A0A060W4N6_ONCMY Loading...

Synaptic vesicle glycoprotein 2Bb

AlphaFold DB , UniProt , Accession A0A060W4N6, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110510003, Length 688 aa.

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(Predicted Aligned Error values between residue pairs)

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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	37.6	Very low	34	Very low	241 Å²	241	159.1 Å²	159.1	100%	1.187	81%	0.806	S	S	*	*				0	80.5	0	-77.2	170.4	168.5	0	0	105.6
2	A	32.4	Very low	33.6	Very low	91 Å²	91	161.4 Å²	161.4	75%	0.752	81%	0.811	S	S	*	*				64.9	91.4	52.4	0	0	0	0	0	112.7
3	D	33.2	Very low	33.2	Very low	155 Å²	155	155 Å²	155	83%	0.829	81%	0.811	S	S	*	*			trans	58.7	175.4	136.8	-72	-9	0	0	0	119.5
4	P	52.8	Low	32.9	Very low	107 Å²	107	150.3 Å²	150.3	70%	0.695	82%	0.818	S	S	*	*				-130.1	-176.8	-80.9	36	-15.7	0	0	0	110.5
5	Y	31.4	Very low	32.6	Very low	238 Å²	238	145.3 Å²	145.3	93%	0.933	82%	0.815	S	S	*	*			trans	-114.9	116.5	163.5	-101.8	-83.7	0	0	0	111.6
6	Q	32.8	Very low	32.5	Very low	149 Å²	149	146.1 Å²	146.1	70%	0.696	82%	0.817	S	S	*	*			trans	-67.7	152.6	167.2	-67.2	171.2	-55.3	0	0	111.4
7	N	31.1	Very low	33.5	Very low	161 Å²	161	143.3 Å²	143.3	86%	0.861	81%	0.807	S	S	*	*				-163.4	133.2	112.1	-102.1	-17.4	0	0	0	113.9
8	N	31.1	Very low	33.4	Very low	134 Å²	134	147.9 Å²	147.9	72%	0.717	81%	0.811	S	S	*	*			trans	-65	172.8	168.5	-64.6	-38.3	0	0	0	110.8
9	V	31.7	Very low	33.1	Very low	100 Å²	100	143.4 Å²	143.4	61%	0.606	80%	0.803	S	S	*	*			cis	-170.2	140.7	45	-169.1	0	0	0	0	105.3
10	Y	31.1	Very low	32.9	Very low	207 Å²	207	142.3 Å²	142.3	81%	0.812	80%	0.8	S	S	*	*				-177.1	142.7	85.6	-92	-80.7	0	0	0	113.1
11	H	28.6	Very low	32.7	Very low	167 Å²	167	146.4 Å²	146.4	77%	0.773	80%	0.804	S	S	*	*			trans	-14.9	148	152.5	-76.3	-78.5	0	0	0	117
12	Q	29.2	Very low	32.3	Very low	187 Å²	187	138 Å²	138	87%	0.874	78%	0.779	S	S	*	*				-176.8	142	55.5	-143.2	168.6	22.6	0	0	111.9
13	G	29.3	Very low	32.1	Very low	78 Å²	78	143.6 Å²	143.6	80%	0.804	79%	0.79	S	S	*	*			trans	80.7	110.5	157.6	0	0	0	0	0	116.8
14	G	28.9	Very low	31.8	Very low	89 Å²	89	139.9 Å²	139.9	92%	0.918	79%	0.788	S	S	*	*			cis	84.2	110.9	36.9	0	0	0	0	0	108.8
15	G	28.3	Very low	30.6	Very low	75 Å²	75	138 Å²	138	77%	0.773	79%	0.788	S	S	*	*			cis	-172.2	164.3	2.5	0	0	0	0	0	109.3
16	D	30.7	Very low	30.5	Very low	158 Å²	158	133.8 Å²	133.8	85%	0.845	78%	0.782	S	S	*	*			trans	-65.4	-172.4	159.4	-61.8	-46.8	0	0	0	110.3
17	P	50.2	Low	30.2	Very low	99 Å²	99	133.5 Å²	133.5	64%	0.643	78%	0.78	S	S	*	*			cis	-144	-170.6	-3	14.8	15.6	0	0	0	114.8
18	Y	30.1	Very low	30.1	Very low	226 Å²	226	133.8 Å²	133.8	89%	0.886	78%	0.777	S	S	*	*			trans	90.3	117.8	152.9	-65.2	-72.3	0	0	0	121.2
19	G	28.1	Very low	29.9	Very low	63 Å²	63	130.1 Å²	130.1	65%	0.649	77%	0.771	S	S	*	*				81.8	99.1	95.2	0	0	0	0	0	121
20	T	30	Very low	29.6	Very low	121 Å²	121	136.9 Å²	136.9	74%	0.742	79%	0.787	S	S	*	*				68	144.7	127.3	-27.1	0	0	0	0	123.1
21	Y	29	Very low	29.4	Very low	228 Å²	228	130 Å²	130	89%	0.894	78%	0.779	S	S	*	*			trans	85.6	133.7	168.4	-58.5	-79.3	0	0	0	115.8
22	G	28.2	Very low	29.3	Very low	64 Å²	64	132.2 Å²	132.2	66%	0.66	78%	0.782	S	S	*	*			cis	160	163.8	6.1	0	0	0	0	0	108.6
23	E	28.4	Very low	29.2	Very low	210 Å²	210	131.6 Å²	131.6	98%	0.981	78%	0.779	S	S	*	*			trans	71.9	140.1	172.5	-58.4	-176.7	146.5	0	0	117.5
24	G	27.5	Very low	29	Very low	76 Å²	76	131.3 Å²	131.3	78%	0.784	78%	0.776	S	S	*	*			cis	155.6	143.4	5.3	0	0	0	0	0	109.4
25	G	27.2	Very low	28.9	Very low	68 Å²	68	135.9 Å²	135.9	70%	0.701	77%	0.773	S	S	*	*			trans	85.9	144.9	168.1	0	0	0	0	0	115.7
26	D	28	Very low	28.8	Very low	149 Å²	149	136.6 Å²	136.6	80%	0.797	77%	0.766	S	S	*	*			cis	-164.9	149.9	-0.3	-90.2	-42.4	0	0	0	108.7
27	Q	27.9	Very low	28.6	Very low	143 Å²	143	139.9 Å²	139.9	67%	0.668	77%	0.768	S	S	*	*			trans	48.8	120.4	141.4	-68.5	-173.5	-54	0	0	121.8
28	E	28.2	Very low	28.4	Very low	168 Å²	168	140.6 Å²	140.6	79%	0.785	77%	0.773	S	S	*	*				74.4	134.2	108.4	-63.5	174.8	-160	0	0	113.6
29	G	26.9	Very low	28.2	Very low	57 Å²	57	139 Å²	139	59%	0.588	77%	0.773	S	S	*	*			cis	161.3	162.6	11.4	0	0	0	0	0	107.7
30	Y	26.7	Very low	28.2	Very low	242 Å²	242	144.1 Å²	144.1	95%	0.949	78%	0.781	S	S	*	*			trans	60	146	162.6	-54.5	-83.5	0	0	0	117.7
31	G	25.4	Very low	28.2	Very low	62 Å²	62	146.4 Å²	146.4	64%	0.639	78%	0.783	S	S	*	*			cis	159.5	156.3	7.4	0	0	0	0	0	108.7
32	Y	26.2	Very low	28.1	Very low	214 Å²	214	142.7 Å²	142.7	84%	0.839	78%	0.778	S	S	*	*			trans	63.2	122	160.1	-79.8	-102.6	0	0	0	119.7
33	Q	27.4	Very low	28.3	Very low	174 Å²	174	144.6 Å²	144.6	81%	0.813	79%	0.788	S	S	*	*				88.4	132.9	63.7	-143	-176.4	24.5	0	0	114.2
34	G	26.5	Very low	28.5	Very low	71 Å²	71	139.3 Å²	139.3	73%	0.732	78%	0.781	S	S	*	*			trans	95	146.4	163.3	0	0	0	0	0	115.1
35	E	26.7	Very low	28.8	Very low	186 Å²	186	141.5 Å²	141.5	87%	0.869	78%	0.784	S	S	*	*			cis	-173.9	142.6	-5.5	-121.9	177.8	-174.3	0	0	106.5
36	S	25	Very low	29	Very low	89 Å²	89	144.9 Å²	144.9	62%	0.622	79%	0.786	S	S	*	*			trans	11.1	125.7	150.7	35.3	0	0	0	0	124.5
37	Y	28	Very low	29.3	Very low	227 Å²	227	142.1 Å²	142.1	89%	0.89	78%	0.783	S	S	*	*			trans	50.4	166.1	135.7	-65.9	-76.9	0	0	0	121.9
38	P	44.4	Very low	29.6	Very low	115 Å²	115	140.7 Å²	140.7	75%	0.747	79%	0.785	S	S	*	*			cis	-131.5	-175.6	-10.6	29	-5.8	0	0	0	113.1
39	Q	27.3	Very low	29.8	Very low	191 Å²	191	141.5 Å²	141.5	89%	0.893	79%	0.788	S	S	*	*				151.9	137.2	125.3	-159.5	158.4	18.4	0	0	114.1
40	E	27	Very low	30	Very low	171 Å²	171	142.3 Å²	142.3	80%	0.799	80%	0.797	S	S	*	*			trans	-81.8	178.5	-171	-64.8	167.9	136.9	0	0	115.1
41	E	30.6	Very low	30.3	Very low	169 Å²	169	137.5 Å²	137.5	79%	0.79	78%	0.783	S	S	*	*			trans	86.4	141.7	158.2	-61	-176.3	177	0	0	117.3
42	D	27.6	Very low	30.8	Very low	150 Å²	150	142.6 Å²	142.6	80%	0.802	80%	0.795	S	S	*	*			cis	-172.4	139.3	-21.6	-106.9	-19.7	0	0	0	104
43	A	32.1	Very low	31.5	Very low	105 Å²	105	138.6 Å²	138.6	87%	0.868	79%	0.788	S	S	*	*			trans	-158.2	106	155.7	0	0	0	0	0	110
44	A	31.9	Very low	32.1	Very low	99 Å²	99	139.1 Å²	139.1	82%	0.818	79%	0.791	S	S	*	*			trans	-67.4	154.1	-178.3	0	0	0	0	0	114.7
45	S	33.3	Very low	32.5	Very low	122 Å²	122	143.4 Å²	143.4	85%	0.853	80%	0.797	S	S	*	*			trans	-148.9	96.4	137.8	175.2	0	0	0	0	108.1
46	D	31.6	Very low	33.1	Very low	139 Å²	139	143.7 Å²	143.7	74%	0.743	80%	0.798	S	S	*	*			trans	-75.5	130.5	173.7	-166	0.2	0	0	0	110.2	T48	D46-T48 PolarHBondContact OD1-N 3.05Å
47	A	35.5	Very low	33.6	Very low	90 Å²	90	147.7 Å²	147.7	74%	0.744	81%	0.809	S	S	*	*			trans	-147.1	80.9	161.2	0	0	0	0	0	107.9
48	T	33.6	Very low	34	Very low	113 Å²	113	147.2 Å²	147.2	69%	0.693	81%	0.808	S	S	*	*			trans	-5.8	147.4	143.2	54.5	0	0	0	0	116.5	D46	D46-T48 PolarHBondContact OD1-N 3.05Å
49	E	32.5	Very low	33.7	Very low	185 Å²	185	150.6 Å²	150.6	86%	0.864	81%	0.813	S	S	*	*			cis	178	138.8	-10.5	178.4	178.3	-166.2	0	0	102.6
50	G	30.1	Very low	34.1	Very low	74 Å²	74	143.9 Å²	143.9	76%	0.763	80%	0.795	S	S	*	*			trans	170.6	80.8	177.5	0	0	0	0	0	112.6
51	H	33.7	Very low	34.8	Very low	141 Å²	141	143.9 Å²	143.9	65%	0.653	80%	0.795	S	S	*	*			trans	-41	130.3	168.2	-102.2	-78.1	0	0	0	113.4	D53	H51-D53 IonicContact CE1-OD1 2.79Å; H51-D53 PolarHBondContact CE1-OD1 3.17Å; H51-D53 IonicContact CE1-OD2 3.06Å; H51-D53 PolarHBondContact CE1-OD2 3.19Å; H51-D53 IonicContact ND1-OD1 2.72Å; H51-D53 PolarHBondContact ND1-OD1 2.95Å; H51-D53 VanDerWaalsContact ND1-OD1 3.17Å; H51-D53 IonicContact ND1-OD2 2.9Å; H51-D53 PolarHBondContact ND1-OD2 3.5Å; H51-D53 VanDerWaalsContact ND1-OD2 3.14Å
52	D	35.3	Very low	35.2	Very low	170 Å²	170	146.3 Å²	146.3	91%	0.909	80%	0.799	S	S	*	*			trans	-137	105.6	136.1	-86.5	-31.7	0	0	0	106.6	E54	D52-E54 PolarHBondContact O-N 3Å
53	D	40.7	Very low	36.1	Very low	129 Å²	129	147.2 Å²	147.2	69%	0.69	80%	0.798	S	S	*	*			trans	-72	109	170.4	-65.3	-49.7	0	0	0	108.2	H51	H51-D53 IonicContact CE1-OD1 2.79Å; H51-D53 PolarHBondContact CE1-OD1 3.17Å; H51-D53 IonicContact CE1-OD2 3.06Å; H51-D53 PolarHBondContact CE1-OD2 3.19Å; H51-D53 IonicContact ND1-OD1 2.72Å; H51-D53 PolarHBondContact ND1-OD1 2.95Å; H51-D53 VanDerWaalsContact ND1-OD1 3.17Å; H51-D53 IonicContact ND1-OD2 2.9Å; H51-D53 PolarHBondContact ND1-OD2 3.5Å; H51-D53 VanDerWaalsContact ND1-OD2 3.14Å
54	E	40.3	Very low	37	Very low	186 Å²	186	144.1 Å²	144.1	87%	0.869	78%	0.777	S	S	*	*			trans	171.4	72.4	148.7	-96.9	176.8	-156.6	0	0	110.5	D52	D52-E54 PolarHBondContact O-N 3Å
55	D	35.7	Very low	38.1	Very low	161 Å²	161	147.1 Å²	147.1	86%	0.861	78%	0.777	S	S	*	*			trans	-140.3	68.9	157.8	-88.9	-34.6	0	0	0	108.2	M57	D55-M57 PolarHBondContact O-N 3.45Å
56	Q	38.7	Very low	39	Very low	191 Å²	191	144.6 Å²	144.6	89%	0.893	76%	0.758	S	S	*	*			trans	-67.4	89.5	156.6	-74.3	-176.8	7.4	0	0	106.7	Y58	Q56-Y58 VanDerWaalsContact C-N 3.3Å; Q56-Y58 PolarHBondContact O-N 2.87Å
57	M	35.4	Very low	40.1	Very low	174 Å²	174	143.2 Å²	143.2	86%	0.857	75%	0.747	S	S	*	*			trans	-54	104	158.5	-95.8	-164.9	-69.6	0	0	106.7	D55 E59	D55-M57 PolarHBondContact O-N 3.45Å; M57-E59 VanDerWaalsContact C-N 3.27Å; M57-E59 PolarHBondContact O-N 3.09Å
58	Y	35.8	Very low	41.2	Very low	217 Å²	217	142.8 Å²	142.8	85%	0.851	74%	0.737	S	S	*	*			trans	-63.4	95.5	168.7	-148.9	-91.4	0	0	0	105.9	Q56 G60	Q56-Y58 VanDerWaalsContact C-N 3.3Å; Q56-Y58 PolarHBondContact O-N 2.87Å; Y58-G60 PolarHBondContact O-N 2.85Å
59	E	39.3	Very low	42.5	Very low	186 Å²	186	142.1 Å²	142.1	87%	0.869	73%	0.729	S	S	*	*			trans	-66.6	71.9	160.9	-75.8	-171.3	165.7	0	0	107.2	M57 E61	M57-E59 VanDerWaalsContact C-N 3.27Å; M57-E59 PolarHBondContact O-N 3.09Å; E59-E61 VanDerWaalsContact C-N 3.32Å; E59-E61 PolarHBondContact O-N 3.37Å
60	G	35.8	Very low	43.9	Very low	50 Å²	50	139.2 Å²	139.2	52%	0.515	72%	0.715	S	S	.	*			trans	-65.3	102.4	159	0	0	0	0	0	105.6	Y58 Y62	Y58-G60 PolarHBondContact O-N 2.85Å; G60-Y62 PolarHBondContact O-N 3.1Å
61	E	40.5	Very low	45.7	Very low	170 Å²	170	138.4 Å²	138.4	79%	0.794	70%	0.696	S	S	*	*			trans	-44.4	115	159.5	-76.8	-177.2	156.7	0	0	106.5	E59 Q63	E59-E61 VanDerWaalsContact C-N 3.32Å; E59-E61 PolarHBondContact O-N 3.37Å; E61-Q63 PolarHBondContact O-N 3.32Å
62	Y	39.4	Very low	47.2	Very low	221 Å²	221	135.3 Å²	135.3	87%	0.867	68%	0.68	S	S	*	*			trans	-66.4	86	169.9	-159.3	-88.6	0	0	0	105.4	G60 G64	G60-Y62 PolarHBondContact O-N 3.1Å; Y62-G64 PolarHBondContact O-N 3.28Å
63	Q	47.8	Very low	48.5	Very low	168 Å²	168	129.9 Å²	129.9	79%	0.785	66%	0.659	S	S	*	*			trans	-59	97.2	163.8	-84.7	174.4	-12.1	0	0	104.4	E61	E61-Q63 PolarHBondContact O-N 3.32Å
64	G	49.7	Very low	49.7	Very low	41 Å²	41	126.7 Å²	126.7	42%	0.423	65%	0.651	S	S	.	*			trans	-48.4	152.6	173.4	0	0	0	0	0	108.8	Y62 P66	Y62-G64 PolarHBondContact O-N 3.28Å; G64-P66 VanDerWaalsContact O-CD 3.25Å; G64-P66 WeakPolarHBondContact O-CD 3.41Å
65	I	54.5	Low	50.9	Low	161 Å²	161	121.9 Å²	121.9	83%	0.826	63%	0.628	S	S	*	*	S	Bend	trans	-46.6	113.5	176.7	-59.1	166.7	0	0	0	107	H67	I65-H67 PolarHBondContact O-N 3.49Å
66	P	52.2	Low	52.2	Low	69 Å²	69	118.1 Å²	118.1	45%	0.448	60%	0.602	S	S	.	*			trans	-57.2	136.1	-170	15.6	-27.8	0	0	0	108.7	G64 E70 V71	G64-P66 VanDerWaalsContact O-CD 3.25Å; G64-P66 WeakPolarHBondContact O-CD 3.41Å; P66-E70 HydrophobicContact CB-CB 4.43Å; P66-V71 HydrophobicContact CB-CG2 3.74Å; P66-V71 HydrophobicContact CG-CG2 3.66Å
67	H	54.9	Low	53.4	Low	110 Å²	110	111.5 Å²	111.5	51%	0.509	58%	0.579	S	S	.	*			trans	-57.3	142	-179.7	-168	-92.1	0	0	0	107.8	I65 D69 E70 V71	I65-H67 PolarHBondContact O-N 3.49Å; H67-D69 IonicContact CE1-OD2 3.17Å; H67-D69 PolarHBondContact CE1-OD2 3.5Å; H67-D69 VanDerWaalsContact CE1-OD2 3.22Å; H67-D69 IonicContact ND1-OD2 3.36Å; H67-D69 PolarHBondContact ND1-OD2 3.48Å; H67-D69 PolarHBondContact O-N 3.44Å; H67-E70 HydrophobicContact CB-CG 4.21Å; H67-E70 PolarHBondContact N-OE2 3.21Å; H67-E70 WeakPolarHBondContact O-CA 3.49Å; H67-E70 WeakPolarHBondContact O-CB 3.48Å; H67-E70 PolarHBondContact O-N 3.3Å; H67-V71 PolarHBondContact O-N 3.44Å
68	P	60	Low	54.8	Low	82 Å²	82	106.1 Å²	106.1	53%	0.532	56%	0.563	S	S	.	*	H	α-helix	trans	-51.1	-28	-176.8	-29.3	34.2	0	0	0	114.1	K72	P68-K72 VanDerWaalsContact O-CG 3.24Å; P68-K72 WeakPolarHBondContact O-CG 3.46Å; P68-K72 PolarHBondContact O-N 2.86Å
69	D	59.3	Low	56.2	Low	99 Å²	99	98.4 Å²	98.4	53%	0.529	53%	0.532	S	S	.	.	H	α-helix	trans	-75.2	-31.4	176.5	-61.2	-33.1	0	0	0	113.5	H67 A73	H67-D69 IonicContact CE1-OD2 3.17Å; H67-D69 PolarHBondContact CE1-OD2 3.5Å; H67-D69 VanDerWaalsContact CE1-OD2 3.22Å; H67-D69 IonicContact ND1-OD2 3.36Å; H67-D69 PolarHBondContact ND1-OD2 3.48Å; H67-D69 PolarHBondContact O-N 3.44Å; D69-A73 WeakPolarHBondContact O-CB 2.84Å; D69-A73 PolarHBondContact O-N 3.34Å
70	E	63.7	Low	57.3	Low	123 Å²	123	92 Å²	92	58%	0.575	51%	0.511	S	S	*	.	H	α-helix	trans	-72.7	-39	174.3	-65.7	175.1	161.9	0	0	111.2	P66 H67 K72 A73 A74	P66-E70 HydrophobicContact CB-CB 4.43Å; H67-E70 HydrophobicContact CB-CG 4.21Å; H67-E70 PolarHBondContact N-OE2 3.21Å; H67-E70 WeakPolarHBondContact O-CA 3.49Å; H67-E70 WeakPolarHBondContact O-CB 3.48Å; H67-E70 PolarHBondContact O-N 3.3Å; E70-K72 VanDerWaalsContact C-N 3.32Å; E70-K72 PolarHBondContact O-N 3.27Å; E70-A73 PolarHBondContact O-N 3.34Å; E70-A74 WeakPolarHBondContact O-CB 3.32Å; E70-A74 PolarHBondContact O-N 3.45Å
71	V	66.4	Low	58.6	Low	58 Å²	58	97 Å²	97	35%	0.352	52%	0.518	S	S	.	.	H	α-helix	trans	-60.7	-44.3	172.7	-179.6	0	0	0	0	110.5	P66 H67 A74 Q75	P66-V71 HydrophobicContact CB-CG2 3.74Å; P66-V71 HydrophobicContact CG-CG2 3.66Å; H67-V71 PolarHBondContact O-N 3.44Å; V71-A74 PolarHBondContact O-N 2.88Å; V71-Q75 WeakPolarHBondContact O-CG 3.37Å; V71-Q75 PolarHBondContact O-N 2.98Å
72	K	65.3	Low	59.6	Low	76 Å²	76	91.2 Å²	91.2	33%	0.33	50%	0.499	S	S	.	.	H	α-helix	trans	-65.1	-42.2	175.8	-74.9	173.6	-179.4	-176.4	0	112.4	P68 E70 A74 Q75 R76	P68-K72 VanDerWaalsContact O-CG 3.24Å; P68-K72 WeakPolarHBondContact O-CG 3.46Å; P68-K72 PolarHBondContact O-N 2.86Å; E70-K72 VanDerWaalsContact C-N 3.32Å; E70-K72 PolarHBondContact O-N 3.27Å; K72-A74 VanDerWaalsContact C-N 3.33Å; K72-A74 PolarHBondContact O-N 3.42Å; K72-Q75 PolarHBondContact O-N 2.97Å; K72-R76 WeakPolarHBondContact O-CG 3.33Å; K72-R76 PolarHBondContact O-N 3.41Å
73	A	63.6	Low	60.5	Low	56 Å²	56	87 Å²	87	46%	0.463	48%	0.482	S	S	.	.	H	α-helix	trans	-63	-40	175.9	0	0	0	0	0	111.9	D69 E70 R76 A77	D69-A73 WeakPolarHBondContact O-CB 2.84Å; D69-A73 PolarHBondContact O-N 3.34Å; E70-A73 PolarHBondContact O-N 3.34Å; A73-R76 PolarHBondContact O-N 3.11Å; A73-A77 WeakPolarHBondContact O-CB 3.43Å; A73-A77 PolarHBondContact O-N 3.01Å
74	A	64.5	Low	61	Low	62 Å²	62	87.1 Å²	87.1	51%	0.512	48%	0.482	S	S	.	.	H	α-helix	trans	-65.9	-40.6	174.6	0	0	0	0	0	112.2	E70 V71 K72 A77 A78	E70-A74 WeakPolarHBondContact O-CB 3.32Å; E70-A74 PolarHBondContact O-N 3.45Å; V71-A74 PolarHBondContact O-N 2.88Å; K72-A74 VanDerWaalsContact C-N 3.33Å; K72-A74 PolarHBondContact O-N 3.42Å; A74-A77 PolarHBondContact O-N 3.44Å; A74-A78 WeakPolarHBondContact O-CB 3.25Å; A74-A78 PolarHBondContact O-N 2.9Å
75	Q	66.5	Low	61.4	Low	84 Å²	84	89.1 Å²	89.1	39%	0.393	50%	0.495	S	S	.	.	H	α-helix	trans	-63.1	-42.6	173.2	-77.3	176.8	-24	0	0	112.1	V71 K72 A78 R79	V71-Q75 WeakPolarHBondContact O-CG 3.37Å; V71-Q75 PolarHBondContact O-N 2.98Å; K72-Q75 PolarHBondContact O-N 2.97Å; Q75-A78 WeakPolarHBondContact O-CB 3.35Å; Q75-A78 PolarHBondContact O-N 2.9Å; Q75-R79 WeakPolarHBondContact O-CG 3.23Å; Q75-R79 PolarHBondContact O-N 2.86Å
76	R	63.5	Low	61.4	Low	83 Å²	83	87 Å²	87	31%	0.313	48%	0.482	S	S	.	.	H	α-helix	trans	-60.4	-44.4	172.6	-75.7	-179	-173.9	-169.9	-0.2	111.9	K72 A73 A78 R79 A80 E104 D105	K72-R76 WeakPolarHBondContact O-CG 3.33Å; K72-R76 PolarHBondContact O-N 3.41Å; A73-R76 PolarHBondContact O-N 3.11Å; R76-A78 VanDerWaalsContact C-N 3.29Å; R76-A78 PolarHBondContact O-N 3.03Å; R76-R79 PolarHBondContact O-N 3.36Å; R76-A80 WeakPolarHBondContact O-CB 3.24Å; R76-A80 PolarHBondContact O-N 3.47Å; R76-E104 IonicContact CZ-OE2 3.04Å; R76-E104 IonicContact NE-OE2 2.82Å; R76-E104 PolarHBondContact NE-OE2 3.49Å; R76-E104 IonicContact NH2-OE2 2.83Å; R76-E104 PolarHBondContact NH2-OE2 3.1Å; R76-E104 VanDerWaalsContact NH2-OE2 3.15Å; R76-D105 IonicContact CZ-OD1 3.23Å; R76-D105 IonicContact NH1-OD1 4Å; R76-D105 PolarHBondContact NH1-OD1 2.91Å; R76-D105 IonicContact NH2-OD1 3.18Å; R76-D105 PolarHBondContact NH2-OD1 3.37Å
77	A	62.8	Low	61	Low	51 Å²	51	88.9 Å²	88.9	42%	0.421	50%	0.503	S	S	.	.	H	α-helix	trans	-63.6	-36.2	176.8	0	0	0	0	0	112	A73 A74 K81	A73-A77 WeakPolarHBondContact O-CB 3.43Å; A73-A77 PolarHBondContact O-N 3.01Å; A74-A77 PolarHBondContact O-N 3.44Å; A77-K81 WeakPolarHBondContact O-CB 3.29Å; A77-K81 WeakPolarHBondContact O-CG 3.2Å; A77-K81 PolarHBondContact O-N 2.95Å
78	A	65.1	Low	60.8	Low	61 Å²	61	87.1 Å²	87.1	50%	0.504	52%	0.515	S	S	.	.	H	α-helix	trans	-67.8	-43.5	173.9	0	0	0	0	0	112.2	A74 Q75 R76 K81 A82	A74-A78 WeakPolarHBondContact O-CB 3.25Å; A74-A78 PolarHBondContact O-N 2.9Å; Q75-A78 WeakPolarHBondContact O-CB 3.35Å; Q75-A78 PolarHBondContact O-N 2.9Å; R76-A78 VanDerWaalsContact C-N 3.29Å; R76-A78 PolarHBondContact O-N 3.03Å; A78-K81 PolarHBondContact O-N 2.85Å; A78-A82 PolarHBondContact O-N 3.42Å
79	R	65.9	Low	60.5	Low	56 Å²	56	84.7 Å²	84.7	21%	0.211	50%	0.502	C	S	.	.	H	α-helix	trans	-63.2	-43.4	174.3	-72	-177.6	-171.3	156.8	7.1	111.9	Q75 R76 K81 A82 R83 E104 M233	Q75-R79 WeakPolarHBondContact O-CG 3.23Å; Q75-R79 PolarHBondContact O-N 2.86Å; R76-R79 PolarHBondContact O-N 3.36Å; R79-K81 VanDerWaalsContact C-N 3.29Å; R79-K81 PolarHBondContact O-N 3.38Å; R79-A82 CarbonylContact O-C 3.49Å; R79-A82 WeakPolarHBondContact O-CB 3.22Å; R79-A82 PolarHBondContact O-N 3.27Å; R79-A82 VanDerWaalsContact O-N 3.12Å; R79-R83 WeakPolarHBondContact O-CB 3.27Å; R79-R83 PolarHBondContact O-N 3.11Å; R79-E104 IonicContact CZ-OE1 3.53Å; R79-E104 IonicContact NH1-OE1 3.39Å; R79-E104 PolarHBondContact NH1-OE1 3.35Å; R79-E104 IonicContact NH2-OE1 3.14Å; R79-M233 VanDerWaalsContact NH2-CE 3.27Å
80	A	62.4	Low	60.7	Low	51 Å²	51	83.9 Å²	83.9	42%	0.421	50%	0.5	S	S	.	.	H	α-helix	trans	-63.5	-33.8	175.9	0	0	0	0	0	112.7	R76 R83 Q84	R76-A80 WeakPolarHBondContact O-CB 3.24Å; R76-A80 PolarHBondContact O-N 3.47Å; A80-R83 WeakPolarHBondContact O-CB 3.36Å; A80-Q84 PolarHBondContact O-N 3.13Å
81	K	61.8	Low	60.7	Low	155 Å²	155	84.9 Å²	84.9	67%	0.674	51%	0.505	S	S	*	.	H	α-helix	trans	-70.2	-39.2	171.2	-77.6	178.1	-179.7	179.7	0	112.2	A77 A78 R79 R83 Q84 A85	A77-K81 WeakPolarHBondContact O-CB 3.29Å; A77-K81 WeakPolarHBondContact O-CG 3.2Å; A77-K81 PolarHBondContact O-N 2.95Å; A78-K81 PolarHBondContact O-N 2.85Å; R79-K81 VanDerWaalsContact C-N 3.29Å; R79-K81 PolarHBondContact O-N 3.38Å; K81-R83 VanDerWaalsContact C-N 3.35Å; K81-Q84 PolarHBondContact O-N 3.36Å; K81-A85 PolarHBondContact O-N 3.25Å
82	A	61.9	Low	60.6	Low	48 Å²	48	86.4 Å²	86.4	40%	0.397	51%	0.511	S	S	.	.	H	α-helix	trans	-62.6	-40.4	172.7	0	0	0	0	0	112	A78 R79 Q84 A85 Q86	A78-A82 PolarHBondContact O-N 3.42Å; R79-A82 CarbonylContact O-C 3.49Å; R79-A82 WeakPolarHBondContact O-CB 3.22Å; R79-A82 PolarHBondContact O-N 3.27Å; R79-A82 VanDerWaalsContact O-N 3.12Å; A82-Q84 VanDerWaalsContact C-N 3.28Å; A82-Q84 PolarHBondContact O-N 3.23Å; A82-A85 PolarHBondContact O-N 3.13Å; A82-Q86 PolarHBondContact O-N 3.35Å
83	R	58.4	Low	60.6	Low	132 Å²	132	85.8 Å²	85.8	50%	0.498	51%	0.509	S	S	.	.	H	α-helix	trans	-55.4	-39.8	172.7	-178.8	-177	177.7	-175.7	2.9	112.7	R79 A80 K81 A85	R79-R83 WeakPolarHBondContact O-CB 3.27Å; R79-R83 PolarHBondContact O-N 3.11Å; A80-R83 WeakPolarHBondContact O-CB 3.36Å; K81-R83 VanDerWaalsContact C-N 3.35Å; R83-A85 VanDerWaalsContact C-N 3.34Å
84	Q	59.2	Low	60.9	Low	171 Å²	171	86.9 Å²	86.9	80%	0.799	51%	0.505	S	S	*	.	H	α-helix	trans	-75	-23.5	176.7	-71.6	179.9	-10.2	0	0	113.2	A80 K81 A82	A80-Q84 PolarHBondContact O-N 3.13Å; K81-Q84 PolarHBondContact O-N 3.36Å; A82-Q84 VanDerWaalsContact C-N 3.28Å; A82-Q84 PolarHBondContact O-N 3.23Å
85	A	56.9	Low	61.2	Low	84 Å²	84	85 Å²	85	69%	0.694	49%	0.486	S	S	*	.	H	α-helix	trans	-86	-23.6	179.3	0	0	0	0	0	113.5	K81 A82 R83 A87	K81-A85 PolarHBondContact O-N 3.25Å; A82-A85 PolarHBondContact O-N 3.13Å; R83-A85 VanDerWaalsContact C-N 3.34Å; A85-A87 PolarHBondContact O-N 3.38Å
86	Q	55.6	Low	61.4	Low	115 Å²	115	81.1 Å²	81.1	54%	0.537	47%	0.469	S	S	.	.			trans	-86.9	77.1	178.4	-103.1	168.7	-40.9	0	0	112.2	A82 G88	A82-Q86 PolarHBondContact O-N 3.35Å; Q86-G88 VanDerWaalsContact C-N 3.27Å; Q86-G88 PolarHBondContact O-N 2.88Å
87	A	43.4	Very low	61.8	Low	109 Å²	109	80 Å²	80	90%	0.901	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	79.8	166.4	0	0	0	0	0	110.2	A85	A85-A87 PolarHBondContact O-N 3.38Å
88	G	50.1	Low	62.4	Low	73 Å²	73	79.6 Å²	79.6	75%	0.753	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	153.7	8.8	178.1	0	0	0	0	0	116.8	Q86	Q86-G88 VanDerWaalsContact C-N 3.27Å; Q86-G88 PolarHBondContact O-N 2.88Å
89	A	55.2	Low	63	Low	31 Å²	31	76.9 Å²	76.9	26%	0.256	43%	0.433	S	S	.	.			trans	-63.4	141.9	175.2	0	0	0	0	0	111.2	E94	A89-E94 HydrophobicContact CB-CG 4.3Å
90	T	61.8	Low	63.6	Low	82 Å²	82	74.4 Å²	74.4	50%	0.503	42%	0.424	S	S	.	.			trans	-71.4	144.5	178.7	-21.8	0	0	0	0	109.1	L92 E93 E94	T90-L92 PolarHBondContact O-N 2.9Å; T90-E93 PolarHBondContact N-OE2 3.44Å; T90-E93 WeakPolarHBondContact O-CB 3.34Å; T90-E93 PolarHBondContact O-N 3.38Å; T90-E93 PolarHBondContact OG1-OE2 3.25Å; T90-E94 PolarHBondContact O-N 2.79Å
91	E	64.6	Low	64.3	Low	144 Å²	144	74.7 Å²	74.7	67%	0.673	42%	0.418	S	S	*	.	H	α-helix	trans	-52.2	-28.2	179.4	-67.8	-176.1	157.4	0	0	113.3	L95	E91-L95 WeakPolarHBondContact O-CB 3.48Å; E91-L95 PolarHBondContact O-N 3.3Å
92	L	63.2	Low	65.2	Low	90 Å²	90	68 Å²	68	47%	0.471	39%	0.39	S	S	.	.	H	α-helix	trans	-70.1	-35.8	174.7	-76.1	156.7	0	0	0	113.7	T90 L95 A96	T90-L92 PolarHBondContact O-N 2.9Å; L92-L95 PolarHBondContact O-N 3.44Å; L92-A96 PolarHBondContact O-N 2.92Å
93	E	66.9	Low	66.1	Low	63 Å²	63	65.7 Å²	65.7	29%	0.294	37%	0.371	S	S	.	.	H	α-helix	trans	-71.6	-41.2	177.7	-69.8	172.9	136.5	0	0	110.3	T90 L95 A96 E97 Q688	T90-E93 PolarHBondContact N-OE2 3.44Å; T90-E93 WeakPolarHBondContact O-CB 3.34Å; T90-E93 PolarHBondContact O-N 3.38Å; T90-E93 PolarHBondContact OG1-OE2 3.25Å; E93-L95 VanDerWaalsContact C-N 3.29Å; E93-L95 PolarHBondContact O-N 3.4Å; E93-A96 PolarHBondContact O-N 2.9Å; E93-E97 WeakPolarHBondContact O-CG 3.22Å; E93-E97 PolarHBondContact O-N 2.73Å; E93-Q688 PolarHBondContact OE1-NE2 2.91Å; E93-Q688 VanDerWaalsContact OE1-NE2 3.13Å
94	E	69.4	Low	67.2	Low	79 Å²	79	60.5 Å²	60.5	37%	0.369	35%	0.352	S	S	.	.	H	α-helix	trans	-61.8	-38	173.9	-65.1	-169	167.6	0	0	112.1	A89 T90 Q98	A89-E94 HydrophobicContact CB-CG 4.3Å; T90-E94 PolarHBondContact O-N 2.79Å; E94-Q98 VanDerWaalsContact O-CG 3.27Å; E94-Q98 WeakPolarHBondContact O-CG 3.36Å; E94-Q98 PolarHBondContact O-N 2.67Å
95	L	70.2	Confident	68.1	Low	22 Å²	22	55.7 Å²	55.7	12%	0.115	33%	0.332	C	S	.	.	H	α-helix	trans	-63.1	-44.6	174.9	175.8	65.4	0	0	0	111.9	E91 L92 E93 Q98 Y99 I344	E91-L95 WeakPolarHBondContact O-CB 3.48Å; E91-L95 PolarHBondContact O-N 3.3Å; L92-L95 PolarHBondContact O-N 3.44Å; E93-L95 VanDerWaalsContact C-N 3.29Å; E93-L95 PolarHBondContact O-N 3.4Å; L95-Q98 PolarHBondContact O-N 3.01Å; L95-Y99 WeakPolarHBondContact O-CB 3.34Å; L95-Y99 PolarHBondContact O-N 3.14Å; L95-I344 HydrophobicContact CD1-CB 4.45Å; L95-I344 HydrophobicContact CD1-CG2 3.15Å
96	A	71.1	Confident	69.2	Low	4 Å²	4	51.7 Å²	51.7	3%	0.033	30%	0.299	C	S	.	.	H	α-helix	trans	-62.3	-43.4	178.6	0	0	0	0	0	111.8	L92 E93 Y99 E100 I686 L687	L92-A96 PolarHBondContact O-N 2.92Å; E93-A96 PolarHBondContact O-N 2.9Å; A96-Y99 PolarHBondContact O-N 3.31Å; A96-E100 PolarHBondContact O-N 3.45Å; A96-E100 VanDerWaalsContact O-N 3.15Å; A96-I686 HydrophobicContact CB-CG2 4.11Å; A96-L687 WeakPolarHBondContact CB-O 3.24Å
97	E	71.6	Confident	70.4	Confident	60 Å²	60	46.4 Å²	46.4	28%	0.28	28%	0.275	S	S	.	.	H	α-helix	trans	-63.3	-47.3	176.2	-69.7	-169.2	164.7	0	0	112.3	E93 Y99 E100 D101 I686	E93-E97 WeakPolarHBondContact O-CG 3.22Å; E93-E97 PolarHBondContact O-N 2.73Å; E97-Y99 VanDerWaalsContact C-N 3.25Å; E97-Y99 PolarHBondContact O-N 3.38Å; E97-E100 PolarHBondContact O-N 2.91Å; E97-D101 PolarHBondContact O-N 2.96Å; E97-D101 VanDerWaalsContact O-N 3.12Å; E97-I686 HydrophobicContact CG-CD1 3.69Å
98	Q	75.3	Confident	72.4	Confident	41 Å²	41	42.4 Å²	42.4	19%	0.192	24%	0.238	C	C	.	.	H	α-helix	trans	-59.1	-38.5	177	-74.2	174.7	15.8	0	0	112.1	E94 L95 D101 I102	E94-Q98 VanDerWaalsContact O-CG 3.27Å; E94-Q98 WeakPolarHBondContact O-CG 3.36Å; E94-Q98 PolarHBondContact O-N 2.67Å; L95-Q98 PolarHBondContact O-N 3.01Å; Q98-D101 PolarHBondContact O-N 3.3Å; Q98-I102 WeakPolarHBondContact O-CD1 3.36Å; Q98-I102 VanDerWaalsContact O-CG1 3.24Å; Q98-I102 WeakPolarHBondContact O-CG1 3.32Å; Q98-I102 PolarHBondContact O-N 2.88Å; Q98-I102 VanDerWaalsContact O-N 3.15Å
99	Y	78.4	Confident	74.1	Confident	5 Å²	5	39.5 Å²	39.5	2%	0.02	21%	0.208	C	C	.	.	H	α-helix	trans	-65.3	-41.2	177.6	-179.5	-94.1	0	0	0	112.4	L95 A96 E97 I102 M103 E229 P305 R306 L309 L321	L95-Y99 WeakPolarHBondContact O-CB 3.34Å; L95-Y99 PolarHBondContact O-N 3.14Å; A96-Y99 PolarHBondContact O-N 3.31Å; E97-Y99 VanDerWaalsContact C-N 3.25Å; E97-Y99 PolarHBondContact O-N 3.38Å; Y99-I102 WeakPolarHBondContact O-CB 3.48Å; Y99-I102 PolarHBondContact O-N 3.33Å; Y99-M103 HydrophobicContact CD1-CG 4.03Å; Y99-M103 HydrophobicContact CE1-CG 3.5Å; Y99-M103 VanDerWaalsContact CE1-CG 3.5Å; Y99-M103 HydrophobicContact CE1-SD 4.38Å; Y99-M103 HydrophobicContact CE2-CG 4.36Å; Y99-M103 WeakPolarHBondContact O-CG 3.32Å; Y99-M103 PolarHBondContact O-N 3.01Å; Y99-E229 PolarHBondContact OH-O 3.48Å; Y99-P305 HydrophobicContact CE2-CB 4.41Å; Y99-P305 HydrophobicContact CE2-CG 4.26Å; Y99-P305 WeakPolarHBondContact OH-CG 3.5Å; Y99-R306 HydrophobicContact CE1-CB 4.34Å; Y99-R306 HydrophobicContact CE2-CB 4.16Å; Y99-L309 HydrophobicContact CD2-CD1 3.69Å; Y99-L309 HydrophobicContact CE2-CD1 4.14Å; Y99-L321 HydrophobicContact CE2-CD2 4.27Å
100	E	78.4	Confident	75.7	Confident	3 Å²	3	46.7 Å²	46.7	1%	0.014	23%	0.228	C	C	.	.	H	α-helix	trans	-64.7	-41.7	176.9	-69.4	-63.2	157.5	0	0	111.9	A96 E97 I102 M103 E104 I686	A96-E100 PolarHBondContact O-N 3.45Å; A96-E100 VanDerWaalsContact O-N 3.15Å; E97-E100 PolarHBondContact O-N 2.91Å; E100-I102 VanDerWaalsContact C-N 3.28Å; E100-I102 PolarHBondContact O-N 2.97Å; E100-M103 CarbonylContact O-C 3.48Å; E100-M103 PolarHBondContact O-N 2.88Å; E100-M103 VanDerWaalsContact O-N 3.07Å; E100-E104 PolarHBondContact O-N 3.33Å; E100-I686 HydrophobicContact CG-CG2 3.8Å
101	D	76.6	Confident	77.1	Confident	58 Å²	58	43.5 Å²	43.5	31%	0.31	21%	0.208	S	C	.	.	H	α-helix	trans	-58.8	-42.6	175.6	-74	-17.9	0	0	0	111.2	E97 Q98 M103 E104 D105	E97-D101 PolarHBondContact O-N 2.96Å; E97-D101 VanDerWaalsContact O-N 3.12Å; Q98-D101 PolarHBondContact O-N 3.3Å; D101-M103 VanDerWaalsContact C-N 3.35Å; D101-M103 PolarHBondContact O-N 3.4Å; D101-E104 WeakPolarHBondContact O-CB 3.49Å; D101-E104 PolarHBondContact O-N 3.16Å; D101-D105 PolarHBondContact O-N 3.33Å
102	I	80	Confident	78.4	Confident	14 Å²	14	36.7 Å²	36.7	7%	0.072	18%	0.176	C	C	.	.	H	α-helix	trans	-62.6	-41.9	174.7	-69.8	166.9	0	0	0	111.2	Q98 Y99 E100 D105 C106 L321 F339 V341 I344	Q98-I102 WeakPolarHBondContact O-CD1 3.36Å; Q98-I102 VanDerWaalsContact O-CG1 3.24Å; Q98-I102 WeakPolarHBondContact O-CG1 3.32Å; Q98-I102 PolarHBondContact O-N 2.88Å; Q98-I102 VanDerWaalsContact O-N 3.15Å; Y99-I102 WeakPolarHBondContact O-CB 3.48Å; Y99-I102 PolarHBondContact O-N 3.33Å; E100-I102 VanDerWaalsContact C-N 3.28Å; E100-I102 PolarHBondContact O-N 2.97Å; I102-D105 CarbonylContact O-C 3.57Å; I102-D105 PolarHBondContact O-N 3.19Å; I102-C106 WeakPolarHBondContact O-CB 3.41Å; I102-C106 PolarHBondContact O-N 3.39Å; I102-C106 PolarHBondContact O-SG 3.33Å; I102-L321 HydrophobicContact CG2-CD1 4.11Å; I102-L321 HydrophobicContact CG2-CD2 4.22Å; I102-F339 HydrophobicContact CG2-CE2 3.74Å; I102-F339 HydrophobicContact CG2-CZ 3.51Å; I102-V341 HydrophobicContact CD1-CG1 3.75Å; I102-V341 HydrophobicContact CD1-CG2 3.93Å; I102-V341 HydrophobicContact CG1-CG2 4.09Å; I102-I344 HydrophobicContact CD1-CD1 4.08Å
103	M	82.3	Confident	79.8	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-69	-33.8	178.6	-77.1	-58.1	-57.3	0	0	112.4	Y99 E100 D101 D105 C106 G107 F230 Q232 L321	Y99-M103 HydrophobicContact CD1-CG 4.03Å; Y99-M103 HydrophobicContact CE1-CG 3.5Å; Y99-M103 VanDerWaalsContact CE1-CG 3.5Å; Y99-M103 HydrophobicContact CE1-SD 4.38Å; Y99-M103 HydrophobicContact CE2-CG 4.36Å; Y99-M103 WeakPolarHBondContact O-CG 3.32Å; Y99-M103 PolarHBondContact O-N 3.01Å; E100-M103 CarbonylContact O-C 3.48Å; E100-M103 PolarHBondContact O-N 2.88Å; E100-M103 VanDerWaalsContact O-N 3.07Å; D101-M103 VanDerWaalsContact C-N 3.35Å; D101-M103 PolarHBondContact O-N 3.4Å; M103-D105 VanDerWaalsContact C-N 3.35Å; M103-C106 PolarHBondContact O-N 2.89Å; M103-G107 PolarHBondContact O-N 2.97Å; M103-F230 VanDerWaalsContact CE-C 3.42Å; M103-F230 WeakPolarHBondContact CE-O 3.46Å; M103-Q232 PolarHBondContact O-NE2 2.84Å; M103-L321 HydrophobicContact SD-CD2 3.83Å
104	E	80.1	Confident	81.1	Confident	23 Å²	23	38.3 Å²	38.3	11%	0.107	18%	0.183	C	C	.	.	H	α-helix	trans	-60.7	-45.7	169.6	-73.8	-176.2	-173.1	0	0	111.1	R76 R79 E100 D101 G107 Q232	R76-E104 IonicContact CZ-OE2 3.04Å; R76-E104 IonicContact NE-OE2 2.82Å; R76-E104 PolarHBondContact NE-OE2 3.49Å; R76-E104 IonicContact NH2-OE2 2.83Å; R76-E104 PolarHBondContact NH2-OE2 3.1Å; R76-E104 VanDerWaalsContact NH2-OE2 3.15Å; R79-E104 IonicContact CZ-OE1 3.53Å; R79-E104 IonicContact NH1-OE1 3.39Å; R79-E104 PolarHBondContact NH1-OE1 3.35Å; R79-E104 IonicContact NH2-OE1 3.14Å; E100-E104 PolarHBondContact O-N 3.33Å; D101-E104 WeakPolarHBondContact O-CB 3.49Å; D101-E104 PolarHBondContact O-N 3.16Å; E104-G107 PolarHBondContact O-N 3.17Å; E104-G107 VanDerWaalsContact O-N 3.17Å; E104-Q232 VanDerWaalsContact CA-NE2 3.3Å; E104-Q232 PolarHBondContact O-NE2 3.37Å; E104-Q232 VanDerWaalsContact O-NE2 3.1Å
105	D	78.9	Confident	82.3	Confident	69 Å²	69	34.6 Å²	34.6	37%	0.369	17%	0.165	S	C	.	.	H	α-helix	trans	-67.3	-32.2	176.7	-74.7	-10.1	0	0	0	112.9	R76 D101 I102 M103 G107 H325 W329	R76-D105 IonicContact CZ-OD1 3.23Å; R76-D105 IonicContact NH1-OD1 4Å; R76-D105 PolarHBondContact NH1-OD1 2.91Å; R76-D105 IonicContact NH2-OD1 3.18Å; R76-D105 PolarHBondContact NH2-OD1 3.37Å; D101-D105 PolarHBondContact O-N 3.33Å; I102-D105 CarbonylContact O-C 3.57Å; I102-D105 PolarHBondContact O-N 3.19Å; M103-D105 VanDerWaalsContact C-N 3.35Å; D105-G107 PolarHBondContact O-N 3.06Å; D105-H325 PolarHBondContact O-CD2 3.39Å; D105-W329 WeakPolarHBondContact O-CH2 3.37Å; D105-W329 WeakPolarHBondContact O-CZ2 3.39Å
106	C	80.5	Confident	83.5	Confident	0 Å²	0	34 Å²	34	0%	0	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-11.4	173.7	-70.4	0	0	0	0	113.9	I102 M103 V324 H325 N328 W329	I102-C106 WeakPolarHBondContact O-CB 3.41Å; I102-C106 PolarHBondContact O-N 3.39Å; I102-C106 PolarHBondContact O-SG 3.33Å; M103-C106 PolarHBondContact O-N 2.89Å; C106-V324 HydrophobicContact CB-CG1 4.41Å; C106-H325 HydrophobicContact CB-CB 4.42Å; C106-N328 PolarHBondContact O-ND2 3.32Å; C106-W329 VanDerWaalsContact C-CH2 3.44Å; C106-W329 WeakPolarHBondContact O-CZ3 3.39Å
107	G	80.6	Confident	84.7	Confident	4 Å²	4	37.8 Å²	37.8	4%	0.041	18%	0.181	C	C	.	.			trans	57.4	172.6	176	0	0	0	0	0	115.7	M103 E104 D105 Q112 N328 W329	M103-G107 PolarHBondContact O-N 2.97Å; E104-G107 PolarHBondContact O-N 3.17Å; E104-G107 VanDerWaalsContact O-N 3.17Å; D105-G107 PolarHBondContact O-N 3.06Å; G107-Q112 PolarHBondContact O-NE2 3.45Å; G107-N328 PolarHBondContact O-ND2 3.17Å; G107-W329 VanDerWaalsContact N-CZ3 3.28Å
108	H	84.6	Confident	85.8	Confident	25 Å²	25	35.6 Å²	35.6	12%	0.116	17%	0.171	C	C	.	.	S	Bend	trans	-98.9	133.9	166.8	-164.5	93.5	0	0	0	110.6	Q112 W113 H239 K332	H108-Q112 WeakPolarHBondContact CE1-CB 3.42Å; H108-W113 AromaticContact CD2-NE1 3.95Å; H108-W113 AromaticContact NE2-CD1 3.87Å; H108-W113 AromaticContact NE2-NE1 3.55Å; H108-H239 AromaticContact CE1-CD2 3.68Å; H108-H239 AromaticContact CE1-CE1 3.63Å; H108-H239 AromaticContact CE1-NE2 3.31Å; H108-H239 PolarHBondContact CE1-NE2 3.18Å; H108-H239 VanDerWaalsContact CE1-NE2 3.31Å; H108-H239 AromaticContact ND1-NE2 3.87Å; H108-H239 AromaticContact NE2-CE1 3.51Å; H108-H239 AromaticContact NE2-NE2 3.48Å; H108-H239 PolarHBondContact NE2-NE2 3.32Å; H108-K332 WeakPolarHBondContact O-CE 3.34Å; H108-K332 PolarHBondContact O-NZ 2.79Å
109	G	87.1	Confident	86.8	Confident	13 Å²	13	33.6 Å²	33.6	13%	0.134	16%	0.162	C	C	.	.	S	Bend	trans	-168.4	-150.4	-176.4	0	0	0	0	0	114.3	F111 Q112 W113 N328	G109-F111 VanDerWaalsContact C-N 3.27Å; G109-F111 PolarHBondContact O-N 2.83Å; G109-Q112 PolarHBondContact O-N 2.95Å; G109-Q112 PolarHBondContact O-OE1 3.28Å; G109-W113 PolarHBondContact O-N 2.92Å; G109-N328 VanDerWaalsContact CA-OD1 3.22Å; G109-N328 WeakPolarHBondContact CA-OD1 3.47Å
110	R	88.5	Confident	87.7	Confident	181 Å²	181	33.4 Å²	33.4	68%	0.683	16%	0.161	S	C	*	.	H	α-helix	trans	-60.7	-33.9	-172.3	-70.3	179	76.7	178	2.9	113.1	S114 T327 N328 A331	R110-S114 WeakPolarHBondContact O-CB 3.08Å; R110-S114 PolarHBondContact O-N 3.08Å; R110-T327 HydrophobicContact CB-CG2 4.32Å; R110-N328 PolarHBondContact N-OD1 2.87Å; R110-A331 HydrophobicContact CB-CB 4.36Å; R110-A331 HydrophobicContact CG-CB 3.57Å
111	F	91.1	Very high	88.5	Confident	16 Å²	16	35.3 Å²	35.3	7%	0.07	17%	0.171	C	C	.	.	H	α-helix	trans	-64.3	-49	-179.4	-178.3	-88.6	0	0	0	110.9	G109 W113 S114 L115 F230 P302 V324 T327 N328	G109-F111 VanDerWaalsContact C-N 3.27Å; G109-F111 PolarHBondContact O-N 2.83Å; F111-W113 PolarHBondContact O-N 3.41Å; F111-S114 PolarHBondContact O-N 3.39Å; F111-L115 HydrophobicContact CE1-CD2 4.3Å; F111-L115 WeakPolarHBondContact O-CB 3.35Å; F111-L115 PolarHBondContact O-N 2.87Å; F111-F230 HydrophobicContact CD1-CD1 4.43Å; F111-F230 AromaticContact CE1-CD1 3.61Å; F111-F230 HydrophobicContact CE1-CD1 3.61Å; F111-F230 AromaticContact CE1-CE1 3.7Å; F111-F230 HydrophobicContact CE1-CE1 3.7Å; F111-F230 HydrophobicContact CE1-CG 4.26Å; F111-F230 HydrophobicContact CE1-CZ 4.43Å; F111-F230 HydrophobicContact CZ-CD1 4.4Å; F111-F230 HydrophobicContact CZ-CE1 4.03Å; F111-P302 HydrophobicContact CE2-CG 4.02Å; F111-P302 HydrophobicContact CZ-CG 3.62Å; F111-V324 HydrophobicContact CB-CG1 4.42Å; F111-V324 HydrophobicContact CD1-CB 4.35Å; F111-V324 HydrophobicContact CD1-CG1 3.95Å; F111-V324 HydrophobicContact CD1-CG2 3.66Å; F111-V324 HydrophobicContact CD2-CG2 4.2Å; F111-V324 HydrophobicContact CE1-CG2 3.59Å; F111-V324 HydrophobicContact CE2-CG2 4.13Å; F111-V324 HydrophobicContact CG-CB 4.46Å; F111-V324 HydrophobicContact CG-CG1 4.26Å; F111-V324 HydrophobicContact CG-CG2 3.98Å; F111-V324 HydrophobicContact CZ-CG2 3.83Å; F111-T327 HydrophobicContact CB-CG2 4.02Å; F111-N328 PolarHBondContact N-OD1 2.79Å
112	Q	92.1	Very high	89.4	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-63.8	-39.2	179.4	-68.7	87.3	-8.4	0	0	112.2	G107 H108 G109 L115 F116 N328	G107-Q112 PolarHBondContact O-NE2 3.45Å; H108-Q112 WeakPolarHBondContact CE1-CB 3.42Å; G109-Q112 PolarHBondContact O-N 2.95Å; G109-Q112 PolarHBondContact O-OE1 3.28Å; Q112-L115 PolarHBondContact O-N 3.23Å; Q112-F116 VanDerWaalsContact O-CB 3.22Å; Q112-F116 WeakPolarHBondContact O-CB 3.38Å; Q112-F116 PolarHBondContact O-N 3.48Å; Q112-N328 PolarHBondContact NE2-ND2 3.49Å; Q112-N328 VanDerWaalsContact NE2-ND2 3.2Å; Q112-N328 PolarHBondContact OE1-ND2 3.18Å; Q112-N328 PolarHBondContact OE1-OD1 3.32Å; Q112-N328 VanDerWaalsContact OE1-OD1 3.13Å
113	W	92.7	Very high	90.1	Very high	125 Å²	125	32 Å²	32	47%	0.473	15%	0.154	S	C	.	.	H	α-helix	trans	-65.7	-39.1	174.4	-79.7	105.9	0	0	0	112.8	H108 G109 F111 L115 F116 I117	H108-W113 AromaticContact CD2-NE1 3.95Å; H108-W113 AromaticContact NE2-CD1 3.87Å; H108-W113 AromaticContact NE2-NE1 3.55Å; G109-W113 PolarHBondContact O-N 2.92Å; F111-W113 PolarHBondContact O-N 3.41Å; W113-L115 VanDerWaalsContact C-N 3.35Å; W113-F116 AromaticContact CE3-CD1 3.76Å; W113-F116 HydrophobicContact CE3-CD1 3.76Å; W113-F116 HydrophobicContact CE3-CE1 4.24Å; W113-F116 HydrophobicContact CE3-CG 4.39Å; W113-F116 AromaticContact CZ3-CD1 3.79Å; W113-F116 HydrophobicContact CZ3-CD1 3.79Å; W113-F116 AromaticContact CZ3-CE1 3.79Å; W113-F116 HydrophobicContact CZ3-CE1 3.79Å; W113-F116 WeakPolarHBondContact O-CB 2.98Å; W113-F116 PolarHBondContact O-N 2.97Å; W113-I117 WeakPolarHBondContact O-CG1 3.24Å; W113-I117 PolarHBondContact O-N 3.02Å; W113-I117 VanDerWaalsContact O-N 3.08Å
114	S	93.8	Very high	90.7	Very high	63 Å²	63	32.9 Å²	32.9	44%	0.441	16%	0.158	S	C	.	.	H	α-helix	trans	-64.9	-41.6	175	-166.7	0	0	0	0	111.5	R110 F111 I117 V118 M301	R110-S114 WeakPolarHBondContact O-CB 3.08Å; R110-S114 PolarHBondContact O-N 3.08Å; F111-S114 PolarHBondContact O-N 3.39Å; S114-I117 PolarHBondContact O-N 2.83Å; S114-V118 WeakPolarHBondContact O-CG2 3.48Å; S114-V118 PolarHBondContact O-N 3.29Å; S114-M301 WeakPolarHBondContact O-CE 3.29Å; S114-M301 WeakPolarHBondContact OG-CE 3.42Å
115	L	94.1	Very high	91.4	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.3	-43.1	175.7	-175.8	62.9	0	0	0	111.2	F111 Q112 W113 I117 V118 L119 Y226 F227 F230 M301	F111-L115 HydrophobicContact CE1-CD2 4.3Å; F111-L115 WeakPolarHBondContact O-CB 3.35Å; F111-L115 PolarHBondContact O-N 2.87Å; Q112-L115 PolarHBondContact O-N 3.23Å; W113-L115 VanDerWaalsContact C-N 3.35Å; L115-I117 VanDerWaalsContact C-N 3.35Å; L115-I117 PolarHBondContact O-N 3.35Å; L115-V118 PolarHBondContact O-N 3.4Å; L115-L119 HydrophobicContact CD1-CD1 3.83Å; L115-L119 HydrophobicContact CD1-CG 3.97Å; L115-L119 HydrophobicContact CD2-CD1 4.36Å; L115-L119 HydrophobicContact CG-CD1 3.75Å; L115-L119 HydrophobicContact CG-CG 4.23Å; L115-L119 WeakPolarHBondContact O-CB 3.26Å; L115-L119 VanDerWaalsContact O-CG 3.29Å; L115-L119 WeakPolarHBondContact O-CG 3.43Å; L115-L119 PolarHBondContact O-N 3.24Å; L115-Y226 HydrophobicContact CD1-CD1 4.32Å; L115-Y226 HydrophobicContact CD1-CE1 3.55Å; L115-F227 HydrophobicContact CD2-CD2 3.98Å; L115-F227 HydrophobicContact CG-CD2 4.11Å; L115-F230 HydrophobicContact CD2-CB 3.82Å; L115-F230 HydrophobicContact CD2-CD2 3.47Å; L115-F230 VanDerWaalsContact CD2-CD2 3.47Å; L115-F230 HydrophobicContact CD2-CE2 4.12Å; L115-F230 HydrophobicContact CD2-CG 3.7Å; L115-M301 HydrophobicContact CD1-CB 4.45Å; L115-M301 HydrophobicContact CD1-CG 4.06Å; L115-M301 HydrophobicContact CD1-SD 4.01Å
116	F	95.2	Very high	92.2	Very high	11 Å²	11	28.6 Å²	28.6	5%	0.048	14%	0.136	C	C	.	.	H	α-helix	trans	-55.9	-45.3	176.3	175.5	-102.9	0	0	0	112.2	Q112 W113 G120 F227 W242 L243 F246	Q112-F116 VanDerWaalsContact O-CB 3.22Å; Q112-F116 WeakPolarHBondContact O-CB 3.38Å; Q112-F116 PolarHBondContact O-N 3.48Å; W113-F116 AromaticContact CE3-CD1 3.76Å; W113-F116 HydrophobicContact CE3-CD1 3.76Å; W113-F116 HydrophobicContact CE3-CE1 4.24Å; W113-F116 HydrophobicContact CE3-CG 4.39Å; W113-F116 AromaticContact CZ3-CD1 3.79Å; W113-F116 HydrophobicContact CZ3-CD1 3.79Å; W113-F116 AromaticContact CZ3-CE1 3.79Å; W113-F116 HydrophobicContact CZ3-CE1 3.79Å; W113-F116 WeakPolarHBondContact O-CB 2.98Å; W113-F116 PolarHBondContact O-N 2.97Å; F116-G120 WeakPolarHBondContact O-CA 3.3Å; F116-G120 PolarHBondContact O-N 2.73Å; F116-F227 HydrophobicContact CB-CE2 3.93Å; F116-F227 HydrophobicContact CB-CZ 3.78Å; F116-F227 AromaticContact CD2-CE1 3.75Å; F116-F227 HydrophobicContact CD2-CE1 3.75Å; F116-F227 HydrophobicContact CD2-CE2 4.47Å; F116-F227 AromaticContact CD2-CZ 3.61Å; F116-F227 HydrophobicContact CD2-CZ 3.61Å; F116-F227 HydrophobicContact CE2-CE1 4.49Å; F116-F227 HydrophobicContact CG-CZ 4.16Å; F116-W242 HydrophobicContact CE2-CB 3.94Å; F116-W242 HydrophobicContact CZ-CB 3.85Å; F116-L243 HydrophobicContact CD2-CB 4.37Å; F116-L243 HydrophobicContact CD2-CD1 3.78Å; F116-L243 HydrophobicContact CE2-CB 3.92Å; F116-L243 HydrophobicContact CE2-CD1 3.94Å; F116-F246 HydrophobicContact CD1-CE2 4.18Å; F116-F246 AromaticContact CE1-CE2 3.5Å; F116-F246 HydrophobicContact CE1-CE2 3.5Å; F116-F246 HydrophobicContact CE1-CZ 4.07Å; F116-F246 HydrophobicContact CE2-CE2 4.32Å; F116-F246 HydrophobicContact CZ-CD2 4.33Å; F116-F246 AromaticContact CZ-CE2 3.59Å; F116-F246 HydrophobicContact CZ-CE2 3.59Å
117	I	95.9	Very high	92.7	Very high	82 Å²	82	28.6 Å²	28.6	42%	0.421	14%	0.136	S	C	.	.	H	α-helix	trans	-66.8	-45.1	177.2	-63.4	-58.4	0	0	0	111.7	W113 S114 L115 L119 G120 L121 F246	W113-I117 WeakPolarHBondContact O-CG1 3.24Å; W113-I117 PolarHBondContact O-N 3.02Å; W113-I117 VanDerWaalsContact O-N 3.08Å; S114-I117 PolarHBondContact O-N 2.83Å; L115-I117 VanDerWaalsContact C-N 3.35Å; L115-I117 PolarHBondContact O-N 3.35Å; I117-L119 PolarHBondContact O-N 3.46Å; I117-G120 PolarHBondContact O-N 2.96Å; I117-L121 HydrophobicContact CG2-CD1 4.38Å; I117-L121 WeakPolarHBondContact O-CG 3.3Å; I117-L121 PolarHBondContact O-N 2.84Å; I117-F246 HydrophobicContact CD1-CZ 3.88Å
118	V	96.3	Very high	93.3	Very high	14 Å²	14	28.4 Å²	28.4	9%	0.085	13%	0.134	C	C	.	.	H	α-helix	trans	-63.1	-42.6	-178.8	170.4	0	0	0	0	111.7	S114 L115 L121 A122 S294 L298 M301	S114-V118 WeakPolarHBondContact O-CG2 3.48Å; S114-V118 PolarHBondContact O-N 3.29Å; L115-V118 PolarHBondContact O-N 3.4Å; V118-L121 PolarHBondContact O-N 2.89Å; V118-A122 PolarHBondContact O-N 3.1Å; V118-S294 PolarHBondContact O-OG 2.93Å; V118-L298 HydrophobicContact CG1-CD2 3.79Å; V118-L298 HydrophobicContact CG1-CG 3.75Å; V118-M301 HydrophobicContact CB-CE 4.2Å; V118-M301 HydrophobicContact CG1-CG 4.35Å; V118-M301 HydrophobicContact CG2-CE 3.6Å
119	L	96.3	Very high	93.7	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-74.8	-33.6	177.1	-63.9	-177.7	0	0	0	112.6	L115 I117 L121 A122 L123 L182 V223 Y226 F227 L243 L298	L115-L119 HydrophobicContact CD1-CD1 3.83Å; L115-L119 HydrophobicContact CD1-CG 3.97Å; L115-L119 HydrophobicContact CD2-CD1 4.36Å; L115-L119 HydrophobicContact CG-CD1 3.75Å; L115-L119 HydrophobicContact CG-CG 4.23Å; L115-L119 WeakPolarHBondContact O-CB 3.26Å; L115-L119 VanDerWaalsContact O-CG 3.29Å; L115-L119 WeakPolarHBondContact O-CG 3.43Å; L115-L119 PolarHBondContact O-N 3.24Å; I117-L119 PolarHBondContact O-N 3.46Å; L119-L121 VanDerWaalsContact C-N 3.32Å; L119-L121 PolarHBondContact O-N 3.41Å; L119-A122 WeakPolarHBondContact O-CB 3.48Å; L119-A122 PolarHBondContact O-N 2.68Å; L119-A122 VanDerWaalsContact O-N 3.13Å; L119-L123 PolarHBondContact O-N 3Å; L119-L123 VanDerWaalsContact O-N 3.09Å; L119-L182 HydrophobicContact CD2-CD2 3.7Å; L119-V223 HydrophobicContact CB-CG1 3.85Å; L119-V223 HydrophobicContact CD2-CG2 4.21Å; L119-Y226 HydrophobicContact CD1-CD1 3.58Å; L119-Y226 HydrophobicContact CD1-CE1 4.11Å; L119-Y226 HydrophobicContact CD1-CG 4.49Å; L119-Y226 HydrophobicContact CD2-CD1 3.54Å; L119-Y226 HydrophobicContact CD2-CE1 3.84Å; L119-Y226 HydrophobicContact CG-CD1 4.13Å; L119-Y226 HydrophobicContact CG-CE1 4.4Å; L119-F227 HydrophobicContact CD1-CB 3.66Å; L119-F227 HydrophobicContact CD1-CD2 4.05Å; L119-F227 HydrophobicContact CD1-CG 4.16Å; L119-L243 HydrophobicContact CB-CD1 4.33Å; L119-L298 HydrophobicContact CD2-CD2 3.94Å
120	G	96	Very high	93.7	Very high	0 Å²	0	28 Å²	28	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-57.8	-44.9	169.7	0	0	0	0	0	111.3	F116 I117 A122 L123 M124 F246	F116-G120 WeakPolarHBondContact O-CA 3.3Å; F116-G120 PolarHBondContact O-N 2.73Å; I117-G120 PolarHBondContact O-N 2.96Å; G120-A122 VanDerWaalsContact C-N 3.27Å; G120-A122 PolarHBondContact O-N 3.48Å; G120-L123 PolarHBondContact O-N 3.07Å; G120-L123 VanDerWaalsContact O-N 3.15Å; G120-M124 WeakPolarHBondContact O-CB 3.24Å; G120-M124 PolarHBondContact O-N 3.46Å; G120-F246 VanDerWaalsContact C-CD1 3.42Å; G120-F246 WeakPolarHBondContact O-CB 3.43Å; G120-F246 WeakPolarHBondContact O-CD1 3.5Å; G120-F246 WeakPolarHBondContact O-CG 3.37Å
121	L	95.9	Very high	93.7	Very high	43 Å²	43	22.3 Å²	22.3	23%	0.225	11%	0.111	C	C	.	.	H	α-helix	trans	-62.1	-32	174.9	-68.8	171.3	0	0	0	113.1	I117 V118 L119 M124 A125	I117-L121 HydrophobicContact CG2-CD1 4.38Å; I117-L121 WeakPolarHBondContact O-CG 3.3Å; I117-L121 PolarHBondContact O-N 2.84Å; V118-L121 PolarHBondContact O-N 2.89Å; L119-L121 VanDerWaalsContact C-N 3.32Å; L119-L121 PolarHBondContact O-N 3.41Å; L121-M124 HydrophobicContact CD2-SD 4.01Å; L121-M124 PolarHBondContact O-N 3.22Å; L121-A125 PolarHBondContact O-N 3.17Å
122	A	96.1	Very high	93.6	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-66.9	-42.2	173.8	0	0	0	0	0	111.7	V118 L119 G120 A125 D126 L186 V223 S294	V118-A122 PolarHBondContact O-N 3.1Å; L119-A122 WeakPolarHBondContact O-CB 3.48Å; L119-A122 PolarHBondContact O-N 2.68Å; L119-A122 VanDerWaalsContact O-N 3.13Å; G120-A122 VanDerWaalsContact C-N 3.27Å; G120-A122 PolarHBondContact O-N 3.48Å; A122-A125 WeakPolarHBondContact O-CB 3.47Å; A122-A125 PolarHBondContact O-N 2.52Å; A122-D126 PolarHBondContact O-N 3.38Å; A122-D126 VanDerWaalsContact O-N 3.09Å; A122-L186 HydrophobicContact CB-CD1 4.14Å; A122-V223 HydrophobicContact CB-CG2 3.88Å; A122-S294 WeakPolarHBondContact CB-OG 3.49Å; A122-S294 PolarHBondContact N-OG 3.17Å
123	L	95	Very high	93.2	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.01	11%	0.112	C	C	.	.	H	α-helix	trans	-71.6	-32.3	175.6	-70.7	170.3	0	0	0	112.6	L119 G120 A125 D126 G127 V220 V223 Y224 L243 F246	L119-L123 PolarHBondContact O-N 3Å; L119-L123 VanDerWaalsContact O-N 3.09Å; G120-L123 PolarHBondContact O-N 3.07Å; G120-L123 VanDerWaalsContact O-N 3.15Å; L123-A125 VanDerWaalsContact C-N 3.29Å; L123-D126 WeakPolarHBondContact O-CB 3.36Å; L123-D126 PolarHBondContact O-N 3Å; L123-G127 PolarHBondContact O-N 2.93Å; L123-V220 HydrophobicContact CD2-CB 4.38Å; L123-V220 HydrophobicContact CD2-CG2 3.91Å; L123-V223 HydrophobicContact CD1-CG1 3.68Å; L123-V223 HydrophobicContact CD2-CB 4.33Å; L123-V223 HydrophobicContact CD2-CG1 4.2Å; L123-V223 HydrophobicContact CG-CB 4.34Å; L123-V223 HydrophobicContact CG-CG1 3.78Å; L123-Y224 HydrophobicContact CD1-CE2 4.11Å; L123-Y224 HydrophobicContact CD2-CE2 4.06Å; L123-L243 HydrophobicContact CD1-CD1 4.1Å; L123-L243 HydrophobicContact CD1-CD2 3.81Å; L123-L243 HydrophobicContact CD1-CG 3.47Å; L123-L243 VanDerWaalsContact CD1-CG 3.47Å; L123-F246 HydrophobicContact CB-CB 4.28Å
124	M	95.1	Very high	92.7	Very high	19 Å²	19	18.6 Å²	18.6	9%	0.094	11%	0.114	C	C	.	.	H	α-helix	trans	-60	-43.4	170.2	-176.1	-172.6	171	0	0	110.2	G120 L121 G127 V128 F246 V249 Y253 P290	G120-M124 WeakPolarHBondContact O-CB 3.24Å; G120-M124 PolarHBondContact O-N 3.46Å; L121-M124 HydrophobicContact CD2-SD 4.01Å; L121-M124 PolarHBondContact O-N 3.22Å; M124-G127 PolarHBondContact O-N 3.46Å; M124-V128 VanDerWaalsContact O-CG2 3.25Å; M124-V128 WeakPolarHBondContact O-CG2 3.24Å; M124-V128 PolarHBondContact O-N 3.46Å; M124-F246 VanDerWaalsContact CA-O 3.31Å; M124-F246 WeakPolarHBondContact CA-O 3.36Å; M124-F246 HydrophobicContact CB-CB 4.49Å; M124-V249 HydrophobicContact CE-CG1 4.45Å; M124-V249 HydrophobicContact SD-CG1 4.37Å; M124-Y253 HydrophobicContact CE-CD1 3.78Å; M124-Y253 HydrophobicContact CE-CD2 3.66Å; M124-Y253 HydrophobicContact CE-CE1 4.47Å; M124-Y253 HydrophobicContact CE-CE2 4.38Å; M124-Y253 HydrophobicContact CE-CG 3.31Å; M124-P290 HydrophobicContact CE-CB 4.35Å; M124-P290 HydrophobicContact CE-CG 3.8Å; M124-P290 HydrophobicContact CG-CB 4.21Å; M124-P290 HydrophobicContact CG-CG 4.47Å; M124-P290 HydrophobicContact SD-CB 4.03Å; M124-P290 HydrophobicContact SD-CG 4.15Å
125	A	94.8	Very high	92.2	Very high	1 Å²	1	15.9 Å²	15.9	1%	0.008	9%	0.094	C	C	.	.	H	α-helix	trans	-61.7	-41.1	173.8	0	0	0	0	0	112.7	L121 A122 L123 V128 E129 I216 P290 A291	L121-A125 PolarHBondContact O-N 3.17Å; A122-A125 WeakPolarHBondContact O-CB 3.47Å; A122-A125 PolarHBondContact O-N 2.52Å; L123-A125 VanDerWaalsContact C-N 3.29Å; A125-V128 PolarHBondContact O-N 2.82Å; A125-E129 WeakPolarHBondContact O-CG 3.4Å; A125-E129 PolarHBondContact O-N 3.35Å; A125-I216 HydrophobicContact CB-CD1 4.33Å; A125-P290 HydrophobicContact CB-CB 4.29Å; A125-A291 HydrophobicContact CB-CB 3.74Å
126	D	94.1	Very high	91.8	Very high	2 Å²	2	15.9 Å²	15.9	1%	0.011	9%	0.094	C	C	.	.	H	α-helix	trans	-60.5	-44.8	174.2	-176.1	82.9	0	0	0	112.6	A122 L123 E129 C130 I216 S219 V220 W247	A122-D126 PolarHBondContact O-N 3.38Å; A122-D126 VanDerWaalsContact O-N 3.09Å; L123-D126 WeakPolarHBondContact O-CB 3.36Å; L123-D126 PolarHBondContact O-N 3Å; D126-E129 PolarHBondContact O-N 3Å; D126-C130 PolarHBondContact O-N 3.28Å; D126-C130 PolarHBondContact O-SG 3.07Å; D126-C130 VanDerWaalsContact O-SG 3.32Å; D126-I216 HydrophobicContact CB-CD1 4.26Å; D126-I216 HydrophobicContact CB-CG1 3.96Å; D126-S219 WeakPolarHBondContact CB-OG 3.08Å; D126-S219 PolarHBondContact OD1-OG 3.03Å; D126-V220 HydrophobicContact CB-CG2 4.5Å; D126-W247 VanDerWaalsContact OD2-CD1 3.28Å; D126-W247 PolarHBondContact OD2-NE1 3.33Å
127	G	92	Very high	91.1	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-59.7	-48.3	174.4	0	0	0	0	0	111.6	L123 M124 E129 C130 F131	L123-G127 PolarHBondContact O-N 2.93Å; M124-G127 PolarHBondContact O-N 3.46Å; G127-E129 PolarHBondContact O-N 3.49Å; G127-C130 WeakPolarHBondContact O-CB 3.44Å; G127-C130 PolarHBondContact O-N 3.33Å; G127-C130 VanDerWaalsContact O-N 3.15Å; G127-F131 WeakPolarHBondContact O-CD2 3.29Å; G127-F131 PolarHBondContact O-N 3.09Å; G127-F131 VanDerWaalsContact O-N 3.16Å
128	V	93.4	Very high	90.3	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-56	-49.4	177.7	171.4	0	0	0	0	111.2	M124 A125 C130 F131 V132 G250 Y253 A254 C287	M124-V128 VanDerWaalsContact O-CG2 3.25Å; M124-V128 WeakPolarHBondContact O-CG2 3.24Å; M124-V128 PolarHBondContact O-N 3.46Å; A125-V128 PolarHBondContact O-N 2.82Å; V128-C130 VanDerWaalsContact C-N 3.26Å; V128-C130 PolarHBondContact O-N 2.93Å; V128-F131 PolarHBondContact O-N 3.47Å; V128-F131 VanDerWaalsContact O-N 3.08Å; V128-V132 HydrophobicContact CG1-CG2 3.61Å; V128-V132 WeakPolarHBondContact O-CB 3.38Å; V128-V132 WeakPolarHBondContact O-CG2 3.13Å; V128-V132 PolarHBondContact O-N 2.82Å; V128-G250 VanDerWaalsContact CG2-O 3.29Å; V128-G250 WeakPolarHBondContact CG2-O 3.39Å; V128-Y253 HydrophobicContact CG2-CD1 3.69Å; V128-Y253 HydrophobicContact CG2-CE1 4.4Å; V128-A254 HydrophobicContact CG1-CB 4.43Å; V128-A254 HydrophobicContact CG2-CB 4.42Å; V128-C287 HydrophobicContact CG1-CB 3.46Å; V128-C287 VanDerWaalsContact CG1-CB 3.46Å
129	E	91.8	Very high	89.5	Confident	7 Å²	7	15.1 Å²	15.1	3%	0.033	9%	0.094	C	C	.	.	H	α-helix	trans	-59.2	-35.4	179.3	-71.4	-65.8	163.1	0	0	113	A125 D126 G127 M162 N189 I216	A125-E129 WeakPolarHBondContact O-CG 3.4Å; A125-E129 PolarHBondContact O-N 3.35Å; D126-E129 PolarHBondContact O-N 3Å; G127-E129 PolarHBondContact O-N 3.49Å; E129-M162 HydrophobicContact CB-CE 4.07Å; E129-N189 PolarHBondContact OE1-ND2 2.83Å; E129-N189 PolarHBondContact OE1-OD1 2.85Å; E129-I216 HydrophobicContact CB-CG1 4.4Å; E129-I216 HydrophobicContact CB-CG2 4.2Å; E129-I216 HydrophobicContact CG-CB 4.4Å; E129-I216 HydrophobicContact CG-CG1 4.11Å; E129-I216 HydrophobicContact CG-CG2 4.31Å
130	C	88.1	Confident	88.7	Confident	23 Å²	23	15.1 Å²	15.1	16%	0.155	9%	0.094	C	C	.	.	H	α-helix	trans	-65.9	-39.4	175.3	-66.9	0	0	0	0	112.6	D126 G127 V128 M162 W247	D126-C130 PolarHBondContact O-N 3.28Å; D126-C130 PolarHBondContact O-SG 3.07Å; D126-C130 VanDerWaalsContact O-SG 3.32Å; G127-C130 WeakPolarHBondContact O-CB 3.44Å; G127-C130 PolarHBondContact O-N 3.33Å; G127-C130 VanDerWaalsContact O-N 3.15Å; V128-C130 VanDerWaalsContact C-N 3.26Å; V128-C130 PolarHBondContact O-N 2.93Å; C130-M162 WeakPolarHBondContact SG-CE 3.48Å; C130-W247 HydrophobicContact CB-CZ2 4.13Å
131	F	87.4	Confident	87.8	Confident	60 Å²	60	18.2 Å²	18.2	26%	0.263	11%	0.108	S	C	.	.	H	α-helix	trans	-89.6	-24.9	-175.2	-69.4	-70.3	0	0	0	114.1	G127 V128 V133 G134 F135 W247 A254	G127-F131 WeakPolarHBondContact O-CD2 3.29Å; G127-F131 PolarHBondContact O-N 3.09Å; G127-F131 VanDerWaalsContact O-N 3.16Å; V128-F131 PolarHBondContact O-N 3.47Å; V128-F131 VanDerWaalsContact O-N 3.08Å; F131-V133 VanDerWaalsContact C-N 3.3Å; F131-V133 PolarHBondContact O-N 3.33Å; F131-G134 PolarHBondContact O-N 3.48Å; F131-G134 VanDerWaalsContact O-N 3.13Å; F131-F135 HydrophobicContact CB-CD2 4.45Å; F131-F135 HydrophobicContact CB-CE2 3.96Å; F131-F135 WeakPolarHBondContact O-CD2 3.32Å; F131-F135 PolarHBondContact O-N 3.21Å; F131-W247 HydrophobicContact CE2-CE3 4.11Å; F131-W247 AromaticContact CE2-CH2 3.52Å; F131-W247 HydrophobicContact CE2-CH2 3.52Å; F131-W247 HydrophobicContact CE2-CZ2 4.14Å; F131-W247 AromaticContact CE2-CZ3 3.49Å; F131-W247 HydrophobicContact CE2-CZ3 3.49Å; F131-W247 VanDerWaalsContact CE2-CZ3 3.49Å; F131-W247 AromaticContact CZ-CH2 3.54Å; F131-W247 HydrophobicContact CZ-CH2 3.54Å; F131-W247 HydrophobicContact CZ-CZ2 4.5Å; F131-W247 AromaticContact CZ-CZ3 3.57Å; F131-W247 HydrophobicContact CZ-CZ3 3.57Å; F131-A254 HydrophobicContact CB-CB 4.16Å
132	V	88.8	Confident	86.8	Confident	2 Å²	2	18 Å²	18	1%	0.012	11%	0.106	C	C	.	.	H	α-helix	trans	-54.9	-42.5	-176.3	161.3	0	0	0	0	112.6	V128 G134 F135 V136 F283 V284 C287	V128-V132 HydrophobicContact CG1-CG2 3.61Å; V128-V132 WeakPolarHBondContact O-CB 3.38Å; V128-V132 WeakPolarHBondContact O-CG2 3.13Å; V128-V132 PolarHBondContact O-N 2.82Å; V132-G134 VanDerWaalsContact C-N 3.32Å; V132-G134 PolarHBondContact O-N 2.81Å; V132-F135 PolarHBondContact O-N 2.45Å; V132-V136 HydrophobicContact CG1-CG2 3.99Å; V132-V136 WeakPolarHBondContact O-CB 3.26Å; V132-V136 WeakPolarHBondContact O-CG2 3.47Å; V132-V136 PolarHBondContact O-N 3.2Å; V132-F283 HydrophobicContact CB-CE1 4.38Å; V132-F283 HydrophobicContact CG1-CE1 4.06Å; V132-F283 HydrophobicContact CG2-CE1 4.16Å; V132-F283 HydrophobicContact CG2-CZ 4.09Å; V132-V284 HydrophobicContact CG1-CG2 4.25Å; V132-C287 HydrophobicContact CG2-CB 3.62Å; V132-C287 WeakPolarHBondContact CG2-SG 3.37Å
133	V	85.3	Confident	85.9	Confident	11 Å²	11	19.4 Å²	19.4	7%	0.067	11%	0.113	C	C	.	.	H	α-helix	trans	-63.5	-40.3	-177.8	177.9	0	0	0	0	111.3	F131 F135 V136 L137 L154 V158	F131-V133 VanDerWaalsContact C-N 3.3Å; F131-V133 PolarHBondContact O-N 3.33Å; V133-F135 PolarHBondContact O-N 3.33Å; V133-V136 PolarHBondContact O-N 3.4Å; V133-L137 WeakPolarHBondContact O-CB 3.36Å; V133-L137 PolarHBondContact O-N 3.48Å; V133-L154 HydrophobicContact CG1-CD2 4.47Å; V133-L154 HydrophobicContact CG1-CG 3.96Å; V133-V158 HydrophobicContact CG2-CG2 3.78Å
134	G	81.4	Confident	85	Confident	50 Å²	50	21 Å²	21	52%	0.515	12%	0.121	S	C	.	.	H	α-helix	trans	-60	-34.3	177.9	0	0	0	0	0	112.9	F131 V132	F131-G134 PolarHBondContact O-N 3.48Å; F131-G134 VanDerWaalsContact O-N 3.13Å; V132-G134 VanDerWaalsContact C-N 3.32Å; V132-G134 PolarHBondContact O-N 2.81Å
135	F	83.4	Confident	84.2	Confident	6 Å²	6	23.6 Å²	23.6	3%	0.026	14%	0.14	C	C	.	.	H	α-helix	trans	-85.1	-29.9	178.1	-60.6	-48.9	0	0	0	114.1	F131 V132 V133 A254 S255 A258 I262 F283 Y544	F131-F135 HydrophobicContact CB-CD2 4.45Å; F131-F135 HydrophobicContact CB-CE2 3.96Å; F131-F135 WeakPolarHBondContact O-CD2 3.32Å; F131-F135 PolarHBondContact O-N 3.21Å; V132-F135 PolarHBondContact O-N 2.45Å; V133-F135 PolarHBondContact O-N 3.33Å; F135-A254 HydrophobicContact CD2-CB 4.2Å; F135-A254 HydrophobicContact CE2-CB 3.95Å; F135-S255 WeakPolarHBondContact CZ-OG 3.39Å; F135-A258 HydrophobicContact CB-CB 3.94Å; F135-A258 HydrophobicContact CD1-CB 4.41Å; F135-A258 HydrophobicContact CD2-CB 4.2Å; F135-A258 HydrophobicContact CG-CB 3.93Å; F135-I262 HydrophobicContact CB-CD1 4.46Å; F135-F283 HydrophobicContact CB-CE1 3.93Å; F135-F283 HydrophobicContact CB-CZ 4.04Å; F135-F283 HydrophobicContact CD2-CZ 4.11Å; F135-Y544 HydrophobicContact CB-CE1 4.13Å; F135-Y544 AromaticContact CD1-CD1 3.43Å; F135-Y544 HydrophobicContact CD1-CD1 3.43Å; F135-Y544 VanDerWaalsContact CD1-CD1 3.43Å; F135-Y544 AromaticContact CD1-CE1 3.75Å; F135-Y544 HydrophobicContact CD1-CE1 3.75Å; F135-Y544 AromaticContact CE1-CD1 3.96Å; F135-Y544 HydrophobicContact CE1-CD1 3.96Å; F135-Y544 HydrophobicContact CG-CD1 4.31Å; F135-Y544 HydrophobicContact CG-CE1 4.37Å; F135-Y544 PolarHBondContact O-OH 3.21Å
136	V	84.8	Confident	83.4	Confident	1 Å²	1	24.1 Å²	24.1	1%	0.006	14%	0.142	C	C	.	.	H	α-helix	trans	-75.5	-30.3	177	168.5	0	0	0	0	111.5	V132 V133 S139 A140 F205 W280 F283 V284	V132-V136 HydrophobicContact CG1-CG2 3.99Å; V132-V136 WeakPolarHBondContact O-CB 3.26Å; V132-V136 WeakPolarHBondContact O-CG2 3.47Å; V132-V136 PolarHBondContact O-N 3.2Å; V133-V136 PolarHBondContact O-N 3.4Å; V136-S139 PolarHBondContact O-N 3.43Å; V136-A140 HydrophobicContact CG1-CB 3.84Å; V136-A140 VanDerWaalsContact O-CB 3.32Å; V136-A140 WeakPolarHBondContact O-CB 3.45Å; V136-A140 PolarHBondContact O-N 3.4Å; V136-F205 HydrophobicContact CG1-CZ 4.25Å; V136-W280 HydrophobicContact CB-CE3 4.45Å; V136-W280 HydrophobicContact CG1-CD2 4.13Å; V136-W280 HydrophobicContact CG1-CE3 3.37Å; V136-W280 HydrophobicContact CG1-CZ3 3.66Å; V136-W280 HydrophobicContact CG2-CE3 4.26Å; V136-F283 HydrophobicContact CG2-CD1 3.69Å; V136-F283 HydrophobicContact CG2-CE1 3.8Å; V136-V284 HydrophobicContact CG2-CG2 3.7Å
137	L	82	Confident	82.7	Confident	46 Å²	46	26.8 Å²	26.8	24%	0.241	16%	0.161	C	C	.	.	H	α-helix	trans	-53.9	-48.7	-169.5	-168.2	70.2	0	0	0	114.4	V133 S139 A140 E141 K151 L154	V133-L137 WeakPolarHBondContact O-CB 3.36Å; V133-L137 PolarHBondContact O-N 3.48Å; L137-S139 VanDerWaalsContact C-N 3.35Å; L137-S139 PolarHBondContact O-N 3.48Å; L137-A140 PolarHBondContact O-N 2.94Å; L137-E141 WeakPolarHBondContact O-CB 3.38Å; L137-E141 PolarHBondContact O-N 3.1Å; L137-K151 HydrophobicContact CD1-CB 3.94Å; L137-K151 HydrophobicContact CD1-CG 4.16Å; L137-K151 HydrophobicContact CD2-CB 4.36Å; L137-K151 HydrophobicContact CG-CB 4.49Å; L137-L154 HydrophobicContact CD1-CD2 3.88Å
138	P	78.1	Confident	82.1	Confident	24 Å²	24	33 Å²	33	16%	0.156	20%	0.195	C	C	.	.	H	α-helix	trans	-64.8	-38.5	-178.2	-20.3	33.7	0	0	0	112.7	K142	P138-K142 WeakPolarHBondContact O-CG 3.47Å; P138-K142 PolarHBondContact O-N 3.31Å
139	S	78.9	Confident	81.4	Confident	21 Å²	21	35.8 Å²	35.8	15%	0.147	22%	0.224	C	C	.	.	H	α-helix	trans	-73.4	-38.9	177.2	-60.3	0	0	0	0	112.3	V136 L137 E141 K142 D143 I262	V136-S139 PolarHBondContact O-N 3.43Å; L137-S139 VanDerWaalsContact C-N 3.35Å; L137-S139 PolarHBondContact O-N 3.48Å; S139-E141 VanDerWaalsContact C-N 3.34Å; S139-K142 PolarHBondContact O-N 3.5Å; S139-D143 WeakPolarHBondContact O-CB 3.43Å; S139-D143 PolarHBondContact O-N 3.46Å; S139-I262 VanDerWaalsContact OG-CG2 3.3Å; S139-I262 WeakPolarHBondContact OG-CG2 3.2Å
140	A	80.1	Confident	81.1	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-70.3	-31.5	178.2	0	0	0	0	0	112.3	V136 L137 D143 M144 L146	V136-A140 HydrophobicContact CG1-CB 3.84Å; V136-A140 VanDerWaalsContact O-CB 3.32Å; V136-A140 WeakPolarHBondContact O-CB 3.45Å; V136-A140 PolarHBondContact O-N 3.4Å; L137-A140 PolarHBondContact O-N 2.94Å; A140-D143 PolarHBondContact O-N 3Å; A140-M144 WeakPolarHBondContact O-CB 3.36Å; A140-M144 PolarHBondContact O-N 2.95Å; A140-L146 HydrophobicContact CB-CD1 4.35Å
141	E	77.9	Confident	80.8	Confident	65 Å²	65	39 Å²	39	30%	0.304	24%	0.236	S	C	.	.	H	α-helix	trans	-58.3	-52	170.8	167.9	176.3	-178.9	0	0	111.2	L137 S139 D143 C145 L146 K151	L137-E141 WeakPolarHBondContact O-CB 3.38Å; L137-E141 PolarHBondContact O-N 3.1Å; S139-E141 VanDerWaalsContact C-N 3.34Å; E141-D143 VanDerWaalsContact C-N 3.34Å; E141-D143 PolarHBondContact O-N 3.49Å; E141-C145 WeakPolarHBondContact O-CA 3.39Å; E141-C145 PolarHBondContact O-N 3.35Å; E141-L146 PolarHBondContact O-N 3.36Å; E141-K151 WeakPolarHBondContact OE1-CE 3.08Å; E141-K151 IonicContact OE1-NZ 3.29Å; E141-K151 PolarHBondContact OE1-NZ 3.38Å; E141-K151 WeakPolarHBondContact OE2-CE 3.36Å; E141-K151 IonicContact OE2-NZ 2.79Å; E141-K151 PolarHBondContact OE2-NZ 3.02Å
142	K	74.2	Confident	80.6	Confident	39 Å²	39	38 Å²	38	17%	0.17	24%	0.242	C	C	.	.	H	α-helix	trans	-62.9	-41.1	179.2	-67.6	171.6	-178.8	171.7	0	111.3	P138 S139 H532 D534 D540	P138-K142 WeakPolarHBondContact O-CG 3.47Å; P138-K142 PolarHBondContact O-N 3.31Å; S139-K142 PolarHBondContact O-N 3.5Å; K142-H532 PolarHBondContact O-CE1 3.16Å; K142-H532 PolarHBondContact O-ND1 3.36Å; K142-D534 WeakPolarHBondContact CE-O 3.49Å; K142-D540 IonicContact NZ-OD2 2.82Å; K142-D540 PolarHBondContact NZ-OD2 3.05Å
143	D	76.7	Confident	80.6	Confident	29 Å²	29	42 Å²	42	16%	0.155	26%	0.262	C	S	.	.	H	α-helix	trans	-71.8	-45.8	-177.1	-168.8	17.5	0	0	0	112.9	S139 A140 E141 H278 W280 R281 H532	S139-D143 WeakPolarHBondContact O-CB 3.43Å; S139-D143 PolarHBondContact O-N 3.46Å; A140-D143 PolarHBondContact O-N 3Å; E141-D143 VanDerWaalsContact C-N 3.34Å; E141-D143 PolarHBondContact O-N 3.49Å; D143-H278 IonicContact OD1-CD2 3.15Å; D143-H278 PolarHBondContact OD1-CD2 3.31Å; D143-H278 VanDerWaalsContact OD1-CD2 3.23Å; D143-H278 IonicContact OD1-NE2 3.88Å; D143-H278 PolarHBondContact OD1-NE2 3.02Å; D143-H278 IonicContact OD2-CD2 3.92Å; D143-H278 PolarHBondContact OD2-CD2 2.86Å; D143-H278 IonicContact OD2-CG 2.95Å; D143-H278 IonicContact OD2-NE2 3.49Å; D143-W280 WeakPolarHBondContact OD2-CZ2 3.24Å; D143-W280 PolarHBondContact OD2-NE1 3.43Å; D143-R281 IonicContact OD2-NH2 3.37Å; D143-H532 PolarHBondContact O-CE1 3.41Å
144	M	77.4	Confident	80.7	Confident	36 Å²	36	41.6 Å²	41.6	18%	0.177	26%	0.259	C	S	.	.	H	α-helix	trans	-103.8	2.9	-171.7	-61.9	-174.5	177	0	0	114.8	A140 L146 Y202 W280	A140-M144 WeakPolarHBondContact O-CB 3.36Å; A140-M144 PolarHBondContact O-N 2.95Å; M144-L146 HydrophobicContact CB-CD2 3.99Å; M144-L146 HydrophobicContact CB-CG 3.99Å; M144-Y202 HydrophobicContact SD-CD2 4.43Å; M144-W280 HydrophobicContact CE-CH2 3.93Å; M144-W280 HydrophobicContact CE-CZ2 3.95Å
145	C	77.1	Confident	80.9	Confident	73 Å²	73	40.5 Å²	40.5	49%	0.493	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	48.4	-178.2	-47.9	0	0	0	0	112.8	E141 C531	E141-C145 WeakPolarHBondContact O-CA 3.39Å; E141-C145 PolarHBondContact O-N 3.35Å; C145-C531 HydrophobicContact CB-CB 3.76Å; C145-C531 WeakPolarHBondContact SG-CB 3.31Å
146	L	77.9	Confident	81.2	Confident	11 Å²	11	42.6 Å²	42.6	6%	0.058	26%	0.259	C	S	.	.			trans	-75.5	132.6	-171.4	-62.5	172.7	0	0	0	112.9	A140 E141 M144 E150 K151 Y202	A140-L146 HydrophobicContact CB-CD1 4.35Å; E141-L146 PolarHBondContact O-N 3.36Å; M144-L146 HydrophobicContact CB-CD2 3.99Å; M144-L146 HydrophobicContact CB-CG 3.99Å; L146-E150 HydrophobicContact CB-CB 4.41Å; L146-E150 HydrophobicContact CD2-CB 4.23Å; L146-K151 HydrophobicContact CB-CG 4.13Å; L146-K151 VanDerWaalsContact O-CE 3.23Å; L146-K151 WeakPolarHBondContact O-CE 3.41Å; L146-Y202 HydrophobicContact CD1-CD2 4.47Å; L146-Y202 HydrophobicContact CD1-CE2 4.38Å; L146-Y202 HydrophobicContact CD2-CD1 4.25Å; L146-Y202 HydrophobicContact CD2-CD2 3.37Å; L146-Y202 HydrophobicContact CD2-CE1 4.45Å; L146-Y202 HydrophobicContact CD2-CE2 3.63Å; L146-Y202 HydrophobicContact CD2-CG 3.72Å
147	S	81	Confident	81.6	Confident	59 Å²	59	44 Å²	44	41%	0.413	27%	0.266	S	S	.	.			trans	-69.4	158.4	169	67.1	0	0	0	0	112.1	G149 E150 K151	S147-G149 PolarHBondContact O-N 3.31Å; S147-E150 WeakPolarHBondContact CB-OE2 3.21Å; S147-E150 PolarHBondContact N-OE2 3.29Å; S147-E150 WeakPolarHBondContact O-CB 3.27Å; S147-E150 PolarHBondContact O-N 3.19Å; S147-E150 VanDerWaalsContact OG-CD 3.26Å; S147-E150 VanDerWaalsContact OG-CG 3.26Å; S147-E150 WeakPolarHBondContact OG-CG 3.32Å; S147-E150 PolarHBondContact OG-N 2.91Å; S147-E150 PolarHBondContact OG-OE2 3.49Å; S147-K151 WeakPolarHBondContact O-CG 3.43Å; S147-K151 PolarHBondContact O-N 3.04Å
148	N	77.6	Confident	82	Confident	130 Å²	130	42 Å²	42	70%	0.695	26%	0.256	S	S	*	.	H	α-helix	trans	-57.6	-33.7	178.9	-69.8	-26.2	0	0	0	113.4	K151 G152	N148-K151 PolarHBondContact OD1-NZ 2.63Å; N148-G152 PolarHBondContact O-N 3.29Å
149	G	79.4	Confident	82.7	Confident	59 Å²	59	42.4 Å²	42.4	61%	0.608	26%	0.255	S	S	*	.	H	α-helix	trans	-68.8	-37.6	175.2	0	0	0	0	0	113	S147 G152 M153	S147-G149 PolarHBondContact O-N 3.31Å; G149-G152 PolarHBondContact O-N 3.36Å; G149-M153 PolarHBondContact O-N 3.16Å
150	E	85.3	Confident	83.5	Confident	67 Å²	67	44.8 Å²	44.8	31%	0.313	27%	0.266	S	S	.	.	H	α-helix	trans	-68.2	-41.4	176.5	-72.7	168.2	137.3	0	0	111.6	L146 S147 G152 M153 L154 Y202	L146-E150 HydrophobicContact CB-CB 4.41Å; L146-E150 HydrophobicContact CD2-CB 4.23Å; S147-E150 WeakPolarHBondContact CB-OE2 3.21Å; S147-E150 PolarHBondContact N-OE2 3.29Å; S147-E150 WeakPolarHBondContact O-CB 3.27Å; S147-E150 PolarHBondContact O-N 3.19Å; S147-E150 VanDerWaalsContact OG-CD 3.26Å; S147-E150 VanDerWaalsContact OG-CG 3.26Å; S147-E150 WeakPolarHBondContact OG-CG 3.32Å; S147-E150 PolarHBondContact OG-N 2.91Å; S147-E150 PolarHBondContact OG-OE2 3.49Å; E150-G152 VanDerWaalsContact C-N 3.3Å; E150-G152 PolarHBondContact O-N 3.15Å; E150-M153 PolarHBondContact O-N 2.81Å; E150-M153 VanDerWaalsContact O-N 3.14Å; E150-L154 PolarHBondContact O-N 3.22Å; E150-Y202 WeakPolarHBondContact CA-OH 3.3Å; E150-Y202 HydrophobicContact CB-CE1 3.86Å; E150-Y202 HydrophobicContact CB-CE2 4.46Å; E150-Y202 WeakPolarHBondContact CB-OH 3.43Å; E150-Y202 HydrophobicContact CG-CE1 3.67Å; E150-Y202 PolarHBondContact O-OH 3.12Å
151	K	82.1	Confident	84.3	Confident	31 Å²	31	44.8 Å²	44.8	14%	0.135	27%	0.266	C	S	.	.	H	α-helix	trans	-54	-48	173.1	-64.7	174.6	-156.1	178.1	0	111.9	L137 E141 L146 S147 N148 L154 G155	L137-K151 HydrophobicContact CD1-CB 3.94Å; L137-K151 HydrophobicContact CD1-CG 4.16Å; L137-K151 HydrophobicContact CD2-CB 4.36Å; L137-K151 HydrophobicContact CG-CB 4.49Å; E141-K151 WeakPolarHBondContact OE1-CE 3.08Å; E141-K151 IonicContact OE1-NZ 3.29Å; E141-K151 PolarHBondContact OE1-NZ 3.38Å; E141-K151 WeakPolarHBondContact OE2-CE 3.36Å; E141-K151 IonicContact OE2-NZ 2.79Å; E141-K151 PolarHBondContact OE2-NZ 3.02Å; L146-K151 HydrophobicContact CB-CG 4.13Å; L146-K151 VanDerWaalsContact O-CE 3.23Å; L146-K151 WeakPolarHBondContact O-CE 3.41Å; S147-K151 WeakPolarHBondContact O-CG 3.43Å; S147-K151 PolarHBondContact O-N 3.04Å; N148-K151 PolarHBondContact OD1-NZ 2.63Å; K151-L154 PolarHBondContact O-N 3.06Å; K151-G155 PolarHBondContact O-N 3.48Å
152	G	83.7	Confident	85.1	Confident	37 Å²	37	41.7 Å²	41.7	38%	0.381	25%	0.251	S	S	.	.	H	α-helix	trans	-60.9	-44.8	176.9	0	0	0	0	0	112.4	N148 G149 E150 L154 G155 L156	N148-G152 PolarHBondContact O-N 3.29Å; G149-G152 PolarHBondContact O-N 3.36Å; E150-G152 VanDerWaalsContact C-N 3.3Å; E150-G152 PolarHBondContact O-N 3.15Å; G152-L154 VanDerWaalsContact C-N 3.34Å; G152-L154 PolarHBondContact O-N 3.39Å; G152-G155 PolarHBondContact O-N 3.17Å; G152-L156 WeakPolarHBondContact O-CG 3.36Å; G152-L156 PolarHBondContact O-N 2.92Å; G152-L156 VanDerWaalsContact O-N 3.1Å
153	M	88.9	Confident	86.1	Confident	88 Å²	88	41.9 Å²	41.9	43%	0.433	25%	0.253	S	S	.	.	H	α-helix	trans	-62.2	-39.8	178.1	-173.8	172.2	58.2	0	0	112.4	G149 E150 G155 L156 I157 Y202 L206	G149-M153 PolarHBondContact O-N 3.16Å; E150-M153 PolarHBondContact O-N 2.81Å; E150-M153 VanDerWaalsContact O-N 3.14Å; M153-G155 VanDerWaalsContact C-N 3.33Å; M153-G155 PolarHBondContact O-N 3.48Å; M153-L156 PolarHBondContact O-N 3.03Å; M153-I157 WeakPolarHBondContact O-CB 3.33Å; M153-I157 PolarHBondContact O-N 3.36Å; M153-Y202 HydrophobicContact CE-CE1 3.85Å; M153-Y202 VanDerWaalsContact CE-OH 3.25Å; M153-Y202 WeakPolarHBondContact CE-OH 3.15Å; M153-L206 HydrophobicContact CE-CD1 3.52Å
154	L	87.5	Confident	87	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-62.7	-38.1	176.6	-179.9	62	0	0	0	112.3	V133 L137 E150 K151 G152 I157 Y202 F205 L206	V133-L154 HydrophobicContact CG1-CD2 4.47Å; V133-L154 HydrophobicContact CG1-CG 3.96Å; L137-L154 HydrophobicContact CD1-CD2 3.88Å; E150-L154 PolarHBondContact O-N 3.22Å; K151-L154 PolarHBondContact O-N 3.06Å; G152-L154 VanDerWaalsContact C-N 3.34Å; G152-L154 PolarHBondContact O-N 3.39Å; L154-I157 WeakPolarHBondContact O-CG2 3.31Å; L154-Y202 HydrophobicContact CB-CE2 4.39Å; L154-F205 HydrophobicContact CD1-CD1 3.82Å; L154-F205 HydrophobicContact CD1-CE1 3.51Å; L154-F205 HydrophobicContact CD2-CD1 4.45Å; L154-F205 HydrophobicContact CD2-CE1 3.83Å; L154-F205 HydrophobicContact CG-CE1 4.31Å; L154-L206 HydrophobicContact CB-CD2 4.13Å; L154-L206 HydrophobicContact CD1-CD2 3.7Å
155	G	84.4	Confident	87.9	Confident	27 Å²	27	41.7 Å²	41.7	28%	0.278	26%	0.255	S	S	.	.	H	α-helix	trans	-64.9	-40.1	172.9	0	0	0	0	0	113.2	K151 G152 M153 F159	K151-G155 PolarHBondContact O-N 3.48Å; G152-G155 PolarHBondContact O-N 3.17Å; M153-G155 VanDerWaalsContact C-N 3.33Å; M153-G155 PolarHBondContact O-N 3.48Å; G155-F159 WeakPolarHBondContact O-CD2 3.34Å
156	L	90.1	Very high	88.7	Confident	51 Å²	51	38.2 Å²	38.2	27%	0.267	23%	0.231	S	C	.	.	H	α-helix	trans	-83.1	-28.6	-174.2	-64.1	175.8	0	0	0	114	G152 M153 V158 F159 L160 I644 T647	G152-L156 WeakPolarHBondContact O-CG 3.36Å; G152-L156 PolarHBondContact O-N 2.92Å; G152-L156 VanDerWaalsContact O-N 3.1Å; M153-L156 PolarHBondContact O-N 3.03Å; L156-V158 VanDerWaalsContact C-N 3.27Å; L156-V158 PolarHBondContact O-N 3.15Å; L156-F159 PolarHBondContact O-N 2.98Å; L156-L160 PolarHBondContact O-N 3.28Å; L156-I644 HydrophobicContact CD2-CG1 4.47Å; L156-I644 HydrophobicContact CD2-CG2 4.26Å; L156-T647 VanDerWaalsContact CD2-OG1 3.28Å; L156-T647 WeakPolarHBondContact CD2-OG1 3.42Å
157	I	92.9	Very high	89.5	Confident	29 Å²	29	41.3 Å²	41.3	15%	0.149	25%	0.245	C	C	.	.	H	α-helix	trans	-63.3	-33.4	-173.6	-161.3	68.6	0	0	0	112.5	M153 L154 L160 G161 L206 L210	M153-I157 WeakPolarHBondContact O-CB 3.33Å; M153-I157 PolarHBondContact O-N 3.36Å; L154-I157 WeakPolarHBondContact O-CG2 3.31Å; I157-L160 HydrophobicContact CD1-CD2 4.09Å; I157-L160 WeakPolarHBondContact O-CB 3.36Å; I157-L160 PolarHBondContact O-N 3.11Å; I157-G161 PolarHBondContact O-N 3.49Å; I157-L206 HydrophobicContact CB-CD2 4.38Å; I157-L206 HydrophobicContact CG2-CD2 3.87Å; I157-L210 HydrophobicContact CD1-CB 4.5Å; I157-L210 HydrophobicContact CD1-CD1 3.98Å; I157-L210 HydrophobicContact CD1-CD2 4.46Å; I157-L210 HydrophobicContact CG1-CB 3.91Å; I157-L210 HydrophobicContact CG1-CD1 3.97Å; I157-L210 HydrophobicContact CG1-CG 4.41Å
158	V	91.7	Very high	90.1	Very high	6 Å²	6	41.7 Å²	41.7	4%	0.036	24%	0.241	C	C	.	.	H	α-helix	trans	-69.5	-43.5	178	176.4	0	0	0	0	110.4	V133 L156 L160 G161 M162 R209	V133-V158 HydrophobicContact CG2-CG2 3.78Å; L156-V158 VanDerWaalsContact C-N 3.27Å; L156-V158 PolarHBondContact O-N 3.15Å; V158-L160 VanDerWaalsContact C-N 3.29Å; V158-L160 PolarHBondContact O-N 3.32Å; V158-G161 PolarHBondContact O-N 3.1Å; V158-G161 VanDerWaalsContact O-N 3.17Å; V158-M162 HydrophobicContact CG1-CE 3.61Å; V158-M162 HydrophobicContact CG1-CG 4.47Å; V158-M162 HydrophobicContact CG1-SD 4.22Å; V158-M162 WeakPolarHBondContact O-CG 3.43Å; V158-M162 PolarHBondContact O-N 3.4Å; V158-R209 HydrophobicContact CG2-CB 4.11Å
159	F	92.9	Very high	90.9	Very high	32 Å²	32	36.5 Å²	36.5	14%	0.14	21%	0.212	C	C	.	.	H	α-helix	trans	-62.2	-37.6	173.9	-70.7	-66.5	0	0	0	112.1	G155 L156 M162 M163 Y410 K640 A643 I644	G155-F159 WeakPolarHBondContact O-CD2 3.34Å; L156-F159 PolarHBondContact O-N 2.98Å; F159-M162 HydrophobicContact CD1-SD 4.4Å; F159-M162 PolarHBondContact O-N 3.31Å; F159-M163 WeakPolarHBondContact O-CB 3.33Å; F159-M163 PolarHBondContact O-N 3.33Å; F159-Y410 HydrophobicContact CE1-CD1 4.46Å; F159-Y410 HydrophobicContact CE1-CE1 4.2Å; F159-Y410 HydrophobicContact CZ-CD1 4.41Å; F159-Y410 HydrophobicContact CZ-CE1 4.44Å; F159-K640 HydrophobicContact CD1-CD 4.09Å; F159-A643 HydrophobicContact CD1-CB 4.49Å; F159-I644 HydrophobicContact CB-CD1 4.05Å; F159-I644 HydrophobicContact CB-CG1 3.71Å
160	L	95.3	Very high	91.5	Very high	70 Å²	70	33.7 Å²	33.7	37%	0.366	18%	0.183	S	C	.	.	H	α-helix	trans	-63	-44.3	173.6	-176	71.4	0	0	0	111.2	L156 I157 V158 M163 V164 L210 I644	L156-L160 PolarHBondContact O-N 3.28Å; I157-L160 HydrophobicContact CD1-CD2 4.09Å; I157-L160 WeakPolarHBondContact O-CB 3.36Å; I157-L160 PolarHBondContact O-N 3.11Å; V158-L160 VanDerWaalsContact C-N 3.29Å; V158-L160 PolarHBondContact O-N 3.32Å; L160-M163 HydrophobicContact CD1-CE 3.61Å; L160-M163 WeakPolarHBondContact O-CB 3.45Å; L160-M163 PolarHBondContact O-N 2.66Å; L160-V164 WeakPolarHBondContact O-CG2 3.3Å; L160-V164 PolarHBondContact O-N 2.85Å; L160-V164 VanDerWaalsContact O-N 3.17Å; L160-L210 HydrophobicContact CD2-CD1 4.39Å; L160-I644 HydrophobicContact CB-CD1 4.29Å; L160-I644 HydrophobicContact CD1-CD1 4.48Å
161	G	95.7	Very high	91.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-59	-48.5	173.6	0	0	0	0	0	111.6	I157 V158 M163 V164 G165 G213 I214	I157-G161 PolarHBondContact O-N 3.49Å; V158-G161 PolarHBondContact O-N 3.1Å; V158-G161 VanDerWaalsContact O-N 3.17Å; G161-M163 VanDerWaalsContact C-N 3.31Å; G161-M163 PolarHBondContact O-N 2.97Å; G161-V164 PolarHBondContact O-N 3.29Å; G161-G165 PolarHBondContact O-N 3Å; G161-G213 CarbonylContact C-O 3.44Å; G161-I214 VanDerWaalsContact O-CA 3.29Å; G161-I214 WeakPolarHBondContact O-CA 3.46Å; G161-I214 WeakPolarHBondContact O-CG1 3.4Å; G161-I214 PolarHBondContact O-N 3.29Å
162	M	95.3	Very high	92.1	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-60.9	-37.9	178.3	-71.6	173.6	177.5	0	0	112.6	E129 C130 V158 F159 G165 A166 G213 I216 K640	E129-M162 HydrophobicContact CB-CE 4.07Å; C130-M162 WeakPolarHBondContact SG-CE 3.48Å; V158-M162 HydrophobicContact CG1-CE 3.61Å; V158-M162 HydrophobicContact CG1-CG 4.47Å; V158-M162 HydrophobicContact CG1-SD 4.22Å; V158-M162 WeakPolarHBondContact O-CG 3.43Å; V158-M162 PolarHBondContact O-N 3.4Å; F159-M162 HydrophobicContact CD1-SD 4.4Å; F159-M162 PolarHBondContact O-N 3.31Å; M162-G165 PolarHBondContact O-N 2.94Å; M162-A166 VanDerWaalsContact O-CB 3.25Å; M162-A166 WeakPolarHBondContact O-CB 3.48Å; M162-A166 PolarHBondContact O-N 3.02Å; M162-G213 VanDerWaalsContact CA-O 3.31Å; M162-G213 WeakPolarHBondContact CA-O 3.33Å; M162-G213 PolarHBondContact N-O 3.37Å; M162-I216 HydrophobicContact CE-CG2 3.57Å; M162-I216 HydrophobicContact CG-CG2 3.98Å; M162-K640 HydrophobicContact CB-CD 4.23Å; M162-K640 HydrophobicContact CB-CG 4.05Å
163	M	95.5	Very high	92.5	Very high	44 Å²	44	30 Å²	30	22%	0.217	16%	0.157	C	C	.	.	H	α-helix	trans	-60	-50.3	175.3	-179.6	-176.9	77.7	0	0	111.4	F159 L160 G161 F167 A637 K640 L641	F159-M163 WeakPolarHBondContact O-CB 3.33Å; F159-M163 PolarHBondContact O-N 3.33Å; L160-M163 HydrophobicContact CD1-CE 3.61Å; L160-M163 WeakPolarHBondContact O-CB 3.45Å; L160-M163 PolarHBondContact O-N 2.66Å; G161-M163 VanDerWaalsContact C-N 3.31Å; G161-M163 PolarHBondContact O-N 2.97Å; M163-F167 PolarHBondContact O-N 3.14Å; M163-A637 HydrophobicContact CG-CB 4.05Å; M163-A637 WeakPolarHBondContact CG-O 3.4Å; M163-A637 WeakPolarHBondContact O-CB 3.41Å; M163-K640 HydrophobicContact CB-CB 3.82Å; M163-L641 HydrophobicContact SD-CB 3.88Å; M163-L641 HydrophobicContact SD-CD1 4.13Å
164	V	96.1	Very high	92.5	Very high	60 Å²	60	26.1 Å²	26.1	36%	0.364	14%	0.138	S	C	.	.	H	α-helix	trans	-66.3	-42.1	179	175	0	0	0	0	110.5	L160 G161 F167 I168 I214	L160-V164 WeakPolarHBondContact O-CG2 3.3Å; L160-V164 PolarHBondContact O-N 2.85Å; L160-V164 VanDerWaalsContact O-N 3.17Å; G161-V164 PolarHBondContact O-N 3.29Å; V164-F167 PolarHBondContact O-N 3.14Å; V164-I168 HydrophobicContact CG1-CD1 3.64Å; V164-I168 HydrophobicContact CG1-CG1 4.43Å; V164-I168 WeakPolarHBondContact O-CG1 3.47Å; V164-I168 PolarHBondContact O-N 2.93Å; V164-I168 VanDerWaalsContact O-N 3.08Å; V164-I214 HydrophobicContact CB-CG1 4.32Å; V164-I214 HydrophobicContact CG1-CD1 4.45Å; V164-I214 HydrophobicContact CG1-CG1 4.35Å
165	G	95.6	Very high	92.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-60.6	-46.5	177.1	0	0	0	0	0	113.3	G161 M162 F167 I168 W169 I214	G161-G165 PolarHBondContact O-N 3Å; M162-G165 PolarHBondContact O-N 2.94Å; G165-F167 VanDerWaalsContact C-N 3.29Å; G165-F167 PolarHBondContact O-N 3.2Å; G165-I168 PolarHBondContact O-N 2.88Å; G165-W169 WeakPolarHBondContact O-CB 3.49Å; G165-W169 PolarHBondContact O-N 3.2Å; G165-I214 WeakPolarHBondContact CA-O 3.26Å
166	A	94.8	Very high	92.5	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-58.6	-41.4	179	0	0	0	0	0	111.9	M162 G170 G217 G633 N636 A637	M162-A166 VanDerWaalsContact O-CB 3.25Å; M162-A166 WeakPolarHBondContact O-CB 3.48Å; M162-A166 PolarHBondContact O-N 3.02Å; A166-G170 WeakPolarHBondContact O-CA 3.09Å; A166-G170 PolarHBondContact O-N 3.44Å; A166-G217 VanDerWaalsContact CA-O 3.29Å; A166-G217 WeakPolarHBondContact CA-O 3.34Å; A166-G217 WeakPolarHBondContact CB-O 3.47Å; A166-G633 VanDerWaalsContact O-CA 3.26Å; A166-G633 WeakPolarHBondContact O-CA 3.26Å; A166-N636 HydrophobicContact CB-CB 4.19Å; A166-A637 HydrophobicContact CB-CB 4.27Å
167	F	93.5	Very high	92.4	Very high	76 Å²	76	28.1 Å²	28.1	33%	0.333	14%	0.14	S	C	.	.	H	α-helix	trans	-66.8	-47.8	176.9	-174.1	-96.1	0	0	0	112.3	M163 V164 G165 G171 L380 V383 V634 A637	M163-F167 PolarHBondContact O-N 3.14Å; V164-F167 PolarHBondContact O-N 3.14Å; G165-F167 VanDerWaalsContact C-N 3.29Å; G165-F167 PolarHBondContact O-N 3.2Å; F167-G171 PolarHBondContact O-N 3Å; F167-L380 HydrophobicContact CZ-CD2 4.42Å; F167-V383 HydrophobicContact CE2-CG1 4.35Å; F167-V383 HydrophobicContact CE2-CG2 4Å; F167-V383 HydrophobicContact CZ-CG2 4.15Å; F167-V634 HydrophobicContact CD2-CG2 3.96Å; F167-V634 HydrophobicContact CE2-CG2 3.99Å; F167-A637 HydrophobicContact CB-CB 4.41Å
168	I	93.5	Very high	92.4	Very high	68 Å²	68	26.8 Å²	26.8	35%	0.349	13%	0.133	S	C	.	.	H	α-helix	trans	-66.1	-57.1	-177.9	-66.9	170.8	0	0	0	110.7	V164 G165 G171 M172	V164-I168 HydrophobicContact CG1-CD1 3.64Å; V164-I168 HydrophobicContact CG1-CG1 4.43Å; V164-I168 WeakPolarHBondContact O-CG1 3.47Å; V164-I168 PolarHBondContact O-N 2.93Å; V164-I168 VanDerWaalsContact O-N 3.08Å; G165-I168 PolarHBondContact O-N 2.88Å; I168-G171 PolarHBondContact O-N 3.5Å; I168-M172 HydrophobicContact CG2-SD 3.62Å; I168-M172 WeakPolarHBondContact O-CB 3.21Å; I168-M172 WeakPolarHBondContact O-CG 3.12Å; I168-M172 PolarHBondContact O-N 3.46Å
169	W	94.7	Very high	92.5	Very high	20 Å²	20	29.6 Å²	29.6	8%	0.076	14%	0.143	C	C	.	.	H	α-helix	trans	-72.4	-35.6	-173.9	-67.9	117	0	0	0	112.8	G165 M172 A173 C181 W184 A185 I188 I214 G218 I222	G165-W169 WeakPolarHBondContact O-CB 3.49Å; G165-W169 PolarHBondContact O-N 3.2Å; W169-M172 HydrophobicContact CE3-SD 4.4Å; W169-M172 HydrophobicContact CZ3-CE 4.2Å; W169-M172 HydrophobicContact CZ3-SD 4.41Å; W169-M172 PolarHBondContact O-N 3.37Å; W169-A173 VanDerWaalsContact O-CB 3.31Å; W169-A173 WeakPolarHBondContact O-CB 3.16Å; W169-A173 PolarHBondContact O-N 3.42Å; W169-C181 HydrophobicContact CE3-CB 4.35Å; W169-W184 HydrophobicContact CH2-CB 3.6Å; W169-W184 HydrophobicContact CZ3-CB 3.63Å; W169-A185 HydrophobicContact CD2-CB 3.95Å; W169-A185 HydrophobicContact CE3-CB 4.33Å; W169-A185 HydrophobicContact CG-CB 4.19Å; W169-I188 HydrophobicContact CH2-CD1 3.82Å; W169-I188 HydrophobicContact CZ2-CD1 3.43Å; W169-I188 VanDerWaalsContact CZ2-CD1 3.43Å; W169-I214 PolarHBondContact NE1-O 3.38Å; W169-G218 VanDerWaalsContact CB-CA 3.44Å; W169-I222 HydrophobicContact CB-CD1 3.99Å
170	G	91.2	Very high	92.4	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.1	-46.4	174.8	0	0	0	0	0	111.7	A166 A629 T630	A166-G170 WeakPolarHBondContact O-CA 3.09Å; A166-G170 PolarHBondContact O-N 3.44Å; G170-A629 CarbonylContact C-O 3.15Å; G170-A629 WeakPolarHBondContact CA-O 3.47Å; G170-A629 CarbonylContact O-C 3.57Å; G170-A629 WeakPolarHBondContact O-CB 3.45Å; G170-T630 PolarHBondContact O-N 3.46Å
171	G	89.7	Confident	92.4	Very high	1 Å²	1	30 Å²	30	1%	0.01	14%	0.142	C	C	.	.	H	α-helix	trans	-66.1	-41.9	175.3	0	0	0	0	0	113.7	F167 I168 A173	F167-G171 PolarHBondContact O-N 3Å; I168-G171 PolarHBondContact O-N 3.5Å; G171-A173 VanDerWaalsContact C-N 3.31Å; G171-A173 PolarHBondContact O-N 2.87Å
172	M	91.1	Very high	92.4	Very high	57 Å²	57	30 Å²	30	28%	0.281	14%	0.142	S	C	.	.	H	α-helix	trans	-66.5	-32.2	-179.7	-74.3	177.3	69.8	0	0	112.9	I168 W169 D174 K175 L176 C181	I168-M172 HydrophobicContact CG2-SD 3.62Å; I168-M172 WeakPolarHBondContact O-CB 3.21Å; I168-M172 WeakPolarHBondContact O-CG 3.12Å; I168-M172 PolarHBondContact O-N 3.46Å; W169-M172 HydrophobicContact CE3-SD 4.4Å; W169-M172 HydrophobicContact CZ3-CE 4.2Å; W169-M172 HydrophobicContact CZ3-SD 4.41Å; W169-M172 PolarHBondContact O-N 3.37Å; M172-D174 VanDerWaalsContact C-N 3.29Å; M172-D174 PolarHBondContact O-N 3.4Å; M172-K175 PolarHBondContact O-N 2.86Å; M172-L176 HydrophobicContact CB-CD1 4.34Å; M172-L176 HydrophobicContact CE-CD1 3.38Å; M172-L176 PolarHBondContact O-N 3.15Å; M172-C181 VanDerWaalsContact C-SG 3.5Å; M172-C181 PolarHBondContact O-SG 3.32Å
173	A	91.7	Very high	92.4	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-64.6	-30.8	-176.6	0	0	0	0	0	114	W169 G171 K175 G177 C181 I222 A629	W169-A173 VanDerWaalsContact O-CB 3.31Å; W169-A173 WeakPolarHBondContact O-CB 3.16Å; W169-A173 PolarHBondContact O-N 3.42Å; G171-A173 VanDerWaalsContact C-N 3.31Å; G171-A173 PolarHBondContact O-N 2.87Å; A173-K175 PolarHBondContact O-N 3.11Å; A173-G177 CarbonylContact O-C 3.53Å; A173-G177 PolarHBondContact O-N 2.89Å; A173-C181 HydrophobicContact CB-CB 4.06Å; A173-I222 HydrophobicContact CB-CD1 3.96Å; A173-I222 HydrophobicContact CB-CG1 3.61Å; A173-A629 HydrophobicContact CB-CB 3.81Å
174	D	89.2	Confident	92.4	Very high	6 Å²	6	37.3 Å²	37.3	3%	0.032	17%	0.17	C	C	.	.	H	α-helix	trans	-73.8	-14.8	175.7	-73.1	-30.3	0	0	0	113.1	M172 R178 K627 R628 A629 T630	M172-D174 VanDerWaalsContact C-N 3.29Å; M172-D174 PolarHBondContact O-N 3.4Å; D174-R178 IonicContact OD1-CZ 3.98Å; D174-R178 IonicContact OD1-NH2 3.1Å; D174-R178 PolarHBondContact OD1-NH2 3.43Å; D174-K627 WeakPolarHBondContact OD2-CA 3.4Å; D174-R628 PolarHBondContact OD2-N 3.35Å; D174-A629 VanDerWaalsContact OD1-CB 3.31Å; D174-A629 WeakPolarHBondContact OD1-CB 3.39Å; D174-A629 PolarHBondContact OD1-N 3.01Å; D174-A629 PolarHBondContact OD2-N 3.34Å; D174-T630 WeakPolarHBondContact OD2-CB 3.36Å; D174-T630 PolarHBondContact OD2-N 3.41Å; D174-T630 PolarHBondContact OD2-OG1 3.01Å
175	K	85.4	Confident	92.4	Very high	59 Å²	59	34.5 Å²	34.5	26%	0.257	15%	0.153	S	C	.	.	H	α-helix	trans	-115.1	-38.7	-174.9	-58.3	-56.5	174.7	168.4	0	114.5	M172 A173 L375 L378 N382	M172-K175 PolarHBondContact O-N 2.86Å; A173-K175 PolarHBondContact O-N 3.11Å; K175-L375 HydrophobicContact CB-CD2 4.33Å; K175-L378 HydrophobicContact CD-CD2 3.43Å; K175-L378 VanDerWaalsContact CD-CD2 3.43Å; K175-L378 HydrophobicContact CD-CG 3.91Å; K175-L378 HydrophobicContact CG-CD2 3.89Å; K175-L378 HydrophobicContact CG-CG 4.28Å; K175-N382 VanDerWaalsContact CE-ND2 3.3Å; K175-N382 WeakPolarHBondContact CE-ND2 3.49Å
176	L	86.1	Confident	92.3	Very high	63 Å²	63	34.5 Å²	34.5	33%	0.33	15%	0.153	S	C	.	.	H	α-helix	trans	-92.6	-17.5	-179.5	-65.6	175.4	0	0	0	112.9	M172 L375	M172-L176 HydrophobicContact CB-CD1 4.34Å; M172-L176 HydrophobicContact CE-CD1 3.38Å; M172-L176 PolarHBondContact O-N 3.15Å; L176-L375 HydrophobicContact CD2-CD1 4.17Å; L176-L375 HydrophobicContact CD2-CD2 4.3Å
177	G	88.3	Confident	92.4	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.166	C	C	.	.			trans	110.8	148.5	-175	0	0	0	0	0	111.7	A173 C181 F307	A173-G177 CarbonylContact O-C 3.53Å; A173-G177 PolarHBondContact O-N 2.89Å; G177-C181 WeakPolarHBondContact O-CB 3.44Å; G177-C181 PolarHBondContact O-N 3Å; G177-C181 PolarHBondContact O-SG 2.86Å; G177-F307 VanDerWaalsContact CA-CE1 3.43Å
178	R	92.7	Very high	92.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-69.4	-48.8	-174.9	-71.3	86.9	-158.9	-157.9	9.2	110.9	D174 L182 I222 Y226 E229 E303 F307 A625	D174-R178 IonicContact OD1-CZ 3.98Å; D174-R178 IonicContact OD1-NH2 3.1Å; D174-R178 PolarHBondContact OD1-NH2 3.43Å; R178-L182 WeakPolarHBondContact O-CB 3.4Å; R178-L182 PolarHBondContact O-N 3.48Å; R178-I222 HydrophobicContact CB-CG2 4.29Å; R178-I222 WeakPolarHBondContact O-CG2 3.47Å; R178-Y226 HydrophobicContact CB-CD2 3.69Å; R178-Y226 HydrophobicContact CB-CG 4.05Å; R178-E229 IonicContact CZ-OE1 3.26Å; R178-E229 VanDerWaalsContact CZ-OE1 3.26Å; R178-E229 IonicContact CZ-OE2 3.76Å; R178-E229 IonicContact NE-OE1 3.48Å; R178-E229 PolarHBondContact NE-OE1 3.43Å; R178-E229 IonicContact NH1-OE1 2.94Å; R178-E229 PolarHBondContact NH1-OE1 2.95Å; R178-E229 VanDerWaalsContact NH1-OE1 3.1Å; R178-E229 IonicContact NH1-OE2 3.19Å; R178-E229 PolarHBondContact NH1-OE2 3.19Å; R178-E229 IonicContact NH2-OE1 2.59Å; R178-E303 PolarHBondContact N-OE1 2.83Å; R178-F307 VanDerWaalsContact NH1-CA 3.34Å; R178-A625 PolarHBondContact NH2-O 3.49Å
179	R	93.8	Very high	92.6	Very high	65 Å²	65	32 Å²	32	25%	0.245	14%	0.144	C	C	.	.	H	α-helix	trans	-63.5	-48.1	-179.7	175.4	-166.8	170.9	-150.9	7.6	111.6	C181 L182 I183 Y226 L298 M299 M301 E303	R179-C181 PolarHBondContact O-N 3.16Å; R179-L182 PolarHBondContact O-N 2.91Å; R179-I183 HydrophobicContact CG-CD1 3.93Å; R179-I183 WeakPolarHBondContact O-CG1 3.49Å; R179-I183 PolarHBondContact O-N 3.14Å; R179-Y226 HydrophobicContact CB-CE2 4.41Å; R179-L298 PolarHBondContact NE-O 3.21Å; R179-L298 PolarHBondContact NH2-O 3.01Å; R179-M299 PolarHBondContact NH2-O 3.28Å; R179-M301 WeakPolarHBondContact CD-O 3.47Å; R179-M301 PolarHBondContact NE-O 3.26Å; R179-M301 PolarHBondContact NH2-O 3.38Å; R179-E303 WeakPolarHBondContact CB-OE2 3.49Å; R179-E303 PolarHBondContact N-OE1 3.34Å
180	K	92.6	Very high	92.6	Very high	110 Å²	110	31.7 Å²	31.7	48%	0.478	15%	0.146	S	C	.	.	H	α-helix	trans	-61.7	-45.5	-178.2	-68.9	179	-171.9	169.4	0	111.9	L182 I183 W184	K180-L182 VanDerWaalsContact C-N 3.34Å; K180-L182 PolarHBondContact O-N 2.97Å; K180-I183 PolarHBondContact O-N 3.39Å; K180-W184 PolarHBondContact O-N 3.08Å; K180-W184 VanDerWaalsContact O-N 3.09Å
181	C	94.1	Very high	92.8	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.007	17%	0.166	C	C	.	.	H	α-helix	trans	-62.8	-40.8	177.2	-76.3	0	0	0	0	112	W169 M172 A173 G177 R179 I183 W184 A185 I222	W169-C181 HydrophobicContact CE3-CB 4.35Å; M172-C181 VanDerWaalsContact C-SG 3.5Å; M172-C181 PolarHBondContact O-SG 3.32Å; A173-C181 HydrophobicContact CB-CB 4.06Å; G177-C181 WeakPolarHBondContact O-CB 3.44Å; G177-C181 PolarHBondContact O-N 3Å; G177-C181 PolarHBondContact O-SG 2.86Å; R179-C181 PolarHBondContact O-N 3.16Å; C181-I183 PolarHBondContact O-N 2.82Å; C181-W184 PolarHBondContact O-N 3.41Å; C181-A185 VanDerWaalsContact O-CB 3.26Å; C181-A185 WeakPolarHBondContact O-CB 3.25Å; C181-A185 PolarHBondContact O-N 3.4Å; C181-I222 HydrophobicContact CB-CD1 3.71Å
182	L	95.3	Very high	93.1	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-62.5	-41.9	176.6	-168.5	56.2	0	0	0	112.4	L119 R178 R179 K180 A185 L186 I222 V223 L298	L119-L182 HydrophobicContact CD2-CD2 3.7Å; R178-L182 WeakPolarHBondContact O-CB 3.4Å; R178-L182 PolarHBondContact O-N 3.48Å; R179-L182 PolarHBondContact O-N 2.91Å; K180-L182 VanDerWaalsContact C-N 3.34Å; K180-L182 PolarHBondContact O-N 2.97Å; L182-A185 PolarHBondContact O-N 3.5Å; L182-L186 HydrophobicContact CD1-CD1 4.17Å; L182-L186 HydrophobicContact CD1-CG 4.24Å; L182-L186 HydrophobicContact CG-CD1 4.02Å; L182-L186 HydrophobicContact CG-CG 4.49Å; L182-L186 WeakPolarHBondContact O-CB 3.4Å; L182-L186 WeakPolarHBondContact O-CG 3.48Å; L182-L186 PolarHBondContact O-N 2.96Å; L182-I222 HydrophobicContact CB-CG2 3.81Å; L182-I222 HydrophobicContact CD1-CB 4.41Å; L182-I222 HydrophobicContact CD1-CG2 4.34Å; L182-I222 HydrophobicContact CG-CG2 4.44Å; L182-V223 HydrophobicContact CD1-CG2 3.97Å; L182-V223 HydrophobicContact CD2-CG2 3.86Å; L182-L298 HydrophobicContact CB-CD1 4.32Å; L182-L298 HydrophobicContact CD2-CD1 3.59Å; L182-L298 HydrophobicContact CD2-CD2 3.81Å; L182-L298 HydrophobicContact CD2-CG 4.35Å; L182-L298 HydrophobicContact CG-CD1 3.63Å
183	I	96.2	Very high	93.1	Very high	39 Å²	39	34.7 Å²	34.7	20%	0.2	16%	0.163	C	C	.	.	H	α-helix	trans	-60.6	-47.3	176.1	-72.1	170.9	0	0	0	110.9	R179 K180 C181 T187 L295 L298	R179-I183 HydrophobicContact CG-CD1 3.93Å; R179-I183 WeakPolarHBondContact O-CG1 3.49Å; R179-I183 PolarHBondContact O-N 3.14Å; K180-I183 PolarHBondContact O-N 3.39Å; C181-I183 PolarHBondContact O-N 2.82Å; I183-T187 VanDerWaalsContact O-CB 3.29Å; I183-T187 WeakPolarHBondContact O-CB 3.35Å; I183-T187 PolarHBondContact O-N 3.37Å; I183-T187 PolarHBondContact O-OG1 3.41Å; I183-L295 HydrophobicContact CB-CD1 4.33Å; I183-L295 HydrophobicContact CG1-CD1 4.45Å; I183-L295 HydrophobicContact CG2-CD1 3.91Å; I183-L298 HydrophobicContact CD1-CB 4.39Å; I183-L298 HydrophobicContact CG1-CB 3.98Å; I183-L298 HydrophobicContact CG1-CD1 4.45Å
184	W	94.8	Very high	93.1	Very high	159 Å²	159	39.7 Å²	39.7	60%	0.602	19%	0.185	S	C	*	.	H	α-helix	trans	-64	-45.6	178.7	-75.8	116.5	0	0	0	112.4	W169 K180 C181 T187 I188	W169-W184 HydrophobicContact CH2-CB 3.6Å; W169-W184 HydrophobicContact CZ3-CB 3.63Å; K180-W184 PolarHBondContact O-N 3.08Å; K180-W184 VanDerWaalsContact O-N 3.09Å; C181-W184 PolarHBondContact O-N 3.41Å; W184-T187 PolarHBondContact O-N 3.36Å; W184-I188 WeakPolarHBondContact O-CG1 3.34Å; W184-I188 PolarHBondContact O-N 3.03Å
185	A	95.4	Very high	93.3	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.008	20%	0.2	C	C	.	.	H	α-helix	trans	-56.6	-51.5	176.9	0	0	0	0	0	112	W169 C181 L182 T187 I188 N189 G215	W169-A185 HydrophobicContact CD2-CB 3.95Å; W169-A185 HydrophobicContact CE3-CB 4.33Å; W169-A185 HydrophobicContact CG-CB 4.19Å; C181-A185 VanDerWaalsContact O-CB 3.26Å; C181-A185 WeakPolarHBondContact O-CB 3.25Å; C181-A185 PolarHBondContact O-N 3.4Å; L182-A185 PolarHBondContact O-N 3.5Å; A185-T187 PolarHBondContact O-N 3.44Å; A185-I188 PolarHBondContact O-N 3.08Å; A185-N189 PolarHBondContact O-N 2.65Å; A185-G215 VanDerWaalsContact CB-O 3.3Å; A185-G215 WeakPolarHBondContact CB-O 3.34Å; A185-G215 CarbonylContact O-C 3.33Å; A185-G215 WeakPolarHBondContact O-CA 3.2Å
186	L	95.4	Very high	93.6	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-67.9	-34.6	178.9	-70.7	174.5	0	0	0	112.8	A122 L182 N189 C190 I216 L295 L298	A122-L186 HydrophobicContact CB-CD1 4.14Å; L182-L186 HydrophobicContact CD1-CD1 4.17Å; L182-L186 HydrophobicContact CD1-CG 4.24Å; L182-L186 HydrophobicContact CG-CD1 4.02Å; L182-L186 HydrophobicContact CG-CG 4.49Å; L182-L186 WeakPolarHBondContact O-CB 3.4Å; L182-L186 WeakPolarHBondContact O-CG 3.48Å; L182-L186 PolarHBondContact O-N 2.96Å; L186-N189 PolarHBondContact O-N 3.33Å; L186-C190 WeakPolarHBondContact O-CB 3.46Å; L186-C190 PolarHBondContact O-N 3.49Å; L186-C190 PolarHBondContact O-SG 2.79Å; L186-I216 HydrophobicContact CD2-CD1 3.87Å; L186-L295 HydrophobicContact CB-CD1 4.37Å; L186-L298 HydrophobicContact CD1-CD1 3.51Å
187	T	96	Very high	93.8	Very high	44 Å²	44	36.7 Å²	36.7	27%	0.27	17%	0.172	S	C	.	.	H	α-helix	trans	-64.5	-44.7	176.3	-59.3	0	0	0	0	110.8	I183 W184 A185 N189 C190 V191	I183-T187 VanDerWaalsContact O-CB 3.29Å; I183-T187 WeakPolarHBondContact O-CB 3.35Å; I183-T187 PolarHBondContact O-N 3.37Å; I183-T187 PolarHBondContact O-OG1 3.41Å; W184-T187 PolarHBondContact O-N 3.36Å; A185-T187 PolarHBondContact O-N 3.44Å; T187-N189 VanDerWaalsContact C-N 3.33Å; T187-C190 PolarHBondContact O-N 3.07Å; T187-V191 HydrophobicContact CG2-CG2 4.34Å; T187-V191 VanDerWaalsContact O-CG2 3.32Å; T187-V191 WeakPolarHBondContact O-CG2 3.41Å; T187-V191 PolarHBondContact O-N 3.04Å
188	I	95.9	Very high	93.9	Very high	46 Å²	46	40.8 Å²	40.8	24%	0.236	19%	0.19	C	C	.	.	H	α-helix	trans	-61.6	-45	175.8	-71.3	162.2	0	0	0	109.8	W169 W184 A185 C190 F192 I211	W169-I188 HydrophobicContact CH2-CD1 3.82Å; W169-I188 HydrophobicContact CZ2-CD1 3.43Å; W169-I188 VanDerWaalsContact CZ2-CD1 3.43Å; W184-I188 WeakPolarHBondContact O-CG1 3.34Å; W184-I188 PolarHBondContact O-N 3.03Å; A185-I188 PolarHBondContact O-N 3.08Å; I188-C190 PolarHBondContact O-N 3.27Å; I188-F192 HydrophobicContact CG2-CD2 3.92Å; I188-F192 HydrophobicContact CG2-CE2 4.29Å; I188-F192 VanDerWaalsContact O-CD2 3.29Å; I188-F192 WeakPolarHBondContact O-CD2 3.29Å; I188-F192 PolarHBondContact O-N 3.34Å; I188-F192 VanDerWaalsContact O-N 3.08Å; I188-I211 HydrophobicContact CG2-CG2 3.88Å
189	N	95.3	Very high	93.7	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-57.6	-51.4	174.5	-170.3	62.3	0	0	0	111.9	E129 A185 L186 T187 V191 F192 A193 S212 I216	E129-N189 PolarHBondContact OE1-ND2 2.83Å; E129-N189 PolarHBondContact OE1-OD1 2.85Å; A185-N189 PolarHBondContact O-N 2.65Å; L186-N189 PolarHBondContact O-N 3.33Å; T187-N189 VanDerWaalsContact C-N 3.33Å; N189-V191 PolarHBondContact O-N 3.37Å; N189-F192 PolarHBondContact O-N 3.38Å; N189-A193 WeakPolarHBondContact O-CB 3.39Å; N189-A193 PolarHBondContact O-N 3.19Å; N189-S212 PolarHBondContact O-OG 2.7Å; N189-S212 PolarHBondContact OD1-O 2.93Å; N189-S212 VanDerWaalsContact OD1-O 3.08Å; N189-S212 PolarHBondContact OD1-OG 3.01Å; N189-I216 HydrophobicContact CB-CB 4.25Å; N189-I216 HydrophobicContact CB-CD1 4.45Å
190	C	94.1	Very high	93.2	Very high	15 Å²	15	41.2 Å²	41.2	10%	0.101	20%	0.195	C	C	.	.	H	α-helix	trans	-59.7	-45.9	-177.7	-68.4	0	0	0	0	112.7	L186 T187 I188 F194 A291 I292	L186-C190 WeakPolarHBondContact O-CB 3.46Å; L186-C190 PolarHBondContact O-N 3.49Å; L186-C190 PolarHBondContact O-SG 2.79Å; T187-C190 PolarHBondContact O-N 3.07Å; I188-C190 PolarHBondContact O-N 3.27Å; C190-F194 WeakPolarHBondContact O-CB 2.84Å; C190-F194 PolarHBondContact O-N 2.74Å; C190-A291 WeakPolarHBondContact SG-CB 3.27Å; C190-I292 HydrophobicContact CB-CG1 4.49Å
191	V	95.6	Very high	92.9	Very high	71 Å²	71	37.4 Å²	37.4	43%	0.43	19%	0.188	S	C	.	.	H	α-helix	trans	-65.2	-46.9	-177.8	171.4	0	0	0	0	110.6	T187 N189 F194 L195	T187-V191 HydrophobicContact CG2-CG2 4.34Å; T187-V191 VanDerWaalsContact O-CG2 3.32Å; T187-V191 WeakPolarHBondContact O-CG2 3.41Å; T187-V191 PolarHBondContact O-N 3.04Å; N189-V191 PolarHBondContact O-N 3.37Å; V191-F194 PolarHBondContact O-N 3.15Å; V191-L195 HydrophobicContact CG1-CD1 4.01Å; V191-L195 WeakPolarHBondContact O-CB 3.41Å; V191-L195 VanDerWaalsContact O-CG 3.25Å; V191-L195 WeakPolarHBondContact O-CG 3.1Å; V191-L195 PolarHBondContact O-N 3.47Å
192	F	95.3	Very high	92.7	Very high	48 Å²	48	39 Å²	39	21%	0.211	19%	0.194	C	C	.	.	H	α-helix	trans	-78.8	-31.5	-176.4	-75.7	-80.7	0	0	0	113.1	I188 N189 L195 S196 F208 I211	I188-F192 HydrophobicContact CG2-CD2 3.92Å; I188-F192 HydrophobicContact CG2-CE2 4.29Å; I188-F192 VanDerWaalsContact O-CD2 3.29Å; I188-F192 WeakPolarHBondContact O-CD2 3.29Å; I188-F192 PolarHBondContact O-N 3.34Å; I188-F192 VanDerWaalsContact O-N 3.08Å; N189-F192 PolarHBondContact O-N 3.38Å; F192-L195 HydrophobicContact CD1-CD1 4.31Å; F192-L195 HydrophobicContact CE1-CD1 4.44Å; F192-L195 PolarHBondContact O-N 2.98Å; F192-S196 WeakPolarHBondContact O-CB 3.35Å; F192-S196 PolarHBondContact O-N 3.47Å; F192-F208 AromaticContact CD1-CD1 3.66Å; F192-F208 HydrophobicContact CD1-CD1 3.66Å; F192-F208 HydrophobicContact CD1-CE1 4.34Å; F192-F208 HydrophobicContact CD1-CG 4.44Å; F192-F208 HydrophobicContact CE1-CD1 4.02Å; F192-F208 HydrophobicContact CE1-CE1 4.32Å; F192-I211 HydrophobicContact CB-CB 4.37Å; F192-I211 HydrophobicContact CB-CG2 4.31Å; F192-I211 HydrophobicContact CD1-CB 3.94Å; F192-I211 HydrophobicContact CD1-CD1 4.05Å; F192-I211 HydrophobicContact CD1-CG2 3.89Å; F192-I211 HydrophobicContact CD2-CB 4.21Å; F192-I211 HydrophobicContact CD2-CG2 3.34Å; F192-I211 HydrophobicContact CE1-CB 4.24Å; F192-I211 HydrophobicContact CE1-CD1 3.62Å; F192-I211 HydrophobicContact CE1-CG2 3.99Å; F192-I211 HydrophobicContact CE2-CG2 3.46Å; F192-I211 VanDerWaalsContact CE2-CG2 3.46Å; F192-I211 HydrophobicContact CG-CB 3.9Å; F192-I211 HydrophobicContact CG-CG2 3.57Å; F192-I211 HydrophobicContact CZ-CD1 4.02Å; F192-I211 HydrophobicContact CZ-CG2 3.78Å
193	A	92.2	Very high	92.4	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.008	22%	0.219	C	C	.	.	H	α-helix	trans	-61.9	-45.2	169	0	0	0	0	0	110.8	N189 S196 S197 S212	N189-A193 WeakPolarHBondContact O-CB 3.39Å; N189-A193 PolarHBondContact O-N 3.19Å; A193-S196 WeakPolarHBondContact O-CB 3.37Å; A193-S196 PolarHBondContact O-N 3.45Å; A193-S196 PolarHBondContact O-OG 2.88Å; A193-S197 PolarHBondContact O-N 3.02Å; A193-S212 PolarHBondContact N-OG 2.94Å
194	F	92.3	Very high	92.2	Very high	105 Å²	105	46.3 Å²	46.3	46%	0.461	24%	0.239	S	C	.	.	H	α-helix	trans	-58.8	-51.4	174.2	179	-95.6	0	0	0	111.6	C190 V191 S196 S197 F198 L285	C190-F194 WeakPolarHBondContact O-CB 2.84Å; C190-F194 PolarHBondContact O-N 2.74Å; V191-F194 PolarHBondContact O-N 3.15Å; F194-S196 VanDerWaalsContact C-N 3.26Å; F194-S196 PolarHBondContact O-N 3.17Å; F194-S197 WeakPolarHBondContact O-CB 3.41Å; F194-S197 PolarHBondContact O-N 2.91Å; F194-S197 VanDerWaalsContact O-N 3.16Å; F194-S197 PolarHBondContact O-OG 3.41Å; F194-F198 HydrophobicContact CD1-CD2 4.48Å; F194-F198 HydrophobicContact CD1-CE2 4.09Å; F194-F198 HydrophobicContact CD2-CE2 4.26Å; F194-F198 HydrophobicContact CE1-CD2 4.21Å; F194-F198 AromaticContact CE1-CE2 3.58Å; F194-F198 HydrophobicContact CE1-CE2 3.58Å; F194-F198 HydrophobicContact CE1-CZ 4.36Å; F194-F198 AromaticContact CE2-CE2 3.76Å; F194-F198 HydrophobicContact CE2-CE2 3.76Å; F194-F198 HydrophobicContact CE2-CZ 4.26Å; F194-F198 HydrophobicContact CG-CE2 4.41Å; F194-F198 HydrophobicContact CZ-CD2 4.43Å; F194-F198 AromaticContact CZ-CE2 3.39Å; F194-F198 HydrophobicContact CZ-CE2 3.39Å; F194-F198 AromaticContact CZ-CZ 3.84Å; F194-F198 HydrophobicContact CZ-CZ 3.84Å; F194-F198 VanDerWaalsContact O-CD2 3.31Å; F194-F198 WeakPolarHBondContact O-CD2 3.42Å; F194-L285 HydrophobicContact CD2-CD2 3.29Å; F194-L285 HydrophobicContact CE2-CD2 3.69Å; F194-L285 HydrophobicContact CG-CD2 4.14Å
195	L	93.1	Very high	92.1	Very high	66 Å²	66	38.8 Å²	38.8	35%	0.346	21%	0.21	S	C	.	.	H	α-helix	trans	-61.3	-33.3	177.8	-70.4	173.1	0	0	0	112.7	V191 F192 S197 F198 A199 F208	V191-L195 HydrophobicContact CG1-CD1 4.01Å; V191-L195 WeakPolarHBondContact O-CB 3.41Å; V191-L195 VanDerWaalsContact O-CG 3.25Å; V191-L195 WeakPolarHBondContact O-CG 3.1Å; V191-L195 PolarHBondContact O-N 3.47Å; F192-L195 HydrophobicContact CD1-CD1 4.31Å; F192-L195 HydrophobicContact CE1-CD1 4.44Å; F192-L195 PolarHBondContact O-N 2.98Å; L195-S197 VanDerWaalsContact C-N 3.25Å; L195-S197 PolarHBondContact O-N 3.31Å; L195-F198 PolarHBondContact O-N 3.13Å; L195-A199 PolarHBondContact O-N 3.37Å; L195-F208 HydrophobicContact CB-CD1 4.49Å; L195-F208 HydrophobicContact CB-CD2 4.18Å; L195-F208 HydrophobicContact CB-CE2 4.2Å; L195-F208 HydrophobicContact CB-CG 4.33Å; L195-F208 HydrophobicContact CB-CZ 4.35Å; L195-F208 HydrophobicContact CD1-CE1 4.48Å
196	S	92	Very high	91.9	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.2	-32.1	177.7	82	0	0	0	0	112.8	F192 A193 F194 F198 A199 F205 R209	F192-S196 WeakPolarHBondContact O-CB 3.35Å; F192-S196 PolarHBondContact O-N 3.47Å; A193-S196 WeakPolarHBondContact O-CB 3.37Å; A193-S196 PolarHBondContact O-N 3.45Å; A193-S196 PolarHBondContact O-OG 2.88Å; F194-S196 VanDerWaalsContact C-N 3.26Å; F194-S196 PolarHBondContact O-N 3.17Å; S196-F198 VanDerWaalsContact C-N 3.26Å; S196-F198 PolarHBondContact O-N 3.33Å; S196-A199 WeakPolarHBondContact O-CB 3.48Å; S196-A199 PolarHBondContact O-N 3.47Å; S196-F205 WeakPolarHBondContact O-CD2 3.13Å; S196-R209 PolarHBondContact OG-NE 3.46Å
197	S	90.3	Very high	91.9	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-64.6	-29.7	177.7	72.6	0	0	0	0	113	A193 F194 L195 R281 L285	A193-S197 PolarHBondContact O-N 3.02Å; F194-S197 WeakPolarHBondContact O-CB 3.41Å; F194-S197 PolarHBondContact O-N 2.91Å; F194-S197 VanDerWaalsContact O-N 3.16Å; F194-S197 PolarHBondContact O-OG 3.41Å; L195-S197 VanDerWaalsContact C-N 3.25Å; L195-S197 PolarHBondContact O-N 3.31Å; S197-R281 WeakPolarHBondContact CB-O 3.49Å; S197-R281 WeakPolarHBondContact O-CB 3.44Å; S197-R281 VanDerWaalsContact O-CD 3.29Å; S197-R281 WeakPolarHBondContact O-CD 3.45Å; S197-R281 WeakPolarHBondContact O-CG 3.5Å; S197-R281 PolarHBondContact O-NH1 3.14Å; S197-L285 WeakPolarHBondContact OG-CD2 3.44Å; S197-L285 WeakPolarHBondContact OG-CG 3.44Å
198	F	89	Confident	91.9	Very high	86 Å²	86	44.8 Å²	44.8	38%	0.377	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-4.2	179.2	-63.1	-88.4	0	0	0	113.4	F194 L195 S196 Q200 F275 F277 L285	F194-F198 HydrophobicContact CD1-CD2 4.48Å; F194-F198 HydrophobicContact CD1-CE2 4.09Å; F194-F198 HydrophobicContact CD2-CE2 4.26Å; F194-F198 HydrophobicContact CE1-CD2 4.21Å; F194-F198 AromaticContact CE1-CE2 3.58Å; F194-F198 HydrophobicContact CE1-CE2 3.58Å; F194-F198 HydrophobicContact CE1-CZ 4.36Å; F194-F198 AromaticContact CE2-CE2 3.76Å; F194-F198 HydrophobicContact CE2-CE2 3.76Å; F194-F198 HydrophobicContact CE2-CZ 4.26Å; F194-F198 HydrophobicContact CG-CE2 4.41Å; F194-F198 HydrophobicContact CZ-CD2 4.43Å; F194-F198 AromaticContact CZ-CE2 3.39Å; F194-F198 HydrophobicContact CZ-CE2 3.39Å; F194-F198 AromaticContact CZ-CZ 3.84Å; F194-F198 HydrophobicContact CZ-CZ 3.84Å; F194-F198 VanDerWaalsContact O-CD2 3.31Å; F194-F198 WeakPolarHBondContact O-CD2 3.42Å; L195-F198 PolarHBondContact O-N 3.13Å; S196-F198 VanDerWaalsContact C-N 3.26Å; S196-F198 PolarHBondContact O-N 3.33Å; F198-Q200 PolarHBondContact O-N 2.8Å; F198-F275 AromaticContact CD1-CZ 3.93Å; F198-F275 HydrophobicContact CD1-CZ 3.93Å; F198-F277 HydrophobicContact CD1-CE2 4.19Å; F198-F277 HydrophobicContact CE1-CE2 4.19Å; F198-L285 HydrophobicContact CE2-CD2 4.34Å
199	A	88.7	Confident	91.8	Very high	7 Å²	7	42.7 Å²	42.7	6%	0.058	22%	0.223	C	C	.	.			trans	-76.6	105.8	-174.7	0	0	0	0	0	111.8	L195 S196 F204 F205 F208 R281	L195-A199 PolarHBondContact O-N 3.37Å; S196-A199 WeakPolarHBondContact O-CB 3.48Å; S196-A199 PolarHBondContact O-N 3.47Å; A199-F204 HydrophobicContact CB-CB 4.26Å; A199-F205 HydrophobicContact CB-CB 3.99Å; A199-F205 HydrophobicContact CB-CD2 4.38Å; A199-F208 HydrophobicContact CB-CD2 3.93Å; A199-F208 HydrophobicContact CB-CE2 4.15Å; A199-R281 VanDerWaalsContact O-CZ 3.28Å; A199-R281 PolarHBondContact O-NH1 3.25Å; A199-R281 PolarHBondContact O-NH2 3.41Å
200	Q	84.4	Confident	91.8	Very high	66 Å²	66	44.8 Å²	44.8	31%	0.308	23%	0.234	S	C	.	.			trans	-77.4	-29.6	-179.9	-63	-62.6	-10	0	0	113.2	F198 F275 Q276	F198-Q200 PolarHBondContact O-N 2.8Å; Q200-F275 HydrophobicContact CG-CD2 3.85Å; Q200-F275 HydrophobicContact CG-CE2 3.82Å; Q200-Q276 PolarHBondContact NE2-O 2.88Å; Q200-Q276 PolarHBondContact OE1-O 2.89Å
201	G	86.1	Confident	91.9	Very high	31 Å²	31	45.6 Å²	45.6	32%	0.32	24%	0.237	S	C	.	.	S	Bend	trans	-91.5	138.1	176.9	0	0	0	0	0	112.8	G203 F204 F205	G201-G203 VanDerWaalsContact C-N 3.33Å; G201-G203 PolarHBondContact O-N 3.42Å; G201-F204 PolarHBondContact O-N 3.15Å; G201-F205 PolarHBondContact O-N 3.18Å
202	Y	88.6	Confident	91.9	Very high	34 Å²	34	42.2 Å²	42.2	13%	0.133	22%	0.216	C	C	.	.	H	α-helix	trans	-53.3	-44.8	177.2	175.4	-118.4	0	0	0	113.3	M144 L146 E150 M153 L154 F204 F205 L206	M144-Y202 HydrophobicContact SD-CD2 4.43Å; L146-Y202 HydrophobicContact CD1-CD2 4.47Å; L146-Y202 HydrophobicContact CD1-CE2 4.38Å; L146-Y202 HydrophobicContact CD2-CD1 4.25Å; L146-Y202 HydrophobicContact CD2-CD2 3.37Å; L146-Y202 HydrophobicContact CD2-CE1 4.45Å; L146-Y202 HydrophobicContact CD2-CE2 3.63Å; L146-Y202 HydrophobicContact CD2-CG 3.72Å; E150-Y202 WeakPolarHBondContact CA-OH 3.3Å; E150-Y202 HydrophobicContact CB-CE1 3.86Å; E150-Y202 HydrophobicContact CB-CE2 4.46Å; E150-Y202 WeakPolarHBondContact CB-OH 3.43Å; E150-Y202 HydrophobicContact CG-CE1 3.67Å; E150-Y202 PolarHBondContact O-OH 3.12Å; M153-Y202 HydrophobicContact CE-CE1 3.85Å; M153-Y202 VanDerWaalsContact CE-OH 3.25Å; M153-Y202 WeakPolarHBondContact CE-OH 3.15Å; L154-Y202 HydrophobicContact CB-CE2 4.39Å; Y202-F204 PolarHBondContact O-N 3.29Å; Y202-F205 WeakPolarHBondContact O-CB 3.29Å; Y202-F205 PolarHBondContact O-N 3.44Å; Y202-L206 HydrophobicContact CD1-CD1 4.01Å; Y202-L206 HydrophobicContact CD2-CD1 4.45Å; Y202-L206 HydrophobicContact CD2-CG 4.26Å; Y202-L206 HydrophobicContact CE1-CD1 3.48Å; Y202-L206 VanDerWaalsContact CE1-CD1 3.48Å; Y202-L206 HydrophobicContact CE1-CG 4.26Å; Y202-L206 HydrophobicContact CE2-CD1 3.96Å; Y202-L206 HydrophobicContact CE2-CD2 4.01Å; Y202-L206 HydrophobicContact CE2-CG 3.82Å; Y202-L206 HydrophobicContact CG-CD1 4.46Å; Y202-L206 VanDerWaalsContact CZ-CD1 3.44Å; Y202-L206 WeakPolarHBondContact O-CG 3.48Å; Y202-L206 PolarHBondContact O-N 2.81Å
203	G	90.4	Very high	91.9	Very high	51 Å²	51	40 Å²	40	53%	0.526	21%	0.207	S	C	.	.	H	α-helix	trans	-62.9	-40.5	178.7	0	0	0	0	0	114.1	G201 F207	G201-G203 VanDerWaalsContact C-N 3.33Å; G201-G203 PolarHBondContact O-N 3.42Å; G203-F207 WeakPolarHBondContact O-CB 3.26Å; G203-F207 PolarHBondContact O-N 3.4Å
204	F	91.5	Very high	92.1	Very high	141 Å²	141	42 Å²	42	62%	0.618	22%	0.217	S	C	*	.	H	α-helix	trans	-69.9	-38.1	175.2	-74.5	-70.2	0	0	0	111.6	A199 G201 Y202 F207 F208	A199-F204 HydrophobicContact CB-CB 4.26Å; G201-F204 PolarHBondContact O-N 3.15Å; Y202-F204 PolarHBondContact O-N 3.29Å; F204-F207 PolarHBondContact O-N 3.08Å; F204-F208 HydrophobicContact CB-CE2 4.45Å; F204-F208 VanDerWaalsContact O-CD2 3.27Å; F204-F208 WeakPolarHBondContact O-CD2 3.45Å; F204-F208 WeakPolarHBondContact O-CG 3.11Å; F204-F208 PolarHBondContact O-N 2.83Å
205	F	91.8	Very high	92.2	Very high	1 Å²	1	37 Å²	37	0%	0.004	20%	0.195	C	C	.	.	H	α-helix	trans	-60	-48.2	175.1	-178.5	-115.2	0	0	0	111.3	V136 L154 S196 A199 G201 Y202 F207 F208 R209 W280	V136-F205 HydrophobicContact CG1-CZ 4.25Å; L154-F205 HydrophobicContact CD1-CD1 3.82Å; L154-F205 HydrophobicContact CD1-CE1 3.51Å; L154-F205 HydrophobicContact CD2-CD1 4.45Å; L154-F205 HydrophobicContact CD2-CE1 3.83Å; L154-F205 HydrophobicContact CG-CE1 4.31Å; S196-F205 WeakPolarHBondContact O-CD2 3.13Å; A199-F205 HydrophobicContact CB-CB 3.99Å; A199-F205 HydrophobicContact CB-CD2 4.38Å; G201-F205 PolarHBondContact O-N 3.18Å; Y202-F205 WeakPolarHBondContact O-CB 3.29Å; Y202-F205 PolarHBondContact O-N 3.44Å; F205-F207 PolarHBondContact O-N 2.86Å; F205-F208 PolarHBondContact O-N 2.83Å; F205-R209 HydrophobicContact CE2-CG 4.23Å; F205-R209 HydrophobicContact CZ-CG 4.23Å; F205-R209 WeakPolarHBondContact O-CG 3.35Å; F205-R209 PolarHBondContact O-N 2.83Å; F205-W280 HydrophobicContact CD2-CH2 4.5Å; F205-W280 HydrophobicContact CE2-CH2 4.17Å; F205-W280 AromaticContact CE2-CZ3 3.83Å; F205-W280 HydrophobicContact CE2-CZ3 3.83Å; F205-W280 HydrophobicContact CZ-CH2 4.3Å; F205-W280 AromaticContact CZ-CZ3 3.86Å; F205-W280 HydrophobicContact CZ-CZ3 3.86Å
206	L	92.8	Very high	92.3	Very high	20 Å²	20	33.9 Å²	33.9	11%	0.105	18%	0.179	C	C	.	.	H	α-helix	trans	-57.9	-46.8	173.4	-74.9	171.7	0	0	0	112.8	M153 L154 I157 Y202 F208 R209 L210	M153-L206 HydrophobicContact CE-CD1 3.52Å; L154-L206 HydrophobicContact CB-CD2 4.13Å; L154-L206 HydrophobicContact CD1-CD2 3.7Å; I157-L206 HydrophobicContact CB-CD2 4.38Å; I157-L206 HydrophobicContact CG2-CD2 3.87Å; Y202-L206 HydrophobicContact CD1-CD1 4.01Å; Y202-L206 HydrophobicContact CD2-CD1 4.45Å; Y202-L206 HydrophobicContact CD2-CG 4.26Å; Y202-L206 HydrophobicContact CE1-CD1 3.48Å; Y202-L206 VanDerWaalsContact CE1-CD1 3.48Å; Y202-L206 HydrophobicContact CE1-CG 4.26Å; Y202-L206 HydrophobicContact CE2-CD1 3.96Å; Y202-L206 HydrophobicContact CE2-CD2 4.01Å; Y202-L206 HydrophobicContact CE2-CG 3.82Å; Y202-L206 HydrophobicContact CG-CD1 4.46Å; Y202-L206 VanDerWaalsContact CZ-CD1 3.44Å; Y202-L206 WeakPolarHBondContact O-CG 3.48Å; Y202-L206 PolarHBondContact O-N 2.81Å; L206-F208 PolarHBondContact O-N 3.35Å; L206-R209 PolarHBondContact O-N 3.42Å; L206-L210 PolarHBondContact O-N 3.36Å
207	F	95.1	Very high	92.3	Very high	111 Å²	111	33.9 Å²	33.9	49%	0.487	18%	0.179	S	C	.	.	H	α-helix	trans	-60.6	-45.9	-178.3	174.6	-104	0	0	0	111.9	G203 F204 F205 L210 I211	G203-F207 WeakPolarHBondContact O-CB 3.26Å; G203-F207 PolarHBondContact O-N 3.4Å; F204-F207 PolarHBondContact O-N 3.08Å; F205-F207 PolarHBondContact O-N 2.86Å; F207-L210 PolarHBondContact O-N 3.27Å; F207-I211 HydrophobicContact CD1-CD1 4.09Å; F207-I211 HydrophobicContact CD2-CD1 4.38Å; F207-I211 HydrophobicContact CE1-CD1 3.48Å; F207-I211 VanDerWaalsContact CE1-CD1 3.48Å; F207-I211 HydrophobicContact CE2-CD1 3.82Å; F207-I211 HydrophobicContact CZ-CD1 3.34Å; F207-I211 HydrophobicContact CZ-CG1 4.48Å; F207-I211 WeakPolarHBondContact O-CG1 3.3Å; F207-I211 PolarHBondContact O-N 3.01Å
208	F	95.4	Very high	92.2	Very high	40 Å²	40	33.9 Å²	33.9	18%	0.175	18%	0.179	C	C	.	.	H	α-helix	trans	-66.5	-37.6	176.8	-64.8	-36.5	0	0	0	112.1	F192 L195 A199 F204 F205 L206 I211 S212	F192-F208 AromaticContact CD1-CD1 3.66Å; F192-F208 HydrophobicContact CD1-CD1 3.66Å; F192-F208 HydrophobicContact CD1-CE1 4.34Å; F192-F208 HydrophobicContact CD1-CG 4.44Å; F192-F208 HydrophobicContact CE1-CD1 4.02Å; F192-F208 HydrophobicContact CE1-CE1 4.32Å; L195-F208 HydrophobicContact CB-CD1 4.49Å; L195-F208 HydrophobicContact CB-CD2 4.18Å; L195-F208 HydrophobicContact CB-CE2 4.2Å; L195-F208 HydrophobicContact CB-CG 4.33Å; L195-F208 HydrophobicContact CB-CZ 4.35Å; L195-F208 HydrophobicContact CD1-CE1 4.48Å; A199-F208 HydrophobicContact CB-CD2 3.93Å; A199-F208 HydrophobicContact CB-CE2 4.15Å; F204-F208 HydrophobicContact CB-CE2 4.45Å; F204-F208 VanDerWaalsContact O-CD2 3.27Å; F204-F208 WeakPolarHBondContact O-CD2 3.45Å; F204-F208 WeakPolarHBondContact O-CG 3.11Å; F204-F208 PolarHBondContact O-N 2.83Å; F205-F208 PolarHBondContact O-N 2.83Å; L206-F208 PolarHBondContact O-N 3.35Å; F208-I211 PolarHBondContact O-N 2.95Å; F208-S212 WeakPolarHBondContact O-CB 3.35Å; F208-S212 PolarHBondContact O-N 2.87Å
209	R	93.3	Very high	92.5	Very high	2 Å²	2	29.8 Å²	29.8	1%	0.008	16%	0.161	C	C	.	.	H	α-helix	trans	-66.5	-36.2	175.2	-72.2	-56	-178.6	97	3.8	113.6	V158 S196 F205 L206 S212 G213	V158-R209 HydrophobicContact CG2-CB 4.11Å; S196-R209 PolarHBondContact OG-NE 3.46Å; F205-R209 HydrophobicContact CE2-CG 4.23Å; F205-R209 HydrophobicContact CZ-CG 4.23Å; F205-R209 WeakPolarHBondContact O-CG 3.35Å; F205-R209 PolarHBondContact O-N 2.83Å; L206-R209 PolarHBondContact O-N 3.42Å; R209-S212 PolarHBondContact O-N 2.89Å; R209-G213 PolarHBondContact O-N 2.83Å
210	L	95.6	Very high	92.7	Very high	45 Å²	45	29.8 Å²	29.8	24%	0.236	16%	0.16	C	C	.	.	H	α-helix	trans	-59.3	-48.6	172.2	179.4	64.2	0	0	0	111	I157 L160 L206 F207 G213 I214	I157-L210 HydrophobicContact CD1-CB 4.5Å; I157-L210 HydrophobicContact CD1-CD1 3.98Å; I157-L210 HydrophobicContact CD1-CD2 4.46Å; I157-L210 HydrophobicContact CG1-CB 3.91Å; I157-L210 HydrophobicContact CG1-CD1 3.97Å; I157-L210 HydrophobicContact CG1-CG 4.41Å; L160-L210 HydrophobicContact CD2-CD1 4.39Å; L206-L210 PolarHBondContact O-N 3.36Å; F207-L210 PolarHBondContact O-N 3.27Å; L210-G213 PolarHBondContact O-N 3.12Å; L210-I214 HydrophobicContact CG-CD1 4.4Å; L210-I214 WeakPolarHBondContact O-CG1 3.38Å; L210-I214 PolarHBondContact O-N 3.05Å
211	I	96.5	Very high	93.1	Very high	32 Å²	32	26.6 Å²	26.6	16%	0.164	15%	0.145	C	C	.	.	H	α-helix	trans	-68.8	-38.6	-178.7	-60.8	171.5	0	0	0	111.6	I188 F192 F207 F208 G213 I214 G215	I188-I211 HydrophobicContact CG2-CG2 3.88Å; F192-I211 HydrophobicContact CB-CB 4.37Å; F192-I211 HydrophobicContact CB-CG2 4.31Å; F192-I211 HydrophobicContact CD1-CB 3.94Å; F192-I211 HydrophobicContact CD1-CD1 4.05Å; F192-I211 HydrophobicContact CD1-CG2 3.89Å; F192-I211 HydrophobicContact CD2-CB 4.21Å; F192-I211 HydrophobicContact CD2-CG2 3.34Å; F192-I211 HydrophobicContact CE1-CB 4.24Å; F192-I211 HydrophobicContact CE1-CD1 3.62Å; F192-I211 HydrophobicContact CE1-CG2 3.99Å; F192-I211 HydrophobicContact CE2-CG2 3.46Å; F192-I211 VanDerWaalsContact CE2-CG2 3.46Å; F192-I211 HydrophobicContact CG-CB 3.9Å; F192-I211 HydrophobicContact CG-CG2 3.57Å; F192-I211 HydrophobicContact CZ-CD1 4.02Å; F192-I211 HydrophobicContact CZ-CG2 3.78Å; F207-I211 HydrophobicContact CD1-CD1 4.09Å; F207-I211 HydrophobicContact CD2-CD1 4.38Å; F207-I211 HydrophobicContact CE1-CD1 3.48Å; F207-I211 VanDerWaalsContact CE1-CD1 3.48Å; F207-I211 HydrophobicContact CE2-CD1 3.82Å; F207-I211 HydrophobicContact CZ-CD1 3.34Å; F207-I211 HydrophobicContact CZ-CG1 4.48Å; F207-I211 WeakPolarHBondContact O-CG1 3.3Å; F207-I211 PolarHBondContact O-N 3.01Å; F208-I211 PolarHBondContact O-N 2.95Å; I211-G213 VanDerWaalsContact C-N 3.31Å; I211-G213 PolarHBondContact O-N 3.3Å; I211-I214 WeakPolarHBondContact O-CB 3.37Å; I211-I214 PolarHBondContact O-N 3.03Å; I211-G215 PolarHBondContact O-N 3.37Å
212	S	95.3	Very high	93.6	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-57.2	-47.2	172	-147	0	0	0	0	110.8	N189 A193 F208 R209 I214 G215 I216	N189-S212 PolarHBondContact O-OG 2.7Å; N189-S212 PolarHBondContact OD1-O 2.93Å; N189-S212 VanDerWaalsContact OD1-O 3.08Å; N189-S212 PolarHBondContact OD1-OG 3.01Å; A193-S212 PolarHBondContact N-OG 2.94Å; F208-S212 WeakPolarHBondContact O-CB 3.35Å; F208-S212 PolarHBondContact O-N 2.87Å; R209-S212 PolarHBondContact O-N 2.89Å; S212-I214 VanDerWaalsContact C-N 3.33Å; S212-I214 PolarHBondContact O-N 3.26Å; S212-G215 WeakPolarHBondContact O-CA 3.29Å; S212-G215 PolarHBondContact O-N 2.97Å; S212-I216 PolarHBondContact O-N 3.32Å
213	G	95	Very high	93.9	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.01	12%	0.124	C	C	.	.	H	α-helix	trans	-55.7	-43	173.6	0	0	0	0	0	113.2	G161 M162 R209 L210 I211 G215 I216 G217	G161-G213 CarbonylContact C-O 3.44Å; M162-G213 VanDerWaalsContact CA-O 3.31Å; M162-G213 WeakPolarHBondContact CA-O 3.33Å; M162-G213 PolarHBondContact N-O 3.37Å; R209-G213 PolarHBondContact O-N 2.83Å; L210-G213 PolarHBondContact O-N 3.12Å; I211-G213 VanDerWaalsContact C-N 3.31Å; I211-G213 PolarHBondContact O-N 3.3Å; G213-G215 VanDerWaalsContact C-N 3.31Å; G213-G215 PolarHBondContact O-N 3.34Å; G213-I216 PolarHBondContact O-N 2.89Å; G213-G217 PolarHBondContact O-N 2.94Å
214	I	96.6	Very high	94.1	Very high	44 Å²	44	21.2 Å²	21.2	23%	0.226	10%	0.099	C	C	.	.	H	α-helix	trans	-62.5	-39	174.9	-66	167.7	0	0	0	111.2	G161 V164 G165 W169 L210 I211 S212	G161-I214 VanDerWaalsContact O-CA 3.29Å; G161-I214 WeakPolarHBondContact O-CA 3.46Å; G161-I214 WeakPolarHBondContact O-CG1 3.4Å; G161-I214 PolarHBondContact O-N 3.29Å; V164-I214 HydrophobicContact CB-CG1 4.32Å; V164-I214 HydrophobicContact CG1-CD1 4.45Å; V164-I214 HydrophobicContact CG1-CG1 4.35Å; G165-I214 WeakPolarHBondContact CA-O 3.26Å; W169-I214 PolarHBondContact NE1-O 3.38Å; L210-I214 HydrophobicContact CG-CD1 4.4Å; L210-I214 WeakPolarHBondContact O-CG1 3.38Å; L210-I214 PolarHBondContact O-N 3.05Å; I211-I214 WeakPolarHBondContact O-CB 3.37Å; I211-I214 PolarHBondContact O-N 3.03Å; S212-I214 VanDerWaalsContact C-N 3.33Å; S212-I214 PolarHBondContact O-N 3.26Å
215	G	95.1	Very high	94.1	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-62	-56.7	174.1	0	0	0	0	0	111.6	A185 I211 S212 G213 G217	A185-G215 VanDerWaalsContact CB-O 3.3Å; A185-G215 WeakPolarHBondContact CB-O 3.34Å; A185-G215 CarbonylContact O-C 3.33Å; A185-G215 WeakPolarHBondContact O-CA 3.2Å; I211-G215 PolarHBondContact O-N 3.37Å; S212-G215 WeakPolarHBondContact O-CA 3.29Å; S212-G215 PolarHBondContact O-N 2.97Å; G213-G215 VanDerWaalsContact C-N 3.31Å; G213-G215 PolarHBondContact O-N 3.34Å; G215-G217 PolarHBondContact O-N 3.36Å
216	I	94.2	Very high	94.2	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-73.3	-28.3	-171.5	-158.6	63	0	0	0	113.9	A125 D126 E129 M162 L186 N189 S212 G213 G218 S219	A125-I216 HydrophobicContact CB-CD1 4.33Å; D126-I216 HydrophobicContact CB-CD1 4.26Å; D126-I216 HydrophobicContact CB-CG1 3.96Å; E129-I216 HydrophobicContact CB-CG1 4.4Å; E129-I216 HydrophobicContact CB-CG2 4.2Å; E129-I216 HydrophobicContact CG-CB 4.4Å; E129-I216 HydrophobicContact CG-CG1 4.11Å; E129-I216 HydrophobicContact CG-CG2 4.31Å; M162-I216 HydrophobicContact CE-CG2 3.57Å; M162-I216 HydrophobicContact CG-CG2 3.98Å; L186-I216 HydrophobicContact CD2-CD1 3.87Å; N189-I216 HydrophobicContact CB-CB 4.25Å; N189-I216 HydrophobicContact CB-CD1 4.45Å; S212-I216 PolarHBondContact O-N 3.32Å; G213-I216 PolarHBondContact O-N 2.89Å; I216-G218 PolarHBondContact O-N 3.21Å; I216-S219 WeakPolarHBondContact O-CB 3.47Å; I216-S219 PolarHBondContact O-N 3.13Å; I216-S219 PolarHBondContact O-OG 2.99Å
217	G	92.4	Very high	94.3	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-21.1	-177.8	0	0	0	0	0	115.1	A166 G213 G215	A166-G217 VanDerWaalsContact CA-O 3.29Å; A166-G217 WeakPolarHBondContact CA-O 3.34Å; A166-G217 WeakPolarHBondContact CB-O 3.47Å; G213-G217 PolarHBondContact O-N 2.94Å; G215-G217 PolarHBondContact O-N 3.36Å
218	G	89.6	Confident	94.1	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	4%	0.041	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-14.3	173.2	0	0	0	0	0	115.5	W169 I216 P221 I222	W169-G218 VanDerWaalsContact CB-CA 3.44Å; I216-G218 PolarHBondContact O-N 3.21Å; G218-P221 WeakPolarHBondContact O-CD 3.42Å; G218-P221 WeakPolarHBondContact O-CG 3.26Å; G218-I222 WeakPolarHBondContact O-CB 3.5Å; G218-I222 VanDerWaalsContact O-CD1 3.26Å; G218-I222 WeakPolarHBondContact O-CD1 3.48Å; G218-I222 WeakPolarHBondContact O-CG1 3.35Å; G218-I222 PolarHBondContact O-N 3.48Å
219	S	93.9	Very high	93.8	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-65.5	-50.8	-170.2	65.8	0	0	0	0	112	D126 I216 I222 V223	D126-S219 WeakPolarHBondContact CB-OG 3.08Å; D126-S219 PolarHBondContact OD1-OG 3.03Å; I216-S219 WeakPolarHBondContact O-CB 3.47Å; I216-S219 PolarHBondContact O-N 3.13Å; I216-S219 PolarHBondContact O-OG 2.99Å; S219-I222 PolarHBondContact O-N 2.87Å; S219-V223 VanDerWaalsContact O-CB 3.28Å; S219-V223 WeakPolarHBondContact O-CB 3.34Å; S219-V223 WeakPolarHBondContact O-CG2 3.2Å; S219-V223 PolarHBondContact O-N 3.22Å
220	V	93	Very high	93.6	Very high	6 Å²	6	6.4 Å²	6.4	4%	0.036	3%	0.033	C	C	.	.	H	α-helix	trans	-52.8	-62.3	179.4	179.4	0	0	0	0	112.1	L123 D126 I222 V223 Y224 F632	L123-V220 HydrophobicContact CD2-CB 4.38Å; L123-V220 HydrophobicContact CD2-CG2 3.91Å; D126-V220 HydrophobicContact CB-CG2 4.5Å; V220-I222 PolarHBondContact O-N 3.2Å; V220-I222 VanDerWaalsContact O-N 3.13Å; V220-V223 PolarHBondContact O-N 3.3Å; V220-Y224 HydrophobicContact CG1-CD2 3.83Å; V220-Y224 HydrophobicContact CG1-CE2 3.87Å; V220-Y224 VanDerWaalsContact O-CD2 3.28Å; V220-Y224 WeakPolarHBondContact O-CD2 3.44Å; V220-Y224 PolarHBondContact O-N 3.2Å; V220-Y224 VanDerWaalsContact O-N 3.14Å; V220-F632 HydrophobicContact CG1-CE1 3.79Å; V220-F632 HydrophobicContact CG1-CZ 3.92Å
221	P	94.1	Very high	93.2	Very high	0 Å²	0	4.3 Å²	4.3	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-60.3	-33.3	-175.4	23.9	-34.8	0	0	0	113	G218 S225 F632	G218-P221 WeakPolarHBondContact O-CD 3.42Å; G218-P221 WeakPolarHBondContact O-CG 3.26Å; P221-S225 VanDerWaalsContact O-CB 3.3Å; P221-S225 WeakPolarHBondContact O-CB 3.46Å; P221-S225 PolarHBondContact O-N 3.32Å; P221-S225 PolarHBondContact O-OG 3.4Å; P221-F632 HydrophobicContact CB-CB 3.71Å; P221-F632 HydrophobicContact CB-CD1 3.77Å; P221-F632 HydrophobicContact CB-CG 3.79Å
222	I	94.9	Very high	92.4	Very high	0 Å²	0	3.6 Å²	3.6	0%	0	2%	0.019	C	C	.	.	H	α-helix	trans	-74	-46.8	179.7	-62.3	173.9	0	0	0	111.1	W169 A173 R178 C181 L182 G218 S219 V220 Y224 S225 Y226	W169-I222 HydrophobicContact CB-CD1 3.99Å; A173-I222 HydrophobicContact CB-CD1 3.96Å; A173-I222 HydrophobicContact CB-CG1 3.61Å; R178-I222 HydrophobicContact CB-CG2 4.29Å; R178-I222 WeakPolarHBondContact O-CG2 3.47Å; C181-I222 HydrophobicContact CB-CD1 3.71Å; L182-I222 HydrophobicContact CB-CG2 3.81Å; L182-I222 HydrophobicContact CD1-CB 4.41Å; L182-I222 HydrophobicContact CD1-CG2 4.34Å; L182-I222 HydrophobicContact CG-CG2 4.44Å; G218-I222 WeakPolarHBondContact O-CB 3.5Å; G218-I222 VanDerWaalsContact O-CD1 3.26Å; G218-I222 WeakPolarHBondContact O-CD1 3.48Å; G218-I222 WeakPolarHBondContact O-CG1 3.35Å; G218-I222 PolarHBondContact O-N 3.48Å; S219-I222 PolarHBondContact O-N 2.87Å; V220-I222 PolarHBondContact O-N 3.2Å; V220-I222 VanDerWaalsContact O-N 3.13Å; I222-Y224 PolarHBondContact O-N 3.11Å; I222-S225 PolarHBondContact O-N 3.4Å; I222-Y226 WeakPolarHBondContact O-CB 3.46Å; I222-Y226 PolarHBondContact O-N 2.95Å
223	V	95.8	Very high	91.3	Very high	0 Å²	0	4 Å²	4	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-59.2	-48.4	-178.5	162.5	0	0	0	0	110.8	L119 A122 L123 L182 S219 V220 Y226 F227 L243	L119-V223 HydrophobicContact CB-CG1 3.85Å; L119-V223 HydrophobicContact CD2-CG2 4.21Å; A122-V223 HydrophobicContact CB-CG2 3.88Å; L123-V223 HydrophobicContact CD1-CG1 3.68Å; L123-V223 HydrophobicContact CD2-CB 4.33Å; L123-V223 HydrophobicContact CD2-CG1 4.2Å; L123-V223 HydrophobicContact CG-CB 4.34Å; L123-V223 HydrophobicContact CG-CG1 3.78Å; L182-V223 HydrophobicContact CD1-CG2 3.97Å; L182-V223 HydrophobicContact CD2-CG2 3.86Å; S219-V223 VanDerWaalsContact O-CB 3.28Å; S219-V223 WeakPolarHBondContact O-CB 3.34Å; S219-V223 WeakPolarHBondContact O-CG2 3.2Å; S219-V223 PolarHBondContact O-N 3.22Å; V220-V223 PolarHBondContact O-N 3.3Å; V223-Y226 PolarHBondContact O-N 3.11Å; V223-F227 WeakPolarHBondContact O-CB 3.44Å; V223-F227 PolarHBondContact O-N 3.32Å; V223-L243 HydrophobicContact CG1-CD2 3.67Å
224	Y	93.8	Very high	90.1	Very high	2 Å²	2	7 Å²	7	1%	0.008	4%	0.036	C	C	.	.	H	α-helix	trans	-66	-42.4	180	-83.5	-84.7	0	0	0	112.4	L123 V220 I222 S228 L240 L243 C244 E616 V620 F632	L123-Y224 HydrophobicContact CD1-CE2 4.11Å; L123-Y224 HydrophobicContact CD2-CE2 4.06Å; V220-Y224 HydrophobicContact CG1-CD2 3.83Å; V220-Y224 HydrophobicContact CG1-CE2 3.87Å; V220-Y224 VanDerWaalsContact O-CD2 3.28Å; V220-Y224 WeakPolarHBondContact O-CD2 3.44Å; V220-Y224 PolarHBondContact O-N 3.2Å; V220-Y224 VanDerWaalsContact O-N 3.14Å; I222-Y224 PolarHBondContact O-N 3.11Å; Y224-S228 VanDerWaalsContact O-CB 3.3Å; Y224-S228 WeakPolarHBondContact O-CB 3.42Å; Y224-S228 PolarHBondContact O-N 3.39Å; Y224-S228 VanDerWaalsContact O-N 3.08Å; Y224-S228 PolarHBondContact O-OG 3.04Å; Y224-L240 HydrophobicContact CD1-CD2 3.86Å; Y224-L240 HydrophobicContact CE1-CD2 4.48Å; Y224-L243 HydrophobicContact CE1-CD2 4.46Å; Y224-C244 WeakPolarHBondContact OH-CA 3.38Å; Y224-C244 PolarHBondContact OH-SG 3.12Å; Y224-E616 HydrophobicContact CD1-CB 4.41Å; Y224-E616 HydrophobicContact CE1-CB 3.99Å; Y224-E616 PolarHBondContact OH-OE2 3.21Å; Y224-V620 HydrophobicContact CD1-CG2 4.34Å; Y224-V620 HydrophobicContact CG-CG2 4.35Å; Y224-F632 HydrophobicContact CD2-CE2 4.12Å; Y224-F632 HydrophobicContact CD2-CZ 4Å; Y224-F632 AromaticContact CG-CE2 3.84Å; Y224-F632 HydrophobicContact CG-CE2 3.84Å; Y224-F632 HydrophobicContact CG-CZ 4.17Å
225	S	92.5	Very high	89.1	Confident	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-64	-43.2	175.8	-58.3	0	0	0	0	111.1	P221 I222 S228 E229	P221-S225 VanDerWaalsContact O-CB 3.3Å; P221-S225 WeakPolarHBondContact O-CB 3.46Å; P221-S225 PolarHBondContact O-N 3.32Å; P221-S225 PolarHBondContact O-OG 3.4Å; I222-S225 PolarHBondContact O-N 3.4Å; S225-S228 PolarHBondContact O-OG 3.25Å; S225-E229 WeakPolarHBondContact O-CG 3.41Å; S225-E229 PolarHBondContact O-N 3.27Å
226	Y	94.3	Very high	88.6	Confident	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-67.7	-45.4	-179.1	-175.9	-132	0	0	0	112.1	L115 L119 R178 R179 I222 V223 E229 F230 L298 P302	L115-Y226 HydrophobicContact CD1-CD1 4.32Å; L115-Y226 HydrophobicContact CD1-CE1 3.55Å; L119-Y226 HydrophobicContact CD1-CD1 3.58Å; L119-Y226 HydrophobicContact CD1-CE1 4.11Å; L119-Y226 HydrophobicContact CD1-CG 4.49Å; L119-Y226 HydrophobicContact CD2-CD1 3.54Å; L119-Y226 HydrophobicContact CD2-CE1 3.84Å; L119-Y226 HydrophobicContact CG-CD1 4.13Å; L119-Y226 HydrophobicContact CG-CE1 4.4Å; R178-Y226 HydrophobicContact CB-CD2 3.69Å; R178-Y226 HydrophobicContact CB-CG 4.05Å; R179-Y226 HydrophobicContact CB-CE2 4.41Å; I222-Y226 WeakPolarHBondContact O-CB 3.46Å; I222-Y226 PolarHBondContact O-N 2.95Å; V223-Y226 PolarHBondContact O-N 3.11Å; Y226-E229 PolarHBondContact O-N 3.49Å; Y226-F230 AromaticContact CD2-CE2 3.96Å; Y226-F230 HydrophobicContact CD2-CE2 3.96Å; Y226-F230 HydrophobicContact CE2-CD2 4.38Å; Y226-F230 AromaticContact CE2-CE2 3.49Å; Y226-F230 HydrophobicContact CE2-CE2 3.49Å; Y226-F230 VanDerWaalsContact CE2-CE2 3.49Å; Y226-F230 HydrophobicContact CE2-CZ 4.31Å; Y226-F230 AromaticContact CZ-CE2 3.99Å; Y226-F230 WeakPolarHBondContact O-CD2 3.41Å; Y226-L298 HydrophobicContact CE1-CD2 4.41Å; Y226-P302 PolarHBondContact OH-O 3.42Å
227	F	93.9	Very high	87.9	Confident	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-67.9	-40.5	-179.6	-168.2	-134.6	0	0	0	112.2	L115 F116 L119 V223 E229 F230 L231 H239 L240 L243	L115-F227 HydrophobicContact CD2-CD2 3.98Å; L115-F227 HydrophobicContact CG-CD2 4.11Å; F116-F227 HydrophobicContact CB-CE2 3.93Å; F116-F227 HydrophobicContact CB-CZ 3.78Å; F116-F227 AromaticContact CD2-CE1 3.75Å; F116-F227 HydrophobicContact CD2-CE1 3.75Å; F116-F227 HydrophobicContact CD2-CE2 4.47Å; F116-F227 AromaticContact CD2-CZ 3.61Å; F116-F227 HydrophobicContact CD2-CZ 3.61Å; F116-F227 HydrophobicContact CE2-CE1 4.49Å; F116-F227 HydrophobicContact CG-CZ 4.16Å; L119-F227 HydrophobicContact CD1-CB 3.66Å; L119-F227 HydrophobicContact CD1-CD2 4.05Å; L119-F227 HydrophobicContact CD1-CG 4.16Å; V223-F227 WeakPolarHBondContact O-CB 3.44Å; V223-F227 PolarHBondContact O-N 3.32Å; F227-E229 PolarHBondContact O-N 3.47Å; F227-F230 PolarHBondContact O-N 3.21Å; F227-F230 VanDerWaalsContact O-N 3.08Å; F227-L231 HydrophobicContact CD1-CD1 3.55Å; F227-L231 HydrophobicContact CD1-CG 4.28Å; F227-L231 HydrophobicContact CD2-CG 4.5Å; F227-L231 HydrophobicContact CE1-CD1 3.53Å; F227-L231 HydrophobicContact CE1-CD2 4.17Å; F227-L231 HydrophobicContact CE1-CG 4.15Å; F227-L231 HydrophobicContact CE2-CD2 4.21Å; F227-L231 HydrophobicContact CE2-CG 4.33Å; F227-L231 HydrophobicContact CG-CD1 4.11Å; F227-L231 HydrophobicContact CG-CG 4.47Å; F227-L231 HydrophobicContact CZ-CD1 4.03Å; F227-L231 HydrophobicContact CZ-CD2 3.83Å; F227-L231 HydrophobicContact CZ-CG 4.14Å; F227-L231 WeakPolarHBondContact O-CG 3.19Å; F227-L231 PolarHBondContact O-N 3.02Å; F227-H239 HydrophobicContact CE1-CB 3.91Å; F227-H239 HydrophobicContact CZ-CB 4.22Å; F227-L240 HydrophobicContact CB-CD2 4.31Å; F227-L240 HydrophobicContact CD1-CD2 3.76Å; F227-L240 HydrophobicContact CG-CD2 4.49Å; F227-L243 HydrophobicContact CB-CD2 4.26Å; F227-L243 HydrophobicContact CD1-CD2 3.79Å; F227-L243 HydrophobicContact CE1-CD2 4.5Å; F227-L243 HydrophobicContact CG-CD2 4.29Å
228	S	90.8	Very high	87.5	Confident	1 Å²	1	11.9 Å²	11.9	1%	0.007	6%	0.057	C	C	.	.	H	α-helix	trans	-62.6	-28.2	179.4	63.9	0	0	0	0	114.2	Y224 S225 F230 L231 V620 R628	Y224-S228 VanDerWaalsContact O-CB 3.3Å; Y224-S228 WeakPolarHBondContact O-CB 3.42Å; Y224-S228 PolarHBondContact O-N 3.39Å; Y224-S228 VanDerWaalsContact O-N 3.08Å; Y224-S228 PolarHBondContact O-OG 3.04Å; S225-S228 PolarHBondContact O-OG 3.25Å; S228-F230 VanDerWaalsContact C-N 3.26Å; S228-F230 PolarHBondContact O-N 2.95Å; S228-L231 PolarHBondContact O-N 3.43Å; S228-V620 WeakPolarHBondContact OG-CG1 3.44Å; S228-R628 PolarHBondContact OG-NH1 2.98Å
229	E	89.6	Confident	87.5	Confident	2 Å²	2	12.4 Å²	12.4	1%	0.009	6%	0.059	C	C	.	.	H	α-helix	trans	-72	-18.7	177.2	-70.3	173.8	-148.1	0	0	112.7	Y99 R178 S225 Y226 F227 S304 R306 R628	Y99-E229 PolarHBondContact OH-O 3.48Å; R178-E229 IonicContact CZ-OE1 3.26Å; R178-E229 VanDerWaalsContact CZ-OE1 3.26Å; R178-E229 IonicContact CZ-OE2 3.76Å; R178-E229 IonicContact NE-OE1 3.48Å; R178-E229 PolarHBondContact NE-OE1 3.43Å; R178-E229 IonicContact NH1-OE1 2.94Å; R178-E229 PolarHBondContact NH1-OE1 2.95Å; R178-E229 VanDerWaalsContact NH1-OE1 3.1Å; R178-E229 IonicContact NH1-OE2 3.19Å; R178-E229 PolarHBondContact NH1-OE2 3.19Å; R178-E229 IonicContact NH2-OE1 2.59Å; S225-E229 WeakPolarHBondContact O-CG 3.41Å; S225-E229 PolarHBondContact O-N 3.27Å; Y226-E229 PolarHBondContact O-N 3.49Å; F227-E229 PolarHBondContact O-N 3.47Å; E229-S304 WeakPolarHBondContact CB-OG 3.4Å; E229-S304 WeakPolarHBondContact OE2-CB 3.38Å; E229-S304 PolarHBondContact OE2-OG 3.14Å; E229-R306 HydrophobicContact CB-CB 4.38Å; E229-R306 HydrophobicContact CG-CB 4.25Å; E229-R628 IonicContact OE1-NH1 3.98Å
230	F	89.4	Confident	87.3	Confident	1 Å²	1	12.4 Å²	12.4	0%	0.004	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102	0.3	175.3	-72.5	-83.3	0	0	0	114.1	M103 F111 L115 Y226 F227 S228 P302 P305 I320 V324	M103-F230 VanDerWaalsContact CE-C 3.42Å; M103-F230 WeakPolarHBondContact CE-O 3.46Å; F111-F230 HydrophobicContact CD1-CD1 4.43Å; F111-F230 AromaticContact CE1-CD1 3.61Å; F111-F230 HydrophobicContact CE1-CD1 3.61Å; F111-F230 AromaticContact CE1-CE1 3.7Å; F111-F230 HydrophobicContact CE1-CE1 3.7Å; F111-F230 HydrophobicContact CE1-CG 4.26Å; F111-F230 HydrophobicContact CE1-CZ 4.43Å; F111-F230 HydrophobicContact CZ-CD1 4.4Å; F111-F230 HydrophobicContact CZ-CE1 4.03Å; L115-F230 HydrophobicContact CD2-CB 3.82Å; L115-F230 HydrophobicContact CD2-CD2 3.47Å; L115-F230 VanDerWaalsContact CD2-CD2 3.47Å; L115-F230 HydrophobicContact CD2-CE2 4.12Å; L115-F230 HydrophobicContact CD2-CG 3.7Å; Y226-F230 AromaticContact CD2-CE2 3.96Å; Y226-F230 HydrophobicContact CD2-CE2 3.96Å; Y226-F230 HydrophobicContact CE2-CD2 4.38Å; Y226-F230 AromaticContact CE2-CE2 3.49Å; Y226-F230 HydrophobicContact CE2-CE2 3.49Å; Y226-F230 VanDerWaalsContact CE2-CE2 3.49Å; Y226-F230 HydrophobicContact CE2-CZ 4.31Å; Y226-F230 AromaticContact CZ-CE2 3.99Å; Y226-F230 WeakPolarHBondContact O-CD2 3.41Å; F227-F230 PolarHBondContact O-N 3.21Å; F227-F230 VanDerWaalsContact O-N 3.08Å; S228-F230 VanDerWaalsContact C-N 3.26Å; S228-F230 PolarHBondContact O-N 2.95Å; F230-P302 HydrophobicContact CZ-CG 4.38Å; F230-P305 VanDerWaalsContact CE1-CD 3.41Å; F230-P305 HydrophobicContact CE1-CG 3.99Å; F230-P305 HydrophobicContact CZ-CG 4.32Å; F230-I320 HydrophobicContact CE1-CG2 4.17Å; F230-I320 HydrophobicContact CZ-CG2 4.48Å; F230-V324 HydrophobicContact CD1-CG2 4.27Å; F230-V324 HydrophobicContact CE1-CG2 4.11Å
231	L	87.3	Confident	87.1	Confident	2 Å²	2	12.1 Å²	12.1	1%	0.01	6%	0.057	C	C	.	.	S	Bend	trans	-98.3	147.2	-179.5	-74.2	172.8	0	0	0	111.5	F227 S228 R236 H239 L240	F227-L231 HydrophobicContact CD1-CD1 3.55Å; F227-L231 HydrophobicContact CD1-CG 4.28Å; F227-L231 HydrophobicContact CD2-CG 4.5Å; F227-L231 HydrophobicContact CE1-CD1 3.53Å; F227-L231 HydrophobicContact CE1-CD2 4.17Å; F227-L231 HydrophobicContact CE1-CG 4.15Å; F227-L231 HydrophobicContact CE2-CD2 4.21Å; F227-L231 HydrophobicContact CE2-CG 4.33Å; F227-L231 HydrophobicContact CG-CD1 4.11Å; F227-L231 HydrophobicContact CG-CG 4.47Å; F227-L231 HydrophobicContact CZ-CD1 4.03Å; F227-L231 HydrophobicContact CZ-CD2 3.83Å; F227-L231 HydrophobicContact CZ-CG 4.14Å; F227-L231 WeakPolarHBondContact O-CG 3.19Å; F227-L231 PolarHBondContact O-N 3.02Å; S228-L231 PolarHBondContact O-N 3.43Å; L231-R236 HydrophobicContact CB-CB 4.16Å; L231-R236 HydrophobicContact CB-CG 4.05Å; L231-R236 HydrophobicContact CD1-CG 4.11Å; L231-H239 HydrophobicContact CD1-CB 3.94Å; L231-H239 HydrophobicContact CD2-CB 3.83Å; L231-L240 HydrophobicContact CD1-CD2 4.17Å; L231-L240 HydrophobicContact CD1-CG 3.9Å
232	Q	79.8	Confident	87	Confident	17 Å²	17	14.7 Å²	14.7	8%	0.079	7%	0.067	C	C	.	.			trans	-80.1	145.8	173.1	-56	-176.3	-46.8	0	0	110.1	M103 E104 D234 K235 R236	M103-Q232 PolarHBondContact O-NE2 2.84Å; E104-Q232 VanDerWaalsContact CA-NE2 3.3Å; E104-Q232 PolarHBondContact O-NE2 3.37Å; E104-Q232 VanDerWaalsContact O-NE2 3.1Å; Q232-D234 VanDerWaalsContact C-N 3.31Å; Q232-D234 PolarHBondContact O-N 3.27Å; Q232-K235 PolarHBondContact O-N 2.91Å; Q232-R236 WeakPolarHBondContact O-CB 3.44Å; Q232-R236 PolarHBondContact O-N 3.43Å
233	M	70.6	Confident	86.8	Confident	9 Å²	9	14.7 Å²	14.7	4%	0.044	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.8	-47.6	-176.5	-165.4	-176.2	85.4	0	0	113.9	R79 K235 R236 E684 I686	R79-M233 VanDerWaalsContact NH2-CE 3.27Å; M233-K235 PolarHBondContact O-N 3.22Å; M233-R236 PolarHBondContact O-N 3.33Å; M233-E684 HydrophobicContact CE-CB 4.41Å; M233-I686 HydrophobicContact SD-CG1 4.13Å
234	D	69.9	Low	86.5	Confident	63 Å²	63	14.9 Å²	14.9	34%	0.337	7%	0.068	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-44	-171.9	-62.8	-24.2	0	0	0	113.1	Q232 E566	Q232-D234 VanDerWaalsContact C-N 3.31Å; Q232-D234 PolarHBondContact O-N 3.27Å; D234-E566 VanDerWaalsContact O-OE1 3.12Å
235	K	76.1	Confident	86.3	Confident	99 Å²	99	16.6 Å²	16.6	43%	0.43	8%	0.077	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	0.8	-174.4	-59.6	-168	173.2	-164.1	0	114	Q232 M233 G237 E238 H239 E566	Q232-K235 PolarHBondContact O-N 2.91Å; M233-K235 PolarHBondContact O-N 3.22Å; K235-G237 PolarHBondContact O-N 3.19Å; K235-E238 PolarHBondContact O-N 3.13Å; K235-H239 PolarHBondContact O-CD2 3.19Å; K235-H239 PolarHBondContact O-N 3.28Å; K235-H239 VanDerWaalsContact O-N 3.1Å; K235-E566 WeakPolarHBondContact CA-OE1 3.48Å
236	R	83.8	Confident	86.3	Confident	1 Å²	1	18.2 Å²	18.2	0%	0.004	8%	0.084	C	C	.	.	H	α-helix	trans	-59.7	-50	-171.3	-179.3	176.9	64.1	-142.2	2	111.6	L231 Q232 M233 E238 H239 L240 E621 K685 L687	L231-R236 HydrophobicContact CB-CB 4.16Å; L231-R236 HydrophobicContact CB-CG 4.05Å; L231-R236 HydrophobicContact CD1-CG 4.11Å; Q232-R236 WeakPolarHBondContact O-CB 3.44Å; Q232-R236 PolarHBondContact O-N 3.43Å; M233-R236 PolarHBondContact O-N 3.33Å; R236-E238 PolarHBondContact O-N 3.22Å; R236-H239 PolarHBondContact O-N 2.9Å; R236-L240 HydrophobicContact CG-CD1 3.63Å; R236-L240 HydrophobicContact CG-CG 4.31Å; R236-L240 WeakPolarHBondContact O-CB 3.46Å; R236-L240 VanDerWaalsContact O-CG 3.26Å; R236-L240 WeakPolarHBondContact O-CG 3.22Å; R236-L240 PolarHBondContact O-N 3.32Å; R236-E621 IonicContact CZ-OE1 3.2Å; R236-E621 VanDerWaalsContact CZ-OE1 3.27Å; R236-E621 IonicContact NE-OE1 2.74Å; R236-E621 PolarHBondContact NE-OE1 2.98Å; R236-E621 VanDerWaalsContact NH2-CD 3.27Å; R236-E621 IonicContact NH2-OE1 2.79Å; R236-E621 PolarHBondContact NH2-OE1 2.98Å; R236-K685 PolarHBondContact NH2-O 2.84Å; R236-L687 VanDerWaalsContact NH1-CD1 3.31Å
237	G	79.8	Confident	86.2	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-65.6	-37.7	-177.5	0	0	0	0	0	113.3	K235 S241	K235-G237 PolarHBondContact O-N 3.19Å; G237-S241 WeakPolarHBondContact O-CB 2.94Å; G237-S241 PolarHBondContact O-N 3.16Å
238	E	84.9	Confident	86	Confident	47 Å²	47	20.4 Å²	20.4	22%	0.22	9%	0.093	C	C	.	.	H	α-helix	trans	-63.4	-52	176	-166.4	-159.6	148	0	0	110.8	K235 R236 L240 S241 W242 E566	K235-E238 PolarHBondContact O-N 3.13Å; R236-E238 PolarHBondContact O-N 3.22Å; E238-L240 PolarHBondContact O-N 2.67Å; E238-S241 PolarHBondContact O-N 3.2Å; E238-S241 VanDerWaalsContact O-N 3.17Å; E238-W242 PolarHBondContact O-N 3.24Å; E238-W242 PolarHBondContact OE1-NE1 3.1Å; E238-E566 HydrophobicContact CB-CG 4.03Å; E238-E566 WeakPolarHBondContact CB-OE1 3.42Å
239	H	89	Confident	86	Confident	11 Å²	11	23.1 Å²	23.1	5%	0.051	11%	0.11	C	C	.	.	H	α-helix	trans	-66.4	-36.9	-178.5	-74	-64.4	0	0	0	113.3	H108 F227 L231 K235 R236 S241 W242 L243	H108-H239 AromaticContact CE1-CD2 3.68Å; H108-H239 AromaticContact CE1-CE1 3.63Å; H108-H239 AromaticContact CE1-NE2 3.31Å; H108-H239 PolarHBondContact CE1-NE2 3.18Å; H108-H239 VanDerWaalsContact CE1-NE2 3.31Å; H108-H239 AromaticContact ND1-NE2 3.87Å; H108-H239 AromaticContact NE2-CE1 3.51Å; H108-H239 AromaticContact NE2-NE2 3.48Å; H108-H239 PolarHBondContact NE2-NE2 3.32Å; F227-H239 HydrophobicContact CE1-CB 3.91Å; F227-H239 HydrophobicContact CZ-CB 4.22Å; L231-H239 HydrophobicContact CD1-CB 3.94Å; L231-H239 HydrophobicContact CD2-CB 3.83Å; K235-H239 PolarHBondContact O-CD2 3.19Å; K235-H239 PolarHBondContact O-N 3.28Å; K235-H239 VanDerWaalsContact O-N 3.1Å; R236-H239 PolarHBondContact O-N 2.9Å; H239-S241 VanDerWaalsContact C-N 3.34Å; H239-W242 PolarHBondContact O-N 3.48Å; H239-L243 PolarHBondContact O-N 3.21Å
240	L	90.2	Very high	86.2	Confident	0 Å²	0	23 Å²	23	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-65.8	-37.7	173.2	-71.5	169.5	0	0	0	111.2	Y224 F227 L231 R236 E238 L243 C244 V617 V620	Y224-L240 HydrophobicContact CD1-CD2 3.86Å; Y224-L240 HydrophobicContact CE1-CD2 4.48Å; F227-L240 HydrophobicContact CB-CD2 4.31Å; F227-L240 HydrophobicContact CD1-CD2 3.76Å; F227-L240 HydrophobicContact CG-CD2 4.49Å; L231-L240 HydrophobicContact CD1-CD2 4.17Å; L231-L240 HydrophobicContact CD1-CG 3.9Å; R236-L240 HydrophobicContact CG-CD1 3.63Å; R236-L240 HydrophobicContact CG-CG 4.31Å; R236-L240 WeakPolarHBondContact O-CB 3.46Å; R236-L240 VanDerWaalsContact O-CG 3.26Å; R236-L240 WeakPolarHBondContact O-CG 3.22Å; R236-L240 PolarHBondContact O-N 3.32Å; E238-L240 PolarHBondContact O-N 2.67Å; L240-L243 VanDerWaalsContact O-CB 3.25Å; L240-L243 WeakPolarHBondContact O-CB 3.48Å; L240-L243 PolarHBondContact O-N 3.18Å; L240-C244 PolarHBondContact O-N 2.86Å; L240-C244 PolarHBondContact O-SG 3.31Å; L240-C244 VanDerWaalsContact O-SG 3.38Å; L240-V617 HydrophobicContact CB-CG2 3.67Å; L240-V617 HydrophobicContact CD1-CG1 4.34Å; L240-V617 HydrophobicContact CD1-CG2 4.47Å; L240-V620 HydrophobicContact CD1-CG1 4.47Å
241	S	88.6	Confident	86.1	Confident	0 Å²	0	23 Å²	23	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-68.9	-35.5	174.9	-172.3	0	0	0	0	112.6	G237 E238 H239 L243 C244 S561 A562 N613	G237-S241 WeakPolarHBondContact O-CB 2.94Å; G237-S241 PolarHBondContact O-N 3.16Å; E238-S241 PolarHBondContact O-N 3.2Å; E238-S241 VanDerWaalsContact O-N 3.17Å; H239-S241 VanDerWaalsContact C-N 3.34Å; S241-L243 PolarHBondContact O-N 3.32Å; S241-C244 WeakPolarHBondContact O-CB 3.13Å; S241-C244 PolarHBondContact O-N 3.35Å; S241-S561 PolarHBondContact OG-OG 3.4Å; S241-A562 WeakPolarHBondContact OG-CA 3.31Å; S241-A562 PolarHBondContact OG-N 3.31Å; S241-N613 PolarHBondContact OG-ND2 2.69Å
242	W	91.2	Very high	86.3	Confident	53 Å²	53	24.5 Å²	24.5	20%	0.201	12%	0.117	C	C	.	.	H	α-helix	trans	-63.6	-30.2	171.9	-75.9	124.5	0	0	0	112.1	F116 E238 H239 C244 M245 I559 A562 L563	F116-W242 HydrophobicContact CE2-CB 3.94Å; F116-W242 HydrophobicContact CZ-CB 3.85Å; E238-W242 PolarHBondContact O-N 3.24Å; E238-W242 PolarHBondContact OE1-NE1 3.1Å; H239-W242 PolarHBondContact O-N 3.48Å; W242-C244 VanDerWaalsContact C-N 3.35Å; W242-M245 HydrophobicContact CD2-CE 4.15Å; W242-M245 HydrophobicContact CE3-CE 3.1Å; W242-M245 HydrophobicContact CE3-CG 4.3Å; W242-M245 HydrophobicContact CE3-SD 3.38Å; W242-M245 HydrophobicContact CZ3-CE 3.52Å; W242-M245 HydrophobicContact CZ3-SD 3.44Å; W242-M245 WeakPolarHBondContact CZ3-SD 3.5Å; W242-M245 WeakPolarHBondContact O-CB 3.49Å; W242-M245 PolarHBondContact O-N 3.13Å; W242-I559 HydrophobicContact CH2-CG2 4.17Å; W242-I559 HydrophobicContact CZ3-CG1 4.08Å; W242-I559 HydrophobicContact CZ3-CG2 4.49Å; W242-A562 HydrophobicContact CD2-CB 3.79Å; W242-A562 HydrophobicContact CE3-CB 3.96Å; W242-A562 HydrophobicContact CG-CB 4.21Å; W242-A562 HydrophobicContact CZ2-CB 4.36Å; W242-A562 HydrophobicContact CZ3-CB 4.42Å; W242-L563 HydrophobicContact CZ2-CD2 4.19Å
243	L	91.7	Very high	86.9	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-67.3	-36.4	179.2	-169.9	69.6	0	0	0	111.5	F116 L119 L123 V223 Y224 F227 H239 L240 S241 M245 F246	F116-L243 HydrophobicContact CD2-CB 4.37Å; F116-L243 HydrophobicContact CD2-CD1 3.78Å; F116-L243 HydrophobicContact CE2-CB 3.92Å; F116-L243 HydrophobicContact CE2-CD1 3.94Å; L119-L243 HydrophobicContact CB-CD1 4.33Å; L123-L243 HydrophobicContact CD1-CD1 4.1Å; L123-L243 HydrophobicContact CD1-CD2 3.81Å; L123-L243 HydrophobicContact CD1-CG 3.47Å; L123-L243 VanDerWaalsContact CD1-CG 3.47Å; V223-L243 HydrophobicContact CG1-CD2 3.67Å; Y224-L243 HydrophobicContact CE1-CD2 4.46Å; F227-L243 HydrophobicContact CB-CD2 4.26Å; F227-L243 HydrophobicContact CD1-CD2 3.79Å; F227-L243 HydrophobicContact CE1-CD2 4.5Å; F227-L243 HydrophobicContact CG-CD2 4.29Å; H239-L243 PolarHBondContact O-N 3.21Å; L240-L243 VanDerWaalsContact O-CB 3.25Å; L240-L243 WeakPolarHBondContact O-CB 3.48Å; L240-L243 PolarHBondContact O-N 3.18Å; S241-L243 PolarHBondContact O-N 3.32Å; L243-M245 PolarHBondContact O-N 3.48Å; L243-M245 VanDerWaalsContact O-N 3.11Å; L243-F246 HydrophobicContact CD1-CD2 4.5Å; L243-F246 PolarHBondContact O-N 3.45Å; L243-F246 VanDerWaalsContact O-N 3.13Å
244	C	88.6	Confident	87.8	Confident	4 Å²	4	25.8 Å²	25.8	3%	0.027	12%	0.121	C	C	.	.	H	α-helix	trans	-54.3	-30.1	174.5	-52.6	0	0	0	0	113	Y224 L240 S241 W242 F246 W247 N613 E616	Y224-C244 WeakPolarHBondContact OH-CA 3.38Å; Y224-C244 PolarHBondContact OH-SG 3.12Å; L240-C244 PolarHBondContact O-N 2.86Å; L240-C244 PolarHBondContact O-SG 3.31Å; L240-C244 VanDerWaalsContact O-SG 3.38Å; S241-C244 WeakPolarHBondContact O-CB 3.13Å; S241-C244 PolarHBondContact O-N 3.35Å; W242-C244 VanDerWaalsContact C-N 3.35Å; C244-F246 PolarHBondContact O-N 3.26Å; C244-W247 WeakPolarHBondContact O-CB 3.42Å; C244-W247 PolarHBondContact O-N 3.41Å; C244-N613 WeakPolarHBondContact CB-OD1 3.43Å; C244-N613 VanDerWaalsContact SG-CG 3.56Å; C244-N613 PolarHBondContact SG-OD1 3.47Å; C244-E616 PolarHBondContact SG-OE2 2.83Å
245	M	90.4	Very high	88.6	Confident	39 Å²	39	22.8 Å²	22.8	19%	0.192	11%	0.105	C	C	.	.	H	α-helix	trans	-59.5	-32.5	-179.7	-67.7	-163.8	-54	0	0	113	W242 L243 W247 M248 V249 N558 I559	W242-M245 HydrophobicContact CD2-CE 4.15Å; W242-M245 HydrophobicContact CE3-CE 3.1Å; W242-M245 HydrophobicContact CE3-CG 4.3Å; W242-M245 HydrophobicContact CE3-SD 3.38Å; W242-M245 HydrophobicContact CZ3-CE 3.52Å; W242-M245 HydrophobicContact CZ3-SD 3.44Å; W242-M245 WeakPolarHBondContact CZ3-SD 3.5Å; W242-M245 WeakPolarHBondContact O-CB 3.49Å; W242-M245 PolarHBondContact O-N 3.13Å; L243-M245 PolarHBondContact O-N 3.48Å; L243-M245 VanDerWaalsContact O-N 3.11Å; M245-W247 PolarHBondContact O-N 3.37Å; M245-M248 PolarHBondContact O-N 2.77Å; M245-V249 WeakPolarHBondContact O-CG2 3.36Å; M245-V249 PolarHBondContact O-N 2.93Å; M245-N558 HydrophobicContact CG-CB 3.82Å; M245-I559 HydrophobicContact SD-CG1 4.15Å
246	F	93.3	Very high	89.1	Confident	34 Å²	34	24 Å²	24	15%	0.149	11%	0.11	C	C	.	.	H	α-helix	trans	-62.6	-30.2	-178.3	-81.4	-89.4	0	0	0	112.8	F116 I117 G120 L123 M124 L243 C244 M248 V249 G250	F116-F246 HydrophobicContact CD1-CE2 4.18Å; F116-F246 AromaticContact CE1-CE2 3.5Å; F116-F246 HydrophobicContact CE1-CE2 3.5Å; F116-F246 HydrophobicContact CE1-CZ 4.07Å; F116-F246 HydrophobicContact CE2-CE2 4.32Å; F116-F246 HydrophobicContact CZ-CD2 4.33Å; F116-F246 AromaticContact CZ-CE2 3.59Å; F116-F246 HydrophobicContact CZ-CE2 3.59Å; I117-F246 HydrophobicContact CD1-CZ 3.88Å; G120-F246 VanDerWaalsContact C-CD1 3.42Å; G120-F246 WeakPolarHBondContact O-CB 3.43Å; G120-F246 WeakPolarHBondContact O-CD1 3.5Å; G120-F246 WeakPolarHBondContact O-CG 3.37Å; L123-F246 HydrophobicContact CB-CB 4.28Å; M124-F246 VanDerWaalsContact CA-O 3.31Å; M124-F246 WeakPolarHBondContact CA-O 3.36Å; M124-F246 HydrophobicContact CB-CB 4.49Å; L243-F246 HydrophobicContact CD1-CD2 4.5Å; L243-F246 PolarHBondContact O-N 3.45Å; L243-F246 VanDerWaalsContact O-N 3.13Å; C244-F246 PolarHBondContact O-N 3.26Å; F246-M248 VanDerWaalsContact C-N 3.32Å; F246-M248 PolarHBondContact O-N 3.24Å; F246-V249 PolarHBondContact O-N 2.81Å; F246-G250 PolarHBondContact O-N 2.96Å
247	W	92	Very high	89.3	Confident	31 Å²	31	24.7 Å²	24.7	12%	0.117	12%	0.115	C	C	.	.	H	α-helix	trans	-61.5	-42.9	174.3	-168.3	92.6	0	0	0	111.3	D126 C130 F131 C244 M245 G250 G251	D126-W247 VanDerWaalsContact OD2-CD1 3.28Å; D126-W247 PolarHBondContact OD2-NE1 3.33Å; C130-W247 HydrophobicContact CB-CZ2 4.13Å; F131-W247 HydrophobicContact CE2-CE3 4.11Å; F131-W247 AromaticContact CE2-CH2 3.52Å; F131-W247 HydrophobicContact CE2-CH2 3.52Å; F131-W247 HydrophobicContact CE2-CZ2 4.14Å; F131-W247 AromaticContact CE2-CZ3 3.49Å; F131-W247 HydrophobicContact CE2-CZ3 3.49Å; F131-W247 VanDerWaalsContact CE2-CZ3 3.49Å; F131-W247 AromaticContact CZ-CH2 3.54Å; F131-W247 HydrophobicContact CZ-CH2 3.54Å; F131-W247 HydrophobicContact CZ-CZ2 4.5Å; F131-W247 AromaticContact CZ-CZ3 3.57Å; F131-W247 HydrophobicContact CZ-CZ3 3.57Å; C244-W247 WeakPolarHBondContact O-CB 3.42Å; C244-W247 PolarHBondContact O-N 3.41Å; M245-W247 PolarHBondContact O-N 3.37Å; W247-G250 WeakPolarHBondContact O-CA 3.29Å; W247-G250 PolarHBondContact O-N 3.02Å; W247-G250 VanDerWaalsContact O-N 3.13Å; W247-G251 PolarHBondContact O-N 2.68Å
248	M	88.9	Confident	89.5	Confident	15 Å²	15	24.7 Å²	24.7	7%	0.074	12%	0.115	C	C	.	.	H	α-helix	trans	-71.3	-36.9	176.6	-59.8	-61.2	156.9	0	0	112.4	M245 F246 G250 G251 I252 V554 L555 N558 V609	M245-M248 PolarHBondContact O-N 2.77Å; F246-M248 VanDerWaalsContact C-N 3.32Å; F246-M248 PolarHBondContact O-N 3.24Å; M248-G250 PolarHBondContact O-N 2.85Å; M248-G251 PolarHBondContact O-N 2.81Å; M248-I252 WeakPolarHBondContact O-CG1 3.22Å; M248-I252 PolarHBondContact O-N 3.08Å; M248-V554 HydrophobicContact CE-CG1 3.81Å; M248-V554 HydrophobicContact CG-CG1 3.72Å; M248-V554 HydrophobicContact SD-CB 4.09Å; M248-V554 HydrophobicContact SD-CG1 3.45Å; M248-V554 WeakPolarHBondContact SD-CG1 3.38Å; M248-L555 HydrophobicContact CB-CD2 3.89Å; M248-N558 VanDerWaalsContact CG-ND2 3.29Å; M248-N558 WeakPolarHBondContact CG-ND2 3.36Å; M248-V609 HydrophobicContact CE-CG2 4.3Å
249	V	91.5	Very high	89.4	Confident	58 Å²	58	29.1 Å²	29.1	35%	0.352	13%	0.129	S	C	.	.	H	α-helix	trans	-58.4	-34.2	170.1	175.4	0	0	0	0	110.3	M124 M245 F246 I252 Y253	M124-V249 HydrophobicContact CE-CG1 4.45Å; M124-V249 HydrophobicContact SD-CG1 4.37Å; M245-V249 WeakPolarHBondContact O-CG2 3.36Å; M245-V249 PolarHBondContact O-N 2.93Å; F246-V249 PolarHBondContact O-N 2.81Å; V249-I252 PolarHBondContact O-N 3.17Å; V249-Y253 VanDerWaalsContact O-CB 3.29Å; V249-Y253 WeakPolarHBondContact O-CB 3.4Å; V249-Y253 PolarHBondContact O-N 3.1Å
250	G	92.3	Very high	89	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.2	-47	170.8	0	0	0	0	0	113.1	V128 F246 W247 M248 I252 Y253 A254	V128-G250 VanDerWaalsContact CG2-O 3.29Å; V128-G250 WeakPolarHBondContact CG2-O 3.39Å; F246-G250 PolarHBondContact O-N 2.96Å; W247-G250 WeakPolarHBondContact O-CA 3.29Å; W247-G250 PolarHBondContact O-N 3.02Å; W247-G250 VanDerWaalsContact O-N 3.13Å; M248-G250 PolarHBondContact O-N 2.85Å; G250-I252 PolarHBondContact O-N 3.37Å; G250-Y253 PolarHBondContact O-N 3.19Å; G250-A254 WeakPolarHBondContact O-CB 3.42Å; G250-A254 PolarHBondContact O-N 3.44Å
251	G	89.1	Confident	88.7	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62.1	-40.9	175	0	0	0	0	0	113.5	W247 M248 A254 S255	W247-G251 PolarHBondContact O-N 2.68Å; M248-G251 PolarHBondContact O-N 2.81Å; G251-A254 PolarHBondContact O-N 3.03Å; G251-S255 WeakPolarHBondContact O-CB 3.38Å; G251-S255 PolarHBondContact O-N 3.37Å; G251-S255 PolarHBondContact O-OG 3.36Å
252	I	90.1	Very high	88.1	Confident	34 Å²	34	31.1 Å²	31.1	17%	0.174	15%	0.147	C	C	.	.	H	α-helix	trans	-63.3	-44.9	174.7	-67.3	172	0	0	0	110.5	M248 V249 G250 S255 F256 F548 L555	M248-I252 WeakPolarHBondContact O-CG1 3.22Å; M248-I252 PolarHBondContact O-N 3.08Å; V249-I252 PolarHBondContact O-N 3.17Å; G250-I252 PolarHBondContact O-N 3.37Å; I252-S255 PolarHBondContact O-N 2.86Å; I252-F256 WeakPolarHBondContact O-CB 3.33Å; I252-F256 PolarHBondContact O-N 3.37Å; I252-F548 HydrophobicContact CG2-CD2 4.27Å; I252-F548 HydrophobicContact CG2-CE2 3.77Å; I252-L555 HydrophobicContact CD1-CD1 3.68Å; I252-L555 HydrophobicContact CD1-CD2 4.36Å; I252-L555 HydrophobicContact CD1-CG 4.09Å
253	Y	92	Very high	87.1	Confident	52 Å²	52	30.8 Å²	30.8	20%	0.204	15%	0.151	C	C	.	.	H	α-helix	trans	-62.3	-45.8	176.7	174.1	-96.7	0	0	0	112	M124 V128 V249 G250 S255 F256 T257 V286 P290	M124-Y253 HydrophobicContact CE-CD1 3.78Å; M124-Y253 HydrophobicContact CE-CD2 3.66Å; M124-Y253 HydrophobicContact CE-CE1 4.47Å; M124-Y253 HydrophobicContact CE-CE2 4.38Å; M124-Y253 HydrophobicContact CE-CG 3.31Å; V128-Y253 HydrophobicContact CG2-CD1 3.69Å; V128-Y253 HydrophobicContact CG2-CE1 4.4Å; V249-Y253 VanDerWaalsContact O-CB 3.29Å; V249-Y253 WeakPolarHBondContact O-CB 3.4Å; V249-Y253 PolarHBondContact O-N 3.1Å; G250-Y253 PolarHBondContact O-N 3.19Å; Y253-S255 VanDerWaalsContact C-N 3.35Å; Y253-S255 PolarHBondContact O-N 3.26Å; Y253-F256 PolarHBondContact O-N 3.15Å; Y253-T257 HydrophobicContact CD1-CG2 4.48Å; Y253-T257 HydrophobicContact CD2-CG2 4.13Å; Y253-T257 HydrophobicContact CE1-CG2 4.15Å; Y253-T257 HydrophobicContact CE2-CG2 3.75Å; Y253-T257 HydrophobicContact CG-CG2 4.48Å; Y253-T257 WeakPolarHBondContact O-CB 3.41Å; Y253-T257 WeakPolarHBondContact O-CG2 3.1Å; Y253-T257 PolarHBondContact O-N 2.95Å; Y253-T257 PolarHBondContact O-OG1 3.31Å; Y253-V286 WeakPolarHBondContact OH-CG1 3.38Å; Y253-V286 PolarHBondContact OH-O 2.92Å; Y253-P290 HydrophobicContact CD1-CG 4.1Å; Y253-P290 HydrophobicContact CE1-CG 3.72Å
254	A	90.5	Very high	85.9	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-60.2	-44.5	175.8	0	0	0	0	0	111.2	V128 F131 F135 G250 G251 T257 A258 F283	V128-A254 HydrophobicContact CG1-CB 4.43Å; V128-A254 HydrophobicContact CG2-CB 4.42Å; F131-A254 HydrophobicContact CB-CB 4.16Å; F135-A254 HydrophobicContact CD2-CB 4.2Å; F135-A254 HydrophobicContact CE2-CB 3.95Å; G250-A254 WeakPolarHBondContact O-CB 3.42Å; G250-A254 PolarHBondContact O-N 3.44Å; G251-A254 PolarHBondContact O-N 3.03Å; A254-T257 PolarHBondContact O-OG1 2.91Å; A254-A258 WeakPolarHBondContact O-CB 3.19Å; A254-A258 PolarHBondContact O-N 3.32Å; A254-F283 VanDerWaalsContact O-CE2 3.32Å; A254-F283 WeakPolarHBondContact O-CE2 3.25Å
255	S	86.4	Confident	84.4	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.007	20%	0.204	C	C	.	.	H	α-helix	trans	-63.9	-45.1	178.1	-51.7	0	0	0	0	112	F135 G251 I252 Y253 A258 W259	F135-S255 WeakPolarHBondContact CZ-OG 3.39Å; G251-S255 WeakPolarHBondContact O-CB 3.38Å; G251-S255 PolarHBondContact O-N 3.37Å; G251-S255 PolarHBondContact O-OG 3.36Å; I252-S255 PolarHBondContact O-N 2.86Å; Y253-S255 VanDerWaalsContact C-N 3.35Å; Y253-S255 PolarHBondContact O-N 3.26Å; S255-A258 PolarHBondContact O-N 2.95Å; S255-W259 WeakPolarHBondContact O-CB 3.28Å; S255-W259 PolarHBondContact O-N 3.19Å
256	F	86.4	Confident	82.6	Confident	125 Å²	125	45.1 Å²	45.1	55%	0.548	23%	0.231	S	C	.	.	H	α-helix	trans	-65.5	-42.4	179.8	-179.5	-100.3	0	0	0	112.1	I252 Y253 W259 G260	I252-F256 WeakPolarHBondContact O-CB 3.33Å; I252-F256 PolarHBondContact O-N 3.37Å; Y253-F256 PolarHBondContact O-N 3.15Å; F256-W259 HydrophobicContact CD2-CE3 4.31Å; F256-W259 HydrophobicContact CE2-CE3 4.25Å; F256-W259 HydrophobicContact CE2-CZ3 4.09Å; F256-G260 PolarHBondContact O-N 3.32Å
257	T	87.9	Confident	80.8	Confident	15 Å²	15	50.9 Å²	50.9	9%	0.092	25%	0.252	C	S	.	.	H	α-helix	trans	-72.4	-33.1	177.3	52.8	0	0	0	0	112.6	Y253 A254 G260 I261 F283 V286	Y253-T257 HydrophobicContact CD1-CG2 4.48Å; Y253-T257 HydrophobicContact CD2-CG2 4.13Å; Y253-T257 HydrophobicContact CE1-CG2 4.15Å; Y253-T257 HydrophobicContact CE2-CG2 3.75Å; Y253-T257 HydrophobicContact CG-CG2 4.48Å; Y253-T257 WeakPolarHBondContact O-CB 3.41Å; Y253-T257 WeakPolarHBondContact O-CG2 3.1Å; Y253-T257 PolarHBondContact O-N 2.95Å; Y253-T257 PolarHBondContact O-OG1 3.31Å; A254-T257 PolarHBondContact O-OG1 2.91Å; T257-G260 PolarHBondContact O-N 3.03Å; T257-I261 WeakPolarHBondContact O-CB 3.36Å; T257-I261 VanDerWaalsContact O-CG1 3.27Å; T257-I261 WeakPolarHBondContact O-CG1 3.38Å; T257-I261 PolarHBondContact O-N 2.91Å; T257-I261 VanDerWaalsContact O-N 3.12Å; T257-F283 WeakPolarHBondContact OG1-CE2 3.35Å; T257-V286 HydrophobicContact CG2-CG1 3.97Å
258	A	85.1	Confident	79.2	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.8	-50.8	171.5	0	0	0	0	0	110.7	F135 A254 S255 G260 I261 I262 P263 F283 Y544	F135-A258 HydrophobicContact CB-CB 3.94Å; F135-A258 HydrophobicContact CD1-CB 4.41Å; F135-A258 HydrophobicContact CD2-CB 4.2Å; F135-A258 HydrophobicContact CG-CB 3.93Å; A254-A258 WeakPolarHBondContact O-CB 3.19Å; A254-A258 PolarHBondContact O-N 3.32Å; S255-A258 PolarHBondContact O-N 2.95Å; A258-G260 VanDerWaalsContact C-N 3.32Å; A258-G260 PolarHBondContact O-N 3.47Å; A258-I261 PolarHBondContact O-N 3.24Å; A258-I262 HydrophobicContact CB-CD1 3.83Å; A258-I262 WeakPolarHBondContact O-CB 3.41Å; A258-I262 WeakPolarHBondContact O-CG1 3.36Å; A258-I262 PolarHBondContact O-N 3Å; A258-P263 WeakPolarHBondContact O-CD 3.43Å; A258-F283 HydrophobicContact CB-CD2 4.13Å; A258-F283 HydrophobicContact CB-CE2 3.62Å; A258-F283 HydrophobicContact CB-CZ 3.86Å; A258-F283 VanDerWaalsContact N-CE2 3.3Å; A258-Y544 HydrophobicContact CB-CD1 4.39Å
259	W	82.6	Confident	78.1	Confident	140 Å²	140	56.9 Å²	56.9	53%	0.53	29%	0.289	S	S	.	.	H	α-helix	trans	-59	-40.5	177	174.4	71	0	0	0	112.9	S255 F256 P263	S255-W259 WeakPolarHBondContact O-CB 3.28Å; S255-W259 PolarHBondContact O-N 3.19Å; F256-W259 HydrophobicContact CD2-CE3 4.31Å; F256-W259 HydrophobicContact CE2-CE3 4.25Å; F256-W259 HydrophobicContact CE2-CZ3 4.09Å; W259-P263 WeakPolarHBondContact O-CD 3.36Å; W259-P263 WeakPolarHBondContact O-CG 3.45Å
260	G	81	Confident	76.5	Confident	27 Å²	27	57.2 Å²	57.2	28%	0.278	29%	0.293	S	S	.	.	H	α-helix	trans	-78.7	-15.7	-178.5	0	0	0	0	0	115.5	F256 T257 A258 H264	F256-G260 PolarHBondContact O-N 3.32Å; T257-G260 PolarHBondContact O-N 3.03Å; A258-G260 VanDerWaalsContact C-N 3.32Å; A258-G260 PolarHBondContact O-N 3.47Å; G260-H264 PolarHBondContact O-CD2 3.25Å
261	I	83.4	Confident	74.7	Confident	12 Å²	12	63.5 Å²	63.5	6%	0.062	33%	0.325	C	S	.	.	H	α-helix	trans	-116.9	-48	-172.9	-61.6	170.4	0	0	0	111.9	T257 A258 H264 W267 S279 V282 F283 V286	T257-I261 WeakPolarHBondContact O-CB 3.36Å; T257-I261 VanDerWaalsContact O-CG1 3.27Å; T257-I261 WeakPolarHBondContact O-CG1 3.38Å; T257-I261 PolarHBondContact O-N 2.91Å; T257-I261 VanDerWaalsContact O-N 3.12Å; A258-I261 PolarHBondContact O-N 3.24Å; I261-H264 PolarHBondContact O-N 3.45Å; I261-W267 HydrophobicContact CG1-CE3 4.47Å; I261-W267 HydrophobicContact CG1-CZ3 4.26Å; I261-W267 HydrophobicContact CG2-CE3 4.34Å; I261-S279 WeakPolarHBondContact CG2-O 3.43Å; I261-S279 WeakPolarHBondContact O-CB 3.01Å; I261-V282 HydrophobicContact CG2-CB 4.04Å; I261-V282 HydrophobicContact CG2-CG1 4.16Å; I261-F283 HydrophobicContact CB-CB 4.43Å; I261-F283 HydrophobicContact CG2-CB 4.19Å; I261-V286 HydrophobicContact CD1-CB 3.98Å; I261-V286 HydrophobicContact CD1-CG1 4.14Å; I261-V286 HydrophobicContact CD1-CG2 3.75Å
262	I	76.3	Confident	73.3	Confident	14 Å²	14	66.3 Å²	66.3	7%	0.072	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-47.1	-169.8	-59.5	175.2	0	0	0	112.4	F135 S139 A258 H264 F283 Y544	F135-I262 HydrophobicContact CB-CD1 4.46Å; S139-I262 VanDerWaalsContact OG-CG2 3.3Å; S139-I262 WeakPolarHBondContact OG-CG2 3.2Å; A258-I262 HydrophobicContact CB-CD1 3.83Å; A258-I262 WeakPolarHBondContact O-CB 3.41Å; A258-I262 WeakPolarHBondContact O-CG1 3.36Å; A258-I262 PolarHBondContact O-N 3Å; I262-H264 PolarHBondContact O-N 2.86Å; I262-F283 HydrophobicContact CD1-CD1 4.15Å; I262-F283 HydrophobicContact CD1-CG 4.25Å; I262-F283 HydrophobicContact CG1-CB 4.17Å; I262-F283 HydrophobicContact CG1-CG 4.32Å; I262-Y544 HydrophobicContact CB-CE2 4.47Å; I262-Y544 HydrophobicContact CD1-CE1 4.39Å; I262-Y544 HydrophobicContact CG2-CE2 4.39Å
263	P	69.7	Low	71.7	Confident	45 Å²	45	71.1 Å²	71.1	29%	0.292	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-19.8	-177.5	-19.7	33.9	0	0	0	114	A258 W259 Y265 V541	A258-P263 WeakPolarHBondContact O-CD 3.43Å; W259-P263 WeakPolarHBondContact O-CD 3.36Å; W259-P263 WeakPolarHBondContact O-CG 3.45Å; P263-Y265 PolarHBondContact O-N 3.02Å; P263-V541 HydrophobicContact CB-CG2 4.48Å; P263-V541 HydrophobicContact CG-CG2 4.29Å
264	H	66.7	Low	70.2	Confident	112 Å²	112	77.2 Å²	77.2	52%	0.519	42%	0.415	S	S	.	.			trans	-89	93.1	-179.4	-66.1	-60.3	0	0	0	110.2	G260 I261 I262 G266 W267 S279	G260-H264 PolarHBondContact O-CD2 3.25Å; I261-H264 PolarHBondContact O-N 3.45Å; I262-H264 PolarHBondContact O-N 2.86Å; H264-G266 PolarHBondContact O-N 3.48Å; H264-W267 PolarHBondContact O-N 3.45Å; H264-S279 PolarHBondContact O-OG 2.83Å
265	Y	56	Low	69.1	Low	159 Å²	159	80.5 Å²	80.5	62%	0.624	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-59.7	-11.6	179	-80.8	-87.7	0	0	0	115.4	P263 W267 E537	P263-Y265 PolarHBondContact O-N 3.02Å; Y265-W267 VanDerWaalsContact C-N 3.28Å; Y265-W267 PolarHBondContact O-N 2.97Å; Y265-E537 VanDerWaalsContact CE2-OE1 3.25Å; Y265-E537 WeakPolarHBondContact CE2-OE1 3.38Å; Y265-E537 PolarHBondContact OH-OE1 3.01Å
266	G	52.4	Low	68.3	Low	73 Å²	73	84.5 Å²	84.5	75%	0.753	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-76.1	-5.6	179.5	0	0	0	0	0	115.6	H264	H264-G266 PolarHBondContact O-N 3.48Å
267	W	56.5	Low	68	Low	156 Å²	156	80 Å²	80	59%	0.591	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-98	6.5	-175.2	-73.9	40.9	0	0	0	113.4	I261 H264 Y265 V282	I261-W267 HydrophobicContact CG1-CE3 4.47Å; I261-W267 HydrophobicContact CG1-CZ3 4.26Å; I261-W267 HydrophobicContact CG2-CE3 4.34Å; H264-W267 PolarHBondContact O-N 3.45Å; Y265-W267 VanDerWaalsContact C-N 3.28Å; Y265-W267 PolarHBondContact O-N 2.97Å; W267-V282 HydrophobicContact CE3-CG1 4.25Å; W267-V282 WeakPolarHBondContact O-CG2 3.31Å
268	G	58.8	Low	67.7	Low	36 Å²	36	81.8 Å²	81.8	37%	0.371	44%	0.435	S	S	.	.			trans	-92.6	138.9	172.4	0	0	0	0	0	112.6	F277	G268-F277 CarbonylContact C-O 3.57Å; G268-F277 WeakPolarHBondContact CA-O 3.28Å
269	F	64.9	Low	67.6	Low	136 Å²	136	82.1 Å²	82.1	60%	0.596	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.1	127.2	173.4	-175.3	-95.4	0	0	0	109.4	M271 F277	F269-M271 HydrophobicContact CD1-CB 4.29Å; F269-M271 HydrophobicContact CE1-CB 3.87Å; F269-M271 HydrophobicContact CE1-CG 4.33Å; F269-M271 HydrophobicContact CE1-SD 3.61Å; F269-M271 HydrophobicContact CZ-SD 4.06Å; F269-F277 PolarHBondContact N-O 3.46Å; F269-F277 VanDerWaalsContact N-O 3.1Å; F269-F277 WeakPolarHBondContact O-CB 3.19Å; F269-F277 PolarHBondContact O-N 2.93Å; F269-F277 VanDerWaalsContact O-N 3.11Å
270	S	58.2	Low	67.6	Low	64 Å²	64	75.8 Å²	75.8	45%	0.448	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	119.4	173.4	-170.3	0	0	0	0	109.2	G272	S270-G272 PolarHBondContact OG-O 3.27Å; S270-G272 VanDerWaalsContact OG-O 3.14Å
271	M	54.1	Low	68	Low	133 Å²	133	74.5 Å²	74.5	66%	0.655	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.1	92.6	174	-167.2	71.3	179.7	0	0	108.7	F269 F275	F269-M271 HydrophobicContact CD1-CB 4.29Å; F269-M271 HydrophobicContact CE1-CB 3.87Å; F269-M271 HydrophobicContact CE1-CG 4.33Å; F269-M271 HydrophobicContact CE1-SD 3.61Å; F269-M271 HydrophobicContact CZ-SD 4.06Å; M271-F275 PolarHBondContact N-O 3.37Å
272	G	60.2	Low	68.2	Low	58 Å²	58	75.1 Å²	75.1	60%	0.598	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.8	-157.9	-177.2	0	0	0	0	0	113.5	S270	S270-G272 PolarHBondContact OG-O 3.27Å; S270-G272 VanDerWaalsContact OG-O 3.14Å
273	T	57	Low	68.8	Low	136 Å²	136	74.4 Å²	74.4	83%	0.834	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-16.7	-176.6	49.6	0	0	0	0	114.2
274	E	59.2	Low	69.8	Low	179 Å²	179	72.5 Å²	72.5	84%	0.836	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.8	-22.2	-173.2	-67.8	-171.4	170.9	0	0	114.6
275	F	69	Low	71	Confident	70 Å²	70	69.2 Å²	69.2	31%	0.307	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	94.7	-178.1	-164.5	-91.2	0	0	0	111.3	F198 Q200 M271 F277	F198-F275 AromaticContact CD1-CZ 3.93Å; F198-F275 HydrophobicContact CD1-CZ 3.93Å; Q200-F275 HydrophobicContact CG-CD2 3.85Å; Q200-F275 HydrophobicContact CG-CE2 3.82Å; M271-F275 PolarHBondContact N-O 3.37Å; F275-F277 HydrophobicContact CE1-CB 4.14Å; F275-F277 AromaticContact CE1-CD2 3.89Å; F275-F277 HydrophobicContact CE1-CD2 3.89Å; F275-F277 HydrophobicContact CE1-CG 4.46Å; F275-F277 HydrophobicContact CZ-CD2 4.12Å
276	Q	69.8	Low	72.7	Confident	85 Å²	85	63.2 Å²	63.2	40%	0.397	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	119.3	174.7	-56.5	-164.7	11.3	0	0	109.9	Q200 H278	Q200-Q276 PolarHBondContact NE2-O 2.88Å; Q200-Q276 PolarHBondContact OE1-O 2.89Å; Q276-H278 WeakPolarHBondContact CB-NE2 3.5Å; Q276-H278 PolarHBondContact OE1-CE1 2.94Å; Q276-H278 PolarHBondContact OE1-NE2 3.44Å
277	F	79.8	Confident	74.5	Confident	29 Å²	29	59.9 Å²	59.9	13%	0.127	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	94.2	175.5	-158.7	-97.3	0	0	0	109.1	F198 G268 F269 F275 R281 V282 L285	F198-F277 HydrophobicContact CD1-CE2 4.19Å; F198-F277 HydrophobicContact CE1-CE2 4.19Å; G268-F277 CarbonylContact C-O 3.57Å; G268-F277 WeakPolarHBondContact CA-O 3.28Å; F269-F277 PolarHBondContact N-O 3.46Å; F269-F277 VanDerWaalsContact N-O 3.1Å; F269-F277 WeakPolarHBondContact O-CB 3.19Å; F269-F277 PolarHBondContact O-N 2.93Å; F269-F277 VanDerWaalsContact O-N 3.11Å; F275-F277 HydrophobicContact CE1-CB 4.14Å; F275-F277 AromaticContact CE1-CD2 3.89Å; F275-F277 HydrophobicContact CE1-CD2 3.89Å; F275-F277 HydrophobicContact CE1-CG 4.46Å; F275-F277 HydrophobicContact CZ-CD2 4.12Å; F277-R281 HydrophobicContact CD1-CB 4.3Å; F277-R281 HydrophobicContact CD2-CB 4.11Å; F277-R281 HydrophobicContact CE1-CB 3.91Å; F277-R281 HydrophobicContact CE2-CB 3.7Å; F277-R281 HydrophobicContact CG-CB 4.39Å; F277-R281 HydrophobicContact CZ-CB 3.59Å; F277-V282 HydrophobicContact CD1-CG2 3.91Å; F277-V282 HydrophobicContact CE1-CB 4.35Å; F277-V282 HydrophobicContact CE1-CG2 3.5Å; F277-V282 VanDerWaalsContact CE1-CG2 3.5Å; F277-L285 HydrophobicContact CE1-CD1 4.36Å; F277-L285 HydrophobicContact CZ-CD1 3.75Å
278	H	80.4	Confident	76.2	Confident	53 Å²	53	52.7 Å²	52.7	25%	0.245	29%	0.293	C	S	.	.			trans	-78.4	161	179.7	-64.8	-75.7	0	0	0	112.9	D143 Q276 W280 R281	D143-H278 IonicContact OD1-CD2 3.15Å; D143-H278 PolarHBondContact OD1-CD2 3.31Å; D143-H278 VanDerWaalsContact OD1-CD2 3.23Å; D143-H278 IonicContact OD1-NE2 3.88Å; D143-H278 PolarHBondContact OD1-NE2 3.02Å; D143-H278 IonicContact OD2-CD2 3.92Å; D143-H278 PolarHBondContact OD2-CD2 2.86Å; D143-H278 IonicContact OD2-CG 2.95Å; D143-H278 IonicContact OD2-NE2 3.49Å; Q276-H278 WeakPolarHBondContact CB-NE2 3.5Å; Q276-H278 PolarHBondContact OE1-CE1 2.94Å; Q276-H278 PolarHBondContact OE1-NE2 3.44Å; H278-W280 PolarHBondContact O-N 3.34Å; H278-W280 VanDerWaalsContact O-N 3.15Å; H278-R281 WeakPolarHBondContact O-CB 3.3Å; H278-R281 PolarHBondContact O-N 2.73Å
279	S	82.6	Confident	77.8	Confident	8 Å²	8	55 Å²	55	6%	0.056	30%	0.297	C	S	.	.	H	α-helix	trans	-55.3	-33.7	-177.6	-55.4	0	0	0	0	113.7	I261 H264 R281 V282 F283	I261-S279 WeakPolarHBondContact CG2-O 3.43Å; I261-S279 WeakPolarHBondContact O-CB 3.01Å; H264-S279 PolarHBondContact O-OG 2.83Å; S279-R281 VanDerWaalsContact C-N 3.26Å; S279-R281 PolarHBondContact O-N 3.22Å; S279-V282 WeakPolarHBondContact O-CB 3.46Å; S279-V282 PolarHBondContact O-N 3Å; S279-F283 PolarHBondContact O-N 2.82Å
280	W	84.4	Confident	79.2	Confident	6 Å²	6	48.8 Å²	48.8	2%	0.023	27%	0.27	C	S	.	.	H	α-helix	trans	-65.1	-27.2	177.5	72.6	-98.6	0	0	0	113.1	V136 D143 M144 F205 H278 F283 V284	V136-W280 HydrophobicContact CB-CE3 4.45Å; V136-W280 HydrophobicContact CG1-CD2 4.13Å; V136-W280 HydrophobicContact CG1-CE3 3.37Å; V136-W280 HydrophobicContact CG1-CZ3 3.66Å; V136-W280 HydrophobicContact CG2-CE3 4.26Å; D143-W280 WeakPolarHBondContact OD2-CZ2 3.24Å; D143-W280 PolarHBondContact OD2-NE1 3.43Å; M144-W280 HydrophobicContact CE-CH2 3.93Å; M144-W280 HydrophobicContact CE-CZ2 3.95Å; F205-W280 HydrophobicContact CD2-CH2 4.5Å; F205-W280 HydrophobicContact CE2-CH2 4.17Å; F205-W280 AromaticContact CE2-CZ3 3.83Å; F205-W280 HydrophobicContact CE2-CZ3 3.83Å; F205-W280 HydrophobicContact CZ-CH2 4.3Å; F205-W280 AromaticContact CZ-CZ3 3.86Å; F205-W280 HydrophobicContact CZ-CZ3 3.86Å; H278-W280 PolarHBondContact O-N 3.34Å; H278-W280 VanDerWaalsContact O-N 3.15Å; W280-F283 WeakPolarHBondContact O-CB 3.35Å; W280-F283 PolarHBondContact O-N 2.77Å; W280-V284 HydrophobicContact CE3-CG2 4.29Å; W280-V284 WeakPolarHBondContact O-CG2 3.28Å; W280-V284 PolarHBondContact O-N 2.88Å
281	R	87.9	Confident	80.9	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-73.5	-35.2	175.1	-62.3	174.6	175.9	-77.3	-0.8	111.5	D143 S197 A199 F277 H278 S279 F283 V284 L285	D143-R281 IonicContact OD2-NH2 3.37Å; S197-R281 WeakPolarHBondContact CB-O 3.49Å; S197-R281 WeakPolarHBondContact O-CB 3.44Å; S197-R281 VanDerWaalsContact O-CD 3.29Å; S197-R281 WeakPolarHBondContact O-CD 3.45Å; S197-R281 WeakPolarHBondContact O-CG 3.5Å; S197-R281 PolarHBondContact O-NH1 3.14Å; A199-R281 VanDerWaalsContact O-CZ 3.28Å; A199-R281 PolarHBondContact O-NH1 3.25Å; A199-R281 PolarHBondContact O-NH2 3.41Å; F277-R281 HydrophobicContact CD1-CB 4.3Å; F277-R281 HydrophobicContact CD2-CB 4.11Å; F277-R281 HydrophobicContact CE1-CB 3.91Å; F277-R281 HydrophobicContact CE2-CB 3.7Å; F277-R281 HydrophobicContact CG-CB 4.39Å; F277-R281 HydrophobicContact CZ-CB 3.59Å; H278-R281 WeakPolarHBondContact O-CB 3.3Å; H278-R281 PolarHBondContact O-N 2.73Å; S279-R281 VanDerWaalsContact C-N 3.26Å; S279-R281 PolarHBondContact O-N 3.22Å; R281-F283 VanDerWaalsContact C-N 3.33Å; R281-V284 PolarHBondContact O-N 3.39Å; R281-L285 PolarHBondContact O-N 2.88Å
282	V	87.8	Confident	82.8	Confident	25 Å²	25	43.3 Å²	43.3	15%	0.152	24%	0.238	C	C	.	.	H	α-helix	trans	-62.4	-43.5	170.6	-175.6	0	0	0	0	110.2	I261 W267 F277 S279 V284 L285 V286	I261-V282 HydrophobicContact CG2-CB 4.04Å; I261-V282 HydrophobicContact CG2-CG1 4.16Å; W267-V282 HydrophobicContact CE3-CG1 4.25Å; W267-V282 WeakPolarHBondContact O-CG2 3.31Å; F277-V282 HydrophobicContact CD1-CG2 3.91Å; F277-V282 HydrophobicContact CE1-CB 4.35Å; F277-V282 HydrophobicContact CE1-CG2 3.5Å; F277-V282 VanDerWaalsContact CE1-CG2 3.5Å; S279-V282 WeakPolarHBondContact O-CB 3.46Å; S279-V282 PolarHBondContact O-N 3Å; V282-V284 VanDerWaalsContact C-N 3.33Å; V282-V284 PolarHBondContact O-N 3.08Å; V282-L285 WeakPolarHBondContact O-CB 3.36Å; V282-L285 PolarHBondContact O-N 2.73Å; V282-L285 VanDerWaalsContact O-N 3.08Å; V282-V286 HydrophobicContact CG1-CG2 4.45Å; V282-V286 WeakPolarHBondContact O-CG2 3.48Å; V282-V286 PolarHBondContact O-N 3.19Å
283	F	89.6	Confident	84.5	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-55.4	-47.3	176.2	165	-109	0	0	0	111.7	V132 F135 V136 A254 T257 A258 I261 I262 S279 W280 R281 L285 V286 C287	V132-F283 HydrophobicContact CB-CE1 4.38Å; V132-F283 HydrophobicContact CG1-CE1 4.06Å; V132-F283 HydrophobicContact CG2-CE1 4.16Å; V132-F283 HydrophobicContact CG2-CZ 4.09Å; F135-F283 HydrophobicContact CB-CE1 3.93Å; F135-F283 HydrophobicContact CB-CZ 4.04Å; F135-F283 HydrophobicContact CD2-CZ 4.11Å; V136-F283 HydrophobicContact CG2-CD1 3.69Å; V136-F283 HydrophobicContact CG2-CE1 3.8Å; A254-F283 VanDerWaalsContact O-CE2 3.32Å; A254-F283 WeakPolarHBondContact O-CE2 3.25Å; T257-F283 WeakPolarHBondContact OG1-CE2 3.35Å; A258-F283 HydrophobicContact CB-CD2 4.13Å; A258-F283 HydrophobicContact CB-CE2 3.62Å; A258-F283 HydrophobicContact CB-CZ 3.86Å; A258-F283 VanDerWaalsContact N-CE2 3.3Å; I261-F283 HydrophobicContact CB-CB 4.43Å; I261-F283 HydrophobicContact CG2-CB 4.19Å; I262-F283 HydrophobicContact CD1-CD1 4.15Å; I262-F283 HydrophobicContact CD1-CG 4.25Å; I262-F283 HydrophobicContact CG1-CB 4.17Å; I262-F283 HydrophobicContact CG1-CG 4.32Å; S279-F283 PolarHBondContact O-N 2.82Å; W280-F283 WeakPolarHBondContact O-CB 3.35Å; W280-F283 PolarHBondContact O-N 2.77Å; R281-F283 VanDerWaalsContact C-N 3.33Å; F283-L285 VanDerWaalsContact C-N 3.27Å; F283-L285 PolarHBondContact O-N 3.24Å; F283-V286 PolarHBondContact O-N 3.32Å; F283-V286 VanDerWaalsContact O-N 3.12Å; F283-C287 WeakPolarHBondContact CE2-SG 3.33Å; F283-C287 WeakPolarHBondContact CZ-SG 3.25Å; F283-C287 PolarHBondContact O-N 2.92Å; F283-C287 PolarHBondContact O-SG 3.39Å
284	V	90.8	Very high	86.3	Confident	4 Å²	4	37.4 Å²	37.4	2%	0.024	19%	0.19	C	C	.	.	H	α-helix	trans	-57.6	-38.1	176.1	174.1	0	0	0	0	112.6	V132 V136 W280 R281 V282 C287	V132-V284 HydrophobicContact CG1-CG2 4.25Å; V136-V284 HydrophobicContact CG2-CG2 3.7Å; W280-V284 HydrophobicContact CE3-CG2 4.29Å; W280-V284 WeakPolarHBondContact O-CG2 3.28Å; W280-V284 PolarHBondContact O-N 2.88Å; R281-V284 PolarHBondContact O-N 3.39Å; V282-V284 VanDerWaalsContact C-N 3.33Å; V282-V284 PolarHBondContact O-N 3.08Å; V284-C287 PolarHBondContact O-N 3.17Å
285	L	90.6	Very high	88	Confident	44 Å²	44	30.2 Å²	30.2	23%	0.23	16%	0.157	C	C	.	.	H	α-helix	trans	-66.4	-44.1	175.7	-74	175.5	0	0	0	112.3	F194 S197 F198 F277 R281 V282 F283 C287 A288	F194-L285 HydrophobicContact CD2-CD2 3.29Å; F194-L285 HydrophobicContact CE2-CD2 3.69Å; F194-L285 HydrophobicContact CG-CD2 4.14Å; S197-L285 WeakPolarHBondContact OG-CD2 3.44Å; S197-L285 WeakPolarHBondContact OG-CG 3.44Å; F198-L285 HydrophobicContact CE2-CD2 4.34Å; F277-L285 HydrophobicContact CE1-CD1 4.36Å; F277-L285 HydrophobicContact CZ-CD1 3.75Å; R281-L285 PolarHBondContact O-N 2.88Å; V282-L285 WeakPolarHBondContact O-CB 3.36Å; V282-L285 PolarHBondContact O-N 2.73Å; V282-L285 VanDerWaalsContact O-N 3.08Å; F283-L285 VanDerWaalsContact C-N 3.27Å; F283-L285 PolarHBondContact O-N 3.24Å; L285-C287 PolarHBondContact O-N 3.29Å; L285-A288 WeakPolarHBondContact O-CB 3.47Å; L285-A288 PolarHBondContact O-N 3.48Å; L285-A288 VanDerWaalsContact O-N 3.14Å
286	V	92	Very high	89.3	Confident	33 Å²	33	30.1 Å²	30.1	20%	0.2	16%	0.162	C	C	.	.	H	α-helix	trans	-63.9	-35.5	179	173.4	0	0	0	0	110.7	Y253 T257 I261 V282 F283 A288 L289	Y253-V286 WeakPolarHBondContact OH-CG1 3.38Å; Y253-V286 PolarHBondContact OH-O 2.92Å; T257-V286 HydrophobicContact CG2-CG1 3.97Å; I261-V286 HydrophobicContact CD1-CB 3.98Å; I261-V286 HydrophobicContact CD1-CG1 4.14Å; I261-V286 HydrophobicContact CD1-CG2 3.75Å; V282-V286 HydrophobicContact CG1-CG2 4.45Å; V282-V286 WeakPolarHBondContact O-CG2 3.48Å; V282-V286 PolarHBondContact O-N 3.19Å; F283-V286 PolarHBondContact O-N 3.32Å; F283-V286 VanDerWaalsContact O-N 3.12Å; V286-A288 PolarHBondContact O-N 2.91Å; V286-L289 HydrophobicContact CG1-CD1 4.11Å; V286-L289 VanDerWaalsContact O-CB 3.3Å; V286-L289 WeakPolarHBondContact O-CB 3.16Å; V286-L289 VanDerWaalsContact O-CG 3.27Å; V286-L289 WeakPolarHBondContact O-CG 3.47Å; V286-L289 PolarHBondContact O-N 2.89Å
287	C	90.9	Very high	90.5	Very high	2 Å²	2	26.8 Å²	26.8	1%	0.014	15%	0.15	C	C	.	.	H	α-helix	trans	-62.3	-21.2	175.2	-71.1	0	0	0	0	114.6	V128 V132 F283 V284 L285 L289 P290	V128-C287 HydrophobicContact CG1-CB 3.46Å; V128-C287 VanDerWaalsContact CG1-CB 3.46Å; V132-C287 HydrophobicContact CG2-CB 3.62Å; V132-C287 WeakPolarHBondContact CG2-SG 3.37Å; F283-C287 WeakPolarHBondContact CE2-SG 3.33Å; F283-C287 WeakPolarHBondContact CZ-SG 3.25Å; F283-C287 PolarHBondContact O-N 2.92Å; F283-C287 PolarHBondContact O-SG 3.39Å; V284-C287 PolarHBondContact O-N 3.17Å; L285-C287 PolarHBondContact O-N 3.29Å; C287-L289 VanDerWaalsContact C-N 3.3Å; C287-L289 PolarHBondContact O-N 3.35Å; C287-P290 WeakPolarHBondContact O-CD 3.24Å
288	A	91.4	Very high	91.2	Very high	5 Å²	5	25.4 Å²	25.4	4%	0.041	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-12.3	174.9	0	0	0	0	0	113.5	L285 V286 A291 I292	L285-A288 WeakPolarHBondContact O-CB 3.47Å; L285-A288 PolarHBondContact O-N 3.48Å; L285-A288 VanDerWaalsContact O-N 3.14Å; V286-A288 PolarHBondContact O-N 2.91Å; A288-A291 WeakPolarHBondContact O-CB 3.34Å; A288-A291 PolarHBondContact O-N 3.37Å; A288-I292 WeakPolarHBondContact O-CG1 3.13Å; A288-I292 PolarHBondContact O-N 3.25Å; A288-I292 VanDerWaalsContact O-N 3.1Å
289	L	93.3	Very high	91.7	Very high	85 Å²	85	28 Å²	28	45%	0.445	16%	0.158	S	C	.	.	H	α-helix	trans	-60.4	-45.2	-175	-68.1	175	0	0	0	114.2	V286 C287 A291 I292 T293	V286-L289 HydrophobicContact CG1-CD1 4.11Å; V286-L289 VanDerWaalsContact O-CB 3.3Å; V286-L289 WeakPolarHBondContact O-CB 3.16Å; V286-L289 VanDerWaalsContact O-CG 3.27Å; V286-L289 WeakPolarHBondContact O-CG 3.47Å; V286-L289 PolarHBondContact O-N 2.89Å; C287-L289 VanDerWaalsContact C-N 3.3Å; C287-L289 PolarHBondContact O-N 3.35Å; L289-A291 PolarHBondContact O-N 3.36Å; L289-I292 PolarHBondContact O-N 2.82Å; L289-T293 WeakPolarHBondContact O-CG2 3.27Å; L289-T293 PolarHBondContact O-N 3.23Å; L289-T293 PolarHBondContact O-OG1 3.17Å
290	P	94.1	Very high	92.2	Very high	6 Å²	6	35.7 Å²	35.7	4%	0.039	19%	0.191	C	C	.	.	H	α-helix	trans	-60	-34.1	175.9	-24.5	36.1	0	0	0	113.2	M124 A125 Y253 C287 T293 S294	M124-P290 HydrophobicContact CE-CB 4.35Å; M124-P290 HydrophobicContact CE-CG 3.8Å; M124-P290 HydrophobicContact CG-CB 4.21Å; M124-P290 HydrophobicContact CG-CG 4.47Å; M124-P290 HydrophobicContact SD-CB 4.03Å; M124-P290 HydrophobicContact SD-CG 4.15Å; A125-P290 HydrophobicContact CB-CB 4.29Å; Y253-P290 HydrophobicContact CD1-CG 4.1Å; Y253-P290 HydrophobicContact CE1-CG 3.72Å; C287-P290 WeakPolarHBondContact O-CD 3.24Å; P290-T293 WeakPolarHBondContact CA-OG1 3.42Å; P290-T293 PolarHBondContact O-OG1 3.35Å; P290-S294 WeakPolarHBondContact O-CB 3.38Å; P290-S294 PolarHBondContact O-N 3.38Å
291	A	93.5	Very high	92.6	Very high	1 Å²	1	36 Å²	36	1%	0.008	19%	0.193	C	C	.	.	H	α-helix	trans	-68.2	-42.6	177.1	0	0	0	0	0	111.3	A125 C190 A288 L289 S294 L295	A125-A291 HydrophobicContact CB-CB 3.74Å; C190-A291 WeakPolarHBondContact SG-CB 3.27Å; A288-A291 WeakPolarHBondContact O-CB 3.34Å; A288-A291 PolarHBondContact O-N 3.37Å; L289-A291 PolarHBondContact O-N 3.36Å; A291-S294 PolarHBondContact O-N 2.87Å; A291-L295 WeakPolarHBondContact O-CB 3.43Å; A291-L295 PolarHBondContact O-N 3.02Å
292	I	94.9	Very high	92.8	Very high	80 Å²	80	37 Å²	37	41%	0.41	20%	0.199	S	C	.	.	H	α-helix	trans	-65.2	-44.5	177.5	-64.6	167.5	0	0	0	110.8	C190 A288 L289 S294 L295 V296	C190-I292 HydrophobicContact CB-CG1 4.49Å; A288-I292 WeakPolarHBondContact O-CG1 3.13Å; A288-I292 PolarHBondContact O-N 3.25Å; A288-I292 VanDerWaalsContact O-N 3.1Å; L289-I292 PolarHBondContact O-N 2.82Å; I292-S294 PolarHBondContact O-N 3.4Å; I292-L295 WeakPolarHBondContact O-CB 3.28Å; I292-L295 PolarHBondContact O-N 3.06Å; I292-V296 WeakPolarHBondContact O-CG2 3.27Å; I292-V296 PolarHBondContact O-N 3.29Å
293	T	95.2	Very high	93.1	Very high	70 Å²	70	36.7 Å²	36.7	43%	0.429	20%	0.196	S	C	.	.	H	α-helix	trans	-65.1	-40	179.1	56.2	0	0	0	0	111.6	L289 P290 V296 G297	L289-T293 WeakPolarHBondContact O-CG2 3.27Å; L289-T293 PolarHBondContact O-N 3.23Å; L289-T293 PolarHBondContact O-OG1 3.17Å; P290-T293 WeakPolarHBondContact CA-OG1 3.42Å; P290-T293 PolarHBondContact O-OG1 3.35Å; T293-V296 PolarHBondContact O-N 3.21Å; T293-G297 PolarHBondContact O-N 2.97Å
294	S	94.9	Very high	93.1	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.4	-43.8	172.7	-172.8	0	0	0	0	112.1	V118 A122 P290 A291 I292 V296 G297 L298	V118-S294 PolarHBondContact O-OG 2.93Å; A122-S294 WeakPolarHBondContact CB-OG 3.49Å; A122-S294 PolarHBondContact N-OG 3.17Å; P290-S294 WeakPolarHBondContact O-CB 3.38Å; P290-S294 PolarHBondContact O-N 3.38Å; A291-S294 PolarHBondContact O-N 2.87Å; I292-S294 PolarHBondContact O-N 3.4Å; S294-V296 VanDerWaalsContact C-N 3.32Å; S294-V296 PolarHBondContact O-N 3.41Å; S294-G297 PolarHBondContact O-N 3.33Å; S294-G297 VanDerWaalsContact O-N 3.11Å; S294-L298 WeakPolarHBondContact O-CG 3.3Å; S294-L298 PolarHBondContact O-N 2.88Å
295	L	95.5	Very high	92.9	Very high	28 Å²	28	36.5 Å²	36.5	15%	0.147	20%	0.195	C	C	.	.	H	α-helix	trans	-58	-44.4	177.6	-176	65.8	0	0	0	111.7	I183 L186 A291 I292 L298 M299	I183-L295 HydrophobicContact CB-CD1 4.33Å; I183-L295 HydrophobicContact CG1-CD1 4.45Å; I183-L295 HydrophobicContact CG2-CD1 3.91Å; L186-L295 HydrophobicContact CB-CD1 4.37Å; A291-L295 WeakPolarHBondContact O-CB 3.43Å; A291-L295 PolarHBondContact O-N 3.02Å; I292-L295 WeakPolarHBondContact O-CB 3.28Å; I292-L295 PolarHBondContact O-N 3.06Å; L295-L298 PolarHBondContact O-N 3.49Å; L295-M299 WeakPolarHBondContact O-CG 3.43Å; L295-M299 PolarHBondContact O-N 3.49Å
296	V	95.8	Very high	92.6	Very high	68 Å²	68	35 Å²	35	41%	0.412	19%	0.186	S	C	.	.	H	α-helix	trans	-63.4	-44.5	175.1	174.5	0	0	0	0	111	I292 T293 S294 L298 M299 F300	I292-V296 WeakPolarHBondContact O-CG2 3.27Å; I292-V296 PolarHBondContact O-N 3.29Å; T293-V296 PolarHBondContact O-N 3.21Å; S294-V296 VanDerWaalsContact C-N 3.32Å; S294-V296 PolarHBondContact O-N 3.41Å; V296-L298 VanDerWaalsContact C-N 3.34Å; V296-L298 PolarHBondContact O-N 2.78Å; V296-M299 HydrophobicContact CG2-CE 4.16Å; V296-M299 WeakPolarHBondContact O-CB 3.35Å; V296-M299 PolarHBondContact O-N 2.92Å; V296-F300 HydrophobicContact CG1-CE2 4.07Å; V296-F300 WeakPolarHBondContact O-CD2 3.44Å; V296-F300 WeakPolarHBondContact O-CE2 3.49Å
297	G	94.5	Very high	92.2	Very high	15 Å²	15	34.1 Å²	34.1	16%	0.155	18%	0.179	C	C	.	.	H	α-helix	trans	-59	-42	176.1	0	0	0	0	0	113.3	T293 S294 M299 F300 M301	T293-G297 PolarHBondContact O-N 2.97Å; S294-G297 PolarHBondContact O-N 3.33Å; S294-G297 VanDerWaalsContact O-N 3.11Å; G297-M299 PolarHBondContact O-N 3.3Å; G297-F300 PolarHBondContact O-N 2.75Å; G297-F300 VanDerWaalsContact O-N 3.08Å; G297-M301 PolarHBondContact O-N 3.48Å
298	L	94.4	Very high	91.9	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-67.4	-21.2	179.9	-72.6	169.2	0	0	0	113.7	V118 L119 R179 L182 I183 L186 Y226 S294 L295 V296 F300 M301	V118-L298 HydrophobicContact CG1-CD2 3.79Å; V118-L298 HydrophobicContact CG1-CG 3.75Å; L119-L298 HydrophobicContact CD2-CD2 3.94Å; R179-L298 PolarHBondContact NE-O 3.21Å; R179-L298 PolarHBondContact NH2-O 3.01Å; L182-L298 HydrophobicContact CB-CD1 4.32Å; L182-L298 HydrophobicContact CD2-CD1 3.59Å; L182-L298 HydrophobicContact CD2-CD2 3.81Å; L182-L298 HydrophobicContact CD2-CG 4.35Å; L182-L298 HydrophobicContact CG-CD1 3.63Å; I183-L298 HydrophobicContact CD1-CB 4.39Å; I183-L298 HydrophobicContact CG1-CB 3.98Å; I183-L298 HydrophobicContact CG1-CD1 4.45Å; L186-L298 HydrophobicContact CD1-CD1 3.51Å; Y226-L298 HydrophobicContact CE1-CD2 4.41Å; S294-L298 WeakPolarHBondContact O-CG 3.3Å; S294-L298 PolarHBondContact O-N 2.88Å; L295-L298 PolarHBondContact O-N 3.49Å; V296-L298 VanDerWaalsContact C-N 3.34Å; V296-L298 PolarHBondContact O-N 2.78Å; L298-F300 PolarHBondContact O-N 2.84Å; L298-M301 PolarHBondContact O-N 2.93Å
299	M	92.6	Very high	91.3	Very high	108 Å²	108	34.3 Å²	34.3	53%	0.532	18%	0.18	S	C	.	.	H	α-helix	trans	-65	-28.1	172.3	-65.7	-165.2	-116.2	0	0	112	R179 L295 V296 G297	R179-M299 PolarHBondContact NH2-O 3.28Å; L295-M299 WeakPolarHBondContact O-CG 3.43Å; L295-M299 PolarHBondContact O-N 3.49Å; V296-M299 HydrophobicContact CG2-CE 4.16Å; V296-M299 WeakPolarHBondContact O-CB 3.35Å; V296-M299 PolarHBondContact O-N 2.92Å; G297-M299 PolarHBondContact O-N 3.3Å
300	F	92	Very high	90.4	Very high	169 Å²	169	32.7 Å²	32.7	74%	0.741	17%	0.17	S	C	*	.	H	α-helix	trans	-91.9	-14.4	178.9	-59.4	-75.7	0	0	0	114.1	V296 G297 L298	V296-F300 HydrophobicContact CG1-CE2 4.07Å; V296-F300 WeakPolarHBondContact O-CD2 3.44Å; V296-F300 WeakPolarHBondContact O-CE2 3.49Å; G297-F300 PolarHBondContact O-N 2.75Å; G297-F300 VanDerWaalsContact O-N 3.08Å; L298-F300 PolarHBondContact O-N 2.84Å
301	M	92.7	Very high	89.5	Confident	14 Å²	14	35.6 Å²	35.6	7%	0.069	19%	0.185	C	C	.	.	S	Bend	trans	-83.1	145.2	-179.4	-64.9	-61.5	171.6	0	0	111.8	S114 L115 V118 R179 G297 L298	S114-M301 WeakPolarHBondContact O-CE 3.29Å; S114-M301 WeakPolarHBondContact OG-CE 3.42Å; L115-M301 HydrophobicContact CD1-CB 4.45Å; L115-M301 HydrophobicContact CD1-CG 4.06Å; L115-M301 HydrophobicContact CD1-SD 4.01Å; V118-M301 HydrophobicContact CB-CE 4.2Å; V118-M301 HydrophobicContact CG1-CG 4.35Å; V118-M301 HydrophobicContact CG2-CE 3.6Å; R179-M301 WeakPolarHBondContact CD-O 3.47Å; R179-M301 PolarHBondContact NE-O 3.26Å; R179-M301 PolarHBondContact NH2-O 3.38Å; G297-M301 PolarHBondContact O-N 3.48Å; L298-M301 PolarHBondContact O-N 2.93Å
302	P	93.3	Very high	88.6	Confident	21 Å²	21	37.4 Å²	37.4	14%	0.136	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-80.1	165.6	177.3	31.7	-34.3	0	0	0	112.7	F111 Y226 F230 I320	F111-P302 HydrophobicContact CE2-CG 4.02Å; F111-P302 HydrophobicContact CZ-CG 3.62Å; Y226-P302 PolarHBondContact OH-O 3.42Å; F230-P302 HydrophobicContact CZ-CG 4.38Å; P302-I320 HydrophobicContact CB-CB 4.49Å; P302-I320 HydrophobicContact CB-CD1 3.9Å; P302-I320 HydrophobicContact CB-CG1 3.77Å; P302-I320 HydrophobicContact CB-CG2 3.91Å; P302-I320 HydrophobicContact CG-CG2 3.87Å
303	E	92.3	Very high	87.8	Confident	17 Å²	17	38 Å²	38	8%	0.079	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-68.1	161.2	169.5	-166.6	61.1	-106	0	0	110.5	R178 R179 F307 L308	R178-E303 PolarHBondContact N-OE1 2.83Å; R179-E303 WeakPolarHBondContact CB-OE2 3.49Å; R179-E303 PolarHBondContact N-OE1 3.34Å; E303-F307 HydrophobicContact CG-CD1 3.76Å; E303-F307 HydrophobicContact CG-CE1 4.34Å; E303-L308 HydrophobicContact CB-CD1 4.3Å; E303-L308 HydrophobicContact CG-CD2 4.46Å; E303-L308 HydrophobicContact CG-CG 4.43Å
304	S	90.4	Very high	87	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-64.1	130.2	177.2	175.4	0	0	0	0	111.7	E229 R306 F307 L308	E229-S304 WeakPolarHBondContact CB-OG 3.4Å; E229-S304 WeakPolarHBondContact OE2-CB 3.38Å; E229-S304 PolarHBondContact OE2-OG 3.14Å; S304-R306 VanDerWaalsContact C-N 3.28Å; S304-R306 PolarHBondContact O-N 3.25Å; S304-R306 PolarHBondContact OG-N 3.11Å; S304-F307 WeakPolarHBondContact O-CB 3.37Å; S304-F307 PolarHBondContact O-N 3.06Å; S304-L308 WeakPolarHBondContact O-CG 3.31Å; S304-L308 PolarHBondContact O-N 3.1Å
305	P	86.6	Confident	86.3	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-65.1	-32.7	177.2	25.7	-33.1	0	0	0	111.9	Y99 F230 L308 L309 A317 I320 L321	Y99-P305 HydrophobicContact CE2-CB 4.41Å; Y99-P305 HydrophobicContact CE2-CG 4.26Å; Y99-P305 WeakPolarHBondContact OH-CG 3.5Å; F230-P305 VanDerWaalsContact CE1-CD 3.41Å; F230-P305 HydrophobicContact CE1-CG 3.99Å; F230-P305 HydrophobicContact CZ-CG 4.32Å; P305-L308 PolarHBondContact O-N 3.08Å; P305-L309 WeakPolarHBondContact O-CG 3.41Å; P305-L309 PolarHBondContact O-N 3.39Å; P305-A317 HydrophobicContact CB-CB 4.46Å; P305-I320 HydrophobicContact CB-CG2 4.3Å; P305-I320 HydrophobicContact CG-CG2 4.33Å; P305-L321 HydrophobicContact CB-CD1 4.28Å; P305-L321 HydrophobicContact CB-CD2 3.98Å; P305-L321 HydrophobicContact CB-CG 3.78Å; P305-L321 HydrophobicContact CG-CD2 3.89Å; P305-L321 HydrophobicContact CG-CG 4.24Å
306	R	83.7	Confident	85.7	Confident	13 Å²	13	47.2 Å²	47.2	5%	0.049	24%	0.241	C	C	.	.	H	α-helix	trans	-65.1	-43	176.3	-171.7	172	-177.8	147.7	0.8	112.1	Y99 E229 S304 L308 L309 E310 A625 L687 Q688	Y99-R306 HydrophobicContact CE1-CB 4.34Å; Y99-R306 HydrophobicContact CE2-CB 4.16Å; E229-R306 HydrophobicContact CB-CB 4.38Å; E229-R306 HydrophobicContact CG-CB 4.25Å; S304-R306 VanDerWaalsContact C-N 3.28Å; S304-R306 PolarHBondContact O-N 3.25Å; S304-R306 PolarHBondContact OG-N 3.11Å; R306-L308 VanDerWaalsContact C-N 3.26Å; R306-L308 PolarHBondContact O-N 3.12Å; R306-L309 PolarHBondContact O-N 3.14Å; R306-E310 PolarHBondContact O-N 3.4Å; R306-E310 VanDerWaalsContact O-N 3.1Å; R306-A625 HydrophobicContact CG-CB 4.33Å; R306-L687 VanDerWaalsContact CZ-O 3.3Å; R306-L687 PolarHBondContact NH1-O 3.08Å; R306-L687 PolarHBondContact NH2-O 3.25Å; R306-Q688 PolarHBondContact NH2-O 2.69Å; R306-Q688 PolarHBondContact NH2-OXT 3.02Å
307	F	84.9	Confident	85.1	Confident	14 Å²	14	44 Å²	44	6%	0.061	22%	0.222	C	C	.	.	H	α-helix	trans	-55.8	-42.1	171.4	179.8	-108.6	0	0	0	112.3	G177 R178 E303 S304 E310 N311	G177-F307 VanDerWaalsContact CA-CE1 3.43Å; R178-F307 VanDerWaalsContact NH1-CA 3.34Å; E303-F307 HydrophobicContact CG-CD1 3.76Å; E303-F307 HydrophobicContact CG-CE1 4.34Å; S304-F307 WeakPolarHBondContact O-CB 3.37Å; S304-F307 PolarHBondContact O-N 3.06Å; F307-E310 PolarHBondContact O-N 3.17Å; F307-N311 WeakPolarHBondContact CD2-ND2 3.49Å; F307-N311 VanDerWaalsContact CE1-ND2 3.26Å; F307-N311 WeakPolarHBondContact CE1-ND2 3.18Å; F307-N311 WeakPolarHBondContact CE2-ND2 3.42Å; F307-N311 WeakPolarHBondContact CZ-ND2 3.45Å; F307-N311 PolarHBondContact O-N 3.05Å; F307-N311 VanDerWaalsContact O-N 3.16Å; F307-N311 PolarHBondContact O-ND2 3.08Å
308	L	83.8	Confident	84.6	Confident	4 Å²	4	48.4 Å²	48.4	2%	0.021	23%	0.234	C	C	.	.	H	α-helix	trans	-71.8	-36.4	-177.1	-68.9	170.8	0	0	0	112.1	E303 S304 P305 R306 N311 A312 K313 E316 A317 I320	E303-L308 HydrophobicContact CB-CD1 4.3Å; E303-L308 HydrophobicContact CG-CD2 4.46Å; E303-L308 HydrophobicContact CG-CG 4.43Å; S304-L308 WeakPolarHBondContact O-CG 3.31Å; S304-L308 PolarHBondContact O-N 3.1Å; P305-L308 PolarHBondContact O-N 3.08Å; R306-L308 VanDerWaalsContact C-N 3.26Å; R306-L308 PolarHBondContact O-N 3.12Å; L308-N311 CarbonylContact O-C 3.54Å; L308-N311 PolarHBondContact O-N 3.48Å; L308-A312 PolarHBondContact O-N 3.38Å; L308-K313 HydrophobicContact CB-CB 4.25Å; L308-K313 HydrophobicContact CD2-CB 4.11Å; L308-K313 HydrophobicContact CD2-CD 3.79Å; L308-K313 WeakPolarHBondContact O-CA 3.25Å; L308-K313 PolarHBondContact O-N 2.73Å; L308-E316 HydrophobicContact CD1-CB 3.98Å; L308-A317 HydrophobicContact CB-CB 3.77Å; L308-I320 HydrophobicContact CD1-CD1 3.35Å
309	L	79.2	Confident	84.1	Confident	8 Å²	8	54.4 Å²	54.4	4%	0.042	26%	0.264	C	S	.	.	H	α-helix	trans	-63.2	-43.8	173	-69.7	171.8	0	0	0	111.5	Y99 P305 R306 N311 A312 A317 I344 A346	Y99-L309 HydrophobicContact CD2-CD1 3.69Å; Y99-L309 HydrophobicContact CE2-CD1 4.14Å; P305-L309 WeakPolarHBondContact O-CG 3.41Å; P305-L309 PolarHBondContact O-N 3.39Å; R306-L309 PolarHBondContact O-N 3.14Å; L309-N311 VanDerWaalsContact C-N 3.28Å; L309-N311 PolarHBondContact O-N 3.16Å; L309-A312 PolarHBondContact O-N 3.45Å; L309-A312 VanDerWaalsContact O-N 3.13Å; L309-A317 HydrophobicContact CD2-CB 3.77Å; L309-A317 HydrophobicContact CG-CB 3.8Å; L309-I344 HydrophobicContact CD1-CD1 4.09Å; L309-I344 HydrophobicContact CD2-CD1 3.96Å; L309-I344 HydrophobicContact CD2-CG2 4.23Å; L309-A346 VanDerWaalsContact O-CB 3.24Å; L309-A346 WeakPolarHBondContact O-CB 3.5Å
310	E	75	Confident	84	Confident	51 Å²	51	50.3 Å²	50.3	24%	0.238	24%	0.244	C	C	.	.	H	α-helix	trans	-61.5	-35.3	175.7	-72.1	179.8	166.9	0	0	112.5	R306 F307 A312 A625 S626	R306-E310 PolarHBondContact O-N 3.4Å; R306-E310 VanDerWaalsContact O-N 3.1Å; F307-E310 PolarHBondContact O-N 3.17Å; E310-A312 VanDerWaalsContact C-N 3.25Å; E310-A312 PolarHBondContact O-N 2.87Å; E310-A625 WeakPolarHBondContact OE1-CB 3.45Å; E310-S626 PolarHBondContact OE1-N 3.32Å
311	N	75.2	Confident	83.7	Confident	67 Å²	67	42.5 Å²	42.5	36%	0.358	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	17.1	177.3	-68.7	-62.4	0	0	0	114	F307 L308 L309 K313	F307-N311 WeakPolarHBondContact CD2-ND2 3.49Å; F307-N311 VanDerWaalsContact CE1-ND2 3.26Å; F307-N311 WeakPolarHBondContact CE1-ND2 3.18Å; F307-N311 WeakPolarHBondContact CE2-ND2 3.42Å; F307-N311 WeakPolarHBondContact CZ-ND2 3.45Å; F307-N311 PolarHBondContact O-N 3.05Å; F307-N311 VanDerWaalsContact O-N 3.16Å; F307-N311 PolarHBondContact O-ND2 3.08Å; L308-N311 CarbonylContact O-C 3.54Å; L308-N311 PolarHBondContact O-N 3.48Å; L309-N311 VanDerWaalsContact C-N 3.28Å; L309-N311 PolarHBondContact O-N 3.16Å; N311-K313 PolarHBondContact O-N 3.19Å; N311-K313 VanDerWaalsContact O-N 3.13Å
312	A	73.9	Confident	83.3	Confident	39 Å²	39	45.9 Å²	45.9	32%	0.322	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	21.2	-179.4	0	0	0	0	0	115.8	L308 L309 E310 H314	L308-A312 PolarHBondContact O-N 3.38Å; L309-A312 PolarHBondContact O-N 3.45Å; L309-A312 VanDerWaalsContact O-N 3.13Å; E310-A312 VanDerWaalsContact C-N 3.25Å; E310-A312 PolarHBondContact O-N 2.87Å; A312-H314 VanDerWaalsContact C-ND1 3.32Å; A312-H314 PolarHBondContact O-N 3.28Å; A312-H314 PolarHBondContact O-ND1 3.19Å
313	K	78.9	Confident	83	Confident	91 Å²	91	48.5 Å²	48.5	40%	0.396	24%	0.236	S	C	.	.			trans	-93.3	65	176.3	-65.2	-174.8	175.5	-166.7	0	111.9	L308 N311 D315 E316 A317	L308-K313 HydrophobicContact CB-CB 4.25Å; L308-K313 HydrophobicContact CD2-CB 4.11Å; L308-K313 HydrophobicContact CD2-CD 3.79Å; L308-K313 WeakPolarHBondContact O-CA 3.25Å; L308-K313 PolarHBondContact O-N 2.73Å; N311-K313 PolarHBondContact O-N 3.19Å; N311-K313 VanDerWaalsContact O-N 3.13Å; K313-D315 PolarHBondContact O-N 2.96Å; K313-E316 HydrophobicContact CB-CB 4.47Å; K313-E316 PolarHBondContact O-N 2.92Å; K313-A317 PolarHBondContact O-N 3.26Å; K313-A317 VanDerWaalsContact O-N 3.11Å
314	H	77.6	Confident	82.8	Confident	56 Å²	56	47.8 Å²	47.8	26%	0.259	23%	0.233	S	C	.	.	H	α-helix	trans	-63.2	-40.3	-171.3	-59.5	79	0	0	0	113.1	A312 A317 W318 I344 A346	A312-H314 VanDerWaalsContact C-ND1 3.32Å; A312-H314 PolarHBondContact O-N 3.28Å; A312-H314 PolarHBondContact O-ND1 3.19Å; H314-A317 PolarHBondContact O-N 3.39Å; H314-W318 WeakPolarHBondContact O-CB 3.24Å; H314-W318 PolarHBondContact O-N 3.15Å; H314-I344 PolarHBondContact CD2-O 3.41Å; H314-I344 VanDerWaalsContact CD2-O 3.25Å; H314-I344 PolarHBondContact NE2-O 2.98Å; H314-A346 PolarHBondContact NE2-N 3.49Å
315	D	79.6	Confident	82.6	Confident	135 Å²	135	48 Å²	48	72%	0.722	24%	0.235	S	C	*	.	H	α-helix	trans	-66.8	-42.6	-177.7	-59.4	-28	0	0	0	112.2	K313 W318 M319	K313-D315 PolarHBondContact O-N 2.96Å; D315-W318 PolarHBondContact O-N 3Å; D315-M319 WeakPolarHBondContact O-CG 3.42Å; D315-M319 PolarHBondContact O-N 3.48Å
316	E	83.5	Confident	82.5	Confident	101 Å²	101	49.7 Å²	49.7	47%	0.472	24%	0.243	S	C	.	.	H	α-helix	trans	-65.3	-44.1	176	-68.5	-178.7	-160.5	0	0	110.9	L308 K313 W318 M319 I320	L308-E316 HydrophobicContact CD1-CB 3.98Å; K313-E316 HydrophobicContact CB-CB 4.47Å; K313-E316 PolarHBondContact O-N 2.92Å; E316-W318 VanDerWaalsContact C-N 3.32Å; E316-W318 PolarHBondContact O-N 2.79Å; E316-M319 PolarHBondContact O-N 3.48Å; E316-I320 WeakPolarHBondContact O-CD1 3.41Å; E316-I320 WeakPolarHBondContact O-CG1 3.44Å; E316-I320 PolarHBondContact O-N 3.22Å; E316-I320 VanDerWaalsContact O-N 3.14Å
317	A	83.9	Confident	82.6	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-60	-43.6	176.9	0	0	0	0	0	111.6	P305 L308 L309 K313 H314 I320 L321	P305-A317 HydrophobicContact CB-CB 4.46Å; L308-A317 HydrophobicContact CB-CB 3.77Å; L309-A317 HydrophobicContact CD2-CB 3.77Å; L309-A317 HydrophobicContact CG-CB 3.8Å; K313-A317 PolarHBondContact O-N 3.26Å; K313-A317 VanDerWaalsContact O-N 3.11Å; H314-A317 PolarHBondContact O-N 3.39Å; A317-I320 PolarHBondContact O-N 3.28Å; A317-L321 WeakPolarHBondContact O-CG 3.42Å; A317-L321 PolarHBondContact O-N 3.49Å
318	W	82.4	Confident	82.7	Confident	108 Å²	108	50.5 Å²	50.5	41%	0.409	25%	0.251	S	S	.	.	H	α-helix	trans	-64.7	-44.3	178.8	-179.7	85	0	0	0	112.3	H314 D315 E316 I320 L321 K322 F339	H314-W318 WeakPolarHBondContact O-CB 3.24Å; H314-W318 PolarHBondContact O-N 3.15Å; D315-W318 PolarHBondContact O-N 3Å; E316-W318 VanDerWaalsContact C-N 3.32Å; E316-W318 PolarHBondContact O-N 2.79Å; W318-I320 PolarHBondContact O-N 2.89Å; W318-L321 PolarHBondContact O-N 3.32Å; W318-K322 HydrophobicContact CH2-CD 3.63Å; W318-K322 HydrophobicContact CZ2-CD 3.93Å; W318-K322 HydrophobicContact CZ3-CD 4.06Å; W318-K322 WeakPolarHBondContact O-CB 3.26Å; W318-K322 PolarHBondContact O-N 2.78Å; W318-F339 AromaticContact CD1-CE1 3.96Å; W318-F339 AromaticContact NE1-CD1 3.8Å; W318-F339 AromaticContact NE1-CE1 3.88Å
319	M	85.7	Confident	82.5	Confident	127 Å²	127	51.3 Å²	51.3	63%	0.626	25%	0.254	S	S	*	.	H	α-helix	trans	-57.1	-40.2	175.6	-74.1	-106.3	-72.3	0	0	111.8	D315 E316 N323	D315-M319 WeakPolarHBondContact O-CG 3.42Å; D315-M319 PolarHBondContact O-N 3.48Å; E316-M319 PolarHBondContact O-N 3.48Å; M319-N323 WeakPolarHBondContact O-CB 3.37Å; M319-N323 PolarHBondContact O-N 3.31Å
320	I	88.7	Confident	82.5	Confident	22 Å²	22	58.2 Å²	58.2	11%	0.113	28%	0.279	C	S	.	.	H	α-helix	trans	-70.7	-48.6	179.3	-68.1	162.1	0	0	0	110.7	F230 P302 P305 L308 E316 A317 W318 K322 N323 V324	F230-I320 HydrophobicContact CE1-CG2 4.17Å; F230-I320 HydrophobicContact CZ-CG2 4.48Å; P302-I320 HydrophobicContact CB-CB 4.49Å; P302-I320 HydrophobicContact CB-CD1 3.9Å; P302-I320 HydrophobicContact CB-CG1 3.77Å; P302-I320 HydrophobicContact CB-CG2 3.91Å; P302-I320 HydrophobicContact CG-CG2 3.87Å; P305-I320 HydrophobicContact CB-CG2 4.3Å; P305-I320 HydrophobicContact CG-CG2 4.33Å; L308-I320 HydrophobicContact CD1-CD1 3.35Å; E316-I320 WeakPolarHBondContact O-CD1 3.41Å; E316-I320 WeakPolarHBondContact O-CG1 3.44Å; E316-I320 PolarHBondContact O-N 3.22Å; E316-I320 VanDerWaalsContact O-N 3.14Å; A317-I320 PolarHBondContact O-N 3.28Å; W318-I320 PolarHBondContact O-N 2.89Å; I320-K322 VanDerWaalsContact C-N 3.3Å; I320-K322 PolarHBondContact O-N 3Å; I320-N323 WeakPolarHBondContact O-CB 3.39Å; I320-N323 PolarHBondContact O-N 3.33Å; I320-V324 HydrophobicContact CG2-CG2 4.45Å; I320-V324 WeakPolarHBondContact O-CG2 3.48Å; I320-V324 PolarHBondContact O-N 3.09Å
321	L	86.3	Confident	82.5	Confident	5 Å²	5	58 Å²	58	3%	0.026	29%	0.286	C	S	.	.	H	α-helix	trans	-58.6	-43.1	177.7	-73	167	0	0	0	111.7	Y99 I102 M103 P305 A317 W318 N323 V324 H325 F339	Y99-L321 HydrophobicContact CE2-CD2 4.27Å; I102-L321 HydrophobicContact CG2-CD1 4.11Å; I102-L321 HydrophobicContact CG2-CD2 4.22Å; M103-L321 HydrophobicContact SD-CD2 3.83Å; P305-L321 HydrophobicContact CB-CD1 4.28Å; P305-L321 HydrophobicContact CB-CD2 3.98Å; P305-L321 HydrophobicContact CB-CG 3.78Å; P305-L321 HydrophobicContact CG-CD2 3.89Å; P305-L321 HydrophobicContact CG-CG 4.24Å; A317-L321 WeakPolarHBondContact O-CG 3.42Å; A317-L321 PolarHBondContact O-N 3.49Å; W318-L321 PolarHBondContact O-N 3.32Å; L321-N323 VanDerWaalsContact C-N 3.35Å; L321-N323 PolarHBondContact O-N 3.35Å; L321-V324 PolarHBondContact O-N 3.3Å; L321-H325 WeakPolarHBondContact O-CB 3.26Å; L321-H325 PolarHBondContact O-N 2.95Å; L321-F339 HydrophobicContact CB-CE1 4.28Å; L321-F339 HydrophobicContact CB-CZ 3.92Å
322	K	85.3	Confident	82.6	Confident	84 Å²	84	60.5 Å²	60.5	37%	0.365	29%	0.294	S	S	.	.	H	α-helix	trans	-60.1	-44.1	173.4	-176.9	176.8	178.6	178.8	0	111.8	W318 I320 V324 H325 D326	W318-K322 HydrophobicContact CH2-CD 3.63Å; W318-K322 HydrophobicContact CZ2-CD 3.93Å; W318-K322 HydrophobicContact CZ3-CD 4.06Å; W318-K322 WeakPolarHBondContact O-CB 3.26Å; W318-K322 PolarHBondContact O-N 2.78Å; I320-K322 VanDerWaalsContact C-N 3.3Å; I320-K322 PolarHBondContact O-N 3Å; K322-V324 VanDerWaalsContact C-N 3.33Å; K322-V324 PolarHBondContact O-N 2.92Å; K322-H325 PolarHBondContact O-N 3.41Å; K322-D326 VanDerWaalsContact O-CB 3.24Å; K322-D326 WeakPolarHBondContact O-CB 3.36Å; K322-D326 VanDerWaalsContact O-CG 3.3Å; K322-D326 PolarHBondContact O-N 3.4Å
323	N	87.3	Confident	82.4	Confident	76 Å²	76	61.5 Å²	61.5	41%	0.406	31%	0.308	S	S	.	.	H	α-helix	trans	-62.4	-40.1	177	-174.2	28.1	0	0	0	112.1	M319 I320 L321 T327	M319-N323 WeakPolarHBondContact O-CB 3.37Å; M319-N323 PolarHBondContact O-N 3.31Å; I320-N323 WeakPolarHBondContact O-CB 3.39Å; I320-N323 PolarHBondContact O-N 3.33Å; L321-N323 VanDerWaalsContact C-N 3.35Å; L321-N323 PolarHBondContact O-N 3.35Å; N323-T327 VanDerWaalsContact O-CB 3.24Å; N323-T327 WeakPolarHBondContact O-CB 3.33Å; N323-T327 PolarHBondContact O-N 2.93Å; N323-T327 PolarHBondContact O-OG1 3.25Å
324	V	87.6	Confident	81.8	Confident	2 Å²	2	62.6 Å²	62.6	1%	0.012	32%	0.315	C	S	.	.	H	α-helix	trans	-63.8	-51.3	175.8	175.9	0	0	0	0	110.6	C106 F111 F230 I320 L321 K322 T327 N328	C106-V324 HydrophobicContact CB-CG1 4.41Å; F111-V324 HydrophobicContact CB-CG1 4.42Å; F111-V324 HydrophobicContact CD1-CB 4.35Å; F111-V324 HydrophobicContact CD1-CG1 3.95Å; F111-V324 HydrophobicContact CD1-CG2 3.66Å; F111-V324 HydrophobicContact CD2-CG2 4.2Å; F111-V324 HydrophobicContact CE1-CG2 3.59Å; F111-V324 HydrophobicContact CE2-CG2 4.13Å; F111-V324 HydrophobicContact CG-CB 4.46Å; F111-V324 HydrophobicContact CG-CG1 4.26Å; F111-V324 HydrophobicContact CG-CG2 3.98Å; F111-V324 HydrophobicContact CZ-CG2 3.83Å; F230-V324 HydrophobicContact CD1-CG2 4.27Å; F230-V324 HydrophobicContact CE1-CG2 4.11Å; I320-V324 HydrophobicContact CG2-CG2 4.45Å; I320-V324 WeakPolarHBondContact O-CG2 3.48Å; I320-V324 PolarHBondContact O-N 3.09Å; L321-V324 PolarHBondContact O-N 3.3Å; K322-V324 VanDerWaalsContact C-N 3.33Å; K322-V324 PolarHBondContact O-N 2.92Å; V324-T327 PolarHBondContact O-N 3.1Å; V324-N328 WeakPolarHBondContact O-CB 3.39Å; V324-N328 VanDerWaalsContact O-CG 3.27Å; V324-N328 PolarHBondContact O-N 3.09Å; V324-N328 PolarHBondContact O-ND2 3.45Å
325	H	85.8	Confident	80.8	Confident	6 Å²	6	63.8 Å²	63.8	3%	0.028	33%	0.327	C	S	.	.	H	α-helix	trans	-55.8	-54.2	176.7	173.4	-84.7	0	0	0	111.2	D105 C106 L321 K322 T327 N328 W329 K337 F339	D105-H325 PolarHBondContact O-CD2 3.39Å; C106-H325 HydrophobicContact CB-CB 4.42Å; L321-H325 WeakPolarHBondContact O-CB 3.26Å; L321-H325 PolarHBondContact O-N 2.95Å; K322-H325 PolarHBondContact O-N 3.41Å; H325-T327 VanDerWaalsContact C-N 3.33Å; H325-T327 PolarHBondContact O-N 3.4Å; H325-N328 PolarHBondContact O-N 3.44Å; H325-N328 VanDerWaalsContact O-N 3.15Å; H325-W329 AromaticContact NE2-CD2 3.8Å; H325-W329 AromaticContact NE2-CE2 3.98Å; H325-W329 WeakPolarHBondContact O-CB 3.25Å; H325-W329 PolarHBondContact O-N 3.18Å; H325-K337 PolarHBondContact CE1-O 3.34Å; H325-F339 HydrophobicContact CB-CD2 4.41Å
326	D	84.4	Confident	79.4	Confident	35 Å²	35	65.7 Å²	65.7	19%	0.187	33%	0.332	C	S	.	.	H	α-helix	trans	-57.8	-44	-179.9	-81.5	12.8	0	0	0	112	K322 N328 W329 R330	K322-D326 VanDerWaalsContact O-CB 3.24Å; K322-D326 WeakPolarHBondContact O-CB 3.36Å; K322-D326 VanDerWaalsContact O-CG 3.3Å; K322-D326 PolarHBondContact O-N 3.4Å; D326-N328 VanDerWaalsContact C-N 3.32Å; D326-N328 PolarHBondContact O-N 3.07Å; D326-W329 PolarHBondContact O-N 3.18Å; D326-R330 WeakPolarHBondContact O-CB 3.44Å; D326-R330 WeakPolarHBondContact O-CG 3.41Å; D326-R330 PolarHBondContact O-N 2.94Å; D326-R330 IonicContact OD2-NH2 2.97Å; D326-R330 PolarHBondContact OD2-NH2 3.07Å
327	T	85.7	Confident	78	Confident	43 Å²	43	66.9 Å²	66.9	26%	0.264	34%	0.336	S	S	.	.	H	α-helix	trans	-63.8	-40.7	179.4	-61.6	0	0	0	0	111.2	R110 F111 N323 V324 H325 A331	R110-T327 HydrophobicContact CB-CG2 4.32Å; F111-T327 HydrophobicContact CB-CG2 4.02Å; N323-T327 VanDerWaalsContact O-CB 3.24Å; N323-T327 WeakPolarHBondContact O-CB 3.33Å; N323-T327 PolarHBondContact O-N 2.93Å; N323-T327 PolarHBondContact O-OG1 3.25Å; V324-T327 PolarHBondContact O-N 3.1Å; H325-T327 VanDerWaalsContact C-N 3.33Å; H325-T327 PolarHBondContact O-N 3.4Å; T327-A331 WeakPolarHBondContact O-CB 3.41Å; T327-A331 PolarHBondContact O-N 3.45Å
328	N	86.5	Confident	76.5	Confident	0 Å²	0	72.5 Å²	72.5	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-72.9	-39	-179.7	-72.6	-17.1	0	0	0	112.6	C106 G107 G109 R110 F111 Q112 V324 H325 D326 A331 K332	C106-N328 PolarHBondContact O-ND2 3.32Å; G107-N328 PolarHBondContact O-ND2 3.17Å; G109-N328 VanDerWaalsContact CA-OD1 3.22Å; G109-N328 WeakPolarHBondContact CA-OD1 3.47Å; R110-N328 PolarHBondContact N-OD1 2.87Å; F111-N328 PolarHBondContact N-OD1 2.79Å; Q112-N328 PolarHBondContact NE2-ND2 3.49Å; Q112-N328 VanDerWaalsContact NE2-ND2 3.2Å; Q112-N328 PolarHBondContact OE1-ND2 3.18Å; Q112-N328 PolarHBondContact OE1-OD1 3.32Å; Q112-N328 VanDerWaalsContact OE1-OD1 3.13Å; V324-N328 WeakPolarHBondContact O-CB 3.39Å; V324-N328 VanDerWaalsContact O-CG 3.27Å; V324-N328 PolarHBondContact O-N 3.09Å; V324-N328 PolarHBondContact O-ND2 3.45Å; H325-N328 PolarHBondContact O-N 3.44Å; H325-N328 VanDerWaalsContact O-N 3.15Å; D326-N328 VanDerWaalsContact C-N 3.32Å; D326-N328 PolarHBondContact O-N 3.07Å; N328-A331 WeakPolarHBondContact O-CB 3.43Å; N328-K332 WeakPolarHBondContact O-CG 3.25Å; N328-K332 PolarHBondContact O-N 2.93Å
329	W	80.7	Confident	75.1	Confident	21 Å²	21	69 Å²	69	8%	0.08	36%	0.358	C	S	.	.	H	α-helix	trans	-81.5	-35.7	-177.6	-97	-108.9	0	0	0	112.7	D105 C106 G107 H325 D326 A331 K332 G333 Q334	D105-W329 WeakPolarHBondContact O-CH2 3.37Å; D105-W329 WeakPolarHBondContact O-CZ2 3.39Å; C106-W329 VanDerWaalsContact C-CH2 3.44Å; C106-W329 WeakPolarHBondContact O-CZ3 3.39Å; G107-W329 VanDerWaalsContact N-CZ3 3.28Å; H325-W329 AromaticContact NE2-CD2 3.8Å; H325-W329 AromaticContact NE2-CE2 3.98Å; H325-W329 WeakPolarHBondContact O-CB 3.25Å; H325-W329 PolarHBondContact O-N 3.18Å; D326-W329 PolarHBondContact O-N 3.18Å; W329-A331 PolarHBondContact O-N 3.18Å; W329-K332 CarbonylContact O-C 3.48Å; W329-K332 PolarHBondContact O-N 3.38Å; W329-K332 VanDerWaalsContact O-N 3.11Å; W329-G333 PolarHBondContact O-N 2.92Å; W329-G333 VanDerWaalsContact O-N 3.12Å; W329-Q334 WeakPolarHBondContact CB-O 3.47Å; W329-Q334 VanDerWaalsContact CD1-O 3.23Å; W329-Q334 PolarHBondContact O-N 2.55Å
330	R	79.6	Confident	73.4	Confident	153 Å²	153	71 Å²	71	58%	0.577	37%	0.365	S	S	*	.	H	α-helix	trans	-58.9	-39.4	168.5	-73.8	178	-143.3	-179.3	8.2	111.2	D326 K332 G333 P335	D326-R330 WeakPolarHBondContact O-CB 3.44Å; D326-R330 WeakPolarHBondContact O-CG 3.41Å; D326-R330 PolarHBondContact O-N 2.94Å; D326-R330 IonicContact OD2-NH2 2.97Å; D326-R330 PolarHBondContact OD2-NH2 3.07Å; R330-K332 VanDerWaalsContact C-N 3.27Å; R330-K332 PolarHBondContact O-N 3.48Å; R330-G333 PolarHBondContact O-N 3.49Å; R330-P335 HydrophobicContact CG-CB 4.21Å
331	A	74.4	Confident	71.6	Confident	47 Å²	47	72.2 Å²	72.2	39%	0.388	37%	0.374	S	S	.	.	H	α-helix	trans	-63.9	-32.1	176.1	0	0	0	0	0	113.4	R110 T327 N328 W329 G333	R110-A331 HydrophobicContact CB-CB 4.36Å; R110-A331 HydrophobicContact CG-CB 3.57Å; T327-A331 WeakPolarHBondContact O-CB 3.41Å; T327-A331 PolarHBondContact O-N 3.45Å; N328-A331 WeakPolarHBondContact O-CB 3.43Å; W329-A331 PolarHBondContact O-N 3.18Å; A331-G333 VanDerWaalsContact C-N 3.34Å
332	K	76.4	Confident	70	Confident	119 Å²	119	76.9 Å²	76.9	52%	0.517	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	0.4	177.9	-69.2	177.4	-177.4	175.2	0	113.5	H108 N328 W329 R330	H108-K332 WeakPolarHBondContact O-CE 3.34Å; H108-K332 PolarHBondContact O-NZ 2.79Å; N328-K332 WeakPolarHBondContact O-CG 3.25Å; N328-K332 PolarHBondContact O-N 2.93Å; W329-K332 CarbonylContact O-C 3.48Å; W329-K332 PolarHBondContact O-N 3.38Å; W329-K332 VanDerWaalsContact O-N 3.11Å; R330-K332 VanDerWaalsContact C-N 3.27Å; R330-K332 PolarHBondContact O-N 3.48Å
333	G	70.3	Confident	68.2	Low	61 Å²	61	82 Å²	82	63%	0.629	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	14.6	179.5	0	0	0	0	0	115.4	W329 R330 A331 P335	W329-G333 PolarHBondContact O-N 2.92Å; W329-G333 VanDerWaalsContact O-N 3.12Å; R330-G333 PolarHBondContact O-N 3.49Å; A331-G333 VanDerWaalsContact C-N 3.34Å; G333-P335 WeakPolarHBondContact O-CD 3.46Å
334	Q	67.1	Low	66.6	Low	113 Å²	113	79.3 Å²	79.3	53%	0.528	41%	0.413	S	S	.	.			trans	-123.5	72.1	179.7	-67.7	-173.8	-8.1	0	0	111.8	W329 E336	W329-Q334 WeakPolarHBondContact CB-O 3.47Å; W329-Q334 VanDerWaalsContact CD1-O 3.23Å; W329-Q334 PolarHBondContact O-N 2.55Å; Q334-E336 VanDerWaalsContact C-N 3.26Å; Q334-E336 PolarHBondContact O-N 2.91Å
335	P	56.3	Low	64.6	Low	81 Å²	81	88.3 Å²	88.3	53%	0.526	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-9.1	-171.3	28.3	-34.3	0	0	0	115.7	R330 G333	R330-P335 HydrophobicContact CG-CB 4.21Å; G333-P335 WeakPolarHBondContact O-CD 3.46Å
336	E	49.8	Very low	63.1	Low	176 Å²	176	88.8 Å²	88.8	82%	0.822	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	5.7	-165.1	-63	-173.3	166.1	0	0	116	Q334 V338	Q334-E336 VanDerWaalsContact C-N 3.26Å; Q334-E336 PolarHBondContact O-N 2.91Å; E336-V338 PolarHBondContact O-N 3.42Å
337	K	53.3	Low	61.4	Low	125 Å²	125	90 Å²	90	54%	0.543	47%	0.466	S	S	.	.			trans	-64.3	114.5	173.9	-77.4	-154.4	-173.3	179.8	0	109.5	H325 F339	H325-K337 PolarHBondContact CE1-O 3.34Å; K337-F339 PolarHBondContact O-N 3.22Å
338	V	52.3	Low	59.6	Low	119 Å²	119	96.8 Å²	96.8	72%	0.721	49%	0.492	S	S	*	.			trans	-71.7	113.4	-179.1	-177.6	0	0	0	0	108.9	E336 Q340	E336-V338 PolarHBondContact O-N 3.42Å; V338-Q340 HydrophobicContact CG1-CG 4.11Å; V338-Q340 PolarHBondContact O-N 2.94Å; V338-Q340 VanDerWaalsContact O-N 3.1Å
339	F	54.7	Low	58	Low	35 Å²	35	100.7 Å²	100.7	15%	0.154	52%	0.516	C	S	.	.			trans	-69.9	100.7	173	-171.1	-109.7	0	0	0	109.7	I102 W318 L321 H325 K337 V341	I102-F339 HydrophobicContact CG2-CE2 3.74Å; I102-F339 HydrophobicContact CG2-CZ 3.51Å; W318-F339 AromaticContact CD1-CE1 3.96Å; W318-F339 AromaticContact NE1-CD1 3.8Å; W318-F339 AromaticContact NE1-CE1 3.88Å; L321-F339 HydrophobicContact CB-CE1 4.28Å; L321-F339 HydrophobicContact CB-CZ 3.92Å; H325-F339 HydrophobicContact CB-CD2 4.41Å; K337-F339 PolarHBondContact O-N 3.22Å; F339-V341 HydrophobicContact CD1-CG2 3.81Å; F339-V341 HydrophobicContact CE1-CB 4.35Å; F339-V341 HydrophobicContact CE1-CG2 3.21Å; F339-V341 HydrophobicContact CE2-CG2 4.07Å; F339-V341 HydrophobicContact CG-CG2 4.46Å; F339-V341 HydrophobicContact CZ-CG2 3.36Å
340	Q	48.5	Very low	56.2	Low	168 Å²	168	106.6 Å²	106.6	79%	0.785	55%	0.545	S	S	*	.			trans	-98.8	119.3	174	-65.7	-170.1	-5.1	0	0	108.9	V338	V338-Q340 HydrophobicContact CG1-CG 4.11Å; V338-Q340 PolarHBondContact O-N 2.94Å; V338-Q340 VanDerWaalsContact O-N 3.1Å
341	V	52.2	Low	54.8	Low	48 Å²	48	104.1 Å²	104.1	29%	0.291	54%	0.54	S	S	.	.			trans	-121.5	125.7	173	175	0	0	0	0	109.6	I102 F339 I344	I102-V341 HydrophobicContact CD1-CG1 3.75Å; I102-V341 HydrophobicContact CD1-CG2 3.93Å; I102-V341 HydrophobicContact CG1-CG2 4.09Å; F339-V341 HydrophobicContact CD1-CG2 3.81Å; F339-V341 HydrophobicContact CE1-CB 4.35Å; F339-V341 HydrophobicContact CE1-CG2 3.21Å; F339-V341 HydrophobicContact CE2-CG2 4.07Å; F339-V341 HydrophobicContact CG-CG2 4.46Å; F339-V341 HydrophobicContact CZ-CG2 3.36Å; V341-I344 HydrophobicContact CG1-CD1 4.18Å; V341-I344 HydrophobicContact CG1-CG1 4.33Å
342	T	51.6	Low	53.8	Low	102 Å²	102	105.5 Å²	105.5	63%	0.626	54%	0.541	S	S	*	.			trans	-65.1	135.7	168.5	43.8	0	0	0	0	109.8	I344	T342-I344 PolarHBondContact O-N 3.46Å
343	H	47.4	Very low	52.6	Low	191 Å²	191	105.8 Å²	105.8	88%	0.884	54%	0.544	S	S	*	.			trans	-46.2	112.6	179.5	-92.6	-82.7	0	0	0	112.4
344	I	54.1	Low	51.7	Low	20 Å²	20	109.4 Å²	109.4	10%	0.103	54%	0.542	C	S	.	.			trans	-79.9	123.4	172.4	-64.3	172.5	0	0	0	107.7	L95 I102 L309 H314 V341 T342	L95-I344 HydrophobicContact CD1-CB 4.45Å; L95-I344 HydrophobicContact CD1-CG2 3.15Å; I102-I344 HydrophobicContact CD1-CD1 4.08Å; L309-I344 HydrophobicContact CD1-CD1 4.09Å; L309-I344 HydrophobicContact CD2-CD1 3.96Å; L309-I344 HydrophobicContact CD2-CG2 4.23Å; H314-I344 PolarHBondContact CD2-O 3.41Å; H314-I344 VanDerWaalsContact CD2-O 3.25Å; H314-I344 PolarHBondContact NE2-O 2.98Å; V341-I344 HydrophobicContact CG1-CD1 4.18Å; V341-I344 HydrophobicContact CG1-CG1 4.33Å; T342-I344 PolarHBondContact O-N 3.46Å
345	K	46.6	Very low	51.1	Low	191 Å²	191	106.6 Å²	106.6	83%	0.83	53%	0.531	S	S	*	.			trans	-101	103	169.9	-79.8	-177.7	179.4	176.4	0	108.7
346	A	52.9	Low	51.2	Low	16 Å²	16	109.7 Å²	109.7	13%	0.132	54%	0.538	C	S	.	.			trans	-77.9	136.3	166.7	0	0	0	0	0	110.5	L309 H314 K348	L309-A346 VanDerWaalsContact O-CB 3.24Å; L309-A346 WeakPolarHBondContact O-CB 3.5Å; H314-A346 PolarHBondContact NE2-N 3.49Å; A346-K348 PolarHBondContact O-N 3.29Å
347	P	48.7	Very low	51.3	Low	60 Å²	60	106.5 Å²	106.5	39%	0.39	53%	0.525	S	S	.	.			trans	-68	123.1	172.9	26.1	-31.1	0	0	0	109.5	T349	P347-T349 PolarHBondContact O-N 3.21Å
348	K	48	Very low	51.3	Low	186 Å²	186	107 Å²	107	81%	0.809	53%	0.53	S	S	*	.			trans	-71.4	111.7	170.6	-71.1	-177.3	175.8	-175.1	0	108.6	A346 Q350	A346-K348 PolarHBondContact O-N 3.29Å; K348-Q350 PolarHBondContact O-N 3.04Å
349	T	52.7	Low	51.4	Low	83 Å²	83	102.1 Å²	102.1	51%	0.509	50%	0.501	S	S	.	.			trans	-69.9	121	172	15.7	0	0	0	0	110.5	P347 E351 D352	P347-T349 PolarHBondContact O-N 3.21Å; T349-E351 PolarHBondContact O-N 3.46Å; T349-D352 PolarHBondContact O-N 3.38Å; T349-D352 VanDerWaalsContact O-N 3.11Å; T349-D352 PolarHBondContact OG1-OD2 2.95Å
350	Q	43.9	Very low	51.6	Low	145 Å²	145	104.4 Å²	104.4	68%	0.678	53%	0.526	S	S	*	.	H	α-helix	trans	-56.7	-21.1	-179.1	-155.6	176.2	9.1	0	0	113.4	K348 F354	K348-Q350 PolarHBondContact O-N 3.04Å; Q350-F354 HydrophobicContact CG-CE2 4.27Å; Q350-F354 VanDerWaalsContact O-CD2 3.24Å; Q350-F354 WeakPolarHBondContact O-CD2 3.24Å
351	E	50.7	Low	52.1	Low	101 Å²	101	102.4 Å²	102.4	47%	0.472	53%	0.526	S	S	.	.	H	α-helix	trans	-70.3	-29.8	178.1	-64.8	-174.3	166	0	0	113.4	T349 I355 K381	T349-E351 PolarHBondContact O-N 3.46Å; E351-I355 WeakPolarHBondContact O-CD1 3.04Å; E351-I355 WeakPolarHBondContact O-CG1 3.45Å; E351-K381 IonicContact OE1-NZ 2.67Å; E351-K381 PolarHBondContact OE1-NZ 2.91Å; E351-K381 IonicContact OE2-NZ 2.73Å; E351-K381 PolarHBondContact OE2-NZ 2.86Å
352	D	52.8	Low	52.7	Low	76 Å²	76	101.4 Å²	101.4	41%	0.406	53%	0.525	S	S	.	.	H	α-helix	trans	-74.2	-32.2	-177.7	-64.8	-49	0	0	0	112	T349 I355 E356	T349-D352 PolarHBondContact O-N 3.38Å; T349-D352 VanDerWaalsContact O-N 3.11Å; T349-D352 PolarHBondContact OG1-OD2 2.95Å; D352-I355 PolarHBondContact O-N 3.44Å; D352-E356 PolarHBondContact O-N 2.61Å
353	E	51.7	Low	54	Low	124 Å²	124	100.7 Å²	100.7	58%	0.579	52%	0.521	S	S	*	.	H	α-helix	trans	-69.6	-36.3	-179.6	-155.8	170.3	-156	0	0	111.9	I355 I357	E353-I355 VanDerWaalsContact C-N 3.33Å; E353-I355 PolarHBondContact O-N 2.92Å; E353-I357 WeakPolarHBondContact O-CD1 3.46Å; E353-I357 VanDerWaalsContact O-CG1 3.32Å; E353-I357 WeakPolarHBondContact O-CG1 3.32Å; E353-I357 PolarHBondContact O-N 3.13Å
354	F	50.7	Low	55.5	Low	137 Å²	137	94.9 Å²	94.9	60%	0.601	51%	0.505	S	S	*	.	H	α-helix	trans	-69.2	-29.2	175.8	-78.9	-74.8	0	0	0	113.2	Q350 Q358	Q350-F354 HydrophobicContact CG-CE2 4.27Å; Q350-F354 VanDerWaalsContact O-CD2 3.24Å; Q350-F354 WeakPolarHBondContact O-CD2 3.24Å; F354-Q358 PolarHBondContact O-N 3.39Å
355	I	54.8	Low	56.8	Low	55 Å²	55	101.3 Å²	101.3	28%	0.282	54%	0.537	S	S	.	.	H	α-helix	trans	-76.7	-36.8	-179	-62.9	165.5	0	0	0	110.9	E351 D352 E353 I357 S359 T374	E351-I355 WeakPolarHBondContact O-CD1 3.04Å; E351-I355 WeakPolarHBondContact O-CG1 3.45Å; D352-I355 PolarHBondContact O-N 3.44Å; E353-I355 VanDerWaalsContact C-N 3.33Å; E353-I355 PolarHBondContact O-N 2.92Å; I355-I357 VanDerWaalsContact C-N 3.34Å; I355-I357 PolarHBondContact O-N 3.28Å; I355-S359 PolarHBondContact O-N 3.46Å; I355-T374 HydrophobicContact CD1-CG2 3.47Å; I355-T374 VanDerWaalsContact CD1-CG2 3.47Å; I355-T374 HydrophobicContact CG1-CG2 3.75Å; I355-T374 HydrophobicContact CG2-CG2 3.99Å
356	E	57.3	Low	58.3	Low	145 Å²	145	97.7 Å²	97.7	68%	0.678	52%	0.523	S	S	*	.	H	α-helix	trans	-60.9	-43.4	174.9	-78.6	-166.9	148.4	0	0	111.7	D352 Q358 S359	D352-E356 PolarHBondContact O-N 2.61Å; E356-Q358 PolarHBondContact O-N 3.35Å; E356-S359 PolarHBondContact O-N 3.04Å; E356-S359 PolarHBondContact O-OG 3.35Å; E356-S359 VanDerWaalsContact O-OG 3.1Å
357	I	53.2	Low	59.5	Low	109 Å²	109	101.8 Å²	101.8	56%	0.559	54%	0.535	S	S	*	.	H	α-helix	trans	-65.5	-40.6	-177.5	-61.9	164.5	0	0	0	111.9	E353 I355 S359 T361	E353-I357 WeakPolarHBondContact O-CD1 3.46Å; E353-I357 VanDerWaalsContact O-CG1 3.32Å; E353-I357 WeakPolarHBondContact O-CG1 3.32Å; E353-I357 PolarHBondContact O-N 3.13Å; I355-I357 VanDerWaalsContact C-N 3.34Å; I355-I357 PolarHBondContact O-N 3.28Å; I357-S359 VanDerWaalsContact C-N 3.34Å; I357-S359 PolarHBondContact O-N 3.13Å; I357-T361 PolarHBondContact O-OG1 2.98Å
358	Q	52.8	Low	61	Low	137 Å²	137	107.3 Å²	107.3	64%	0.64	55%	0.548	S	S	*	.	H	α-helix	trans	-74	-24.7	180	-120.3	177.3	-0.7	0	0	113.3	F354 E356 A360	F354-Q358 PolarHBondContact O-N 3.39Å; E356-Q358 PolarHBondContact O-N 3.35Å; Q358-A360 VanDerWaalsContact C-N 3.33Å
359	S	54.6	Low	62.6	Low	16 Å²	16	100.6 Å²	100.6	11%	0.112	53%	0.527	C	S	.	.	H	α-helix	trans	-81.5	-9.2	-179.7	85.2	0	0	0	0	114	I355 E356 I357 R367 R371	I355-S359 PolarHBondContact O-N 3.46Å; E356-S359 PolarHBondContact O-N 3.04Å; E356-S359 PolarHBondContact O-OG 3.35Å; E356-S359 VanDerWaalsContact O-OG 3.1Å; I357-S359 VanDerWaalsContact C-N 3.34Å; I357-S359 PolarHBondContact O-N 3.13Å; S359-R367 WeakPolarHBondContact O-CD 3.26Å; S359-R367 VanDerWaalsContact O-CG 3.25Å; S359-R367 WeakPolarHBondContact O-CG 3.18Å; S359-R371 PolarHBondContact OG-NH2 2.93Å
360	A	57.8	Low	64	Low	82 Å²	82	99 Å²	99	68%	0.678	52%	0.518	S	S	*	.	S	Bend	trans	-88.1	-22.3	-179.5	0	0	0	0	0	113.7	Q358	Q358-A360 VanDerWaalsContact C-N 3.33Å
361	T	59.1	Low	65.7	Low	127 Å²	127	98.2 Å²	98.2	78%	0.779	51%	0.508	S	S	*	.	S	Bend	trans	-107.2	8.2	-161.3	-2	0	0	0	0	115.7	I357	I357-T361 PolarHBondContact O-OG1 2.98Å
362	G	66.2	Low	67.2	Low	27 Å²	27	95.9 Å²	95.9	28%	0.278	50%	0.501	S	S	.	.	S	Bend	trans	-121.8	167.1	-174.9	0	0	0	0	0	116.2	R367	G362-R367 WeakPolarHBondContact O-CD 3.41Å; G362-R367 WeakPolarHBondContact O-CG 3.42Å; G362-R367 PolarHBondContact O-NE 2.87Å
363	T	78.7	Confident	68.7	Low	87 Å²	87	97 Å²	97	53%	0.534	51%	0.507	S	S	.	.			trans	-59.2	157	169.8	58.3	0	0	0	0	111.4	M365 Q366 R367	T363-M365 VanDerWaalsContact C-N 3.25Å; T363-M365 PolarHBondContact O-N 3.04Å; T363-Q366 PolarHBondContact O-N 3.22Å; T363-Q366 VanDerWaalsContact O-N 3.09Å; T363-Q366 WeakPolarHBondContact OG1-CG 3.44Å; T363-Q366 PolarHBondContact OG1-OE1 2.91Å; T363-R367 WeakPolarHBondContact O-CG 3.49Å; T363-R367 PolarHBondContact O-N 3.23Å
364	A	78.9	Confident	70.2	Confident	68 Å²	68	92.6 Å²	92.6	56%	0.562	49%	0.488	S	S	*	.	H	α-helix	trans	-54.9	-39.2	-176.3	0	0	0	0	0	113.3	R367 W368	A364-R367 PolarHBondContact O-N 2.61Å; A364-W368 PolarHBondContact O-N 2.96Å
365	M	80.1	Confident	71.7	Confident	155 Å²	155	89 Å²	89	76%	0.764	48%	0.475	S	S	*	.	H	α-helix	trans	-68.6	-42.2	177	-170.9	-180	-177.9	0	0	112.4	T363 W368 A369	T363-M365 VanDerWaalsContact C-N 3.25Å; T363-M365 PolarHBondContact O-N 3.04Å; M365-W368 PolarHBondContact O-N 3.03Å; M365-A369 WeakPolarHBondContact O-CB 3.32Å; M365-A369 PolarHBondContact O-N 2.86Å
366	Q	78.1	Confident	73.1	Confident	115 Å²	115	89.9 Å²	89.9	54%	0.537	49%	0.485	S	S	.	.	H	α-helix	trans	-64.7	-39.8	174.4	-80.7	171.9	-39.2	0	0	111.7	T363 A369 V370	T363-Q366 PolarHBondContact O-N 3.22Å; T363-Q366 VanDerWaalsContact O-N 3.09Å; T363-Q366 WeakPolarHBondContact OG1-CG 3.44Å; T363-Q366 PolarHBondContact OG1-OE1 2.91Å; Q366-A369 PolarHBondContact O-N 3.49Å; Q366-V370 WeakPolarHBondContact O-CB 3.4Å; Q366-V370 VanDerWaalsContact O-CG2 3.23Å; Q366-V370 WeakPolarHBondContact O-CG2 3.41Å; Q366-V370 PolarHBondContact O-N 2.92Å
367	R	78.5	Confident	74.5	Confident	102 Å²	102	89.3 Å²	89.3	39%	0.385	48%	0.48	S	S	.	.	H	α-helix	trans	-62.5	-44.7	176.1	-72.5	-173.3	-76.1	154.2	-4	111.7	S359 G362 T363 A364 R371	S359-R367 WeakPolarHBondContact O-CD 3.26Å; S359-R367 VanDerWaalsContact O-CG 3.25Å; S359-R367 WeakPolarHBondContact O-CG 3.18Å; G362-R367 WeakPolarHBondContact O-CD 3.41Å; G362-R367 WeakPolarHBondContact O-CG 3.42Å; G362-R367 PolarHBondContact O-NE 2.87Å; T363-R367 WeakPolarHBondContact O-CG 3.49Å; T363-R367 PolarHBondContact O-N 3.23Å; A364-R367 PolarHBondContact O-N 2.61Å; R367-R371 VanDerWaalsContact O-CB 3.29Å; R367-R371 WeakPolarHBondContact O-CB 3.37Å; R367-R371 WeakPolarHBondContact O-CG 3.42Å; R367-R371 PolarHBondContact O-N 3.26Å
368	W	80.5	Confident	75.9	Confident	176 Å²	176	85.6 Å²	85.6	67%	0.667	46%	0.462	S	S	*	.	H	α-helix	trans	-62.5	-48.9	174.7	178.1	84.1	0	0	0	111.4	A364 M365 V370 R371 T372	A364-W368 PolarHBondContact O-N 2.96Å; M365-W368 PolarHBondContact O-N 3.03Å; W368-V370 PolarHBondContact O-N 3.43Å; W368-R371 PolarHBondContact O-N 2.93Å; W368-T372 WeakPolarHBondContact O-CB 3.4Å; W368-T372 PolarHBondContact O-N 3.42Å; W368-T372 PolarHBondContact O-OG1 3.3Å
369	A	81.6	Confident	77.5	Confident	45 Å²	45	79.9 Å²	79.9	37%	0.372	44%	0.436	S	S	.	.	H	α-helix	trans	-61.4	-44.6	-179.5	0	0	0	0	0	112.6	M365 Q366 L373	M365-A369 WeakPolarHBondContact O-CB 3.32Å; M365-A369 PolarHBondContact O-N 2.86Å; Q366-A369 PolarHBondContact O-N 3.49Å; A369-L373 WeakPolarHBondContact O-CB 3.22Å; A369-L373 PolarHBondContact O-N 3.23Å
370	V	82.4	Confident	79.1	Confident	51 Å²	51	83.9 Å²	83.9	31%	0.309	46%	0.455	S	S	.	.	H	α-helix	trans	-64.3	-45.2	176.6	171.8	0	0	0	0	110.5	Q366 W368 L373 T374	Q366-V370 WeakPolarHBondContact O-CB 3.4Å; Q366-V370 VanDerWaalsContact O-CG2 3.23Å; Q366-V370 WeakPolarHBondContact O-CG2 3.41Å; Q366-V370 PolarHBondContact O-N 2.92Å; W368-V370 PolarHBondContact O-N 3.43Å; V370-L373 PolarHBondContact O-N 2.93Å; V370-T374 VanDerWaalsContact O-CB 3.27Å; V370-T374 WeakPolarHBondContact O-CB 3.33Å; V370-T374 PolarHBondContact O-N 2.99Å; V370-T374 PolarHBondContact O-OG1 3.15Å
371	R	79.6	Confident	80.6	Confident	127 Å²	127	84.9 Å²	84.9	48%	0.479	45%	0.445	S	S	.	.	H	α-helix	trans	-61	-48.1	177.2	-76.9	177.6	177.8	-179.4	0.8	112.1	S359 R367 W368 T374 L375	S359-R371 PolarHBondContact OG-NH2 2.93Å; R367-R371 VanDerWaalsContact O-CB 3.29Å; R367-R371 WeakPolarHBondContact O-CB 3.37Å; R367-R371 WeakPolarHBondContact O-CG 3.42Å; R367-R371 PolarHBondContact O-N 3.26Å; W368-R371 PolarHBondContact O-N 2.93Å; R371-T374 PolarHBondContact O-N 3.44Å; R371-L375 WeakPolarHBondContact O-CB 3.37Å; R371-L375 VanDerWaalsContact O-CG 3.24Å; R371-L375 WeakPolarHBondContact O-CG 3.4Å; R371-L375 PolarHBondContact O-N 2.99Å
372	T	81.6	Confident	81.9	Confident	53 Å²	53	79.4 Å²	79.4	33%	0.325	41%	0.41	S	S	.	.	H	α-helix	trans	-62.8	-44.3	178.9	-57.3	0	0	0	0	111.3	W368 L375 C376	W368-T372 WeakPolarHBondContact O-CB 3.4Å; W368-T372 PolarHBondContact O-N 3.42Å; W368-T372 PolarHBondContact O-OG1 3.3Å; T372-L375 PolarHBondContact O-N 3.07Å; T372-C376 WeakPolarHBondContact O-CB 2.91Å; T372-C376 PolarHBondContact O-N 3.4Å
373	L	84.3	Confident	83	Confident	100 Å²	100	79.4 Å²	79.4	52%	0.524	41%	0.405	S	S	.	.	H	α-helix	trans	-64.6	-43	178.1	-174.6	69.9	0	0	0	111.8	A369 V370 C376 K377	A369-L373 WeakPolarHBondContact O-CB 3.22Å; A369-L373 PolarHBondContact O-N 3.23Å; V370-L373 PolarHBondContact O-N 2.93Å; L373-C376 PolarHBondContact O-N 3.36Å; L373-K377 WeakPolarHBondContact O-CB 3.49Å; L373-K377 WeakPolarHBondContact O-CG 3.39Å; L373-K377 PolarHBondContact O-N 3.4Å
374	T	82.4	Confident	83.5	Confident	30 Å²	30	78.3 Å²	78.3	18%	0.184	41%	0.405	C	S	.	.	H	α-helix	trans	-65.6	-42.8	177.8	-62.7	0	0	0	0	111.4	I355 V370 R371 K377 L378	I355-T374 HydrophobicContact CD1-CG2 3.47Å; I355-T374 VanDerWaalsContact CD1-CG2 3.47Å; I355-T374 HydrophobicContact CG1-CG2 3.75Å; I355-T374 HydrophobicContact CG2-CG2 3.99Å; V370-T374 VanDerWaalsContact O-CB 3.27Å; V370-T374 WeakPolarHBondContact O-CB 3.33Å; V370-T374 PolarHBondContact O-N 2.99Å; V370-T374 PolarHBondContact O-OG1 3.15Å; R371-T374 PolarHBondContact O-N 3.44Å; T374-K377 PolarHBondContact O-N 3.19Å; T374-L378 WeakPolarHBondContact O-CB 3.41Å; T374-L378 PolarHBondContact O-N 2.96Å
375	L	82.7	Confident	83.9	Confident	63 Å²	63	76.6 Å²	76.6	33%	0.33	39%	0.388	S	S	.	.	H	α-helix	trans	-60.3	-47	173.7	-73.8	170.2	0	0	0	111.3	K175 L176 R371 T372 K377 L378 V379	K175-L375 HydrophobicContact CB-CD2 4.33Å; L176-L375 HydrophobicContact CD2-CD1 4.17Å; L176-L375 HydrophobicContact CD2-CD2 4.3Å; R371-L375 WeakPolarHBondContact O-CB 3.37Å; R371-L375 VanDerWaalsContact O-CG 3.24Å; R371-L375 WeakPolarHBondContact O-CG 3.4Å; R371-L375 PolarHBondContact O-N 2.99Å; T372-L375 PolarHBondContact O-N 3.07Å; L375-K377 PolarHBondContact O-N 3.18Å; L375-L378 PolarHBondContact O-N 3.23Å; L375-V379 WeakPolarHBondContact O-CG2 3.48Å; L375-V379 PolarHBondContact O-N 3.18Å
376	C	85.3	Confident	84.3	Confident	73 Å²	73	69.3 Å²	69.3	49%	0.493	35%	0.353	S	S	.	.	H	α-helix	trans	-58.8	-45.4	175.1	-95.2	0	0	0	0	112.3	T372 L373 L378 V379 L380	T372-C376 WeakPolarHBondContact O-CB 2.91Å; T372-C376 PolarHBondContact O-N 3.4Å; L373-C376 PolarHBondContact O-N 3.36Å; C376-L378 VanDerWaalsContact C-N 3.27Å; C376-L378 PolarHBondContact O-N 3.41Å; C376-V379 PolarHBondContact O-N 3.31Å; C376-L380 WeakPolarHBondContact O-CB 3.27Å; C376-L380 VanDerWaalsContact O-CG 3.3Å; C376-L380 WeakPolarHBondContact O-CG 3.48Å; C376-L380 PolarHBondContact O-N 3.23Å
377	K	86.1	Confident	84.8	Confident	133 Å²	133	70 Å²	70	58%	0.578	36%	0.36	S	S	*	.	H	α-helix	trans	-59.5	-40.7	176.3	-77.2	178.3	179.2	-178.8	0	111.7	L373 T374 L375 L380 K381	L373-K377 WeakPolarHBondContact O-CB 3.49Å; L373-K377 WeakPolarHBondContact O-CG 3.39Å; L373-K377 PolarHBondContact O-N 3.4Å; T374-K377 PolarHBondContact O-N 3.19Å; L375-K377 PolarHBondContact O-N 3.18Å; K377-L380 PolarHBondContact O-N 3.28Å; K377-K381 WeakPolarHBondContact O-CB 3.42Å; K377-K381 PolarHBondContact O-N 3.48Å
378	L	82.4	Confident	85.2	Confident	31 Å²	31	66.1 Å²	66.1	16%	0.162	35%	0.351	C	S	.	.	H	α-helix	trans	-69.8	-40.7	-179.3	-170.2	63.2	0	0	0	112	K175 T374 L375 C376 K381 N382	K175-L378 HydrophobicContact CD-CD2 3.43Å; K175-L378 VanDerWaalsContact CD-CD2 3.43Å; K175-L378 HydrophobicContact CD-CG 3.91Å; K175-L378 HydrophobicContact CG-CD2 3.89Å; K175-L378 HydrophobicContact CG-CG 4.28Å; T374-L378 WeakPolarHBondContact O-CB 3.41Å; T374-L378 PolarHBondContact O-N 2.96Å; L375-L378 PolarHBondContact O-N 3.23Å; C376-L378 VanDerWaalsContact C-N 3.27Å; C376-L378 PolarHBondContact O-N 3.41Å; L378-K381 WeakPolarHBondContact O-CB 3.36Å; L378-K381 PolarHBondContact O-N 2.93Å; L378-N382 PolarHBondContact O-N 3.23Å
379	V	87.1	Confident	85.4	Confident	16 Å²	16	63 Å²	63	10%	0.097	35%	0.354	C	S	.	.	H	α-helix	trans	-61.6	-47.5	172.1	171.1	0	0	0	0	110.6	L375 C376 K381 N382 V383	L375-V379 WeakPolarHBondContact O-CG2 3.48Å; L375-V379 PolarHBondContact O-N 3.18Å; C376-V379 PolarHBondContact O-N 3.31Å; V379-K381 VanDerWaalsContact C-N 3.28Å; V379-K381 PolarHBondContact O-N 2.73Å; V379-N382 WeakPolarHBondContact O-CB 3.39Å; V379-N382 PolarHBondContact O-N 2.84Å; V379-N382 VanDerWaalsContact O-N 3.11Å; V379-V383 WeakPolarHBondContact O-CG2 3.4Å; V379-V383 PolarHBondContact O-N 3.42Å
380	L	87.8	Confident	85.4	Confident	100 Å²	100	69.4 Å²	69.4	52%	0.524	38%	0.375	S	S	.	.	H	α-helix	trans	-63.3	-34.9	177.5	-70.7	167.2	0	0	0	112.2	F167 C376 K377 V383 A384	F167-L380 HydrophobicContact CZ-CD2 4.42Å; C376-L380 WeakPolarHBondContact O-CB 3.27Å; C376-L380 VanDerWaalsContact O-CG 3.3Å; C376-L380 WeakPolarHBondContact O-CG 3.48Å; C376-L380 PolarHBondContact O-N 3.23Å; K377-L380 PolarHBondContact O-N 3.28Å; L380-V383 PolarHBondContact O-N 3.42Å; L380-A384 WeakPolarHBondContact O-CB 3.33Å; L380-A384 PolarHBondContact O-N 3.47Å
381	K	88.1	Confident	85.6	Confident	104 Å²	104	68.2 Å²	68.2	45%	0.452	37%	0.367	S	S	.	.	H	α-helix	trans	-63.9	-43	172.4	-174.3	-179.9	175.8	-176.6	0	111.2	E351 K377 L378 V379 A384 S385	E351-K381 IonicContact OE1-NZ 2.67Å; E351-K381 PolarHBondContact OE1-NZ 2.91Å; E351-K381 IonicContact OE2-NZ 2.73Å; E351-K381 PolarHBondContact OE2-NZ 2.86Å; K377-K381 WeakPolarHBondContact O-CB 3.42Å; K377-K381 PolarHBondContact O-N 3.48Å; L378-K381 WeakPolarHBondContact O-CB 3.36Å; L378-K381 PolarHBondContact O-N 2.93Å; V379-K381 VanDerWaalsContact C-N 3.28Å; V379-K381 PolarHBondContact O-N 2.73Å; K381-A384 PolarHBondContact O-N 3.3Å; K381-S385 WeakPolarHBondContact O-CB 3.37Å; K381-S385 PolarHBondContact O-N 3.13Å
382	N	87.3	Confident	86.1	Confident	12 Å²	12	69.9 Å²	69.9	6%	0.064	37%	0.374	C	S	.	.	H	α-helix	trans	-60.1	-47.7	173.6	-88.6	13.6	0	0	0	111.1	K175 L378 V379 A384 S385 L386 S626 T630	K175-N382 VanDerWaalsContact CE-ND2 3.3Å; K175-N382 WeakPolarHBondContact CE-ND2 3.49Å; L378-N382 PolarHBondContact O-N 3.23Å; V379-N382 WeakPolarHBondContact O-CB 3.39Å; V379-N382 PolarHBondContact O-N 2.84Å; V379-N382 VanDerWaalsContact O-N 3.11Å; N382-A384 PolarHBondContact O-N 3.21Å; N382-S385 WeakPolarHBondContact O-CB 3.43Å; N382-S385 PolarHBondContact O-N 3.48Å; N382-S385 VanDerWaalsContact O-N 3.14Å; N382-S385 PolarHBondContact O-OG 2.84Å; N382-L386 PolarHBondContact O-N 3.22Å; N382-S626 PolarHBondContact ND2-O 3.48Å; N382-S626 VanDerWaalsContact ND2-O 3.15Å; N382-T630 HydrophobicContact CB-CG2 4.04Å
383	V	89.6	Confident	86.5	Confident	26 Å²	26	72.1 Å²	72.1	16%	0.158	38%	0.383	C	S	.	.	H	α-helix	trans	-58.9	-48.1	176.5	174.7	0	0	0	0	111.3	F167 V379 L380 S385 L386 T630 V634	F167-V383 HydrophobicContact CE2-CG1 4.35Å; F167-V383 HydrophobicContact CE2-CG2 4Å; F167-V383 HydrophobicContact CZ-CG2 4.15Å; V379-V383 WeakPolarHBondContact O-CG2 3.4Å; V379-V383 PolarHBondContact O-N 3.42Å; L380-V383 PolarHBondContact O-N 3.42Å; V383-S385 PolarHBondContact O-N 3.18Å; V383-L386 VanDerWaalsContact O-CB 3.3Å; V383-L386 WeakPolarHBondContact O-CB 3.32Å; V383-L386 PolarHBondContact O-N 3.32Å; V383-L386 VanDerWaalsContact O-N 3.1Å; V383-T630 HydrophobicContact CG2-CG2 3.53Å; V383-V634 HydrophobicContact CG1-CG2 4.28Å; V383-V634 HydrophobicContact CG2-CG2 4.02Å
384	A	88.8	Confident	86.8	Confident	65 Å²	65	68.5 Å²	68.5	54%	0.537	37%	0.366	S	S	.	.	H	α-helix	trans	-61.2	-34.3	177.5	0	0	0	0	0	112	L380 K381 N382 L386 L387	L380-A384 WeakPolarHBondContact O-CB 3.33Å; L380-A384 PolarHBondContact O-N 3.47Å; K381-A384 PolarHBondContact O-N 3.3Å; N382-A384 PolarHBondContact O-N 3.21Å; A384-L386 PolarHBondContact O-N 2.97Å; A384-L387 PolarHBondContact O-N 2.89Å; A384-L387 VanDerWaalsContact O-N 3.14Å
385	S	87.6	Confident	87.2	Confident	31 Å²	31	68 Å²	68	22%	0.217	36%	0.363	C	S	.	.	H	α-helix	trans	-69.7	-18.3	178.4	82.7	0	0	0	0	114	K381 N382 V383 L387 G388 K627	K381-S385 WeakPolarHBondContact O-CB 3.37Å; K381-S385 PolarHBondContact O-N 3.13Å; N382-S385 WeakPolarHBondContact O-CB 3.43Å; N382-S385 PolarHBondContact O-N 3.48Å; N382-S385 VanDerWaalsContact O-N 3.14Å; N382-S385 PolarHBondContact O-OG 2.84Å; V383-S385 PolarHBondContact O-N 3.18Å; S385-L387 PolarHBondContact O-N 3.01Å; S385-G388 PolarHBondContact O-N 3.48Å; S385-K627 VanDerWaalsContact OG-CD 3.26Å; S385-K627 WeakPolarHBondContact OG-CD 3.29Å; S385-K627 WeakPolarHBondContact OG-CE 3.25Å; S385-K627 PolarHBondContact OG-NZ 3.33Å
386	L	88.7	Confident	87.8	Confident	3 Å²	3	69.6 Å²	69.6	2%	0.016	37%	0.371	C	S	.	.	H	α-helix	trans	-65.8	-29.8	171.7	-57.5	174.5	0	0	0	111.5	N382 V383 A384 G388 L391 R392 T395 Y623 K627 A631 V634	N382-L386 PolarHBondContact O-N 3.22Å; V383-L386 VanDerWaalsContact O-CB 3.3Å; V383-L386 WeakPolarHBondContact O-CB 3.32Å; V383-L386 PolarHBondContact O-N 3.32Å; V383-L386 VanDerWaalsContact O-N 3.1Å; A384-L386 PolarHBondContact O-N 2.97Å; L386-G388 PolarHBondContact O-N 2.94Å; L386-L391 CarbonylContact O-C 3.58Å; L386-R392 PolarHBondContact O-N 3.27Å; L386-T395 HydrophobicContact CB-CG2 4.32Å; L386-T395 PolarHBondContact O-OG1 3.21Å; L386-Y623 HydrophobicContact CD2-CD1 3.98Å; L386-Y623 HydrophobicContact CD2-CE1 4Å; L386-K627 HydrophobicContact CD2-CB 4.45Å; L386-A631 HydrophobicContact CD1-CB 4.12Å; L386-A631 HydrophobicContact CD2-CB 3.7Å; L386-V634 HydrophobicContact CD1-CG2 4.3Å
387	L	88.3	Confident	88.2	Confident	130 Å²	130	68.3 Å²	68.3	68%	0.681	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	8	172.4	-72	87.6	0	0	0	112.7	A384 S385	A384-L387 PolarHBondContact O-N 2.89Å; A384-L387 VanDerWaalsContact O-N 3.14Å; S385-L387 PolarHBondContact O-N 3.01Å
388	G	86.7	Confident	88.6	Confident	19 Å²	19	62 Å²	62	20%	0.196	33%	0.33	C	S	.	.	S	Bend	trans	-61.7	157.8	174	0	0	0	0	0	112.5	S385 L386 E390 L391 R392	S385-G388 PolarHBondContact O-N 3.48Å; L386-G388 PolarHBondContact O-N 2.94Å; G388-E390 PolarHBondContact O-N 3.24Å; G388-E390 VanDerWaalsContact O-N 3.11Å; G388-L391 PolarHBondContact O-N 3.23Å; G388-R392 WeakPolarHBondContact O-CB 3.4Å; G388-R392 WeakPolarHBondContact O-CG 3.29Å; G388-R392 PolarHBondContact O-N 3.43Å
389	P	84.3	Confident	89.2	Confident	112 Å²	112	61.5 Å²	61.5	73%	0.727	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-30.6	-173.3	22.5	-32.9	0	0	0	113.9
390	E	83.2	Confident	89.7	Confident	178 Å²	178	63.6 Å²	63.6	83%	0.832	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-40.9	-179.9	-64	175.1	-179.5	0	0	113.1	G388	G388-E390 PolarHBondContact O-N 3.24Å; G388-E390 VanDerWaalsContact O-N 3.11Å
391	L	86.4	Confident	90	Very high	27 Å²	27	58.9 Å²	58.9	14%	0.141	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-12.8	-171.6	-67.5	171.1	0	0	0	113.8	L386 G388 L393 S394 T395 Y623	L386-L391 CarbonylContact O-C 3.58Å; G388-L391 PolarHBondContact O-N 3.23Å; L391-L393 VanDerWaalsContact C-N 3.33Å; L391-L393 PolarHBondContact O-N 2.86Å; L391-S394 PolarHBondContact O-N 3.43Å; L391-T395 WeakPolarHBondContact O-CB 3.35Å; L391-T395 PolarHBondContact O-N 3.08Å; L391-T395 PolarHBondContact O-OG1 3.07Å; L391-Y623 HydrophobicContact CD1-CD1 4.45Å; L391-Y623 HydrophobicContact CD2-CD1 4.44Å
392	R	89.4	Confident	90.4	Very high	161 Å²	161	54 Å²	54	61%	0.608	30%	0.295	S	S	*	.	H	α-helix	trans	-57.9	-40.1	-172.3	62.5	-178.4	-176.3	162.9	5	114.1	L386 G388 L396	L386-R392 PolarHBondContact O-N 3.27Å; G388-R392 WeakPolarHBondContact O-CB 3.4Å; G388-R392 WeakPolarHBondContact O-CG 3.29Å; G388-R392 PolarHBondContact O-N 3.43Å; R392-L396 VanDerWaalsContact O-CB 3.28Å; R392-L396 WeakPolarHBondContact O-CB 3.32Å; R392-L396 PolarHBondContact O-N 3.47Å
393	L	90.2	Very high	90.9	Very high	101 Å²	101	56.5 Å²	56.5	53%	0.529	31%	0.305	S	S	.	.	H	α-helix	trans	-73.6	-46.7	-176.6	-168.7	76.9	0	0	0	110.4	L391 T395 L396 F397	L391-L393 VanDerWaalsContact C-N 3.33Å; L391-L393 PolarHBondContact O-N 2.86Å; L393-T395 VanDerWaalsContact C-N 3.3Å; L393-T395 PolarHBondContact O-N 3.26Å; L393-L396 PolarHBondContact O-N 3.06Å; L393-F397 HydrophobicContact CD1-CE1 4.04Å; L393-F397 HydrophobicContact CD1-CE2 4.24Å; L393-F397 HydrophobicContact CD1-CZ 3.72Å; L393-F397 HydrophobicContact CD2-CE2 3.82Å; L393-F397 HydrophobicContact CD2-CZ 4.02Å; L393-F397 HydrophobicContact CG-CD2 4.25Å; L393-F397 HydrophobicContact CG-CE1 4.3Å; L393-F397 HydrophobicContact CG-CE2 3.7Å; L393-F397 HydrophobicContact CG-CZ 3.72Å; L393-F397 WeakPolarHBondContact O-CG 3.12Å; L393-F397 PolarHBondContact O-N 3.26Å
394	S	89.6	Confident	91.2	Very high	24 Å²	24	55.9 Å²	55.9	17%	0.168	30%	0.301	C	S	.	.	H	α-helix	trans	-56.4	-45	173.2	-60.5	0	0	0	0	111.4	L391 F397 M398	L391-S394 PolarHBondContact O-N 3.43Å; S394-F397 PolarHBondContact O-N 3.13Å; S394-M398 WeakPolarHBondContact O-CB 3.47Å; S394-M398 VanDerWaalsContact O-CG 3.26Å; S394-M398 WeakPolarHBondContact O-CG 3.33Å; S394-M398 PolarHBondContact O-N 3.21Å
395	T	92.8	Very high	91.5	Very high	18 Å²	18	52.8 Å²	52.8	11%	0.11	28%	0.276	C	S	.	.	H	α-helix	trans	-65.9	-42	178.1	-51.7	0	0	0	0	112	L386 L391 L393 M398 A399 Y623	L386-T395 HydrophobicContact CB-CG2 4.32Å; L386-T395 PolarHBondContact O-OG1 3.21Å; L391-T395 WeakPolarHBondContact O-CB 3.35Å; L391-T395 PolarHBondContact O-N 3.08Å; L391-T395 PolarHBondContact O-OG1 3.07Å; L393-T395 VanDerWaalsContact C-N 3.3Å; L393-T395 PolarHBondContact O-N 3.26Å; T395-M398 PolarHBondContact O-N 3.16Å; T395-A399 VanDerWaalsContact O-CB 3.24Å; T395-A399 WeakPolarHBondContact O-CB 3.4Å; T395-A399 PolarHBondContact O-N 3.15Å; T395-Y623 VanDerWaalsContact CA-OH 3.27Å; T395-Y623 WeakPolarHBondContact CA-OH 3.4Å; T395-Y623 WeakPolarHBondContact OG1-CE1 3.4Å; T395-Y623 PolarHBondContact OG1-OH 2.96Å
396	L	93.8	Very high	91.8	Very high	97 Å²	97	51.3 Å²	51.3	51%	0.508	27%	0.266	S	S	.	.	H	α-helix	trans	-63.1	-46	176.5	179.8	66.1	0	0	0	111.7	R392 L393 A399 I400	R392-L396 VanDerWaalsContact O-CB 3.28Å; R392-L396 WeakPolarHBondContact O-CB 3.32Å; R392-L396 PolarHBondContact O-N 3.47Å; L393-L396 PolarHBondContact O-N 3.06Å; L396-A399 PolarHBondContact O-N 3.29Å; L396-I400 HydrophobicContact CD1-CD1 4.37Å; L396-I400 HydrophobicContact CG-CD1 4.16Å; L396-I400 WeakPolarHBondContact O-CG1 3.42Å; L396-I400 PolarHBondContact O-N 3.39Å
397	F	94.6	Very high	92.2	Very high	46 Å²	46	52 Å²	52	20%	0.202	27%	0.268	C	S	.	.	H	α-helix	trans	-63.5	-45.7	177.8	-68.1	-15.4	0	0	0	111.5	L393 S394 A399 I400 I401 V675 K678 L679	L393-F397 HydrophobicContact CD1-CE1 4.04Å; L393-F397 HydrophobicContact CD1-CE2 4.24Å; L393-F397 HydrophobicContact CD1-CZ 3.72Å; L393-F397 HydrophobicContact CD2-CE2 3.82Å; L393-F397 HydrophobicContact CD2-CZ 4.02Å; L393-F397 HydrophobicContact CG-CD2 4.25Å; L393-F397 HydrophobicContact CG-CE1 4.3Å; L393-F397 HydrophobicContact CG-CE2 3.7Å; L393-F397 HydrophobicContact CG-CZ 3.72Å; L393-F397 WeakPolarHBondContact O-CG 3.12Å; L393-F397 PolarHBondContact O-N 3.26Å; S394-F397 PolarHBondContact O-N 3.13Å; F397-A399 VanDerWaalsContact C-N 3.32Å; F397-A399 PolarHBondContact O-N 3.36Å; F397-I400 PolarHBondContact O-N 3.18Å; F397-I401 WeakPolarHBondContact O-CD1 3.48Å; F397-I401 VanDerWaalsContact O-CG1 3.22Å; F397-I401 WeakPolarHBondContact O-CG1 3.33Å; F397-I401 PolarHBondContact O-N 3.33Å; F397-V675 HydrophobicContact CB-CG1 3.75Å; F397-V675 HydrophobicContact CD1-CG1 3.77Å; F397-V675 HydrophobicContact CG-CG1 3.86Å; F397-K678 HydrophobicContact CE2-CB 4.19Å; F397-L679 HydrophobicContact CB-CD2 3.81Å; F397-L679 HydrophobicContact CB-CG 4.42Å; F397-L679 HydrophobicContact CD2-CD2 4.23Å
398	M	94.4	Very high	92.5	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-59.4	-43.1	174.1	-72.5	-56.7	-64.2	0	0	111.8	S394 T395 I400 I401 W402 I615 I618 T619 L622 L635 L679	S394-M398 WeakPolarHBondContact O-CB 3.47Å; S394-M398 VanDerWaalsContact O-CG 3.26Å; S394-M398 WeakPolarHBondContact O-CG 3.33Å; S394-M398 PolarHBondContact O-N 3.21Å; T395-M398 PolarHBondContact O-N 3.16Å; M398-I400 VanDerWaalsContact C-N 3.34Å; M398-I400 PolarHBondContact O-N 3.13Å; M398-I401 PolarHBondContact O-N 2.96Å; M398-I401 HydrophobicContact SD-CD1 4.47Å; M398-W402 WeakPolarHBondContact O-CB 3.35Å; M398-W402 VanDerWaalsContact O-CD1 3.24Å; M398-W402 PolarHBondContact O-N 3.11Å; M398-I615 HydrophobicContact CE-CG2 4.33Å; M398-I618 HydrophobicContact CE-CG2 3.54Å; M398-I618 HydrophobicContact SD-CG2 3.85Å; M398-T619 WeakPolarHBondContact CE-OG1 3.3Å; M398-L622 HydrophobicContact CG-CD2 3.59Å; M398-L622 HydrophobicContact SD-CD2 4.21Å; M398-L635 HydrophobicContact CB-CD1 3.91Å; M398-L635 HydrophobicContact CB-CD2 4.02Å; M398-L679 HydrophobicContact CG-CD2 4.42Å; M398-L679 HydrophobicContact SD-CD1 3.54Å; M398-L679 VanDerWaalsContact SD-CD1 3.54Å; M398-L679 HydrophobicContact SD-CD2 4.31Å
399	A	95.8	Very high	92.7	Very high	21 Å²	21	46.1 Å²	46.1	17%	0.174	23%	0.231	C	C	.	.	H	α-helix	trans	-60.3	-42.7	177.5	0	0	0	0	0	112.2	T395 L396 F397 F403 L635 L638	T395-A399 VanDerWaalsContact O-CB 3.24Å; T395-A399 WeakPolarHBondContact O-CB 3.4Å; T395-A399 PolarHBondContact O-N 3.15Å; L396-A399 PolarHBondContact O-N 3.29Å; F397-A399 VanDerWaalsContact C-N 3.32Å; F397-A399 PolarHBondContact O-N 3.36Å; A399-F403 WeakPolarHBondContact O-CB 3.09Å; A399-F403 PolarHBondContact O-N 3.39Å; A399-L635 HydrophobicContact CB-CD2 3.97Å; A399-L638 HydrophobicContact CB-CD2 3.59Å; A399-L638 WeakPolarHBondContact O-CD2 3.43Å
400	I	95.9	Very high	93	Very high	60 Å²	60	42.4 Å²	42.4	31%	0.308	20%	0.203	S	C	.	.	H	α-helix	trans	-63.4	-44.2	176	-67.4	164.3	0	0	0	110.8	L396 F397 M398 F403 T404 V675	L396-I400 HydrophobicContact CD1-CD1 4.37Å; L396-I400 HydrophobicContact CG-CD1 4.16Å; L396-I400 WeakPolarHBondContact O-CG1 3.42Å; L396-I400 PolarHBondContact O-N 3.39Å; F397-I400 PolarHBondContact O-N 3.18Å; M398-I400 VanDerWaalsContact C-N 3.34Å; M398-I400 PolarHBondContact O-N 3.13Å; I400-F403 PolarHBondContact O-N 3.19Å; I400-T404 HydrophobicContact CG2-CG2 4.23Å; I400-T404 WeakPolarHBondContact O-CB 3.37Å; I400-T404 VanDerWaalsContact O-CG2 3.32Å; I400-T404 WeakPolarHBondContact O-CG2 3.44Å; I400-T404 PolarHBondContact O-N 3.17Å; I400-T404 PolarHBondContact O-OG1 3.46Å; I400-V675 HydrophobicContact CB-CG1 4.49Å; I400-V675 HydrophobicContact CG2-CG1 4.44Å; I400-V675 HydrophobicContact CG2-CG2 4.27Å
401	I	95.9	Very high	93.4	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-66.2	-48.6	-178.7	-65.2	158.4	0	0	0	110.5	F397 M398 F403 T404 M405 I574 M578 I615 V675 A676 L679	F397-I401 WeakPolarHBondContact O-CD1 3.48Å; F397-I401 VanDerWaalsContact O-CG1 3.22Å; F397-I401 WeakPolarHBondContact O-CG1 3.33Å; F397-I401 PolarHBondContact O-N 3.33Å; M398-I401 PolarHBondContact O-N 2.96Å; M398-I401 HydrophobicContact SD-CD1 4.47Å; I401-F403 VanDerWaalsContact C-N 3.35Å; I401-F403 PolarHBondContact O-N 2.87Å; I401-T404 PolarHBondContact O-OG1 2.95Å; I401-M405 WeakPolarHBondContact O-CB 3.36Å; I401-M405 PolarHBondContact O-N 3.4Å; I401-I574 HydrophobicContact CG2-CG2 4.1Å; I401-M578 HydrophobicContact CG2-SD 4.05Å; I401-I615 HydrophobicContact CG2-CD1 3.56Å; I401-I615 HydrophobicContact CG2-CG1 3.67Å; I401-V675 HydrophobicContact CD1-CG1 4.25Å; I401-V675 HydrophobicContact CG1-CB 4.45Å; I401-V675 HydrophobicContact CG1-CG1 4.15Å; I401-A676 HydrophobicContact CD1-CB 3.84Å; I401-A676 HydrophobicContact CG1-CB 4.19Å; I401-L679 HydrophobicContact CD1-CD1 3.42Å; I401-L679 VanDerWaalsContact CD1-CD1 3.42Å; I401-L679 HydrophobicContact CD1-CG 4.2Å
402	W	95.9	Very high	93.5	Very high	1 Å²	1	32.6 Å²	32.6	0%	0.004	16%	0.157	C	C	.	.	H	α-helix	trans	-58.7	-46	176	-87.5	95.7	0	0	0	111.4	M398 A406 W612 I615 E616 T619 F632 L635 C639	M398-W402 WeakPolarHBondContact O-CB 3.35Å; M398-W402 VanDerWaalsContact O-CD1 3.24Å; M398-W402 PolarHBondContact O-N 3.11Å; W402-A406 WeakPolarHBondContact O-CB 3.11Å; W402-A406 PolarHBondContact O-N 3.14Å; W402-W612 AromaticContact CE3-CZ3 3.73Å; W402-W612 HydrophobicContact CE3-CZ3 3.73Å; W402-W612 HydrophobicContact CZ3-CE3 4.32Å; W402-W612 AromaticContact CZ3-CZ3 3.63Å; W402-W612 HydrophobicContact CZ3-CZ3 3.63Å; W402-I615 HydrophobicContact CD2-CG2 3.58Å; W402-I615 HydrophobicContact CE3-CG2 4.24Å; W402-I615 HydrophobicContact CG-CG2 3.88Å; W402-I615 HydrophobicContact CH2-CG2 4.33Å; W402-I615 HydrophobicContact CZ2-CG2 3.65Å; W402-E616 HydrophobicContact CH2-CG 4.05Å; W402-E616 HydrophobicContact CZ2-CG 4.43Å; W402-T619 PolarHBondContact NE1-OG1 2.72Å; W402-F632 HydrophobicContact CH2-CD1 4.44Å; W402-F632 AromaticContact CH2-CE1 3.59Å; W402-F632 HydrophobicContact CH2-CE1 3.59Å; W402-F632 HydrophobicContact CH2-CZ 4.13Å; W402-F632 HydrophobicContact CZ2-CD1 4.25Å; W402-F632 AromaticContact CZ2-CE1 3.65Å; W402-F632 HydrophobicContact CZ2-CE1 3.65Å; W402-F632 HydrophobicContact CZ2-CZ 4.08Å; W402-L635 HydrophobicContact CD2-CB 4.31Å; W402-L635 HydrophobicContact CG-CB 4.13Å; W402-C639 HydrophobicContact CE3-CB 3.52Å; W402-C639 HydrophobicContact CZ3-CB 3.96Å
403	F	96.6	Very high	93.3	Very high	65 Å²	65	26.5 Å²	26.5	29%	0.285	14%	0.144	S	C	.	.	H	α-helix	trans	-64.6	-51.5	-179.6	-176.4	-85	0	0	0	112	A399 I400 I401 M405 A406 F407 L638 A642 L645	A399-F403 WeakPolarHBondContact O-CB 3.09Å; A399-F403 PolarHBondContact O-N 3.39Å; I400-F403 PolarHBondContact O-N 3.19Å; I401-F403 VanDerWaalsContact C-N 3.35Å; I401-F403 PolarHBondContact O-N 2.87Å; F403-M405 PolarHBondContact O-N 2.9Å; F403-A406 PolarHBondContact O-N 3.3Å; F403-F407 HydrophobicContact CE1-CB 4.43Å; F403-F407 WeakPolarHBondContact O-CB 3.32Å; F403-F407 PolarHBondContact O-N 3.42Å; F403-L638 HydrophobicContact CB-CD2 4.26Å; F403-L638 HydrophobicContact CB-CG 4.34Å; F403-L638 HydrophobicContact CD2-CD1 3.91Å; F403-L638 HydrophobicContact CD2-CG 4.17Å; F403-A642 HydrophobicContact CD2-CB 3.55Å; F403-A642 HydrophobicContact CE2-CB 3.75Å; F403-A642 HydrophobicContact CG-CB 4.01Å; F403-A642 HydrophobicContact CZ-CB 4.37Å; F403-L645 HydrophobicContact CE2-CD1 4.25Å; F403-L645 HydrophobicContact CZ-CD1 4.28Å
404	T	96.3	Very high	92.9	Very high	13 Å²	13	24.3 Å²	24.3	8%	0.08	14%	0.135	C	C	.	.	H	α-helix	trans	-64.9	-41.4	-177.5	49.4	0	0	0	0	111.9	I400 I401 S408 A668 G672	I400-T404 HydrophobicContact CG2-CG2 4.23Å; I400-T404 WeakPolarHBondContact O-CB 3.37Å; I400-T404 VanDerWaalsContact O-CG2 3.32Å; I400-T404 WeakPolarHBondContact O-CG2 3.44Å; I400-T404 PolarHBondContact O-N 3.17Å; I400-T404 PolarHBondContact O-OG1 3.46Å; I401-T404 PolarHBondContact O-OG1 2.95Å; T404-S408 WeakPolarHBondContact O-CB 3.38Å; T404-S408 PolarHBondContact O-N 3.39Å; T404-S408 PolarHBondContact O-OG 3.01Å; T404-A668 VanDerWaalsContact CB-O 3.28Å; T404-A668 WeakPolarHBondContact CB-O 3.33Å; T404-A668 HydrophobicContact CG2-CB 4.23Å; T404-A668 WeakPolarHBondContact CG2-O 3.18Å; T404-G672 WeakPolarHBondContact OG1-CA 3.36Å
405	M	95.3	Very high	92.8	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-62.9	-49.6	175.4	-173	64	-168.9	0	0	111.8	I401 F403 S408 Y409 M578 S608 A611 W612 I615 L669	I401-M405 WeakPolarHBondContact O-CB 3.36Å; I401-M405 PolarHBondContact O-N 3.4Å; F403-M405 PolarHBondContact O-N 2.9Å; M405-S408 PolarHBondContact O-N 2.88Å; M405-Y409 HydrophobicContact CE-CD2 4.46Å; M405-Y409 WeakPolarHBondContact O-CB 3.36Å; M405-Y409 PolarHBondContact O-N 3.44Å; M405-M578 HydrophobicContact CB-CE 4.09Å; M405-M578 HydrophobicContact SD-CE 4.21Å; M405-M578 HydrophobicContact SD-CG 4.14Å; M405-S608 WeakPolarHBondContact CE-O 3.36Å; M405-A611 HydrophobicContact CE-CB 3.73Å; M405-A611 HydrophobicContact SD-CB 3.87Å; M405-W612 VanDerWaalsContact CE-CD1 3.48Å; M405-W612 HydrophobicContact CE-CD2 4.33Å; M405-W612 HydrophobicContact CE-CG 4.05Å; M405-W612 HydrophobicContact CG-CD2 4.09Å; M405-W612 HydrophobicContact CG-CE3 4.43Å; M405-W612 HydrophobicContact CG-CH2 4.2Å; M405-W612 HydrophobicContact CG-CZ2 3.87Å; M405-W612 HydrophobicContact CG-CZ3 4.47Å; M405-I615 HydrophobicContact CB-CD1 3.93Å; M405-I615 HydrophobicContact CG-CD1 3.82Å; M405-L669 HydrophobicContact SD-CD2 3.98Å
406	A	94.9	Very high	92.3	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-62.7	-47.4	-179.8	0	0	0	0	0	112.4	W402 F403 S408 Y409 Y410 W612 C639 A642	W402-A406 WeakPolarHBondContact O-CB 3.11Å; W402-A406 PolarHBondContact O-N 3.14Å; F403-A406 PolarHBondContact O-N 3.3Å; A406-S408 VanDerWaalsContact C-N 3.32Å; A406-S408 PolarHBondContact O-N 3.28Å; A406-Y409 PolarHBondContact O-N 3.36Å; A406-Y410 HydrophobicContact CB-CD2 4.21Å; A406-Y410 HydrophobicContact CB-CE2 4.44Å; A406-Y410 WeakPolarHBondContact O-CB 3.25Å; A406-Y410 WeakPolarHBondContact O-CD2 3.42Å; A406-Y410 PolarHBondContact O-N 3.38Å; A406-W612 HydrophobicContact CB-CH2 3.84Å; A406-W612 HydrophobicContact CB-CZ2 4.36Å; A406-C639 HydrophobicContact CB-CB 4.21Å; A406-C639 WeakPolarHBondContact CB-O 3.35Å; A406-C639 VanDerWaalsContact CB-SG 3.58Å; A406-A642 HydrophobicContact CB-CB 3.71Å
407	F	95.6	Very high	91.6	Very high	16 Å²	16	21.2 Å²	21.2	7%	0.07	12%	0.119	C	C	.	.	H	α-helix	trans	-55.6	-48.1	179.7	-179.2	-102.6	0	0	0	111.5	F403 G411 A642 L645 I649 F650 L664 A668	F403-F407 HydrophobicContact CE1-CB 4.43Å; F403-F407 WeakPolarHBondContact O-CB 3.32Å; F403-F407 PolarHBondContact O-N 3.42Å; F407-G411 WeakPolarHBondContact O-CA 3.17Å; F407-G411 PolarHBondContact O-N 3.02Å; F407-G411 VanDerWaalsContact O-N 3.1Å; F407-A642 HydrophobicContact CB-CB 4.31Å; F407-L645 HydrophobicContact CD2-CB 4.5Å; F407-L645 HydrophobicContact CE2-CB 4.48Å; F407-I649 HydrophobicContact CE2-CD1 4.08Å; F407-I649 HydrophobicContact CZ-CD1 4.36Å; F407-F650 HydrophobicContact CD1-CE2 4.34Å; F407-F650 AromaticContact CE1-CE2 3.64Å; F407-F650 HydrophobicContact CE1-CE2 3.64Å; F407-F650 HydrophobicContact CE1-CZ 4.1Å; F407-F650 HydrophobicContact CE2-CE2 4.31Å; F407-F650 HydrophobicContact CZ-CD2 4.47Å; F407-F650 AromaticContact CZ-CE2 3.63Å; F407-F650 HydrophobicContact CZ-CE2 3.63Å; F407-L664 HydrophobicContact CE1-CB 4.36Å; F407-L664 HydrophobicContact CE1-CD2 4.03Å; F407-L664 HydrophobicContact CZ-CD2 4.24Å; F407-A668 HydrophobicContact CD1-CB 4.32Å
408	S	94.6	Very high	90.8	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-71.4	-45.4	179.5	-68.9	0	0	0	0	113	T404 M405 A406 L412 S665	T404-S408 WeakPolarHBondContact O-CB 3.38Å; T404-S408 PolarHBondContact O-N 3.39Å; T404-S408 PolarHBondContact O-OG 3.01Å; M405-S408 PolarHBondContact O-N 2.88Å; A406-S408 VanDerWaalsContact C-N 3.32Å; A406-S408 PolarHBondContact O-N 3.28Å; S408-L412 VanDerWaalsContact O-CB 3.26Å; S408-L412 WeakPolarHBondContact O-CB 3.47Å; S408-L412 WeakPolarHBondContact O-CG 3.43Å; S408-L412 PolarHBondContact O-N 3.47Å; S408-S665 WeakPolarHBondContact CB-OG 3.36Å; S408-S665 WeakPolarHBondContact OG-CA 3.34Å; S408-S665 PolarHBondContact OG-O 2.69Å; S408-S665 VanDerWaalsContact OG-O 3.11Å; S408-S665 PolarHBondContact OG-OG 2.87Å
409	Y	92.4	Very high	90.2	Very high	27 Å²	27	22.7 Å²	22.7	11%	0.106	13%	0.129	C	C	.	.	H	α-helix	trans	-68	-51.3	-175.1	-177.3	-97.6	0	0	0	112.4	M405 A406 G413 F604 V609 W612	M405-Y409 HydrophobicContact CE-CD2 4.46Å; M405-Y409 WeakPolarHBondContact O-CB 3.36Å; M405-Y409 PolarHBondContact O-N 3.44Å; A406-Y409 PolarHBondContact O-N 3.36Å; Y409-G413 WeakPolarHBondContact O-CA 3.43Å; Y409-G413 PolarHBondContact O-N 3.19Å; Y409-F604 HydrophobicContact CD2-CE1 4.35Å; Y409-V609 HydrophobicContact CE2-CG2 4.37Å; Y409-W612 AromaticContact CD1-CE2 4Å; Y409-W612 HydrophobicContact CD1-CZ2 4.06Å; Y409-W612 AromaticContact CD1-NE1 3.39Å; Y409-W612 AromaticContact CD2-NE1 3.43Å; Y409-W612 AromaticContact CE1-NE1 3.77Å; Y409-W612 AromaticContact CE2-NE1 3.81Å; Y409-W612 HydrophobicContact CG-CZ2 4.19Å; Y409-W612 AromaticContact CG-NE1 3.21Å; Y409-W612 AromaticContact CZ-NE1 3.97Å
410	Y	90.4	Very high	89.5	Confident	33 Å²	33	22.8 Å²	22.8	13%	0.129	13%	0.126	C	C	.	.	H	α-helix	trans	-75.1	-36.2	-179.9	-68.3	-76.7	0	0	0	111.9	F159 A406 G413 V414 W612 A643	F159-Y410 HydrophobicContact CE1-CD1 4.46Å; F159-Y410 HydrophobicContact CE1-CE1 4.2Å; F159-Y410 HydrophobicContact CZ-CD1 4.41Å; F159-Y410 HydrophobicContact CZ-CE1 4.44Å; A406-Y410 HydrophobicContact CB-CD2 4.21Å; A406-Y410 HydrophobicContact CB-CE2 4.44Å; A406-Y410 WeakPolarHBondContact O-CB 3.25Å; A406-Y410 WeakPolarHBondContact O-CD2 3.42Å; A406-Y410 PolarHBondContact O-N 3.38Å; Y410-G413 PolarHBondContact O-N 3.01Å; Y410-V414 PolarHBondContact O-N 3.34Å; Y410-W612 HydrophobicContact CD2-CZ2 4.37Å; Y410-W612 HydrophobicContact CE2-CH2 4.01Å; Y410-W612 AromaticContact CE2-CZ2 3.82Å; Y410-W612 HydrophobicContact CE2-CZ2 3.82Å; Y410-A643 HydrophobicContact CD1-CB 4.38Å; Y410-A643 HydrophobicContact CD2-CB 3.54Å; Y410-A643 HydrophobicContact CE2-CB 4.18Å; Y410-A643 HydrophobicContact CG-CB 3.67Å
411	G	90.6	Very high	88.6	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.6	-50.8	176	0	0	0	0	0	112.4	F407 G413 W415 F650	F407-G411 WeakPolarHBondContact O-CA 3.17Å; F407-G411 PolarHBondContact O-N 3.02Å; F407-G411 VanDerWaalsContact O-N 3.1Å; G411-G413 VanDerWaalsContact C-N 3.33Å; G411-W415 WeakPolarHBondContact O-CB 3.28Å; G411-W415 PolarHBondContact O-N 3.1Å; G411-W415 VanDerWaalsContact O-N 3.11Å; G411-F650 VanDerWaalsContact C-CD1 3.43Å; G411-F650 WeakPolarHBondContact O-CB 3.44Å
412	L	88.5	Confident	88	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-68.1	-33.5	174.3	-72.1	177.6	0	0	0	112.4	S408 V414 W415 F416 T585 F604 F650 S665	S408-L412 VanDerWaalsContact O-CB 3.26Å; S408-L412 WeakPolarHBondContact O-CB 3.47Å; S408-L412 WeakPolarHBondContact O-CG 3.43Å; S408-L412 PolarHBondContact O-N 3.47Å; L412-V414 VanDerWaalsContact C-N 3.27Å; L412-V414 PolarHBondContact O-N 3.27Å; L412-W415 HydrophobicContact CD2-CD2 4.34Å; L412-W415 HydrophobicContact CD2-CE3 3.82Å; L412-W415 HydrophobicContact CD2-CZ3 4.35Å; L412-W415 PolarHBondContact O-N 3.23Å; L412-F416 HydrophobicContact CB-CD2 4.11Å; L412-F416 HydrophobicContact CB-CE2 3.67Å; L412-F416 HydrophobicContact CB-CZ 4.27Å; L412-F416 HydrophobicContact CD1-CE2 4.47Å; L412-F416 HydrophobicContact CD1-CZ 4.43Å; L412-F416 WeakPolarHBondContact O-CD2 3.49Å; L412-F416 WeakPolarHBondContact O-CG 3.33Å; L412-F416 PolarHBondContact O-N 3.2Å; L412-T585 HydrophobicContact CD1-CG2 3.49Å; L412-T585 VanDerWaalsContact CD1-CG2 3.49Å; L412-F604 HydrophobicContact CB-CE1 4.11Å; L412-F604 HydrophobicContact CB-CZ 4.47Å; L412-F604 HydrophobicContact CD1-CD1 4.48Å; L412-F604 HydrophobicContact CD1-CE1 3.98Å; L412-F604 HydrophobicContact CD1-CE2 4.06Å; L412-F604 HydrophobicContact CD1-CZ 3.75Å; L412-F650 HydrophobicContact CD2-CD1 4.01Å; L412-F650 HydrophobicContact CD2-CE1 3.68Å; L412-F650 HydrophobicContact CG-CD1 4.35Å; L412-F650 HydrophobicContact CG-CE1 3.85Å; L412-S665 WeakPolarHBondContact CD1-OG 3.33Å
413	G	84.3	Confident	87.2	Confident	33 Å²	33	32 Å²	32	34%	0.34	16%	0.164	S	C	.	.	H	α-helix	trans	-55.8	-38.4	177.6	0	0	0	0	0	113.7	Y409 Y410 G411 P417	Y409-G413 WeakPolarHBondContact O-CA 3.43Å; Y409-G413 PolarHBondContact O-N 3.19Å; Y410-G413 PolarHBondContact O-N 3.01Å; G411-G413 VanDerWaalsContact C-N 3.33Å; G413-P417 WeakPolarHBondContact O-CD 3.1Å
414	V	83.3	Confident	86.5	Confident	55 Å²	55	33 Å²	33	33%	0.333	17%	0.17	S	C	.	.	H	α-helix	trans	-82.3	-39.4	173.6	174.4	0	0	0	0	111.8	Y410 L412 F416 P417 D418 T647	Y410-V414 PolarHBondContact O-N 3.34Å; L412-V414 VanDerWaalsContact C-N 3.27Å; L412-V414 PolarHBondContact O-N 3.27Å; V414-F416 VanDerWaalsContact C-N 3.31Å; V414-F416 PolarHBondContact O-N 3.44Å; V414-P417 WeakPolarHBondContact O-CD 3.13Å; V414-D418 PolarHBondContact O-N 3.14Å; V414-T647 HydrophobicContact CB-CG2 4.35Å; V414-T647 HydrophobicContact CG2-CG2 3.58Å
415	W	87.2	Confident	85.6	Confident	6 Å²	6	36.6 Å²	36.6	2%	0.023	19%	0.186	C	C	.	.	H	α-helix	trans	-62.5	-34.5	-178.6	-177.1	79.7	0	0	0	113.8	G411 L412 M419 F650 K658 I662	G411-W415 WeakPolarHBondContact O-CB 3.28Å; G411-W415 PolarHBondContact O-N 3.1Å; G411-W415 VanDerWaalsContact O-N 3.11Å; L412-W415 HydrophobicContact CD2-CD2 4.34Å; L412-W415 HydrophobicContact CD2-CE3 3.82Å; L412-W415 HydrophobicContact CD2-CZ3 4.35Å; L412-W415 PolarHBondContact O-N 3.23Å; W415-M419 HydrophobicContact CD2-CB 4.39Å; W415-M419 HydrophobicContact CH2-CE 4.45Å; W415-M419 HydrophobicContact CH2-CG 4.24Å; W415-M419 HydrophobicContact CZ2-CB 4.45Å; W415-M419 HydrophobicContact CZ2-CE 3.48Å; W415-M419 VanDerWaalsContact CZ2-CE 3.48Å; W415-M419 HydrophobicContact CZ2-CG 4.11Å; W415-M419 WeakPolarHBondContact O-CB 3.34Å; W415-M419 PolarHBondContact O-N 3.37Å; W415-F650 HydrophobicContact CB-CB 4.16Å; W415-F650 HydrophobicContact CB-CD1 4.18Å; W415-F650 HydrophobicContact CG-CD1 4.44Å; W415-K658 HydrophobicContact CH2-CB 4.46Å; W415-K658 HydrophobicContact CZ2-CB 3.92Å; W415-I662 HydrophobicContact CH2-CD1 3.98Å; W415-I662 HydrophobicContact CH2-CG1 4.05Å; W415-I662 HydrophobicContact CZ2-CG1 4.49Å
416	F	82.9	Confident	85	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.7	-56.7	-177.5	-75.9	-58.9	0	0	0	113.4	L412 V414 D418 M419 I420 L588 I597 Q601 F604	L412-F416 HydrophobicContact CB-CD2 4.11Å; L412-F416 HydrophobicContact CB-CE2 3.67Å; L412-F416 HydrophobicContact CB-CZ 4.27Å; L412-F416 HydrophobicContact CD1-CE2 4.47Å; L412-F416 HydrophobicContact CD1-CZ 4.43Å; L412-F416 WeakPolarHBondContact O-CD2 3.49Å; L412-F416 WeakPolarHBondContact O-CG 3.33Å; L412-F416 PolarHBondContact O-N 3.2Å; V414-F416 VanDerWaalsContact C-N 3.31Å; V414-F416 PolarHBondContact O-N 3.44Å; F416-D418 VanDerWaalsContact C-N 3.3Å; F416-D418 PolarHBondContact O-N 2.89Å; F416-M419 PolarHBondContact O-N 3.48Å; F416-I420 VanDerWaalsContact O-CG1 3.31Å; F416-I420 WeakPolarHBondContact O-CG1 3.36Å; F416-I420 PolarHBondContact O-N 3.22Å; F416-L588 HydrophobicContact CE1-CD1 3.41Å; F416-L588 VanDerWaalsContact CE1-CD1 3.41Å; F416-L588 HydrophobicContact CE1-CD2 4.1Å; F416-L588 HydrophobicContact CE1-CG 4.43Å; F416-L588 HydrophobicContact CZ-CD1 3.45Å; F416-L588 VanDerWaalsContact CZ-CD1 3.45Å; F416-I597 HydrophobicContact CD1-CG2 4.24Å; F416-Q601 HydrophobicContact CB-CG 4.21Å; F416-Q601 VanDerWaalsContact CB-NE2 3.28Å; F416-Q601 HydrophobicContact CD1-CB 3.92Å; F416-Q601 HydrophobicContact CD1-CG 4.08Å; F416-Q601 HydrophobicContact CD2-CB 4.14Å; F416-Q601 HydrophobicContact CD2-CG 3.51Å; F416-Q601 HydrophobicContact CE1-CB 3.84Å; F416-Q601 HydrophobicContact CE1-CG 4.29Å; F416-Q601 HydrophobicContact CE2-CB 4.07Å; F416-Q601 HydrophobicContact CE2-CG 3.77Å; F416-Q601 HydrophobicContact CG-CB 4.08Å; F416-Q601 VanDerWaalsContact CG-CD 3.44Å; F416-Q601 HydrophobicContact CG-CG 3.7Å; F416-Q601 HydrophobicContact CZ-CB 3.94Å; F416-Q601 HydrophobicContact CZ-CG 4.16Å; F416-F604 AromaticContact CE2-CD1 3.85Å; F416-F604 HydrophobicContact CE2-CD1 3.85Å; F416-F604 HydrophobicContact CE2-CE1 4.29Å; F416-F604 HydrophobicContact CZ-CD1 4.35Å
417	P	77.4	Confident	84.3	Confident	67 Å²	67	45 Å²	45	44%	0.435	23%	0.225	S	C	.	.	H	α-helix	trans	-55.3	-44.4	174.8	-25.4	32.7	0	0	0	112.9	G413 V414 M419 I420 K421	G413-P417 WeakPolarHBondContact O-CD 3.1Å; V414-P417 WeakPolarHBondContact O-CD 3.13Å; P417-M419 PolarHBondContact O-N 3.17Å; P417-I420 PolarHBondContact O-N 3.16Å; P417-K421 WeakPolarHBondContact O-CB 3.32Å; P417-K421 PolarHBondContact O-N 3.04Å
418	D	78.7	Confident	83.5	Confident	64 Å²	64	48 Å²	48	34%	0.342	24%	0.237	S	C	.	.	H	α-helix	trans	-66.2	-38.7	-177.9	-71	-12.9	0	0	0	111.9	V414 F416 K421 Y422 V654	V414-D418 PolarHBondContact O-N 3.14Å; F416-D418 VanDerWaalsContact C-N 3.3Å; F416-D418 PolarHBondContact O-N 2.89Å; D418-K421 PolarHBondContact O-N 2.98Å; D418-Y422 VanDerWaalsContact O-CB 3.29Å; D418-Y422 WeakPolarHBondContact O-CB 3.33Å; D418-Y422 PolarHBondContact O-N 3.11Å; D418-V654 HydrophobicContact CB-CG1 4.17Å; D418-V654 HydrophobicContact CB-CG2 3.85Å
419	M	82.5	Confident	82.8	Confident	15 Å²	15	53.1 Å²	53.1	7%	0.074	26%	0.261	C	S	.	.	H	α-helix	trans	-68.4	-38.1	174.7	-175	58.3	66.2	0	0	111.9	W415 F416 P417 Y422 L423 K658	W415-M419 HydrophobicContact CD2-CB 4.39Å; W415-M419 HydrophobicContact CH2-CE 4.45Å; W415-M419 HydrophobicContact CH2-CG 4.24Å; W415-M419 HydrophobicContact CZ2-CB 4.45Å; W415-M419 HydrophobicContact CZ2-CE 3.48Å; W415-M419 VanDerWaalsContact CZ2-CE 3.48Å; W415-M419 HydrophobicContact CZ2-CG 4.11Å; W415-M419 WeakPolarHBondContact O-CB 3.34Å; W415-M419 PolarHBondContact O-N 3.37Å; F416-M419 PolarHBondContact O-N 3.48Å; P417-M419 PolarHBondContact O-N 3.17Å; M419-Y422 PolarHBondContact O-N 3.06Å; M419-Y422 HydrophobicContact SD-CD1 4.22Å; M419-L423 HydrophobicContact CG-CD1 4.43Å; M419-L423 VanDerWaalsContact O-CG 3.3Å; M419-L423 WeakPolarHBondContact O-CG 3.16Å; M419-L423 PolarHBondContact O-N 3.3Å; M419-K658 HydrophobicContact CE-CB 4.28Å
420	I	79.9	Confident	82.3	Confident	22 Å²	22	56.2 Å²	56.2	11%	0.113	29%	0.286	C	S	.	.	H	α-helix	trans	-64.1	-46.1	174.4	-68.7	165.2	0	0	0	109.9	F416 P417 Y422 L423 Q424 Q594 I598	F416-I420 VanDerWaalsContact O-CG1 3.31Å; F416-I420 WeakPolarHBondContact O-CG1 3.36Å; F416-I420 PolarHBondContact O-N 3.22Å; P417-I420 PolarHBondContact O-N 3.16Å; I420-Y422 VanDerWaalsContact C-N 3.32Å; I420-Y422 PolarHBondContact O-N 3.1Å; I420-L423 PolarHBondContact O-N 3.44Å; I420-Q424 HydrophobicContact CG2-CG 4.45Å; I420-Q424 WeakPolarHBondContact O-CG 3.35Å; I420-Q424 PolarHBondContact O-N 2.83Å; I420-Q594 HydrophobicContact CG2-CG 4.5Å; I420-I598 HydrophobicContact CD1-CD1 4.45Å; I420-I598 HydrophobicContact CD1-CG1 3.79Å
421	K	77.9	Confident	82	Confident	137 Å²	137	60.6 Å²	60.6	60%	0.596	31%	0.306	S	S	*	.	H	α-helix	trans	-59.4	-44.3	176.3	-174.8	176.1	179.7	176.1	0	111.1	P417 D418 Q424 Q425	P417-K421 WeakPolarHBondContact O-CB 3.32Å; P417-K421 PolarHBondContact O-N 3.04Å; D418-K421 PolarHBondContact O-N 2.98Å; K421-Q424 PolarHBondContact O-N 3.38Å; K421-Q425 WeakPolarHBondContact O-CB 3.35Å; K421-Q425 PolarHBondContact O-N 2.99Å
422	Y	82.3	Confident	81.8	Confident	73 Å²	73	62.6 Å²	62.6	29%	0.286	32%	0.318	S	S	.	.	H	α-helix	trans	-59.9	-45.9	175.8	178.1	-93.2	0	0	0	112.3	D418 M419 I420 Q424 Q425 E426 V654 G655	D418-Y422 VanDerWaalsContact O-CB 3.29Å; D418-Y422 WeakPolarHBondContact O-CB 3.33Å; D418-Y422 PolarHBondContact O-N 3.11Å; M419-Y422 PolarHBondContact O-N 3.06Å; M419-Y422 HydrophobicContact SD-CD1 4.22Å; I420-Y422 VanDerWaalsContact C-N 3.32Å; I420-Y422 PolarHBondContact O-N 3.1Å; Y422-Q424 PolarHBondContact O-N 3.44Å; Y422-Q425 WeakPolarHBondContact O-CB 3.28Å; Y422-Q425 PolarHBondContact O-N 3.4Å; Y422-E426 HydrophobicContact CD1-CG 4.43Å; Y422-E426 HydrophobicContact CE1-CG 3.81Å; Y422-E426 WeakPolarHBondContact CE1-OE1 3.18Å; Y422-E426 PolarHBondContact O-N 3.39Å; Y422-E426 PolarHBondContact OH-OE1 2.97Å; Y422-V654 HydrophobicContact CG-CG1 4.44Å; Y422-G655 VanDerWaalsContact CE2-CA 3.48Å
423	L	80.4	Confident	81.9	Confident	46 Å²	46	68.8 Å²	68.8	24%	0.241	35%	0.345	C	S	.	.	H	α-helix	trans	-65.4	-37.7	177.4	-71.6	171	0	0	0	112.6	M419 I420 Q425 E426 E427 I597	M419-L423 HydrophobicContact CG-CD1 4.43Å; M419-L423 VanDerWaalsContact O-CG 3.3Å; M419-L423 WeakPolarHBondContact O-CG 3.16Å; M419-L423 PolarHBondContact O-N 3.3Å; I420-L423 PolarHBondContact O-N 3.44Å; L423-Q425 VanDerWaalsContact C-N 3.31Å; L423-E426 PolarHBondContact O-N 3.2Å; L423-E427 WeakPolarHBondContact O-CB 3.48Å; L423-E427 PolarHBondContact O-N 3.4Å; L423-I597 HydrophobicContact CD1-CD1 3.48Å; L423-I597 VanDerWaalsContact CD1-CD1 3.48Å
424	Q	80.3	Confident	82.2	Confident	86 Å²	86	70.5 Å²	70.5	40%	0.402	35%	0.348	S	S	.	.	H	α-helix	trans	-64.1	-39.6	173.8	-73.5	175.5	-42.4	0	0	111.3	I420 K421 Y422 E427 Y428	I420-Q424 HydrophobicContact CG2-CG 4.45Å; I420-Q424 WeakPolarHBondContact O-CG 3.35Å; I420-Q424 PolarHBondContact O-N 2.83Å; K421-Q424 PolarHBondContact O-N 3.38Å; Y422-Q424 PolarHBondContact O-N 3.44Å; Q424-E427 PolarHBondContact O-N 2.97Å; Q424-Y428 VanDerWaalsContact O-CB 3.3Å; Q424-Y428 WeakPolarHBondContact O-CB 3.43Å; Q424-Y428 PolarHBondContact O-N 3.47Å
425	Q	79.1	Confident	82.6	Confident	88 Å²	88	70.8 Å²	70.8	41%	0.411	35%	0.345	S	S	.	.	H	α-helix	trans	-66.6	-44.2	175.6	-176.4	169.1	-7.1	0	0	111.7	K421 Y422 L423 E427 Y428 E429	K421-Q425 WeakPolarHBondContact O-CB 3.35Å; K421-Q425 PolarHBondContact O-N 2.99Å; Y422-Q425 WeakPolarHBondContact O-CB 3.28Å; Y422-Q425 PolarHBondContact O-N 3.4Å; L423-Q425 VanDerWaalsContact C-N 3.31Å; Q425-E427 VanDerWaalsContact C-N 3.33Å; Q425-E427 PolarHBondContact O-N 3.12Å; Q425-Y428 WeakPolarHBondContact O-CB 3.29Å; Q425-Y428 PolarHBondContact O-N 3.08Å; Q425-E429 HydrophobicContact CG-CG 4.46Å; Q425-E429 PolarHBondContact NE2-OE1 3.49Å; Q425-E429 VanDerWaalsContact NE2-OE1 3.17Å; Q425-E429 WeakPolarHBondContact O-CB 3.32Å; Q425-E429 WeakPolarHBondContact O-CG 3.35Å; Q425-E429 PolarHBondContact O-N 2.81Å
426	E	81.3	Confident	82.8	Confident	88 Å²	88	75.8 Å²	75.8	41%	0.411	37%	0.369	S	S	.	.	H	α-helix	trans	-60.4	-41.8	173.3	-79.8	-170.8	155.3	0	0	112	Y422 L423 Y428 E429 S430	Y422-E426 HydrophobicContact CD1-CG 4.43Å; Y422-E426 HydrophobicContact CE1-CG 3.81Å; Y422-E426 WeakPolarHBondContact CE1-OE1 3.18Å; Y422-E426 PolarHBondContact O-N 3.39Å; Y422-E426 PolarHBondContact OH-OE1 2.97Å; L423-E426 PolarHBondContact O-N 3.2Å; E426-Y428 VanDerWaalsContact C-N 3.32Å; E426-E429 PolarHBondContact O-N 2.87Å; E426-S430 WeakPolarHBondContact O-CB 3.16Å; E426-S430 PolarHBondContact O-N 2.95Å
427	E	80.4	Confident	83.2	Confident	88 Å²	88	84.6 Å²	84.6	41%	0.411	40%	0.402	S	S	.	.	H	α-helix	trans	-65.1	-39.2	176.1	-171.7	179.5	169.1	0	0	111.2	L423 Q424 Q425 S430 K431	L423-E427 WeakPolarHBondContact O-CB 3.48Å; L423-E427 PolarHBondContact O-N 3.4Å; Q424-E427 PolarHBondContact O-N 2.97Å; Q425-E427 VanDerWaalsContact C-N 3.33Å; Q425-E427 PolarHBondContact O-N 3.12Å; E427-S430 PolarHBondContact O-N 3.27Å; E427-S430 PolarHBondContact O-OG 3.42Å; E427-K431 WeakPolarHBondContact O-CG 3.44Å; E427-K431 PolarHBondContact O-N 2.9Å; E427-K431 WeakPolarHBondContact OE1-CE 3.33Å; E427-K431 IonicContact OE1-NZ 3.22Å; E427-K431 PolarHBondContact OE1-NZ 2.68Å
428	Y	79.3	Confident	83.8	Confident	80 Å²	80	84.4 Å²	84.4	31%	0.314	40%	0.395	S	S	.	.	H	α-helix	trans	-62.4	-52.8	174.5	-174.2	-97.4	0	0	0	110.7	Q424 Q425 E426 S430 K431 N451	Q424-Y428 VanDerWaalsContact O-CB 3.3Å; Q424-Y428 WeakPolarHBondContact O-CB 3.43Å; Q424-Y428 PolarHBondContact O-N 3.47Å; Q425-Y428 WeakPolarHBondContact O-CB 3.29Å; Q425-Y428 PolarHBondContact O-N 3.08Å; E426-Y428 VanDerWaalsContact C-N 3.32Å; Y428-S430 VanDerWaalsContact C-N 3.26Å; Y428-S430 PolarHBondContact O-N 3.42Å; Y428-K431 PolarHBondContact O-N 2.95Å; Y428-N451 HydrophobicContact CE1-CB 3.85Å; Y428-N451 VanDerWaalsContact CE1-CG 3.41Å; Y428-N451 WeakPolarHBondContact CE1-OD1 3.38Å; Y428-N451 HydrophobicContact CE2-CB 4.02Å; Y428-N451 PolarHBondContact O-ND2 3.41Å; Y428-N451 WeakPolarHBondContact OH-CB 3.25Å; Y428-N451 PolarHBondContact OH-N 3.27Å
429	E	79.2	Confident	84.5	Confident	108 Å²	108	88.9 Å²	88.9	51%	0.505	41%	0.407	S	S	.	.	H	α-helix	trans	-58.7	-35.4	177	-72.4	176.4	-167.2	0	0	112.4	Q425 E426 K431 V432	Q425-E429 HydrophobicContact CG-CG 4.46Å; Q425-E429 PolarHBondContact NE2-OE1 3.49Å; Q425-E429 VanDerWaalsContact NE2-OE1 3.17Å; Q425-E429 WeakPolarHBondContact O-CB 3.32Å; Q425-E429 WeakPolarHBondContact O-CG 3.35Å; Q425-E429 PolarHBondContact O-N 2.81Å; E426-E429 PolarHBondContact O-N 2.87Å; E429-K431 PolarHBondContact O-N 3.21Å; E429-V432 WeakPolarHBondContact O-CB 3.32Å; E429-V432 WeakPolarHBondContact O-CG2 3.3Å; E429-V432 PolarHBondContact O-N 2.89Å
430	S	81.9	Confident	85	Confident	91 Å²	91	89.6 Å²	89.6	64%	0.636	41%	0.412	S	S	*	.	H	α-helix	trans	-66	-21.7	176.5	79	0	0	0	0	114	E426 E427 Y428	E426-S430 WeakPolarHBondContact O-CB 3.16Å; E426-S430 PolarHBondContact O-N 2.95Å; E427-S430 PolarHBondContact O-N 3.27Å; E427-S430 PolarHBondContact O-OG 3.42Å; Y428-S430 VanDerWaalsContact C-N 3.26Å; Y428-S430 PolarHBondContact O-N 3.42Å
431	K	85.4	Confident	85.6	Confident	125 Å²	125	92.9 Å²	92.9	54%	0.543	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	6.6	179.5	-68	172.5	-172.7	167.1	0	113	E427 Y428 E429 K433	E427-K431 WeakPolarHBondContact O-CG 3.44Å; E427-K431 PolarHBondContact O-N 2.9Å; E427-K431 WeakPolarHBondContact OE1-CE 3.33Å; E427-K431 IonicContact OE1-NZ 3.22Å; E427-K431 PolarHBondContact OE1-NZ 2.68Å; Y428-K431 PolarHBondContact O-N 2.95Å; E429-K431 PolarHBondContact O-N 3.21Å; K431-K433 PolarHBondContact O-N 3.45Å
432	V	86.6	Confident	86.3	Confident	43 Å²	43	96.2 Å²	96.2	26%	0.261	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-55.7	130.5	178	168.4	0	0	0	0	110.4	E429 V434 N451 I453	E429-V432 WeakPolarHBondContact O-CB 3.32Å; E429-V432 WeakPolarHBondContact O-CG2 3.3Å; E429-V432 PolarHBondContact O-N 2.89Å; V432-V434 HydrophobicContact CG1-CG2 4.08Å; V432-N451 WeakPolarHBondContact CA-O 3.34Å; V432-N451 WeakPolarHBondContact CG2-OD1 3.35Å; V432-N451 PolarHBondContact N-ND2 2.94Å; V432-I453 HydrophobicContact CG1-CB 4.41Å; V432-I453 HydrophobicContact CG1-CD1 3.68Å; V432-I453 HydrophobicContact CG1-CG1 3.66Å
433	K	89	Confident	86.8	Confident	129 Å²	129	97 Å²	97	56%	0.561	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.7	120.7	172.2	-64.8	176.7	-174.5	169.1	0	109.3	K431 F435 N451 Q452 I453	K431-K433 PolarHBondContact O-N 3.45Å; K433-F435 HydrophobicContact CB-CE2 3.89Å; K433-F435 HydrophobicContact CB-CZ 4.27Å; K433-N451 PolarHBondContact N-O 3.27Å; K433-Q452 HydrophobicContact CB-CG 4.35Å; K433-Q452 CarbonylContact O-C 3.51Å; K433-Q452 WeakPolarHBondContact O-CA 3.07Å; K433-I453 PolarHBondContact O-N 3.12Å
434	V	90.6	Very high	87.3	Confident	69 Å²	69	98.8 Å²	98.8	42%	0.418	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	122.6	176.8	-170.5	0	0	0	0	109.6	V432 H436 I453 R455	V432-V434 HydrophobicContact CG1-CG2 4.08Å; V434-H436 WeakPolarHBondContact CG1-NE2 3.41Å; V434-I453 CarbonylContact C-O 3.54Å; V434-I453 WeakPolarHBondContact CA-O 3.45Å; V434-I453 HydrophobicContact CG1-CB 4.44Å; V434-I453 HydrophobicContact CG2-CB 4.38Å; V434-R455 HydrophobicContact CG1-CG 4.49Å
435	F	91.8	Very high	87.8	Confident	62 Å²	62	95.6 Å²	95.6	27%	0.272	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	132.9	175.4	-64.7	-78.6	0	0	0	109.5	K433 E438 Q452 I453 H454 R455	K433-F435 HydrophobicContact CB-CE2 3.89Å; K433-F435 HydrophobicContact CB-CZ 4.27Å; F435-E438 VanDerWaalsContact CB-CD 3.42Å; F435-E438 HydrophobicContact CB-CG 3.97Å; F435-E438 VanDerWaalsContact CB-OE2 3.23Å; F435-E438 WeakPolarHBondContact CB-OE2 3.2Å; F435-E438 WeakPolarHBondContact CD1-OE1 3.36Å; F435-E438 WeakPolarHBondContact CG-OE2 3.44Å; F435-Q452 HydrophobicContact CD2-CB 4.47Å; F435-Q452 HydrophobicContact CE2-CB 4.29Å; F435-Q452 HydrophobicContact CE2-CG 3.98Å; F435-I453 PolarHBondContact N-O 3.46Å; F435-H454 AromaticContact CD2-CE1 3.46Å; F435-H454 VanDerWaalsContact CD2-CE1 3.46Å; F435-H454 WeakPolarHBondContact CD2-CE1 3.12Å; F435-H454 AromaticContact CD2-ND1 3.71Å; F435-H454 AromaticContact CG-ND1 3.92Å; F435-R455 PolarHBondContact O-N 3.31Å
436	H	92.7	Very high	88.3	Confident	110 Å²	110	96.9 Å²	96.9	51%	0.509	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	129.1	-174.2	-82.9	-77.5	0	0	0	110.8	V434 E438 R455	V434-H436 WeakPolarHBondContact CG1-NE2 3.41Å; H436-E438 PolarHBondContact O-N 2.99Å; H436-R455 WeakPolarHBondContact CA-O 3.3Å; H436-R455 WeakPolarHBondContact CE1-CD 3.39Å; H436-R455 WeakPolarHBondContact ND1-CB 2.88Å
437	R	90.6	Very high	88.6	Confident	186 Å²	186	97.3 Å²	97.3	70%	0.702	44%	0.444	S	S	*	.	S	Bend	trans	53.4	39.4	175	-62.1	-178.6	175	177.1	-1	113.3	R455 E456	R437-R455 PolarHBondContact N-O 3.47Å; R437-E456 WeakPolarHBondContact CA-O 3.23Å; R437-E456 HydrophobicContact CG-CB 3.94Å; R437-E456 IonicContact CZ-OE2 3.25Å; R437-E456 VanDerWaalsContact CZ-OE2 3.25Å; R437-E456 IonicContact NE-OE2 2.69Å; R437-E456 PolarHBondContact NE-OE2 2.98Å; R437-E456 IonicContact NH2-OE1 2.69Å; R437-E456 IonicContact NH2-OE2 2.91Å; R437-E456 PolarHBondContact NH2-OE2 3.43Å
438	E	90.8	Very high	88.9	Confident	63 Å²	63	95.9 Å²	95.9	29%	0.294	44%	0.443	S	S	.	.			trans	-74.2	129.8	174	-67.9	-167.9	133.8	0	0	109.2	F435 H436 H454 G457 E458	F435-E438 VanDerWaalsContact CB-CD 3.42Å; F435-E438 HydrophobicContact CB-CG 3.97Å; F435-E438 VanDerWaalsContact CB-OE2 3.23Å; F435-E438 WeakPolarHBondContact CB-OE2 3.2Å; F435-E438 WeakPolarHBondContact CD1-OE1 3.36Å; F435-E438 WeakPolarHBondContact CG-OE2 3.44Å; H436-E438 PolarHBondContact O-N 2.99Å; E438-H454 IonicContact OE2-CE1 3.27Å; E438-H454 IonicContact OE2-ND1 2.87Å; E438-H454 PolarHBondContact OE2-ND1 3.38Å; E438-G457 CarbonylContact O-C 3.56Å; E438-G457 VanDerWaalsContact O-CA 3.31Å; E438-G457 WeakPolarHBondContact O-CA 3.02Å; E438-E458 PolarHBondContact O-N 3.38Å
439	R	92.8	Very high	89.3	Confident	157 Å²	157	92.2 Å²	92.2	59%	0.592	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.4	112.6	170.7	-176.7	172.5	174.7	148.9	-5.4	108.5	E441 E458	R439-E441 HydrophobicContact CG-CG 4.28Å; R439-E441 IonicContact CZ-OE1 2.74Å; R439-E441 IonicContact NE-OE1 3.63Å; R439-E441 PolarHBondContact NE-OE1 3.03Å; R439-E441 IonicContact NH2-OE1 3.58Å; R439-E441 PolarHBondContact NH2-OE1 3.39Å; R439-E458 CarbonylContact C-O 3.55Å; R439-E458 WeakPolarHBondContact CA-O 3.27Å; R439-E458 HydrophobicContact CB-CB 4.33Å; R439-E458 WeakPolarHBondContact CD-OE2 3.44Å; R439-E458 HydrophobicContact CG-CB 4.06Å; R439-E458 IonicContact CZ-OE2 3.28Å; R439-E458 IonicContact NE-OE2 3.99Å; R439-E458 IonicContact NH1-OE2 3.08Å; R439-E458 PolarHBondContact NH1-OE2 3.48Å; R439-E458 VanDerWaalsContact NH1-OE2 3.08Å
440	V	92.4	Very high	89.7	Confident	30 Å²	30	91.4 Å²	91.4	18%	0.182	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	129.7	179.1	-173.6	0	0	0	0	107.1	F443 F445 E458 Y459 I460 D462	V440-F443 HydrophobicContact CG1-CB 3.39Å; V440-F443 HydrophobicContact CG1-CD1 4.43Å; V440-F443 HydrophobicContact CG1-CG 4.07Å; V440-F445 HydrophobicContact CG1-CE2 4.19Å; V440-F445 HydrophobicContact CG1-CZ 4.06Å; V440-E458 PolarHBondContact N-O 2.89Å; V440-Y459 HydrophobicContact CB-CD1 3.9Å; V440-Y459 HydrophobicContact CB-CE1 4.22Å; V440-Y459 HydrophobicContact CG2-CD1 4.16Å; V440-Y459 HydrophobicContact CG2-CE1 3.95Å; V440-I460 PolarHBondContact O-N 2.92Å; V440-D462 VanDerWaalsContact O-OD2 3.1Å
441	E	93.1	Very high	89.9	Confident	92 Å²	92	87.9 Å²	87.9	43%	0.43	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	134.8	178.1	-55.4	-171.3	171.9	0	0	110.5	R439 F443 I460	R439-E441 HydrophobicContact CG-CG 4.28Å; R439-E441 IonicContact CZ-OE1 2.74Å; R439-E441 IonicContact NE-OE1 3.63Å; R439-E441 PolarHBondContact NE-OE1 3.03Å; R439-E441 IonicContact NH2-OE1 3.58Å; R439-E441 PolarHBondContact NH2-OE1 3.39Å; E441-F443 PolarHBondContact O-N 2.84Å; E441-I460 VanDerWaalsContact CA-O 3.26Å; E441-I460 WeakPolarHBondContact CA-O 3.41Å; E441-I460 HydrophobicContact CG-CB 4.18Å
442	R	92.3	Very high	90.2	Very high	207 Å²	207	83.1 Å²	83.1	78%	0.781	38%	0.379	S	S	*	.	S	Bend	trans	54.9	34.7	175.5	-55.3	178.5	-178	172.4	2.7	113.2	I460 N461 D462	R442-I460 PolarHBondContact N-O 2.97Å; R442-N461 WeakPolarHBondContact CA-O 3.3Å; R442-N461 HydrophobicContact CG-CB 4.02Å; R442-D462 PolarHBondContact N-OD1 2.83Å
443	F	92.8	Very high	90.5	Very high	89 Å²	89	82.9 Å²	82.9	39%	0.39	38%	0.376	S	S	.	.			trans	-96.4	148	177.2	-168	-103	0	0	0	111.2	V440 E441 F445 F447 D462 K463	V440-F443 HydrophobicContact CG1-CB 3.39Å; V440-F443 HydrophobicContact CG1-CD1 4.43Å; V440-F443 HydrophobicContact CG1-CG 4.07Å; E441-F443 PolarHBondContact O-N 2.84Å; F443-F445 HydrophobicContact CB-CE2 4.47Å; F443-F445 AromaticContact CD1-CD1 3.85Å; F443-F445 HydrophobicContact CD1-CD1 3.85Å; F443-F445 AromaticContact CD1-CD2 3.68Å; F443-F445 HydrophobicContact CD1-CD2 3.68Å; F443-F445 AromaticContact CD1-CE1 3.85Å; F443-F445 HydrophobicContact CD1-CE1 3.85Å; F443-F445 AromaticContact CD1-CE2 3.68Å; F443-F445 HydrophobicContact CD1-CE2 3.68Å; F443-F445 AromaticContact CD1-CG 3.77Å; F443-F445 HydrophobicContact CD1-CG 3.77Å; F443-F445 AromaticContact CD1-CZ 3.76Å; F443-F445 HydrophobicContact CD1-CZ 3.76Å; F443-F445 AromaticContact CE1-CD1 3.71Å; F443-F445 HydrophobicContact CE1-CD1 3.71Å; F443-F445 HydrophobicContact CE1-CD2 4.32Å; F443-F445 AromaticContact CE1-CE1 3.92Å; F443-F445 HydrophobicContact CE1-CE1 3.92Å; F443-F445 HydrophobicContact CE1-CE2 4.5Å; F443-F445 AromaticContact CE1-CG 3.92Å; F443-F445 HydrophobicContact CE1-CG 3.92Å; F443-F445 HydrophobicContact CE1-CZ 4.31Å; F443-F447 AromaticContact CE1-CE1 3.91Å; F443-F447 HydrophobicContact CE1-CE1 3.91Å; F443-F447 HydrophobicContact CE1-CZ 4.47Å; F443-F447 HydrophobicContact CZ-CE1 4.14Å; F443-D462 PolarHBondContact N-OD1 2.99Å; F443-D462 WeakPolarHBondContact O-CA 3.42Å; F443-K463 PolarHBondContact O-N 3.41Å
444	H	91.4	Very high	90.7	Very high	83 Å²	83	77.3 Å²	77.3	38%	0.384	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	101.6	176.7	-178	-86.1	0	0	0	108.7	N446 K463 I465	H444-N446 PolarHBondContact O-N 3.01Å; H444-K463 CarbonylContact C-O 3.41Å; H444-K463 WeakPolarHBondContact CA-O 3.42Å; H444-I465 WeakPolarHBondContact NE2-CD1 3.18Å
445	F	90.5	Very high	90.9	Very high	20 Å²	20	78.8 Å²	78.8	9%	0.088	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	122.1	174.2	-66.2	-89.8	0	0	0	109.1	V440 F443 F447 Y459 D462 K463 F464 I465 I467	V440-F445 HydrophobicContact CG1-CE2 4.19Å; V440-F445 HydrophobicContact CG1-CZ 4.06Å; F443-F445 HydrophobicContact CB-CE2 4.47Å; F443-F445 AromaticContact CD1-CD1 3.85Å; F443-F445 HydrophobicContact CD1-CD1 3.85Å; F443-F445 AromaticContact CD1-CD2 3.68Å; F443-F445 HydrophobicContact CD1-CD2 3.68Å; F443-F445 AromaticContact CD1-CE1 3.85Å; F443-F445 HydrophobicContact CD1-CE1 3.85Å; F443-F445 AromaticContact CD1-CE2 3.68Å; F443-F445 HydrophobicContact CD1-CE2 3.68Å; F443-F445 AromaticContact CD1-CG 3.77Å; F443-F445 HydrophobicContact CD1-CG 3.77Å; F443-F445 AromaticContact CD1-CZ 3.76Å; F443-F445 HydrophobicContact CD1-CZ 3.76Å; F443-F445 AromaticContact CE1-CD1 3.71Å; F443-F445 HydrophobicContact CE1-CD1 3.71Å; F443-F445 HydrophobicContact CE1-CD2 4.32Å; F443-F445 AromaticContact CE1-CE1 3.92Å; F443-F445 HydrophobicContact CE1-CE1 3.92Å; F443-F445 HydrophobicContact CE1-CE2 4.5Å; F443-F445 AromaticContact CE1-CG 3.92Å; F443-F445 HydrophobicContact CE1-CG 3.92Å; F443-F445 HydrophobicContact CE1-CZ 4.31Å; F445-F447 HydrophobicContact CD1-CE1 4.1Å; F445-F447 HydrophobicContact CD1-CE2 4.48Å; F445-F447 AromaticContact CD1-CZ 3.8Å; F445-F447 HydrophobicContact CD1-CZ 3.8Å; F445-F447 HydrophobicContact CE1-CZ 4.2Å; F445-Y459 HydrophobicContact CE2-CD1 4.43Å; F445-Y459 HydrophobicContact CZ-CD1 4.41Å; F445-Y459 HydrophobicContact CZ-CE1 4.21Å; F445-D462 HydrophobicContact CE2-CB 4.33Å; F445-K463 PolarHBondContact N-O 3.41Å; F445-F464 HydrophobicContact CB-CD1 3.82Å; F445-F464 HydrophobicContact CB-CE1 4.21Å; F445-F464 HydrophobicContact CB-CG 4.45Å; F445-F464 HydrophobicContact CD1-CE1 4.22Å; F445-F464 AromaticContact CD2-CD1 3.61Å; F445-F464 HydrophobicContact CD2-CD1 3.61Å; F445-F464 HydrophobicContact CD2-CD2 4.37Å; F445-F464 AromaticContact CD2-CE1 3.24Å; F445-F464 HydrophobicContact CD2-CE1 3.24Å; F445-F464 HydrophobicContact CD2-CE2 4.06Å; F445-F464 HydrophobicContact CD2-CG 4.17Å; F445-F464 AromaticContact CD2-CZ 3.49Å; F445-F464 HydrophobicContact CD2-CZ 3.49Å; F445-F464 VanDerWaalsContact CD2-CZ 3.49Å; F445-F464 HydrophobicContact CE1-CE1 4.43Å; F445-F464 HydrophobicContact CE2-CD1 4.34Å; F445-F464 AromaticContact CE2-CE1 3.51Å; F445-F464 HydrophobicContact CE2-CE1 3.51Å; F445-F464 HydrophobicContact CE2-CE2 4.17Å; F445-F464 AromaticContact CE2-CZ 3.41Å; F445-F464 HydrophobicContact CE2-CZ 3.41Å; F445-F464 VanDerWaalsContact CE2-CZ 3.41Å; F445-F464 AromaticContact CG-CD1 3.79Å; F445-F464 HydrophobicContact CG-CD1 3.79Å; F445-F464 AromaticContact CG-CE1 3.65Å; F445-F464 HydrophobicContact CG-CE1 3.65Å; F445-F464 HydrophobicContact CG-CZ 4.35Å; F445-F464 HydrophobicContact CZ-CE1 4.11Å; F445-F464 HydrophobicContact CZ-CZ 4.2Å; F445-I465 PolarHBondContact O-N 3.42Å; F445-I467 HydrophobicContact CB-CD1 3.32Å; F445-I467 HydrophobicContact CG-CD1 4.5Å; F445-I467 WeakPolarHBondContact O-CD1 3.26Å
446	N	88.5	Confident	90.9	Very high	114 Å²	114	79.9 Å²	79.9	61%	0.61	36%	0.356	S	S	*	.			trans	-134.2	20.8	179.7	68.5	-19.8	0	0	0	112.3	H444	H444-N446 PolarHBondContact O-N 3.01Å
447	F	88.8	Confident	90.9	Very high	98 Å²	98	74.8 Å²	74.8	43%	0.43	33%	0.332	S	S	.	.	S	Bend	trans	-134	149.8	-178.9	58.9	-94	0	0	0	109.7	F443 F445 L449 I467	F443-F447 AromaticContact CE1-CE1 3.91Å; F443-F447 HydrophobicContact CE1-CE1 3.91Å; F443-F447 HydrophobicContact CE1-CZ 4.47Å; F443-F447 HydrophobicContact CZ-CE1 4.14Å; F445-F447 HydrophobicContact CD1-CE1 4.1Å; F445-F447 HydrophobicContact CD1-CE2 4.48Å; F445-F447 AromaticContact CD1-CZ 3.8Å; F445-F447 HydrophobicContact CD1-CZ 3.8Å; F445-F447 HydrophobicContact CE1-CZ 4.2Å; F447-L449 HydrophobicContact CD2-CD2 4.07Å; F447-L449 HydrophobicContact CE2-CD2 3.54Å; F447-L449 HydrophobicContact CZ-CD2 4.44Å; F447-I467 WeakPolarHBondContact O-CG2 3.47Å
448	S	86.3	Confident	91.1	Very high	57 Å²	57	69.5 Å²	69.5	40%	0.399	32%	0.316	S	S	.	.			trans	-67.9	139.7	-179.5	-52.7	0	0	0	0	111.9	Q468	S448-Q468 CarbonylContact C-O 3.59Å; S448-Q468 VanDerWaalsContact CA-O 3.27Å; S448-Q468 WeakPolarHBondContact CA-O 3.21Å; S448-Q468 WeakPolarHBondContact CB-O 3.29Å
449	L	87.9	Confident	91.3	Very high	4 Å²	4	66.6 Å²	66.6	2%	0.021	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	119	175.2	-61.3	178.5	0	0	0	108.1	F447 Q468 M469 K470 V472	F447-L449 HydrophobicContact CD2-CD2 4.07Å; F447-L449 HydrophobicContact CE2-CD2 3.54Å; F447-L449 HydrophobicContact CZ-CD2 4.44Å; L449-Q468 PolarHBondContact N-O 3.49Å; L449-M469 HydrophobicContact CB-CG 4.47Å; L449-M469 HydrophobicContact CD1-CE 4.24Å; L449-M469 CarbonylContact O-C 3.54Å; L449-M469 WeakPolarHBondContact O-CA 3.26Å; L449-K470 PolarHBondContact O-N 2.99Å; L449-V472 HydrophobicContact CB-CG2 3.7Å; L449-V472 VanDerWaalsContact O-CG2 3.28Å; L449-V472 WeakPolarHBondContact O-CG2 3.42Å
450	E	87.3	Confident	91.4	Very high	91 Å²	91	60.3 Å²	60.3	43%	0.425	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	129.8	-179.6	-57	-172	157.8	0	0	110.4	Q452 K470	E450-Q452 WeakPolarHBondContact O-CG 3.44Å; E450-Q452 PolarHBondContact O-NE2 3.04Å; E450-K470 CarbonylContact C-O 3.53Å; E450-K470 WeakPolarHBondContact CA-O 3.41Å; E450-K470 HydrophobicContact CG-CB 4.19Å; E450-K470 HydrophobicContact CG-CD 4.35Å; E450-K470 IonicContact OE1-NZ 3.83Å; E450-K470 PolarHBondContact OE1-NZ 2.72Å
451	N	87.3	Confident	91.5	Very high	16 Å²	16	62.5 Å²	62.5	9%	0.086	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	59.3	52.8	171.9	-155	24.8	0	0	0	114.7	Y428 V432 K433 K470	Y428-N451 HydrophobicContact CE1-CB 3.85Å; Y428-N451 VanDerWaalsContact CE1-CG 3.41Å; Y428-N451 WeakPolarHBondContact CE1-OD1 3.38Å; Y428-N451 HydrophobicContact CE2-CB 4.02Å; Y428-N451 PolarHBondContact O-ND2 3.41Å; Y428-N451 WeakPolarHBondContact OH-CB 3.25Å; Y428-N451 PolarHBondContact OH-N 3.27Å; V432-N451 WeakPolarHBondContact CA-O 3.34Å; V432-N451 WeakPolarHBondContact CG2-OD1 3.35Å; V432-N451 PolarHBondContact N-ND2 2.94Å; K433-N451 PolarHBondContact N-O 3.27Å; N451-K470 PolarHBondContact N-O 2.79Å
452	Q	90.9	Very high	91.6	Very high	25 Å²	25	58.1 Å²	58.1	12%	0.117	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	140.1	-173.1	-62.6	174.6	42.6	0	0	111.5	K433 F435 E450 H454 S471 V472 K473	K433-Q452 HydrophobicContact CB-CG 4.35Å; K433-Q452 CarbonylContact O-C 3.51Å; K433-Q452 WeakPolarHBondContact O-CA 3.07Å; F435-Q452 HydrophobicContact CD2-CB 4.47Å; F435-Q452 HydrophobicContact CE2-CB 4.29Å; F435-Q452 HydrophobicContact CE2-CG 3.98Å; E450-Q452 WeakPolarHBondContact O-CG 3.44Å; E450-Q452 PolarHBondContact O-NE2 3.04Å; Q452-H454 PolarHBondContact OE1-NE2 2.9Å; Q452-S471 PolarHBondContact N-O 3.31Å; Q452-V472 CarbonylContact O-C 3.54Å; Q452-V472 VanDerWaalsContact O-CA 3.32Å; Q452-V472 WeakPolarHBondContact O-CA 3.2Å; Q452-K473 PolarHBondContact O-N 2.59Å
453	I	92.1	Very high	91.7	Very high	38 Å²	38	53.4 Å²	53.4	20%	0.195	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	118.9	170.7	-57	178.4	0	0	0	108	V432 K433 V434 F435 R455 K473	V432-I453 HydrophobicContact CG1-CB 4.41Å; V432-I453 HydrophobicContact CG1-CD1 3.68Å; V432-I453 HydrophobicContact CG1-CG1 3.66Å; K433-I453 PolarHBondContact O-N 3.12Å; V434-I453 CarbonylContact C-O 3.54Å; V434-I453 WeakPolarHBondContact CA-O 3.45Å; V434-I453 HydrophobicContact CG1-CB 4.44Å; V434-I453 HydrophobicContact CG2-CB 4.38Å; F435-I453 PolarHBondContact N-O 3.46Å; I453-R455 HydrophobicContact CG2-CG 3.98Å; I453-K473 CarbonylContact C-O 3.59Å; I453-K473 WeakPolarHBondContact CA-O 3.15Å; I453-K473 HydrophobicContact CG1-CB 4.21Å; I453-K473 HydrophobicContact CG2-CB 4.42Å
454	H	93.8	Very high	91.7	Very high	12 Å²	12	49.2 Å²	49.2	6%	0.056	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	119.7	175.2	-59.9	-93.1	0	0	0	109.1	F435 E438 Q452 Y459 K473 F474 E475	F435-H454 AromaticContact CD2-CE1 3.46Å; F435-H454 VanDerWaalsContact CD2-CE1 3.46Å; F435-H454 WeakPolarHBondContact CD2-CE1 3.12Å; F435-H454 AromaticContact CD2-ND1 3.71Å; F435-H454 AromaticContact CG-ND1 3.92Å; E438-H454 IonicContact OE2-CE1 3.27Å; E438-H454 IonicContact OE2-ND1 2.87Å; E438-H454 PolarHBondContact OE2-ND1 3.38Å; Q452-H454 PolarHBondContact OE1-NE2 2.9Å; H454-Y459 WeakPolarHBondContact CB-OH 3.49Å; H454-Y459 VanDerWaalsContact CG-OH 3.27Å; H454-Y459 PolarHBondContact ND1-OH 3.36Å; H454-K473 PolarHBondContact N-O 2.83Å; H454-F474 HydrophobicContact CB-CD1 3.62Å; H454-F474 HydrophobicContact CB-CE1 3.87Å; H454-F474 AromaticContact CD2-CD1 3.95Å; H454-F474 AromaticContact CD2-CE1 3.43Å; H454-F474 VanDerWaalsContact CD2-CE1 3.43Å; H454-F474 WeakPolarHBondContact CD2-CE1 3.27Å; H454-F474 AromaticContact CD2-CZ 3.91Å; H454-F474 AromaticContact CG-CD1 3.98Å; H454-F474 AromaticContact CG-CE1 3.69Å; H454-E475 PolarHBondContact O-N 3Å
455	R	93.9	Very high	91.7	Very high	100 Å²	100	47.2 Å²	47.2	38%	0.377	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	130.7	-177.4	-68.6	-177	162.8	-176.6	-4.8	111	V434 F435 H436 R437 I453 G457 E475	V434-R455 HydrophobicContact CG1-CG 4.49Å; F435-R455 PolarHBondContact O-N 3.31Å; H436-R455 WeakPolarHBondContact CA-O 3.3Å; H436-R455 WeakPolarHBondContact CE1-CD 3.39Å; H436-R455 WeakPolarHBondContact ND1-CB 2.88Å; R437-R455 PolarHBondContact N-O 3.47Å; I453-R455 HydrophobicContact CG2-CG 3.98Å; R455-G457 PolarHBondContact O-N 2.86Å; R455-E475 WeakPolarHBondContact CA-O 3.45Å; R455-E475 HydrophobicContact CG-CB 4.24Å; R455-E475 IonicContact CZ-OE2 2.67Å; R455-E475 VanDerWaalsContact CZ-OE2 3.26Å; R455-E475 IonicContact NE-OE2 3.22Å; R455-E475 PolarHBondContact NE-OE2 3.35Å; R455-E475 IonicContact NH2-OE1 3.12Å; R455-E475 IonicContact NH2-OE2 3.96Å; R455-E475 PolarHBondContact NH2-OE2 3.19Å
456	E	93.2	Very high	91.6	Very high	86 Å²	86	52.4 Å²	52.4	40%	0.402	26%	0.257	S	S	.	.	S	Bend	trans	55.6	34.4	178.6	-56.6	175.9	-158.1	0	0	112.1	R437 E475 D476	R437-E456 WeakPolarHBondContact CA-O 3.23Å; R437-E456 HydrophobicContact CG-CB 3.94Å; R437-E456 IonicContact CZ-OE2 3.25Å; R437-E456 VanDerWaalsContact CZ-OE2 3.25Å; R437-E456 IonicContact NE-OE2 2.69Å; R437-E456 PolarHBondContact NE-OE2 2.98Å; R437-E456 IonicContact NH2-OE1 2.69Å; R437-E456 IonicContact NH2-OE2 2.91Å; R437-E456 PolarHBondContact NH2-OE2 3.43Å; E456-E475 PolarHBondContact N-O 2.69Å; E456-D476 WeakPolarHBondContact CA-O 3.06Å; E456-D476 HydrophobicContact CG-CB 4.27Å
457	G	92	Very high	91.6	Very high	2 Å²	2	47 Å²	47	2%	0.021	23%	0.229	C	C	.	.			trans	-78.8	146.1	-178.9	0	0	0	0	0	112.7	E438 R455 S477 L478	E438-G457 CarbonylContact O-C 3.56Å; E438-G457 VanDerWaalsContact O-CA 3.31Å; E438-G457 WeakPolarHBondContact O-CA 3.02Å; R455-G457 PolarHBondContact O-N 2.86Å; G457-S477 PolarHBondContact N-OG 2.92Å; G457-S477 VanDerWaalsContact N-OG 3.13Å; G457-S477 CarbonylContact O-C 3.57Å; G457-S477 VanDerWaalsContact O-CA 3.25Å; G457-S477 WeakPolarHBondContact O-CA 3.37Å; G457-S477 WeakPolarHBondContact O-CB 3.46Å; G457-L478 PolarHBondContact O-N 3.41Å
458	E	94.8	Very high	91.5	Very high	75 Å²	75	46 Å²	46	35%	0.35	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	112	172.3	-69.1	-179.3	179.9	0	0	109.1	E438 R439 V440	E438-E458 PolarHBondContact O-N 3.38Å; R439-E458 CarbonylContact C-O 3.55Å; R439-E458 WeakPolarHBondContact CA-O 3.27Å; R439-E458 HydrophobicContact CB-CB 4.33Å; R439-E458 WeakPolarHBondContact CD-OE2 3.44Å; R439-E458 HydrophobicContact CG-CB 4.06Å; R439-E458 IonicContact CZ-OE2 3.28Å; R439-E458 IonicContact NE-OE2 3.99Å; R439-E458 IonicContact NH1-OE2 3.08Å; R439-E458 PolarHBondContact NH1-OE2 3.48Å; R439-E458 VanDerWaalsContact NH1-OE2 3.08Å; V440-E458 PolarHBondContact N-O 2.89Å
459	Y	95.3	Very high	91.5	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.008	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	114.9	177.6	-59.7	-83.5	0	0	0	109	V440 F445 H454 D462 F464 F474 L478 F479 E480 C482	V440-Y459 HydrophobicContact CB-CD1 3.9Å; V440-Y459 HydrophobicContact CB-CE1 4.22Å; V440-Y459 HydrophobicContact CG2-CD1 4.16Å; V440-Y459 HydrophobicContact CG2-CE1 3.95Å; F445-Y459 HydrophobicContact CE2-CD1 4.43Å; F445-Y459 HydrophobicContact CZ-CD1 4.41Å; F445-Y459 HydrophobicContact CZ-CE1 4.21Å; H454-Y459 WeakPolarHBondContact CB-OH 3.49Å; H454-Y459 VanDerWaalsContact CG-OH 3.27Å; H454-Y459 PolarHBondContact ND1-OH 3.36Å; Y459-D462 WeakPolarHBondContact CA-OD2 3.46Å; Y459-D462 WeakPolarHBondContact CB-OD2 3.14Å; Y459-F464 HydrophobicContact CD1-CZ 4.29Å; Y459-F474 HydrophobicContact CE2-CD1 4.05Å; Y459-F474 AromaticContact CE2-CE1 4Å; Y459-F474 HydrophobicContact CE2-CE1 4Å; Y459-F474 AromaticContact CZ-CE1 3.94Å; Y459-L478 PolarHBondContact N-O 2.92Å; Y459-F479 HydrophobicContact CD1-CE1 4.45Å; Y459-F479 AromaticContact CD2-CD1 3.89Å; Y459-F479 HydrophobicContact CD2-CD1 3.89Å; Y459-F479 AromaticContact CD2-CE1 3.39Å; Y459-F479 HydrophobicContact CD2-CE1 3.39Å; Y459-F479 HydrophobicContact CD2-CE2 4.08Å; Y459-F479 HydrophobicContact CD2-CG 4.43Å; Y459-F479 AromaticContact CD2-CZ 3.5Å; Y459-F479 HydrophobicContact CD2-CZ 3.5Å; Y459-F479 HydrophobicContact CE2-CE1 4.05Å; Y459-F479 HydrophobicContact CE2-CE2 4.47Å; Y459-F479 AromaticContact CE2-CZ 3.8Å; Y459-F479 HydrophobicContact CE2-CZ 3.8Å; Y459-F479 AromaticContact CG-CD1 3.96Å; Y459-F479 HydrophobicContact CG-CD1 3.96Å; Y459-F479 AromaticContact CG-CE1 3.64Å; Y459-F479 HydrophobicContact CG-CE1 3.64Å; Y459-F479 HydrophobicContact CG-CZ 4.22Å; Y459-F479 WeakPolarHBondContact O-CA 3.19Å; Y459-E480 PolarHBondContact O-N 3.25Å; Y459-C482 PolarHBondContact O-SG 2.92Å
460	I	95.3	Very high	91.3	Very high	25 Å²	25	45.1 Å²	45.1	13%	0.128	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	122.7	-170.2	-51.3	176.6	0	0	0	110.8	V440 E441 R442 D462 E480	V440-I460 PolarHBondContact O-N 2.92Å; E441-I460 VanDerWaalsContact CA-O 3.26Å; E441-I460 WeakPolarHBondContact CA-O 3.41Å; E441-I460 HydrophobicContact CG-CB 4.18Å; R442-I460 PolarHBondContact N-O 2.97Å; I460-D462 PolarHBondContact N-OD2 3.3Å; I460-D462 VanDerWaalsContact N-OD2 3.11Å; I460-D462 PolarHBondContact O-N 3.09Å; I460-E480 CarbonylContact C-O 3.57Å; I460-E480 WeakPolarHBondContact CA-O 3.27Å
461	N	94.7	Very high	91.2	Very high	76 Å²	76	42.2 Å²	42.2	41%	0.406	20%	0.204	S	C	.	.	S	Bend	trans	56.9	30.3	-175.9	-68.5	-74	0	0	0	113.7	R442 E480 D481	R442-N461 WeakPolarHBondContact CA-O 3.3Å; R442-N461 HydrophobicContact CG-CB 4.02Å; N461-E480 PolarHBondContact N-O 3.46Å; N461-D481 WeakPolarHBondContact CA-O 3.46Å; N461-D481 WeakPolarHBondContact OD1-CB 3.39Å
462	D	94.2	Very high	91.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.2	C	C	.	.			trans	-90.1	151.6	-178.3	-64.5	-41.3	0	0	0	112.8	V440 R442 F443 F445 Y459 I460 F464 C482 Y483	V440-D462 VanDerWaalsContact O-OD2 3.1Å; R442-D462 PolarHBondContact N-OD1 2.83Å; F443-D462 PolarHBondContact N-OD1 2.99Å; F443-D462 WeakPolarHBondContact O-CA 3.42Å; F445-D462 HydrophobicContact CE2-CB 4.33Å; Y459-D462 WeakPolarHBondContact CA-OD2 3.46Å; Y459-D462 WeakPolarHBondContact CB-OD2 3.14Å; I460-D462 PolarHBondContact N-OD2 3.3Å; I460-D462 VanDerWaalsContact N-OD2 3.11Å; I460-D462 PolarHBondContact O-N 3.09Å; D462-F464 HydrophobicContact CB-CE2 4.01Å; D462-C482 CarbonylContact O-C 3.6Å; D462-C482 VanDerWaalsContact O-CA 3.25Å; D462-C482 WeakPolarHBondContact O-CA 3.28Å; D462-Y483 PolarHBondContact O-N 3.23Å
463	K	93.8	Very high	91.4	Very high	109 Å²	109	43 Å²	43	47%	0.474	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	128.8	177.9	-63.5	-171.2	176.5	-173.1	0	110.9	F443 H444 F445 I465 Y483	F443-K463 PolarHBondContact O-N 3.41Å; H444-K463 CarbonylContact C-O 3.41Å; H444-K463 WeakPolarHBondContact CA-O 3.42Å; F445-K463 PolarHBondContact N-O 3.41Å; K463-I465 HydrophobicContact CB-CD1 4.42Å; K463-I465 HydrophobicContact CB-CG1 4.3Å; K463-I465 HydrophobicContact CD-CD1 4.47Å; K463-Y483 CarbonylContact C-O 3.45Å; K463-Y483 WeakPolarHBondContact CA-O 3.16Å
464	F	93.9	Very high	91.5	Very high	1 Å²	1	41.2 Å²	41.2	0%	0.004	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	100.5	176.5	-65.2	-94.1	0	0	0	107.8	F445 Y459 D462 I467 M469 F479 Y483 F484 E485 I487	F445-F464 HydrophobicContact CB-CD1 3.82Å; F445-F464 HydrophobicContact CB-CE1 4.21Å; F445-F464 HydrophobicContact CB-CG 4.45Å; F445-F464 HydrophobicContact CD1-CE1 4.22Å; F445-F464 AromaticContact CD2-CD1 3.61Å; F445-F464 HydrophobicContact CD2-CD1 3.61Å; F445-F464 HydrophobicContact CD2-CD2 4.37Å; F445-F464 AromaticContact CD2-CE1 3.24Å; F445-F464 HydrophobicContact CD2-CE1 3.24Å; F445-F464 HydrophobicContact CD2-CE2 4.06Å; F445-F464 HydrophobicContact CD2-CG 4.17Å; F445-F464 AromaticContact CD2-CZ 3.49Å; F445-F464 HydrophobicContact CD2-CZ 3.49Å; F445-F464 VanDerWaalsContact CD2-CZ 3.49Å; F445-F464 HydrophobicContact CE1-CE1 4.43Å; F445-F464 HydrophobicContact CE2-CD1 4.34Å; F445-F464 AromaticContact CE2-CE1 3.51Å; F445-F464 HydrophobicContact CE2-CE1 3.51Å; F445-F464 HydrophobicContact CE2-CE2 4.17Å; F445-F464 AromaticContact CE2-CZ 3.41Å; F445-F464 HydrophobicContact CE2-CZ 3.41Å; F445-F464 VanDerWaalsContact CE2-CZ 3.41Å; F445-F464 AromaticContact CG-CD1 3.79Å; F445-F464 HydrophobicContact CG-CD1 3.79Å; F445-F464 AromaticContact CG-CE1 3.65Å; F445-F464 HydrophobicContact CG-CE1 3.65Å; F445-F464 HydrophobicContact CG-CZ 4.35Å; F445-F464 HydrophobicContact CZ-CE1 4.11Å; F445-F464 HydrophobicContact CZ-CZ 4.2Å; Y459-F464 HydrophobicContact CD1-CZ 4.29Å; D462-F464 HydrophobicContact CB-CE2 4.01Å; F464-I467 HydrophobicContact CB-CD1 3.76Å; F464-I467 HydrophobicContact CD1-CD1 3.77Å; F464-I467 HydrophobicContact CG-CD1 4.23Å; F464-M469 HydrophobicContact CD1-CE 3.81Å; F464-M469 HydrophobicContact CE1-CE 4.35Å; F464-M469 HydrophobicContact CG-CE 4.5Å; F464-F479 HydrophobicContact CE2-CE1 4.29Å; F464-F479 HydrophobicContact CZ-CE1 4.16Å; F464-Y483 PolarHBondContact N-O 3.19Å; F464-F484 HydrophobicContact CB-CD1 3.74Å; F464-F484 HydrophobicContact CB-CE1 4.07Å; F464-F484 HydrophobicContact CB-CG 4.17Å; F464-F484 HydrophobicContact CD1-CE1 4.19Å; F464-F484 AromaticContact CD2-CD1 3.92Å; F464-F484 HydrophobicContact CD2-CD1 3.92Å; F464-F484 HydrophobicContact CD2-CD2 4.28Å; F464-F484 AromaticContact CD2-CE1 3.51Å; F464-F484 HydrophobicContact CD2-CE1 3.51Å; F464-F484 AromaticContact CD2-CE2 3.93Å; F464-F484 HydrophobicContact CD2-CE2 3.93Å; F464-F484 HydrophobicContact CD2-CG 4.28Å; F464-F484 AromaticContact CD2-CZ 3.51Å; F464-F484 HydrophobicContact CD2-CZ 3.51Å; F464-F484 AromaticContact CE2-CE1 3.93Å; F464-F484 HydrophobicContact CE2-CE1 3.93Å; F464-F484 HydrophobicContact CE2-CE2 4.2Å; F464-F484 AromaticContact CE2-CZ 3.61Å; F464-F484 HydrophobicContact CE2-CZ 3.61Å; F464-F484 AromaticContact CG-CD1 3.88Å; F464-F484 HydrophobicContact CG-CD1 3.88Å; F464-F484 AromaticContact CG-CE1 3.67Å; F464-F484 HydrophobicContact CG-CE1 3.67Å; F464-F484 HydrophobicContact CG-CG 4.5Å; F464-F484 HydrophobicContact CG-CZ 4.16Å; F464-F484 HydrophobicContact CZ-CE1 4.42Å; F464-F484 HydrophobicContact CZ-CZ 4.32Å; F464-F484 CarbonylContact O-C 3.6Å; F464-F484 WeakPolarHBondContact O-CA 3.25Å; F464-E485 PolarHBondContact O-N 3.04Å; F464-I487 HydrophobicContact CB-CD1 3.9Å
465	I	92.3	Very high	91.5	Very high	41 Å²	41	41.9 Å²	41.9	21%	0.21	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	125.8	-173	-51.4	-169.1	0	0	0	110.2	H444 F445 K463 E485	H444-I465 WeakPolarHBondContact NE2-CD1 3.18Å; F445-I465 PolarHBondContact O-N 3.42Å; K463-I465 HydrophobicContact CB-CD1 4.42Å; K463-I465 HydrophobicContact CB-CG1 4.3Å; K463-I465 HydrophobicContact CD-CD1 4.47Å; I465-E485 WeakPolarHBondContact CA-O 3.14Å; I465-E485 HydrophobicContact CG1-CB 4.31Å; I465-E485 HydrophobicContact CG2-CB 4.28Å; I465-E485 HydrophobicContact CG2-CG 4.22Å
466	N	88.4	Confident	91.5	Very high	128 Å²	128	41.2 Å²	41.2	68%	0.684	20%	0.204	S	C	*	.	E	Extended strand (participates in β ladder)	trans	55.8	56.1	177	-166.9	34.5	0	0	0	112	E485 D486	N466-E485 PolarHBondContact N-O 3.39Å; N466-D486 WeakPolarHBondContact CA-O 3.42Å
467	I	87.8	Confident	91.6	Very high	2 Å²	2	37.2 Å²	37.2	1%	0.01	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	138.9	-175.3	-61.4	172.7	0	0	0	109.6	F445 F447 F464 M469 D486 I487 E488	F445-I467 HydrophobicContact CB-CD1 3.32Å; F445-I467 HydrophobicContact CG-CD1 4.5Å; F445-I467 WeakPolarHBondContact O-CD1 3.26Å; F447-I467 WeakPolarHBondContact O-CG2 3.47Å; F464-I467 HydrophobicContact CB-CD1 3.76Å; F464-I467 HydrophobicContact CD1-CD1 3.77Å; F464-I467 HydrophobicContact CG-CD1 4.23Å; I467-M469 HydrophobicContact CG2-CE 4.3Å; I467-M469 HydrophobicContact CG2-CG 3.98Å; I467-D486 PolarHBondContact N-O 3.27Å; I467-I487 WeakPolarHBondContact O-CA 3.42Å; I467-E488 PolarHBondContact O-N 3.23Å
468	Q	86.3	Confident	91.7	Very high	75 Å²	75	39.5 Å²	39.5	35%	0.35	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	124.6	164.5	-62.9	-174.6	-25.6	0	0	109.8	S448 L449 E488	S448-Q468 CarbonylContact C-O 3.59Å; S448-Q468 VanDerWaalsContact CA-O 3.27Å; S448-Q468 WeakPolarHBondContact CA-O 3.21Å; S448-Q468 WeakPolarHBondContact CB-O 3.29Å; L449-Q468 PolarHBondContact N-O 3.49Å; Q468-E488 CarbonylContact C-O 3.56Å; Q468-E488 VanDerWaalsContact CA-O 3.31Å; Q468-E488 WeakPolarHBondContact CA-O 3.2Å; Q468-E488 HydrophobicContact CG-CB 4.3Å; Q468-E488 PolarHBondContact NE2-OE2 2.93Å
469	M	86.6	Confident	91.8	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	111.7	175.7	-62.5	-174.5	-179.1	0	0	109	L449 F464 I467 V472 F474 F484 I487 E488 S489 T490 T492	L449-M469 HydrophobicContact CB-CG 4.47Å; L449-M469 HydrophobicContact CD1-CE 4.24Å; L449-M469 CarbonylContact O-C 3.54Å; L449-M469 WeakPolarHBondContact O-CA 3.26Å; F464-M469 HydrophobicContact CD1-CE 3.81Å; F464-M469 HydrophobicContact CE1-CE 4.35Å; F464-M469 HydrophobicContact CG-CE 4.5Å; I467-M469 HydrophobicContact CG2-CE 4.3Å; I467-M469 HydrophobicContact CG2-CG 3.98Å; M469-V472 HydrophobicContact CB-CB 4.44Å; M469-V472 HydrophobicContact CB-CG2 4.13Å; M469-F474 HydrophobicContact SD-CE2 4.49Å; M469-F484 HydrophobicContact CE-CE1 4.35Å; M469-I487 HydrophobicContact CE-CD1 4.22Å; M469-I487 HydrophobicContact CE-CG2 4.47Å; M469-I487 HydrophobicContact CG-CG2 4.36Å; M469-I487 HydrophobicContact SD-CG2 4.3Å; M469-E488 PolarHBondContact N-O 3.09Å; M469-S489 CarbonylContact O-C 3.56Å; M469-S489 VanDerWaalsContact O-CA 3.27Å; M469-S489 WeakPolarHBondContact O-CA 3.42Å; M469-T490 PolarHBondContact O-N 3.29Å; M469-T492 HydrophobicContact CB-CG2 4.18Å; M469-T492 WeakPolarHBondContact CB-OG1 3.24Å; M469-T492 PolarHBondContact O-OG1 2.75Å; M469-T492 VanDerWaalsContact O-OG1 3.12Å; M469-T492 HydrophobicContact SD-CG2 4.2Å
470	K	84.6	Confident	91.7	Very high	43 Å²	43	38.2 Å²	38.2	19%	0.187	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	118.7	179	-61.9	-179.1	-174.1	163.8	0	110.5	L449 E450 N451 V472	L449-K470 PolarHBondContact O-N 2.99Å; E450-K470 CarbonylContact C-O 3.53Å; E450-K470 WeakPolarHBondContact CA-O 3.41Å; E450-K470 HydrophobicContact CG-CB 4.19Å; E450-K470 HydrophobicContact CG-CD 4.35Å; E450-K470 IonicContact OE1-NZ 3.83Å; E450-K470 PolarHBondContact OE1-NZ 2.72Å; N451-K470 PolarHBondContact N-O 2.79Å; K470-V472 VanDerWaalsContact C-N 3.3Å; K470-V472 PolarHBondContact O-N 3.03Å
471	S	84.4	Confident	91.7	Very high	30 Å²	30	40.6 Å²	40.6	21%	0.21	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	49.9	50.4	-178.7	-47.4	0	0	0	0	111.8	Q452 T490 E491	Q452-S471 PolarHBondContact N-O 3.31Å; S471-T490 PolarHBondContact N-O 3.37Å; S471-E491 PolarHBondContact OG-OE2 2.94Å
472	V	89.6	Confident	91.7	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.006	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	131.3	178.3	-177.4	0	0	0	0	109.8	L449 Q452 M469 K470 F474 T492 I493	L449-V472 HydrophobicContact CB-CG2 3.7Å; L449-V472 VanDerWaalsContact O-CG2 3.28Å; L449-V472 WeakPolarHBondContact O-CG2 3.42Å; Q452-V472 CarbonylContact O-C 3.54Å; Q452-V472 VanDerWaalsContact O-CA 3.32Å; Q452-V472 WeakPolarHBondContact O-CA 3.2Å; M469-V472 HydrophobicContact CB-CB 4.44Å; M469-V472 HydrophobicContact CB-CG2 4.13Å; K470-V472 VanDerWaalsContact C-N 3.3Å; K470-V472 PolarHBondContact O-N 3.03Å; V472-F474 HydrophobicContact CG1-CD2 4.2Å; V472-F474 HydrophobicContact CG1-CE2 3.55Å; V472-F474 HydrophobicContact CG1-CZ 3.84Å; V472-T492 HydrophobicContact CB-CG2 4.17Å; V472-T492 CarbonylContact O-C 3.49Å; V472-T492 WeakPolarHBondContact O-CA 3.49Å; V472-T492 WeakPolarHBondContact O-CG2 3.27Å; V472-I493 PolarHBondContact O-N 3.1Å
473	K	92.3	Very high	91.7	Very high	57 Å²	57	40.6 Å²	40.6	25%	0.248	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	127.4	178.7	-161.6	179.6	-178.6	-163.9	0	111.5	Q452 I453 H454 E475 I493 E495	Q452-K473 PolarHBondContact O-N 2.59Å; I453-K473 CarbonylContact C-O 3.59Å; I453-K473 WeakPolarHBondContact CA-O 3.15Å; I453-K473 HydrophobicContact CG1-CB 4.21Å; I453-K473 HydrophobicContact CG2-CB 4.42Å; H454-K473 PolarHBondContact N-O 2.83Å; K473-E475 HydrophobicContact CD-CG 4.01Å; K473-E475 VanDerWaalsContact CD-OE1 3.3Å; K473-E475 WeakPolarHBondContact CD-OE1 3.49Å; K473-E475 WeakPolarHBondContact CE-OE1 3.16Å; K473-E475 HydrophobicContact CG-CG 4.07Å; K473-E475 IonicContact NZ-OE1 2.77Å; K473-E475 PolarHBondContact NZ-OE1 2.78Å; K473-I493 WeakPolarHBondContact CA-O 3Å; K473-I493 HydrophobicContact CG-CB 4.48Å; K473-E495 WeakPolarHBondContact CE-OE2 3.44Å; K473-E495 IonicContact NZ-OE2 3.91Å; K473-E495 PolarHBondContact NZ-OE2 3.02Å
474	F	93.9	Very high	91.6	Very high	1 Å²	1	35.4 Å²	35.4	0%	0.004	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	120	170.5	-64.4	-84.1	0	0	0	108.7	H454 Y459 M469 V472 F479 I493 F494 E495 C497	H454-F474 HydrophobicContact CB-CD1 3.62Å; H454-F474 HydrophobicContact CB-CE1 3.87Å; H454-F474 AromaticContact CD2-CD1 3.95Å; H454-F474 AromaticContact CD2-CE1 3.43Å; H454-F474 VanDerWaalsContact CD2-CE1 3.43Å; H454-F474 WeakPolarHBondContact CD2-CE1 3.27Å; H454-F474 AromaticContact CD2-CZ 3.91Å; H454-F474 AromaticContact CG-CD1 3.98Å; H454-F474 AromaticContact CG-CE1 3.69Å; Y459-F474 HydrophobicContact CE2-CD1 4.05Å; Y459-F474 AromaticContact CE2-CE1 4Å; Y459-F474 HydrophobicContact CE2-CE1 4Å; Y459-F474 AromaticContact CZ-CE1 3.94Å; M469-F474 HydrophobicContact SD-CE2 4.49Å; V472-F474 HydrophobicContact CG1-CD2 4.2Å; V472-F474 HydrophobicContact CG1-CE2 3.55Å; V472-F474 HydrophobicContact CG1-CZ 3.84Å; F474-F479 HydrophobicContact CB-CE2 4.36Å; F474-F479 HydrophobicContact CD1-CE2 4.23Å; F474-F479 AromaticContact CD1-CZ 3.64Å; F474-F479 HydrophobicContact CD1-CZ 3.64Å; F474-F479 HydrophobicContact CD2-CZ 4.44Å; F474-F479 AromaticContact CE1-CZ 3.89Å; F474-F479 HydrophobicContact CE1-CZ 3.89Å; F474-F479 HydrophobicContact CG-CE2 4.27Å; F474-F479 AromaticContact CG-CZ 3.95Å; F474-F479 HydrophobicContact CG-CZ 3.95Å; F474-F479 HydrophobicContact CZ-CZ 4.38Å; F474-I493 PolarHBondContact N-O 3.32Å; F474-F494 HydrophobicContact CB-CD1 3.75Å; F474-F494 HydrophobicContact CB-CE1 4.12Å; F474-F494 HydrophobicContact CB-CG 4.45Å; F474-F494 AromaticContact CD2-CD1 3.73Å; F474-F494 HydrophobicContact CD2-CD1 3.73Å; F474-F494 AromaticContact CD2-CE1 3.29Å; F474-F494 HydrophobicContact CD2-CE1 3.29Å; F474-F494 HydrophobicContact CD2-CE2 4.31Å; F474-F494 HydrophobicContact CD2-CG 4.41Å; F474-F494 AromaticContact CD2-CZ 3.62Å; F474-F494 HydrophobicContact CD2-CZ 3.62Å; F474-F494 AromaticContact CE2-CE1 3.84Å; F474-F494 HydrophobicContact CE2-CE1 3.84Å; F474-F494 AromaticContact CE2-CZ 3.85Å; F474-F494 HydrophobicContact CE2-CZ 3.85Å; F474-F494 AromaticContact CG-CD1 3.97Å; F474-F494 HydrophobicContact CG-CD1 3.97Å; F474-F494 AromaticContact CG-CE1 3.81Å; F474-F494 HydrophobicContact CG-CE1 3.81Å; F474-E495 PolarHBondContact O-N 2.75Å; F474-C497 PolarHBondContact O-SG 3.01Å
475	E	94.2	Very high	91.5	Very high	26 Å²	26	37.8 Å²	37.8	12%	0.121	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	133.2	179.9	-63.7	178.7	167.7	0	0	109.2	H454 R455 E456 K473 S477 E495	H454-E475 PolarHBondContact O-N 3Å; R455-E475 WeakPolarHBondContact CA-O 3.45Å; R455-E475 HydrophobicContact CG-CB 4.24Å; R455-E475 IonicContact CZ-OE2 2.67Å; R455-E475 VanDerWaalsContact CZ-OE2 3.26Å; R455-E475 IonicContact NE-OE2 3.22Å; R455-E475 PolarHBondContact NE-OE2 3.35Å; R455-E475 IonicContact NH2-OE1 3.12Å; R455-E475 IonicContact NH2-OE2 3.96Å; R455-E475 PolarHBondContact NH2-OE2 3.19Å; E456-E475 PolarHBondContact N-O 2.69Å; K473-E475 HydrophobicContact CD-CG 4.01Å; K473-E475 VanDerWaalsContact CD-OE1 3.3Å; K473-E475 WeakPolarHBondContact CD-OE1 3.49Å; K473-E475 WeakPolarHBondContact CE-OE1 3.16Å; K473-E475 HydrophobicContact CG-CG 4.07Å; K473-E475 IonicContact NZ-OE1 2.77Å; K473-E475 PolarHBondContact NZ-OE1 2.78Å; E475-S477 PolarHBondContact O-N 3.43Å; E475-S477 PolarHBondContact O-OG 3.37Å; E475-E495 WeakPolarHBondContact CA-O 3.45Å
476	D	94.4	Very high	91.3	Very high	86 Å²	86	38.3 Å²	38.3	46%	0.46	19%	0.191	S	C	.	.	S	Bend	trans	52.6	30.2	174.9	-61.7	-42	0	0	0	114	E456 E495 N496	E456-D476 WeakPolarHBondContact CA-O 3.06Å; E456-D476 HydrophobicContact CG-CB 4.27Å; D476-E495 PolarHBondContact N-O 2.9Å; D476-E495 VanDerWaalsContact N-O 3.09Å; D476-N496 WeakPolarHBondContact OD1-CB 3.27Å; D476-N496 PolarHBondContact OD1-ND2 3.5Å
477	S	94.9	Very high	91.2	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.014	16%	0.159	C	C	.	.			trans	-101.5	148.6	-170.8	-62.2	0	0	0	0	112.5	G457 E475 C497 T498	G457-S477 PolarHBondContact N-OG 2.92Å; G457-S477 VanDerWaalsContact N-OG 3.13Å; G457-S477 CarbonylContact O-C 3.57Å; G457-S477 VanDerWaalsContact O-CA 3.25Å; G457-S477 WeakPolarHBondContact O-CA 3.37Å; G457-S477 WeakPolarHBondContact O-CB 3.46Å; E475-S477 PolarHBondContact O-N 3.43Å; E475-S477 PolarHBondContact O-OG 3.37Å; S477-C497 CarbonylContact O-C 3.6Å; S477-C497 WeakPolarHBondContact O-CA 3.49Å; S477-C497 WeakPolarHBondContact O-CB 3.04Å; S477-T498 PolarHBondContact O-N 2.97Å
478	L	94.9	Very high	91	Very high	49 Å²	49	35 Å²	35	26%	0.257	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	127.4	177.2	176	67	0	0	0	110	G457 Y459 T498	G457-L478 PolarHBondContact O-N 3.41Å; Y459-L478 PolarHBondContact N-O 2.92Å; L478-T498 CarbonylContact C-O 3.6Å; L478-T498 WeakPolarHBondContact CA-O 3.43Å; L478-T498 HydrophobicContact CD1-CG2 3.91Å
479	F	95.4	Very high	90.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	114.1	168.9	-67.4	-93	0	0	0	108.7	Y459 F464 F474 F484 F494 T498 I499 R500	Y459-F479 HydrophobicContact CD1-CE1 4.45Å; Y459-F479 AromaticContact CD2-CD1 3.89Å; Y459-F479 HydrophobicContact CD2-CD1 3.89Å; Y459-F479 AromaticContact CD2-CE1 3.39Å; Y459-F479 HydrophobicContact CD2-CE1 3.39Å; Y459-F479 HydrophobicContact CD2-CE2 4.08Å; Y459-F479 HydrophobicContact CD2-CG 4.43Å; Y459-F479 AromaticContact CD2-CZ 3.5Å; Y459-F479 HydrophobicContact CD2-CZ 3.5Å; Y459-F479 HydrophobicContact CE2-CE1 4.05Å; Y459-F479 HydrophobicContact CE2-CE2 4.47Å; Y459-F479 AromaticContact CE2-CZ 3.8Å; Y459-F479 HydrophobicContact CE2-CZ 3.8Å; Y459-F479 AromaticContact CG-CD1 3.96Å; Y459-F479 HydrophobicContact CG-CD1 3.96Å; Y459-F479 AromaticContact CG-CE1 3.64Å; Y459-F479 HydrophobicContact CG-CE1 3.64Å; Y459-F479 HydrophobicContact CG-CZ 4.22Å; Y459-F479 WeakPolarHBondContact O-CA 3.19Å; F464-F479 HydrophobicContact CE2-CE1 4.29Å; F464-F479 HydrophobicContact CZ-CE1 4.16Å; F474-F479 HydrophobicContact CB-CE2 4.36Å; F474-F479 HydrophobicContact CD1-CE2 4.23Å; F474-F479 AromaticContact CD1-CZ 3.64Å; F474-F479 HydrophobicContact CD1-CZ 3.64Å; F474-F479 HydrophobicContact CD2-CZ 4.44Å; F474-F479 AromaticContact CE1-CZ 3.89Å; F474-F479 HydrophobicContact CE1-CZ 3.89Å; F474-F479 HydrophobicContact CG-CE2 4.27Å; F474-F479 AromaticContact CG-CZ 3.95Å; F474-F479 HydrophobicContact CG-CZ 3.95Å; F474-F479 HydrophobicContact CZ-CZ 4.38Å; F479-F484 HydrophobicContact CD1-CE2 4.27Å; F479-F484 AromaticContact CD1-CZ 3.81Å; F479-F484 HydrophobicContact CD1-CZ 3.81Å; F479-F484 AromaticContact CE1-CZ 3.86Å; F479-F484 HydrophobicContact CE1-CZ 3.86Å; F479-F494 AromaticContact CE2-CD1 3.97Å; F479-F494 HydrophobicContact CE2-CD1 3.97Å; F479-F494 AromaticContact CE2-CE1 3.81Å; F479-F494 HydrophobicContact CE2-CE1 3.81Å; F479-F494 HydrophobicContact CZ-CD1 4.37Å; F479-F494 AromaticContact CZ-CE1 3.78Å; F479-F494 HydrophobicContact CZ-CE1 3.78Å; F479-T498 PolarHBondContact N-O 3.38Å; F479-I499 HydrophobicContact CB-CG1 4.29Å; F479-I499 HydrophobicContact CB-CG2 4.32Å; F479-I499 HydrophobicContact CD2-CG1 4.2Å; F479-I499 CarbonylContact O-C 3.6Å; F479-I499 WeakPolarHBondContact O-CA 3.49Å; F479-R500 PolarHBondContact O-N 3.39Å
480	E	94.9	Very high	90.2	Very high	51 Å²	51	32.3 Å²	32.3	24%	0.238	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	125.6	-180	-171.5	166.3	-140.4	0	0	110.9	Y459 I460 N461 C482 R500	Y459-E480 PolarHBondContact O-N 3.25Å; I460-E480 CarbonylContact C-O 3.57Å; I460-E480 WeakPolarHBondContact CA-O 3.27Å; N461-E480 PolarHBondContact N-O 3.46Å; E480-C482 VanDerWaalsContact C-N 3.26Å; E480-C482 PolarHBondContact O-N 3.02Å; E480-R500 WeakPolarHBondContact CA-O 3.43Å; E480-R500 HydrophobicContact CG-CB 4.5Å; E480-R500 VanDerWaalsContact OE1-CD 3.31Å; E480-R500 WeakPolarHBondContact OE1-CD 3.38Å; E480-R500 IonicContact OE1-NH1 3.74Å; E480-R500 PolarHBondContact OE1-NH1 3.43Å
481	D	94.7	Very high	89.8	Confident	74 Å²	74	36 Å²	36	40%	0.396	18%	0.178	S	C	.	.	S	Bend	trans	57.4	35	-179.4	-60.5	-50.7	0	0	0	113.5	N461 R500 S501	N461-D481 WeakPolarHBondContact CA-O 3.46Å; N461-D481 WeakPolarHBondContact OD1-CB 3.39Å; D481-R500 PolarHBondContact N-O 3.03Å; D481-S501 WeakPolarHBondContact OD1-CB 3.45Å
482	C	94	Very high	89.9	Confident	3 Å²	3	34.6 Å²	34.6	2%	0.02	17%	0.168	C	C	.	.			trans	-86.8	157.5	-179.8	-66.5	0	0	0	0	113	Y459 D462 E480 F484 T502 V503	Y459-C482 PolarHBondContact O-SG 2.92Å; D462-C482 CarbonylContact O-C 3.6Å; D462-C482 VanDerWaalsContact O-CA 3.25Å; D462-C482 WeakPolarHBondContact O-CA 3.28Å; E480-C482 VanDerWaalsContact C-N 3.26Å; E480-C482 PolarHBondContact O-N 3.02Å; C482-F484 HydrophobicContact CB-CD2 4.29Å; C482-F484 HydrophobicContact CB-CE2 3.67Å; C482-T502 HydrophobicContact CB-CG2 3.9Å; C482-T502 VanDerWaalsContact O-CA 3.26Å; C482-T502 WeakPolarHBondContact O-CA 3.4Å; C482-T502 WeakPolarHBondContact O-CG2 3.5Å; C482-V503 PolarHBondContact O-N 2.88Å
483	Y	93.9	Very high	89.9	Confident	73 Å²	73	37.1 Å²	37.1	29%	0.286	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	119.4	177.2	-166.9	-95.8	0	0	0	111.2	D462 K463 F464 E485 V503	D462-Y483 PolarHBondContact O-N 3.23Å; K463-Y483 CarbonylContact C-O 3.45Å; K463-Y483 WeakPolarHBondContact CA-O 3.16Å; F464-Y483 PolarHBondContact N-O 3.19Å; Y483-E485 HydrophobicContact CD1-CB 4.21Å; Y483-E485 HydrophobicContact CE1-CB 3.74Å; Y483-E485 HydrophobicContact CE1-CG 4.5Å; Y483-E485 WeakPolarHBondContact CE1-OE2 3.46Å; Y483-V503 HydrophobicContact CD2-CB 3.64Å; Y483-V503 HydrophobicContact CD2-CG1 4.09Å; Y483-V503 HydrophobicContact CD2-CG2 4.18Å; Y483-V503 HydrophobicContact CE2-CB 3.79Å; Y483-V503 HydrophobicContact CE2-CG1 3.69Å; Y483-V503 HydrophobicContact CE2-CG2 4.39Å
484	F	93.3	Very high	89.9	Confident	1 Å²	1	34.5 Å²	34.5	0%	0.004	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	120.4	-179.2	-68.3	-105.4	0	0	0	109.1	F464 M469 F479 C482 I487 T502 V503 F504 Y505 T507 L509	F464-F484 HydrophobicContact CB-CD1 3.74Å; F464-F484 HydrophobicContact CB-CE1 4.07Å; F464-F484 HydrophobicContact CB-CG 4.17Å; F464-F484 HydrophobicContact CD1-CE1 4.19Å; F464-F484 AromaticContact CD2-CD1 3.92Å; F464-F484 HydrophobicContact CD2-CD1 3.92Å; F464-F484 HydrophobicContact CD2-CD2 4.28Å; F464-F484 AromaticContact CD2-CE1 3.51Å; F464-F484 HydrophobicContact CD2-CE1 3.51Å; F464-F484 AromaticContact CD2-CE2 3.93Å; F464-F484 HydrophobicContact CD2-CE2 3.93Å; F464-F484 HydrophobicContact CD2-CG 4.28Å; F464-F484 AromaticContact CD2-CZ 3.51Å; F464-F484 HydrophobicContact CD2-CZ 3.51Å; F464-F484 AromaticContact CE2-CE1 3.93Å; F464-F484 HydrophobicContact CE2-CE1 3.93Å; F464-F484 HydrophobicContact CE2-CE2 4.2Å; F464-F484 AromaticContact CE2-CZ 3.61Å; F464-F484 HydrophobicContact CE2-CZ 3.61Å; F464-F484 AromaticContact CG-CD1 3.88Å; F464-F484 HydrophobicContact CG-CD1 3.88Å; F464-F484 AromaticContact CG-CE1 3.67Å; F464-F484 HydrophobicContact CG-CE1 3.67Å; F464-F484 HydrophobicContact CG-CG 4.5Å; F464-F484 HydrophobicContact CG-CZ 4.16Å; F464-F484 HydrophobicContact CZ-CE1 4.42Å; F464-F484 HydrophobicContact CZ-CZ 4.32Å; F464-F484 CarbonylContact O-C 3.6Å; F464-F484 WeakPolarHBondContact O-CA 3.25Å; M469-F484 HydrophobicContact CE-CE1 4.35Å; F479-F484 HydrophobicContact CD1-CE2 4.27Å; F479-F484 AromaticContact CD1-CZ 3.81Å; F479-F484 HydrophobicContact CD1-CZ 3.81Å; F479-F484 AromaticContact CE1-CZ 3.86Å; F479-F484 HydrophobicContact CE1-CZ 3.86Å; C482-F484 HydrophobicContact CB-CD2 4.29Å; C482-F484 HydrophobicContact CB-CE2 3.67Å; F484-I487 HydrophobicContact CB-CD1 3.59Å; F484-I487 HydrophobicContact CD1-CD1 3.29Å; F484-I487 HydrophobicContact CE1-CD1 4.35Å; F484-I487 HydrophobicContact CG-CD1 3.88Å; F484-T502 HydrophobicContact CD2-CG2 3.51Å; F484-T502 HydrophobicContact CE2-CG2 3.53Å; F484-V503 PolarHBondContact N-O 3.11Å; F484-F504 HydrophobicContact CB-CD1 3.5Å; F484-F504 VanDerWaalsContact CB-CD1 3.5Å; F484-F504 HydrophobicContact CB-CE1 3.88Å; F484-F504 HydrophobicContact CB-CG 4.29Å; F484-F504 HydrophobicContact CD1-CD1 4.3Å; F484-F504 AromaticContact CD1-CE1 3.84Å; F484-F504 HydrophobicContact CD1-CE1 3.84Å; F484-F504 AromaticContact CD2-CD1 3.99Å; F484-F504 HydrophobicContact CD2-CD1 3.99Å; F484-F504 AromaticContact CD2-CE1 3.57Å; F484-F504 HydrophobicContact CD2-CE1 3.57Å; F484-F504 AromaticContact CD2-CZ 3.97Å; F484-F504 HydrophobicContact CD2-CZ 3.97Å; F484-F504 HydrophobicContact CE1-CE1 4.3Å; F484-F504 HydrophobicContact CE2-CE1 4.02Å; F484-F504 HydrophobicContact CE2-CZ 4.13Å; F484-F504 AromaticContact CG-CD1 3.7Å; F484-F504 HydrophobicContact CG-CD1 3.7Å; F484-F504 AromaticContact CG-CE1 3.49Å; F484-F504 HydrophobicContact CG-CE1 3.49Å; F484-F504 VanDerWaalsContact CG-CE1 3.49Å; F484-F504 HydrophobicContact CG-CZ 4.35Å; F484-F504 HydrophobicContact CZ-CE1 4.38Å; F484-F504 CarbonylContact O-C 3.55Å; F484-Y505 PolarHBondContact O-N 3.44Å; F484-T507 HydrophobicContact CB-CG2 4.18Å; F484-L509 HydrophobicContact CD1-CD1 4.39Å
485	E	91.9	Very high	89.9	Confident	50 Å²	50	37.8 Å²	37.8	23%	0.234	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	132.5	-177.2	173.6	168.4	-151.3	0	0	111.3	F464 I465 N466 Y483 Y505	F464-E485 PolarHBondContact O-N 3.04Å; I465-E485 WeakPolarHBondContact CA-O 3.14Å; I465-E485 HydrophobicContact CG1-CB 4.31Å; I465-E485 HydrophobicContact CG2-CB 4.28Å; I465-E485 HydrophobicContact CG2-CG 4.22Å; N466-E485 PolarHBondContact N-O 3.39Å; Y483-E485 HydrophobicContact CD1-CB 4.21Å; Y483-E485 HydrophobicContact CE1-CB 3.74Å; Y483-E485 HydrophobicContact CE1-CG 4.5Å; Y483-E485 WeakPolarHBondContact CE1-OE2 3.46Å; E485-Y505 VanDerWaalsContact CA-O 3.31Å; E485-Y505 WeakPolarHBondContact CA-O 3.47Å; E485-Y505 HydrophobicContact CG-CD1 4.09Å
486	D	87.6	Confident	89.9	Confident	53 Å²	53	41 Å²	41	28%	0.283	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	51.4	59.5	176.9	-68.4	-29.6	0	0	0	112.5	N466 I467 Y505 N506	N466-D486 WeakPolarHBondContact CA-O 3.42Å; I467-D486 PolarHBondContact N-O 3.27Å; D486-Y505 PolarHBondContact N-O 3.35Å; D486-Y505 VanDerWaalsContact N-O 3.12Å; D486-N506 WeakPolarHBondContact OD1-CB 3.37Å; D486-N506 PolarHBondContact OD1-ND2 2.94Å
487	I	85.9	Confident	89.9	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	133.3	-179.9	-59.8	-179.4	0	0	0	110.1	F464 I467 M469 F484 T507 D508 L509	F464-I487 HydrophobicContact CB-CD1 3.9Å; I467-I487 WeakPolarHBondContact O-CA 3.42Å; M469-I487 HydrophobicContact CE-CD1 4.22Å; M469-I487 HydrophobicContact CE-CG2 4.47Å; M469-I487 HydrophobicContact CG-CG2 4.36Å; M469-I487 HydrophobicContact SD-CG2 4.3Å; F484-I487 HydrophobicContact CB-CD1 3.59Å; F484-I487 HydrophobicContact CD1-CD1 3.29Å; F484-I487 HydrophobicContact CE1-CD1 4.35Å; F484-I487 HydrophobicContact CG-CD1 3.88Å; I487-T507 HydrophobicContact CB-CG2 3.83Å; I487-T507 HydrophobicContact CD1-CG2 4.21Å; I487-T507 HydrophobicContact CG1-CG2 4.02Å; I487-D508 PolarHBondContact O-N 3.39Å; I487-L509 HydrophobicContact CG2-CD1 4.36Å
488	E	82.9	Confident	89.8	Confident	60 Å²	60	39.1 Å²	39.1	28%	0.28	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	123.2	170.8	-64.3	175.9	169.3	0	0	107.6	I467 Q468 M469 D508	I467-E488 PolarHBondContact O-N 3.23Å; Q468-E488 CarbonylContact C-O 3.56Å; Q468-E488 VanDerWaalsContact CA-O 3.31Å; Q468-E488 WeakPolarHBondContact CA-O 3.2Å; Q468-E488 HydrophobicContact CG-CB 4.3Å; Q468-E488 PolarHBondContact NE2-OE2 2.93Å; M469-E488 PolarHBondContact N-O 3.09Å; E488-D508 WeakPolarHBondContact CA-OD2 3.14Å
489	S	79.1	Confident	89.8	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.007	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	120.3	-171	70.3	0	0	0	0	112	M469 D508 L509	M469-S489 CarbonylContact O-C 3.56Å; M469-S489 VanDerWaalsContact O-CA 3.27Å; M469-S489 WeakPolarHBondContact O-CA 3.42Å; S489-D508 WeakPolarHBondContact CB-OD1 3.39Å; S489-D508 VanDerWaalsContact N-CG 3.31Å; S489-D508 PolarHBondContact N-OD1 3.43Å; S489-D508 VanDerWaalsContact N-OD1 3.16Å; S489-D508 PolarHBondContact N-OD2 3.18Å; S489-D508 VanDerWaalsContact OG-CG 3.29Å; S489-D508 PolarHBondContact OG-OD1 3.28Å; S489-L509 VanDerWaalsContact OG-CD2 3.27Å; S489-L509 WeakPolarHBondContact OG-CD2 3.4Å
490	T	76.5	Confident	89.8	Confident	18 Å²	18	41.5 Å²	41.5	11%	0.11	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	128.8	176.3	-44.7	0	0	0	0	108.1	M469 S471 T492 D534	M469-T490 PolarHBondContact O-N 3.29Å; S471-T490 PolarHBondContact N-O 3.37Å; T490-T492 PolarHBondContact O-N 2.97Å; T490-T492 PolarHBondContact O-OG1 3.09Å; T490-D534 HydrophobicContact CG2-CB 4.28Å
491	E	76.4	Confident	89.7	Confident	120 Å²	120	40.9 Å²	40.9	56%	0.561	20%	0.202	S	C	*	.	S	Bend	trans	49.2	25.6	-179.7	-63.1	-175	163.4	0	0	115.3	S471	S471-E491 PolarHBondContact OG-OE2 2.94Å
492	T	86.4	Confident	89.6	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.183	C	C	.	.			trans	-91.6	131.4	-177.2	-64.8	0	0	0	0	110.5	M469 V472 T490 F494 R513	M469-T492 HydrophobicContact CB-CG2 4.18Å; M469-T492 WeakPolarHBondContact CB-OG1 3.24Å; M469-T492 PolarHBondContact O-OG1 2.75Å; M469-T492 VanDerWaalsContact O-OG1 3.12Å; M469-T492 HydrophobicContact SD-CG2 4.2Å; V472-T492 HydrophobicContact CB-CG2 4.17Å; V472-T492 CarbonylContact O-C 3.49Å; V472-T492 WeakPolarHBondContact O-CA 3.49Å; V472-T492 WeakPolarHBondContact O-CG2 3.27Å; T490-T492 PolarHBondContact O-N 2.97Å; T490-T492 PolarHBondContact O-OG1 3.09Å; T492-F494 HydrophobicContact CG2-CE2 4.14Å; T492-R513 WeakPolarHBondContact O-CD 3.08Å
493	I	89.8	Confident	89.6	Confident	55 Å²	55	39 Å²	39	28%	0.282	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	137.2	-174.2	-59.6	176.1	0	0	0	110.5	V472 K473 F474 I515	V472-I493 PolarHBondContact O-N 3.1Å; K473-I493 WeakPolarHBondContact CA-O 3Å; K473-I493 HydrophobicContact CG-CB 4.48Å; F474-I493 PolarHBondContact N-O 3.32Å; I493-I515 HydrophobicContact CG2-CD1 3.68Å; I493-I515 HydrophobicContact CG2-CG1 4.08Å
494	F	92.7	Very high	89.5	Confident	1 Å²	1	35.6 Å²	35.6	0%	0.004	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	119.9	167.8	-64.6	-99.8	0	0	0	108.1	F474 F479 T492 C497 L509 R513 F514 I515 C517	F474-F494 HydrophobicContact CB-CD1 3.75Å; F474-F494 HydrophobicContact CB-CE1 4.12Å; F474-F494 HydrophobicContact CB-CG 4.45Å; F474-F494 AromaticContact CD2-CD1 3.73Å; F474-F494 HydrophobicContact CD2-CD1 3.73Å; F474-F494 AromaticContact CD2-CE1 3.29Å; F474-F494 HydrophobicContact CD2-CE1 3.29Å; F474-F494 HydrophobicContact CD2-CE2 4.31Å; F474-F494 HydrophobicContact CD2-CG 4.41Å; F474-F494 AromaticContact CD2-CZ 3.62Å; F474-F494 HydrophobicContact CD2-CZ 3.62Å; F474-F494 AromaticContact CE2-CE1 3.84Å; F474-F494 HydrophobicContact CE2-CE1 3.84Å; F474-F494 AromaticContact CE2-CZ 3.85Å; F474-F494 HydrophobicContact CE2-CZ 3.85Å; F474-F494 AromaticContact CG-CD1 3.97Å; F474-F494 HydrophobicContact CG-CD1 3.97Å; F474-F494 AromaticContact CG-CE1 3.81Å; F474-F494 HydrophobicContact CG-CE1 3.81Å; F479-F494 AromaticContact CE2-CD1 3.97Å; F479-F494 HydrophobicContact CE2-CD1 3.97Å; F479-F494 AromaticContact CE2-CE1 3.81Å; F479-F494 HydrophobicContact CE2-CE1 3.81Å; F479-F494 HydrophobicContact CZ-CD1 4.37Å; F479-F494 AromaticContact CZ-CE1 3.78Å; F479-F494 HydrophobicContact CZ-CE1 3.78Å; T492-F494 HydrophobicContact CG2-CE2 4.14Å; F494-C497 HydrophobicContact CB-CB 4.49Å; F494-L509 HydrophobicContact CE2-CD1 4.06Å; F494-L509 HydrophobicContact CE2-CD2 3.89Å; F494-L509 HydrophobicContact CZ-CD1 4.35Å; F494-R513 PolarHBondContact N-O 2.95Å; F494-F514 HydrophobicContact CB-CD1 3.61Å; F494-F514 HydrophobicContact CB-CE1 4.02Å; F494-F514 HydrophobicContact CD1-CE1 4.27Å; F494-F514 HydrophobicContact CD2-CD1 4.04Å; F494-F514 AromaticContact CD2-CE1 3.67Å; F494-F514 HydrophobicContact CD2-CE1 3.67Å; F494-F514 HydrophobicContact CD2-CZ 4.32Å; F494-F514 HydrophobicContact CE2-CE1 4.22Å; F494-F514 AromaticContact CG-CD1 3.86Å; F494-F514 HydrophobicContact CG-CD1 3.86Å; F494-F514 AromaticContact CG-CE1 3.72Å; F494-F514 HydrophobicContact CG-CE1 3.72Å; F494-F514 CarbonylContact O-C 3.55Å; F494-I515 PolarHBondContact O-N 2.92Å; F494-C517 VanDerWaalsContact C-SG 3.59Å; F494-C517 PolarHBondContact O-SG 3.29Å
495	E	93.6	Very high	89.4	Confident	71 Å²	71	39.3 Å²	39.3	33%	0.332	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	127.7	-177.4	-170.5	175.3	-176.4	0	0	110.3	K473 F474 E475 D476 C497 I515	K473-E495 WeakPolarHBondContact CE-OE2 3.44Å; K473-E495 IonicContact NZ-OE2 3.91Å; K473-E495 PolarHBondContact NZ-OE2 3.02Å; F474-E495 PolarHBondContact O-N 2.75Å; E475-E495 WeakPolarHBondContact CA-O 3.45Å; D476-E495 PolarHBondContact N-O 2.9Å; D476-E495 VanDerWaalsContact N-O 3.09Å; E495-C497 PolarHBondContact O-N 3.1Å; E495-C497 PolarHBondContact O-SG 3.46Å; E495-I515 WeakPolarHBondContact CA-O 3.5Å
496	N	94.6	Very high	89.1	Confident	92 Å²	92	39.3 Å²	39.3	49%	0.492	20%	0.195	S	C	.	.	S	Bend	trans	50.6	31.5	-179.9	-161.7	29	0	0	0	114	D476 I515	D476-N496 WeakPolarHBondContact OD1-CB 3.27Å; D476-N496 PolarHBondContact OD1-ND2 3.5Å; N496-I515 PolarHBondContact N-O 2.84Å
497	C	93.6	Very high	89	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.182	C	C	.	.			trans	-87.4	147.3	-178.5	-67.5	0	0	0	0	111.3	F474 S477 F494 E495 C517 R518	F474-C497 PolarHBondContact O-SG 3.01Å; S477-C497 CarbonylContact O-C 3.6Å; S477-C497 WeakPolarHBondContact O-CA 3.49Å; S477-C497 WeakPolarHBondContact O-CB 3.04Å; F494-C497 HydrophobicContact CB-CB 4.49Å; E495-C497 PolarHBondContact O-N 3.1Å; E495-C497 PolarHBondContact O-SG 3.46Å; C497-C517 PolarHBondContact N-SG 3.47Å; C497-C517 VanDerWaalsContact N-SG 3.39Å; C497-C517 CarbonylContact O-C 3.54Å; C497-C517 WeakPolarHBondContact O-CA 3.45Å; C497-C517 WeakPolarHBondContact O-CB 3.48Å; C497-R518 PolarHBondContact O-N 2.59Å
498	T	94.3	Very high	88.7	Confident	49 Å²	49	37 Å²	37	30%	0.301	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	118	170.2	-59.3	0	0	0	0	108.9	S477 L478 F479	S477-T498 PolarHBondContact O-N 2.97Å; L478-T498 CarbonylContact C-O 3.6Å; L478-T498 WeakPolarHBondContact CA-O 3.43Å; L478-T498 HydrophobicContact CD1-CG2 3.91Å; F479-T498 PolarHBondContact N-O 3.38Å
499	I	94.4	Very high	88.7	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	114.2	-177.8	-56.2	177.5	0	0	0	107.7	F479 T502 F504 F514 R518 L519 E520 T522	F479-I499 HydrophobicContact CB-CG1 4.29Å; F479-I499 HydrophobicContact CB-CG2 4.32Å; F479-I499 HydrophobicContact CD2-CG1 4.2Å; F479-I499 CarbonylContact O-C 3.6Å; F479-I499 WeakPolarHBondContact O-CA 3.49Å; I499-T502 HydrophobicContact CG2-CG2 4Å; I499-F504 HydrophobicContact CD1-CZ 4.49Å; I499-F504 HydrophobicContact CG2-CE2 4.29Å; I499-F514 HydrophobicContact CD1-CD1 3.61Å; I499-F514 HydrophobicContact CD1-CE1 3.31Å; I499-F514 HydrophobicContact CD1-CZ 4.34Å; I499-R518 PolarHBondContact N-O 3.33Å; I499-L519 HydrophobicContact CB-CD2 3.79Å; I499-L519 HydrophobicContact CD1-CD2 3.76Å; I499-L519 HydrophobicContact CG1-CD2 4.15Å; I499-L519 HydrophobicContact CG2-CD2 4.35Å; I499-L519 CarbonylContact O-C 3.56Å; I499-L519 WeakPolarHBondContact O-CA 3.35Å; I499-E520 PolarHBondContact O-N 3.38Å; I499-T522 HydrophobicContact CG2-CG2 4.3Å; I499-T522 PolarHBondContact O-OG1 3.37Å
500	R	94.4	Very high	88.6	Confident	99 Å²	99	37 Å²	37	37%	0.374	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	132.1	-175.2	179	-177.8	-80.8	168.6	-1.5	111.5	F479 E480 D481 T502 E520	F479-R500 PolarHBondContact O-N 3.39Å; E480-R500 WeakPolarHBondContact CA-O 3.43Å; E480-R500 HydrophobicContact CG-CB 4.5Å; E480-R500 VanDerWaalsContact OE1-CD 3.31Å; E480-R500 WeakPolarHBondContact OE1-CD 3.38Å; E480-R500 IonicContact OE1-NH1 3.74Å; E480-R500 PolarHBondContact OE1-NH1 3.43Å; D481-R500 PolarHBondContact N-O 3.03Å; R500-T502 PolarHBondContact O-N 2.93Å; R500-T502 VanDerWaalsContact O-N 3.15Å; R500-T502 PolarHBondContact O-OG1 3.3Å; R500-E520 CarbonylContact C-O 3.5Å; R500-E520 VanDerWaalsContact CA-O 3.26Å; R500-E520 WeakPolarHBondContact CA-O 3.45Å; R500-E520 HydrophobicContact CB-CB 4.39Å; R500-E520 HydrophobicContact CG-CB 4.31Å; R500-E520 IonicContact CZ-OE2 2.64Å; R500-E520 VanDerWaalsContact CZ-OE2 3.29Å; R500-E520 IonicContact NE-OE2 3.36Å; R500-E520 PolarHBondContact NE-OE2 3.07Å; R500-E520 IonicContact NH2-OE2 2.69Å; R500-E520 PolarHBondContact NH2-OE2 3.47Å
501	S	94.1	Very high	88.4	Confident	38 Å²	38	43.6 Å²	43.6	27%	0.266	21%	0.21	S	C	.	.	S	Bend	trans	55	31.1	174.5	-60.9	0	0	0	0	113.7	D481 E520 N521	D481-S501 WeakPolarHBondContact OD1-CB 3.45Å; S501-E520 PolarHBondContact N-O 2.94Å; S501-N521 WeakPolarHBondContact CA-O 3.27Å
502	T	93.3	Very high	88.5	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.218	C	C	.	.			trans	-98.5	143.7	-175.8	-63.2	0	0	0	0	111.2	C482 F484 I499 R500 F504 T522 T523	C482-T502 HydrophobicContact CB-CG2 3.9Å; C482-T502 VanDerWaalsContact O-CA 3.26Å; C482-T502 WeakPolarHBondContact O-CA 3.4Å; C482-T502 WeakPolarHBondContact O-CG2 3.5Å; F484-T502 HydrophobicContact CD2-CG2 3.51Å; F484-T502 HydrophobicContact CE2-CG2 3.53Å; I499-T502 HydrophobicContact CG2-CG2 4Å; R500-T502 PolarHBondContact O-N 2.93Å; R500-T502 VanDerWaalsContact O-N 3.15Å; R500-T502 PolarHBondContact O-OG1 3.3Å; T502-F504 HydrophobicContact CG2-CD2 4.24Å; T502-F504 HydrophobicContact CG2-CE2 3.69Å; T502-F504 HydrophobicContact CG2-CZ 3.9Å; T502-T522 WeakPolarHBondContact O-CA 3.3Å; T502-T522 WeakPolarHBondContact O-CG2 3.49Å; T502-T523 PolarHBondContact O-N 3.34Å
503	V	93.4	Very high	88.3	Confident	37 Å²	37	47.4 Å²	47.4	22%	0.224	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	130.5	176.3	-175.4	0	0	0	0	110	C482 Y483 F484 T523 L525	C482-V503 PolarHBondContact O-N 2.88Å; Y483-V503 HydrophobicContact CD2-CB 3.64Å; Y483-V503 HydrophobicContact CD2-CG1 4.09Å; Y483-V503 HydrophobicContact CD2-CG2 4.18Å; Y483-V503 HydrophobicContact CE2-CB 3.79Å; Y483-V503 HydrophobicContact CE2-CG1 3.69Å; Y483-V503 HydrophobicContact CE2-CG2 4.39Å; F484-V503 PolarHBondContact N-O 3.11Å; V503-T523 WeakPolarHBondContact CG2-OG1 3.4Å; V503-L525 HydrophobicContact CG1-CD1 4.27Å
504	F	91.9	Very high	88.3	Confident	1 Å²	1	45.8 Å²	45.8	0%	0.004	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	117.6	171.1	-65.8	-87.2	0	0	0	109.2	F484 I499 T502 T507 L509 F514 T522 T523 F524 L525	F484-F504 HydrophobicContact CB-CD1 3.5Å; F484-F504 VanDerWaalsContact CB-CD1 3.5Å; F484-F504 HydrophobicContact CB-CE1 3.88Å; F484-F504 HydrophobicContact CB-CG 4.29Å; F484-F504 HydrophobicContact CD1-CD1 4.3Å; F484-F504 AromaticContact CD1-CE1 3.84Å; F484-F504 HydrophobicContact CD1-CE1 3.84Å; F484-F504 AromaticContact CD2-CD1 3.99Å; F484-F504 HydrophobicContact CD2-CD1 3.99Å; F484-F504 AromaticContact CD2-CE1 3.57Å; F484-F504 HydrophobicContact CD2-CE1 3.57Å; F484-F504 AromaticContact CD2-CZ 3.97Å; F484-F504 HydrophobicContact CD2-CZ 3.97Å; F484-F504 HydrophobicContact CE1-CE1 4.3Å; F484-F504 HydrophobicContact CE2-CE1 4.02Å; F484-F504 HydrophobicContact CE2-CZ 4.13Å; F484-F504 AromaticContact CG-CD1 3.7Å; F484-F504 HydrophobicContact CG-CD1 3.7Å; F484-F504 AromaticContact CG-CE1 3.49Å; F484-F504 HydrophobicContact CG-CE1 3.49Å; F484-F504 VanDerWaalsContact CG-CE1 3.49Å; F484-F504 HydrophobicContact CG-CZ 4.35Å; F484-F504 HydrophobicContact CZ-CE1 4.38Å; F484-F504 CarbonylContact O-C 3.55Å; I499-F504 HydrophobicContact CD1-CZ 4.49Å; I499-F504 HydrophobicContact CG2-CE2 4.29Å; T502-F504 HydrophobicContact CG2-CD2 4.24Å; T502-F504 HydrophobicContact CG2-CE2 3.69Å; T502-F504 HydrophobicContact CG2-CZ 3.9Å; F504-T507 HydrophobicContact CB-CG2 4.49Å; F504-T507 HydrophobicContact CD1-CG2 4.48Å; F504-L509 HydrophobicContact CD1-CB 4.42Å; F504-L509 HydrophobicContact CD1-CD1 4.15Å; F504-L509 HydrophobicContact CE1-CD1 3.85Å; F504-F514 HydrophobicContact CE1-CZ 4.18Å; F504-F514 HydrophobicContact CE2-CZ 4.35Å; F504-F514 HydrophobicContact CZ-CE1 4.26Å; F504-F514 AromaticContact CZ-CZ 3.84Å; F504-F514 HydrophobicContact CZ-CZ 3.84Å; F504-T522 HydrophobicContact CD2-CG2 3.74Å; F504-T522 HydrophobicContact CE2-CG2 3.6Å; F504-T523 PolarHBondContact N-O 2.88Å; F504-F524 HydrophobicContact CB-CD1 3.57Å; F504-F524 HydrophobicContact CB-CE1 3.97Å; F504-F524 HydrophobicContact CB-CG 4.37Å; F504-F524 HydrophobicContact CD1-CE1 4.42Å; F504-F524 AromaticContact CD2-CD1 3.76Å; F504-F524 HydrophobicContact CD2-CD1 3.76Å; F504-F524 AromaticContact CD2-CE1 3.34Å; F504-F524 HydrophobicContact CD2-CE1 3.34Å; F504-F524 AromaticContact CD2-CZ 3.79Å; F504-F524 HydrophobicContact CD2-CZ 3.79Å; F504-F524 AromaticContact CE2-CE1 3.89Å; F504-F524 HydrophobicContact CE2-CE1 3.89Å; F504-F524 HydrophobicContact CE2-CZ 4.02Å; F504-F524 AromaticContact CG-CD1 3.82Å; F504-F524 HydrophobicContact CG-CD1 3.82Å; F504-F524 AromaticContact CG-CE1 3.67Å; F504-F524 HydrophobicContact CG-CE1 3.67Å; F504-F524 CarbonylContact O-C 3.6Å; F504-F524 WeakPolarHBondContact O-CA 3.4Å; F504-L525 PolarHBondContact O-N 2.79Å
505	Y	90.6	Very high	88.1	Confident	80 Å²	80	49.2 Å²	49.2	31%	0.314	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	122.1	-176.9	-176.9	-91.8	0	0	0	110.9	F484 E485 D486 T507 L525 H526	F484-Y505 PolarHBondContact O-N 3.44Å; E485-Y505 VanDerWaalsContact CA-O 3.31Å; E485-Y505 WeakPolarHBondContact CA-O 3.47Å; E485-Y505 HydrophobicContact CG-CD1 4.09Å; D486-Y505 PolarHBondContact N-O 3.35Å; D486-Y505 VanDerWaalsContact N-O 3.12Å; Y505-T507 WeakPolarHBondContact O-CG2 3.21Å; Y505-T507 PolarHBondContact O-N 3.28Å; Y505-L525 WeakPolarHBondContact CA-O 3.1Å; Y505-L525 HydrophobicContact CD2-CB 3.72Å; Y505-L525 HydrophobicContact CD2-CD1 4.12Å; Y505-L525 HydrophobicContact CE2-CB 4.4Å; Y505-H526 AromaticContact CE2-CD2 3.81Å
506	N	86.3	Confident	87.9	Confident	49 Å²	49	52.2 Å²	52.2	26%	0.262	25%	0.253	S	S	.	.	S	Bend	trans	53.9	36.8	179.9	-160.9	29	0	0	0	114.6	D486 L525 H526 K528	D486-N506 WeakPolarHBondContact OD1-CB 3.37Å; D486-N506 PolarHBondContact OD1-ND2 2.94Å; N506-L525 PolarHBondContact N-O 3.36Å; N506-H526 WeakPolarHBondContact CA-O 3.41Å; N506-H526 HydrophobicContact CB-CB 4.48Å; N506-K528 WeakPolarHBondContact O-CE 3.26Å; N506-K528 WeakPolarHBondContact OD1-CE 3.43Å
507	T	84.4	Confident	87.8	Confident	1 Å²	1	49 Å²	49	1%	0.006	24%	0.238	C	C	.	.			trans	-101.1	163	178.7	62.4	0	0	0	0	111.3	F484 I487 F504 Y505 N527 K528	F484-T507 HydrophobicContact CB-CG2 4.18Å; I487-T507 HydrophobicContact CB-CG2 3.83Å; I487-T507 HydrophobicContact CD1-CG2 4.21Å; I487-T507 HydrophobicContact CG1-CG2 4.02Å; F504-T507 HydrophobicContact CB-CG2 4.49Å; F504-T507 HydrophobicContact CD1-CG2 4.48Å; Y505-T507 WeakPolarHBondContact O-CG2 3.21Å; Y505-T507 PolarHBondContact O-N 3.28Å; T507-N527 WeakPolarHBondContact O-CA 3.26Å; T507-N527 PolarHBondContact O-OD1 2.83Å; T507-K528 PolarHBondContact O-N 3.22Å
508	D	80.1	Confident	87.7	Confident	3 Å²	3	56.6 Å²	56.6	2%	0.016	27%	0.267	C	S	.	.	S	Bend	trans	-98	7.4	168.9	63.7	-1.1	0	0	0	113.9	I487 E488 S489 Y510 K528 L533	I487-D508 PolarHBondContact O-N 3.39Å; E488-D508 WeakPolarHBondContact CA-OD2 3.14Å; S489-D508 WeakPolarHBondContact CB-OD1 3.39Å; S489-D508 VanDerWaalsContact N-CG 3.31Å; S489-D508 PolarHBondContact N-OD1 3.43Å; S489-D508 VanDerWaalsContact N-OD1 3.16Å; S489-D508 PolarHBondContact N-OD2 3.18Å; S489-D508 VanDerWaalsContact OG-CG 3.29Å; S489-D508 PolarHBondContact OG-OD1 3.28Å; D508-Y510 WeakPolarHBondContact O-CD1 3.27Å; D508-Y510 WeakPolarHBondContact O-CE1 3.5Å; D508-Y510 PolarHBondContact O-N 2.68Å; D508-K528 HydrophobicContact CB-CB 4.44Å; D508-L533 HydrophobicContact CB-CB 4.45Å; D508-L533 HydrophobicContact CB-CD1 3.77Å; D508-L533 HydrophobicContact CB-CD2 4.5Å; D508-L533 HydrophobicContact CB-CG 4.45Å
509	L	83	Confident	87.6	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	27%	0.271	C	S	.	.			trans	-77	100.1	172.1	-62.6	173.6	0	0	0	109.9	F484 I487 S489 F494 F504 F514 N527	F484-L509 HydrophobicContact CD1-CD1 4.39Å; I487-L509 HydrophobicContact CG2-CD1 4.36Å; S489-L509 VanDerWaalsContact OG-CD2 3.27Å; S489-L509 WeakPolarHBondContact OG-CD2 3.4Å; F494-L509 HydrophobicContact CE2-CD1 4.06Å; F494-L509 HydrophobicContact CE2-CD2 3.89Å; F494-L509 HydrophobicContact CZ-CD1 4.35Å; F504-L509 HydrophobicContact CD1-CB 4.42Å; F504-L509 HydrophobicContact CD1-CD1 4.15Å; F504-L509 HydrophobicContact CE1-CD1 3.85Å; L509-F514 HydrophobicContact CB-CE2 4.3Å; L509-F514 HydrophobicContact CB-CZ 4.22Å; L509-N527 PolarHBondContact O-ND2 3.08Å; L509-N527 VanDerWaalsContact O-ND2 3.08Å
510	Y	76.1	Confident	87.5	Confident	62 Å²	62	59.9 Å²	59.9	24%	0.243	28%	0.28	C	S	.	.			trans	-115.5	173.6	175.1	57.8	-92.4	0	0	0	111.8	D508 E512 R513 F514	D508-Y510 WeakPolarHBondContact O-CD1 3.27Å; D508-Y510 WeakPolarHBondContact O-CE1 3.5Å; D508-Y510 PolarHBondContact O-N 2.68Å; Y510-E512 HydrophobicContact CD2-CB 4.04Å; Y510-E512 HydrophobicContact CD2-CG 4.11Å; Y510-E512 HydrophobicContact CE2-CB 3.72Å; Y510-E512 HydrophobicContact CE2-CG 3.88Å; Y510-E512 WeakPolarHBondContact CE2-OE2 3.47Å; Y510-E512 PolarHBondContact O-N 3.11Å; Y510-R513 WeakPolarHBondContact O-CB 2.93Å; Y510-R513 PolarHBondContact O-N 3.21Å; Y510-F514 WeakPolarHBondContact O-CD2 3.49Å
511	E	72.9	Confident	87.3	Confident	157 Å²	157	61.5 Å²	61.5	73%	0.734	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-50.1	-34.1	-166.4	-69.2	177.2	-179.1	0	0	115.1	R513 F514	E511-R513 VanDerWaalsContact C-N 3.25Å; E511-R513 PolarHBondContact O-N 3.38Å; E511-F514 PolarHBondContact O-N 3.48Å
512	E	78.2	Confident	87.1	Confident	156 Å²	156	61 Å²	61	73%	0.729	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-69	-19.1	-179.4	-58.5	-179.5	176	0	0	114.1	Y510 F514	Y510-E512 HydrophobicContact CD2-CB 4.04Å; Y510-E512 HydrophobicContact CD2-CG 4.11Å; Y510-E512 HydrophobicContact CE2-CB 3.72Å; Y510-E512 HydrophobicContact CE2-CG 3.88Å; Y510-E512 WeakPolarHBondContact CE2-OE2 3.47Å; Y510-E512 PolarHBondContact O-N 3.11Å; E512-F514 VanDerWaalsContact C-N 3.29Å
513	R	82.9	Confident	87	Confident	44 Å²	44	64 Å²	64	17%	0.166	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-81.3	-9.2	176.5	-59	-65.6	-161.2	174.5	0.3	112.7	T492 F494 Y510 E511 D534	T492-R513 WeakPolarHBondContact O-CD 3.08Å; F494-R513 PolarHBondContact N-O 2.95Å; Y510-R513 WeakPolarHBondContact O-CB 2.93Å; Y510-R513 PolarHBondContact O-N 3.21Å; E511-R513 VanDerWaalsContact C-N 3.25Å; E511-R513 PolarHBondContact O-N 3.38Å; R513-D534 IonicContact NH2-OD1 3.73Å
514	F	89.1	Confident	86.8	Confident	21 Å²	21	65.5 Å²	65.5	9%	0.092	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	94.2	-178.9	-62.1	-80.1	0	0	0	110.3	F494 I499 F504 L509 Y510 E511 E512 C517 F524	F494-F514 HydrophobicContact CB-CD1 3.61Å; F494-F514 HydrophobicContact CB-CE1 4.02Å; F494-F514 HydrophobicContact CD1-CE1 4.27Å; F494-F514 HydrophobicContact CD2-CD1 4.04Å; F494-F514 AromaticContact CD2-CE1 3.67Å; F494-F514 HydrophobicContact CD2-CE1 3.67Å; F494-F514 HydrophobicContact CD2-CZ 4.32Å; F494-F514 HydrophobicContact CE2-CE1 4.22Å; F494-F514 AromaticContact CG-CD1 3.86Å; F494-F514 HydrophobicContact CG-CD1 3.86Å; F494-F514 AromaticContact CG-CE1 3.72Å; F494-F514 HydrophobicContact CG-CE1 3.72Å; F494-F514 CarbonylContact O-C 3.55Å; I499-F514 HydrophobicContact CD1-CD1 3.61Å; I499-F514 HydrophobicContact CD1-CE1 3.31Å; I499-F514 HydrophobicContact CD1-CZ 4.34Å; F504-F514 HydrophobicContact CE1-CZ 4.18Å; F504-F514 HydrophobicContact CE2-CZ 4.35Å; F504-F514 HydrophobicContact CZ-CE1 4.26Å; F504-F514 AromaticContact CZ-CZ 3.84Å; F504-F514 HydrophobicContact CZ-CZ 3.84Å; L509-F514 HydrophobicContact CB-CE2 4.3Å; L509-F514 HydrophobicContact CB-CZ 4.22Å; Y510-F514 WeakPolarHBondContact O-CD2 3.49Å; E511-F514 PolarHBondContact O-N 3.48Å; E512-F514 VanDerWaalsContact C-N 3.29Å; F514-C517 HydrophobicContact CB-CB 3.99Å; F514-C517 HydrophobicContact CD1-CB 4.45Å; F514-F524 HydrophobicContact CE2-CE1 4.05Å; F514-F524 HydrophobicContact CE2-CZ 4.08Å; F514-F524 HydrophobicContact CZ-CE1 4.41Å; F514-F524 HydrophobicContact CZ-CZ 4.48Å
515	I	89.4	Confident	86.5	Confident	73 Å²	73	69.6 Å²	69.6	37%	0.374	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	121.3	-178.9	-53.7	178.4	0	0	0	108.6	I493 F494 E495 N496 C517	I493-I515 HydrophobicContact CG2-CD1 3.68Å; I493-I515 HydrophobicContact CG2-CG1 4.08Å; F494-I515 PolarHBondContact O-N 2.92Å; E495-I515 WeakPolarHBondContact CA-O 3.5Å; N496-I515 PolarHBondContact N-O 2.84Å; I515-C517 PolarHBondContact O-N 3.4Å; I515-C517 PolarHBondContact O-SG 3.31Å; I515-C517 VanDerWaalsContact O-SG 3.32Å
516	D	90	Very high	86	Confident	133 Å²	133	72.4 Å²	72.4	71%	0.711	35%	0.351	S	S	*	.	S	Bend	trans	52.5	27.5	179.6	-63.5	-35.1	0	0	0	114.8
517	C	91.7	Very high	85.4	Confident	26 Å²	26	72 Å²	72	18%	0.176	35%	0.349	C	S	.	.			trans	-86.4	145.7	-179.2	-65.8	0	0	0	0	112.5	F494 C497 F514 I515	F494-C517 VanDerWaalsContact C-SG 3.59Å; F494-C517 PolarHBondContact O-SG 3.29Å; C497-C517 PolarHBondContact N-SG 3.47Å; C497-C517 VanDerWaalsContact N-SG 3.39Å; C497-C517 CarbonylContact O-C 3.54Å; C497-C517 WeakPolarHBondContact O-CA 3.45Å; C497-C517 WeakPolarHBondContact O-CB 3.48Å; F514-C517 HydrophobicContact CB-CB 3.99Å; F514-C517 HydrophobicContact CD1-CB 4.45Å; I515-C517 PolarHBondContact O-N 3.4Å; I515-C517 PolarHBondContact O-SG 3.31Å; I515-C517 VanDerWaalsContact O-SG 3.32Å
518	R	92.2	Very high	84.7	Confident	159 Å²	159	74.6 Å²	74.6	60%	0.6	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.3	108.3	175	-172.2	176.2	176.6	167	-2.4	110.3	C497 I499 E520	C497-R518 PolarHBondContact O-N 2.59Å; I499-R518 PolarHBondContact N-O 3.33Å; R518-E520 HydrophobicContact CG-CG 4.21Å; R518-E520 IonicContact CZ-OE1 2.7Å; R518-E520 IonicContact NE-OE1 3.03Å; R518-E520 PolarHBondContact NE-OE1 2.88Å; R518-E520 IonicContact NH2-OE1 3.26Å; R518-E520 PolarHBondContact NH2-OE1 3.01Å
519	L	91.4	Very high	83.9	Confident	74 Å²	74	83 Å²	83	39%	0.387	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	112.9	178.3	-55.1	177.5	0	0	0	110.3	I499 F524	I499-L519 HydrophobicContact CB-CD2 3.79Å; I499-L519 HydrophobicContact CD1-CD2 3.76Å; I499-L519 HydrophobicContact CG1-CD2 4.15Å; I499-L519 HydrophobicContact CG2-CD2 4.35Å; I499-L519 CarbonylContact O-C 3.56Å; I499-L519 WeakPolarHBondContact O-CA 3.35Å; L519-F524 HydrophobicContact CD1-CE2 4.37Å; L519-F524 HydrophobicContact CD1-CZ 4.46Å
520	E	91.5	Very high	82.7	Confident	45 Å²	45	84.5 Å²	84.5	21%	0.21	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	117	177.9	-63.3	-169	157.7	0	0	110.7	I499 R500 S501 R518 T522	I499-E520 PolarHBondContact O-N 3.38Å; R500-E520 CarbonylContact C-O 3.5Å; R500-E520 VanDerWaalsContact CA-O 3.26Å; R500-E520 WeakPolarHBondContact CA-O 3.45Å; R500-E520 HydrophobicContact CB-CB 4.39Å; R500-E520 HydrophobicContact CG-CB 4.31Å; R500-E520 IonicContact CZ-OE2 2.64Å; R500-E520 VanDerWaalsContact CZ-OE2 3.29Å; R500-E520 IonicContact NE-OE2 3.36Å; R500-E520 PolarHBondContact NE-OE2 3.07Å; R500-E520 IonicContact NH2-OE2 2.69Å; R500-E520 PolarHBondContact NH2-OE2 3.47Å; S501-E520 PolarHBondContact N-O 2.94Å; R518-E520 HydrophobicContact CG-CG 4.21Å; R518-E520 IonicContact CZ-OE1 2.7Å; R518-E520 IonicContact NE-OE1 3.03Å; R518-E520 PolarHBondContact NE-OE1 2.88Å; R518-E520 IonicContact NH2-OE1 3.26Å; R518-E520 PolarHBondContact NH2-OE1 3.01Å; E520-T522 PolarHBondContact O-N 2.96Å
521	N	91.9	Very high	81.8	Confident	133 Å²	133	83.9 Å²	83.9	71%	0.711	42%	0.417	S	S	*	.	S	Bend	trans	56.6	34.3	178.4	-163.7	35.6	0	0	0	113.9	S501	S501-N521 WeakPolarHBondContact CA-O 3.27Å
522	T	89.2	Confident	80.9	Confident	27 Å²	27	81.4 Å²	81.4	17%	0.166	41%	0.405	C	S	.	.			trans	-89	141	179.6	-51.8	0	0	0	0	110.9	I499 T502 F504 E520 F524	I499-T522 HydrophobicContact CG2-CG2 4.3Å; I499-T522 PolarHBondContact O-OG1 3.37Å; T502-T522 WeakPolarHBondContact O-CA 3.3Å; T502-T522 WeakPolarHBondContact O-CG2 3.49Å; F504-T522 HydrophobicContact CD2-CG2 3.74Å; F504-T522 HydrophobicContact CE2-CG2 3.6Å; E520-T522 PolarHBondContact O-N 2.96Å; T522-F524 HydrophobicContact CG2-CD2 4.48Å; T522-F524 HydrophobicContact CG2-CE2 3.84Å; T522-F524 HydrophobicContact CG2-CZ 4.03Å
523	T	90.2	Very high	79.5	Confident	63 Å²	63	75.7 Å²	75.7	39%	0.387	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	136.7	177.8	55.9	0	0	0	0	111.7	T502 V503 F504	T502-T523 PolarHBondContact O-N 3.34Å; V503-T523 WeakPolarHBondContact CG2-OG1 3.4Å; F504-T523 PolarHBondContact N-O 2.88Å
524	F	88.9	Confident	78	Confident	69 Å²	69	76.7 Å²	76.7	30%	0.303	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	122.6	176.1	-63.8	-90.2	0	0	0	109.6	F504 F514 L519 T522	F504-F524 HydrophobicContact CB-CD1 3.57Å; F504-F524 HydrophobicContact CB-CE1 3.97Å; F504-F524 HydrophobicContact CB-CG 4.37Å; F504-F524 HydrophobicContact CD1-CE1 4.42Å; F504-F524 AromaticContact CD2-CD1 3.76Å; F504-F524 HydrophobicContact CD2-CD1 3.76Å; F504-F524 AromaticContact CD2-CE1 3.34Å; F504-F524 HydrophobicContact CD2-CE1 3.34Å; F504-F524 AromaticContact CD2-CZ 3.79Å; F504-F524 HydrophobicContact CD2-CZ 3.79Å; F504-F524 AromaticContact CE2-CE1 3.89Å; F504-F524 HydrophobicContact CE2-CE1 3.89Å; F504-F524 HydrophobicContact CE2-CZ 4.02Å; F504-F524 AromaticContact CG-CD1 3.82Å; F504-F524 HydrophobicContact CG-CD1 3.82Å; F504-F524 AromaticContact CG-CE1 3.67Å; F504-F524 HydrophobicContact CG-CE1 3.67Å; F504-F524 CarbonylContact O-C 3.6Å; F504-F524 WeakPolarHBondContact O-CA 3.4Å; F514-F524 HydrophobicContact CE2-CE1 4.05Å; F514-F524 HydrophobicContact CE2-CZ 4.08Å; F514-F524 HydrophobicContact CZ-CE1 4.41Å; F514-F524 HydrophobicContact CZ-CZ 4.48Å; L519-F524 HydrophobicContact CD1-CE2 4.37Å; L519-F524 HydrophobicContact CD1-CZ 4.46Å; T522-F524 HydrophobicContact CG2-CD2 4.48Å; T522-F524 HydrophobicContact CG2-CE2 3.84Å; T522-F524 HydrophobicContact CG2-CZ 4.03Å
525	L	85.9	Confident	76.2	Confident	86 Å²	86	78.4 Å²	78.4	45%	0.45	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	131.5	-176	-65	170.2	0	0	0	109.4	V503 F504 Y505 N506 N527	V503-L525 HydrophobicContact CG1-CD1 4.27Å; F504-L525 PolarHBondContact O-N 2.79Å; Y505-L525 WeakPolarHBondContact CA-O 3.1Å; Y505-L525 HydrophobicContact CD2-CB 3.72Å; Y505-L525 HydrophobicContact CD2-CD1 4.12Å; Y505-L525 HydrophobicContact CE2-CB 4.4Å; N506-L525 PolarHBondContact N-O 3.36Å; L525-N527 VanDerWaalsContact C-N 3.35Å; L525-N527 PolarHBondContact O-N 2.95Å
526	H	80.1	Confident	74.4	Confident	139 Å²	139	78 Å²	78	64%	0.644	40%	0.396	S	S	*	.	S	Bend	trans	53.3	42.7	179.4	-67.8	-67.8	0	0	0	115.1	Y505 N506 K528	Y505-H526 AromaticContact CE2-CD2 3.81Å; N506-H526 WeakPolarHBondContact CA-O 3.41Å; N506-H526 HydrophobicContact CB-CB 4.48Å; H526-K528 PolarHBondContact O-N 2.92Å
527	N	74.1	Confident	72.5	Confident	41 Å²	41	76.3 Å²	76.3	22%	0.219	38%	0.383	C	S	.	.			trans	-64.3	128.1	-178.2	-156.9	-26.9	0	0	0	111.6	T507 L509 L525 K529	T507-N527 WeakPolarHBondContact O-CA 3.26Å; T507-N527 PolarHBondContact O-OD1 2.83Å; L509-N527 PolarHBondContact O-ND2 3.08Å; L509-N527 VanDerWaalsContact O-ND2 3.08Å; L525-N527 VanDerWaalsContact C-N 3.35Å; L525-N527 PolarHBondContact O-N 2.95Å; N527-K529 PolarHBondContact O-N 3.32Å
528	K	69.8	Low	70.4	Confident	56 Å²	56	82.6 Å²	82.6	24%	0.243	41%	0.41	C	S	.	.			trans	-79.2	105.6	176.8	-61.3	177.9	-174	168.3	0	107.9	N506 T507 D508 H526 L533	N506-K528 WeakPolarHBondContact O-CE 3.26Å; N506-K528 WeakPolarHBondContact OD1-CE 3.43Å; T507-K528 PolarHBondContact O-N 3.22Å; D508-K528 HydrophobicContact CB-CB 4.44Å; H526-K528 PolarHBondContact O-N 2.92Å; K528-L533 HydrophobicContact CB-CD1 3.64Å; K528-L533 HydrophobicContact CB-CD2 4.16Å; K528-L533 HydrophobicContact CD-CD2 3.96Å; K528-L533 VanDerWaalsContact O-CD1 3.27Å; K528-L533 WeakPolarHBondContact O-CD1 3.36Å
529	K	63	Low	68.6	Low	178 Å²	178	78.6 Å²	78.6	77%	0.774	40%	0.401	S	S	*	.			trans	-104.3	128.2	177.8	-64.7	-172.5	179.3	-170.5	0	110.5	N527	N527-K529 PolarHBondContact O-N 3.32Å
530	G	57.9	Low	67.1	Low	33 Å²	33	76.2 Å²	76.2	34%	0.34	39%	0.389	S	S	.	.	S	Bend	trans	149.9	154.1	173.2	0	0	0	0	0	112.1	H532	G530-H532 PolarHBondContact O-N 3.04Å; G530-H532 VanDerWaalsContact O-N 3.09Å
531	C	58.2	Low	65.7	Low	49 Å²	49	76.9 Å²	76.9	33%	0.331	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-69.5	-1.6	178.5	-156.8	0	0	0	0	113.5	C145 L533	C145-C531 HydrophobicContact CB-CB 3.76Å; C145-C531 WeakPolarHBondContact SG-CB 3.31Å; C531-L533 VanDerWaalsContact C-N 3.25Å; C531-L533 PolarHBondContact O-N 2.82Å
532	H	52.6	Low	64.3	Low	105 Å²	105	74.8 Å²	74.8	49%	0.486	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-79.1	5.1	-175.8	-55	-69.8	0	0	0	114.6	K142 D143 G530	K142-H532 PolarHBondContact O-CE1 3.16Å; K142-H532 PolarHBondContact O-ND1 3.36Å; D143-H532 PolarHBondContact O-CE1 3.41Å; G530-H532 PolarHBondContact O-N 3.04Å; G530-H532 VanDerWaalsContact O-N 3.09Å
533	L	50.3	Low	63.2	Low	36 Å²	36	77.3 Å²	77.3	19%	0.188	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-103.9	-10.6	-168.2	-69.2	156.1	0	0	0	114.9	D508 K528 C531 I535	D508-L533 HydrophobicContact CB-CB 4.45Å; D508-L533 HydrophobicContact CB-CD1 3.77Å; D508-L533 HydrophobicContact CB-CD2 4.5Å; D508-L533 HydrophobicContact CB-CG 4.45Å; K528-L533 HydrophobicContact CB-CD1 3.64Å; K528-L533 HydrophobicContact CB-CD2 4.16Å; K528-L533 HydrophobicContact CD-CD2 3.96Å; K528-L533 VanDerWaalsContact O-CD1 3.27Å; K528-L533 WeakPolarHBondContact O-CD1 3.36Å; C531-L533 VanDerWaalsContact C-N 3.25Å; C531-L533 PolarHBondContact O-N 2.82Å; L533-I535 VanDerWaalsContact C-N 3.29Å; L533-I535 PolarHBondContact O-N 3Å
534	D	51.3	Low	62.3	Low	64 Å²	64	74.4 Å²	74.4	34%	0.342	38%	0.377	S	S	.	.			trans	-78	82.8	171.8	-73.1	-38.1	0	0	0	109.4	K142 T490 R513 D536	K142-D534 WeakPolarHBondContact CE-O 3.49Å; T490-D534 HydrophobicContact CG2-CB 4.28Å; R513-D534 IonicContact NH2-OD1 3.73Å; D534-D536 VanDerWaalsContact C-N 3.32Å; D534-D536 PolarHBondContact O-N 3.48Å
535	I	51.6	Low	61.4	Low	57 Å²	57	75.4 Å²	75.4	29%	0.292	39%	0.386	S	S	.	.			trans	-81.3	77.9	-179	-57.4	175.2	0	0	0	109.4	L533 E537	L533-I535 VanDerWaalsContact C-N 3.29Å; L533-I535 PolarHBondContact O-N 3Å; I535-E537 HydrophobicContact CG2-CB 3.65Å; I535-E537 HydrophobicContact CG2-CG 3.53Å; I535-E537 PolarHBondContact O-N 3.34Å
536	D	51.5	Low	60.5	Low	66 Å²	66	75.3 Å²	75.3	35%	0.353	39%	0.388	S	S	.	.			trans	-83.6	48.1	160.8	-109.1	18.5	0	0	0	110.2	D534 E538 N539	D534-D536 VanDerWaalsContact C-N 3.32Å; D534-D536 PolarHBondContact O-N 3.48Å; D536-E538 VanDerWaalsContact C-N 3.26Å; D536-E538 PolarHBondContact O-N 3.45Å; D536-N539 HydrophobicContact CB-CB 4.48Å; D536-N539 PolarHBondContact O-N 3.33Å; D536-N539 PolarHBondContact OD2-ND2 3.43Å
537	E	49.4	Very low	60	Low	96 Å²	96	71 Å²	71	45%	0.449	37%	0.374	S	S	.	.	H	α-helix	trans	-62.2	-28.8	-176.1	-98.4	176.3	174	0	0	113.6	Y265 I535	Y265-E537 VanDerWaalsContact CE2-OE1 3.25Å; Y265-E537 WeakPolarHBondContact CE2-OE1 3.38Å; Y265-E537 PolarHBondContact OH-OE1 3.01Å; I535-E537 HydrophobicContact CG2-CB 3.65Å; I535-E537 HydrophobicContact CG2-CG 3.53Å; I535-E537 PolarHBondContact O-N 3.34Å
538	E	48.3	Very low	60.1	Low	159 Å²	159	72 Å²	72	74%	0.743	38%	0.376	S	S	*	.	H	α-helix	trans	-75.5	-27.4	179	-75.8	-176.1	146.6	0	0	113	D536	D536-E538 VanDerWaalsContact C-N 3.26Å; D536-E538 PolarHBondContact O-N 3.45Å
539	N	53.3	Low	60.2	Low	74 Å²	74	73.8 Å²	73.8	40%	0.396	39%	0.388	S	S	.	.	H	α-helix	trans	-79.4	-35.6	-177.6	-75.5	-25.9	0	0	0	112.1	D536 V541 L542 I543	D536-N539 HydrophobicContact CB-CB 4.48Å; D536-N539 PolarHBondContact O-N 3.33Å; D536-N539 PolarHBondContact OD2-ND2 3.43Å; N539-V541 PolarHBondContact O-N 3.32Å; N539-L542 PolarHBondContact O-N 3.31Å; N539-I543 HydrophobicContact CB-CD1 4.48Å; N539-I543 WeakPolarHBondContact O-CD1 3.47Å; N539-I543 WeakPolarHBondContact O-CG1 3.34Å; N539-I543 PolarHBondContact O-N 3.47Å
540	D	59.4	Low	60.5	Low	25 Å²	25	67 Å²	67	13%	0.134	37%	0.368	C	S	.	.	H	α-helix	trans	-61.3	-42.8	-176.1	-72.2	-24.2	0	0	0	111.9	K142 I543 Y544	K142-D540 IonicContact NZ-OD2 2.82Å; K142-D540 PolarHBondContact NZ-OD2 3.05Å; D540-I543 PolarHBondContact O-N 2.98Å; D540-Y544 HydrophobicContact CB-CE2 4.14Å; D540-Y544 WeakPolarHBondContact O-CD2 3.32Å; D540-Y544 VanDerWaalsContact O-CE2 3.27Å; D540-Y544 WeakPolarHBondContact O-CE2 3.27Å; D540-Y544 VanDerWaalsContact O-CG 3.28Å; D540-Y544 PolarHBondContact O-N 2.94Å; D540-Y544 VanDerWaalsContact O-N 3.16Å
541	V	62.7	Low	61.4	Low	58 Å²	58	65.8 Å²	65.8	35%	0.352	36%	0.355	S	S	.	.	H	α-helix	trans	-66.7	-39.9	179	-179.2	0	0	0	0	111.8	P263 N539 Y544 L545	P263-V541 HydrophobicContact CB-CG2 4.48Å; P263-V541 HydrophobicContact CG-CG2 4.29Å; N539-V541 PolarHBondContact O-N 3.32Å; V541-Y544 PolarHBondContact O-N 2.92Å; V541-L545 PolarHBondContact O-N 3.05Å; V541-L545 VanDerWaalsContact O-N 3.11Å
542	L	63.4	Low	62.4	Low	90 Å²	90	67.1 Å²	67.1	47%	0.471	36%	0.358	S	S	.	.	H	α-helix	trans	-66.7	-39.1	178	-173.4	64.7	0	0	0	111.2	N539 Y544 L545 V546	N539-L542 PolarHBondContact O-N 3.31Å; L542-Y544 PolarHBondContact O-N 3.44Å; L542-L545 PolarHBondContact O-N 3.34Å; L542-V546 HydrophobicContact CG-CG2 4.46Å; L542-V546 VanDerWaalsContact O-CG2 3.29Å; L542-V546 WeakPolarHBondContact O-CG2 3.46Å; L542-V546 PolarHBondContact O-N 3.32Å
543	I	66	Low	63.6	Low	79 Å²	79	63.8 Å²	63.8	41%	0.405	35%	0.349	S	S	.	.	H	α-helix	trans	-59.6	-46.3	175.7	-69	162.4	0	0	0	110.4	N539 D540 L545 V546 S547	N539-I543 HydrophobicContact CB-CD1 4.48Å; N539-I543 WeakPolarHBondContact O-CD1 3.47Å; N539-I543 WeakPolarHBondContact O-CG1 3.34Å; N539-I543 PolarHBondContact O-N 3.47Å; D540-I543 PolarHBondContact O-N 2.98Å; I543-L545 VanDerWaalsContact C-N 3.34Å; I543-L545 PolarHBondContact O-N 3.19Å; I543-V546 PolarHBondContact O-N 3.36Å; I543-S547 PolarHBondContact O-N 3.26Å; I543-S547 PolarHBondContact O-OG 3.34Å
544	Y	71.1	Confident	65.2	Low	3 Å²	3	62.3 Å²	62.3	1%	0.012	34%	0.341	C	S	.	.	H	α-helix	trans	-62	-40.8	177.1	-56.5	-41	0	0	0	112.5	F135 A258 I262 D540 V541 L542 F548	F135-Y544 HydrophobicContact CB-CE1 4.13Å; F135-Y544 AromaticContact CD1-CD1 3.43Å; F135-Y544 HydrophobicContact CD1-CD1 3.43Å; F135-Y544 VanDerWaalsContact CD1-CD1 3.43Å; F135-Y544 AromaticContact CD1-CE1 3.75Å; F135-Y544 HydrophobicContact CD1-CE1 3.75Å; F135-Y544 AromaticContact CE1-CD1 3.96Å; F135-Y544 HydrophobicContact CE1-CD1 3.96Å; F135-Y544 HydrophobicContact CG-CD1 4.31Å; F135-Y544 HydrophobicContact CG-CE1 4.37Å; F135-Y544 PolarHBondContact O-OH 3.21Å; A258-Y544 HydrophobicContact CB-CD1 4.39Å; I262-Y544 HydrophobicContact CB-CE2 4.47Å; I262-Y544 HydrophobicContact CD1-CE1 4.39Å; I262-Y544 HydrophobicContact CG2-CE2 4.39Å; D540-Y544 HydrophobicContact CB-CE2 4.14Å; D540-Y544 WeakPolarHBondContact O-CD2 3.32Å; D540-Y544 VanDerWaalsContact O-CE2 3.27Å; D540-Y544 WeakPolarHBondContact O-CE2 3.27Å; D540-Y544 VanDerWaalsContact O-CG 3.28Å; D540-Y544 PolarHBondContact O-N 2.94Å; D540-Y544 VanDerWaalsContact O-N 3.16Å; V541-Y544 PolarHBondContact O-N 2.92Å; L542-Y544 PolarHBondContact O-N 3.44Å; Y544-F548 WeakPolarHBondContact O-CB 3.45Å; Y544-F548 PolarHBondContact O-N 3.22Å
545	L	68.8	Low	66.8	Low	90 Å²	90	61.1 Å²	61.1	47%	0.471	34%	0.335	S	S	.	.	H	α-helix	trans	-66.2	-41.8	177.8	-176	67.7	0	0	0	112.1	V541 L542 I543 F548 L549	V541-L545 PolarHBondContact O-N 3.05Å; V541-L545 VanDerWaalsContact O-N 3.11Å; L542-L545 PolarHBondContact O-N 3.34Å; I543-L545 VanDerWaalsContact C-N 3.34Å; I543-L545 PolarHBondContact O-N 3.19Å; L545-F548 WeakPolarHBondContact O-CB 3.23Å; L545-F548 PolarHBondContact O-N 2.95Å; L545-L549 HydrophobicContact CG-CD1 4.44Å; L545-L549 WeakPolarHBondContact O-CG 3.38Å; L545-L549 PolarHBondContact O-N 3.1Å
546	V	68.1	Low	68.5	Low	83 Å²	83	61.8 Å²	61.8	50%	0.503	34%	0.342	S	S	.	.	H	α-helix	trans	-65.2	-43.3	177.7	171.1	0	0	0	0	110.9	L542 I543 F548 L549 G550	L542-V546 HydrophobicContact CG-CG2 4.46Å; L542-V546 VanDerWaalsContact O-CG2 3.29Å; L542-V546 WeakPolarHBondContact O-CG2 3.46Å; L542-V546 PolarHBondContact O-N 3.32Å; I543-V546 PolarHBondContact O-N 3.36Å; V546-F548 VanDerWaalsContact C-N 3.33Å; V546-F548 PolarHBondContact O-N 2.99Å; V546-L549 PolarHBondContact O-N 3.49Å; V546-G550 PolarHBondContact O-N 2.93Å
547	S	70	Confident	70.1	Confident	49 Å²	49	59.1 Å²	59.1	34%	0.343	33%	0.331	S	S	.	.	H	α-helix	trans	-63.4	-36.9	174.5	-71.2	0	0	0	0	113	I543 G550 S551	I543-S547 PolarHBondContact O-N 3.26Å; I543-S547 PolarHBondContact O-OG 3.34Å; S547-G550 PolarHBondContact O-N 3.46Å; S547-S551 PolarHBondContact O-N 3.06Å; S547-S551 PolarHBondContact O-OG 2.87Å
548	F	75.2	Confident	71.9	Confident	62 Å²	62	54.6 Å²	54.6	27%	0.272	31%	0.31	S	S	.	.	H	α-helix	trans	-62	-48.5	173.1	173.8	-94.8	0	0	0	111.4	I252 Y544 L545 V546 G550 S551 L552	I252-F548 HydrophobicContact CG2-CD2 4.27Å; I252-F548 HydrophobicContact CG2-CE2 3.77Å; Y544-F548 WeakPolarHBondContact O-CB 3.45Å; Y544-F548 PolarHBondContact O-N 3.22Å; L545-F548 WeakPolarHBondContact O-CB 3.23Å; L545-F548 PolarHBondContact O-N 2.95Å; V546-F548 VanDerWaalsContact C-N 3.33Å; V546-F548 PolarHBondContact O-N 2.99Å; F548-G550 VanDerWaalsContact C-N 3.32Å; F548-G550 PolarHBondContact O-N 3.2Å; F548-S551 PolarHBondContact O-N 2.96Å; F548-L552 HydrophobicContact CE1-CD2 4.4Å; F548-L552 WeakPolarHBondContact O-CB 3.37Å; F548-L552 PolarHBondContact O-N 2.87Å
549	L	71.3	Confident	73.9	Confident	93 Å²	93	50.4 Å²	50.4	49%	0.487	29%	0.292	S	S	.	.	H	α-helix	trans	-62.3	-39.2	177.3	-71.1	172.3	0	0	0	112	L545 V546 L552 A553	L545-L549 HydrophobicContact CG-CD1 4.44Å; L545-L549 WeakPolarHBondContact O-CG 3.38Å; L545-L549 PolarHBondContact O-N 3.1Å; V546-L549 PolarHBondContact O-N 3.49Å; L549-L552 PolarHBondContact O-N 3.29Å; L549-A553 WeakPolarHBondContact O-CB 3.48Å; L549-A553 PolarHBondContact O-N 3.33Å
550	G	70.4	Confident	75.5	Confident	35 Å²	35	51.4 Å²	51.4	36%	0.361	30%	0.296	S	S	.	.	H	α-helix	trans	-61.5	-44.8	174.6	0	0	0	0	0	112.5	V546 S547 F548 L552 A553	V546-G550 PolarHBondContact O-N 2.93Å; S547-G550 PolarHBondContact O-N 3.46Å; F548-G550 VanDerWaalsContact C-N 3.32Å; F548-G550 PolarHBondContact O-N 3.2Å; G550-L552 VanDerWaalsContact C-N 3.32Å; G550-L552 PolarHBondContact O-N 3.19Å; G550-A553 PolarHBondContact O-N 3.3Å
551	S	76.2	Confident	76.7	Confident	9 Å²	9	50.3 Å²	50.3	6%	0.063	29%	0.291	C	S	.	.	H	α-helix	trans	-65.5	-36.6	176.1	-58.3	0	0	0	0	112	S547 F548 V554	S547-S551 PolarHBondContact O-N 3.06Å; S547-S551 PolarHBondContact O-OG 2.87Å; F548-S551 PolarHBondContact O-N 2.96Å; S551-V554 PolarHBondContact O-N 2.76Å
552	L	80.5	Confident	77.8	Confident	77 Å²	77	47.6 Å²	47.6	40%	0.403	27%	0.274	S	S	.	.	H	α-helix	trans	-66.8	-38.1	176.4	-171.7	66.6	0	0	0	112	F548 L549 G550 V554 L555 P556	F548-L552 HydrophobicContact CE1-CD2 4.4Å; F548-L552 WeakPolarHBondContact O-CB 3.37Å; F548-L552 PolarHBondContact O-N 2.87Å; L549-L552 PolarHBondContact O-N 3.29Å; G550-L552 VanDerWaalsContact C-N 3.32Å; G550-L552 PolarHBondContact O-N 3.19Å; L552-V554 PolarHBondContact O-N 3.47Å; L552-L555 HydrophobicContact CD1-CD1 4.05Å; L552-L555 PolarHBondContact O-N 3.47Å; L552-P556 WeakPolarHBondContact O-CD 3.31Å
553	A	77.4	Confident	78.9	Confident	34 Å²	34	47.8 Å²	47.8	28%	0.281	28%	0.275	S	S	.	.	H	α-helix	trans	-64.3	-19.6	178.5	0	0	0	0	0	113.5	L549 G550 P556	L549-A553 WeakPolarHBondContact O-CB 3.48Å; L549-A553 PolarHBondContact O-N 3.33Å; G550-A553 PolarHBondContact O-N 3.3Å; A553-P556 WeakPolarHBondContact O-CD 3.47Å
554	V	83.8	Confident	79.8	Confident	6 Å²	6	48.4 Å²	48.4	4%	0.036	28%	0.275	C	S	.	.	H	α-helix	trans	-80.3	-28.4	177.9	171.9	0	0	0	0	112.8	M248 S551 L552 G557 N558 C605 V609	M248-V554 HydrophobicContact CE-CG1 3.81Å; M248-V554 HydrophobicContact CG-CG1 3.72Å; M248-V554 HydrophobicContact SD-CB 4.09Å; M248-V554 HydrophobicContact SD-CG1 3.45Å; M248-V554 WeakPolarHBondContact SD-CG1 3.38Å; S551-V554 PolarHBondContact O-N 2.76Å; L552-V554 PolarHBondContact O-N 3.47Å; V554-G557 PolarHBondContact O-N 3.2Å; V554-G557 VanDerWaalsContact O-N 3.1Å; V554-N558 PolarHBondContact O-N 3.37Å; V554-C605 HydrophobicContact CG2-CB 4.13Å; V554-V609 HydrophobicContact CB-CG2 4.32Å; V554-V609 HydrophobicContact CG1-CB 3.87Å; V554-V609 HydrophobicContact CG1-CG1 3.72Å; V554-V609 HydrophobicContact CG1-CG2 3.23Å; V554-V609 HydrophobicContact CG2-CG2 4.23Å
555	L	85.4	Confident	80.3	Confident	39 Å²	39	48.2 Å²	48.2	20%	0.204	27%	0.274	C	S	.	.	H	α-helix	trans	-58.1	-43.7	-176.4	-68.2	-176.2	0	0	0	114.4	M248 I252 L552 G557 N558 I559	M248-L555 HydrophobicContact CB-CD2 3.89Å; I252-L555 HydrophobicContact CD1-CD1 3.68Å; I252-L555 HydrophobicContact CD1-CD2 4.36Å; I252-L555 HydrophobicContact CD1-CG 4.09Å; L552-L555 HydrophobicContact CD1-CD1 4.05Å; L552-L555 PolarHBondContact O-N 3.47Å; L555-G557 VanDerWaalsContact C-N 3.26Å; L555-G557 PolarHBondContact O-N 2.9Å; L555-N558 WeakPolarHBondContact O-CB 3.41Å; L555-N558 PolarHBondContact O-N 3.39Å; L555-I559 WeakPolarHBondContact O-CG1 3.27Å; L555-I559 PolarHBondContact O-N 2.75Å
556	P	87	Confident	80.8	Confident	70 Å²	70	46.6 Å²	46.6	46%	0.455	26%	0.264	S	S	.	.	H	α-helix	trans	-58	-39.3	175.9	-24.7	34.7	0	0	0	112.6	L552 A553 N558 I559 I560	L552-P556 WeakPolarHBondContact O-CD 3.31Å; A553-P556 WeakPolarHBondContact O-CD 3.47Å; P556-N558 PolarHBondContact O-N 3.46Å; P556-I559 PolarHBondContact O-N 2.92Å; P556-I560 WeakPolarHBondContact O-CB 3.27Å; P556-I560 WeakPolarHBondContact O-CD1 3.36Å; P556-I560 WeakPolarHBondContact O-CG1 3.32Å; P556-I560 PolarHBondContact O-N 3.48Å
557	G	84.9	Confident	81.4	Confident	11 Å²	11	50.1 Å²	50.1	11%	0.113	27%	0.273	C	S	.	.	H	α-helix	trans	-60.6	-44.2	176.8	0	0	0	0	0	112.3	V554 L555 S561 G606	V554-G557 PolarHBondContact O-N 3.2Å; V554-G557 VanDerWaalsContact O-N 3.1Å; L555-G557 VanDerWaalsContact C-N 3.26Å; L555-G557 PolarHBondContact O-N 2.9Å; G557-S561 WeakPolarHBondContact O-CB 3.29Å; G557-S561 PolarHBondContact O-N 3.03Å; G557-S561 PolarHBondContact O-OG 3.39Å; G557-G606 WeakPolarHBondContact CA-O 3.46Å
558	N	87.6	Confident	82	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-59.6	-50.5	174.2	-89	-31.9	0	0	0	112.5	M245 M248 V554 L555 P556 I560 S561 A562 V609 N613	M245-N558 HydrophobicContact CG-CB 3.82Å; M248-N558 VanDerWaalsContact CG-ND2 3.29Å; M248-N558 WeakPolarHBondContact CG-ND2 3.36Å; V554-N558 PolarHBondContact O-N 3.37Å; L555-N558 WeakPolarHBondContact O-CB 3.41Å; L555-N558 PolarHBondContact O-N 3.39Å; P556-N558 PolarHBondContact O-N 3.46Å; N558-I560 VanDerWaalsContact C-N 3.34Å; N558-I560 PolarHBondContact O-N 2.95Å; N558-S561 PolarHBondContact O-N 3.49Å; N558-S561 PolarHBondContact O-OG 2.89Å; N558-A562 PolarHBondContact O-N 2.86Å; N558-V609 HydrophobicContact CB-CG1 4.33Å; N558-V609 VanDerWaalsContact CG-CG1 3.41Å; N558-V609 WeakPolarHBondContact OD1-CG1 3.33Å; N558-N613 PolarHBondContact OD1-ND2 2.82Å; N558-N613 PolarHBondContact OD1-OD1 3.05Å
559	I	89.4	Confident	82.3	Confident	71 Å²	71	48.3 Å²	48.3	36%	0.364	26%	0.262	S	S	.	.	H	α-helix	trans	-60.1	-46.7	-178.6	-65	165.6	0	0	0	110.4	W242 M245 L555 P556 S561 A562 L563	W242-I559 HydrophobicContact CH2-CG2 4.17Å; W242-I559 HydrophobicContact CZ3-CG1 4.08Å; W242-I559 HydrophobicContact CZ3-CG2 4.49Å; M245-I559 HydrophobicContact SD-CG1 4.15Å; L555-I559 WeakPolarHBondContact O-CG1 3.27Å; L555-I559 PolarHBondContact O-N 2.75Å; P556-I559 PolarHBondContact O-N 2.92Å; I559-S561 VanDerWaalsContact C-N 3.34Å; I559-S561 PolarHBondContact O-N 3.18Å; I559-A562 PolarHBondContact O-N 3.11Å; I559-L563 HydrophobicContact CG2-CD1 3.9Å; I559-L563 HydrophobicContact CG2-CG 4.45Å; I559-L563 VanDerWaalsContact O-CG 3.3Å; I559-L563 WeakPolarHBondContact O-CG 3.27Å; I559-L563 PolarHBondContact O-N 3.18Å
560	I	87.1	Confident	83	Confident	95 Å²	95	44 Å²	44	49%	0.487	24%	0.239	S	C	.	.	H	α-helix	trans	-59.8	-47.3	177.4	-68.6	167.2	0	0	0	109.8	P556 N558 A562 L563 F564	P556-I560 WeakPolarHBondContact O-CB 3.27Å; P556-I560 WeakPolarHBondContact O-CD1 3.36Å; P556-I560 WeakPolarHBondContact O-CG1 3.32Å; P556-I560 PolarHBondContact O-N 3.48Å; N558-I560 VanDerWaalsContact C-N 3.34Å; N558-I560 PolarHBondContact O-N 2.95Å; I560-A562 PolarHBondContact O-N 3.32Å; I560-L563 PolarHBondContact O-N 3.32Å; I560-F564 HydrophobicContact CG2-CD2 3.75Å; I560-F564 HydrophobicContact CG2-CE2 4.11Å; I560-F564 WeakPolarHBondContact O-CB 3.18Å; I560-F564 VanDerWaalsContact O-CD2 3.27Å; I560-F564 WeakPolarHBondContact O-CD2 3.4Å; I560-F564 PolarHBondContact O-N 3.21Å
561	S	85.4	Confident	83.9	Confident	3 Å²	3	42.7 Å²	42.7	2%	0.021	22%	0.224	C	C	.	.	H	α-helix	trans	-61.2	-42.4	180	72.5	0	0	0	0	112.5	S241 G557 N558 I559 F564 M565 N613	S241-S561 PolarHBondContact OG-OG 3.4Å; G557-S561 WeakPolarHBondContact O-CB 3.29Å; G557-S561 PolarHBondContact O-N 3.03Å; G557-S561 PolarHBondContact O-OG 3.39Å; N558-S561 PolarHBondContact O-N 3.49Å; N558-S561 PolarHBondContact O-OG 2.89Å; I559-S561 VanDerWaalsContact C-N 3.34Å; I559-S561 PolarHBondContact O-N 3.18Å; S561-F564 PolarHBondContact O-N 2.69Å; S561-M565 VanDerWaalsContact O-CB 3.3Å; S561-M565 WeakPolarHBondContact O-CB 3.37Å; S561-M565 PolarHBondContact O-N 2.89Å; S561-N613 PolarHBondContact OG-ND2 2.95Å
562	A	84.9	Confident	84.6	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62.7	-46.3	178.9	0	0	0	0	0	111.5	S241 W242 N558 I559 I560 F564 M565	S241-A562 WeakPolarHBondContact OG-CA 3.31Å; S241-A562 PolarHBondContact OG-N 3.31Å; W242-A562 HydrophobicContact CD2-CB 3.79Å; W242-A562 HydrophobicContact CE3-CB 3.96Å; W242-A562 HydrophobicContact CG-CB 4.21Å; W242-A562 HydrophobicContact CZ2-CB 4.36Å; W242-A562 HydrophobicContact CZ3-CB 4.42Å; N558-A562 PolarHBondContact O-N 2.86Å; I559-A562 PolarHBondContact O-N 3.11Å; I560-A562 PolarHBondContact O-N 3.32Å; A562-F564 VanDerWaalsContact C-N 3.35Å; A562-F564 PolarHBondContact O-N 3.18Å; A562-M565 PolarHBondContact O-N 2.89Å
563	L	86.5	Confident	85.1	Confident	95 Å²	95	45.2 Å²	45.2	50%	0.497	23%	0.231	S	C	.	.	H	α-helix	trans	-66.9	-32.8	-179.9	-67.8	174.2	0	0	0	113.4	W242 I559 I560	W242-L563 HydrophobicContact CZ2-CD2 4.19Å; I559-L563 HydrophobicContact CG2-CD1 3.9Å; I559-L563 HydrophobicContact CG2-CG 4.45Å; I559-L563 VanDerWaalsContact O-CG 3.3Å; I559-L563 WeakPolarHBondContact O-CG 3.27Å; I559-L563 PolarHBondContact O-N 3.18Å; I560-L563 PolarHBondContact O-N 3.32Å
564	F	85.3	Confident	85.8	Confident	91 Å²	91	43.6 Å²	43.6	40%	0.399	22%	0.218	S	C	.	.	H	α-helix	trans	-93.6	-11	-178.5	-77.7	-75.7	0	0	0	113.9	I560 S561 A562 E566 K567 I568	I560-F564 HydrophobicContact CG2-CD2 3.75Å; I560-F564 HydrophobicContact CG2-CE2 4.11Å; I560-F564 WeakPolarHBondContact O-CB 3.18Å; I560-F564 VanDerWaalsContact O-CD2 3.27Å; I560-F564 WeakPolarHBondContact O-CD2 3.4Å; I560-F564 PolarHBondContact O-N 3.21Å; S561-F564 PolarHBondContact O-N 2.69Å; A562-F564 VanDerWaalsContact C-N 3.35Å; A562-F564 PolarHBondContact O-N 3.18Å; F564-E566 PolarHBondContact O-N 3.39Å; F564-K567 PolarHBondContact O-N 3.33Å; F564-I568 HydrophobicContact CB-CD1 3.85Å; F564-I568 HydrophobicContact CB-CG1 4.22Å; F564-I568 HydrophobicContact CD1-CD1 3.67Å; F564-I568 HydrophobicContact CD1-CG1 4.01Å; F564-I568 HydrophobicContact CG-CD1 3.98Å; F564-I568 PolarHBondContact O-N 2.95Å
565	M	81.9	Confident	86.2	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-59.5	-35	-177.1	-165.8	142.9	-76.4	0	0	113.4	S561 A562 R570 I573 N613 V617	S561-M565 VanDerWaalsContact O-CB 3.3Å; S561-M565 WeakPolarHBondContact O-CB 3.37Å; S561-M565 PolarHBondContact O-N 2.89Å; A562-M565 PolarHBondContact O-N 2.89Å; M565-R570 HydrophobicContact CG-CG 4.02Å; M565-R570 HydrophobicContact SD-CG 4.32Å; M565-I573 VanDerWaalsContact CA-CD1 3.42Å; M565-I573 HydrophobicContact CB-CD1 4.22Å; M565-I573 HydrophobicContact CE-CD1 4.15Å; M565-I573 HydrophobicContact CE-CG2 4.26Å; M565-I573 HydrophobicContact CG-CD1 4.47Å; M565-N613 HydrophobicContact CE-CB 4.45Å; M565-V617 HydrophobicContact SD-CB 4.13Å; M565-V617 HydrophobicContact SD-CG1 4.24Å; M565-V617 HydrophobicContact SD-CG2 3.8Å
566	E	78.6	Confident	86.6	Confident	55 Å²	55	46.1 Å²	46.1	26%	0.257	23%	0.231	S	C	.	.	H	α-helix	trans	-78.4	-34.3	174.6	-62.4	-167.7	163.8	0	0	112.5	D234 K235 E238 F564 R683	D234-E566 VanDerWaalsContact O-OE1 3.12Å; K235-E566 WeakPolarHBondContact CA-OE1 3.48Å; E238-E566 HydrophobicContact CB-CG 4.03Å; E238-E566 WeakPolarHBondContact CB-OE1 3.42Å; F564-E566 PolarHBondContact O-N 3.39Å; E566-R683 PolarHBondContact O-NE 3.21Å; E566-R683 VanDerWaalsContact O-NE 3.11Å; E566-R683 PolarHBondContact O-NH1 3.24Å; E566-R683 PolarHBondContact O-NH2 2.77Å
567	K	80.6	Confident	86.9	Confident	158 Å²	158	43.1 Å²	43.1	69%	0.687	21%	0.211	S	C	*	.	H	α-helix	trans	-80.4	-48	-174.1	-68.6	-177.1	-177.9	177.1	0	113.3	F564 R683	F564-K567 PolarHBondContact O-N 3.33Å; K567-R683 PolarHBondContact O-NH1 3.22Å
568	I	81.9	Confident	87.4	Confident	70 Å²	70	42.6 Å²	42.6	36%	0.359	21%	0.206	S	C	.	.	H	α-helix	trans	-86.7	-27.4	-169.7	-61	-178.5	0	0	0	111.5	F564 K572 I573	F564-I568 HydrophobicContact CB-CD1 3.85Å; F564-I568 HydrophobicContact CB-CG1 4.22Å; F564-I568 HydrophobicContact CD1-CD1 3.67Å; F564-I568 HydrophobicContact CD1-CG1 4.01Å; F564-I568 HydrophobicContact CG-CD1 3.98Å; F564-I568 PolarHBondContact O-N 2.95Å; I568-K572 HydrophobicContact CG2-CB 3.85Å; I568-K572 WeakPolarHBondContact O-CD 3.42Å; I568-I573 HydrophobicContact CB-CD1 4.25Å; I568-I573 HydrophobicContact CB-CG1 4.03Å; I568-I573 HydrophobicContact CG2-CG1 3.95Å
569	G	82.5	Confident	87.8	Confident	2 Å²	2	45.4 Å²	45.4	2%	0.021	22%	0.221	C	C	.	.			trans	92.5	154.4	-171.5	0	0	0	0	0	112.1	I573	G569-I573 WeakPolarHBondContact O-CD1 3.31Å; G569-I573 VanDerWaalsContact O-CG1 3.3Å; G569-I573 WeakPolarHBondContact O-CG1 3.46Å; G569-I573 PolarHBondContact O-N 3.05Å
570	R	86.2	Confident	88	Confident	3 Å²	3	45.7 Å²	45.7	1%	0.011	22%	0.222	C	C	.	.	H	α-helix	trans	-74.2	-46.5	-168.1	-71.9	82.8	-161.9	-163.5	5.1	110.5	M565 K572 I573 I574 V617 E681 R683	M565-R570 HydrophobicContact CG-CG 4.02Å; M565-R570 HydrophobicContact SD-CG 4.32Å; R570-K572 PolarHBondContact O-N 2.89Å; R570-I573 PolarHBondContact O-N 3.09Å; R570-I574 WeakPolarHBondContact O-CG1 3.46Å; R570-I574 PolarHBondContact O-N 3.38Å; R570-I574 VanDerWaalsContact O-N 3.12Å; R570-V617 HydrophobicContact CG-CG1 4.13Å; R570-E681 PolarHBondContact N-OE1 2.89Å; R570-R683 VanDerWaalsContact NH1-CB 3.27Å; R570-R683 VanDerWaalsContact NH1-CG 3.33Å; R570-R683 PolarHBondContact NH1-O 3.38Å
571	V	88.9	Confident	88.3	Confident	8 Å²	8	41.2 Å²	41.2	5%	0.048	20%	0.199	C	C	.	.	H	α-helix	trans	-61.8	-43.6	-178	172.5	0	0	0	0	111.7	I574 G575 I618 A676 L679	V571-I574 PolarHBondContact O-N 2.93Å; V571-G575 PolarHBondContact O-N 2.96Å; V571-I618 HydrophobicContact CG2-CD1 3.59Å; V571-A676 WeakPolarHBondContact CG1-O 3.21Å; V571-L679 HydrophobicContact CG2-CB 4.05Å
572	K	90.5	Very high	88.8	Confident	125 Å²	125	41.2 Å²	41.2	54%	0.543	20%	0.199	S	C	.	.	H	α-helix	trans	-66.6	-38.5	179.5	-67.9	-174.9	-168.2	167	0	112.2	I568 R570 L576	I568-K572 HydrophobicContact CG2-CB 3.85Å; I568-K572 WeakPolarHBondContact O-CD 3.42Å; R570-K572 PolarHBondContact O-N 2.89Å; K572-L576 WeakPolarHBondContact O-CB 3.47Å; K572-L576 PolarHBondContact O-N 2.97Å
573	I	90.8	Very high	89.2	Confident	13 Å²	13	42.5 Å²	42.5	7%	0.067	21%	0.213	C	C	.	.	H	α-helix	trans	-61.9	-48	175.5	-73.2	169.9	0	0	0	110.2	M565 I568 G569 R570 S577 A610	M565-I573 VanDerWaalsContact CA-CD1 3.42Å; M565-I573 HydrophobicContact CB-CD1 4.22Å; M565-I573 HydrophobicContact CE-CD1 4.15Å; M565-I573 HydrophobicContact CE-CG2 4.26Å; M565-I573 HydrophobicContact CG-CD1 4.47Å; I568-I573 HydrophobicContact CB-CD1 4.25Å; I568-I573 HydrophobicContact CB-CG1 4.03Å; I568-I573 HydrophobicContact CG2-CG1 3.95Å; G569-I573 WeakPolarHBondContact O-CD1 3.31Å; G569-I573 VanDerWaalsContact O-CG1 3.3Å; G569-I573 WeakPolarHBondContact O-CG1 3.46Å; G569-I573 PolarHBondContact O-N 3.05Å; R570-I573 PolarHBondContact O-N 3.09Å; I573-S577 WeakPolarHBondContact O-CB 3.48Å; I573-S577 PolarHBondContact O-N 2.76Å; I573-S577 PolarHBondContact O-OG 3.12Å; I573-A610 HydrophobicContact CG2-CB 4.25Å
574	I	92.1	Very high	89.5	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-59	-54.3	178.2	-59.6	164.4	0	0	0	110.1	I401 R570 V571 L576 S577 M578 G614 I615 I618 A676	I401-I574 HydrophobicContact CG2-CG2 4.1Å; R570-I574 WeakPolarHBondContact O-CG1 3.46Å; R570-I574 PolarHBondContact O-N 3.38Å; R570-I574 VanDerWaalsContact O-N 3.12Å; V571-I574 PolarHBondContact O-N 2.93Å; I574-L576 PolarHBondContact O-N 3.38Å; I574-S577 PolarHBondContact O-OG 3.24Å; I574-S577 VanDerWaalsContact O-OG 3.1Å; I574-M578 HydrophobicContact CG2-CG 4.44Å; I574-M578 HydrophobicContact CG2-SD 3.81Å; I574-M578 WeakPolarHBondContact O-CB 3.39Å; I574-M578 VanDerWaalsContact O-CG 3.24Å; I574-M578 WeakPolarHBondContact O-CG 3.31Å; I574-M578 PolarHBondContact O-N 3.4Å; I574-G614 VanDerWaalsContact CD1-C 3.45Å; I574-I615 HydrophobicContact CD1-CG1 4.19Å; I574-I615 HydrophobicContact CG1-CG1 4.21Å; I574-I615 HydrophobicContact CG2-CD1 4.3Å; I574-I615 HydrophobicContact CG2-CG1 3.85Å; I574-I618 HydrophobicContact CD1-CB 4.34Å; I574-I618 HydrophobicContact CD1-CD1 4.39Å; I574-I618 HydrophobicContact CD1-CG2 3.76Å; I574-A676 HydrophobicContact CB-CB 4.24Å; I574-A676 HydrophobicContact CG2-CB 3.64Å
575	G	92.9	Very high	89.7	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-60.5	-48	-177.6	0	0	0	0	0	113.1	V571 L579	V571-G575 PolarHBondContact O-N 2.96Å; G575-L579 WeakPolarHBondContact O-CB 3.35Å; G575-L579 VanDerWaalsContact O-CG 3.23Å; G575-L579 WeakPolarHBondContact O-CG 3.29Å; G575-L579 PolarHBondContact O-N 2.78Å; G575-L579 VanDerWaalsContact O-N 3.09Å
576	L	93.3	Very high	90.1	Very high	97 Å²	97	38.7 Å²	38.7	51%	0.508	19%	0.193	S	C	.	.	H	α-helix	trans	-67.6	-44.5	-178.1	-177	62.8	0	0	0	111.9	K572 I574 L579 I580	K572-L576 WeakPolarHBondContact O-CB 3.47Å; K572-L576 PolarHBondContact O-N 2.97Å; I574-L576 PolarHBondContact O-N 3.38Å; L576-L579 PolarHBondContact O-N 3.29Å; L576-I580 HydrophobicContact CD1-CD1 3.92Å; L576-I580 HydrophobicContact CD1-CG1 4.18Å; L576-I580 HydrophobicContact CD2-CD1 4.38Å; L576-I580 HydrophobicContact CG-CD1 3.74Å; L576-I580 HydrophobicContact CG-CG1 4.37Å; L576-I580 WeakPolarHBondContact O-CB 3.33Å; L576-I580 VanDerWaalsContact O-CG1 3.26Å; L576-I580 WeakPolarHBondContact O-CG1 3.3Å; L576-I580 PolarHBondContact O-N 2.66Å
577	S	93.6	Very high	90.6	Very high	7 Å²	7	40.7 Å²	40.7	5%	0.049	20%	0.201	C	C	.	.	H	α-helix	trans	-65.8	-39.1	179.5	57.6	0	0	0	0	112.2	I573 I574 S581 V607 A611	I573-S577 WeakPolarHBondContact O-CB 3.48Å; I573-S577 PolarHBondContact O-N 2.76Å; I573-S577 PolarHBondContact O-OG 3.12Å; I574-S577 PolarHBondContact O-OG 3.24Å; I574-S577 VanDerWaalsContact O-OG 3.1Å; S577-S581 VanDerWaalsContact O-CB 3.26Å; S577-S581 WeakPolarHBondContact O-CB 3.42Å; S577-S581 PolarHBondContact O-N 2.93Å; S577-S581 PolarHBondContact O-OG 3.37Å; S577-V607 WeakPolarHBondContact O-CG1 3.5Å; S577-A611 VanDerWaalsContact OG-CA 3.26Å; S577-A611 WeakPolarHBondContact OG-CA 3.21Å; S577-A611 WeakPolarHBondContact OG-CB 3.38Å; S577-A611 PolarHBondContact OG-N 3.2Å
578	M	95.1	Very high	90.9	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-64.2	-41.3	174	-69.9	-177.3	80.6	0	0	112.1	I401 M405 I574 S581 A582 A611 L669	I401-M578 HydrophobicContact CG2-SD 4.05Å; M405-M578 HydrophobicContact CB-CE 4.09Å; M405-M578 HydrophobicContact SD-CE 4.21Å; M405-M578 HydrophobicContact SD-CG 4.14Å; I574-M578 HydrophobicContact CG2-CG 4.44Å; I574-M578 HydrophobicContact CG2-SD 3.81Å; I574-M578 WeakPolarHBondContact O-CB 3.39Å; I574-M578 VanDerWaalsContact O-CG 3.24Å; I574-M578 WeakPolarHBondContact O-CG 3.31Å; I574-M578 PolarHBondContact O-N 3.4Å; M578-S581 PolarHBondContact O-N 3.22Å; M578-A582 PolarHBondContact O-N 3.11Å; M578-A611 HydrophobicContact CG-CB 3.75Å; M578-L669 HydrophobicContact CE-CD2 4.21Å
579	L	95.5	Very high	91	Very high	59 Å²	59	33.7 Å²	33.7	31%	0.309	17%	0.168	S	C	.	.	H	α-helix	trans	-68.9	-40.5	177.8	-69.8	172.5	0	0	0	112.8	G575 L576 S581 A582 G583 V670	G575-L579 WeakPolarHBondContact O-CB 3.35Å; G575-L579 VanDerWaalsContact O-CG 3.23Å; G575-L579 WeakPolarHBondContact O-CG 3.29Å; G575-L579 PolarHBondContact O-N 2.78Å; G575-L579 VanDerWaalsContact O-N 3.09Å; L576-L579 PolarHBondContact O-N 3.29Å; L579-S581 VanDerWaalsContact C-N 3.33Å; L579-A582 WeakPolarHBondContact O-CB 3.22Å; L579-A582 PolarHBondContact O-N 3.26Å; L579-G583 PolarHBondContact O-N 3.43Å; L579-V670 HydrophobicContact CD2-CG1 4.4Å; L579-V670 HydrophobicContact CD2-CG2 4.38Å
580	I	94.7	Very high	91.1	Very high	78 Å²	78	38.2 Å²	38.2	40%	0.4	19%	0.192	S	C	.	.	H	α-helix	trans	-64.7	-41.4	174	-67	169.4	0	0	0	110	L576 A582 G583 C584 V607	L576-I580 HydrophobicContact CD1-CD1 3.92Å; L576-I580 HydrophobicContact CD1-CG1 4.18Å; L576-I580 HydrophobicContact CD2-CD1 4.38Å; L576-I580 HydrophobicContact CG-CD1 3.74Å; L576-I580 HydrophobicContact CG-CG1 4.37Å; L576-I580 WeakPolarHBondContact O-CB 3.33Å; L576-I580 VanDerWaalsContact O-CG1 3.26Å; L576-I580 WeakPolarHBondContact O-CG1 3.3Å; L576-I580 PolarHBondContact O-N 2.66Å; I580-A582 VanDerWaalsContact C-N 3.32Å; I580-A582 PolarHBondContact O-N 3.22Å; I580-G583 WeakPolarHBondContact O-CA 3.14Å; I580-G583 PolarHBondContact O-N 3.33Å; I580-G583 VanDerWaalsContact O-N 3.12Å; I580-C584 PolarHBondContact O-N 3.41Å; I580-C584 PolarHBondContact O-SG 3.25Å; I580-V607 HydrophobicContact CB-CG1 3.89Å; I580-V607 HydrophobicContact CG2-CB 4.46Å; I580-V607 HydrophobicContact CG2-CG1 3.77Å; I580-V607 HydrophobicContact CG2-CG2 4.09Å
581	S	94.3	Very high	91	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.3	-41.8	175.7	-59	0	0	0	0	111.2	S577 M578 L579 G583 C584 T585 V607 S608	S577-S581 VanDerWaalsContact O-CB 3.26Å; S577-S581 WeakPolarHBondContact O-CB 3.42Å; S577-S581 PolarHBondContact O-N 2.93Å; S577-S581 PolarHBondContact O-OG 3.37Å; M578-S581 PolarHBondContact O-N 3.22Å; L579-S581 VanDerWaalsContact C-N 3.33Å; S581-G583 VanDerWaalsContact C-N 3.33Å; S581-G583 PolarHBondContact O-N 3.29Å; S581-C584 WeakPolarHBondContact O-CB 3.22Å; S581-C584 PolarHBondContact O-N 2.84Å; S581-T585 WeakPolarHBondContact O-CG2 3.43Å; S581-T585 PolarHBondContact O-N 3.25Å; S581-V607 WeakPolarHBondContact OG-CG1 3.47Å; S581-S608 PolarHBondContact OG-N 3.15Å; S581-S608 PolarHBondContact OG-OG 3.24Å
582	A	95.1	Very high	90.4	Very high	3 Å²	3	46.3 Å²	46.3	3%	0.025	23%	0.228	C	C	.	.	H	α-helix	trans	-59.4	-43	172.7	0	0	0	0	0	112	M578 L579 I580 C584 T585 F586 L669 V670	M578-A582 PolarHBondContact O-N 3.11Å; L579-A582 WeakPolarHBondContact O-CB 3.22Å; L579-A582 PolarHBondContact O-N 3.26Å; I580-A582 VanDerWaalsContact C-N 3.32Å; I580-A582 PolarHBondContact O-N 3.22Å; A582-C584 PolarHBondContact O-N 3.02Å; A582-T585 WeakPolarHBondContact CA-OG1 3.08Å; A582-T585 PolarHBondContact O-N 2.95Å; A582-T585 PolarHBondContact O-OG1 2.96Å; A582-F586 PolarHBondContact O-N 3.24Å; A582-L669 HydrophobicContact CB-CB 3.77Å; A582-L669 HydrophobicContact CB-CD1 4.49Å; A582-V670 HydrophobicContact CB-CG2 3.67Å
583	G	93.6	Very high	90	Very high	27 Å²	27	43.6 Å²	43.6	28%	0.278	22%	0.224	S	C	.	.	H	α-helix	trans	-57.5	-45.4	173.1	0	0	0	0	0	112.7	L579 I580 S581 T585 F586 F587	L579-G583 PolarHBondContact O-N 3.43Å; I580-G583 WeakPolarHBondContact O-CA 3.14Å; I580-G583 PolarHBondContact O-N 3.33Å; I580-G583 VanDerWaalsContact O-N 3.12Å; S581-G583 VanDerWaalsContact C-N 3.33Å; S581-G583 PolarHBondContact O-N 3.29Å; G583-T585 VanDerWaalsContact C-N 3.33Å; G583-T585 PolarHBondContact O-N 2.9Å; G583-F586 WeakPolarHBondContact O-CB 3.41Å; G583-F586 PolarHBondContact O-N 3.4Å; G583-F586 VanDerWaalsContact O-N 3.15Å; G583-F587 WeakPolarHBondContact O-CD2 3.43Å; G583-F587 PolarHBondContact O-N 2.92Å
584	C	92	Very high	89.5	Confident	6 Å²	6	46 Å²	46	4%	0.041	24%	0.235	C	C	.	.	H	α-helix	trans	-60.2	-43.3	175.8	-59.3	0	0	0	0	111.3	I580 S581 A582 F586 F587 L588 W600 L603 F604	I580-C584 PolarHBondContact O-N 3.41Å; I580-C584 PolarHBondContact O-SG 3.25Å; S581-C584 WeakPolarHBondContact O-CB 3.22Å; S581-C584 PolarHBondContact O-N 2.84Å; A582-C584 PolarHBondContact O-N 3.02Å; C584-F586 VanDerWaalsContact C-N 3.33Å; C584-F586 PolarHBondContact O-N 2.73Å; C584-F587 PolarHBondContact O-N 2.64Å; C584-L588 PolarHBondContact O-N 3.16Å; C584-W600 HydrophobicContact CB-CE3 4.13Å; C584-W600 HydrophobicContact CB-CZ3 4.46Å; C584-L603 WeakPolarHBondContact SG-CD2 3.32Å; C584-F604 HydrophobicContact CB-CB 4.28Å
585	T	90.4	Very high	89.1	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.006	26%	0.262	C	S	.	.	H	α-helix	trans	-64.8	-36.4	175.5	63	0	0	0	0	112.6	L412 S581 A582 G583 F587 L588 F604 I662 C666 L669	L412-T585 HydrophobicContact CD1-CG2 3.49Å; L412-T585 VanDerWaalsContact CD1-CG2 3.49Å; S581-T585 WeakPolarHBondContact O-CG2 3.43Å; S581-T585 PolarHBondContact O-N 3.25Å; A582-T585 WeakPolarHBondContact CA-OG1 3.08Å; A582-T585 PolarHBondContact O-N 2.95Å; A582-T585 PolarHBondContact O-OG1 2.96Å; G583-T585 VanDerWaalsContact C-N 3.33Å; G583-T585 PolarHBondContact O-N 2.9Å; T585-F587 VanDerWaalsContact C-N 3.35Å; T585-F587 PolarHBondContact O-N 2.89Å; T585-L588 WeakPolarHBondContact O-CB 3.25Å; T585-L588 PolarHBondContact O-N 3.29Å; T585-F604 HydrophobicContact CG2-CD2 3.6Å; T585-F604 HydrophobicContact CG2-CE2 3.74Å; T585-F604 HydrophobicContact CG2-CG 4.39Å; T585-I662 WeakPolarHBondContact O-CG2 3.46Å; T585-C666 WeakPolarHBondContact OG1-CB 3.43Å; T585-L669 HydrophobicContact CG2-CD1 4.14Å
586	F	90.4	Very high	88.7	Confident	100 Å²	100	50.8 Å²	50.8	44%	0.439	28%	0.275	S	S	.	.	H	α-helix	trans	-64.5	-39	175	-177	-98.4	0	0	0	111.9	A582 G583 C584 L588 F589	A582-F586 PolarHBondContact O-N 3.24Å; G583-F586 WeakPolarHBondContact O-CB 3.41Å; G583-F586 PolarHBondContact O-N 3.4Å; G583-F586 VanDerWaalsContact O-N 3.15Å; C584-F586 VanDerWaalsContact C-N 3.33Å; C584-F586 PolarHBondContact O-N 2.73Å; F586-L588 VanDerWaalsContact C-N 3.29Å; F586-L588 PolarHBondContact O-N 3.37Å; F586-F589 WeakPolarHBondContact O-CB 3.43Å; F586-F589 PolarHBondContact O-N 3.45Å; F586-F589 VanDerWaalsContact O-N 3.15Å
587	F	89.3	Confident	88.2	Confident	96 Å²	96	46.8 Å²	46.8	42%	0.421	25%	0.253	S	S	.	.	H	α-helix	trans	-70.7	-21.9	176.3	-74.1	-68.1	0	0	0	114	G583 C584 T585 F589 L590 S591 W600	G583-F587 WeakPolarHBondContact O-CD2 3.43Å; G583-F587 PolarHBondContact O-N 2.92Å; C584-F587 PolarHBondContact O-N 2.64Å; T585-F587 VanDerWaalsContact C-N 3.35Å; T585-F587 PolarHBondContact O-N 2.89Å; F587-F589 PolarHBondContact O-N 2.86Å; F587-L590 HydrophobicContact CD1-CD1 4.22Å; F587-L590 PolarHBondContact O-N 3.43Å; F587-L590 VanDerWaalsContact O-N 3.15Å; F587-S591 PolarHBondContact O-N 2.93Å; F587-S591 PolarHBondContact O-OG 3.44Å; F587-S591 VanDerWaalsContact O-OG 3.13Å; F587-W600 HydrophobicContact CB-CD2 3.98Å; F587-W600 HydrophobicContact CB-CE3 4.15Å; F587-W600 HydrophobicContact CB-CH2 3.69Å; F587-W600 HydrophobicContact CB-CZ2 3.49Å; F587-W600 VanDerWaalsContact CB-CZ2 3.49Å; F587-W600 HydrophobicContact CB-CZ3 4.01Å; F587-W600 HydrophobicContact CD1-CZ2 4.41Å; F587-W600 AromaticContact CD2-CH2 3.72Å; F587-W600 HydrophobicContact CD2-CH2 3.72Å; F587-W600 HydrophobicContact CD2-CZ2 4.29Å; F587-W600 HydrophobicContact CD2-CZ3 4.07Å; F587-W600 AromaticContact CG-CH2 3.75Å; F587-W600 HydrophobicContact CG-CH2 3.75Å; F587-W600 AromaticContact CG-CZ2 3.84Å; F587-W600 HydrophobicContact CG-CZ2 3.84Å; F587-W600 HydrophobicContact CG-CZ3 4.32Å
588	L	85.9	Confident	87.7	Confident	6 Å²	6	49.6 Å²	49.6	3%	0.031	27%	0.267	C	S	.	.	H	α-helix	trans	-61	-30.9	169.2	-77.7	166.7	0	0	0	112.4	F416 C584 T585 F586 L590 S591 I597 W600 I662	F416-L588 HydrophobicContact CE1-CD1 3.41Å; F416-L588 VanDerWaalsContact CE1-CD1 3.41Å; F416-L588 HydrophobicContact CE1-CD2 4.1Å; F416-L588 HydrophobicContact CE1-CG 4.43Å; F416-L588 HydrophobicContact CZ-CD1 3.45Å; F416-L588 VanDerWaalsContact CZ-CD1 3.45Å; C584-L588 PolarHBondContact O-N 3.16Å; T585-L588 WeakPolarHBondContact O-CB 3.25Å; T585-L588 PolarHBondContact O-N 3.29Å; F586-L588 VanDerWaalsContact C-N 3.29Å; F586-L588 PolarHBondContact O-N 3.37Å; L588-L590 PolarHBondContact O-N 2.9Å; L588-S591 WeakPolarHBondContact O-CB 3.47Å; L588-S591 PolarHBondContact O-N 2.95Å; L588-I597 HydrophobicContact CD2-CB 4.47Å; L588-I597 HydrophobicContact CD2-CG2 4.29Å; L588-W600 HydrophobicContact CD1-CB 4.45Å; L588-W600 HydrophobicContact CD2-CB 3.4Å; L588-W600 HydrophobicContact CD2-CG 4.16Å; L588-W600 HydrophobicContact CG-CB 3.69Å; L588-W600 HydrophobicContact CG-CG 4.34Å; L588-I662 HydrophobicContact CB-CD1 4.1Å
589	F	84.2	Confident	87.3	Confident	75 Å²	75	52.5 Å²	52.5	33%	0.329	29%	0.292	S	S	.	.	H	α-helix	trans	-58.3	-35.8	175.9	178.3	-104	0	0	0	112.1	F586 F587 S591 V659 I662	F586-F589 WeakPolarHBondContact O-CB 3.43Å; F586-F589 PolarHBondContact O-N 3.45Å; F586-F589 VanDerWaalsContact O-N 3.15Å; F587-F589 PolarHBondContact O-N 2.86Å; F589-S591 VanDerWaalsContact C-N 3.31Å; F589-V659 HydrophobicContact CD2-CG1 4.25Å; F589-V659 HydrophobicContact CD2-CG2 4.27Å; F589-V659 HydrophobicContact CE2-CB 4.2Å; F589-V659 HydrophobicContact CE2-CG1 3.72Å; F589-V659 HydrophobicContact CE2-CG2 3.68Å; F589-I662 HydrophobicContact CB-CG2 4.18Å
590	L	84.9	Confident	86.9	Confident	98 Å²	98	53.2 Å²	53.2	51%	0.513	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-1.9	-179.2	-57.7	177.6	0	0	0	113.3	F587 L588 F592	F587-L590 HydrophobicContact CD1-CD1 4.22Å; F587-L590 PolarHBondContact O-N 3.43Å; F587-L590 VanDerWaalsContact O-N 3.15Å; L588-L590 PolarHBondContact O-N 2.9Å; L590-F592 VanDerWaalsContact O-CD2 3.25Å; L590-F592 WeakPolarHBondContact O-CD2 3.33Å; L590-F592 VanDerWaalsContact O-CE2 3.3Å; L590-F592 WeakPolarHBondContact O-CE2 3.48Å
591	S	83	Confident	86.5	Confident	9 Å²	9	51.3 Å²	51.3	6%	0.063	28%	0.28	C	S	.	.			trans	-89.7	132.5	-175.5	-62.8	0	0	0	0	111.3	F587 L588 F589 W600 K658	F587-S591 PolarHBondContact O-N 2.93Å; F587-S591 PolarHBondContact O-OG 3.44Å; F587-S591 VanDerWaalsContact O-OG 3.13Å; L588-S591 WeakPolarHBondContact O-CB 3.47Å; L588-S591 PolarHBondContact O-N 2.95Å; F589-S591 VanDerWaalsContact C-N 3.31Å; S591-W600 VanDerWaalsContact OG-CD1 3.25Å; S591-K658 PolarHBondContact O-NZ 3.47Å
592	F	76.3	Confident	86.1	Confident	172 Å²	172	53.9 Å²	53.9	75%	0.754	30%	0.297	S	S	*	.			trans	-125.8	-10.1	178.7	-59.5	-83.4	0	0	0	113.3	L590	L590-F592 VanDerWaalsContact O-CD2 3.25Å; L590-F592 WeakPolarHBondContact O-CD2 3.33Å; L590-F592 VanDerWaalsContact O-CE2 3.3Å; L590-F592 WeakPolarHBondContact O-CE2 3.48Å
593	S	83	Confident	85.8	Confident	67 Å²	67	57.6 Å²	57.6	47%	0.469	32%	0.316	S	S	.	.	S	Bend	trans	-100.7	140.8	177.9	175.7	0	0	0	0	110.6	A595 A596 I597	S593-A595 VanDerWaalsContact C-N 3.29Å; S593-A595 PolarHBondContact O-N 3.24Å; S593-A595 PolarHBondContact OG-N 2.96Å; S593-A596 WeakPolarHBondContact O-CB 3.4Å; S593-A596 PolarHBondContact O-N 3.4Å; S593-A596 VanDerWaalsContact O-N 3.11Å; S593-I597 PolarHBondContact O-N 3.47Å; S593-I597 VanDerWaalsContact O-N 3.08Å
594	Q	80.1	Confident	85.6	Confident	65 Å²	65	56.4 Å²	56.4	30%	0.304	30%	0.303	S	S	.	.	H	α-helix	trans	-53.4	-45.2	174.2	-176.1	-175.8	-11.9	0	0	111.8	I420 A596 I597 I598	I420-Q594 HydrophobicContact CG2-CG 4.5Å; Q594-A596 VanDerWaalsContact C-N 3.31Å; Q594-A596 PolarHBondContact O-N 2.86Å; Q594-I597 PolarHBondContact O-N 3.33Å; Q594-I598 HydrophobicContact CG-CD1 4.07Å; Q594-I598 WeakPolarHBondContact O-CG1 3.37Å; Q594-I598 PolarHBondContact O-N 3.22Å; Q594-I598 VanDerWaalsContact O-N 3.09Å
595	A	82.6	Confident	85.4	Confident	68 Å²	68	57.1 Å²	57.1	56%	0.562	31%	0.308	S	S	*	.	H	α-helix	trans	-63.5	-36.3	179.5	0	0	0	0	0	112.5	S593 A599	S593-A595 VanDerWaalsContact C-N 3.29Å; S593-A595 PolarHBondContact O-N 3.24Å; S593-A595 PolarHBondContact OG-N 2.96Å; A595-A599 WeakPolarHBondContact O-CB 3.49Å; A595-A599 PolarHBondContact O-N 3.36Å
596	A	85.2	Confident	85.3	Confident	32 Å²	32	57.7 Å²	57.7	26%	0.264	31%	0.314	S	S	.	.	H	α-helix	trans	-68	-41.1	176.7	0	0	0	0	0	111.7	S593 Q594 A599 W600	S593-A596 WeakPolarHBondContact O-CB 3.4Å; S593-A596 PolarHBondContact O-N 3.4Å; S593-A596 VanDerWaalsContact O-N 3.11Å; Q594-A596 VanDerWaalsContact C-N 3.31Å; Q594-A596 PolarHBondContact O-N 2.86Å; A596-A599 PolarHBondContact O-N 3.3Å; A596-W600 PolarHBondContact O-N 2.9Å
597	I	83.6	Confident	85.3	Confident	13 Å²	13	54.4 Å²	54.4	7%	0.067	30%	0.302	C	S	.	.	H	α-helix	trans	-61.5	-46.2	177.3	-66.5	168.6	0	0	0	110.6	F416 L423 L588 S593 Q594 A599 W600 Q601	F416-I597 HydrophobicContact CD1-CG2 4.24Å; L423-I597 HydrophobicContact CD1-CD1 3.48Å; L423-I597 VanDerWaalsContact CD1-CD1 3.48Å; L588-I597 HydrophobicContact CD2-CB 4.47Å; L588-I597 HydrophobicContact CD2-CG2 4.29Å; S593-I597 PolarHBondContact O-N 3.47Å; S593-I597 VanDerWaalsContact O-N 3.08Å; Q594-I597 PolarHBondContact O-N 3.33Å; I597-A599 PolarHBondContact O-N 3.42Å; I597-W600 PolarHBondContact O-N 2.97Å; I597-Q601 WeakPolarHBondContact O-CB 3.09Å; I597-Q601 PolarHBondContact O-N 3.14Å
598	I	83.1	Confident	85.4	Confident	66 Å²	66	49.8 Å²	49.8	34%	0.338	28%	0.282	S	S	.	.	H	α-helix	trans	-61.8	-44.6	177.7	-65.1	166.8	0	0	0	111.1	I420 Q594 W600 Q601 C602	I420-I598 HydrophobicContact CD1-CD1 4.45Å; I420-I598 HydrophobicContact CD1-CG1 3.79Å; Q594-I598 HydrophobicContact CG-CD1 4.07Å; Q594-I598 WeakPolarHBondContact O-CG1 3.37Å; Q594-I598 PolarHBondContact O-N 3.22Å; Q594-I598 VanDerWaalsContact O-N 3.09Å; I598-W600 PolarHBondContact O-N 2.87Å; I598-Q601 WeakPolarHBondContact O-CB 3.39Å; I598-Q601 PolarHBondContact O-N 3.39Å; I598-C602 PolarHBondContact O-N 3.02Å; I598-C602 PolarHBondContact O-SG 2.86Å; I598-C602 VanDerWaalsContact O-SG 3.37Å
599	A	85.9	Confident	85.7	Confident	62 Å²	62	49.5 Å²	49.5	51%	0.512	28%	0.281	S	S	.	.	H	α-helix	trans	-61.2	-45.9	179.6	0	0	0	0	0	112.2	A595 A596 I597 C602 L603	A595-A599 WeakPolarHBondContact O-CB 3.49Å; A595-A599 PolarHBondContact O-N 3.36Å; A596-A599 PolarHBondContact O-N 3.3Å; I597-A599 PolarHBondContact O-N 3.42Å; A599-C602 PolarHBondContact O-N 2.94Å; A599-L603 PolarHBondContact O-N 3.18Å; A599-L603 VanDerWaalsContact O-N 3.12Å
600	W	88.3	Confident	86	Confident	73 Å²	73	46.7 Å²	46.7	28%	0.277	27%	0.271	S	S	.	.	H	α-helix	trans	-68.8	-33.7	177.2	-75.9	119.2	0	0	0	113	C584 F587 L588 S591 A596 I597 I598 L603 F604	C584-W600 HydrophobicContact CB-CE3 4.13Å; C584-W600 HydrophobicContact CB-CZ3 4.46Å; F587-W600 HydrophobicContact CB-CD2 3.98Å; F587-W600 HydrophobicContact CB-CE3 4.15Å; F587-W600 HydrophobicContact CB-CH2 3.69Å; F587-W600 HydrophobicContact CB-CZ2 3.49Å; F587-W600 VanDerWaalsContact CB-CZ2 3.49Å; F587-W600 HydrophobicContact CB-CZ3 4.01Å; F587-W600 HydrophobicContact CD1-CZ2 4.41Å; F587-W600 AromaticContact CD2-CH2 3.72Å; F587-W600 HydrophobicContact CD2-CH2 3.72Å; F587-W600 HydrophobicContact CD2-CZ2 4.29Å; F587-W600 HydrophobicContact CD2-CZ3 4.07Å; F587-W600 AromaticContact CG-CH2 3.75Å; F587-W600 HydrophobicContact CG-CH2 3.75Å; F587-W600 AromaticContact CG-CZ2 3.84Å; F587-W600 HydrophobicContact CG-CZ2 3.84Å; F587-W600 HydrophobicContact CG-CZ3 4.32Å; L588-W600 HydrophobicContact CD1-CB 4.45Å; L588-W600 HydrophobicContact CD2-CB 3.4Å; L588-W600 HydrophobicContact CD2-CG 4.16Å; L588-W600 HydrophobicContact CG-CB 3.69Å; L588-W600 HydrophobicContact CG-CG 4.34Å; S591-W600 VanDerWaalsContact OG-CD1 3.25Å; A596-W600 PolarHBondContact O-N 2.9Å; I597-W600 PolarHBondContact O-N 2.97Å; I598-W600 PolarHBondContact O-N 2.87Å; W600-L603 HydrophobicContact CE3-CD2 3.79Å; W600-L603 HydrophobicContact CZ3-CD2 3.57Å; W600-L603 PolarHBondContact O-N 3.44Å; W600-F604 VanDerWaalsContact O-CB 3.3Å; W600-F604 WeakPolarHBondContact O-CB 3.31Å; W600-F604 PolarHBondContact O-N 3.12Å
601	Q	85.7	Confident	86.4	Confident	38 Å²	38	42 Å²	42	18%	0.178	25%	0.246	C	C	.	.	H	α-helix	trans	-60.4	-50.1	171.7	172.4	179.7	8.9	0	0	111.2	F416 I597 I598 L603 F604 C605	F416-Q601 HydrophobicContact CB-CG 4.21Å; F416-Q601 VanDerWaalsContact CB-NE2 3.28Å; F416-Q601 HydrophobicContact CD1-CB 3.92Å; F416-Q601 HydrophobicContact CD1-CG 4.08Å; F416-Q601 HydrophobicContact CD2-CB 4.14Å; F416-Q601 HydrophobicContact CD2-CG 3.51Å; F416-Q601 HydrophobicContact CE1-CB 3.84Å; F416-Q601 HydrophobicContact CE1-CG 4.29Å; F416-Q601 HydrophobicContact CE2-CB 4.07Å; F416-Q601 HydrophobicContact CE2-CG 3.77Å; F416-Q601 HydrophobicContact CG-CB 4.08Å; F416-Q601 VanDerWaalsContact CG-CD 3.44Å; F416-Q601 HydrophobicContact CG-CG 3.7Å; F416-Q601 HydrophobicContact CZ-CB 3.94Å; F416-Q601 HydrophobicContact CZ-CG 4.16Å; I597-Q601 WeakPolarHBondContact O-CB 3.09Å; I597-Q601 PolarHBondContact O-N 3.14Å; I598-Q601 WeakPolarHBondContact O-CB 3.39Å; I598-Q601 PolarHBondContact O-N 3.39Å; Q601-L603 VanDerWaalsContact C-N 3.29Å; Q601-L603 PolarHBondContact O-N 3.17Å; Q601-F604 PolarHBondContact O-N 3.36Å; Q601-C605 WeakPolarHBondContact O-CB 3.45Å; Q601-C605 PolarHBondContact O-N 3.45Å; Q601-C605 PolarHBondContact O-SG 2.95Å; Q601-C605 VanDerWaalsContact O-SG 3.37Å
602	C	85.1	Confident	86.9	Confident	54 Å²	54	42.5 Å²	42.5	37%	0.365	25%	0.247	S	C	.	.	H	α-helix	trans	-58.5	-42.9	178.3	-70.8	0	0	0	0	111.6	I598 A599 C605 G606	I598-C602 PolarHBondContact O-N 3.02Å; I598-C602 PolarHBondContact O-SG 2.86Å; I598-C602 VanDerWaalsContact O-SG 3.37Å; A599-C602 PolarHBondContact O-N 2.94Å; C602-C605 PolarHBondContact O-N 2.93Å; C602-G606 PolarHBondContact O-N 3.43Å
603	L	88.6	Confident	87.6	Confident	82 Å²	82	34.5 Å²	34.5	43%	0.429	21%	0.212	S	C	.	.	H	α-helix	trans	-65	-44.9	177.1	-171.6	66.9	0	0	0	111.8	C584 A599 W600 Q601 G606 V607	C584-L603 WeakPolarHBondContact SG-CD2 3.32Å; A599-L603 PolarHBondContact O-N 3.18Å; A599-L603 VanDerWaalsContact O-N 3.12Å; W600-L603 HydrophobicContact CE3-CD2 3.79Å; W600-L603 HydrophobicContact CZ3-CD2 3.57Å; W600-L603 PolarHBondContact O-N 3.44Å; Q601-L603 VanDerWaalsContact C-N 3.29Å; Q601-L603 PolarHBondContact O-N 3.17Å; L603-G606 PolarHBondContact O-N 3.12Å; L603-V607 HydrophobicContact CD1-CG2 4.31Å; L603-V607 WeakPolarHBondContact O-CB 3.34Å; L603-V607 VanDerWaalsContact O-CG2 3.31Å; L603-V607 WeakPolarHBondContact O-CG2 3.39Å; L603-V607 PolarHBondContact O-N 3.45Å
604	F	90.9	Very high	88	Confident	1 Å²	1	31.3 Å²	31.3	0%	0.004	19%	0.19	C	C	.	.	H	α-helix	trans	-57.8	-49.9	175.4	167.7	-101.8	0	0	0	111.6	Y409 L412 F416 C584 T585 W600 Q601 S608 L669	Y409-F604 HydrophobicContact CD2-CE1 4.35Å; L412-F604 HydrophobicContact CB-CE1 4.11Å; L412-F604 HydrophobicContact CB-CZ 4.47Å; L412-F604 HydrophobicContact CD1-CD1 4.48Å; L412-F604 HydrophobicContact CD1-CE1 3.98Å; L412-F604 HydrophobicContact CD1-CE2 4.06Å; L412-F604 HydrophobicContact CD1-CZ 3.75Å; F416-F604 AromaticContact CE2-CD1 3.85Å; F416-F604 HydrophobicContact CE2-CD1 3.85Å; F416-F604 HydrophobicContact CE2-CE1 4.29Å; F416-F604 HydrophobicContact CZ-CD1 4.35Å; C584-F604 HydrophobicContact CB-CB 4.28Å; T585-F604 HydrophobicContact CG2-CD2 3.6Å; T585-F604 HydrophobicContact CG2-CE2 3.74Å; T585-F604 HydrophobicContact CG2-CG 4.39Å; W600-F604 VanDerWaalsContact O-CB 3.3Å; W600-F604 WeakPolarHBondContact O-CB 3.31Å; W600-F604 PolarHBondContact O-N 3.12Å; Q601-F604 PolarHBondContact O-N 3.36Å; F604-S608 VanDerWaalsContact CE2-OG 3.27Å; F604-S608 WeakPolarHBondContact CE2-OG 3.26Å; F604-S608 WeakPolarHBondContact O-CB 3.26Å; F604-S608 PolarHBondContact O-N 3.43Å; F604-S608 PolarHBondContact O-OG 3.18Å; F604-L669 HydrophobicContact CE2-CD1 3.79Å
605	C	87.6	Confident	88.6	Confident	21 Å²	21	28.2 Å²	28.2	14%	0.142	18%	0.175	C	C	.	.	H	α-helix	trans	-62.4	-46.9	180	-70.6	0	0	0	0	111.6	V554 Q601 C602 V607 S608 V609	V554-C605 HydrophobicContact CG2-CB 4.13Å; Q601-C605 WeakPolarHBondContact O-CB 3.45Å; Q601-C605 PolarHBondContact O-N 3.45Å; Q601-C605 PolarHBondContact O-SG 2.95Å; Q601-C605 VanDerWaalsContact O-SG 3.37Å; C602-C605 PolarHBondContact O-N 2.93Å; C605-V607 PolarHBondContact O-N 3.14Å; C605-S608 PolarHBondContact O-N 3.18Å; C605-V609 WeakPolarHBondContact O-CG2 3.19Å; C605-V609 PolarHBondContact O-N 3.47Å
606	G	87.6	Confident	89.1	Confident	13 Å²	13	26.4 Å²	26.4	13%	0.134	16%	0.155	C	C	.	.	H	α-helix	trans	-62.7	-41.9	-179.4	0	0	0	0	0	113.4	G557 C602 L603	G557-G606 WeakPolarHBondContact CA-O 3.46Å; C602-G606 PolarHBondContact O-N 3.43Å; L603-G606 PolarHBondContact O-N 3.12Å
607	V	91	Very high	89.4	Confident	31 Å²	31	24.9 Å²	24.9	19%	0.188	14%	0.142	C	C	.	.	H	α-helix	trans	-74.6	-41.7	178.5	178	0	0	0	0	111.5	S577 I580 S581 L603 C605 V609 A610	S577-V607 WeakPolarHBondContact O-CG1 3.5Å; I580-V607 HydrophobicContact CB-CG1 3.89Å; I580-V607 HydrophobicContact CG2-CB 4.46Å; I580-V607 HydrophobicContact CG2-CG1 3.77Å; I580-V607 HydrophobicContact CG2-CG2 4.09Å; S581-V607 WeakPolarHBondContact OG-CG1 3.47Å; L603-V607 HydrophobicContact CD1-CG2 4.31Å; L603-V607 WeakPolarHBondContact O-CB 3.34Å; L603-V607 VanDerWaalsContact O-CG2 3.31Å; L603-V607 WeakPolarHBondContact O-CG2 3.39Å; L603-V607 PolarHBondContact O-N 3.45Å; C605-V607 PolarHBondContact O-N 3.14Å; V607-V609 PolarHBondContact O-N 2.87Å; V607-A610 WeakPolarHBondContact O-CB 3.33Å; V607-A610 PolarHBondContact O-N 3.15Å; V607-A610 VanDerWaalsContact O-N 3.09Å
608	S	91.6	Very high	89.8	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-59	-31.3	-179.5	-71.8	0	0	0	0	112.6	M405 S581 F604 C605 A610 A611 W612	M405-S608 WeakPolarHBondContact CE-O 3.36Å; S581-S608 PolarHBondContact OG-N 3.15Å; S581-S608 PolarHBondContact OG-OG 3.24Å; F604-S608 VanDerWaalsContact CE2-OG 3.27Å; F604-S608 WeakPolarHBondContact CE2-OG 3.26Å; F604-S608 WeakPolarHBondContact O-CB 3.26Å; F604-S608 PolarHBondContact O-N 3.43Å; F604-S608 PolarHBondContact O-OG 3.18Å; C605-S608 PolarHBondContact O-N 3.18Å; S608-A610 VanDerWaalsContact C-N 3.28Å; S608-A610 PolarHBondContact O-N 3.43Å; S608-A611 WeakPolarHBondContact O-CA 3.18Å; S608-A611 VanDerWaalsContact O-CB 3.27Å; S608-A611 WeakPolarHBondContact O-CB 3.4Å; S608-A611 PolarHBondContact O-N 3.35Å; S608-W612 PolarHBondContact O-N 2.69Å; S608-W612 VanDerWaalsContact O-N 3.11Å
609	V	90.8	Very high	90.2	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-66.9	-30.7	179.7	165.9	0	0	0	0	112.5	M248 Y409 V554 N558 C605 V607 A611 W612 N613	M248-V609 HydrophobicContact CE-CG2 4.3Å; Y409-V609 HydrophobicContact CE2-CG2 4.37Å; V554-V609 HydrophobicContact CB-CG2 4.32Å; V554-V609 HydrophobicContact CG1-CB 3.87Å; V554-V609 HydrophobicContact CG1-CG1 3.72Å; V554-V609 HydrophobicContact CG1-CG2 3.23Å; V554-V609 HydrophobicContact CG2-CG2 4.23Å; N558-V609 HydrophobicContact CB-CG1 4.33Å; N558-V609 VanDerWaalsContact CG-CG1 3.41Å; N558-V609 WeakPolarHBondContact OD1-CG1 3.33Å; C605-V609 WeakPolarHBondContact O-CG2 3.19Å; C605-V609 PolarHBondContact O-N 3.47Å; V607-V609 PolarHBondContact O-N 2.87Å; V609-A611 VanDerWaalsContact C-N 3.26Å; V609-A611 PolarHBondContact O-N 3.43Å; V609-W612 PolarHBondContact O-N 3Å; V609-N613 PolarHBondContact O-N 3.02Å; V609-N613 PolarHBondContact O-OD1 3.15Å
610	A	91.3	Very high	90.4	Very high	15 Å²	15	18.1 Å²	18.1	12%	0.124	10%	0.099	C	C	.	.	H	α-helix	trans	-64.1	-33.8	171.2	0	0	0	0	0	112.2	I573 V607 S608 G614	I573-A610 HydrophobicContact CG2-CB 4.25Å; V607-A610 WeakPolarHBondContact O-CB 3.33Å; V607-A610 PolarHBondContact O-N 3.15Å; V607-A610 VanDerWaalsContact O-N 3.09Å; S608-A610 VanDerWaalsContact C-N 3.28Å; S608-A610 PolarHBondContact O-N 3.43Å; A610-G614 PolarHBondContact O-N 2.84Å; A610-G614 VanDerWaalsContact O-N 3.16Å
611	A	93.1	Very high	90.4	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-66.7	-46.4	174	0	0	0	0	0	110.8	M405 S577 M578 S608 V609 N613 G614 I615	M405-A611 HydrophobicContact CE-CB 3.73Å; M405-A611 HydrophobicContact SD-CB 3.87Å; S577-A611 VanDerWaalsContact OG-CA 3.26Å; S577-A611 WeakPolarHBondContact OG-CA 3.21Å; S577-A611 WeakPolarHBondContact OG-CB 3.38Å; S577-A611 PolarHBondContact OG-N 3.2Å; M578-A611 HydrophobicContact CG-CB 3.75Å; S608-A611 WeakPolarHBondContact O-CA 3.18Å; S608-A611 VanDerWaalsContact O-CB 3.27Å; S608-A611 WeakPolarHBondContact O-CB 3.4Å; S608-A611 PolarHBondContact O-N 3.35Å; V609-A611 VanDerWaalsContact C-N 3.26Å; V609-A611 PolarHBondContact O-N 3.43Å; A611-N613 PolarHBondContact O-N 2.81Å; A611-G614 PolarHBondContact O-N 2.84Å; A611-I615 WeakPolarHBondContact O-CB 3.5Å; A611-I615 WeakPolarHBondContact O-CD1 3.32Å; A611-I615 WeakPolarHBondContact O-CG1 3.43Å; A611-I615 PolarHBondContact O-N 3.12Å
612	W	92.9	Very high	90.5	Very high	19 Å²	19	14.8 Å²	14.8	7%	0.072	9%	0.087	C	C	.	.	H	α-helix	trans	-54.8	-50.6	177	-80.7	118.5	0	0	0	112.1	W402 M405 A406 Y409 Y410 S608 V609 G614 I615 E616 C639	W402-W612 AromaticContact CE3-CZ3 3.73Å; W402-W612 HydrophobicContact CE3-CZ3 3.73Å; W402-W612 HydrophobicContact CZ3-CE3 4.32Å; W402-W612 AromaticContact CZ3-CZ3 3.63Å; W402-W612 HydrophobicContact CZ3-CZ3 3.63Å; M405-W612 VanDerWaalsContact CE-CD1 3.48Å; M405-W612 HydrophobicContact CE-CD2 4.33Å; M405-W612 HydrophobicContact CE-CG 4.05Å; M405-W612 HydrophobicContact CG-CD2 4.09Å; M405-W612 HydrophobicContact CG-CE3 4.43Å; M405-W612 HydrophobicContact CG-CH2 4.2Å; M405-W612 HydrophobicContact CG-CZ2 3.87Å; M405-W612 HydrophobicContact CG-CZ3 4.47Å; A406-W612 HydrophobicContact CB-CH2 3.84Å; A406-W612 HydrophobicContact CB-CZ2 4.36Å; Y409-W612 AromaticContact CD1-CE2 4Å; Y409-W612 HydrophobicContact CD1-CZ2 4.06Å; Y409-W612 AromaticContact CD1-NE1 3.39Å; Y409-W612 AromaticContact CD2-NE1 3.43Å; Y409-W612 AromaticContact CE1-NE1 3.77Å; Y409-W612 AromaticContact CE2-NE1 3.81Å; Y409-W612 HydrophobicContact CG-CZ2 4.19Å; Y409-W612 AromaticContact CG-NE1 3.21Å; Y409-W612 AromaticContact CZ-NE1 3.97Å; Y410-W612 HydrophobicContact CD2-CZ2 4.37Å; Y410-W612 HydrophobicContact CE2-CH2 4.01Å; Y410-W612 AromaticContact CE2-CZ2 3.82Å; Y410-W612 HydrophobicContact CE2-CZ2 3.82Å; S608-W612 PolarHBondContact O-N 2.69Å; S608-W612 VanDerWaalsContact O-N 3.11Å; V609-W612 PolarHBondContact O-N 3Å; W612-G614 VanDerWaalsContact C-N 3.32Å; W612-G614 PolarHBondContact O-N 2.83Å; W612-I615 PolarHBondContact O-N 3.37Å; W612-I615 VanDerWaalsContact O-N 3.17Å; W612-E616 WeakPolarHBondContact O-CG 2.94Å; W612-E616 PolarHBondContact O-N 3.27Å; W612-C639 VanDerWaalsContact CH2-SG 3.51Å
613	N	91.8	Very high	90.7	Very high	4 Å²	4	12.4 Å²	12.4	2%	0.021	7%	0.07	C	C	.	.	H	α-helix	trans	-60.6	-43.4	179.6	-66.3	1.5	0	0	0	111.5	S241 C244 N558 S561 M565 V609 A611 I615 E616 V617	S241-N613 PolarHBondContact OG-ND2 2.69Å; C244-N613 WeakPolarHBondContact CB-OD1 3.43Å; C244-N613 VanDerWaalsContact SG-CG 3.56Å; C244-N613 PolarHBondContact SG-OD1 3.47Å; N558-N613 PolarHBondContact OD1-ND2 2.82Å; N558-N613 PolarHBondContact OD1-OD1 3.05Å; S561-N613 PolarHBondContact OG-ND2 2.95Å; M565-N613 HydrophobicContact CE-CB 4.45Å; V609-N613 PolarHBondContact O-N 3.02Å; V609-N613 PolarHBondContact O-OD1 3.15Å; A611-N613 PolarHBondContact O-N 2.81Å; N613-I615 PolarHBondContact O-N 3.39Å; N613-E616 PolarHBondContact O-N 2.78Å; N613-V617 VanDerWaalsContact O-CG2 3.25Å; N613-V617 WeakPolarHBondContact O-CG2 3.3Å; N613-V617 PolarHBondContact O-N 3.34Å
614	G	91.2	Very high	90.5	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-61.9	-43.1	176.9	0	0	0	0	0	112.5	I574 A610 A611 W612 V617 I618	I574-G614 VanDerWaalsContact CD1-C 3.45Å; A610-G614 PolarHBondContact O-N 2.84Å; A610-G614 VanDerWaalsContact O-N 3.16Å; A611-G614 PolarHBondContact O-N 2.84Å; W612-G614 VanDerWaalsContact C-N 3.32Å; W612-G614 PolarHBondContact O-N 2.83Å; G614-V617 PolarHBondContact O-N 2.99Å; G614-I618 WeakPolarHBondContact O-CB 3.49Å; G614-I618 WeakPolarHBondContact O-CG2 3.44Å; G614-I618 PolarHBondContact O-N 2.9Å
615	I	93.7	Very high	90	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-63.9	-44	179.6	-70	163.8	0	0	0	110.8	M398 I401 W402 M405 I574 A611 W612 N613 I618 T619	M398-I615 HydrophobicContact CE-CG2 4.33Å; I401-I615 HydrophobicContact CG2-CD1 3.56Å; I401-I615 HydrophobicContact CG2-CG1 3.67Å; W402-I615 HydrophobicContact CD2-CG2 3.58Å; W402-I615 HydrophobicContact CE3-CG2 4.24Å; W402-I615 HydrophobicContact CG-CG2 3.88Å; W402-I615 HydrophobicContact CH2-CG2 4.33Å; W402-I615 HydrophobicContact CZ2-CG2 3.65Å; M405-I615 HydrophobicContact CB-CD1 3.93Å; M405-I615 HydrophobicContact CG-CD1 3.82Å; I574-I615 HydrophobicContact CD1-CG1 4.19Å; I574-I615 HydrophobicContact CG1-CG1 4.21Å; I574-I615 HydrophobicContact CG2-CD1 4.3Å; I574-I615 HydrophobicContact CG2-CG1 3.85Å; A611-I615 WeakPolarHBondContact O-CB 3.5Å; A611-I615 WeakPolarHBondContact O-CD1 3.32Å; A611-I615 WeakPolarHBondContact O-CG1 3.43Å; A611-I615 PolarHBondContact O-N 3.12Å; W612-I615 PolarHBondContact O-N 3.37Å; W612-I615 VanDerWaalsContact O-N 3.17Å; N613-I615 PolarHBondContact O-N 3.39Å; I615-I618 WeakPolarHBondContact O-CG2 3.43Å; I615-T619 WeakPolarHBondContact O-CB 3.19Å; I615-T619 PolarHBondContact O-N 2.87Å; I615-T619 PolarHBondContact O-OG1 2.79Å
616	E	92.8	Very high	89.6	Confident	30 Å²	30	10.8 Å²	10.8	14%	0.14	7%	0.065	C	C	.	.	H	α-helix	trans	-64.2	-46.4	178	-69.5	178.3	161.7	0	0	111.2	Y224 C244 W402 W612 N613 T619 V620 F632	Y224-E616 HydrophobicContact CD1-CB 4.41Å; Y224-E616 HydrophobicContact CE1-CB 3.99Å; Y224-E616 PolarHBondContact OH-OE2 3.21Å; C244-E616 PolarHBondContact SG-OE2 2.83Å; W402-E616 HydrophobicContact CH2-CG 4.05Å; W402-E616 HydrophobicContact CZ2-CG 4.43Å; W612-E616 WeakPolarHBondContact O-CG 2.94Å; W612-E616 PolarHBondContact O-N 3.27Å; N613-E616 PolarHBondContact O-N 2.78Å; E616-T619 PolarHBondContact O-N 3.2Å; E616-V620 WeakPolarHBondContact O-CG2 3.16Å; E616-V620 PolarHBondContact O-N 2.82Å; E616-F632 HydrophobicContact CB-CZ 4.15Å; E616-F632 HydrophobicContact CG-CZ 4.11Å
617	V	91	Very high	89.6	Confident	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-62.4	-51	178.5	174.1	0	0	0	0	111.4	L240 M565 R570 N613 G614 T619 V620 E621	L240-V617 HydrophobicContact CB-CG2 3.67Å; L240-V617 HydrophobicContact CD1-CG1 4.34Å; L240-V617 HydrophobicContact CD1-CG2 4.47Å; M565-V617 HydrophobicContact SD-CB 4.13Å; M565-V617 HydrophobicContact SD-CG1 4.24Å; M565-V617 HydrophobicContact SD-CG2 3.8Å; R570-V617 HydrophobicContact CG-CG1 4.13Å; N613-V617 VanDerWaalsContact O-CG2 3.25Å; N613-V617 WeakPolarHBondContact O-CG2 3.3Å; N613-V617 PolarHBondContact O-N 3.34Å; G614-V617 PolarHBondContact O-N 2.99Å; V617-T619 PolarHBondContact O-N 2.79Å; V617-V620 WeakPolarHBondContact O-CB 3.34Å; V617-V620 PolarHBondContact O-N 2.85Å; V617-E621 HydrophobicContact CG1-CG 4.44Å; V617-E621 WeakPolarHBondContact O-CG 3.15Å; V617-E621 PolarHBondContact O-N 3.32Å
618	I	91	Very high	89.6	Confident	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-65.7	-30	-177.6	-159.4	167.7	0	0	0	111.8	M398 V571 I574 G614 I615 V620 E621 L622 L679 T682	M398-I618 HydrophobicContact CE-CG2 3.54Å; M398-I618 HydrophobicContact SD-CG2 3.85Å; V571-I618 HydrophobicContact CG2-CD1 3.59Å; I574-I618 HydrophobicContact CD1-CB 4.34Å; I574-I618 HydrophobicContact CD1-CD1 4.39Å; I574-I618 HydrophobicContact CD1-CG2 3.76Å; G614-I618 WeakPolarHBondContact O-CB 3.49Å; G614-I618 WeakPolarHBondContact O-CG2 3.44Å; G614-I618 PolarHBondContact O-N 2.9Å; I615-I618 WeakPolarHBondContact O-CG2 3.43Å; I618-V620 PolarHBondContact O-N 3.39Å; I618-E621 PolarHBondContact O-N 3.23Å; I618-L622 WeakPolarHBondContact O-CB 3.45Å; I618-L622 PolarHBondContact O-N 2.8Å; I618-L679 HydrophobicContact CD1-CB 4.48Å; I618-L679 HydrophobicContact CD1-CD1 4.14Å; I618-T682 HydrophobicContact CD1-CG2 4.41Å; I618-T682 HydrophobicContact CG1-CG2 3.94Å
619	T	92.6	Very high	89.6	Confident	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-62.7	-33.2	174.9	-59.3	0	0	0	0	111.5	M398 W402 I615 E616 V617 Y623 F632 L635	M398-T619 WeakPolarHBondContact CE-OG1 3.3Å; W402-T619 PolarHBondContact NE1-OG1 2.72Å; I615-T619 WeakPolarHBondContact O-CB 3.19Å; I615-T619 PolarHBondContact O-N 2.87Å; I615-T619 PolarHBondContact O-OG1 2.79Å; E616-T619 PolarHBondContact O-N 3.2Å; V617-T619 PolarHBondContact O-N 2.79Å; T619-Y623 HydrophobicContact CG2-CE2 4.39Å; T619-Y623 VanDerWaalsContact O-CD2 3.25Å; T619-Y623 WeakPolarHBondContact O-CD2 3.35Å; T619-F632 HydrophobicContact CG2-CB 3.83Å; T619-F632 HydrophobicContact CG2-CD1 4.17Å; T619-F632 HydrophobicContact CG2-CD2 3.65Å; T619-F632 HydrophobicContact CG2-CE2 4.22Å; T619-F632 HydrophobicContact CG2-CG 3.61Å; T619-L635 HydrophobicContact CG2-CD1 3.74Å
620	V	89.9	Confident	89.7	Confident	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-78.6	-34.8	178.3	179.4	0	0	0	0	111	Y224 S228 L240 E616 V617 I618 R628 F632	Y224-V620 HydrophobicContact CD1-CG2 4.34Å; Y224-V620 HydrophobicContact CG-CG2 4.35Å; S228-V620 WeakPolarHBondContact OG-CG1 3.44Å; L240-V620 HydrophobicContact CD1-CG1 4.47Å; E616-V620 WeakPolarHBondContact O-CG2 3.16Å; E616-V620 PolarHBondContact O-N 2.82Å; V617-V620 WeakPolarHBondContact O-CB 3.34Å; V617-V620 PolarHBondContact O-N 2.85Å; I618-V620 PolarHBondContact O-N 3.39Å; V620-R628 VanDerWaalsContact O-CD 3.26Å; V620-R628 WeakPolarHBondContact O-CD 3.27Å; V620-R628 PolarHBondContact O-NE 3.25Å; V620-F632 HydrophobicContact CG2-CD2 3.78Å; V620-F632 HydrophobicContact CG2-CE2 3.62Å
621	E	87.8	Confident	89.9	Confident	14 Å²	14	10.5 Å²	10.5	7%	0.065	6%	0.056	C	C	.	.	H	α-helix	trans	-81.3	-26.9	-175.6	-63.7	-172.2	151.8	0	0	113.9	R236 V617 I618 T682 L687	R236-E621 IonicContact CZ-OE1 3.2Å; R236-E621 VanDerWaalsContact CZ-OE1 3.27Å; R236-E621 IonicContact NE-OE1 2.74Å; R236-E621 PolarHBondContact NE-OE1 2.98Å; R236-E621 VanDerWaalsContact NH2-CD 3.27Å; R236-E621 IonicContact NH2-OE1 2.79Å; R236-E621 PolarHBondContact NH2-OE1 2.98Å; V617-E621 HydrophobicContact CG1-CG 4.44Å; V617-E621 WeakPolarHBondContact O-CG 3.15Å; V617-E621 PolarHBondContact O-N 3.32Å; I618-E621 PolarHBondContact O-N 3.23Å; E621-T682 HydrophobicContact CB-CG2 4.15Å; E621-T682 VanDerWaalsContact OE2-CB 3.25Å; E621-T682 WeakPolarHBondContact OE2-CB 3.12Å; E621-T682 PolarHBondContact OE2-OG1 2.85Å; E621-L687 HydrophobicContact CB-CD2 4.43Å
622	L	88.5	Confident	89.9	Confident	27 Å²	27	10.5 Å²	10.5	14%	0.141	6%	0.056	C	C	.	.	H	α-helix	trans	-80.7	-26.8	-173.6	-170	63.5	0	0	0	113.6	M398 I618 L679 P680	M398-L622 HydrophobicContact CG-CD2 3.59Å; M398-L622 HydrophobicContact SD-CD2 4.21Å; I618-L622 WeakPolarHBondContact O-CB 3.45Å; I618-L622 PolarHBondContact O-N 2.8Å; L622-L679 HydrophobicContact CD2-CD2 4.47Å; L622-P680 HydrophobicContact CD1-CG 4.08Å
623	Y	89.1	Confident	90	Very high	3 Å²	3	9.6 Å²	9.6	1%	0.012	5%	0.052	C	C	.	.	S	Bend	trans	-106.5	143.3	-174.1	-64.5	-87.2	0	0	0	112.6	L386 L391 T395 T619 R628 A631 L635	L386-Y623 HydrophobicContact CD2-CD1 3.98Å; L386-Y623 HydrophobicContact CD2-CE1 4Å; L391-Y623 HydrophobicContact CD1-CD1 4.45Å; L391-Y623 HydrophobicContact CD2-CD1 4.44Å; T395-Y623 VanDerWaalsContact CA-OH 3.27Å; T395-Y623 WeakPolarHBondContact CA-OH 3.4Å; T395-Y623 WeakPolarHBondContact OG1-CE1 3.4Å; T395-Y623 PolarHBondContact OG1-OH 2.96Å; T619-Y623 HydrophobicContact CG2-CE2 4.39Å; T619-Y623 VanDerWaalsContact O-CD2 3.25Å; T619-Y623 WeakPolarHBondContact O-CD2 3.35Å; Y623-R628 PolarHBondContact O-NE 3.08Å; Y623-A631 HydrophobicContact CD1-CB 3.44Å; Y623-A631 VanDerWaalsContact CD1-CB 3.44Å; Y623-A631 HydrophobicContact CD2-CB 3.63Å; Y623-A631 HydrophobicContact CE1-CB 3.63Å; Y623-A631 HydrophobicContact CE2-CB 3.81Å; Y623-A631 HydrophobicContact CG-CB 3.43Å; Y623-A631 VanDerWaalsContact CG-CB 3.43Å; Y623-L635 HydrophobicContact CE2-CD1 3.94Å
624	P	84.5	Confident	90.2	Very high	24 Å²	24	11.4 Å²	11.4	16%	0.156	6%	0.063	C	C	.	.			trans	-66.9	149	179.2	28.5	-35	0	0	0	111.3	S626 K627 R628 Q688	P624-S626 VanDerWaalsContact C-N 3.28Å; P624-S626 PolarHBondContact O-N 2.92Å; P624-S626 VanDerWaalsContact O-N 3.15Å; P624-K627 HydrophobicContact CG-CB 4.43Å; P624-K627 HydrophobicContact CG-CD 4.37Å; P624-K627 CarbonylContact O-C 3.52Å; P624-K627 PolarHBondContact O-N 3.25Å; P624-R628 WeakPolarHBondContact O-CB 3.47Å; P624-R628 PolarHBondContact O-N 3.09Å; P624-Q688 CarbonylContact C-O 3.58Å; P624-Q688 WeakPolarHBondContact CA-O 3.23Å; P624-Q688 HydrophobicContact CB-CB 4.38Å; P624-Q688 WeakPolarHBondContact CB-O 3Å
625	A	80	Confident	90.4	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-55.4	-37.4	-171.1	0	0	0	0	0	114.3	R178 R306 E310 K627 R628 Q688	R178-A625 PolarHBondContact NH2-O 3.49Å; R306-A625 HydrophobicContact CG-CB 4.33Å; E310-A625 WeakPolarHBondContact OE1-CB 3.45Å; A625-K627 PolarHBondContact O-N 3.22Å; A625-K627 VanDerWaalsContact O-N 3.16Å; A625-R628 PolarHBondContact O-N 2.9Å; A625-Q688 PolarHBondContact N-O 3.02Å
626	S	80	Confident	90.5	Very high	46 Å²	46	11.9 Å²	11.9	32%	0.322	7%	0.066	S	C	.	.	H	α-helix	trans	-65.2	-14	177.9	61.8	0	0	0	0	115.7	E310 N382 P624	E310-S626 PolarHBondContact OE1-N 3.32Å; N382-S626 PolarHBondContact ND2-O 3.48Å; N382-S626 VanDerWaalsContact ND2-O 3.15Å; P624-S626 VanDerWaalsContact C-N 3.28Å; P624-S626 PolarHBondContact O-N 2.92Å; P624-S626 VanDerWaalsContact O-N 3.15Å
627	K	86.8	Confident	90.6	Very high	52 Å²	52	11 Å²	11	23%	0.226	6%	0.064	C	C	.	.	H	α-helix	trans	-131.2	0.7	-177.6	-59.4	173.2	-175.5	-178.7	0	113	D174 S385 L386 P624 A625 T630 A631	D174-K627 WeakPolarHBondContact OD2-CA 3.4Å; S385-K627 VanDerWaalsContact OG-CD 3.26Å; S385-K627 WeakPolarHBondContact OG-CD 3.29Å; S385-K627 WeakPolarHBondContact OG-CE 3.25Å; S385-K627 PolarHBondContact OG-NZ 3.33Å; L386-K627 HydrophobicContact CD2-CB 4.45Å; P624-K627 HydrophobicContact CG-CB 4.43Å; P624-K627 HydrophobicContact CG-CD 4.37Å; P624-K627 CarbonylContact O-C 3.52Å; P624-K627 PolarHBondContact O-N 3.25Å; A625-K627 PolarHBondContact O-N 3.22Å; A625-K627 VanDerWaalsContact O-N 3.16Å; K627-T630 WeakPolarHBondContact O-CB 3.25Å; K627-T630 PolarHBondContact O-N 3.47Å; K627-A631 WeakPolarHBondContact O-CB 3.42Å; K627-A631 PolarHBondContact O-N 3.04Å
628	R	90.9	Very high	90.8	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-65.3	-49.4	-168.6	-174.6	-174.5	-61.1	156.1	6.8	111.8	D174 S228 E229 V620 Y623 P624 A625 T630 A631 F632	D174-R628 PolarHBondContact OD2-N 3.35Å; S228-R628 PolarHBondContact OG-NH1 2.98Å; E229-R628 IonicContact OE1-NH1 3.98Å; V620-R628 VanDerWaalsContact O-CD 3.26Å; V620-R628 WeakPolarHBondContact O-CD 3.27Å; V620-R628 PolarHBondContact O-NE 3.25Å; Y623-R628 PolarHBondContact O-NE 3.08Å; P624-R628 WeakPolarHBondContact O-CB 3.47Å; P624-R628 PolarHBondContact O-N 3.09Å; A625-R628 PolarHBondContact O-N 2.9Å; R628-T630 VanDerWaalsContact C-N 3.27Å; R628-T630 PolarHBondContact O-N 3.04Å; R628-A631 PolarHBondContact O-N 3.42Å; R628-F632 WeakPolarHBondContact O-CB 3.36Å; R628-F632 PolarHBondContact O-N 3.49Å
629	A	92.1	Very high	91	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-67.6	-33.7	-179.8	0	0	0	0	0	111.1	G170 A173 D174 G633	G170-A629 CarbonylContact C-O 3.15Å; G170-A629 WeakPolarHBondContact CA-O 3.47Å; G170-A629 CarbonylContact O-C 3.57Å; G170-A629 WeakPolarHBondContact O-CB 3.45Å; A173-A629 HydrophobicContact CB-CB 3.81Å; D174-A629 VanDerWaalsContact OD1-CB 3.31Å; D174-A629 WeakPolarHBondContact OD1-CB 3.39Å; D174-A629 PolarHBondContact OD1-N 3.01Å; D174-A629 PolarHBondContact OD2-N 3.34Å; A629-G633 PolarHBondContact O-N 3.37Å
630	T	93.4	Very high	91.1	Very high	1 Å²	1	13.7 Å²	13.7	1%	0.006	8%	0.078	C	C	.	.	H	α-helix	trans	-62.9	-49	173.7	-51.5	0	0	0	0	110.9	G170 D174 N382 V383 K627 R628 G633 V634	G170-T630 PolarHBondContact O-N 3.46Å; D174-T630 WeakPolarHBondContact OD2-CB 3.36Å; D174-T630 PolarHBondContact OD2-N 3.41Å; D174-T630 PolarHBondContact OD2-OG1 3.01Å; N382-T630 HydrophobicContact CB-CG2 4.04Å; V383-T630 HydrophobicContact CG2-CG2 3.53Å; K627-T630 WeakPolarHBondContact O-CB 3.25Å; K627-T630 PolarHBondContact O-N 3.47Å; R628-T630 VanDerWaalsContact C-N 3.27Å; R628-T630 PolarHBondContact O-N 3.04Å; T630-G633 PolarHBondContact O-N 3.35Å; T630-V634 WeakPolarHBondContact O-CG2 3.36Å; T630-V634 PolarHBondContact O-N 3.04Å
631	A	94	Very high	91.4	Very high	1 Å²	1	17 Å²	17	1%	0.008	10%	0.095	C	C	.	.	H	α-helix	trans	-61.8	-47.6	179.3	0	0	0	0	0	111.9	L386 Y623 K627 R628 G633 V634 L635	L386-A631 HydrophobicContact CD1-CB 4.12Å; L386-A631 HydrophobicContact CD2-CB 3.7Å; Y623-A631 HydrophobicContact CD1-CB 3.44Å; Y623-A631 VanDerWaalsContact CD1-CB 3.44Å; Y623-A631 HydrophobicContact CD2-CB 3.63Å; Y623-A631 HydrophobicContact CE1-CB 3.63Å; Y623-A631 HydrophobicContact CE2-CB 3.81Å; Y623-A631 HydrophobicContact CG-CB 3.43Å; Y623-A631 VanDerWaalsContact CG-CB 3.43Å; K627-A631 WeakPolarHBondContact O-CB 3.42Å; K627-A631 PolarHBondContact O-N 3.04Å; R628-A631 PolarHBondContact O-N 3.42Å; A631-G633 PolarHBondContact O-N 3.37Å; A631-V634 PolarHBondContact O-N 3.09Å; A631-L635 WeakPolarHBondContact O-CG 3.31Å; A631-L635 PolarHBondContact O-N 2.69Å
632	F	94.9	Very high	91.8	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-60.1	-47.3	175.7	-156.9	-40.5	0	0	0	110.1	V220 P221 Y224 W402 E616 T619 V620 R628 V634 L635 N636	V220-F632 HydrophobicContact CG1-CE1 3.79Å; V220-F632 HydrophobicContact CG1-CZ 3.92Å; P221-F632 HydrophobicContact CB-CB 3.71Å; P221-F632 HydrophobicContact CB-CD1 3.77Å; P221-F632 HydrophobicContact CB-CG 3.79Å; Y224-F632 HydrophobicContact CD2-CE2 4.12Å; Y224-F632 HydrophobicContact CD2-CZ 4Å; Y224-F632 AromaticContact CG-CE2 3.84Å; Y224-F632 HydrophobicContact CG-CE2 3.84Å; Y224-F632 HydrophobicContact CG-CZ 4.17Å; W402-F632 HydrophobicContact CH2-CD1 4.44Å; W402-F632 AromaticContact CH2-CE1 3.59Å; W402-F632 HydrophobicContact CH2-CE1 3.59Å; W402-F632 HydrophobicContact CH2-CZ 4.13Å; W402-F632 HydrophobicContact CZ2-CD1 4.25Å; W402-F632 AromaticContact CZ2-CE1 3.65Å; W402-F632 HydrophobicContact CZ2-CE1 3.65Å; W402-F632 HydrophobicContact CZ2-CZ 4.08Å; E616-F632 HydrophobicContact CB-CZ 4.15Å; E616-F632 HydrophobicContact CG-CZ 4.11Å; T619-F632 HydrophobicContact CG2-CB 3.83Å; T619-F632 HydrophobicContact CG2-CD1 4.17Å; T619-F632 HydrophobicContact CG2-CD2 3.65Å; T619-F632 HydrophobicContact CG2-CE2 4.22Å; T619-F632 HydrophobicContact CG2-CG 3.61Å; V620-F632 HydrophobicContact CG2-CD2 3.78Å; V620-F632 HydrophobicContact CG2-CE2 3.62Å; R628-F632 WeakPolarHBondContact O-CB 3.36Å; R628-F632 PolarHBondContact O-N 3.49Å; F632-V634 VanDerWaalsContact C-N 3.34Å; F632-V634 PolarHBondContact O-N 2.64Å; F632-L635 PolarHBondContact O-N 3.17Å; F632-N636 HydrophobicContact CD1-CB 4.25Å; F632-N636 HydrophobicContact CE1-CB 4.49Å; F632-N636 VanDerWaalsContact O-CB 3.28Å; F632-N636 WeakPolarHBondContact O-CB 3.39Å; F632-N636 PolarHBondContact O-N 2.89Å
633	G	94.9	Very high	92	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-57.1	-43	178.2	0	0	0	0	0	113.7	A166 A629 T630 A631 A637	A166-G633 VanDerWaalsContact O-CA 3.26Å; A166-G633 WeakPolarHBondContact O-CA 3.26Å; A629-G633 PolarHBondContact O-N 3.37Å; T630-G633 PolarHBondContact O-N 3.35Å; A631-G633 PolarHBondContact O-N 3.37Å; G633-A637 WeakPolarHBondContact O-CB 3.44Å; G633-A637 PolarHBondContact O-N 2.95Å
634	V	95.3	Very high	92.2	Very high	41 Å²	41	16.4 Å²	16.4	25%	0.248	9%	0.092	C	C	.	.	H	α-helix	trans	-65.7	-45.3	176.2	172.1	0	0	0	0	111.6	F167 V383 L386 T630 A631 F632 A637 L638	F167-V634 HydrophobicContact CD2-CG2 3.96Å; F167-V634 HydrophobicContact CE2-CG2 3.99Å; V383-V634 HydrophobicContact CG1-CG2 4.28Å; V383-V634 HydrophobicContact CG2-CG2 4.02Å; L386-V634 HydrophobicContact CD1-CG2 4.3Å; T630-V634 WeakPolarHBondContact O-CG2 3.36Å; T630-V634 PolarHBondContact O-N 3.04Å; A631-V634 PolarHBondContact O-N 3.09Å; F632-V634 VanDerWaalsContact C-N 3.34Å; F632-V634 PolarHBondContact O-N 2.64Å; V634-A637 PolarHBondContact O-N 3.19Å; V634-L638 PolarHBondContact O-N 3.06Å
635	L	95.7	Very high	92.7	Very high	4 Å²	4	18.7 Å²	18.7	2%	0.021	10%	0.103	C	C	.	.	H	α-helix	trans	-65.8	-39	178.1	-70	170	0	0	0	111.9	M398 A399 W402 T619 Y623 A631 F632 L638 C639	M398-L635 HydrophobicContact CB-CD1 3.91Å; M398-L635 HydrophobicContact CB-CD2 4.02Å; A399-L635 HydrophobicContact CB-CD2 3.97Å; W402-L635 HydrophobicContact CD2-CB 4.31Å; W402-L635 HydrophobicContact CG-CB 4.13Å; T619-L635 HydrophobicContact CG2-CD1 3.74Å; Y623-L635 HydrophobicContact CE2-CD1 3.94Å; A631-L635 WeakPolarHBondContact O-CG 3.31Å; A631-L635 PolarHBondContact O-N 2.69Å; F632-L635 PolarHBondContact O-N 3.17Å; L635-L638 WeakPolarHBondContact O-CB 3.28Å; L635-L638 PolarHBondContact O-N 3.26Å; L635-C639 PolarHBondContact O-N 3.33Å
636	N	94.6	Very high	93.3	Very high	6 Å²	6	18.7 Å²	18.7	3%	0.032	10%	0.103	C	C	.	.	H	α-helix	trans	-69.1	-36.2	175.7	-167.4	37.6	0	0	0	111.4	A166 F632 L638 C639 K640	A166-N636 HydrophobicContact CB-CB 4.19Å; F632-N636 HydrophobicContact CD1-CB 4.25Å; F632-N636 HydrophobicContact CE1-CB 4.49Å; F632-N636 VanDerWaalsContact O-CB 3.28Å; F632-N636 WeakPolarHBondContact O-CB 3.39Å; F632-N636 PolarHBondContact O-N 2.89Å; N636-L638 VanDerWaalsContact C-N 3.34Å; N636-L638 PolarHBondContact O-N 3.15Å; N636-C639 VanDerWaalsContact O-CB 3.24Å; N636-C639 WeakPolarHBondContact O-CB 3.32Å; N636-C639 PolarHBondContact O-N 3.15Å; N636-K640 WeakPolarHBondContact O-CG 3.19Å; N636-K640 PolarHBondContact O-N 3.03Å
637	A	95.8	Very high	93.8	Very high	12 Å²	12	17.1 Å²	17.1	10%	0.099	9%	0.091	C	C	.	.	H	α-helix	trans	-61.5	-43.6	171.3	0	0	0	0	0	111.3	M163 A166 F167 G633 V634 C639 K640 L641	M163-A637 HydrophobicContact CG-CB 4.05Å; M163-A637 WeakPolarHBondContact CG-O 3.4Å; M163-A637 WeakPolarHBondContact O-CB 3.41Å; A166-A637 HydrophobicContact CB-CB 4.27Å; F167-A637 HydrophobicContact CB-CB 4.41Å; G633-A637 WeakPolarHBondContact O-CB 3.44Å; G633-A637 PolarHBondContact O-N 2.95Å; V634-A637 PolarHBondContact O-N 3.19Å; A637-C639 VanDerWaalsContact C-N 3.29Å; A637-C639 PolarHBondContact O-N 3.26Å; A637-K640 PolarHBondContact O-N 3.46Å; A637-L641 PolarHBondContact O-N 2.62Å
638	L	95.8	Very high	93.9	Very high	50 Å²	50	18 Å²	18	26%	0.262	10%	0.104	S	C	.	.	H	α-helix	trans	-61.6	-38	174.3	-177.2	66.1	0	0	0	112.2	A399 F403 V634 L635 N636 L641 A642	A399-L638 HydrophobicContact CB-CD2 3.59Å; A399-L638 WeakPolarHBondContact O-CD2 3.43Å; F403-L638 HydrophobicContact CB-CD2 4.26Å; F403-L638 HydrophobicContact CB-CG 4.34Å; F403-L638 HydrophobicContact CD2-CD1 3.91Å; F403-L638 HydrophobicContact CD2-CG 4.17Å; V634-L638 PolarHBondContact O-N 3.06Å; L635-L638 WeakPolarHBondContact O-CB 3.28Å; L635-L638 PolarHBondContact O-N 3.26Å; N636-L638 VanDerWaalsContact C-N 3.34Å; N636-L638 PolarHBondContact O-N 3.15Å; L638-L641 HydrophobicContact CD1-CD2 4.35Å; L638-L641 WeakPolarHBondContact O-CB 3.4Å; L638-L641 PolarHBondContact O-N 3.31Å; L638-A642 WeakPolarHBondContact O-CB 3.42Å; L638-A642 PolarHBondContact O-N 2.98Å
639	C	95	Very high	94	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.007	12%	0.119	C	C	.	.	H	α-helix	trans	-58.6	-47.8	172.5	173	0	0	0	0	112.1	W402 A406 W612 L635 N636 A637 L641 A642 A643	W402-C639 HydrophobicContact CE3-CB 3.52Å; W402-C639 HydrophobicContact CZ3-CB 3.96Å; A406-C639 HydrophobicContact CB-CB 4.21Å; A406-C639 WeakPolarHBondContact CB-O 3.35Å; A406-C639 VanDerWaalsContact CB-SG 3.58Å; W612-C639 VanDerWaalsContact CH2-SG 3.51Å; L635-C639 PolarHBondContact O-N 3.33Å; N636-C639 VanDerWaalsContact O-CB 3.24Å; N636-C639 WeakPolarHBondContact O-CB 3.32Å; N636-C639 PolarHBondContact O-N 3.15Å; A637-C639 VanDerWaalsContact C-N 3.29Å; A637-C639 PolarHBondContact O-N 3.26Å; C639-L641 VanDerWaalsContact C-N 3.33Å; C639-L641 PolarHBondContact O-N 2.8Å; C639-A642 WeakPolarHBondContact O-CB 3.39Å; C639-A642 PolarHBondContact O-N 3.4Å; C639-A643 PolarHBondContact O-N 3.5Å
640	K	94.7	Very high	93.9	Very high	6 Å²	6	20.9 Å²	20.9	3%	0.026	12%	0.119	C	C	.	.	H	α-helix	trans	-66.9	-34.3	178.1	-58.8	-54.9	176.9	172.5	0	112.2	F159 M162 M163 N636 A637 A643 I644	F159-K640 HydrophobicContact CD1-CD 4.09Å; M162-K640 HydrophobicContact CB-CD 4.23Å; M162-K640 HydrophobicContact CB-CG 4.05Å; M163-K640 HydrophobicContact CB-CB 3.82Å; N636-K640 WeakPolarHBondContact O-CG 3.19Å; N636-K640 PolarHBondContact O-N 3.03Å; A637-K640 PolarHBondContact O-N 3.46Å; K640-A643 WeakPolarHBondContact O-CB 3.42Å; K640-A643 PolarHBondContact O-N 2.79Å; K640-I644 WeakPolarHBondContact O-CG1 3.32Å; K640-I644 PolarHBondContact O-N 2.9Å
641	L	95.6	Very high	93.6	Very high	69 Å²	69	22.8 Å²	22.8	36%	0.361	13%	0.134	S	C	.	.	H	α-helix	trans	-62.1	-46.4	170.8	-179.4	65.4	0	0	0	111.7	M163 A637 L638 C639 A643 I644 L645	M163-L641 HydrophobicContact SD-CB 3.88Å; M163-L641 HydrophobicContact SD-CD1 4.13Å; A637-L641 PolarHBondContact O-N 2.62Å; L638-L641 HydrophobicContact CD1-CD2 4.35Å; L638-L641 WeakPolarHBondContact O-CB 3.4Å; L638-L641 PolarHBondContact O-N 3.31Å; C639-L641 VanDerWaalsContact C-N 3.33Å; C639-L641 PolarHBondContact O-N 2.8Å; L641-A643 VanDerWaalsContact C-N 3.29Å; L641-A643 PolarHBondContact O-N 2.9Å; L641-I644 PolarHBondContact O-N 3.36Å; L641-L645 HydrophobicContact CG-CD1 4.32Å; L641-L645 WeakPolarHBondContact O-CG 3.43Å; L641-L645 PolarHBondContact O-N 3.3Å
642	A	95.8	Very high	93.2	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-62.8	-36.2	176.7	0	0	0	0	0	112.1	F403 A406 F407 L638 C639 G646	F403-A642 HydrophobicContact CD2-CB 3.55Å; F403-A642 HydrophobicContact CE2-CB 3.75Å; F403-A642 HydrophobicContact CG-CB 4.01Å; F403-A642 HydrophobicContact CZ-CB 4.37Å; A406-A642 HydrophobicContact CB-CB 3.71Å; F407-A642 HydrophobicContact CB-CB 4.31Å; L638-A642 WeakPolarHBondContact O-CB 3.42Å; L638-A642 PolarHBondContact O-N 2.98Å; C639-A642 WeakPolarHBondContact O-CB 3.39Å; C639-A642 PolarHBondContact O-N 3.4Å; A642-G646 PolarHBondContact O-N 2.86Å
643	A	93.4	Very high	92.9	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-61.5	-50.5	173.3	0	0	0	0	0	111.2	F159 Y410 C639 K640 L641 L645 G646 T647	F159-A643 HydrophobicContact CD1-CB 4.49Å; Y410-A643 HydrophobicContact CD1-CB 4.38Å; Y410-A643 HydrophobicContact CD2-CB 3.54Å; Y410-A643 HydrophobicContact CE2-CB 4.18Å; Y410-A643 HydrophobicContact CG-CB 3.67Å; C639-A643 PolarHBondContact O-N 3.5Å; K640-A643 WeakPolarHBondContact O-CB 3.42Å; K640-A643 PolarHBondContact O-N 2.79Å; L641-A643 VanDerWaalsContact C-N 3.29Å; L641-A643 PolarHBondContact O-N 2.9Å; A643-L645 VanDerWaalsContact C-N 3.34Å; A643-L645 PolarHBondContact O-N 2.93Å; A643-G646 PolarHBondContact O-N 3.48Å; A643-T647 WeakPolarHBondContact O-CG2 3.25Å; A643-T647 PolarHBondContact O-N 2.91Å; A643-T647 PolarHBondContact O-OG1 3.46Å
644	I	93.7	Very high	92.4	Very high	31 Å²	31	30.5 Å²	30.5	16%	0.159	18%	0.18	C	C	.	.	H	α-helix	trans	-57.2	-46	177.8	-67.5	163.9	0	0	0	111.4	L156 F159 L160 K640 L641 T647 S648	L156-I644 HydrophobicContact CD2-CG1 4.47Å; L156-I644 HydrophobicContact CD2-CG2 4.26Å; F159-I644 HydrophobicContact CB-CD1 4.05Å; F159-I644 HydrophobicContact CB-CG1 3.71Å; L160-I644 HydrophobicContact CB-CD1 4.29Å; L160-I644 HydrophobicContact CD1-CD1 4.48Å; K640-I644 WeakPolarHBondContact O-CG1 3.32Å; K640-I644 PolarHBondContact O-N 2.9Å; L641-I644 PolarHBondContact O-N 3.36Å; I644-T647 PolarHBondContact O-OG1 3.48Å; I644-T647 VanDerWaalsContact O-OG1 3.1Å; I644-S648 WeakPolarHBondContact O-CB 3.39Å; I644-S648 PolarHBondContact O-N 3.49Å; I644-S648 VanDerWaalsContact O-N 3.08Å
645	L	94	Very high	91.5	Very high	72 Å²	72	30.4 Å²	30.4	38%	0.377	19%	0.187	S	C	.	.	H	α-helix	trans	-65	-45.9	177.5	-68.9	173.9	0	0	0	111.5	F403 F407 L641 A643 S648 I649	F403-L645 HydrophobicContact CE2-CD1 4.25Å; F403-L645 HydrophobicContact CZ-CD1 4.28Å; F407-L645 HydrophobicContact CD2-CB 4.5Å; F407-L645 HydrophobicContact CE2-CB 4.48Å; L641-L645 HydrophobicContact CG-CD1 4.32Å; L641-L645 WeakPolarHBondContact O-CG 3.43Å; L641-L645 PolarHBondContact O-N 3.3Å; A643-L645 VanDerWaalsContact C-N 3.34Å; A643-L645 PolarHBondContact O-N 2.93Å; L645-S648 PolarHBondContact O-N 2.9Å; L645-I649 WeakPolarHBondContact O-CB 3.35Å; L645-I649 WeakPolarHBondContact O-CG1 3.02Å; L645-I649 PolarHBondContact O-N 2.9Å
646	G	92.4	Very high	91.1	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60	-51.7	178.9	0	0	0	0	0	111.7	A642 A643 S648 I649 F650	A642-G646 PolarHBondContact O-N 2.86Å; A643-G646 PolarHBondContact O-N 3.48Å; G646-S648 PolarHBondContact O-N 3.3Å; G646-I649 PolarHBondContact O-N 3.32Å; G646-F650 VanDerWaalsContact O-CB 3.27Å; G646-F650 WeakPolarHBondContact O-CB 3.04Å; G646-F650 WeakPolarHBondContact O-CD2 3.3Å; G646-F650 WeakPolarHBondContact O-CG 3.43Å; G646-F650 PolarHBondContact O-N 3.13Å
647	T	90.3	Very high	90.6	Very high	14 Å²	14	37.6 Å²	37.6	9%	0.086	23%	0.231	C	C	.	.	H	α-helix	trans	-62.3	-42.5	-180	53.8	0	0	0	0	111.8	L156 V414 A643 I644 A651	L156-T647 VanDerWaalsContact CD2-OG1 3.28Å; L156-T647 WeakPolarHBondContact CD2-OG1 3.42Å; V414-T647 HydrophobicContact CB-CG2 4.35Å; V414-T647 HydrophobicContact CG2-CG2 3.58Å; A643-T647 WeakPolarHBondContact O-CG2 3.25Å; A643-T647 PolarHBondContact O-N 2.91Å; A643-T647 PolarHBondContact O-OG1 3.46Å; I644-T647 PolarHBondContact O-OG1 3.48Å; I644-T647 VanDerWaalsContact O-OG1 3.1Å; T647-A651 WeakPolarHBondContact O-CB 3.46Å; T647-A651 PolarHBondContact O-N 2.9Å; T647-A651 VanDerWaalsContact O-N 3.09Å
648	S	90	Very high	90.1	Very high	71 Å²	71	40.1 Å²	40.1	50%	0.497	24%	0.24	S	C	.	.	H	α-helix	trans	-68.4	-42.9	180	-176.5	0	0	0	0	112.7	I644 L645 G646 S652	I644-S648 WeakPolarHBondContact O-CB 3.39Å; I644-S648 PolarHBondContact O-N 3.49Å; I644-S648 VanDerWaalsContact O-N 3.08Å; L645-S648 PolarHBondContact O-N 2.9Å; G646-S648 PolarHBondContact O-N 3.3Å; S648-S652 PolarHBondContact O-N 2.9Å
649	I	92	Very high	89.7	Confident	60 Å²	60	40.4 Å²	40.4	31%	0.308	24%	0.244	S	C	.	.	H	α-helix	trans	-69.4	-47.7	-178.8	-68.1	173.6	0	0	0	109.7	F407 L645 G646 S652 F653	F407-I649 HydrophobicContact CE2-CD1 4.08Å; F407-I649 HydrophobicContact CZ-CD1 4.36Å; L645-I649 WeakPolarHBondContact O-CB 3.35Å; L645-I649 WeakPolarHBondContact O-CG1 3.02Å; L645-I649 PolarHBondContact O-N 2.9Å; G646-I649 PolarHBondContact O-N 3.32Å; I649-S652 PolarHBondContact O-N 2.81Å; I649-S652 PolarHBondContact O-OG 2.79Å; I649-F653 HydrophobicContact CG2-CD2 4.15Å; I649-F653 HydrophobicContact CG2-CE2 3.78Å; I649-F653 WeakPolarHBondContact O-CD2 3.47Å
650	F	90.9	Very high	89.5	Confident	0 Å²	0	43 Å²	43	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-69.3	-39.3	-174.1	-77.5	-125.5	0	0	0	111.9	F407 G411 L412 W415 G646 S652 F653 P661 L664	F407-F650 HydrophobicContact CD1-CE2 4.34Å; F407-F650 AromaticContact CE1-CE2 3.64Å; F407-F650 HydrophobicContact CE1-CE2 3.64Å; F407-F650 HydrophobicContact CE1-CZ 4.1Å; F407-F650 HydrophobicContact CE2-CE2 4.31Å; F407-F650 HydrophobicContact CZ-CD2 4.47Å; F407-F650 AromaticContact CZ-CE2 3.63Å; F407-F650 HydrophobicContact CZ-CE2 3.63Å; G411-F650 VanDerWaalsContact C-CD1 3.43Å; G411-F650 WeakPolarHBondContact O-CB 3.44Å; L412-F650 HydrophobicContact CD2-CD1 4.01Å; L412-F650 HydrophobicContact CD2-CE1 3.68Å; L412-F650 HydrophobicContact CG-CD1 4.35Å; L412-F650 HydrophobicContact CG-CE1 3.85Å; W415-F650 HydrophobicContact CB-CB 4.16Å; W415-F650 HydrophobicContact CB-CD1 4.18Å; W415-F650 HydrophobicContact CG-CD1 4.44Å; G646-F650 VanDerWaalsContact O-CB 3.27Å; G646-F650 WeakPolarHBondContact O-CB 3.04Å; G646-F650 WeakPolarHBondContact O-CD2 3.3Å; G646-F650 WeakPolarHBondContact O-CG 3.43Å; G646-F650 PolarHBondContact O-N 3.13Å; F650-S652 VanDerWaalsContact C-N 3.26Å; F650-S652 PolarHBondContact O-N 2.84Å; F650-F653 PolarHBondContact O-N 2.83Å; F650-P661 HydrophobicContact CD1-CB 3.59Å; F650-P661 HydrophobicContact CE1-CB 3.71Å; F650-P661 WeakPolarHBondContact CE1-O 3.45Å; F650-P661 HydrophobicContact CG-CB 4.22Å; F650-P661 HydrophobicContact CZ-CB 4.45Å; F650-P661 WeakPolarHBondContact CZ-O 3.36Å; F650-L664 HydrophobicContact CZ-CB 4.36Å
651	A	85.8	Confident	89.4	Confident	40 Å²	40	42.7 Å²	42.7	33%	0.331	26%	0.258	S	S	.	.	H	α-helix	trans	-59.8	-36.8	175.4	0	0	0	0	0	112.1	T647 F653 V654	T647-A651 WeakPolarHBondContact O-CB 3.46Å; T647-A651 PolarHBondContact O-N 2.9Å; T647-A651 VanDerWaalsContact O-N 3.09Å; A651-F653 PolarHBondContact O-N 2.86Å; A651-V654 WeakPolarHBondContact O-CG2 3.47Å; A651-V654 PolarHBondContact O-N 3.33Å
652	S	87.6	Confident	89.2	Confident	75 Å²	75	39.5 Å²	39.5	52%	0.524	24%	0.241	S	C	.	.	H	α-helix	trans	-67.8	-16.8	179.7	74.6	0	0	0	0	114.8	S648 I649 F650	S648-S652 PolarHBondContact O-N 2.9Å; I649-S652 PolarHBondContact O-N 2.81Å; I649-S652 PolarHBondContact O-OG 2.79Å; F650-S652 VanDerWaalsContact C-N 3.26Å; F650-S652 PolarHBondContact O-N 2.84Å
653	F	88.1	Confident	89	Confident	55 Å²	55	43.3 Å²	43.3	24%	0.241	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-4.6	-179.3	-75.2	-64.8	0	0	0	114	I649 F650 A651 G655 V656 T657 V660 P661	I649-F653 HydrophobicContact CG2-CD2 4.15Å; I649-F653 HydrophobicContact CG2-CE2 3.78Å; I649-F653 WeakPolarHBondContact O-CD2 3.47Å; F650-F653 PolarHBondContact O-N 2.83Å; A651-F653 PolarHBondContact O-N 2.86Å; F653-G655 PolarHBondContact O-N 2.98Å; F653-V656 PolarHBondContact O-N 3.26Å; F653-V656 VanDerWaalsContact O-N 3.15Å; F653-T657 PolarHBondContact O-N 2.72Å; F653-V660 HydrophobicContact CD2-CG1 4.25Å; F653-V660 HydrophobicContact CE1-CB 4.46Å; F653-V660 HydrophobicContact CE1-CG1 4.17Å; F653-V660 HydrophobicContact CE2-CG1 3.86Å; F653-V660 HydrophobicContact CZ-CG1 3.82Å; F653-P661 HydrophobicContact CB-CG 3.61Å; F653-P661 HydrophobicContact CD2-CG 4.27Å; F653-P661 HydrophobicContact CG-CG 4.19Å
654	V	83.1	Confident	89.1	Confident	34 Å²	34	46.4 Å²	46.4	21%	0.206	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	132.3	172.6	-178.2	0	0	0	0	108.6	D418 Y422 A651 V656	D418-V654 HydrophobicContact CB-CG1 4.17Å; D418-V654 HydrophobicContact CB-CG2 3.85Å; Y422-V654 HydrophobicContact CG-CG1 4.44Å; A651-V654 WeakPolarHBondContact O-CG2 3.47Å; A651-V654 PolarHBondContact O-N 3.33Å; V654-V656 PolarHBondContact O-N 2.8Å; V654-V656 VanDerWaalsContact O-N 3.14Å
655	G	78.1	Confident	89.1	Confident	38 Å²	38	44.9 Å²	44.9	39%	0.392	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.6	-12.4	-175.3	0	0	0	0	0	116.3	Y422 F653	Y422-G655 VanDerWaalsContact CE2-CA 3.48Å; F653-G655 PolarHBondContact O-N 2.98Å
656	V	85.9	Confident	89.1	Confident	107 Å²	107	42.4 Å²	42.4	65%	0.648	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-61.4	177.5	-176.3	0	0	0	0	111	F653 V654	F653-V656 PolarHBondContact O-N 3.26Å; F653-V656 VanDerWaalsContact O-N 3.15Å; V654-V656 PolarHBondContact O-N 2.8Å; V654-V656 VanDerWaalsContact O-N 3.14Å
657	T	85.4	Confident	89.2	Confident	55 Å²	55	46.2 Å²	46.2	34%	0.337	28%	0.281	S	S	.	.			trans	-152	135.2	176.4	62.8	0	0	0	0	111.7	F653 P661	F653-T657 PolarHBondContact O-N 2.72Å; T657-P661 WeakPolarHBondContact O-CD 3.3Å
658	K	84.3	Confident	89.5	Confident	65 Å²	65	46.2 Å²	46.2	28%	0.283	28%	0.283	S	S	.	.	S	Bend	trans	-77.7	-20.1	169.7	66.9	179.3	-175.4	177.2	0	113.9	W415 M419 S591 I662	W415-K658 HydrophobicContact CH2-CB 4.46Å; W415-K658 HydrophobicContact CZ2-CB 3.92Å; M419-K658 HydrophobicContact CE-CB 4.28Å; S591-K658 PolarHBondContact O-NZ 3.47Å; K658-I662 WeakPolarHBondContact O-CD1 3.41Å; K658-I662 WeakPolarHBondContact O-CG1 3.25Å
659	V	88.5	Confident	89.8	Confident	55 Å²	55	42.9 Å²	42.9	33%	0.333	26%	0.259	S	S	.	.	H	α-helix	trans	-72.5	-43.8	-169.6	-177.1	0	0	0	0	112.5	F589 I662 L663	F589-V659 HydrophobicContact CD2-CG1 4.25Å; F589-V659 HydrophobicContact CD2-CG2 4.27Å; F589-V659 HydrophobicContact CE2-CB 4.2Å; F589-V659 HydrophobicContact CE2-CG1 3.72Å; F589-V659 HydrophobicContact CE2-CG2 3.68Å; V659-I662 PolarHBondContact O-N 3.45Å; V659-L663 HydrophobicContact CG1-CD1 3.68Å; V659-L663 HydrophobicContact CG1-CG 4.17Å; V659-L663 WeakPolarHBondContact O-CG 3.44Å; V659-L663 PolarHBondContact O-N 3.18Å
660	V	90.8	Very high	90	Very high	55 Å²	55	42.5 Å²	42.5	33%	0.333	26%	0.26	S	S	.	.	H	α-helix	trans	-64.4	-51	-173.8	173.3	0	0	0	0	111.8	F653 I662 L663 L664	F653-V660 HydrophobicContact CD2-CG1 4.25Å; F653-V660 HydrophobicContact CE1-CB 4.46Å; F653-V660 HydrophobicContact CE1-CG1 4.17Å; F653-V660 HydrophobicContact CE2-CG1 3.86Å; F653-V660 HydrophobicContact CZ-CG1 3.82Å; V660-I662 VanDerWaalsContact C-N 3.32Å; V660-I662 PolarHBondContact O-N 3.43Å; V660-L663 PolarHBondContact O-N 2.86Å; V660-L664 HydrophobicContact CG1-CD1 3.83Å; V660-L664 WeakPolarHBondContact O-CB 3.33Å; V660-L664 PolarHBondContact O-N 3.39Å
661	P	91.4	Very high	90.2	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-58	-41.2	176.9	-27.5	37.6	0	0	0	113.5	F650 F653 T657 S665	F650-P661 HydrophobicContact CD1-CB 3.59Å; F650-P661 HydrophobicContact CE1-CB 3.71Å; F650-P661 WeakPolarHBondContact CE1-O 3.45Å; F650-P661 HydrophobicContact CG-CB 4.22Å; F650-P661 HydrophobicContact CZ-CB 4.45Å; F650-P661 WeakPolarHBondContact CZ-O 3.36Å; F653-P661 HydrophobicContact CB-CG 3.61Å; F653-P661 HydrophobicContact CD2-CG 4.27Å; F653-P661 HydrophobicContact CG-CG 4.19Å; T657-P661 WeakPolarHBondContact O-CD 3.3Å; P661-S665 WeakPolarHBondContact O-CB 3.42Å; P661-S665 PolarHBondContact O-N 2.71Å
662	I	91.5	Very high	90.6	Very high	2 Å²	2	44 Å²	44	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-65.7	-47.7	-179.2	-67.2	171.8	0	0	0	111.2	W415 T585 L588 F589 K658 V659 V660 S665 C666	W415-I662 HydrophobicContact CH2-CD1 3.98Å; W415-I662 HydrophobicContact CH2-CG1 4.05Å; W415-I662 HydrophobicContact CZ2-CG1 4.49Å; T585-I662 WeakPolarHBondContact O-CG2 3.46Å; L588-I662 HydrophobicContact CB-CD1 4.1Å; F589-I662 HydrophobicContact CB-CG2 4.18Å; K658-I662 WeakPolarHBondContact O-CD1 3.41Å; K658-I662 WeakPolarHBondContact O-CG1 3.25Å; V659-I662 PolarHBondContact O-N 3.45Å; V660-I662 VanDerWaalsContact C-N 3.32Å; V660-I662 PolarHBondContact O-N 3.43Å; I662-S665 PolarHBondContact O-N 3.42Å; I662-C666 VanDerWaalsContact O-CB 3.25Å; I662-C666 WeakPolarHBondContact O-CB 3.49Å; I662-C666 PolarHBondContact O-N 3.46Å
663	L	92.5	Very high	91	Very high	81 Å²	81	40.4 Å²	40.4	42%	0.424	24%	0.242	S	C	.	.	H	α-helix	trans	-68.3	-38.9	179.8	-69.9	179.7	0	0	0	112.1	V659 V660 S665 T667	V659-L663 HydrophobicContact CG1-CD1 3.68Å; V659-L663 HydrophobicContact CG1-CG 4.17Å; V659-L663 WeakPolarHBondContact O-CG 3.44Å; V659-L663 PolarHBondContact O-N 3.18Å; V660-L663 PolarHBondContact O-N 2.86Å; L663-S665 VanDerWaalsContact C-N 3.35Å; L663-T667 WeakPolarHBondContact O-CB 3.46Å; L663-T667 VanDerWaalsContact O-CG2 3.27Å; L663-T667 WeakPolarHBondContact O-CG2 3.26Å; L663-T667 PolarHBondContact O-N 3.11Å; L663-T667 PolarHBondContact O-OG1 3.35Å
664	L	94	Very high	91.3	Very high	64 Å²	64	42.3 Å²	42.3	34%	0.335	25%	0.254	S	S	.	.	H	α-helix	trans	-59.4	-46.9	173.4	-99.7	157.9	0	0	0	111.1	F407 F650 V660 T667 A668	F407-L664 HydrophobicContact CE1-CB 4.36Å; F407-L664 HydrophobicContact CE1-CD2 4.03Å; F407-L664 HydrophobicContact CZ-CD2 4.24Å; F650-L664 HydrophobicContact CZ-CB 4.36Å; V660-L664 HydrophobicContact CG1-CD1 3.83Å; V660-L664 WeakPolarHBondContact O-CB 3.33Å; V660-L664 PolarHBondContact O-N 3.39Å; L664-T667 PolarHBondContact O-OG1 3.01Å; L664-T667 VanDerWaalsContact O-OG1 3.05Å; L664-A668 VanDerWaalsContact O-CB 3.27Å; L664-A668 WeakPolarHBondContact O-CB 3.31Å; L664-A668 PolarHBondContact O-N 2.99Å
665	S	93.9	Very high	91.8	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-66.6	-45.9	179.9	-176.2	0	0	0	0	112.1	S408 L412 P661 I662 L663 A668 L669	S408-S665 WeakPolarHBondContact CB-OG 3.36Å; S408-S665 WeakPolarHBondContact OG-CA 3.34Å; S408-S665 PolarHBondContact OG-O 2.69Å; S408-S665 VanDerWaalsContact OG-O 3.11Å; S408-S665 PolarHBondContact OG-OG 2.87Å; L412-S665 WeakPolarHBondContact CD1-OG 3.33Å; P661-S665 WeakPolarHBondContact O-CB 3.42Å; P661-S665 PolarHBondContact O-N 2.71Å; I662-S665 PolarHBondContact O-N 3.42Å; L663-S665 VanDerWaalsContact C-N 3.35Å; S665-A668 PolarHBondContact O-N 2.95Å; S665-L669 WeakPolarHBondContact O-CB 3.21Å; S665-L669 VanDerWaalsContact O-CG 3.27Å; S665-L669 WeakPolarHBondContact O-CG 3.34Å; S665-L669 PolarHBondContact O-N 3.03Å
666	C	94.8	Very high	92.5	Very high	19 Å²	19	40.4 Å²	40.4	13%	0.128	24%	0.235	C	C	.	.	H	α-helix	trans	-61.1	-46.9	179	-178.9	0	0	0	0	111.7	T585 I662 L669 V670	T585-C666 WeakPolarHBondContact OG1-CB 3.43Å; I662-C666 VanDerWaalsContact O-CB 3.25Å; I662-C666 WeakPolarHBondContact O-CB 3.49Å; I662-C666 PolarHBondContact O-N 3.46Å; C666-L669 PolarHBondContact O-N 2.9Å; C666-V670 WeakPolarHBondContact O-CG2 3.35Å; C666-V670 PolarHBondContact O-N 2.67Å
667	T	95.1	Very high	92.7	Very high	80 Å²	80	39.4 Å²	39.4	49%	0.491	23%	0.226	S	C	.	.	H	α-helix	trans	-64.8	-43.1	178.3	52.6	0	0	0	0	111.8	L663 L664 L669 V670 C671	L663-T667 WeakPolarHBondContact O-CB 3.46Å; L663-T667 VanDerWaalsContact O-CG2 3.27Å; L663-T667 WeakPolarHBondContact O-CG2 3.26Å; L663-T667 PolarHBondContact O-N 3.11Å; L663-T667 PolarHBondContact O-OG1 3.35Å; L664-T667 PolarHBondContact O-OG1 3.01Å; L664-T667 VanDerWaalsContact O-OG1 3.05Å; T667-L669 PolarHBondContact O-N 3.13Å; T667-V670 PolarHBondContact O-N 2.9Å; T667-C671 WeakPolarHBondContact O-CB 3.49Å; T667-C671 PolarHBondContact O-N 3.43Å; T667-C671 PolarHBondContact O-SG 3.49Å
668	A	95.7	Very high	92.8	Very high	14 Å²	14	44.3 Å²	44.3	12%	0.116	24%	0.242	C	C	.	.	H	α-helix	trans	-58.9	-46.8	175.3	0	0	0	0	0	111.9	T404 F407 L664 S665 C671 G672	T404-A668 VanDerWaalsContact CB-O 3.28Å; T404-A668 WeakPolarHBondContact CB-O 3.33Å; T404-A668 HydrophobicContact CG2-CB 4.23Å; T404-A668 WeakPolarHBondContact CG2-O 3.18Å; F407-A668 HydrophobicContact CD1-CB 4.32Å; L664-A668 VanDerWaalsContact O-CB 3.27Å; L664-A668 WeakPolarHBondContact O-CB 3.31Å; L664-A668 PolarHBondContact O-N 2.99Å; S665-A668 PolarHBondContact O-N 2.95Å; A668-C671 PolarHBondContact O-N 3.31Å; A668-G672 PolarHBondContact O-N 2.7Å
669	L	95.9	Very high	93	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-66.3	-39.6	179.4	-70.3	167.4	0	0	0	112.9	M405 M578 A582 T585 F604 S665 C666 T667 G673	M405-L669 HydrophobicContact SD-CD2 3.98Å; M578-L669 HydrophobicContact CE-CD2 4.21Å; A582-L669 HydrophobicContact CB-CB 3.77Å; A582-L669 HydrophobicContact CB-CD1 4.49Å; T585-L669 HydrophobicContact CG2-CD1 4.14Å; F604-L669 HydrophobicContact CE2-CD1 3.79Å; S665-L669 WeakPolarHBondContact O-CB 3.21Å; S665-L669 VanDerWaalsContact O-CG 3.27Å; S665-L669 WeakPolarHBondContact O-CG 3.34Å; S665-L669 PolarHBondContact O-N 3.03Å; C666-L669 PolarHBondContact O-N 2.9Å; T667-L669 PolarHBondContact O-N 3.13Å; L669-G673 PolarHBondContact O-N 3Å
670	V	96.6	Very high	92.7	Very high	52 Å²	52	41.6 Å²	41.6	32%	0.315	23%	0.232	S	C	.	.	H	α-helix	trans	-64.1	-46.8	174.7	172	0	0	0	0	110.7	L579 A582 C666 T667 G673 L674	L579-V670 HydrophobicContact CD2-CG1 4.4Å; L579-V670 HydrophobicContact CD2-CG2 4.38Å; A582-V670 HydrophobicContact CB-CG2 3.67Å; C666-V670 WeakPolarHBondContact O-CG2 3.35Å; C666-V670 PolarHBondContact O-N 2.67Å; T667-V670 PolarHBondContact O-N 2.9Å; V670-G673 PolarHBondContact O-N 3.01Å; V670-L674 HydrophobicContact CG1-CD1 3.92Å; V670-L674 HydrophobicContact CG1-CG 4.36Å; V670-L674 WeakPolarHBondContact O-CB 3.35Å; V670-L674 VanDerWaalsContact O-CG 3.28Å; V670-L674 WeakPolarHBondContact O-CG 3.39Å; V670-L674 PolarHBondContact O-N 2.83Å
671	C	95.6	Very high	92	Very high	71 Å²	71	42.3 Å²	42.3	48%	0.48	23%	0.231	S	C	.	.	H	α-helix	trans	-59.9	-48.1	177.2	-72.7	0	0	0	0	111.6	T667 A668 L674 V675	T667-C671 WeakPolarHBondContact O-CB 3.49Å; T667-C671 PolarHBondContact O-N 3.43Å; T667-C671 PolarHBondContact O-SG 3.49Å; A668-C671 PolarHBondContact O-N 3.31Å; C671-L674 PolarHBondContact O-N 2.84Å; C671-V675 VanDerWaalsContact O-CG2 3.29Å; C671-V675 WeakPolarHBondContact O-CG2 3.44Å; C671-V675 PolarHBondContact O-N 3.01Å
672	G	94.8	Very high	91.1	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.6	-45.2	177.1	0	0	0	0	0	112.7	T404 A668 L674 V675 A676	T404-G672 WeakPolarHBondContact OG1-CA 3.36Å; A668-G672 PolarHBondContact O-N 2.7Å; G672-L674 PolarHBondContact O-N 3Å; G672-V675 PolarHBondContact O-N 3.11Å; G672-A676 WeakPolarHBondContact O-CB 3.47Å; G672-A676 PolarHBondContact O-N 3.42Å
673	G	94.6	Very high	89.7	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-63.3	-40.3	178.7	0	0	0	0	0	113.4	L669 V670 A676 L677	L669-G673 PolarHBondContact O-N 3Å; V670-G673 PolarHBondContact O-N 3.01Å; G673-A676 WeakPolarHBondContact O-CB 3.5Å; G673-A676 PolarHBondContact O-N 3.22Å; G673-L677 WeakPolarHBondContact O-CG 3.44Å; G673-L677 PolarHBondContact O-N 3.26Å
674	L	94.7	Very high	88.1	Confident	96 Å²	96	50.9 Å²	50.9	50%	0.503	27%	0.265	S	S	.	.	H	α-helix	trans	-68.3	-37.7	175.8	-70.1	175.8	0	0	0	112.5	V670 C671 G672	V670-L674 HydrophobicContact CG1-CD1 3.92Å; V670-L674 HydrophobicContact CG1-CG 4.36Å; V670-L674 WeakPolarHBondContact O-CB 3.35Å; V670-L674 VanDerWaalsContact O-CG 3.28Å; V670-L674 WeakPolarHBondContact O-CG 3.39Å; V670-L674 PolarHBondContact O-N 2.83Å; C671-L674 PolarHBondContact O-N 2.84Å; G672-L674 PolarHBondContact O-N 3Å
675	V	94.7	Very high	86.5	Confident	32 Å²	32	53.3 Å²	53.3	19%	0.194	27%	0.273	C	S	.	.	H	α-helix	trans	-68.1	-38.3	174.3	172	0	0	0	0	110.8	F397 I400 I401 C671 G672 L677 K678	F397-V675 HydrophobicContact CB-CG1 3.75Å; F397-V675 HydrophobicContact CD1-CG1 3.77Å; F397-V675 HydrophobicContact CG-CG1 3.86Å; I400-V675 HydrophobicContact CB-CG1 4.49Å; I400-V675 HydrophobicContact CG2-CG1 4.44Å; I400-V675 HydrophobicContact CG2-CG2 4.27Å; I401-V675 HydrophobicContact CD1-CG1 4.25Å; I401-V675 HydrophobicContact CG1-CB 4.45Å; I401-V675 HydrophobicContact CG1-CG1 4.15Å; C671-V675 VanDerWaalsContact O-CG2 3.29Å; C671-V675 WeakPolarHBondContact O-CG2 3.44Å; C671-V675 PolarHBondContact O-N 3.01Å; G672-V675 PolarHBondContact O-N 3.11Å; V675-L677 VanDerWaalsContact C-N 3.29Å; V675-L677 PolarHBondContact O-N 2.83Å; V675-K678 WeakPolarHBondContact O-CB 3.35Å; V675-K678 PolarHBondContact O-N 2.8Å
676	A	92.3	Very high	84.8	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-56	-43.8	176.3	0	0	0	0	0	111.7	I401 V571 I574 G672 G673 K678 L679	I401-A676 HydrophobicContact CD1-CB 3.84Å; I401-A676 HydrophobicContact CG1-CB 4.19Å; V571-A676 WeakPolarHBondContact CG1-O 3.21Å; I574-A676 HydrophobicContact CB-CB 4.24Å; I574-A676 HydrophobicContact CG2-CB 3.64Å; G672-A676 WeakPolarHBondContact O-CB 3.47Å; G672-A676 PolarHBondContact O-N 3.42Å; G673-A676 WeakPolarHBondContact O-CB 3.5Å; G673-A676 PolarHBondContact O-N 3.22Å; A676-K678 PolarHBondContact O-N 2.67Å; A676-L679 WeakPolarHBondContact O-CB 3.49Å; A676-L679 PolarHBondContact O-N 2.79Å
677	L	89.4	Confident	83.1	Confident	86 Å²	86	54.4 Å²	54.4	45%	0.45	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-11.2	177.9	-64.2	175.4	0	0	0	114.6	G673 V675	G673-L677 WeakPolarHBondContact O-CG 3.44Å; G673-L677 PolarHBondContact O-N 3.26Å; V675-L677 VanDerWaalsContact C-N 3.29Å; V675-L677 PolarHBondContact O-N 2.83Å
678	K	88.8	Confident	80.7	Confident	158 Å²	158	56.2 Å²	56.2	69%	0.687	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-7.3	174.9	-62.8	-66.2	-175.4	179.7	0	113.3	F397 V675 A676	F397-K678 HydrophobicContact CE2-CB 4.19Å; V675-K678 WeakPolarHBondContact O-CB 3.35Å; V675-K678 PolarHBondContact O-N 2.8Å; A676-K678 PolarHBondContact O-N 2.67Å
679	L	86.5	Confident	79.9	Confident	10 Å²	10	58.4 Å²	58.4	5%	0.052	29%	0.288	C	S	.	.	S	Bend	trans	-71.4	147.8	175.8	-73.1	170.7	0	0	0	111.5	F397 M398 I401 V571 I618 L622 A676	F397-L679 HydrophobicContact CB-CD2 3.81Å; F397-L679 HydrophobicContact CB-CG 4.42Å; F397-L679 HydrophobicContact CD2-CD2 4.23Å; M398-L679 HydrophobicContact CG-CD2 4.42Å; M398-L679 HydrophobicContact SD-CD1 3.54Å; M398-L679 VanDerWaalsContact SD-CD1 3.54Å; M398-L679 HydrophobicContact SD-CD2 4.31Å; I401-L679 HydrophobicContact CD1-CD1 3.42Å; I401-L679 VanDerWaalsContact CD1-CD1 3.42Å; I401-L679 HydrophobicContact CD1-CG 4.2Å; V571-L679 HydrophobicContact CG2-CB 4.05Å; I618-L679 HydrophobicContact CD1-CB 4.48Å; I618-L679 HydrophobicContact CD1-CD1 4.14Å; L622-L679 HydrophobicContact CD2-CD2 4.47Å; A676-L679 WeakPolarHBondContact O-CB 3.49Å; A676-L679 PolarHBondContact O-N 2.79Å
680	P	82.3	Confident	79.1	Confident	53 Å²	53	61.4 Å²	61.4	34%	0.344	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-68.1	137	172	29.4	-33.5	0	0	0	110.3	L622 T682	L622-P680 HydrophobicContact CD1-CG 4.08Å; P680-T682 PolarHBondContact O-N 3.04Å
681	E	77.8	Confident	78.1	Confident	69 Å²	69	61.9 Å²	61.9	32%	0.322	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-67.3	133	174.3	-171.5	65.6	-113.7	0	0	110.3	R570 R683	R570-E681 PolarHBondContact N-OE1 2.89Å; E681-R683 HydrophobicContact CG-CB 4.15Å
682	T	72.6	Confident	77.1	Confident	2 Å²	2	61.4 Å²	61.4	1%	0.012	29%	0.292	C	S	.	.			trans	-102	3.4	-174.4	53.5	0	0	0	0	113.2	I618 E621 P680 E684 K685	I618-T682 HydrophobicContact CD1-CG2 4.41Å; I618-T682 HydrophobicContact CG1-CG2 3.94Å; E621-T682 HydrophobicContact CB-CG2 4.15Å; E621-T682 VanDerWaalsContact OE2-CB 3.25Å; E621-T682 WeakPolarHBondContact OE2-CB 3.12Å; E621-T682 PolarHBondContact OE2-OG1 2.85Å; P680-T682 PolarHBondContact O-N 3.04Å; T682-E684 VanDerWaalsContact C-N 3.3Å; T682-E684 PolarHBondContact O-N 2.69Å; T682-E684 VanDerWaalsContact O-N 3.13Å; T682-K685 PolarHBondContact O-N 2.74Å; T682-K685 VanDerWaalsContact O-N 3.13Å
683	R	60.2	Low	76	Confident	106 Å²	106	65.2 Å²	65.2	40%	0.4	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-33.1	-163	170.7	176.4	175.8	-172.1	1.6	117	E566 K567 R570 E681	E566-R683 PolarHBondContact O-NE 3.21Å; E566-R683 VanDerWaalsContact O-NE 3.11Å; E566-R683 PolarHBondContact O-NH1 3.24Å; E566-R683 PolarHBondContact O-NH2 2.77Å; K567-R683 PolarHBondContact O-NH1 3.22Å; R570-R683 VanDerWaalsContact NH1-CB 3.27Å; R570-R683 VanDerWaalsContact NH1-CG 3.33Å; R570-R683 PolarHBondContact NH1-O 3.38Å; E681-R683 HydrophobicContact CG-CB 4.15Å
684	E	59.2	Low	74.8	Confident	155 Å²	155	69.5 Å²	69.5	72%	0.724	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.6	15.5	-178.4	-59.1	179.6	174.4	0	0	111.5	M233 T682	M233-E684 HydrophobicContact CE-CB 4.41Å; T682-E684 VanDerWaalsContact C-N 3.3Å; T682-E684 PolarHBondContact O-N 2.69Å; T682-E684 VanDerWaalsContact O-N 3.13Å
685	K	61.7	Low	73.3	Confident	116 Å²	116	67.6 Å²	67.6	50%	0.504	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-86.6	130.7	-179.6	-76.5	-169.1	176	-173.6	0	111.4	R236 T682	R236-K685 PolarHBondContact NH2-O 2.84Å; T682-K685 PolarHBondContact O-N 2.74Å; T682-K685 VanDerWaalsContact O-N 3.13Å
686	I	58.4	Low	71.7	Confident	40 Å²	40	70.4 Å²	70.4	21%	0.205	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-67.1	136.5	169.6	-63.9	174.6	0	0	0	108.2	A96 E97 E100 M233 Q688	A96-I686 HydrophobicContact CB-CG2 4.11Å; E97-I686 HydrophobicContact CG-CD1 3.69Å; E100-I686 HydrophobicContact CG-CG2 3.8Å; M233-I686 HydrophobicContact SD-CG1 4.13Å; I686-Q688 PolarHBondContact O-N 2.88Å
687	L	58.1	Low	70	Confident	1 Å²	1	76.3 Å²	76.3	1%	0.005	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-68.4	116.2	176	-70.7	168.8	0	0	0	107.9	A96 R236 R306 E621	A96-L687 WeakPolarHBondContact CB-O 3.24Å; R236-L687 VanDerWaalsContact NH1-CD1 3.31Å; R306-L687 VanDerWaalsContact CZ-O 3.3Å; R306-L687 PolarHBondContact NH1-O 3.08Å; R306-L687 PolarHBondContact NH2-O 3.25Å; E621-L687 HydrophobicContact CB-CD2 4.43Å
688	Q	44.6	Very low	68.2	Low	119 Å²	119	75.4 Å²	75.4	56%	0.556	35%	0.347	S	S	*	.			trans	-72.4	0	175	-70.6	-177	-26.7	0	0	112.8	E93 R306 P624 A625 I686	E93-Q688 PolarHBondContact OE1-NE2 2.91Å; E93-Q688 VanDerWaalsContact OE1-NE2 3.13Å; R306-Q688 PolarHBondContact NH2-O 2.69Å; R306-Q688 PolarHBondContact NH2-OXT 3.02Å; P624-Q688 CarbonylContact C-O 3.58Å; P624-Q688 WeakPolarHBondContact CA-O 3.23Å; P624-Q688 HydrophobicContact CB-CB 4.38Å; P624-Q688 WeakPolarHBondContact CB-O 3Å; A625-Q688 PolarHBondContact N-O 3.02Å; I686-Q688 PolarHBondContact O-N 2.88Å

Retrieved 688 of 688 residues in 1973.8 ms (Link to these results)

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