CE2 4.1Å; V473-F510 HydrophobicContact CG2-CG 4.47Å; V473-F510 HydrophobicContact CG2-CZ 4.49Å; V473-V514 HydrophobicContact CG1-CG2 4.36Å
474	S	92	Very high	93.9	Very high	48 Å²	48	52 Å²	52	34%	0.336	29%	0.29	S	S	.	.	H	α-helix	trans	-64.3	-23.2	178.2	-58.2	0	0	0	0	113.2	Q470 E471 I472	Q470-S474 VanDerWaalsContact O-CB 3.28Å; Q470-S474 WeakPolarHBondContact O-CB 3.21Å; Q470-S474 PolarHBondContact O-N 2.82Å; Q470-S474 PolarHBondContact O-OG 2.94Å; E471-S474 PolarHBondContact O-N 3.22Å; I472-S474 VanDerWaalsContact C-N 3.31Å; I472-S474 PolarHBondContact O-N 2.8Å
475	F	90.4	Very high	93.9	Very high	62 Å²	62	50.5 Å²	50.5	27%	0.272	29%	0.285	S	S	.	.	H	α-helix	trans	-89.7	-43.9	177.4	-157.1	-117.7	0	0	0	111.9	L439 Q440 E471 I472 V473 L477 L478 F479	L439-F475 HydrophobicContact CB-CE1 3.88Å; L439-F475 HydrophobicContact CD1-CD1 3.88Å; L439-F475 HydrophobicContact CD1-CE1 3.91Å; Q440-F475 HydrophobicContact CG-CZ 4.22Å; E471-F475 WeakPolarHBondContact O-CB 3.02Å; E471-F475 PolarHBondContact O-N 3.3Å; I472-F475 WeakPolarHBondContact O-CA 3.41Å; I472-F475 WeakPolarHBondContact O-CB 3.49Å; I472-F475 PolarHBondContact O-N 3.28Å; V473-F475 PolarHBondContact O-N 2.91Å; F475-L477 VanDerWaalsContact C-N 3.32Å; F475-L477 PolarHBondContact O-N 3.35Å; F475-L478 HydrophobicContact CD2-CD1 4.1Å; F475-L478 HydrophobicContact CE2-CD1 4.5Å; F475-L478 WeakPolarHBondContact O-CB 3.34Å; F475-L478 PolarHBondContact O-N 3.12Å; F475-L478 VanDerWaalsContact O-N 3.11Å; F475-F479 AromaticContact CD1-CE2 3.78Å; F475-F479 HydrophobicContact CD1-CE2 3.78Å; F475-F479 HydrophobicContact CD1-CZ 4.42Å; F475-F479 AromaticContact CE1-CE2 3.79Å; F475-F479 HydrophobicContact CE1-CE2 3.79Å; F475-F479 AromaticContact CE1-CZ 3.95Å; F475-F479 HydrophobicContact CE1-CZ 3.95Å; F475-F479 HydrophobicContact CG-CE2 4.41Å; F475-F479 HydrophobicContact CZ-CE2 4.42Å; F475-F479 HydrophobicContact CZ-CZ 4.31Å; F475-F479 VanDerWaalsContact O-CD2 3.32Å; F475-F479 WeakPolarHBondContact O-CD2 3.4Å
476	V	96.1	Very high	93.9	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.006	29%	0.289	C	S	.	.	H	α-helix	trans	-57	-44.1	175.9	173.6	0	0	0	0	111.4	L451 L454 I472 V473 L478 F479 A494 I495 M498	L451-V476 HydrophobicContact CD2-CG1 4.31Å; L451-V476 HydrophobicContact CD2-CG2 4.25Å; L454-V476 HydrophobicContact CD2-CG2 3.37Å; I472-V476 HydrophobicContact CG2-CG2 4.1Å; I472-V476 WeakPolarHBondContact O-CG2 3.44Å; I472-V476 PolarHBondContact O-N 3.49Å; V473-V476 PolarHBondContact O-N 2.92Å; V476-L478 PolarHBondContact O-N 3.04Å; V476-F479 WeakPolarHBondContact O-CB 3.37Å; V476-F479 PolarHBondContact O-N 3.14Å; V476-A494 HydrophobicContact CG1-CB 4.02Å; V476-I495 HydrophobicContact CG1-CD1 4.28Å; V476-I495 HydrophobicContact CG1-CG1 3.79Å; V476-M498 HydrophobicContact CB-CE 4.12Å; V476-M498 HydrophobicContact CG1-CE 4.01Å; V476-M498 HydrophobicContact CG2-CE 3.93Å
477	L	95.8	Very high	94.1	Very high	27 Å²	27	47.5 Å²	47.5	14%	0.141	27%	0.27	C	S	.	.	H	α-helix	trans	-59.8	-19.8	179	-69.9	167.4	0	0	0	114.1	V473 F475 I495 K513 A517	V473-L477 HydrophobicContact CG1-CD1 3.72Å; V473-L477 HydrophobicContact CG1-CG 4.24Å; V473-L477 WeakPolarHBondContact O-CB 3.41Å; V473-L477 WeakPolarHBondContact O-CD1 3.49Å; V473-L477 WeakPolarHBondContact O-CG 3.34Å; V473-L477 PolarHBondContact O-N 3.42Å; V473-L477 VanDerWaalsContact O-N 3.08Å; F475-L477 VanDerWaalsContact C-N 3.32Å; F475-L477 PolarHBondContact O-N 3.35Å; L477-I495 HydrophobicContact CD2-CD1 3.79Å; L477-K513 HydrophobicContact CD1-CB 3.84Å; L477-K513 HydrophobicContact CD1-CD 4.35Å; L477-A517 HydrophobicContact CD2-CB 3.48Å; L477-A517 VanDerWaalsContact CD2-CB 3.48Å
478	L	94.4	Very high	94.3	Very high	112 Å²	112	44.7 Å²	44.7	59%	0.586	24%	0.239	S	C	*	.	H	α-helix	trans	-72.7	-32	173.8	-59	174.3	0	0	0	111.7	F475 V476 C480 S481	F475-L478 HydrophobicContact CD2-CD1 4.1Å; F475-L478 HydrophobicContact CE2-CD1 4.5Å; F475-L478 WeakPolarHBondContact O-CB 3.34Å; F475-L478 PolarHBondContact O-N 3.12Å; F475-L478 VanDerWaalsContact O-N 3.11Å; V476-L478 PolarHBondContact O-N 3.04Å; L478-C480 VanDerWaalsContact C-N 3.28Å; L478-C480 PolarHBondContact O-N 3.28Å; L478-S481 PolarHBondContact O-N 3.23Å; L478-S481 VanDerWaalsContact O-N 3.15Å
479	F	96.9	Very high	94.5	Very high	19 Å²	19	45.6 Å²	45.6	8%	0.083	24%	0.241	C	C	.	.	H	α-helix	trans	-75.7	-13.8	-178.8	-63.8	-74.2	0	0	0	113.4	L439 L451 F475 V476 S481 D482 V487 R488 A491	L439-F479 HydrophobicContact CB-CE2 4.22Å; L439-F479 HydrophobicContact CB-CZ 3.87Å; L439-F479 HydrophobicContact CD1-CE2 4.37Å; L439-F479 HydrophobicContact CD2-CE2 4.14Å; L439-F479 HydrophobicContact CD2-CZ 4.29Å; L439-F479 HydrophobicContact CG-CE2 4.49Å; L439-F479 WeakPolarHBondContact O-CE1 3.42Å; L439-F479 VanDerWaalsContact O-CZ 3.32Å; L439-F479 WeakPolarHBondContact O-CZ 3.35Å; L451-F479 HydrophobicContact CD1-CB 3.89Å; L451-F479 HydrophobicContact CD1-CG 4.12Å; L451-F479 HydrophobicContact CD2-CB 4.41Å; L451-F479 HydrophobicContact CD2-CD2 4.01Å; L451-F479 HydrophobicContact CD2-CG 4.35Å; F475-F479 AromaticContact CD1-CE2 3.78Å; F475-F479 HydrophobicContact CD1-CE2 3.78Å; F475-F479 HydrophobicContact CD1-CZ 4.42Å; F475-F479 AromaticContact CE1-CE2 3.79Å; F475-F479 HydrophobicContact CE1-CE2 3.79Å; F475-F479 AromaticContact CE1-CZ 3.95Å; F475-F479 HydrophobicContact CE1-CZ 3.95Å; F475-F479 HydrophobicContact CG-CE2 4.41Å; F475-F479 HydrophobicContact CZ-CE2 4.42Å; F475-F479 HydrophobicContact CZ-CZ 4.31Å; F475-F479 VanDerWaalsContact O-CD2 3.32Å; F475-F479 WeakPolarHBondContact O-CD2 3.4Å; V476-F479 WeakPolarHBondContact O-CB 3.37Å; V476-F479 PolarHBondContact O-N 3.14Å; F479-S481 PolarHBondContact O-N 3.07Å; F479-S481 VanDerWaalsContact O-N 3.12Å; F479-D482 HydrophobicContact CD1-CB 4.5Å; F479-D482 WeakPolarHBondContact O-CB 3.33Å; F479-D482 PolarHBondContact O-N 3.32Å; F479-V487 HydrophobicContact CB-CG1 4.35Å; F479-V487 HydrophobicContact CD1-CG1 4.07Å; F479-R488 VanDerWaalsContact O-CG 3.27Å; F479-R488 WeakPolarHBondContact O-CG 3.38Å; F479-A491 HydrophobicContact CB-CB 3.7Å
480	C	95.3	Very high	94.6	Very high	7 Å²	7	45.6 Å²	45.6	5%	0.047	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-18	165.4	-55.5	0	0	0	0	112.7	L478 R488 I495	L478-C480 VanDerWaalsContact C-N 3.28Å; L478-C480 PolarHBondContact O-N 3.28Å; C480-R488 WeakPolarHBondContact O-CD 3.17Å; C480-R488 WeakPolarHBondContact O-CG 3.1Å; C480-I495 WeakPolarHBondContact SG-CD1 3.44Å
481	S	94.1	Very high	94.8	Very high	90 Å²	90	39.3 Å²	39.3	63%	0.629	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-112.6	19.5	173.7	-63	0	0	0	0	113.7	L478 F479	L478-S481 PolarHBondContact O-N 3.23Å; L478-S481 VanDerWaalsContact O-N 3.15Å; F479-S481 PolarHBondContact O-N 3.07Å; F479-S481 VanDerWaalsContact O-N 3.12Å
482	D	96.5	Very high	95.1	Very high	14 Å²	14	32.7 Å²	32.7	8%	0.075	18%	0.181	C	C	.	.			trans	-61.3	142.7	175.3	-166.8	-82.1	0	0	0	111.2	R447 F479 H484 V487 R488	R447-D482 IonicContact CZ-OD1 3.97Å; R447-D482 IonicContact CZ-OD2 3.59Å; R447-D482 IonicContact NE-OD1 2.59Å; R447-D482 IonicContact NE-OD2 3.94Å; R447-D482 PolarHBondContact NE-OD2 3.1Å; R447-D482 IonicContact NH2-OD1 2.7Å; R447-D482 PolarHBondContact NH2-OD1 2.58Å; R447-D482 IonicContact NH2-OD2 2.64Å; R447-D482 PolarHBondContact NH2-OD2 3.14Å; F479-D482 HydrophobicContact CD1-CB 4.5Å; F479-D482 WeakPolarHBondContact O-CB 3.33Å; F479-D482 PolarHBondContact O-N 3.32Å; D482-H484 PolarHBondContact O-N 2.99Å; D482-H484 VanDerWaalsContact O-N 3.14Å; D482-H484 WeakPolarHBondContact OD1-CB 3.28Å; D482-H484 PolarHBondContact OD1-N 3.02Å; D482-V487 HydrophobicContact CB-CB 3.93Å; D482-V487 HydrophobicContact CB-CG1 3.67Å; D482-V487 VanDerWaalsContact CG-CG1 3.44Å; D482-R488 HydrophobicContact CB-CG 4.04Å; D482-R488 WeakPolarHBondContact O-CD 3.42Å; D482-R488 WeakPolarHBondContact O-CG 3.26Å; D482-R488 PolarHBondContact O-NE 3.45Å; D482-R488 VanDerWaalsContact O-NE 3.1Å
483	P	94.7	Very high	95.3	Very high	119 Å²	119	33.4 Å²	33.4	77%	0.773	19%	0.185	S	C	*	.	S	Bend	trans	-58.4	-23.2	176.2	23.3	-36.1	0	0	0	114.3
484	H	94.9	Very high	95.4	Very high	38 Å²	38	33.3 Å²	33.3	18%	0.176	18%	0.184	C	C	.	.	S	Bend	trans	-95.5	128.2	-178.3	-158.8	-98.8	0	0	0	112.4	W444 D482 R486 V487 R488	W444-H484 HydrophobicContact CB-CB 3.85Å; W444-H484 AromaticContact CD1-CD2 3.73Å; W444-H484 AromaticContact CD1-NE2 3.67Å; W444-H484 AromaticContact CD2-CE1 3.25Å; W444-H484 AromaticContact CD2-CG 3.91Å; W444-H484 AromaticContact CD2-ND1 3.38Å; W444-H484 AromaticContact CD2-NE2 3.72Å; W444-H484 AromaticContact CE2-CE1 3.34Å; W444-H484 AromaticContact CE2-ND1 3.99Å; W444-H484 AromaticContact CE2-NE2 3.6Å; W444-H484 AromaticContact CE3-CE1 3.51Å; W444-H484 AromaticContact CE3-ND1 3.41Å; W444-H484 HydrophobicContact CG-CB 4.38Å; W444-H484 AromaticContact CG-CD2 3.71Å; W444-H484 AromaticContact CG-CE1 3.73Å; W444-H484 AromaticContact CG-CG 3.64Å; W444-H484 AromaticContact CG-ND1 3.66Å; W444-H484 AromaticContact CG-NE2 3.79Å; W444-H484 AromaticContact CZ2-CE1 3.73Å; W444-H484 AromaticContact CZ3-CE1 3.89Å; W444-H484 AromaticContact NE1-CE1 3.77Å; W444-H484 AromaticContact NE1-NE2 3.53Å; D482-H484 PolarHBondContact O-N 2.99Å; D482-H484 VanDerWaalsContact O-N 3.14Å; D482-H484 WeakPolarHBondContact OD1-CB 3.28Å; D482-H484 PolarHBondContact OD1-N 3.02Å; H484-R486 PolarHBondContact ND1-N 3.12Å; H484-R486 PolarHBondContact O-N 3.27Å; H484-V487 HydrophobicContact CB-CB 4.23Å; H484-V487 HydrophobicContact CB-CG2 3.87Å; H484-V487 PolarHBondContact O-N 3.41Å; H484-R488 PolarHBondContact O-N 3.36Å
485	P	94	Very high	95.7	Very high	26 Å²	26	31.1 Å²	31.1	17%	0.169	17%	0.169	C	C	.	.	H	α-helix	trans	-63.4	-39.9	-177.5	25	-33.2	0	0	0	113.1	W393 A394 V487 R488 Y489 N527 V530	W393-P485 HydrophobicContact CZ3-CB 4.33Å; A394-P485 HydrophobicContact CB-CB 4.31Å; A394-P485 HydrophobicContact CB-CG 4.26Å; P485-V487 VanDerWaalsContact C-N 3.27Å; P485-V487 PolarHBondContact O-N 3.19Å; P485-R488 PolarHBondContact O-N 2.94Å; P485-Y489 PolarHBondContact O-N 2.88Å; P485-N527 WeakPolarHBondContact CB-OD1 3.25Å; P485-V530 HydrophobicContact CB-CG2 4.12Å; P485-V530 WeakPolarHBondContact O-CG2 3.43Å
486	R	94.3	Very high	96	Very high	21 Å²	21	28.3 Å²	28.3	8%	0.079	16%	0.157	C	C	.	.	H	α-helix	trans	-62.6	-32.1	175.9	-64	-173.2	70.7	165.1	12	112.6	E388 W393 W444 H448 H484 Y489 A490	E388-R486 PolarHBondContact O-NH1 3.06Å; W393-R486 HydrophobicContact CD2-CG 3.58Å; W393-R486 HydrophobicContact CE3-CG 3.51Å; W393-R486 HydrophobicContact CG-CG 4.33Å; W393-R486 HydrophobicContact CH2-CB 4.49Å; W393-R486 HydrophobicContact CH2-CG 3.88Å; W393-R486 HydrophobicContact CZ2-CG 3.88Å; W393-R486 HydrophobicContact CZ3-CB 4.49Å; W393-R486 HydrophobicContact CZ3-CG 3.69Å; W444-R486 HydrophobicContact CE3-CB 4.23Å; W444-R486 HydrophobicContact CH2-CB 4.43Å; W444-R486 HydrophobicContact CZ3-CB 3.79Å; W444-R486 HydrophobicContact CZ3-CG 4.35Å; H448-R486 PolarHBondContact CD2-O 2.92Å; H448-R486 VanDerWaalsContact CD2-O 3.31Å; H484-R486 PolarHBondContact ND1-N 3.12Å; H484-R486 PolarHBondContact O-N 3.27Å; R486-Y489 WeakPolarHBondContact O-CB 3.27Å; R486-Y489 PolarHBondContact O-N 3.3Å; R486-A490 PolarHBondContact O-N 3.4Å
487	V	96.8	Very high	96	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-72.6	-37.4	176.8	-179.6	0	0	0	0	110.9	W444 R447 H448 L451 F479 D482 H484 P485 Y489 A490 A491	W444-V487 HydrophobicContact CB-CG2 3.96Å; W444-V487 HydrophobicContact CE3-CG2 4.37Å; W444-V487 WeakPolarHBondContact O-CG2 3.33Å; R447-V487 HydrophobicContact CB-CG1 3.9Å; R447-V487 HydrophobicContact CB-CG2 4.05Å; H448-V487 HydrophobicContact CB-CG2 4.33Å; L451-V487 HydrophobicContact CD1-CG1 3.75Å; L451-V487 WeakPolarHBondContact CD1-O 3.4Å; F479-V487 HydrophobicContact CB-CG1 4.35Å; F479-V487 HydrophobicContact CD1-CG1 4.07Å; D482-V487 HydrophobicContact CB-CB 3.93Å; D482-V487 HydrophobicContact CB-CG1 3.67Å; D482-V487 VanDerWaalsContact CG-CG1 3.44Å; H484-V487 HydrophobicContact CB-CB 4.23Å; H484-V487 HydrophobicContact CB-CG2 3.87Å; H484-V487 PolarHBondContact O-N 3.41Å; P485-V487 VanDerWaalsContact C-N 3.27Å; P485-V487 PolarHBondContact O-N 3.19Å; V487-Y489 VanDerWaalsContact C-N 3.34Å; V487-A490 PolarHBondContact O-N 3.39Å; V487-A491 WeakPolarHBondContact O-CB 3.47Å; V487-A491 PolarHBondContact O-N 3.45Å
488	R	96.6	Very high	96.1	Very high	36 Å²	36	29.9 Å²	29.9	14%	0.136	16%	0.164	C	C	.	.	H	α-helix	trans	-64.8	-37.4	172.4	-68.3	-174.7	-74.8	151.5	6.1	112.3	F479 C480 D482 H484 P485 A491 C492 D524 N527 V530	F479-R488 VanDerWaalsContact O-CG 3.27Å; F479-R488 WeakPolarHBondContact O-CG 3.38Å; C480-R488 WeakPolarHBondContact O-CD 3.17Å; C480-R488 WeakPolarHBondContact O-CG 3.1Å; D482-R488 HydrophobicContact CB-CG 4.04Å; D482-R488 WeakPolarHBondContact O-CD 3.42Å; D482-R488 WeakPolarHBondContact O-CG 3.26Å; D482-R488 PolarHBondContact O-NE 3.45Å; D482-R488 VanDerWaalsContact O-NE 3.1Å; H484-R488 PolarHBondContact O-N 3.36Å; P485-R488 PolarHBondContact O-N 2.94Å; R488-A491 WeakPolarHBondContact O-CB 3.49Å; R488-A491 PolarHBondContact O-N 2.75Å; R488-C492 PolarHBondContact O-N 3.31Å; R488-C492 VanDerWaalsContact O-N 3.12Å; R488-C492 PolarHBondContact O-SG 3.1Å; R488-D524 IonicContact CZ-OD2 3.22Å; R488-D524 IonicContact NH1-OD2 2.91Å; R488-D524 PolarHBondContact NH1-OD2 3.19Å; R488-D524 IonicContact NH2-OD2 2.68Å; R488-D524 PolarHBondContact NH2-OD2 3.34Å; R488-N527 PolarHBondContact NH2-ND2 3.11Å; R488-V530 HydrophobicContact CB-CG1 3.86Å; R488-V530 HydrophobicContact CB-CG2 4.33Å
489	Y	94.8	Very high	96.2	Very high	50 Å²	50	24.6 Å²	24.6	20%	0.196	14%	0.136	C	C	.	.	H	α-helix	trans	-60.2	-54.9	170.3	179.6	-82.6	0	0	0	111	W393 P485 R486 V487 A491 C492 N493 H533	W393-Y489 HydrophobicContact CH2-CD1 4.49Å; W393-Y489 AromaticContact CH2-CD2 3.75Å; W393-Y489 HydrophobicContact CH2-CD2 3.75Å; W393-Y489 HydrophobicContact CH2-CE2 4.49Å; W393-Y489 AromaticContact CH2-CG 3.75Å; W393-Y489 HydrophobicContact CH2-CG 3.75Å; W393-Y489 HydrophobicContact CZ2-CD1 4.48Å; W393-Y489 HydrophobicContact CZ2-CD2 4.16Å; W393-Y489 HydrophobicContact CZ2-CG 4.14Å; P485-Y489 PolarHBondContact O-N 2.88Å; R486-Y489 WeakPolarHBondContact O-CB 3.27Å; R486-Y489 PolarHBondContact O-N 3.3Å; V487-Y489 VanDerWaalsContact C-N 3.34Å; Y489-A491 PolarHBondContact O-N 3.47Å; Y489-A491 VanDerWaalsContact O-N 3.12Å; Y489-C492 WeakPolarHBondContact O-CA 3.34Å; Y489-C492 WeakPolarHBondContact O-CB 3.46Å; Y489-C492 PolarHBondContact O-N 3.19Å; Y489-N493 PolarHBondContact O-N 3.44Å; Y489-H533 AromaticContact CD1-CD2 3.84Å; Y489-H533 HydrophobicContact CD2-CB 3.5Å; Y489-H533 AromaticContact CD2-CD2 3.62Å; Y489-H533 AromaticContact CD2-CG 3.66Å; Y489-H533 AromaticContact CE1-CD2 3.78Å; Y489-H533 AromaticContact CE1-NE2 3.71Å; Y489-H533 HydrophobicContact CE2-CB 3.42Å; Y489-H533 VanDerWaalsContact CE2-CB 3.42Å; Y489-H533 AromaticContact CE2-CD2 3.59Å; Y489-H533 AromaticContact CE2-CG 3.35Å; Y489-H533 AromaticContact CE2-ND1 3.81Å; Y489-H533 HydrophobicContact CG-CB 4.41Å; Y489-H533 AromaticContact CG-CD2 3.74Å; Y489-H533 AromaticContact CZ-CD2 3.65Å; Y489-H533 AromaticContact CZ-CE1 3.81Å; Y489-H533 AromaticContact CZ-CG 3.67Å; Y489-H533 AromaticContact CZ-ND1 3.75Å; Y489-H533 AromaticContact CZ-NE2 3.76Å; Y489-H533 PolarHBondContact O-CD2 3.4Å
490	A	96.3	Very high	96.2	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-59.3	-27.9	177.7	0	0	0	0	0	113.4	L451 M452 R486 V487 N493 A494	L451-A490 HydrophobicContact CB-CB 3.77Å; L451-A490 HydrophobicContact CD1-CB 4Å; M452-A490 HydrophobicContact CG-CB 4.12Å; M452-A490 HydrophobicContact SD-CB 3.62Å; R486-A490 PolarHBondContact O-N 3.4Å; V487-A490 PolarHBondContact O-N 3.39Å; A490-N493 WeakPolarHBondContact O-CB 3.3Å; A490-N493 PolarHBondContact O-N 3.32Å; A490-A494 PolarHBondContact O-N 2.9Å
491	A	97.9	Very high	96.1	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-69.5	-39	172.9	0	0	0	0	0	112.3	L451 F479 V487 R488 Y489 I495	L451-A491 HydrophobicContact CD1-CB 4.05Å; F479-A491 HydrophobicContact CB-CB 3.7Å; V487-A491 WeakPolarHBondContact O-CB 3.47Å; V487-A491 PolarHBondContact O-N 3.45Å; R488-A491 WeakPolarHBondContact O-CB 3.49Å; R488-A491 PolarHBondContact O-N 2.75Å; Y489-A491 PolarHBondContact O-N 3.47Å; Y489-A491 VanDerWaalsContact O-N 3.12Å; A491-I495 WeakPolarHBondContact O-CD1 3.46Å; A491-I495 VanDerWaalsContact O-CG1 3.26Å; A491-I495 WeakPolarHBondContact O-CG1 3.39Å; A491-I495 PolarHBondContact O-N 2.96Å; A491-I495 VanDerWaalsContact O-N 3.1Å
492	C	97.4	Very high	96.2	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-64.5	-41.1	169.8	-65.9	0	0	0	0	111.3	R488 Y489 A494 I495 G496 A537	R488-C492 PolarHBondContact O-N 3.31Å; R488-C492 VanDerWaalsContact O-N 3.12Å; R488-C492 PolarHBondContact O-SG 3.1Å; Y489-C492 WeakPolarHBondContact O-CA 3.34Å; Y489-C492 WeakPolarHBondContact O-CB 3.46Å; Y489-C492 PolarHBondContact O-N 3.19Å; C492-A494 PolarHBondContact O-N 2.85Å; C492-I495 PolarHBondContact O-N 2.93Å; C492-I495 VanDerWaalsContact O-N 3.14Å; C492-G496 PolarHBondContact O-N 3.48Å; C492-A537 HydrophobicContact CB-CB 4.37Å; C492-A537 VanDerWaalsContact O-CB 3.29Å; C492-A537 WeakPolarHBondContact O-CB 3.42Å
493	N	96.6	Very high	96.1	Very high	30 Å²	30	24 Å²	24	16%	0.16	13%	0.133	C	C	.	.	H	α-helix	trans	-55.3	-53.3	175.4	-166.6	56.5	0	0	0	111.1	M452 S455 Y489 A490 I495 G496 Q497 H533	M452-N493 HydrophobicContact CE-CB 4.37Å; M452-N493 WeakPolarHBondContact CE-ND2 3.48Å; M452-N493 HydrophobicContact SD-CB 3.95Å; S455-N493 PolarHBondContact OG-ND2 2.85Å; Y489-N493 PolarHBondContact O-N 3.44Å; A490-N493 WeakPolarHBondContact O-CB 3.3Å; A490-N493 PolarHBondContact O-N 3.32Å; N493-I495 VanDerWaalsContact C-N 3.26Å; N493-I495 PolarHBondContact O-N 3.12Å; N493-G496 PolarHBondContact O-N 2.74Å; N493-G496 VanDerWaalsContact O-N 3.13Å; N493-Q497 WeakPolarHBondContact O-CB 3.41Å; N493-Q497 PolarHBondContact O-N 2.82Å; N493-H533 VanDerWaalsContact CA-NE2 3.26Å; N493-H533 WeakPolarHBondContact CA-NE2 3.4Å; N493-H533 VanDerWaalsContact CB-NE2 3.26Å; N493-H533 WeakPolarHBondContact CB-NE2 3.43Å; N493-H533 PolarHBondContact N-NE2 3.2Å
494	A	97.5	Very high	96.1	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-60.7	-33.4	178.6	0	0	0	0	0	113	S455 V476 A490 C492 M498	S455-A494 VanDerWaalsContact OG-CA 3.27Å; S455-A494 WeakPolarHBondContact OG-CA 3.36Å; S455-A494 PolarHBondContact OG-N 3.37Å; V476-A494 HydrophobicContact CG1-CB 4.02Å; A490-A494 PolarHBondContact O-N 2.9Å; C492-A494 PolarHBondContact O-N 2.85Å; A494-M498 HydrophobicContact CB-CE 4.45Å; A494-M498 WeakPolarHBondContact O-CB 3.38Å; A494-M498 WeakPolarHBondContact O-CE 3.45Å; A494-M498 WeakPolarHBondContact O-CG 3.43Å; A494-M498 PolarHBondContact O-N 2.93Å
495	I	98.1	Very high	96.1	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.01	11%	0.114	C	C	.	.	H	α-helix	trans	-70.9	-41.9	175	-70.1	164.9	0	0	0	111.6	V476 L477 C480 A491 C492 N493 A499 V514 L518	V476-I495 HydrophobicContact CG1-CD1 4.28Å; V476-I495 HydrophobicContact CG1-CG1 3.79Å; L477-I495 HydrophobicContact CD2-CD1 3.79Å; C480-I495 WeakPolarHBondContact SG-CD1 3.44Å; A491-I495 WeakPolarHBondContact O-CD1 3.46Å; A491-I495 VanDerWaalsContact O-CG1 3.26Å; A491-I495 WeakPolarHBondContact O-CG1 3.39Å; A491-I495 PolarHBondContact O-N 2.96Å; A491-I495 VanDerWaalsContact O-N 3.1Å; C492-I495 PolarHBondContact O-N 2.93Å; C492-I495 VanDerWaalsContact O-N 3.14Å; N493-I495 VanDerWaalsContact C-N 3.26Å; N493-I495 PolarHBondContact O-N 3.12Å; I495-A499 WeakPolarHBondContact O-CB 3.18Å; I495-A499 PolarHBondContact O-N 2.7Å; I495-A499 VanDerWaalsContact O-N 3.11Å; I495-V514 HydrophobicContact CG2-CG1 3.65Å; I495-L518 HydrophobicContact CD1-CD2 4.31Å; I495-L518 HydrophobicContact CG2-CD1 3.96Å; I495-L518 HydrophobicContact CG2-CD2 3.99Å; I495-L518 HydrophobicContact CG2-CG 4.16Å
496	G	97.1	Very high	96.3	Very high	3 Å²	3	19.5 Å²	19.5	3%	0.031	11%	0.106	C	C	.	.	H	α-helix	trans	-64.6	-51.4	177.6	0	0	0	0	0	111.6	C492 N493 M498 A499 T500 N540	C492-G496 PolarHBondContact O-N 3.48Å; N493-G496 PolarHBondContact O-N 2.74Å; N493-G496 VanDerWaalsContact O-N 3.13Å; G496-M498 PolarHBondContact O-N 3.46Å; G496-A499 VanDerWaalsContact O-CB 3.32Å; G496-A499 WeakPolarHBondContact O-CB 3.29Å; G496-A499 PolarHBondContact O-N 3.39Å; G496-T500 PolarHBondContact O-N 3.37Å; G496-N540 WeakPolarHBondContact O-CB 3.47Å
497	Q	96.7	Very high	96.4	Very high	61 Å²	61	18.5 Å²	18.5	29%	0.285	10%	0.102	S	C	.	.	H	α-helix	trans	-60.5	-48.4	178.6	-163.1	63.3	46.1	0	0	111.5	N493 A499 T500 D501	N493-Q497 WeakPolarHBondContact O-CB 3.41Å; N493-Q497 PolarHBondContact O-N 2.82Å; Q497-A499 PolarHBondContact O-N 3.31Å; Q497-A499 VanDerWaalsContact O-N 3.12Å; Q497-T500 PolarHBondContact O-N 2.92Å; Q497-D501 WeakPolarHBondContact CG-OD2 3.49Å; Q497-D501 PolarHBondContact NE2-OD1 2.88Å; Q497-D501 PolarHBondContact O-N 3.47Å
498	M	97.3	Very high	96.3	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-62.1	-22.3	175.3	-74.6	-172.7	-69.1	0	0	113.8	L469 I472 V473 V476 A494 G496 F502 F506	L469-M498 HydrophobicContact CD1-SD 4.11Å; I472-M498 HydrophobicContact CG2-SD 3.74Å; V473-M498 HydrophobicContact CG2-CE 4.24Å; V473-M498 HydrophobicContact CG2-SD 4.11Å; V476-M498 HydrophobicContact CB-CE 4.12Å; V476-M498 HydrophobicContact CG1-CE 4.01Å; V476-M498 HydrophobicContact CG2-CE 3.93Å; A494-M498 HydrophobicContact CB-CE 4.45Å; A494-M498 WeakPolarHBondContact O-CB 3.38Å; A494-M498 WeakPolarHBondContact O-CE 3.45Å; A494-M498 WeakPolarHBondContact O-CG 3.43Å; A494-M498 PolarHBondContact O-N 2.93Å; G496-M498 PolarHBondContact O-N 3.46Å; M498-F502 HydrophobicContact CB-CD2 4.08Å; M498-F502 HydrophobicContact CB-CE2 4.37Å; M498-F502 HydrophobicContact CG-CD2 4.23Å; M498-F502 HydrophobicContact CG-CE2 4.01Å; M498-F502 WeakPolarHBondContact O-CB 3.3Å; M498-F502 WeakPolarHBondContact O-CD2 3.43Å; M498-F502 PolarHBondContact O-N 3.17Å; M498-F506 HydrophobicContact CB-CD2 4.01Å; M498-F506 HydrophobicContact CB-CE2 3.5Å; M498-F506 HydrophobicContact CB-CZ 4.02Å; M498-F506 HydrophobicContact CE-CE2 4.37Å; M498-F506 HydrophobicContact CG-CE2 4.47Å; M498-F506 WeakPolarHBondContact O-CD2 3.48Å; M498-F506 WeakPolarHBondContact O-CG 3.09Å; M498-F506 HydrophobicContact SD-CE2 4.27Å
499	A	97.3	Very high	96.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-72.6	-35.2	174.6	0	0	0	0	0	111.7	I495 G496 Q497 A503 F506 Q507 N540 F541	I495-A499 WeakPolarHBondContact O-CB 3.18Å; I495-A499 PolarHBondContact O-N 2.7Å; I495-A499 VanDerWaalsContact O-N 3.11Å; G496-A499 VanDerWaalsContact O-CB 3.32Å; G496-A499 WeakPolarHBondContact O-CB 3.29Å; G496-A499 PolarHBondContact O-N 3.39Å; Q497-A499 PolarHBondContact O-N 3.31Å; Q497-A499 VanDerWaalsContact O-N 3.12Å; A499-A503 WeakPolarHBondContact O-CB 3.3Å; A499-A503 PolarHBondContact O-N 2.89Å; A499-F506 HydrophobicContact CB-CD1 3.86Å; A499-F506 HydrophobicContact CB-CE1 3.92Å; A499-Q507 PolarHBondContact O-NE2 2.94Å; A499-N540 HydrophobicContact CB-CB 4.41Å; A499-F541 HydrophobicContact CB-CB 4.21Å; A499-F541 HydrophobicContact CB-CD2 4.13Å
500	T	95.4	Very high	96.4	Very high	55 Å²	55	25.3 Å²	25.3	34%	0.337	13%	0.134	S	C	.	.	H	α-helix	trans	-75.1	-60.1	173.9	-57.1	0	0	0	0	111.1	G496 Q497 F502 A503 N540	G496-T500 PolarHBondContact O-N 3.37Å; Q497-T500 PolarHBondContact O-N 2.92Å; T500-F502 PolarHBondContact O-N 3.46Å; T500-F502 VanDerWaalsContact O-N 3.08Å; T500-A503 WeakPolarHBondContact O-CB 3.44Å; T500-A503 PolarHBondContact O-N 3.39Å; T500-N540 PolarHBondContact OG1-ND2 3.28Å; T500-N540 VanDerWaalsContact OG1-ND2 3.11Å
501	D	94.8	Very high	96.3	Very high	26 Å²	26	27.3 Å²	27.3	14%	0.139	14%	0.143	C	C	.	.	H	α-helix	trans	-62.8	-27	-171.2	-38.7	-30.6	0	0	0	114.1	G458 Q497	G458-D501 VanDerWaalsContact CA-OD2 3.23Å; G458-D501 WeakPolarHBondContact CA-OD2 3.45Å; Q497-D501 WeakPolarHBondContact CG-OD2 3.49Å; Q497-D501 PolarHBondContact NE2-OD1 2.88Å; Q497-D501 PolarHBondContact O-N 3.47Å
502	F	96.1	Very high	96.1	Very high	5 Å²	5	30.8 Å²	30.8	2%	0.022	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	17.6	-179.6	-57.8	-99.6	0	0	0	112.1	H462 M465 E466 L469 M498 T500 T505 F506	H462-F502 HydrophobicContact CB-CD1 4.01Å; H462-F502 HydrophobicContact CB-CE1 3.72Å; H462-F502 HydrophobicContact CB-CE2 4.33Å; H462-F502 HydrophobicContact CB-CG 4.46Å; H462-F502 HydrophobicContact CB-CZ 3.89Å; H462-F502 VanDerWaalsContact O-CE1 3.29Å; H462-F502 WeakPolarHBondContact O-CE1 3.42Å; M465-F502 HydrophobicContact CB-CE1 3.72Å; M465-F502 HydrophobicContact CB-CZ 3.64Å; M465-F502 HydrophobicContact CE-CZ 3.97Å; M465-F502 HydrophobicContact CG-CZ 4.49Å; M465-F502 HydrophobicContact SD-CZ 4.19Å; E466-F502 HydrophobicContact CG-CD1 4.45Å; L469-F502 HydrophobicContact CD1-CD1 3.97Å; L469-F502 HydrophobicContact CD1-CD2 4.25Å; L469-F502 HydrophobicContact CD1-CE1 3.88Å; L469-F502 HydrophobicContact CD1-CE2 4.21Å; L469-F502 HydrophobicContact CD1-CG 4.15Å; L469-F502 HydrophobicContact CD1-CZ 4.02Å; L469-F502 HydrophobicContact CD2-CB 4.15Å; L469-F502 HydrophobicContact CD2-CD1 3.6Å; L469-F502 HydrophobicContact CD2-CE1 4.17Å; L469-F502 HydrophobicContact CD2-CG 3.97Å; L469-F502 HydrophobicContact CG-CD1 4.37Å; M498-F502 HydrophobicContact CB-CD2 4.08Å; M498-F502 HydrophobicContact CB-CE2 4.37Å; M498-F502 HydrophobicContact CG-CD2 4.23Å; M498-F502 HydrophobicContact CG-CE2 4.01Å; M498-F502 WeakPolarHBondContact O-CB 3.3Å; M498-F502 WeakPolarHBondContact O-CD2 3.43Å; M498-F502 PolarHBondContact O-N 3.17Å; T500-F502 PolarHBondContact O-N 3.46Å; T500-F502 VanDerWaalsContact O-N 3.08Å; F502-T505 CarbonylContact O-C 3.59Å; F502-T505 WeakPolarHBondContact O-CA 3.5Å; F502-T505 WeakPolarHBondContact O-CB 3.42Å; F502-T505 PolarHBondContact O-N 3.14Å; F502-F506 HydrophobicContact CB-CB 3.96Å; F502-F506 HydrophobicContact CB-CD2 4.47Å; F502-F506 PolarHBondContact O-N 2.94Å
503	A	94.8	Very high	96	Very high	33 Å²	33	34.9 Å²	34.9	27%	0.273	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	147.7	173.6	0	0	0	0	0	112.1	A499 T500 D544	A499-A503 WeakPolarHBondContact O-CB 3.3Å; A499-A503 PolarHBondContact O-N 2.89Å; T500-A503 WeakPolarHBondContact O-CB 3.44Å; T500-A503 PolarHBondContact O-N 3.39Å; A503-D544 HydrophobicContact CB-CB 3.65Å
504	P	94.2	Very high	96	Very high	52 Å²	52	33.4 Å²	33.4	34%	0.338	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	cis	-84.1	13.4	-20.3	36.7	-37.5	0	0	0	112.1	Q507 K508 P546	P504-Q507 VanDerWaalsContact C-OE1 3.29Å; P504-Q507 VanDerWaalsContact CA-OE1 3.27Å; P504-K508 WeakPolarHBondContact O-CB 3.27Å; P504-K508 VanDerWaalsContact O-CD 3.32Å; P504-K508 WeakPolarHBondContact O-CD 3.48Å; P504-K508 WeakPolarHBondContact O-CG 3.47Å; P504-K508 PolarHBondContact O-N 3.1Å; P504-K508 VanDerWaalsContact O-N 3.15Å; P504-P546 HydrophobicContact CB-CG 4.18Å
505	T	94.8	Very high	95.8	Very high	36 Å²	36	33.7 Å²	33.7	22%	0.221	17%	0.173	C	C	.	.	H	α-helix	trans	-70.8	-34.7	-174.4	-70.7	0	0	0	0	112.1	F502 K508 K509	F502-T505 CarbonylContact O-C 3.59Å; F502-T505 WeakPolarHBondContact O-CA 3.5Å; F502-T505 WeakPolarHBondContact O-CB 3.42Å; F502-T505 PolarHBondContact O-N 3.14Å; T505-K508 PolarHBondContact O-N 3.26Å; T505-K509 HydrophobicContact CG2-CD 3.8Å; T505-K509 WeakPolarHBondContact O-CB 3.49Å; T505-K509 WeakPolarHBondContact O-CG 3.3Å; T505-K509 PolarHBondContact O-N 3.01Å; T505-K509 VanDerWaalsContact O-N 3.16Å
506	F	96.9	Very high	95.5	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-60.4	-53.3	175.2	-170.6	-96.3	0	0	0	111.5	V473 M498 A499 F502 K508 K509 F510 V514 F541	V473-F506 HydrophobicContact CG2-CD2 4.24Å; V473-F506 HydrophobicContact CG2-CE2 3.46Å; V473-F506 VanDerWaalsContact CG2-CE2 3.46Å; V473-F506 HydrophobicContact CG2-CZ 4.22Å; M498-F506 HydrophobicContact CB-CD2 4.01Å; M498-F506 HydrophobicContact CB-CE2 3.5Å; M498-F506 HydrophobicContact CB-CZ 4.02Å; M498-F506 HydrophobicContact CE-CE2 4.37Å; M498-F506 HydrophobicContact CG-CE2 4.47Å; M498-F506 WeakPolarHBondContact O-CD2 3.48Å; M498-F506 WeakPolarHBondContact O-CG 3.09Å; M498-F506 HydrophobicContact SD-CE2 4.27Å; A499-F506 HydrophobicContact CB-CD1 3.86Å; A499-F506 HydrophobicContact CB-CE1 3.92Å; F502-F506 HydrophobicContact CB-CB 3.96Å; F502-F506 HydrophobicContact CB-CD2 4.47Å; F502-F506 PolarHBondContact O-N 2.94Å; F506-K508 VanDerWaalsContact C-N 3.32Å; F506-K508 PolarHBondContact O-N 3.12Å; F506-K509 PolarHBondContact O-N 2.9Å; F506-K509 VanDerWaalsContact O-N 3.08Å; F506-F510 AromaticContact CD2-CD2 3.84Å; F506-F510 HydrophobicContact CD2-CD2 3.84Å; F506-F510 HydrophobicContact CD2-CE2 4.29Å; F506-F510 HydrophobicContact CE2-CD2 4.19Å; F506-F510 HydrophobicContact CG-CD2 4.17Å; F506-F510 WeakPolarHBondContact O-CD2 3.14Å; F506-F510 PolarHBondContact O-N 3.46Å; F506-V514 HydrophobicContact CE1-CG1 4.19Å; F506-V514 HydrophobicContact CE1-CG2 3.82Å; F506-V514 HydrophobicContact CZ-CG2 3.89Å; F506-F541 AromaticContact CD1-CD2 3.92Å; F506-F541 HydrophobicContact CD1-CD2 3.92Å; F506-F541 AromaticContact CD1-CE2 3.76Å; F506-F541 HydrophobicContact CD1-CE2 3.76Å; F506-F541 AromaticContact CE1-CD2 3.84Å; F506-F541 HydrophobicContact CE1-CD2 3.84Å; F506-F541 AromaticContact CE1-CE2 3.9Å; F506-F541 HydrophobicContact CE1-CE2 3.9Å
507	Q	96.8	Very high	95.4	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-59.3	-44.2	178.3	-61.8	79.9	-5	0	0	110.2	A499 P504 K509 H511 F541 D544 C545	A499-Q507 PolarHBondContact O-NE2 2.94Å; P504-Q507 VanDerWaalsContact C-OE1 3.29Å; P504-Q507 VanDerWaalsContact CA-OE1 3.27Å; Q507-K509 VanDerWaalsContact C-N 3.28Å; Q507-K509 PolarHBondContact O-N 3.14Å; Q507-H511 WeakPolarHBondContact O-CB 3.44Å; Q507-H511 PolarHBondContact O-CD2 3.4Å; Q507-H511 VanDerWaalsContact O-CD2 3.23Å; Q507-H511 PolarHBondContact O-N 3.19Å; Q507-F541 HydrophobicContact CB-CE1 4.47Å; Q507-F541 HydrophobicContact CB-CE2 4.25Å; Q507-F541 HydrophobicContact CB-CZ 3.91Å; Q507-F541 HydrophobicContact CG-CD1 4.49Å; Q507-F541 HydrophobicContact CG-CD2 4.18Å; Q507-F541 HydrophobicContact CG-CE1 4.15Å; Q507-F541 HydrophobicContact CG-CE2 3.85Å; Q507-F541 HydrophobicContact CG-CG 4.49Å; Q507-F541 HydrophobicContact CG-CZ 3.81Å; Q507-D544 VanDerWaalsContact NE2-CB 3.33Å; Q507-C545 HydrophobicContact CB-CB 4.41Å; Q507-C545 HydrophobicContact CG-CB 4.03Å
508	K	95.4	Very high	95.3	Very high	114 Å²	114	34.6 Å²	34.6	50%	0.496	19%	0.187	S	C	.	.	H	α-helix	trans	-60.2	-29.2	175.7	-75.1	165.2	-171.9	173.5	0	114.7	P504 T505 F506 L549	P504-K508 WeakPolarHBondContact O-CB 3.27Å; P504-K508 VanDerWaalsContact O-CD 3.32Å; P504-K508 WeakPolarHBondContact O-CD 3.48Å; P504-K508 WeakPolarHBondContact O-CG 3.47Å; P504-K508 PolarHBondContact O-N 3.1Å; P504-K508 VanDerWaalsContact O-N 3.15Å; T505-K508 PolarHBondContact O-N 3.26Å; F506-K508 VanDerWaalsContact C-N 3.32Å; F506-K508 PolarHBondContact O-N 3.12Å; K508-L549 HydrophobicContact CB-CD1 4.28Å; K508-L549 HydrophobicContact CG-CD1 3.71Å
509	K	95.9	Very high	95	Very high	106 Å²	106	35.1 Å²	35.1	46%	0.461	19%	0.19	S	C	.	.	H	α-helix	trans	-103.5	-29.5	-172.4	-73.3	174.4	-179	163.8	0	114.6	T505 F506 Q507	T505-K509 HydrophobicContact CG2-CD 3.8Å; T505-K509 WeakPolarHBondContact O-CB 3.49Å; T505-K509 WeakPolarHBondContact O-CG 3.3Å; T505-K509 PolarHBondContact O-N 3.01Å; T505-K509 VanDerWaalsContact O-N 3.16Å; F506-K509 PolarHBondContact O-N 2.9Å; F506-K509 VanDerWaalsContact O-N 3.08Å; Q507-K509 VanDerWaalsContact C-N 3.28Å; Q507-K509 PolarHBondContact O-N 3.14Å
510	F	96.8	Very high	94.7	Very high	8 Å²	8	41.2 Å²	41.2	4%	0.035	22%	0.218	C	C	.	.	H	α-helix	trans	-129.3	6.6	-164.5	-49.3	-62.5	0	0	0	115.3	L469 Q470 V473 F506 D512 K513 V514	L469-F510 HydrophobicContact CD2-CE2 3.74Å; L469-F510 HydrophobicContact CD2-CZ 4.4Å; L469-F510 HydrophobicContact CG-CE2 3.75Å; L469-F510 HydrophobicContact CG-CZ 4.13Å; Q470-F510 HydrophobicContact CB-CE1 4.04Å; Q470-F510 HydrophobicContact CB-CZ 4.14Å; Q470-F510 HydrophobicContact CG-CE1 4.22Å; V473-F510 HydrophobicContact CG1-CB 4.26Å; V473-F510 HydrophobicContact CG1-CD1 4.21Å; V473-F510 HydrophobicContact CG1-CD2 4.45Å; V473-F510 HydrophobicContact CG1-CG 4.05Å; V473-F510 HydrophobicContact CG2-CD2 4.08Å; V473-F510 HydrophobicContact CG2-CE2 4.1Å; V473-F510 HydrophobicContact CG2-CG 4.47Å; V473-F510 HydrophobicContact CG2-CZ 4.49Å; F506-F510 AromaticContact CD2-CD2 3.84Å; F506-F510 HydrophobicContact CD2-CD2 3.84Å; F506-F510 HydrophobicContact CD2-CE2 4.29Å; F506-F510 HydrophobicContact CE2-CD2 4.19Å; F506-F510 HydrophobicContact CG-CD2 4.17Å; F506-F510 WeakPolarHBondContact O-CD2 3.14Å; F506-F510 PolarHBondContact O-N 3.46Å; F510-D512 PolarHBondContact O-N 2.99Å; F510-D512 VanDerWaalsContact O-N 3.12Å; F510-K513 PolarHBondContact O-N 3.01Å; F510-K513 VanDerWaalsContact O-N 3.15Å; F510-V514 HydrophobicContact CB-CG2 3.86Å; F510-V514 WeakPolarHBondContact O-CB 3.45Å; F510-V514 WeakPolarHBondContact O-CG2 3.38Å; F510-V514 PolarHBondContact O-N 3.12Å
511	H	95.1	Very high	94.5	Very high	43 Å²	43	39 Å²	39	20%	0.199	21%	0.205	C	C	.	.	H	α-helix	trans	-49.4	-39.3	-178	59.3	78.1	0	0	0	114.2	Q507 I515 F541 Y553	Q507-H511 WeakPolarHBondContact O-CB 3.44Å; Q507-H511 PolarHBondContact O-CD2 3.4Å; Q507-H511 VanDerWaalsContact O-CD2 3.23Å; Q507-H511 PolarHBondContact O-N 3.19Å; H511-I515 HydrophobicContact CB-CD1 4.32Å; H511-I515 VanDerWaalsContact O-CB 3.26Å; H511-I515 WeakPolarHBondContact O-CB 3.35Å; H511-I515 WeakPolarHBondContact O-CD1 3.32Å; H511-I515 VanDerWaalsContact O-CG1 3.27Å; H511-I515 WeakPolarHBondContact O-CG1 3.3Å; H511-I515 PolarHBondContact O-N 2.91Å; H511-F541 HydrophobicContact CB-CE1 4.38Å; H511-F541 HydrophobicContact CB-CZ 3.81Å; H511-Y553 AromaticContact CE1-CE2 3.78Å; H511-Y553 AromaticContact CE1-CZ 3.9Å; H511-Y553 PolarHBondContact CE1-OH 3.23Å; H511-Y553 AromaticContact ND1-CE2 3.18Å; H511-Y553 WeakPolarHBondContact ND1-CE2 3.22Å; H511-Y553 AromaticContact ND1-CZ 3.31Å; H511-Y553 VanDerWaalsContact ND1-CZ 3.31Å; H511-Y553 PolarHBondContact ND1-OH 3.37Å
512	D	93.3	Very high	94.3	Very high	72 Å²	72	37.9 Å²	37.9	39%	0.385	20%	0.199	S	C	.	.	H	α-helix	trans	-64.8	-44	-177.5	68.9	-40.3	0	0	0	112.4	F510 S516 Y553	F510-D512 PolarHBondContact O-N 2.99Å; F510-D512 VanDerWaalsContact O-N 3.12Å; D512-S516 WeakPolarHBondContact O-CB 3.43Å; D512-S516 PolarHBondContact O-OG 3.27Å; D512-Y553 WeakPolarHBondContact CB-OH 3.49Å
513	K	95.1	Very high	93.7	Very high	86 Å²	86	43.1 Å²	43.1	37%	0.374	22%	0.223	S	C	.	.	H	α-helix	trans	-80.2	-45	-179.2	-65.4	178	-174.7	175.4	0	112.3	L477 F510 S516 A517	L477-K513 HydrophobicContact CD1-CB 3.84Å; L477-K513 HydrophobicContact CD1-CD 4.35Å; F510-K513 PolarHBondContact O-N 3.01Å; F510-K513 VanDerWaalsContact O-N 3.15Å; K513-S516 PolarHBondContact O-N 3.16Å; K513-A517 WeakPolarHBondContact O-CB 3.47Å; K513-A517 PolarHBondContact O-N 3.25Å
514	V	96.2	Very high	93.2	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-66.3	-50.6	-174.1	171.8	0	0	0	0	110.6	V473 I495 F506 F510 S516 A517 L518 F541	V473-V514 HydrophobicContact CG1-CG2 4.36Å; I495-V514 HydrophobicContact CG2-CG1 3.65Å; F506-V514 HydrophobicContact CE1-CG1 4.19Å; F506-V514 HydrophobicContact CE1-CG2 3.82Å; F506-V514 HydrophobicContact CZ-CG2 3.89Å; F510-V514 HydrophobicContact CB-CG2 3.86Å; F510-V514 WeakPolarHBondContact O-CB 3.45Å; F510-V514 WeakPolarHBondContact O-CG2 3.38Å; F510-V514 PolarHBondContact O-N 3.12Å; V514-S516 VanDerWaalsContact C-N 3.29Å; V514-S516 PolarHBondContact O-N 2.99Å; V514-A517 PolarHBondContact O-N 3.2Å; V514-L518 HydrophobicContact CG1-CD1 3.83Å; V514-L518 HydrophobicContact CG1-CG 4.27Å; V514-L518 WeakPolarHBondContact O-CB 3.4Å; V514-L518 WeakPolarHBondContact O-CG 3.36Å; V514-L518 PolarHBondContact O-N 3.48Å; V514-F541 HydrophobicContact CB-CD2 4.36Å; V514-F541 HydrophobicContact CB-CE2 4.09Å; V514-F541 HydrophobicContact CG1-CD2 3.65Å; V514-F541 HydrophobicContact CG1-CE2 3.89Å; V514-F541 HydrophobicContact CG1-CG 4.34Å
515	I	93.8	Very high	92.5	Very high	5 Å²	5	47 Å²	47	3%	0.026	23%	0.232	C	C	.	.	H	α-helix	trans	-58	-44.6	177.3	-66.9	169.6	0	0	0	110.4	H511 A517 L519 F541 Y553 L557	H511-I515 HydrophobicContact CB-CD1 4.32Å; H511-I515 VanDerWaalsContact O-CB 3.26Å; H511-I515 WeakPolarHBondContact O-CB 3.35Å; H511-I515 WeakPolarHBondContact O-CD1 3.32Å; H511-I515 VanDerWaalsContact O-CG1 3.27Å; H511-I515 WeakPolarHBondContact O-CG1 3.3Å; H511-I515 PolarHBondContact O-N 2.91Å; I515-A517 PolarHBondContact O-N 3.03Å; I515-L519 HydrophobicContact CG2-CD1 3.84Å; I515-L519 HydrophobicContact CG2-CG 4.25Å; I515-L519 WeakPolarHBondContact O-CB 3.35Å; I515-L519 VanDerWaalsContact O-CG 3.27Å; I515-L519 WeakPolarHBondContact O-CG 3.43Å; I515-L519 PolarHBondContact O-N 3.2Å; I515-F541 HydrophobicContact CD1-CE1 3.93Å; I515-F541 HydrophobicContact CG1-CD1 4.25Å; I515-F541 HydrophobicContact CG1-CE1 3.94Å; I515-F541 HydrophobicContact CG1-CZ 4.48Å; I515-Y553 HydrophobicContact CD1-CD1 4.24Å; I515-Y553 HydrophobicContact CD1-CD2 4.13Å; I515-Y553 HydrophobicContact CD1-CG 3.87Å; I515-L557 HydrophobicContact CD1-CD1 4.46Å; I515-L557 HydrophobicContact CG2-CD2 3.69Å; I515-L557 HydrophobicContact CG2-CG 4.12Å
516	S	92.6	Very high	92.1	Very high	70 Å²	70	48.9 Å²	48.9	49%	0.49	25%	0.247	S	C	.	.	H	α-helix	trans	-62.1	-43.1	179.8	-59.9	0	0	0	0	112.6	D512 K513 V514 Q520	D512-S516 WeakPolarHBondContact O-CB 3.43Å; D512-S516 PolarHBondContact O-OG 3.27Å; K513-S516 PolarHBondContact O-N 3.16Å; V514-S516 VanDerWaalsContact C-N 3.29Å; V514-S516 PolarHBondContact O-N 2.99Å; S516-Q520 WeakPolarHBondContact O-CB 3.27Å; S516-Q520 PolarHBondContact O-N 3.18Å
517	A	94.8	Very high	91.8	Very high	16 Å²	16	49.8 Å²	49.8	13%	0.132	25%	0.252	C	S	.	.	H	α-helix	trans	-72.7	-40.4	-179.2	0	0	0	0	0	112.8	L477 K513 V514 I515 Q520 T521	L477-A517 HydrophobicContact CD2-CB 3.48Å; L477-A517 VanDerWaalsContact CD2-CB 3.48Å; K513-A517 WeakPolarHBondContact O-CB 3.47Å; K513-A517 PolarHBondContact O-N 3.25Å; V514-A517 PolarHBondContact O-N 3.2Å; I515-A517 PolarHBondContact O-N 3.03Å; A517-Q520 PolarHBondContact O-N 3.44Å; A517-T521 WeakPolarHBondContact O-CB 3.33Å; A517-T521 PolarHBondContact O-N 2.97Å; A517-T521 PolarHBondContact O-OG1 3.05Å
518	L	94.8	Very high	91.5	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64.5	-47.6	175.7	-69.5	179	0	0	0	110.8	I495 V514 Q520 T521 M522 A534 A537 L538	I495-L518 HydrophobicContact CD1-CD2 4.31Å; I495-L518 HydrophobicContact CG2-CD1 3.96Å; I495-L518 HydrophobicContact CG2-CD2 3.99Å; I495-L518 HydrophobicContact CG2-CG 4.16Å; V514-L518 HydrophobicContact CG1-CD1 3.83Å; V514-L518 HydrophobicContact CG1-CG 4.27Å; V514-L518 WeakPolarHBondContact O-CB 3.4Å; V514-L518 WeakPolarHBondContact O-CG 3.36Å; V514-L518 PolarHBondContact O-N 3.48Å; L518-Q520 VanDerWaalsContact C-N 3.35Å; L518-Q520 PolarHBondContact O-N 3.22Å; L518-T521 PolarHBondContact O-N 3.07Å; L518-M522 VanDerWaalsContact O-CG 3.3Å; L518-M522 WeakPolarHBondContact O-CG 3.43Å; L518-M522 PolarHBondContact O-N 3.46Å; L518-A534 HydrophobicContact CD2-CB 4.43Å; L518-A537 HydrophobicContact CD1-CB 4.21Å; L518-A537 HydrophobicContact CD2-CB 3.86Å; L518-L538 HydrophobicContact CD1-CB 4.13Å; L518-L538 HydrophobicContact CD1-CD1 4.37Å
519	L	90.2	Very high	91.3	Very high	11 Å²	11	46.4 Å²	46.4	6%	0.058	24%	0.239	C	C	.	.	H	α-helix	trans	-57.5	-45.5	175.3	-73.8	-179.8	0	0	0	112.1	I515 T521 M522 E523 L538 L557 H560	I515-L519 HydrophobicContact CG2-CD1 3.84Å; I515-L519 HydrophobicContact CG2-CG 4.25Å; I515-L519 WeakPolarHBondContact O-CB 3.35Å; I515-L519 VanDerWaalsContact O-CG 3.27Å; I515-L519 WeakPolarHBondContact O-CG 3.43Å; I515-L519 PolarHBondContact O-N 3.2Å; L519-T521 VanDerWaalsContact C-N 3.3Å; L519-T521 PolarHBondContact O-N 3.25Å; L519-M522 HydrophobicContact CD2-SD 4.44Å; L519-M522 PolarHBondContact O-N 3.27Å; L519-E523 PolarHBondContact O-N 2.95Å; L519-L538 HydrophobicContact CD2-CD2 4.47Å; L519-L557 HydrophobicContact CD1-CD2 4.2Å; L519-L557 HydrophobicContact CD2-CD2 4.25Å; L519-L557 HydrophobicContact CG-CD2 4.39Å; L519-H560 HydrophobicContact CD2-CB 3.81Å
520	Q	90.8	Very high	91.2	Very high	127 Å²	127	41.4 Å²	41.4	59%	0.593	22%	0.217	S	C	*	.	H	α-helix	trans	-61.9	-37.6	175.4	-174.4	-175.9	-9.5	0	0	112.2	S516 A517 L518 E523	S516-Q520 WeakPolarHBondContact O-CB 3.27Å; S516-Q520 PolarHBondContact O-N 3.18Å; A517-Q520 PolarHBondContact O-N 3.44Å; L518-Q520 VanDerWaalsContact C-N 3.35Å; L518-Q520 PolarHBondContact O-N 3.22Å; Q520-E523 WeakPolarHBondContact O-CB 3.33Å; Q520-E523 PolarHBondContact O-N 2.85Å
521	T	92.5	Very high	91	Very high	10 Å²	10	41.2 Å²	41.2	6%	0.061	22%	0.216	C	C	.	.	H	α-helix	trans	-70.4	-34.7	179	-54.1	0	0	0	0	111.4	A517 L518 L519 E523 D524 V530 A534	A517-T521 WeakPolarHBondContact O-CB 3.33Å; A517-T521 PolarHBondContact O-N 2.97Å; A517-T521 PolarHBondContact O-OG1 3.05Å; L518-T521 PolarHBondContact O-N 3.07Å; L519-T521 VanDerWaalsContact C-N 3.3Å; L519-T521 PolarHBondContact O-N 3.25Å; T521-E523 PolarHBondContact O-N 3.47Å; T521-D524 PolarHBondContact O-N 3.13Å; T521-V530 HydrophobicContact CG2-CG1 3.61Å; T521-A534 HydrophobicContact CG2-CB 3.84Å
522	M	89.1	Confident	90.9	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-65.9	-13.6	171.8	-66.3	171.4	66.1	0	0	113.4	L518 L519 D524 Q531 A534 A535 L538 L561 I564 V584	L518-M522 VanDerWaalsContact O-CG 3.3Å; L518-M522 WeakPolarHBondContact O-CG 3.43Å; L518-M522 PolarHBondContact O-N 3.46Å; L519-M522 HydrophobicContact CD2-SD 4.44Å; L519-M522 PolarHBondContact O-N 3.27Å; M522-D524 VanDerWaalsContact C-N 3.35Å; M522-Q531 PolarHBondContact O-NE2 3.42Å; M522-A534 HydrophobicContact CG-CB 3.63Å; M522-A535 HydrophobicContact CE-CB 3.72Å; M522-A535 HydrophobicContact SD-CB 4.15Å; M522-L538 HydrophobicContact SD-CD2 4.02Å; M522-L561 HydrophobicContact CE-CD2 3.67Å; M522-I564 HydrophobicContact CB-CD1 3.86Å; M522-I564 HydrophobicContact CE-CD1 3.92Å; M522-V584 HydrophobicContact CE-CG2 4.08Å
523	E	84.8	Confident	90.9	Very high	114 Å²	114	37.4 Å²	37.4	53%	0.533	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-11	173.4	-63.8	-175.3	160.1	0	0	113.8	L519 Q520 T521 Q525 H560	L519-E523 PolarHBondContact O-N 2.95Å; Q520-E523 WeakPolarHBondContact O-CB 3.33Å; Q520-E523 PolarHBondContact O-N 2.85Å; T521-E523 PolarHBondContact O-N 3.47Å; E523-Q525 VanDerWaalsContact C-N 3.34Å; E523-Q525 PolarHBondContact O-N 2.87Å; E523-H560 IonicContact OE1-CD2 3.74Å
524	D	83.9	Confident	91	Very high	30 Å²	30	33.3 Å²	33.3	16%	0.16	18%	0.18	C	C	.	.			trans	-75.1	79.9	-177.4	-177.1	13	0	0	0	113.7	R488 T521 M522 S526 N527 Q531	R488-D524 IonicContact CZ-OD2 3.22Å; R488-D524 IonicContact NH1-OD2 2.91Å; R488-D524 PolarHBondContact NH1-OD2 3.19Å; R488-D524 IonicContact NH2-OD2 2.68Å; R488-D524 PolarHBondContact NH2-OD2 3.34Å; T521-D524 PolarHBondContact O-N 3.13Å; M522-D524 VanDerWaalsContact C-N 3.35Å; D524-S526 PolarHBondContact O-N 2.75Å; D524-S526 WeakPolarHBondContact OD1-CB 3.03Å; D524-S526 PolarHBondContact OD1-N 3.3Å; D524-S526 PolarHBondContact OD1-OG 3.14Å; D524-N527 PolarHBondContact O-N 2.95Å; D524-N527 VanDerWaalsContact O-N 3.16Å; D524-N527 PolarHBondContact OD2-ND2 3.46Å; D524-Q531 VanDerWaalsContact C-NE2 3.27Å; D524-Q531 WeakPolarHBondContact O-CG 3.14Å; D524-Q531 PolarHBondContact O-NE2 3.02Å
525	Q	79.3	Confident	90.9	Very high	137 Å²	137	33.3 Å²	33.3	64%	0.64	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-9.9	177.8	-63.4	-178.1	2.6	0	0	114.6	E523	E523-Q525 VanDerWaalsContact C-N 3.34Å; E523-Q525 PolarHBondContact O-N 2.87Å
526	S	85.9	Confident	90.9	Very high	76 Å²	76	34 Å²	34	53%	0.531	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-11.3	178.5	69.3	0	0	0	0	114.2	D524	D524-S526 PolarHBondContact O-N 2.75Å; D524-S526 WeakPolarHBondContact OD1-CB 3.03Å; D524-S526 PolarHBondContact OD1-N 3.3Å; D524-S526 PolarHBondContact OD1-OG 3.14Å
527	N	91.1	Very high	91.1	Very high	19 Å²	19	30.8 Å²	30.8	10%	0.102	16%	0.164	C	C	.	.			trans	-136.4	79.6	-178.9	-60.3	-87.2	0	0	0	111.5	P485 R488 D524 R529 V530 Q531	P485-N527 WeakPolarHBondContact CB-OD1 3.25Å; R488-N527 PolarHBondContact NH2-ND2 3.11Å; D524-N527 PolarHBondContact O-N 2.95Å; D524-N527 VanDerWaalsContact O-N 3.16Å; D524-N527 PolarHBondContact OD2-ND2 3.46Å; N527-R529 VanDerWaalsContact C-N 3.35Å; N527-R529 PolarHBondContact O-N 3.3Å; N527-V530 HydrophobicContact CB-CB 4Å; N527-V530 HydrophobicContact CB-CG2 3.86Å; N527-V530 WeakPolarHBondContact O-CB 3.29Å; N527-V530 PolarHBondContact O-N 2.9Å; N527-Q531 PolarHBondContact O-N 3.26Å; N527-Q531 VanDerWaalsContact O-N 3.16Å
528	P	90.8	Very high	91.2	Very high	25 Å²	25	30 Å²	30	16%	0.162	16%	0.158	C	C	.	.	H	α-helix	trans	-47.3	-45.3	-178.9	-32	36	0	0	0	115.6	A394 M395 V530 Q531 A532 V580	A394-P528 WeakPolarHBondContact O-CD 3.39Å; M395-P528 HydrophobicContact SD-CG 4.28Å; P528-V530 VanDerWaalsContact C-N 3.27Å; P528-V530 PolarHBondContact O-N 3.3Å; P528-Q531 PolarHBondContact O-N 3.45Å; P528-Q531 VanDerWaalsContact O-N 3.17Å; P528-A532 WeakPolarHBondContact O-CB 3.25Å; P528-A532 PolarHBondContact O-N 2.9Å; P528-V580 HydrophobicContact CB-CG2 3.93Å; P528-V580 WeakPolarHBondContact O-CG2 3.29Å
529	R	91.4	Very high	91.2	Very high	18 Å²	18	30.7 Å²	30.7	7%	0.068	16%	0.161	C	C	.	.	H	α-helix	trans	-60.1	-36	177.8	-71.6	-173.3	79.3	157.7	-1	112.9	W393 N527 H533 L579	W393-R529 VanDerWaalsContact CD1-NH1 3.32Å; W393-R529 HydrophobicContact CH2-CB 3.94Å; W393-R529 HydrophobicContact CZ3-CB 4.07Å; W393-R529 VanDerWaalsContact NE1-NH1 3.15Å; W393-R529 WeakPolarHBondContact O-CD 3.38Å; N527-R529 VanDerWaalsContact C-N 3.35Å; N527-R529 PolarHBondContact O-N 3.3Å; R529-H533 WeakPolarHBondContact O-CB 3.47Å; R529-H533 PolarHBondContact O-N 3.07Å; R529-L579 HydrophobicContact CG-CD2 3.83Å
530	V	93.6	Very high	91.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-70.7	-40.4	177.3	-179.1	0	0	0	0	110.8	P485 R488 T521 N527 P528 A534	P485-V530 HydrophobicContact CB-CG2 4.12Å; P485-V530 WeakPolarHBondContact O-CG2 3.43Å; R488-V530 HydrophobicContact CB-CG1 3.86Å; R488-V530 HydrophobicContact CB-CG2 4.33Å; T521-V530 HydrophobicContact CG2-CG1 3.61Å; N527-V530 HydrophobicContact CB-CB 4Å; N527-V530 HydrophobicContact CB-CG2 3.86Å; N527-V530 WeakPolarHBondContact O-CB 3.29Å; N527-V530 PolarHBondContact O-N 2.9Å; P528-V530 VanDerWaalsContact C-N 3.27Å; P528-V530 PolarHBondContact O-N 3.3Å; V530-A534 WeakPolarHBondContact O-CB 3.46Å; V530-A534 PolarHBondContact O-N 2.96Å
531	Q	93.2	Very high	91.8	Very high	4 Å²	4	26.4 Å²	26.4	2%	0.019	14%	0.142	C	C	.	.	H	α-helix	trans	-62.4	-47	174	-59.5	-169.4	-61.5	0	0	111.9	M522 D524 N527 P528 H533 A534 A535 V580	M522-Q531 PolarHBondContact O-NE2 3.42Å; D524-Q531 VanDerWaalsContact C-NE2 3.27Å; D524-Q531 WeakPolarHBondContact O-CG 3.14Å; D524-Q531 PolarHBondContact O-NE2 3.02Å; N527-Q531 PolarHBondContact O-N 3.26Å; N527-Q531 VanDerWaalsContact O-N 3.16Å; P528-Q531 PolarHBondContact O-N 3.45Å; P528-Q531 VanDerWaalsContact O-N 3.17Å; Q531-H533 VanDerWaalsContact C-N 3.34Å; Q531-H533 PolarHBondContact O-N 3.07Å; Q531-A534 PolarHBondContact O-N 3.42Å; Q531-A535 PolarHBondContact O-N 3.46Å; Q531-V580 HydrophobicContact CB-CG1 3.83Å; Q531-V580 HydrophobicContact CB-CG2 4.05Å
532	A	92.1	Very high	92	Very high	6 Å²	6	26 Å²	26	5%	0.05	14%	0.139	C	C	.	.	H	α-helix	trans	-61.7	-43.1	-178.8	0	0	0	0	0	111.4	P528 A535 A536 L579 V580 Q583	P528-A532 WeakPolarHBondContact O-CB 3.25Å; P528-A532 PolarHBondContact O-N 2.9Å; A532-A535 WeakPolarHBondContact O-CB 3.44Å; A532-A535 PolarHBondContact O-N 2.67Å; A532-A536 PolarHBondContact O-N 3.03Å; A532-L579 HydrophobicContact CB-CD2 4.18Å; A532-L579 HydrophobicContact CB-CG 3.84Å; A532-V580 HydrophobicContact CB-CG2 4.25Å; A532-Q583 HydrophobicContact CB-CG 4.08Å; A532-Q583 WeakPolarHBondContact O-CB 3.39Å
533	H	94.4	Very high	92.1	Very high	30 Å²	30	31.5 Å²	31.5	14%	0.139	17%	0.165	C	C	.	.	H	α-helix	trans	-79.1	-25.4	-178.5	-161.8	61.2	0	0	0	113.3	Y489 N493 R529 Q531 A535 A536 A537	Y489-H533 AromaticContact CD1-CD2 3.84Å; Y489-H533 HydrophobicContact CD2-CB 3.5Å; Y489-H533 AromaticContact CD2-CD2 3.62Å; Y489-H533 AromaticContact CD2-CG 3.66Å; Y489-H533 AromaticContact CE1-CD2 3.78Å; Y489-H533 AromaticContact CE1-NE2 3.71Å; Y489-H533 HydrophobicContact CE2-CB 3.42Å; Y489-H533 VanDerWaalsContact CE2-CB 3.42Å; Y489-H533 AromaticContact CE2-CD2 3.59Å; Y489-H533 AromaticContact CE2-CG 3.35Å; Y489-H533 AromaticContact CE2-ND1 3.81Å; Y489-H533 HydrophobicContact CG-CB 4.41Å; Y489-H533 AromaticContact CG-CD2 3.74Å; Y489-H533 AromaticContact CZ-CD2 3.65Å; Y489-H533 AromaticContact CZ-CE1 3.81Å; Y489-H533 AromaticContact CZ-CG 3.67Å; Y489-H533 AromaticContact CZ-ND1 3.75Å; Y489-H533 AromaticContact CZ-NE2 3.76Å; Y489-H533 PolarHBondContact O-CD2 3.4Å; N493-H533 VanDerWaalsContact CA-NE2 3.26Å; N493-H533 WeakPolarHBondContact CA-NE2 3.4Å; N493-H533 VanDerWaalsContact CB-NE2 3.26Å; N493-H533 WeakPolarHBondContact CB-NE2 3.43Å; N493-H533 PolarHBondContact N-NE2 3.2Å; R529-H533 WeakPolarHBondContact O-CB 3.47Å; R529-H533 PolarHBondContact O-N 3.07Å; Q531-H533 VanDerWaalsContact C-N 3.34Å; Q531-H533 PolarHBondContact O-N 3.07Å; H533-A535 VanDerWaalsContact C-N 3.33Å; H533-A536 PolarHBondContact O-N 3.17Å; H533-A537 PolarHBondContact O-N 3.06Å
534	A	95.7	Very high	92.4	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-65.8	-35.3	165.5	0	0	0	0	0	112.3	L518 T521 M522 V530 Q531 L538	L518-A534 HydrophobicContact CD2-CB 4.43Å; T521-A534 HydrophobicContact CG2-CB 3.84Å; M522-A534 HydrophobicContact CG-CB 3.63Å; V530-A534 WeakPolarHBondContact O-CB 3.46Å; V530-A534 PolarHBondContact O-N 2.96Å; Q531-A534 PolarHBondContact O-N 3.42Å; A534-L538 PolarHBondContact O-N 3.4Å; A534-L538 VanDerWaalsContact O-N 3.16Å
535	A	94.3	Very high	92.9	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-70	-36.7	171.8	0	0	0	0	0	112.1	M522 Q531 A532 H533 L538 I539 Q583 V584	M522-A535 HydrophobicContact CE-CB 3.72Å; M522-A535 HydrophobicContact SD-CB 4.15Å; Q531-A535 PolarHBondContact O-N 3.46Å; A532-A535 WeakPolarHBondContact O-CB 3.44Å; A532-A535 PolarHBondContact O-N 2.67Å; H533-A535 VanDerWaalsContact C-N 3.33Å; A535-L538 WeakPolarHBondContact O-CB 3.2Å; A535-L538 PolarHBondContact O-N 3.3Å; A535-I539 PolarHBondContact O-N 3.11Å; A535-Q583 HydrophobicContact CB-CB 3.8Å; A535-V584 HydrophobicContact CB-CG2 4.37Å
536	A	94.1	Very high	93.6	Very high	19 Å²	19	23.5 Å²	23.5	16%	0.157	13%	0.133	C	C	.	.	H	α-helix	trans	-60.7	-51.1	172	0	0	0	0	0	111.7	A532 H533 L538 I539 N540	A532-A536 PolarHBondContact O-N 3.03Å; H533-A536 PolarHBondContact O-N 3.17Å; A536-L538 PolarHBondContact O-N 3.46Å; A536-L538 VanDerWaalsContact O-N 3.12Å; A536-I539 WeakPolarHBondContact O-CA 3.35Å; A536-I539 VanDerWaalsContact O-CB 3.32Å; A536-I539 WeakPolarHBondContact O-CB 3.45Å; A536-I539 PolarHBondContact O-N 2.87Å; A536-N540 PolarHBondContact O-N 2.93Å; A536-N540 PolarHBondContact O-OD1 3.26Å
537	A	96.4	Very high	93.9	Very high	3 Å²	3	22.2 Å²	22.2	3%	0.025	12%	0.118	C	C	.	.	H	α-helix	trans	-59.4	-26.5	175.5	0	0	0	0	0	113.7	C492 L518 H533 F541	C492-A537 HydrophobicContact CB-CB 4.37Å; C492-A537 VanDerWaalsContact O-CB 3.29Å; C492-A537 WeakPolarHBondContact O-CB 3.42Å; L518-A537 HydrophobicContact CD1-CB 4.21Å; L518-A537 HydrophobicContact CD2-CB 3.86Å; H533-A537 PolarHBondContact O-N 3.06Å; A537-F541 WeakPolarHBondContact O-CB 3.48Å; A537-F541 PolarHBondContact O-N 3.43Å
538	L	96.4	Very high	94	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-73.4	-31.2	173.5	-176.5	59.5	0	0	0	112.2	L518 L519 M522 A534 A535 A536 F541 T542 L557 L561 S587	L518-L538 HydrophobicContact CD1-CB 4.13Å; L518-L538 HydrophobicContact CD1-CD1 4.37Å; L519-L538 HydrophobicContact CD2-CD2 4.47Å; M522-L538 HydrophobicContact SD-CD2 4.02Å; A534-L538 PolarHBondContact O-N 3.4Å; A534-L538 VanDerWaalsContact O-N 3.16Å; A535-L538 WeakPolarHBondContact O-CB 3.2Å; A535-L538 PolarHBondContact O-N 3.3Å; A536-L538 PolarHBondContact O-N 3.46Å; A536-L538 VanDerWaalsContact O-N 3.12Å; L538-F541 PolarHBondContact O-N 3.26Å; L538-T542 HydrophobicContact CD1-CG2 4.08Å; L538-T542 WeakPolarHBondContact O-CG2 3.34Å; L538-T542 PolarHBondContact O-N 2.88Å; L538-T542 PolarHBondContact O-OG1 3.09Å; L538-L557 HydrophobicContact CD1-CD2 4.13Å; L538-L557 HydrophobicContact CD2-CD2 4.12Å; L538-L561 HydrophobicContact CD2-CD2 4.43Å; L538-S587 WeakPolarHBondContact CD2-OG 3.47Å
539	I	95.9	Very high	94.1	Very high	14 Å²	14	26.6 Å²	26.6	7%	0.072	15%	0.147	C	C	.	.	H	α-helix	trans	-62.9	-57.2	174	-65.6	160.8	0	0	0	109.8	A535 A536 F541 T542 E543 T586	A535-I539 PolarHBondContact O-N 3.11Å; A536-I539 WeakPolarHBondContact O-CA 3.35Å; A536-I539 VanDerWaalsContact O-CB 3.32Å; A536-I539 WeakPolarHBondContact O-CB 3.45Å; A536-I539 PolarHBondContact O-N 2.87Å; I539-F541 PolarHBondContact O-N 3.05Å; I539-F541 VanDerWaalsContact O-N 3.14Å; I539-T542 PolarHBondContact O-N 2.93Å; I539-T542 PolarHBondContact O-OG1 3.09Å; I539-E543 HydrophobicContact CG2-CG 4.12Å; I539-E543 VanDerWaalsContact CG2-OE1 3.31Å; I539-E543 WeakPolarHBondContact CG2-OE1 3.5Å; I539-E543 WeakPolarHBondContact O-CG 3.35Å; I539-E543 PolarHBondContact O-N 3.12Å; I539-T586 HydrophobicContact CD1-CG2 3.61Å; I539-T586 HydrophobicContact CG1-CG2 4.35Å
540	N	95.9	Very high	94.2	Very high	48 Å²	48	25.8 Å²	25.8	26%	0.257	14%	0.144	S	C	.	.	H	α-helix	trans	-51.8	-39.4	175.1	-65.3	60	0	0	0	111.8	G496 A499 T500 A536	G496-N540 WeakPolarHBondContact O-CB 3.47Å; A499-N540 HydrophobicContact CB-CB 4.41Å; T500-N540 PolarHBondContact OG1-ND2 3.28Å; T500-N540 VanDerWaalsContact OG1-ND2 3.11Å; A536-N540 PolarHBondContact O-N 2.93Å; A536-N540 PolarHBondContact O-OD1 3.26Å
541	F	97.2	Very high	94.2	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-64.2	-41.9	176.1	-170.7	-84.6	0	0	0	113	A499 F506 Q507 H511 V514 I515 A537 L538 I539 C545	A499-F541 HydrophobicContact CB-CB 4.21Å; A499-F541 HydrophobicContact CB-CD2 4.13Å; F506-F541 AromaticContact CD1-CD2 3.92Å; F506-F541 HydrophobicContact CD1-CD2 3.92Å; F506-F541 AromaticContact CD1-CE2 3.76Å; F506-F541 HydrophobicContact CD1-CE2 3.76Å; F506-F541 AromaticContact CE1-CD2 3.84Å; F506-F541 HydrophobicContact CE1-CD2 3.84Å; F506-F541 AromaticContact CE1-CE2 3.9Å; F506-F541 HydrophobicContact CE1-CE2 3.9Å; Q507-F541 HydrophobicContact CB-CE1 4.47Å; Q507-F541 HydrophobicContact CB-CE2 4.25Å; Q507-F541 HydrophobicContact CB-CZ 3.91Å; Q507-F541 HydrophobicContact CG-CD1 4.49Å; Q507-F541 HydrophobicContact CG-CD2 4.18Å; Q507-F541 HydrophobicContact CG-CE1 4.15Å; Q507-F541 HydrophobicContact CG-CE2 3.85Å; Q507-F541 HydrophobicContact CG-CG 4.49Å; Q507-F541 HydrophobicContact CG-CZ 3.81Å; H511-F541 HydrophobicContact CB-CE1 4.38Å; H511-F541 HydrophobicContact CB-CZ 3.81Å; V514-F541 HydrophobicContact CB-CD2 4.36Å; V514-F541 HydrophobicContact CB-CE2 4.09Å; V514-F541 HydrophobicContact CG1-CD2 3.65Å; V514-F541 HydrophobicContact CG1-CE2 3.89Å; V514-F541 HydrophobicContact CG1-CG 4.34Å; I515-F541 HydrophobicContact CD1-CE1 3.93Å; I515-F541 HydrophobicContact CG1-CD1 4.25Å; I515-F541 HydrophobicContact CG1-CE1 3.94Å; I515-F541 HydrophobicContact CG1-CZ 4.48Å; A537-F541 WeakPolarHBondContact O-CB 3.48Å; A537-F541 PolarHBondContact O-N 3.43Å; L538-F541 PolarHBondContact O-N 3.26Å; I539-F541 PolarHBondContact O-N 3.05Å; I539-F541 VanDerWaalsContact O-N 3.14Å; F541-C545 HydrophobicContact CE1-CB 4.47Å; F541-C545 VanDerWaalsContact O-CB 3.24Å; F541-C545 WeakPolarHBondContact O-CB 3.44Å; F541-C545 PolarHBondContact O-N 3.17Å
542	T	95.8	Very high	94.2	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-87	-23.8	-172.5	52.2	0	0	0	0	115	L538 I539 C545 L550 S590 V591 T594	L538-T542 HydrophobicContact CD1-CG2 4.08Å; L538-T542 WeakPolarHBondContact O-CG2 3.34Å; L538-T542 PolarHBondContact O-N 2.88Å; L538-T542 PolarHBondContact O-OG1 3.09Å; I539-T542 PolarHBondContact O-N 2.93Å; I539-T542 PolarHBondContact O-OG1 3.09Å; T542-C545 PolarHBondContact O-N 2.85Å; T542-L550 HydrophobicContact CG2-CD1 3.99Å; T542-S590 PolarHBondContact OG1-OG 3.19Å; T542-V591 HydrophobicContact CG2-CG2 3.87Å; T542-T594 WeakPolarHBondContact O-CG2 3.49Å; T542-T594 PolarHBondContact O-OG1 3.41Å
543	E	91.4	Very high	94.3	Very high	119 Å²	119	36.2 Å²	36.2	56%	0.556	20%	0.199	S	C	*	.	H	α-helix	trans	-63.2	-52.2	173.5	-70.4	177.9	161.5	0	0	110.8	I539 C545 S590	I539-E543 HydrophobicContact CG2-CG 4.12Å; I539-E543 VanDerWaalsContact CG2-OE1 3.31Å; I539-E543 WeakPolarHBondContact CG2-OE1 3.5Å; I539-E543 WeakPolarHBondContact O-CG 3.35Å; I539-E543 PolarHBondContact O-N 3.12Å; E543-C545 VanDerWaalsContact C-N 3.29Å; E543-C545 PolarHBondContact O-N 2.91Å; E543-S590 VanDerWaalsContact CG-OG 3.3Å; E543-S590 WeakPolarHBondContact CG-OG 3.49Å; E543-S590 PolarHBondContact N-OG 3.18Å
544	D	91.3	Very high	94.2	Very high	70 Å²	70	34.9 Å²	34.9	37%	0.374	19%	0.193	S	C	.	.	S	Bend	trans	-84	4	178.7	-76	-53.7	0	0	0	114.5	A503 Q507 P546	A503-D544 HydrophobicContact CB-CB 3.65Å; Q507-D544 VanDerWaalsContact NE2-CB 3.33Å; D544-P546 VanDerWaalsContact O-CD 3.29Å; D544-P546 WeakPolarHBondContact O-CD 3.4Å
545	C	94.5	Very high	94.1	Very high	6 Å²	6	38.9 Å²	38.9	4%	0.041	22%	0.215	C	C	.	.	S	Bend	trans	-80	119.9	180	-179.3	0	0	0	0	111.6	Q507 F541 T542 E543 K547 T594	Q507-C545 HydrophobicContact CB-CB 4.41Å; Q507-C545 HydrophobicContact CG-CB 4.03Å; F541-C545 HydrophobicContact CE1-CB 4.47Å; F541-C545 VanDerWaalsContact O-CB 3.24Å; F541-C545 WeakPolarHBondContact O-CB 3.44Å; F541-C545 PolarHBondContact O-N 3.17Å; T542-C545 PolarHBondContact O-N 2.85Å; E543-C545 VanDerWaalsContact C-N 3.29Å; E543-C545 PolarHBondContact O-N 2.91Å; C545-K547 PolarHBondContact O-N 3.49Å; C545-K547 VanDerWaalsContact O-N 3.1Å; C545-T594 WeakPolarHBondContact O-CG2 3.48Å
546	P	93.4	Very high	93.9	Very high	37 Å²	37	41.4 Å²	41.4	24%	0.24	23%	0.233	C	C	.	.			trans	-54.4	123.7	169.7	-24.2	33.6	0	0	0	110.8	P504 D544 S548 L549 L550	P504-P546 HydrophobicContact CB-CG 4.18Å; D544-P546 VanDerWaalsContact O-CD 3.29Å; D544-P546 WeakPolarHBondContact O-CD 3.4Å; P546-S548 PolarHBondContact O-N 2.98Å; P546-L549 HydrophobicContact CB-CD1 4.35Å; P546-L549 HydrophobicContact CB-CG 4.42Å; P546-L549 HydrophobicContact CG-CD1 4.14Å; P546-L549 WeakPolarHBondContact O-CA 3.47Å; P546-L549 WeakPolarHBondContact O-CB 3.38Å; P546-L549 PolarHBondContact O-N 3.4Å; P546-L550 PolarHBondContact O-N 3.2Å
547	K	93.2	Very high	93.8	Very high	49 Å²	49	40.5 Å²	40.5	21%	0.213	23%	0.225	C	C	.	.	H	α-helix	trans	-42.7	-39.1	179.1	175.4	175.1	174.3	-168.4	0	114.3	C545 L549 L550 I551 T594 A595 E596 E597	C545-K547 PolarHBondContact O-N 3.49Å; C545-K547 VanDerWaalsContact O-N 3.1Å; K547-L549 PolarHBondContact O-N 2.6Å; K547-L550 PolarHBondContact O-N 2.85Å; K547-I551 HydrophobicContact CG-CD1 4.06Å; K547-I551 WeakPolarHBondContact O-CD1 3.5Å; K547-I551 VanDerWaalsContact O-CG1 3.26Å; K547-I551 WeakPolarHBondContact O-CG1 3.41Å; K547-I551 PolarHBondContact O-N 2.86Å; K547-T594 WeakPolarHBondContact CB-O 3.24Å; K547-T594 VanDerWaalsContact CG-O 3.25Å; K547-T594 WeakPolarHBondContact CG-O 3.34Å; K547-A595 WeakPolarHBondContact CE-O 3.34Å; K547-E596 HydrophobicContact CD-CB 4.5Å; K547-E596 HydrophobicContact CD-CG 4.36Å; K547-E596 VanDerWaalsContact CD-OE2 3.27Å; K547-E596 WeakPolarHBondContact CD-OE2 3.39Å; K547-E596 WeakPolarHBondContact CE-OE2 3.34Å; K547-E596 IonicContact NZ-OE2 2.84Å; K547-E596 PolarHBondContact NZ-OE2 3.49Å; K547-E597 VanDerWaalsContact NZ-CD 3.34Å; K547-E597 IonicContact NZ-OE1 2.76Å; K547-E597 PolarHBondContact NZ-OE1 2.78Å; K547-E597 IonicContact NZ-OE2 3.15Å; K547-E597 PolarHBondContact NZ-OE2 3.24Å
548	S	92.9	Very high	93.7	Very high	91 Å²	91	40.4 Å²	40.4	64%	0.636	22%	0.224	S	C	*	.	H	α-helix	trans	-61.5	-26.4	177.8	54.7	0	0	0	0	114.6	P546	P546-S548 PolarHBondContact O-N 2.98Å
549	L	93.1	Very high	93.5	Very high	45 Å²	45	45 Å²	45	24%	0.236	25%	0.246	C	C	.	.	H	α-helix	trans	-90.7	-25.9	176.5	-62.1	178.1	0	0	0	113.2	K508 P546 K547 P552	K508-L549 HydrophobicContact CB-CD1 4.28Å; K508-L549 HydrophobicContact CG-CD1 3.71Å; P546-L549 HydrophobicContact CB-CD1 4.35Å; P546-L549 HydrophobicContact CB-CG 4.42Å; P546-L549 HydrophobicContact CG-CD1 4.14Å; P546-L549 WeakPolarHBondContact O-CA 3.47Å; P546-L549 WeakPolarHBondContact O-CB 3.38Å; P546-L549 PolarHBondContact O-N 3.4Å; K547-L549 PolarHBondContact O-N 2.6Å; L549-P552 WeakPolarHBondContact O-CD 3.38Å
550	L	93.2	Very high	93.3	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-74.4	-39.7	178	-172.2	62.6	0	0	0	112.1	T542 P546 K547 P552 Y553 L554 L557 T594	T542-L550 HydrophobicContact CG2-CD1 3.99Å; P546-L550 PolarHBondContact O-N 3.2Å; K547-L550 PolarHBondContact O-N 2.85Å; L550-P552 VanDerWaalsContact C-CD 3.47Å; L550-Y553 PolarHBondContact O-N 3.22Å; L550-L554 PolarHBondContact O-N 2.95Å; L550-L557 HydrophobicContact CD1-CD1 3.51Å; L550-T594 HydrophobicContact CD2-CG2 3.65Å
551	I	93.9	Very high	93.2	Very high	69 Å²	69	45.1 Å²	45.1	35%	0.354	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-48.6	-45.2	-174.5	-72.6	161.9	0	0	0	114.6	K547 Y553 L554 K598	K547-I551 HydrophobicContact CG-CD1 4.06Å; K547-I551 WeakPolarHBondContact O-CD1 3.5Å; K547-I551 VanDerWaalsContact O-CG1 3.26Å; K547-I551 WeakPolarHBondContact O-CG1 3.41Å; K547-I551 PolarHBondContact O-N 2.86Å; I551-Y553 PolarHBondContact O-N 2.99Å; I551-L554 WeakPolarHBondContact O-CB 3.2Å; I551-L554 PolarHBondContact O-N 3.36Å; I551-K598 HydrophobicContact CD1-CD 4.46Å; I551-K598 HydrophobicContact CD1-CG 3.81Å; I551-K598 HydrophobicContact CG1-CB 4.36Å; I551-K598 HydrophobicContact CG1-CG 3.93Å
552	P	93.9	Very high	93	Very high	100 Å²	100	47.2 Å²	47.2	65%	0.649	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-62.1	-24	178.8	-24.2	35.5	0	0	0	114.9	L549 L550	L549-P552 WeakPolarHBondContact O-CD 3.38Å; L550-P552 VanDerWaalsContact C-CD 3.47Å
553	Y	92.4	Very high	92.9	Very high	59 Å²	59	51.9 Å²	51.9	23%	0.231	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-99.1	-13.5	-178.4	-63.9	-85.6	0	0	0	113.1	H511 D512 I515 L550 I551 D555 S556 L557	H511-Y553 AromaticContact CE1-CE2 3.78Å; H511-Y553 AromaticContact CE1-CZ 3.9Å; H511-Y553 PolarHBondContact CE1-OH 3.23Å; H511-Y553 AromaticContact ND1-CE2 3.18Å; H511-Y553 WeakPolarHBondContact ND1-CE2 3.22Å; H511-Y553 AromaticContact ND1-CZ 3.31Å; H511-Y553 VanDerWaalsContact ND1-CZ 3.31Å; H511-Y553 PolarHBondContact ND1-OH 3.37Å; D512-Y553 WeakPolarHBondContact CB-OH 3.49Å; I515-Y553 HydrophobicContact CD1-CD1 4.24Å; I515-Y553 HydrophobicContact CD1-CD2 4.13Å; I515-Y553 HydrophobicContact CD1-CG 3.87Å; L550-Y553 PolarHBondContact O-N 3.22Å; I551-Y553 PolarHBondContact O-N 2.99Å; Y553-D555 PolarHBondContact O-N 3.43Å; Y553-S556 PolarHBondContact O-N 3.11Å; Y553-L557 PolarHBondContact O-N 2.98Å
554	L	93.1	Very high	92.9	Very high	3 Å²	3	47.2 Å²	47.2	2%	0.016	26%	0.261	C	S	.	.	H	α-helix	trans	-55.8	-43.8	-166.8	-174.5	59.5	0	0	0	113.6	L550 I551 S556 L557 V558 V591 A595 K598 F599 Y602	L550-L554 PolarHBondContact O-N 2.95Å; I551-L554 WeakPolarHBondContact O-CB 3.2Å; I551-L554 PolarHBondContact O-N 3.36Å; L554-S556 PolarHBondContact O-N 3.18Å; L554-L557 PolarHBondContact O-N 3.5Å; L554-V558 HydrophobicContact CD1-CG2 4.06Å; L554-V558 HydrophobicContact CG-CG2 4.48Å; L554-V558 VanDerWaalsContact O-CB 3.23Å; L554-V558 WeakPolarHBondContact O-CB 3.47Å; L554-V558 VanDerWaalsContact O-CG2 3.28Å; L554-V558 WeakPolarHBondContact O-CG2 3.33Å; L554-V558 PolarHBondContact O-N 3.35Å; L554-V591 HydrophobicContact CD1-CG1 3.51Å; L554-A595 HydrophobicContact CD1-CB 4.08Å; L554-A595 HydrophobicContact CD2-CB 3.87Å; L554-K598 HydrophobicContact CD2-CB 3.98Å; L554-F599 HydrophobicContact CD1-CD2 4.44Å; L554-Y602 HydrophobicContact CD2-CD2 4.38Å; L554-Y602 HydrophobicContact CD2-CE2 3.64Å; L554-Y602 HydrophobicContact CG-CD2 4.37Å; L554-Y602 HydrophobicContact CG-CE2 3.66Å
555	D	93.6	Very high	93.1	Very high	83 Å²	83	43.9 Å²	43.9	44%	0.444	24%	0.243	S	C	.	.	H	α-helix	trans	-62.8	-42.6	177.8	-176.8	52.9	0	0	0	112	Y553 Q559 Y602	Y553-D555 PolarHBondContact O-N 3.43Å; D555-Q559 WeakPolarHBondContact O-CB 3.45Å; D555-Q559 WeakPolarHBondContact O-CG 3.33Å; D555-Q559 PolarHBondContact O-N 2.71Å; D555-Q559 PolarHBondContact OD1-NE2 2.98Å; D555-Q559 PolarHBondContact OD2-NE2 3.43Å; D555-Y602 HydrophobicContact CB-CE1 4.46Å
556	S	90.7	Very high	93	Very high	54 Å²	54	45.8 Å²	45.8	38%	0.378	25%	0.254	S	S	.	.	H	α-helix	trans	-67.7	-48.7	177.5	-172.1	0	0	0	0	111.4	Y553 L554 V558 Q559 H560	Y553-S556 PolarHBondContact O-N 3.11Å; L554-S556 PolarHBondContact O-N 3.18Å; S556-V558 PolarHBondContact O-N 3.29Å; S556-Q559 PolarHBondContact O-N 3.04Å; S556-H560 PolarHBondContact O-N 3.39Å; S556-H560 VanDerWaalsContact O-N 3.1Å; S556-H560 PolarHBondContact O-ND1 3.45Å; S556-H560 PolarHBondContact OG-CE1 3.24Å
557	L	92	Very high	92.9	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-54.1	-53.2	176.9	-80.4	164.5	0	0	0	111	I515 L519 L538 L550 Y553 L554 Q559 H560 L561	I515-L557 HydrophobicContact CD1-CD1 4.46Å; I515-L557 HydrophobicContact CG2-CD2 3.69Å; I515-L557 HydrophobicContact CG2-CG 4.12Å; L519-L557 HydrophobicContact CD1-CD2 4.2Å; L519-L557 HydrophobicContact CD2-CD2 4.25Å; L519-L557 HydrophobicContact CG-CD2 4.39Å; L538-L557 HydrophobicContact CD1-CD2 4.13Å; L538-L557 HydrophobicContact CD2-CD2 4.12Å; L550-L557 HydrophobicContact CD1-CD1 3.51Å; Y553-L557 PolarHBondContact O-N 2.98Å; L554-L557 PolarHBondContact O-N 3.5Å; L557-Q559 PolarHBondContact O-N 2.89Å; L557-H560 PolarHBondContact O-N 3.35Å; L557-L561 WeakPolarHBondContact O-CB 3.33Å; L557-L561 WeakPolarHBondContact O-CG 3.18Å; L557-L561 PolarHBondContact O-N 2.93Å
558	V	93.7	Very high	92.8	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.006	25%	0.246	C	C	.	.	H	α-helix	trans	-58	-45.1	179.2	158.7	0	0	0	0	112	L554 S556 H562 F599 Y602 L605 F606	L554-V558 HydrophobicContact CD1-CG2 4.06Å; L554-V558 HydrophobicContact CG-CG2 4.48Å; L554-V558 VanDerWaalsContact O-CB 3.23Å; L554-V558 WeakPolarHBondContact O-CB 3.47Å; L554-V558 VanDerWaalsContact O-CG2 3.28Å; L554-V558 WeakPolarHBondContact O-CG2 3.33Å; L554-V558 PolarHBondContact O-N 3.35Å; S556-V558 PolarHBondContact O-N 3.29Å; V558-H562 VanDerWaalsContact O-CB 3.26Å; V558-H562 WeakPolarHBondContact O-CB 3.24Å; V558-H562 PolarHBondContact O-N 3.46Å; V558-F599 HydrophobicContact CG2-CE2 3.89Å; V558-Y602 HydrophobicContact CB-CD1 4.13Å; V558-Y602 HydrophobicContact CB-CE1 4.43Å; V558-Y602 HydrophobicContact CB-CG 4.34Å; V558-Y602 HydrophobicContact CG1-CD1 3.51Å; V558-Y602 HydrophobicContact CG1-CE1 4.19Å; V558-Y602 HydrophobicContact CG1-CG 3.83Å; V558-Y602 HydrophobicContact CG2-CD1 4.27Å; V558-Y602 HydrophobicContact CG2-CD2 4.17Å; V558-Y602 HydrophobicContact CG2-CG 3.99Å; V558-L605 HydrophobicContact CG1-CD2 3.65Å; V558-F606 HydrophobicContact CB-CE2 4.32Å; V558-F606 HydrophobicContact CB-CZ 4.38Å; V558-F606 HydrophobicContact CG1-CE2 3.58Å; V558-F606 HydrophobicContact CG1-CZ 3.81Å; V558-F606 HydrophobicContact CG2-CE2 4.14Å; V558-F606 HydrophobicContact CG2-CZ 4.46Å
559	Q	92.1	Very high	92.8	Very high	97 Å²	97	40 Å²	40	45%	0.453	22%	0.22	S	C	.	.	H	α-helix	trans	-63.3	-43.1	-179.6	-75.1	173.4	31.8	0	0	112.2	D555 S556 L557 V563	D555-Q559 WeakPolarHBondContact O-CB 3.45Å; D555-Q559 WeakPolarHBondContact O-CG 3.33Å; D555-Q559 PolarHBondContact O-N 2.71Å; D555-Q559 PolarHBondContact OD1-NE2 2.98Å; D555-Q559 PolarHBondContact OD2-NE2 3.43Å; S556-Q559 PolarHBondContact O-N 3.04Å; L557-Q559 PolarHBondContact O-N 2.89Å; Q559-V563 WeakPolarHBondContact O-CG2 3.36Å; Q559-V563 PolarHBondContact O-N 3.12Å; Q559-V563 VanDerWaalsContact O-N 3.11Å
560	H	91.6	Very high	92.7	Very high	62 Å²	62	43 Å²	43	29%	0.287	23%	0.233	S	C	.	.	H	α-helix	trans	-68.2	-47.9	178.2	-68.6	74.1	0	0	0	111.1	L519 E523 S556 L557 H562 V563 I564	L519-H560 HydrophobicContact CD2-CB 3.81Å; E523-H560 IonicContact OE1-CD2 3.74Å; S556-H560 PolarHBondContact O-N 3.39Å; S556-H560 VanDerWaalsContact O-N 3.1Å; S556-H560 PolarHBondContact O-ND1 3.45Å; S556-H560 PolarHBondContact OG-CE1 3.24Å; L557-H560 PolarHBondContact O-N 3.35Å; H560-H562 VanDerWaalsContact C-N 3.32Å; H560-H562 PolarHBondContact O-N 3.5Å; H560-V563 PolarHBondContact O-N 2.91Å; H560-I564 WeakPolarHBondContact O-CG1 3.33Å; H560-I564 PolarHBondContact O-N 2.99Å
561	L	93.8	Very high	92.5	Very high	1 Å²	1	45 Å²	45	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-57.9	-42.3	177.2	-72.5	171	0	0	0	112.1	M522 L538 L557 I564 M565 V584 I588 V591	M522-L561 HydrophobicContact CE-CD2 3.67Å; L538-L561 HydrophobicContact CD2-CD2 4.43Å; L557-L561 WeakPolarHBondContact O-CB 3.33Å; L557-L561 WeakPolarHBondContact O-CG 3.18Å; L557-L561 PolarHBondContact O-N 2.93Å; L561-I564 PolarHBondContact O-N 2.74Å; L561-M565 VanDerWaalsContact O-CB 3.24Å; L561-M565 WeakPolarHBondContact O-CB 3.36Å; L561-M565 PolarHBondContact O-N 3.4Å; L561-V584 HydrophobicContact CD2-CG1 4.32Å; L561-I588 HydrophobicContact CB-CD1 4.34Å; L561-I588 HydrophobicContact CB-CG1 3.83Å; L561-I588 HydrophobicContact CD1-CG1 4.05Å; L561-I588 HydrophobicContact CG-CG1 4.35Å; L561-V591 HydrophobicContact CD1-CG2 4.16Å
562	H	94.1	Very high	92.3	Very high	45 Å²	45	42.7 Å²	42.7	21%	0.208	23%	0.23	C	C	.	.	H	α-helix	trans	-63.2	-44.8	175.6	171	-101.1	0	0	0	112.6	V558 H560 I564 M565 V566 L605 F606	V558-H562 VanDerWaalsContact O-CB 3.26Å; V558-H562 WeakPolarHBondContact O-CB 3.24Å; V558-H562 PolarHBondContact O-N 3.46Å; H560-H562 VanDerWaalsContact C-N 3.32Å; H560-H562 PolarHBondContact O-N 3.5Å; H562-I564 VanDerWaalsContact C-N 3.35Å; H562-I564 PolarHBondContact O-N 3.25Å; H562-M565 PolarHBondContact O-N 3.43Å; H562-V566 WeakPolarHBondContact O-CG2 3.34Å; H562-V566 PolarHBondContact O-N 3.07Å; H562-L605 HydrophobicContact CB-CD2 3.82Å; H562-L605 HydrophobicContact CB-CG 4.18Å; H562-F606 HydrophobicContact CB-CE1 3.73Å; H562-F606 HydrophobicContact CB-CZ 3.96Å
563	V	93.3	Very high	92	Very high	98 Å²	98	43.4 Å²	43.4	59%	0.594	23%	0.228	S	C	*	.	H	α-helix	trans	-61.3	-44.5	178	168.1	0	0	0	0	111	Q559 H560 A567	Q559-V563 WeakPolarHBondContact O-CG2 3.36Å; Q559-V563 PolarHBondContact O-N 3.12Å; Q559-V563 VanDerWaalsContact O-N 3.11Å; H560-V563 PolarHBondContact O-N 2.91Å; V563-A567 WeakPolarHBondContact O-CB 3.24Å; V563-A567 PolarHBondContact O-N 3.05Å; V563-A567 VanDerWaalsContact O-N 3.08Å
564	I	92	Very high	91.8	Very high	20 Å²	20	47.7 Å²	47.7	10%	0.103	25%	0.25	C	C	.	.	H	α-helix	trans	-66.7	-46.6	178.7	-61.8	163.7	0	0	0	110.4	M522 H560 L561 H562 V566 A567 K568 V584	M522-I564 HydrophobicContact CB-CD1 3.86Å; M522-I564 HydrophobicContact CE-CD1 3.92Å; H560-I564 WeakPolarHBondContact O-CG1 3.33Å; H560-I564 PolarHBondContact O-N 2.99Å; L561-I564 PolarHBondContact O-N 2.74Å; H562-I564 VanDerWaalsContact C-N 3.35Å; H562-I564 PolarHBondContact O-N 3.25Å; I564-V566 VanDerWaalsContact C-N 3.34Å; I564-V566 PolarHBondContact O-N 2.96Å; I564-A567 PolarHBondContact O-N 3.5Å; I564-K568 HydrophobicContact CG2-CG 4.1Å; I564-K568 WeakPolarHBondContact O-CG 3.41Å; I564-K568 PolarHBondContact O-N 2.85Å; I564-V584 HydrophobicContact CG2-CG2 3.72Å
565	M	93.8	Very high	91.5	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-56	-46.4	177.3	-176.8	-167.1	64.5	0	0	111.6	L561 H562 K568 L569 L581 V584 I588 F606 L610	L561-M565 VanDerWaalsContact O-CB 3.24Å; L561-M565 WeakPolarHBondContact O-CB 3.36Å; L561-M565 PolarHBondContact O-N 3.4Å; H562-M565 PolarHBondContact O-N 3.43Å; M565-K568 PolarHBondContact O-N 3.29Å; M565-L569 WeakPolarHBondContact O-CB 3.38Å; M565-L569 PolarHBondContact O-N 3.45Å; M565-L581 HydrophobicContact CG-CD1 3.93Å; M565-V584 HydrophobicContact CB-CG1 3.89Å; M565-I588 HydrophobicContact CB-CD1 4.22Å; M565-I588 HydrophobicContact CG-CD1 4.34Å; M565-I588 HydrophobicContact SD-CD1 3.82Å; M565-F606 HydrophobicContact CE-CD1 3.72Å; M565-F606 HydrophobicContact CE-CE1 4.32Å; M565-F606 HydrophobicContact SD-CD1 3.95Å; M565-L610 HydrophobicContact SD-CD2 4.19Å
566	V	92.9	Very high	91.1	Very high	46 Å²	46	53 Å²	53	28%	0.279	28%	0.28	S	S	.	.	H	α-helix	trans	-65.8	-38.8	178.8	171.3	0	0	0	0	111.8	H562 I564 Q570	H562-V566 WeakPolarHBondContact O-CG2 3.34Å; H562-V566 PolarHBondContact O-N 3.07Å; I564-V566 VanDerWaalsContact C-N 3.34Å; I564-V566 PolarHBondContact O-N 2.96Å; V566-Q570 WeakPolarHBondContact O-CG 3.26Å; V566-Q570 PolarHBondContact O-N 3.35Å
567	A	91.7	Very high	90.9	Very high	29 Å²	29	52.6 Å²	52.6	24%	0.24	28%	0.276	C	S	.	.	H	α-helix	trans	-66.1	-48.1	175.7	0	0	0	0	0	111.7	V563 I564 L569 Q570 E571	V563-A567 WeakPolarHBondContact O-CB 3.24Å; V563-A567 PolarHBondContact O-N 3.05Å; V563-A567 VanDerWaalsContact O-N 3.08Å; I564-A567 PolarHBondContact O-N 3.5Å; A567-L569 PolarHBondContact O-N 3.13Å; A567-Q570 WeakPolarHBondContact O-CB 3.26Å; A567-Q570 PolarHBondContact O-N 3.44Å; A567-Q570 VanDerWaalsContact O-N 3.09Å; A567-E571 PolarHBondContact O-N 3.12Å
568	K	91.9	Very high	90.8	Very high	10 Å²	10	53.8 Å²	53.8	4%	0.043	28%	0.281	C	S	.	.	H	α-helix	trans	-69.6	-30.1	-179.6	-64	-49.3	-170.4	-173.4	0	113.3	I564 M565 Q570 E571 L572 V580 L581	I564-K568 HydrophobicContact CG2-CG 4.1Å; I564-K568 WeakPolarHBondContact O-CG 3.41Å; I564-K568 PolarHBondContact O-N 2.85Å; M565-K568 PolarHBondContact O-N 3.29Å; K568-Q570 VanDerWaalsContact C-N 3.33Å; K568-Q570 PolarHBondContact O-N 3.47Å; K568-E571 VanDerWaalsContact CD-CD 3.49Å; K568-E571 HydrophobicContact CD-CG 4.47Å; K568-E571 WeakPolarHBondContact CD-OE1 3.43Å; K568-E571 WeakPolarHBondContact CD-OE2 3.48Å; K568-E571 IonicContact NZ-OE1 3.47Å; K568-E571 PolarHBondContact NZ-OE1 3.06Å; K568-E571 IonicContact NZ-OE2 2.65Å; K568-E571 PolarHBondContact NZ-OE2 2.95Å; K568-E571 PolarHBondContact O-N 3.36Å; K568-L572 WeakPolarHBondContact O-CB 3.36Å; K568-L572 PolarHBondContact O-N 3.07Å; K568-V580 HydrophobicContact CD-CB 4.27Å; K568-V580 HydrophobicContact CD-CG1 4.38Å; K568-V580 HydrophobicContact CG-CB 4.13Å; K568-V580 HydrophobicContact CG-CG1 3.99Å; K568-L581 HydrophobicContact CB-CB 4Å; K568-L581 HydrophobicContact CB-CD1 4.11Å
569	L	92	Very high	90.7	Very high	18 Å²	18	54.6 Å²	54.6	9%	0.094	29%	0.285	C	S	.	.	H	α-helix	trans	-63.1	-37.3	168.3	-179.3	55.4	0	0	0	112.3	M565 A567 L572 I573 I613	M565-L569 WeakPolarHBondContact O-CB 3.38Å; M565-L569 PolarHBondContact O-N 3.45Å; A567-L569 PolarHBondContact O-N 3.13Å; L569-L572 HydrophobicContact CD1-CD2 4.33Å; L569-I573 HydrophobicContact CD1-CD1 4.25Å; L569-I573 HydrophobicContact CG-CD1 4.28Å; L569-I573 WeakPolarHBondContact O-CD1 3.46Å; L569-I573 VanDerWaalsContact O-CG1 3.27Å; L569-I573 WeakPolarHBondContact O-CG1 3.28Å; L569-I573 PolarHBondContact O-N 3.47Å; L569-I573 VanDerWaalsContact O-N 3.16Å; L569-I613 HydrophobicContact CD1-CD1 4.31Å; L569-I613 HydrophobicContact CD1-CG1 3.67Å; L569-I613 HydrophobicContact CD2-CD1 4.49Å; L569-I613 HydrophobicContact CD2-CG1 4.27Å
570	Q	90.5	Very high	90.6	Very high	106 Å²	106	50.4 Å²	50.4	50%	0.495	27%	0.266	S	S	.	.	H	α-helix	trans	-70.2	-36	173.5	-68.9	174	25.4	0	0	112.4	V566 A567 K568 Q574	V566-Q570 WeakPolarHBondContact O-CG 3.26Å; V566-Q570 PolarHBondContact O-N 3.35Å; A567-Q570 WeakPolarHBondContact O-CB 3.26Å; A567-Q570 PolarHBondContact O-N 3.44Å; A567-Q570 VanDerWaalsContact O-N 3.09Å; K568-Q570 VanDerWaalsContact C-N 3.33Å; K568-Q570 PolarHBondContact O-N 3.47Å; Q570-Q574 WeakPolarHBondContact O-CB 3.31Å; Q570-Q574 VanDerWaalsContact O-CG 3.24Å; Q570-Q574 WeakPolarHBondContact O-CG 3.23Å; Q570-Q574 PolarHBondContact O-N 2.78Å; Q570-Q574 PolarHBondContact O-NE2 3.06Å
571	E	89.8	Confident	90.7	Very high	43 Å²	43	47.5 Å²	47.5	20%	0.201	25%	0.253	C	S	.	.	H	α-helix	trans	-65	-45.9	173.7	-69.6	176.5	-145.6	0	0	111.4	A567 K568 I573 Q574 K575	A567-E571 PolarHBondContact O-N 3.12Å; K568-E571 VanDerWaalsContact CD-CD 3.49Å; K568-E571 HydrophobicContact CD-CG 4.47Å; K568-E571 WeakPolarHBondContact CD-OE1 3.43Å; K568-E571 WeakPolarHBondContact CD-OE2 3.48Å; K568-E571 IonicContact NZ-OE1 3.47Å; K568-E571 PolarHBondContact NZ-OE1 3.06Å; K568-E571 IonicContact NZ-OE2 2.65Å; K568-E571 PolarHBondContact NZ-OE2 2.95Å; K568-E571 PolarHBondContact O-N 3.36Å; E571-I573 PolarHBondContact O-N 2.89Å; E571-Q574 PolarHBondContact O-N 2.94Å; E571-Q574 VanDerWaalsContact O-N 3.08Å; E571-K575 WeakPolarHBondContact O-CB 3.36Å; E571-K575 PolarHBondContact O-N 2.92Å
572	L	90	Very high	90.7	Very high	21 Å²	21	48 Å²	48	11%	0.11	26%	0.255	C	S	.	.	H	α-helix	trans	-53	-49.9	173.7	178.5	70.5	0	0	0	111.5	K568 L569 Q574 G576 K578 L581 L622 L625	K568-L572 WeakPolarHBondContact O-CB 3.36Å; K568-L572 PolarHBondContact O-N 3.07Å; L569-L572 HydrophobicContact CD1-CD2 4.33Å; L572-Q574 VanDerWaalsContact C-N 3.26Å; L572-Q574 PolarHBondContact O-N 3.48Å; L572-G576 VanDerWaalsContact O-CA 3.31Å; L572-G576 WeakPolarHBondContact O-CA 3.46Å; L572-G576 PolarHBondContact O-N 2.74Å; L572-K578 HydrophobicContact CD1-CB 4.34Å; L572-L581 HydrophobicContact CB-CD2 4.41Å; L572-L581 HydrophobicContact CD2-CD2 3.84Å; L572-L622 HydrophobicContact CD1-CD1 4.24Å; L572-L622 HydrophobicContact CD1-CD2 3.75Å; L572-L625 HydrophobicContact CD1-CD2 4.42Å; L572-L625 HydrophobicContact CD2-CD2 3.69Å
573	I	87.4	Confident	90.7	Very high	116 Å²	116	48 Å²	48	60%	0.595	26%	0.255	S	S	*	.	H	α-helix	trans	-64	-30.4	179.8	-67.8	165	0	0	0	112.3	L569 E571	L569-I573 HydrophobicContact CD1-CD1 4.25Å; L569-I573 HydrophobicContact CG-CD1 4.28Å; L569-I573 WeakPolarHBondContact O-CD1 3.46Å; L569-I573 VanDerWaalsContact O-CG1 3.27Å; L569-I573 WeakPolarHBondContact O-CG1 3.28Å; L569-I573 PolarHBondContact O-N 3.47Å; L569-I573 VanDerWaalsContact O-N 3.16Å; E571-I573 PolarHBondContact O-N 2.89Å
574	Q	87.8	Confident	90.8	Very high	149 Å²	149	43.3 Å²	43.3	70%	0.696	23%	0.227	S	C	*	.	H	α-helix	trans	-91.1	-31.1	-176.5	-72.8	172.7	53.4	0	0	114.3	Q570 E571 L572	Q570-Q574 WeakPolarHBondContact O-CB 3.31Å; Q570-Q574 VanDerWaalsContact O-CG 3.24Å; Q570-Q574 WeakPolarHBondContact O-CG 3.23Å; Q570-Q574 PolarHBondContact O-N 2.78Å; Q570-Q574 PolarHBondContact O-NE2 3.06Å; E571-Q574 PolarHBondContact O-N 2.94Å; E571-Q574 VanDerWaalsContact O-N 3.08Å; L572-Q574 VanDerWaalsContact C-N 3.26Å; L572-Q574 PolarHBondContact O-N 3.48Å
575	K	86.8	Confident	91	Very high	156 Å²	156	42.3 Å²	42.3	68%	0.678	22%	0.222	S	C	*	.	H	α-helix	trans	-132.7	-17.3	-167.1	-63.1	179.2	-179.9	176.5	0	114.7	E571 T577	E571-K575 WeakPolarHBondContact O-CB 3.36Å; E571-K575 PolarHBondContact O-N 2.92Å; K575-T577 HydrophobicContact CB-CG2 4.16Å
576	G	85	Confident	91.1	Very high	41 Å²	41	43.4 Å²	43.4	42%	0.423	23%	0.228	S	C	.	.			trans	84.4	-0.2	-174.3	0	0	0	0	0	115.7	L572 K578	L572-G576 VanDerWaalsContact O-CA 3.31Å; L572-G576 WeakPolarHBondContact O-CA 3.46Å; L572-G576 PolarHBondContact O-N 2.74Å; G576-K578 PolarHBondContact O-N 2.99Å
577	T	87.5	Confident	91.2	Very high	45 Å²	45	41.2 Å²	41.2	28%	0.276	22%	0.215	S	C	.	.			trans	-67.3	125.2	-177.7	50.7	0	0	0	0	112.3	D397 K575	D397-T577 WeakPolarHBondContact OD2-CA 3.24Å; K575-T577 HydrophobicContact CB-CG2 4.16Å
578	K	89.8	Confident	91.4	Very high	25 Å²	25	39.9 Å²	39.9	11%	0.109	20%	0.204	C	C	.	.			trans	-115.2	-30.6	-172.4	65.3	-171.6	178.8	-68.7	0	115.2	D397 E398 L572 G576 V580 L581 E582 E621 L622	D397-K578 PolarHBondContact OD1-N 3.11Å; D397-K578 WeakPolarHBondContact OD2-CG 3.5Å; D397-K578 PolarHBondContact OD2-N 2.57Å; D397-K578 IonicContact OD2-NZ 3.54Å; E398-K578 IonicContact OE1-NZ 2.8Å; E398-K578 PolarHBondContact OE1-NZ 2.65Å; L572-K578 HydrophobicContact CD1-CB 4.34Å; G576-K578 PolarHBondContact O-N 2.99Å; K578-V580 PolarHBondContact O-N 2.59Å; K578-L581 WeakPolarHBondContact O-CB 3.34Å; K578-L581 PolarHBondContact O-N 2.88Å; K578-E582 PolarHBondContact O-N 3Å; K578-E582 VanDerWaalsContact O-N 3.12Å; K578-E621 WeakPolarHBondContact CD-O 3.21Å; K578-E621 VanDerWaalsContact CE-O 3.22Å; K578-E621 WeakPolarHBondContact CE-O 3.4Å; K578-L622 HydrophobicContact CB-CD2 4.14Å; K578-L622 HydrophobicContact CD-CD2 4.05Å
579	L	90.3	Very high	91.7	Very high	19 Å²	19	39.5 Å²	39.5	10%	0.099	20%	0.202	C	C	.	.	H	α-helix	trans	-50.7	-51.7	-163.1	-178.5	66.9	0	0	0	114.6	D397 R529 A532	D397-L579 WeakPolarHBondContact OD1-CB 3.33Å; D397-L579 PolarHBondContact OD1-N 2.9Å; R529-L579 HydrophobicContact CG-CD2 3.83Å; A532-L579 HydrophobicContact CB-CD2 4.18Å; A532-L579 HydrophobicContact CB-CG 3.84Å
580	V	91.7	Very high	91.9	Very high	8 Å²	8	39 Å²	39	5%	0.048	20%	0.2	C	C	.	.	H	α-helix	trans	-70.5	-35	-178.3	-173.1	0	0	0	0	111.7	P528 Q531 A532 K568 K578 E582 Q583 V584	P528-V580 HydrophobicContact CB-CG2 3.93Å; P528-V580 WeakPolarHBondContact O-CG2 3.29Å; Q531-V580 HydrophobicContact CB-CG1 3.83Å; Q531-V580 HydrophobicContact CB-CG2 4.05Å; A532-V580 HydrophobicContact CB-CG2 4.25Å; K568-V580 HydrophobicContact CD-CB 4.27Å; K568-V580 HydrophobicContact CD-CG1 4.38Å; K568-V580 HydrophobicContact CG-CB 4.13Å; K568-V580 HydrophobicContact CG-CG1 3.99Å; K578-V580 PolarHBondContact O-N 2.59Å; V580-E582 VanDerWaalsContact C-N 3.34Å; V580-Q583 PolarHBondContact O-N 3.01Å; V580-V584 HydrophobicContact CG1-CG2 4.17Å; V580-V584 WeakPolarHBondContact O-CB 3.4Å; V580-V584 WeakPolarHBondContact O-CG2 3.27Å; V580-V584 PolarHBondContact O-N 2.85Å
581	L	93.6	Very high	92.2	Very high	2 Å²	2	34 Å²	34	1%	0.01	18%	0.177	C	C	.	.	H	α-helix	trans	-67.3	-38.6	-178.5	-176.3	61.5	0	0	0	111.1	M565 K568 L572 K578 V584 V585 I613 L625	M565-L581 HydrophobicContact CG-CD1 3.93Å; K568-L581 HydrophobicContact CB-CB 4Å; K568-L581 HydrophobicContact CB-CD1 4.11Å; L572-L581 HydrophobicContact CB-CD2 4.41Å; L572-L581 HydrophobicContact CD2-CD2 3.84Å; K578-L581 WeakPolarHBondContact O-CB 3.34Å; K578-L581 PolarHBondContact O-N 2.88Å; L581-V584 PolarHBondContact O-N 3.38Å; L581-V585 HydrophobicContact CD1-CG2 4.26Å; L581-V585 HydrophobicContact CG-CG2 4.42Å; L581-V585 WeakPolarHBondContact O-CB 3.27Å; L581-V585 VanDerWaalsContact O-CG2 3.28Å; L581-V585 WeakPolarHBondContact O-CG2 3.16Å; L581-V585 PolarHBondContact O-N 2.65Å; L581-I613 HydrophobicContact CD2-CD1 4.36Å; L581-L625 HydrophobicContact CB-CD1 4.41Å; L581-L625 HydrophobicContact CD2-CD1 4.07Å; L581-L625 HydrophobicContact CD2-CD2 4.01Å; L581-L625 HydrophobicContact CG-CD1 3.92Å
582	E	93.6	Very high	92.5	Very high	10 Å²	10	32 Å²	32	5%	0.047	17%	0.168	C	C	.	.	H	α-helix	trans	-57.2	-51.4	175.8	-68.3	-161.6	176.4	0	0	112.2	K578 V580 V584 V585 T586 L624 L625 K628	K578-E582 PolarHBondContact O-N 3Å; K578-E582 VanDerWaalsContact O-N 3.12Å; V580-E582 VanDerWaalsContact C-N 3.34Å; E582-V584 PolarHBondContact O-N 2.75Å; E582-V585 PolarHBondContact O-N 2.98Å; E582-T586 PolarHBondContact O-N 3.48Å; E582-T586 VanDerWaalsContact O-N 3.11Å; E582-T586 PolarHBondContact O-OG1 2.73Å; E582-L624 VanDerWaalsContact OE2-CD2 3.29Å; E582-L624 WeakPolarHBondContact OE2-CD2 3.32Å; E582-L624 WeakPolarHBondContact OE2-CG 3.41Å; E582-L625 HydrophobicContact CG-CB 3.78Å; E582-L625 HydrophobicContact CG-CD1 3.85Å; E582-L625 HydrophobicContact CG-CG 4.37Å; E582-L625 PolarHBondContact OE1-N 2.94Å; E582-K628 HydrophobicContact CB-CD 3.86Å; E582-K628 HydrophobicContact CG-CD 4.34Å; E582-K628 IonicContact OE2-NZ 3.41Å; E582-K628 PolarHBondContact OE2-NZ 3.2Å
583	Q	93.7	Very high	92.7	Very high	45 Å²	45	34.2 Å²	34.2	21%	0.21	18%	0.18	C	C	.	.	H	α-helix	trans	-68.8	-34.7	-178.2	-60.3	-61.2	-14.4	0	0	112.3	A532 A535 V580 T586 S587	A532-Q583 HydrophobicContact CB-CG 4.08Å; A532-Q583 WeakPolarHBondContact O-CB 3.39Å; A535-Q583 HydrophobicContact CB-CB 3.8Å; V580-Q583 PolarHBondContact O-N 3.01Å; Q583-T586 PolarHBondContact O-N 3.23Å; Q583-S587 VanDerWaalsContact O-CB 3.31Å; Q583-S587 WeakPolarHBondContact O-CB 3.48Å; Q583-S587 PolarHBondContact O-N 3.18Å
584	V	94.8	Very high	93.1	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-65.9	-38.9	174.3	169.2	0	0	0	0	111.5	M522 A535 L561 I564 M565 V580 L581 E582 S587 I588	M522-V584 HydrophobicContact CE-CG2 4.08Å; A535-V584 HydrophobicContact CB-CG2 4.37Å; L561-V584 HydrophobicContact CD2-CG1 4.32Å; I564-V584 HydrophobicContact CG2-CG2 3.72Å; M565-V584 HydrophobicContact CB-CG1 3.89Å; V580-V584 HydrophobicContact CG1-CG2 4.17Å; V580-V584 WeakPolarHBondContact O-CB 3.4Å; V580-V584 WeakPolarHBondContact O-CG2 3.27Å; V580-V584 PolarHBondContact O-N 2.85Å; L581-V584 PolarHBondContact O-N 3.38Å; E582-V584 PolarHBondContact O-N 2.75Å; V584-S587 PolarHBondContact O-N 3.36Å; V584-I588 HydrophobicContact CG1-CD1 3.97Å; V584-I588 WeakPolarHBondContact O-CD1 3.44Å; V584-I588 VanDerWaalsContact O-CG1 3.24Å; V584-I588 WeakPolarHBondContact O-CG1 3.38Å; V584-I588 PolarHBondContact O-N 3.46Å
585	V	96.2	Very high	93.5	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-64.4	-45.1	175.9	165.7	0	0	0	0	111.2	L581 E582 I588 A589 L610 K628 C632	L581-V585 HydrophobicContact CD1-CG2 4.26Å; L581-V585 HydrophobicContact CG-CG2 4.42Å; L581-V585 WeakPolarHBondContact O-CB 3.27Å; L581-V585 VanDerWaalsContact O-CG2 3.28Å; L581-V585 WeakPolarHBondContact O-CG2 3.16Å; L581-V585 PolarHBondContact O-N 2.65Å; E582-V585 PolarHBondContact O-N 2.98Å; V585-I588 PolarHBondContact O-N 3.42Å; V585-A589 PolarHBondContact O-N 3Å; V585-A589 VanDerWaalsContact O-N 3.08Å; V585-L610 HydrophobicContact CG1-CD2 4.36Å; V585-L610 HydrophobicContact CG2-CD2 4.26Å; V585-K628 HydrophobicContact CG1-CB 4.41Å; V585-K628 WeakPolarHBondContact CG1-O 3.28Å; V585-C632 HydrophobicContact CG1-CB 3.65Å
586	T	95.6	Very high	93.9	Very high	23 Å²	23	20 Å²	20	14%	0.141	12%	0.115	C	C	.	.	H	α-helix	trans	-67.3	-36.5	175.8	-53.7	0	0	0	0	112.1	I539 E582 Q583 I588 A589 S590	I539-T586 HydrophobicContact CD1-CG2 3.61Å; I539-T586 HydrophobicContact CG1-CG2 4.35Å; E582-T586 PolarHBondContact O-N 3.48Å; E582-T586 VanDerWaalsContact O-N 3.11Å; E582-T586 PolarHBondContact O-OG1 2.73Å; Q583-T586 PolarHBondContact O-N 3.23Å; T586-I588 PolarHBondContact O-N 3.2Å; T586-A589 WeakPolarHBondContact O-CA 3.48Å; T586-A589 VanDerWaalsContact O-CB 3.28Å; T586-A589 WeakPolarHBondContact O-CB 3.31Å; T586-A589 PolarHBondContact O-N 2.91Å; T586-A589 VanDerWaalsContact O-N 3.08Å; T586-S590 PolarHBondContact O-N 2.86Å
587	S	95.9	Very high	94.4	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-62.5	-40.1	173.3	-176.7	0	0	0	0	112.9	L538 Q583 V584 A589 V591	L538-S587 WeakPolarHBondContact CD2-OG 3.47Å; Q583-S587 VanDerWaalsContact O-CB 3.31Å; Q583-S587 WeakPolarHBondContact O-CB 3.48Å; Q583-S587 PolarHBondContact O-N 3.18Å; V584-S587 PolarHBondContact O-N 3.36Å; S587-A589 VanDerWaalsContact C-N 3.29Å; S587-A589 PolarHBondContact O-N 2.98Å; S587-V591 WeakPolarHBondContact O-CB 3.44Å; S587-V591 VanDerWaalsContact O-CG2 3.3Å; S587-V591 WeakPolarHBondContact O-CG2 3.32Å; S587-V591 PolarHBondContact O-N 3.32Å
588	I	96.7	Very high	94.9	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-62.4	-38.4	171.6	-66.6	157.9	0	0	0	110.8	L561 M565 V584 V585 T586 A592 F599 F606 I636	L561-I588 HydrophobicContact CB-CD1 4.34Å; L561-I588 HydrophobicContact CB-CG1 3.83Å; L561-I588 HydrophobicContact CD1-CG1 4.05Å; L561-I588 HydrophobicContact CG-CG1 4.35Å; M565-I588 HydrophobicContact CB-CD1 4.22Å; M565-I588 HydrophobicContact CG-CD1 4.34Å; M565-I588 HydrophobicContact SD-CD1 3.82Å; V584-I588 HydrophobicContact CG1-CD1 3.97Å; V584-I588 WeakPolarHBondContact O-CD1 3.44Å; V584-I588 VanDerWaalsContact O-CG1 3.24Å; V584-I588 WeakPolarHBondContact O-CG1 3.38Å; V584-I588 PolarHBondContact O-N 3.46Å; V585-I588 PolarHBondContact O-N 3.42Å; T586-I588 PolarHBondContact O-N 3.2Å; I588-A592 VanDerWaalsContact O-CB 3.3Å; I588-A592 WeakPolarHBondContact O-CB 3.45Å; I588-A592 PolarHBondContact O-N 3.43Å; I588-F599 HydrophobicContact CG2-CZ 4.32Å; I588-F606 HydrophobicContact CD1-CD1 3.77Å; I588-F606 HydrophobicContact CD1-CE1 3.48Å; I588-F606 VanDerWaalsContact CD1-CE1 3.48Å; I588-F606 HydrophobicContact CD1-CZ 4.39Å; I588-F606 HydrophobicContact CG1-CD1 4.31Å; I588-F606 HydrophobicContact CG1-CE1 3.78Å; I588-F606 HydrophobicContact CG1-CZ 4.21Å; I588-F606 HydrophobicContact CG2-CD1 3.97Å; I588-F606 HydrophobicContact CG2-CD2 4.29Å; I588-F606 HydrophobicContact CG2-CE1 4.03Å; I588-F606 HydrophobicContact CG2-CE2 4.33Å; I588-F606 HydrophobicContact CG2-CG 4.1Å; I588-F606 HydrophobicContact CG2-CZ 4.2Å; I588-I636 HydrophobicContact CG2-CD1 4.13Å
589	A	96.4	Very high	95.3	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.008	11%	0.114	C	C	.	.	H	α-helix	trans	-64.1	-49.8	178.8	0	0	0	0	0	112.3	V585 T586 S587 A592 D593 C632 L635	V585-A589 PolarHBondContact O-N 3Å; V585-A589 VanDerWaalsContact O-N 3.08Å; T586-A589 WeakPolarHBondContact O-CA 3.48Å; T586-A589 VanDerWaalsContact O-CB 3.28Å; T586-A589 WeakPolarHBondContact O-CB 3.31Å; T586-A589 PolarHBondContact O-N 2.91Å; T586-A589 VanDerWaalsContact O-N 3.08Å; S587-A589 VanDerWaalsContact C-N 3.29Å; S587-A589 PolarHBondContact O-N 2.98Å; A589-A592 WeakPolarHBondContact O-CB 3.29Å; A589-A592 PolarHBondContact O-N 2.93Å; A589-D593 PolarHBondContact O-N 3.41Å; A589-C632 HydrophobicContact CB-CB 3.82Å; A589-L635 HydrophobicContact CB-CD1 3.9Å
590	S	96.4	Very high	95.6	Very high	8 Å²	8	24.7 Å²	24.7	6%	0.056	13%	0.125	C	C	.	.	H	α-helix	trans	-60.9	-46.9	176.8	175.1	0	0	0	0	111.7	T542 E543 T586 A592 D593 T594	T542-S590 PolarHBondContact OG1-OG 3.19Å; E543-S590 VanDerWaalsContact CG-OG 3.3Å; E543-S590 WeakPolarHBondContact CG-OG 3.49Å; E543-S590 PolarHBondContact N-OG 3.18Å; T586-S590 PolarHBondContact O-N 2.86Å; S590-A592 VanDerWaalsContact C-N 3.25Å; S590-A592 PolarHBondContact O-N 3.42Å; S590-D593 PolarHBondContact O-N 3.45Å; S590-T594 PolarHBondContact O-N 3.48Å; S590-T594 VanDerWaalsContact O-N 3.07Å; S590-T594 PolarHBondContact O-OG1 3.06Å
591	V	96.4	Very high	95.9	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.006	15%	0.151	C	C	.	.	H	α-helix	trans	-58.8	-36.3	174.6	169.1	0	0	0	0	112.2	T542 L554 L561 S587 A595 F599	T542-V591 HydrophobicContact CG2-CG2 3.87Å; L554-V591 HydrophobicContact CD1-CG1 3.51Å; L561-V591 HydrophobicContact CD1-CG2 4.16Å; S587-V591 WeakPolarHBondContact O-CB 3.44Å; S587-V591 VanDerWaalsContact O-CG2 3.3Å; S587-V591 WeakPolarHBondContact O-CG2 3.32Å; S587-V591 PolarHBondContact O-N 3.32Å; V591-A595 WeakPolarHBondContact O-CB 3.44Å; V591-A595 PolarHBondContact O-N 3.17Å; V591-F599 HydrophobicContact CG1-CE2 4.33Å
592	A	96.7	Very high	96	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-71.6	-46	178.6	0	0	0	0	0	112.4	I588 A589 S590 A595 E596 F599 I636 A639	I588-A592 VanDerWaalsContact O-CB 3.3Å; I588-A592 WeakPolarHBondContact O-CB 3.45Å; I588-A592 PolarHBondContact O-N 3.43Å; A589-A592 WeakPolarHBondContact O-CB 3.29Å; A589-A592 PolarHBondContact O-N 2.93Å; S590-A592 VanDerWaalsContact C-N 3.25Å; S590-A592 PolarHBondContact O-N 3.42Å; A592-A595 PolarHBondContact O-N 3.17Å; A592-E596 PolarHBondContact O-N 3.23Å; A592-E596 VanDerWaalsContact O-N 3.1Å; A592-F599 HydrophobicContact CB-CD1 3.83Å; A592-F599 HydrophobicContact CB-CD2 3.79Å; A592-F599 HydrophobicContact CB-CE1 3.87Å; A592-F599 HydrophobicContact CB-CE2 3.82Å; A592-F599 HydrophobicContact CB-CG 3.78Å; A592-F599 HydrophobicContact CB-CZ 3.86Å; A592-I636 HydrophobicContact CB-CB 4.49Å; A592-I636 HydrophobicContact CB-CG1 3.59Å; A592-A639 WeakPolarHBondContact O-CB 3.5Å
593	D	95.4	Very high	96.2	Very high	69 Å²	69	30.4 Å²	30.4	37%	0.369	16%	0.157	S	C	.	.	H	α-helix	trans	-61.3	-51.8	-179.5	-157.6	56	0	0	0	110.7	A589 S590 A595 E596 L635	A589-D593 PolarHBondContact O-N 3.41Å; S590-D593 PolarHBondContact O-N 3.45Å; D593-A595 VanDerWaalsContact C-N 3.25Å; D593-A595 PolarHBondContact O-N 2.97Å; D593-E596 VanDerWaalsContact O-CG 3.29Å; D593-E596 WeakPolarHBondContact O-CG 3.32Å; D593-E596 PolarHBondContact O-N 3.05Å; D593-E596 VanDerWaalsContact O-N 3.14Å; D593-L635 HydrophobicContact CB-CD2 4.35Å; D593-L635 WeakPolarHBondContact OD1-CD2 3.17Å
594	T	95.1	Very high	96.3	Very high	21 Å²	21	33.1 Å²	33.1	13%	0.129	17%	0.173	C	C	.	.	H	α-helix	trans	-62.4	-27.9	176.5	-56.2	0	0	0	0	113.4	T542 C545 K547 L550 S590	T542-T594 WeakPolarHBondContact O-CG2 3.49Å; T542-T594 PolarHBondContact O-OG1 3.41Å; C545-T594 WeakPolarHBondContact O-CG2 3.48Å; K547-T594 WeakPolarHBondContact CB-O 3.24Å; K547-T594 VanDerWaalsContact CG-O 3.25Å; K547-T594 WeakPolarHBondContact CG-O 3.34Å; L550-T594 HydrophobicContact CD2-CG2 3.65Å; S590-T594 PolarHBondContact O-N 3.48Å; S590-T594 VanDerWaalsContact O-N 3.07Å; S590-T594 PolarHBondContact O-OG1 3.06Å
595	A	96	Very high	96.3	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.008	19%	0.189	C	C	.	.	H	α-helix	trans	-81.3	-21.4	178.1	0	0	0	0	0	114	K547 L554 V591 A592 D593 E597 K598 F599	K547-A595 WeakPolarHBondContact CE-O 3.34Å; L554-A595 HydrophobicContact CD1-CB 4.08Å; L554-A595 HydrophobicContact CD2-CB 3.87Å; V591-A595 WeakPolarHBondContact O-CB 3.44Å; V591-A595 PolarHBondContact O-N 3.17Å; A592-A595 PolarHBondContact O-N 3.17Å; D593-A595 VanDerWaalsContact C-N 3.25Å; D593-A595 PolarHBondContact O-N 2.97Å; A595-E597 PolarHBondContact O-N 3.32Å; A595-K598 HydrophobicContact CB-CB 4.42Å; A595-K598 VanDerWaalsContact O-CB 3.23Å; A595-K598 WeakPolarHBondContact O-CB 3.39Å; A595-K598 WeakPolarHBondContact O-CG 3.47Å; A595-K598 PolarHBondContact O-N 3.44Å; A595-F599 HydrophobicContact CB-CB 4.13Å; A595-F599 HydrophobicContact CB-CD2 4.33Å
596	E	95.9	Very high	96.3	Very high	99 Å²	99	36.1 Å²	36.1	46%	0.463	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	44.6	-125.7	-176.6	-55.8	179.6	116.4	0	0	112	K547 A592 D593 K598 F599 A639	K547-E596 HydrophobicContact CD-CB 4.5Å; K547-E596 HydrophobicContact CD-CG 4.36Å; K547-E596 VanDerWaalsContact CD-OE2 3.27Å; K547-E596 WeakPolarHBondContact CD-OE2 3.39Å; K547-E596 WeakPolarHBondContact CE-OE2 3.34Å; K547-E596 IonicContact NZ-OE2 2.84Å; K547-E596 PolarHBondContact NZ-OE2 3.49Å; A592-E596 PolarHBondContact O-N 3.23Å; A592-E596 VanDerWaalsContact O-N 3.1Å; D593-E596 VanDerWaalsContact O-CG 3.29Å; D593-E596 WeakPolarHBondContact O-CG 3.32Å; D593-E596 PolarHBondContact O-N 3.05Å; D593-E596 VanDerWaalsContact O-N 3.14Å; E596-K598 PolarHBondContact O-N 2.9Å; E596-F599 WeakPolarHBondContact O-CB 3.36Å; E596-F599 PolarHBondContact O-N 2.96Å; E596-A639 CarbonylContact C-O 3.05Å; E596-A639 CarbonylContact O-C 3.56Å
597	E	95.7	Very high	96.3	Very high	88 Å²	88	35.1 Å²	35.1	41%	0.411	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-65.3	-11.1	-176.7	83.6	-64.8	155.9	0	0	113.8	K547 A595 F599 V600 A639	K547-E597 VanDerWaalsContact NZ-CD 3.34Å; K547-E597 IonicContact NZ-OE1 2.76Å; K547-E597 PolarHBondContact NZ-OE1 2.78Å; K547-E597 IonicContact NZ-OE2 3.15Å; K547-E597 PolarHBondContact NZ-OE2 3.24Å; A595-E597 PolarHBondContact O-N 3.32Å; E597-F599 VanDerWaalsContact C-N 3.25Å; E597-V600 VanDerWaalsContact O-CG2 3.27Å; E597-V600 WeakPolarHBondContact O-CG2 3.16Å; E597-A639 PolarHBondContact N-O 2.72Å
598	K	97.1	Very high	96.2	Very high	89 Å²	89	38.7 Å²	38.7	39%	0.387	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-76.3	-13.8	173.1	-52.6	-56.5	-169.8	-128.4	0	112.5	I551 L554 A595 E596 P601	I551-K598 HydrophobicContact CD1-CD 4.46Å; I551-K598 HydrophobicContact CD1-CG 3.81Å; I551-K598 HydrophobicContact CG1-CB 4.36Å; I551-K598 HydrophobicContact CG1-CG 3.93Å; L554-K598 HydrophobicContact CD2-CB 3.98Å; A595-K598 HydrophobicContact CB-CB 4.42Å; A595-K598 VanDerWaalsContact O-CB 3.23Å; A595-K598 WeakPolarHBondContact O-CB 3.39Å; A595-K598 WeakPolarHBondContact O-CG 3.47Å; A595-K598 PolarHBondContact O-N 3.44Å; E596-K598 PolarHBondContact O-N 2.9Å; K598-P601 VanDerWaalsContact O-CD 3.27Å; K598-P601 WeakPolarHBondContact O-CD 3.42Å
599	F	97.7	Very high	96	Very high	1 Å²	1	39.8 Å²	39.8	0%	0.004	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-79.7	-16.6	175.5	-156.4	-99.3	0	0	0	113.8	L554 V558 I588 V591 A592 A595 E596 E597 P601 Y602 Y603 F606 I636 V640	L554-F599 HydrophobicContact CD1-CD2 4.44Å; V558-F599 HydrophobicContact CG2-CE2 3.89Å; I588-F599 HydrophobicContact CG2-CZ 4.32Å; V591-F599 HydrophobicContact CG1-CE2 4.33Å; A592-F599 HydrophobicContact CB-CD1 3.83Å; A592-F599 HydrophobicContact CB-CD2 3.79Å; A592-F599 HydrophobicContact CB-CE1 3.87Å; A592-F599 HydrophobicContact CB-CE2 3.82Å; A592-F599 HydrophobicContact CB-CG 3.78Å; A592-F599 HydrophobicContact CB-CZ 3.86Å; A595-F599 HydrophobicContact CB-CB 4.13Å; A595-F599 HydrophobicContact CB-CD2 4.33Å; E596-F599 WeakPolarHBondContact O-CB 3.36Å; E596-F599 PolarHBondContact O-N 2.96Å; E597-F599 VanDerWaalsContact C-N 3.25Å; F599-P601 VanDerWaalsContact C-N 3.34Å; F599-P601 VanDerWaalsContact O-N 3.13Å; F599-Y602 HydrophobicContact CD2-CD2 4.27Å; F599-Y602 PolarHBondContact O-N 3.31Å; F599-Y603 PolarHBondContact O-N 3.35Å; F599-F606 HydrophobicContact CE1-CD2 4.14Å; F599-F606 HydrophobicContact CE2-CE2 4.38Å; F599-F606 AromaticContact CZ-CD2 3.68Å; F599-F606 HydrophobicContact CZ-CD2 3.68Å; F599-F606 AromaticContact CZ-CE2 3.69Å; F599-F606 HydrophobicContact CZ-CE2 3.69Å; F599-I636 HydrophobicContact CD1-CG1 4.35Å; F599-I636 HydrophobicContact CD1-CG2 4.16Å; F599-I636 HydrophobicContact CE1-CD1 4.06Å; F599-I636 HydrophobicContact CE1-CG1 3.81Å; F599-I636 HydrophobicContact CE1-CG2 4.04Å; F599-I636 HydrophobicContact CZ-CG1 4.44Å; F599-V640 HydrophobicContact CB-CG1 4.39Å; F599-V640 HydrophobicContact CD1-CG1 4.3Å
600	V	97.3	Very high	96	Very high	52 Å²	52	39.8 Å²	39.8	32%	0.315	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-46.5	-42.2	-178.2	173	0	0	0	0	114.8	E597 Y602 V640 K644	E597-V600 VanDerWaalsContact O-CG2 3.27Å; E597-V600 WeakPolarHBondContact O-CG2 3.16Å; V600-Y602 PolarHBondContact O-N 3.21Å; V600-V640 HydrophobicContact CG2-CB 3.85Å; V600-V640 HydrophobicContact CG2-CG1 4.04Å; V600-K644 HydrophobicContact CG1-CG 4.29Å
601	P	97.3	Very high	95.8	Very high	94 Å²	94	41.2 Å²	41.2	61%	0.61	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-66.1	-22.3	179.2	-21.2	35.1	0	0	0	114.6	K598 F599	K598-P601 VanDerWaalsContact O-CD 3.27Å; K598-P601 WeakPolarHBondContact O-CD 3.42Å; F599-P601 VanDerWaalsContact C-N 3.34Å; F599-P601 VanDerWaalsContact O-N 3.13Å
602	Y	97.2	Very high	95.5	Very high	43 Å²	43	44.9 Å²	44.9	17%	0.169	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-100.7	-9.1	-174.1	-47.4	-71.9	0	0	0	113.2	L554 D555 V558 F599 V600 D604 L605	L554-Y602 HydrophobicContact CD2-CD2 4.38Å; L554-Y602 HydrophobicContact CD2-CE2 3.64Å; L554-Y602 HydrophobicContact CG-CD2 4.37Å; L554-Y602 HydrophobicContact CG-CE2 3.66Å; D555-Y602 HydrophobicContact CB-CE1 4.46Å; V558-Y602 HydrophobicContact CB-CD1 4.13Å; V558-Y602 HydrophobicContact CB-CE1 4.43Å; V558-Y602 HydrophobicContact CB-CG 4.34Å; V558-Y602 HydrophobicContact CG1-CD1 3.51Å; V558-Y602 HydrophobicContact CG1-CE1 4.19Å; V558-Y602 HydrophobicContact CG1-CG 3.83Å; V558-Y602 HydrophobicContact CG2-CD1 4.27Å; V558-Y602 HydrophobicContact CG2-CD2 4.17Å; V558-Y602 HydrophobicContact CG2-CG 3.99Å; F599-Y602 HydrophobicContact CD2-CD2 4.27Å; F599-Y602 PolarHBondContact O-N 3.31Å; V600-Y602 PolarHBondContact O-N 3.21Å; Y602-D604 VanDerWaalsContact C-N 3.3Å; Y602-D604 PolarHBondContact O-N 2.94Å; Y602-L605 WeakPolarHBondContact O-CB 3.39Å; Y602-L605 PolarHBondContact O-N 3.27Å
603	Y	96.6	Very high	95.2	Very high	2 Å²	2	45 Å²	45	1%	0.008	24%	0.236	C	C	.	.	H	α-helix	trans	-48.4	-49	179.8	-178.7	-87.6	0	0	0	113.5	F599 L605 F606 M607 I636 V640 K644 F645 D648	F599-Y603 PolarHBondContact O-N 3.35Å; Y603-L605 PolarHBondContact O-N 3.45Å; Y603-F606 PolarHBondContact O-N 3.42Å; Y603-M607 HydrophobicContact CD1-CB 4.24Å; Y603-M607 HydrophobicContact CD2-CE 4.37Å; Y603-M607 HydrophobicContact CE1-CB 3.92Å; Y603-M607 HydrophobicContact CE1-CG 3.91Å; Y603-M607 HydrophobicContact CE2-CE 3.6Å; Y603-M607 HydrophobicContact CE2-CG 4.44Å; Y603-M607 WeakPolarHBondContact O-CB 3.29Å; Y603-M607 PolarHBondContact O-N 2.94Å; Y603-I636 HydrophobicContact CD2-CG2 3.54Å; Y603-I636 HydrophobicContact CE2-CG2 3.87Å; Y603-V640 HydrophobicContact CD2-CB 4.34Å; Y603-V640 HydrophobicContact CD2-CG1 3.89Å; Y603-V640 HydrophobicContact CD2-CG2 3.78Å; Y603-V640 HydrophobicContact CE2-CG2 3.88Å; Y603-K644 HydrophobicContact CD1-CD 4.3Å; Y603-K644 VanDerWaalsContact CD1-CE 3.47Å; Y603-K644 HydrophobicContact CD1-CG 4.46Å; Y603-K644 HydrophobicContact CD2-CG 4.29Å; Y603-K644 HydrophobicContact CG-CD 4.39Å; Y603-K644 HydrophobicContact CG-CG 4.15Å; Y603-F645 HydrophobicContact CE2-CD2 4.07Å; Y603-F645 WeakPolarHBondContact OH-CD2 3.39Å; Y603-D648 WeakPolarHBondContact OH-CB 3.4Å; Y603-D648 PolarHBondContact OH-OD2 3.37Å
604	D	95.6	Very high	94.9	Very high	102 Å²	102	41.8 Å²	41.8	55%	0.545	22%	0.219	S	C	.	.	H	α-helix	trans	-71.3	-11.7	-175.3	-55.5	-55.9	0	0	0	112.9	Y602 K644	Y602-D604 VanDerWaalsContact C-N 3.3Å; Y602-D604 PolarHBondContact O-N 2.94Å; D604-K644 IonicContact OD1-NZ 2.75Å; D604-K644 PolarHBondContact OD1-NZ 3.02Å; D604-K644 IonicContact OD2-NZ 2.65Å; D604-K644 PolarHBondContact OD2-NZ 2.7Å
605	L	95.8	Very high	94.5	Very high	63 Å²	63	45.6 Å²	45.6	33%	0.33	24%	0.236	S	C	.	.	H	α-helix	trans	-79.7	-39.2	176.3	-171.5	65.5	0	0	0	111.9	V558 H562 Y602 Y603	V558-L605 HydrophobicContact CG1-CD2 3.65Å; H562-L605 HydrophobicContact CB-CD2 3.82Å; H562-L605 HydrophobicContact CB-CG 4.18Å; Y602-L605 WeakPolarHBondContact O-CB 3.39Å; Y602-L605 PolarHBondContact O-N 3.27Å; Y603-L605 PolarHBondContact O-N 3.45Å
606	F	96.2	Very high	94	Very high	1 Å²	1	49.9 Å²	49.9	0%	0.004	26%	0.258	C	S	.	.	H	α-helix	trans	-99.9	-42.4	-174.2	-64.8	-76.7	0	0	0	113.7	V558 H562 M565 I588 F599 Y603 P608 S609 L610 I636	V558-F606 HydrophobicContact CB-CE2 4.32Å; V558-F606 HydrophobicContact CB-CZ 4.38Å; V558-F606 HydrophobicContact CG1-CE2 3.58Å; V558-F606 HydrophobicContact CG1-CZ 3.81Å; V558-F606 HydrophobicContact CG2-CE2 4.14Å; V558-F606 HydrophobicContact CG2-CZ 4.46Å; H562-F606 HydrophobicContact CB-CE1 3.73Å; H562-F606 HydrophobicContact CB-CZ 3.96Å; M565-F606 HydrophobicContact CE-CD1 3.72Å; M565-F606 HydrophobicContact CE-CE1 4.32Å; M565-F606 HydrophobicContact SD-CD1 3.95Å; I588-F606 HydrophobicContact CD1-CD1 3.77Å; I588-F606 HydrophobicContact CD1-CE1 3.48Å; I588-F606 VanDerWaalsContact CD1-CE1 3.48Å; I588-F606 HydrophobicContact CD1-CZ 4.39Å; I588-F606 HydrophobicContact CG1-CD1 4.31Å; I588-F606 HydrophobicContact CG1-CE1 3.78Å; I588-F606 HydrophobicContact CG1-CZ 4.21Å; I588-F606 HydrophobicContact CG2-CD1 3.97Å; I588-F606 HydrophobicContact CG2-CD2 4.29Å; I588-F606 HydrophobicContact CG2-CE1 4.03Å; I588-F606 HydrophobicContact CG2-CE2 4.33Å; I588-F606 HydrophobicContact CG2-CG 4.1Å; I588-F606 HydrophobicContact CG2-CZ 4.2Å; F599-F606 HydrophobicContact CE1-CD2 4.14Å; F599-F606 HydrophobicContact CE2-CE2 4.38Å; F599-F606 AromaticContact CZ-CD2 3.68Å; F599-F606 HydrophobicContact CZ-CD2 3.68Å; F599-F606 AromaticContact CZ-CE2 3.69Å; F599-F606 HydrophobicContact CZ-CE2 3.69Å; Y603-F606 PolarHBondContact O-N 3.42Å; F606-P608 VanDerWaalsContact C-CD 3.44Å; F606-P608 VanDerWaalsContact C-N 3.35Å; F606-P608 VanDerWaalsContact O-N 3.17Å; F606-S609 PolarHBondContact O-N 3.46Å; F606-L610 HydrophobicContact CB-CD1 3.96Å; F606-L610 HydrophobicContact CB-CG 4.43Å; F606-L610 WeakPolarHBondContact O-CG 3.38Å; F606-L610 PolarHBondContact O-N 2.89Å; F606-I636 HydrophobicContact CB-CD1 4.41Å
607	M	95.1	Very high	93.5	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-54.7	-38.4	-169.1	-170.9	55.6	64.7	0	0	114.6	Y603 K611 I633 I636 F645 D648	Y603-M607 HydrophobicContact CD1-CB 4.24Å; Y603-M607 HydrophobicContact CD2-CE 4.37Å; Y603-M607 HydrophobicContact CE1-CB 3.92Å; Y603-M607 HydrophobicContact CE1-CG 3.91Å; Y603-M607 HydrophobicContact CE2-CE 3.6Å; Y603-M607 HydrophobicContact CE2-CG 4.44Å; Y603-M607 WeakPolarHBondContact O-CB 3.29Å; Y603-M607 PolarHBondContact O-N 2.94Å; M607-K611 HydrophobicContact CG-CD 4.47Å; M607-K611 VanDerWaalsContact O-CE 3.32Å; M607-K611 WeakPolarHBondContact O-CE 3.36Å; M607-K611 WeakPolarHBondContact O-CG 3.33Å; M607-K611 PolarHBondContact O-N 2.97Å; M607-K611 VanDerWaalsContact O-N 3.14Å; M607-K611 HydrophobicContact SD-CD 4.47Å; M607-K611 HydrophobicContact SD-CG 4.25Å; M607-I633 HydrophobicContact CE-CB 4.48Å; M607-I633 HydrophobicContact CE-CG2 4.01Å; M607-I633 HydrophobicContact SD-CG1 4.14Å; M607-I633 HydrophobicContact SD-CG2 3.92Å; M607-I636 HydrophobicContact CE-CB 4.33Å; M607-I636 HydrophobicContact CE-CG2 3.86Å; M607-F645 HydrophobicContact CE-CE2 4.27Å; M607-D648 HydrophobicContact CG-CB 4.5Å
608	P	93.2	Very high	92.9	Very high	75 Å²	75	45.2 Å²	45.2	49%	0.487	24%	0.242	S	C	.	.	H	α-helix	trans	-63.4	-42	174.9	-22.6	35	0	0	0	113.6	F606 H612	F606-P608 VanDerWaalsContact C-CD 3.44Å; F606-P608 VanDerWaalsContact C-N 3.35Å; F606-P608 VanDerWaalsContact O-N 3.17Å; P608-H612 PolarHBondContact O-N 3.47Å; P608-H612 VanDerWaalsContact O-N 3.15Å
609	S	94.1	Very high	92.2	Very high	25 Å²	25	46.1 Å²	46.1	18%	0.175	25%	0.248	C	C	.	.	H	α-helix	trans	-70.7	-40.8	-179.3	-58.5	0	0	0	0	112	F606 H612 I613	F606-S609 PolarHBondContact O-N 3.46Å; S609-H612 WeakPolarHBondContact O-CB 3.33Å; S609-H612 PolarHBondContact O-N 3.21Å; S609-I613 WeakPolarHBondContact O-CG1 3.34Å; S609-I613 PolarHBondContact O-N 3.49Å
610	L	94.9	Very high	91.5	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.2	-44.6	177.5	-63.9	170	0	0	0	111.4	M565 V585 F606 H612 I613 V614 T629 C632 I633 I636	M565-L610 HydrophobicContact SD-CD2 4.19Å; V585-L610 HydrophobicContact CG1-CD2 4.36Å; V585-L610 HydrophobicContact CG2-CD2 4.26Å; F606-L610 HydrophobicContact CB-CD1 3.96Å; F606-L610 HydrophobicContact CB-CG 4.43Å; F606-L610 WeakPolarHBondContact O-CG 3.38Å; F606-L610 PolarHBondContact O-N 2.89Å; L610-H612 VanDerWaalsContact C-N 3.3Å; L610-H612 PolarHBondContact O-N 3.16Å; L610-I613 PolarHBondContact O-N 3.18Å; L610-I613 VanDerWaalsContact O-N 3.17Å; L610-V614 PolarHBondContact O-N 3.08Å; L610-V614 VanDerWaalsContact O-N 3.1Å; L610-T629 HydrophobicContact CB-CG2 4.01Å; L610-T629 HydrophobicContact CD2-CG2 3.89Å; L610-T629 WeakPolarHBondContact O-CG2 3.44Å; L610-C632 HydrophobicContact CD2-CB 4.49Å; L610-I633 HydrophobicContact CB-CD1 3.89Å; L610-I633 HydrophobicContact CB-CG1 3.62Å; L610-I633 HydrophobicContact CD1-CG1 4.12Å; L610-I633 HydrophobicContact CG-CG1 4.47Å; L610-I636 HydrophobicContact CD1-CD1 3.52Å
611	K	91.9	Very high	90.9	Very high	38 Å²	38	55 Å²	55	17%	0.165	29%	0.285	C	S	.	.	H	α-helix	trans	-58.9	-41.5	173	-73.1	-178.5	-61.8	-179.4	0	111.9	M607 I613 V614 E615 I633 D648 V652 L655	M607-K611 HydrophobicContact CG-CD 4.47Å; M607-K611 VanDerWaalsContact O-CE 3.32Å; M607-K611 WeakPolarHBondContact O-CE 3.36Å; M607-K611 WeakPolarHBondContact O-CG 3.33Å; M607-K611 PolarHBondContact O-N 2.97Å; M607-K611 VanDerWaalsContact O-N 3.14Å; M607-K611 HydrophobicContact SD-CD 4.47Å; M607-K611 HydrophobicContact SD-CG 4.25Å; K611-I613 VanDerWaalsContact C-N 3.32Å; K611-I613 PolarHBondContact O-N 2.95Å; K611-V614 PolarHBondContact O-N 3.08Å; K611-E615 WeakPolarHBondContact O-CG 3.46Å; K611-E615 PolarHBondContact O-N 3.35Å; K611-I633 HydrophobicContact CG-CD1 4.44Å; K611-D648 IonicContact NZ-OD1 3.94Å; K611-D648 PolarHBondContact NZ-OD1 3.32Å; K611-D648 IonicContact NZ-OD2 2.84Å; K611-V652 HydrophobicContact CD-CG2 4.3Å; K611-V652 HydrophobicContact CG-CG2 4.42Å; K611-L655 HydrophobicContact CB-CD1 4.23Å; K611-L655 HydrophobicContact CG-CD1 4.2Å
612	H	90.8	Very high	90.5	Very high	78 Å²	78	51.2 Å²	51.2	36%	0.361	26%	0.259	S	S	.	.	H	α-helix	trans	-61.5	-38.5	176.6	-173	65.7	0	0	0	112.5	P608 S609 L610 E615 N616	P608-H612 PolarHBondContact O-N 3.47Å; P608-H612 VanDerWaalsContact O-N 3.15Å; S609-H612 WeakPolarHBondContact O-CB 3.33Å; S609-H612 PolarHBondContact O-N 3.21Å; L610-H612 VanDerWaalsContact C-N 3.3Å; L610-H612 PolarHBondContact O-N 3.16Å; H612-E615 PolarHBondContact O-N 3.28Å; H612-N616 PolarHBondContact CE1-ND2 3.25Å; H612-N616 VanDerWaalsContact CE1-ND2 3.27Å; H612-N616 PolarHBondContact ND1-ND2 3.32Å; H612-N616 PolarHBondContact O-N 2.87Å; H612-N616 PolarHBondContact O-ND2 3.41Å
613	I	91.1	Very high	90	Very high	3 Å²	3	51.5 Å²	51.5	2%	0.015	26%	0.26	C	S	.	.	H	α-helix	trans	-62	-50.9	173.5	-68.2	161.7	0	0	0	110.4	L569 L581 S609 L610 K611 E615 N616 A617 L625 T629	L569-I613 HydrophobicContact CD1-CD1 4.31Å; L569-I613 HydrophobicContact CD1-CG1 3.67Å; L569-I613 HydrophobicContact CD2-CD1 4.49Å; L569-I613 HydrophobicContact CD2-CG1 4.27Å; L581-I613 HydrophobicContact CD2-CD1 4.36Å; S609-I613 WeakPolarHBondContact O-CG1 3.34Å; S609-I613 PolarHBondContact O-N 3.49Å; L610-I613 PolarHBondContact O-N 3.18Å; L610-I613 VanDerWaalsContact O-N 3.17Å; K611-I613 VanDerWaalsContact C-N 3.32Å; K611-I613 PolarHBondContact O-N 2.95Å; I613-E615 PolarHBondContact O-N 2.97Å; I613-N616 PolarHBondContact O-N 3.08Å; I613-N616 VanDerWaalsContact O-N 3.09Å; I613-A617 HydrophobicContact CG2-CB 4.32Å; I613-A617 VanDerWaalsContact O-CB 3.23Å; I613-A617 WeakPolarHBondContact O-CB 3.45Å; I613-A617 PolarHBondContact O-N 3.43Å; I613-L625 HydrophobicContact CG2-CD1 4.44Å; I613-L625 HydrophobicContact CG2-CD2 4.34Å; I613-L625 HydrophobicContact CG2-CG 4.15Å; I613-T629 HydrophobicContact CB-CG2 3.97Å; I613-T629 HydrophobicContact CG2-CG2 3.9Å; I613-T629 WeakPolarHBondContact CG2-OG1 3.42Å
614	V	88.9	Confident	89.6	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.012	27%	0.274	C	S	.	.	H	α-helix	trans	-62.2	-30.2	-179.4	179.5	0	0	0	0	113.3	L610 K611 R626 T629 I630 I633 L655	L610-V614 PolarHBondContact O-N 3.08Å; L610-V614 VanDerWaalsContact O-N 3.1Å; K611-V614 PolarHBondContact O-N 3.08Å; V614-R626 HydrophobicContact CG1-CG 4.33Å; V614-R626 PolarHBondContact O-NE 3.36Å; V614-R626 PolarHBondContact O-NH2 3.32Å; V614-T629 HydrophobicContact CG2-CG2 3.57Å; V614-I630 HydrophobicContact CG1-CD1 4.3Å; V614-I630 HydrophobicContact CG1-CG1 4.06Å; V614-I630 HydrophobicContact CG2-CG1 3.97Å; V614-I633 HydrophobicContact CG2-CD1 3.81Å; V614-L655 HydrophobicContact CG1-CB 4.14Å
615	E	87.3	Confident	89.4	Confident	101 Å²	101	49.4 Å²	49.4	47%	0.472	25%	0.248	S	C	.	.	H	α-helix	trans	-71	-29.9	175.5	-78.2	175.6	176.1	0	0	114	K611 H612 I613 L655	K611-E615 WeakPolarHBondContact O-CG 3.46Å; K611-E615 PolarHBondContact O-N 3.35Å; H612-E615 PolarHBondContact O-N 3.28Å; I613-E615 PolarHBondContact O-N 2.97Å; E615-L655 HydrophobicContact CG-CD1 4.23Å; E615-L655 HydrophobicContact CG-CD2 3.49Å; E615-L655 VanDerWaalsContact CG-CD2 3.49Å
616	N	84.6	Confident	89.1	Confident	91 Å²	91	47 Å²	47	49%	0.487	24%	0.235	S	C	.	.	H	α-helix	trans	-112.6	-24.8	-170	-68.1	-89.6	0	0	0	113.8	H612 I613 V618	H612-N616 PolarHBondContact CE1-ND2 3.25Å; H612-N616 VanDerWaalsContact CE1-ND2 3.27Å; H612-N616 PolarHBondContact ND1-ND2 3.32Å; H612-N616 PolarHBondContact O-N 2.87Å; H612-N616 PolarHBondContact O-ND2 3.41Å; I613-N616 PolarHBondContact O-N 3.08Å; I613-N616 VanDerWaalsContact O-N 3.09Å; N616-V618 PolarHBondContact O-N 3.01Å
617	A	85.4	Confident	88.8	Confident	2 Å²	2	47 Å²	47	2%	0.017	24%	0.235	C	C	.	.			trans	-76.7	63.9	176	0	0	0	0	0	112	I613 L622 R626	I613-A617 HydrophobicContact CG2-CB 4.32Å; I613-A617 VanDerWaalsContact O-CB 3.23Å; I613-A617 WeakPolarHBondContact O-CB 3.45Å; I613-A617 PolarHBondContact O-N 3.43Å; A617-L622 HydrophobicContact CB-CB 4Å; A617-L622 HydrophobicContact CB-CD1 4.24Å; A617-R626 HydrophobicContact CB-CB 4.04Å; A617-R626 HydrophobicContact CB-CG 4.25Å; A617-R626 WeakPolarHBondContact O-CD 3.43Å; A617-R626 PolarHBondContact O-NE 3.06Å
618	V	82	Confident	88.7	Confident	86 Å²	86	47.9 Å²	47.9	52%	0.521	24%	0.239	S	C	.	.			trans	-102	-2.2	-176.3	-60.4	0	0	0	0	114.3	N616	N616-V618 PolarHBondContact O-N 3.01Å
619	Q	84.1	Confident	88.8	Confident	108 Å²	108	44.3 Å²	44.3	51%	0.505	22%	0.215	S	C	.	.	S	Bend	trans	-83.4	153	-177.2	-66.1	153.3	-14.3	0	0	110.5	E621 L622 R623	Q619-E621 WeakPolarHBondContact CB-OE2 3.44Å; Q619-E621 PolarHBondContact O-N 2.87Å; Q619-L622 HydrophobicContact CB-CG 4.32Å; Q619-L622 PolarHBondContact O-N 3.26Å; Q619-L622 VanDerWaalsContact O-N 3.11Å; Q619-R623 PolarHBondContact O-N 3.23Å
620	K	82.4	Confident	88.7	Confident	116 Å²	116	43.3 Å²	43.3	50%	0.504	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-61.5	-37	-175.8	-176.5	162.7	179.8	170.4	0	110.9	L622 R623 E667	K620-L622 VanDerWaalsContact C-N 3.26Å; K620-L622 PolarHBondContact O-N 2.92Å; K620-R623 VanDerWaalsContact O-CB 3.3Å; K620-R623 WeakPolarHBondContact O-CB 3.49Å; K620-R623 VanDerWaalsContact O-CG 3.29Å; K620-R623 WeakPolarHBondContact O-CG 3.43Å; K620-R623 PolarHBondContact O-N 3.02Å; K620-E667 IonicContact NZ-OE1 2.77Å; K620-E667 IonicContact NZ-OE2 3.67Å; K620-E667 PolarHBondContact NZ-OE2 2.97Å
621	E	84.4	Confident	88.6	Confident	125 Å²	125	44.8 Å²	44.8	58%	0.584	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-71.1	-18	-179.1	-50	75.9	-168.1	0	0	113	K578 Q619	K578-E621 WeakPolarHBondContact CD-O 3.21Å; K578-E621 VanDerWaalsContact CE-O 3.22Å; K578-E621 WeakPolarHBondContact CE-O 3.4Å; Q619-E621 WeakPolarHBondContact CB-OE2 3.44Å; Q619-E621 PolarHBondContact O-N 2.87Å
622	L	88.4	Confident	88.8	Confident	13 Å²	13	43 Å²	43	7%	0.068	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-103.9	10.9	177.2	-57.9	-173.5	0	0	0	112.6	L572 K578 A617 Q619 K620 L624 L625 R626	L572-L622 HydrophobicContact CD1-CD1 4.24Å; L572-L622 HydrophobicContact CD1-CD2 3.75Å; K578-L622 HydrophobicContact CB-CD2 4.14Å; K578-L622 HydrophobicContact CD-CD2 4.05Å; A617-L622 HydrophobicContact CB-CB 4Å; A617-L622 HydrophobicContact CB-CD1 4.24Å; Q619-L622 HydrophobicContact CB-CG 4.32Å; Q619-L622 PolarHBondContact O-N 3.26Å; Q619-L622 VanDerWaalsContact O-N 3.11Å; K620-L622 VanDerWaalsContact C-N 3.26Å; K620-L622 PolarHBondContact O-N 2.92Å; L622-L624 PolarHBondContact O-N 3.08Å; L622-L625 HydrophobicContact CD2-CD2 4.48Å; L622-R626 PolarHBondContact O-N 2.91Å
623	R	86.3	Confident	89.1	Confident	50 Å²	50	39.5 Å²	39.5	19%	0.189	19%	0.191	C	C	.	.	H	α-helix	trans	-62.9	-45.1	-173.5	-82.1	-176.4	-177.7	168.2	-1.7	112.3	Q619 K620 R626 G627 D670 Q672	Q619-R623 PolarHBondContact O-N 3.23Å; K620-R623 VanDerWaalsContact O-CB 3.3Å; K620-R623 WeakPolarHBondContact O-CB 3.49Å; K620-R623 VanDerWaalsContact O-CG 3.29Å; K620-R623 WeakPolarHBondContact O-CG 3.43Å; K620-R623 PolarHBondContact O-N 3.02Å; R623-R626 WeakPolarHBondContact O-CB 3.26Å; R623-R626 PolarHBondContact O-N 2.68Å; R623-G627 PolarHBondContact O-N 3.06Å; R623-D670 WeakPolarHBondContact CD-OD2 3.36Å; R623-D670 IonicContact CZ-OD2 3.11Å; R623-D670 VanDerWaalsContact CZ-OD2 3.22Å; R623-D670 IonicContact NE-OD2 2.61Å; R623-D670 PolarHBondContact NE-OD2 3.47Å; R623-D670 IonicContact NH1-OD2 2.58Å; R623-D670 PolarHBondContact NH1-OD2 3.43Å; R623-Q672 HydrophobicContact CB-CG 3.88Å; R623-Q672 HydrophobicContact CG-CG 4.27Å; R623-Q672 WeakPolarHBondContact O-CG 3.46Å; R623-Q672 PolarHBondContact O-NE2 3.15Å
624	L	88.2	Confident	89.2	Confident	60 Å²	60	39.3 Å²	39.3	31%	0.314	19%	0.19	S	C	.	.	H	α-helix	trans	-61.2	-51.6	178.2	-176.6	56.5	0	0	0	112.2	E582 L622 R626 G627 K628 Y675	E582-L624 VanDerWaalsContact OE2-CD2 3.29Å; E582-L624 WeakPolarHBondContact OE2-CD2 3.32Å; E582-L624 WeakPolarHBondContact OE2-CG 3.41Å; L622-L624 PolarHBondContact O-N 3.08Å; L624-R626 VanDerWaalsContact C-N 3.27Å; L624-R626 PolarHBondContact O-N 3.36Å; L624-G627 WeakPolarHBondContact O-CA 3.26Å; L624-G627 PolarHBondContact O-N 2.94Å; L624-K628 HydrophobicContact CD1-CD 4.39Å; L624-K628 HydrophobicContact CD1-CG 4.45Å; L624-K628 HydrophobicContact CG-CD 4.25Å; L624-K628 PolarHBondContact O-N 2.94Å; L624-Y675 HydrophobicContact CD1-CE2 3.65Å
625	L	91.7	Very high	89.5	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-49.2	-45.8	171.7	174.1	62.3	0	0	0	112.8	L572 L581 E582 I613 L622 T629	L572-L625 HydrophobicContact CD1-CD2 4.42Å; L572-L625 HydrophobicContact CD2-CD2 3.69Å; L581-L625 HydrophobicContact CB-CD1 4.41Å; L581-L625 HydrophobicContact CD2-CD1 4.07Å; L581-L625 HydrophobicContact CD2-CD2 4.01Å; L581-L625 HydrophobicContact CG-CD1 3.92Å; E582-L625 HydrophobicContact CG-CB 3.78Å; E582-L625 HydrophobicContact CG-CD1 3.85Å; E582-L625 HydrophobicContact CG-CG 4.37Å; E582-L625 PolarHBondContact OE1-N 2.94Å; I613-L625 HydrophobicContact CG2-CD1 4.44Å; I613-L625 HydrophobicContact CG2-CD2 4.34Å; I613-L625 HydrophobicContact CG2-CG 4.15Å; L622-L625 HydrophobicContact CD2-CD2 4.48Å; L625-T629 WeakPolarHBondContact O-CB 3.36Å; L625-T629 PolarHBondContact O-N 3.41Å; L625-T629 PolarHBondContact O-OG1 3.38Å
626	R	90.1	Very high	90	Very high	13 Å²	13	35.3 Å²	35.3	5%	0.049	17%	0.172	C	C	.	.	H	α-helix	trans	-64.5	-41	178.9	-161.8	-163.8	-156.5	-179	-1.5	111.7	V614 A617 L622 R623 L624 T629 I630 T659	V614-R626 HydrophobicContact CG1-CG 4.33Å; V614-R626 PolarHBondContact O-NE 3.36Å; V614-R626 PolarHBondContact O-NH2 3.32Å; A617-R626 HydrophobicContact CB-CB 4.04Å; A617-R626 HydrophobicContact CB-CG 4.25Å; A617-R626 WeakPolarHBondContact O-CD 3.43Å; A617-R626 PolarHBondContact O-NE 3.06Å; L622-R626 PolarHBondContact O-N 2.91Å; R623-R626 WeakPolarHBondContact O-CB 3.26Å; R623-R626 PolarHBondContact O-N 2.68Å; L624-R626 VanDerWaalsContact C-N 3.27Å; L624-R626 PolarHBondContact O-N 3.36Å; R626-T629 PolarHBondContact O-N 3.03Å; R626-I630 HydrophobicContact CG-CD1 4.32Å; R626-I630 WeakPolarHBondContact O-CB 3.39Å; R626-I630 WeakPolarHBondContact O-CG1 3.44Å; R626-I630 PolarHBondContact O-N 2.96Å; R626-T659 VanDerWaalsContact NH1-CG2 3.33Å; R626-T659 PolarHBondContact NH1-OG1 3.11Å; R626-T659 PolarHBondContact NH2-OG1 3.06Å
627	G	90	Very high	90.5	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-59.8	-54.9	174.7	0	0	0	0	0	112.4	R623 L624 T629 I630 E631	R623-G627 PolarHBondContact O-N 3.06Å; L624-G627 WeakPolarHBondContact O-CA 3.26Å; L624-G627 PolarHBondContact O-N 2.94Å; G627-T629 PolarHBondContact O-N 3.19Å; G627-I630 WeakPolarHBondContact O-CB 3.5Å; G627-I630 PolarHBondContact O-N 3.49Å; G627-E631 PolarHBondContact O-N 2.93Å
628	K	93.4	Very high	90.9	Very high	20 Å²	20	33 Å²	33	9%	0.087	16%	0.159	C	C	.	.	H	α-helix	trans	-55.6	-36.1	174.3	-69.2	173.9	178.4	170.2	0	112.6	E582 V585 L624 C632 Y675	E582-K628 HydrophobicContact CB-CD 3.86Å; E582-K628 HydrophobicContact CG-CD 4.34Å; E582-K628 IonicContact OE2-NZ 3.41Å; E582-K628 PolarHBondContact OE2-NZ 3.2Å; V585-K628 HydrophobicContact CG1-CB 4.41Å; V585-K628 WeakPolarHBondContact CG1-O 3.28Å; L624-K628 HydrophobicContact CD1-CD 4.39Å; L624-K628 HydrophobicContact CD1-CG 4.45Å; L624-K628 HydrophobicContact CG-CD 4.25Å; L624-K628 PolarHBondContact O-N 2.94Å; K628-C632 WeakPolarHBondContact O-CB 3.49Å; K628-C632 PolarHBondContact O-N 2.94Å; K628-Y675 HydrophobicContact CG-CE1 4.14Å; K628-Y675 HydrophobicContact CG-CE2 4.38Å
629	T	94.4	Very high	91.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-71.4	-40.4	176.1	-52.3	0	0	0	0	112.6	L610 I613 V614 L625 R626 G627 E631 C632 I633	L610-T629 HydrophobicContact CB-CG2 4.01Å; L610-T629 HydrophobicContact CD2-CG2 3.89Å; L610-T629 WeakPolarHBondContact O-CG2 3.44Å; I613-T629 HydrophobicContact CB-CG2 3.97Å; I613-T629 HydrophobicContact CG2-CG2 3.9Å; I613-T629 WeakPolarHBondContact CG2-OG1 3.42Å; V614-T629 HydrophobicContact CG2-CG2 3.57Å; L625-T629 WeakPolarHBondContact O-CB 3.36Å; L625-T629 PolarHBondContact O-N 3.41Å; L625-T629 PolarHBondContact O-OG1 3.38Å; R626-T629 PolarHBondContact O-N 3.03Å; G627-T629 PolarHBondContact O-N 3.19Å; T629-E631 VanDerWaalsContact C-N 3.31Å; T629-C632 PolarHBondContact O-N 3.06Å; T629-I633 HydrophobicContact CG2-CD1 4.32Å; T629-I633 VanDerWaalsContact O-CG1 3.32Å; T629-I633 WeakPolarHBondContact O-CG1 3.41Å; T629-I633 PolarHBondContact O-N 3.23Å
630	I	92.3	Very high	92.1	Very high	4 Å²	4	24.9 Å²	24.9	2%	0.021	12%	0.118	C	C	.	.	H	α-helix	trans	-59.2	-45.2	173	-80.9	166.9	0	0	0	110.4	V614 R626 G627 I633 S634 L656 M676 A679	V614-I630 HydrophobicContact CG1-CD1 4.3Å; V614-I630 HydrophobicContact CG1-CG1 4.06Å; V614-I630 HydrophobicContact CG2-CG1 3.97Å; R626-I630 HydrophobicContact CG-CD1 4.32Å; R626-I630 WeakPolarHBondContact O-CB 3.39Å; R626-I630 WeakPolarHBondContact O-CG1 3.44Å; R626-I630 PolarHBondContact O-N 2.96Å; G627-I630 WeakPolarHBondContact O-CB 3.5Å; G627-I630 PolarHBondContact O-N 3.49Å; I630-I633 PolarHBondContact O-N 3.27Å; I630-S634 WeakPolarHBondContact O-CB 3.4Å; I630-S634 PolarHBondContact O-N 3.14Å; I630-S634 PolarHBondContact O-OG 3.08Å; I630-L656 HydrophobicContact CB-CD2 4.11Å; I630-L656 HydrophobicContact CD1-CD2 3.79Å; I630-L656 HydrophobicContact CG1-CD2 3.65Å; I630-L656 HydrophobicContact CG2-CD2 3.45Å; I630-L656 VanDerWaalsContact CG2-CD2 3.45Å; I630-M676 HydrophobicContact CD1-CG 4.33Å; I630-A679 HydrophobicContact CG2-CB 3.42Å; I630-A679 VanDerWaalsContact CG2-CB 3.42Å
631	E	93.4	Very high	92.7	Very high	31 Å²	31	20.7 Å²	20.7	15%	0.145	11%	0.108	C	C	.	.	H	α-helix	trans	-58.2	-53.4	172.8	165.3	151.4	-89.6	0	0	111.9	G627 T629 I633 S634 L635 Y675 R682	G627-E631 PolarHBondContact O-N 2.93Å; T629-E631 VanDerWaalsContact C-N 3.31Å; E631-I633 VanDerWaalsContact C-N 3.3Å; E631-I633 PolarHBondContact O-N 2.86Å; E631-S634 WeakPolarHBondContact CA-OG 3.48Å; E631-S634 CarbonylContact O-C 3.08Å; E631-S634 WeakPolarHBondContact O-CA 3.36Å; E631-S634 PolarHBondContact O-N 2.81Å; E631-S634 PolarHBondContact O-OG 3.48Å; E631-L635 HydrophobicContact CG-CD1 3.65Å; E631-L635 HydrophobicContact CG-CG 4.36Å; E631-L635 PolarHBondContact O-N 3.12Å; E631-Y675 HydrophobicContact CB-CD1 3.91Å; E631-Y675 VanDerWaalsContact OE2-CE1 3.32Å; E631-Y675 WeakPolarHBondContact OE2-CE1 3.46Å; E631-R682 IonicContact OE1-CZ 3.16Å; E631-R682 IonicContact OE1-NH1 2.92Å; E631-R682 PolarHBondContact OE1-NH1 2.94Å; E631-R682 IonicContact OE1-NH2 2.7Å; E631-R682 PolarHBondContact OE1-NH2 3.36Å
632	C	96.3	Very high	93	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-54.3	-44.1	178.4	179.8	0	0	0	0	112.7	V585 A589 L610 K628 T629 S634 I636	V585-C632 HydrophobicContact CG1-CB 3.65Å; A589-C632 HydrophobicContact CB-CB 3.82Å; L610-C632 HydrophobicContact CD2-CB 4.49Å; K628-C632 WeakPolarHBondContact O-CB 3.49Å; K628-C632 PolarHBondContact O-N 2.94Å; T629-C632 PolarHBondContact O-N 3.06Å; C632-S634 VanDerWaalsContact C-N 3.33Å; C632-S634 PolarHBondContact O-N 3.12Å; C632-I636 WeakPolarHBondContact O-CB 3.42Å; C632-I636 VanDerWaalsContact O-CG1 3.23Å; C632-I636 WeakPolarHBondContact O-CG1 3.07Å; C632-I636 PolarHBondContact O-N 2.9Å
633	I	95.9	Very high	93.2	Very high	4 Å²	4	24.6 Å²	24.6	2%	0.021	13%	0.13	C	C	.	.	H	α-helix	trans	-60.9	-43	175.1	-70.3	169.3	0	0	0	111.1	M607 L610 K611 V614 T629 I630 E631 G637 F645 V652	M607-I633 HydrophobicContact CE-CB 4.48Å; M607-I633 HydrophobicContact CE-CG2 4.01Å; M607-I633 HydrophobicContact SD-CG1 4.14Å; M607-I633 HydrophobicContact SD-CG2 3.92Å; L610-I633 HydrophobicContact CB-CD1 3.89Å; L610-I633 HydrophobicContact CB-CG1 3.62Å; L610-I633 HydrophobicContact CD1-CG1 4.12Å; L610-I633 HydrophobicContact CG-CG1 4.47Å; K611-I633 HydrophobicContact CG-CD1 4.44Å; V614-I633 HydrophobicContact CG2-CD1 3.81Å; T629-I633 HydrophobicContact CG2-CD1 4.32Å; T629-I633 VanDerWaalsContact O-CG1 3.32Å; T629-I633 WeakPolarHBondContact O-CG1 3.41Å; T629-I633 PolarHBondContact O-N 3.23Å; I630-I633 PolarHBondContact O-N 3.27Å; E631-I633 VanDerWaalsContact C-N 3.3Å; E631-I633 PolarHBondContact O-N 2.86Å; I633-G637 PolarHBondContact O-N 3.01Å; I633-F645 HydrophobicContact CG2-CE2 4.33Å; I633-V652 HydrophobicContact CG2-CB 4.33Å; I633-V652 HydrophobicContact CG2-CG1 3.56Å; I633-V652 HydrophobicContact CG2-CG2 3.75Å
634	S	94	Very high	93.6	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-70.2	-38.3	-178.1	72.6	0	0	0	0	113.4	I630 E631 C632 G637 L638 R682	I630-S634 WeakPolarHBondContact O-CB 3.4Å; I630-S634 PolarHBondContact O-N 3.14Å; I630-S634 PolarHBondContact O-OG 3.08Å; E631-S634 WeakPolarHBondContact CA-OG 3.48Å; E631-S634 CarbonylContact O-C 3.08Å; E631-S634 WeakPolarHBondContact O-CA 3.36Å; E631-S634 PolarHBondContact O-N 2.81Å; E631-S634 PolarHBondContact O-OG 3.48Å; C632-S634 VanDerWaalsContact C-N 3.33Å; C632-S634 PolarHBondContact O-N 3.12Å; S634-G637 PolarHBondContact O-N 2.75Å; S634-L638 PolarHBondContact O-N 2.94Å; S634-R682 WeakPolarHBondContact OG-CD 3.24Å; S634-R682 PolarHBondContact OG-NH1 3.23Å
635	L	95.6	Very high	94	Very high	19 Å²	19	22 Å²	22	10%	0.099	12%	0.117	C	C	.	.	H	α-helix	trans	-71.3	-44.1	175.8	-73.3	169.6	0	0	0	111.4	A589 D593 E631 G637 L638 A639	A589-L635 HydrophobicContact CB-CD1 3.9Å; D593-L635 HydrophobicContact CB-CD2 4.35Å; D593-L635 WeakPolarHBondContact OD1-CD2 3.17Å; E631-L635 HydrophobicContact CG-CD1 3.65Å; E631-L635 HydrophobicContact CG-CG 4.36Å; E631-L635 PolarHBondContact O-N 3.12Å; L635-G637 VanDerWaalsContact C-N 3.26Å; L635-G637 PolarHBondContact O-N 3.35Å; L635-L638 WeakPolarHBondContact O-CB 3.35Å; L635-L638 PolarHBondContact O-N 3.01Å; L635-L638 VanDerWaalsContact O-N 3.08Å; L635-A639 WeakPolarHBondContact O-CB 3.29Å; L635-A639 PolarHBondContact O-N 2.88Å
636	I	97.1	Very high	93.8	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-56.1	-44	170.5	-71	168.7	0	0	0	110.5	I588 A592 F599 Y603 F606 M607 L610 C632 L638 A639 V640	I588-I636 HydrophobicContact CG2-CD1 4.13Å; A592-I636 HydrophobicContact CB-CB 4.49Å; A592-I636 HydrophobicContact CB-CG1 3.59Å; F599-I636 HydrophobicContact CD1-CG1 4.35Å; F599-I636 HydrophobicContact CD1-CG2 4.16Å; F599-I636 HydrophobicContact CE1-CD1 4.06Å; F599-I636 HydrophobicContact CE1-CG1 3.81Å; F599-I636 HydrophobicContact CE1-CG2 4.04Å; F599-I636 HydrophobicContact CZ-CG1 4.44Å; Y603-I636 HydrophobicContact CD2-CG2 3.54Å; Y603-I636 HydrophobicContact CE2-CG2 3.87Å; F606-I636 HydrophobicContact CB-CD1 4.41Å; M607-I636 HydrophobicContact CE-CB 4.33Å; M607-I636 HydrophobicContact CE-CG2 3.86Å; L610-I636 HydrophobicContact CD1-CD1 3.52Å; C632-I636 WeakPolarHBondContact O-CB 3.42Å; C632-I636 VanDerWaalsContact O-CG1 3.23Å; C632-I636 WeakPolarHBondContact O-CG1 3.07Å; C632-I636 PolarHBondContact O-N 2.9Å; I636-L638 VanDerWaalsContact C-N 3.3Å; I636-L638 PolarHBondContact O-N 3.31Å; I636-A639 PolarHBondContact O-N 3.02Å; I636-V640 HydrophobicContact CG2-CG1 4.46Å; I636-V640 WeakPolarHBondContact O-CG1 3.32Å; I636-V640 VanDerWaalsContact O-CG2 3.24Å; I636-V640 WeakPolarHBondContact O-CG2 3.14Å; I636-V640 PolarHBondContact O-N 2.88Å; I636-V640 VanDerWaalsContact O-N 3.07Å
637	G	95.4	Very high	93.9	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62.6	-34.3	177.3	0	0	0	0	0	113.8	I633 S634 L635 G641	I633-G637 PolarHBondContact O-N 3.01Å; S634-G637 PolarHBondContact O-N 2.75Å; L635-G637 VanDerWaalsContact C-N 3.26Å; L635-G637 PolarHBondContact O-N 3.35Å; G637-G641 PolarHBondContact O-N 2.91Å
638	L	94.1	Very high	93.9	Very high	43 Å²	43	31 Å²	31	23%	0.225	17%	0.171	C	C	.	.	H	α-helix	trans	-71.3	-50.2	176.2	-173.8	63.4	0	0	0	111	S634 L635 I636 V640 G641 K685 I686	S634-L638 PolarHBondContact O-N 2.94Å; L635-L638 WeakPolarHBondContact O-CB 3.35Å; L635-L638 PolarHBondContact O-N 3.01Å; L635-L638 VanDerWaalsContact O-N 3.08Å; I636-L638 VanDerWaalsContact C-N 3.3Å; I636-L638 PolarHBondContact O-N 3.31Å; L638-V640 PolarHBondContact O-N 2.77Å; L638-G641 PolarHBondContact O-N 3.27Å; L638-K685 HydrophobicContact CD1-CB 4.38Å; L638-K685 HydrophobicContact CD1-CD 3.89Å; L638-K685 HydrophobicContact CD1-CG 4.04Å; L638-I686 HydrophobicContact CB-CD1 4.17Å; L638-I686 HydrophobicContact CB-CG1 4.21Å; L638-I686 HydrophobicContact CD1-CG1 3.91Å
639	A	94.8	Very high	93.6	Very high	12 Å²	12	30.2 Å²	30.2	10%	0.099	17%	0.168	C	C	.	.	H	α-helix	trans	-58.2	-45.8	-179.9	0	0	0	0	0	113.4	A592 E596 E597 L635 I636 G641	A592-A639 WeakPolarHBondContact O-CB 3.5Å; E596-A639 CarbonylContact C-O 3.05Å; E596-A639 CarbonylContact O-C 3.56Å; E597-A639 PolarHBondContact N-O 2.72Å; L635-A639 WeakPolarHBondContact O-CB 3.29Å; L635-A639 PolarHBondContact O-N 2.88Å; I636-A639 PolarHBondContact O-N 3.02Å; A639-G641 VanDerWaalsContact C-N 3.27Å; A639-G641 PolarHBondContact O-N 3.11Å
640	V	96.1	Very high	93.1	Very high	13 Å²	13	33.2 Å²	33.2	8%	0.079	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-10.9	-179.7	-56.4	0	0	0	0	114	F599 V600 Y603 I636 L638 K644 F645	F599-V640 HydrophobicContact CB-CG1 4.39Å; F599-V640 HydrophobicContact CD1-CG1 4.3Å; V600-V640 HydrophobicContact CG2-CB 3.85Å; V600-V640 HydrophobicContact CG2-CG1 4.04Å; Y603-V640 HydrophobicContact CD2-CB 4.34Å; Y603-V640 HydrophobicContact CD2-CG1 3.89Å; Y603-V640 HydrophobicContact CD2-CG2 3.78Å; Y603-V640 HydrophobicContact CE2-CG2 3.88Å; I636-V640 HydrophobicContact CG2-CG1 4.46Å; I636-V640 WeakPolarHBondContact O-CG1 3.32Å; I636-V640 VanDerWaalsContact O-CG2 3.24Å; I636-V640 WeakPolarHBondContact O-CG2 3.14Å; I636-V640 PolarHBondContact O-N 2.88Å; I636-V640 VanDerWaalsContact O-N 3.07Å; L638-V640 PolarHBondContact O-N 2.77Å; V640-K644 HydrophobicContact CB-CB 4.01Å; V640-K644 HydrophobicContact CB-CG 3.9Å; V640-K644 HydrophobicContact CG2-CB 3.89Å; V640-K644 HydrophobicContact CG2-CG 3.86Å; V640-F645 HydrophobicContact CG2-CB 4.17Å
641	G	93.8	Very high	92.9	Very high	28 Å²	28	35 Å²	35	29%	0.289	21%	0.205	S	C	.	.	H	α-helix	trans	71.4	168	-178.4	0	0	0	0	0	115	G637 L638 A639 D643 K644 F645	G637-G641 PolarHBondContact O-N 2.91Å; L638-G641 PolarHBondContact O-N 3.27Å; A639-G641 VanDerWaalsContact C-N 3.27Å; A639-G641 PolarHBondContact O-N 3.11Å; G641-D643 PolarHBondContact O-N 2.76Å; G641-K644 PolarHBondContact O-N 2.86Å; G641-F645 PolarHBondContact O-N 2.84Å; G641-F645 VanDerWaalsContact O-N 3.16Å
642	K	92.2	Very high	92.5	Very high	66 Å²	66	33.8 Å²	33.8	29%	0.287	20%	0.199	S	C	.	.	H	α-helix	trans	-49.7	-50.7	-173.3	-174.5	174.2	179.5	165.2	0	113.8	K644 F645 M646 I686 L687 E690	K642-K644 VanDerWaalsContact C-N 3.31Å; K642-K644 PolarHBondContact O-N 2.98Å; K642-F645 PolarHBondContact O-N 3.44Å; K642-M646 HydrophobicContact CG-SD 4.17Å; K642-M646 WeakPolarHBondContact O-CB 3.26Å; K642-M646 PolarHBondContact O-N 2.93Å; K642-I686 HydrophobicContact CB-CG2 4.31Å; K642-I686 WeakPolarHBondContact CB-O 3.45Å; K642-I686 WeakPolarHBondContact CD-O 3.46Å; K642-L687 PolarHBondContact NZ-O 3.29Å; K642-E690 WeakPolarHBondContact CE-OE1 3.41Å; K642-E690 IonicContact NZ-OE1 3.76Å; K642-E690 PolarHBondContact NZ-OE1 2.72Å
643	D	92.6	Very high	91.9	Very high	154 Å²	154	33.8 Å²	33.8	82%	0.824	20%	0.199	S	C	*	.	H	α-helix	trans	-62	-35.5	-171.4	-69.5	-17.8	0	0	0	113.4	G641	G641-D643 PolarHBondContact O-N 2.76Å
644	K	94.9	Very high	91.4	Very high	54 Å²	54	39.6 Å²	39.6	24%	0.235	23%	0.226	C	C	.	.	H	α-helix	trans	-83.4	-33.2	177.6	177.9	57	170.5	163.4	0	112.1	V600 Y603 D604 V640 G641 K642 P647	V600-K644 HydrophobicContact CG1-CG 4.29Å; Y603-K644 HydrophobicContact CD1-CD 4.3Å; Y603-K644 VanDerWaalsContact CD1-CE 3.47Å; Y603-K644 HydrophobicContact CD1-CG 4.46Å; Y603-K644 HydrophobicContact CD2-CG 4.29Å; Y603-K644 HydrophobicContact CG-CD 4.39Å; Y603-K644 HydrophobicContact CG-CG 4.15Å; D604-K644 IonicContact OD1-NZ 2.75Å; D604-K644 PolarHBondContact OD1-NZ 3.02Å; D604-K644 IonicContact OD2-NZ 2.65Å; D604-K644 PolarHBondContact OD2-NZ 2.7Å; V640-K644 HydrophobicContact CB-CB 4.01Å; V640-K644 HydrophobicContact CB-CG 3.9Å; V640-K644 HydrophobicContact CG2-CB 3.89Å; V640-K644 HydrophobicContact CG2-CG 3.86Å; G641-K644 PolarHBondContact O-N 2.86Å; K642-K644 VanDerWaalsContact C-N 3.31Å; K642-K644 PolarHBondContact O-N 2.98Å; K644-P647 WeakPolarHBondContact O-CD 3.41Å
645	F	95	Very high	90.8	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-78.5	-28.3	180	-174.8	-108	0	0	0	114	Y603 M607 I633 V640 G641 K642 P647 D648 A649 V652 M683 I686	Y603-F645 HydrophobicContact CE2-CD2 4.07Å; Y603-F645 WeakPolarHBondContact OH-CD2 3.39Å; M607-F645 HydrophobicContact CE-CE2 4.27Å; I633-F645 HydrophobicContact CG2-CE2 4.33Å; V640-F645 HydrophobicContact CG2-CB 4.17Å; G641-F645 PolarHBondContact O-N 2.84Å; G641-F645 VanDerWaalsContact O-N 3.16Å; K642-F645 PolarHBondContact O-N 3.44Å; F645-P647 WeakPolarHBondContact O-CD 3.27Å; F645-P647 VanDerWaalsContact O-N 3.15Å; F645-D648 PolarHBondContact O-N 2.97Å; F645-A649 HydrophobicContact CD1-CB 3.67Å; F645-A649 HydrophobicContact CE1-CB 3.5Å; F645-A649 HydrophobicContact CZ-CB 4.34Å; F645-A649 PolarHBondContact O-N 2.82Å; F645-V652 HydrophobicContact CE2-CG2 4.36Å; F645-V652 HydrophobicContact CZ-CB 4.16Å; F645-V652 HydrophobicContact CZ-CG1 4.23Å; F645-V652 HydrophobicContact CZ-CG2 4.19Å; F645-M683 HydrophobicContact CE1-CE 4.16Å; F645-M683 HydrophobicContact CE1-SD 3.46Å; F645-M683 WeakPolarHBondContact CE1-SD 3.44Å; F645-M683 HydrophobicContact CZ-CE 3.66Å; F645-M683 HydrophobicContact CZ-SD 3.62Å; F645-I686 HydrophobicContact CB-CG2 4.43Å; F645-I686 HydrophobicContact CD1-CD1 4.45Å; F645-I686 HydrophobicContact CD1-CG2 3.87Å; F645-I686 HydrophobicContact CG-CG2 4.49Å
646	M	89.2	Confident	90	Very high	66 Å²	66	39.8 Å²	39.8	33%	0.325	23%	0.227	S	C	.	.	H	α-helix	trans	-49.8	-39.3	-173.6	-150.5	65.4	159	0	0	116.4	K642 D648 A649 L687 E690	K642-M646 HydrophobicContact CG-SD 4.17Å; K642-M646 WeakPolarHBondContact O-CB 3.26Å; K642-M646 PolarHBondContact O-N 2.93Å; M646-D648 VanDerWaalsContact C-N 3.26Å; M646-D648 PolarHBondContact O-N 3.34Å; M646-A649 PolarHBondContact O-N 2.91Å; M646-L687 HydrophobicContact CE-CD2 4.22Å; M646-L687 HydrophobicContact SD-CD2 3.6Å; M646-L687 VanDerWaalsContact SD-CD2 3.6Å; M646-E690 WeakPolarHBondContact CE-OE2 3.43Å
647	P	90.9	Very high	89	Confident	105 Å²	105	41.7 Å²	41.7	68%	0.682	24%	0.237	S	C	*	.	H	α-helix	trans	-61.7	-31.9	179.5	-24.1	35.9	0	0	0	113.9	K644 F645	K644-P647 WeakPolarHBondContact O-CD 3.41Å; F645-P647 WeakPolarHBondContact O-CD 3.27Å; F645-P647 VanDerWaalsContact O-N 3.15Å
648	D	91.3	Very high	88.1	Confident	32 Å²	32	47.7 Å²	47.7	17%	0.171	26%	0.263	C	S	.	.	H	α-helix	trans	-98.9	-21	179.5	-79	-51.1	0	0	0	113.1	Y603 M607 K611 F645 M646 S650 A651 V652	Y603-D648 WeakPolarHBondContact OH-CB 3.4Å; Y603-D648 PolarHBondContact OH-OD2 3.37Å; M607-D648 HydrophobicContact CG-CB 4.5Å; K611-D648 IonicContact NZ-OD1 3.94Å; K611-D648 PolarHBondContact NZ-OD1 3.32Å; K611-D648 IonicContact NZ-OD2 2.84Å; F645-D648 PolarHBondContact O-N 2.97Å; M646-D648 VanDerWaalsContact C-N 3.26Å; M646-D648 PolarHBondContact O-N 3.34Å; D648-S650 VanDerWaalsContact C-N 3.29Å; D648-S650 PolarHBondContact O-N 2.86Å; D648-S650 VanDerWaalsContact O-N 3.15Å; D648-A651 WeakPolarHBondContact O-CA 3.3Å; D648-A651 WeakPolarHBondContact O-CB 3.41Å; D648-A651 PolarHBondContact O-N 3.3Å; D648-V652 HydrophobicContact CB-CG2 4.47Å; D648-V652 PolarHBondContact O-N 2.79Å
649	A	86.3	Confident	87	Confident	4 Å²	4	45.7 Å²	45.7	3%	0.033	25%	0.253	C	S	.	.	H	α-helix	trans	-47.6	-47.9	-176.5	0	0	0	0	0	113.1	F645 M646 A651 V652 M653 L687	F645-A649 HydrophobicContact CD1-CB 3.67Å; F645-A649 HydrophobicContact CE1-CB 3.5Å; F645-A649 HydrophobicContact CZ-CB 4.34Å; F645-A649 PolarHBondContact O-N 2.82Å; M646-A649 PolarHBondContact O-N 2.91Å; A649-A651 VanDerWaalsContact C-N 3.33Å; A649-A651 PolarHBondContact O-N 2.9Å; A649-V652 PolarHBondContact O-N 2.7Å; A649-M653 WeakPolarHBondContact O-CB 3.38Å; A649-M653 WeakPolarHBondContact O-CG 3.2Å; A649-M653 PolarHBondContact O-N 2.74Å; A649-L687 HydrophobicContact CB-CD2 4.21Å
650	S	84.5	Confident	85.7	Confident	62 Å²	62	45.8 Å²	45.8	43%	0.434	25%	0.251	S	S	.	.	H	α-helix	trans	-62.9	-37.2	179.4	-168	0	0	0	0	113.2	D648 Q654	D648-S650 VanDerWaalsContact C-N 3.29Å; D648-S650 PolarHBondContact O-N 2.86Å; D648-S650 VanDerWaalsContact O-N 3.15Å; S650-Q654 VanDerWaalsContact O-CG 3.28Å; S650-Q654 WeakPolarHBondContact O-CG 3.43Å; S650-Q654 PolarHBondContact O-N 2.86Å; S650-Q654 VanDerWaalsContact O-N 3.11Å
651	A	86.7	Confident	84.2	Confident	43 Å²	43	49.8 Å²	49.8	36%	0.355	28%	0.276	S	S	.	.	H	α-helix	trans	-72.6	-43.5	177.7	0	0	0	0	0	111.3	D648 A649 Q654 L655	D648-A651 WeakPolarHBondContact O-CA 3.3Å; D648-A651 WeakPolarHBondContact O-CB 3.41Å; D648-A651 PolarHBondContact O-N 3.3Å; A649-A651 VanDerWaalsContact C-N 3.33Å; A649-A651 PolarHBondContact O-N 2.9Å; A651-Q654 WeakPolarHBondContact O-CB 3.48Å; A651-Q654 PolarHBondContact O-N 3.01Å; A651-L655 WeakPolarHBondContact O-CG 3.41Å; A651-L655 PolarHBondContact O-N 2.93Å
652	V	86.4	Confident	82.7	Confident	4 Å²	4	52.5 Å²	52.5	2%	0.024	28%	0.284	C	S	.	.	H	α-helix	trans	-61.1	-47.5	175.3	174.6	0	0	0	0	110.8	K611 I633 F645 D648 A649 Q654 L655 L656 M683	K611-V652 HydrophobicContact CD-CG2 4.3Å; K611-V652 HydrophobicContact CG-CG2 4.42Å; I633-V652 HydrophobicContact CG2-CB 4.33Å; I633-V652 HydrophobicContact CG2-CG1 3.56Å; I633-V652 HydrophobicContact CG2-CG2 3.75Å; F645-V652 HydrophobicContact CE2-CG2 4.36Å; F645-V652 HydrophobicContact CZ-CB 4.16Å; F645-V652 HydrophobicContact CZ-CG1 4.23Å; F645-V652 HydrophobicContact CZ-CG2 4.19Å; D648-V652 HydrophobicContact CB-CG2 4.47Å; D648-V652 PolarHBondContact O-N 2.79Å; A649-V652 PolarHBondContact O-N 2.7Å; V652-Q654 VanDerWaalsContact C-N 3.26Å; V652-Q654 PolarHBondContact O-N 3.03Å; V652-L655 WeakPolarHBondContact O-CB 3.43Å; V652-L655 PolarHBondContact O-N 2.89Å; V652-L656 HydrophobicContact CG1-CD1 4.16Å; V652-L656 HydrophobicContact CG1-CG 4.4Å; V652-L656 WeakPolarHBondContact O-CG 3.45Å; V652-L656 PolarHBondContact O-N 3.31Å; V652-M683 HydrophobicContact CG1-CE 3.59Å
653	M	83.9	Confident	80.9	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-57.4	-39.2	175.1	-67.6	-64	-76	0	0	111.4	A649 L656 L657 W680 M683 F691 Y694	A649-M653 WeakPolarHBondContact O-CB 3.38Å; A649-M653 WeakPolarHBondContact O-CG 3.2Å; A649-M653 PolarHBondContact O-N 2.74Å; M653-L656 PolarHBondContact O-N 2.95Å; M653-L656 HydrophobicContact SD-CD1 4.43Å; M653-L657 WeakPolarHBondContact O-CB 3.47Å; M653-L657 VanDerWaalsContact O-CG 3.23Å; M653-L657 WeakPolarHBondContact O-CG 3.46Å; M653-L657 PolarHBondContact O-N 3.01Å; M653-W680 HydrophobicContact CE-CE3 3.84Å; M653-W680 HydrophobicContact CE-CZ3 3.44Å; M653-W680 VanDerWaalsContact CE-CZ3 3.44Å; M653-W680 HydrophobicContact SD-CE3 4Å; M653-W680 HydrophobicContact SD-CZ3 3.6Å; M653-M683 HydrophobicContact SD-CB 3.79Å; M653-M683 HydrophobicContact SD-CG 3.66Å; M653-M683 HydrophobicContact SD-SD 4.14Å; M653-F691 HydrophobicContact CE-CD2 4.01Å; M653-F691 HydrophobicContact CE-CE2 3.64Å; M653-Y694 HydrophobicContact CB-CE1 4.1Å; M653-Y694 HydrophobicContact CE-CD1 3.71Å; M653-Y694 HydrophobicContact CE-CD2 3.36Å; M653-Y694 HydrophobicContact CE-CE1 4.07Å; M653-Y694 HydrophobicContact CE-CE2 3.75Å; M653-Y694 HydrophobicContact CE-CG 3.32Å; M653-Y694 HydrophobicContact CG-CE1 4.44Å; M653-Y694 HydrophobicContact CG-CE2 4.34Å
654	Q	83.6	Confident	79.1	Confident	126 Å²	126	49.6 Å²	49.6	59%	0.589	27%	0.271	S	S	*	.	H	α-helix	trans	-66.8	-36	174.4	-74.7	172.9	39.3	0	0	113.4	S650 A651 V652 L657 K658	S650-Q654 VanDerWaalsContact O-CG 3.28Å; S650-Q654 WeakPolarHBondContact O-CG 3.43Å; S650-Q654 PolarHBondContact O-N 2.86Å; S650-Q654 VanDerWaalsContact O-N 3.11Å; A651-Q654 WeakPolarHBondContact O-CB 3.48Å; A651-Q654 PolarHBondContact O-N 3.01Å; V652-Q654 VanDerWaalsContact C-N 3.26Å; V652-Q654 PolarHBondContact O-N 3.03Å; Q654-L657 PolarHBondContact O-N 3.49Å; Q654-K658 VanDerWaalsContact O-CB 3.3Å; Q654-K658 WeakPolarHBondContact O-CB 3.38Å; Q654-K658 PolarHBondContact O-N 2.91Å
655	L	82.2	Confident	77.4	Confident	21 Å²	21	54 Å²	54	11%	0.11	30%	0.297	C	S	.	.	H	α-helix	trans	-66.5	-42.7	174.4	-68	174.9	0	0	0	111.7	K611 V614 E615 A651 V652 K658 T659	K611-L655 HydrophobicContact CB-CD1 4.23Å; K611-L655 HydrophobicContact CG-CD1 4.2Å; V614-L655 HydrophobicContact CG1-CB 4.14Å; E615-L655 HydrophobicContact CG-CD1 4.23Å; E615-L655 HydrophobicContact CG-CD2 3.49Å; E615-L655 VanDerWaalsContact CG-CD2 3.49Å; A651-L655 WeakPolarHBondContact O-CG 3.41Å; A651-L655 PolarHBondContact O-N 2.93Å; V652-L655 WeakPolarHBondContact O-CB 3.43Å; V652-L655 PolarHBondContact O-N 2.89Å; L655-K658 PolarHBondContact O-N 3.37Å; L655-T659 PolarHBondContact O-N 3.18Å; L655-T659 PolarHBondContact O-OG1 3.12Å
656	L	78.4	Confident	76	Confident	3 Å²	3	55 Å²	55	2%	0.016	30%	0.302	C	S	.	.	H	α-helix	trans	-62.8	-46.8	173.8	-63.7	174.5	0	0	0	110.9	I630 V652 M653 K658 T659 Q660 W680 M683	I630-L656 HydrophobicContact CB-CD2 4.11Å; I630-L656 HydrophobicContact CD1-CD2 3.79Å; I630-L656 HydrophobicContact CG1-CD2 3.65Å; I630-L656 HydrophobicContact CG2-CD2 3.45Å; I630-L656 VanDerWaalsContact CG2-CD2 3.45Å; V652-L656 HydrophobicContact CG1-CD1 4.16Å; V652-L656 HydrophobicContact CG1-CG 4.4Å; V652-L656 WeakPolarHBondContact O-CG 3.45Å; V652-L656 PolarHBondContact O-N 3.31Å; M653-L656 PolarHBondContact O-N 2.95Å; M653-L656 HydrophobicContact SD-CD1 4.43Å; L656-K658 PolarHBondContact O-N 3.48Å; L656-T659 CarbonylContact O-C 3.55Å; L656-T659 WeakPolarHBondContact O-CB 3.36Å; L656-T659 PolarHBondContact O-N 3.17Å; L656-Q660 WeakPolarHBondContact O-CB 3.41Å; L656-Q660 PolarHBondContact O-N 3.5Å; L656-W680 HydrophobicContact CB-CE3 4.39Å; L656-W680 HydrophobicContact CB-CH2 3.17Å; L656-W680 HydrophobicContact CB-CZ2 3.61Å; L656-W680 HydrophobicContact CB-CZ3 3.6Å; L656-W680 HydrophobicContact CD1-CE3 3.89Å; L656-W680 HydrophobicContact CD1-CH2 4.16Å; L656-W680 HydrophobicContact CD1-CZ3 3.68Å; L656-W680 HydrophobicContact CG-CH2 4.29Å; L656-W680 HydrophobicContact CG-CZ3 4.29Å; L656-M683 HydrophobicContact CD1-CE 4.22Å; L656-M683 HydrophobicContact CD1-CG 4.27Å
657	L	77.1	Confident	75	Confident	39 Å²	39	56.7 Å²	56.7	20%	0.204	31%	0.309	C	S	.	.	H	α-helix	trans	-64.2	-35.4	177.3	-73.5	-176.6	0	0	0	113.3	M653 Q654 T659 Q660 T661 W680 Y694 V697	M653-L657 WeakPolarHBondContact O-CB 3.47Å; M653-L657 VanDerWaalsContact O-CG 3.23Å; M653-L657 WeakPolarHBondContact O-CG 3.46Å; M653-L657 PolarHBondContact O-N 3.01Å; Q654-L657 PolarHBondContact O-N 3.49Å; L657-T659 VanDerWaalsContact C-N 3.35Å; L657-Q660 CarbonylContact O-C 3.6Å; L657-Q660 WeakPolarHBondContact O-CB 3.49Å; L657-Q660 PolarHBondContact O-N 3.15Å; L657-T661 PolarHBondContact O-N 2.83Å; L657-W680 HydrophobicContact CD2-CH2 3.55Å; L657-W680 HydrophobicContact CD2-CZ2 3.95Å; L657-W680 HydrophobicContact CG-CH2 3.78Å; L657-Y694 HydrophobicContact CD1-CD1 4.38Å; L657-V697 HydrophobicContact CD2-CB 3.82Å; L657-V697 HydrophobicContact CD2-CG1 3.53Å; L657-V697 HydrophobicContact CD2-CG2 4.48Å
658	K	77	Confident	73.7	Confident	126 Å²	126	55.9 Å²	55.9	55%	0.548	30%	0.299	S	S	.	.	H	α-helix	trans	-67.6	-37.8	174.5	-175.5	-174.3	173.7	-164.4	0	111.4	Q654 L655 L656 Q660 T661	Q654-K658 VanDerWaalsContact O-CB 3.3Å; Q654-K658 WeakPolarHBondContact O-CB 3.38Å; Q654-K658 PolarHBondContact O-N 2.91Å; L655-K658 PolarHBondContact O-N 3.37Å; L656-K658 PolarHBondContact O-N 3.48Å; K658-Q660 VanDerWaalsContact C-N 3.29Å; K658-T661 PolarHBondContact O-N 2.99Å; K658-T661 PolarHBondContact O-OG1 3.18Å
659	T	70.9	Confident	72.4	Confident	2 Å²	2	59.3 Å²	59.3	1%	0.012	32%	0.318	C	S	.	.	H	α-helix	trans	-66	-36.7	171.5	-50.7	0	0	0	0	110.5	R626 L655 L656 L657 T661 D662 M676	R626-T659 VanDerWaalsContact NH1-CG2 3.33Å; R626-T659 PolarHBondContact NH1-OG1 3.11Å; R626-T659 PolarHBondContact NH2-OG1 3.06Å; L655-T659 PolarHBondContact O-N 3.18Å; L655-T659 PolarHBondContact O-OG1 3.12Å; L656-T659 CarbonylContact O-C 3.55Å; L656-T659 WeakPolarHBondContact O-CB 3.36Å; L656-T659 PolarHBondContact O-N 3.17Å; L657-T659 VanDerWaalsContact C-N 3.35Å; T659-T661 PolarHBondContact O-N 3.21Å; T659-D662 PolarHBondContact O-N 2.89Å; T659-M676 HydrophobicContact CG2-CE 4.01Å; T659-M676 HydrophobicContact CG2-SD 3.63Å
660	Q	65.7	Low	71.9	Confident	13 Å²	13	59.3 Å²	59.3	6%	0.061	32%	0.317	C	S	.	.	H	α-helix	trans	-68.2	-26	176.5	-162.7	72.2	68.9	0	0	113.7	L656 L657 K658 D662 F663 M676 W680 P701	L656-Q660 WeakPolarHBondContact O-CB 3.41Å; L656-Q660 PolarHBondContact O-N 3.5Å; L657-Q660 CarbonylContact O-C 3.6Å; L657-Q660 WeakPolarHBondContact O-CB 3.49Å; L657-Q660 PolarHBondContact O-N 3.15Å; K658-Q660 VanDerWaalsContact C-N 3.29Å; Q660-D662 VanDerWaalsContact C-N 3.28Å; Q660-D662 PolarHBondContact O-N 2.85Å; Q660-F663 VanDerWaalsContact NE2-CD1 3.26Å; Q660-F663 WeakPolarHBondContact O-CB 3.48Å; Q660-F663 PolarHBondContact O-N 2.95Å; Q660-M676 HydrophobicContact CB-CE 3.96Å; Q660-M676 VanDerWaalsContact OE1-CE 3.3Å; Q660-W680 HydrophobicContact CB-CZ2 4.45Å; Q660-P701 HydrophobicContact CG-CG 4.07Å; Q660-P701 VanDerWaalsContact NE2-CB 3.34Å
661	T	65.1	Low	71.4	Confident	98 Å²	98	59.2 Å²	59.2	60%	0.601	32%	0.315	S	S	*	.	H	α-helix	trans	-71.2	-24.3	176	40.7	0	0	0	0	113.4	L657 K658 T659 F663	L657-T661 PolarHBondContact O-N 2.83Å; K658-T661 PolarHBondContact O-N 2.99Å; K658-T661 PolarHBondContact O-OG1 3.18Å; T659-T661 PolarHBondContact O-N 3.21Å; T661-F663 VanDerWaalsContact C-N 3.28Å
662	D	61.9	Low	71.1	Confident	85 Å²	85	57.4 Å²	57.4	46%	0.455	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-9.2	174.4	-53.4	-27	0	0	0	111.4	T659 Q660 N664 D665	T659-D662 PolarHBondContact O-N 2.89Å; Q660-D662 VanDerWaalsContact C-N 3.28Å; Q660-D662 PolarHBondContact O-N 2.85Å; D662-N664 VanDerWaalsContact C-N 3.3Å; D662-N664 PolarHBondContact O-N 3.26Å; D662-D665 PolarHBondContact O-N 3.01Å
663	F	55.3	Low	70.7	Confident	9 Å²	9	57.5 Å²	57.5	4%	0.039	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-14.1	-171.6	-154.4	-87.1	0	0	0	115	Q660 T661 L666 I673 M676 P701	Q660-F663 VanDerWaalsContact NE2-CD1 3.26Å; Q660-F663 WeakPolarHBondContact O-CB 3.48Å; Q660-F663 PolarHBondContact O-N 2.95Å; T661-F663 VanDerWaalsContact C-N 3.28Å; F663-L666 HydrophobicContact CB-CD1 4.35Å; F663-L666 HydrophobicContact CD2-CD1 3.8Å; F663-L666 HydrophobicContact CG-CD1 4.12Å; F663-I673 HydrophobicContact CE1-CG1 4.42Å; F663-I673 HydrophobicContact CE2-CG1 3.92Å; F663-I673 HydrophobicContact CZ-CB 4.26Å; F663-I673 HydrophobicContact CZ-CD1 4.47Å; F663-I673 HydrophobicContact CZ-CG1 3.72Å; F663-I673 HydrophobicContact CZ-CG2 4.1Å; F663-M676 HydrophobicContact CD2-CE 4.23Å; F663-M676 HydrophobicContact CD2-SD 3.98Å; F663-M676 HydrophobicContact CE2-CE 4.33Å; F663-M676 HydrophobicContact CE2-SD 3.89Å; F663-P701 HydrophobicContact CD1-CB 4.24Å; F663-P701 HydrophobicContact CE1-CB 3.88Å; F663-P701 HydrophobicContact CZ-CB 4.38Å
664	N	53.8	Low	70.6	Confident	150 Å²	150	58.8 Å²	58.8	80%	0.802	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-16.2	169.2	-70.2	-38.3	0	0	0	112.2	D662	D662-N664 VanDerWaalsContact C-N 3.3Å; D662-N664 PolarHBondContact O-N 3.26Å
665	D	60.8	Low	70.7	Confident	146 Å²	146	55.1 Å²	55.1	78%	0.781	29%	0.29	S	S	*	.	S	Bend	trans	-107.7	8.6	178.3	-57.2	-40.3	0	0	0	111.9	D662	D662-D665 PolarHBondContact O-N 3.01Å
666	L	65.9	Low	70.8	Confident	21 Å²	21	54.1 Å²	54.1	11%	0.11	29%	0.285	C	S	.	.	S	Bend	trans	-89.6	147	172.7	-65.1	-178.7	0	0	0	111.2	F663 D670	F663-L666 HydrophobicContact CB-CD1 4.35Å; F663-L666 HydrophobicContact CD2-CD1 3.8Å; F663-L666 HydrophobicContact CG-CD1 4.12Å; L666-D670 HydrophobicContact CB-CB 4.28Å
667	E	67.4	Low	71	Confident	101 Å²	101	54.2 Å²	54.2	47%	0.472	29%	0.285	S	S	.	.			trans	-71.4	150.1	173.6	-64.1	152.2	143	0	0	108.9	K620 D669 D670 I673	K620-E667 IonicContact NZ-OE1 2.77Å; K620-E667 IonicContact NZ-OE2 3.67Å; K620-E667 PolarHBondContact NZ-OE2 2.97Å; E667-D669 WeakPolarHBondContact CB-OD1 3.11Å; E667-D669 PolarHBondContact O-N 2.75Å; E667-D670 WeakPolarHBondContact O-CB 3.3Å; E667-D670 PolarHBondContact O-N 3.24Å; E667-D670 VanDerWaalsContact O-N 3.12Å; E667-I673 WeakPolarHBondContact O-CD1 3.35Å
668	D	63.6	Low	71.5	Confident	88 Å²	88	53.7 Å²	53.7	47%	0.471	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-13.7	-171.7	-80.6	-37	0	0	0	113.6	K704	D668-K704 VanDerWaalsContact OD1-CE 3.27Å; D668-K704 WeakPolarHBondContact OD1-CE 3.35Å; D668-K704 IonicContact OD1-NZ 3.98Å; D668-K704 PolarHBondContact OD1-NZ 2.69Å; D668-K704 IonicContact OD2-NZ 3.74Å
669	D	64.6	Low	72	Confident	104 Å²	104	47.7 Å²	47.7	56%	0.556	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	12	176.8	57	-8.7	0	0	0	113.2	E667	E667-D669 WeakPolarHBondContact CB-OD1 3.11Å; E667-D669 PolarHBondContact O-N 2.75Å
670	D	75.6	Confident	72.8	Confident	5 Å²	5	47.8 Å²	47.8	3%	0.027	26%	0.259	C	S	.	.			trans	-64.7	125.3	-179.5	-169.1	-72.7	0	0	0	112	R623 L666 E667 Q672 I673	R623-D670 WeakPolarHBondContact CD-OD2 3.36Å; R623-D670 IonicContact CZ-OD2 3.11Å; R623-D670 VanDerWaalsContact CZ-OD2 3.22Å; R623-D670 IonicContact NE-OD2 2.61Å; R623-D670 PolarHBondContact NE-OD2 3.47Å; R623-D670 IonicContact NH1-OD2 2.58Å; R623-D670 PolarHBondContact NH1-OD2 3.43Å; L666-D670 HydrophobicContact CB-CB 4.28Å; E667-D670 WeakPolarHBondContact O-CB 3.3Å; E667-D670 PolarHBondContact O-N 3.24Å; E667-D670 VanDerWaalsContact O-N 3.12Å; D670-Q672 PolarHBondContact O-N 3.43Å; D670-Q672 VanDerWaalsContact OD1-CB 3.31Å; D670-Q672 WeakPolarHBondContact OD1-CB 3.46Å; D670-Q672 WeakPolarHBondContact OD1-CG 3.07Å; D670-Q672 PolarHBondContact OD1-N 2.92Å; D670-I673 HydrophobicContact CB-CD1 4.07Å; D670-I673 HydrophobicContact CB-CG1 4.24Å; D670-I673 WeakPolarHBondContact O-CB 3.49Å; D670-I673 VanDerWaalsContact O-CG1 3.3Å; D670-I673 WeakPolarHBondContact O-CG1 3.42Å; D670-I673 PolarHBondContact O-N 2.91Å
671	P	74.3	Confident	73.7	Confident	60 Å²	60	47.5 Å²	47.5	39%	0.39	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-10.3	-173.4	25.6	-35.7	0	0	0	114.1	I673 S674 Y675	P671-I673 VanDerWaalsContact C-N 3.32Å; P671-S674 PolarHBondContact O-OG 2.98Å; P671-Y675 VanDerWaalsContact O-CD2 3.23Å; P671-Y675 WeakPolarHBondContact O-CD2 3.39Å
672	Q	78.8	Confident	74.9	Confident	5 Å²	5	45.2 Å²	45.2	2%	0.023	24%	0.239	C	C	.	.	H	α-helix	trans	-73.2	-22.3	172.5	-63.8	-168.3	-25.4	0	0	113.8	R623 D670 S674 Y675 M676	R623-Q672 HydrophobicContact CB-CG 3.88Å; R623-Q672 HydrophobicContact CG-CG 4.27Å; R623-Q672 WeakPolarHBondContact O-CG 3.46Å; R623-Q672 PolarHBondContact O-NE2 3.15Å; D670-Q672 PolarHBondContact O-N 3.43Å; D670-Q672 VanDerWaalsContact OD1-CB 3.31Å; D670-Q672 WeakPolarHBondContact OD1-CB 3.46Å; D670-Q672 WeakPolarHBondContact OD1-CG 3.07Å; D670-Q672 PolarHBondContact OD1-N 2.92Å; Q672-S674 PolarHBondContact O-N 3.13Å; Q672-Y675 PolarHBondContact O-N 3.34Å; Q672-M676 HydrophobicContact CB-SD 4.49Å; Q672-M676 WeakPolarHBondContact O-CB 3.49Å; Q672-M676 VanDerWaalsContact O-CG 3.3Å; Q672-M676 WeakPolarHBondContact O-CG 3.43Å; Q672-M676 PolarHBondContact O-N 3.22Å
673	I	78.4	Confident	76.3	Confident	5 Å²	5	41.2 Å²	41.2	3%	0.026	22%	0.218	C	C	.	.	H	α-helix	trans	-60	-51.2	-170.7	-69.1	173.3	0	0	0	110.8	F663 E667 D670 P671 M676 I677 T705 E749	F663-I673 HydrophobicContact CE1-CG1 4.42Å; F663-I673 HydrophobicContact CE2-CG1 3.92Å; F663-I673 HydrophobicContact CZ-CB 4.26Å; F663-I673 HydrophobicContact CZ-CD1 4.47Å; F663-I673 HydrophobicContact CZ-CG1 3.72Å; F663-I673 HydrophobicContact CZ-CG2 4.1Å; E667-I673 WeakPolarHBondContact O-CD1 3.35Å; D670-I673 HydrophobicContact CB-CD1 4.07Å; D670-I673 HydrophobicContact CB-CG1 4.24Å; D670-I673 WeakPolarHBondContact O-CB 3.49Å; D670-I673 VanDerWaalsContact O-CG1 3.3Å; D670-I673 WeakPolarHBondContact O-CG1 3.42Å; D670-I673 PolarHBondContact O-N 2.91Å; P671-I673 VanDerWaalsContact C-N 3.32Å; I673-M676 PolarHBondContact O-N 3.42Å; I673-I677 HydrophobicContact CG2-CD1 3.7Å; I673-I677 WeakPolarHBondContact O-CB 3.46Å; I673-I677 VanDerWaalsContact O-CG1 3.26Å; I673-I677 WeakPolarHBondContact O-CG1 3.34Å; I673-I677 PolarHBondContact O-N 2.83Å; I673-T705 HydrophobicContact CG2-CG2 4.03Å; I673-E749 HydrophobicContact CG2-CG 4.17Å
674	S	81.6	Confident	77.9	Confident	28 Å²	28	40.8 Å²	40.8	20%	0.196	22%	0.216	C	C	.	.	H	α-helix	trans	-59.6	-52.1	178.9	55.7	0	0	0	0	112.2	P671 Q672 M676 I677 S678	P671-S674 PolarHBondContact O-OG 2.98Å; Q672-S674 PolarHBondContact O-N 3.13Å; S674-M676 VanDerWaalsContact C-N 3.33Å; S674-M676 PolarHBondContact O-N 3.24Å; S674-I677 PolarHBondContact O-N 3.28Å; S674-S678 PolarHBondContact O-N 2.97Å; S674-S678 PolarHBondContact O-OG 3.33Å
675	Y	86.7	Confident	79.6	Confident	48 Å²	48	39.5 Å²	39.5	19%	0.188	20%	0.203	C	C	.	.	H	α-helix	trans	-58.9	-40.2	177.9	-68.6	-66.9	0	0	0	113.2	L624 K628 E631 P671 Q672 A679	L624-Y675 HydrophobicContact CD1-CE2 3.65Å; K628-Y675 HydrophobicContact CG-CE1 4.14Å; K628-Y675 HydrophobicContact CG-CE2 4.38Å; E631-Y675 HydrophobicContact CB-CD1 3.91Å; E631-Y675 VanDerWaalsContact OE2-CE1 3.32Å; E631-Y675 WeakPolarHBondContact OE2-CE1 3.46Å; P671-Y675 VanDerWaalsContact O-CD2 3.23Å; P671-Y675 WeakPolarHBondContact O-CD2 3.39Å; Q672-Y675 PolarHBondContact O-N 3.34Å; Y675-A679 WeakPolarHBondContact O-CB 3.45Å; Y675-A679 PolarHBondContact O-N 2.91Å
676	M	84.3	Confident	81	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-66.9	-45	177.3	-75.3	-175.7	69.5	0	0	111.9	I630 T659 Q660 F663 Q672 I673 S674 A679 W680	I630-M676 HydrophobicContact CD1-CG 4.33Å; T659-M676 HydrophobicContact CG2-CE 4.01Å; T659-M676 HydrophobicContact CG2-SD 3.63Å; Q660-M676 HydrophobicContact CB-CE 3.96Å; Q660-M676 VanDerWaalsContact OE1-CE 3.3Å; F663-M676 HydrophobicContact CD2-CE 4.23Å; F663-M676 HydrophobicContact CD2-SD 3.98Å; F663-M676 HydrophobicContact CE2-CE 4.33Å; F663-M676 HydrophobicContact CE2-SD 3.89Å; Q672-M676 HydrophobicContact CB-SD 4.49Å; Q672-M676 WeakPolarHBondContact O-CB 3.49Å; Q672-M676 VanDerWaalsContact O-CG 3.3Å; Q672-M676 WeakPolarHBondContact O-CG 3.43Å; Q672-M676 PolarHBondContact O-N 3.22Å; I673-M676 PolarHBondContact O-N 3.42Å; S674-M676 VanDerWaalsContact C-N 3.33Å; S674-M676 PolarHBondContact O-N 3.24Å; M676-A679 PolarHBondContact O-N 3.19Å; M676-W680 PolarHBondContact O-N 3.21Å
677	I	83	Confident	82.1	Confident	6 Å²	6	32.4 Å²	32.4	3%	0.031	17%	0.165	C	C	.	.	H	α-helix	trans	-60.2	-49.5	178.7	-74.6	172.5	0	0	0	110.7	I673 S674 A679 W680 A681 L702 T705 T752 A753 M756	I673-I677 HydrophobicContact CG2-CD1 3.7Å; I673-I677 WeakPolarHBondContact O-CB 3.46Å; I673-I677 VanDerWaalsContact O-CG1 3.26Å; I673-I677 WeakPolarHBondContact O-CG1 3.34Å; I673-I677 PolarHBondContact O-N 2.83Å; S674-I677 PolarHBondContact O-N 3.28Å; I677-A679 PolarHBondContact O-N 3.1Å; I677-W680 PolarHBondContact O-N 3.05Å; I677-A681 PolarHBondContact O-N 3.37Å; I677-L702 HydrophobicContact CD1-CD1 4.31Å; I677-L702 HydrophobicContact CG1-CD1 4.22Å; I677-L702 HydrophobicContact CG2-CD1 3.78Å; I677-T705 HydrophobicContact CD1-CG2 3.76Å; I677-T752 HydrophobicContact CG2-CG2 3.9Å; I677-A753 HydrophobicContact CD1-CB 4.26Å; I677-M756 HydrophobicContact CG2-CB 4.22Å; I677-M756 HydrophobicContact CG2-CG 3.33Å
678	S	86.4	Confident	83.1	Confident	27 Å²	27	28.6 Å²	28.6	19%	0.189	15%	0.153	C	C	.	.	H	α-helix	trans	-63.4	-39.7	176.7	-65.9	0	0	0	0	112.7	S674 W680 A681 R682 T752	S674-S678 PolarHBondContact O-N 2.97Å; S674-S678 PolarHBondContact O-OG 3.33Å; S678-W680 PolarHBondContact O-N 3.11Å; S678-A681 PolarHBondContact O-N 3.28Å; S678-R682 WeakPolarHBondContact O-CG 3.34Å; S678-R682 PolarHBondContact O-N 3.15Å; S678-R682 VanDerWaalsContact O-N 3.14Å; S678-T752 WeakPolarHBondContact OG-CG2 3.21Å
679	A	89.1	Confident	84.2	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62.8	-40.8	174.6	0	0	0	0	0	112.2	I630 Y675 M676 I677 A681 R682 M683	I630-A679 HydrophobicContact CG2-CB 3.42Å; I630-A679 VanDerWaalsContact CG2-CB 3.42Å; Y675-A679 WeakPolarHBondContact O-CB 3.45Å; Y675-A679 PolarHBondContact O-N 2.91Å; M676-A679 PolarHBondContact O-N 3.19Å; I677-A679 PolarHBondContact O-N 3.1Å; A679-A681 VanDerWaalsContact C-N 3.34Å; A679-A681 PolarHBondContact O-N 3.35Å; A679-R682 PolarHBondContact O-N 2.94Å; A679-M683 VanDerWaalsContact O-CG 3.26Å; A679-M683 WeakPolarHBondContact O-CG 3.36Å; A679-M683 PolarHBondContact O-N 3.39Å
680	W	86.9	Confident	85.3	Confident	4 Å²	4	31.3 Å²	31.3	2%	0.015	16%	0.157	C	C	.	.	H	α-helix	trans	-61.5	-38.6	177.3	-68.2	130.3	0	0	0	112.9	M653 L656 L657 Q660 M676 I677 S678 M683 C684 F691 V698 Y760	M653-W680 HydrophobicContact CE-CE3 3.84Å; M653-W680 HydrophobicContact CE-CZ3 3.44Å; M653-W680 VanDerWaalsContact CE-CZ3 3.44Å; M653-W680 HydrophobicContact SD-CE3 4Å; M653-W680 HydrophobicContact SD-CZ3 3.6Å; L656-W680 HydrophobicContact CB-CE3 4.39Å; L656-W680 HydrophobicContact CB-CH2 3.17Å; L656-W680 HydrophobicContact CB-CZ2 3.61Å; L656-W680 HydrophobicContact CB-CZ3 3.6Å; L656-W680 HydrophobicContact CD1-CE3 3.89Å; L656-W680 HydrophobicContact CD1-CH2 4.16Å; L656-W680 HydrophobicContact CD1-CZ3 3.68Å; L656-W680 HydrophobicContact CG-CH2 4.29Å; L656-W680 HydrophobicContact CG-CZ3 4.29Å; L657-W680 HydrophobicContact CD2-CH2 3.55Å; L657-W680 HydrophobicContact CD2-CZ2 3.95Å; L657-W680 HydrophobicContact CG-CH2 3.78Å; Q660-W680 HydrophobicContact CB-CZ2 4.45Å; M676-W680 PolarHBondContact O-N 3.21Å; I677-W680 PolarHBondContact O-N 3.05Å; S678-W680 PolarHBondContact O-N 3.11Å; W680-M683 WeakPolarHBondContact O-CB 3.22Å; W680-M683 PolarHBondContact O-N 3.03Å; W680-C684 PolarHBondContact O-N 3.26Å; W680-F691 HydrophobicContact CB-CZ 4.41Å; W680-F691 HydrophobicContact CE3-CE2 4.49Å; W680-F691 WeakPolarHBondContact O-CE2 3.47Å; W680-F691 WeakPolarHBondContact O-CZ 3.34Å; W680-V698 HydrophobicContact CB-CG1 3.91Å; W680-V698 HydrophobicContact CD2-CG1 4.23Å; W680-V698 HydrophobicContact CD2-CG2 3.71Å; W680-V698 HydrophobicContact CE3-CG2 3.91Å; W680-V698 HydrophobicContact CG-CG1 3.74Å; W680-V698 HydrophobicContact CG-CG2 4.13Å; W680-V698 HydrophobicContact CH2-CG2 4.36Å; W680-V698 HydrophobicContact CZ2-CG2 4.19Å; W680-V698 HydrophobicContact CZ3-CG2 4.25Å; W680-Y760 WeakPolarHBondContact CB-OH 3.42Å
681	A	84.9	Confident	86.1	Confident	8 Å²	8	31.1 Å²	31.1	7%	0.066	16%	0.156	C	C	.	.	H	α-helix	trans	-68.8	-40	175.7	0	0	0	0	0	113.1	I677 S678 A679 M683 C684 K685 M756 Y760	I677-A681 PolarHBondContact O-N 3.37Å; S678-A681 PolarHBondContact O-N 3.28Å; A679-A681 VanDerWaalsContact C-N 3.34Å; A679-A681 PolarHBondContact O-N 3.35Å; A681-M683 VanDerWaalsContact C-N 3.31Å; A681-M683 PolarHBondContact O-N 3.07Å; A681-C684 WeakPolarHBondContact O-CB 3.28Å; A681-C684 PolarHBondContact O-N 2.95Å; A681-C684 VanDerWaalsContact O-N 3.12Å; A681-K685 PolarHBondContact O-N 2.97Å; A681-M756 HydrophobicContact CB-CB 4.31Å; A681-M756 HydrophobicContact CB-CG 4.01Å; A681-M756 HydrophobicContact CB-SD 3.13Å; A681-M756 WeakPolarHBondContact CB-SD 3.35Å; A681-Y760 HydrophobicContact CB-CE1 4.38Å
682	R	90.1	Very high	86.8	Confident	50 Å²	50	32.9 Å²	32.9	19%	0.189	16%	0.159	C	C	.	.	H	α-helix	trans	-58.8	-43.6	170.8	-66.7	167.1	-173.4	142.8	-3.8	110.5	E631 S634 S678 A679 C684 K685 I686	E631-R682 IonicContact OE1-CZ 3.16Å; E631-R682 IonicContact OE1-NH1 2.92Å; E631-R682 PolarHBondContact OE1-NH1 2.94Å; E631-R682 IonicContact OE1-NH2 2.7Å; E631-R682 PolarHBondContact OE1-NH2 3.36Å; S634-R682 WeakPolarHBondContact OG-CD 3.24Å; S634-R682 PolarHBondContact OG-NH1 3.23Å; S678-R682 WeakPolarHBondContact O-CG 3.34Å; S678-R682 PolarHBondContact O-N 3.15Å; S678-R682 VanDerWaalsContact O-N 3.14Å; A679-R682 PolarHBondContact O-N 2.94Å; R682-C684 VanDerWaalsContact C-N 3.34Å; R682-C684 PolarHBondContact O-N 3.41Å; R682-K685 PolarHBondContact O-N 2.9Å; R682-I686 VanDerWaalsContact O-CD1 3.29Å; R682-I686 WeakPolarHBondContact O-CD1 3.4Å; R682-I686 WeakPolarHBondContact O-CG1 3.32Å; R682-I686 PolarHBondContact O-N 3.08Å
683	M	90.5	Very high	87.4	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-60.7	-38.6	173.2	-64.3	-63.2	162.3	0	0	112.9	F645 V652 M653 L656 A679 W680 A681 I686 L687 F691	F645-M683 HydrophobicContact CE1-CE 4.16Å; F645-M683 HydrophobicContact CE1-SD 3.46Å; F645-M683 WeakPolarHBondContact CE1-SD 3.44Å; F645-M683 HydrophobicContact CZ-CE 3.66Å; F645-M683 HydrophobicContact CZ-SD 3.62Å; V652-M683 HydrophobicContact CG1-CE 3.59Å; M653-M683 HydrophobicContact SD-CB 3.79Å; M653-M683 HydrophobicContact SD-CG 3.66Å; M653-M683 HydrophobicContact SD-SD 4.14Å; L656-M683 HydrophobicContact CD1-CE 4.22Å; L656-M683 HydrophobicContact CD1-CG 4.27Å; A679-M683 VanDerWaalsContact O-CG 3.26Å; A679-M683 WeakPolarHBondContact O-CG 3.36Å; A679-M683 PolarHBondContact O-N 3.39Å; W680-M683 WeakPolarHBondContact O-CB 3.22Å; W680-M683 PolarHBondContact O-N 3.03Å; A681-M683 VanDerWaalsContact C-N 3.31Å; A681-M683 PolarHBondContact O-N 3.07Å; M683-I686 PolarHBondContact O-N 3.18Å; M683-I686 HydrophobicContact SD-CD1 4.44Å; M683-L687 WeakPolarHBondContact O-CB 3.29Å; M683-L687 WeakPolarHBondContact O-CG 3.39Å; M683-L687 PolarHBondContact O-N 3.23Å; M683-F691 HydrophobicContact CB-CD2 4.22Å; M683-F691 HydrophobicContact CB-CE2 3.87Å
684	C	90.5	Very high	87.9	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-63.6	-46.6	174.3	-176.2	0	0	0	0	112	W680 A681 R682 I686 L687 G688 F691 Y760	W680-C684 PolarHBondContact O-N 3.26Å; A681-C684 WeakPolarHBondContact O-CB 3.28Å; A681-C684 PolarHBondContact O-N 2.95Å; A681-C684 VanDerWaalsContact O-N 3.12Å; R682-C684 VanDerWaalsContact C-N 3.34Å; R682-C684 PolarHBondContact O-N 3.41Å; C684-I686 VanDerWaalsContact C-N 3.32Å; C684-I686 PolarHBondContact O-N 3.16Å; C684-L687 PolarHBondContact O-N 3.16Å; C684-G688 WeakPolarHBondContact O-CA 3.49Å; C684-G688 PolarHBondContact O-N 3.4Å; C684-F691 HydrophobicContact CB-CB 4.32Å; C684-F691 HydrophobicContact CB-CD1 3.63Å; C684-F691 HydrophobicContact CB-CD2 3.99Å; C684-F691 HydrophobicContact CB-CE1 3.8Å; C684-F691 HydrophobicContact CB-CE2 4.14Å; C684-F691 HydrophobicContact CB-CG 3.72Å; C684-F691 HydrophobicContact CB-CZ 4.05Å; C684-Y760 HydrophobicContact CB-CD1 3.81Å; C684-Y760 HydrophobicContact CB-CE1 3.54Å
685	K	88.9	Confident	88.3	Confident	124 Å²	124	39 Å²	39	54%	0.539	18%	0.183	S	C	.	.	H	α-helix	trans	-61.6	-37.9	176.8	-170.1	174.8	177.9	-175.6	0	112.2	L638 A681 R682	L638-K685 HydrophobicContact CD1-CB 4.38Å; L638-K685 HydrophobicContact CD1-CD 3.89Å; L638-K685 HydrophobicContact CD1-CG 4.04Å; A681-K685 PolarHBondContact O-N 2.97Å; R682-K685 PolarHBondContact O-N 2.9Å
686	I	90.3	Very high	88.5	Confident	11 Å²	11	41 Å²	41	6%	0.056	20%	0.202	C	C	.	.	H	α-helix	trans	-70.7	-49.3	177	-63.8	156.6	0	0	0	112	L638 K642 F645 R682 M683 C684	L638-I686 HydrophobicContact CB-CD1 4.17Å; L638-I686 HydrophobicContact CB-CG1 4.21Å; L638-I686 HydrophobicContact CD1-CG1 3.91Å; K642-I686 HydrophobicContact CB-CG2 4.31Å; K642-I686 WeakPolarHBondContact CB-O 3.45Å; K642-I686 WeakPolarHBondContact CD-O 3.46Å; F645-I686 HydrophobicContact CB-CG2 4.43Å; F645-I686 HydrophobicContact CD1-CD1 4.45Å; F645-I686 HydrophobicContact CD1-CG2 3.87Å; F645-I686 HydrophobicContact CG-CG2 4.49Å; R682-I686 VanDerWaalsContact O-CD1 3.29Å; R682-I686 WeakPolarHBondContact O-CD1 3.4Å; R682-I686 WeakPolarHBondContact O-CG1 3.32Å; R682-I686 PolarHBondContact O-N 3.08Å; M683-I686 PolarHBondContact O-N 3.18Å; M683-I686 HydrophobicContact SD-CD1 4.44Å; C684-I686 VanDerWaalsContact C-N 3.32Å; C684-I686 PolarHBondContact O-N 3.16Å
687	L	89.4	Confident	88.4	Confident	7 Å²	7	44.4 Å²	44.4	4%	0.037	22%	0.223	C	C	.	.	H	α-helix	trans	-82.8	-25.8	-172	-65.4	174.8	0	0	0	112.7	K642 M646 A649 M683 C684 E690 F691 Y694	K642-L687 PolarHBondContact NZ-O 3.29Å; M646-L687 HydrophobicContact CE-CD2 4.22Å; M646-L687 HydrophobicContact SD-CD2 3.6Å; M646-L687 VanDerWaalsContact SD-CD2 3.6Å; A649-L687 HydrophobicContact CB-CD2 4.21Å; M683-L687 WeakPolarHBondContact O-CB 3.29Å; M683-L687 WeakPolarHBondContact O-CG 3.39Å; M683-L687 PolarHBondContact O-N 3.23Å; C684-L687 PolarHBondContact O-N 3.16Å; L687-E690 HydrophobicContact CB-CB 4.41Å; L687-E690 PolarHBondContact O-N 2.98Å; L687-F691 HydrophobicContact CB-CB 4.18Å; L687-F691 HydrophobicContact CD1-CD2 4.3Å; L687-Y694 HydrophobicContact CD1-CE2 4.2Å
688	G	87.5	Confident	88.6	Confident	21 Å²	21	44.2 Å²	44.2	22%	0.216	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	59.6	-131.6	-173.6	0	0	0	0	0	111	C684 E690 F691 L764	C684-G688 WeakPolarHBondContact O-CA 3.49Å; C684-G688 PolarHBondContact O-N 3.4Å; G688-E690 PolarHBondContact O-N 3.47Å; G688-F691 VanDerWaalsContact O-CB 3.23Å; G688-F691 WeakPolarHBondContact O-CB 3.5Å; G688-F691 PolarHBondContact O-N 2.88Å; G688-L764 WeakPolarHBondContact O-CD2 3.32Å
689	K	86.4	Confident	88.8	Confident	156 Å²	156	43.1 Å²	43.1	68%	0.678	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-55.4	-24.4	-179.9	-62.1	-167.3	176.6	-164.7	0	114.5	F691 Q692	K689-F691 PolarHBondContact O-N 3.37Å; K689-Q692 WeakPolarHBondContact O-CB 3.41Å; K689-Q692 PolarHBondContact O-N 2.74Å
690	E	88.6	Confident	88.7	Confident	93 Å²	93	45.5 Å²	45.5	44%	0.435	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-72.3	-13.4	176.3	-69.2	-179.1	-114.2	0	0	113.5	K642 M646 L687 G688 Q692 Q693	K642-E690 WeakPolarHBondContact CE-OE1 3.41Å; K642-E690 IonicContact NZ-OE1 3.76Å; K642-E690 PolarHBondContact NZ-OE1 2.72Å; M646-E690 WeakPolarHBondContact CE-OE2 3.43Å; L687-E690 HydrophobicContact CB-CB 4.41Å; L687-E690 PolarHBondContact O-N 2.98Å; G688-E690 PolarHBondContact O-N 3.47Å; E690-Q692 PolarHBondContact O-N 2.84Å; E690-Q693 PolarHBondContact O-NE2 3.49Å
691	F	91	Very high	88.6	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-69.1	-22.4	171.4	-170	-101.5	0	0	0	112.9	M653 W680 M683 C684 L687 G688 K689 Q693 Y694 L695 V698 Y760 L764	M653-F691 HydrophobicContact CE-CD2 4.01Å; M653-F691 HydrophobicContact CE-CE2 3.64Å; W680-F691 HydrophobicContact CB-CZ 4.41Å; W680-F691 HydrophobicContact CE3-CE2 4.49Å; W680-F691 WeakPolarHBondContact O-CE2 3.47Å; W680-F691 WeakPolarHBondContact O-CZ 3.34Å; M683-F691 HydrophobicContact CB-CD2 4.22Å; M683-F691 HydrophobicContact CB-CE2 3.87Å; C684-F691 HydrophobicContact CB-CB 4.32Å; C684-F691 HydrophobicContact CB-CD1 3.63Å; C684-F691 HydrophobicContact CB-CD2 3.99Å; C684-F691 HydrophobicContact CB-CE1 3.8Å; C684-F691 HydrophobicContact CB-CE2 4.14Å; C684-F691 HydrophobicContact CB-CG 3.72Å; C684-F691 HydrophobicContact CB-CZ 4.05Å; L687-F691 HydrophobicContact CB-CB 4.18Å; L687-F691 HydrophobicContact CD1-CD2 4.3Å; G688-F691 VanDerWaalsContact O-CB 3.23Å; G688-F691 WeakPolarHBondContact O-CB 3.5Å; G688-F691 PolarHBondContact O-N 2.88Å; K689-F691 PolarHBondContact O-N 3.37Å; F691-Q693 PolarHBondContact O-N 3.39Å; F691-Y694 HydrophobicContact CD2-CD2 4.23Å; F691-Y694 WeakPolarHBondContact O-CB 3.47Å; F691-Y694 PolarHBondContact O-N 3.3Å; F691-L695 HydrophobicContact CD1-CD2 4.26Å; F691-L695 HydrophobicContact CE1-CD2 4.06Å; F691-V698 HydrophobicContact CZ-CG2 4.24Å; F691-Y760 HydrophobicContact CE1-CD1 4.32Å; F691-Y760 AromaticContact CE1-CE1 3.72Å; F691-Y760 HydrophobicContact CE1-CE1 3.72Å; F691-Y760 AromaticContact CE1-CZ 3.88Å; F691-Y760 HydrophobicContact CZ-CE1 4.11Å; F691-L764 HydrophobicContact CB-CD2 4.41Å; F691-L764 HydrophobicContact CD1-CD1 4.22Å
692	Q	90.3	Very high	88.8	Confident	97 Å²	97	46.5 Å²	46.5	45%	0.453	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-55.3	-30.4	-173.1	-165.1	-176.8	7.9	0	0	113.4	K689 E690 Y694 L695 G767	K689-Q692 WeakPolarHBondContact O-CB 3.41Å; K689-Q692 PolarHBondContact O-N 2.74Å; E690-Q692 PolarHBondContact O-N 2.84Å; Q692-Y694 PolarHBondContact O-N 2.92Å; Q692-L695 HydrophobicContact CG-CD1 4.09Å; Q692-L695 PolarHBondContact O-N 3.05Å; Q692-G767 VanDerWaalsContact NE2-CA 3.33Å; Q692-G767 PolarHBondContact NE2-O 3.39Å
693	Q	89.9	Confident	88.9	Confident	129 Å²	129	44.7 Å²	44.7	60%	0.603	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-64.2	-20	176.4	72.7	-168.3	-59.6	0	0	114.2	E690 F691	E690-Q693 PolarHBondContact O-NE2 3.49Å; F691-Q693 PolarHBondContact O-N 3.39Å
694	Y	89.8	Confident	88.8	Confident	34 Å²	34	49.3 Å²	49.3	13%	0.133	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-98.1	-16	-178.1	-55.8	-73.6	0	0	0	113.3	M653 L657 L687 F691 Q692 P696 V697 V698	M653-Y694 HydrophobicContact CB-CE1 4.1Å; M653-Y694 HydrophobicContact CE-CD1 3.71Å; M653-Y694 HydrophobicContact CE-CD2 3.36Å; M653-Y694 HydrophobicContact CE-CE1 4.07Å; M653-Y694 HydrophobicContact CE-CE2 3.75Å; M653-Y694 HydrophobicContact CE-CG 3.32Å; M653-Y694 HydrophobicContact CG-CE1 4.44Å; M653-Y694 HydrophobicContact CG-CE2 4.34Å; L657-Y694 HydrophobicContact CD1-CD1 4.38Å; L687-Y694 HydrophobicContact CD1-CE2 4.2Å; F691-Y694 HydrophobicContact CD2-CD2 4.23Å; F691-Y694 WeakPolarHBondContact O-CB 3.47Å; F691-Y694 PolarHBondContact O-N 3.3Å; Q692-Y694 PolarHBondContact O-N 2.92Å; Y694-P696 VanDerWaalsContact C-N 3.3Å; Y694-V697 PolarHBondContact O-N 3.06Å; Y694-V698 PolarHBondContact O-N 3.42Å; Y694-V698 VanDerWaalsContact O-N 3.11Å
695	L	90.5	Very high	88.7	Confident	3 Å²	3	49.6 Å²	49.6	2%	0.016	26%	0.26	C	S	.	.	H	α-helix	trans	-48.9	-41.7	177	-73.2	178.7	0	0	0	113.9	F691 Q692 V697 V698 M699 Y760 L764 F768 Y771	F691-L695 HydrophobicContact CD1-CD2 4.26Å; F691-L695 HydrophobicContact CE1-CD2 4.06Å; Q692-L695 HydrophobicContact CG-CD1 4.09Å; Q692-L695 PolarHBondContact O-N 3.05Å; L695-V697 PolarHBondContact O-N 2.95Å; L695-V698 PolarHBondContact O-N 2.99Å; L695-M699 HydrophobicContact CB-CG 4.19Å; L695-M699 HydrophobicContact CD2-CG 3.99Å; L695-M699 HydrophobicContact CD2-SD 4.19Å; L695-M699 VanDerWaalsContact O-CB 3.23Å; L695-M699 WeakPolarHBondContact O-CB 3.49Å; L695-M699 VanDerWaalsContact O-CG 3.24Å; L695-M699 WeakPolarHBondContact O-CG 3.02Å; L695-M699 PolarHBondContact O-N 3.23Å; L695-Y760 HydrophobicContact CD2-CD2 4.22Å; L695-L764 HydrophobicContact CD1-CD1 3.79Å; L695-L764 HydrophobicContact CD2-CD1 3.83Å; L695-L764 HydrophobicContact CG-CD1 4.06Å; L695-F768 HydrophobicContact CD1-CD2 4.33Å; L695-F768 HydrophobicContact CD2-CD2 4.46Å; L695-F768 HydrophobicContact CD2-CE2 4.48Å; L695-Y771 HydrophobicContact CB-CE2 3.76Å; L695-Y771 HydrophobicContact CD1-CD2 4.18Å; L695-Y771 HydrophobicContact CD1-CE2 3.77Å; L695-Y771 HydrophobicContact CG-CE2 4.33Å
696	P	89.5	Confident	88.8	Confident	91 Å²	91	43.7 Å²	43.7	59%	0.591	23%	0.234	S	C	*	.	H	α-helix	trans	-60.3	-20.9	179.6	-25.8	36.6	0	0	0	114.9	Y694 Y771	Y694-P696 VanDerWaalsContact C-N 3.3Å; P696-Y771 WeakPolarHBondContact CA-OH 3.23Å
697	V	83.6	Confident	89	Confident	71 Å²	71	45.9 Å²	45.9	43%	0.43	25%	0.251	S	S	.	.	H	α-helix	trans	-101.7	-33.5	180	-160.5	0	0	0	0	112	L657 Y694 L695 P701	L657-V697 HydrophobicContact CD2-CB 3.82Å; L657-V697 HydrophobicContact CD2-CG1 3.53Å; L657-V697 HydrophobicContact CD2-CG2 4.48Å; Y694-V697 PolarHBondContact O-N 3.06Å; L695-V697 PolarHBondContact O-N 2.95Å; V697-P701 VanDerWaalsContact O-CD 3.23Å; V697-P701 WeakPolarHBondContact O-CD 3.38Å
698	V	87	Confident	89	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.012	26%	0.256	C	S	.	.	H	α-helix	trans	-81.5	-34.3	-178.9	179.4	0	0	0	0	112.6	W680 F691 Y694 L695 G700 P701 L702 Y760	W680-V698 HydrophobicContact CB-CG1 3.91Å; W680-V698 HydrophobicContact CD2-CG1 4.23Å; W680-V698 HydrophobicContact CD2-CG2 3.71Å; W680-V698 HydrophobicContact CE3-CG2 3.91Å; W680-V698 HydrophobicContact CG-CG1 3.74Å; W680-V698 HydrophobicContact CG-CG2 4.13Å; W680-V698 HydrophobicContact CH2-CG2 4.36Å; W680-V698 HydrophobicContact CZ2-CG2 4.19Å; W680-V698 HydrophobicContact CZ3-CG2 4.25Å; F691-V698 HydrophobicContact CZ-CG2 4.24Å; Y694-V698 PolarHBondContact O-N 3.42Å; Y694-V698 VanDerWaalsContact O-N 3.11Å; L695-V698 PolarHBondContact O-N 2.99Å; V698-G700 PolarHBondContact O-N 3.01Å; V698-P701 WeakPolarHBondContact O-CD 3.46Å; V698-L702 WeakPolarHBondContact O-CB 3.14Å; V698-L702 PolarHBondContact O-N 3.14Å; V698-Y760 HydrophobicContact CG1-CE2 4.1Å; V698-Y760 WeakPolarHBondContact CG1-OH 3.5Å
699	M	89.9	Confident	88.9	Confident	5 Å²	5	54.9 Å²	54.9	3%	0.025	29%	0.285	C	S	.	.	H	α-helix	trans	-68.1	-33	-174.4	-74.4	-61.8	-60.9	0	0	114	L695 L702 M703 L757 Y760 F768 Y771 V775	L695-M699 HydrophobicContact CB-CG 4.19Å; L695-M699 HydrophobicContact CD2-CG 3.99Å; L695-M699 HydrophobicContact CD2-SD 4.19Å; L695-M699 VanDerWaalsContact O-CB 3.23Å; L695-M699 WeakPolarHBondContact O-CB 3.49Å; L695-M699 VanDerWaalsContact O-CG 3.24Å; L695-M699 WeakPolarHBondContact O-CG 3.02Å; L695-M699 PolarHBondContact O-N 3.23Å; M699-L702 HydrophobicContact SD-CD2 4.4Å; M699-M703 HydrophobicContact CE-CG 4.01Å; M699-M703 HydrophobicContact CE-SD 4.12Å; M699-M703 VanDerWaalsContact O-CB 3.29Å; M699-M703 WeakPolarHBondContact O-CB 3.46Å; M699-M703 WeakPolarHBondContact O-CG 3.46Å; M699-M703 PolarHBondContact O-N 3.11Å; M699-L757 HydrophobicContact CE-CD2 3.59Å; M699-L757 HydrophobicContact SD-CD2 4.13Å; M699-Y760 HydrophobicContact SD-CD2 3.84Å; M699-Y760 HydrophobicContact SD-CE2 4.18Å; M699-F768 HydrophobicContact CE-CE2 3.88Å; M699-F768 HydrophobicContact CE-CZ 3.83Å; M699-F768 HydrophobicContact SD-CE2 3.69Å; M699-F768 HydrophobicContact SD-CZ 4.18Å; M699-Y771 HydrophobicContact CB-CD1 4.03Å; M699-Y771 HydrophobicContact CB-CE1 3.68Å; M699-Y771 HydrophobicContact CE-CD1 3.87Å; M699-Y771 HydrophobicContact CE-CG 3.89Å; M699-Y771 HydrophobicContact CG-CD1 3.86Å; M699-Y771 HydrophobicContact CG-CD2 4.27Å; M699-Y771 HydrophobicContact CG-CE1 3.68Å; M699-Y771 HydrophobicContact CG-CE2 4.13Å; M699-Y771 HydrophobicContact CG-CG 4.15Å; M699-V775 HydrophobicContact CE-CG2 4.15Å
700	G	88.2	Confident	88.8	Confident	50 Å²	50	48.6 Å²	48.6	52%	0.515	26%	0.26	S	S	.	.	H	α-helix	trans	-60.8	-58.4	179.3	0	0	0	0	0	112.7	V698 L702 M703 K704	V698-G700 PolarHBondContact O-N 3.01Å; G700-L702 PolarHBondContact O-N 2.61Å; G700-M703 PolarHBondContact O-N 3.29Å; G700-K704 PolarHBondContact O-N 3.37Å
701	P	84.5	Confident	88.4	Confident	28 Å²	28	50 Å²	50	18%	0.182	27%	0.266	C	S	.	.	H	α-helix	trans	-57.4	-44.3	174.5	-26.2	35.1	0	0	0	113.1	Q660 F663 V697 V698 M703 K704 T705	Q660-P701 HydrophobicContact CG-CG 4.07Å; Q660-P701 VanDerWaalsContact NE2-CB 3.34Å; F663-P701 HydrophobicContact CD1-CB 4.24Å; F663-P701 HydrophobicContact CE1-CB 3.88Å; F663-P701 HydrophobicContact CZ-CB 4.38Å; V697-P701 VanDerWaalsContact O-CD 3.23Å; V697-P701 WeakPolarHBondContact O-CD 3.38Å; V698-P701 WeakPolarHBondContact O-CD 3.46Å; P701-M703 PolarHBondContact O-N 3.49Å; P701-K704 WeakPolarHBondContact O-CB 3.3Å; P701-K704 PolarHBondContact O-N 2.96Å; P701-K704 VanDerWaalsContact O-N 3.09Å; P701-T705 PolarHBondContact O-N 2.99Å; P701-T705 PolarHBondContact O-OG1 3.33Å
702	L	89	Confident	87.9	Confident	4 Å²	4	53.3 Å²	53.3	2%	0.021	29%	0.286	C	S	.	.	H	α-helix	trans	-61.3	-43.5	-179.8	-174.1	63.4	0	0	0	112.3	I677 V698 M699 G700 K704 T705 A706 A753 M756 L757 Y760	I677-L702 HydrophobicContact CD1-CD1 4.31Å; I677-L702 HydrophobicContact CG1-CD1 4.22Å; I677-L702 HydrophobicContact CG2-CD1 3.78Å; V698-L702 WeakPolarHBondContact O-CB 3.14Å; V698-L702 PolarHBondContact O-N 3.14Å; M699-L702 HydrophobicContact SD-CD2 4.4Å; G700-L702 PolarHBondContact O-N 2.61Å; L702-K704 VanDerWaalsContact C-N 3.32Å; L702-K704 PolarHBondContact O-N 2.68Å; L702-T705 PolarHBondContact O-N 2.94Å; L702-A706 WeakPolarHBondContact O-CB 3.34Å; L702-A706 PolarHBondContact O-N 2.87Å; L702-A753 HydrophobicContact CD1-CB 3.69Å; L702-M756 HydrophobicContact CD1-CB 4.1Å; L702-M756 HydrophobicContact CD2-CB 4.14Å; L702-L757 HydrophobicContact CD2-CD2 3.55Å; L702-L757 HydrophobicContact CD2-CG 3.84Å; L702-L757 HydrophobicContact CG-CD2 4.04Å; L702-L757 HydrophobicContact CG-CG 4.13Å; L702-Y760 HydrophobicContact CD2-CD2 3.84Å; L702-Y760 HydrophobicContact CD2-CE2 3.37Å
703	M	91.6	Very high	87.2	Confident	12 Å²	12	49.7 Å²	49.7	6%	0.059	27%	0.273	C	S	.	.	H	α-helix	trans	-68.3	-29.7	175.9	-68.1	-63.5	-74.3	0	0	112.3	M699 G700 P701 S707 L757 Q774 V775 L778	M699-M703 HydrophobicContact CE-CG 4.01Å; M699-M703 HydrophobicContact CE-SD 4.12Å; M699-M703 VanDerWaalsContact O-CB 3.29Å; M699-M703 WeakPolarHBondContact O-CB 3.46Å; M699-M703 WeakPolarHBondContact O-CG 3.46Å; M699-M703 PolarHBondContact O-N 3.11Å; G700-M703 PolarHBondContact O-N 3.29Å; P701-M703 PolarHBondContact O-N 3.49Å; M703-S707 WeakPolarHBondContact O-CB 3.26Å; M703-S707 PolarHBondContact O-N 2.73Å; M703-S707 VanDerWaalsContact O-N 3.13Å; M703-S707 PolarHBondContact O-OG 3.03Å; M703-L757 HydrophobicContact SD-CD1 3.83Å; M703-L757 HydrophobicContact SD-CD2 3.83Å; M703-Q774 HydrophobicContact CE-CB 4.33Å; M703-Q774 HydrophobicContact CE-CG 3.72Å; M703-V775 HydrophobicContact CE-CG2 4.15Å; M703-V775 HydrophobicContact SD-CG2 3.9Å; M703-L778 HydrophobicContact CE-CB 4.04Å; M703-L778 HydrophobicContact CE-CD2 3.52Å; M703-L778 HydrophobicContact CE-CG 4.43Å; M703-L778 HydrophobicContact SD-CD2 3.75Å
704	K	88.3	Confident	86.3	Confident	98 Å²	98	49.2 Å²	49.2	43%	0.426	27%	0.274	S	S	.	.	H	α-helix	trans	-62	-54.8	171.2	-170.7	-158.3	-179.9	-158.5	0	109.8	D668 G700 P701 L702 S707 I708	D668-K704 VanDerWaalsContact OD1-CE 3.27Å; D668-K704 WeakPolarHBondContact OD1-CE 3.35Å; D668-K704 IonicContact OD1-NZ 3.98Å; D668-K704 PolarHBondContact OD1-NZ 2.69Å; D668-K704 IonicContact OD2-NZ 3.74Å; G700-K704 PolarHBondContact O-N 3.37Å; P701-K704 WeakPolarHBondContact O-CB 3.3Å; P701-K704 PolarHBondContact O-N 2.96Å; P701-K704 VanDerWaalsContact O-N 3.09Å; L702-K704 VanDerWaalsContact C-N 3.32Å; L702-K704 PolarHBondContact O-N 2.68Å; K704-S707 CarbonylContact O-C 3.05Å; K704-S707 WeakPolarHBondContact O-CA 3.48Å; K704-S707 PolarHBondContact O-N 3.44Å; K704-I708 PolarHBondContact O-N 3.29Å
705	T	88.4	Confident	85.3	Confident	5 Å²	5	48.5 Å²	48.5	3%	0.031	27%	0.272	C	S	.	.	H	α-helix	trans	-62.6	-47.5	-177.5	-49.6	0	0	0	0	112.1	I673 I677 P701 L702 S707 I708 E749 A753	I673-T705 HydrophobicContact CG2-CG2 4.03Å; I677-T705 HydrophobicContact CD1-CG2 3.76Å; P701-T705 PolarHBondContact O-N 2.99Å; P701-T705 PolarHBondContact O-OG1 3.33Å; L702-T705 PolarHBondContact O-N 2.94Å; T705-S707 PolarHBondContact O-N 3.42Å; T705-S707 VanDerWaalsContact O-N 3.13Å; T705-I708 HydrophobicContact CG2-CD1 3.87Å; T705-I708 WeakPolarHBondContact O-CB 3.32Å; T705-I708 WeakPolarHBondContact O-CD1 3.46Å; T705-I708 VanDerWaalsContact O-CG1 3.25Å; T705-I708 WeakPolarHBondContact O-CG1 3.43Å; T705-I708 PolarHBondContact O-N 3.06Å; T705-E749 HydrophobicContact CG2-CB 3.76Å; T705-E749 WeakPolarHBondContact CG2-O 3.45Å; T705-A753 HydrophobicContact CG2-CB 3.89Å
706	A	92.1	Very high	84.3	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-63.1	-20.9	175.1	0	0	0	0	0	113.1	L702 K750 A753 L757 L778	L702-A706 WeakPolarHBondContact O-CB 3.34Å; L702-A706 PolarHBondContact O-N 2.87Å; A706-K750 PolarHBondContact O-NZ 2.81Å; A706-A753 HydrophobicContact CB-CB 3.83Å; A706-L757 HydrophobicContact CB-CD1 3.9Å; A706-L778 HydrophobicContact CB-CD2 3.73Å
707	S	93	Very high	83	Confident	57 Å²	57	46.7 Å²	46.7	40%	0.399	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	4	175.1	-56.2	0	0	0	0	114.7	M703 K704 T705 K709 L778	M703-S707 WeakPolarHBondContact O-CB 3.26Å; M703-S707 PolarHBondContact O-N 2.73Å; M703-S707 VanDerWaalsContact O-N 3.13Å; M703-S707 PolarHBondContact O-OG 3.03Å; K704-S707 CarbonylContact O-C 3.05Å; K704-S707 WeakPolarHBondContact O-CA 3.48Å; K704-S707 PolarHBondContact O-N 3.44Å; T705-S707 PolarHBondContact O-N 3.42Å; T705-S707 VanDerWaalsContact O-N 3.13Å; S707-K709 PolarHBondContact O-N 2.91Å; S707-L778 WeakPolarHBondContact OG-CD1 3.35Å
708	I	88.9	Confident	81.9	Confident	29 Å²	29	47.7 Å²	47.7	15%	0.149	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-52.5	132.4	173.9	-71.6	167.2	0	0	0	109	K704 T705 K750	K704-I708 PolarHBondContact O-N 3.29Å; T705-I708 HydrophobicContact CG2-CD1 3.87Å; T705-I708 WeakPolarHBondContact O-CB 3.32Å; T705-I708 WeakPolarHBondContact O-CD1 3.46Å; T705-I708 VanDerWaalsContact O-CG1 3.25Å; T705-I708 WeakPolarHBondContact O-CG1 3.43Å; T705-I708 PolarHBondContact O-N 3.06Å; I708-K750 PolarHBondContact O-NZ 3.47Å
709	K	86.7	Confident	81	Confident	189 Å²	189	49.4 Å²	49.4	82%	0.822	27%	0.268	S	S	*	.	P	Polyproline II helix	trans	-102.8	120.7	172.1	-65.8	-176.5	178.6	-176	0	106.6	S707	S707-K709 PolarHBondContact O-N 2.91Å
710	P	84.4	Confident	80	Confident	23 Å²	23	51 Å²	51	15%	0.149	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-61.8	145.4	174.3	27.1	-33.5	0	0	0	109.5	V712 I742 L747 F785 F787	P710-V712 HydrophobicContact CB-CG1 4.42Å; P710-V712 HydrophobicContact CG-CG1 4.31Å; P710-I742 HydrophobicContact CB-CD1 3.88Å; P710-I742 HydrophobicContact CB-CG1 3.99Å; P710-I742 HydrophobicContact CG-CD1 4.12Å; P710-L747 HydrophobicContact CB-CD2 3.96Å; P710-L747 HydrophobicContact CG-CD2 4.28Å; P710-F785 HydrophobicContact CG-CE2 3.88Å; P710-F785 HydrophobicContact CG-CZ 3.83Å; P710-F787 HydrophobicContact CG-CD2 3.98Å; P710-F787 HydrophobicContact CG-CE2 4.25Å
711	E	80.6	Confident	78.9	Confident	122 Å²	122	54.2 Å²	54.2	57%	0.57	28%	0.278	S	S	*	.	P	Polyproline II helix	trans	-73.7	127.2	166.3	-159.6	170.3	-178.7	0	0	107.7	W729 K743	E711-W729 HydrophobicContact CB-CH2 4.08Å; E711-W729 HydrophobicContact CB-CZ2 4.37Å; E711-W729 HydrophobicContact CG-CH2 3.83Å; E711-W729 HydrophobicContact CG-CZ2 4.12Å; E711-K743 HydrophobicContact CB-CB 3.95Å; E711-K743 PolarHBondContact O-N 2.78Å
712	V	80.6	Confident	78.1	Confident	71 Å²	71	58.4 Å²	58.4	43%	0.43	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	135.5	-178	-65.4	0	0	0	0	109.1	P710 F740 G741 I742 F787	P710-V712 HydrophobicContact CB-CG1 4.42Å; P710-V712 HydrophobicContact CG-CG1 4.31Å; V712-F740 HydrophobicContact CB-CE1 4.41Å; V712-F740 HydrophobicContact CB-CE2 4.33Å; V712-F740 HydrophobicContact CB-CZ 3.76Å; V712-F740 HydrophobicContact CG1-CE1 4.14Å; V712-F740 HydrophobicContact CG1-CZ 3.74Å; V712-G741 WeakPolarHBondContact CA-O 3.25Å; V712-I742 HydrophobicContact CG1-CB 4.39Å; V712-I742 HydrophobicContact CG1-CD1 4.14Å; V712-I742 HydrophobicContact CG1-CG1 4.09Å; V712-F787 HydrophobicContact CG1-CE2 4.48Å; V712-F787 HydrophobicContact CG1-CZ 4.19Å
713	A	75.4	Confident	77.1	Confident	20 Å²	20	60 Å²	60	17%	0.165	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	126.4	-176	0	0	0	0	0	110.3	L715 W729 G741	A713-L715 HydrophobicContact CB-CD1 4.41Å; A713-L715 HydrophobicContact CB-CD2 3.67Å; A713-L715 HydrophobicContact CB-CG 3.87Å; A713-W729 HydrophobicContact CB-CH2 4.05Å; A713-W729 HydrophobicContact CB-CZ3 3.97Å; A713-G741 PolarHBondContact N-O 3.12Å; A713-G741 PolarHBondContact O-N 3.33Å
714	L	70.6	Confident	75.7	Confident	120 Å²	120	62.6 Å²	62.6	63%	0.628	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89	108.2	164.8	-82.3	162.2	0	0	0	107.6	L734 F740	L714-L734 HydrophobicContact CD2-CD1 3.75Å; L714-F740 HydrophobicContact CD2-CD2 3.99Å; L714-F740 HydrophobicContact CG-CD2 4.25Å
715	L	69.3	Low	74.5	Confident	19 Å²	19	66.3 Å²	66.3	10%	0.099	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	159.9	-173	-59.8	-173.6	0	0	0	110.7	A713 D719 M720 I723 F731 Q738 S739	A713-L715 HydrophobicContact CB-CD1 4.41Å; A713-L715 HydrophobicContact CB-CD2 3.67Å; A713-L715 HydrophobicContact CB-CG 3.87Å; L715-D719 HydrophobicContact CB-CB 3.99Å; L715-D719 HydrophobicContact CD1-CB 4.5Å; L715-D719 HydrophobicContact CD2-CB 3.91Å; L715-D719 HydrophobicContact CG-CB 4.35Å; L715-M720 HydrophobicContact CD1-CB 4.47Å; L715-I723 HydrophobicContact CD1-CB 4.46Å; L715-I723 HydrophobicContact CD1-CD1 3.78Å; L715-I723 HydrophobicContact CD2-CD1 4.02Å; L715-F731 HydrophobicContact CD1-CD1 4.11Å; L715-F731 HydrophobicContact CD1-CE1 3.45Å; L715-F731 VanDerWaalsContact CD1-CE1 3.45Å; L715-F731 HydrophobicContact CD1-CZ 4.32Å; L715-Q738 WeakPolarHBondContact O-CA 3.46Å; L715-S739 PolarHBondContact N-O 3.46Å; L715-S739 PolarHBondContact O-N 3.32Å
716	D	68.1	Low	73.6	Confident	11 Å²	11	71.1 Å²	71.1	6%	0.059	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	170	157.7	72.8	35.9	0	0	0	111.1	R139 Q718 D719 M720 Q737	R139-D716 IonicContact CZ-OD2 2.63Å; R139-D716 VanDerWaalsContact CZ-OD2 3.31Å; R139-D716 IonicContact NE-OD2 2.64Å; R139-D716 VanDerWaalsContact NH2-CB 3.28Å; R139-D716 IonicContact NH2-OD2 3.38Å; R139-D716 PolarHBondContact NH2-OD2 3.35Å; D716-Q718 PolarHBondContact O-N 2.68Å; D716-Q718 VanDerWaalsContact O-N 3.08Å; D716-Q718 WeakPolarHBondContact OD1-CA 3.34Å; D716-Q718 VanDerWaalsContact OD1-CB 3.28Å; D716-Q718 WeakPolarHBondContact OD1-CB 3.21Å; D716-Q718 PolarHBondContact OD1-N 3.46Å; D716-D719 PolarHBondContact O-N 3.43Å; D716-D719 VanDerWaalsContact O-N 3.08Å; D716-D719 PolarHBondContact OD1-N 3.05Å; D716-M720 WeakPolarHBondContact O-CB 3.35Å; D716-M720 PolarHBondContact O-N 3.43Å; D716-Q737 WeakPolarHBondContact CA-O 3.41Å
717	T	62.5	Low	72.3	Confident	45 Å²	45	79.3 Å²	79.3	28%	0.276	41%	0.406	S	S	.	.	H	α-helix	trans	-53.5	-26.8	177.5	16.6	0	0	0	0	115.1	E721	T717-E721 WeakPolarHBondContact O-CG 3.4Å; T717-E721 PolarHBondContact O-N 3.41Å
718	Q	60.1	Low	71.2	Confident	92 Å²	92	78.2 Å²	78.2	43%	0.43	40%	0.403	S	S	.	.	H	α-helix	trans	-82	-39.4	177.4	-63.3	175.3	8.3	0	0	110.7	D716 M720 N722	D716-Q718 PolarHBondContact O-N 2.68Å; D716-Q718 VanDerWaalsContact O-N 3.08Å; D716-Q718 WeakPolarHBondContact OD1-CA 3.34Å; D716-Q718 VanDerWaalsContact OD1-CB 3.28Å; D716-Q718 WeakPolarHBondContact OD1-CB 3.21Å; D716-Q718 PolarHBondContact OD1-N 3.46Å; Q718-M720 VanDerWaalsContact C-N 3.34Å; Q718-N722 PolarHBondContact O-ND2 2.96Å
719	D	68.5	Low	70.8	Confident	37 Å²	37	78.2 Å²	78.2	20%	0.198	40%	0.401	C	S	.	.	H	α-helix	trans	-67.9	-36.1	174.7	-61.1	-50.7	0	0	0	111.6	R140 L715 D716 N722 I723	R140-D719 IonicContact CZ-OD2 3.87Å; R140-D719 IonicContact NE-OD2 3.54Å; R140-D719 IonicContact NH2-OD1 3.31Å; R140-D719 PolarHBondContact NH2-OD1 3.33Å; R140-D719 IonicContact NH2-OD2 2.71Å; R140-D719 PolarHBondContact NH2-OD2 2.98Å; L715-D719 HydrophobicContact CB-CB 3.99Å; L715-D719 HydrophobicContact CD1-CB 4.5Å; L715-D719 HydrophobicContact CD2-CB 3.91Å; L715-D719 HydrophobicContact CG-CB 4.35Å; D716-D719 PolarHBondContact O-N 3.43Å; D716-D719 VanDerWaalsContact O-N 3.08Å; D716-D719 PolarHBondContact OD1-N 3.05Å; D719-N722 PolarHBondContact O-N 3.47Å; D719-I723 PolarHBondContact O-N 3.26Å
720	M	68.5	Low	70.3	Confident	39 Å²	39	73.3 Å²	73.3	19%	0.192	38%	0.381	C	S	.	.	H	α-helix	trans	-59.7	-49	176.4	-170	-156.1	80	0	0	111.9	L715 D716 Q718 N722 I723 S724 F731	L715-M720 HydrophobicContact CD1-CB 4.47Å; D716-M720 WeakPolarHBondContact O-CB 3.35Å; D716-M720 PolarHBondContact O-N 3.43Å; Q718-M720 VanDerWaalsContact C-N 3.34Å; M720-N722 PolarHBondContact O-N 3.12Å; M720-I723 PolarHBondContact O-N 3.14Å; M720-I723 VanDerWaalsContact O-N 3.1Å; M720-S724 WeakPolarHBondContact O-CB 3.48Å; M720-S724 PolarHBondContact O-N 2.89Å; M720-S724 PolarHBondContact O-OG 2.94Å; M720-F731 HydrophobicContact CG-CB 4.11Å; M720-F731 HydrophobicContact CG-CD1 3.76Å; M720-F731 HydrophobicContact CG-CD2 4.07Å; M720-F731 HydrophobicContact CG-CE1 4.25Å; M720-F731 HydrophobicContact CG-CG 3.67Å; M720-F731 HydrophobicContact SD-CB 4.15Å; M720-F731 HydrophobicContact SD-CG 4.34Å
721	E	66.6	Low	70.1	Confident	117 Å²	117	74.4 Å²	74.4	55%	0.547	38%	0.384	S	S	.	.	H	α-helix	trans	-58.3	-31.9	179.3	-74.9	174.4	172.7	0	0	112.7	T717 S724	T717-E721 WeakPolarHBondContact O-CG 3.4Å; T717-E721 PolarHBondContact O-N 3.41Å; E721-S724 WeakPolarHBondContact CA-OG 3.48Å; E721-S724 PolarHBondContact O-OG 3.35Å; E721-S724 VanDerWaalsContact O-OG 3.04Å
722	N	67.4	Low	69.6	Low	117 Å²	117	69.9 Å²	69.9	63%	0.626	36%	0.364	S	S	*	.	H	α-helix	trans	-78.5	-26.4	178.5	-67.6	-71	0	0	0	113.7	Q718 D719 M720	Q718-N722 PolarHBondContact O-ND2 2.96Å; D719-N722 PolarHBondContact O-N 3.47Å; M720-N722 PolarHBondContact O-N 3.12Å
723	I	68.1	Low	69.1	Low	37 Å²	37	70.4 Å²	70.4	19%	0.19	37%	0.365	C	S	.	.	H	α-helix	trans	-99.7	-17.1	-177.5	-55.7	172.1	0	0	0	110.6	L715 D719 M720 E725 E726 W729 F731	L715-I723 HydrophobicContact CD1-CB 4.46Å; L715-I723 HydrophobicContact CD1-CD1 3.78Å; L715-I723 HydrophobicContact CD2-CD1 4.02Å; D719-I723 PolarHBondContact O-N 3.26Å; M720-I723 PolarHBondContact O-N 3.14Å; M720-I723 VanDerWaalsContact O-N 3.1Å; I723-E725 PolarHBondContact O-N 2.73Å; I723-E726 HydrophobicContact CG2-CB 4.44Å; I723-E726 WeakPolarHBondContact O-CB 3.13Å; I723-E726 PolarHBondContact O-N 2.77Å; I723-W729 HydrophobicContact CG2-CB 4.37Å; I723-W729 HydrophobicContact CG2-CD2 3.79Å; I723-W729 HydrophobicContact CG2-CE3 4.48Å; I723-W729 HydrophobicContact CG2-CG 3.74Å; I723-W729 HydrophobicContact CG2-CZ2 4.43Å; I723-F731 HydrophobicContact CB-CZ 3.97Å; I723-F731 HydrophobicContact CG2-CZ 3.87Å
724	S	62.2	Low	68.5	Low	67 Å²	67	71.6 Å²	71.6	47%	0.469	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-10.8	170	55.2	0	0	0	0	114.6	M720 E721	M720-S724 WeakPolarHBondContact O-CB 3.48Å; M720-S724 PolarHBondContact O-N 2.89Å; M720-S724 PolarHBondContact O-OG 2.94Å; E721-S724 WeakPolarHBondContact CA-OG 3.48Å; E721-S724 PolarHBondContact O-OG 3.35Å; E721-S724 VanDerWaalsContact O-OG 3.04Å
725	E	63.4	Low	68	Low	176 Å²	176	67.5 Å²	67.5	82%	0.822	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-6.8	167.7	-62.3	-175.1	177.2	0	0	112.7	I723	I723-E725 PolarHBondContact O-N 2.73Å
726	E	67.9	Low	67.8	Low	105 Å²	105	69.8 Å²	69.8	49%	0.491	37%	0.367	S	S	.	.	S	Bend	trans	-92.3	122.6	174.4	-65.8	-171	-177.6	0	0	111.3	I723 W729	I723-E726 HydrophobicContact CG2-CB 4.44Å; I723-E726 WeakPolarHBondContact O-CB 3.13Å; I723-E726 PolarHBondContact O-N 2.77Å; E726-W729 PolarHBondContact OE2-NE1 3.49Å
727	E	65.2	Low	67.6	Low	173 Å²	173	70.7 Å²	70.7	81%	0.808	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	140.1	177.2	-71.7	175.1	-173.3	0	0	113.3
728	G	71.1	Confident	67.8	Low	33 Å²	33	71 Å²	71	34%	0.34	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.9	16.9	176	0	0	0	0	0	115	K743 T744	G728-K743 CarbonylContact O-C 3.56Å; G728-K743 VanDerWaalsContact O-CA 3.27Å; G728-K743 WeakPolarHBondContact O-CA 3.39Å; G728-K743 WeakPolarHBondContact O-CG 3.23Å; G728-T744 PolarHBondContact O-N 3.32Å; G728-T744 PolarHBondContact O-OG1 2.9Å
729	W	79.3	Confident	68.4	Low	29 Å²	29	66.6 Å²	66.6	11%	0.11	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	129.9	165.7	-77.8	96.9	0	0	0	111.8	E711 A713 I723 E726 F731 I742 K743	E711-W729 HydrophobicContact CB-CH2 4.08Å; E711-W729 HydrophobicContact CB-CZ2 4.37Å; E711-W729 HydrophobicContact CG-CH2 3.83Å; E711-W729 HydrophobicContact CG-CZ2 4.12Å; A713-W729 HydrophobicContact CB-CH2 4.05Å; A713-W729 HydrophobicContact CB-CZ3 3.97Å; I723-W729 HydrophobicContact CG2-CB 4.37Å; I723-W729 HydrophobicContact CG2-CD2 3.79Å; I723-W729 HydrophobicContact CG2-CE3 4.48Å; I723-W729 HydrophobicContact CG2-CG 3.74Å; I723-W729 HydrophobicContact CG2-CZ2 4.43Å; E726-W729 PolarHBondContact OE2-NE1 3.49Å; W729-F731 HydrophobicContact CB-CE2 3.79Å; W729-F731 HydrophobicContact CB-CZ 3.68Å; W729-F731 HydrophobicContact CD2-CZ 4.48Å; W729-F731 HydrophobicContact CE3-CE1 4.34Å; W729-F731 HydrophobicContact CE3-CZ 4.37Å; W729-F731 HydrophobicContact CG-CZ 4.27Å; W729-I742 WeakPolarHBondContact CA-O 3.33Å; W729-I742 VanDerWaalsContact CE3-C 3.41Å; W729-K743 HydrophobicContact CD2-CB 4.1Å; W729-K743 HydrophobicContact CE3-CB 4.24Å; W729-K743 HydrophobicContact CH2-CB 4.4Å; W729-K743 HydrophobicContact CZ2-CB 4.28Å; W729-K743 HydrophobicContact CZ3-CB 4.38Å
730	E	77	Confident	68.7	Low	86 Å²	86	66.6 Å²	66.6	40%	0.402	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	144.4	172.5	-71.8	174.4	-146.9	0	0	110.7	M1 G741 I742 T744	M1-E730 HydrophobicContact CE-CB 4.3Å; M1-E730 WeakPolarHBondContact CE-OE2 3.5Å; E730-G741 CarbonylContact O-C 3.6Å; E730-G741 WeakPolarHBondContact O-CA 3.41Å; E730-I742 HydrophobicContact CB-CG2 4.41Å; E730-I742 PolarHBondContact N-O 3.14Å; E730-I742 PolarHBondContact O-N 3.37Å; E730-T744 HydrophobicContact CB-CG2 3.99Å; E730-T744 VanDerWaalsContact CD-CG2 3.43Å; E730-T744 HydrophobicContact CG-CG2 3.86Å; E730-T744 WeakPolarHBondContact OE1-CG2 3.17Å; E730-T744 PolarHBondContact OE1-OG1 2.91Å
731	F	78.9	Confident	69.3	Low	46 Å²	46	64.7 Å²	64.7	20%	0.202	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	131.4	-173.4	-59.1	-79.1	0	0	0	112.3	L715 M720 I723 W729 F740	L715-F731 HydrophobicContact CD1-CD1 4.11Å; L715-F731 HydrophobicContact CD1-CE1 3.45Å; L715-F731 VanDerWaalsContact CD1-CE1 3.45Å; L715-F731 HydrophobicContact CD1-CZ 4.32Å; M720-F731 HydrophobicContact CG-CB 4.11Å; M720-F731 HydrophobicContact CG-CD1 3.76Å; M720-F731 HydrophobicContact CG-CD2 4.07Å; M720-F731 HydrophobicContact CG-CE1 4.25Å; M720-F731 HydrophobicContact CG-CG 3.67Å; M720-F731 HydrophobicContact SD-CB 4.15Å; M720-F731 HydrophobicContact SD-CG 4.34Å; I723-F731 HydrophobicContact CB-CZ 3.97Å; I723-F731 HydrophobicContact CG2-CZ 3.87Å; W729-F731 HydrophobicContact CB-CE2 3.79Å; W729-F731 HydrophobicContact CB-CZ 3.68Å; W729-F731 HydrophobicContact CD2-CZ 4.48Å; W729-F731 HydrophobicContact CE3-CE1 4.34Å; W729-F731 HydrophobicContact CE3-CZ 4.37Å; W729-F731 HydrophobicContact CG-CZ 4.27Å; F731-F740 WeakPolarHBondContact CA-O 3.32Å
732	V	71.8	Confident	70	Confident	28 Å²	28	59.6 Å²	59.6	17%	0.17	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	116.3	169.1	-177.1	0	0	0	0	108.7	M1 L734 S739 F740	M1-V732 HydrophobicContact CB-CG2 4.11Å; M1-V732 HydrophobicContact CG-CG2 4.21Å; M1-V732 HydrophobicContact SD-CG2 3.36Å; M1-V732 WeakPolarHBondContact SD-CG2 3.47Å; V732-L734 PolarHBondContact O-N 3.32Å; V732-S739 CarbonylContact O-C 3.42Å; V732-S739 WeakPolarHBondContact O-CA 3.5Å; V732-F740 PolarHBondContact N-O 2.98Å; V732-F740 PolarHBondContact O-N 3.16Å
733	N	68.4	Low	70.7	Confident	82 Å²	82	57.1 Å²	57.1	44%	0.439	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	122	170.7	-98.4	-29.4	0	0	0	109.8	G735 S739	N733-G735 PolarHBondContact O-N 3.44Å; N733-S739 PolarHBondContact OD1-OG 3.26Å
734	L	63.7	Low	71.4	Confident	44 Å²	44	57 Å²	57	23%	0.23	30%	0.299	C	S	.	.			trans	-86.3	5.2	-179	-61.1	-178.3	0	0	0	113.1	Y5 L714 V732 Q738 F740	Y5-L734 HydrophobicContact CD2-CD2 3.75Å; Y5-L734 VanDerWaalsContact CE2-CA 3.47Å; Y5-L734 HydrophobicContact CE2-CB 4.12Å; Y5-L734 HydrophobicContact CE2-CD2 3.93Å; Y5-L734 WeakPolarHBondContact CE2-O 3.18Å; Y5-L734 VanDerWaalsContact OH-C 3.24Å; Y5-L734 PolarHBondContact OH-O 3.36Å; L714-L734 HydrophobicContact CD2-CD1 3.75Å; V732-L734 PolarHBondContact O-N 3.32Å; L734-Q738 HydrophobicContact CB-CB 4.45Å; L734-Q738 PolarHBondContact N-O 2.75Å; L734-F740 HydrophobicContact CD1-CB 4.1Å; L734-F740 HydrophobicContact CD2-CB 4.07Å; L734-F740 HydrophobicContact CG-CB 4.08Å
735	G	61.1	Low	72.3	Confident	34 Å²	34	56 Å²	56	35%	0.351	29%	0.294	S	S	.	.	S	Bend	trans	78.4	-178.4	-161.2	0	0	0	0	0	111.5	N733 Q737 Q738	N733-G735 PolarHBondContact O-N 3.44Å; G735-Q737 PolarHBondContact O-N 3.41Å; G735-Q738 PolarHBondContact O-N 3.41Å
736	D	63.6	Low	73.2	Confident	67 Å²	67	47.9 Å²	47.9	36%	0.358	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	21.6	168.6	-82.8	-50.5	0	0	0	116.6	R190 Q738	R190-D736 VanDerWaalsContact CZ-CB 3.49Å; R190-D736 VanDerWaalsContact CZ-CG 3.49Å; R190-D736 IonicContact CZ-OD1 3.22Å; R190-D736 IonicContact NE-OD1 3.75Å; R190-D736 PolarHBondContact NE-OD1 3.41Å; R190-D736 IonicContact NE-OD2 2.66Å; R190-D736 PolarHBondContact NE-OD2 3.46Å; R190-D736 PolarHBondContact NH2-O 3.3Å; R190-D736 IonicContact NH2-OD1 2.62Å; R190-D736 PolarHBondContact NH2-OD1 2.94Å; D736-Q738 VanDerWaalsContact C-N 3.28Å; D736-Q738 PolarHBondContact O-N 3.07Å
737	Q	63.7	Low	74.1	Confident	31 Å²	31	43.4 Å²	43.4	15%	0.145	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.3	24.8	-175.5	-49.7	-173.4	7.1	0	0	115.1	W228 N229 D716 G735	W228-Q737 VanDerWaalsContact CE3-NE2 3.32Å; W228-Q737 VanDerWaalsContact CZ2-NE2 3.29Å; N229-Q737 VanDerWaalsContact CG-CD 3.5Å; N229-Q737 VanDerWaalsContact ND2-CD 3.31Å; N229-Q737 PolarHBondContact ND2-OE1 2.59Å; D716-Q737 WeakPolarHBondContact CA-O 3.41Å; G735-Q737 PolarHBondContact O-N 3.41Å
738	Q	66.7	Low	75.1	Confident	51 Å²	51	40.9 Å²	40.9	24%	0.238	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	138.3	167.1	-61.9	-172	11.6	0	0	110.2	L715 L734 G735 D736	L715-Q738 WeakPolarHBondContact O-CA 3.46Å; L734-Q738 HydrophobicContact CB-CB 4.45Å; L734-Q738 PolarHBondContact N-O 2.75Å; G735-Q738 PolarHBondContact O-N 3.41Å; D736-Q738 VanDerWaalsContact C-N 3.28Å; D736-Q738 PolarHBondContact O-N 3.07Å
739	S	72.9	Confident	75.8	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	131	178.1	-44.7	0	0	0	0	108.4	L715 V732 N733	L715-S739 PolarHBondContact N-O 3.46Å; L715-S739 PolarHBondContact O-N 3.32Å; V732-S739 CarbonylContact O-C 3.42Å; V732-S739 WeakPolarHBondContact O-CA 3.5Å; N733-S739 PolarHBondContact OD1-OG 3.26Å
740	F	75.8	Confident	76.3	Confident	36 Å²	36	40 Å²	40	16%	0.158	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	106.2	172.1	-171.8	-89.6	0	0	0	108.6	V712 L714 F731 V732 L734 I742 F787	V712-F740 HydrophobicContact CB-CE1 4.41Å; V712-F740 HydrophobicContact CB-CE2 4.33Å; V712-F740 HydrophobicContact CB-CZ 3.76Å; V712-F740 HydrophobicContact CG1-CE1 4.14Å; V712-F740 HydrophobicContact CG1-CZ 3.74Å; L714-F740 HydrophobicContact CD2-CD2 3.99Å; L714-F740 HydrophobicContact CG-CD2 4.25Å; F731-F740 WeakPolarHBondContact CA-O 3.32Å; V732-F740 PolarHBondContact N-O 2.98Å; V732-F740 PolarHBondContact O-N 3.16Å; L734-F740 HydrophobicContact CD1-CB 4.1Å; L734-F740 HydrophobicContact CD2-CB 4.07Å; L734-F740 HydrophobicContact CG-CB 4.08Å; F740-I742 HydrophobicContact CE1-CB 4.16Å; F740-F787 HydrophobicContact CE1-CD1 4.24Å; F740-F787 AromaticContact CE1-CE1 3.51Å; F740-F787 HydrophobicContact CE1-CE1 3.51Å; F740-F787 HydrophobicContact CE1-CZ 4.24Å; F740-F787 AromaticContact CZ-CE1 3.56Å; F740-F787 HydrophobicContact CZ-CE1 3.56Å; F740-F787 AromaticContact CZ-CZ 3.85Å; F740-F787 HydrophobicContact CZ-CZ 3.85Å
741	G	80.4	Confident	77.1	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	136.7	170.8	0	0	0	0	0	111.2	V712 A713 E730	V712-G741 WeakPolarHBondContact CA-O 3.25Å; A713-G741 PolarHBondContact N-O 3.12Å; A713-G741 PolarHBondContact O-N 3.33Å; E730-G741 CarbonylContact O-C 3.6Å; E730-G741 WeakPolarHBondContact O-CA 3.41Å
742	I	82.1	Confident	77.5	Confident	9 Å²	9	35.7 Å²	35.7	5%	0.046	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	134.5	168.7	-177.5	160.5	0	0	0	110	P710 V712 W729 E730 F740 T744 L747 F787	P710-I742 HydrophobicContact CB-CD1 3.88Å; P710-I742 HydrophobicContact CB-CG1 3.99Å; P710-I742 HydrophobicContact CG-CD1 4.12Å; V712-I742 HydrophobicContact CG1-CB 4.39Å; V712-I742 HydrophobicContact CG1-CD1 4.14Å; V712-I742 HydrophobicContact CG1-CG1 4.09Å; W729-I742 WeakPolarHBondContact CA-O 3.33Å; W729-I742 VanDerWaalsContact CE3-C 3.41Å; E730-I742 HydrophobicContact CB-CG2 4.41Å; E730-I742 PolarHBondContact N-O 3.14Å; E730-I742 PolarHBondContact O-N 3.37Å; F740-I742 HydrophobicContact CE1-CB 4.16Å; I742-T744 HydrophobicContact CG2-CG2 4.21Å; I742-T744 PolarHBondContact O-N 2.89Å; I742-L747 HydrophobicContact CD1-CD1 4.13Å; I742-F787 HydrophobicContact CD1-CB 3.57Å; I742-F787 HydrophobicContact CD1-CD1 3.47Å; I742-F787 VanDerWaalsContact CD1-CD1 3.47Å; I742-F787 HydrophobicContact CD1-CD2 3.97Å; I742-F787 HydrophobicContact CD1-CE1 4.13Å; I742-F787 HydrophobicContact CD1-CG 3.38Å
743	K	82.3	Confident	78.5	Confident	65 Å²	65	34.3 Å²	34.3	28%	0.283	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	112.7	168.2	-163.5	168.7	-171.1	162.8	0	109	E711 G728 W729 A745	E711-K743 HydrophobicContact CB-CB 3.95Å; E711-K743 PolarHBondContact O-N 2.78Å; G728-K743 CarbonylContact O-C 3.56Å; G728-K743 VanDerWaalsContact O-CA 3.27Å; G728-K743 WeakPolarHBondContact O-CA 3.39Å; G728-K743 WeakPolarHBondContact O-CG 3.23Å; W729-K743 HydrophobicContact CD2-CB 4.1Å; W729-K743 HydrophobicContact CE3-CB 4.24Å; W729-K743 HydrophobicContact CH2-CB 4.4Å; W729-K743 HydrophobicContact CZ2-CB 4.28Å; W729-K743 HydrophobicContact CZ3-CB 4.38Å; K743-A745 HydrophobicContact CG-CB 4.22Å
744	T	81.7	Confident	79.8	Confident	35 Å²	35	30.4 Å²	30.4	22%	0.215	17%	0.169	C	C	.	.			trans	-82.6	-17.5	-176	54.5	0	0	0	0	113.4	G728 E730 I742 G746 L747	G728-T744 PolarHBondContact O-N 3.32Å; G728-T744 PolarHBondContact O-OG1 2.9Å; E730-T744 HydrophobicContact CB-CG2 3.99Å; E730-T744 VanDerWaalsContact CD-CG2 3.43Å; E730-T744 HydrophobicContact CG-CG2 3.86Å; E730-T744 WeakPolarHBondContact OE1-CG2 3.17Å; E730-T744 PolarHBondContact OE1-OG1 2.91Å; I742-T744 HydrophobicContact CG2-CG2 4.21Å; I742-T744 PolarHBondContact O-N 2.89Å; T744-G746 PolarHBondContact O-N 3.31Å; T744-L747 HydrophobicContact CG2-CD1 4.05Å; T744-L747 VanDerWaalsContact O-CB 3.29Å; T744-L747 WeakPolarHBondContact O-CB 3.16Å; T744-L747 WeakPolarHBondContact O-CG 3.42Å; T744-L747 PolarHBondContact O-N 3.12Å
745	A	81.5	Confident	81.2	Confident	45 Å²	45	31.5 Å²	31.5	37%	0.372	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	126	169.9	0	0	0	0	0	111.8	K743	K743-A745 HydrophobicContact CG-CB 4.22Å
746	G	81.4	Confident	82.6	Confident	6 Å²	6	31.1 Å²	31.1	6%	0.062	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.6	-4.5	-178.3	0	0	0	0	0	115.5	T744 E749 K750	T744-G746 PolarHBondContact O-N 3.31Å; G746-E749 WeakPolarHBondContact CA-OE2 3.49Å; G746-E749 PolarHBondContact N-OE2 3.33Å; G746-K750 VanDerWaalsContact O-CB 3.23Å; G746-K750 WeakPolarHBondContact O-CB 3.19Å; G746-K750 PolarHBondContact O-N 2.74Å
747	L	87.1	Confident	84.2	Confident	11 Å²	11	28 Å²	28	6%	0.058	15%	0.145	C	C	.	.	H	α-helix	trans	-71.9	-42.1	178.1	-69.6	-174	0	0	0	112.5	P710 I742 T744 K750 A751 F785	P710-L747 HydrophobicContact CB-CD2 3.96Å; P710-L747 HydrophobicContact CG-CD2 4.28Å; I742-L747 HydrophobicContact CD1-CD1 4.13Å; T744-L747 HydrophobicContact CG2-CD1 4.05Å; T744-L747 VanDerWaalsContact O-CB 3.29Å; T744-L747 WeakPolarHBondContact O-CB 3.16Å; T744-L747 WeakPolarHBondContact O-CG 3.42Å; T744-L747 PolarHBondContact O-N 3.12Å; L747-K750 WeakPolarHBondContact O-CB 3.14Å; L747-K750 PolarHBondContact O-N 2.83Å; L747-A751 PolarHBondContact O-N 3Å; L747-F785 HydrophobicContact CD2-CE1 3.87Å; L747-F785 HydrophobicContact CD2-CZ 3.64Å
748	E	86.4	Confident	85.7	Confident	120 Å²	120	26.7 Å²	26.7	56%	0.561	14%	0.14	S	C	*	.	H	α-helix	trans	-68.7	-39.5	175.8	-73.9	-64.6	165.9	0	0	111.7	K750 A751 T752 H788	E748-K750 VanDerWaalsContact C-N 3.28Å; E748-K750 PolarHBondContact O-N 3.34Å; E748-A751 PolarHBondContact O-N 3.04Å; E748-T752 VanDerWaalsContact O-CB 3.29Å; E748-T752 WeakPolarHBondContact O-CB 3.36Å; E748-T752 PolarHBondContact O-N 2.89Å; E748-T752 PolarHBondContact O-OG1 3.01Å; E748-H788 IonicContact OE1-NE2 3.72Å; E748-H788 PolarHBondContact OE1-NE2 3.26Å; E748-H788 IonicContact OE2-NE2 2.69Å
749	E	86.1	Confident	86.9	Confident	38 Å²	38	25.7 Å²	25.7	18%	0.178	14%	0.138	C	C	.	.	H	α-helix	trans	-59.8	-40.7	171.8	-71.5	64.3	-144.4	0	0	110.9	I673 T705 G746 A753	I673-E749 HydrophobicContact CG2-CG 4.17Å; T705-E749 HydrophobicContact CG2-CB 3.76Å; T705-E749 WeakPolarHBondContact CG2-O 3.45Å; G746-E749 WeakPolarHBondContact CA-OE2 3.49Å; G746-E749 PolarHBondContact N-OE2 3.33Å; E749-A753 WeakPolarHBondContact O-CB 3.42Å; E749-A753 PolarHBondContact O-N 3.33Å
750	K	90.8	Very high	87.9	Confident	6 Å²	6	25.7 Å²	25.7	3%	0.026	14%	0.138	C	C	.	.	H	α-helix	trans	-66.2	-44.9	175.7	-179.1	-168.3	-177.8	68.9	0	111.7	A706 I708 G746 L747 E748 A753 C754 F785 V791	A706-K750 PolarHBondContact O-NZ 2.81Å; I708-K750 PolarHBondContact O-NZ 3.47Å; G746-K750 VanDerWaalsContact O-CB 3.23Å; G746-K750 WeakPolarHBondContact O-CB 3.19Å; G746-K750 PolarHBondContact O-N 2.74Å; L747-K750 WeakPolarHBondContact O-CB 3.14Å; L747-K750 PolarHBondContact O-N 2.83Å; E748-K750 VanDerWaalsContact C-N 3.28Å; E748-K750 PolarHBondContact O-N 3.34Å; K750-A753 PolarHBondContact O-N 3.39Å; K750-C754 PolarHBondContact O-N 2.95Å; K750-C754 PolarHBondContact O-SG 3.35Å; K750-F785 HydrophobicContact CD-CE1 3.89Å; K750-F785 HydrophobicContact CD-CE2 4.25Å; K750-F785 HydrophobicContact CD-CZ 3.67Å; K750-V791 HydrophobicContact CD-CG2 4.18Å; K750-V791 HydrophobicContact CG-CG2 4.2Å
751	A	91.9	Very high	88.9	Confident	8 Å²	8	24.1 Å²	24.1	7%	0.066	13%	0.131	C	C	.	.	H	α-helix	trans	-60.9	-50.7	176.7	0	0	0	0	0	111.1	L747 E748 A753 C754 Q755 H788 V791	L747-A751 PolarHBondContact O-N 3Å; E748-A751 PolarHBondContact O-N 3.04Å; A751-A753 VanDerWaalsContact C-N 3.34Å; A751-A753 PolarHBondContact O-N 3.33Å; A751-C754 WeakPolarHBondContact O-CB 3.41Å; A751-C754 PolarHBondContact O-N 3.23Å; A751-C754 VanDerWaalsContact O-N 3.16Å; A751-Q755 PolarHBondContact O-N 3.45Å; A751-H788 VanDerWaalsContact CB-CE1 3.41Å; A751-H788 WeakPolarHBondContact CB-CE1 3.47Å; A751-H788 WeakPolarHBondContact CB-NE2 3.4Å; A751-V791 HydrophobicContact CB-CG2 3.78Å
752	T	89.3	Confident	89.5	Confident	33 Å²	33	29.8 Å²	29.8	20%	0.202	16%	0.156	C	C	.	.	H	α-helix	trans	-54.6	-49.3	174	-57.4	0	0	0	0	110.8	I677 S678 E748 C754 Q755 M756	I677-T752 HydrophobicContact CG2-CG2 3.9Å; S678-T752 WeakPolarHBondContact OG-CG2 3.21Å; E748-T752 VanDerWaalsContact O-CB 3.29Å; E748-T752 WeakPolarHBondContact O-CB 3.36Å; E748-T752 PolarHBondContact O-N 2.89Å; E748-T752 PolarHBondContact O-OG1 3.01Å; T752-C754 VanDerWaalsContact C-N 3.34Å; T752-C754 PolarHBondContact O-N 3.15Å; T752-Q755 PolarHBondContact O-N 2.89Å; T752-Q755 VanDerWaalsContact O-N 3.16Å; T752-M756 HydrophobicContact CG2-CE 4.38Å; T752-M756 WeakPolarHBondContact O-CE 3.45Å; T752-M756 VanDerWaalsContact O-CG 3.31Å; T752-M756 WeakPolarHBondContact O-CG 3.24Å; T752-M756 PolarHBondContact O-N 3.4Å
753	A	91.8	Very high	89.9	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-60.7	-40.2	179	0	0	0	0	0	112.9	I677 L702 T705 A706 E749 K750 A751 M756 L757	I677-A753 HydrophobicContact CD1-CB 4.26Å; L702-A753 HydrophobicContact CD1-CB 3.69Å; T705-A753 HydrophobicContact CG2-CB 3.89Å; A706-A753 HydrophobicContact CB-CB 3.83Å; E749-A753 WeakPolarHBondContact O-CB 3.42Å; E749-A753 PolarHBondContact O-N 3.33Å; K750-A753 PolarHBondContact O-N 3.39Å; A751-A753 VanDerWaalsContact C-N 3.34Å; A751-A753 PolarHBondContact O-N 3.33Å; A753-M756 PolarHBondContact O-N 3.41Å; A753-L757 WeakPolarHBondContact O-CG 3.23Å; A753-L757 PolarHBondContact O-N 3.32Å
754	C	95.8	Very high	90.4	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-63.2	-45.2	174.1	-66.6	0	0	0	0	111.1	K750 A751 T752 M756 L757 V758 M779 A794	K750-C754 PolarHBondContact O-N 2.95Å; K750-C754 PolarHBondContact O-SG 3.35Å; A751-C754 WeakPolarHBondContact O-CB 3.41Å; A751-C754 PolarHBondContact O-N 3.23Å; A751-C754 VanDerWaalsContact O-N 3.16Å; T752-C754 VanDerWaalsContact C-N 3.34Å; T752-C754 PolarHBondContact O-N 3.15Å; C754-M756 VanDerWaalsContact C-N 3.28Å; C754-M756 PolarHBondContact O-N 3.39Å; C754-L757 WeakPolarHBondContact O-CB 3.4Å; C754-L757 PolarHBondContact O-N 3.04Å; C754-L757 VanDerWaalsContact O-N 3.07Å; C754-V758 PolarHBondContact O-N 2.87Å; C754-V758 VanDerWaalsContact O-N 3.16Å; C754-M779 HydrophobicContact CB-CE 3.98Å; C754-M779 HydrophobicContact CB-SD 4.36Å; C754-M779 WeakPolarHBondContact O-CE 3.34Å; C754-A794 HydrophobicContact CB-CB 3.66Å
755	Q	93.5	Very high	90.9	Very high	67 Å²	67	33.3 Å²	33.3	31%	0.313	17%	0.169	S	C	.	.	H	α-helix	trans	-65.7	-29.9	178.8	-162.3	60.5	9.3	0	0	112.8	A751 T752 L757 V758 C759 A794 E797	A751-Q755 PolarHBondContact O-N 3.45Å; T752-Q755 PolarHBondContact O-N 2.89Å; T752-Q755 VanDerWaalsContact O-N 3.16Å; Q755-L757 VanDerWaalsContact C-N 3.35Å; Q755-V758 WeakPolarHBondContact O-CB 3.44Å; Q755-V758 PolarHBondContact O-N 2.97Å; Q755-C759 PolarHBondContact O-N 2.92Å; Q755-A794 HydrophobicContact CB-CB 4.47Å; Q755-E797 PolarHBondContact NE2-OE2 2.75Å
756	M	90.9	Very high	91.4	Very high	26 Å²	26	36.8 Å²	36.8	13%	0.128	18%	0.178	C	C	.	.	H	α-helix	trans	-71.4	-30.4	173.7	-57.1	-45.6	89.2	0	0	112.1	I677 A681 L702 T752 A753 C754 C759 Y760	I677-M756 HydrophobicContact CG2-CB 4.22Å; I677-M756 HydrophobicContact CG2-CG 3.33Å; A681-M756 HydrophobicContact CB-CB 4.31Å; A681-M756 HydrophobicContact CB-CG 4.01Å; A681-M756 HydrophobicContact CB-SD 3.13Å; A681-M756 WeakPolarHBondContact CB-SD 3.35Å; L702-M756 HydrophobicContact CD1-CB 4.1Å; L702-M756 HydrophobicContact CD2-CB 4.14Å; T752-M756 HydrophobicContact CG2-CE 4.38Å; T752-M756 WeakPolarHBondContact O-CE 3.45Å; T752-M756 VanDerWaalsContact O-CG 3.31Å; T752-M756 WeakPolarHBondContact O-CG 3.24Å; T752-M756 PolarHBondContact O-N 3.4Å; A753-M756 PolarHBondContact O-N 3.41Å; C754-M756 VanDerWaalsContact C-N 3.28Å; C754-M756 PolarHBondContact O-N 3.39Å; M756-C759 WeakPolarHBondContact O-CB 3.45Å; M756-C759 PolarHBondContact O-N 3.12Å; M756-Y760 PolarHBondContact O-N 3.14Å
757	L	95.9	Very high	92	Very high	1 Å²	1	37 Å²	37	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-66.1	-39.2	171.7	-67.4	168.4	0	0	0	111.4	M699 L702 M703 A706 A753 C754 Q755 Y760 A761 F768 V775 L778 M779	M699-L757 HydrophobicContact CE-CD2 3.59Å; M699-L757 HydrophobicContact SD-CD2 4.13Å; L702-L757 HydrophobicContact CD2-CD2 3.55Å; L702-L757 HydrophobicContact CD2-CG 3.84Å; L702-L757 HydrophobicContact CG-CD2 4.04Å; L702-L757 HydrophobicContact CG-CG 4.13Å; M703-L757 HydrophobicContact SD-CD1 3.83Å; M703-L757 HydrophobicContact SD-CD2 3.83Å; A706-L757 HydrophobicContact CB-CD1 3.9Å; A753-L757 WeakPolarHBondContact O-CG 3.23Å; A753-L757 PolarHBondContact O-N 3.32Å; C754-L757 WeakPolarHBondContact O-CB 3.4Å; C754-L757 PolarHBondContact O-N 3.04Å; C754-L757 VanDerWaalsContact O-N 3.07Å; Q755-L757 VanDerWaalsContact C-N 3.35Å; L757-Y760 PolarHBondContact O-N 3.13Å; L757-A761 PolarHBondContact O-N 3.16Å; L757-F768 HydrophobicContact CD2-CZ 4.24Å; L757-V775 HydrophobicContact CB-CG1 4.29Å; L757-V775 HydrophobicContact CD1-CG1 4.3Å; L757-V775 HydrophobicContact CD2-CG2 4.08Å; L757-L778 HydrophobicContact CD1-CD2 4.05Å; L757-M779 HydrophobicContact CB-CE 3.71Å; L757-M779 HydrophobicContact CD1-CE 3.89Å; L757-M779 HydrophobicContact CG-CE 4.44Å
758	V	96.2	Very high	92.4	Very high	4 Å²	4	36.5 Å²	36.5	2%	0.024	18%	0.178	C	C	.	.	H	α-helix	trans	-58.3	-49.5	169.9	-178.5	0	0	0	0	110.2	C754 Q755 Y760 A761 K762 A794 E797 L801	C754-V758 PolarHBondContact O-N 2.87Å; C754-V758 VanDerWaalsContact O-N 3.16Å; Q755-V758 WeakPolarHBondContact O-CB 3.44Å; Q755-V758 PolarHBondContact O-N 2.97Å; V758-Y760 PolarHBondContact O-N 2.93Å; V758-A761 PolarHBondContact O-N 2.96Å; V758-K762 WeakPolarHBondContact O-CB 3.33Å; V758-K762 PolarHBondContact O-N 3.29Å; V758-A794 HydrophobicContact CG2-CB 4.13Å; V758-A794 WeakPolarHBondContact CG2-O 3.45Å; V758-E797 HydrophobicContact CG1-CB 3.92Å; V758-E797 WeakPolarHBondContact CG1-OE2 3.41Å; V758-E797 HydrophobicContact CG2-CB 4.25Å; V758-L801 HydrophobicContact CG1-CD1 3.56Å
759	C	92	Very high	92.8	Very high	29 Å²	29	31.4 Å²	31.4	20%	0.196	16%	0.155	C	C	.	.	H	α-helix	trans	-57.4	-45	178	-172.8	0	0	0	0	112.3	Q755 M756 K762 E763	Q755-C759 PolarHBondContact O-N 2.92Å; M756-C759 WeakPolarHBondContact O-CB 3.45Å; M756-C759 PolarHBondContact O-N 3.12Å; C759-K762 PolarHBondContact O-N 3.4Å; C759-E763 WeakPolarHBondContact O-CB 3.49Å; C759-E763 WeakPolarHBondContact O-CG 3.33Å; C759-E763 PolarHBondContact O-N 3.06Å
760	Y	94.2	Very high	93.3	Very high	1 Å²	1	35.9 Å²	35.9	0%	0.004	18%	0.176	C	C	.	.	H	α-helix	trans	-66.7	-40.1	178.7	-65.8	-19.7	0	0	0	113.1	W680 A681 C684 F691 L695 V698 M699 L702 M756 L757 V758 L764 F768	W680-Y760 WeakPolarHBondContact CB-OH 3.42Å; A681-Y760 HydrophobicContact CB-CE1 4.38Å; C684-Y760 HydrophobicContact CB-CD1 3.81Å; C684-Y760 HydrophobicContact CB-CE1 3.54Å; F691-Y760 HydrophobicContact CE1-CD1 4.32Å; F691-Y760 AromaticContact CE1-CE1 3.72Å; F691-Y760 HydrophobicContact CE1-CE1 3.72Å; F691-Y760 AromaticContact CE1-CZ 3.88Å; F691-Y760 HydrophobicContact CZ-CE1 4.11Å; L695-Y760 HydrophobicContact CD2-CD2 4.22Å; V698-Y760 HydrophobicContact CG1-CE2 4.1Å; V698-Y760 WeakPolarHBondContact CG1-OH 3.5Å; M699-Y760 HydrophobicContact SD-CD2 3.84Å; M699-Y760 HydrophobicContact SD-CE2 4.18Å; L702-Y760 HydrophobicContact CD2-CD2 3.84Å; L702-Y760 HydrophobicContact CD2-CE2 3.37Å; M756-Y760 PolarHBondContact O-N 3.14Å; L757-Y760 PolarHBondContact O-N 3.13Å; V758-Y760 PolarHBondContact O-N 2.93Å; Y760-L764 VanDerWaalsContact O-CB 3.25Å; Y760-L764 WeakPolarHBondContact O-CB 3.45Å; Y760-L764 WeakPolarHBondContact O-CG 3.31Å; Y760-L764 PolarHBondContact O-N 3.31Å; Y760-F768 HydrophobicContact CD2-CE2 4.17Å; Y760-F768 HydrophobicContact CG-CE2 4.33Å
761	A	95.1	Very high	93.6	Very high	2 Å²	2	37.8 Å²	37.8	2%	0.017	18%	0.183	C	C	.	.	H	α-helix	trans	-60.8	-46.7	174.1	0	0	0	0	0	111.1	L757 V758 K765 F768 L801 L802	L757-A761 PolarHBondContact O-N 3.16Å; V758-A761 PolarHBondContact O-N 2.96Å; A761-K765 WeakPolarHBondContact O-CA 3.41Å; A761-K765 PolarHBondContact O-N 3.09Å; A761-F768 HydrophobicContact CB-CD1 3.98Å; A761-F768 HydrophobicContact CB-CE1 4.16Å; A761-L801 HydrophobicContact CB-CB 3.98Å; A761-L802 HydrophobicContact CB-CD2 4.42Å
762	K	92.9	Very high	93.8	Very high	119 Å²	119	37.4 Å²	37.4	52%	0.517	18%	0.18	S	C	.	.	H	α-helix	trans	-62.6	-49.8	-179.7	-172.3	172.8	-178.8	170.6	0	113.6	V758 C759 K765 L801	V758-K762 WeakPolarHBondContact O-CB 3.33Å; V758-K762 PolarHBondContact O-N 3.29Å; C759-K762 PolarHBondContact O-N 3.4Å; K762-K765 VanDerWaalsContact O-CE 3.26Å; K762-K765 WeakPolarHBondContact O-CE 3.41Å; K762-K765 VanDerWaalsContact O-CG 3.26Å; K762-K765 WeakPolarHBondContact O-CG 3.3Å; K762-L801 HydrophobicContact CB-CD1 4.07Å; K762-L801 HydrophobicContact CB-CD2 4.26Å; K762-L801 HydrophobicContact CG-CD2 4.37Å
763	E	91.4	Very high	94.2	Very high	76 Å²	76	39.4 Å²	39.4	36%	0.355	19%	0.187	S	C	.	.	H	α-helix	trans	-82	-35.8	-172.7	-62.9	-54.8	141.2	0	0	113	C759	C759-E763 WeakPolarHBondContact O-CB 3.49Å; C759-E763 WeakPolarHBondContact O-CG 3.33Å; C759-E763 PolarHBondContact O-N 3.06Å
764	L	92.9	Very high	94.5	Very high	5 Å²	5	44.7 Å²	44.7	3%	0.026	21%	0.212	C	C	.	.	H	α-helix	trans	-93.5	-25.2	-175.6	-55.2	177.9	0	0	0	113.1	G688 F691 L695 Y760 E766 G767 F768	G688-L764 WeakPolarHBondContact O-CD2 3.32Å; F691-L764 HydrophobicContact CB-CD2 4.41Å; F691-L764 HydrophobicContact CD1-CD1 4.22Å; L695-L764 HydrophobicContact CD1-CD1 3.79Å; L695-L764 HydrophobicContact CD2-CD1 3.83Å; L695-L764 HydrophobicContact CG-CD1 4.06Å; Y760-L764 VanDerWaalsContact O-CB 3.25Å; Y760-L764 WeakPolarHBondContact O-CB 3.45Å; Y760-L764 WeakPolarHBondContact O-CG 3.31Å; Y760-L764 PolarHBondContact O-N 3.31Å; L764-E766 PolarHBondContact O-N 3.2Å; L764-E766 VanDerWaalsContact O-N 3.12Å; L764-G767 PolarHBondContact O-N 3.04Å; L764-F768 HydrophobicContact CB-CB 4.34Å
765	K	91.9	Very high	94.6	Very high	103 Å²	103	44.7 Å²	44.7	45%	0.448	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	49.5	-112.4	178.7	-53.9	-165.3	176.2	-145.1	0	112	A761 K762 G767 F768 E804 C805	A761-K765 WeakPolarHBondContact O-CA 3.41Å; A761-K765 PolarHBondContact O-N 3.09Å; K762-K765 VanDerWaalsContact O-CE 3.26Å; K762-K765 WeakPolarHBondContact O-CE 3.41Å; K762-K765 VanDerWaalsContact O-CG 3.26Å; K762-K765 WeakPolarHBondContact O-CG 3.3Å; K765-G767 PolarHBondContact O-N 3.36Å; K765-G767 VanDerWaalsContact O-N 3.09Å; K765-F768 WeakPolarHBondContact O-CB 3.45Å; K765-F768 PolarHBondContact O-N 2.99Å; K765-E804 IonicContact NZ-OE2 3.29Å; K765-C805 PolarHBondContact O-SG 2.67Å
766	E	91.9	Very high	94.8	Very high	117 Å²	117	41.5 Å²	41.5	55%	0.547	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-51.8	-31.3	175.4	-56.8	174.1	158.7	0	0	113	L764 F768 V769 V808	L764-E766 PolarHBondContact O-N 3.2Å; L764-E766 VanDerWaalsContact O-N 3.12Å; E766-F768 PolarHBondContact O-N 3.05Å; E766-V769 WeakPolarHBondContact O-CG1 3.44Å; E766-V769 PolarHBondContact O-N 3.08Å; E766-V808 HydrophobicContact CB-CG1 4.48Å; E766-V808 HydrophobicContact CB-CG2 4.4Å; E766-V808 HydrophobicContact CG-CB 4.2Å; E766-V808 HydrophobicContact CG-CG2 4.09Å
767	G	93.3	Very high	95.1	Very high	12 Å²	12	45 Å²	45	12%	0.124	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-69	-15.4	179.2	0	0	0	0	0	114.8	Q692 L764 K765	Q692-G767 VanDerWaalsContact NE2-CA 3.33Å; Q692-G767 PolarHBondContact NE2-O 3.39Å; L764-G767 PolarHBondContact O-N 3.04Å; K765-G767 PolarHBondContact O-N 3.36Å; K765-G767 VanDerWaalsContact O-N 3.09Å
768	F	96.2	Very high	95.2	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-95.1	-6	-179.4	-161	-116.9	0	0	0	113.7	L695 M699 L757 Y760 A761 L764 K765 E766 E770 Y771 V775 L802	L695-F768 HydrophobicContact CD1-CD2 4.33Å; L695-F768 HydrophobicContact CD2-CD2 4.46Å; L695-F768 HydrophobicContact CD2-CE2 4.48Å; M699-F768 HydrophobicContact CE-CE2 3.88Å; M699-F768 HydrophobicContact CE-CZ 3.83Å; M699-F768 HydrophobicContact SD-CE2 3.69Å; M699-F768 HydrophobicContact SD-CZ 4.18Å; L757-F768 HydrophobicContact CD2-CZ 4.24Å; Y760-F768 HydrophobicContact CD2-CE2 4.17Å; Y760-F768 HydrophobicContact CG-CE2 4.33Å; A761-F768 HydrophobicContact CB-CD1 3.98Å; A761-F768 HydrophobicContact CB-CE1 4.16Å; L764-F768 HydrophobicContact CB-CB 4.34Å; K765-F768 WeakPolarHBondContact O-CB 3.45Å; K765-F768 PolarHBondContact O-N 2.99Å; E766-F768 PolarHBondContact O-N 3.05Å; F768-E770 PolarHBondContact O-N 2.93Å; F768-Y771 HydrophobicContact CD2-CD2 4.24Å; F768-Y771 HydrophobicContact CE2-CD2 4.38Å; F768-Y771 PolarHBondContact O-N 2.9Å; F768-V775 HydrophobicContact CE1-CG2 3.99Å; F768-V775 HydrophobicContact CZ-CG2 3.95Å; F768-L802 HydrophobicContact CD1-CD2 4.33Å; F768-L802 HydrophobicContact CE1-CD2 4.02Å
769	V	95.7	Very high	95.3	Very high	13 Å²	13	45.9 Å²	45.9	8%	0.079	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-26.5	-167.4	73.2	0	0	0	0	115.3	E766 Y771 T772 C805 V808 R809 Y813	E766-V769 WeakPolarHBondContact O-CG1 3.44Å; E766-V769 PolarHBondContact O-N 3.08Å; V769-Y771 PolarHBondContact O-N 3.41Å; V769-T772 WeakPolarHBondContact CA-OG1 3.13Å; V769-C805 WeakPolarHBondContact CG2-O 3.36Å; V769-V808 HydrophobicContact CB-CG1 3.95Å; V769-V808 HydrophobicContact CG1-CG1 4.1Å; V769-V808 HydrophobicContact CG2-CG1 3.76Å; V769-R809 HydrophobicContact CG2-CG 3.82Å; V769-Y813 HydrophobicContact CG2-CE1 4.44Å
770	E	95.8	Very high	95.6	Very high	132 Å²	132	45.6 Å²	45.6	62%	0.617	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-21.2	176.7	-61	-54.6	133.8	0	0	113.2	F768 R809	F768-E770 PolarHBondContact O-N 2.93Å; E770-R809 IonicContact OE1-CZ 3.14Å; E770-R809 IonicContact OE1-NH2 2.78Å; E770-R809 PolarHBondContact OE1-NH2 2.94Å; E770-R809 IonicContact OE2-CZ 2.69Å; E770-R809 IonicContact OE2-NH2 3.84Å; E770-R809 PolarHBondContact OE2-NH2 3.09Å
771	Y	96.8	Very high	95.7	Very high	45 Å²	45	49.6 Å²	49.6	18%	0.176	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-16.1	-178.6	-59	-78.9	0	0	0	113.3	L695 P696 M699 F768 V769 E773 Q774 V775	L695-Y771 HydrophobicContact CB-CE2 3.76Å; L695-Y771 HydrophobicContact CD1-CD2 4.18Å; L695-Y771 HydrophobicContact CD1-CE2 3.77Å; L695-Y771 HydrophobicContact CG-CE2 4.33Å; P696-Y771 WeakPolarHBondContact CA-OH 3.23Å; M699-Y771 HydrophobicContact CB-CD1 4.03Å; M699-Y771 HydrophobicContact CB-CE1 3.68Å; M699-Y771 HydrophobicContact CE-CD1 3.87Å; M699-Y771 HydrophobicContact CE-CG 3.89Å; M699-Y771 HydrophobicContact CG-CD1 3.86Å; M699-Y771 HydrophobicContact CG-CD2 4.27Å; M699-Y771 HydrophobicContact CG-CE1 3.68Å; M699-Y771 HydrophobicContact CG-CE2 4.13Å; M699-Y771 HydrophobicContact CG-CG 4.15Å; F768-Y771 HydrophobicContact CD2-CD2 4.24Å; F768-Y771 HydrophobicContact CE2-CD2 4.38Å; F768-Y771 PolarHBondContact O-N 2.9Å; V769-Y771 PolarHBondContact O-N 3.41Å; Y771-E773 PolarHBondContact O-N 3.29Å; Y771-Q774 PolarHBondContact O-N 3.19Å; Y771-V775 WeakPolarHBondContact O-CG2 3.42Å; Y771-V775 PolarHBondContact O-N 3.26Å
772	T	96.8	Very high	95.9	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-49.5	-54.4	-171.2	-61.3	0	0	0	0	113.1	V769 Q774 V775 V776 L802 C805 A806 M817	V769-T772 WeakPolarHBondContact CA-OG1 3.13Å; T772-Q774 VanDerWaalsContact C-N 3.28Å; T772-Q774 PolarHBondContact O-N 3.2Å; T772-V775 PolarHBondContact O-N 3.04Å; T772-V775 VanDerWaalsContact O-N 3.15Å; T772-V776 HydrophobicContact CG2-CG2 4.15Å; T772-V776 VanDerWaalsContact O-CG2 3.28Å; T772-V776 WeakPolarHBondContact O-CG2 3.32Å; T772-V776 PolarHBondContact O-N 2.89Å; T772-L802 HydrophobicContact CG2-CB 4.17Å; T772-L802 HydrophobicContact CG2-CD2 4.11Å; T772-L802 WeakPolarHBondContact CG2-O 3.47Å; T772-C805 WeakPolarHBondContact OG1-CB 3.42Å; T772-A806 HydrophobicContact CG2-CB 4.17Å; T772-M817 HydrophobicContact CG2-CG 4.44Å; T772-M817 HydrophobicContact CG2-SD 4.49Å
773	E	97.3	Very high	96	Very high	76 Å²	76	44.4 Å²	44.4	36%	0.355	22%	0.217	S	C	.	.	H	α-helix	trans	-59.6	-35.5	-179	178.4	177	167.4	0	0	113.7	Y771 K777 Y813 M817	Y771-E773 PolarHBondContact O-N 3.29Å; E773-K777 HydrophobicContact CG-CD 4.37Å; E773-K777 WeakPolarHBondContact O-CG 3.46Å; E773-K777 PolarHBondContact O-N 2.73Å; E773-K777 WeakPolarHBondContact OE1-CE 3.4Å; E773-K777 IonicContact OE1-NZ 3.5Å; E773-K777 PolarHBondContact OE1-NZ 2.92Å; E773-Y813 WeakPolarHBondContact CB-OH 3.36Å; E773-Y813 PolarHBondContact N-OH 3.27Å; E773-M817 HydrophobicContact CB-CE 4.14Å; E773-M817 HydrophobicContact CB-SD 3.88Å; E773-M817 HydrophobicContact CG-CE 4.01Å; E773-M817 HydrophobicContact CG-SD 4.26Å
774	Q	97.3	Very high	96.1	Very high	110 Å²	110	45.1 Å²	45.1	51%	0.514	22%	0.219	S	C	.	.	H	α-helix	trans	-71.5	-40.7	178.4	-164.5	-167.7	-16.7	0	0	110.9	M703 Y771 T772 K777 L778	M703-Q774 HydrophobicContact CE-CB 4.33Å; M703-Q774 HydrophobicContact CE-CG 3.72Å; Y771-Q774 PolarHBondContact O-N 3.19Å; T772-Q774 VanDerWaalsContact C-N 3.28Å; T772-Q774 PolarHBondContact O-N 3.2Å; Q774-K777 PolarHBondContact O-N 2.96Å; Q774-L778 PolarHBondContact O-N 3.04Å
775	V	98.1	Very high	96.1	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-70.2	-40	178.3	-178.7	0	0	0	0	111.1	M699 M703 L757 F768 Y771 T772 K777 L778 M779 L802	M699-V775 HydrophobicContact CE-CG2 4.15Å; M703-V775 HydrophobicContact CE-CG2 4.15Å; M703-V775 HydrophobicContact SD-CG2 3.9Å; L757-V775 HydrophobicContact CB-CG1 4.29Å; L757-V775 HydrophobicContact CD1-CG1 4.3Å; L757-V775 HydrophobicContact CD2-CG2 4.08Å; F768-V775 HydrophobicContact CE1-CG2 3.99Å; F768-V775 HydrophobicContact CZ-CG2 3.95Å; Y771-V775 WeakPolarHBondContact O-CG2 3.42Å; Y771-V775 PolarHBondContact O-N 3.26Å; T772-V775 PolarHBondContact O-N 3.04Å; T772-V775 VanDerWaalsContact O-N 3.15Å; V775-K777 VanDerWaalsContact C-N 3.33Å; V775-K777 PolarHBondContact O-N 2.64Å; V775-L778 WeakPolarHBondContact O-CB 3.44Å; V775-L778 PolarHBondContact O-N 3.45Å; V775-L778 VanDerWaalsContact O-N 3.08Å; V775-M779 HydrophobicContact CG1-CE 4.39Å; V775-M779 HydrophobicContact CG1-CG 3.85Å; V775-M779 WeakPolarHBondContact O-CG 3.49Å; V775-M779 PolarHBondContact O-N 3.28Å; V775-L802 HydrophobicContact CB-CD1 4.44Å; V775-L802 HydrophobicContact CB-CD2 3.98Å; V775-L802 HydrophobicContact CG1-CD1 3.88Å; V775-L802 HydrophobicContact CG1-CD2 3.9Å
776	V	98.3	Very high	95.9	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-56.9	-47	173.6	172.6	0	0	0	0	110.9	T772 L778 M779 V780 L802 M817 F820 M821	T772-V776 HydrophobicContact CG2-CG2 4.15Å; T772-V776 VanDerWaalsContact O-CG2 3.28Å; T772-V776 WeakPolarHBondContact O-CG2 3.32Å; T772-V776 PolarHBondContact O-N 2.89Å; V776-L778 PolarHBondContact O-N 2.92Å; V776-M779 PolarHBondContact O-N 3.36Å; V776-V780 HydrophobicContact CG1-CG2 4.09Å; V776-V780 WeakPolarHBondContact O-CB 3.35Å; V776-V780 VanDerWaalsContact O-CG2 3.28Å; V776-V780 WeakPolarHBondContact O-CG2 3.14Å; V776-V780 PolarHBondContact O-N 2.99Å; V776-L802 HydrophobicContact CG2-CB 3.93Å; V776-L802 HydrophobicContact CG2-CD1 3.82Å; V776-L802 HydrophobicContact CG2-CG 4.31Å; V776-M817 HydrophobicContact CB-SD 4.44Å; V776-M817 HydrophobicContact CG2-SD 4.2Å; V776-F820 HydrophobicContact CG1-CB 4.01Å; V776-M821 HydrophobicContact CB-CE 4.3Å; V776-M821 HydrophobicContact CG1-CE 3.89Å; V776-M821 HydrophobicContact CG1-CG 4.13Å; V776-M821 HydrophobicContact CG2-CE 3.43Å; V776-M821 VanDerWaalsContact CG2-CE 3.43Å
777	K	97.3	Very high	95.7	Very high	99 Å²	99	40.6 Å²	40.6	43%	0.43	20%	0.197	S	C	.	.	H	α-helix	trans	-66.1	-23.6	178	-70.6	173.9	-170.6	172.1	0	113.8	E773 Q774 V775 P781	E773-K777 HydrophobicContact CG-CD 4.37Å; E773-K777 WeakPolarHBondContact O-CG 3.46Å; E773-K777 PolarHBondContact O-N 2.73Å; E773-K777 WeakPolarHBondContact OE1-CE 3.4Å; E773-K777 IonicContact OE1-NZ 3.5Å; E773-K777 PolarHBondContact OE1-NZ 2.92Å; Q774-K777 PolarHBondContact O-N 2.96Å; V775-K777 VanDerWaalsContact C-N 3.33Å; V775-K777 PolarHBondContact O-N 2.64Å; K777-P781 WeakPolarHBondContact O-CD 3.37Å
778	L	97.9	Very high	95.5	Very high	24 Å²	24	41.5 Å²	41.5	13%	0.126	20%	0.198	C	C	.	.	H	α-helix	trans	-80.5	-47.7	173.1	175.7	59.8	0	0	0	111.8	M703 A706 S707 L757 Q774 V775 V776 P781 L782	M703-L778 HydrophobicContact CE-CB 4.04Å; M703-L778 HydrophobicContact CE-CD2 3.52Å; M703-L778 HydrophobicContact CE-CG 4.43Å; M703-L778 HydrophobicContact SD-CD2 3.75Å; A706-L778 HydrophobicContact CB-CD2 3.73Å; S707-L778 WeakPolarHBondContact OG-CD1 3.35Å; L757-L778 HydrophobicContact CD1-CD2 4.05Å; Q774-L778 PolarHBondContact O-N 3.04Å; V775-L778 WeakPolarHBondContact O-CB 3.44Å; V775-L778 PolarHBondContact O-N 3.45Å; V775-L778 VanDerWaalsContact O-N 3.08Å; V776-L778 PolarHBondContact O-N 2.92Å; L778-P781 WeakPolarHBondContact O-CD 3.23Å; L778-L782 HydrophobicContact CD1-CD1 4.19Å; L778-L782 HydrophobicContact CG-CD1 4.21Å; L778-L782 WeakPolarHBondContact O-CG 3.39Å
779	M	98.2	Very high	95.4	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-75.1	-33.6	-172.1	-65.5	-60.3	-151.3	0	0	113.5	C754 L757 V775 V776 L782 L783 A795 S798 M799	C754-M779 HydrophobicContact CB-CE 3.98Å; C754-M779 HydrophobicContact CB-SD 4.36Å; C754-M779 WeakPolarHBondContact O-CE 3.34Å; L757-M779 HydrophobicContact CB-CE 3.71Å; L757-M779 HydrophobicContact CD1-CE 3.89Å; L757-M779 HydrophobicContact CG-CE 4.44Å; V775-M779 HydrophobicContact CG1-CE 4.39Å; V775-M779 HydrophobicContact CG1-CG 3.85Å; V775-M779 WeakPolarHBondContact O-CG 3.49Å; V775-M779 PolarHBondContact O-N 3.28Å; V776-M779 PolarHBondContact O-N 3.36Å; M779-L782 WeakPolarHBondContact O-CA 3.48Å; M779-L782 WeakPolarHBondContact O-CB 3.21Å; M779-L782 PolarHBondContact O-N 2.69Å; M779-L782 HydrophobicContact SD-CD1 4.11Å; M779-L783 PolarHBondContact O-N 3.11Å; M779-A795 HydrophobicContact CB-CB 4.39Å; M779-A795 HydrophobicContact SD-CB 4.4Å; M779-S798 WeakPolarHBondContact CG-OG 3.45Å; M779-M799 HydrophobicContact CB-CE 3.72Å
780	V	98.3	Very high	95.3	Very high	23 Å²	23	45.6 Å²	45.6	14%	0.139	23%	0.227	C	C	.	.	H	α-helix	trans	-58.4	-46.6	-177.3	164.3	0	0	0	0	112.9	V776 L782 M799 F820 M821 A824	V776-V780 HydrophobicContact CG1-CG2 4.09Å; V776-V780 WeakPolarHBondContact O-CB 3.35Å; V776-V780 VanDerWaalsContact O-CG2 3.28Å; V776-V780 WeakPolarHBondContact O-CG2 3.14Å; V776-V780 PolarHBondContact O-N 2.99Å; V780-L782 VanDerWaalsContact C-N 3.26Å; V780-L782 PolarHBondContact O-N 3.1Å; V780-M799 HydrophobicContact CB-CE 4.45Å; V780-M799 HydrophobicContact CG2-CE 3.81Å; V780-M799 HydrophobicContact CG2-SD 4.05Å; V780-F820 WeakPolarHBondContact CG1-O 3.41Å; V780-M821 HydrophobicContact CG2-CB 4.46Å; V780-M821 HydrophobicContact CG2-CG 4.04Å; V780-A824 HydrophobicContact CG1-CB 3.58Å
781	P	97.1	Very high	95.3	Very high	85 Å²	85	39.3 Å²	39.3	55%	0.552	20%	0.197	S	C	*	.	H	α-helix	trans	-62	-29.2	170.6	-25.8	34.9	0	0	0	114.7	K777 L778 L783 K784	K777-P781 WeakPolarHBondContact O-CD 3.37Å; L778-P781 WeakPolarHBondContact O-CD 3.23Å; P781-L783 VanDerWaalsContact C-N 3.28Å; P781-L783 PolarHBondContact O-N 2.97Å; P781-K784 PolarHBondContact O-N 2.82Å; P781-K784 VanDerWaalsContact O-N 3.17Å
782	L	97.8	Very high	95.4	Very high	12 Å²	12	37.2 Å²	37.2	6%	0.063	19%	0.189	C	C	.	.	H	α-helix	trans	-73.8	-16	-175.3	-65.1	177.9	0	0	0	113.6	L778 M779 V780 K784 F785 V791 R792 A795	L778-L782 HydrophobicContact CD1-CD1 4.19Å; L778-L782 HydrophobicContact CG-CD1 4.21Å; L778-L782 WeakPolarHBondContact O-CG 3.39Å; M779-L782 WeakPolarHBondContact O-CA 3.48Å; M779-L782 WeakPolarHBondContact O-CB 3.21Å; M779-L782 PolarHBondContact O-N 2.69Å; M779-L782 HydrophobicContact SD-CD1 4.11Å; V780-L782 VanDerWaalsContact C-N 3.26Å; V780-L782 PolarHBondContact O-N 3.1Å; L782-K784 PolarHBondContact O-N 3.41Å; L782-K784 VanDerWaalsContact O-N 3.09Å; L782-F785 HydrophobicContact CD2-CB 4.16Å; L782-F785 HydrophobicContact CD2-CD2 4.04Å; L782-F785 HydrophobicContact CD2-CG 4.18Å; L782-F785 VanDerWaalsContact O-CB 3.22Å; L782-F785 WeakPolarHBondContact O-CB 3.36Å; L782-F785 PolarHBondContact O-N 3.11Å; L782-V791 HydrophobicContact CB-CG1 3.99Å; L782-V791 HydrophobicContact CD1-CG1 4.21Å; L782-V791 HydrophobicContact CD2-CG1 4.07Å; L782-V791 HydrophobicContact CG-CG1 4.3Å; L782-R792 WeakPolarHBondContact O-CG 3.49Å; L782-A795 HydrophobicContact CB-CB 3.93Å
783	L	96.8	Very high	95.5	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-23.1	165.9	-66.2	172.7	0	0	0	113.2	M779 P781 A795 A796 M799 A824 L825 A828 I841	M779-L783 PolarHBondContact O-N 3.11Å; P781-L783 VanDerWaalsContact C-N 3.28Å; P781-L783 PolarHBondContact O-N 2.97Å; L783-A795 HydrophobicContact CD2-CB 4.04Å; L783-A795 HydrophobicContact CG-CB 4.36Å; L783-A796 HydrophobicContact CD2-CB 4.2Å; L783-M799 HydrophobicContact CD1-CE 4.05Å; L783-M799 HydrophobicContact CD2-CE 4.36Å; L783-M799 HydrophobicContact CG-CE 4.11Å; L783-A824 HydrophobicContact CD1-CB 4.18Å; L783-L825 HydrophobicContact CD1-CD2 3.81Å; L783-L825 HydrophobicContact CD1-CG 4.06Å; L783-L825 HydrophobicContact CD2-CD2 4.2Å; L783-A828 HydrophobicContact CB-CB 4.37Å; L783-I841 HydrophobicContact CD2-CG1 4.3Å
784	K	93.7	Very high	95.5	Very high	92 Å²	92	35.2 Å²	35.2	40%	0.4	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.8	19.9	179.3	-60.9	-176.7	179.4	-179	0	112.7	P781 L782 Y786	P781-K784 PolarHBondContact O-N 2.82Å; P781-K784 VanDerWaalsContact O-N 3.17Å; L782-K784 PolarHBondContact O-N 3.41Å; L782-K784 VanDerWaalsContact O-N 3.09Å; K784-Y786 VanDerWaalsContact C-N 3.29Å; K784-Y786 HydrophobicContact CB-CE2 4.3Å; K784-Y786 WeakPolarHBondContact O-CD2 3.47Å; K784-Y786 PolarHBondContact O-N 3.33Å; K784-Y786 VanDerWaalsContact O-N 3.09Å
785	F	92.1	Very high	95.6	Very high	21 Å²	21	30 Å²	30	9%	0.092	16%	0.157	C	C	.	.			trans	-84.1	70.9	177.7	-166.3	-98.5	0	0	0	110.5	P710 L747 K750 L782 F787 H788 V791 R792	P710-F785 HydrophobicContact CG-CE2 3.88Å; P710-F785 HydrophobicContact CG-CZ 3.83Å; L747-F785 HydrophobicContact CD2-CE1 3.87Å; L747-F785 HydrophobicContact CD2-CZ 3.64Å; K750-F785 HydrophobicContact CD-CE1 3.89Å; K750-F785 HydrophobicContact CD-CE2 4.25Å; K750-F785 HydrophobicContact CD-CZ 3.67Å; L782-F785 HydrophobicContact CD2-CB 4.16Å; L782-F785 HydrophobicContact CD2-CD2 4.04Å; L782-F785 HydrophobicContact CD2-CG 4.18Å; L782-F785 VanDerWaalsContact O-CB 3.22Å; L782-F785 WeakPolarHBondContact O-CB 3.36Å; L782-F785 PolarHBondContact O-N 3.11Å; F785-F787 HydrophobicContact CD1-CB 4.23Å; F785-F787 AromaticContact CD2-CD2 4Å; F785-F787 HydrophobicContact CD2-CD2 4Å; F785-F787 HydrophobicContact CE1-CB 3.85Å; F785-F787 HydrophobicContact CE1-CD2 4.26Å; F785-F787 AromaticContact CE2-CD2 3.71Å; F785-F787 HydrophobicContact CE2-CD2 3.71Å; F785-F787 HydrophobicContact CE2-CE2 4.41Å; F785-F787 HydrophobicContact CG-CD2 4.39Å; F785-F787 HydrophobicContact CZ-CB 4.14Å; F785-F787 AromaticContact CZ-CD2 3.85Å; F785-F787 HydrophobicContact CZ-CD2 3.85Å; F785-F787 PolarHBondContact O-N 3.45Å; F785-H788 HydrophobicContact CD1-CB 4.17Å; F785-H788 HydrophobicContact CE1-CB 4Å; F785-H788 PolarHBondContact O-N 2.95Å; F785-V791 HydrophobicContact CB-CG1 4Å; F785-V791 HydrophobicContact CD1-CB 3.83Å; F785-V791 HydrophobicContact CD1-CG1 3.62Å; F785-V791 HydrophobicContact CD1-CG2 4.06Å; F785-V791 HydrophobicContact CE1-CB 4.42Å; F785-V791 HydrophobicContact CE1-CG1 4.34Å; F785-V791 HydrophobicContact CE1-CG2 4.14Å; F785-V791 HydrophobicContact CG-CG1 3.96Å; F785-R792 HydrophobicContact CB-CG 4.38Å; F785-R792 WeakPolarHBondContact O-CD 3.35Å; F785-R792 WeakPolarHBondContact O-CG 3.31Å; F785-R792 PolarHBondContact O-NE 3.05Å
786	Y	87.6	Confident	95.6	Very high	31 Å²	31	30 Å²	30	12%	0.122	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	8.1	-175.9	-57.5	-57.5	0	0	0	115.6	F8 K784 T831 P833	F8-Y786 HydrophobicContact CD2-CD2 4.38Å; F8-Y786 HydrophobicContact CE2-CD2 4.44Å; K784-Y786 VanDerWaalsContact C-N 3.29Å; K784-Y786 HydrophobicContact CB-CE2 4.3Å; K784-Y786 WeakPolarHBondContact O-CD2 3.47Å; K784-Y786 PolarHBondContact O-N 3.33Å; K784-Y786 VanDerWaalsContact O-N 3.09Å; Y786-T831 PolarHBondContact OH-OG1 2.87Å; Y786-P833 HydrophobicContact CD1-CG 4.03Å; Y786-P833 HydrophobicContact CE1-CG 4.25Å
787	F	86.6	Confident	95.6	Very high	78 Å²	78	32.9 Å²	32.9	34%	0.342	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-15.9	177.9	-51.8	-54.6	0	0	0	113.3	P710 V712 F740 I742 F785	P710-F787 HydrophobicContact CG-CD2 3.98Å; P710-F787 HydrophobicContact CG-CE2 4.25Å; V712-F787 HydrophobicContact CG1-CE2 4.48Å; V712-F787 HydrophobicContact CG1-CZ 4.19Å; F740-F787 HydrophobicContact CE1-CD1 4.24Å; F740-F787 AromaticContact CE1-CE1 3.51Å; F740-F787 HydrophobicContact CE1-CE1 3.51Å; F740-F787 HydrophobicContact CE1-CZ 4.24Å; F740-F787 AromaticContact CZ-CE1 3.56Å; F740-F787 HydrophobicContact CZ-CE1 3.56Å; F740-F787 AromaticContact CZ-CZ 3.85Å; F740-F787 HydrophobicContact CZ-CZ 3.85Å; I742-F787 HydrophobicContact CD1-CB 3.57Å; I742-F787 HydrophobicContact CD1-CD1 3.47Å; I742-F787 VanDerWaalsContact CD1-CD1 3.47Å; I742-F787 HydrophobicContact CD1-CD2 3.97Å; I742-F787 HydrophobicContact CD1-CE1 4.13Å; I742-F787 HydrophobicContact CD1-CG 3.38Å; F785-F787 HydrophobicContact CD1-CB 4.23Å; F785-F787 AromaticContact CD2-CD2 4Å; F785-F787 HydrophobicContact CD2-CD2 4Å; F785-F787 HydrophobicContact CE1-CB 3.85Å; F785-F787 HydrophobicContact CE1-CD2 4.26Å; F785-F787 AromaticContact CE2-CD2 3.71Å; F785-F787 HydrophobicContact CE2-CD2 3.71Å; F785-F787 HydrophobicContact CE2-CE2 4.41Å; F785-F787 HydrophobicContact CG-CD2 4.39Å; F785-F787 HydrophobicContact CZ-CB 4.14Å; F785-F787 AromaticContact CZ-CD2 3.85Å; F785-F787 HydrophobicContact CZ-CD2 3.85Å; F785-F787 PolarHBondContact O-N 3.45Å
788	H	89.9	Confident	95.6	Very high	31 Å²	31	28.2 Å²	28.2	14%	0.144	15%	0.151	C	C	.	.			trans	-156	131.2	-179.1	-168	-49.4	0	0	0	111.4	E748 A751 F785 G790 V791	E748-H788 IonicContact OE1-NE2 3.72Å; E748-H788 PolarHBondContact OE1-NE2 3.26Å; E748-H788 IonicContact OE2-NE2 2.69Å; A751-H788 VanDerWaalsContact CB-CE1 3.41Å; A751-H788 WeakPolarHBondContact CB-CE1 3.47Å; A751-H788 WeakPolarHBondContact CB-NE2 3.4Å; F785-H788 HydrophobicContact CD1-CB 4.17Å; F785-H788 HydrophobicContact CE1-CB 4Å; F785-H788 PolarHBondContact O-N 2.95Å; H788-G790 PolarHBondContact ND1-N 3.2Å; H788-G790 VanDerWaalsContact ND1-N 3.13Å; H788-V791 HydrophobicContact CB-CB 4.23Å; H788-V791 HydrophobicContact CB-CG2 3.82Å
789	D	93.3	Very high	95.6	Very high	67 Å²	67	27 Å²	27	36%	0.358	15%	0.145	S	C	.	.	H	α-helix	trans	-78.1	-48.6	-169.9	-58.6	-5.4	0	0	0	110.7	V791 R792 V793 V837	D789-V791 PolarHBondContact O-N 3.13Å; D789-V791 VanDerWaalsContact O-N 3.14Å; D789-R792 WeakPolarHBondContact O-CA 3.44Å; D789-R792 WeakPolarHBondContact O-CB 3.18Å; D789-R792 PolarHBondContact O-N 2.91Å; D789-R792 IonicContact OD1-CZ 3.17Å; D789-R792 IonicContact OD1-NE 3.17Å; D789-R792 IonicContact OD1-NH2 3.68Å; D789-R792 PolarHBondContact OD1-NH2 3.18Å; D789-V793 PolarHBondContact O-N 3.41Å; D789-V837 HydrophobicContact CB-CG2 3.94Å
790	G	94.5	Very high	95.6	Very high	32 Å²	32	27.9 Å²	27.9	33%	0.33	15%	0.15	S	C	.	.	H	α-helix	trans	-52.5	-32.4	171.9	0	0	0	0	0	115.3	H788 A794	H788-G790 PolarHBondContact ND1-N 3.2Å; H788-G790 VanDerWaalsContact ND1-N 3.13Å; G790-A794 WeakPolarHBondContact O-CB 3.34Å; G790-A794 PolarHBondContact O-N 3.34Å
791	V	96.4	Very high	95.6	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-65.6	-40.8	172.9	174	0	0	0	0	111.5	K750 A751 L782 F785 H788 D789 A795	K750-V791 HydrophobicContact CD-CG2 4.18Å; K750-V791 HydrophobicContact CG-CG2 4.2Å; A751-V791 HydrophobicContact CB-CG2 3.78Å; L782-V791 HydrophobicContact CB-CG1 3.99Å; L782-V791 HydrophobicContact CD1-CG1 4.21Å; L782-V791 HydrophobicContact CD2-CG1 4.07Å; L782-V791 HydrophobicContact CG-CG1 4.3Å; F785-V791 HydrophobicContact CB-CG1 4Å; F785-V791 HydrophobicContact CD1-CB 3.83Å; F785-V791 HydrophobicContact CD1-CG1 3.62Å; F785-V791 HydrophobicContact CD1-CG2 4.06Å; F785-V791 HydrophobicContact CE1-CB 4.42Å; F785-V791 HydrophobicContact CE1-CG1 4.34Å; F785-V791 HydrophobicContact CE1-CG2 4.14Å; F785-V791 HydrophobicContact CG-CG1 3.96Å; H788-V791 HydrophobicContact CB-CB 4.23Å; H788-V791 HydrophobicContact CB-CG2 3.82Å; D789-V791 PolarHBondContact O-N 3.13Å; D789-V791 VanDerWaalsContact O-N 3.14Å; V791-A795 VanDerWaalsContact O-CB 3.31Å; V791-A795 WeakPolarHBondContact O-CB 3.3Å; V791-A795 PolarHBondContact O-N 3.1Å
792	R	98.1	Very high	95.7	Very high	1 Å²	1	24.4 Å²	24.4	0%	0.004	13%	0.126	C	C	.	.	H	α-helix	trans	-73.5	-40.3	180	-66.9	-177.9	-74.3	152.4	0.4	111.7	L782 F785 D789 A795 A796 E832 V837	L782-R792 WeakPolarHBondContact O-CG 3.49Å; F785-R792 HydrophobicContact CB-CG 4.38Å; F785-R792 WeakPolarHBondContact O-CD 3.35Å; F785-R792 WeakPolarHBondContact O-CG 3.31Å; F785-R792 PolarHBondContact O-NE 3.05Å; D789-R792 WeakPolarHBondContact O-CA 3.44Å; D789-R792 WeakPolarHBondContact O-CB 3.18Å; D789-R792 PolarHBondContact O-N 2.91Å; D789-R792 IonicContact OD1-CZ 3.17Å; D789-R792 IonicContact OD1-NE 3.17Å; D789-R792 IonicContact OD1-NH2 3.68Å; D789-R792 PolarHBondContact OD1-NH2 3.18Å; R792-A795 PolarHBondContact O-N 3.11Å; R792-A796 PolarHBondContact O-N 2.91Å; R792-E832 IonicContact CZ-OE1 3.54Å; R792-E832 IonicContact CZ-OE2 2.76Å; R792-E832 IonicContact NH1-OE1 2.81Å; R792-E832 PolarHBondContact NH1-OE1 3.37Å; R792-E832 IonicContact NH1-OE2 2.76Å; R792-E832 PolarHBondContact NH1-OE2 3.4Å; R792-E832 IonicContact NH2-OE1 2.75Å; R792-V837 HydrophobicContact CB-CG1 3.63Å
793	V	98.3	Very high	95.7	Very high	33 Å²	33	23.9 Å²	23.9	20%	0.2	12%	0.123	C	C	.	.	H	α-helix	trans	-60.3	-52.7	171.8	176.2	0	0	0	0	110.6	D789 A795 A796 E797 V837 E840	D789-V793 PolarHBondContact O-N 3.41Å; V793-A795 VanDerWaalsContact C-N 3.27Å; V793-A795 PolarHBondContact O-N 3.22Å; V793-A796 WeakPolarHBondContact O-CA 3.38Å; V793-A796 WeakPolarHBondContact O-CB 3.34Å; V793-A796 PolarHBondContact O-N 3.47Å; V793-E797 HydrophobicContact CG1-CG 4.24Å; V793-E797 PolarHBondContact O-N 3.08Å; V793-V837 HydrophobicContact CG2-CG1 4.48Å; V793-V837 HydrophobicContact CG2-CG2 4.01Å; V793-E840 HydrophobicContact CG1-CG 4.38Å
794	A	97.9	Very high	95.7	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-58.9	-38.1	177.5	0	0	0	0	0	112.4	C754 Q755 V758 G790 S798	C754-A794 HydrophobicContact CB-CB 3.66Å; Q755-A794 HydrophobicContact CB-CB 4.47Å; V758-A794 HydrophobicContact CG2-CB 4.13Å; V758-A794 WeakPolarHBondContact CG2-O 3.45Å; G790-A794 WeakPolarHBondContact O-CB 3.34Å; G790-A794 PolarHBondContact O-N 3.34Å; A794-S798 WeakPolarHBondContact O-CB 3.38Å; A794-S798 PolarHBondContact O-N 3.31Å; A794-S798 VanDerWaalsContact O-N 3.11Å
795	A	98.5	Very high	95.8	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-62.4	-47.1	173.2	0	0	0	0	0	111.5	M779 L782 L783 V791 R792 V793 S798 M799	M779-A795 HydrophobicContact CB-CB 4.39Å; M779-A795 HydrophobicContact SD-CB 4.4Å; L782-A795 HydrophobicContact CB-CB 3.93Å; L783-A795 HydrophobicContact CD2-CB 4.04Å; L783-A795 HydrophobicContact CG-CB 4.36Å; V791-A795 VanDerWaalsContact O-CB 3.31Å; V791-A795 WeakPolarHBondContact O-CB 3.3Å; V791-A795 PolarHBondContact O-N 3.1Å; R792-A795 PolarHBondContact O-N 3.11Å; V793-A795 VanDerWaalsContact C-N 3.27Å; V793-A795 PolarHBondContact O-N 3.22Å; A795-S798 PolarHBondContact O-N 2.7Å; A795-S798 PolarHBondContact O-OG 2.99Å; A795-M799 VanDerWaalsContact O-CE 3.31Å; A795-M799 WeakPolarHBondContact O-CE 3.28Å; A795-M799 WeakPolarHBondContact O-CG 3.42Å
796	A	98.4	Very high	95.9	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-59.7	-56.8	176.7	0	0	0	0	0	112.1	L783 R792 V793 S798 M799 I841 S844	L783-A796 HydrophobicContact CD2-CB 4.2Å; R792-A796 PolarHBondContact O-N 2.91Å; V793-A796 WeakPolarHBondContact O-CA 3.38Å; V793-A796 WeakPolarHBondContact O-CB 3.34Å; V793-A796 PolarHBondContact O-N 3.47Å; A796-S798 PolarHBondContact O-N 2.59Å; A796-S798 VanDerWaalsContact O-N 3.1Å; A796-M799 WeakPolarHBondContact O-CB 3.41Å; A796-M799 WeakPolarHBondContact O-CG 3.5Å; A796-M799 PolarHBondContact O-N 2.93Å; A796-I841 HydrophobicContact CB-CB 4.49Å; A796-I841 HydrophobicContact CB-CG1 3.74Å; A796-S844 VanDerWaalsContact C-OG 3.23Å; A796-S844 WeakPolarHBondContact O-CB 3.41Å; A796-S844 PolarHBondContact O-OG 3.02Å; A796-S844 VanDerWaalsContact O-OG 3.11Å
797	E	98.4	Very high	96.3	Very high	61 Å²	61	25.5 Å²	25.5	29%	0.285	13%	0.128	S	C	.	.	H	α-helix	trans	-51.9	-36.7	178.9	-72.4	-171.7	175.8	0	0	112.1	Q755 V758 V793 M799 L801	Q755-E797 PolarHBondContact NE2-OE2 2.75Å; V758-E797 HydrophobicContact CG1-CB 3.92Å; V758-E797 WeakPolarHBondContact CG1-OE2 3.41Å; V758-E797 HydrophobicContact CG2-CB 4.25Å; V793-E797 HydrophobicContact CG1-CG 4.24Å; V793-E797 PolarHBondContact O-N 3.08Å; E797-M799 VanDerWaalsContact C-N 3.29Å; E797-M799 PolarHBondContact O-N 3.3Å; E797-L801 WeakPolarHBondContact O-CD1 2.9Å
798	S	98.4	Very high	96.6	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.007	13%	0.133	C	C	.	.	H	α-helix	trans	-64.1	-29.8	-179.5	81.5	0	0	0	0	113.6	M779 A794 A795 A796 L801 L802	M779-S798 WeakPolarHBondContact CG-OG 3.45Å; A794-S798 WeakPolarHBondContact O-CB 3.38Å; A794-S798 PolarHBondContact O-N 3.31Å; A794-S798 VanDerWaalsContact O-N 3.11Å; A795-S798 PolarHBondContact O-N 2.7Å; A795-S798 PolarHBondContact O-OG 2.99Å; A796-S798 PolarHBondContact O-N 2.59Å; A796-S798 VanDerWaalsContact O-N 3.1Å; S798-L801 PolarHBondContact O-N 2.94Å; S798-L802 VanDerWaalsContact O-CB 3.3Å; S798-L802 WeakPolarHBondContact O-CB 3.33Å; S798-L802 WeakPolarHBondContact O-CD1 3.27Å; S798-L802 WeakPolarHBondContact O-CG 3.42Å; S798-L802 PolarHBondContact O-N 3.24Å
799	M	98.4	Very high	96.8	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60.7	-57.8	-169	-59.7	-63.1	164.8	0	0	113.2	M779 V780 L783 A795 A796 E797 L801 L802 L803 M821 L825	M779-M799 HydrophobicContact CB-CE 3.72Å; V780-M799 HydrophobicContact CB-CE 4.45Å; V780-M799 HydrophobicContact CG2-CE 3.81Å; V780-M799 HydrophobicContact CG2-SD 4.05Å; L783-M799 HydrophobicContact CD1-CE 4.05Å; L783-M799 HydrophobicContact CD2-CE 4.36Å; L783-M799 HydrophobicContact CG-CE 4.11Å; A795-M799 VanDerWaalsContact O-CE 3.31Å; A795-M799 WeakPolarHBondContact O-CE 3.28Å; A795-M799 WeakPolarHBondContact O-CG 3.42Å; A796-M799 WeakPolarHBondContact O-CB 3.41Å; A796-M799 WeakPolarHBondContact O-CG 3.5Å; A796-M799 PolarHBondContact O-N 2.93Å; E797-M799 VanDerWaalsContact C-N 3.29Å; E797-M799 PolarHBondContact O-N 3.3Å; M799-L801 VanDerWaalsContact C-N 3.3Å; M799-L801 PolarHBondContact O-N 3.07Å; M799-L802 PolarHBondContact O-N 3.4Å; M799-L803 WeakPolarHBondContact O-CG 3.4Å; M799-L803 PolarHBondContact O-N 3.07Å; M799-L803 VanDerWaalsContact O-N 3.13Å; M799-M821 HydrophobicContact CB-SD 4.14Å; M799-M821 HydrophobicContact SD-CB 4.23Å; M799-M821 HydrophobicContact SD-CE 3.96Å; M799-M821 HydrophobicContact SD-CG 3.64Å; M799-M821 HydrophobicContact SD-SD 3.93Å; M799-L825 HydrophobicContact CB-CD1 4.3Å; M799-L825 HydrophobicContact CG-CD1 4.24Å; M799-L825 HydrophobicContact CG-CD2 4.25Å
800	P	98.3	Very high	96.9	Very high	18 Å²	18	27.2 Å²	27.2	12%	0.117	14%	0.141	C	C	.	.	H	α-helix	trans	-64.4	-34.2	178.3	25.4	-34.9	0	0	0	112.4	L803 E804 K847 L851	P800-L803 PolarHBondContact O-N 3.16Å; P800-E804 WeakPolarHBondContact O-CG 3.29Å; P800-E804 PolarHBondContact O-N 3.24Å; P800-K847 HydrophobicContact CB-CB 3.87Å; P800-K847 HydrophobicContact CG-CB 4.21Å; P800-L851 HydrophobicContact CB-CD1 3.8Å; P800-L851 WeakPolarHBondContact O-CD1 3.26Å
801	L	98.1	Very high	96.8	Very high	33 Å²	33	29.7 Å²	29.7	17%	0.173	15%	0.151	C	C	.	.	H	α-helix	trans	-66.7	-40.1	178.1	-63.1	172.1	0	0	0	112.1	V758 A761 K762 E797 S798 M799 L803 E804 C805	V758-L801 HydrophobicContact CG1-CD1 3.56Å; A761-L801 HydrophobicContact CB-CB 3.98Å; K762-L801 HydrophobicContact CB-CD1 4.07Å; K762-L801 HydrophobicContact CB-CD2 4.26Å; K762-L801 HydrophobicContact CG-CD2 4.37Å; E797-L801 WeakPolarHBondContact O-CD1 2.9Å; S798-L801 PolarHBondContact O-N 2.94Å; M799-L801 VanDerWaalsContact C-N 3.3Å; M799-L801 PolarHBondContact O-N 3.07Å; L801-L803 VanDerWaalsContact C-N 3.32Å; L801-E804 WeakPolarHBondContact O-CB 3.42Å; L801-E804 PolarHBondContact O-N 2.92Å; L801-C805 PolarHBondContact O-N 3.18Å; L801-C805 PolarHBondContact O-SG 2.98Å
802	L	98.2	Very high	96.7	Very high	1 Å²	1	36 Å²	36	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-67.3	-33.7	175.5	-70.9	165.9	0	0	0	111.5	A761 F768 T772 V775 V776 S798 M799 C805 A806 M821	A761-L802 HydrophobicContact CB-CD2 4.42Å; F768-L802 HydrophobicContact CD1-CD2 4.33Å; F768-L802 HydrophobicContact CE1-CD2 4.02Å; T772-L802 HydrophobicContact CG2-CB 4.17Å; T772-L802 HydrophobicContact CG2-CD2 4.11Å; T772-L802 WeakPolarHBondContact CG2-O 3.47Å; V775-L802 HydrophobicContact CB-CD1 4.44Å; V775-L802 HydrophobicContact CB-CD2 3.98Å; V775-L802 HydrophobicContact CG1-CD1 3.88Å; V775-L802 HydrophobicContact CG1-CD2 3.9Å; V776-L802 HydrophobicContact CG2-CB 3.93Å; V776-L802 HydrophobicContact CG2-CD1 3.82Å; V776-L802 HydrophobicContact CG2-CG 4.31Å; S798-L802 VanDerWaalsContact O-CB 3.3Å; S798-L802 WeakPolarHBondContact O-CB 3.33Å; S798-L802 WeakPolarHBondContact O-CD1 3.27Å; S798-L802 WeakPolarHBondContact O-CG 3.42Å; S798-L802 PolarHBondContact O-N 3.24Å; M799-L802 PolarHBondContact O-N 3.4Å; L802-C805 PolarHBondContact O-N 3.16Å; L802-A806 WeakPolarHBondContact O-CB 3.35Å; L802-A806 PolarHBondContact O-N 3.01Å; L802-M821 HydrophobicContact CB-CE 3.93Å
803	L	97.6	Very high	96.6	Very high	2 Å²	2	37.2 Å²	37.2	1%	0.01	19%	0.185	C	C	.	.	H	α-helix	trans	-66.5	-41.2	169	-65.4	180	0	0	0	111.9	M799 P800 L801 C805 A806 R807 L814 M817 W818 M821 C848 L851 M852	M799-L803 WeakPolarHBondContact O-CG 3.4Å; M799-L803 PolarHBondContact O-N 3.07Å; M799-L803 VanDerWaalsContact O-N 3.13Å; P800-L803 PolarHBondContact O-N 3.16Å; L801-L803 VanDerWaalsContact C-N 3.32Å; L803-C805 VanDerWaalsContact C-N 3.32Å; L803-C805 PolarHBondContact O-N 2.8Å; L803-A806 PolarHBondContact O-N 3.22Å; L803-R807 PolarHBondContact O-N 3.25Å; L803-L814 HydrophobicContact CB-CD1 3.89Å; L803-L814 HydrophobicContact CD2-CD1 3.84Å; L803-L814 HydrophobicContact CG-CD1 4.43Å; L803-L814 WeakPolarHBondContact O-CD1 3.48Å; L803-M817 HydrophobicContact CD2-CB 4.03Å; L803-W818 HydrophobicContact CD1-CE3 4Å; L803-W818 HydrophobicContact CD2-CB 4.14Å; L803-M821 HydrophobicContact CD1-SD 4.15Å; L803-M821 HydrophobicContact CD2-CE 4.04Å; L803-M821 HydrophobicContact CD2-SD 3.81Å; L803-M821 HydrophobicContact CG-CE 4.12Å; L803-M821 HydrophobicContact CG-SD 3.84Å; L803-C848 HydrophobicContact CD1-CB 3.78Å; L803-C848 VanDerWaalsContact CD1-SG 3.6Å; L803-L851 HydrophobicContact CB-CD1 4.29Å; L803-M852 HydrophobicContact CD1-CG 4.16Å; L803-M852 HydrophobicContact CD1-SD 4.3Å; L803-M852 HydrophobicContact CD2-SD 4.4Å
804	E	96.3	Very high	96.4	Very high	48 Å²	48	36.8 Å²	36.8	22%	0.224	18%	0.181	C	C	.	.	H	α-helix	trans	-58.7	-41.9	172.8	-69.8	-138.3	120.9	0	0	112.4	K765 P800 L801 R807 L851	K765-E804 IonicContact NZ-OE2 3.29Å; P800-E804 WeakPolarHBondContact O-CG 3.29Å; P800-E804 PolarHBondContact O-N 3.24Å; L801-E804 WeakPolarHBondContact O-CB 3.42Å; L801-E804 PolarHBondContact O-N 2.92Å; E804-R807 VanDerWaalsContact CD-NH2 3.34Å; E804-R807 WeakPolarHBondContact O-CB 3.37Å; E804-R807 IonicContact OE1-CZ 2.64Å; E804-R807 IonicContact OE1-NH1 2.71Å; E804-R807 IonicContact OE1-NH2 3.74Å; E804-R807 PolarHBondContact OE1-NH2 3.07Å; E804-R807 IonicContact OE2-NH2 2.84Å; E804-L851 HydrophobicContact CG-CD1 4.09Å; E804-L851 HydrophobicContact CG-CD2 4.18Å
805	C	95.8	Very high	96.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.7	-46.4	172.9	-66.6	0	0	0	0	111.7	K765 V769 T772 L801 L802 L803 R807 V808	K765-C805 PolarHBondContact O-SG 2.67Å; V769-C805 WeakPolarHBondContact CG2-O 3.36Å; T772-C805 WeakPolarHBondContact OG1-CB 3.42Å; L801-C805 PolarHBondContact O-N 3.18Å; L801-C805 PolarHBondContact O-SG 2.98Å; L802-C805 PolarHBondContact O-N 3.16Å; L803-C805 VanDerWaalsContact C-N 3.32Å; L803-C805 PolarHBondContact O-N 2.8Å; C805-R807 VanDerWaalsContact C-N 3.28Å; C805-R807 PolarHBondContact O-N 3.41Å; C805-V808 WeakPolarHBondContact O-CG1 3.47Å
806	A	95.8	Very high	96.1	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63	-32.3	-178.3	0	0	0	0	0	113.2	T772 L802 L803 V808 R809 Y813 L814 M817	T772-A806 HydrophobicContact CG2-CB 4.17Å; L802-A806 WeakPolarHBondContact O-CB 3.35Å; L802-A806 PolarHBondContact O-N 3.01Å; L803-A806 PolarHBondContact O-N 3.22Å; A806-V808 PolarHBondContact O-N 3.16Å; A806-R809 PolarHBondContact O-N 3Å; A806-Y813 HydrophobicContact CB-CD1 3.8Å; A806-Y813 HydrophobicContact CB-CE1 3.81Å; A806-L814 HydrophobicContact CB-CD1 3.91Å; A806-M817 HydrophobicContact CB-CG 4.04Å
807	R	94.3	Very high	96.1	Very high	129 Å²	129	44.5 Å²	44.5	49%	0.487	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-50.4	-33.2	-177.1	-177.4	169.8	53.9	-166.8	-10.2	113.9	L803 E804 C805 R809 G810	L803-R807 PolarHBondContact O-N 3.25Å; E804-R807 VanDerWaalsContact CD-NH2 3.34Å; E804-R807 WeakPolarHBondContact O-CB 3.37Å; E804-R807 IonicContact OE1-CZ 2.64Å; E804-R807 IonicContact OE1-NH1 2.71Å; E804-R807 IonicContact OE1-NH2 3.74Å; E804-R807 PolarHBondContact OE1-NH2 3.07Å; E804-R807 IonicContact OE2-NH2 2.84Å; C805-R807 VanDerWaalsContact C-N 3.28Å; C805-R807 PolarHBondContact O-N 3.41Å; R807-R809 VanDerWaalsContact C-N 3.26Å; R807-R809 PolarHBondContact O-N 3.25Å; R807-G810 PolarHBondContact O-N 3.12Å; R807-G810 VanDerWaalsContact O-N 3.16Å
808	V	94.8	Very high	96.1	Very high	75 Å²	75	41.6 Å²	41.6	46%	0.455	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-67.5	-22	179.6	78	0	0	0	0	113.6	E766 V769 C805 A806	E766-V808 HydrophobicContact CB-CG1 4.48Å; E766-V808 HydrophobicContact CB-CG2 4.4Å; E766-V808 HydrophobicContact CG-CB 4.2Å; E766-V808 HydrophobicContact CG-CG2 4.09Å; V769-V808 HydrophobicContact CB-CG1 3.95Å; V769-V808 HydrophobicContact CG1-CG1 4.1Å; V769-V808 HydrophobicContact CG2-CG1 3.76Å; C805-V808 WeakPolarHBondContact O-CG1 3.47Å; A806-V808 PolarHBondContact O-N 3.16Å
809	R	94	Very high	95.9	Very high	116 Å²	116	47.6 Å²	47.6	44%	0.438	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-86.9	-1.7	174.9	-83.3	-176.2	176.1	-160.8	-1.3	114.2	V769 E770 A806 R807 Y813	V769-R809 HydrophobicContact CG2-CG 3.82Å; E770-R809 IonicContact OE1-CZ 3.14Å; E770-R809 IonicContact OE1-NH2 2.78Å; E770-R809 PolarHBondContact OE1-NH2 2.94Å; E770-R809 IonicContact OE2-CZ 2.69Å; E770-R809 IonicContact OE2-NH2 3.84Å; E770-R809 PolarHBondContact OE2-NH2 3.09Å; A806-R809 PolarHBondContact O-N 3Å; R807-R809 VanDerWaalsContact C-N 3.26Å; R807-R809 PolarHBondContact O-N 3.25Å; R809-Y813 HydrophobicContact CB-CD1 3.64Å; R809-Y813 HydrophobicContact CB-CE1 4.38Å; R809-Y813 HydrophobicContact CB-CG 3.95Å; R809-Y813 HydrophobicContact CG-CD1 4.38Å
810	G	93.8	Very high	95.7	Very high	21 Å²	21	52.6 Å²	52.6	22%	0.216	26%	0.257	C	S	.	.			trans	95.7	169.4	176.9	0	0	0	0	0	114.6	R807 E812 Y813 L814	R807-G810 PolarHBondContact O-N 3.12Å; R807-G810 VanDerWaalsContact O-N 3.16Å; G810-E812 VanDerWaalsContact C-N 3.34Å; G810-E812 PolarHBondContact O-N 2.92Å; G810-Y813 PolarHBondContact O-N 3.35Å; G810-L814 PolarHBondContact O-N 2.92Å; G810-L814 VanDerWaalsContact O-N 3.15Å
811	P	92.8	Very high	95.7	Very high	84 Å²	84	51.7 Å²	51.7	55%	0.545	25%	0.252	S	S	.	.	H	α-helix	trans	-67	-29.9	-167.5	26.6	-34	0	0	0	113.5	Y813 L814 T815	P811-Y813 PolarHBondContact O-N 3.41Å; P811-L814 PolarHBondContact O-N 3.04Å; P811-T815 WeakPolarHBondContact O-CB 3.48Å; P811-T815 PolarHBondContact O-N 3.09Å; P811-T815 PolarHBondContact O-OG1 2.91Å
812	E	94.5	Very high	95.7	Very high	134 Å²	134	50.1 Å²	50.1	63%	0.626	24%	0.243	S	C	*	.	H	α-helix	trans	-66.6	-38.7	179.3	-62.7	78.7	-175	0	0	112.2	G810 Q816	G810-E812 VanDerWaalsContact C-N 3.34Å; G810-E812 PolarHBondContact O-N 2.92Å; E812-Q816 VanDerWaalsContact O-CG 3.26Å; E812-Q816 WeakPolarHBondContact O-CG 3.47Å; E812-Q816 PolarHBondContact O-N 3.5Å; E812-Q816 PolarHBondContact O-NE2 2.94Å
813	Y	95.6	Very high	95.6	Very high	26 Å²	26	53.1 Å²	53.1	10%	0.102	26%	0.259	C	S	.	.	H	α-helix	trans	-73.3	-42.3	175.9	-176.9	-107.6	0	0	0	111	V769 E773 A806 R809 G810 P811 T815 Q816 M817	V769-Y813 HydrophobicContact CG2-CE1 4.44Å; E773-Y813 WeakPolarHBondContact CB-OH 3.36Å; E773-Y813 PolarHBondContact N-OH 3.27Å; A806-Y813 HydrophobicContact CB-CD1 3.8Å; A806-Y813 HydrophobicContact CB-CE1 3.81Å; R809-Y813 HydrophobicContact CB-CD1 3.64Å; R809-Y813 HydrophobicContact CB-CE1 4.38Å; R809-Y813 HydrophobicContact CB-CG 3.95Å; R809-Y813 HydrophobicContact CG-CD1 4.38Å; G810-Y813 PolarHBondContact O-N 3.35Å; P811-Y813 PolarHBondContact O-N 3.41Å; Y813-T815 PolarHBondContact O-N 3.44Å; Y813-Q816 WeakPolarHBondContact O-CB 3.36Å; Y813-Q816 PolarHBondContact O-N 3.18Å; Y813-M817 HydrophobicContact CD1-CG 4.42Å; Y813-M817 HydrophobicContact CD2-CE 4.4Å; Y813-M817 HydrophobicContact CE1-CG 4.1Å; Y813-M817 HydrophobicContact CE1-SD 4.48Å; Y813-M817 HydrophobicContact CE2-CE 3.91Å; Y813-M817 HydrophobicContact CE2-SD 4.35Å; Y813-M817 WeakPolarHBondContact O-CG 3.46Å; Y813-M817 PolarHBondContact O-N 3.38Å
814	L	95.3	Very high	95.6	Very high	23 Å²	23	53.6 Å²	53.6	12%	0.12	26%	0.264	C	S	.	.	H	α-helix	trans	-57	-49.3	176.2	-176.9	65.9	0	0	0	112	L803 A806 G810 P811 Q816 M817 W818 M852	L803-L814 HydrophobicContact CB-CD1 3.89Å; L803-L814 HydrophobicContact CD2-CD1 3.84Å; L803-L814 HydrophobicContact CG-CD1 4.43Å; L803-L814 WeakPolarHBondContact O-CD1 3.48Å; A806-L814 HydrophobicContact CB-CD1 3.91Å; G810-L814 PolarHBondContact O-N 2.92Å; G810-L814 VanDerWaalsContact O-N 3.15Å; P811-L814 PolarHBondContact O-N 3.04Å; L814-Q816 VanDerWaalsContact C-N 3.32Å; L814-Q816 PolarHBondContact O-N 2.79Å; L814-M817 PolarHBondContact O-N 2.83Å; L814-W818 PolarHBondContact O-N 3.2Å; L814-M852 HydrophobicContact CD1-SD 4.04Å; L814-M852 HydrophobicContact CD2-CE 4.48Å; L814-M852 HydrophobicContact CD2-SD 3.87Å; L814-M852 HydrophobicContact CG-CE 4.15Å; L814-M852 HydrophobicContact CG-SD 3.56Å; L814-M852 VanDerWaalsContact CG-SD 3.56Å
815	T	94.9	Very high	95.7	Very high	54 Å²	54	51.3 Å²	51.3	33%	0.331	25%	0.253	S	S	.	.	H	α-helix	trans	-62.9	-35.4	176.4	-63.1	0	0	0	0	112.7	P811 Y813 W818 H819	P811-T815 WeakPolarHBondContact O-CB 3.48Å; P811-T815 PolarHBondContact O-N 3.09Å; P811-T815 PolarHBondContact O-OG1 2.91Å; Y813-T815 PolarHBondContact O-N 3.44Å; T815-W818 PolarHBondContact O-N 3.15Å; T815-H819 VanDerWaalsContact O-CG 3.22Å; T815-H819 PolarHBondContact O-N 2.83Å
816	Q	95.4	Very high	95.8	Very high	107 Å²	107	51.3 Å²	51.3	50%	0.5	25%	0.253	S	S	.	.	H	α-helix	trans	-64.3	-42.1	173.6	-74.7	168	34	0	0	112	E812 Y813 L814 F820	E812-Q816 VanDerWaalsContact O-CG 3.26Å; E812-Q816 WeakPolarHBondContact O-CG 3.47Å; E812-Q816 PolarHBondContact O-N 3.5Å; E812-Q816 PolarHBondContact O-NE2 2.94Å; Y813-Q816 WeakPolarHBondContact O-CB 3.36Å; Y813-Q816 PolarHBondContact O-N 3.18Å; L814-Q816 VanDerWaalsContact C-N 3.32Å; L814-Q816 PolarHBondContact O-N 2.79Å; Q816-F820 WeakPolarHBondContact O-CD2 3.35Å
817	M	97.4	Very high	95.9	Very high	1 Å²	1	54.4 Å²	54.4	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-64.8	-44.9	175.8	-62.6	-56.1	94.4	0	0	111	T772 E773 V776 L803 A806 Y813 L814 H819 F820 M821	T772-M817 HydrophobicContact CG2-CG 4.44Å; T772-M817 HydrophobicContact CG2-SD 4.49Å; E773-M817 HydrophobicContact CB-CE 4.14Å; E773-M817 HydrophobicContact CB-SD 3.88Å; E773-M817 HydrophobicContact CG-CE 4.01Å; E773-M817 HydrophobicContact CG-SD 4.26Å; V776-M817 HydrophobicContact CB-SD 4.44Å; V776-M817 HydrophobicContact CG2-SD 4.2Å; L803-M817 HydrophobicContact CD2-CB 4.03Å; A806-M817 HydrophobicContact CB-CG 4.04Å; Y813-M817 HydrophobicContact CD1-CG 4.42Å; Y813-M817 HydrophobicContact CD2-CE 4.4Å; Y813-M817 HydrophobicContact CE1-CG 4.1Å; Y813-M817 HydrophobicContact CE1-SD 4.48Å; Y813-M817 HydrophobicContact CE2-CE 3.91Å; Y813-M817 HydrophobicContact CE2-SD 4.35Å; Y813-M817 WeakPolarHBondContact O-CG 3.46Å; Y813-M817 PolarHBondContact O-N 3.38Å; L814-M817 PolarHBondContact O-N 2.83Å; M817-H819 VanDerWaalsContact C-N 3.35Å; M817-H819 PolarHBondContact O-N 3.08Å; M817-F820 HydrophobicContact CE-CD2 4.39Å; M817-F820 HydrophobicContact CE-CE2 4.45Å; M817-F820 PolarHBondContact O-N 3.21Å; M817-F820 VanDerWaalsContact O-N 3.1Å; M817-M821 WeakPolarHBondContact O-CG 3.36Å; M817-M821 PolarHBondContact O-N 3.4Å
818	W	97.9	Very high	96	Very high	1 Å²	1	48.2 Å²	48.2	0%	0.004	24%	0.243	C	C	.	.	H	α-helix	trans	-59.8	-40.5	177.5	175.8	-121.7	0	0	0	113.3	L803 L814 T815 F820 M821 C822 L825 F845 C848 V849 M852 C856 L857	L803-W818 HydrophobicContact CD1-CE3 4Å; L803-W818 HydrophobicContact CD2-CB 4.14Å; L814-W818 PolarHBondContact O-N 3.2Å; T815-W818 PolarHBondContact O-N 3.15Å; W818-F820 PolarHBondContact O-N 3.36Å; W818-M821 HydrophobicContact CE3-CB 3.99Å; W818-M821 HydrophobicContact CE3-SD 4.29Å; W818-M821 HydrophobicContact CZ3-CB 4.2Å; W818-M821 PolarHBondContact O-N 2.91Å; W818-C822 HydrophobicContact CD2-CB 4.01Å; W818-C822 HydrophobicContact CE3-CB 4.3Å; W818-C822 HydrophobicContact CH2-CB 4.01Å; W818-C822 HydrophobicContact CZ2-CB 3.68Å; W818-C822 WeakPolarHBondContact CZ2-SG 3.14Å; W818-C822 HydrophobicContact CZ3-CB 4.28Å; W818-C822 WeakPolarHBondContact O-CB 3.38Å; W818-C822 PolarHBondContact O-N 2.89Å; W818-L825 HydrophobicContact CH2-CD1 4.43Å; W818-L825 HydrophobicContact CZ3-CD1 3.89Å; W818-F845 AromaticContact CH2-CD2 3.9Å; W818-F845 HydrophobicContact CH2-CD2 3.9Å; W818-F845 AromaticContact CH2-CE2 3.78Å; W818-F845 HydrophobicContact CH2-CE2 3.78Å; W818-F845 HydrophobicContact CZ2-CE2 4.23Å; W818-C848 HydrophobicContact CE3-CB 3.94Å; W818-C848 HydrophobicContact CH2-CB 3.69Å; W818-C848 HydrophobicContact CZ3-CB 3.26Å; W818-V849 HydrophobicContact CZ2-CG2 4.47Å; W818-M852 HydrophobicContact CB-CE 3.75Å; W818-M852 HydrophobicContact CB-CG 4.25Å; W818-M852 HydrophobicContact CB-SD 3.87Å; W818-M852 HydrophobicContact CD2-CG 4.07Å; W818-M852 HydrophobicContact CG-CE 3.96Å; W818-M852 HydrophobicContact CG-CG 3.89Å; W818-M852 HydrophobicContact CG-SD 4.14Å; W818-C856 PolarHBondContact NE1-O 3.5Å; W818-L857 HydrophobicContact CZ2-CD2 4.03Å
819	H	94.4	Very high	96.2	Very high	126 Å²	126	44.7 Å²	44.7	58%	0.583	22%	0.221	S	C	*	.	H	α-helix	trans	-60.5	-27.3	175.9	-71.9	168.2	0	0	0	113.8	T815 M817	T815-H819 VanDerWaalsContact O-CG 3.22Å; T815-H819 PolarHBondContact O-N 2.83Å; M817-H819 VanDerWaalsContact C-N 3.35Å; M817-H819 PolarHBondContact O-N 3.08Å
820	F	94.1	Very high	96.2	Very high	105 Å²	105	41 Å²	41	46%	0.461	22%	0.219	S	C	.	.	H	α-helix	trans	-74.9	-28.4	172.2	-75.4	-71.5	0	0	0	112.8	V776 V780 Q816 M817 W818	V776-F820 HydrophobicContact CG1-CB 4.01Å; V780-F820 WeakPolarHBondContact CG1-O 3.41Å; Q816-F820 WeakPolarHBondContact O-CD2 3.35Å; M817-F820 HydrophobicContact CE-CD2 4.39Å; M817-F820 HydrophobicContact CE-CE2 4.45Å; M817-F820 PolarHBondContact O-N 3.21Å; M817-F820 VanDerWaalsContact O-N 3.1Å; W818-F820 PolarHBondContact O-N 3.36Å
821	M	98.1	Very high	96.2	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-90.3	-41.6	-174	-58.3	170.1	173.2	0	0	113.3	V776 V780 M799 L802 L803 M817 W818 D823 A824 L825	V776-M821 HydrophobicContact CB-CE 4.3Å; V776-M821 HydrophobicContact CG1-CE 3.89Å; V776-M821 HydrophobicContact CG1-CG 4.13Å; V776-M821 HydrophobicContact CG2-CE 3.43Å; V776-M821 VanDerWaalsContact CG2-CE 3.43Å; V780-M821 HydrophobicContact CG2-CB 4.46Å; V780-M821 HydrophobicContact CG2-CG 4.04Å; M799-M821 HydrophobicContact CB-SD 4.14Å; M799-M821 HydrophobicContact SD-CB 4.23Å; M799-M821 HydrophobicContact SD-CE 3.96Å; M799-M821 HydrophobicContact SD-CG 3.64Å; M799-M821 HydrophobicContact SD-SD 3.93Å; L802-M821 HydrophobicContact CB-CE 3.93Å; L803-M821 HydrophobicContact CD1-SD 4.15Å; L803-M821 HydrophobicContact CD2-CE 4.04Å; L803-M821 HydrophobicContact CD2-SD 3.81Å; L803-M821 HydrophobicContact CG-CE 4.12Å; L803-M821 HydrophobicContact CG-SD 3.84Å; M817-M821 WeakPolarHBondContact O-CG 3.36Å; M817-M821 PolarHBondContact O-N 3.4Å; W818-M821 HydrophobicContact CE3-CB 3.99Å; W818-M821 HydrophobicContact CE3-SD 4.29Å; W818-M821 HydrophobicContact CZ3-CB 4.2Å; W818-M821 PolarHBondContact O-N 2.91Å; M821-D823 PolarHBondContact O-N 3.4Å; M821-A824 PolarHBondContact O-N 3.36Å; M821-L825 HydrophobicContact CB-CD1 4.11Å; M821-L825 PolarHBondContact O-N 3.14Å
822	C	98	Very high	96.4	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-56.8	-52	-162.5	-173.2	0	0	0	0	113.7	W818 A824 L825 I826 L857 H861	W818-C822 HydrophobicContact CD2-CB 4.01Å; W818-C822 HydrophobicContact CE3-CB 4.3Å; W818-C822 HydrophobicContact CH2-CB 4.01Å; W818-C822 HydrophobicContact CZ2-CB 3.68Å; W818-C822 WeakPolarHBondContact CZ2-SG 3.14Å; W818-C822 HydrophobicContact CZ3-CB 4.28Å; W818-C822 WeakPolarHBondContact O-CB 3.38Å; W818-C822 PolarHBondContact O-N 2.89Å; C822-A824 PolarHBondContact O-N 3.46Å; C822-L825 PolarHBondContact O-N 2.95Å; C822-I826 WeakPolarHBondContact O-CG1 3.37Å; C822-I826 PolarHBondContact O-N 3.25Å; C822-I826 VanDerWaalsContact O-N 3.09Å; C822-L857 VanDerWaalsContact SG-CD2 3.53Å; C822-H861 VanDerWaalsContact SG-CE1 3.51Å; C822-H861 PolarHBondContact SG-ND1 2.96Å
823	D	96.9	Very high	96.1	Very high	63 Å²	63	33.7 Å²	33.7	34%	0.337	18%	0.178	S	C	.	.	H	α-helix	trans	-60.9	-42.7	179.2	179.3	93.4	0	0	0	112.1	M821 K827	M821-D823 PolarHBondContact O-N 3.4Å; D823-K827 WeakPolarHBondContact O-CB 3.16Å; D823-K827 WeakPolarHBondContact O-CG 3.19Å; D823-K827 PolarHBondContact O-N 2.87Å; D823-K827 VanDerWaalsContact O-N 3.08Å; D823-K827 WeakPolarHBondContact OD1-CE 3.29Å; D823-K827 IonicContact OD1-NZ 3.64Å; D823-K827 PolarHBondContact OD1-NZ 3.16Å; D823-K827 WeakPolarHBondContact OD2-CD 3.2Å; D823-K827 IonicContact OD2-NZ 3.72Å; D823-K827 PolarHBondContact OD2-NZ 2.82Å
824	A	97.7	Very high	96	Very high	12 Å²	12	34.8 Å²	34.8	10%	0.099	19%	0.186	C	C	.	.	H	α-helix	trans	-68.9	-40.1	-179.1	0	0	0	0	0	112.3	V780 L783 M821 C822 A828	V780-A824 HydrophobicContact CG1-CB 3.58Å; L783-A824 HydrophobicContact CD1-CB 4.18Å; M821-A824 PolarHBondContact O-N 3.36Å; C822-A824 PolarHBondContact O-N 3.46Å; A824-A828 VanDerWaalsContact O-CB 3.31Å; A824-A828 WeakPolarHBondContact O-CB 3.41Å; A824-A828 PolarHBondContact O-N 3.01Å
825	L	98.6	Very high	95.8	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64.2	-48.5	175.7	-78.9	168.1	0	0	0	111.7	L783 M799 W818 M821 C822 K827 A828 I829 I841 F845	L783-L825 HydrophobicContact CD1-CD2 3.81Å; L783-L825 HydrophobicContact CD1-CG 4.06Å; L783-L825 HydrophobicContact CD2-CD2 4.2Å; M799-L825 HydrophobicContact CB-CD1 4.3Å; M799-L825 HydrophobicContact CG-CD1 4.24Å; M799-L825 HydrophobicContact CG-CD2 4.25Å; W818-L825 HydrophobicContact CH2-CD1 4.43Å; W818-L825 HydrophobicContact CZ3-CD1 3.89Å; M821-L825 HydrophobicContact CB-CD1 4.11Å; M821-L825 PolarHBondContact O-N 3.14Å; C822-L825 PolarHBondContact O-N 2.95Å; L825-K827 VanDerWaalsContact C-N 3.33Å; L825-K827 PolarHBondContact O-N 3.41Å; L825-A828 WeakPolarHBondContact O-CB 3.17Å; L825-A828 PolarHBondContact O-N 3.27Å; L825-A828 VanDerWaalsContact O-N 3.12Å; L825-I829 WeakPolarHBondContact O-CG1 3.35Å; L825-I829 PolarHBondContact O-N 3.25Å; L825-I841 HydrophobicContact CD2-CG2 4.12Å; L825-F845 HydrophobicContact CB-CD2 3.87Å; L825-F845 HydrophobicContact CD1-CD2 4.28Å
826	I	98.4	Very high	95.7	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-57.9	-48.3	178	-67.8	168.5	0	0	0	110	C822 A828 I829 G830 F845 L857 H861 E864 I868	C822-I826 WeakPolarHBondContact O-CG1 3.37Å; C822-I826 PolarHBondContact O-N 3.25Å; C822-I826 VanDerWaalsContact O-N 3.09Å; I826-A828 VanDerWaalsContact C-N 3.3Å; I826-A828 PolarHBondContact O-N 3.09Å; I826-I829 PolarHBondContact O-N 2.97Å; I826-G830 PolarHBondContact O-N 3.19Å; I826-F845 HydrophobicContact CD1-CE2 4.04Å; I826-F845 HydrophobicContact CD1-CZ 4.17Å; I826-F845 HydrophobicContact CG1-CD2 4.32Å; I826-F845 HydrophobicContact CG1-CE2 3.55Å; I826-F845 HydrophobicContact CG1-CZ 3.85Å; I826-L857 HydrophobicContact CD1-CD2 4.45Å; I826-H861 HydrophobicContact CD1-CB 3.63Å; I826-E864 HydrophobicContact CG2-CB 4.1Å; I826-E864 HydrophobicContact CG2-CG 3.71Å; I826-I868 HydrophobicContact CG2-CD1 3.8Å; I826-I868 VanDerWaalsContact O-CD1 3.28Å; I826-I868 WeakPolarHBondContact O-CD1 3.43Å
827	K	96.4	Very high	95.8	Very high	65 Å²	65	32.3 Å²	32.3	28%	0.283	18%	0.178	S	C	.	.	H	α-helix	trans	-63.4	-33.6	177.3	-74.2	167.9	-172.3	164.5	0	113.2	D823 L825 G830 T831 E864	D823-K827 WeakPolarHBondContact O-CB 3.16Å; D823-K827 WeakPolarHBondContact O-CG 3.19Å; D823-K827 PolarHBondContact O-N 2.87Å; D823-K827 VanDerWaalsContact O-N 3.08Å; D823-K827 WeakPolarHBondContact OD1-CE 3.29Å; D823-K827 IonicContact OD1-NZ 3.64Å; D823-K827 PolarHBondContact OD1-NZ 3.16Å; D823-K827 WeakPolarHBondContact OD2-CD 3.2Å; D823-K827 IonicContact OD2-NZ 3.72Å; D823-K827 PolarHBondContact OD2-NZ 2.82Å; L825-K827 VanDerWaalsContact C-N 3.33Å; L825-K827 PolarHBondContact O-N 3.41Å; K827-G830 PolarHBondContact O-N 2.88Å; K827-T831 PolarHBondContact O-N 3.48Å; K827-T831 PolarHBondContact O-OG1 3Å; K827-E864 VanDerWaalsContact CE-OE1 3.27Å; K827-E864 WeakPolarHBondContact CE-OE1 3.38Å; K827-E864 WeakPolarHBondContact CG-OE1 3.23Å
828	A	97.8	Very high	95.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-66.7	-45.3	175.4	0	0	0	0	0	111.2	L783 A824 L825 I826 G830 T831 E832 I841	L783-A828 HydrophobicContact CB-CB 4.37Å; A824-A828 VanDerWaalsContact O-CB 3.31Å; A824-A828 WeakPolarHBondContact O-CB 3.41Å; A824-A828 PolarHBondContact O-N 3.01Å; L825-A828 WeakPolarHBondContact O-CB 3.17Å; L825-A828 PolarHBondContact O-N 3.27Å; L825-A828 VanDerWaalsContact O-N 3.12Å; I826-A828 VanDerWaalsContact C-N 3.3Å; I826-A828 PolarHBondContact O-N 3.09Å; A828-G830 PolarHBondContact O-N 3.46Å; A828-G830 VanDerWaalsContact O-N 3.16Å; A828-T831 PolarHBondContact O-N 3.16Å; A828-E832 WeakPolarHBondContact O-CB 3.48Å; A828-E832 PolarHBondContact O-N 2.71Å; A828-I841 HydrophobicContact CB-CD1 4.13Å; A828-I841 HydrophobicContact CB-CG2 3.93Å
829	I	98.3	Very high	95.8	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-55.3	-37.1	174.8	-59.9	165.7	0	0	0	111.7	L825 I826 L838 I841 M842 F845 I868 I917	L825-I829 WeakPolarHBondContact O-CG1 3.35Å; L825-I829 PolarHBondContact O-N 3.25Å; I826-I829 PolarHBondContact O-N 2.97Å; I829-L838 HydrophobicContact CB-CD1 4.4Å; I829-L838 HydrophobicContact CG2-CD1 4.06Å; I829-L838 WeakPolarHBondContact O-CD1 3.38Å; I829-I841 HydrophobicContact CG1-CG2 3.75Å; I829-M842 HydrophobicContact CB-CG 4.41Å; I829-M842 HydrophobicContact CD1-CG 4.27Å; I829-M842 HydrophobicContact CG1-CG 3.89Å; I829-M842 HydrophobicContact CG2-CG 3.74Å; I829-M842 HydrophobicContact CG2-SD 4.16Å; I829-F845 HydrophobicContact CD1-CB 3.93Å; I829-F845 HydrophobicContact CD1-CD1 4.08Å; I829-F845 HydrophobicContact CD1-CG 3.93Å; I829-I868 HydrophobicContact CB-CG2 4.24Å; I829-I868 HydrophobicContact CG2-CG2 3.65Å; I829-I917 HydrophobicContact CD1-CD1 3.9Å
830	G	94.3	Very high	96	Very high	38 Å²	38	29 Å²	29	39%	0.392	16%	0.162	S	C	.	.	H	α-helix	trans	-78.1	-14.1	178.1	0	0	0	0	0	115.9	I826 K827 A828	I826-G830 PolarHBondContact O-N 3.19Å; K827-G830 PolarHBondContact O-N 2.88Å; A828-G830 PolarHBondContact O-N 3.46Å; A828-G830 VanDerWaalsContact O-N 3.16Å
831	T	94.1	Very high	96.2	Very high	71 Å²	71	24 Å²	24	44%	0.436	14%	0.141	S	C	.	.	H	α-helix	trans	-130.9	-8.7	-171.4	55.7	0	0	0	0	115.5	Y786 K827 A828 P833	Y786-T831 PolarHBondContact OH-OG1 2.87Å; K827-T831 PolarHBondContact O-N 3.48Å; K827-T831 PolarHBondContact O-OG1 3Å; A828-T831 PolarHBondContact O-N 3.16Å; T831-P833 WeakPolarHBondContact O-CD 3.18Å
832	E	96.4	Very high	96.2	Very high	5 Å²	5	24 Å²	24	2%	0.023	14%	0.141	C	C	.	.			trans	-63.7	120.4	-178.3	174.7	48.9	-118.8	0	0	111.7	R792 A828 D834 V837 L838 I841	R792-E832 IonicContact CZ-OE1 3.54Å; R792-E832 IonicContact CZ-OE2 2.76Å; R792-E832 IonicContact NH1-OE1 2.81Å; R792-E832 PolarHBondContact NH1-OE1 3.37Å; R792-E832 IonicContact NH1-OE2 2.76Å; R792-E832 PolarHBondContact NH1-OE2 3.4Å; R792-E832 IonicContact NH2-OE1 2.75Å; A828-E832 WeakPolarHBondContact O-CB 3.48Å; A828-E832 PolarHBondContact O-N 2.71Å; E832-D834 WeakPolarHBondContact OE1-CB 3.48Å; E832-D834 PolarHBondContact OE1-N 3.2Å; E832-V837 HydrophobicContact CG-CB 4.21Å; E832-V837 HydrophobicContact CG-CG1 4.12Å; E832-L838 HydrophobicContact CB-CB 4.26Å; E832-L838 HydrophobicContact CB-CD1 4.19Å; E832-L838 HydrophobicContact CG-CB 3.71Å; E832-I841 HydrophobicContact CB-CD1 4.34Å; E832-I841 HydrophobicContact CG-CD1 4.06Å
833	P	87.4	Confident	96.3	Very high	11 Å²	11	26.6 Å²	26.6	7%	0.071	15%	0.153	C	C	.	.			trans	-78	-23.7	-177.3	30.8	-39.4	0	0	0	115.9	R7 Y786 T831	R7-P833 HydrophobicContact CB-CB 3.64Å; R7-P833 VanDerWaalsContact CD-CB 3.47Å; R7-P833 VanDerWaalsContact CD-O 3.29Å; R7-P833 WeakPolarHBondContact CD-O 3.48Å; R7-P833 HydrophobicContact CG-CB 4.13Å; R7-P833 PolarHBondContact NH1-O 2.97Å; Y786-P833 HydrophobicContact CD1-CG 4.03Å; Y786-P833 HydrophobicContact CE1-CG 4.25Å; T831-P833 WeakPolarHBondContact O-CD 3.18Å
834	D	93.8	Very high	96.3	Very high	48 Å²	48	23.8 Å²	23.8	26%	0.257	14%	0.138	S	C	.	.			trans	-101.5	139.3	-176.2	-178.1	-94.8	0	0	0	112.1	E832 D836 V837 L838	E832-D834 WeakPolarHBondContact OE1-CB 3.48Å; E832-D834 PolarHBondContact OE1-N 3.2Å; D834-D836 PolarHBondContact OD1-N 3.12Å; D834-V837 HydrophobicContact CB-CB 4.09Å; D834-V837 HydrophobicContact CB-CG2 3.95Å; D834-V837 WeakPolarHBondContact OD1-CG2 3.31Å; D834-V837 PolarHBondContact OD1-N 3.17Å; D834-L838 WeakPolarHBondContact O-CB 3.27Å; D834-L838 PolarHBondContact O-N 2.92Å
835	S	91.9	Very high	96.4	Very high	39 Å²	39	23.2 Å²	23.2	27%	0.273	13%	0.133	S	C	.	.	H	α-helix	trans	-72.2	-37.1	-173.9	-62	0	0	0	0	113.1	S839	S835-S839 WeakPolarHBondContact O-CB 3.13Å; S835-S839 PolarHBondContact O-N 3.1Å
836	D	93.3	Very high	96.4	Very high	91 Å²	91	23.4 Å²	23.4	49%	0.487	14%	0.135	S	C	.	.	H	α-helix	trans	-76.1	-44.7	-178.3	-68.1	-31.8	0	0	0	110	D834 L838 S839 E840	D834-D836 PolarHBondContact OD1-N 3.12Å; D836-L838 VanDerWaalsContact C-N 3.32Å; D836-L838 PolarHBondContact O-N 3.01Å; D836-S839 WeakPolarHBondContact O-CB 3.37Å; D836-S839 PolarHBondContact O-N 3.42Å; D836-S839 VanDerWaalsContact O-N 3.11Å; D836-S839 PolarHBondContact O-OG 3.38Å; D836-E840 PolarHBondContact O-N 3.23Å
837	V	97.4	Very high	96.4	Very high	3 Å²	3	27.3 Å²	27.3	2%	0.018	15%	0.152	C	C	.	.	H	α-helix	trans	-59.9	-42.3	172.3	-176.2	0	0	0	0	111	D789 R792 V793 E832 D834 S839 E840 I841	D789-V837 HydrophobicContact CB-CG2 3.94Å; R792-V837 HydrophobicContact CB-CG1 3.63Å; V793-V837 HydrophobicContact CG2-CG1 4.48Å; V793-V837 HydrophobicContact CG2-CG2 4.01Å; E832-V837 HydrophobicContact CG-CB 4.21Å; E832-V837 HydrophobicContact CG-CG1 4.12Å; D834-V837 HydrophobicContact CB-CB 4.09Å; D834-V837 HydrophobicContact CB-CG2 3.95Å; D834-V837 WeakPolarHBondContact OD1-CG2 3.31Å; D834-V837 PolarHBondContact OD1-N 3.17Å; V837-S839 VanDerWaalsContact C-N 3.3Å; V837-S839 PolarHBondContact O-N 2.72Å; V837-E840 PolarHBondContact O-N 2.95Å; V837-I841 HydrophobicContact CG1-CD1 3.91Å; V837-I841 WeakPolarHBondContact O-CG1 3.43Å; V837-I841 PolarHBondContact O-N 3.15Å
838	L	97.9	Very high	96.5	Very high	5 Å²	5	24.2 Å²	24.2	3%	0.026	14%	0.139	C	C	.	.	H	α-helix	trans	-58.7	-43.4	174.2	173.7	61.5	0	0	0	111.2	I829 E832 D834 D836 E840 I841 M842 K872 V910	I829-L838 HydrophobicContact CB-CD1 4.4Å; I829-L838 HydrophobicContact CG2-CD1 4.06Å; I829-L838 WeakPolarHBondContact O-CD1 3.38Å; E832-L838 HydrophobicContact CB-CB 4.26Å; E832-L838 HydrophobicContact CB-CD1 4.19Å; E832-L838 HydrophobicContact CG-CB 3.71Å; D834-L838 WeakPolarHBondContact O-CB 3.27Å; D834-L838 PolarHBondContact O-N 2.92Å; D836-L838 VanDerWaalsContact C-N 3.32Å; D836-L838 PolarHBondContact O-N 3.01Å; L838-E840 VanDerWaalsContact C-N 3.3Å; L838-E840 PolarHBondContact O-N 3.22Å; L838-I841 PolarHBondContact O-N 2.91Å; L838-M842 HydrophobicContact CD1-CG 3.85Å; L838-M842 HydrophobicContact CD1-SD 3.74Å; L838-M842 HydrophobicContact CD2-SD 4.34Å; L838-M842 HydrophobicContact CG-CG 4.3Å; L838-M842 HydrophobicContact CG-SD 3.76Å; L838-M842 WeakPolarHBondContact O-CB 3.41Å; L838-M842 VanDerWaalsContact O-CG 3.26Å; L838-M842 WeakPolarHBondContact O-CG 3.29Å; L838-M842 PolarHBondContact O-N 3.35Å; L838-K872 HydrophobicContact CD2-CD 4.24Å; L838-V910 HydrophobicContact CD2-CG1 4.22Å; L838-V910 HydrophobicContact CD2-CG2 4.24Å
839	S	96.8	Very high	96.5	Very high	3 Å²	3	24.2 Å²	24.2	2%	0.021	14%	0.139	C	C	.	.	H	α-helix	trans	-61	-39.9	-178.4	86.7	0	0	0	0	112.2	S835 D836 V837 M842 H843 Y909	S835-S839 WeakPolarHBondContact O-CB 3.13Å; S835-S839 PolarHBondContact O-N 3.1Å; D836-S839 WeakPolarHBondContact O-CB 3.37Å; D836-S839 PolarHBondContact O-N 3.42Å; D836-S839 VanDerWaalsContact O-N 3.11Å; D836-S839 PolarHBondContact O-OG 3.38Å; V837-S839 VanDerWaalsContact C-N 3.3Å; V837-S839 PolarHBondContact O-N 2.72Å; S839-M842 PolarHBondContact O-N 3.04Å; S839-H843 WeakPolarHBondContact O-CB 3.31Å; S839-H843 PolarHBondContact O-N 2.67Å; S839-Y909 VanDerWaalsContact OG-CE1 3.27Å; S839-Y909 WeakPolarHBondContact OG-CE1 3.49Å
840	E	98.1	Very high	96.4	Very high	49 Å²	49	28.9 Å²	28.9	23%	0.229	16%	0.16	C	C	.	.	H	α-helix	trans	-74.9	-35.9	178.3	-72.6	-53.9	138.5	0	0	112.7	V793 D836 V837 L838 S844	V793-E840 HydrophobicContact CG1-CG 4.38Å; D836-E840 PolarHBondContact O-N 3.23Å; V837-E840 PolarHBondContact O-N 2.95Å; L838-E840 VanDerWaalsContact C-N 3.3Å; L838-E840 PolarHBondContact O-N 3.22Å; E840-S844 WeakPolarHBondContact O-CB 3.5Å; E840-S844 PolarHBondContact O-N 3.34Å; E840-S844 PolarHBondContact O-OG 3.33Å
841	I	98.8	Very high	96.5	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.2	-44	171.6	-68.3	170.3	0	0	0	110.6	L783 A796 L825 A828 I829 E832 V837 L838 S844 F845	L783-I841 HydrophobicContact CD2-CG1 4.3Å; A796-I841 HydrophobicContact CB-CB 4.49Å; A796-I841 HydrophobicContact CB-CG1 3.74Å; L825-I841 HydrophobicContact CD2-CG2 4.12Å; A828-I841 HydrophobicContact CB-CD1 4.13Å; A828-I841 HydrophobicContact CB-CG2 3.93Å; I829-I841 HydrophobicContact CG1-CG2 3.75Å; E832-I841 HydrophobicContact CB-CD1 4.34Å; E832-I841 HydrophobicContact CG-CD1 4.06Å; V837-I841 HydrophobicContact CG1-CD1 3.91Å; V837-I841 WeakPolarHBondContact O-CG1 3.43Å; V837-I841 PolarHBondContact O-N 3.15Å; L838-I841 PolarHBondContact O-N 2.91Å; I841-S844 PolarHBondContact O-N 3.1Å; I841-F845 WeakPolarHBondContact O-CB 3.47Å; I841-F845 PolarHBondContact O-N 2.93Å
842	M	98.7	Very high	96.6	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-65.5	-45.1	177.8	-72.4	178.2	74.8	0	0	112.1	I829 L838 S839 F845 A846 L869 V910 K913 V914 I917	I829-M842 HydrophobicContact CB-CG 4.41Å; I829-M842 HydrophobicContact CD1-CG 4.27Å; I829-M842 HydrophobicContact CG1-CG 3.89Å; I829-M842 HydrophobicContact CG2-CG 3.74Å; I829-M842 HydrophobicContact CG2-SD 4.16Å; L838-M842 HydrophobicContact CD1-CG 3.85Å; L838-M842 HydrophobicContact CD1-SD 3.74Å; L838-M842 HydrophobicContact CD2-SD 4.34Å; L838-M842 HydrophobicContact CG-CG 4.3Å; L838-M842 HydrophobicContact CG-SD 3.76Å; L838-M842 WeakPolarHBondContact O-CB 3.41Å; L838-M842 VanDerWaalsContact O-CG 3.26Å; L838-M842 WeakPolarHBondContact O-CG 3.29Å; L838-M842 PolarHBondContact O-N 3.35Å; S839-M842 PolarHBondContact O-N 3.04Å; M842-F845 PolarHBondContact O-N 2.93Å; M842-A846 PolarHBondContact O-N 3.06Å; M842-L869 HydrophobicContact CE-CD2 4.36Å; M842-V910 HydrophobicContact SD-CG1 4.23Å; M842-K913 HydrophobicContact CB-CB 3.71Å; M842-K913 HydrophobicContact CB-CG 4.48Å; M842-K913 HydrophobicContact CE-CB 3.87Å; M842-K913 HydrophobicContact CG-CB 4.48Å; M842-K913 HydrophobicContact SD-CB 4.02Å; M842-V914 HydrophobicContact CE-CB 4.42Å; M842-V914 HydrophobicContact CE-CG2 3.71Å; M842-I917 HydrophobicContact CB-CD1 3.81Å; M842-I917 HydrophobicContact CB-CG1 4.46Å; M842-I917 HydrophobicContact CE-CD1 3.78Å; M842-I917 HydrophobicContact CG-CD1 3.92Å
843	H	98.4	Very high	96.6	Very high	56 Å²	56	28.4 Å²	28.4	26%	0.259	15%	0.149	S	C	.	.	H	α-helix	trans	-62.2	-44.5	175.5	-173.1	71.2	0	0	0	111.8	S839 F845 A846 K847 K913 D916	S839-H843 WeakPolarHBondContact O-CB 3.31Å; S839-H843 PolarHBondContact O-N 2.67Å; H843-F845 PolarHBondContact O-N 2.92Å; H843-A846 WeakPolarHBondContact O-CB 3.49Å; H843-A846 PolarHBondContact O-N 3.37Å; H843-K847 WeakPolarHBondContact O-CG 3.39Å; H843-K847 PolarHBondContact O-N 3.15Å; H843-K913 HydrophobicContact CB-CD 4.32Å; H843-D916 IonicContact CE1-OD2 2.73Å; H843-D916 IonicContact ND1-OD2 2.77Å; H843-D916 PolarHBondContact ND1-OD2 3.29Å
844	S	98.4	Very high	97	Very high	3 Å²	3	32.3 Å²	32.3	2%	0.021	17%	0.169	C	C	.	.	H	α-helix	trans	-63	-39.9	177.6	-63.4	0	0	0	0	112	A796 E840 I841 K847 C848	A796-S844 VanDerWaalsContact C-OG 3.23Å; A796-S844 WeakPolarHBondContact O-CB 3.41Å; A796-S844 PolarHBondContact O-OG 3.02Å; A796-S844 VanDerWaalsContact O-OG 3.11Å; E840-S844 WeakPolarHBondContact O-CB 3.5Å; E840-S844 PolarHBondContact O-N 3.34Å; E840-S844 PolarHBondContact O-OG 3.33Å; I841-S844 PolarHBondContact O-N 3.1Å; S844-K847 PolarHBondContact O-N 3.04Å; S844-C848 PolarHBondContact O-N 3.43Å; S844-C848 PolarHBondContact O-SG 3.04Å
845	F	98.8	Very high	97	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.6	-46.8	172.8	178.9	-98.9	0	0	0	112	W818 L825 I826 I829 I841 M842 H843 K847 C848 V849 L857 L865 I917	W818-F845 AromaticContact CH2-CD2 3.9Å; W818-F845 HydrophobicContact CH2-CD2 3.9Å; W818-F845 AromaticContact CH2-CE2 3.78Å; W818-F845 HydrophobicContact CH2-CE2 3.78Å; W818-F845 HydrophobicContact CZ2-CE2 4.23Å; L825-F845 HydrophobicContact CB-CD2 3.87Å; L825-F845 HydrophobicContact CD1-CD2 4.28Å; I826-F845 HydrophobicContact CD1-CE2 4.04Å; I826-F845 HydrophobicContact CD1-CZ 4.17Å; I826-F845 HydrophobicContact CG1-CD2 4.32Å; I826-F845 HydrophobicContact CG1-CE2 3.55Å; I826-F845 HydrophobicContact CG1-CZ 3.85Å; I829-F845 HydrophobicContact CD1-CB 3.93Å; I829-F845 HydrophobicContact CD1-CD1 4.08Å; I829-F845 HydrophobicContact CD1-CG 3.93Å; I841-F845 WeakPolarHBondContact O-CB 3.47Å; I841-F845 PolarHBondContact O-N 2.93Å; M842-F845 PolarHBondContact O-N 2.93Å; H843-F845 PolarHBondContact O-N 2.92Å; F845-K847 VanDerWaalsContact C-N 3.32Å; F845-K847 PolarHBondContact O-N 3.29Å; F845-C848 WeakPolarHBondContact O-CB 3.36Å; F845-C848 PolarHBondContact O-N 3.49Å; F845-V849 HydrophobicContact CD1-CG2 4.29Å; F845-V849 HydrophobicContact CE1-CG2 3.86Å; F845-V849 HydrophobicContact CE2-CG2 4.34Å; F845-V849 HydrophobicContact CZ-CG2 3.9Å; F845-V849 WeakPolarHBondContact O-CG2 3.03Å; F845-V849 PolarHBondContact O-N 3.4Å; F845-L857 HydrophobicContact CE2-CD2 4.27Å; F845-L857 HydrophobicContact CZ-CD1 4.33Å; F845-L857 HydrophobicContact CZ-CD2 3.93Å; F845-L865 HydrophobicContact CE1-CD1 4.08Å; F845-L865 HydrophobicContact CE1-CD2 3.8Å; F845-L865 HydrophobicContact CZ-CD1 4.46Å; F845-L865 HydrophobicContact CZ-CD2 4.01Å; F845-I917 HydrophobicContact CD1-CD1 4.05Å; F845-I917 HydrophobicContact CD1-CG1 4.07Å; F845-I917 HydrophobicContact CD1-CG2 4.08Å; F845-I917 HydrophobicContact CE1-CG2 3.97Å
846	A	98.6	Very high	97.3	Very high	5 Å²	5	31.6 Å²	31.6	4%	0.041	18%	0.177	C	C	.	.	H	α-helix	trans	-57.8	-44.1	176.3	0	0	0	0	0	111.9	M842 H843 C848 V849 E850 D916 I917 S920	M842-A846 PolarHBondContact O-N 3.06Å; H843-A846 WeakPolarHBondContact O-CB 3.49Å; H843-A846 PolarHBondContact O-N 3.37Å; A846-C848 PolarHBondContact O-N 2.7Å; A846-V849 PolarHBondContact O-N 2.9Å; A846-E850 PolarHBondContact O-N 2.94Å; A846-D916 HydrophobicContact CB-CB 4.06Å; A846-I917 HydrophobicContact CB-CG1 4.09Å; A846-S920 VanDerWaalsContact O-CB 3.24Å; A846-S920 WeakPolarHBondContact O-CB 3.22Å
847	K	98.4	Very high	97.5	Very high	82 Å²	82	27.8 Å²	27.8	36%	0.357	16%	0.157	S	C	.	.	H	α-helix	trans	-66.1	-36	176.2	-71.6	-69.2	165.6	-144	0	113.2	P800 H843 S844 F845 E850 L851	P800-K847 HydrophobicContact CB-CB 3.87Å; P800-K847 HydrophobicContact CG-CB 4.21Å; H843-K847 WeakPolarHBondContact O-CG 3.39Å; H843-K847 PolarHBondContact O-N 3.15Å; S844-K847 PolarHBondContact O-N 3.04Å; F845-K847 VanDerWaalsContact C-N 3.32Å; F845-K847 PolarHBondContact O-N 3.29Å; K847-E850 WeakPolarHBondContact CD-OE2 3.43Å; K847-E850 IonicContact NZ-OE2 3.21Å; K847-E850 PolarHBondContact NZ-OE2 2.87Å; K847-E850 PolarHBondContact O-N 2.85Å; K847-L851 WeakPolarHBondContact O-CB 3.45Å; K847-L851 VanDerWaalsContact O-CG 3.27Å; K847-L851 WeakPolarHBondContact O-CG 3.42Å; K847-L851 PolarHBondContact O-N 3.45Å
848	C	98.5	Very high	97.4	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-63.9	-42.8	171.5	-69.6	0	0	0	0	112.2	L803 W818 S844 F845 A846 L851 M852	L803-C848 HydrophobicContact CD1-CB 3.78Å; L803-C848 VanDerWaalsContact CD1-SG 3.6Å; W818-C848 HydrophobicContact CE3-CB 3.94Å; W818-C848 HydrophobicContact CH2-CB 3.69Å; W818-C848 HydrophobicContact CZ3-CB 3.26Å; S844-C848 PolarHBondContact O-N 3.43Å; S844-C848 PolarHBondContact O-SG 3.04Å; F845-C848 WeakPolarHBondContact O-CB 3.36Å; F845-C848 PolarHBondContact O-N 3.49Å; A846-C848 PolarHBondContact O-N 2.7Å; C848-L851 PolarHBondContact O-N 3.36Å; C848-M852 WeakPolarHBondContact O-CB 3.37Å; C848-M852 WeakPolarHBondContact O-CG 3.34Å; C848-M852 PolarHBondContact O-N 2.88Å
849	V	98.4	Very high	97.3	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-61.9	-45.1	176.2	172.1	0	0	0	0	110.8	W818 F845 A846 L851 M852 G853 V921	W818-V849 HydrophobicContact CZ2-CG2 4.47Å; F845-V849 HydrophobicContact CD1-CG2 4.29Å; F845-V849 HydrophobicContact CE1-CG2 3.86Å; F845-V849 HydrophobicContact CE2-CG2 4.34Å; F845-V849 HydrophobicContact CZ-CG2 3.9Å; F845-V849 WeakPolarHBondContact O-CG2 3.03Å; F845-V849 PolarHBondContact O-N 3.4Å; A846-V849 PolarHBondContact O-N 2.9Å; V849-L851 PolarHBondContact O-N 3.21Å; V849-M852 PolarHBondContact O-N 3.48Å; V849-G853 PolarHBondContact O-N 3.49Å; V849-V921 HydrophobicContact CG1-CG2 4.21Å
850	E	96.6	Very high	97.2	Very high	98 Å²	98	44.2 Å²	44.2	46%	0.458	24%	0.24	S	C	.	.	H	α-helix	trans	-59.6	-42.6	176.1	-169.2	-170.2	165.1	0	0	112.4	A846 K847	A846-E850 PolarHBondContact O-N 2.94Å; K847-E850 WeakPolarHBondContact CD-OE2 3.43Å; K847-E850 IonicContact NZ-OE2 3.21Å; K847-E850 PolarHBondContact NZ-OE2 2.87Å; K847-E850 PolarHBondContact O-N 2.85Å
851	L	95.6	Very high	97.2	Very high	54 Å²	54	43 Å²	43	28%	0.283	23%	0.234	S	C	.	.	H	α-helix	trans	-68.3	-32.2	177.7	-75.3	169.6	0	0	0	113.5	P800 L803 E804 K847 C848 V849	P800-L851 HydrophobicContact CB-CD1 3.8Å; P800-L851 WeakPolarHBondContact O-CD1 3.26Å; L803-L851 HydrophobicContact CB-CD1 4.29Å; E804-L851 HydrophobicContact CG-CD1 4.09Å; E804-L851 HydrophobicContact CG-CD2 4.18Å; K847-L851 WeakPolarHBondContact O-CB 3.45Å; K847-L851 VanDerWaalsContact O-CG 3.27Å; K847-L851 WeakPolarHBondContact O-CG 3.42Å; K847-L851 PolarHBondContact O-N 3.45Å; C848-L851 PolarHBondContact O-N 3.36Å; V849-L851 PolarHBondContact O-N 3.21Å
852	M	96.8	Very high	97.2	Very high	34 Å²	34	44 Å²	44	17%	0.167	24%	0.238	C	C	.	.	H	α-helix	trans	-90.4	-36.4	-176.3	-67.6	-60.8	-58.3	0	0	113.5	L803 L814 W818 C848 V849 C856	L803-M852 HydrophobicContact CD1-CG 4.16Å; L803-M852 HydrophobicContact CD1-SD 4.3Å; L803-M852 HydrophobicContact CD2-SD 4.4Å; L814-M852 HydrophobicContact CD1-SD 4.04Å; L814-M852 HydrophobicContact CD2-CE 4.48Å; L814-M852 HydrophobicContact CD2-SD 3.87Å; L814-M852 HydrophobicContact CG-CE 4.15Å; L814-M852 HydrophobicContact CG-SD 3.56Å; L814-M852 VanDerWaalsContact CG-SD 3.56Å; W818-M852 HydrophobicContact CB-CE 3.75Å; W818-M852 HydrophobicContact CB-CG 4.25Å; W818-M852 HydrophobicContact CB-SD 3.87Å; W818-M852 HydrophobicContact CD2-CG 4.07Å; W818-M852 HydrophobicContact CG-CE 3.96Å; W818-M852 HydrophobicContact CG-CG 3.89Å; W818-M852 HydrophobicContact CG-SD 4.14Å; C848-M852 WeakPolarHBondContact O-CB 3.37Å; C848-M852 WeakPolarHBondContact O-CG 3.34Å; C848-M852 PolarHBondContact O-N 2.88Å; V849-M852 PolarHBondContact O-N 3.48Å; M852-C856 HydrophobicContact CB-CB 3.41Å; M852-C856 VanDerWaalsContact CB-CB 3.41Å; M852-C856 HydrophobicContact CG-CB 4.3Å
853	G	95.7	Very high	97.1	Very high	16 Å²	16	51.2 Å²	51.2	17%	0.165	27%	0.272	C	S	.	.			trans	73.1	-159.1	178.1	0	0	0	0	0	115.9	V849 G855 C856	V849-G853 PolarHBondContact O-N 3.49Å; G853-G855 PolarHBondContact O-N 2.95Å; G853-C856 WeakPolarHBondContact O-CB 3.45Å; G853-C856 PolarHBondContact O-N 3.38Å; G853-C856 PolarHBondContact O-SG 2.95Å
854	D	95.9	Very high	97.1	Very high	92 Å²	92	51.4 Å²	51.4	49%	0.492	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	121.8	-176.8	-172.3	3.1	0	0	0	112.7	K928	D854-K928 IonicContact OD1-NZ 2.77Å; D854-K928 PolarHBondContact OD1-NZ 2.99Å; D854-K928 IonicContact OD2-NZ 3.58Å; D854-K928 PolarHBondContact OD2-NZ 2.84Å
855	G	94.6	Very high	97.1	Very high	58 Å²	58	51.2 Å²	51.2	60%	0.598	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.7	4.9	179.3	0	0	0	0	0	115.6	G853 Y925	G853-G855 PolarHBondContact O-N 2.95Å; G855-Y925 WeakPolarHBondContact CA-OH 3.41Å; G855-Y925 PolarHBondContact N-OH 3.27Å
856	C	97	Very high	97.1	Very high	14 Å²	14	51.2 Å²	51.2	10%	0.095	27%	0.272	C	S	.	.	S	Bend	trans	-72.7	-28.1	177.7	68.5	0	0	0	0	114.6	W818 M852 G853 Y925	W818-C856 PolarHBondContact NE1-O 3.5Å; M852-C856 HydrophobicContact CB-CB 3.41Å; M852-C856 VanDerWaalsContact CB-CB 3.41Å; M852-C856 HydrophobicContact CG-CB 4.3Å; G853-C856 WeakPolarHBondContact O-CB 3.45Å; G853-C856 PolarHBondContact O-N 3.38Å; G853-C856 PolarHBondContact O-SG 2.95Å; C856-Y925 PolarHBondContact N-OH 3.34Å; C856-Y925 VanDerWaalsContact N-OH 3.15Å
857	L	97.6	Very high	97.1	Very high	11 Å²	11	52.9 Å²	52.9	6%	0.058	29%	0.29	C	S	.	.	S	Bend	trans	-102.6	138.1	174.3	-57.3	178.4	0	0	0	110.9	W818 C822 I826 F845 H861 F862 L865 V921 Y925	W818-L857 HydrophobicContact CZ2-CD2 4.03Å; C822-L857 VanDerWaalsContact SG-CD2 3.53Å; I826-L857 HydrophobicContact CD1-CD2 4.45Å; F845-L857 HydrophobicContact CE2-CD2 4.27Å; F845-L857 HydrophobicContact CZ-CD1 4.33Å; F845-L857 HydrophobicContact CZ-CD2 3.93Å; L857-H861 HydrophobicContact CB-CB 4.41Å; L857-H861 HydrophobicContact CD2-CB 4.28Å; L857-F862 HydrophobicContact CB-CD2 3.97Å; L857-F862 HydrophobicContact CB-CE2 3.68Å; L857-F862 HydrophobicContact CB-CG 4.5Å; L857-F862 HydrophobicContact CB-CZ 3.97Å; L857-F862 HydrophobicContact CD1-CD1 4.27Å; L857-F862 HydrophobicContact CD1-CE1 3.85Å; L857-F862 HydrophobicContact CD1-CE2 4.48Å; L857-F862 HydrophobicContact CD1-CZ 3.97Å; L857-L865 HydrophobicContact CD1-CD2 4.24Å; L857-V921 HydrophobicContact CD1-CG2 4.35Å; L857-Y925 WeakPolarHBondContact CA-OH 3.42Å; L857-Y925 WeakPolarHBondContact CB-OH 3.38Å; L857-Y925 PolarHBondContact N-OH 3.46Å; L857-Y925 PolarHBondContact O-OH 3.3Å; L857-Y925 VanDerWaalsContact O-OH 3.07Å
858	N	95.5	Very high	97.1	Very high	70 Å²	70	50.3 Å²	50.3	37%	0.374	28%	0.279	S	S	.	.			trans	-93.8	176.7	171.3	71.7	41.8	0	0	0	110.8	E860 H861 F862	N858-E860 PolarHBondContact O-N 2.96Å; N858-E860 WeakPolarHBondContact OD1-CA 3.38Å; N858-E860 WeakPolarHBondContact OD1-CB 3.48Å; N858-E860 PolarHBondContact OD1-N 3.25Å; N858-H861 PolarHBondContact ND2-CD2 3.44Å; N858-H861 PolarHBondContact ND2-CE1 3.18Å; N858-H861 PolarHBondContact ND2-ND1 3.04Å; N858-H861 PolarHBondContact ND2-NE2 3.44Å; N858-H861 PolarHBondContact O-N 3.48Å; N858-H861 PolarHBondContact OD1-CD2 3.05Å; N858-H861 PolarHBondContact OD1-N 2.87Å; N858-F862 VanDerWaalsContact O-CD2 3.3Å; N858-F862 WeakPolarHBondContact O-CD2 3.5Å; N858-F862 PolarHBondContact O-N 3.24Å
859	N	95.5	Very high	97.1	Very high	144 Å²	144	50.3 Å²	50.3	77%	0.77	28%	0.279	S	S	*	.	H	α-helix	trans	-63.9	-36	-176.7	-66.1	-1.5	0	0	0	113.8	F862 E863	N859-F862 PolarHBondContact O-N 3.21Å; N859-E863 PolarHBondContact O-N 2.96Å
860	E	96.2	Very high	97.1	Very high	143 Å²	143	53.6 Å²	53.6	67%	0.668	29%	0.294	S	S	*	.	H	α-helix	trans	-69.8	-44.5	-179.7	-176.6	173.3	-171.3	0	0	110.3	N858 F862 E863 E864	N858-E860 PolarHBondContact O-N 2.96Å; N858-E860 WeakPolarHBondContact OD1-CA 3.38Å; N858-E860 WeakPolarHBondContact OD1-CB 3.48Å; N858-E860 PolarHBondContact OD1-N 3.25Å; E860-F862 VanDerWaalsContact C-N 3.29Å; E860-F862 PolarHBondContact O-N 2.95Å; E860-E863 PolarHBondContact O-N 3.34Å; E860-E863 VanDerWaalsContact O-N 3.14Å; E860-E864 PolarHBondContact O-N 3.24Å
861	H	97.6	Very high	97.1	Very high	22 Å²	22	50.5 Å²	50.5	10%	0.102	29%	0.288	C	S	.	.	H	α-helix	trans	-59.3	-39.2	172.2	-61.9	179	0	0	0	112	C822 I826 L857 N858 L865	C822-H861 VanDerWaalsContact SG-CE1 3.51Å; C822-H861 PolarHBondContact SG-ND1 2.96Å; I826-H861 HydrophobicContact CD1-CB 3.63Å; L857-H861 HydrophobicContact CB-CB 4.41Å; L857-H861 HydrophobicContact CD2-CB 4.28Å; N858-H861 PolarHBondContact ND2-CD2 3.44Å; N858-H861 PolarHBondContact ND2-CE1 3.18Å; N858-H861 PolarHBondContact ND2-ND1 3.04Å; N858-H861 PolarHBondContact ND2-NE2 3.44Å; N858-H861 PolarHBondContact O-N 3.48Å; N858-H861 PolarHBondContact OD1-CD2 3.05Å; N858-H861 PolarHBondContact OD1-N 2.87Å; H861-L865 WeakPolarHBondContact O-CB 3.5Å; H861-L865 PolarHBondContact O-N 3Å
862	F	98.1	Very high	97.3	Very high	22 Å²	22	49.5 Å²	49.5	10%	0.096	28%	0.281	C	S	.	.	H	α-helix	trans	-66.9	-41.4	174.3	-89.6	-60.3	0	0	0	112.2	L857 N858 N859 E860 G866 V921 Y925 V929 W932	L857-F862 HydrophobicContact CB-CD2 3.97Å; L857-F862 HydrophobicContact CB-CE2 3.68Å; L857-F862 HydrophobicContact CB-CG 4.5Å; L857-F862 HydrophobicContact CB-CZ 3.97Å; L857-F862 HydrophobicContact CD1-CD1 4.27Å; L857-F862 HydrophobicContact CD1-CE1 3.85Å; L857-F862 HydrophobicContact CD1-CE2 4.48Å; L857-F862 HydrophobicContact CD1-CZ 3.97Å; N858-F862 VanDerWaalsContact O-CD2 3.3Å; N858-F862 WeakPolarHBondContact O-CD2 3.5Å; N858-F862 PolarHBondContact O-N 3.24Å; N859-F862 PolarHBondContact O-N 3.21Å; E860-F862 VanDerWaalsContact C-N 3.29Å; E860-F862 PolarHBondContact O-N 2.95Å; F862-G866 PolarHBondContact O-N 2.86Å; F862-V921 HydrophobicContact CE1-CG1 4Å; F862-Y925 HydrophobicContact CE2-CD1 4.39Å; F862-Y925 AromaticContact CE2-CE1 3.76Å; F862-Y925 HydrophobicContact CE2-CE1 3.76Å; F862-Y925 HydrophobicContact CE2-CE2 4.39Å; F862-Y925 AromaticContact CE2-CZ 3.76Å; F862-Y925 HydrophobicContact CZ-CD1 4.1Å; F862-Y925 HydrophobicContact CZ-CD2 4.07Å; F862-Y925 AromaticContact CZ-CE1 3.79Å; F862-Y925 HydrophobicContact CZ-CE1 3.79Å; F862-Y925 AromaticContact CZ-CE2 3.8Å; F862-Y925 HydrophobicContact CZ-CE2 3.8Å; F862-Y925 HydrophobicContact CZ-CG 4.22Å; F862-Y925 AromaticContact CZ-CZ 3.63Å; F862-V929 HydrophobicContact CE1-CG2 3.76Å; F862-V929 HydrophobicContact CZ-CG2 4.06Å; F862-W932 AromaticContact CD1-CD1 3.86Å; F862-W932 AromaticContact CD1-CD2 3.95Å; F862-W932 HydrophobicContact CD1-CD2 3.95Å; F862-W932 AromaticContact CD1-CE2 3.69Å; F862-W932 HydrophobicContact CD1-CG 4.05Å; F862-W932 HydrophobicContact CD1-CZ2 4.18Å; F862-W932 AromaticContact CD1-NE1 3.65Å; F862-W932 HydrophobicContact CE1-CD2 4.38Å; F862-W932 PolarHBondContact O-NE1 2.79Å
863	E	97.5	Very high	97.3	Very high	151 Å²	151	47.9 Å²	47.9	71%	0.706	27%	0.274	S	S	*	.	H	α-helix	trans	-64.1	-46.8	177.7	-171.4	166.8	-178	0	0	111.4	N859 E860 G866 G867	N859-E863 PolarHBondContact O-N 2.96Å; E860-E863 PolarHBondContact O-N 3.34Å; E860-E863 VanDerWaalsContact O-N 3.14Å; E863-G866 PolarHBondContact O-N 3.01Å; E863-G867 PolarHBondContact O-N 3.38Å
864	E	97.9	Very high	97.4	Very high	60 Å²	60	51.5 Å²	51.5	28%	0.28	29%	0.286	S	S	.	.	H	α-helix	trans	-64	-49.6	177.1	-169.8	175.7	-163.7	0	0	111.9	I826 K827 E860 G866 G867 I868	I826-E864 HydrophobicContact CG2-CB 4.1Å; I826-E864 HydrophobicContact CG2-CG 3.71Å; K827-E864 VanDerWaalsContact CE-OE1 3.27Å; K827-E864 WeakPolarHBondContact CE-OE1 3.38Å; K827-E864 WeakPolarHBondContact CG-OE1 3.23Å; E860-E864 PolarHBondContact O-N 3.24Å; E864-G866 VanDerWaalsContact C-N 3.31Å; E864-G866 PolarHBondContact O-N 3.24Å; E864-G867 PolarHBondContact O-N 3.35Å; E864-I868 HydrophobicContact CG-CD1 3.92Å; E864-I868 WeakPolarHBondContact O-CG1 3.37Å; E864-I868 PolarHBondContact O-N 3.49Å
865	L	98.4	Very high	97.5	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60.8	-39.2	176.9	-178.4	66.3	0	0	0	112	F845 L857 H861 I868 L869 I917 W932	F845-L865 HydrophobicContact CE1-CD1 4.08Å; F845-L865 HydrophobicContact CE1-CD2 3.8Å; F845-L865 HydrophobicContact CZ-CD1 4.46Å; F845-L865 HydrophobicContact CZ-CD2 4.01Å; L857-L865 HydrophobicContact CD1-CD2 4.24Å; H861-L865 WeakPolarHBondContact O-CB 3.5Å; H861-L865 PolarHBondContact O-N 3Å; L865-I868 PolarHBondContact O-N 3.41Å; L865-L869 HydrophobicContact CD1-CD1 4.11Å; L865-L869 HydrophobicContact CD1-CD2 4.44Å; L865-L869 HydrophobicContact CD1-CG 4.01Å; L865-L869 HydrophobicContact CG-CD1 3.99Å; L865-L869 HydrophobicContact CG-CG 4.25Å; L865-L869 WeakPolarHBondContact O-CB 3.36Å; L865-L869 WeakPolarHBondContact O-CG 3.22Å; L865-L869 PolarHBondContact O-N 3.4Å; L865-I917 HydrophobicContact CD1-CG2 4.39Å; L865-I917 HydrophobicContact CD2-CG2 4.28Å; L865-W932 HydrophobicContact CD2-CZ2 4.31Å; L865-W932 HydrophobicContact CG-CZ2 4.36Å
866	G	98.3	Very high	97.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61	-45.4	175.8	0	0	0	0	0	112	F862 E863 E864 K870	F862-G866 PolarHBondContact O-N 2.86Å; E863-G866 PolarHBondContact O-N 3.01Å; E864-G866 VanDerWaalsContact C-N 3.31Å; E864-G866 PolarHBondContact O-N 3.24Å; G866-K870 WeakPolarHBondContact O-CB 3.31Å; G866-K870 PolarHBondContact O-N 2.82Å
867	G	98.3	Very high	97.6	Very high	40 Å²	40	47.7 Å²	47.7	41%	0.412	25%	0.248	S	C	.	.	H	α-helix	trans	-62	-43	173.9	0	0	0	0	0	113.4	E863 E864 K870 G871	E863-G867 PolarHBondContact O-N 3.38Å; E864-G867 PolarHBondContact O-N 3.35Å; G867-K870 WeakPolarHBondContact O-CB 3.43Å; G867-K870 PolarHBondContact O-N 2.84Å; G867-G871 PolarHBondContact O-N 3.29Å
868	I	98.6	Very high	97.6	Very high	27 Å²	27	53.6 Å²	53.6	14%	0.138	27%	0.273	C	S	.	.	H	α-helix	trans	-66.9	-50.3	-179.5	-70.7	168.8	0	0	0	111.7	I826 I829 E864 L865 K870 G871 K872	I826-I868 HydrophobicContact CG2-CD1 3.8Å; I826-I868 VanDerWaalsContact O-CD1 3.28Å; I826-I868 WeakPolarHBondContact O-CD1 3.43Å; I829-I868 HydrophobicContact CB-CG2 4.24Å; I829-I868 HydrophobicContact CG2-CG2 3.65Å; E864-I868 HydrophobicContact CG-CD1 3.92Å; E864-I868 WeakPolarHBondContact O-CG1 3.37Å; E864-I868 PolarHBondContact O-N 3.49Å; L865-I868 PolarHBondContact O-N 3.41Å; I868-K870 VanDerWaalsContact C-N 3.27Å; I868-K870 PolarHBondContact O-N 3.27Å; I868-G871 PolarHBondContact O-N 2.9Å; I868-G871 VanDerWaalsContact O-N 3.12Å; I868-K872 PolarHBondContact O-N 3.39Å
869	L	98.6	Very high	97.6	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.8	-35.9	178	-66.3	178.9	0	0	0	111.5	M842 L865 K872 L873 V914 I917 L918 W932 L936	M842-L869 HydrophobicContact CE-CD2 4.36Å; L865-L869 HydrophobicContact CD1-CD1 4.11Å; L865-L869 HydrophobicContact CD1-CD2 4.44Å; L865-L869 HydrophobicContact CD1-CG 4.01Å; L865-L869 HydrophobicContact CG-CD1 3.99Å; L865-L869 HydrophobicContact CG-CG 4.25Å; L865-L869 WeakPolarHBondContact O-CB 3.36Å; L865-L869 WeakPolarHBondContact O-CG 3.22Å; L865-L869 PolarHBondContact O-N 3.4Å; L869-K872 PolarHBondContact O-N 2.85Å; L869-L873 WeakPolarHBondContact O-CG 3.47Å; L869-L873 PolarHBondContact O-N 3.16Å; L869-V914 HydrophobicContact CD2-CG1 4.37Å; L869-V914 HydrophobicContact CD2-CG2 4.31Å; L869-I917 HydrophobicContact CD1-CG2 4.12Å; L869-I917 HydrophobicContact CD2-CD1 4.28Å; L869-L918 HydrophobicContact CD1-CD2 4.17Å; L869-L918 HydrophobicContact CD1-CG 4.48Å; L869-W932 HydrophobicContact CD1-CH2 4.17Å; L869-L936 HydrophobicContact CB-CD1 4.16Å; L869-L936 HydrophobicContact CB-CD2 4.22Å; L869-L936 HydrophobicContact CD1-CD1 4.25Å
870	K	98.5	Very high	97.5	Very high	70 Å²	70	45.6 Å²	45.6	30%	0.304	23%	0.23	S	C	.	.	H	α-helix	trans	-60.9	-48.1	171.9	-172.2	-179	173.6	-80	0	111.3	G866 G867 I868 K872 L873 E874 L936 L939	G866-K870 WeakPolarHBondContact O-CB 3.31Å; G866-K870 PolarHBondContact O-N 2.82Å; G867-K870 WeakPolarHBondContact O-CB 3.43Å; G867-K870 PolarHBondContact O-N 2.84Å; I868-K870 VanDerWaalsContact C-N 3.27Å; I868-K870 PolarHBondContact O-N 3.27Å; K870-K872 PolarHBondContact O-N 3.37Å; K870-L873 PolarHBondContact O-N 3.16Å; K870-E874 WeakPolarHBondContact CE-OE1 3.47Å; K870-E874 IonicContact NZ-OE1 2.72Å; K870-E874 PolarHBondContact NZ-OE1 3.07Å; K870-E874 IonicContact NZ-OE2 2.82Å; K870-E874 PolarHBondContact NZ-OE2 3.03Å; K870-E874 WeakPolarHBondContact O-CG 3.34Å; K870-E874 PolarHBondContact O-N 2.94Å; K870-L936 HydrophobicContact CB-CD2 3.73Å; K870-L939 HydrophobicContact CB-CD1 4.48Å; K870-L939 HydrophobicContact CG-CD1 3.66Å
871	G	97.9	Very high	97.4	Very high	33 Å²	33	45 Å²	45	34%	0.34	23%	0.228	S	C	.	.	H	α-helix	trans	-59.5	-42.9	177.7	0	0	0	0	0	112.8	G867 I868 E874 E875	G867-G871 PolarHBondContact O-N 3.29Å; I868-G871 PolarHBondContact O-N 2.9Å; I868-G871 VanDerWaalsContact O-N 3.12Å; G871-E874 PolarHBondContact O-N 3.23Å; G871-E875 WeakPolarHBondContact O-CB 3.28Å; G871-E875 PolarHBondContact O-N 2.94Å
872	K	97.8	Very high	97.2	Very high	32 Å²	32	48 Å²	48	14%	0.139	24%	0.243	C	C	.	.	H	α-helix	trans	-64.9	-38.5	176.7	-70.4	-73.1	163.7	-162.5	0	113	L838 I868 L869 K870 E875 H876	L838-K872 HydrophobicContact CD2-CD 4.24Å; I868-K872 PolarHBondContact O-N 3.39Å; L869-K872 PolarHBondContact O-N 2.85Å; K870-K872 PolarHBondContact O-N 3.37Å; K872-E875 IonicContact NZ-OE2 2.97Å; K872-E875 PolarHBondContact NZ-OE2 3.39Å; K872-E875 PolarHBondContact O-N 3.27Å; K872-H876 PolarHBondContact O-N 3.34Å
873	L	98.3	Very high	97	Very high	1 Å²	1	47 Å²	47	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-69.2	-35.1	173	-71.5	164.8	0	0	0	112.7	L869 K870 F877 L911 V914 L939 I940 L943	L869-L873 WeakPolarHBondContact O-CG 3.47Å; L869-L873 PolarHBondContact O-N 3.16Å; K870-L873 PolarHBondContact O-N 3.16Å; L873-F877 WeakPolarHBondContact O-CD2 3.44Å; L873-F877 PolarHBondContact O-N 3.36Å; L873-L911 HydrophobicContact CD2-CD1 3.82Å; L873-V914 HydrophobicContact CD2-CG1 4.44Å; L873-L939 HydrophobicContact CB-CB 4.08Å; L873-L939 HydrophobicContact CB-CD1 3.82Å; L873-L939 HydrophobicContact CB-CG 4.46Å; L873-L939 HydrophobicContact CD1-CB 4.06Å; L873-L939 HydrophobicContact CD1-CD1 4.4Å; L873-I940 HydrophobicContact CD1-CD1 3.65Å; L873-I940 HydrophobicContact CD2-CD1 4.17Å; L873-L943 HydrophobicContact CD2-CD1 4.26Å
874	E	98.2	Very high	96.7	Very high	92 Å²	92	45.6 Å²	45.6	43%	0.43	23%	0.233	S	C	.	.	H	α-helix	trans	-68.9	-37.2	173.4	-72.2	176	152.3	0	0	111.7	K870 G871 K878 L939	K870-E874 WeakPolarHBondContact CE-OE1 3.47Å; K870-E874 IonicContact NZ-OE1 2.72Å; K870-E874 PolarHBondContact NZ-OE1 3.07Å; K870-E874 IonicContact NZ-OE2 2.82Å; K870-E874 PolarHBondContact NZ-OE2 3.03Å; K870-E874 WeakPolarHBondContact O-CG 3.34Å; K870-E874 PolarHBondContact O-N 2.94Å; G871-E874 PolarHBondContact O-N 3.23Å; E874-K878 WeakPolarHBondContact O-CB 3.47Å; E874-K878 PolarHBondContact O-N 2.85Å; E874-L939 HydrophobicContact CG-CD1 3.89Å; E874-L939 HydrophobicContact CG-CD2 4.09Å
875	E	96.6	Very high	96.4	Very high	65 Å²	65	45.5 Å²	45.5	30%	0.304	24%	0.242	S	C	.	.	H	α-helix	trans	-61.2	-50.9	172.4	-175.9	171.7	-156.8	0	0	111.4	G871 K872 F877 K878 N879	G871-E875 WeakPolarHBondContact O-CB 3.28Å; G871-E875 PolarHBondContact O-N 2.94Å; K872-E875 IonicContact NZ-OE2 2.97Å; K872-E875 PolarHBondContact NZ-OE2 3.39Å; K872-E875 PolarHBondContact O-N 3.27Å; E875-F877 PolarHBondContact O-N 3.36Å; E875-K878 WeakPolarHBondContact O-CB 3.13Å; E875-K878 PolarHBondContact O-N 3.09Å; E875-K878 VanDerWaalsContact O-N 3.08Å; E875-N879 WeakPolarHBondContact O-CB 3.47Å; E875-N879 VanDerWaalsContact O-CG 3.25Å; E875-N879 PolarHBondContact O-N 3.36Å; E875-N879 PolarHBondContact O-OD1 3.12Å
876	H	97.6	Very high	95.9	Very high	9 Å²	9	49.7 Å²	49.7	4%	0.042	26%	0.26	C	S	.	.	H	α-helix	trans	-48.9	-51.9	176.5	-178.7	76.9	0	0	0	113	K872 K878 N879 Q880 D952	K872-H876 PolarHBondContact O-N 3.34Å; H876-K878 PolarHBondContact O-N 3.36Å; H876-N879 PolarHBondContact O-N 3.22Å; H876-Q880 PolarHBondContact NE2-NE2 3.43Å; H876-Q880 VanDerWaalsContact NE2-NE2 3.16Å; H876-Q880 PolarHBondContact O-N 2.93Å; H876-Q880 VanDerWaalsContact O-N 3.17Å; H876-D952 IonicContact CD2-OD1 2.85Å; H876-D952 IonicContact CE1-OD1 2.77Å; H876-D952 IonicContact NE2-OD1 3.7Å; H876-D952 PolarHBondContact NE2-OD1 3.11Å; H876-D952 IonicContact NE2-OD2 2.82Å
877	F	97.6	Very high	95.5	Very high	10 Å²	10	53.2 Å²	53.2	4%	0.044	27%	0.274	C	S	.	.	H	α-helix	trans	-68.9	-34.6	-179.7	-65.6	-54.9	0	0	0	113.4	L873 E875 E881 L939 Q942 L943	L873-F877 WeakPolarHBondContact O-CD2 3.44Å; L873-F877 PolarHBondContact O-N 3.36Å; E875-F877 PolarHBondContact O-N 3.36Å; F877-E881 PolarHBondContact O-N 2.98Å; F877-L939 HydrophobicContact CD2-CD2 4.19Å; F877-L939 HydrophobicContact CE2-CB 4.31Å; F877-L939 HydrophobicContact CE2-CD2 4.02Å; F877-Q942 HydrophobicContact CD1-CG 4.47Å; F877-Q942 HydrophobicContact CD2-CG 4.5Å; F877-Q942 HydrophobicContact CE1-CB 4.49Å; F877-Q942 HydrophobicContact CE1-CG 3.89Å; F877-Q942 HydrophobicContact CE2-CB 4.03Å; F877-Q942 HydrophobicContact CE2-CG 3.92Å; F877-Q942 VanDerWaalsContact CE2-NE2 3.28Å; F877-Q942 HydrophobicContact CZ-CB 3.74Å; F877-Q942 HydrophobicContact CZ-CG 3.57Å; F877-L943 HydrophobicContact CE1-CD2 3.75Å; F877-L943 HydrophobicContact CE1-CG 4.47Å; F877-L943 HydrophobicContact CZ-CD2 3.54Å; F877-L943 HydrophobicContact CZ-CG 3.87Å
878	K	96.5	Very high	95.2	Very high	135 Å²	135	59 Å²	59	59%	0.587	29%	0.29	S	S	*	.	H	α-helix	trans	-67.3	-39.8	175.5	-176.9	-171.8	175.1	-165.5	0	111.1	E874 E875 H876 E881 L882	E874-K878 WeakPolarHBondContact O-CB 3.47Å; E874-K878 PolarHBondContact O-N 2.85Å; E875-K878 WeakPolarHBondContact O-CB 3.13Å; E875-K878 PolarHBondContact O-N 3.09Å; E875-K878 VanDerWaalsContact O-N 3.08Å; H876-K878 PolarHBondContact O-N 3.36Å; K878-E881 PolarHBondContact O-N 2.93Å; K878-L882 HydrophobicContact CG-CD1 4.29Å; K878-L882 WeakPolarHBondContact O-CG 3.43Å; K878-L882 PolarHBondContact O-N 2.92Å
879	N	95.4	Very high	94.7	Very high	34 Å²	34	60.2 Å²	60.2	18%	0.182	30%	0.297	C	S	.	.	H	α-helix	trans	-64.3	-40.4	178.2	-69.6	-6	0	0	0	111.3	E875 H876 E881 L882 R883 D907	E875-N879 WeakPolarHBondContact O-CB 3.47Å; E875-N879 VanDerWaalsContact O-CG 3.25Å; E875-N879 PolarHBondContact O-N 3.36Å; E875-N879 PolarHBondContact O-OD1 3.12Å; H876-N879 PolarHBondContact O-N 3.22Å; N879-E881 VanDerWaalsContact C-N 3.33Å; N879-E881 PolarHBondContact O-N 3.15Å; N879-L882 PolarHBondContact O-N 2.93Å; N879-R883 WeakPolarHBondContact O-CG 3.49Å; N879-R883 PolarHBondContact O-N 3.04Å; N879-D907 WeakPolarHBondContact CB-OD2 3.27Å; N879-D907 PolarHBondContact ND2-OD1 3.11Å; N879-D907 PolarHBondContact ND2-OD2 2.92Å
880	Q	93.9	Very high	94.2	Very high	11 Å²	11	66.4 Å²	66.4	5%	0.051	33%	0.326	C	S	.	.	H	α-helix	trans	-55.3	-44	170.5	-69.5	179.4	0.9	0	0	112.7	H876 Q884 D952	H876-Q880 PolarHBondContact NE2-NE2 3.43Å; H876-Q880 VanDerWaalsContact NE2-NE2 3.16Å; H876-Q880 PolarHBondContact O-N 2.93Å; H876-Q880 VanDerWaalsContact O-N 3.17Å; Q880-Q884 WeakPolarHBondContact O-CG 3.46Å; Q880-Q884 PolarHBondContact O-N 2.68Å; Q880-Q884 VanDerWaalsContact O-N 3.1Å; Q880-D952 VanDerWaalsContact NE2-CG 3.32Å; Q880-D952 PolarHBondContact NE2-OD1 2.98Å; Q880-D952 VanDerWaalsContact NE2-OD1 3.08Å; Q880-D952 PolarHBondContact NE2-OD2 2.98Å
881	E	94.1	Very high	93.5	Very high	132 Å²	132	63.9 Å²	63.9	62%	0.617	32%	0.315	S	S	*	.	H	α-helix	trans	-66.7	-40.6	177	-67.8	-178.7	-176.9	0	0	111.9	F877 K878 N879 Q884 A885	F877-E881 PolarHBondContact O-N 2.98Å; K878-E881 PolarHBondContact O-N 2.93Å; N879-E881 VanDerWaalsContact C-N 3.33Å; N879-E881 PolarHBondContact O-N 3.15Å; E881-Q884 PolarHBondContact O-N 2.91Å; E881-A885 PolarHBondContact O-N 3.43Å
882	L	92.3	Very high	93	Very high	83 Å²	83	66.8 Å²	66.8	44%	0.435	32%	0.317	S	S	.	.	H	α-helix	trans	-63.4	-43.9	175.6	-70	171.8	0	0	0	111.9	K878 N879 Q884 A885 K886	K878-L882 HydrophobicContact CG-CD1 4.29Å; K878-L882 WeakPolarHBondContact O-CG 3.43Å; K878-L882 PolarHBondContact O-N 2.92Å; N879-L882 PolarHBondContact O-N 2.93Å; L882-Q884 VanDerWaalsContact C-N 3.33Å; L882-Q884 PolarHBondContact O-N 2.96Å; L882-A885 WeakPolarHBondContact O-CB 3.28Å; L882-A885 PolarHBondContact O-N 3.48Å; L882-A885 VanDerWaalsContact O-N 3.13Å; L882-K886 WeakPolarHBondContact O-CG 3.4Å; L882-K886 PolarHBondContact O-N 3.29Å
883	R	94	Very high	92.3	Very high	3 Å²	3	67 Å²	67	1%	0.011	32%	0.32	C	S	.	.	H	α-helix	trans	-60.1	-41.5	174	-71	-166.1	-80.4	-73.4	1.7	111.6	N879 A885 K886 R887 L900 E903 D904 D907	N879-R883 WeakPolarHBondContact O-CG 3.49Å; N879-R883 PolarHBondContact O-N 3.04Å; R883-A885 VanDerWaalsContact C-N 3.3Å; R883-A885 PolarHBondContact O-N 3.4Å; R883-K886 PolarHBondContact O-N 3.41Å; R883-R887 WeakPolarHBondContact O-CG 3.44Å; R883-R887 PolarHBondContact O-N 3.32Å; R883-R887 VanDerWaalsContact O-N 3.08Å; R883-L900 HydrophobicContact CB-CD2 4.28Å; R883-L900 WeakPolarHBondContact CD-O 3.49Å; R883-L900 HydrophobicContact CG-CD2 3.95Å; R883-E903 PolarHBondContact NH1-O 2.98Å; R883-D904 IonicContact CZ-OD1 3.51Å; R883-D904 IonicContact NE-OD1 3.68Å; R883-D904 PolarHBondContact NE-OD1 3.44Å; R883-D904 IonicContact NH2-OD1 3.96Å; R883-D904 PolarHBondContact NH2-OD1 3.48Å; R883-D907 IonicContact CZ-OD2 2.73Å; R883-D907 IonicContact NH1-OD2 3.56Å; R883-D907 PolarHBondContact NH1-OD2 3.29Å; R883-D907 IonicContact NH2-OD2 3.3Å; R883-D907 PolarHBondContact NH2-OD2 2.76Å
884	Q	92	Very high	91.6	Very high	120 Å²	120	72.4 Å²	72.4	56%	0.561	35%	0.345	S	S	*	.	H	α-helix	trans	-64.9	-31.2	174.8	-72.6	-177.6	26.2	0	0	113.5	Q880 E881 L882 Q888	Q880-Q884 WeakPolarHBondContact O-CG 3.46Å; Q880-Q884 PolarHBondContact O-N 2.68Å; Q880-Q884 VanDerWaalsContact O-N 3.1Å; E881-Q884 PolarHBondContact O-N 2.91Å; L882-Q884 VanDerWaalsContact C-N 3.33Å; L882-Q884 PolarHBondContact O-N 2.96Å; Q884-Q888 PolarHBondContact O-NE2 3.36Å
885	A	90.8	Very high	90.8	Very high	58 Å²	58	69.9 Å²	69.9	48%	0.479	33%	0.333	S	S	.	.	H	α-helix	trans	-74.3	-40.9	173.1	0	0	0	0	0	112.2	E881 L882 R883 R887 Q888	E881-A885 PolarHBondContact O-N 3.43Å; L882-A885 WeakPolarHBondContact O-CB 3.28Å; L882-A885 PolarHBondContact O-N 3.48Å; L882-A885 VanDerWaalsContact O-N 3.13Å; R883-A885 VanDerWaalsContact C-N 3.3Å; R883-A885 PolarHBondContact O-N 3.4Å; A885-R887 VanDerWaalsContact C-N 3.3Å; A885-R887 PolarHBondContact O-N 2.84Å; A885-Q888 WeakPolarHBondContact O-CB 3.47Å; A885-Q888 PolarHBondContact O-N 3.03Å
886	K	88.9	Confident	90.3	Very high	89 Å²	89	68.6 Å²	68.6	39%	0.387	33%	0.329	S	S	.	.	H	α-helix	trans	-58.1	-40.3	174.5	-71.9	178	-177.5	174.4	0	111.6	L882 R883 Q888 D889 L900 E903	L882-K886 WeakPolarHBondContact O-CG 3.4Å; L882-K886 PolarHBondContact O-N 3.29Å; R883-K886 PolarHBondContact O-N 3.41Å; K886-Q888 PolarHBondContact O-N 3.09Å; K886-D889 WeakPolarHBondContact O-CB 3.48Å; K886-D889 PolarHBondContact O-N 2.83Å; K886-L900 HydrophobicContact CB-CD1 4.13Å; K886-L900 HydrophobicContact CB-CD2 3.91Å; K886-L900 HydrophobicContact CD-CD2 3.35Å; K886-L900 HydrophobicContact CG-CD2 4.29Å; K886-E903 IonicContact NZ-OE1 3.21Å; K886-E903 PolarHBondContact NZ-OE1 3.15Å; K886-E903 IonicContact NZ-OE2 3.65Å; K886-E903 PolarHBondContact NZ-OE2 2.94Å
887	R	90.6	Very high	90	Very high	73 Å²	73	70.6 Å²	70.6	28%	0.275	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-8.5	172.9	-69.6	176.5	174.6	108.9	-3.3	115.2	R883 A885 Y892 E897 L900	R883-R887 WeakPolarHBondContact O-CG 3.44Å; R883-R887 PolarHBondContact O-N 3.32Å; R883-R887 VanDerWaalsContact O-N 3.08Å; A885-R887 VanDerWaalsContact C-N 3.3Å; A885-R887 PolarHBondContact O-N 2.84Å; R887-Y892 HydrophobicContact CB-CD2 4.37Å; R887-Y892 HydrophobicContact CB-CE2 4.24Å; R887-Y892 HydrophobicContact CG-CD2 4.26Å; R887-Y892 HydrophobicContact CG-CE2 3.77Å; R887-E897 IonicContact CZ-OE1 3.77Å; R887-E897 VanDerWaalsContact CZ-OE1 3.3Å; R887-E897 IonicContact CZ-OE2 3.38Å; R887-E897 VanDerWaalsContact NE-CD 3.31Å; R887-E897 IonicContact NE-OE1 2.75Å; R887-E897 PolarHBondContact NE-OE1 3.44Å; R887-E897 IonicContact NE-OE2 2.81Å; R887-E897 PolarHBondContact NE-OE2 3.48Å; R887-E897 IonicContact NH2-OE1 3.12Å; R887-E897 PolarHBondContact NH2-OE1 3.15Å; R887-E897 IonicContact NH2-OE2 3.76Å; R887-E897 PolarHBondContact NH2-OE2 3.02Å; R887-L900 HydrophobicContact CG-CD1 3.58Å
888	Q	91.7	Very high	89.4	Confident	161 Å²	161	74.7 Å²	74.7	75%	0.752	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	0.5	177.2	-62.5	172	48.1	0	0	113.1	Q884 A885 K886	Q884-Q888 PolarHBondContact O-NE2 3.36Å; A885-Q888 WeakPolarHBondContact O-CB 3.47Å; A885-Q888 PolarHBondContact O-N 3.03Å; K886-Q888 PolarHBondContact O-N 3.09Å
889	D	88.4	Confident	89	Confident	53 Å²	53	72 Å²	72	28%	0.283	35%	0.353	S	S	.	.	S	Bend	trans	-68.9	152.7	174.5	-162.1	-61.1	0	0	0	110.9	K321 R324 K886 D891 Y892	K321-D889 IonicContact NZ-OD2 3.52Å; K321-D889 PolarHBondContact NZ-OD2 2.85Å; R324-D889 IonicContact NH2-OD1 2.71Å; R324-D889 PolarHBondContact NH2-OD1 3.27Å; K886-D889 WeakPolarHBondContact O-CB 3.48Å; K886-D889 PolarHBondContact O-N 2.83Å; D889-D891 PolarHBondContact O-N 3.24Å; D889-D891 PolarHBondContact OD1-N 3.15Å; D889-D891 VanDerWaalsContact OD1-N 3.12Å; D889-Y892 WeakPolarHBondContact O-CB 3.28Å; D889-Y892 PolarHBondContact O-N 2.89Å
890	E	87.1	Confident	88.8	Confident	131 Å²	131	70.5 Å²	70.5	61%	0.612	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-12.2	179.7	64.9	-175.2	-165.4	0	0	113.5	R324 K368	R324-E890 WeakPolarHBondContact CD-OE1 3.43Å; R324-E890 IonicContact CZ-OE1 3.83Å; R324-E890 IonicContact NE-OE1 3.48Å; R324-E890 IonicContact NH1-OE1 3.33Å; R324-E890 PolarHBondContact NH1-OE1 3.08Å; K368-E890 PolarHBondContact NZ-O 3.4Å
891	D	83.6	Confident	88.6	Confident	16 Å²	16	73.4 Å²	73.4	9%	0.086	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	9.3	172.7	-62.4	-28.5	0	0	0	114	R324 A364 M365 K368 D889 D893	R324-D891 IonicContact CZ-OD2 3.81Å; R324-D891 IonicContact NE-OD2 2.74Å; R324-D891 PolarHBondContact NE-OD2 3.32Å; R324-D891 IonicContact NH2-OD2 2.61Å; R324-D891 PolarHBondContact NH2-OD2 2.95Å; A364-D891 HydrophobicContact CB-CB 4.06Å; A364-D891 WeakPolarHBondContact CB-O 3.5Å; M365-D891 WeakPolarHBondContact CG-OD2 3.46Å; K368-D891 IonicContact NZ-OD1 3.14Å; K368-D891 PolarHBondContact NZ-OD1 3.16Å; D889-D891 PolarHBondContact O-N 3.24Å; D889-D891 PolarHBondContact OD1-N 3.15Å; D889-D891 VanDerWaalsContact OD1-N 3.12Å; D891-D893 PolarHBondContact O-N 2.92Å
892	Y	87.1	Confident	88.4	Confident	95 Å²	95	71.3 Å²	71.3	37%	0.373	35%	0.351	S	S	.	.			trans	-63.3	126.6	175.2	174.6	-104.5	0	0	0	112	R887 D889 V896 E897 L900	R887-Y892 HydrophobicContact CB-CD2 4.37Å; R887-Y892 HydrophobicContact CB-CE2 4.24Å; R887-Y892 HydrophobicContact CG-CD2 4.26Å; R887-Y892 HydrophobicContact CG-CE2 3.77Å; D889-Y892 WeakPolarHBondContact O-CB 3.28Å; D889-Y892 PolarHBondContact O-N 2.89Å; Y892-V896 HydrophobicContact CD2-CB 4.3Å; Y892-V896 HydrophobicContact CD2-CG1 3.97Å; Y892-E897 HydrophobicContact CE2-CB 3.91Å; Y892-E897 VanDerWaalsContact CE2-OE2 3.28Å; Y892-E897 WeakPolarHBondContact CE2-OE2 3.43Å; Y892-E897 PolarHBondContact OH-OE2 3.3Å; Y892-L900 HydrophobicContact CE2-CD1 4.34Å
893	D	84.3	Confident	88.4	Confident	37 Å²	37	70.4 Å²	70.4	20%	0.198	35%	0.345	C	S	.	.			trans	-143.5	-177.1	175.3	67.7	25.5	0	0	0	112.1	A364 R367 D891 Q895 V896 E897	A364-D893 VanDerWaalsContact CB-OD2 3.28Å; A364-D893 WeakPolarHBondContact CB-OD2 3.35Å; R367-D893 IonicContact CZ-OD1 2.94Å; R367-D893 IonicContact CZ-OD2 3.29Å; R367-D893 VanDerWaalsContact CZ-OD2 3.29Å; R367-D893 IonicContact NE-OD1 3.3Å; R367-D893 IonicContact NE-OD2 3.09Å; R367-D893 PolarHBondContact NE-OD2 3.03Å; R367-D893 VanDerWaalsContact NH2-CG 3.33Å; R367-D893 IonicContact NH2-OD1 2.78Å; R367-D893 PolarHBondContact NH2-OD1 3.49Å; R367-D893 IonicContact NH2-OD2 2.72Å; R367-D893 PolarHBondContact NH2-OD2 2.91Å; D891-D893 PolarHBondContact O-N 2.92Å; D893-Q895 VanDerWaalsContact C-N 3.32Å; D893-Q895 PolarHBondContact O-N 3.44Å; D893-Q895 PolarHBondContact OD1-N 3.09Å; D893-V896 PolarHBondContact O-N 3.38Å; D893-V896 WeakPolarHBondContact OD1-CG2 3.3Å; D893-V896 PolarHBondContact OD1-N 2.94Å; D893-E897 PolarHBondContact O-N 3.34Å
894	E	82.6	Confident	88.5	Confident	113 Å²	113	71.7 Å²	71.7	53%	0.528	35%	0.352	S	S	.	.	H	α-helix	trans	-60.2	-38.8	-176.1	-173.2	-171.4	-162	0	0	112.5	K425 E897 E898	K425-E894 IonicContact NZ-OE1 3.44Å; K425-E894 PolarHBondContact NZ-OE1 2.91Å; K425-E894 IonicContact NZ-OE2 3.67Å; K425-E894 PolarHBondContact NZ-OE2 3.27Å; E894-E897 WeakPolarHBondContact O-CB 3.4Å; E894-E897 PolarHBondContact O-N 3.45Å; E894-E898 WeakPolarHBondContact O-CG 3.48Å; E894-E898 PolarHBondContact O-N 3.05Å
895	Q	81.2	Confident	88.6	Confident	40 Å²	40	71.3 Å²	71.3	19%	0.187	35%	0.35	C	S	.	.	H	α-helix	trans	-76.5	-32.1	-179.6	-73	61.2	66	0	0	111.5	D893 E897 E898 T899	D893-Q895 VanDerWaalsContact C-N 3.32Å; D893-Q895 PolarHBondContact O-N 3.44Å; D893-Q895 PolarHBondContact OD1-N 3.09Å; Q895-E897 VanDerWaalsContact C-N 3.29Å; Q895-E898 WeakPolarHBondContact CA-OE2 3.41Å; Q895-E898 WeakPolarHBondContact O-CB 3.45Å; Q895-E898 PolarHBondContact O-N 3.17Å; Q895-T899 PolarHBondContact O-N 3.38Å; Q895-T899 VanDerWaalsContact O-N 3.13Å; Q895-T899 PolarHBondContact O-OG1 3.38Å
896	V	87	Confident	88.6	Confident	37 Å²	37	71.6 Å²	71.6	22%	0.224	34%	0.344	C	S	.	.	H	α-helix	trans	-62.9	-39.7	168.5	175	0	0	0	0	110.3	A364 Y892 D893 E898 T899 L900	A364-V896 HydrophobicContact CB-CG2 3.91Å; Y892-V896 HydrophobicContact CD2-CB 4.3Å; Y892-V896 HydrophobicContact CD2-CG1 3.97Å; D893-V896 PolarHBondContact O-N 3.38Å; D893-V896 WeakPolarHBondContact OD1-CG2 3.3Å; D893-V896 PolarHBondContact OD1-N 2.94Å; V896-E898 VanDerWaalsContact C-N 3.35Å; V896-T899 PolarHBondContact O-N 3.05Å; V896-L900 HydrophobicContact CG1-CD1 4.07Å; V896-L900 HydrophobicContact CG1-CG 4.27Å; V896-L900 WeakPolarHBondContact O-CG 3.27Å; V896-L900 PolarHBondContact O-N 3.37Å
897	E	90.4	Very high	89	Confident	52 Å²	52	68.5 Å²	68.5	24%	0.243	33%	0.331	C	S	.	.	H	α-helix	trans	-64.6	-37.1	175.3	-171.9	61.6	-172.7	0	0	112.9	R887 Y892 D893 E894 Q895 L900 Q901	R887-E897 IonicContact CZ-OE1 3.77Å; R887-E897 VanDerWaalsContact CZ-OE1 3.3Å; R887-E897 IonicContact CZ-OE2 3.38Å; R887-E897 VanDerWaalsContact NE-CD 3.31Å; R887-E897 IonicContact NE-OE1 2.75Å; R887-E897 PolarHBondContact NE-OE1 3.44Å; R887-E897 IonicContact NE-OE2 2.81Å; R887-E897 PolarHBondContact NE-OE2 3.48Å; R887-E897 IonicContact NH2-OE1 3.12Å; R887-E897 PolarHBondContact NH2-OE1 3.15Å; R887-E897 IonicContact NH2-OE2 3.76Å; R887-E897 PolarHBondContact NH2-OE2 3.02Å; Y892-E897 HydrophobicContact CE2-CB 3.91Å; Y892-E897 VanDerWaalsContact CE2-OE2 3.28Å; Y892-E897 WeakPolarHBondContact CE2-OE2 3.43Å; Y892-E897 PolarHBondContact OH-OE2 3.3Å; D893-E897 PolarHBondContact O-N 3.34Å; E894-E897 WeakPolarHBondContact O-CB 3.4Å; E894-E897 PolarHBondContact O-N 3.45Å; Q895-E897 VanDerWaalsContact C-N 3.29Å; E897-L900 PolarHBondContact O-N 3.45Å; E897-Q901 WeakPolarHBondContact O-CB 3.18Å; E897-Q901 PolarHBondContact O-N 3.06Å
898	E	86.5	Confident	89.3	Confident	95 Å²	95	66.2 Å²	66.2	44%	0.444	33%	0.326	S	S	.	.	H	α-helix	trans	-56.5	-54.3	171.9	-69.8	159.4	-178.4	0	0	110.1	E894 Q895 V896 L900 Q901 D902	E894-E898 WeakPolarHBondContact O-CG 3.48Å; E894-E898 PolarHBondContact O-N 3.05Å; Q895-E898 WeakPolarHBondContact CA-OE2 3.41Å; Q895-E898 WeakPolarHBondContact O-CB 3.45Å; Q895-E898 PolarHBondContact O-N 3.17Å; V896-E898 VanDerWaalsContact C-N 3.35Å; E898-L900 VanDerWaalsContact C-N 3.31Å; E898-L900 PolarHBondContact O-N 3.19Å; E898-Q901 WeakPolarHBondContact O-CA 3.26Å; E898-Q901 WeakPolarHBondContact O-CB 3.33Å; E898-Q901 PolarHBondContact O-N 3.33Å; E898-D902 PolarHBondContact O-N 3.33Å
899	T	86.4	Confident	89.5	Confident	78 Å²	78	62.7 Å²	62.7	48%	0.479	31%	0.306	S	S	.	.	H	α-helix	trans	-60.8	-35.2	176.4	-48.5	0	0	0	0	113.7	Q895 V896 Q901 D902 E903	Q895-T899 PolarHBondContact O-N 3.38Å; Q895-T899 VanDerWaalsContact O-N 3.13Å; Q895-T899 PolarHBondContact O-OG1 3.38Å; V896-T899 PolarHBondContact O-N 3.05Å; T899-Q901 VanDerWaalsContact C-N 3.26Å; T899-Q901 PolarHBondContact O-N 2.97Å; T899-D902 PolarHBondContact O-N 3.41Å; T899-E903 WeakPolarHBondContact O-CG 3.39Å; T899-E903 PolarHBondContact O-N 3.28Å
900	L	91.1	Very high	89.9	Confident	3 Å²	3	61 Å²	61	2%	0.016	30%	0.298	C	S	.	.	H	α-helix	trans	-70.9	-23.1	175.7	-67.2	177.5	0	0	0	113	R883 K886 R887 Y892 V896 E897 E898 D904	R883-L900 HydrophobicContact CB-CD2 4.28Å; R883-L900 WeakPolarHBondContact CD-O 3.49Å; R883-L900 HydrophobicContact CG-CD2 3.95Å; K886-L900 HydrophobicContact CB-CD1 4.13Å; K886-L900 HydrophobicContact CB-CD2 3.91Å; K886-L900 HydrophobicContact CD-CD2 3.35Å; K886-L900 HydrophobicContact CG-CD2 4.29Å; R887-L900 HydrophobicContact CG-CD1 3.58Å; Y892-L900 HydrophobicContact CE2-CD1 4.34Å; V896-L900 HydrophobicContact CG1-CD1 4.07Å; V896-L900 HydrophobicContact CG1-CG 4.27Å; V896-L900 WeakPolarHBondContact O-CG 3.27Å; V896-L900 PolarHBondContact O-N 3.37Å; E897-L900 PolarHBondContact O-N 3.45Å; E898-L900 VanDerWaalsContact C-N 3.31Å; E898-L900 PolarHBondContact O-N 3.19Å; L900-D904 PolarHBondContact O-N 2.72Å
901	Q	91.6	Very high	90.4	Very high	72 Å²	72	55 Å²	55	34%	0.336	27%	0.27	S	S	.	.	H	α-helix	trans	-78.8	-41.6	173.7	-174.6	56.1	38.7	0	0	110	E897 E898 T899 E903 D904 E905	E897-Q901 WeakPolarHBondContact O-CB 3.18Å; E897-Q901 PolarHBondContact O-N 3.06Å; E898-Q901 WeakPolarHBondContact O-CA 3.26Å; E898-Q901 WeakPolarHBondContact O-CB 3.33Å; E898-Q901 PolarHBondContact O-N 3.33Å; T899-Q901 VanDerWaalsContact C-N 3.26Å; T899-Q901 PolarHBondContact O-N 2.97Å; Q901-E903 VanDerWaalsContact C-N 3.34Å; Q901-E903 PolarHBondContact O-N 3.47Å; Q901-D904 CarbonylContact O-C 3.55Å; Q901-D904 WeakPolarHBondContact O-CA 3.38Å; Q901-D904 WeakPolarHBondContact O-CB 3.43Å; Q901-D904 PolarHBondContact O-N 3.13Å; Q901-E905 WeakPolarHBondContact CG-OE1 3.45Å; Q901-E905 PolarHBondContact NE2-OE1 3.1Å; Q901-E905 WeakPolarHBondContact O-CG 3.42Å; Q901-E905 PolarHBondContact O-N 2.91Å
902	D	89.6	Confident	91.1	Very high	88 Å²	88	55 Å²	55	47%	0.471	27%	0.271	S	S	.	.	H	α-helix	trans	-59.9	-42.3	172.1	-53.6	-31.9	0	0	0	111.6	E898 T899 D904 E905 N906	E898-D902 PolarHBondContact O-N 3.33Å; T899-D902 PolarHBondContact O-N 3.41Å; D902-D904 VanDerWaalsContact C-N 3.27Å; D902-D904 PolarHBondContact O-N 3.2Å; D902-E905 PolarHBondContact O-N 2.96Å; D902-N906 WeakPolarHBondContact O-CB 3.15Å; D902-N906 PolarHBondContact O-N 3.45Å; D902-N906 PolarHBondContact O-ND2 2.95Å
903	E	91.9	Very high	91.7	Very high	64 Å²	64	51.3 Å²	51.3	30%	0.299	26%	0.256	S	S	.	.	H	α-helix	trans	-59.6	-33.7	171.4	-79.3	-179.8	-162.3	0	0	112.9	R883 K886 T899 Q901 D907	R883-E903 PolarHBondContact NH1-O 2.98Å; K886-E903 IonicContact NZ-OE1 3.21Å; K886-E903 PolarHBondContact NZ-OE1 3.15Å; K886-E903 IonicContact NZ-OE2 3.65Å; K886-E903 PolarHBondContact NZ-OE2 2.94Å; T899-E903 WeakPolarHBondContact O-CG 3.39Å; T899-E903 PolarHBondContact O-N 3.28Å; Q901-E903 VanDerWaalsContact C-N 3.34Å; Q901-E903 PolarHBondContact O-N 3.47Å; E903-D907 PolarHBondContact O-N 3.32Å
904	D	94.8	Very high	92.3	Very high	31 Å²	31	49.7 Å²	49.7	17%	0.166	25%	0.248	C	C	.	.	H	α-helix	trans	-77.3	-39.7	178.6	-155.8	68.6	0	0	0	111.4	R883 L900 Q901 D902 D907 V908	R883-D904 IonicContact CZ-OD1 3.51Å; R883-D904 IonicContact NE-OD1 3.68Å; R883-D904 PolarHBondContact NE-OD1 3.44Å; R883-D904 IonicContact NH2-OD1 3.96Å; R883-D904 PolarHBondContact NH2-OD1 3.48Å; L900-D904 PolarHBondContact O-N 2.72Å; Q901-D904 CarbonylContact O-C 3.55Å; Q901-D904 WeakPolarHBondContact O-CA 3.38Å; Q901-D904 WeakPolarHBondContact O-CB 3.43Å; Q901-D904 PolarHBondContact O-N 3.13Å; D902-D904 VanDerWaalsContact C-N 3.27Å; D902-D904 PolarHBondContact O-N 3.2Å; D904-D907 PolarHBondContact O-N 2.9Å; D904-V908 WeakPolarHBondContact O-CB 3.24Å; D904-V908 VanDerWaalsContact O-CG2 3.26Å; D904-V908 WeakPolarHBondContact O-CG2 3.31Å; D904-V908 PolarHBondContact O-N 3.15Å
905	E	94.3	Very high	93.1	Very high	111 Å²	111	44.6 Å²	44.6	52%	0.519	23%	0.225	S	C	.	.	H	α-helix	trans	-66.1	-39.2	177.7	-72.8	178.4	-158.3	0	0	111.5	Q901 D902 V908 Y909	Q901-E905 WeakPolarHBondContact CG-OE1 3.45Å; Q901-E905 PolarHBondContact NE2-OE1 3.1Å; Q901-E905 WeakPolarHBondContact O-CG 3.42Å; Q901-E905 PolarHBondContact O-N 2.91Å; D902-E905 PolarHBondContact O-N 2.96Å; E905-V908 PolarHBondContact O-N 3.44Å; E905-Y909 WeakPolarHBondContact O-CB 3.37Å; E905-Y909 PolarHBondContact O-N 3.22Å
906	N	92.4	Very high	93.9	Very high	65 Å²	65	44.9 Å²	44.9	35%	0.348	23%	0.228	S	C	.	.	H	α-helix	trans	-65.9	-45.1	173.1	-73.9	-24.3	0	0	0	112.9	D902 V908 Y909 V910	D902-N906 WeakPolarHBondContact O-CB 3.15Å; D902-N906 PolarHBondContact O-N 3.45Å; D902-N906 PolarHBondContact O-ND2 2.95Å; N906-V908 VanDerWaalsContact C-N 3.33Å; N906-V908 PolarHBondContact O-N 3.39Å; N906-Y909 PolarHBondContact O-N 2.98Å; N906-V910 WeakPolarHBondContact O-CG2 3.43Å; N906-V910 PolarHBondContact O-N 3.45Å
907	D	95.5	Very high	94.5	Very high	23 Å²	23	43.1 Å²	43.1	12%	0.123	22%	0.217	C	C	.	.	H	α-helix	trans	-58.9	-44.3	173.5	-89.9	-12	0	0	0	111.1	N879 R883 E903 D904 Y909 V910 L911	N879-D907 WeakPolarHBondContact CB-OD2 3.27Å; N879-D907 PolarHBondContact ND2-OD1 3.11Å; N879-D907 PolarHBondContact ND2-OD2 2.92Å; R883-D907 IonicContact CZ-OD2 2.73Å; R883-D907 IonicContact NH1-OD2 3.56Å; R883-D907 PolarHBondContact NH1-OD2 3.29Å; R883-D907 IonicContact NH2-OD2 3.3Å; R883-D907 PolarHBondContact NH2-OD2 2.76Å; E903-D907 PolarHBondContact O-N 3.32Å; D904-D907 PolarHBondContact O-N 2.9Å; D907-Y909 VanDerWaalsContact C-N 3.34Å; D907-V910 PolarHBondContact O-N 3.34Å; D907-L911 PolarHBondContact O-N 2.89Å
908	V	96.9	Very high	94.9	Very high	26 Å²	26	40.7 Å²	40.7	16%	0.158	21%	0.205	C	C	.	.	H	α-helix	trans	-65	-37.3	176.4	168.4	0	0	0	0	111.4	D904 E905 N906 L911 T912 A951	D904-V908 WeakPolarHBondContact O-CB 3.24Å; D904-V908 VanDerWaalsContact O-CG2 3.26Å; D904-V908 WeakPolarHBondContact O-CG2 3.31Å; D904-V908 PolarHBondContact O-N 3.15Å; E905-V908 PolarHBondContact O-N 3.44Å; N906-V908 VanDerWaalsContact C-N 3.33Å; N906-V908 PolarHBondContact O-N 3.39Å; V908-L911 WeakPolarHBondContact O-CB 3.34Å; V908-L911 PolarHBondContact O-N 3.18Å; V908-T912 WeakPolarHBondContact O-CG2 3.27Å; V908-T912 PolarHBondContact O-N 3.4Å; V908-A951 HydrophobicContact CG1-CB 3.84Å; V908-A951 HydrophobicContact CG2-CB 3.74Å
909	Y	96.6	Very high	95.4	Very high	86 Å²	86	39.5 Å²	39.5	34%	0.337	20%	0.2	S	C	.	.	H	α-helix	trans	-65	-43.9	176.8	-167.7	-128.7	0	0	0	111.5	S839 E905 N906 D907 L911 T912 K913	S839-Y909 VanDerWaalsContact OG-CE1 3.27Å; S839-Y909 WeakPolarHBondContact OG-CE1 3.49Å; E905-Y909 WeakPolarHBondContact O-CB 3.37Å; E905-Y909 PolarHBondContact O-N 3.22Å; N906-Y909 PolarHBondContact O-N 2.98Å; D907-Y909 VanDerWaalsContact C-N 3.34Å; Y909-L911 VanDerWaalsContact C-N 3.29Å; Y909-L911 PolarHBondContact O-N 3.27Å; Y909-T912 HydrophobicContact CD2-CG2 4.43Å; Y909-T912 PolarHBondContact O-N 3.34Å; Y909-T912 VanDerWaalsContact O-N 3.14Å; Y909-T912 PolarHBondContact O-OG1 3Å; Y909-K913 PolarHBondContact O-N 3.26Å; Y909-K913 VanDerWaalsContact OH-CE 3.26Å; Y909-K913 WeakPolarHBondContact OH-CE 3.33Å; Y909-K913 PolarHBondContact OH-NZ 3Å
910	V	97.3	Very high	96	Very high	18 Å²	18	35.9 Å²	35.9	11%	0.109	18%	0.178	C	C	.	.	H	α-helix	trans	-60.5	-38.2	171.8	174.1	0	0	0	0	111.4	L838 M842 N906 D907 T912 K913 V914	L838-V910 HydrophobicContact CD2-CG1 4.22Å; L838-V910 HydrophobicContact CD2-CG2 4.24Å; M842-V910 HydrophobicContact SD-CG1 4.23Å; N906-V910 WeakPolarHBondContact O-CG2 3.43Å; N906-V910 PolarHBondContact O-N 3.45Å; D907-V910 PolarHBondContact O-N 3.34Å; V910-T912 VanDerWaalsContact C-N 3.33Å; V910-T912 PolarHBondContact O-N 3.04Å; V910-K913 PolarHBondContact O-N 3.42Å; V910-K913 VanDerWaalsContact O-N 3.07Å; V910-V914 PolarHBondContact O-N 3.25Å
911	L	98.1	Very high	96.4	Very high	5 Å²	5	35.7 Å²	35.7	3%	0.026	18%	0.177	C	C	.	.	H	α-helix	trans	-62.6	-35.5	175.1	-178.7	62.6	0	0	0	112.6	L873 D907 V908 Y909 K913 V914 S915 L943 W955	L873-L911 HydrophobicContact CD2-CD1 3.82Å; D907-L911 PolarHBondContact O-N 2.89Å; V908-L911 WeakPolarHBondContact O-CB 3.34Å; V908-L911 PolarHBondContact O-N 3.18Å; Y909-L911 VanDerWaalsContact C-N 3.29Å; Y909-L911 PolarHBondContact O-N 3.27Å; L911-K913 VanDerWaalsContact C-N 3.28Å; L911-K913 PolarHBondContact O-N 3.4Å; L911-V914 WeakPolarHBondContact O-CB 3.38Å; L911-V914 PolarHBondContact O-N 2.97Å; L911-S915 PolarHBondContact O-N 3.37Å; L911-S915 VanDerWaalsContact O-N 3.11Å; L911-L943 HydrophobicContact CD1-CD1 3.96Å; L911-L943 HydrophobicContact CD1-CD2 4.37Å; L911-L943 HydrophobicContact CD2-CD2 3.99Å; L911-W955 HydrophobicContact CD2-CB 3.86Å; L911-W955 HydrophobicContact CD2-CG 4.29Å; L911-W955 HydrophobicContact CG-CB 3.89Å; L911-W955 HydrophobicContact CG-CG 4.25Å
912	T	97.9	Very high	96.7	Very high	17 Å²	17	32.3 Å²	32.3	10%	0.104	16%	0.161	C	C	.	.	H	α-helix	trans	-64.1	-37.1	172.4	100.1	0	0	0	0	110.9	V908 Y909 V910 S915 D916 W955	V908-T912 WeakPolarHBondContact O-CG2 3.27Å; V908-T912 PolarHBondContact O-N 3.4Å; Y909-T912 HydrophobicContact CD2-CG2 4.43Å; Y909-T912 PolarHBondContact O-N 3.34Å; Y909-T912 VanDerWaalsContact O-N 3.14Å; Y909-T912 PolarHBondContact O-OG1 3Å; V910-T912 VanDerWaalsContact C-N 3.33Å; V910-T912 PolarHBondContact O-N 3.04Å; T912-S915 CarbonylContact O-C 3.59Å; T912-S915 WeakPolarHBondContact O-CA 3.49Å; T912-S915 WeakPolarHBondContact O-CB 3.44Å; T912-S915 PolarHBondContact O-N 2.91Å; T912-D916 PolarHBondContact O-N 3.43Å; T912-W955 HydrophobicContact CG2-CD2 4.14Å; T912-W955 VanDerWaalsContact CG2-CE2 3.41Å; T912-W955 HydrophobicContact CG2-CH2 3.9Å; T912-W955 HydrophobicContact CG2-CZ2 3.29Å
913	K	98.3	Very high	97.1	Very high	16 Å²	16	29.5 Å²	29.5	7%	0.07	15%	0.148	C	C	.	.	H	α-helix	trans	-72.7	-28.6	177.7	-52	-54	178	173.8	0	113	M842 H843 Y909 V910 L911 S915 D916 I917	M842-K913 HydrophobicContact CB-CB 3.71Å; M842-K913 HydrophobicContact CB-CG 4.48Å; M842-K913 HydrophobicContact CE-CB 3.87Å; M842-K913 HydrophobicContact CG-CB 4.48Å; M842-K913 HydrophobicContact SD-CB 4.02Å; H843-K913 HydrophobicContact CB-CD 4.32Å; Y909-K913 PolarHBondContact O-N 3.26Å; Y909-K913 VanDerWaalsContact OH-CE 3.26Å; Y909-K913 WeakPolarHBondContact OH-CE 3.33Å; Y909-K913 PolarHBondContact OH-NZ 3Å; V910-K913 PolarHBondContact O-N 3.42Å; V910-K913 VanDerWaalsContact O-N 3.07Å; L911-K913 VanDerWaalsContact C-N 3.28Å; L911-K913 PolarHBondContact O-N 3.4Å; K913-S915 VanDerWaalsContact C-N 3.27Å; K913-D916 WeakPolarHBondContact CD-OD2 3.2Å; K913-D916 PolarHBondContact O-N 2.84Å; K913-I917 WeakPolarHBondContact O-CG1 3.35Å; K913-I917 PolarHBondContact O-N 2.99Å
914	V	98.6	Very high	97.4	Very high	3 Å²	3	27.2 Å²	27.2	2%	0.018	14%	0.139	C	C	.	.	H	α-helix	trans	-59.7	-42.3	164.9	174.2	0	0	0	0	109.8	M842 L869 L873 V910 L911 L918	M842-V914 HydrophobicContact CE-CB 4.42Å; M842-V914 HydrophobicContact CE-CG2 3.71Å; L869-V914 HydrophobicContact CD2-CG1 4.37Å; L869-V914 HydrophobicContact CD2-CG2 4.31Å; L873-V914 HydrophobicContact CD2-CG1 4.44Å; V910-V914 PolarHBondContact O-N 3.25Å; L911-V914 WeakPolarHBondContact O-CB 3.38Å; L911-V914 PolarHBondContact O-N 2.97Å; V914-L918 HydrophobicContact CG1-CD1 3.95Å; V914-L918 WeakPolarHBondContact O-CB 3.47Å; V914-L918 VanDerWaalsContact O-CG 3.31Å; V914-L918 WeakPolarHBondContact O-CG 3.24Å; V914-L918 PolarHBondContact O-N 2.99Å
915	S	98.4	Very high	97.5	Very high	6 Å²	6	26.6 Å²	26.6	4%	0.042	14%	0.135	C	C	.	.	H	α-helix	trans	-63.2	-46.6	173.7	-153.6	0	0	0	0	112.2	L911 T912 K913 I917 L918 H919 I959	L911-S915 PolarHBondContact O-N 3.37Å; L911-S915 VanDerWaalsContact O-N 3.11Å; T912-S915 CarbonylContact O-C 3.59Å; T912-S915 WeakPolarHBondContact O-CA 3.49Å; T912-S915 WeakPolarHBondContact O-CB 3.44Å; T912-S915 PolarHBondContact O-N 2.91Å; K913-S915 VanDerWaalsContact C-N 3.27Å; S915-I917 VanDerWaalsContact C-N 3.33Å; S915-I917 PolarHBondContact O-N 2.84Å; S915-L918 PolarHBondContact O-N 2.64Å; S915-H919 WeakPolarHBondContact O-CB 3.46Å; S915-H919 PolarHBondContact O-N 2.95Å; S915-I959 WeakPolarHBondContact OG-CG1 3.31Å
916	D	98.4	Very high	97.7	Very high	47 Å²	47	27 Å²	27	25%	0.251	14%	0.135	S	C	.	.	H	α-helix	trans	-54.7	-46.7	177.2	-76.3	2.1	0	0	0	111.8	H843 A846 T912 K913 S920	H843-D916 IonicContact CE1-OD2 2.73Å; H843-D916 IonicContact ND1-OD2 2.77Å; H843-D916 PolarHBondContact ND1-OD2 3.29Å; A846-D916 HydrophobicContact CB-CB 4.06Å; T912-D916 PolarHBondContact O-N 3.43Å; K913-D916 WeakPolarHBondContact CD-OD2 3.2Å; K913-D916 PolarHBondContact O-N 2.84Å; D916-S920 PolarHBondContact O-N 3.02Å
917	I	98.8	Very high	98	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-63.2	-49.4	178	-67.3	177.8	0	0	0	110.2	I829 M842 F845 A846 L865 L869 K913 S915 H919 S920 V921	I829-I917 HydrophobicContact CD1-CD1 3.9Å; M842-I917 HydrophobicContact CB-CD1 3.81Å; M842-I917 HydrophobicContact CB-CG1 4.46Å; M842-I917 HydrophobicContact CE-CD1 3.78Å; M842-I917 HydrophobicContact CG-CD1 3.92Å; F845-I917 HydrophobicContact CD1-CD1 4.05Å; F845-I917 HydrophobicContact CD1-CG1 4.07Å; F845-I917 HydrophobicContact CD1-CG2 4.08Å; F845-I917 HydrophobicContact CE1-CG2 3.97Å; A846-I917 HydrophobicContact CB-CG1 4.09Å; L865-I917 HydrophobicContact CD1-CG2 4.39Å; L865-I917 HydrophobicContact CD2-CG2 4.28Å; L869-I917 HydrophobicContact CD1-CG2 4.12Å; L869-I917 HydrophobicContact CD2-CD1 4.28Å; K913-I917 WeakPolarHBondContact O-CG1 3.35Å; K913-I917 PolarHBondContact O-N 2.99Å; S915-I917 VanDerWaalsContact C-N 3.33Å; S915-I917 PolarHBondContact O-N 2.84Å; I917-H919 PolarHBondContact O-N 3.35Å; I917-S920 PolarHBondContact O-N 2.84Å; I917-S920 PolarHBondContact O-OG 3.49Å; I917-V921 WeakPolarHBondContact O-CG2 3.39Å; I917-V921 PolarHBondContact O-N 3.09Å
918	L	98.8	Very high	98.1	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-61.4	-43.9	179.9	-73.3	173.4	0	0	0	111.8	L869 V914 S915 S920 V921 F922 W932 F933 L936 I959	L869-L918 HydrophobicContact CD1-CD2 4.17Å; L869-L918 HydrophobicContact CD1-CG 4.48Å; V914-L918 HydrophobicContact CG1-CD1 3.95Å; V914-L918 WeakPolarHBondContact O-CB 3.47Å; V914-L918 VanDerWaalsContact O-CG 3.31Å; V914-L918 WeakPolarHBondContact O-CG 3.24Å; V914-L918 PolarHBondContact O-N 2.99Å; S915-L918 PolarHBondContact O-N 2.64Å; L918-S920 PolarHBondContact O-N 2.77Å; L918-V921 PolarHBondContact O-N 3.17Å; L918-F922 HydrophobicContact CB-CD2 4.2Å; L918-F922 HydrophobicContact CB-CE2 3.81Å; L918-F922 HydrophobicContact CB-CZ 4.5Å; L918-F922 HydrophobicContact CD2-CZ 4.38Å; L918-F922 WeakPolarHBondContact O-CB 3.46Å; L918-F922 WeakPolarHBondContact O-CD2 3.47Å; L918-F922 VanDerWaalsContact O-CG 3.22Å; L918-F922 WeakPolarHBondContact O-CG 3.47Å; L918-F922 PolarHBondContact O-N 3.19Å; L918-W932 HydrophobicContact CD2-CH2 3.91Å; L918-W932 HydrophobicContact CD2-CZ3 3.87Å; L918-F933 HydrophobicContact CD1-CE2 4.44Å; L918-F933 HydrophobicContact CD2-CD2 4.34Å; L918-L936 HydrophobicContact CD2-CD1 3.96Å; L918-I959 HydrophobicContact CD1-CD1 3.88Å; L918-I959 HydrophobicContact CD1-CG1 4.13Å; L918-I959 HydrophobicContact CD1-CG2 3.86Å
919	H	98.6	Very high	98.1	Very high	70 Å²	70	32 Å²	32	32%	0.324	15%	0.152	S	C	.	.	H	α-helix	trans	-52.7	-53.4	172.7	175.1	80.9	0	0	0	111.5	S915 I917 V921 F922 S923 D962 H966	S915-H919 WeakPolarHBondContact O-CB 3.46Å; S915-H919 PolarHBondContact O-N 2.95Å; I917-H919 PolarHBondContact O-N 3.35Å; H919-V921 VanDerWaalsContact C-N 3.27Å; H919-V921 PolarHBondContact O-N 3.45Å; H919-F922 PolarHBondContact O-N 3.2Å; H919-S923 WeakPolarHBondContact O-CB 3.36Å; H919-S923 PolarHBondContact O-N 2.97Å; H919-S923 PolarHBondContact O-OG 3.31Å; H919-S923 VanDerWaalsContact O-OG 3.08Å; H919-D962 WeakPolarHBondContact CB-OD2 3.23Å; H919-D962 IonicContact CE1-OD1 3.01Å; H919-D962 IonicContact CG-OD1 2.8Å; H919-D962 IonicContact CG-OD2 3.9Å; H919-D962 IonicContact ND1-OD1 3.19Å; H919-D962 PolarHBondContact ND1-OD1 3Å; H919-D962 IonicContact ND1-OD2 2.7Å; H919-H966 AromaticContact CE1-NE2 3.3Å; H919-H966 PolarHBondContact CE1-NE2 2.99Å; H919-H966 VanDerWaalsContact CE1-NE2 3.3Å; H919-H966 AromaticContact ND1-NE2 3.68Å
920	S	98.4	Very high	98.2	Very high	2 Å²	2	28 Å²	28	1%	0.014	14%	0.137	C	C	.	.	H	α-helix	trans	-60.6	-35.8	-179.5	73.8	0	0	0	0	113.1	A846 D916 I917 L918 S923 S924	A846-S920 VanDerWaalsContact O-CB 3.24Å; A846-S920 WeakPolarHBondContact O-CB 3.22Å; D916-S920 PolarHBondContact O-N 3.02Å; I917-S920 PolarHBondContact O-N 2.84Å; I917-S920 PolarHBondContact O-OG 3.49Å; L918-S920 PolarHBondContact O-N 2.77Å; S920-S923 PolarHBondContact O-OG 3.08Å; S920-S924 WeakPolarHBondContact O-CB 3.17Å; S920-S924 PolarHBondContact O-N 2.86Å; S920-S924 PolarHBondContact O-OG 3.17Å
921	V	98.6	Very high	98.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-72.3	-43.6	176.9	169.3	0	0	0	0	110.9	V849 L857 F862 I917 L918 H919 Y925 V929 W932	V849-V921 HydrophobicContact CG1-CG2 4.21Å; L857-V921 HydrophobicContact CD1-CG2 4.35Å; F862-V921 HydrophobicContact CE1-CG1 4Å; I917-V921 WeakPolarHBondContact O-CG2 3.39Å; I917-V921 PolarHBondContact O-N 3.09Å; L918-V921 PolarHBondContact O-N 3.17Å; H919-V921 VanDerWaalsContact C-N 3.27Å; H919-V921 PolarHBondContact O-N 3.45Å; V921-Y925 WeakPolarHBondContact O-CB 3.2Å; V921-Y925 PolarHBondContact O-N 2.69Å; V921-V929 HydrophobicContact CG1-CB 4.4Å; V921-V929 HydrophobicContact CG1-CG1 4.14Å; V921-V929 HydrophobicContact CG1-CG2 3.66Å; V921-W932 HydrophobicContact CG1-CZ3 4.2Å
922	F	98.7	Very high	98.3	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-66.3	-46.8	177.8	-67	-44.4	0	0	0	112.3	L918 H919 S924 K926 V929 F933 I959 D962 V963 H966	L918-F922 HydrophobicContact CB-CD2 4.2Å; L918-F922 HydrophobicContact CB-CE2 3.81Å; L918-F922 HydrophobicContact CB-CZ 4.5Å; L918-F922 HydrophobicContact CD2-CZ 4.38Å; L918-F922 WeakPolarHBondContact O-CB 3.46Å; L918-F922 WeakPolarHBondContact O-CD2 3.47Å; L918-F922 VanDerWaalsContact O-CG 3.22Å; L918-F922 WeakPolarHBondContact O-CG 3.47Å; L918-F922 PolarHBondContact O-N 3.19Å; H919-F922 PolarHBondContact O-N 3.2Å; F922-S924 VanDerWaalsContact C-N 3.29Å; F922-S924 PolarHBondContact O-N 2.8Å; F922-K926 WeakPolarHBondContact O-CA 3.44Å; F922-K926 PolarHBondContact O-N 3.17Å; F922-V929 HydrophobicContact CD1-CG1 3.66Å; F922-V929 HydrophobicContact CE1-CG1 4.09Å; F922-F933 HydrophobicContact CE1-CB 4.22Å; F922-F933 HydrophobicContact CE1-CD2 4.18Å; F922-F933 HydrophobicContact CE1-CG 4.07Å; F922-F933 HydrophobicContact CZ-CD1 4.31Å; F922-F933 AromaticContact CZ-CD2 3.63Å; F922-F933 HydrophobicContact CZ-CD2 3.63Å; F922-F933 HydrophobicContact CZ-CE1 4.45Å; F922-F933 AromaticContact CZ-CE2 3.8Å; F922-F933 HydrophobicContact CZ-CE2 3.8Å; F922-F933 AromaticContact CZ-CG 3.89Å; F922-F933 HydrophobicContact CZ-CG 3.89Å; F922-F933 HydrophobicContact CZ-CZ 4.21Å; F922-I959 HydrophobicContact CE2-CG2 4.27Å; F922-D962 HydrophobicContact CB-CB 4.43Å; F922-D962 HydrophobicContact CD2-CB 3.59Å; F922-D962 HydrophobicContact CE2-CB 4.27Å; F922-D962 HydrophobicContact CG-CB 4.41Å; F922-V963 HydrophobicContact CD1-CG2 4.48Å; F922-V963 HydrophobicContact CD2-CG2 4.34Å; F922-V963 HydrophobicContact CE1-CG2 3.9Å; F922-V963 HydrophobicContact CE2-CG2 3.7Å; F922-V963 HydrophobicContact CZ-CG2 3.46Å; F922-V963 VanDerWaalsContact CZ-CG2 3.46Å; F922-H966 HydrophobicContact CB-CB 4.11Å; F922-H966 WeakPolarHBondContact O-CB 3.4Å
923	S	98.1	Very high	98.3	Very high	29 Å²	29	31.9 Å²	31.9	20%	0.203	16%	0.158	C	C	.	.	H	α-helix	trans	-62.2	-37.1	178.9	64.5	0	0	0	0	112.3	H919 S920 K926	H919-S923 WeakPolarHBondContact O-CB 3.36Å; H919-S923 PolarHBondContact O-N 2.97Å; H919-S923 PolarHBondContact O-OG 3.31Å; H919-S923 VanDerWaalsContact O-OG 3.08Å; S920-S923 PolarHBondContact O-OG 3.08Å; S923-K926 WeakPolarHBondContact O-CE 3.49Å
924	S	97.6	Very high	98.3	Very high	16 Å²	16	35.9 Å²	35.9	11%	0.112	18%	0.177	C	C	.	.	H	α-helix	trans	-73.7	-54	176.8	-63	0	0	0	0	113.6	S920 F922	S920-S924 WeakPolarHBondContact O-CB 3.17Å; S920-S924 PolarHBondContact O-N 2.86Å; S920-S924 PolarHBondContact O-OG 3.17Å; F922-S924 VanDerWaalsContact C-N 3.29Å; F922-S924 PolarHBondContact O-N 2.8Å
925	Y	98	Very high	98.2	Very high	18 Å²	18	39.6 Å²	39.6	7%	0.071	19%	0.194	C	C	.	.	H	α-helix	trans	-95.8	-19.7	-170	-75.5	-98.1	0	0	0	114.7	G855 C856 L857 F862 V921 K928	G855-Y925 WeakPolarHBondContact CA-OH 3.41Å; G855-Y925 PolarHBondContact N-OH 3.27Å; C856-Y925 PolarHBondContact N-OH 3.34Å; C856-Y925 VanDerWaalsContact N-OH 3.15Å; L857-Y925 WeakPolarHBondContact CA-OH 3.42Å; L857-Y925 WeakPolarHBondContact CB-OH 3.38Å; L857-Y925 PolarHBondContact N-OH 3.46Å; L857-Y925 PolarHBondContact O-OH 3.3Å; L857-Y925 VanDerWaalsContact O-OH 3.07Å; F862-Y925 HydrophobicContact CE2-CD1 4.39Å; F862-Y925 AromaticContact CE2-CE1 3.76Å; F862-Y925 HydrophobicContact CE2-CE1 3.76Å; F862-Y925 HydrophobicContact CE2-CE2 4.39Å; F862-Y925 AromaticContact CE2-CZ 3.76Å; F862-Y925 HydrophobicContact CZ-CD1 4.1Å; F862-Y925 HydrophobicContact CZ-CD2 4.07Å; F862-Y925 AromaticContact CZ-CE1 3.79Å; F862-Y925 HydrophobicContact CZ-CE1 3.79Å; F862-Y925 AromaticContact CZ-CE2 3.8Å; F862-Y925 HydrophobicContact CZ-CE2 3.8Å; F862-Y925 HydrophobicContact CZ-CG 4.22Å; F862-Y925 AromaticContact CZ-CZ 3.63Å; V921-Y925 WeakPolarHBondContact O-CB 3.2Å; V921-Y925 PolarHBondContact O-N 2.69Å; Y925-K928 WeakPolarHBondContact O-CB 3.38Å; Y925-K928 WeakPolarHBondContact O-CG 3.38Å; Y925-K928 PolarHBondContact O-N 3.39Å
926	K	98.3	Very high	98.2	Very high	120 Å²	120	39.3 Å²	39.3	52%	0.522	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	56.9	-141.5	175	-53.7	-171.5	-176.3	-169.2	0	111.8	F922 S923 K928 V929 H966 C967	F922-K926 WeakPolarHBondContact O-CA 3.44Å; F922-K926 PolarHBondContact O-N 3.17Å; S923-K926 WeakPolarHBondContact O-CE 3.49Å; K926-K928 PolarHBondContact O-N 3.49Å; K926-V929 PolarHBondContact O-N 2.93Å; K926-H966 WeakPolarHBondContact CA-O 3.47Å; K926-H966 VanDerWaalsContact CB-O 3.24Å; K926-H966 WeakPolarHBondContact CB-O 3.35Å; K926-C967 VanDerWaalsContact C-SG 3.54Å; K926-C967 PolarHBondContact O-SG 2.9Å
927	E	97.8	Very high	98.2	Very high	81 Å²	81	37.5 Å²	37.5	38%	0.379	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-53.1	-20.7	-178.1	-57.1	-171.2	-98.8	0	0	114.9	V929 S970	E927-V929 VanDerWaalsContact C-N 3.34Å; E927-V929 PolarHBondContact O-N 3.45Å; E927-S970 WeakPolarHBondContact OE2-CB 3.42Å; E927-S970 PolarHBondContact OE2-N 3.33Å; E927-S970 VanDerWaalsContact OE2-N 3.07Å; E927-S970 PolarHBondContact OE2-OG 3.35Å
928	K	97.4	Very high	98.1	Very high	134 Å²	134	43.4 Å²	43.4	58%	0.583	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-67.6	-30.3	-176.5	-58.6	173.9	-178.6	175.7	0	113.7	D854 Y925 K926 P931	D854-K928 IonicContact OD1-NZ 2.77Å; D854-K928 PolarHBondContact OD1-NZ 2.99Å; D854-K928 IonicContact OD2-NZ 3.58Å; D854-K928 PolarHBondContact OD2-NZ 2.84Å; Y925-K928 WeakPolarHBondContact O-CB 3.38Å; Y925-K928 WeakPolarHBondContact O-CG 3.38Å; Y925-K928 PolarHBondContact O-N 3.39Å; K926-K928 PolarHBondContact O-N 3.49Å; K928-P931 WeakPolarHBondContact O-CD 3.35Å
929	V	98.1	Very high	98.1	Very high	5 Å²	5	44.3 Å²	44.3	3%	0.03	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-91.9	-8.2	-170.3	77.5	0	0	0	0	113.5	F862 V921 F922 K926 E927 P931 W932 F933	F862-V929 HydrophobicContact CE1-CG2 3.76Å; F862-V929 HydrophobicContact CZ-CG2 4.06Å; V921-V929 HydrophobicContact CG1-CB 4.4Å; V921-V929 HydrophobicContact CG1-CG1 4.14Å; V921-V929 HydrophobicContact CG1-CG2 3.66Å; F922-V929 HydrophobicContact CD1-CG1 3.66Å; F922-V929 HydrophobicContact CE1-CG1 4.09Å; K926-V929 PolarHBondContact O-N 2.93Å; E927-V929 VanDerWaalsContact C-N 3.34Å; E927-V929 PolarHBondContact O-N 3.45Å; V929-P931 VanDerWaalsContact C-CD 3.45Å; V929-W932 HydrophobicContact CG2-CB 4.17Å; V929-W932 HydrophobicContact CG2-CD2 4.12Å; V929-W932 HydrophobicContact CG2-CE3 3.63Å; V929-W932 HydrophobicContact CG2-CG 4.38Å; V929-W932 HydrophobicContact CG2-CZ3 4.32Å; V929-W932 WeakPolarHBondContact O-CB 3.3Å; V929-W932 PolarHBondContact O-N 3.24Å; V929-F933 PolarHBondContact O-N 3.28Å; V929-F933 VanDerWaalsContact O-N 3.07Å
930	L	98.2	Very high	98.1	Very high	2 Å²	2	41 Å²	41	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-52.1	-42.2	177.5	-67.1	170.4	0	0	0	114.2	W932 F933 E934 V963 C967 S970 Y974	L930-W932 VanDerWaalsContact C-N 3.27Å; L930-W932 PolarHBondContact O-N 3.09Å; L930-F933 WeakPolarHBondContact O-CB 3.23Å; L930-F933 PolarHBondContact O-N 3.47Å; L930-F933 VanDerWaalsContact O-N 3.14Å; L930-E934 PolarHBondContact O-N 2.99Å; L930-V963 HydrophobicContact CD2-CG1 4.04Å; L930-C967 HydrophobicContact CD1-CB 3.87Å; L930-C967 HydrophobicContact CD2-CB 3.71Å; L930-C967 HydrophobicContact CG-CB 3.88Å; L930-S970 VanDerWaalsContact CD1-CB 3.45Å; L930-Y974 HydrophobicContact CB-CE2 3.93Å; L930-Y974 HydrophobicContact CD1-CE2 4.04Å; L930-Y974 HydrophobicContact CD2-CD2 4.37Å; L930-Y974 HydrophobicContact CD2-CE2 4.12Å; L930-Y974 HydrophobicContact CG-CE2 4.26Å
931	P	98	Very high	98.1	Very high	87 Å²	87	42.3 Å²	42.3	57%	0.565	21%	0.207	S	C	*	.	H	α-helix	trans	-66.1	-25.8	177.1	-20.6	34.5	0	0	0	114.1	K928 V929	K928-P931 WeakPolarHBondContact O-CD 3.35Å; V929-P931 VanDerWaalsContact C-CD 3.45Å
932	W	98.3	Very high	98.1	Very high	33 Å²	33	45.5 Å²	45.5	13%	0.125	22%	0.222	C	C	.	.	H	α-helix	trans	-75.9	-38.4	172.3	164.4	91.3	0	0	0	111	F862 L865 L869 L918 V921 V929 L930 E934 Q935 L936	F862-W932 AromaticContact CD1-CD1 3.86Å; F862-W932 AromaticContact CD1-CD2 3.95Å; F862-W932 HydrophobicContact CD1-CD2 3.95Å; F862-W932 AromaticContact CD1-CE2 3.69Å; F862-W932 HydrophobicContact CD1-CG 4.05Å; F862-W932 HydrophobicContact CD1-CZ2 4.18Å; F862-W932 AromaticContact CD1-NE1 3.65Å; F862-W932 HydrophobicContact CE1-CD2 4.38Å; F862-W932 PolarHBondContact O-NE1 2.79Å; L865-W932 HydrophobicContact CD2-CZ2 4.31Å; L865-W932 HydrophobicContact CG-CZ2 4.36Å; L869-W932 HydrophobicContact CD1-CH2 4.17Å; L918-W932 HydrophobicContact CD2-CH2 3.91Å; L918-W932 HydrophobicContact CD2-CZ3 3.87Å; V921-W932 HydrophobicContact CG1-CZ3 4.2Å; V929-W932 HydrophobicContact CG2-CB 4.17Å; V929-W932 HydrophobicContact CG2-CD2 4.12Å; V929-W932 HydrophobicContact CG2-CE3 3.63Å; V929-W932 HydrophobicContact CG2-CG 4.38Å; V929-W932 HydrophobicContact CG2-CZ3 4.32Å; V929-W932 WeakPolarHBondContact O-CB 3.3Å; V929-W932 PolarHBondContact O-N 3.24Å; L930-W932 VanDerWaalsContact C-N 3.27Å; L930-W932 PolarHBondContact O-N 3.09Å; W932-E934 PolarHBondContact O-N 3.25Å; W932-Q935 WeakPolarHBondContact O-CG 3.28Å; W932-Q935 PolarHBondContact O-N 3.49Å; W932-Q935 PolarHBondContact O-NE2 3.48Å; W932-L936 HydrophobicContact CH2-CD1 4.15Å; W932-L936 HydrophobicContact CZ3-CD1 4.45Å
933	F	98.4	Very high	98.1	Very high	1 Å²	1	45.5 Å²	45.5	0%	0.004	22%	0.222	C	C	.	.	H	α-helix	trans	-65	-23.1	179	177.6	-113.1	0	0	0	113.3	L918 F922 V929 L930 Q935 L936 L937 I940 I959 F960 V963	L918-F933 HydrophobicContact CD1-CE2 4.44Å; L918-F933 HydrophobicContact CD2-CD2 4.34Å; F922-F933 HydrophobicContact CE1-CB 4.22Å; F922-F933 HydrophobicContact CE1-CD2 4.18Å; F922-F933 HydrophobicContact CE1-CG 4.07Å; F922-F933 HydrophobicContact CZ-CD1 4.31Å; F922-F933 AromaticContact CZ-CD2 3.63Å; F922-F933 HydrophobicContact CZ-CD2 3.63Å; F922-F933 HydrophobicContact CZ-CE1 4.45Å; F922-F933 AromaticContact CZ-CE2 3.8Å; F922-F933 HydrophobicContact CZ-CE2 3.8Å; F922-F933 AromaticContact CZ-CG 3.89Å; F922-F933 HydrophobicContact CZ-CG 3.89Å; F922-F933 HydrophobicContact CZ-CZ 4.21Å; V929-F933 PolarHBondContact O-N 3.28Å; V929-F933 VanDerWaalsContact O-N 3.07Å; L930-F933 WeakPolarHBondContact O-CB 3.23Å; L930-F933 PolarHBondContact O-N 3.47Å; L930-F933 VanDerWaalsContact O-N 3.14Å; F933-Q935 PolarHBondContact O-N 3.23Å; F933-L936 HydrophobicContact CD2-CB 4.21Å; F933-L936 HydrophobicContact CD2-CD1 4.36Å; F933-L936 HydrophobicContact CE2-CB 4.26Å; F933-L936 PolarHBondContact O-N 3.07Å; F933-L937 HydrophobicContact CE1-CD1 3.91Å; F933-L937 PolarHBondContact O-N 3.25Å; F933-L937 VanDerWaalsContact O-N 3.12Å; F933-I940 HydrophobicContact CE2-CG1 3.93Å; F933-I940 HydrophobicContact CZ-CB 4.34Å; F933-I940 HydrophobicContact CZ-CG1 3.95Å; F933-I940 HydrophobicContact CZ-CG2 4.4Å; F933-I959 HydrophobicContact CE2-CG2 4.09Å; F933-I959 HydrophobicContact CZ-CG2 4Å; F933-F960 HydrophobicContact CE1-CE1 4.35Å; F933-V963 HydrophobicContact CD1-CG2 4.44Å; F933-V963 HydrophobicContact CE1-CG2 4.06Å; F933-V963 HydrophobicContact CZ-CG2 4.43Å
934	E	98.2	Very high	98.1	Very high	100 Å²	100	44.7 Å²	44.7	47%	0.467	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-28.1	176.2	-73.5	178.5	-170.4	0	0	113.9	L930 W932 L936 Y974	L930-E934 PolarHBondContact O-N 2.99Å; W932-E934 PolarHBondContact O-N 3.25Å; E934-L936 VanDerWaalsContact C-N 3.33Å; E934-L936 PolarHBondContact O-N 3.25Å; E934-Y974 HydrophobicContact CG-CE1 3.79Å; E934-Y974 WeakPolarHBondContact OE1-CE1 3.33Å; E934-Y974 PolarHBondContact OE1-OH 2.71Å
935	Q	97.6	Very high	98.1	Very high	81 Å²	81	46.4 Å²	46.4	38%	0.379	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-26.6	176.9	80.6	-167.7	-77.1	0	0	113.8	W932 F933	W932-Q935 WeakPolarHBondContact O-CG 3.28Å; W932-Q935 PolarHBondContact O-N 3.49Å; W932-Q935 PolarHBondContact O-NE2 3.48Å; F933-Q935 PolarHBondContact O-N 3.23Å
936	L	98.3	Very high	97.9	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-23.1	179.1	-57.9	179.9	0	0	0	111.9	L869 K870 L918 W932 F933 E934 Q938 L939 I940	L869-L936 HydrophobicContact CB-CD1 4.16Å; L869-L936 HydrophobicContact CB-CD2 4.22Å; L869-L936 HydrophobicContact CD1-CD1 4.25Å; K870-L936 HydrophobicContact CB-CD2 3.73Å; L918-L936 HydrophobicContact CD2-CD1 3.96Å; W932-L936 HydrophobicContact CH2-CD1 4.15Å; W932-L936 HydrophobicContact CZ3-CD1 4.45Å; F933-L936 HydrophobicContact CD2-CB 4.21Å; F933-L936 HydrophobicContact CD2-CD1 4.36Å; F933-L936 HydrophobicContact CE2-CB 4.26Å; F933-L936 PolarHBondContact O-N 3.07Å; E934-L936 VanDerWaalsContact C-N 3.33Å; E934-L936 PolarHBondContact O-N 3.25Å; L936-Q938 VanDerWaalsContact C-N 3.29Å; L936-Q938 PolarHBondContact O-N 3.04Å; L936-Q938 VanDerWaalsContact O-N 3.08Å; L936-L939 WeakPolarHBondContact O-CB 3.3Å; L936-L939 PolarHBondContact O-N 3.47Å; L936-I940 HydrophobicContact CB-CG1 4.43Å; L936-I940 PolarHBondContact O-N 2.97Å; L936-I940 VanDerWaalsContact O-N 3.16Å
937	L	97.9	Very high	97.7	Very high	8 Å²	8	53 Å²	53	4%	0.042	28%	0.275	C	S	.	.	H	α-helix	trans	-48.1	-43.1	-168.8	-178.6	62.8	0	0	0	114.3	F933 L939 I940 V941 F960 Y974 Y977	F933-L937 HydrophobicContact CE1-CD1 3.91Å; F933-L937 PolarHBondContact O-N 3.25Å; F933-L937 VanDerWaalsContact O-N 3.12Å; L937-L939 VanDerWaalsContact C-N 3.34Å; L937-L939 PolarHBondContact O-N 3.04Å; L937-I940 PolarHBondContact O-N 2.91Å; L937-V941 HydrophobicContact CD1-CG2 4.27Å; L937-V941 WeakPolarHBondContact O-CB 3.36Å; L937-V941 WeakPolarHBondContact O-CG2 3.4Å; L937-V941 PolarHBondContact O-N 3.04Å; L937-F960 HydrophobicContact CD1-CE1 3.87Å; L937-F960 HydrophobicContact CD1-CZ 3.96Å; L937-Y974 HydrophobicContact CD2-CD1 3.86Å; L937-Y974 HydrophobicContact CD2-CE1 4.35Å; L937-Y977 HydrophobicContact CD1-CD2 4.25Å; L937-Y977 HydrophobicContact CD1-CG 4.22Å; L937-Y977 HydrophobicContact CD2-CD2 3.91Å; L937-Y977 HydrophobicContact CD2-CE1 4.42Å; L937-Y977 HydrophobicContact CD2-CE2 3.77Å; L937-Y977 HydrophobicContact CD2-CG 4.38Å; L937-Y977 HydrophobicContact CG-CD2 4.43Å; L937-Y977 HydrophobicContact CG-CG 4.45Å
938	Q	97.8	Very high	97.6	Very high	124 Å²	124	52 Å²	52	58%	0.579	27%	0.268	S	S	*	.	H	α-helix	trans	-65.1	-35.6	-179.8	-65	-60.7	-56.5	0	0	113	L936 Q942	L936-Q938 VanDerWaalsContact C-N 3.29Å; L936-Q938 PolarHBondContact O-N 3.04Å; L936-Q938 VanDerWaalsContact O-N 3.08Å; Q938-Q942 WeakPolarHBondContact O-CB 3.31Å; Q938-Q942 PolarHBondContact O-N 3.5Å
939	L	98.5	Very high	97.6	Very high	20 Å²	20	47.9 Å²	47.9	11%	0.105	26%	0.255	C	S	.	.	H	α-helix	trans	-74	-38.5	177.6	-64.1	170.5	0	0	0	111	K870 L873 E874 F877 L936 L937 V941 Q942 L943	K870-L939 HydrophobicContact CB-CD1 4.48Å; K870-L939 HydrophobicContact CG-CD1 3.66Å; L873-L939 HydrophobicContact CB-CB 4.08Å; L873-L939 HydrophobicContact CB-CD1 3.82Å; L873-L939 HydrophobicContact CB-CG 4.46Å; L873-L939 HydrophobicContact CD1-CB 4.06Å; L873-L939 HydrophobicContact CD1-CD1 4.4Å; E874-L939 HydrophobicContact CG-CD1 3.89Å; E874-L939 HydrophobicContact CG-CD2 4.09Å; F877-L939 HydrophobicContact CD2-CD2 4.19Å; F877-L939 HydrophobicContact CE2-CB 4.31Å; F877-L939 HydrophobicContact CE2-CD2 4.02Å; L936-L939 WeakPolarHBondContact O-CB 3.3Å; L936-L939 PolarHBondContact O-N 3.47Å; L937-L939 VanDerWaalsContact C-N 3.34Å; L937-L939 PolarHBondContact O-N 3.04Å; L939-V941 VanDerWaalsContact C-N 3.34Å; L939-V941 PolarHBondContact O-N 3.19Å; L939-Q942 WeakPolarHBondContact O-CB 3.48Å; L939-Q942 PolarHBondContact O-N 2.86Å; L939-Q942 VanDerWaalsContact O-N 3.14Å; L939-L943 PolarHBondContact O-N 3.19Å
940	I	98.6	Very high	97.5	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-65.5	-38.3	173.8	-53.9	-52.3	0	0	0	111.4	L873 F933 L936 L937 Q942 L943 I959 F960	L873-I940 HydrophobicContact CD1-CD1 3.65Å; L873-I940 HydrophobicContact CD2-CD1 4.17Å; F933-I940 HydrophobicContact CE2-CG1 3.93Å; F933-I940 HydrophobicContact CZ-CB 4.34Å; F933-I940 HydrophobicContact CZ-CG1 3.95Å; F933-I940 HydrophobicContact CZ-CG2 4.4Å; L936-I940 HydrophobicContact CB-CG1 4.43Å; L936-I940 PolarHBondContact O-N 2.97Å; L936-I940 VanDerWaalsContact O-N 3.16Å; L937-I940 PolarHBondContact O-N 2.91Å; I940-Q942 VanDerWaalsContact C-N 3.27Å; I940-Q942 PolarHBondContact O-N 3.43Å; I940-L943 HydrophobicContact CD1-CD1 4.1Å; I940-L943 WeakPolarHBondContact O-CB 3.35Å; I940-L943 PolarHBondContact O-N 2.83Å; I940-I959 HydrophobicContact CD1-CD1 3.83Å; I940-I959 HydrophobicContact CD1-CG2 4.42Å; I940-I959 HydrophobicContact CG1-CG2 4.33Å; I940-I959 HydrophobicContact CG2-CB 4.17Å; I940-I959 HydrophobicContact CG2-CG2 3.8Å; I940-F960 HydrophobicContact CB-CZ 4.4Å; I940-F960 HydrophobicContact CG2-CD2 4.12Å; I940-F960 HydrophobicContact CG2-CE1 4.5Å; I940-F960 HydrophobicContact CG2-CE2 3.62Å; I940-F960 HydrophobicContact CG2-CZ 3.84Å
941	V	98.5	Very high	97.5	Very high	30 Å²	30	53.5 Å²	53.5	18%	0.182	28%	0.276	C	S	.	.	H	α-helix	trans	-64.6	-33	172.5	171.6	0	0	0	0	112	L937 L939 L943 I944 C945 F960 Y977	L937-V941 HydrophobicContact CD1-CG2 4.27Å; L937-V941 WeakPolarHBondContact O-CB 3.36Å; L937-V941 WeakPolarHBondContact O-CG2 3.4Å; L937-V941 PolarHBondContact O-N 3.04Å; L939-V941 VanDerWaalsContact C-N 3.34Å; L939-V941 PolarHBondContact O-N 3.19Å; V941-L943 VanDerWaalsContact C-N 3.29Å; V941-L943 PolarHBondContact O-N 3.42Å; V941-I944 VanDerWaalsContact O-CG1 3.29Å; V941-I944 WeakPolarHBondContact O-CG1 3.3Å; V941-I944 PolarHBondContact O-N 3.44Å; V941-C945 PolarHBondContact O-SG 2.83Å; V941-F960 HydrophobicContact CG2-CE2 4.36Å; V941-F960 HydrophobicContact CG2-CZ 3.88Å; V941-Y977 HydrophobicContact CG2-CD1 3.66Å; V941-Y977 HydrophobicContact CG2-CG 3.95Å
942	Q	98.2	Very high	97.5	Very high	67 Å²	67	49.3 Å²	49.3	31%	0.313	25%	0.249	S	C	.	.	H	α-helix	trans	-66.8	-28.7	176.3	-176	171.4	-56.9	0	0	112.8	F877 Q938 L939 I940 C945 R948	F877-Q942 HydrophobicContact CD1-CG 4.47Å; F877-Q942 HydrophobicContact CD2-CG 4.5Å; F877-Q942 HydrophobicContact CE1-CB 4.49Å; F877-Q942 HydrophobicContact CE1-CG 3.89Å; F877-Q942 HydrophobicContact CE2-CB 4.03Å; F877-Q942 HydrophobicContact CE2-CG 3.92Å; F877-Q942 VanDerWaalsContact CE2-NE2 3.28Å; F877-Q942 HydrophobicContact CZ-CB 3.74Å; F877-Q942 HydrophobicContact CZ-CG 3.57Å; Q938-Q942 WeakPolarHBondContact O-CB 3.31Å; Q938-Q942 PolarHBondContact O-N 3.5Å; L939-Q942 WeakPolarHBondContact O-CB 3.48Å; L939-Q942 PolarHBondContact O-N 2.86Å; L939-Q942 VanDerWaalsContact O-N 3.14Å; I940-Q942 VanDerWaalsContact C-N 3.27Å; I940-Q942 PolarHBondContact O-N 3.43Å; Q942-C945 WeakPolarHBondContact O-CB 3.26Å; Q942-R948 VanDerWaalsContact O-CG 3.23Å; Q942-R948 WeakPolarHBondContact O-CG 3.39Å; Q942-R948 PolarHBondContact O-NE 3.11Å
943	L	98.6	Very high	97.5	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-66.5	-46.7	174.7	-65.4	171.4	0	0	0	112.2	L873 F877 L911 L939 I940 V941 C945 R948 D952	L873-L943 HydrophobicContact CD2-CD1 4.26Å; F877-L943 HydrophobicContact CE1-CD2 3.75Å; F877-L943 HydrophobicContact CE1-CG 4.47Å; F877-L943 HydrophobicContact CZ-CD2 3.54Å; F877-L943 HydrophobicContact CZ-CG 3.87Å; L911-L943 HydrophobicContact CD1-CD1 3.96Å; L911-L943 HydrophobicContact CD1-CD2 4.37Å; L911-L943 HydrophobicContact CD2-CD2 3.99Å; L939-L943 PolarHBondContact O-N 3.19Å; I940-L943 HydrophobicContact CD1-CD1 4.1Å; I940-L943 WeakPolarHBondContact O-CB 3.35Å; I940-L943 PolarHBondContact O-N 2.83Å; V941-L943 VanDerWaalsContact C-N 3.29Å; V941-L943 PolarHBondContact O-N 3.42Å; L943-C945 PolarHBondContact O-N 3.46Å; L943-C945 VanDerWaalsContact O-N 3.11Å; L943-R948 WeakPolarHBondContact O-CB 3.47Å; L943-D952 HydrophobicContact CB-CB 4.34Å; L943-D952 WeakPolarHBondContact CB-O 3.48Å; L943-D952 HydrophobicContact CD2-CB 3.95Å; L943-D952 CarbonylContact O-C 3.45Å
944	I	98.2	Very high	97.5	Very high	11 Å²	11	50.8 Å²	50.8	6%	0.056	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	8.8	-178.6	62.1	168.9	0	0	0	114.3	V941 L957 F960 Y977 F978 P981	V941-I944 VanDerWaalsContact O-CG1 3.29Å; V941-I944 WeakPolarHBondContact O-CG1 3.3Å; V941-I944 PolarHBondContact O-N 3.44Å; I944-L957 HydrophobicContact CG2-CD2 4.3Å; I944-L957 HydrophobicContact CG2-CG 4.06Å; I944-F960 HydrophobicContact CD1-CD2 4.02Å; I944-F960 HydrophobicContact CD1-CE2 3.62Å; I944-F960 HydrophobicContact CG1-CE2 4.33Å; I944-F960 HydrophobicContact CG2-CD2 4.4Å; I944-Y977 WeakPolarHBondContact CD1-O 3.16Å; I944-F978 HydrophobicContact CD1-CB 4.3Å; I944-P981 HydrophobicContact CD1-CB 4.03Å; I944-P981 HydrophobicContact CD1-CG 4.08Å
945	C	97.5	Very high	97.6	Very high	52 Å²	52	48.5 Å²	48.5	35%	0.351	24%	0.243	S	C	.	.	S	Bend	trans	-70.4	136.4	178.8	-77.5	0	0	0	0	110.9	V941 Q942 L943 N947 R948	V941-C945 PolarHBondContact O-SG 2.83Å; Q942-C945 WeakPolarHBondContact O-CB 3.26Å; L943-C945 PolarHBondContact O-N 3.46Å; L943-C945 VanDerWaalsContact O-N 3.11Å; C945-N947 PolarHBondContact O-N 3.04Å; C945-R948 HydrophobicContact CB-CG 4.14Å; C945-R948 WeakPolarHBondContact O-CB 3.37Å; C945-R948 PolarHBondContact O-N 2.88Å
946	P	93.8	Very high	97.6	Very high	109 Å²	109	44.6 Å²	44.6	71%	0.708	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-19.4	-171.6	-28.2	35.2	0	0	0	117
947	N	93	Very high	97.6	Very high	168 Å²	168	44.7 Å²	44.7	90%	0.898	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93	-2.1	-178.5	-61.6	-8.3	0	0	0	113.4	C945	C945-N947 PolarHBondContact O-N 3.04Å
948	R	96.7	Very high	97.7	Very high	60 Å²	60	45.5 Å²	45.5	23%	0.226	23%	0.232	C	C	.	.	S	Bend	trans	-78.6	161.9	178	-71.9	-66.5	174.4	-168.2	-7.9	112.1	Q942 L943 C945 D952 R953	Q942-R948 VanDerWaalsContact O-CG 3.23Å; Q942-R948 WeakPolarHBondContact O-CG 3.39Å; Q942-R948 PolarHBondContact O-NE 3.11Å; L943-R948 WeakPolarHBondContact O-CB 3.47Å; C945-R948 HydrophobicContact CB-CG 4.14Å; C945-R948 WeakPolarHBondContact O-CB 3.37Å; C945-R948 PolarHBondContact O-N 2.88Å; R948-D952 HydrophobicContact CB-CB 3.82Å; R948-D952 WeakPolarHBondContact CD-OD2 3.44Å; R948-D952 HydrophobicContact CG-CB 4.41Å; R948-R953 HydrophobicContact CB-CG 4.41Å; R948-R953 PolarHBondContact O-NH1 3.26Å
949	P	96.8	Very high	97.7	Very high	47 Å²	47	39.6 Å²	39.6	31%	0.305	20%	0.204	S	C	.	.			trans	-49.5	157.7	166.1	-26.7	36.1	0	0	0	112.6	A951 D952 R953	P949-A951 VanDerWaalsContact C-N 3.33Å; P949-A951 PolarHBondContact O-N 3.48Å; P949-D952 PolarHBondContact O-N 3.21Å; P949-R953 PolarHBondContact O-N 2.94Å; P949-R953 PolarHBondContact O-NH1 3.14Å
950	W	97.3	Very high	97.7	Very high	120 Å²	120	38.7 Å²	38.7	46%	0.455	20%	0.199	S	C	.	.	H	α-helix	trans	-67.6	-34.8	-179.6	66.2	-90.8	0	0	0	112	R953 Q954 E992 V993	W950-R953 PolarHBondContact O-N 2.93Å; W950-Q954 VanDerWaalsContact CZ3-OE1 3.27Å; W950-Q954 PolarHBondContact O-N 2.98Å; W950-E992 HydrophobicContact CE3-CB 4Å; W950-E992 HydrophobicContact CE3-CG 4.21Å; W950-E992 HydrophobicContact CH2-CG 4.21Å; W950-E992 HydrophobicContact CZ3-CB 3.65Å; W950-E992 HydrophobicContact CZ3-CG 3.53Å; W950-V993 HydrophobicContact CB-CG2 4.13Å; W950-V993 WeakPolarHBondContact O-CG2 3.44Å
951	A	97.5	Very high	97.7	Very high	5 Å²	5	38.9 Å²	38.9	4%	0.041	20%	0.2	C	C	.	.	H	α-helix	trans	-61.5	-45.5	176	0	0	0	0	0	112.2	V908 P949 R953 Q954 W955	V908-A951 HydrophobicContact CG1-CB 3.84Å; V908-A951 HydrophobicContact CG2-CB 3.74Å; P949-A951 VanDerWaalsContact C-N 3.33Å; P949-A951 PolarHBondContact O-N 3.48Å; A951-R953 VanDerWaalsContact C-N 3.33Å; A951-R953 PolarHBondContact O-N 3.36Å; A951-Q954 WeakPolarHBondContact O-CB 3.16Å; A951-Q954 PolarHBondContact O-N 3.39Å; A951-W955 PolarHBondContact O-N 3.43Å
952	D	98.4	Very high	97.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-53.7	-49.9	171	-75.1	22.1	0	0	0	111.1	H876 Q880 L943 R948 P949 Q954 W955 G956	H876-D952 IonicContact CD2-OD1 2.85Å; H876-D952 IonicContact CE1-OD1 2.77Å; H876-D952 IonicContact NE2-OD1 3.7Å; H876-D952 PolarHBondContact NE2-OD1 3.11Å; H876-D952 IonicContact NE2-OD2 2.82Å; Q880-D952 VanDerWaalsContact NE2-CG 3.32Å; Q880-D952 PolarHBondContact NE2-OD1 2.98Å; Q880-D952 VanDerWaalsContact NE2-OD1 3.08Å; Q880-D952 PolarHBondContact NE2-OD2 2.98Å; L943-D952 HydrophobicContact CB-CB 4.34Å; L943-D952 WeakPolarHBondContact CB-O 3.48Å; L943-D952 HydrophobicContact CD2-CB 3.95Å; L943-D952 CarbonylContact O-C 3.45Å; R948-D952 HydrophobicContact CB-CB 3.82Å; R948-D952 WeakPolarHBondContact CD-OD2 3.44Å; R948-D952 HydrophobicContact CG-CB 4.41Å; P949-D952 PolarHBondContact O-N 3.21Å; D952-Q954 VanDerWaalsContact C-N 3.31Å; D952-Q954 PolarHBondContact O-N 2.89Å; D952-W955 PolarHBondContact O-N 2.81Å; D952-G956 PolarHBondContact O-N 3.32Å
953	R	98.6	Very high	97.8	Very high	28 Å²	28	35 Å²	35	11%	0.106	18%	0.181	C	C	.	.	H	α-helix	trans	-63.3	-37.6	-179.1	-62.6	-163.9	-50.6	-73.8	1.3	112	R948 P949 W950 A951 L957 D988 V993	R948-R953 HydrophobicContact CB-CG 4.41Å; R948-R953 PolarHBondContact O-NH1 3.26Å; P949-R953 PolarHBondContact O-N 2.94Å; P949-R953 PolarHBondContact O-NH1 3.14Å; W950-R953 PolarHBondContact O-N 2.93Å; A951-R953 VanDerWaalsContact C-N 3.33Å; A951-R953 PolarHBondContact O-N 3.36Å; R953-L957 WeakPolarHBondContact O-CB 3.29Å; R953-L957 WeakPolarHBondContact O-CD1 3.38Å; R953-L957 WeakPolarHBondContact O-CG 3.37Å; R953-L957 PolarHBondContact O-N 3.28Å; R953-L957 VanDerWaalsContact O-N 3.15Å; R953-D988 IonicContact CZ-OD2 2.99Å; R953-D988 VanDerWaalsContact CZ-OD2 3.3Å; R953-D988 IonicContact NE-OD2 2.65Å; R953-D988 PolarHBondContact NE-OD2 3.44Å; R953-D988 IonicContact NH2-OD1 3.73Å; R953-D988 PolarHBondContact NH2-OD1 3.4Å; R953-D988 IonicContact NH2-OD2 3Å; R953-D988 PolarHBondContact NH2-OD2 3.02Å; R953-V993 HydrophobicContact CB-CG1 4.3Å; R953-V993 HydrophobicContact CB-CG2 3.94Å
954	Q	98.6	Very high	97.8	Very high	36 Å²	36	35 Å²	35	17%	0.168	18%	0.181	C	C	.	.	H	α-helix	trans	-61.9	-60.8	175.3	177	-163.9	-3.7	0	0	110.5	W950 A951 D952 G956 L957 C958 E992 V993	W950-Q954 VanDerWaalsContact CZ3-OE1 3.27Å; W950-Q954 PolarHBondContact O-N 2.98Å; A951-Q954 WeakPolarHBondContact O-CB 3.16Å; A951-Q954 PolarHBondContact O-N 3.39Å; D952-Q954 VanDerWaalsContact C-N 3.31Å; D952-Q954 PolarHBondContact O-N 2.89Å; Q954-G956 VanDerWaalsContact C-N 3.33Å; Q954-G956 PolarHBondContact O-N 2.79Å; Q954-L957 WeakPolarHBondContact O-CA 3.37Å; Q954-L957 WeakPolarHBondContact O-CB 3.23Å; Q954-L957 PolarHBondContact O-N 3.03Å; Q954-C958 PolarHBondContact O-N 2.89Å; Q954-C958 PolarHBondContact O-SG 3.41Å; Q954-C958 VanDerWaalsContact O-SG 3.33Å; Q954-E992 HydrophobicContact CG-CB 4.17Å; Q954-V993 HydrophobicContact CB-CG2 4.2Å
955	W	98.4	Very high	97.8	Very high	52 Å²	52	35.9 Å²	35.9	20%	0.197	19%	0.185	C	C	.	.	H	α-helix	trans	-67.7	-34.1	-174.1	-68	111.6	0	0	0	112.8	L911 T912 A951 D952 L957 C958 I959	L911-W955 HydrophobicContact CD2-CB 3.86Å; L911-W955 HydrophobicContact CD2-CG 4.29Å; L911-W955 HydrophobicContact CG-CB 3.89Å; L911-W955 HydrophobicContact CG-CG 4.25Å; T912-W955 HydrophobicContact CG2-CD2 4.14Å; T912-W955 VanDerWaalsContact CG2-CE2 3.41Å; T912-W955 HydrophobicContact CG2-CH2 3.9Å; T912-W955 HydrophobicContact CG2-CZ2 3.29Å; A951-W955 PolarHBondContact O-N 3.43Å; D952-W955 PolarHBondContact O-N 2.81Å; W955-L957 VanDerWaalsContact C-N 3.28Å; W955-L957 PolarHBondContact O-N 3.02Å; W955-C958 HydrophobicContact CE3-CB 4.18Å; W955-C958 PolarHBondContact O-N 3.03Å; W955-I959 VanDerWaalsContact O-CG1 3.32Å; W955-I959 WeakPolarHBondContact O-CG1 3.29Å; W955-I959 PolarHBondContact O-N 3.29Å
956	G	98.6	Very high	97.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-60.8	-35.4	169.7	0	0	0	0	0	113.1	D952 Q954 F960	D952-G956 PolarHBondContact O-N 3.32Å; Q954-G956 VanDerWaalsContact C-N 3.33Å; Q954-G956 PolarHBondContact O-N 2.79Å; G956-F960 WeakPolarHBondContact O-CD2 3.27Å; G956-F960 PolarHBondContact O-N 3.41Å
957	L	98.8	Very high	98.1	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.005	14%	0.143	C	C	.	.	H	α-helix	trans	-72	-46.7	172.5	-73.4	167.6	0	0	0	111.6	I944 R953 Q954 W955 I959 F960 D961 M982 V993 A996 A997	I944-L957 HydrophobicContact CG2-CD2 4.3Å; I944-L957 HydrophobicContact CG2-CG 4.06Å; R953-L957 WeakPolarHBondContact O-CB 3.29Å; R953-L957 WeakPolarHBondContact O-CD1 3.38Å; R953-L957 WeakPolarHBondContact O-CG 3.37Å; R953-L957 PolarHBondContact O-N 3.28Å; R953-L957 VanDerWaalsContact O-N 3.15Å; Q954-L957 WeakPolarHBondContact O-CA 3.37Å; Q954-L957 WeakPolarHBondContact O-CB 3.23Å; Q954-L957 PolarHBondContact O-N 3.03Å; W955-L957 VanDerWaalsContact C-N 3.28Å; W955-L957 PolarHBondContact O-N 3.02Å; L957-I959 VanDerWaalsContact C-N 3.28Å; L957-I959 PolarHBondContact O-N 2.93Å; L957-F960 CarbonylContact O-C 3.44Å; L957-F960 WeakPolarHBondContact O-CA 3.25Å; L957-F960 WeakPolarHBondContact O-CB 3.47Å; L957-F960 PolarHBondContact O-N 3.21Å; L957-D961 PolarHBondContact O-N 3.39Å; L957-M982 HydrophobicContact CD2-CB 3.89Å; L957-M982 HydrophobicContact CD2-CE 4.26Å; L957-M982 HydrophobicContact CD2-CG 4.29Å; L957-V993 HydrophobicContact CD1-CG1 3.97Å; L957-A996 HydrophobicContact CB-CB 3.76Å; L957-A996 HydrophobicContact CD1-CB 4.37Å; L957-A997 HydrophobicContact CD1-CB 4.19Å
958	C	98.7	Very high	98.3	Very high	26 Å²	26	22.9 Å²	22.9	18%	0.176	11%	0.106	C	C	.	.	H	α-helix	trans	-53.8	-43.8	178	-63.3	0	0	0	0	112.4	Q954 W955 F960 D961 D962	Q954-C958 PolarHBondContact O-N 2.89Å; Q954-C958 PolarHBondContact O-SG 3.41Å; Q954-C958 VanDerWaalsContact O-SG 3.33Å; W955-C958 HydrophobicContact CE3-CB 4.18Å; W955-C958 PolarHBondContact O-N 3.03Å; C958-F960 VanDerWaalsContact C-N 3.28Å; C958-F960 PolarHBondContact O-N 2.93Å; C958-D961 WeakPolarHBondContact O-CB 3.24Å; C958-D961 PolarHBondContact O-N 3.47Å; C958-D962 PolarHBondContact O-N 3.13Å
959	I	98.8	Very high	98.3	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-62	-35.3	175.6	-67.5	167.3	0	0	0	111.8	S915 L918 F922 F933 I940 W955 L957 V963	S915-I959 WeakPolarHBondContact OG-CG1 3.31Å; L918-I959 HydrophobicContact CD1-CD1 3.88Å; L918-I959 HydrophobicContact CD1-CG1 4.13Å; L918-I959 HydrophobicContact CD1-CG2 3.86Å; F922-I959 HydrophobicContact CE2-CG2 4.27Å; F933-I959 HydrophobicContact CE2-CG2 4.09Å; F933-I959 HydrophobicContact CZ-CG2 4Å; I940-I959 HydrophobicContact CD1-CD1 3.83Å; I940-I959 HydrophobicContact CD1-CG2 4.42Å; I940-I959 HydrophobicContact CG1-CG2 4.33Å; I940-I959 HydrophobicContact CG2-CB 4.17Å; I940-I959 HydrophobicContact CG2-CG2 3.8Å; W955-I959 VanDerWaalsContact O-CG1 3.32Å; W955-I959 WeakPolarHBondContact O-CG1 3.29Å; W955-I959 PolarHBondContact O-N 3.29Å; L957-I959 VanDerWaalsContact C-N 3.28Å; L957-I959 PolarHBondContact O-N 2.93Å; I959-V963 WeakPolarHBondContact O-CG2 3.13Å; I959-V963 PolarHBondContact O-N 3.39Å
960	F	98.8	Very high	98.4	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-76.7	-27.4	173.3	-77.4	-57.4	0	0	0	113.3	F933 L937 I940 V941 I944 G956 L957 C958 V963 I964 F978 M982	F933-F960 HydrophobicContact CE1-CE1 4.35Å; L937-F960 HydrophobicContact CD1-CE1 3.87Å; L937-F960 HydrophobicContact CD1-CZ 3.96Å; I940-F960 HydrophobicContact CB-CZ 4.4Å; I940-F960 HydrophobicContact CG2-CD2 4.12Å; I940-F960 HydrophobicContact CG2-CE1 4.5Å; I940-F960 HydrophobicContact CG2-CE2 3.62Å; I940-F960 HydrophobicContact CG2-CZ 3.84Å; V941-F960 HydrophobicContact CG2-CE2 4.36Å; V941-F960 HydrophobicContact CG2-CZ 3.88Å; I944-F960 HydrophobicContact CD1-CD2 4.02Å; I944-F960 HydrophobicContact CD1-CE2 3.62Å; I944-F960 HydrophobicContact CG1-CE2 4.33Å; I944-F960 HydrophobicContact CG2-CD2 4.4Å; G956-F960 WeakPolarHBondContact O-CD2 3.27Å; G956-F960 PolarHBondContact O-N 3.41Å; L957-F960 CarbonylContact O-C 3.44Å; L957-F960 WeakPolarHBondContact O-CA 3.25Å; L957-F960 WeakPolarHBondContact O-CB 3.47Å; L957-F960 PolarHBondContact O-N 3.21Å; C958-F960 VanDerWaalsContact C-N 3.28Å; C958-F960 PolarHBondContact O-N 2.93Å; F960-V963 WeakPolarHBondContact O-CB 3.23Å; F960-V963 PolarHBondContact O-N 3.49Å; F960-I964 VanDerWaalsContact O-CG1 3.3Å; F960-I964 WeakPolarHBondContact O-CG1 3.37Å; F960-I964 PolarHBondContact O-N 2.62Å; F960-F978 HydrophobicContact CB-CB 3.85Å; F960-F978 HydrophobicContact CB-CD1 4.37Å; F960-F978 HydrophobicContact CB-CD2 4.37Å; F960-F978 HydrophobicContact CB-CG 3.96Å; F960-F978 HydrophobicContact CD1-CB 3.73Å; F960-F978 AromaticContact CD1-CD1 3.33Å; F960-F978 HydrophobicContact CD1-CD1 3.33Å; F960-F978 HydrophobicContact CD1-CE1 4.1Å; F960-F978 AromaticContact CD1-CG 3.71Å; F960-F978 HydrophobicContact CD1-CG 3.71Å; F960-F978 HydrophobicContact CD2-CB 3.44Å; F960-F978 VanDerWaalsContact CD2-CB 3.44Å; F960-F978 HydrophobicContact CD2-CG 4.3Å; F960-F978 HydrophobicContact CE1-CB 4.1Å; F960-F978 AromaticContact CE1-CD1 3.65Å; F960-F978 HydrophobicContact CE1-CD1 3.65Å; F960-F978 HydrophobicContact CE1-CG 4.26Å; F960-F978 HydrophobicContact CE2-CB 3.84Å; F960-F978 HydrophobicContact CG-CB 3.39Å; F960-F978 AromaticContact CG-CD1 3.89Å; F960-F978 HydrophobicContact CG-CD1 3.89Å; F960-F978 AromaticContact CG-CG 3.74Å; F960-F978 HydrophobicContact CG-CG 3.74Å; F960-F978 HydrophobicContact CZ-CB 4.15Å; F960-F978 HydrophobicContact CZ-CD1 4.43Å; F960-M982 HydrophobicContact CB-CE 4.37Å
961	D	98.7	Very high	98.4	Very high	4 Å²	4	16.8 Å²	16.8	2%	0.021	9%	0.09	C	C	.	.	H	α-helix	trans	-64.4	-44.6	173.5	-59.2	-25.5	0	0	0	110.3	L957 C958 V963 I964 E965 M982 A996 Y999 G1000	L957-D961 PolarHBondContact O-N 3.39Å; C958-D961 WeakPolarHBondContact O-CB 3.24Å; C958-D961 PolarHBondContact O-N 3.47Å; D961-V963 VanDerWaalsContact C-N 3.33Å; D961-V963 PolarHBondContact O-N 2.92Å; D961-I964 CarbonylContact O-C 3.59Å; D961-I964 WeakPolarHBondContact O-CA 3.45Å; D961-I964 WeakPolarHBondContact O-CB 3.42Å; D961-I964 PolarHBondContact O-N 2.84Å; D961-E965 PolarHBondContact O-N 2.97Å; D961-M982 WeakPolarHBondContact OD1-CE 3.42Å; D961-A996 VanDerWaalsContact OD2-O 3.06Å; D961-Y999 HydrophobicContact CB-CD1 3.85Å; D961-Y999 HydrophobicContact CB-CE1 4.25Å; D961-G1000 WeakPolarHBondContact OD1-CA 3.47Å; D961-G1000 PolarHBondContact OD1-N 3.41Å
962	D	98.7	Very high	98.5	Very high	14 Å²	14	20 Å²	20	8%	0.075	10%	0.103	C	C	.	.	H	α-helix	trans	-59.7	-40.8	173	-69.4	-40.5	0	0	0	112.6	H919 F922 C958 I964 E965 H966	H919-D962 WeakPolarHBondContact CB-OD2 3.23Å; H919-D962 IonicContact CE1-OD1 3.01Å; H919-D962 IonicContact CG-OD1 2.8Å; H919-D962 IonicContact CG-OD2 3.9Å; H919-D962 IonicContact ND1-OD1 3.19Å; H919-D962 PolarHBondContact ND1-OD1 3Å; H919-D962 IonicContact ND1-OD2 2.7Å; F922-D962 HydrophobicContact CB-CB 4.43Å; F922-D962 HydrophobicContact CD2-CB 3.59Å; F922-D962 HydrophobicContact CE2-CB 4.27Å; F922-D962 HydrophobicContact CG-CB 4.41Å; C958-D962 PolarHBondContact O-N 3.13Å; D962-I964 VanDerWaalsContact C-N 3.27Å; D962-I964 PolarHBondContact O-N 3.47Å; D962-E965 PolarHBondContact O-N 2.84Å; D962-H966 WeakPolarHBondContact O-CB 3.25Å; D962-H966 PolarHBondContact O-N 2.77Å
963	V	98.8	Very high	98.4	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.006	13%	0.132	C	C	.	.	H	α-helix	trans	-61.6	-36.2	174.1	167	0	0	0	0	110.9	F922 L930 F933 I959 F960 D961 C967 S971	F922-V963 HydrophobicContact CD1-CG2 4.48Å; F922-V963 HydrophobicContact CD2-CG2 4.34Å; F922-V963 HydrophobicContact CE1-CG2 3.9Å; F922-V963 HydrophobicContact CE2-CG2 3.7Å; F922-V963 HydrophobicContact CZ-CG2 3.46Å; F922-V963 VanDerWaalsContact CZ-CG2 3.46Å; L930-V963 HydrophobicContact CD2-CG1 4.04Å; F933-V963 HydrophobicContact CD1-CG2 4.44Å; F933-V963 HydrophobicContact CE1-CG2 4.06Å; F933-V963 HydrophobicContact CZ-CG2 4.43Å; I959-V963 WeakPolarHBondContact O-CG2 3.13Å; I959-V963 PolarHBondContact O-N 3.39Å; F960-V963 WeakPolarHBondContact O-CB 3.23Å; F960-V963 PolarHBondContact O-N 3.49Å; D961-V963 VanDerWaalsContact C-N 3.33Å; D961-V963 PolarHBondContact O-N 2.92Å; V963-C967 CarbonylContact O-C 3.49Å; V963-C967 WeakPolarHBondContact O-CA 3.1Å; V963-C967 VanDerWaalsContact O-CB 3.24Å; V963-C967 WeakPolarHBondContact O-CB 3.42Å; V963-C967 PolarHBondContact O-N 2.94Å; V963-S971 VanDerWaalsContact O-CB 3.25Å; V963-S971 WeakPolarHBondContact O-CB 3.41Å
964	I	98.7	Very high	98.4	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-73.8	-46.1	174.6	-62.9	164	0	0	0	111	F960 D961 D962 S968 F978 M982 V1003 M1004	F960-I964 VanDerWaalsContact O-CG1 3.3Å; F960-I964 WeakPolarHBondContact O-CG1 3.37Å; F960-I964 PolarHBondContact O-N 2.62Å; D961-I964 CarbonylContact O-C 3.59Å; D961-I964 WeakPolarHBondContact O-CA 3.45Å; D961-I964 WeakPolarHBondContact O-CB 3.42Å; D961-I964 PolarHBondContact O-N 2.84Å; D962-I964 VanDerWaalsContact C-N 3.27Å; D962-I964 PolarHBondContact O-N 3.47Å; I964-S968 WeakPolarHBondContact O-CB 3.44Å; I964-S968 PolarHBondContact O-OG 2.78Å; I964-F978 HydrophobicContact CD1-CD2 4.1Å; I964-F978 HydrophobicContact CD1-CE2 3.56Å; I964-F978 HydrophobicContact CD1-CZ 4.32Å; I964-F978 HydrophobicContact CG1-CE2 3.7Å; I964-F978 HydrophobicContact CG1-CZ 3.94Å; I964-M982 HydrophobicContact CD1-CE 3.62Å; I964-M982 HydrophobicContact CD1-SD 3.81Å; I964-V1003 HydrophobicContact CB-CG2 4.07Å; I964-V1003 HydrophobicContact CG2-CB 4.49Å; I964-V1003 HydrophobicContact CG2-CG2 3.89Å; I964-M1004 HydrophobicContact CD1-CE 4.42Å; I964-M1004 VanDerWaalsContact CG2-CA 3.5Å; I964-M1004 HydrophobicContact CG2-CB 4.01Å
965	E	98.5	Very high	98.4	Very high	31 Å²	31	25 Å²	25	15%	0.145	13%	0.127	C	C	.	.	H	α-helix	trans	-68.9	-51	-175.2	178.3	151.9	-160.7	0	0	112.2	D961 D962 Y999 V1003 Y1007	D961-E965 PolarHBondContact O-N 2.97Å; D962-E965 PolarHBondContact O-N 2.84Å; E965-Y999 PolarHBondContact OE2-OH 2.78Å; E965-V1003 HydrophobicContact CB-CB 4.07Å; E965-V1003 HydrophobicContact CB-CG1 4.21Å; E965-V1003 HydrophobicContact CB-CG2 4.37Å; E965-V1003 HydrophobicContact CG-CG1 4.49Å; E965-V1003 WeakPolarHBondContact OE2-CG1 3.41Å; E965-Y1007 HydrophobicContact CB-CD2 4.16Å; E965-Y1007 HydrophobicContact CB-CE2 4.31Å; E965-Y1007 HydrophobicContact CG-CD2 3.7Å; E965-Y1007 HydrophobicContact CG-CE2 3.45Å; E965-Y1007 VanDerWaalsContact CG-CE2 3.45Å; E965-Y1007 HydrophobicContact CG-CG 4.42Å; E965-Y1007 WeakPolarHBondContact OE1-CE2 3.48Å; E965-Y1007 PolarHBondContact OE1-OH 2.87Å
966	H	98.4	Very high	98.3	Very high	39 Å²	39	29.6 Å²	29.6	18%	0.181	15%	0.15	C	C	.	.	H	α-helix	trans	-94.7	-25.1	-170.6	-56.9	-44	0	0	0	113.7	H919 F922 K926 D962	H919-H966 AromaticContact CE1-NE2 3.3Å; H919-H966 PolarHBondContact CE1-NE2 2.99Å; H919-H966 VanDerWaalsContact CE1-NE2 3.3Å; H919-H966 AromaticContact ND1-NE2 3.68Å; F922-H966 HydrophobicContact CB-CB 4.11Å; F922-H966 WeakPolarHBondContact O-CB 3.4Å; K926-H966 WeakPolarHBondContact CA-O 3.47Å; K926-H966 VanDerWaalsContact CB-O 3.24Å; K926-H966 WeakPolarHBondContact CB-O 3.35Å; D962-H966 WeakPolarHBondContact O-CB 3.25Å; D962-H966 PolarHBondContact O-N 2.77Å
967	C	98.4	Very high	98.3	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-113.4	16.7	-173.7	-49	0	0	0	0	114	K926 L930 V963 S970 S971	K926-C967 VanDerWaalsContact C-SG 3.54Å; K926-C967 PolarHBondContact O-SG 2.9Å; L930-C967 HydrophobicContact CD1-CB 3.87Å; L930-C967 HydrophobicContact CD2-CB 3.71Å; L930-C967 HydrophobicContact CG-CB 3.88Å; V963-C967 CarbonylContact O-C 3.49Å; V963-C967 WeakPolarHBondContact O-CA 3.1Å; V963-C967 VanDerWaalsContact O-CB 3.24Å; V963-C967 WeakPolarHBondContact O-CB 3.42Å; V963-C967 PolarHBondContact O-N 2.94Å; C967-S970 PolarHBondContact O-N 2.76Å; C967-S971 PolarHBondContact O-N 3.29Å
968	S	97.8	Very high	98.3	Very high	17 Å²	17	32.6 Å²	32.6	12%	0.119	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	149.4	169.1	-72.8	0	0	0	0	112.9	I964 S971 Y1007 G1008	I964-S968 WeakPolarHBondContact O-CB 3.44Å; I964-S968 PolarHBondContact O-OG 2.78Å; S968-S971 WeakPolarHBondContact OG-CB 3.4Å; S968-S971 PolarHBondContact OG-OG 2.8Å; S968-Y1007 VanDerWaalsContact CB-O 3.28Å; S968-Y1007 WeakPolarHBondContact CB-O 3.34Å; S968-G1008 WeakPolarHBondContact OG-CA 3.34Å
969	P	97.6	Very high	98.2	Very high	77 Å²	77	31.7 Å²	31.7	50%	0.5	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	cis	-83.7	-6.4	6.2	33.9	-37.2	0	0	0	115.2	S971 F972	P969-S971 PolarHBondContact O-N 3.13Å; P969-F972 PolarHBondContact O-N 3.29Å
970	S	98.3	Very high	98.2	Very high	22 Å²	22	37.7 Å²	37.7	15%	0.154	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-61.3	-24.9	179.6	-77	0	0	0	0	114.5	E927 L930 C967 F972 K973	E927-S970 WeakPolarHBondContact OE2-CB 3.42Å; E927-S970 PolarHBondContact OE2-N 3.33Å; E927-S970 VanDerWaalsContact OE2-N 3.07Å; E927-S970 PolarHBondContact OE2-OG 3.35Å; L930-S970 VanDerWaalsContact CD1-CB 3.45Å; C967-S970 PolarHBondContact O-N 2.76Å; S970-F972 PolarHBondContact O-N 2.72Å; S970-K973 WeakPolarHBondContact O-CB 3.33Å; S970-K973 WeakPolarHBondContact O-CD 3.16Å; S970-K973 VanDerWaalsContact O-CG 3.32Å; S970-K973 WeakPolarHBondContact O-CG 3.5Å; S970-K973 PolarHBondContact O-N 2.69Å; S970-K973 PolarHBondContact OG-NZ 2.79Å
971	S	98.2	Very high	98.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-43.6	-37.4	171.8	67.3	0	0	0	0	113.7	V963 C967 S968 P969 K973 Y974 Y1012	V963-S971 VanDerWaalsContact O-CB 3.25Å; V963-S971 WeakPolarHBondContact O-CB 3.41Å; C967-S971 PolarHBondContact O-N 3.29Å; S968-S971 WeakPolarHBondContact OG-CB 3.4Å; S968-S971 PolarHBondContact OG-OG 2.8Å; P969-S971 PolarHBondContact O-N 3.13Å; S971-K973 PolarHBondContact O-N 2.99Å; S971-K973 VanDerWaalsContact O-N 3.09Å; S971-Y974 PolarHBondContact O-N 3.09Å; S971-Y1012 PolarHBondContact OG-OH 3.03Å
972	F	98.3	Very high	98.1	Very high	71 Å²	71	39 Å²	39	31%	0.311	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-63.4	-19.8	-177.1	-166.3	-92.3	0	0	0	113.5	P969 S970 Y974 A975 L979 S1011 Y1012 F1015	P969-F972 PolarHBondContact O-N 3.29Å; S970-F972 PolarHBondContact O-N 2.72Å; F972-Y974 PolarHBondContact O-N 2.89Å; F972-A975 HydrophobicContact CD2-CB 4.06Å; F972-A975 HydrophobicContact CE2-CB 4.26Å; F972-A975 HydrophobicContact CG-CB 4.33Å; F972-A975 VanDerWaalsContact O-CB 3.29Å; F972-A975 WeakPolarHBondContact O-CB 3.38Å; F972-A975 PolarHBondContact O-N 3.31Å; F972-L979 HydrophobicContact CE2-CD2 4.37Å; F972-S1011 VanDerWaalsContact CD2-CB 3.4Å; F972-S1011 WeakPolarHBondContact CE2-O 3.49Å; F972-S1011 VanDerWaalsContact CG-CB 3.45Å; F972-Y1012 WeakPolarHBondContact CA-OH 3.34Å; F972-Y1012 HydrophobicContact CB-CE2 3.98Å; F972-Y1012 AromaticContact CD2-CD1 3.77Å; F972-Y1012 HydrophobicContact CD2-CD1 3.77Å; F972-Y1012 AromaticContact CD2-CD2 3.89Å; F972-Y1012 HydrophobicContact CD2-CD2 3.89Å; F972-Y1012 AromaticContact CD2-CE1 3.63Å; F972-Y1012 HydrophobicContact CD2-CE1 3.63Å; F972-Y1012 AromaticContact CD2-CE2 3.76Å; F972-Y1012 HydrophobicContact CD2-CE2 3.76Å; F972-Y1012 AromaticContact CD2-CG 3.93Å; F972-Y1012 HydrophobicContact CD2-CG 3.93Å; F972-Y1012 AromaticContact CD2-CZ 3.64Å; F972-Y1012 HydrophobicContact CE2-CD1 4.03Å; F972-Y1012 HydrophobicContact CE2-CE1 4.22Å; F972-Y1012 HydrophobicContact CE2-CG 4.29Å; F972-Y1012 HydrophobicContact CG-CE2 4.37Å; F972-Y1012 PolarHBondContact N-OH 3.23Å; F972-F1015 HydrophobicContact CE2-CE2 4.15Å; F972-F1015 HydrophobicContact CZ-CE2 4.32Å
973	K	97.8	Very high	98.1	Very high	138 Å²	138	38.4 Å²	38.4	60%	0.6	18%	0.184	S	C	*	.	G	3₁₀ helix	trans	-59.5	-30.4	171.1	-65.6	166	-176.4	155.1	0	112.1	S970 S971	S970-K973 WeakPolarHBondContact O-CB 3.33Å; S970-K973 WeakPolarHBondContact O-CD 3.16Å; S970-K973 VanDerWaalsContact O-CG 3.32Å; S970-K973 WeakPolarHBondContact O-CG 3.5Å; S970-K973 PolarHBondContact O-N 2.69Å; S970-K973 PolarHBondContact OG-NZ 2.79Å; S971-K973 PolarHBondContact O-N 2.99Å; S971-K973 VanDerWaalsContact O-N 3.09Å
974	Y	98.1	Very high	98	Very high	22 Å²	22	43.9 Å²	43.9	9%	0.086	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-102.9	7	-178	-50.7	-82.6	0	0	0	112.2	L930 E934 L937 S971 F972 E976 Y977 F978	L930-Y974 HydrophobicContact CB-CE2 3.93Å; L930-Y974 HydrophobicContact CD1-CE2 4.04Å; L930-Y974 HydrophobicContact CD2-CD2 4.37Å; L930-Y974 HydrophobicContact CD2-CE2 4.12Å; L930-Y974 HydrophobicContact CG-CE2 4.26Å; E934-Y974 HydrophobicContact CG-CE1 3.79Å; E934-Y974 WeakPolarHBondContact OE1-CE1 3.33Å; E934-Y974 PolarHBondContact OE1-OH 2.71Å; L937-Y974 HydrophobicContact CD2-CD1 3.86Å; L937-Y974 HydrophobicContact CD2-CE1 4.35Å; S971-Y974 PolarHBondContact O-N 3.09Å; F972-Y974 PolarHBondContact O-N 2.89Å; Y974-E976 PolarHBondContact O-N 2.81Å; Y974-E976 VanDerWaalsContact O-N 3.09Å; Y974-Y977 HydrophobicContact CD1-CD2 4.44Å; Y974-Y977 HydrophobicContact CD1-CE2 4.37Å; Y974-Y977 WeakPolarHBondContact O-CB 3.1Å; Y974-Y977 VanDerWaalsContact O-CD2 3.31Å; Y974-Y977 WeakPolarHBondContact O-CD2 3.32Å; Y974-Y977 PolarHBondContact O-N 3.17Å; Y974-F978 VanDerWaalsContact C-CE1 3.45Å; Y974-F978 WeakPolarHBondContact O-CD1 3.23Å; Y974-F978 VanDerWaalsContact O-CE1 3.23Å; Y974-F978 WeakPolarHBondContact O-CE1 3.29Å
975	A	97.4	Very high	98	Very high	10 Å²	10	44.5 Å²	44.5	8%	0.083	21%	0.214	C	C	.	.	H	α-helix	trans	-59.4	-23.9	-179.1	0	0	0	0	0	113.5	F972 Y977 F978 L979 Y1012	F972-A975 HydrophobicContact CD2-CB 4.06Å; F972-A975 HydrophobicContact CE2-CB 4.26Å; F972-A975 HydrophobicContact CG-CB 4.33Å; F972-A975 VanDerWaalsContact O-CB 3.29Å; F972-A975 WeakPolarHBondContact O-CB 3.38Å; F972-A975 PolarHBondContact O-N 3.31Å; A975-Y977 PolarHBondContact O-N 3.3Å; A975-F978 HydrophobicContact CB-CZ 4.36Å; A975-L979 HydrophobicContact CB-CB 4.04Å; A975-L979 HydrophobicContact CB-CD2 3.91Å; A975-L979 WeakPolarHBondContact O-CB 3.41Å; A975-L979 PolarHBondContact O-N 3.49Å; A975-Y1012 HydrophobicContact CB-CE1 4.46Å
976	E	97.5	Very high	98	Very high	148 Å²	148	43 Å²	43	69%	0.692	21%	0.207	S	C	*	.	H	α-helix	trans	-60.2	-25.3	174.4	68	-179.6	172.2	0	0	113.5	Y974	Y974-E976 PolarHBondContact O-N 2.81Å; Y974-E976 VanDerWaalsContact O-N 3.09Å
977	Y	97.9	Very high	97.8	Very high	65 Å²	65	44.8 Å²	44.8	26%	0.255	22%	0.223	S	C	.	.	H	α-helix	trans	-83.4	-44.9	-177.4	-64.3	-70.1	0	0	0	112.8	L937 V941 I944 Y974 A975	L937-Y977 HydrophobicContact CD1-CD2 4.25Å; L937-Y977 HydrophobicContact CD1-CG 4.22Å; L937-Y977 HydrophobicContact CD2-CD2 3.91Å; L937-Y977 HydrophobicContact CD2-CE1 4.42Å; L937-Y977 HydrophobicContact CD2-CE2 3.77Å; L937-Y977 HydrophobicContact CD2-CG 4.38Å; L937-Y977 HydrophobicContact CG-CD2 4.43Å; L937-Y977 HydrophobicContact CG-CG 4.45Å; V941-Y977 HydrophobicContact CG2-CD1 3.66Å; V941-Y977 HydrophobicContact CG2-CG 3.95Å; I944-Y977 WeakPolarHBondContact CD1-O 3.16Å; Y974-Y977 HydrophobicContact CD1-CD2 4.44Å; Y974-Y977 HydrophobicContact CD1-CE2 4.37Å; Y974-Y977 WeakPolarHBondContact O-CB 3.1Å; Y974-Y977 VanDerWaalsContact O-CD2 3.31Å; Y974-Y977 WeakPolarHBondContact O-CD2 3.32Å; Y974-Y977 PolarHBondContact O-N 3.17Å; A975-Y977 PolarHBondContact O-N 3.3Å
978	F	98.1	Very high	97.8	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-116.2	-27.7	-168	63.6	-97.9	0	0	0	115.4	I944 F960 I964 Y974 A975 R980 P981 M982 Y1012	I944-F978 HydrophobicContact CD1-CB 4.3Å; F960-F978 HydrophobicContact CB-CB 3.85Å; F960-F978 HydrophobicContact CB-CD1 4.37Å; F960-F978 HydrophobicContact CB-CD2 4.37Å; F960-F978 HydrophobicContact CB-CG 3.96Å; F960-F978 HydrophobicContact CD1-CB 3.73Å; F960-F978 AromaticContact CD1-CD1 3.33Å; F960-F978 HydrophobicContact CD1-CD1 3.33Å; F960-F978 HydrophobicContact CD1-CE1 4.1Å; F960-F978 AromaticContact CD1-CG 3.71Å; F960-F978 HydrophobicContact CD1-CG 3.71Å; F960-F978 HydrophobicContact CD2-CB 3.44Å; F960-F978 VanDerWaalsContact CD2-CB 3.44Å; F960-F978 HydrophobicContact CD2-CG 4.3Å; F960-F978 HydrophobicContact CE1-CB 4.1Å; F960-F978 AromaticContact CE1-CD1 3.65Å; F960-F978 HydrophobicContact CE1-CD1 3.65Å; F960-F978 HydrophobicContact CE1-CG 4.26Å; F960-F978 HydrophobicContact CE2-CB 3.84Å; F960-F978 HydrophobicContact CG-CB 3.39Å; F960-F978 AromaticContact CG-CD1 3.89Å; F960-F978 HydrophobicContact CG-CD1 3.89Å; F960-F978 AromaticContact CG-CG 3.74Å; F960-F978 HydrophobicContact CG-CG 3.74Å; F960-F978 HydrophobicContact CZ-CB 4.15Å; F960-F978 HydrophobicContact CZ-CD1 4.43Å; I964-F978 HydrophobicContact CD1-CD2 4.1Å; I964-F978 HydrophobicContact CD1-CE2 3.56Å; I964-F978 HydrophobicContact CD1-CZ 4.32Å; I964-F978 HydrophobicContact CG1-CE2 3.7Å; I964-F978 HydrophobicContact CG1-CZ 3.94Å; Y974-F978 VanDerWaalsContact C-CE1 3.45Å; Y974-F978 WeakPolarHBondContact O-CD1 3.23Å; Y974-F978 VanDerWaalsContact O-CE1 3.23Å; Y974-F978 WeakPolarHBondContact O-CE1 3.29Å; A975-F978 HydrophobicContact CB-CZ 4.36Å; F978-R980 PolarHBondContact O-N 3.05Å; F978-P981 WeakPolarHBondContact O-CD 3.45Å; F978-M982 HydrophobicContact CD2-CE 4.14Å; F978-M982 WeakPolarHBondContact O-CB 3.41Å; F978-M982 PolarHBondContact O-N 3.32Å; F978-Y1012 HydrophobicContact CE2-CE1 4.37Å; F978-Y1012 WeakPolarHBondContact CZ-OH 3.48Å
979	L	97.9	Very high	97.8	Very high	7 Å²	7	51.5 Å²	51.5	4%	0.037	26%	0.262	C	S	.	.	H	α-helix	trans	-64.9	-39.6	-165.8	179.9	57.1	0	0	0	112.6	F972 A975 L983 M1004 Y1012 F1015	F972-L979 HydrophobicContact CE2-CD2 4.37Å; A975-L979 HydrophobicContact CB-CB 4.04Å; A975-L979 HydrophobicContact CB-CD2 3.91Å; A975-L979 WeakPolarHBondContact O-CB 3.41Å; A975-L979 PolarHBondContact O-N 3.49Å; L979-L983 WeakPolarHBondContact O-CG 3.38Å; L979-L983 PolarHBondContact O-N 3.44Å; L979-M1004 HydrophobicContact CD1-CE 3.3Å; L979-M1004 HydrophobicContact CD1-SD 3.8Å; L979-Y1012 HydrophobicContact CD1-CD1 4.04Å; L979-Y1012 HydrophobicContact CD1-CE1 4.15Å; L979-Y1012 HydrophobicContact CD2-CD1 4.13Å; L979-Y1012 HydrophobicContact CD2-CE1 4.21Å; L979-F1015 HydrophobicContact CD1-CB 4.22Å; L979-F1015 HydrophobicContact CD1-CG 4.26Å; L979-F1015 HydrophobicContact CD2-CD1 3.89Å; L979-F1015 HydrophobicContact CD2-CD2 3.65Å; L979-F1015 HydrophobicContact CD2-CE1 3.9Å; L979-F1015 HydrophobicContact CD2-CE2 3.66Å; L979-F1015 HydrophobicContact CD2-CG 3.74Å; L979-F1015 HydrophobicContact CD2-CZ 3.78Å; L979-F1015 HydrophobicContact CG-CD1 4.18Å; L979-F1015 HydrophobicContact CG-CE1 4.46Å; L979-F1015 HydrophobicContact CG-CG 4.23Å
980	R	97.8	Very high	97.8	Very high	125 Å²	125	48.4 Å²	48.4	47%	0.472	24%	0.242	S	C	.	.	H	α-helix	trans	-74.8	-46.7	178.3	-169.8	59.6	177	-172.5	10.9	112.8	F978 M982 L983 Q984 E1018	F978-R980 PolarHBondContact O-N 3.05Å; R980-M982 PolarHBondContact O-N 3.24Å; R980-L983 PolarHBondContact O-N 3.03Å; R980-Q984 WeakPolarHBondContact O-CG 3.41Å; R980-Q984 PolarHBondContact O-N 3.47Å; R980-Q984 VanDerWaalsContact O-N 3.16Å; R980-Q984 PolarHBondContact O-OE1 3.32Å; R980-E1018 IonicContact CZ-OE1 3.46Å; R980-E1018 IonicContact NH1-OE1 2.71Å; R980-E1018 PolarHBondContact NH1-OE1 2.87Å; R980-E1018 IonicContact NH1-OE2 2.66Å; R980-E1018 PolarHBondContact NH1-OE2 2.87Å; R980-E1018 VanDerWaalsContact NH1-OE2 3.08Å; R980-E1018 IonicContact NH2-OE1 3.28Å; R980-E1018 PolarHBondContact NH2-OE1 3.28Å
981	P	98.1	Very high	97.8	Very high	31 Å²	31	48.3 Å²	48.3	20%	0.201	24%	0.241	C	C	.	.	H	α-helix	trans	-52.2	-48.5	169.5	-30.3	36.7	0	0	0	113.2	I944 F978 L983 Q984 S985	I944-P981 HydrophobicContact CD1-CB 4.03Å; I944-P981 HydrophobicContact CD1-CG 4.08Å; F978-P981 WeakPolarHBondContact O-CD 3.45Å; P981-L983 PolarHBondContact O-N 3.39Å; P981-Q984 CarbonylContact O-C 3.54Å; P981-Q984 WeakPolarHBondContact O-CA 3.46Å; P981-Q984 WeakPolarHBondContact O-CB 3.35Å; P981-Q984 PolarHBondContact O-N 3.5Å; P981-S985 WeakPolarHBondContact O-CB 3.09Å; P981-S985 PolarHBondContact O-N 2.93Å; P981-S985 PolarHBondContact O-OG 2.97Å
982	M	98.6	Very high	97.8	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-55.6	-49	179.1	-179.5	178.8	-74.1	0	0	112.8	L957 F960 D961 I964 F978 R980 Q984 S985 L986 A997 V1001 M1004	L957-M982 HydrophobicContact CD2-CB 3.89Å; L957-M982 HydrophobicContact CD2-CE 4.26Å; L957-M982 HydrophobicContact CD2-CG 4.29Å; F960-M982 HydrophobicContact CB-CE 4.37Å; D961-M982 WeakPolarHBondContact OD1-CE 3.42Å; I964-M982 HydrophobicContact CD1-CE 3.62Å; I964-M982 HydrophobicContact CD1-SD 3.81Å; F978-M982 HydrophobicContact CD2-CE 4.14Å; F978-M982 WeakPolarHBondContact O-CB 3.41Å; F978-M982 PolarHBondContact O-N 3.32Å; R980-M982 PolarHBondContact O-N 3.24Å; M982-Q984 VanDerWaalsContact C-N 3.26Å; M982-Q984 PolarHBondContact O-N 2.9Å; M982-S985 PolarHBondContact O-N 3.44Å; M982-L986 PolarHBondContact O-N 3.49Å; M982-A997 WeakPolarHBondContact O-CB 3.31Å; M982-V1001 HydrophobicContact CG-CG2 4.43Å; M982-M1004 HydrophobicContact SD-CE 3.75Å
983	L	98.3	Very high	97.8	Very high	3 Å²	3	48 Å²	48	2%	0.016	24%	0.241	C	C	.	.	H	α-helix	trans	-62.9	-31.1	176.2	-69.9	173.5	0	0	0	113.2	L979 R980 P981 L986 V1001 F1015 A1019 L1022	L979-L983 WeakPolarHBondContact O-CG 3.38Å; L979-L983 PolarHBondContact O-N 3.44Å; R980-L983 PolarHBondContact O-N 3.03Å; P981-L983 PolarHBondContact O-N 3.39Å; L983-L986 HydrophobicContact CD2-CD1 4.41Å; L983-V1001 HydrophobicContact CD2-CG2 4.06Å; L983-F1015 HydrophobicContact CD1-CB 4.21Å; L983-F1015 HydrophobicContact CD1-CD1 3.93Å; L983-A1019 HydrophobicContact CD2-CB 3.62Å; L983-L1022 WeakPolarHBondContact O-CD1 3.5Å
984	Q	97.2	Very high	97.8	Very high	115 Å²	115	42.8 Å²	42.8	54%	0.537	22%	0.217	S	C	.	.	H	α-helix	trans	-74.8	-38.2	176	-69.3	171	-43.3	0	0	111.5	R980 P981 M982 L986 C987	R980-Q984 WeakPolarHBondContact O-CG 3.41Å; R980-Q984 PolarHBondContact O-N 3.47Å; R980-Q984 VanDerWaalsContact O-N 3.16Å; R980-Q984 PolarHBondContact O-OE1 3.32Å; P981-Q984 CarbonylContact O-C 3.54Å; P981-Q984 WeakPolarHBondContact O-CA 3.46Å; P981-Q984 WeakPolarHBondContact O-CB 3.35Å; P981-Q984 PolarHBondContact O-N 3.5Å; M982-Q984 VanDerWaalsContact C-N 3.26Å; M982-Q984 PolarHBondContact O-N 2.9Å; Q984-L986 PolarHBondContact O-N 2.89Å; Q984-C987 PolarHBondContact O-N 2.86Å; Q984-C987 VanDerWaalsContact O-N 3.14Å
985	S	98.3	Very high	97.9	Very high	14 Å²	14	44.6 Å²	44.6	10%	0.098	23%	0.226	C	C	.	.	H	α-helix	trans	-67.3	-17.4	-179.5	-65.3	0	0	0	0	114.2	P981 M982 C987 D988	P981-S985 WeakPolarHBondContact O-CB 3.09Å; P981-S985 PolarHBondContact O-N 2.93Å; P981-S985 PolarHBondContact O-OG 2.97Å; M982-S985 PolarHBondContact O-N 3.44Å; S985-C987 PolarHBondContact O-N 2.83Å; S985-C987 VanDerWaalsContact O-N 3.08Å; S985-D988 WeakPolarHBondContact O-CB 3.35Å; S985-D988 PolarHBondContact O-N 2.99Å
986	L	97.9	Very high	97.9	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-27.9	167	-68.8	178.7	0	0	0	112.8	M982 L983 Q984 R994 A997 A998 V1001 A1019 L1022 L1023 V1026	M982-L986 PolarHBondContact O-N 3.49Å; L983-L986 HydrophobicContact CD2-CD1 4.41Å; Q984-L986 PolarHBondContact O-N 2.89Å; L986-R994 WeakPolarHBondContact O-CD 3.3Å; L986-R994 WeakPolarHBondContact O-CG 3.29Å; L986-A997 HydrophobicContact CD2-CB 3.93Å; L986-A997 WeakPolarHBondContact CD2-O 3.02Å; L986-A997 HydrophobicContact CG-CB 4.32Å; L986-A998 HydrophobicContact CD2-CB 4.1Å; L986-V1001 HydrophobicContact CD1-CG2 4.3Å; L986-V1001 HydrophobicContact CD2-CG2 4.35Å; L986-A1019 HydrophobicContact CD1-CB 4.32Å; L986-L1022 HydrophobicContact CB-CB 4.33Å; L986-L1022 HydrophobicContact CD1-CB 3.7Å; L986-L1022 HydrophobicContact CD1-CD1 4.04Å; L986-L1023 HydrophobicContact CD1-CD2 4.33Å; L986-L1023 HydrophobicContact CD1-CG 4.31Å; L986-L1023 HydrophobicContact CD2-CD2 3.68Å; L986-V1026 WeakPolarHBondContact O-CG2 3.42Å
987	C	95.6	Very high	98	Very high	76 Å²	76	37.3 Å²	37.3	51%	0.514	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.7	23.1	178.6	-58.3	0	0	0	0	113	Q984 S985	Q984-C987 PolarHBondContact O-N 2.86Å; Q984-C987 VanDerWaalsContact O-N 3.14Å; S985-C987 PolarHBondContact O-N 2.83Å; S985-C987 VanDerWaalsContact O-N 3.08Å
988	D	97.9	Very high	98	Very high	28 Å²	28	34.2 Å²	34.2	15%	0.15	18%	0.179	C	C	.	.			trans	-63.1	157.5	172.9	-162	-68.2	0	0	0	111.2	R953 S985 S990 V993 R994	R953-D988 IonicContact CZ-OD2 2.99Å; R953-D988 VanDerWaalsContact CZ-OD2 3.3Å; R953-D988 IonicContact NE-OD2 2.65Å; R953-D988 PolarHBondContact NE-OD2 3.44Å; R953-D988 IonicContact NH2-OD1 3.73Å; R953-D988 PolarHBondContact NH2-OD1 3.4Å; R953-D988 IonicContact NH2-OD2 3Å; R953-D988 PolarHBondContact NH2-OD2 3.02Å; S985-D988 WeakPolarHBondContact O-CB 3.35Å; S985-D988 PolarHBondContact O-N 2.99Å; D988-S990 PolarHBondContact OD1-N 3.4Å; D988-V993 HydrophobicContact CB-CB 3.97Å; D988-V993 HydrophobicContact CB-CG1 3.57Å; D988-V993 WeakPolarHBondContact OD2-CG1 3.23Å; D988-R994 HydrophobicContact CB-CG 4.26Å; D988-R994 VanDerWaalsContact O-CD 3.24Å; D988-R994 WeakPolarHBondContact O-CD 3.47Å; D988-R994 WeakPolarHBondContact O-CG 3.19Å; D988-R994 PolarHBondContact O-NH1 3.09Å
989	T	96.3	Very high	98	Very high	130 Å²	130	36.8 Å²	36.8	80%	0.798	19%	0.189	S	C	*	.	S	Bend	trans	-70.7	-34.1	174.6	44.4	0	0	0	0	113.5	R994	T989-R994 VanDerWaalsContact C-NH1 3.28Å; T989-R994 PolarHBondContact O-NH1 3.05Å
990	S	97.9	Very high	98.1	Very high	11 Å²	11	36.4 Å²	36.4	8%	0.077	19%	0.188	C	C	.	.	S	Bend	trans	-76.2	130.3	177.1	147	0	0	0	0	110.6	D988 E992 V993 R994	D988-S990 PolarHBondContact OD1-N 3.4Å; S990-E992 VanDerWaalsContact C-N 3.29Å; S990-E992 WeakPolarHBondContact CB-OE2 3.48Å; S990-E992 PolarHBondContact O-N 3.07Å; S990-E992 PolarHBondContact OG-N 3.47Å; S990-E992 PolarHBondContact OG-OE2 3.12Å; S990-V993 WeakPolarHBondContact OG-CG2 3.27Å; S990-V993 PolarHBondContact OG-N 2.83Å; S990-R994 WeakPolarHBondContact O-CG 3.33Å; S990-R994 PolarHBondContact O-N 2.9Å; S990-R994 PolarHBondContact O-NH1 2.94Å
991	P	98.1	Very high	98.1	Very high	20 Å²	20	30.5 Å²	30.5	13%	0.13	17%	0.165	C	C	.	.	H	α-helix	trans	-62.2	-36.4	173	22.7	-29.1	0	0	0	112.4	R994 Q995 E1036 A1040	P991-R994 CarbonylContact O-C 3.59Å; P991-R994 WeakPolarHBondContact O-CB 3.43Å; P991-R994 PolarHBondContact O-N 2.76Å; P991-Q995 WeakPolarHBondContact O-CB 3.44Å; P991-Q995 PolarHBondContact O-N 2.81Å; P991-E1036 VanDerWaalsContact CB-O 3.29Å; P991-E1036 WeakPolarHBondContact CB-O 3.39Å; P991-E1036 WeakPolarHBondContact CG-O 3.13Å; P991-A1040 HydrophobicContact CB-CB 4.17Å; P991-A1040 WeakPolarHBondContact O-CB 3.49Å
992	E	98.3	Very high	98.1	Very high	66 Å²	66	29 Å²	29	31%	0.308	16%	0.156	S	C	.	.	H	α-helix	trans	-64.6	-43.4	-179.2	-51.7	79.3	-168.9	0	0	111.5	W950 Q954 S990 Q995 A996	W950-E992 HydrophobicContact CE3-CB 4Å; W950-E992 HydrophobicContact CE3-CG 4.21Å; W950-E992 HydrophobicContact CH2-CG 4.21Å; W950-E992 HydrophobicContact CZ3-CB 3.65Å; W950-E992 HydrophobicContact CZ3-CG 3.53Å; Q954-E992 HydrophobicContact CG-CB 4.17Å; S990-E992 VanDerWaalsContact C-N 3.29Å; S990-E992 WeakPolarHBondContact CB-OE2 3.48Å; S990-E992 PolarHBondContact O-N 3.07Å; S990-E992 PolarHBondContact OG-N 3.47Å; S990-E992 PolarHBondContact OG-OE2 3.12Å; E992-Q995 WeakPolarHBondContact O-CB 3.42Å; E992-Q995 PolarHBondContact O-N 3.07Å; E992-A996 PolarHBondContact O-N 3.42Å; E992-A996 VanDerWaalsContact O-N 3.1Å
993	V	98.7	Very high	98.1	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-64.9	-39.3	173.9	176.8	0	0	0	0	111.5	W950 R953 Q954 L957 D988 S990 Q995 A997	W950-V993 HydrophobicContact CB-CG2 4.13Å; W950-V993 WeakPolarHBondContact O-CG2 3.44Å; R953-V993 HydrophobicContact CB-CG1 4.3Å; R953-V993 HydrophobicContact CB-CG2 3.94Å; Q954-V993 HydrophobicContact CB-CG2 4.2Å; L957-V993 HydrophobicContact CD1-CG1 3.97Å; D988-V993 HydrophobicContact CB-CB 3.97Å; D988-V993 HydrophobicContact CB-CG1 3.57Å; D988-V993 WeakPolarHBondContact OD2-CG1 3.23Å; S990-V993 WeakPolarHBondContact OG-CG2 3.27Å; S990-V993 PolarHBondContact OG-N 2.83Å; V993-Q995 VanDerWaalsContact C-N 3.33Å; V993-A997 VanDerWaalsContact O-CB 3.32Å; V993-A997 WeakPolarHBondContact O-CB 3.39Å; V993-A997 PolarHBondContact O-N 3.06Å; V993-A997 VanDerWaalsContact O-N 3.1Å
994	R	98.6	Very high	98.1	Very high	28 Å²	28	28.9 Å²	28.9	11%	0.106	16%	0.155	C	C	.	.	H	α-helix	trans	-65.3	-36	173.4	-69.9	-166.8	-56.9	-85	1	112.3	L986 D988 T989 S990 P991 A998 N1037 A1040	L986-R994 WeakPolarHBondContact O-CD 3.3Å; L986-R994 WeakPolarHBondContact O-CG 3.29Å; D988-R994 HydrophobicContact CB-CG 4.26Å; D988-R994 VanDerWaalsContact O-CD 3.24Å; D988-R994 WeakPolarHBondContact O-CD 3.47Å; D988-R994 WeakPolarHBondContact O-CG 3.19Å; D988-R994 PolarHBondContact O-NH1 3.09Å; T989-R994 VanDerWaalsContact C-NH1 3.28Å; T989-R994 PolarHBondContact O-NH1 3.05Å; S990-R994 WeakPolarHBondContact O-CG 3.33Å; S990-R994 PolarHBondContact O-N 2.9Å; S990-R994 PolarHBondContact O-NH1 2.94Å; P991-R994 CarbonylContact O-C 3.59Å; P991-R994 WeakPolarHBondContact O-CB 3.43Å; P991-R994 PolarHBondContact O-N 2.76Å; R994-A998 VanDerWaalsContact O-CB 3.23Å; R994-A998 WeakPolarHBondContact O-CB 3.44Å; R994-A998 PolarHBondContact O-N 2.74Å; R994-N1037 PolarHBondContact NH2-OD1 3.05Å; R994-A1040 HydrophobicContact CB-CB 4.14Å
995	Q	98.7	Very high	98.1	Very high	59 Å²	59	23.4 Å²	23.4	28%	0.276	13%	0.129	S	C	.	.	H	α-helix	trans	-64.2	-53	179.5	-174.9	174.5	-18.4	0	0	110.9	P991 E992 V993 A997 A998 Y999 N1039 A1040 N1043	P991-Q995 WeakPolarHBondContact O-CB 3.44Å; P991-Q995 PolarHBondContact O-N 2.81Å; E992-Q995 WeakPolarHBondContact O-CB 3.42Å; E992-Q995 PolarHBondContact O-N 3.07Å; V993-Q995 VanDerWaalsContact C-N 3.33Å; Q995-A997 PolarHBondContact O-N 2.98Å; Q995-A998 PolarHBondContact O-N 2.9Å; Q995-Y999 WeakPolarHBondContact O-CB 3.15Å; Q995-Y999 PolarHBondContact O-N 2.78Å; Q995-N1039 VanDerWaalsContact OE1-CB 3.23Å; Q995-A1040 HydrophobicContact CB-CB 4.02Å; Q995-N1043 HydrophobicContact CG-CB 4.09Å; Q995-N1043 PolarHBondContact NE2-ND2 3.15Å
996	A	98.6	Very high	98.1	Very high	6 Å²	6	24.2 Å²	24.2	5%	0.05	13%	0.132	C	C	.	.	H	α-helix	trans	-56.8	-51.5	175.4	0	0	0	0	0	111.1	L957 D961 E992 A998 Y999 G1000	L957-A996 HydrophobicContact CB-CB 3.76Å; L957-A996 HydrophobicContact CD1-CB 4.37Å; D961-A996 VanDerWaalsContact OD2-O 3.06Å; E992-A996 PolarHBondContact O-N 3.42Å; E992-A996 VanDerWaalsContact O-N 3.1Å; A996-A998 VanDerWaalsContact C-N 3.26Å; A996-A998 PolarHBondContact O-N 3.11Å; A996-A998 VanDerWaalsContact O-N 3.16Å; A996-Y999 WeakPolarHBondContact O-CB 3.48Å; A996-Y999 PolarHBondContact O-N 3.18Å; A996-Y999 VanDerWaalsContact O-N 3.09Å; A996-G1000 PolarHBondContact O-N 3.38Å
997	A	98.8	Very high	98.1	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-56.2	-37.4	177.8	0	0	0	0	0	114	L957 M982 L986 V993 Q995 V1001	L957-A997 HydrophobicContact CD1-CB 4.19Å; M982-A997 WeakPolarHBondContact O-CB 3.31Å; L986-A997 HydrophobicContact CD2-CB 3.93Å; L986-A997 WeakPolarHBondContact CD2-O 3.02Å; L986-A997 HydrophobicContact CG-CB 4.32Å; V993-A997 VanDerWaalsContact O-CB 3.32Å; V993-A997 WeakPolarHBondContact O-CB 3.39Å; V993-A997 PolarHBondContact O-N 3.06Å; V993-A997 VanDerWaalsContact O-N 3.1Å; Q995-A997 PolarHBondContact O-N 2.98Å; A997-V1001 WeakPolarHBondContact O-CG2 3.41Å; A997-V1001 PolarHBondContact O-N 2.9Å
998	A	98.8	Very high	98.1	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-72.4	-42.5	177.2	0	0	0	0	0	112.1	L986 R994 Q995 A996 V1001 G1002 L1023 N1043 C1044 A1047	L986-A998 HydrophobicContact CD2-CB 4.1Å; R994-A998 VanDerWaalsContact O-CB 3.23Å; R994-A998 WeakPolarHBondContact O-CB 3.44Å; R994-A998 PolarHBondContact O-N 2.74Å; Q995-A998 PolarHBondContact O-N 2.9Å; A996-A998 VanDerWaalsContact C-N 3.26Å; A996-A998 PolarHBondContact O-N 3.11Å; A996-A998 VanDerWaalsContact O-N 3.16Å; A998-V1001 PolarHBondContact O-N 3.33Å; A998-G1002 PolarHBondContact O-N 3.3Å; A998-L1023 HydrophobicContact CB-CD2 4.1Å; A998-N1043 HydrophobicContact CB-CB 4.06Å; A998-C1044 HydrophobicContact CB-CB 4.4Å; A998-C1044 VanDerWaalsContact CB-SG 3.51Å; A998-A1047 VanDerWaalsContact O-CB 3.29Å; A998-A1047 WeakPolarHBondContact O-CB 3.38Å
999	Y	98.7	Very high	97.9	Very high	53 Å²	53	24.6 Å²	24.6	21%	0.208	13%	0.127	C	C	.	.	H	α-helix	trans	-57.6	-51.6	174.2	-173.8	-93	0	0	0	110.9	D961 E965 Q995 A996 V1001 G1002 V1003 E1080	D961-Y999 HydrophobicContact CB-CD1 3.85Å; D961-Y999 HydrophobicContact CB-CE1 4.25Å; E965-Y999 PolarHBondContact OE2-OH 2.78Å; Q995-Y999 WeakPolarHBondContact O-CB 3.15Å; Q995-Y999 PolarHBondContact O-N 2.78Å; A996-Y999 WeakPolarHBondContact O-CB 3.48Å; A996-Y999 PolarHBondContact O-N 3.18Å; A996-Y999 VanDerWaalsContact O-N 3.09Å; Y999-V1001 VanDerWaalsContact C-N 3.33Å; Y999-V1001 PolarHBondContact O-N 3.23Å; Y999-G1002 CarbonylContact O-C 3.59Å; Y999-G1002 VanDerWaalsContact O-CA 3.3Å; Y999-G1002 WeakPolarHBondContact O-CA 3.38Å; Y999-G1002 PolarHBondContact O-N 3.44Å; Y999-V1003 HydrophobicContact CD1-CG1 4.09Å; Y999-V1003 HydrophobicContact CD1-CG2 4.46Å; Y999-V1003 HydrophobicContact CE1-CG1 3.6Å; Y999-V1003 HydrophobicContact CE1-CG2 4.45Å; Y999-V1003 HydrophobicContact CE2-CG1 4.48Å; Y999-V1003 PolarHBondContact O-N 3.41Å; Y999-E1080 WeakPolarHBondContact CE2-OE1 3.11Å
1000	G	98.4	Very high	97.9	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-49.2	-46.1	173.5	0	0	0	0	0	114.5	D961 A996 V1003 M1004	D961-G1000 WeakPolarHBondContact OD1-CA 3.47Å; D961-G1000 PolarHBondContact OD1-N 3.41Å; A996-G1000 PolarHBondContact O-N 3.38Å; G1000-V1003 VanDerWaalsContact O-CG2 3.28Å; G1000-V1003 WeakPolarHBondContact O-CG2 3.39Å; G1000-V1003 PolarHBondContact O-N 3.22Å; G1000-M1004 WeakPolarHBondContact O-CB 3.44Å; G1000-M1004 PolarHBondContact O-N 3.47Å
1001	V	98.5	Very high	97.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-67.9	-35.2	174.9	169.9	0	0	0	0	112.4	M982 L983 L986 A997 A998 Y999 M1004 A1005 A1019 L1023 L1051	M982-V1001 HydrophobicContact CG-CG2 4.43Å; L983-V1001 HydrophobicContact CD2-CG2 4.06Å; L986-V1001 HydrophobicContact CD1-CG2 4.3Å; L986-V1001 HydrophobicContact CD2-CG2 4.35Å; A997-V1001 WeakPolarHBondContact O-CG2 3.41Å; A997-V1001 PolarHBondContact O-N 2.9Å; A998-V1001 PolarHBondContact O-N 3.33Å; Y999-V1001 VanDerWaalsContact C-N 3.33Å; Y999-V1001 PolarHBondContact O-N 3.23Å; V1001-M1004 HydrophobicContact CG2-CE 4.23Å; V1001-A1005 PolarHBondContact O-N 3.33Å; V1001-A1005 VanDerWaalsContact O-N 3.14Å; V1001-A1019 HydrophobicContact CG1-CB 3.59Å; V1001-A1019 HydrophobicContact CG2-CB 4.27Å; V1001-L1023 HydrophobicContact CG1-CD1 3.91Å; V1001-L1051 HydrophobicContact CG1-CD1 4.39Å
1002	G	98.4	Very high	97.9	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-61.2	-52.3	172.4	0	0	0	0	0	112.3	A998 Y999 M1004 A1005 Q1006	A998-G1002 PolarHBondContact O-N 3.3Å; Y999-G1002 CarbonylContact O-C 3.59Å; Y999-G1002 VanDerWaalsContact O-CA 3.3Å; Y999-G1002 WeakPolarHBondContact O-CA 3.38Å; Y999-G1002 PolarHBondContact O-N 3.44Å; G1002-M1004 VanDerWaalsContact C-N 3.32Å; G1002-M1004 PolarHBondContact O-N 3.18Å; G1002-A1005 WeakPolarHBondContact O-CB 3.34Å; G1002-A1005 PolarHBondContact O-N 3.19Å; G1002-Q1006 PolarHBondContact O-N 3.19Å
1003	V	98.4	Very high	97.8	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.006	13%	0.126	C	C	.	.	H	α-helix	trans	-69.3	-29.7	179.6	-61.5	0	0	0	0	112.2	I964 E965 Y999 G1000 A1005 Q1006 Y1007 G1008	I964-V1003 HydrophobicContact CB-CG2 4.07Å; I964-V1003 HydrophobicContact CG2-CB 4.49Å; I964-V1003 HydrophobicContact CG2-CG2 3.89Å; E965-V1003 HydrophobicContact CB-CB 4.07Å; E965-V1003 HydrophobicContact CB-CG1 4.21Å; E965-V1003 HydrophobicContact CB-CG2 4.37Å; E965-V1003 HydrophobicContact CG-CG1 4.49Å; E965-V1003 WeakPolarHBondContact OE2-CG1 3.41Å; Y999-V1003 HydrophobicContact CD1-CG1 4.09Å; Y999-V1003 HydrophobicContact CD1-CG2 4.46Å; Y999-V1003 HydrophobicContact CE1-CG1 3.6Å; Y999-V1003 HydrophobicContact CE1-CG2 4.45Å; Y999-V1003 HydrophobicContact CE2-CG1 4.48Å; Y999-V1003 PolarHBondContact O-N 3.41Å; G1000-V1003 VanDerWaalsContact O-CG2 3.28Å; G1000-V1003 WeakPolarHBondContact O-CG2 3.39Å; G1000-V1003 PolarHBondContact O-N 3.22Å; V1003-A1005 PolarHBondContact O-N 3.04Å; V1003-Q1006 PolarHBondContact O-N 2.86Å; V1003-Y1007 HydrophobicContact CB-CD2 3.94Å; V1003-Y1007 HydrophobicContact CB-CE2 4.29Å; V1003-Y1007 HydrophobicContact CG1-CD2 4.34Å; V1003-Y1007 HydrophobicContact CG1-CE2 4.18Å; V1003-Y1007 PolarHBondContact O-N 2.98Å; V1003-G1008 PolarHBondContact O-N 3.12Å
1004	M	98.2	Very high	97.7	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-60.3	-42.4	169.9	-176.7	-167.3	-50.9	0	0	112.5	I964 L979 M982 G1000 V1001 G1002 G1008 Y1012 F1015	I964-M1004 HydrophobicContact CD1-CE 4.42Å; I964-M1004 VanDerWaalsContact CG2-CA 3.5Å; I964-M1004 HydrophobicContact CG2-CB 4.01Å; L979-M1004 HydrophobicContact CD1-CE 3.3Å; L979-M1004 HydrophobicContact CD1-SD 3.8Å; M982-M1004 HydrophobicContact SD-CE 3.75Å; G1000-M1004 WeakPolarHBondContact O-CB 3.44Å; G1000-M1004 PolarHBondContact O-N 3.47Å; V1001-M1004 HydrophobicContact CG2-CE 4.23Å; G1002-M1004 VanDerWaalsContact C-N 3.32Å; G1002-M1004 PolarHBondContact O-N 3.18Å; M1004-G1008 WeakPolarHBondContact O-CA 3.45Å; M1004-G1008 PolarHBondContact O-N 3.06Å; M1004-G1008 VanDerWaalsContact O-N 3.14Å; M1004-Y1012 HydrophobicContact CE-CD1 4.26Å; M1004-Y1012 VanDerWaalsContact CG-CB 3.47Å; M1004-Y1012 HydrophobicContact CG-CD1 3.38Å; M1004-Y1012 HydrophobicContact CG-CD2 4.06Å; M1004-Y1012 HydrophobicContact CG-CE1 4.03Å; M1004-Y1012 HydrophobicContact CG-CG 3.37Å; M1004-Y1012 HydrophobicContact SD-CD1 3.52Å; M1004-Y1012 VanDerWaalsContact SD-CD1 3.52Å; M1004-Y1012 HydrophobicContact SD-CE1 4.32Å; M1004-Y1012 HydrophobicContact SD-CG 3.99Å; M1004-F1015 HydrophobicContact SD-CB 4.28Å
1005	A	97.9	Very high	97.6	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-69.2	-38.2	174.8	0	0	0	0	0	112.3	V1001 G1002 V1003 L1051 F1054 R1055	V1001-A1005 PolarHBondContact O-N 3.33Å; V1001-A1005 VanDerWaalsContact O-N 3.14Å; G1002-A1005 WeakPolarHBondContact O-CB 3.34Å; G1002-A1005 PolarHBondContact O-N 3.19Å; V1003-A1005 PolarHBondContact O-N 3.04Å; A1005-L1051 HydrophobicContact CB-CD2 3.65Å; A1005-L1051 HydrophobicContact CB-CG 3.96Å; A1005-F1054 VanDerWaalsContact O-CB 3.29Å; A1005-F1054 WeakPolarHBondContact O-CB 3.44Å; A1005-R1055 HydrophobicContact CB-CG 4.33Å; A1005-R1055 PolarHBondContact O-NH1 3.23Å; A1005-R1055 PolarHBondContact O-NH2 3.22Å
1006	Q	97.9	Very high	97.6	Very high	31 Å²	31	28 Å²	28	15%	0.145	15%	0.145	C	C	.	.	H	α-helix	trans	-74.2	-56	-177.4	-172.5	160.2	-35.7	0	0	112	G1002 V1003 F1054	G1002-Q1006 PolarHBondContact O-N 3.19Å; V1003-Q1006 PolarHBondContact O-N 2.86Å; Q1006-F1054 HydrophobicContact CB-CD2 3.74Å; Q1006-F1054 HydrophobicContact CB-CE2 3.96Å; Q1006-F1054 HydrophobicContact CB-CG 4.33Å; Q1006-F1054 VanDerWaalsContact CD-CE2 3.47Å; Q1006-F1054 HydrophobicContact CG-CD2 3.77Å; Q1006-F1054 HydrophobicContact CG-CE1 4.36Å; Q1006-F1054 HydrophobicContact CG-CE2 3.51Å; Q1006-F1054 HydrophobicContact CG-CG 4.31Å; Q1006-F1054 HydrophobicContact CG-CZ 3.83Å
1007	Y	97.8	Very high	97.5	Very high	90 Å²	90	31.1 Å²	31.1	35%	0.353	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.2	-24.9	-168.3	-51	-76.4	0	0	0	114.8	E965 S968 V1003 G1009	E965-Y1007 HydrophobicContact CB-CD2 4.16Å; E965-Y1007 HydrophobicContact CB-CE2 4.31Å; E965-Y1007 HydrophobicContact CG-CD2 3.7Å; E965-Y1007 HydrophobicContact CG-CE2 3.45Å; E965-Y1007 VanDerWaalsContact CG-CE2 3.45Å; E965-Y1007 HydrophobicContact CG-CG 4.42Å; E965-Y1007 WeakPolarHBondContact OE1-CE2 3.48Å; E965-Y1007 PolarHBondContact OE1-OH 2.87Å; S968-Y1007 VanDerWaalsContact CB-O 3.28Å; S968-Y1007 WeakPolarHBondContact CB-O 3.34Å; V1003-Y1007 HydrophobicContact CB-CD2 3.94Å; V1003-Y1007 HydrophobicContact CB-CE2 4.29Å; V1003-Y1007 HydrophobicContact CG1-CD2 4.34Å; V1003-Y1007 HydrophobicContact CG1-CE2 4.18Å; V1003-Y1007 PolarHBondContact O-N 2.98Å; Y1007-G1009 PolarHBondContact O-N 2.91Å
1008	G	95.9	Very high	97.4	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.179	C	C	.	.	S	Bend	trans	-56.8	-21	-171	0	0	0	0	0	116.9	S968 V1003 M1004 Y1012	S968-G1008 WeakPolarHBondContact OG-CA 3.34Å; V1003-G1008 PolarHBondContact O-N 3.12Å; M1004-G1008 WeakPolarHBondContact O-CA 3.45Å; M1004-G1008 PolarHBondContact O-N 3.06Å; M1004-G1008 VanDerWaalsContact O-N 3.14Å; G1008-Y1012 WeakPolarHBondContact O-CD2 3.46Å; G1008-Y1012 WeakPolarHBondContact O-CE2 3.44Å
1009	G	94	Very high	97.3	Very high	21 Å²	21	34.5 Å²	34.5	22%	0.216	18%	0.179	C	C	.	.			trans	79.1	-163.9	-174.4	0	0	0	0	0	114.4	Y1007 R1055	Y1007-G1009 PolarHBondContact O-N 2.91Å; G1009-R1055 PolarHBondContact O-NE 3.04Å; G1009-R1055 PolarHBondContact O-NH2 2.99Å; G1009-R1055 VanDerWaalsContact O-NH2 3.14Å
1010	D	95.8	Very high	97.3	Very high	99 Å²	99	33.2 Å²	33.2	53%	0.529	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-72.7	-28.1	-169.8	-83.3	10	0	0	0	114.2	Y1012 R1013	D1010-Y1012 VanDerWaalsContact C-N 3.25Å; D1010-Y1012 PolarHBondContact O-N 3.05Å; D1010-R1013 WeakPolarHBondContact O-CB 3.32Å; D1010-R1013 VanDerWaalsContact O-CG 3.3Å; D1010-R1013 WeakPolarHBondContact O-CG 3.43Å; D1010-R1013 PolarHBondContact O-N 3.04Å; D1010-R1013 IonicContact OD1-CZ 2.71Å; D1010-R1013 IonicContact OD1-NH1 2.9Å; D1010-R1013 PolarHBondContact OD1-NH1 3.09Å; D1010-R1013 IonicContact OD1-NH2 2.71Å; D1010-R1013 PolarHBondContact OD1-NH2 3.48Å; D1010-R1013 IonicContact OD2-CZ 3.5Å; D1010-R1013 IonicContact OD2-NH1 3.27Å; D1010-R1013 PolarHBondContact OD2-NH1 3.05Å; D1010-R1013 IonicContact OD2-NH2 2.75Å
1011	S	97.4	Very high	97.2	Very high	60 Å²	60	37.1 Å²	37.1	42%	0.42	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-63.9	-29.3	-175	-54.3	0	0	0	0	113.3	F972 P1014	F972-S1011 VanDerWaalsContact CD2-CB 3.4Å; F972-S1011 WeakPolarHBondContact CE2-O 3.49Å; F972-S1011 VanDerWaalsContact CG-CB 3.45Å; S1011-P1014 WeakPolarHBondContact O-CD 3.23Å
1012	Y	97.8	Very high	97.2	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-82.2	-6.8	180	-66.4	-83.6	0	0	0	114.3	S971 F972 A975 F978 L979 M1004 G1008 D1010 P1014 F1015 C1016	S971-Y1012 PolarHBondContact OG-OH 3.03Å; F972-Y1012 WeakPolarHBondContact CA-OH 3.34Å; F972-Y1012 HydrophobicContact CB-CE2 3.98Å; F972-Y1012 AromaticContact CD2-CD1 3.77Å; F972-Y1012 HydrophobicContact CD2-CD1 3.77Å; F972-Y1012 AromaticContact CD2-CD2 3.89Å; F972-Y1012 HydrophobicContact CD2-CD2 3.89Å; F972-Y1012 AromaticContact CD2-CE1 3.63Å; F972-Y1012 HydrophobicContact CD2-CE1 3.63Å; F972-Y1012 AromaticContact CD2-CE2 3.76Å; F972-Y1012 HydrophobicContact CD2-CE2 3.76Å; F972-Y1012 AromaticContact CD2-CG 3.93Å; F972-Y1012 HydrophobicContact CD2-CG 3.93Å; F972-Y1012 AromaticContact CD2-CZ 3.64Å; F972-Y1012 HydrophobicContact CE2-CD1 4.03Å; F972-Y1012 HydrophobicContact CE2-CE1 4.22Å; F972-Y1012 HydrophobicContact CE2-CG 4.29Å; F972-Y1012 HydrophobicContact CG-CE2 4.37Å; F972-Y1012 PolarHBondContact N-OH 3.23Å; A975-Y1012 HydrophobicContact CB-CE1 4.46Å; F978-Y1012 HydrophobicContact CE2-CE1 4.37Å; F978-Y1012 WeakPolarHBondContact CZ-OH 3.48Å; L979-Y1012 HydrophobicContact CD1-CD1 4.04Å; L979-Y1012 HydrophobicContact CD1-CE1 4.15Å; L979-Y1012 HydrophobicContact CD2-CD1 4.13Å; L979-Y1012 HydrophobicContact CD2-CE1 4.21Å; M1004-Y1012 HydrophobicContact CE-CD1 4.26Å; M1004-Y1012 VanDerWaalsContact CG-CB 3.47Å; M1004-Y1012 HydrophobicContact CG-CD1 3.38Å; M1004-Y1012 HydrophobicContact CG-CD2 4.06Å; M1004-Y1012 HydrophobicContact CG-CE1 4.03Å; M1004-Y1012 HydrophobicContact CG-CG 3.37Å; M1004-Y1012 HydrophobicContact SD-CD1 3.52Å; M1004-Y1012 VanDerWaalsContact SD-CD1 3.52Å; M1004-Y1012 HydrophobicContact SD-CE1 4.32Å; M1004-Y1012 HydrophobicContact SD-CG 3.99Å; G1008-Y1012 WeakPolarHBondContact O-CD2 3.46Å; G1008-Y1012 WeakPolarHBondContact O-CE2 3.44Å; D1010-Y1012 VanDerWaalsContact C-N 3.25Å; D1010-Y1012 PolarHBondContact O-N 3.05Å; Y1012-P1014 VanDerWaalsContact O-N 3.13Å; Y1012-F1015 WeakPolarHBondContact O-CB 3.07Å; Y1012-F1015 PolarHBondContact O-N 3.1Å; Y1012-C1016 PolarHBondContact O-N 2.9Å; Y1012-C1016 PolarHBondContact O-SG 2.63Å
1013	R	96.4	Very high	97.2	Very high	88 Å²	88	39.7 Å²	39.7	33%	0.332	21%	0.214	S	C	.	.	H	α-helix	trans	-45	-45.6	-177.6	-81.4	-174.4	171.5	116.8	19.1	115.6	D1010 F1015 C1016 T1017 E1057 C1058	D1010-R1013 WeakPolarHBondContact O-CB 3.32Å; D1010-R1013 VanDerWaalsContact O-CG 3.3Å; D1010-R1013 WeakPolarHBondContact O-CG 3.43Å; D1010-R1013 PolarHBondContact O-N 3.04Å; D1010-R1013 IonicContact OD1-CZ 2.71Å; D1010-R1013 IonicContact OD1-NH1 2.9Å; D1010-R1013 PolarHBondContact OD1-NH1 3.09Å; D1010-R1013 IonicContact OD1-NH2 2.71Å; D1010-R1013 PolarHBondContact OD1-NH2 3.48Å; D1010-R1013 IonicContact OD2-CZ 3.5Å; D1010-R1013 IonicContact OD2-NH1 3.27Å; D1010-R1013 PolarHBondContact OD2-NH1 3.05Å; D1010-R1013 IonicContact OD2-NH2 2.75Å; R1013-F1015 VanDerWaalsContact C-N 3.25Å; R1013-F1015 PolarHBondContact O-N 2.56Å; R1013-C1016 WeakPolarHBondContact O-CB 3.44Å; R1013-C1016 PolarHBondContact O-N 3.3Å; R1013-T1017 PolarHBondContact O-N 3.29Å; R1013-T1017 PolarHBondContact O-OG1 3.08Å; R1013-E1057 IonicContact CZ-OE1 3.41Å; R1013-E1057 IonicContact NE-OE1 3.38Å; R1013-E1057 PolarHBondContact NE-OE1 3.29Å; R1013-E1057 IonicContact NH2-OE1 2.65Å; R1013-E1057 PolarHBondContact NH2-OE1 3.38Å; R1013-C1058 PolarHBondContact O-SG 3.38Å
1014	P	96.9	Very high	97.2	Very high	83 Å²	83	41 Å²	41	54%	0.539	22%	0.222	S	C	.	.	H	α-helix	trans	-63	-34.6	-179.1	-21.6	34.4	0	0	0	112.7	S1011 Y1012 T1017 E1018	S1011-P1014 WeakPolarHBondContact O-CD 3.23Å; Y1012-P1014 VanDerWaalsContact O-N 3.13Å; P1014-T1017 PolarHBondContact O-N 2.87Å; P1014-E1018 PolarHBondContact O-N 3.08Å; P1014-E1018 VanDerWaalsContact O-N 3.09Å
1015	F	97.5	Very high	97.1	Very high	57 Å²	57	43.8 Å²	43.8	25%	0.25	25%	0.246	C	C	.	.	H	α-helix	trans	-80.6	-33.7	-176.9	-52.9	-78.8	0	0	0	111.4	F972 L979 L983 M1004 Y1012 R1013 T1017 E1018 A1019	F972-F1015 HydrophobicContact CE2-CE2 4.15Å; F972-F1015 HydrophobicContact CZ-CE2 4.32Å; L979-F1015 HydrophobicContact CD1-CB 4.22Å; L979-F1015 HydrophobicContact CD1-CG 4.26Å; L979-F1015 HydrophobicContact CD2-CD1 3.89Å; L979-F1015 HydrophobicContact CD2-CD2 3.65Å; L979-F1015 HydrophobicContact CD2-CE1 3.9Å; L979-F1015 HydrophobicContact CD2-CE2 3.66Å; L979-F1015 HydrophobicContact CD2-CG 3.74Å; L979-F1015 HydrophobicContact CD2-CZ 3.78Å; L979-F1015 HydrophobicContact CG-CD1 4.18Å; L979-F1015 HydrophobicContact CG-CE1 4.46Å; L979-F1015 HydrophobicContact CG-CG 4.23Å; L983-F1015 HydrophobicContact CD1-CB 4.21Å; L983-F1015 HydrophobicContact CD1-CD1 3.93Å; M1004-F1015 HydrophobicContact SD-CB 4.28Å; Y1012-F1015 WeakPolarHBondContact O-CB 3.07Å; Y1012-F1015 PolarHBondContact O-N 3.1Å; R1013-F1015 VanDerWaalsContact C-N 3.25Å; R1013-F1015 PolarHBondContact O-N 2.56Å; F1015-T1017 VanDerWaalsContact C-N 3.25Å; F1015-T1017 PolarHBondContact O-N 3.21Å; F1015-E1018 PolarHBondContact O-N 2.81Å; F1015-E1018 VanDerWaalsContact O-N 3.12Å; F1015-A1019 WeakPolarHBondContact O-CB 3.36Å; F1015-A1019 PolarHBondContact O-N 3.16Å
1016	C	96.8	Very high	97.1	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-56	-39.7	166.3	-65.3	0	0	0	0	112.2	Y1012 R1013 L1051 C1058	Y1012-C1016 PolarHBondContact O-N 2.9Å; Y1012-C1016 PolarHBondContact O-SG 2.63Å; R1013-C1016 WeakPolarHBondContact O-CB 3.44Å; R1013-C1016 PolarHBondContact O-N 3.3Å; C1016-L1051 HydrophobicContact CB-CD2 3.44Å; C1016-L1051 VanDerWaalsContact CB-CD2 3.44Å; C1016-C1058 HydrophobicContact CB-CB 4.21Å
1017	T	96.4	Very high	97.2	Very high	70 Å²	70	43.5 Å²	43.5	43%	0.429	25%	0.246	S	C	.	.	H	α-helix	trans	-70.5	-38.6	173.2	-58.7	0	0	0	0	112.5	R1013 P1014 F1015 C1058	R1013-T1017 PolarHBondContact O-N 3.29Å; R1013-T1017 PolarHBondContact O-OG1 3.08Å; P1014-T1017 PolarHBondContact O-N 2.87Å; F1015-T1017 VanDerWaalsContact C-N 3.25Å; F1015-T1017 PolarHBondContact O-N 3.21Å; T1017-C1058 WeakPolarHBondContact OG1-CB 3.26Å; T1017-C1058 PolarHBondContact OG1-O 3.09Å
1018	E	97.4	Very high	97.1	Very high	72 Å²	72	44.8 Å²	44.8	34%	0.336	26%	0.255	S	S	.	.	H	α-helix	trans	-67.3	-35.7	177.4	-171.6	175.9	-172.4	0	0	112.7	R980 P1014 F1015 P1021	R980-E1018 IonicContact CZ-OE1 3.46Å; R980-E1018 IonicContact NH1-OE1 2.71Å; R980-E1018 PolarHBondContact NH1-OE1 2.87Å; R980-E1018 IonicContact NH1-OE2 2.66Å; R980-E1018 PolarHBondContact NH1-OE2 2.87Å; R980-E1018 VanDerWaalsContact NH1-OE2 3.08Å; R980-E1018 IonicContact NH2-OE1 3.28Å; R980-E1018 PolarHBondContact NH2-OE1 3.28Å; P1014-E1018 PolarHBondContact O-N 3.08Å; P1014-E1018 VanDerWaalsContact O-N 3.09Å; F1015-E1018 PolarHBondContact O-N 2.81Å; F1015-E1018 VanDerWaalsContact O-N 3.12Å; E1018-P1021 VanDerWaalsContact O-CD 3.32Å; E1018-P1021 WeakPolarHBondContact O-CD 3.49Å; E1018-P1021 WeakPolarHBondContact O-CG 3.3Å
1019	A	97.8	Very high	97.1	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-73.9	-32.4	-173.7	0	0	0	0	0	114.4	L983 L986 V1001 F1015 L1022 L1023	L983-A1019 HydrophobicContact CD2-CB 3.62Å; L986-A1019 HydrophobicContact CD1-CB 4.32Å; V1001-A1019 HydrophobicContact CG1-CB 3.59Å; V1001-A1019 HydrophobicContact CG2-CB 4.27Å; F1015-A1019 WeakPolarHBondContact O-CB 3.36Å; F1015-A1019 PolarHBondContact O-N 3.16Å; A1019-L1022 WeakPolarHBondContact O-CB 3.49Å; A1019-L1022 PolarHBondContact O-N 3.36Å; A1019-L1023 PolarHBondContact O-N 3.13Å
1020	L	97.3	Very high	97.1	Very high	25 Å²	25	51.3 Å²	51.3	13%	0.131	31%	0.307	C	S	.	.	H	α-helix	trans	-49.3	-54.7	-177.5	176	67.2	0	0	0	113.7	L1022 L1023 V1024 V1048 I1059 V1064	L1020-L1022 PolarHBondContact O-N 3.09Å; L1020-L1023 PolarHBondContact O-N 2.79Å; L1020-V1024 HydrophobicContact CD1-CG2 3.92Å; L1020-V1024 HydrophobicContact CG-CG2 4.4Å; L1020-V1024 VanDerWaalsContact O-CG2 3.28Å; L1020-V1024 WeakPolarHBondContact O-CG2 3.47Å; L1020-V1024 PolarHBondContact O-N 3.2Å; L1020-V1048 HydrophobicContact CD1-CG1 3.85Å; L1020-V1048 HydrophobicContact CD1-CG2 4.03Å; L1020-I1059 HydrophobicContact CB-CG2 4.12Å; L1020-I1059 HydrophobicContact CD2-CB 3.89Å; L1020-I1059 HydrophobicContact CD2-CG2 3.58Å; L1020-I1059 HydrophobicContact CG-CG2 4.36Å; L1020-V1064 HydrophobicContact CD1-CG1 4.37Å; L1020-V1064 HydrophobicContact CD1-CG2 4.44Å; L1020-V1064 HydrophobicContact CD2-CG2 3.84Å
1021	P	97.1	Very high	97.1	Very high	83 Å²	83	51.2 Å²	51.2	54%	0.539	31%	0.306	S	S	.	.	H	α-helix	trans	-63.5	-27.4	180	24.9	-35.8	0	0	0	113.8	E1018 A1025	E1018-P1021 VanDerWaalsContact O-CD 3.32Å; E1018-P1021 WeakPolarHBondContact O-CD 3.49Å; E1018-P1021 WeakPolarHBondContact O-CG 3.3Å; P1021-A1025 WeakPolarHBondContact O-CB 3.09Å; P1021-A1025 PolarHBondContact O-N 2.89Å; P1021-A1025 VanDerWaalsContact O-N 3.12Å
1022	L	98.3	Very high	97	Very high	53 Å²	53	49 Å²	49	28%	0.277	29%	0.291	S	S	.	.	H	α-helix	trans	-71.5	-49.4	176.9	-57.7	175.4	0	0	0	110.5	L983 L986 A1019 L1020 V1024 A1025 V1026	L983-L1022 WeakPolarHBondContact O-CD1 3.5Å; L986-L1022 HydrophobicContact CB-CB 4.33Å; L986-L1022 HydrophobicContact CD1-CB 3.7Å; L986-L1022 HydrophobicContact CD1-CD1 4.04Å; A1019-L1022 WeakPolarHBondContact O-CB 3.49Å; A1019-L1022 PolarHBondContact O-N 3.36Å; L1020-L1022 PolarHBondContact O-N 3.09Å; L1022-V1024 VanDerWaalsContact C-N 3.34Å; L1022-V1024 PolarHBondContact O-N 3.06Å; L1022-A1025 WeakPolarHBondContact O-CB 3.42Å; L1022-A1025 PolarHBondContact O-N 3.46Å; L1022-V1026 PolarHBondContact O-N 2.69Å
1023	L	98.5	Very high	96.9	Very high	0 Å²	0	54 Å²	54	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-55.5	-48	173.9	-67	167.9	0	0	0	111.4	L986 A998 V1001 A1019 L1020 A1025 V1026 I1027 C1044 A1047 V1048 L1051	L986-L1023 HydrophobicContact CD1-CD2 4.33Å; L986-L1023 HydrophobicContact CD1-CG 4.31Å; L986-L1023 HydrophobicContact CD2-CD2 3.68Å; A998-L1023 HydrophobicContact CB-CD2 4.1Å; V1001-L1023 HydrophobicContact CG1-CD1 3.91Å; A1019-L1023 PolarHBondContact O-N 3.13Å; L1020-L1023 PolarHBondContact O-N 2.79Å; L1023-A1025 VanDerWaalsContact C-N 3.29Å; L1023-A1025 PolarHBondContact O-N 2.62Å; L1023-V1026 PolarHBondContact O-N 2.98Å; L1023-I1027 WeakPolarHBondContact O-CD1 3.32Å; L1023-I1027 VanDerWaalsContact O-CG1 3.25Å; L1023-I1027 WeakPolarHBondContact O-CG1 3.31Å; L1023-I1027 PolarHBondContact O-N 2.85Å; L1023-I1027 VanDerWaalsContact O-N 3.09Å; L1023-C1044 HydrophobicContact CD2-CB 4.09Å; L1023-A1047 HydrophobicContact CD1-CB 3.93Å; L1023-A1047 HydrophobicContact CD2-CB 4.01Å; L1023-V1048 HydrophobicContact CB-CG2 3.71Å; L1023-V1048 HydrophobicContact CD1-CG2 3.83Å; L1023-V1048 HydrophobicContact CG-CG2 4.4Å; L1023-L1051 HydrophobicContact CD1-CD1 3.62Å
1024	V	97.8	Very high	96.9	Very high	28 Å²	28	51.4 Å²	51.4	17%	0.17	31%	0.305	C	S	.	.	H	α-helix	trans	-62.5	-35.9	-179.9	174.7	0	0	0	0	112	L1020 L1022 I1027 Q1028 W1071	L1020-V1024 HydrophobicContact CD1-CG2 3.92Å; L1020-V1024 HydrophobicContact CG-CG2 4.4Å; L1020-V1024 VanDerWaalsContact O-CG2 3.28Å; L1020-V1024 WeakPolarHBondContact O-CG2 3.47Å; L1020-V1024 PolarHBondContact O-N 3.2Å; L1022-V1024 VanDerWaalsContact C-N 3.34Å; L1022-V1024 PolarHBondContact O-N 3.06Å; V1024-I1027 PolarHBondContact O-N 3.49Å; V1024-Q1028 HydrophobicContact CG1-CG 4.23Å; V1024-Q1028 WeakPolarHBondContact O-CB 3.11Å; V1024-Q1028 VanDerWaalsContact O-CG 3.31Å; V1024-Q1028 WeakPolarHBondContact O-CG 3.22Å; V1024-Q1028 PolarHBondContact O-N 3.12Å; V1024-W1071 HydrophobicContact CG1-CH2 4.46Å; V1024-W1071 HydrophobicContact CG1-CZ2 4.46Å; V1024-W1071 HydrophobicContact CG2-CH2 3.96Å
1025	A	97.4	Very high	96.7	Very high	60 Å²	60	56.5 Å²	56.5	50%	0.496	32%	0.319	S	S	.	.	H	α-helix	trans	-64.5	-39.4	176.9	0	0	0	0	0	112.6	P1021 L1022 L1023 A1029	P1021-A1025 WeakPolarHBondContact O-CB 3.09Å; P1021-A1025 PolarHBondContact O-N 2.89Å; P1021-A1025 VanDerWaalsContact O-N 3.12Å; L1022-A1025 WeakPolarHBondContact O-CB 3.42Å; L1022-A1025 PolarHBondContact O-N 3.46Å; L1023-A1025 VanDerWaalsContact C-N 3.29Å; L1023-A1025 PolarHBondContact O-N 2.62Å; A1025-A1029 PolarHBondContact O-N 2.84Å
1026	V	97.8	Very high	96.5	Very high	16 Å²	16	60 Å²	60	10%	0.097	34%	0.336	C	S	.	.	H	α-helix	trans	-65.5	-48.2	175.2	-179.2	0	0	0	0	110.7	L986 L1022 L1023 Q1028 A1029 S1032	L986-V1026 WeakPolarHBondContact O-CG2 3.42Å; L1022-V1026 PolarHBondContact O-N 2.69Å; L1023-V1026 PolarHBondContact O-N 2.98Å; V1026-Q1028 VanDerWaalsContact C-N 3.25Å; V1026-Q1028 PolarHBondContact O-N 3.03Å; V1026-A1029 VanDerWaalsContact O-CB 3.28Å; V1026-A1029 WeakPolarHBondContact O-CB 3.47Å; V1026-A1029 PolarHBondContact O-N 3.34Å; V1026-A1029 VanDerWaalsContact O-N 3.11Å; V1026-S1032 WeakPolarHBondContact O-CB 3.32Å
1027	I	98.4	Very high	96.5	Very high	8 Å²	8	60.9 Å²	60.9	4%	0.041	34%	0.34	C	S	.	.	H	α-helix	trans	-61.6	-36.7	-178	-59.2	162.1	0	0	0	111.5	L1023 V1024 A1029 S1032 T1041 C1044 I1045 V1048 W1071	L1023-I1027 WeakPolarHBondContact O-CD1 3.32Å; L1023-I1027 VanDerWaalsContact O-CG1 3.25Å; L1023-I1027 WeakPolarHBondContact O-CG1 3.31Å; L1023-I1027 PolarHBondContact O-N 2.85Å; L1023-I1027 VanDerWaalsContact O-N 3.09Å; V1024-I1027 PolarHBondContact O-N 3.49Å; I1027-A1029 VanDerWaalsContact C-N 3.35Å; I1027-S1032 WeakPolarHBondContact O-CB 3.46Å; I1027-S1032 PolarHBondContact O-OG 3.25Å; I1027-T1041 HydrophobicContact CG2-CG2 4.39Å; I1027-C1044 HydrophobicContact CD1-CB 3.93Å; I1027-C1044 HydrophobicContact CG1-CB 3.56Å; I1027-I1045 HydrophobicContact CD1-CB 4.49Å; I1027-I1045 HydrophobicContact CD1-CG1 3.9Å; I1027-I1045 HydrophobicContact CG1-CG1 3.94Å; I1027-I1045 HydrophobicContact CG2-CD1 4.27Å; I1027-I1045 HydrophobicContact CG2-CG1 3.8Å; I1027-V1048 HydrophobicContact CD1-CG2 4.08Å; I1027-W1071 HydrophobicContact CD1-CD2 4.45Å; I1027-W1071 HydrophobicContact CD1-CE3 3.82Å; I1027-W1071 HydrophobicContact CD1-CH2 4.26Å; I1027-W1071 HydrophobicContact CD1-CZ3 3.72Å; I1027-W1071 HydrophobicContact CG2-CB 4.32Å; I1027-W1071 HydrophobicContact CG2-CD2 3.52Å; I1027-W1071 HydrophobicContact CG2-CE3 3.99Å; I1027-W1071 HydrophobicContact CG2-CG 3.64Å; I1027-W1071 HydrophobicContact CG2-CZ2 4.34Å
1028	Q	97	Very high	96.5	Very high	118 Å²	118	58.2 Å²	58.2	55%	0.551	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	2.2	-179.8	-65.7	-177.6	-1.6	0	0	114.3	V1024 V1026	V1024-Q1028 HydrophobicContact CG1-CG 4.23Å; V1024-Q1028 WeakPolarHBondContact O-CB 3.11Å; V1024-Q1028 VanDerWaalsContact O-CG 3.31Å; V1024-Q1028 WeakPolarHBondContact O-CG 3.22Å; V1024-Q1028 PolarHBondContact O-N 3.12Å; V1026-Q1028 VanDerWaalsContact C-N 3.25Å; V1026-Q1028 PolarHBondContact O-N 3.03Å
1029	A	96.3	Very high	96.5	Very high	41 Å²	41	57.5 Å²	57.5	34%	0.339	32%	0.323	S	S	.	.	S	Bend	trans	-61.7	146.8	171.2	0	0	0	0	0	111.1	A1025 V1026 I1027 D1031 S1032	A1025-A1029 PolarHBondContact O-N 2.84Å; V1026-A1029 VanDerWaalsContact O-CB 3.28Å; V1026-A1029 WeakPolarHBondContact O-CB 3.47Å; V1026-A1029 PolarHBondContact O-N 3.34Å; V1026-A1029 VanDerWaalsContact O-N 3.11Å; I1027-A1029 VanDerWaalsContact C-N 3.35Å; A1029-D1031 PolarHBondContact O-N 3.47Å; A1029-S1032 WeakPolarHBondContact O-CB 3.46Å; A1029-S1032 PolarHBondContact O-N 2.92Å; A1029-S1032 PolarHBondContact O-OG 3.49Å
1030	A	93.8	Very high	96.5	Very high	117 Å²	117	57.5 Å²	57.5	97%	0.967	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-24	-170.1	0	0	0	0	0	113.9
1031	D	94.6	Very high	96.6	Very high	96 Å²	96	56.4 Å²	56.4	51%	0.513	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	12.9	-177.1	61.4	-37.1	0	0	0	112.6	A1029 R1033 S1034 N1037	A1029-D1031 PolarHBondContact O-N 3.47Å; D1031-R1033 PolarHBondContact O-N 3.25Å; D1031-R1033 VanDerWaalsContact O-N 3.11Å; D1031-S1034 WeakPolarHBondContact O-CB 3.32Å; D1031-S1034 PolarHBondContact O-N 3.14Å; D1031-S1034 PolarHBondContact O-OG 3.04Å; D1031-N1037 PolarHBondContact O-ND2 2.97Å; D1031-N1037 PolarHBondContact OD2-ND2 3.35Å; D1031-N1037 VanDerWaalsContact OD2-ND2 3.11Å
1032	S	95.9	Very high	96.6	Very high	15 Å²	15	52.4 Å²	52.4	11%	0.105	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-27.4	-175.2	69.5	0	0	0	0	113.8	V1026 I1027 A1029 N1037 T1041	V1026-S1032 WeakPolarHBondContact O-CB 3.32Å; I1027-S1032 WeakPolarHBondContact O-CB 3.46Å; I1027-S1032 PolarHBondContact O-OG 3.25Å; A1029-S1032 WeakPolarHBondContact O-CB 3.46Å; A1029-S1032 PolarHBondContact O-N 2.92Å; A1029-S1032 PolarHBondContact O-OG 3.49Å; S1032-N1037 CarbonylContact O-C 3.14Å; S1032-N1037 WeakPolarHBondContact O-CB 3.35Å; S1032-T1041 WeakPolarHBondContact CB-OG1 3.13Å; S1032-T1041 WeakPolarHBondContact O-CB 3.28Å; S1032-T1041 PolarHBondContact O-OG1 3Å
1033	R	94.9	Very high	96.6	Very high	105 Å²	105	50 Å²	50	40%	0.396	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	22.4	177.5	-63.6	-59.5	-151.2	139.1	0.6	113.8	D1031 E1042 W1071 P1073	D1031-R1033 PolarHBondContact O-N 3.25Å; D1031-R1033 VanDerWaalsContact O-N 3.11Å; R1033-E1042 IonicContact CZ-OE1 3.64Å; R1033-E1042 IonicContact NH1-OE1 2.64Å; R1033-E1042 PolarHBondContact NH1-OE1 3.23Å; R1033-E1042 IonicContact NH2-OE1 3.81Å; R1033-W1071 PolarHBondContact NH2-O 2.97Å; R1033-P1073 PolarHBondContact NH2-O 2.98Å
1034	S	96.3	Very high	96.7	Very high	33 Å²	33	50 Å²	50	23%	0.231	28%	0.279	C	S	.	.	S	Bend	trans	-69.4	164.6	167.1	82.6	0	0	0	0	111.2	D1031 E1036 N1037 V1038	D1031-S1034 WeakPolarHBondContact O-CB 3.32Å; D1031-S1034 PolarHBondContact O-N 3.14Å; D1031-S1034 PolarHBondContact O-OG 3.04Å; S1034-E1036 WeakPolarHBondContact CB-OE2 3.42Å; S1034-E1036 PolarHBondContact O-N 3.32Å; S1034-E1036 PolarHBondContact OG-OE2 2.94Å; S1034-N1037 PolarHBondContact O-N 3.13Å; S1034-N1037 PolarHBondContact OG-N 3.46Å; S1034-N1037 PolarHBondContact OG-ND2 3.44Å; S1034-V1038 VanDerWaalsContact O-CB 3.28Å; S1034-V1038 WeakPolarHBondContact O-CB 3.45Å; S1034-V1038 WeakPolarHBondContact O-CG1 3.4Å; S1034-V1038 PolarHBondContact O-N 2.78Å
1035	K	93	Very high	96.7	Very high	189 Å²	189	48.7 Å²	48.7	82%	0.822	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-32.4	-178.6	-170.8	-167.5	173.9	-163.4	0	112
1036	E	93.9	Very high	96.8	Very high	131 Å²	131	45.9 Å²	45.9	61%	0.612	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80	-36	-177.7	-52.7	71.4	-154.9	0	0	111.5	P991 S1034	P991-E1036 VanDerWaalsContact CB-O 3.29Å; P991-E1036 WeakPolarHBondContact CB-O 3.39Å; P991-E1036 WeakPolarHBondContact CG-O 3.13Å; S1034-E1036 WeakPolarHBondContact CB-OE2 3.42Å; S1034-E1036 PolarHBondContact O-N 3.32Å; S1034-E1036 PolarHBondContact OG-OE2 2.94Å
1037	N	96.6	Very high	96.8	Very high	18 Å²	18	45.1 Å²	45.1	10%	0.096	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-13.9	-172.9	-69.1	-35.9	0	0	0	114.4	R994 D1031 S1032 S1034 N1039 A1040 T1041	R994-N1037 PolarHBondContact NH2-OD1 3.05Å; D1031-N1037 PolarHBondContact O-ND2 2.97Å; D1031-N1037 PolarHBondContact OD2-ND2 3.35Å; D1031-N1037 VanDerWaalsContact OD2-ND2 3.11Å; S1032-N1037 CarbonylContact O-C 3.14Å; S1032-N1037 WeakPolarHBondContact O-CB 3.35Å; S1034-N1037 PolarHBondContact O-N 3.13Å; S1034-N1037 PolarHBondContact OG-N 3.46Å; S1034-N1037 PolarHBondContact OG-ND2 3.44Å; N1037-N1039 PolarHBondContact O-N 2.81Å; N1037-A1040 PolarHBondContact O-N 3.31Å; N1037-T1041 PolarHBondContact O-N 3.41Å; N1037-T1041 VanDerWaalsContact O-N 3.07Å; N1037-T1041 PolarHBondContact O-OG1 3.23Å
1038	V	96.9	Very high	96.8	Very high	14 Å²	14	44.8 Å²	44.8	9%	0.085	24%	0.241	C	C	.	.	H	α-helix	trans	-59.5	-47.8	-166.7	57.2	0	0	0	0	113.5	S1034 A1040 T1041 E1042 E1076	S1034-V1038 VanDerWaalsContact O-CB 3.28Å; S1034-V1038 WeakPolarHBondContact O-CB 3.45Å; S1034-V1038 WeakPolarHBondContact O-CG1 3.4Å; S1034-V1038 PolarHBondContact O-N 2.78Å; V1038-A1040 PolarHBondContact O-N 2.89Å; V1038-T1041 CarbonylContact O-C 3.16Å; V1038-T1041 WeakPolarHBondContact O-CB 3.26Å; V1038-T1041 PolarHBondContact O-N 3.22Å; V1038-T1041 VanDerWaalsContact O-N 3.13Å; V1038-E1042 HydrophobicContact CG2-CG 4.09Å; V1038-E1042 WeakPolarHBondContact O-CG 3.38Å; V1038-E1042 PolarHBondContact O-N 3.17Å; V1038-E1076 HydrophobicContact CB-CG 4.37Å; V1038-E1076 HydrophobicContact CG1-CG 3.74Å; V1038-E1076 HydrophobicContact CG2-CG 3.69Å
1039	N	97.1	Very high	96.9	Very high	57 Å²	57	39.3 Å²	39.3	31%	0.305	22%	0.217	S	C	.	.	H	α-helix	trans	-61.8	-41	-178.8	-71.1	-51.7	0	0	0	112.7	Q995 N1037 T1041 E1042 N1043 E1076	Q995-N1039 VanDerWaalsContact OE1-CB 3.23Å; N1037-N1039 PolarHBondContact O-N 2.81Å; N1039-T1041 VanDerWaalsContact C-N 3.34Å; N1039-T1041 PolarHBondContact O-N 3.11Å; N1039-E1042 PolarHBondContact O-N 2.9Å; N1039-N1043 WeakPolarHBondContact O-CB 3.42Å; N1039-N1043 PolarHBondContact O-N 3.32Å; N1039-N1043 PolarHBondContact O-ND2 3.17Å; N1039-E1076 WeakPolarHBondContact OD1-CB 3.5Å
1040	A	98.1	Very high	97	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.008	20%	0.202	C	C	.	.	H	α-helix	trans	-62.6	-40.6	174.9	0	0	0	0	0	112.3	P991 R994 Q995 N1037 V1038 C1044	P991-A1040 HydrophobicContact CB-CB 4.17Å; P991-A1040 WeakPolarHBondContact O-CB 3.49Å; R994-A1040 HydrophobicContact CB-CB 4.14Å; Q995-A1040 HydrophobicContact CB-CB 4.02Å; N1037-A1040 PolarHBondContact O-N 3.31Å; V1038-A1040 PolarHBondContact O-N 2.89Å; A1040-C1044 PolarHBondContact O-N 3.41Å; A1040-C1044 PolarHBondContact O-SG 2.86Å
1041	T	98.4	Very high	97.2	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.006	16%	0.156	C	C	.	.	H	α-helix	trans	-69.6	-39	176.3	-65.1	0	0	0	0	112.2	I1027 S1032 N1037 V1038 N1039 C1044 I1045	I1027-T1041 HydrophobicContact CG2-CG2 4.39Å; S1032-T1041 WeakPolarHBondContact CB-OG1 3.13Å; S1032-T1041 WeakPolarHBondContact O-CB 3.28Å; S1032-T1041 PolarHBondContact O-OG1 3Å; N1037-T1041 PolarHBondContact O-N 3.41Å; N1037-T1041 VanDerWaalsContact O-N 3.07Å; N1037-T1041 PolarHBondContact O-OG1 3.23Å; V1038-T1041 CarbonylContact O-C 3.16Å; V1038-T1041 WeakPolarHBondContact O-CB 3.26Å; V1038-T1041 PolarHBondContact O-N 3.22Å; V1038-T1041 VanDerWaalsContact O-N 3.13Å; N1039-T1041 VanDerWaalsContact C-N 3.34Å; N1039-T1041 PolarHBondContact O-N 3.11Å; T1041-C1044 WeakPolarHBondContact O-CB 3.44Å; T1041-C1044 PolarHBondContact O-N 3.44Å; T1041-I1045 HydrophobicContact CG2-CD1 3.95Å; T1041-I1045 WeakPolarHBondContact O-CD1 3.36Å; T1041-I1045 VanDerWaalsContact O-CG1 3.23Å; T1041-I1045 WeakPolarHBondContact O-CG1 3.05Å; T1041-I1045 PolarHBondContact O-N 3.44Å
1042	E	98.3	Very high	97.3	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-64.5	-43.8	175.7	-71.4	-162.7	161.5	0	0	111.4	R1033 V1038 N1039 C1044 I1045 S1046 L1074 K1075 E1076 D1077	R1033-E1042 IonicContact CZ-OE1 3.64Å; R1033-E1042 IonicContact NH1-OE1 2.64Å; R1033-E1042 PolarHBondContact NH1-OE1 3.23Å; R1033-E1042 IonicContact NH2-OE1 3.81Å; V1038-E1042 HydrophobicContact CG2-CG 4.09Å; V1038-E1042 WeakPolarHBondContact O-CG 3.38Å; V1038-E1042 PolarHBondContact O-N 3.17Å; N1039-E1042 PolarHBondContact O-N 2.9Å; E1042-C1044 VanDerWaalsContact C-N 3.34Å; E1042-C1044 PolarHBondContact O-N 3.08Å; E1042-I1045 PolarHBondContact O-N 2.99Å; E1042-S1046 PolarHBondContact O-N 3.43Å; E1042-L1074 HydrophobicContact CB-CD2 3.9Å; E1042-L1074 HydrophobicContact CB-CG 3.76Å; E1042-L1074 HydrophobicContact CG-CB 4.31Å; E1042-L1074 HydrophobicContact CG-CD2 4.49Å; E1042-L1074 HydrophobicContact CG-CG 3.8Å; E1042-L1074 VanDerWaalsContact OE1-CA 3.24Å; E1042-L1074 WeakPolarHBondContact OE1-CA 3.49Å; E1042-K1075 VanDerWaalsContact CD-N 3.29Å; E1042-K1075 PolarHBondContact OE1-N 3.3Å; E1042-K1075 PolarHBondContact OE2-N 3.34Å; E1042-K1075 VanDerWaalsContact OE2-N 3.12Å; E1042-E1076 PolarHBondContact OE2-N 3.24Å; E1042-D1077 HydrophobicContact CB-CB 4.39Å; E1042-D1077 PolarHBondContact OE2-N 3.21Å
1043	N	98.6	Very high	97.3	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.011	14%	0.14	C	C	.	.	H	α-helix	trans	-59.9	-41.4	170.9	-86.3	-91.9	0	0	0	112.1	Q995 A998 N1039 S1046 A1047 D1077	Q995-N1043 HydrophobicContact CG-CB 4.09Å; Q995-N1043 PolarHBondContact NE2-ND2 3.15Å; A998-N1043 HydrophobicContact CB-CB 4.06Å; N1039-N1043 WeakPolarHBondContact O-CB 3.42Å; N1039-N1043 PolarHBondContact O-N 3.32Å; N1039-N1043 PolarHBondContact O-ND2 3.17Å; N1043-S1046 PolarHBondContact O-N 3.46Å; N1043-A1047 VanDerWaalsContact O-CB 3.3Å; N1043-A1047 WeakPolarHBondContact O-CB 3.16Å; N1043-A1047 PolarHBondContact O-N 3.42Å; N1043-D1077 PolarHBondContact ND2-OD2 3Å
1044	C	98.8	Very high	97.4	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61.4	-44.4	173	-73.8	0	0	0	0	112.7	A998 L1023 I1027 A1040 T1041 E1042 S1046 A1047 V1048	A998-C1044 HydrophobicContact CB-CB 4.4Å; A998-C1044 VanDerWaalsContact CB-SG 3.51Å; L1023-C1044 HydrophobicContact CD2-CB 4.09Å; I1027-C1044 HydrophobicContact CD1-CB 3.93Å; I1027-C1044 HydrophobicContact CG1-CB 3.56Å; A1040-C1044 PolarHBondContact O-N 3.41Å; A1040-C1044 PolarHBondContact O-SG 2.86Å; T1041-C1044 WeakPolarHBondContact O-CB 3.44Å; T1041-C1044 PolarHBondContact O-N 3.44Å; E1042-C1044 VanDerWaalsContact C-N 3.34Å; E1042-C1044 PolarHBondContact O-N 3.08Å; C1044-S1046 VanDerWaalsContact C-N 3.32Å; C1044-S1046 PolarHBondContact O-N 2.85Å; C1044-A1047 PolarHBondContact O-N 3.22Å; C1044-V1048 WeakPolarHBondContact O-CG2 3.38Å; C1044-V1048 PolarHBondContact O-N 3.38Å; C1044-V1048 VanDerWaalsContact O-N 3.08Å
1045	I	98.7	Very high	97.4	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-61.4	-42.6	177.8	-67.4	158.2	0	0	0	110.5	I1027 T1041 E1042 V1048 G1049 W1068 W1071 L1072 L1074	I1027-I1045 HydrophobicContact CD1-CB 4.49Å; I1027-I1045 HydrophobicContact CD1-CG1 3.9Å; I1027-I1045 HydrophobicContact CG1-CG1 3.94Å; I1027-I1045 HydrophobicContact CG2-CD1 4.27Å; I1027-I1045 HydrophobicContact CG2-CG1 3.8Å; T1041-I1045 HydrophobicContact CG2-CD1 3.95Å; T1041-I1045 WeakPolarHBondContact O-CD1 3.36Å; T1041-I1045 VanDerWaalsContact O-CG1 3.23Å; T1041-I1045 WeakPolarHBondContact O-CG1 3.05Å; T1041-I1045 PolarHBondContact O-N 3.44Å; E1042-I1045 PolarHBondContact O-N 2.99Å; I1045-V1048 PolarHBondContact O-N 2.99Å; I1045-G1049 PolarHBondContact O-N 2.73Å; I1045-G1049 VanDerWaalsContact O-N 3.08Å; I1045-W1068 VanDerWaalsContact O-CD1 3.31Å; I1045-W1068 PolarHBondContact O-NE1 2.96Å; I1045-W1071 HydrophobicContact CD1-CB 3.64Å; I1045-W1071 HydrophobicContact CG1-CB 3.72Å; I1045-W1071 HydrophobicContact CG1-CD2 4.41Å; I1045-W1071 HydrophobicContact CG1-CE3 4.12Å; I1045-W1071 HydrophobicContact CG1-CG 4.29Å; I1045-W1071 HydrophobicContact CG2-CB 4.05Å; I1045-W1071 HydrophobicContact CG2-CE3 4.32Å; I1045-L1072 HydrophobicContact CG2-CD2 4.12Å; I1045-L1074 HydrophobicContact CB-CD1 4.25Å; I1045-L1074 HydrophobicContact CG2-CD1 3.75Å
1046	S	98.6	Very high	97.5	Very high	1 Å²	1	22 Å²	22	1%	0.007	11%	0.109	C	C	.	.	H	α-helix	trans	-72.4	-37.9	179.1	-170.1	0	0	0	0	112.6	E1042 N1043 C1044 V1048 G1049 K1050 E1080	E1042-S1046 PolarHBondContact O-N 3.43Å; N1043-S1046 PolarHBondContact O-N 3.46Å; C1044-S1046 VanDerWaalsContact C-N 3.32Å; C1044-S1046 PolarHBondContact O-N 2.85Å; S1046-V1048 VanDerWaalsContact C-N 3.3Å; S1046-V1048 PolarHBondContact O-N 3Å; S1046-G1049 CarbonylContact O-C 3.56Å; S1046-G1049 VanDerWaalsContact O-CA 3.24Å; S1046-G1049 WeakPolarHBondContact O-CA 3.43Å; S1046-G1049 PolarHBondContact O-N 2.73Å; S1046-K1050 WeakPolarHBondContact O-CG 3.32Å; S1046-K1050 PolarHBondContact O-N 2.77Å; S1046-E1080 WeakPolarHBondContact CB-OE2 3.37Å; S1046-E1080 PolarHBondContact OG-OE2 2.62Å
1047	A	98.7	Very high	97.6	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.008	10%	0.102	C	C	.	.	H	α-helix	trans	-57.8	-40.4	171.5	0	0	0	0	0	112.3	A998 L1023 N1043 C1044 G1049 K1050 L1051	A998-A1047 VanDerWaalsContact O-CB 3.29Å; A998-A1047 WeakPolarHBondContact O-CB 3.38Å; L1023-A1047 HydrophobicContact CD1-CB 3.93Å; L1023-A1047 HydrophobicContact CD2-CB 4.01Å; N1043-A1047 VanDerWaalsContact O-CB 3.3Å; N1043-A1047 WeakPolarHBondContact O-CB 3.16Å; N1043-A1047 PolarHBondContact O-N 3.42Å; C1044-A1047 PolarHBondContact O-N 3.22Å; A1047-G1049 VanDerWaalsContact C-N 3.32Å; A1047-G1049 PolarHBondContact O-N 3.32Å; A1047-K1050 PolarHBondContact O-N 2.94Å; A1047-L1051 WeakPolarHBondContact O-CB 3.49Å; A1047-L1051 VanDerWaalsContact O-CG 3.3Å; A1047-L1051 WeakPolarHBondContact O-CG 3.39Å; A1047-L1051 PolarHBondContact O-N 2.66Å
1048	V	98.7	Very high	97.5	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-64.8	-35.7	171	178.1	0	0	0	0	111.8	L1020 L1023 I1027 C1044 I1045 S1046 M1052 V1064 W1071	L1020-V1048 HydrophobicContact CD1-CG1 3.85Å; L1020-V1048 HydrophobicContact CD1-CG2 4.03Å; L1023-V1048 HydrophobicContact CB-CG2 3.71Å; L1023-V1048 HydrophobicContact CD1-CG2 3.83Å; L1023-V1048 HydrophobicContact CG-CG2 4.4Å; I1027-V1048 HydrophobicContact CD1-CG2 4.08Å; C1044-V1048 WeakPolarHBondContact O-CG2 3.38Å; C1044-V1048 PolarHBondContact O-N 3.38Å; C1044-V1048 VanDerWaalsContact O-N 3.08Å; I1045-V1048 PolarHBondContact O-N 2.99Å; S1046-V1048 VanDerWaalsContact C-N 3.3Å; S1046-V1048 PolarHBondContact O-N 3Å; V1048-M1052 HydrophobicContact CG1-CE 4.22Å; V1048-M1052 WeakPolarHBondContact O-CG 3.42Å; V1048-M1052 PolarHBondContact O-N 3.28Å; V1048-V1064 HydrophobicContact CG1-CG1 3.62Å; V1048-W1071 HydrophobicContact CB-CZ3 4.38Å; V1048-W1071 HydrophobicContact CG1-CZ3 4.09Å; V1048-W1071 HydrophobicContact CG2-CZ3 4.48Å
1049	G	98	Very high	97.3	Very high	4 Å²	4	20.6 Å²	20.6	4%	0.041	10%	0.103	C	C	.	.	H	α-helix	trans	-61.3	-51.4	170.8	0	0	0	0	0	113	I1045 S1046 A1047 L1051 M1052 R1053	I1045-G1049 PolarHBondContact O-N 2.73Å; I1045-G1049 VanDerWaalsContact O-N 3.08Å; S1046-G1049 CarbonylContact O-C 3.56Å; S1046-G1049 VanDerWaalsContact O-CA 3.24Å; S1046-G1049 WeakPolarHBondContact O-CA 3.43Å; S1046-G1049 PolarHBondContact O-N 2.73Å; A1047-G1049 VanDerWaalsContact C-N 3.32Å; A1047-G1049 PolarHBondContact O-N 3.32Å; G1049-L1051 VanDerWaalsContact C-N 3.33Å; G1049-L1051 PolarHBondContact O-N 3.32Å; G1049-M1052 PolarHBondContact O-N 2.77Å; G1049-M1052 VanDerWaalsContact O-N 3.15Å; G1049-R1053 WeakPolarHBondContact O-CB 3.37Å; G1049-R1053 PolarHBondContact O-N 2.69Å
1050	K	98.4	Very high	97.1	Very high	6 Å²	6	21.4 Å²	21.4	3%	0.026	11%	0.107	C	C	.	.	H	α-helix	trans	-58.4	-42	176.1	-69.3	172.2	172.4	167.9	0	110.8	S1046 A1047 R1053 F1054 E1080	S1046-K1050 WeakPolarHBondContact O-CG 3.32Å; S1046-K1050 PolarHBondContact O-N 2.77Å; A1047-K1050 PolarHBondContact O-N 2.94Å; K1050-R1053 PolarHBondContact O-N 3.24Å; K1050-F1054 HydrophobicContact CB-CD2 4.18Å; K1050-F1054 HydrophobicContact CB-CE2 4.48Å; K1050-F1054 HydrophobicContact CG-CE2 4.39Å; K1050-F1054 WeakPolarHBondContact O-CB 2.96Å; K1050-F1054 VanDerWaalsContact O-CD2 3.27Å; K1050-F1054 WeakPolarHBondContact O-CD2 3.4Å; K1050-F1054 PolarHBondContact O-N 3.24Å; K1050-E1080 VanDerWaalsContact CE-OE2 3.26Å; K1050-E1080 WeakPolarHBondContact CE-OE2 3.42Å; K1050-E1080 IonicContact NZ-OE1 2.78Å; K1050-E1080 PolarHBondContact NZ-OE1 3.41Å; K1050-E1080 IonicContact NZ-OE2 2.72Å; K1050-E1080 PolarHBondContact NZ-OE2 2.97Å
1051	L	97.9	Very high	96.9	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-59	-48.9	171.5	-76.2	165.9	0	0	0	112.8	V1001 A1005 C1016 L1023 A1047 G1049 R1053 R1055 I1059	V1001-L1051 HydrophobicContact CG1-CD1 4.39Å; A1005-L1051 HydrophobicContact CB-CD2 3.65Å; A1005-L1051 HydrophobicContact CB-CG 3.96Å; C1016-L1051 HydrophobicContact CB-CD2 3.44Å; C1016-L1051 VanDerWaalsContact CB-CD2 3.44Å; L1023-L1051 HydrophobicContact CD1-CD1 3.62Å; A1047-L1051 WeakPolarHBondContact O-CB 3.49Å; A1047-L1051 VanDerWaalsContact O-CG 3.3Å; A1047-L1051 WeakPolarHBondContact O-CG 3.39Å; A1047-L1051 PolarHBondContact O-N 2.66Å; G1049-L1051 VanDerWaalsContact C-N 3.33Å; G1049-L1051 PolarHBondContact O-N 3.32Å; L1051-R1053 PolarHBondContact O-N 2.71Å; L1051-R1055 CarbonylContact O-C 3.51Å; L1051-R1055 WeakPolarHBondContact O-CA 3.18Å; L1051-R1055 PolarHBondContact O-N 2.63Å; L1051-I1059 HydrophobicContact CB-CD1 4.06Å
1052	M	97.5	Very high	96.6	Very high	5 Å²	5	27.2 Å²	27.2	3%	0.025	14%	0.139	C	C	.	.	H	α-helix	trans	-65.3	-36.4	178	-73.7	-170.1	-72.4	0	0	113.1	V1048 G1049 I1059 V1061 V1064 L1065 W1068 F1087	V1048-M1052 HydrophobicContact CG1-CE 4.22Å; V1048-M1052 WeakPolarHBondContact O-CG 3.42Å; V1048-M1052 PolarHBondContact O-N 3.28Å; G1049-M1052 PolarHBondContact O-N 2.77Å; G1049-M1052 VanDerWaalsContact O-N 3.15Å; M1052-I1059 HydrophobicContact CB-CD1 4.26Å; M1052-I1059 HydrophobicContact CG-CD1 3.48Å; M1052-I1059 VanDerWaalsContact CG-CD1 3.48Å; M1052-V1061 HydrophobicContact CB-CG1 4.3Å; M1052-V1061 HydrophobicContact CB-CG2 4.32Å; M1052-V1061 HydrophobicContact CG-CG1 4.19Å; M1052-V1061 HydrophobicContact CG-CG2 4.24Å; M1052-V1061 HydrophobicContact SD-CG1 4.03Å; M1052-V1064 HydrophobicContact CE-CG1 4.34Å; M1052-V1064 HydrophobicContact CG-CG1 4.47Å; M1052-V1064 HydrophobicContact SD-CB 4.04Å; M1052-V1064 HydrophobicContact SD-CG1 3.87Å; M1052-L1065 HydrophobicContact SD-CB 4.17Å; M1052-L1065 HydrophobicContact SD-CD1 4.45Å; M1052-W1068 HydrophobicContact CE-CB 3.43Å; M1052-W1068 VanDerWaalsContact CE-CB 3.43Å; M1052-W1068 HydrophobicContact CE-CD2 3.55Å; M1052-W1068 HydrophobicContact CE-CE3 4.06Å; M1052-W1068 HydrophobicContact CE-CG 3.25Å; M1052-F1087 HydrophobicContact CB-CE1 3.74Å; M1052-F1087 HydrophobicContact CB-CZ 3.72Å; M1052-F1087 HydrophobicContact CE-CE1 3.93Å
1053	R	96.7	Very high	96.3	Very high	67 Å²	67	33.4 Å²	33.4	25%	0.253	17%	0.168	S	C	.	.	H	α-helix	trans	-76.4	-44.9	-177.2	-167.1	176.3	-165.8	-166.7	2	112.6	G1049 K1050 L1051 F1087 D1090	G1049-R1053 WeakPolarHBondContact O-CB 3.37Å; G1049-R1053 PolarHBondContact O-N 2.69Å; K1050-R1053 PolarHBondContact O-N 3.24Å; L1051-R1053 PolarHBondContact O-N 2.71Å; R1053-F1087 HydrophobicContact CB-CD2 3.64Å; R1053-F1087 HydrophobicContact CB-CE2 3.64Å; R1053-F1087 HydrophobicContact CB-CG 4.1Å; R1053-F1087 HydrophobicContact CB-CZ 4.1Å; R1053-F1087 HydrophobicContact CG-CD2 3.51Å; R1053-F1087 HydrophobicContact CG-CE2 3.8Å; R1053-F1087 HydrophobicContact CG-CG 4.25Å; R1053-D1090 IonicContact CZ-OD2 3.78Å; R1053-D1090 IonicContact NE-OD2 2.82Å; R1053-D1090 PolarHBondContact NE-OD2 3.27Å; R1053-D1090 VanDerWaalsContact NH2-CG 3.35Å; R1053-D1090 IonicContact NH2-OD1 2.74Å; R1053-D1090 PolarHBondContact NH2-OD1 3.43Å; R1053-D1090 IonicContact NH2-OD2 2.57Å; R1053-D1090 PolarHBondContact NH2-OD2 3.37Å
1054	F	97.3	Very high	96.2	Very high	64 Å²	64	34.1 Å²	34.1	28%	0.281	17%	0.172	S	C	.	.	H	α-helix	trans	-107.5	-19.1	-168.5	-58.2	-66.9	0	0	0	114.5	A1005 Q1006 K1050 P1056	A1005-F1054 VanDerWaalsContact O-CB 3.29Å; A1005-F1054 WeakPolarHBondContact O-CB 3.44Å; Q1006-F1054 HydrophobicContact CB-CD2 3.74Å; Q1006-F1054 HydrophobicContact CB-CE2 3.96Å; Q1006-F1054 HydrophobicContact CB-CG 4.33Å; Q1006-F1054 VanDerWaalsContact CD-CE2 3.47Å; Q1006-F1054 HydrophobicContact CG-CD2 3.77Å; Q1006-F1054 HydrophobicContact CG-CE1 4.36Å; Q1006-F1054 HydrophobicContact CG-CE2 3.51Å; Q1006-F1054 HydrophobicContact CG-CG 4.31Å; Q1006-F1054 HydrophobicContact CG-CZ 3.83Å; K1050-F1054 HydrophobicContact CB-CD2 4.18Å; K1050-F1054 HydrophobicContact CB-CE2 4.48Å; K1050-F1054 HydrophobicContact CG-CE2 4.39Å; K1050-F1054 WeakPolarHBondContact O-CB 2.96Å; K1050-F1054 VanDerWaalsContact O-CD2 3.27Å; K1050-F1054 WeakPolarHBondContact O-CD2 3.4Å; K1050-F1054 PolarHBondContact O-N 3.24Å; F1054-P1056 VanDerWaalsContact C-CD 3.43Å
1055	R	96.1	Very high	96	Very high	24 Å²	24	34.2 Å²	34.2	9%	0.091	17%	0.172	C	C	.	.			trans	-132.1	51.5	175	-62	-65.6	-179.5	-76.1	-16.9	112.5	A1005 G1009 L1051 E1057 C1058	A1005-R1055 HydrophobicContact CB-CG 4.33Å; A1005-R1055 PolarHBondContact O-NH1 3.23Å; A1005-R1055 PolarHBondContact O-NH2 3.22Å; G1009-R1055 PolarHBondContact O-NE 3.04Å; G1009-R1055 PolarHBondContact O-NH2 2.99Å; G1009-R1055 VanDerWaalsContact O-NH2 3.14Å; L1051-R1055 CarbonylContact O-C 3.51Å; L1051-R1055 WeakPolarHBondContact O-CA 3.18Å; L1051-R1055 PolarHBondContact O-N 2.63Å; R1055-E1057 WeakPolarHBondContact CA-OE2 3.4Å; R1055-E1057 WeakPolarHBondContact CD-OE1 3.4Å; R1055-E1057 PolarHBondContact O-N 3.04Å; R1055-E1057 VanDerWaalsContact O-N 3.07Å; R1055-C1058 HydrophobicContact CB-CB 4.15Å; R1055-C1058 WeakPolarHBondContact O-CB 3.34Å; R1055-C1058 PolarHBondContact O-N 3.1Å
1056	P	95.2	Very high	95.9	Very high	67 Å²	67	37.1 Å²	37.1	44%	0.435	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-18.2	179.8	28.2	-37.1	0	0	0	113.8	F1054 C1058 V1061	F1054-P1056 VanDerWaalsContact C-CD 3.43Å; P1056-C1058 VanDerWaalsContact C-N 3.32Å; P1056-V1061 HydrophobicContact CB-CG2 3.85Å
1057	E	94.9	Very high	95.7	Very high	99 Å²	99	41.6 Å²	41.6	46%	0.463	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-18.5	173.2	72.4	-81.7	-161.5	0	0	114.3	R1013 R1055	R1013-E1057 IonicContact CZ-OE1 3.41Å; R1013-E1057 IonicContact NE-OE1 3.38Å; R1013-E1057 PolarHBondContact NE-OE1 3.29Å; R1013-E1057 IonicContact NH2-OE1 2.65Å; R1013-E1057 PolarHBondContact NH2-OE1 3.38Å; R1055-E1057 WeakPolarHBondContact CA-OE2 3.4Å; R1055-E1057 WeakPolarHBondContact CD-OE1 3.4Å; R1055-E1057 PolarHBondContact O-N 3.04Å; R1055-E1057 VanDerWaalsContact O-N 3.07Å
1058	C	93.7	Very high	95.7	Very high	15 Å²	15	41.6 Å²	41.6	10%	0.101	21%	0.212	C	C	.	.	S	Bend	trans	-87.2	-17.6	-178.2	-73.1	0	0	0	0	113.5	R1013 C1016 T1017 R1055 P1056	R1013-C1058 PolarHBondContact O-SG 3.38Å; C1016-C1058 HydrophobicContact CB-CB 4.21Å; T1017-C1058 WeakPolarHBondContact OG1-CB 3.26Å; T1017-C1058 PolarHBondContact OG1-O 3.09Å; R1055-C1058 HydrophobicContact CB-CB 4.15Å; R1055-C1058 WeakPolarHBondContact O-CB 3.34Å; R1055-C1058 PolarHBondContact O-N 3.1Å; P1056-C1058 VanDerWaalsContact C-N 3.32Å
1059	I	93.6	Very high	95.6	Very high	19 Å²	19	41.7 Å²	41.7	10%	0.097	21%	0.212	C	C	.	.	S	Bend	trans	-144	154.6	-169.9	62.2	166.5	0	0	0	112.5	L1020 L1051 M1052 V1061	L1020-I1059 HydrophobicContact CB-CG2 4.12Å; L1020-I1059 HydrophobicContact CD2-CB 3.89Å; L1020-I1059 HydrophobicContact CD2-CG2 3.58Å; L1020-I1059 HydrophobicContact CG-CG2 4.36Å; L1051-I1059 HydrophobicContact CB-CD1 4.06Å; M1052-I1059 HydrophobicContact CB-CD1 4.26Å; M1052-I1059 HydrophobicContact CG-CD1 3.48Å; M1052-I1059 VanDerWaalsContact CG-CD1 3.48Å; I1059-V1061 HydrophobicContact CG1-CG2 4.16Å; I1059-V1061 PolarHBondContact O-N 2.95Å
1060	N	94.1	Very high	95.5	Very high	74 Å²	74	44.4 Å²	44.4	40%	0.396	23%	0.231	S	C	.	.			trans	-81.6	81.9	174.3	-167.5	-5.9	0	0	0	111.1	N1062 E1063 V1064	N1060-N1062 PolarHBondContact O-N 2.88Å; N1060-N1062 VanDerWaalsContact O-N 3.08Å; N1060-E1063 HydrophobicContact CB-CB 4.36Å; N1060-E1063 WeakPolarHBondContact ND2-CG 3.49Å; N1060-E1063 PolarHBondContact ND2-OE1 3.5Å; N1060-E1063 VanDerWaalsContact ND2-OE1 3.13Å; N1060-E1063 PolarHBondContact ND2-OE2 2.92Å; N1060-E1063 PolarHBondContact O-N 3.17Å; N1060-V1064 PolarHBondContact O-N 2.93Å
1061	V	92.9	Very high	95.5	Very high	25 Å²	25	45.7 Å²	45.7	15%	0.152	24%	0.235	C	C	.	.	H	α-helix	trans	-49.1	-38.2	-178.6	-179.5	0	0	0	0	112.4	M1052 P1056 I1059 E1063 V1064 L1065	M1052-V1061 HydrophobicContact CB-CG1 4.3Å; M1052-V1061 HydrophobicContact CB-CG2 4.32Å; M1052-V1061 HydrophobicContact CG-CG1 4.19Å; M1052-V1061 HydrophobicContact CG-CG2 4.24Å; M1052-V1061 HydrophobicContact SD-CG1 4.03Å; P1056-V1061 HydrophobicContact CB-CG2 3.85Å; I1059-V1061 HydrophobicContact CG1-CG2 4.16Å; I1059-V1061 PolarHBondContact O-N 2.95Å; V1061-E1063 VanDerWaalsContact C-N 3.3Å; V1061-E1063 PolarHBondContact O-N 3.46Å; V1061-V1064 PolarHBondContact O-N 3.2Å; V1061-L1065 WeakPolarHBondContact O-CB 3.36Å; V1061-L1065 PolarHBondContact O-N 3.24Å
1062	N	91.8	Very high	95.4	Very high	98 Å²	98	46.4 Å²	46.4	52%	0.524	24%	0.239	S	C	.	.	H	α-helix	trans	-65.4	-29.7	-178.3	-65.2	-28	0	0	0	113.7	N1060 I1098	N1060-N1062 PolarHBondContact O-N 2.88Å; N1060-N1062 VanDerWaalsContact O-N 3.08Å; N1062-I1098 HydrophobicContact CB-CD1 3.59Å; N1062-I1098 VanDerWaalsContact OD1-CD1 3.23Å; N1062-I1098 WeakPolarHBondContact OD1-CD1 3.32Å
1063	E	93.2	Very high	95.3	Very high	131 Å²	131	46.8 Å²	46.8	61%	0.612	24%	0.242	S	C	*	.	H	α-helix	trans	-84.8	-36.5	176.4	-74.8	171.4	175.9	0	0	111.6	N1060 V1061 H1067	N1060-E1063 HydrophobicContact CB-CB 4.36Å; N1060-E1063 WeakPolarHBondContact ND2-CG 3.49Å; N1060-E1063 PolarHBondContact ND2-OE1 3.5Å; N1060-E1063 VanDerWaalsContact ND2-OE1 3.13Å; N1060-E1063 PolarHBondContact ND2-OE2 2.92Å; N1060-E1063 PolarHBondContact O-N 3.17Å; V1061-E1063 VanDerWaalsContact C-N 3.3Å; V1061-E1063 PolarHBondContact O-N 3.46Å; E1063-H1067 PolarHBondContact O-CE1 2.61Å; E1063-H1067 VanDerWaalsContact O-CE1 3.23Å; E1063-H1067 PolarHBondContact O-ND1 3.45Å
1064	V	95.6	Very high	95.2	Very high	17 Å²	17	43.6 Å²	43.6	10%	0.103	23%	0.23	C	C	.	.	H	α-helix	trans	-77.3	-38.5	-177.6	-178.3	0	0	0	0	112.1	L1020 V1048 M1052 N1060 V1061 H1067 W1068	L1020-V1064 HydrophobicContact CD1-CG1 4.37Å; L1020-V1064 HydrophobicContact CD1-CG2 4.44Å; L1020-V1064 HydrophobicContact CD2-CG2 3.84Å; V1048-V1064 HydrophobicContact CG1-CG1 3.62Å; M1052-V1064 HydrophobicContact CE-CG1 4.34Å; M1052-V1064 HydrophobicContact CG-CG1 4.47Å; M1052-V1064 HydrophobicContact SD-CB 4.04Å; M1052-V1064 HydrophobicContact SD-CG1 3.87Å; N1060-V1064 PolarHBondContact O-N 2.93Å; V1061-V1064 PolarHBondContact O-N 3.2Å; V1064-H1067 WeakPolarHBondContact O-CA 3.31Å; V1064-H1067 WeakPolarHBondContact O-CB 3.36Å; V1064-H1067 PolarHBondContact O-N 3.46Å; V1064-W1068 PolarHBondContact O-N 3.49Å
1065	L	95.4	Very high	94.8	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-55.9	-41.7	-170.4	178.4	60.1	0	0	0	115.3	M1052 V1061 H1067 W1068 L1069 L1091 I1098 V1099	M1052-L1065 HydrophobicContact SD-CB 4.17Å; M1052-L1065 HydrophobicContact SD-CD1 4.45Å; V1061-L1065 WeakPolarHBondContact O-CB 3.36Å; V1061-L1065 PolarHBondContact O-N 3.24Å; L1065-H1067 VanDerWaalsContact C-N 3.27Å; L1065-H1067 PolarHBondContact O-N 2.94Å; L1065-W1068 HydrophobicContact CD1-CE3 3.94Å; L1065-W1068 HydrophobicContact CD1-CZ3 4.44Å; L1065-W1068 PolarHBondContact O-N 3.05Å; L1065-L1069 WeakPolarHBondContact O-CB 3.42Å; L1065-L1069 PolarHBondContact O-N 3.21Å; L1065-L1091 HydrophobicContact CD1-CD1 3.61Å; L1065-L1091 HydrophobicContact CD1-CD2 4.41Å; L1065-L1091 HydrophobicContact CD2-CD2 4.03Å; L1065-I1098 HydrophobicContact CB-CG2 4.36Å; L1065-I1098 HydrophobicContact CD2-CB 4.12Å; L1065-I1098 HydrophobicContact CD2-CG2 4.1Å; L1065-I1098 HydrophobicContact CG-CG2 4.28Å; L1065-V1099 HydrophobicContact CD1-CG2 4.22Å; L1065-V1099 HydrophobicContact CD2-CB 4.3Å
1066	P	95	Very high	94.6	Very high	62 Å²	62	47.4 Å²	47.4	40%	0.403	25%	0.249	S	C	.	.	H	α-helix	trans	-61.8	-33.4	174.4	-23.4	34.4	0	0	0	113.7	S1070 I1098	P1066-S1070 PolarHBondContact O-N 2.89Å; P1066-I1098 HydrophobicContact CG-CG2 3.64Å
1067	H	96.1	Very high	94.5	Very high	95 Å²	95	45.3 Å²	45.3	44%	0.44	23%	0.234	S	C	.	.	H	α-helix	trans	-74	-44.9	177.9	-56.4	85	0	0	0	110.1	E1063 V1064 L1065 L1069 S1070 W1071	E1063-H1067 PolarHBondContact O-CE1 2.61Å; E1063-H1067 VanDerWaalsContact O-CE1 3.23Å; E1063-H1067 PolarHBondContact O-ND1 3.45Å; V1064-H1067 WeakPolarHBondContact O-CA 3.31Å; V1064-H1067 WeakPolarHBondContact O-CB 3.36Å; V1064-H1067 PolarHBondContact O-N 3.46Å; L1065-H1067 VanDerWaalsContact C-N 3.27Å; L1065-H1067 PolarHBondContact O-N 2.94Å; H1067-L1069 PolarHBondContact O-N 3.34Å; H1067-S1070 WeakPolarHBondContact O-CA 3.43Å; H1067-S1070 VanDerWaalsContact O-CB 3.27Å; H1067-S1070 WeakPolarHBondContact O-CB 3.44Å; H1067-S1070 PolarHBondContact O-N 3.37Å; H1067-S1070 PolarHBondContact O-OG 3.21Å; H1067-W1071 HydrophobicContact CB-CH2 4.01Å; H1067-W1071 HydrophobicContact CB-CZ2 3.64Å; H1067-W1071 VanDerWaalsContact O-CD2 3.32Å; H1067-W1071 PolarHBondContact O-N 3.04Å; H1067-W1071 PolarHBondContact O-NE1 3.09Å
1068	W	97.9	Very high	94.4	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.1	-45	175.9	-177.8	82.9	0	0	0	112.7	I1045 M1052 V1064 L1065 S1070 W1071 L1072 T1084 F1087 L1088 L1091	I1045-W1068 VanDerWaalsContact O-CD1 3.31Å; I1045-W1068 PolarHBondContact O-NE1 2.96Å; M1052-W1068 HydrophobicContact CE-CB 3.43Å; M1052-W1068 VanDerWaalsContact CE-CB 3.43Å; M1052-W1068 HydrophobicContact CE-CD2 3.55Å; M1052-W1068 HydrophobicContact CE-CE3 4.06Å; M1052-W1068 HydrophobicContact CE-CG 3.25Å; V1064-W1068 PolarHBondContact O-N 3.49Å; L1065-W1068 HydrophobicContact CD1-CE3 3.94Å; L1065-W1068 HydrophobicContact CD1-CZ3 4.44Å; L1065-W1068 PolarHBondContact O-N 3.05Å; W1068-S1070 PolarHBondContact O-N 3.29Å; W1068-W1071 HydrophobicContact CB-CE3 4.16Å; W1068-W1071 HydrophobicContact CB-CZ3 4.12Å; W1068-W1071 HydrophobicContact CG-CE3 4.44Å; W1068-W1071 PolarHBondContact O-N 2.92Å; W1068-L1072 HydrophobicContact CE3-CD1 4.16Å; W1068-L1072 HydrophobicContact CH2-CD1 3.77Å; W1068-L1072 HydrophobicContact CZ2-CD1 4.17Å; W1068-L1072 HydrophobicContact CZ2-CD2 4.17Å; W1068-L1072 HydrophobicContact CZ3-CD1 3.76Å; W1068-T1084 HydrophobicContact CZ2-CG2 3.94Å; W1068-F1087 HydrophobicContact CH2-CB 4.29Å; W1068-F1087 AromaticContact CH2-CD1 3.54Å; W1068-F1087 HydrophobicContact CH2-CD1 3.54Å; W1068-F1087 HydrophobicContact CH2-CE1 4.29Å; W1068-F1087 HydrophobicContact CH2-CG 4.3Å; W1068-F1087 AromaticContact CZ2-CD1 3.78Å; W1068-F1087 HydrophobicContact CZ2-CD1 3.78Å; W1068-F1087 HydrophobicContact CZ3-CD1 4.01Å; W1068-F1087 HydrophobicContact CZ3-CE1 4.36Å; W1068-L1088 HydrophobicContact CH2-CB 4.35Å; W1068-L1091 HydrophobicContact CZ3-CD1 3.91Å
1069	L	96.6	Very high	94.3	Very high	3 Å²	3	50.3 Å²	50.3	2%	0.016	26%	0.255	C	S	.	.	H	α-helix	trans	-61.9	-13	171.7	-172.8	63.9	0	0	0	113.2	L1065 H1067 L1072 L1088 V1099 N1106 K1109 I1110 I1113	L1065-L1069 WeakPolarHBondContact O-CB 3.42Å; L1065-L1069 PolarHBondContact O-N 3.21Å; H1067-L1069 PolarHBondContact O-N 3.34Å; L1069-L1072 HydrophobicContact CD1-CD1 4.48Å; L1069-L1088 HydrophobicContact CD1-CD1 3.88Å; L1069-V1099 HydrophobicContact CD1-CG2 4.19Å; L1069-V1099 HydrophobicContact CD2-CG2 3.91Å; L1069-V1099 WeakPolarHBondContact CD2-O 3.27Å; L1069-N1106 HydrophobicContact CD2-CB 4.29Å; L1069-K1109 VanDerWaalsContact O-CE 3.31Å; L1069-K1109 WeakPolarHBondContact O-CE 3.47Å; L1069-K1109 PolarHBondContact O-NZ 3.02Å; L1069-I1110 HydrophobicContact CD1-CG1 4.29Å; L1069-I1113 HydrophobicContact CD1-CD1 3.89Å
1070	S	95.8	Very high	94.4	Very high	61 Å²	61	49.5 Å²	49.5	43%	0.427	25%	0.25	S	S	.	.	H	α-helix	trans	-89.4	-15	173.1	84.8	0	0	0	0	115.3	P1066 H1067 W1068 K1109	P1066-S1070 PolarHBondContact O-N 2.89Å; H1067-S1070 WeakPolarHBondContact O-CA 3.43Å; H1067-S1070 VanDerWaalsContact O-CB 3.27Å; H1067-S1070 WeakPolarHBondContact O-CB 3.44Å; H1067-S1070 PolarHBondContact O-N 3.37Å; H1067-S1070 PolarHBondContact O-OG 3.21Å; W1068-S1070 PolarHBondContact O-N 3.29Å; S1070-K1109 VanDerWaalsContact CA-NZ 3.27Å
1071	W	97.4	Very high	94.4	Very high	32 Å²	32	46 Å²	46	12%	0.121	23%	0.232	C	C	.	.	H	α-helix	trans	-95	-14.7	179.8	-50.4	-37.2	0	0	0	113.5	V1024 I1027 R1033 I1045 V1048 H1067 W1068	V1024-W1071 HydrophobicContact CG1-CH2 4.46Å; V1024-W1071 HydrophobicContact CG1-CZ2 4.46Å; V1024-W1071 HydrophobicContact CG2-CH2 3.96Å; I1027-W1071 HydrophobicContact CD1-CD2 4.45Å; I1027-W1071 HydrophobicContact CD1-CE3 3.82Å; I1027-W1071 HydrophobicContact CD1-CH2 4.26Å; I1027-W1071 HydrophobicContact CD1-CZ3 3.72Å; I1027-W1071 HydrophobicContact CG2-CB 4.32Å; I1027-W1071 HydrophobicContact CG2-CD2 3.52Å; I1027-W1071 HydrophobicContact CG2-CE3 3.99Å; I1027-W1071 HydrophobicContact CG2-CG 3.64Å; I1027-W1071 HydrophobicContact CG2-CZ2 4.34Å; R1033-W1071 PolarHBondContact NH2-O 2.97Å; I1045-W1071 HydrophobicContact CD1-CB 3.64Å; I1045-W1071 HydrophobicContact CG1-CB 3.72Å; I1045-W1071 HydrophobicContact CG1-CD2 4.41Å; I1045-W1071 HydrophobicContact CG1-CE3 4.12Å; I1045-W1071 HydrophobicContact CG1-CG 4.29Å; I1045-W1071 HydrophobicContact CG2-CB 4.05Å; I1045-W1071 HydrophobicContact CG2-CE3 4.32Å; V1048-W1071 HydrophobicContact CB-CZ3 4.38Å; V1048-W1071 HydrophobicContact CG1-CZ3 4.09Å; V1048-W1071 HydrophobicContact CG2-CZ3 4.48Å; H1067-W1071 HydrophobicContact CB-CH2 4.01Å; H1067-W1071 HydrophobicContact CB-CZ2 3.64Å; H1067-W1071 VanDerWaalsContact O-CD2 3.32Å; H1067-W1071 PolarHBondContact O-N 3.04Å; H1067-W1071 PolarHBondContact O-NE1 3.09Å; W1068-W1071 HydrophobicContact CB-CE3 4.16Å; W1068-W1071 HydrophobicContact CB-CZ3 4.12Å; W1068-W1071 HydrophobicContact CG-CE3 4.44Å; W1068-W1071 PolarHBondContact O-N 2.92Å
1072	L	96.3	Very high	94.4	Very high	15 Å²	15	46.3 Å²	46.3	8%	0.079	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-75.1	154.5	176.5	-62.6	-175.5	0	0	0	112.8	I1045 W1068 L1069 L1074 T1084 L1088 I1113	I1045-L1072 HydrophobicContact CG2-CD2 4.12Å; W1068-L1072 HydrophobicContact CE3-CD1 4.16Å; W1068-L1072 HydrophobicContact CH2-CD1 3.77Å; W1068-L1072 HydrophobicContact CZ2-CD1 4.17Å; W1068-L1072 HydrophobicContact CZ2-CD2 4.17Å; W1068-L1072 HydrophobicContact CZ3-CD1 3.76Å; L1069-L1072 HydrophobicContact CD1-CD1 4.48Å; L1072-L1074 HydrophobicContact CD2-CD1 3.58Å; L1072-T1084 HydrophobicContact CD2-CG2 4.3Å; L1072-L1088 HydrophobicContact CD1-CD2 4.18Å; L1072-I1113 HydrophobicContact CB-CD1 4.01Å; L1072-I1113 HydrophobicContact CB-CG1 4.23Å; L1072-I1113 HydrophobicContact CB-CG2 3.82Å; L1072-I1113 HydrophobicContact CD1-CG2 4.47Å
1073	P	94.9	Very high	94.6	Very high	14 Å²	14	44.2 Å²	44.2	9%	0.091	22%	0.221	C	C	.	.	P	Polyproline II helix	cis	-81.4	169.3	-0.2	31.6	-32	0	0	0	113.9	R1033 K1075 F1085 I1113 D1116	R1033-P1073 PolarHBondContact NH2-O 2.98Å; P1073-K1075 HydrophobicContact CG-CG 4.48Å; P1073-F1085 HydrophobicContact CB-CZ 3.98Å; P1073-I1113 HydrophobicContact CB-CG2 3.99Å; P1073-D1116 HydrophobicContact CG-CB 3.69Å
1074	L	94.8	Very high	94.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-86.7	145.9	160	-79.5	60.9	0	0	0	108.4	E1042 I1045 L1072 E1080 A1081 T1084 S1122	E1042-L1074 HydrophobicContact CB-CD2 3.9Å; E1042-L1074 HydrophobicContact CB-CG 3.76Å; E1042-L1074 HydrophobicContact CG-CB 4.31Å; E1042-L1074 HydrophobicContact CG-CD2 4.49Å; E1042-L1074 HydrophobicContact CG-CG 3.8Å; E1042-L1074 VanDerWaalsContact OE1-CA 3.24Å; E1042-L1074 WeakPolarHBondContact OE1-CA 3.49Å; I1045-L1074 HydrophobicContact CB-CD1 4.25Å; I1045-L1074 HydrophobicContact CG2-CD1 3.75Å; L1072-L1074 HydrophobicContact CD2-CD1 3.58Å; L1074-E1080 HydrophobicContact CD2-CB 3.71Å; L1074-A1081 HydrophobicContact CB-CB 3.87Å; L1074-T1084 HydrophobicContact CD1-CG2 4.02Å; L1074-T1084 HydrophobicContact CD2-CG2 3.92Å; L1074-S1122 PolarHBondContact O-OG 2.82Å
1075	K	89.7	Confident	94.8	Very high	58 Å²	58	37.5 Å²	37.5	25%	0.252	19%	0.188	S	C	.	.			trans	-128	-43.2	-169.1	-66.5	-167.2	175.7	-166.4	0	113	E1042 P1073 K1078 D1116 S1122	E1042-K1075 VanDerWaalsContact CD-N 3.29Å; E1042-K1075 PolarHBondContact OE1-N 3.3Å; E1042-K1075 PolarHBondContact OE2-N 3.34Å; E1042-K1075 VanDerWaalsContact OE2-N 3.12Å; P1073-K1075 HydrophobicContact CG-CG 4.48Å; K1075-K1078 PolarHBondContact O-NZ 3.45Å; K1075-D1116 WeakPolarHBondContact CE-OD2 3.2Å; K1075-D1116 IonicContact NZ-OD2 2.71Å; K1075-D1116 PolarHBondContact NZ-OD2 3.39Å; K1075-S1122 WeakPolarHBondContact CA-OG 3.42Å; K1075-S1122 PolarHBondContact O-OG 3.32Å
1076	E	91.9	Very high	94.7	Very high	109 Å²	109	38.9 Å²	38.9	51%	0.509	20%	0.196	S	C	.	.	S	Bend	trans	-90.9	-54.3	-171.7	-52.4	-58.4	147.3	0	0	110	V1038 N1039 E1042 K1078	V1038-E1076 HydrophobicContact CB-CG 4.37Å; V1038-E1076 HydrophobicContact CG1-CG 3.74Å; V1038-E1076 HydrophobicContact CG2-CG 3.69Å; N1039-E1076 WeakPolarHBondContact OD1-CB 3.5Å; E1042-E1076 PolarHBondContact OE2-N 3.24Å; E1076-K1078 PolarHBondContact O-N 2.73Å
1077	D	92.9	Very high	94.8	Very high	23 Å²	23	36.6 Å²	36.6	12%	0.123	18%	0.179	C	C	.	.			trans	-78.8	109	178.6	-167.8	-46	0	0	0	110.5	E1042 N1043 E1079 E1080 A1081	E1042-D1077 HydrophobicContact CB-CB 4.39Å; E1042-D1077 PolarHBondContact OE2-N 3.21Å; N1043-D1077 PolarHBondContact ND2-OD2 3Å; D1077-E1079 PolarHBondContact OD1-N 2.92Å; D1077-E1079 VanDerWaalsContact OD1-N 3.15Å; D1077-E1080 HydrophobicContact CB-CB 4.26Å; D1077-E1080 WeakPolarHBondContact OD1-CB 3.47Å; D1077-E1080 PolarHBondContact OD1-N 3.2Å; D1077-A1081 WeakPolarHBondContact O-CB 3.27Å; D1077-A1081 PolarHBondContact O-N 2.91Å
1078	K	92.1	Very high	94.8	Very high	82 Å²	82	32 Å²	32	36%	0.357	16%	0.158	S	C	.	.	H	α-helix	trans	-77	-32.4	-173.2	-53.1	-57.2	-179.6	179.9	0	112.6	K1075 E1076 V1082 N1120 E1121	K1075-K1078 PolarHBondContact O-NZ 3.45Å; E1076-K1078 PolarHBondContact O-N 2.73Å; K1078-V1082 WeakPolarHBondContact O-CG2 3.36Å; K1078-V1082 PolarHBondContact O-N 3.33Å; K1078-V1082 VanDerWaalsContact O-N 3.14Å; K1078-N1120 PolarHBondContact NZ-O 2.94Å; K1078-E1121 WeakPolarHBondContact CD-O 3.43Å; K1078-E1121 WeakPolarHBondContact CE-O 3.48Å; K1078-E1121 PolarHBondContact NZ-O 3.41Å; K1078-E1121 VanDerWaalsContact NZ-O 3.09Å
1079	E	91.6	Very high	94.6	Very high	137 Å²	137	32 Å²	32	64%	0.64	16%	0.158	S	C	*	.	H	α-helix	trans	-75.5	-46	-177.8	-64.3	179.2	178.1	0	0	109.8	D1077 A1081 V1082 H1083	D1077-E1079 PolarHBondContact OD1-N 2.92Å; D1077-E1079 VanDerWaalsContact OD1-N 3.15Å; E1079-A1081 VanDerWaalsContact C-N 3.32Å; E1079-A1081 PolarHBondContact O-N 3.25Å; E1079-V1082 PolarHBondContact O-N 2.99Å; E1079-H1083 PolarHBondContact O-CD2 2.98Å; E1079-H1083 PolarHBondContact O-N 3.29Å; E1079-H1083 VanDerWaalsContact O-N 3.07Å
1080	E	95.8	Very high	94.5	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.009	17%	0.17	C	C	.	.	H	α-helix	trans	-69.9	-28.9	174.5	-62	-55.1	127	0	0	112.2	Y999 S1046 K1050 L1074 D1077 H1083 T1084	Y999-E1080 WeakPolarHBondContact CE2-OE1 3.11Å; S1046-E1080 WeakPolarHBondContact CB-OE2 3.37Å; S1046-E1080 PolarHBondContact OG-OE2 2.62Å; K1050-E1080 VanDerWaalsContact CE-OE2 3.26Å; K1050-E1080 WeakPolarHBondContact CE-OE2 3.42Å; K1050-E1080 IonicContact NZ-OE1 2.78Å; K1050-E1080 PolarHBondContact NZ-OE1 3.41Å; K1050-E1080 IonicContact NZ-OE2 2.72Å; K1050-E1080 PolarHBondContact NZ-OE2 2.97Å; L1074-E1080 HydrophobicContact CD2-CB 3.71Å; D1077-E1080 HydrophobicContact CB-CB 4.26Å; D1077-E1080 WeakPolarHBondContact OD1-CB 3.47Å; D1077-E1080 PolarHBondContact OD1-N 3.2Å; E1080-H1083 PolarHBondContact O-N 3.34Å; E1080-H1083 IonicContact OE1-CD2 3.64Å; E1080-T1084 WeakPolarHBondContact O-CG2 3.4Å; E1080-T1084 PolarHBondContact O-N 3.27Å; E1080-T1084 PolarHBondContact O-OG1 3.43Å
1081	A	94.4	Very high	94.5	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-59.8	-49.9	168.4	0	0	0	0	0	111.9	L1074 D1077 E1079 H1083 T1084 F1085 S1122	L1074-A1081 HydrophobicContact CB-CB 3.87Å; D1077-A1081 WeakPolarHBondContact O-CB 3.27Å; D1077-A1081 PolarHBondContact O-N 2.91Å; E1079-A1081 VanDerWaalsContact C-N 3.32Å; E1079-A1081 PolarHBondContact O-N 3.25Å; A1081-H1083 VanDerWaalsContact C-N 3.34Å; A1081-H1083 PolarHBondContact O-N 3.18Å; A1081-T1084 PolarHBondContact O-N 3.31Å; A1081-T1084 PolarHBondContact O-OG1 3.04Å; A1081-F1085 HydrophobicContact CB-CD2 4.46Å; A1081-F1085 WeakPolarHBondContact O-CB 3.34Å; A1081-F1085 WeakPolarHBondContact O-CD2 3.37Å; A1081-F1085 PolarHBondContact O-N 3.29Å; A1081-S1122 WeakPolarHBondContact CB-O 3.37Å
1082	V	93.9	Very high	94.3	Very high	33 Å²	33	31 Å²	31	20%	0.2	15%	0.151	C	C	.	.	H	α-helix	trans	-58.2	-45.6	176.1	172.3	0	0	0	0	110.9	K1078 E1079 T1084 F1085 D1086 V1123 D1127	K1078-V1082 WeakPolarHBondContact O-CG2 3.36Å; K1078-V1082 PolarHBondContact O-N 3.33Å; K1078-V1082 VanDerWaalsContact O-N 3.14Å; E1079-V1082 PolarHBondContact O-N 2.99Å; V1082-T1084 PolarHBondContact O-N 2.75Å; V1082-F1085 PolarHBondContact O-N 2.97Å; V1082-D1086 WeakPolarHBondContact O-CB 3.37Å; V1082-D1086 PolarHBondContact O-N 3.42Å; V1082-V1123 HydrophobicContact CG2-CG1 4.19Å; V1082-D1127 HydrophobicContact CG2-CB 4.44Å; V1082-D1127 WeakPolarHBondContact CG2-OD2 3.43Å
1083	H	94.9	Very high	94	Very high	54 Å²	54	34.9 Å²	34.9	25%	0.25	17%	0.168	C	C	.	.	H	α-helix	trans	-59.7	-44.1	177.7	-78	-49.4	0	0	0	113.6	E1079 E1080 A1081 F1087	E1079-H1083 PolarHBondContact O-CD2 2.98Å; E1079-H1083 PolarHBondContact O-N 3.29Å; E1079-H1083 VanDerWaalsContact O-N 3.07Å; E1080-H1083 PolarHBondContact O-N 3.34Å; E1080-H1083 IonicContact OE1-CD2 3.64Å; A1081-H1083 VanDerWaalsContact C-N 3.34Å; A1081-H1083 PolarHBondContact O-N 3.18Å; H1083-F1087 PolarHBondContact O-N 3.35Å; H1083-F1087 VanDerWaalsContact O-N 3.15Å
1084	T	96.8	Very high	93.9	Very high	3 Å²	3	38 Å²	38	2%	0.018	19%	0.191	C	C	.	.	H	α-helix	trans	-70.8	-37.4	178.7	54.1	0	0	0	0	112.4	W1068 L1072 L1074 E1080 A1081 V1082 F1087 L1088	W1068-T1084 HydrophobicContact CZ2-CG2 3.94Å; L1072-T1084 HydrophobicContact CD2-CG2 4.3Å; L1074-T1084 HydrophobicContact CD1-CG2 4.02Å; L1074-T1084 HydrophobicContact CD2-CG2 3.92Å; E1080-T1084 WeakPolarHBondContact O-CG2 3.4Å; E1080-T1084 PolarHBondContact O-N 3.27Å; E1080-T1084 PolarHBondContact O-OG1 3.43Å; A1081-T1084 PolarHBondContact O-N 3.31Å; A1081-T1084 PolarHBondContact O-OG1 3.04Å; V1082-T1084 PolarHBondContact O-N 2.75Å; T1084-F1087 PolarHBondContact O-N 3.36Å; T1084-L1088 WeakPolarHBondContact O-CB 3.42Å; T1084-L1088 PolarHBondContact O-N 2.89Å
1085	F	95.8	Very high	93.5	Very high	3 Å²	3	43.9 Å²	43.9	1%	0.013	22%	0.222	C	C	.	.	H	α-helix	trans	-66.3	-39.6	173.5	-82.6	-61.8	0	0	0	112.8	P1073 A1081 V1082 F1087 L1088 C1089 I1113 I1114 V1123 C1129 L1133	P1073-F1085 HydrophobicContact CB-CZ 3.98Å; A1081-F1085 HydrophobicContact CB-CD2 4.46Å; A1081-F1085 WeakPolarHBondContact O-CB 3.34Å; A1081-F1085 WeakPolarHBondContact O-CD2 3.37Å; A1081-F1085 PolarHBondContact O-N 3.29Å; V1082-F1085 PolarHBondContact O-N 2.97Å; F1085-F1087 VanDerWaalsContact C-N 3.35Å; F1085-F1087 PolarHBondContact O-N 3.07Å; F1085-L1088 HydrophobicContact CD1-CD2 4.39Å; F1085-L1088 PolarHBondContact O-N 3.21Å; F1085-C1089 PolarHBondContact O-N 3.09Å; F1085-C1089 PolarHBondContact O-SG 3.24Å; F1085-C1089 VanDerWaalsContact O-SG 3.32Å; F1085-I1113 HydrophobicContact CE1-CG2 3.95Å; F1085-I1113 HydrophobicContact CZ-CG2 4.39Å; F1085-I1114 HydrophobicContact CE1-CG1 4.4Å; F1085-V1123 HydrophobicContact CD2-CG1 3.48Å; F1085-V1123 VanDerWaalsContact CD2-CG1 3.48Å; F1085-V1123 HydrophobicContact CE2-CG1 4.01Å; F1085-V1123 HydrophobicContact CG-CG1 4.24Å; F1085-C1129 HydrophobicContact CB-CB 4.42Å; F1085-L1133 HydrophobicContact CB-CD1 4.18Å; F1085-L1133 HydrophobicContact CB-CD2 4.44Å; F1085-L1133 HydrophobicContact CD1-CD1 3.89Å; F1085-L1133 HydrophobicContact CD1-CD2 3.78Å; F1085-L1133 HydrophobicContact CD1-CG 4.5Å; F1085-L1133 HydrophobicContact CE1-CD1 4.48Å; F1085-L1133 HydrophobicContact CG-CD1 4.03Å; F1085-L1133 HydrophobicContact CG-CD2 4.46Å
1086	D	94.9	Very high	93.5	Very high	31 Å²	31	42.5 Å²	42.5	17%	0.166	22%	0.217	C	C	.	.	H	α-helix	trans	-64.5	-38.8	175.3	-107.2	-21.5	0	0	0	112.3	V1082 C1089 D1090 C1129 R1132	V1082-D1086 WeakPolarHBondContact O-CB 3.37Å; V1082-D1086 PolarHBondContact O-N 3.42Å; D1086-C1089 PolarHBondContact O-N 3.12Å; D1086-D1090 PolarHBondContact O-N 3.38Å; D1086-D1090 VanDerWaalsContact O-OD1 3.13Å; D1086-C1129 HydrophobicContact CB-CB 4.47Å; D1086-C1129 WeakPolarHBondContact OD1-CB 3.43Å; D1086-R1132 PolarHBondContact O-NH1 3.33Å; D1086-R1132 IonicContact OD1-CZ 2.68Å; D1086-R1132 IonicContact OD1-NH1 3.37Å; D1086-R1132 PolarHBondContact OD1-NH1 3.09Å
1087	F	96.6	Very high	93.3	Very high	13 Å²	13	42 Å²	42	6%	0.057	22%	0.223	C	C	.	.	H	α-helix	trans	-69.7	-37.4	174.5	-175.9	-135.3	0	0	0	112.4	M1052 R1053 W1068 H1083 T1084 F1085 C1089 D1090 L1091	M1052-F1087 HydrophobicContact CB-CE1 3.74Å; M1052-F1087 HydrophobicContact CB-CZ 3.72Å; M1052-F1087 HydrophobicContact CE-CE1 3.93Å; R1053-F1087 HydrophobicContact CB-CD2 3.64Å; R1053-F1087 HydrophobicContact CB-CE2 3.64Å; R1053-F1087 HydrophobicContact CB-CG 4.1Å; R1053-F1087 HydrophobicContact CB-CZ 4.1Å; R1053-F1087 HydrophobicContact CG-CD2 3.51Å; R1053-F1087 HydrophobicContact CG-CE2 3.8Å; R1053-F1087 HydrophobicContact CG-CG 4.25Å; W1068-F1087 HydrophobicContact CH2-CB 4.29Å; W1068-F1087 AromaticContact CH2-CD1 3.54Å; W1068-F1087 HydrophobicContact CH2-CD1 3.54Å; W1068-F1087 HydrophobicContact CH2-CE1 4.29Å; W1068-F1087 HydrophobicContact CH2-CG 4.3Å; W1068-F1087 AromaticContact CZ2-CD1 3.78Å; W1068-F1087 HydrophobicContact CZ2-CD1 3.78Å; W1068-F1087 HydrophobicContact CZ3-CD1 4.01Å; W1068-F1087 HydrophobicContact CZ3-CE1 4.36Å; H1083-F1087 PolarHBondContact O-N 3.35Å; H1083-F1087 VanDerWaalsContact O-N 3.15Å; T1084-F1087 PolarHBondContact O-N 3.36Å; F1085-F1087 VanDerWaalsContact C-N 3.35Å; F1085-F1087 PolarHBondContact O-N 3.07Å; F1087-C1089 VanDerWaalsContact C-N 3.29Å; F1087-C1089 PolarHBondContact O-N 3.4Å; F1087-D1090 HydrophobicContact CD2-CB 4.36Å; F1087-D1090 WeakPolarHBondContact O-CB 3.35Å; F1087-D1090 PolarHBondContact O-N 3.04Å; F1087-L1091 HydrophobicContact CD1-CD1 4.02Å; F1087-L1091 HydrophobicContact CD2-CD1 4.3Å; F1087-L1091 HydrophobicContact CD2-CG 4.27Å; F1087-L1091 HydrophobicContact CE1-CD1 3.75Å; F1087-L1091 HydrophobicContact CE1-CG 4.49Å; F1087-L1091 HydrophobicContact CE2-CD1 4.05Å; F1087-L1091 HydrophobicContact CE2-CD2 4.13Å; F1087-L1091 HydrophobicContact CE2-CG 3.92Å; F1087-L1091 HydrophobicContact CG-CD1 4.28Å; F1087-L1091 HydrophobicContact CZ-CD1 3.77Å; F1087-L1091 HydrophobicContact CZ-CD2 4.07Å; F1087-L1091 HydrophobicContact CZ-CG 4.04Å; F1087-L1091 WeakPolarHBondContact O-CD1 3.22Å; F1087-L1091 VanDerWaalsContact O-CG 3.32Å; F1087-L1091 WeakPolarHBondContact O-CG 3.34Å; F1087-L1091 PolarHBondContact O-N 3.1Å; F1087-L1091 VanDerWaalsContact O-N 3.07Å
1088	L	96	Very high	93.2	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-60.4	-40.2	172.4	-179	61.1	0	0	0	111.3	W1068 L1069 L1072 T1084 F1085 L1091 I1092 V1099 I1113	W1068-L1088 HydrophobicContact CH2-CB 4.35Å; L1069-L1088 HydrophobicContact CD1-CD1 3.88Å; L1072-L1088 HydrophobicContact CD1-CD2 4.18Å; T1084-L1088 WeakPolarHBondContact O-CB 3.42Å; T1084-L1088 PolarHBondContact O-N 2.89Å; F1085-L1088 HydrophobicContact CD1-CD2 4.39Å; F1085-L1088 PolarHBondContact O-N 3.21Å; L1088-L1091 PolarHBondContact O-N 3.37Å; L1088-I1092 HydrophobicContact CD1-CD1 4Å; L1088-I1092 HydrophobicContact CD1-CG1 4.41Å; L1088-I1092 HydrophobicContact CG-CD1 3.89Å; L1088-I1092 VanDerWaalsContact O-CG1 3.3Å; L1088-I1092 WeakPolarHBondContact O-CG1 3.37Å; L1088-I1092 PolarHBondContact O-N 3.07Å; L1088-V1099 HydrophobicContact CD1-CG2 4.04Å; L1088-I1113 HydrophobicContact CD2-CG2 4.16Å
1089	C	94.5	Very high	93.2	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-62.2	-46.3	172.8	-70.7	0	0	0	0	112.1	F1085 D1086 F1087 L1091 I1092 E1093 R1132 L1133	F1085-C1089 PolarHBondContact O-N 3.09Å; F1085-C1089 PolarHBondContact O-SG 3.24Å; F1085-C1089 VanDerWaalsContact O-SG 3.32Å; D1086-C1089 PolarHBondContact O-N 3.12Å; F1087-C1089 VanDerWaalsContact C-N 3.29Å; F1087-C1089 PolarHBondContact O-N 3.4Å; C1089-L1091 PolarHBondContact O-N 3.4Å; C1089-I1092 PolarHBondContact O-N 3.29Å; C1089-I1092 VanDerWaalsContact O-N 3.15Å; C1089-E1093 VanDerWaalsContact O-CB 3.31Å; C1089-E1093 WeakPolarHBondContact O-CB 3.33Å; C1089-E1093 VanDerWaalsContact O-CG 3.26Å; C1089-E1093 WeakPolarHBondContact O-CG 3.29Å; C1089-E1093 PolarHBondContact O-N 3.34Å; C1089-R1132 HydrophobicContact CB-CB 4.03Å; C1089-R1132 VanDerWaalsContact SG-CB 3.59Å; C1089-L1133 WeakPolarHBondContact SG-CD2 3.44Å
1090	D	94.6	Very high	93.2	Very high	50 Å²	50	33.8 Å²	33.8	27%	0.267	19%	0.187	S	C	.	.	H	α-helix	trans	-54.5	-42.2	175.8	-67	0.4	0	0	0	111.7	R1053 D1086 F1087 S1094 R1132	R1053-D1090 IonicContact CZ-OD2 3.78Å; R1053-D1090 IonicContact NE-OD2 2.82Å; R1053-D1090 PolarHBondContact NE-OD2 3.27Å; R1053-D1090 VanDerWaalsContact NH2-CG 3.35Å; R1053-D1090 IonicContact NH2-OD1 2.74Å; R1053-D1090 PolarHBondContact NH2-OD1 3.43Å; R1053-D1090 IonicContact NH2-OD2 2.57Å; R1053-D1090 PolarHBondContact NH2-OD2 3.37Å; D1086-D1090 PolarHBondContact O-N 3.38Å; D1086-D1090 VanDerWaalsContact O-OD1 3.13Å; F1087-D1090 HydrophobicContact CD2-CB 4.36Å; F1087-D1090 WeakPolarHBondContact O-CB 3.35Å; F1087-D1090 PolarHBondContact O-N 3.04Å; D1090-S1094 VanDerWaalsContact O-CB 3.23Å; D1090-S1094 WeakPolarHBondContact O-CB 3.44Å; D1090-S1094 PolarHBondContact O-N 3.11Å; D1090-S1094 PolarHBondContact O-OG 3.1Å; D1090-R1132 IonicContact OD1-CZ 3.38Å; D1090-R1132 IonicContact OD1-NH1 3.2Å; D1090-R1132 PolarHBondContact OD1-NH1 2.95Å; D1090-R1132 VanDerWaalsContact OD1-NH1 3.09Å; D1090-R1132 IonicContact OD1-NH2 3.46Å; D1090-R1132 PolarHBondContact OD1-NH2 2.82Å
1091	L	94.6	Very high	93	Very high	11 Å²	11	34 Å²	34	6%	0.058	19%	0.19	C	C	.	.	H	α-helix	trans	-69.4	-35.9	-179.6	-69.4	163.2	0	0	0	112.8	L1065 W1068 F1087 L1088 C1089 S1094 N1096 V1099	L1065-L1091 HydrophobicContact CD1-CD1 3.61Å; L1065-L1091 HydrophobicContact CD1-CD2 4.41Å; L1065-L1091 HydrophobicContact CD2-CD2 4.03Å; W1068-L1091 HydrophobicContact CZ3-CD1 3.91Å; F1087-L1091 HydrophobicContact CD1-CD1 4.02Å; F1087-L1091 HydrophobicContact CD2-CD1 4.3Å; F1087-L1091 HydrophobicContact CD2-CG 4.27Å; F1087-L1091 HydrophobicContact CE1-CD1 3.75Å; F1087-L1091 HydrophobicContact CE1-CG 4.49Å; F1087-L1091 HydrophobicContact CE2-CD1 4.05Å; F1087-L1091 HydrophobicContact CE2-CD2 4.13Å; F1087-L1091 HydrophobicContact CE2-CG 3.92Å; F1087-L1091 HydrophobicContact CG-CD1 4.28Å; F1087-L1091 HydrophobicContact CZ-CD1 3.77Å; F1087-L1091 HydrophobicContact CZ-CD2 4.07Å; F1087-L1091 HydrophobicContact CZ-CG 4.04Å; F1087-L1091 WeakPolarHBondContact O-CD1 3.22Å; F1087-L1091 VanDerWaalsContact O-CG 3.32Å; F1087-L1091 WeakPolarHBondContact O-CG 3.34Å; F1087-L1091 PolarHBondContact O-N 3.1Å; F1087-L1091 VanDerWaalsContact O-N 3.07Å; L1088-L1091 PolarHBondContact O-N 3.37Å; C1089-L1091 PolarHBondContact O-N 3.4Å; L1091-S1094 WeakPolarHBondContact CA-OG 3.43Å; L1091-S1094 PolarHBondContact O-OG 2.83Å; L1091-S1094 VanDerWaalsContact O-OG 3.11Å; L1091-N1096 HydrophobicContact CB-CB 4.49Å; L1091-N1096 HydrophobicContact CD2-CB 4.41Å; L1091-N1096 WeakPolarHBondContact O-CB 3.29Å; L1091-N1096 PolarHBondContact O-N 3.45Å; L1091-V1099 HydrophobicContact CB-CB 4.24Å; L1091-V1099 HydrophobicContact CB-CG1 4.02Å; L1091-V1099 HydrophobicContact CB-CG2 4.18Å; L1091-V1099 HydrophobicContact CD1-CG2 4.29Å
1092	I	92.5	Very high	92.7	Very high	14 Å²	14	39.2 Å²	39.2	7%	0.072	22%	0.224	C	C	.	.	H	α-helix	trans	-76.6	-45.8	177.8	-66.2	165.7	0	0	0	110.6	L1088 C1089 S1094 N1095 V1099 L1100 I1110 V1136	L1088-I1092 HydrophobicContact CD1-CD1 4Å; L1088-I1092 HydrophobicContact CD1-CG1 4.41Å; L1088-I1092 HydrophobicContact CG-CD1 3.89Å; L1088-I1092 VanDerWaalsContact O-CG1 3.3Å; L1088-I1092 WeakPolarHBondContact O-CG1 3.37Å; L1088-I1092 PolarHBondContact O-N 3.07Å; C1089-I1092 PolarHBondContact O-N 3.29Å; C1089-I1092 VanDerWaalsContact O-N 3.15Å; I1092-S1094 VanDerWaalsContact C-N 3.29Å; I1092-S1094 PolarHBondContact O-N 3.39Å; I1092-N1095 WeakPolarHBondContact O-CA 3.35Å; I1092-N1095 PolarHBondContact O-N 3.11Å; I1092-V1099 HydrophobicContact CG1-CG1 4.05Å; I1092-L1100 HydrophobicContact CG1-CD2 4.46Å; I1092-L1100 HydrophobicContact CG2-CD2 4.43Å; I1092-I1110 HydrophobicContact CD1-CD1 4.21Å; I1092-I1110 HydrophobicContact CD1-CG2 3.69Å; I1092-I1110 HydrophobicContact CG1-CD1 4.39Å; I1092-V1136 HydrophobicContact CB-CG2 4.34Å; I1092-V1136 HydrophobicContact CD1-CG1 4.15Å; I1092-V1136 HydrophobicContact CG2-CB 4.48Å; I1092-V1136 HydrophobicContact CG2-CG1 3.9Å; I1092-V1136 HydrophobicContact CG2-CG2 3.75Å
1093	E	91.6	Very high	92.4	Very high	95 Å²	95	47 Å²	47	44%	0.444	26%	0.258	S	S	.	.	H	α-helix	trans	-62.6	-35.2	178.6	-69.9	169.4	-168.8	0	0	111.7	C1089 N1095 R1132	C1089-E1093 VanDerWaalsContact O-CB 3.31Å; C1089-E1093 WeakPolarHBondContact O-CB 3.33Å; C1089-E1093 VanDerWaalsContact O-CG 3.26Å; C1089-E1093 WeakPolarHBondContact O-CG 3.29Å; C1089-E1093 PolarHBondContact O-N 3.34Å; E1093-N1095 PolarHBondContact O-N 2.98Å; E1093-N1095 PolarHBondContact O-ND2 3.43Å; E1093-N1095 VanDerWaalsContact O-ND2 3.1Å; E1093-R1132 IonicContact OE1-CZ 2.75Å; E1093-R1132 IonicContact OE1-NE 2.68Å; E1093-R1132 PolarHBondContact OE1-NE 2.76Å; E1093-R1132 IonicContact OE1-NH2 3.73Å; E1093-R1132 PolarHBondContact OE1-NH2 3.05Å; E1093-R1132 IonicContact OE2-CZ 3.97Å; E1093-R1132 IonicContact OE2-NE 3.94Å; E1093-R1132 IonicContact OE2-NH2 3.08Å; E1093-R1132 PolarHBondContact OE2-NH2 3.32Å
1094	S	91.3	Very high	92.1	Very high	81 Å²	81	47.6 Å²	47.6	57%	0.566	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	1.6	171.4	59.5	0	0	0	0	114.7	D1090 L1091 I1092 N1096	D1090-S1094 VanDerWaalsContact O-CB 3.23Å; D1090-S1094 WeakPolarHBondContact O-CB 3.44Å; D1090-S1094 PolarHBondContact O-N 3.11Å; D1090-S1094 PolarHBondContact O-OG 3.1Å; L1091-S1094 WeakPolarHBondContact CA-OG 3.43Å; L1091-S1094 PolarHBondContact O-OG 2.83Å; L1091-S1094 VanDerWaalsContact O-OG 3.11Å; I1092-S1094 VanDerWaalsContact C-N 3.29Å; I1092-S1094 PolarHBondContact O-N 3.39Å; S1094-N1096 VanDerWaalsContact C-N 3.29Å; S1094-N1096 PolarHBondContact O-N 2.86Å
1095	N	87.6	Confident	91.8	Very high	122 Å²	122	50.8 Å²	50.8	65%	0.652	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	41	-177.3	-69.8	-105.7	0	0	0	112.5	I1092 E1093 P1097	I1092-N1095 WeakPolarHBondContact O-CA 3.35Å; I1092-N1095 PolarHBondContact O-N 3.11Å; E1093-N1095 PolarHBondContact O-N 2.98Å; E1093-N1095 PolarHBondContact O-ND2 3.43Å; E1093-N1095 VanDerWaalsContact O-ND2 3.1Å; N1095-P1097 WeakPolarHBondContact O-CD 3.15Å
1096	N	90.3	Very high	91.7	Very high	29 Å²	29	52.9 Å²	52.9	16%	0.155	30%	0.297	C	S	.	.			trans	-63.5	118.3	-175.7	-174.4	-58.8	0	0	0	111.2	L1091 S1094 I1098 V1099 L1100	L1091-N1096 HydrophobicContact CB-CB 4.49Å; L1091-N1096 HydrophobicContact CD2-CB 4.41Å; L1091-N1096 WeakPolarHBondContact O-CB 3.29Å; L1091-N1096 PolarHBondContact O-N 3.45Å; S1094-N1096 VanDerWaalsContact C-N 3.29Å; S1094-N1096 PolarHBondContact O-N 2.86Å; N1096-I1098 PolarHBondContact O-N 3.28Å; N1096-I1098 WeakPolarHBondContact OD1-CA 2.83Å; N1096-I1098 WeakPolarHBondContact OD1-CB 3.02Å; N1096-I1098 PolarHBondContact OD1-N 3.4Å; N1096-V1099 HydrophobicContact CB-CB 4.3Å; N1096-V1099 HydrophobicContact CB-CG1 4.06Å; N1096-V1099 PolarHBondContact O-N 3.13Å; N1096-V1099 PolarHBondContact OD1-N 2.73Å; N1096-V1099 VanDerWaalsContact OD1-N 3.16Å; N1096-L1100 PolarHBondContact O-N 2.6Å; N1096-L1100 VanDerWaalsContact O-N 3.1Å
1097	P	87.1	Confident	91.5	Very high	99 Å²	99	51.8 Å²	51.8	64%	0.643	29%	0.291	S	S	*	.	H	α-helix	trans	-71.8	-15.7	-172.8	29.4	-36.1	0	0	0	113.5	N1095 G1101	N1095-P1097 WeakPolarHBondContact O-CD 3.15Å; P1097-G1101 CarbonylContact O-C 3.36Å; P1097-G1101 VanDerWaalsContact O-CA 3.31Å; P1097-G1101 WeakPolarHBondContact O-CA 3.49Å; P1097-G1101 PolarHBondContact O-N 2.85Å; P1097-G1101 VanDerWaalsContact O-N 3.13Å
1098	I	89.9	Confident	91.3	Very high	50 Å²	50	52 Å²	52	26%	0.256	29%	0.294	S	S	.	.	H	α-helix	trans	-83.9	-41.5	176.5	-58.5	176.2	0	0	0	109.8	N1062 L1065 P1066 N1096 G1101 N1106	N1062-I1098 HydrophobicContact CB-CD1 3.59Å; N1062-I1098 VanDerWaalsContact OD1-CD1 3.23Å; N1062-I1098 WeakPolarHBondContact OD1-CD1 3.32Å; L1065-I1098 HydrophobicContact CB-CG2 4.36Å; L1065-I1098 HydrophobicContact CD2-CB 4.12Å; L1065-I1098 HydrophobicContact CD2-CG2 4.1Å; L1065-I1098 HydrophobicContact CG-CG2 4.28Å; P1066-I1098 HydrophobicContact CG-CG2 3.64Å; N1096-I1098 PolarHBondContact O-N 3.28Å; N1096-I1098 WeakPolarHBondContact OD1-CA 2.83Å; N1096-I1098 WeakPolarHBondContact OD1-CB 3.02Å; N1096-I1098 PolarHBondContact OD1-N 3.4Å; I1098-G1101 PolarHBondContact O-N 2.82Å; I1098-N1106 PolarHBondContact O-ND2 3Å
1099	V	92.4	Very high	91.2	Very high	0 Å²	0	56 Å²	56	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-68.2	-45.4	177.7	98.2	0	0	0	0	111.2	L1065 L1069 L1088 L1091 I1092 N1096 G1101 N1106	L1065-V1099 HydrophobicContact CD1-CG2 4.22Å; L1065-V1099 HydrophobicContact CD2-CB 4.3Å; L1069-V1099 HydrophobicContact CD1-CG2 4.19Å; L1069-V1099 HydrophobicContact CD2-CG2 3.91Å; L1069-V1099 WeakPolarHBondContact CD2-O 3.27Å; L1088-V1099 HydrophobicContact CD1-CG2 4.04Å; L1091-V1099 HydrophobicContact CB-CB 4.24Å; L1091-V1099 HydrophobicContact CB-CG1 4.02Å; L1091-V1099 HydrophobicContact CB-CG2 4.18Å; L1091-V1099 HydrophobicContact CD1-CG2 4.29Å; I1092-V1099 HydrophobicContact CG1-CG1 4.05Å; N1096-V1099 HydrophobicContact CB-CB 4.3Å; N1096-V1099 HydrophobicContact CB-CG1 4.06Å; N1096-V1099 PolarHBondContact O-N 3.13Å; N1096-V1099 PolarHBondContact OD1-N 2.73Å; N1096-V1099 VanDerWaalsContact OD1-N 3.16Å; V1099-G1101 VanDerWaalsContact C-N 3.32Å; V1099-N1106 WeakPolarHBondContact O-CB 3.47Å; V1099-N1106 PolarHBondContact O-ND2 2.89Å
1100	L	91.8	Very high	91.2	Very high	19 Å²	19	56 Å²	56	10%	0.099	31%	0.311	C	S	.	.	H	α-helix	trans	-73.1	-26.7	177.9	-62.5	176.7	0	0	0	112.5	I1092 N1096 N1104 S1105 N1106 L1107 I1110	I1092-L1100 HydrophobicContact CG1-CD2 4.46Å; I1092-L1100 HydrophobicContact CG2-CD2 4.43Å; N1096-L1100 PolarHBondContact O-N 2.6Å; N1096-L1100 VanDerWaalsContact O-N 3.1Å; L1100-N1104 CarbonylContact O-C 3.57Å; L1100-N1104 VanDerWaalsContact O-CA 3.25Å; L1100-N1104 WeakPolarHBondContact O-CA 3.34Å; L1100-S1105 PolarHBondContact O-N 2.66Å; L1100-N1106 WeakPolarHBondContact O-CB 3.33Å; L1100-N1106 PolarHBondContact O-N 3.28Å; L1100-L1107 HydrophobicContact CD2-CD1 4.11Å; L1100-I1110 HydrophobicContact CD2-CD1 4.29Å
1101	G	91.5	Very high	91.2	Very high	8 Å²	8	53.6 Å²	53.6	8%	0.082	30%	0.298	C	S	.	.			trans	73.5	166.4	-173.5	0	0	0	0	0	113.2	P1097 I1098 V1099 E1103 N1104	P1097-G1101 CarbonylContact O-C 3.36Å; P1097-G1101 VanDerWaalsContact O-CA 3.31Å; P1097-G1101 WeakPolarHBondContact O-CA 3.49Å; P1097-G1101 PolarHBondContact O-N 2.85Å; P1097-G1101 VanDerWaalsContact O-N 3.13Å; I1098-G1101 PolarHBondContact O-N 2.82Å; V1099-G1101 VanDerWaalsContact C-N 3.32Å; G1101-E1103 PolarHBondContact O-N 2.96Å; G1101-N1104 PolarHBondContact O-N 2.95Å; G1101-N1104 VanDerWaalsContact O-N 3.14Å
1102	P	89	Confident	91.1	Very high	109 Å²	109	56.1 Å²	56.1	71%	0.708	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-53.9	131.5	172.9	-22.9	33.6	0	0	0	110.7	N1104 S1105	P1102-N1104 PolarHBondContact O-N 3.05Å; P1102-N1104 VanDerWaalsContact O-N 3.15Å; P1102-S1105 VanDerWaalsContact O-CB 3.25Å; P1102-S1105 WeakPolarHBondContact O-CB 3.26Å; P1102-S1105 PolarHBondContact O-N 3.49Å; P1102-S1105 PolarHBondContact O-OG 3.4Å
1103	E	86.8	Confident	91.3	Very high	195 Å²	195	55.6 Å²	55.6	91%	0.911	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	53.9	30.8	-179.6	-56.1	-173.7	165.7	0	0	114.2	G1101 S1105	G1101-E1103 PolarHBondContact O-N 2.96Å; E1103-S1105 VanDerWaalsContact C-N 3.27Å; E1103-S1105 PolarHBondContact O-N 3.33Å
1104	N	89.2	Confident	91.4	Very high	67 Å²	67	51.1 Å²	51.1	36%	0.358	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	62.2	27.4	-176.5	-53.7	-37.6	0	0	0	114.1	L1100 G1101 P1102 N1106 L1107	L1100-N1104 CarbonylContact O-C 3.57Å; L1100-N1104 VanDerWaalsContact O-CA 3.25Å; L1100-N1104 WeakPolarHBondContact O-CA 3.34Å; G1101-N1104 PolarHBondContact O-N 2.95Å; G1101-N1104 VanDerWaalsContact O-N 3.14Å; P1102-N1104 PolarHBondContact O-N 3.05Å; P1102-N1104 VanDerWaalsContact O-N 3.15Å; N1104-N1106 PolarHBondContact O-N 3.18Å; N1104-N1106 VanDerWaalsContact O-N 3.16Å; N1104-L1107 HydrophobicContact CB-CB 4.32Å; N1104-L1107 HydrophobicContact CB-CD2 4.42Å; N1104-L1107 WeakPolarHBondContact O-CB 3.32Å; N1104-L1107 PolarHBondContact O-N 2.94Å
1105	S	90.8	Very high	91.4	Very high	70 Å²	70	47.3 Å²	47.3	49%	0.49	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-23.9	-176.4	42.9	0	0	0	0	115.5	L1100 P1102 E1103	L1100-S1105 PolarHBondContact O-N 2.66Å; P1102-S1105 VanDerWaalsContact O-CB 3.25Å; P1102-S1105 WeakPolarHBondContact O-CB 3.26Å; P1102-S1105 PolarHBondContact O-N 3.49Å; P1102-S1105 PolarHBondContact O-OG 3.4Å; E1103-S1105 VanDerWaalsContact C-N 3.27Å; E1103-S1105 PolarHBondContact O-N 3.33Å
1106	N	93.8	Very high	91.6	Very high	48 Å²	48	43 Å²	43	26%	0.257	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-9.5	176.4	-65.9	-23.8	0	0	0	113.8	L1069 I1098 V1099 L1100 N1104 K1109 I1110	L1069-N1106 HydrophobicContact CD2-CB 4.29Å; I1098-N1106 PolarHBondContact O-ND2 3Å; V1099-N1106 WeakPolarHBondContact O-CB 3.47Å; V1099-N1106 PolarHBondContact O-ND2 2.89Å; L1100-N1106 WeakPolarHBondContact O-CB 3.33Å; L1100-N1106 PolarHBondContact O-N 3.28Å; N1104-N1106 PolarHBondContact O-N 3.18Å; N1104-N1106 VanDerWaalsContact O-N 3.16Å; N1106-K1109 WeakPolarHBondContact O-CA 3.37Å; N1106-K1109 VanDerWaalsContact O-CB 3.32Å; N1106-K1109 WeakPolarHBondContact O-CB 3.32Å; N1106-K1109 PolarHBondContact O-N 3.11Å; N1106-I1110 PolarHBondContact O-N 3.38Å
1107	L	90.8	Very high	91.4	Very high	8 Å²	8	41.6 Å²	41.6	4%	0.042	23%	0.231	C	C	.	.	H	α-helix	trans	-59.4	-37.8	-173.1	-159.6	74.1	0	0	0	114.5	L1100 N1104 K1109 I1110 F1111 V1140 L1146	L1100-L1107 HydrophobicContact CD2-CD1 4.11Å; N1104-L1107 HydrophobicContact CB-CB 4.32Å; N1104-L1107 HydrophobicContact CB-CD2 4.42Å; N1104-L1107 WeakPolarHBondContact O-CB 3.32Å; N1104-L1107 PolarHBondContact O-N 2.94Å; L1107-K1109 VanDerWaalsContact C-N 3.28Å; L1107-K1109 PolarHBondContact O-N 3.43Å; L1107-I1110 HydrophobicContact CD1-CD1 4.5Å; L1107-I1110 PolarHBondContact O-N 3.14Å; L1107-F1111 WeakPolarHBondContact O-CD2 3.44Å; L1107-F1111 PolarHBondContact O-N 3.28Å; L1107-V1140 HydrophobicContact CD1-CG2 4.2Å; L1107-V1140 HydrophobicContact CD2-CB 4.43Å; L1107-V1140 HydrophobicContact CD2-CG1 3.78Å; L1107-V1140 HydrophobicContact CD2-CG2 3.72Å; L1107-V1140 HydrophobicContact CG-CG2 4.27Å; L1107-L1146 HydrophobicContact CD2-CD1 4.06Å; L1107-L1146 HydrophobicContact CD2-CD2 3.5Å; L1107-L1146 HydrophobicContact CD2-CG 3.69Å
1108	P	91.9	Very high	91.5	Very high	18 Å²	18	38.3 Å²	38.3	12%	0.117	21%	0.209	C	C	.	.	H	α-helix	trans	-62.7	-33.5	172.3	-23.1	35	0	0	0	113.1	F1111 L1112 Q1149 T1153	P1108-F1111 WeakPolarHBondContact O-CB 3.34Å; P1108-F1111 PolarHBondContact O-N 3.2Å; P1108-L1112 PolarHBondContact O-N 3.2Å; P1108-Q1149 HydrophobicContact CG-CG 4.29Å; P1108-T1153 HydrophobicContact CB-CG2 4.14Å
1109	K	93.4	Very high	91.4	Very high	82 Å²	82	37.8 Å²	37.8	36%	0.357	21%	0.212	S	C	.	.	H	α-helix	trans	-70.9	-40.2	175.1	-173.3	-175.8	-176.7	178.3	0	111.4	L1069 S1070 N1106 L1107 F1111 L1112 I1113	L1069-K1109 VanDerWaalsContact O-CE 3.31Å; L1069-K1109 WeakPolarHBondContact O-CE 3.47Å; L1069-K1109 PolarHBondContact O-NZ 3.02Å; S1070-K1109 VanDerWaalsContact CA-NZ 3.27Å; N1106-K1109 WeakPolarHBondContact O-CA 3.37Å; N1106-K1109 VanDerWaalsContact O-CB 3.32Å; N1106-K1109 WeakPolarHBondContact O-CB 3.32Å; N1106-K1109 PolarHBondContact O-N 3.11Å; L1107-K1109 VanDerWaalsContact C-N 3.28Å; L1107-K1109 PolarHBondContact O-N 3.43Å; K1109-F1111 VanDerWaalsContact C-N 3.28Å; K1109-F1111 PolarHBondContact O-N 2.85Å; K1109-L1112 WeakPolarHBondContact O-CB 3.42Å; K1109-L1112 PolarHBondContact O-N 3.32Å; K1109-I1113 HydrophobicContact CG-CD1 4.06Å; K1109-I1113 VanDerWaalsContact O-CG1 3.28Å; K1109-I1113 WeakPolarHBondContact O-CG1 3.45Å; K1109-I1113 PolarHBondContact O-N 2.66Å
1110	I	94.3	Very high	91.1	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-59.2	-42.6	173	-67.2	169	0	0	0	110	L1069 I1092 L1100 N1106 L1107 L1112 I1113 I1114	L1069-I1110 HydrophobicContact CD1-CG1 4.29Å; I1092-I1110 HydrophobicContact CD1-CD1 4.21Å; I1092-I1110 HydrophobicContact CD1-CG2 3.69Å; I1092-I1110 HydrophobicContact CG1-CD1 4.39Å; L1100-I1110 HydrophobicContact CD2-CD1 4.29Å; N1106-I1110 PolarHBondContact O-N 3.38Å; L1107-I1110 HydrophobicContact CD1-CD1 4.5Å; L1107-I1110 PolarHBondContact O-N 3.14Å; I1110-L1112 PolarHBondContact O-N 3.43Å; I1110-I1113 PolarHBondContact O-N 2.8Å; I1110-I1114 HydrophobicContact CG2-CD1 3.93Å; I1110-I1114 VanDerWaalsContact O-CG1 3.3Å; I1110-I1114 WeakPolarHBondContact O-CG1 3.36Å; I1110-I1114 PolarHBondContact O-N 3.12Å
1111	F	93.8	Very high	90.8	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-59	-44.2	173.4	-94.4	-122.7	0	0	0	113	L1107 P1108 K1109 I1114 A1115 I1137 V1140 W1147 C1150 V1151	L1107-F1111 WeakPolarHBondContact O-CD2 3.44Å; L1107-F1111 PolarHBondContact O-N 3.28Å; P1108-F1111 WeakPolarHBondContact O-CB 3.34Å; P1108-F1111 PolarHBondContact O-N 3.2Å; K1109-F1111 VanDerWaalsContact C-N 3.28Å; K1109-F1111 PolarHBondContact O-N 2.85Å; F1111-I1114 PolarHBondContact O-N 3.2Å; F1111-A1115 VanDerWaalsContact O-CB 3.27Å; F1111-A1115 WeakPolarHBondContact O-CB 3.21Å; F1111-A1115 PolarHBondContact O-N 2.95Å; F1111-I1137 HydrophobicContact CD1-CD1 4.02Å; F1111-I1137 HydrophobicContact CD2-CD1 3.72Å; F1111-I1137 HydrophobicContact CE1-CD1 3.83Å; F1111-I1137 HydrophobicContact CE1-CG2 4.16Å; F1111-I1137 HydrophobicContact CE2-CD1 3.49Å; F1111-I1137 VanDerWaalsContact CE2-CD1 3.49Å; F1111-I1137 HydrophobicContact CG-CD1 3.97Å; F1111-I1137 HydrophobicContact CZ-CB 4.43Å; F1111-I1137 HydrophobicContact CZ-CD1 3.55Å; F1111-I1137 HydrophobicContact CZ-CG2 4.06Å; F1111-V1140 HydrophobicContact CE2-CB 3.97Å; F1111-V1140 HydrophobicContact CE2-CG1 3.99Å; F1111-V1140 HydrophobicContact CE2-CG2 3.92Å; F1111-V1140 HydrophobicContact CZ-CB 3.82Å; F1111-V1140 HydrophobicContact CZ-CG1 3.83Å; F1111-V1140 HydrophobicContact CZ-CG2 4.27Å; F1111-W1147 AromaticContact CE1-CE3 3.82Å; F1111-W1147 HydrophobicContact CE1-CE3 3.82Å; F1111-W1147 HydrophobicContact CE1-CH2 4.28Å; F1111-W1147 AromaticContact CE1-CZ3 3.46Å; F1111-W1147 HydrophobicContact CE1-CZ3 3.46Å; F1111-W1147 VanDerWaalsContact CE1-CZ3 3.46Å; F1111-W1147 AromaticContact CZ-CE3 3.94Å; F1111-W1147 HydrophobicContact CZ-CE3 3.94Å; F1111-W1147 AromaticContact CZ-CZ3 3.73Å; F1111-W1147 HydrophobicContact CZ-CZ3 3.73Å; F1111-C1150 HydrophobicContact CB-CB 4.14Å; F1111-C1150 HydrophobicContact CD1-CB 3.54Å; F1111-C1150 HydrophobicContact CD2-CB 3.93Å; F1111-C1150 HydrophobicContact CE1-CB 3.83Å; F1111-C1150 HydrophobicContact CE2-CB 4.22Å; F1111-C1150 HydrophobicContact CG-CB 3.6Å; F1111-C1150 HydrophobicContact CZ-CB 4.17Å; F1111-V1151 HydrophobicContact CE1-CG2 4.41Å
1112	L	94	Very high	90.5	Very high	64 Å²	64	47.4 Å²	47.4	34%	0.335	26%	0.257	S	S	.	.	H	α-helix	trans	-61	-44.3	176	-175	70	0	0	0	111.9	P1108 K1109 I1110 A1115 D1116 L1154 Q1158	P1108-L1112 PolarHBondContact O-N 3.2Å; K1109-L1112 WeakPolarHBondContact O-CB 3.42Å; K1109-L1112 PolarHBondContact O-N 3.32Å; I1110-L1112 PolarHBondContact O-N 3.43Å; L1112-A1115 PolarHBondContact O-N 3.33Å; L1112-D1116 WeakPolarHBondContact O-CB 3.48Å; L1112-D1116 PolarHBondContact O-N 2.99Å; L1112-L1154 HydrophobicContact CB-CD2 4.21Å; L1112-L1154 HydrophobicContact CD1-CD2 3.92Å; L1112-Q1158 VanDerWaalsContact CD1-NE2 3.32Å
1113	I	95.2	Very high	90.2	Very high	4 Å²	4	42.8 Å²	42.8	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-60.2	-45.8	178.1	-69.9	163.2	0	0	0	111	L1069 L1072 P1073 F1085 L1088 K1109 I1110 G1117	L1069-I1113 HydrophobicContact CD1-CD1 3.89Å; L1072-I1113 HydrophobicContact CB-CD1 4.01Å; L1072-I1113 HydrophobicContact CB-CG1 4.23Å; L1072-I1113 HydrophobicContact CB-CG2 3.82Å; L1072-I1113 HydrophobicContact CD1-CG2 4.47Å; P1073-I1113 HydrophobicContact CB-CG2 3.99Å; F1085-I1113 HydrophobicContact CE1-CG2 3.95Å; F1085-I1113 HydrophobicContact CZ-CG2 4.39Å; L1088-I1113 HydrophobicContact CD2-CG2 4.16Å; K1109-I1113 HydrophobicContact CG-CD1 4.06Å; K1109-I1113 VanDerWaalsContact O-CG1 3.28Å; K1109-I1113 WeakPolarHBondContact O-CG1 3.45Å; K1109-I1113 PolarHBondContact O-N 2.66Å; I1110-I1113 PolarHBondContact O-N 2.8Å; I1113-G1117 PolarHBondContact O-N 2.86Å
1114	I	93.7	Very high	89.9	Confident	1 Å²	1	40 Å²	40	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-67.5	-43.6	178.4	-63.1	175.7	0	0	0	110.9	F1085 I1110 F1111 G1117 V1118 L1133 I1137 I1162 L1165	F1085-I1114 HydrophobicContact CE1-CG1 4.4Å; I1110-I1114 HydrophobicContact CG2-CD1 3.93Å; I1110-I1114 VanDerWaalsContact O-CG1 3.3Å; I1110-I1114 WeakPolarHBondContact O-CG1 3.36Å; I1110-I1114 PolarHBondContact O-N 3.12Å; F1111-I1114 PolarHBondContact O-N 3.2Å; I1114-G1117 PolarHBondContact O-N 2.95Å; I1114-V1118 WeakPolarHBondContact O-CG2 3.31Å; I1114-V1118 PolarHBondContact O-N 3.25Å; I1114-L1133 HydrophobicContact CD1-CD2 3.92Å; I1114-L1133 HydrophobicContact CG1-CD2 3.99Å; I1114-L1133 HydrophobicContact CG2-CB 4.32Å; I1114-I1137 HydrophobicContact CD1-CD1 3.93Å; I1114-I1137 HydrophobicContact CD1-CG1 4.44Å; I1114-I1137 HydrophobicContact CG2-CD1 4.37Å; I1114-I1137 HydrophobicContact CG2-CG1 4.42Å; I1114-I1162 HydrophobicContact CB-CD1 4.35Å; I1114-I1162 HydrophobicContact CG2-CD1 3.88Å; I1114-L1165 HydrophobicContact CG2-CD2 3.79Å
1115	A	92.4	Very high	89.3	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.2	-42.8	179.9	0	0	0	0	0	112.2	F1111 L1112 A1119 L1154 Q1158 I1162	F1111-A1115 VanDerWaalsContact O-CB 3.27Å; F1111-A1115 WeakPolarHBondContact O-CB 3.21Å; F1111-A1115 PolarHBondContact O-N 2.95Å; L1112-A1115 PolarHBondContact O-N 3.33Å; A1115-A1119 WeakPolarHBondContact O-CB 3.49Å; A1115-A1119 PolarHBondContact O-N 3.05Å; A1115-L1154 HydrophobicContact CB-CD1 4.2Å; A1115-L1154 HydrophobicContact CB-CD2 3.99Å; A1115-Q1158 HydrophobicContact CB-CB 3.77Å; A1115-Q1158 HydrophobicContact CB-CG 4.04Å; A1115-I1162 HydrophobicContact CB-CD1 3.91Å; A1115-I1162 HydrophobicContact CB-CG1 3.66Å
1116	D	91.2	Very high	88.7	Confident	31 Å²	31	45.6 Å²	45.6	17%	0.166	23%	0.233	C	C	.	.	H	α-helix	trans	-65.7	-41.5	174.4	-97.4	25.2	0	0	0	111.7	P1073 K1075 L1112 V1118 A1119 N1120 Q1158	P1073-D1116 HydrophobicContact CG-CB 3.69Å; K1075-D1116 WeakPolarHBondContact CE-OD2 3.2Å; K1075-D1116 IonicContact NZ-OD2 2.71Å; K1075-D1116 PolarHBondContact NZ-OD2 3.39Å; L1112-D1116 WeakPolarHBondContact O-CB 3.48Å; L1112-D1116 PolarHBondContact O-N 2.99Å; D1116-V1118 VanDerWaalsContact C-N 3.35Å; D1116-V1118 PolarHBondContact O-N 2.86Å; D1116-A1119 PolarHBondContact O-N 2.8Å; D1116-N1120 PolarHBondContact O-N 3.46Å; D1116-N1120 PolarHBondContact O-ND2 2.9Å; D1116-Q1158 PolarHBondContact OD1-NE2 2.93Å
1117	G	87.6	Confident	88.3	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.2	-42.2	177.8	0	0	0	0	0	113.1	I1113 I1114 E1121 S1122	I1113-G1117 PolarHBondContact O-N 2.86Å; I1114-G1117 PolarHBondContact O-N 2.95Å; G1117-E1121 PolarHBondContact O-N 3.34Å; G1117-S1122 VanDerWaalsContact O-CB 3.3Å; G1117-S1122 WeakPolarHBondContact O-CB 3.42Å; G1117-S1122 PolarHBondContact O-N 3.29Å; G1117-S1122 PolarHBondContact O-OG 3.45Å
1118	V	88.1	Confident	87.9	Confident	30 Å²	30	48.3 Å²	48.3	18%	0.182	26%	0.258	C	S	.	.	H	α-helix	trans	-72.4	-40.9	175.7	179	0	0	0	0	111.5	I1114 D1116 N1120 E1121 V1123 A1161 L1165	I1114-V1118 WeakPolarHBondContact O-CG2 3.31Å; I1114-V1118 PolarHBondContact O-N 3.25Å; D1116-V1118 VanDerWaalsContact C-N 3.35Å; D1116-V1118 PolarHBondContact O-N 2.86Å; V1118-N1120 VanDerWaalsContact C-N 3.28Å; V1118-N1120 PolarHBondContact O-N 3.12Å; V1118-E1121 PolarHBondContact O-N 3.35Å; V1118-E1121 VanDerWaalsContact O-N 3.14Å; V1118-V1123 HydrophobicContact CG2-CG2 4.16Å; V1118-A1161 HydrophobicContact CB-CB 4.17Å; V1118-A1161 HydrophobicContact CG1-CB 4.03Å; V1118-L1165 HydrophobicContact CG1-CB 4.42Å; V1118-L1165 HydrophobicContact CG2-CB 4.27Å; V1118-L1165 HydrophobicContact CG2-CD1 4.16Å; V1118-L1165 HydrophobicContact CG2-CD2 4.12Å; V1118-L1165 HydrophobicContact CG2-CG 4.4Å
1119	A	88.3	Confident	87.7	Confident	40 Å²	40	47.5 Å²	47.5	33%	0.331	25%	0.253	S	S	.	.	H	α-helix	trans	-68.1	-23.3	-178.8	0	0	0	0	0	114.3	A1115 D1116 A1161	A1115-A1119 WeakPolarHBondContact O-CB 3.49Å; A1115-A1119 PolarHBondContact O-N 3.05Å; D1116-A1119 PolarHBondContact O-N 2.8Å; A1119-A1161 HydrophobicContact CB-CB 3.86Å
1120	N	86.1	Confident	87.4	Confident	70 Å²	70	43.8 Å²	43.8	37%	0.374	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	13.8	174.7	-61.5	-79.3	0	0	0	112.4	K1078 D1116 V1118 S1122	K1078-N1120 PolarHBondContact NZ-O 2.94Å; D1116-N1120 PolarHBondContact O-N 3.46Å; D1116-N1120 PolarHBondContact O-ND2 2.9Å; V1118-N1120 VanDerWaalsContact C-N 3.28Å; V1118-N1120 PolarHBondContact O-N 3.12Å; N1120-S1122 PolarHBondContact O-N 3.28Å; N1120-S1122 VanDerWaalsContact O-N 3.12Å
1121	E	85.4	Confident	87.2	Confident	156 Å²	156	49.2 Å²	49.2	73%	0.729	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.2	40	-179.7	-58.8	-179.8	-173.7	0	0	112.2	K1078 G1117 V1118 V1123	K1078-E1121 WeakPolarHBondContact CD-O 3.43Å; K1078-E1121 WeakPolarHBondContact CE-O 3.48Å; K1078-E1121 PolarHBondContact NZ-O 3.41Å; K1078-E1121 VanDerWaalsContact NZ-O 3.09Å; G1117-E1121 PolarHBondContact O-N 3.34Å; V1118-E1121 PolarHBondContact O-N 3.35Å; V1118-E1121 VanDerWaalsContact O-N 3.14Å; E1121-V1123 VanDerWaalsContact C-N 3.28Å
1122	S	85	Confident	87.2	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.014	27%	0.269	C	S	.	.			trans	-78.2	-16.6	177.3	-50.7	0	0	0	0	112.5	L1074 K1075 A1081 G1117 N1120	L1074-S1122 PolarHBondContact O-OG 2.82Å; K1075-S1122 WeakPolarHBondContact CA-OG 3.42Å; K1075-S1122 PolarHBondContact O-OG 3.32Å; A1081-S1122 WeakPolarHBondContact CB-O 3.37Å; G1117-S1122 VanDerWaalsContact O-CB 3.3Å; G1117-S1122 WeakPolarHBondContact O-CB 3.42Å; G1117-S1122 PolarHBondContact O-N 3.29Å; G1117-S1122 PolarHBondContact O-OG 3.45Å; N1120-S1122 PolarHBondContact O-N 3.28Å; N1120-S1122 VanDerWaalsContact O-N 3.12Å
1123	V	82.7	Confident	87.2	Confident	12 Å²	12	48.4 Å²	48.4	7%	0.073	25%	0.253	C	S	.	.	S	Bend	trans	-136.5	137.8	172	-66.1	0	0	0	0	109.2	V1082 F1085 V1118 E1121 L1133	V1082-V1123 HydrophobicContact CG2-CG1 4.19Å; F1085-V1123 HydrophobicContact CD2-CG1 3.48Å; F1085-V1123 VanDerWaalsContact CD2-CG1 3.48Å; F1085-V1123 HydrophobicContact CE2-CG1 4.01Å; F1085-V1123 HydrophobicContact CG-CG1 4.24Å; V1118-V1123 HydrophobicContact CG2-CG2 4.16Å; E1121-V1123 VanDerWaalsContact C-N 3.28Å; V1123-L1133 HydrophobicContact CG2-CD1 4.37Å
1124	K	79.8	Confident	87	Confident	138 Å²	138	48.2 Å²	48.2	60%	0.6	25%	0.252	S	S	*	.			trans	-92.9	160.7	-179.7	-64	173.9	-177.9	171.5	0	110.7	E1126 D1127 T1130	K1124-E1126 PolarHBondContact O-N 3.04Å; K1124-D1127 PolarHBondContact N-OD2 3.37Å; K1124-D1127 PolarHBondContact O-N 2.86Å; K1124-T1130 WeakPolarHBondContact O-CB 3.45Å; K1124-T1130 PolarHBondContact O-OG1 3.16Å
1125	T	77	Confident	86.8	Confident	78 Å²	78	52 Å²	52	48%	0.479	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-24.7	176.1	-47.4	0	0	0	0	113.2
1126	E	79.4	Confident	86.6	Confident	176 Å²	176	52.3 Å²	52.3	82%	0.822	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-25.2	-178.8	-61.3	179.6	-131.7	0	0	112.9	K1124	K1124-E1126 PolarHBondContact O-N 3.04Å
1127	D	84.7	Confident	86.6	Confident	39 Å²	39	50.9 Å²	50.9	21%	0.209	27%	0.267	C	S	.	.	S	Bend	trans	-65.9	139.5	-173	-60.1	-28	0	0	0	112	V1082 K1124 C1129 T1130	V1082-D1127 HydrophobicContact CG2-CB 4.44Å; V1082-D1127 WeakPolarHBondContact CG2-OD2 3.43Å; K1124-D1127 PolarHBondContact N-OD2 3.37Å; K1124-D1127 PolarHBondContact O-N 2.86Å; D1127-C1129 PolarHBondContact O-N 3Å; D1127-T1130 WeakPolarHBondContact O-CB 3.47Å; D1127-T1130 PolarHBondContact O-N 2.97Å; D1127-T1130 VanDerWaalsContact O-N 3.14Å
1128	A	82.1	Confident	86.7	Confident	74 Å²	74	55.1 Å²	55.1	61%	0.612	28%	0.283	S	S	*	.	H	α-helix	trans	-59.6	-35	179.6	0	0	0	0	0	112.3	T1130	A1128-T1130 VanDerWaalsContact C-N 3.34Å; A1128-T1130 PolarHBondContact O-N 3.31Å
1129	C	87.9	Confident	86.7	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-65.1	-33.7	179.1	74.3	0	0	0	0	112.5	F1085 D1086 D1127 K1131 R1132 L1133	F1085-C1129 HydrophobicContact CB-CB 4.42Å; D1086-C1129 HydrophobicContact CB-CB 4.47Å; D1086-C1129 WeakPolarHBondContact OD1-CB 3.43Å; D1127-C1129 PolarHBondContact O-N 3Å; C1129-K1131 VanDerWaalsContact C-N 3.31Å; C1129-K1131 PolarHBondContact O-N 3.11Å; C1129-R1132 CarbonylContact O-C 3.51Å; C1129-R1132 WeakPolarHBondContact O-CA 3.45Å; C1129-R1132 VanDerWaalsContact O-CB 3.32Å; C1129-R1132 WeakPolarHBondContact O-CB 3.43Å; C1129-R1132 PolarHBondContact O-N 3.42Å; C1129-L1133 WeakPolarHBondContact O-CG 3.34Å; C1129-L1133 PolarHBondContact O-N 3.02Å
1130	T	88	Confident	86.7	Confident	4 Å²	4	59.1 Å²	59.1	3%	0.025	29%	0.293	C	S	.	.	H	α-helix	trans	-58.5	-40.2	-175.2	-58.3	0	0	0	0	112.5	K1124 D1127 A1128 A1134 L1165 A1169	K1124-T1130 WeakPolarHBondContact O-CB 3.45Å; K1124-T1130 PolarHBondContact O-OG1 3.16Å; D1127-T1130 WeakPolarHBondContact O-CB 3.47Å; D1127-T1130 PolarHBondContact O-N 2.97Å; D1127-T1130 VanDerWaalsContact O-N 3.14Å; A1128-T1130 VanDerWaalsContact C-N 3.34Å; A1128-T1130 PolarHBondContact O-N 3.31Å; T1130-A1134 WeakPolarHBondContact O-CB 3.34Å; T1130-A1134 PolarHBondContact O-N 3.18Å; T1130-L1165 HydrophobicContact CG2-CD1 3.41Å; T1130-L1165 VanDerWaalsContact CG2-CD1 3.41Å; T1130-A1169 HydrophobicContact CG2-CB 3.98Å
1131	K	89.5	Confident	86.8	Confident	115 Å²	115	59.7 Å²	59.7	50%	0.5	29%	0.294	S	S	.	.	H	α-helix	trans	-68.1	-34.6	173.5	-72.2	166.8	-176	154.8	0	112.9	C1129 N1135 A1169	C1129-K1131 VanDerWaalsContact C-N 3.31Å; C1129-K1131 PolarHBondContact O-N 3.11Å; K1131-N1135 WeakPolarHBondContact O-CB 3.5Å; K1131-N1135 PolarHBondContact O-N 3.43Å; K1131-N1135 PolarHBondContact O-ND2 3.45Å; K1131-A1169 HydrophobicContact CG-CB 3.86Å
1132	R	93.8	Very high	86.9	Confident	46 Å²	46	58.2 Å²	58.2	17%	0.174	30%	0.295	C	S	.	.	H	α-helix	trans	-68.2	-46.2	176.2	-57.8	176.4	68.7	-165.1	7.4	110.6	D1086 C1089 D1090 E1093 C1129 A1134 N1135 V1136	D1086-R1132 PolarHBondContact O-NH1 3.33Å; D1086-R1132 IonicContact OD1-CZ 2.68Å; D1086-R1132 IonicContact OD1-NH1 3.37Å; D1086-R1132 PolarHBondContact OD1-NH1 3.09Å; C1089-R1132 HydrophobicContact CB-CB 4.03Å; C1089-R1132 VanDerWaalsContact SG-CB 3.59Å; D1090-R1132 IonicContact OD1-CZ 3.38Å; D1090-R1132 IonicContact OD1-NH1 3.2Å; D1090-R1132 PolarHBondContact OD1-NH1 2.95Å; D1090-R1132 VanDerWaalsContact OD1-NH1 3.09Å; D1090-R1132 IonicContact OD1-NH2 3.46Å; D1090-R1132 PolarHBondContact OD1-NH2 2.82Å; E1093-R1132 IonicContact OE1-CZ 2.75Å; E1093-R1132 IonicContact OE1-NE 2.68Å; E1093-R1132 PolarHBondContact OE1-NE 2.76Å; E1093-R1132 IonicContact OE1-NH2 3.73Å; E1093-R1132 PolarHBondContact OE1-NH2 3.05Å; E1093-R1132 IonicContact OE2-CZ 3.97Å; E1093-R1132 IonicContact OE2-NE 3.94Å; E1093-R1132 IonicContact OE2-NH2 3.08Å; E1093-R1132 PolarHBondContact OE2-NH2 3.32Å; C1129-R1132 CarbonylContact O-C 3.51Å; C1129-R1132 WeakPolarHBondContact O-CA 3.45Å; C1129-R1132 VanDerWaalsContact O-CB 3.32Å; C1129-R1132 WeakPolarHBondContact O-CB 3.43Å; C1129-R1132 PolarHBondContact O-N 3.42Å; R1132-A1134 PolarHBondContact O-N 3.04Å; R1132-N1135 WeakPolarHBondContact O-CB 3.46Å; R1132-N1135 PolarHBondContact O-N 2.75Å; R1132-N1135 VanDerWaalsContact O-N 3.15Å; R1132-V1136 PolarHBondContact O-N 2.72Å
1133	L	92.6	Very high	87	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-57.6	-49.8	174.2	-62.4	171.9	0	0	0	111.2	F1085 C1089 I1114 V1123 C1129 N1135 V1136 I1137 L1165	F1085-L1133 HydrophobicContact CB-CD1 4.18Å; F1085-L1133 HydrophobicContact CB-CD2 4.44Å; F1085-L1133 HydrophobicContact CD1-CD1 3.89Å; F1085-L1133 HydrophobicContact CD1-CD2 3.78Å; F1085-L1133 HydrophobicContact CD1-CG 4.5Å; F1085-L1133 HydrophobicContact CE1-CD1 4.48Å; F1085-L1133 HydrophobicContact CG-CD1 4.03Å; F1085-L1133 HydrophobicContact CG-CD2 4.46Å; C1089-L1133 WeakPolarHBondContact SG-CD2 3.44Å; I1114-L1133 HydrophobicContact CD1-CD2 3.92Å; I1114-L1133 HydrophobicContact CG1-CD2 3.99Å; I1114-L1133 HydrophobicContact CG2-CB 4.32Å; V1123-L1133 HydrophobicContact CG2-CD1 4.37Å; C1129-L1133 WeakPolarHBondContact O-CG 3.34Å; C1129-L1133 PolarHBondContact O-N 3.02Å; L1133-N1135 VanDerWaalsContact C-N 3.28Å; L1133-N1135 PolarHBondContact O-N 2.87Å; L1133-V1136 WeakPolarHBondContact O-CB 3.45Å; L1133-V1136 PolarHBondContact O-N 3Å; L1133-V1136 VanDerWaalsContact O-N 3.17Å; L1133-I1137 WeakPolarHBondContact O-CG1 3.4Å; L1133-I1137 PolarHBondContact O-N 3.34Å; L1133-I1137 VanDerWaalsContact O-N 3.07Å; L1133-L1165 HydrophobicContact CB-CD2 4.4Å
1134	A	91.4	Very high	87	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-57.4	-40.3	175.7	0	0	0	0	0	112.4	T1130 R1132 I1137 R1138 L1165 A1169	T1130-A1134 WeakPolarHBondContact O-CB 3.34Å; T1130-A1134 PolarHBondContact O-N 3.18Å; R1132-A1134 PolarHBondContact O-N 3.04Å; A1134-I1137 PolarHBondContact O-N 3.17Å; A1134-R1138 WeakPolarHBondContact O-CB 3.49Å; A1134-R1138 VanDerWaalsContact O-CG 3.3Å; A1134-R1138 WeakPolarHBondContact O-CG 3.36Å; A1134-R1138 PolarHBondContact O-N 3.12Å; A1134-L1165 HydrophobicContact CB-CD1 4.31Å; A1134-L1165 HydrophobicContact CB-CG 4.12Å; A1134-A1169 HydrophobicContact CB-CB 4.07Å
1135	N	90.9	Very high	87.4	Confident	80 Å²	80	60.1 Å²	60.1	43%	0.428	34%	0.34	S	S	.	.	H	α-helix	trans	-67.7	-37.1	177.1	-72.7	-27.9	0	0	0	113.3	K1131 R1132 L1133 R1138 Q1139	K1131-N1135 WeakPolarHBondContact O-CB 3.5Å; K1131-N1135 PolarHBondContact O-N 3.43Å; K1131-N1135 PolarHBondContact O-ND2 3.45Å; R1132-N1135 WeakPolarHBondContact O-CB 3.46Å; R1132-N1135 PolarHBondContact O-N 2.75Å; R1132-N1135 VanDerWaalsContact O-N 3.15Å; L1133-N1135 VanDerWaalsContact C-N 3.28Å; L1133-N1135 PolarHBondContact O-N 2.87Å; N1135-R1138 PolarHBondContact O-N 3.37Å; N1135-Q1139 WeakPolarHBondContact O-CG 3.29Å; N1135-Q1139 PolarHBondContact O-N 3.33Å
1136	V	88.1	Confident	87.8	Confident	7 Å²	7	58.3 Å²	58.3	4%	0.042	33%	0.327	C	S	.	.	H	α-helix	trans	-58.8	-49.3	170.9	167.3	0	0	0	0	110.4	I1092 R1132 L1133 R1138 Q1139 V1140	I1092-V1136 HydrophobicContact CB-CG2 4.34Å; I1092-V1136 HydrophobicContact CD1-CG1 4.15Å; I1092-V1136 HydrophobicContact CG2-CB 4.48Å; I1092-V1136 HydrophobicContact CG2-CG1 3.9Å; I1092-V1136 HydrophobicContact CG2-CG2 3.75Å; R1132-V1136 PolarHBondContact O-N 2.72Å; L1133-V1136 WeakPolarHBondContact O-CB 3.45Å; L1133-V1136 PolarHBondContact O-N 3Å; L1133-V1136 VanDerWaalsContact O-N 3.17Å; V1136-R1138 PolarHBondContact O-N 3.2Å; V1136-Q1139 PolarHBondContact O-N 2.96Å; V1136-V1140 PolarHBondContact O-N 3.39Å
1137	I	90.3	Very high	88.3	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-60.3	-44.1	178	-60.3	-59.7	0	0	0	111.1	F1111 I1114 L1133 A1134 Q1139 V1140 Q1141 W1147 I1162 L1165 L1166	F1111-I1137 HydrophobicContact CD1-CD1 4.02Å; F1111-I1137 HydrophobicContact CD2-CD1 3.72Å; F1111-I1137 HydrophobicContact CE1-CD1 3.83Å; F1111-I1137 HydrophobicContact CE1-CG2 4.16Å; F1111-I1137 HydrophobicContact CE2-CD1 3.49Å; F1111-I1137 VanDerWaalsContact CE2-CD1 3.49Å; F1111-I1137 HydrophobicContact CG-CD1 3.97Å; F1111-I1137 HydrophobicContact CZ-CB 4.43Å; F1111-I1137 HydrophobicContact CZ-CD1 3.55Å; F1111-I1137 HydrophobicContact CZ-CG2 4.06Å; I1114-I1137 HydrophobicContact CD1-CD1 3.93Å; I1114-I1137 HydrophobicContact CD1-CG1 4.44Å; I1114-I1137 HydrophobicContact CG2-CD1 4.37Å; I1114-I1137 HydrophobicContact CG2-CG1 4.42Å; L1133-I1137 WeakPolarHBondContact O-CG1 3.4Å; L1133-I1137 PolarHBondContact O-N 3.34Å; L1133-I1137 VanDerWaalsContact O-N 3.07Å; A1134-I1137 PolarHBondContact O-N 3.17Å; I1137-Q1139 PolarHBondContact O-N 3.48Å; I1137-V1140 PolarHBondContact O-N 2.93Å; I1137-Q1141 PolarHBondContact O-N 3.44Å; I1137-W1147 HydrophobicContact CG2-CH2 3.99Å; I1137-W1147 HydrophobicContact CG2-CZ3 3.65Å; I1137-I1162 HydrophobicContact CD1-CD1 4.13Å; I1137-I1162 HydrophobicContact CG1-CD1 4.37Å; I1137-I1162 HydrophobicContact CG2-CG2 3.97Å; I1137-L1165 HydrophobicContact CG1-CD2 4.5Å; I1137-L1166 HydrophobicContact CB-CD2 4.24Å; I1137-L1166 HydrophobicContact CG2-CD1 3.89Å; I1137-L1166 HydrophobicContact CG2-CD2 3.9Å; I1137-L1166 HydrophobicContact CG2-CG 4.11Å
1138	R	90.8	Very high	88.6	Confident	89 Å²	89	55.4 Å²	55.4	34%	0.336	32%	0.316	S	S	.	.	H	α-helix	trans	-60.2	-38.2	176.8	-75.8	171.5	174.5	140.1	4.4	113.4	A1134 N1135 V1136 V1140 Q1141 L1166 A1169	A1134-R1138 WeakPolarHBondContact O-CB 3.49Å; A1134-R1138 VanDerWaalsContact O-CG 3.3Å; A1134-R1138 WeakPolarHBondContact O-CG 3.36Å; A1134-R1138 PolarHBondContact O-N 3.12Å; N1135-R1138 PolarHBondContact O-N 3.37Å; V1136-R1138 PolarHBondContact O-N 3.2Å; R1138-V1140 VanDerWaalsContact C-N 3.27Å; R1138-V1140 PolarHBondContact O-N 2.97Å; R1138-Q1141 WeakPolarHBondContact O-CB 3.4Å; R1138-Q1141 PolarHBondContact O-N 2.94Å; R1138-L1166 HydrophobicContact CG-CD2 3.59Å; R1138-L1166 PolarHBondContact NH2-O 3.27Å; R1138-A1169 VanDerWaalsContact NH1-C 3.33Å; R1138-A1169 PolarHBondContact NH1-O 3.29Å; R1138-A1169 PolarHBondContact NH1-OXT 3.35Å; R1138-A1169 PolarHBondContact NH2-OXT 3.23Å
1139	Q	87.9	Confident	88.9	Confident	139 Å²	139	57 Å²	57	65%	0.65	31%	0.311	S	S	*	.	H	α-helix	trans	-63.8	-35.1	177.7	-73.6	178.1	22.6	0	0	112	N1135 V1136 I1137	N1135-Q1139 WeakPolarHBondContact O-CG 3.29Å; N1135-Q1139 PolarHBondContact O-N 3.33Å; V1136-Q1139 PolarHBondContact O-N 2.96Å; I1137-Q1139 PolarHBondContact O-N 3.48Å
1140	V	87.5	Confident	89.1	Confident	15 Å²	15	57 Å²	57	9%	0.091	31%	0.311	C	S	.	.	H	α-helix	trans	-74.3	-30.9	179.4	-178.5	0	0	0	0	112.1	L1107 F1111 V1136 I1137 R1138 V1142 S1143 L1146	L1107-V1140 HydrophobicContact CD1-CG2 4.2Å; L1107-V1140 HydrophobicContact CD2-CB 4.43Å; L1107-V1140 HydrophobicContact CD2-CG1 3.78Å; L1107-V1140 HydrophobicContact CD2-CG2 3.72Å; L1107-V1140 HydrophobicContact CG-CG2 4.27Å; F1111-V1140 HydrophobicContact CE2-CB 3.97Å; F1111-V1140 HydrophobicContact CE2-CG1 3.99Å; F1111-V1140 HydrophobicContact CE2-CG2 3.92Å; F1111-V1140 HydrophobicContact CZ-CB 3.82Å; F1111-V1140 HydrophobicContact CZ-CG1 3.83Å; F1111-V1140 HydrophobicContact CZ-CG2 4.27Å; V1136-V1140 PolarHBondContact O-N 3.39Å; I1137-V1140 PolarHBondContact O-N 2.93Å; R1138-V1140 VanDerWaalsContact C-N 3.27Å; R1138-V1140 PolarHBondContact O-N 2.97Å; V1140-V1142 PolarHBondContact O-N 3.1Å; V1140-V1142 VanDerWaalsContact O-N 3.15Å; V1140-S1143 PolarHBondContact O-N 3.01Å; V1140-L1146 HydrophobicContact CG1-CD2 4.34Å; V1140-L1146 HydrophobicContact CG1-CG 4.16Å
1141	Q	87.6	Confident	89.2	Confident	83 Å²	83	58.2 Å²	58.2	39%	0.388	32%	0.318	S	S	.	.	H	α-helix	trans	-55	-30.8	174.5	-72.8	-177.7	-26.4	0	0	113.7	I1137 R1138 S1143 W1147 L1166	I1137-Q1141 PolarHBondContact O-N 3.44Å; R1138-Q1141 WeakPolarHBondContact O-CB 3.4Å; R1138-Q1141 PolarHBondContact O-N 2.94Å; Q1141-S1143 PolarHBondContact O-N 3.03Å; Q1141-W1147 HydrophobicContact CB-CD2 4.39Å; Q1141-W1147 HydrophobicContact CB-CE3 4.17Å; Q1141-W1147 HydrophobicContact CB-CZ3 4.48Å; Q1141-W1147 HydrophobicContact CG-CD2 3.69Å; Q1141-W1147 HydrophobicContact CG-CE3 3.31Å; Q1141-W1147 HydrophobicContact CG-CH2 3.59Å; Q1141-W1147 HydrophobicContact CG-CZ2 3.93Å; Q1141-W1147 HydrophobicContact CG-CZ3 3.23Å; Q1141-L1166 VanDerWaalsContact NE2-CD1 3.34Å
1142	V	87.7	Confident	89.3	Confident	125 Å²	125	57 Å²	57	76%	0.758	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-27.4	177.7	-173.9	0	0	0	0	111.7	V1140	V1140-V1142 PolarHBondContact O-N 3.1Å; V1140-V1142 VanDerWaalsContact O-N 3.15Å
1143	S	87.4	Confident	89.1	Confident	62 Å²	62	58.3 Å²	58.3	43%	0.434	34%	0.337	S	S	.	.	S	Bend	trans	-100	79.4	179.4	-67	0	0	0	0	111.2	V1140 Q1141 G1145 L1146 W1147	V1140-S1143 PolarHBondContact O-N 3.01Å; Q1141-S1143 PolarHBondContact O-N 3.03Å; S1143-G1145 VanDerWaalsContact C-N 3.28Å; S1143-G1145 PolarHBondContact O-N 2.92Å; S1143-L1146 WeakPolarHBondContact O-CA 3.38Å; S1143-L1146 WeakPolarHBondContact O-CB 3.46Å; S1143-L1146 PolarHBondContact O-N 3.33Å; S1143-W1147 PolarHBondContact O-N 2.97Å
1144	A	83.7	Confident	89.1	Confident	71 Å²	71	58.7 Å²	58.7	59%	0.587	34%	0.34	S	S	*	.	H	α-helix	trans	-45.6	-41.8	-170.8	0	0	0	0	0	115.9	T1148	A1144-T1148 PolarHBondContact O-N 3.15Å; A1144-T1148 PolarHBondContact O-OG1 2.91Å
1145	G	86.9	Confident	89.2	Confident	59 Å²	59	62.6 Å²	62.6	61%	0.608	36%	0.361	S	S	*	.	H	α-helix	trans	-66.8	-40.7	177.4	0	0	0	0	0	113.7	S1143 Q1149	S1143-G1145 VanDerWaalsContact C-N 3.28Å; S1143-G1145 PolarHBondContact O-N 2.92Å; G1145-Q1149 WeakPolarHBondContact O-CB 3.44Å; G1145-Q1149 PolarHBondContact O-N 3.14Å
1146	L	86.1	Confident	89.2	Confident	39 Å²	39	67 Å²	67	20%	0.204	38%	0.379	C	S	.	.	H	α-helix	trans	-72.8	-37.9	178.9	-170.1	63.4	0	0	0	111.1	L1107 V1140 S1143 Q1149 C1150	L1107-L1146 HydrophobicContact CD2-CD1 4.06Å; L1107-L1146 HydrophobicContact CD2-CD2 3.5Å; L1107-L1146 HydrophobicContact CD2-CG 3.69Å; V1140-L1146 HydrophobicContact CG1-CD2 4.34Å; V1140-L1146 HydrophobicContact CG1-CG 4.16Å; S1143-L1146 WeakPolarHBondContact O-CA 3.38Å; S1143-L1146 WeakPolarHBondContact O-CB 3.46Å; S1143-L1146 PolarHBondContact O-N 3.33Å; L1146-Q1149 PolarHBondContact O-N 2.69Å; L1146-C1150 PolarHBondContact O-N 3.34Å; L1146-C1150 PolarHBondContact O-SG 3.35Å
1147	W	90	Very high	89.3	Confident	62 Å²	62	71.3 Å²	71.3	24%	0.235	41%	0.405	C	S	.	.	H	α-helix	trans	-57.5	-52.4	169.7	175.3	-105.4	0	0	0	111.9	F1111 I1137 Q1141 S1143 Q1149 C1150 V1151 I1162 L1166	F1111-W1147 AromaticContact CE1-CE3 3.82Å; F1111-W1147 HydrophobicContact CE1-CE3 3.82Å; F1111-W1147 HydrophobicContact CE1-CH2 4.28Å; F1111-W1147 AromaticContact CE1-CZ3 3.46Å; F1111-W1147 HydrophobicContact CE1-CZ3 3.46Å; F1111-W1147 VanDerWaalsContact CE1-CZ3 3.46Å; F1111-W1147 AromaticContact CZ-CE3 3.94Å; F1111-W1147 HydrophobicContact CZ-CE3 3.94Å; F1111-W1147 AromaticContact CZ-CZ3 3.73Å; F1111-W1147 HydrophobicContact CZ-CZ3 3.73Å; I1137-W1147 HydrophobicContact CG2-CH2 3.99Å; I1137-W1147 HydrophobicContact CG2-CZ3 3.65Å; Q1141-W1147 HydrophobicContact CB-CD2 4.39Å; Q1141-W1147 HydrophobicContact CB-CE3 4.17Å; Q1141-W1147 HydrophobicContact CB-CZ3 4.48Å; Q1141-W1147 HydrophobicContact CG-CD2 3.69Å; Q1141-W1147 HydrophobicContact CG-CE3 3.31Å; Q1141-W1147 HydrophobicContact CG-CH2 3.59Å; Q1141-W1147 HydrophobicContact CG-CZ2 3.93Å; Q1141-W1147 HydrophobicContact CG-CZ3 3.23Å; S1143-W1147 PolarHBondContact O-N 2.97Å; W1147-Q1149 VanDerWaalsContact C-N 3.28Å; W1147-Q1149 PolarHBondContact O-N 2.73Å; W1147-C1150 PolarHBondContact O-N 3.3Å; W1147-V1151 HydrophobicContact CD2-CG2 3.83Å; W1147-V1151 HydrophobicContact CE3-CG2 4.14Å; W1147-V1151 HydrophobicContact CG-CG2 4.46Å; W1147-V1151 HydrophobicContact CH2-CG2 3.91Å; W1147-V1151 HydrophobicContact CZ2-CG2 3.58Å; W1147-V1151 HydrophobicContact CZ3-CG2 4.19Å; W1147-V1151 WeakPolarHBondContact O-CG2 3.5Å; W1147-V1151 PolarHBondContact O-N 3Å; W1147-I1162 HydrophobicContact CH2-CG2 4.41Å; W1147-L1166 HydrophobicContact CH2-CD1 4.2Å
1148	T	89.7	Confident	89.5	Confident	92 Å²	92	72.2 Å²	72.2	56%	0.564	41%	0.409	S	S	*	.	H	α-helix	trans	-58.8	-41.5	177.2	-58.7	0	0	0	0	111.5	A1144 S1152	A1144-T1148 PolarHBondContact O-N 3.15Å; A1144-T1148 PolarHBondContact O-OG1 2.91Å; T1148-S1152 WeakPolarHBondContact O-CB 3.38Å; T1148-S1152 PolarHBondContact O-N 3.04Å; T1148-S1152 PolarHBondContact O-OG 2.89Å
1149	Q	89.7	Confident	89.6	Confident	107 Å²	107	71.9 Å²	71.9	50%	0.5	41%	0.412	S	S	.	.	H	α-helix	trans	-60.3	-49.4	176.1	-175.2	178.8	-5.5	0	0	112	P1108 G1145 L1146 W1147 S1152	P1108-Q1149 HydrophobicContact CG-CG 4.29Å; G1145-Q1149 WeakPolarHBondContact O-CB 3.44Å; G1145-Q1149 PolarHBondContact O-N 3.14Å; L1146-Q1149 PolarHBondContact O-N 2.69Å; W1147-Q1149 VanDerWaalsContact C-N 3.28Å; W1147-Q1149 PolarHBondContact O-N 2.73Å; Q1149-S1152 PolarHBondContact O-N 3.4Å; Q1149-S1152 PolarHBondContact O-OG 2.98Å
1150	C	91.2	Very high	89.7	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	41%	0.407	C	S	.	.	H	α-helix	trans	-67.8	-43.3	-178.9	-60.4	0	0	0	0	112.8	F1111 L1146 W1147 S1152 T1153	F1111-C1150 HydrophobicContact CB-CB 4.14Å; F1111-C1150 HydrophobicContact CD1-CB 3.54Å; F1111-C1150 HydrophobicContact CD2-CB 3.93Å; F1111-C1150 HydrophobicContact CE1-CB 3.83Å; F1111-C1150 HydrophobicContact CE2-CB 4.22Å; F1111-C1150 HydrophobicContact CG-CB 3.6Å; F1111-C1150 HydrophobicContact CZ-CB 4.17Å; L1146-C1150 PolarHBondContact O-N 3.34Å; L1146-C1150 PolarHBondContact O-SG 3.35Å; W1147-C1150 PolarHBondContact O-N 3.3Å; C1150-S1152 VanDerWaalsContact C-N 3.31Å; C1150-S1152 PolarHBondContact O-N 2.82Å; C1150-T1153 PolarHBondContact O-N 2.99Å; C1150-T1153 PolarHBondContact O-OG1 3.08Å
1151	V	90.6	Very high	89.9	Confident	30 Å²	30	71.1 Å²	71.1	18%	0.182	41%	0.406	C	S	.	.	H	α-helix	trans	-68.1	-32.4	179.3	176.4	0	0	0	0	111.6	F1111 W1147 T1153 L1154 Q1159	F1111-V1151 HydrophobicContact CE1-CG2 4.41Å; W1147-V1151 HydrophobicContact CD2-CG2 3.83Å; W1147-V1151 HydrophobicContact CE3-CG2 4.14Å; W1147-V1151 HydrophobicContact CG-CG2 4.46Å; W1147-V1151 HydrophobicContact CH2-CG2 3.91Å; W1147-V1151 HydrophobicContact CZ2-CG2 3.58Å; W1147-V1151 HydrophobicContact CZ3-CG2 4.19Å; W1147-V1151 WeakPolarHBondContact O-CG2 3.5Å; W1147-V1151 PolarHBondContact O-N 3Å; V1151-T1153 PolarHBondContact O-N 3.1Å; V1151-T1153 VanDerWaalsContact O-N 3.12Å; V1151-L1154 WeakPolarHBondContact O-CB 3.25Å; V1151-L1154 PolarHBondContact O-N 3.03Å; V1151-L1154 VanDerWaalsContact O-N 3.08Å; V1151-Q1159 HydrophobicContact CG1-CG 4.18Å
1152	S	91.1	Very high	90.1	Very high	89 Å²	89	67.4 Å²	67.4	62%	0.622	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-13.7	179.2	72	0	0	0	0	114.9	T1148 Q1149 C1150	T1148-S1152 WeakPolarHBondContact O-CB 3.38Å; T1148-S1152 PolarHBondContact O-N 3.04Å; T1148-S1152 PolarHBondContact O-OG 2.89Å; Q1149-S1152 PolarHBondContact O-N 3.4Å; Q1149-S1152 PolarHBondContact O-OG 2.98Å; C1150-S1152 VanDerWaalsContact C-N 3.31Å; C1150-S1152 PolarHBondContact O-N 2.82Å
1153	T	89.8	Confident	90.2	Very high	74 Å²	74	67.2 Å²	67.2	45%	0.454	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-2.6	175.3	58.9	0	0	0	0	113.8	P1108 C1150 V1151	P1108-T1153 HydrophobicContact CB-CG2 4.14Å; C1150-T1153 PolarHBondContact O-N 2.99Å; C1150-T1153 PolarHBondContact O-OG1 3.08Å; V1151-T1153 PolarHBondContact O-N 3.1Å; V1151-T1153 VanDerWaalsContact O-N 3.12Å
1154	L	93.4	Very high	90.2	Very high	10 Å²	10	67.4 Å²	67.4	5%	0.052	38%	0.376	C	S	.	.	S	Bend	trans	-100.6	142.1	-176.9	-56.1	-177.2	0	0	0	111.7	L1112 A1115 V1151 Q1158 Q1159 I1162	L1112-L1154 HydrophobicContact CB-CD2 4.21Å; L1112-L1154 HydrophobicContact CD1-CD2 3.92Å; A1115-L1154 HydrophobicContact CB-CD1 4.2Å; A1115-L1154 HydrophobicContact CB-CD2 3.99Å; V1151-L1154 WeakPolarHBondContact O-CB 3.25Å; V1151-L1154 PolarHBondContact O-N 3.03Å; V1151-L1154 VanDerWaalsContact O-N 3.08Å; L1154-Q1158 HydrophobicContact CB-CB 3.89Å; L1154-Q1158 HydrophobicContact CD2-CB 4.29Å; L1154-Q1158 HydrophobicContact CG-CB 4.49Å; L1154-Q1159 HydrophobicContact CB-CG 3.75Å; L1154-Q1159 PolarHBondContact O-NE2 3.19Å; L1154-I1162 HydrophobicContact CD1-CG1 3.89Å
1155	N	93.1	Very high	90.4	Very high	82 Å²	82	64.1 Å²	64.1	44%	0.439	35%	0.349	S	S	.	.			trans	-77.1	172.4	169.8	71.1	40.4	0	0	0	112.1	T1157 Q1158 Q1159	N1155-T1157 VanDerWaalsContact C-N 3.33Å; N1155-T1157 PolarHBondContact O-N 2.97Å; N1155-T1157 WeakPolarHBondContact OD1-CB 3.29Å; N1155-T1157 PolarHBondContact OD1-N 3.06Å; N1155-T1157 VanDerWaalsContact OD1-N 3.09Å; N1155-Q1158 VanDerWaalsContact CG-OE1 3.3Å; N1155-Q1158 VanDerWaalsContact ND2-CD 3.33Å; N1155-Q1158 PolarHBondContact ND2-OE1 2.97Å; N1155-Q1158 PolarHBondContact O-N 3.36Å; N1155-Q1158 WeakPolarHBondContact OD1-CB 3.37Å; N1155-Q1158 WeakPolarHBondContact OD1-CG 3.49Å; N1155-Q1158 PolarHBondContact OD1-N 3.01Å; N1155-Q1159 VanDerWaalsContact O-CG 3.31Å; N1155-Q1159 WeakPolarHBondContact O-CG 3.19Å; N1155-Q1159 PolarHBondContact O-N 2.99Å
1156	E	91.4	Very high	90.5	Very high	172 Å²	172	62.6 Å²	62.6	80%	0.804	33%	0.326	S	S	*	.	H	α-helix	trans	-58.2	-40.9	-176.5	-64.9	-175.5	168.1	0	0	113.2	Q1159 K1160	E1156-Q1159 PolarHBondContact O-N 3.36Å; E1156-K1160 WeakPolarHBondContact O-CB 3.35Å; E1156-K1160 PolarHBondContact O-N 3.46Å
1157	T	90.6	Very high	90.6	Very high	97 Å²	97	66.2 Å²	66.2	60%	0.595	35%	0.346	S	S	*	.	H	α-helix	trans	-64.3	-44.2	177	-49.8	0	0	0	0	111.8	N1155 K1160 A1161	N1155-T1157 VanDerWaalsContact C-N 3.33Å; N1155-T1157 PolarHBondContact O-N 2.97Å; N1155-T1157 WeakPolarHBondContact OD1-CB 3.29Å; N1155-T1157 PolarHBondContact OD1-N 3.06Å; N1155-T1157 VanDerWaalsContact OD1-N 3.09Å; T1157-K1160 PolarHBondContact O-N 3.14Å; T1157-A1161 WeakPolarHBondContact O-CB 3.37Å; T1157-A1161 PolarHBondContact O-N 2.69Å
1158	Q	93.3	Very high	90	Very high	19 Å²	19	67 Å²	67	9%	0.089	36%	0.358	C	S	.	.	H	α-helix	trans	-67.1	-39.2	177.3	-74.9	164.9	-16.8	0	0	112.2	L1112 A1115 D1116 L1154 N1155 K1160 A1161 I1162	L1112-Q1158 VanDerWaalsContact CD1-NE2 3.32Å; A1115-Q1158 HydrophobicContact CB-CB 3.77Å; A1115-Q1158 HydrophobicContact CB-CG 4.04Å; D1116-Q1158 PolarHBondContact OD1-NE2 2.93Å; L1154-Q1158 HydrophobicContact CB-CB 3.89Å; L1154-Q1158 HydrophobicContact CD2-CB 4.29Å; L1154-Q1158 HydrophobicContact CG-CB 4.49Å; N1155-Q1158 VanDerWaalsContact CG-OE1 3.3Å; N1155-Q1158 VanDerWaalsContact ND2-CD 3.33Å; N1155-Q1158 PolarHBondContact ND2-OE1 2.97Å; N1155-Q1158 PolarHBondContact O-N 3.36Å; N1155-Q1158 WeakPolarHBondContact OD1-CB 3.37Å; N1155-Q1158 WeakPolarHBondContact OD1-CG 3.49Å; N1155-Q1158 PolarHBondContact OD1-N 3.01Å; Q1158-K1160 VanDerWaalsContact C-N 3.34Å; Q1158-A1161 PolarHBondContact O-N 2.6Å; Q1158-I1162 WeakPolarHBondContact O-CG1 3.39Å; Q1158-I1162 PolarHBondContact O-N 3.37Å
1159	Q	92	Very high	89.3	Confident	83 Å²	83	63.8 Å²	63.8	39%	0.388	34%	0.341	S	S	.	.	H	α-helix	trans	-63.1	-42.7	173.5	-71	178.1	33.2	0	0	111	V1151 L1154 N1155 E1156 I1162 Q1163	V1151-Q1159 HydrophobicContact CG1-CG 4.18Å; L1154-Q1159 HydrophobicContact CB-CG 3.75Å; L1154-Q1159 PolarHBondContact O-NE2 3.19Å; N1155-Q1159 VanDerWaalsContact O-CG 3.31Å; N1155-Q1159 WeakPolarHBondContact O-CG 3.19Å; N1155-Q1159 PolarHBondContact O-N 2.99Å; E1156-Q1159 PolarHBondContact O-N 3.36Å; Q1159-I1162 PolarHBondContact O-N 2.72Å; Q1159-Q1163 WeakPolarHBondContact O-CB 3.46Å; Q1159-Q1163 PolarHBondContact O-N 3.42Å
1160	K	91.3	Very high	89.3	Confident	129 Å²	129	61.7 Å²	61.7	56%	0.561	33%	0.333	S	S	*	.	H	α-helix	trans	-61.4	-47.1	173.7	-169	-166.5	171.4	-156.1	0	111.2	E1156 T1157 Q1158 I1162 Q1163 D1164	E1156-K1160 WeakPolarHBondContact O-CB 3.35Å; E1156-K1160 PolarHBondContact O-N 3.46Å; T1157-K1160 PolarHBondContact O-N 3.14Å; Q1158-K1160 VanDerWaalsContact C-N 3.34Å; K1160-I1162 VanDerWaalsContact C-N 3.34Å; K1160-I1162 PolarHBondContact O-N 3.09Å; K1160-Q1163 CarbonylContact O-C 3.46Å; K1160-Q1163 WeakPolarHBondContact O-CA 3.44Å; K1160-Q1163 WeakPolarHBondContact O-CB 3.45Å; K1160-Q1163 PolarHBondContact O-N 2.93Å; K1160-D1164 VanDerWaalsContact CE-OD2 3.25Å; K1160-D1164 WeakPolarHBondContact CE-OD2 3.31Å; K1160-D1164 IonicContact NZ-OD2 3.62Å; K1160-D1164 PolarHBondContact O-N 3.44Å
1161	A	90.8	Very high	89.2	Confident	8 Å²	8	64.9 Å²	64.9	7%	0.066	35%	0.35	C	S	.	.	H	α-helix	trans	-58.5	-41.9	178	0	0	0	0	0	112.8	V1118 A1119 T1157 Q1158 Q1163 D1164 L1165	V1118-A1161 HydrophobicContact CB-CB 4.17Å; V1118-A1161 HydrophobicContact CG1-CB 4.03Å; A1119-A1161 HydrophobicContact CB-CB 3.86Å; T1157-A1161 WeakPolarHBondContact O-CB 3.37Å; T1157-A1161 PolarHBondContact O-N 2.69Å; Q1158-A1161 PolarHBondContact O-N 2.6Å; A1161-Q1163 VanDerWaalsContact C-N 3.34Å; A1161-Q1163 PolarHBondContact O-N 3.28Å; A1161-D1164 PolarHBondContact O-N 2.93Å; A1161-L1165 WeakPolarHBondContact O-CB 3.45Å; A1161-L1165 PolarHBondContact O-N 3.01Å
1162	I	91.6	Very high	89.1	Confident	6 Å²	6	66.8 Å²	66.8	3%	0.031	36%	0.359	C	S	.	.	H	α-helix	trans	-64.8	-37.2	173	-69.4	-66	0	0	0	111.9	I1114 A1115 I1137 W1147 L1154 Q1158 Q1159 K1160 L1166	I1114-I1162 HydrophobicContact CB-CD1 4.35Å; I1114-I1162 HydrophobicContact CG2-CD1 3.88Å; A1115-I1162 HydrophobicContact CB-CD1 3.91Å; A1115-I1162 HydrophobicContact CB-CG1 3.66Å; I1137-I1162 HydrophobicContact CD1-CD1 4.13Å; I1137-I1162 HydrophobicContact CG1-CD1 4.37Å; I1137-I1162 HydrophobicContact CG2-CG2 3.97Å; W1147-I1162 HydrophobicContact CH2-CG2 4.41Å; L1154-I1162 HydrophobicContact CD1-CG1 3.89Å; Q1158-I1162 WeakPolarHBondContact O-CG1 3.39Å; Q1158-I1162 PolarHBondContact O-N 3.37Å; Q1159-I1162 PolarHBondContact O-N 2.72Å; K1160-I1162 VanDerWaalsContact C-N 3.34Å; K1160-I1162 PolarHBondContact O-N 3.09Å; I1162-L1166 HydrophobicContact CG2-CD1 4.02Å; I1162-L1166 WeakPolarHBondContact O-CB 3.28Å; I1162-L1166 WeakPolarHBondContact O-CD1 3.4Å; I1162-L1166 VanDerWaalsContact O-CG 3.23Å; I1162-L1166 WeakPolarHBondContact O-CG 3.21Å; I1162-L1166 PolarHBondContact O-N 3.18Å; I1162-L1166 VanDerWaalsContact O-N 3.09Å
1163	Q	90.1	Very high	89	Confident	120 Å²	120	65.5 Å²	65.5	56%	0.561	34%	0.344	S	S	*	.	H	α-helix	trans	-69.1	-42.4	176.7	-173.5	168.3	4.2	0	0	111.9	Q1159 K1160 A1161 L1166 N1167	Q1159-Q1163 WeakPolarHBondContact O-CB 3.46Å; Q1159-Q1163 PolarHBondContact O-N 3.42Å; K1160-Q1163 CarbonylContact O-C 3.46Å; K1160-Q1163 WeakPolarHBondContact O-CA 3.44Å; K1160-Q1163 WeakPolarHBondContact O-CB 3.45Å; K1160-Q1163 PolarHBondContact O-N 2.93Å; A1161-Q1163 VanDerWaalsContact C-N 3.34Å; A1161-Q1163 PolarHBondContact O-N 3.28Å; Q1163-L1166 PolarHBondContact O-N 3.32Å; Q1163-N1167 WeakPolarHBondContact O-CB 3.49Å; Q1163-N1167 PolarHBondContact O-N 3.4Å; Q1163-N1167 PolarHBondContact O-ND2 3.29Å; Q1163-N1167 VanDerWaalsContact O-ND2 3.09Å
1164	D	87.6	Confident	89	Confident	66 Å²	66	65 Å²	65	35%	0.353	34%	0.337	S	S	.	.	H	α-helix	trans	-65.7	-40.6	177.2	-68.3	-20.4	0	0	0	110.8	K1160 A1161 L1166 N1167 T1168	K1160-D1164 VanDerWaalsContact CE-OD2 3.25Å; K1160-D1164 WeakPolarHBondContact CE-OD2 3.31Å; K1160-D1164 IonicContact NZ-OD2 3.62Å; K1160-D1164 PolarHBondContact O-N 3.44Å; A1161-D1164 PolarHBondContact O-N 2.93Å; D1164-L1166 PolarHBondContact O-N 3.15Å; D1164-N1167 PolarHBondContact O-N 3.09Å; D1164-T1168 WeakPolarHBondContact O-CB 3.45Å; D1164-T1168 WeakPolarHBondContact O-CG2 3.49Å; D1164-T1168 PolarHBondContact O-N 3.05Å; D1164-T1168 PolarHBondContact O-OG1 2.93Å
1165	L	89.4	Confident	88.7	Confident	3 Å²	3	68.7 Å²	68.7	2%	0.016	36%	0.356	C	S	.	.	H	α-helix	trans	-55.4	-50.5	169.8	176.3	66.4	0	0	0	111.9	I1114 V1118 T1130 L1133 A1134 I1137 A1161 N1167 T1168 A1169	I1114-L1165 HydrophobicContact CG2-CD2 3.79Å; V1118-L1165 HydrophobicContact CG1-CB 4.42Å; V1118-L1165 HydrophobicContact CG2-CB 4.27Å; V1118-L1165 HydrophobicContact CG2-CD1 4.16Å; V1118-L1165 HydrophobicContact CG2-CD2 4.12Å; V1118-L1165 HydrophobicContact CG2-CG 4.4Å; T1130-L1165 HydrophobicContact CG2-CD1 3.41Å; T1130-L1165 VanDerWaalsContact CG2-CD1 3.41Å; L1133-L1165 HydrophobicContact CB-CD2 4.4Å; A1134-L1165 HydrophobicContact CB-CD1 4.31Å; A1134-L1165 HydrophobicContact CB-CG 4.12Å; I1137-L1165 HydrophobicContact CG1-CD2 4.5Å; A1161-L1165 WeakPolarHBondContact O-CB 3.45Å; A1161-L1165 PolarHBondContact O-N 3.01Å; L1165-N1167 PolarHBondContact O-N 3.34Å; L1165-T1168 PolarHBondContact O-N 3.32Å; L1165-T1168 PolarHBondContact O-OG1 2.96Å; L1165-A1169 PolarHBondContact O-N 3.29Å; L1165-A1169 VanDerWaalsContact O-N 3.08Å
1166	L	88.6	Confident	88.3	Confident	26 Å²	26	67.7 Å²	67.7	14%	0.136	35%	0.35	C	S	.	.	H	α-helix	trans	-67.4	-21.3	-178.6	-75.2	168.5	0	0	0	114.4	I1137 R1138 Q1141 W1147 I1162 Q1163 D1164	I1137-L1166 HydrophobicContact CB-CD2 4.24Å; I1137-L1166 HydrophobicContact CG2-CD1 3.89Å; I1137-L1166 HydrophobicContact CG2-CD2 3.9Å; I1137-L1166 HydrophobicContact CG2-CG 4.11Å; R1138-L1166 HydrophobicContact CG-CD2 3.59Å; R1138-L1166 PolarHBondContact NH2-O 3.27Å; Q1141-L1166 VanDerWaalsContact NE2-CD1 3.34Å; W1147-L1166 HydrophobicContact CH2-CD1 4.2Å; I1162-L1166 HydrophobicContact CG2-CD1 4.02Å; I1162-L1166 WeakPolarHBondContact O-CB 3.28Å; I1162-L1166 WeakPolarHBondContact O-CD1 3.4Å; I1162-L1166 VanDerWaalsContact O-CG 3.23Å; I1162-L1166 WeakPolarHBondContact O-CG 3.21Å; I1162-L1166 PolarHBondContact O-N 3.18Å; I1162-L1166 VanDerWaalsContact O-N 3.09Å; Q1163-L1166 PolarHBondContact O-N 3.32Å; D1164-L1166 PolarHBondContact O-N 3.15Å
1167	N	86.8	Confident	88.1	Confident	116 Å²	116	59.7 Å²	59.7	62%	0.62	32%	0.315	S	S	*	.	H	α-helix	trans	-87	-27.2	176.9	-69.9	-27.6	0	0	0	112.6	Q1163 D1164 L1165	Q1163-N1167 WeakPolarHBondContact O-CB 3.49Å; Q1163-N1167 PolarHBondContact O-N 3.4Å; Q1163-N1167 PolarHBondContact O-ND2 3.29Å; Q1163-N1167 VanDerWaalsContact O-ND2 3.09Å; D1164-N1167 PolarHBondContact O-N 3.09Å; L1165-N1167 PolarHBondContact O-N 3.34Å
1168	T	79.2	Confident	87.9	Confident	79 Å²	79	56.6 Å²	56.6	49%	0.485	29%	0.292	S	S	.	.	H	α-helix	trans	-102.2	-23.3	-171.4	52.4	0	0	0	0	114.3	D1164 L1165	D1164-T1168 WeakPolarHBondContact O-CB 3.45Å; D1164-T1168 WeakPolarHBondContact O-CG2 3.49Å; D1164-T1168 PolarHBondContact O-N 3.05Å; D1164-T1168 PolarHBondContact O-OG1 2.93Å; L1165-T1168 PolarHBondContact O-N 3.32Å; L1165-T1168 PolarHBondContact O-OG1 2.96Å
1169	A	74.3	Confident	87.4	Confident	24 Å²	24	60 Å²	60	20%	0.198	31%	0.31	C	S	.	.			trans	-133.5	0	178.9	0	0	0	0	0	111.3	T1130 K1131 A1134 R1138 L1165	T1130-A1169 HydrophobicContact CG2-CB 3.98Å; K1131-A1169 HydrophobicContact CG-CB 3.86Å; A1134-A1169 HydrophobicContact CB-CB 4.07Å; R1138-A1169 VanDerWaalsContact NH1-C 3.33Å; R1138-A1169 PolarHBondContact NH1-O 3.29Å; R1138-A1169 PolarHBondContact NH1-OXT 3.35Å; R1138-A1169 PolarHBondContact NH2-OXT 3.23Å; L1165-A1169 PolarHBondContact O-N 3.29Å; L1165-A1169 VanDerWaalsContact O-N 3.08Å

Retrieved 1,169 of 1,169 residues in 1643 ms (Link to these results)

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