A0A3Q0KF18_SCHMA Loading...

DNA mismatch repair protein

Component of the post-replicative DNA mismatch repair system (MMR).

AlphaFold DB , UniProt , Accession A0A3Q0KF18, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,186 aa.

						>A0A3Q0KF18_SCHMA|A0A3Q0KF18
MQKSLLTFFTRSPKPLSETSNKICPESSKNTNSPVACLRPPGECDDENMSSPTTSSVSKRRRVIIESSDDEDEASVLSKEKTESVNKHDLSHYSFSPQPVRQNGKKINEATDESLLETSVVAQVNEAFEDESVSWTHLSLPFLEPSKIKDINGRRPDHPEYDSHTLYVPEEFKTKQTPGMRQWWELKSRYTDVILFFKVGKFYEMYHMDAMIGVKELGLVFMKGSFAHCGFPEVAFPRMADQLVRKGYKVARIEQTESIDAMNERCKRKSSSEKVVRREVCQIITPGTCTASTRSEISDVKAVETGDVENGDEGFRDLINLAHPDSFLLAVVESHGDKSYPFAFGIGLLNASTGKINIGQFLDDRHCSRLRTFLSHYPPNQLLIERGTAGSAIKSLIKTSLSCVPTEFLTPTKQFWSAKNTVQELETADYFPKQTSNTTVDSNHVSKVSSFPDKENWPDVLLNMLSEDDPLGRTVKSEWELAFRCLGALIYYLRYCLIDREVLSLGFIDVYVPIDMKNANSQRSPGSIELFYDTQSQMVLDNITLSNLDIIRNNVDGSQEGSLLQRLNTCCTFFGRRLLRQWITAPPCNPNVIRQRQLAIENLISISDIIPKLREKLAQLPDLERLITKIHLLGSKGDKNHPDSRAIIFEEVQYSRKNIIDFVATLDGFELSYKIIHEINHYPLSSAYLKKLVTLTNLGGNFPDITEKINYFKNAFDAEKAKREGRITPEPGIDPEYDESLSEIKRIVEDMDRFLLKWSKTFGTRLAYWGTGRNRYQIEIPESLASRVPNSWQLSSQRKGVKRYTCSETQEWLSELTAAEERKDASLRSIMQHIFSSFSESFTHWHMAMSCLAELDCIIALYLYSTNASDVMCLPEFIDLNSSTEPLLEIVDGIHPCLINTFSGGDIISNDIKLGTTSSMINSPTQHHTLHDMFNNASVILVTGPNMGGKSTLMRQAALLVILAHLGCRIPAKSCKLTPVDRIFSRLGASDRMLSGESTFLVELSETASILHHITPHSLVLMDELGRGTSTHDGSALAGAVVSYLAKPNGRFFNGSGPRTLFSTHYHSLVDQVANKDRSTSDEDINHLCIGLGHMACMVEAESESTNGLENITFLYKFIPGACPKSYGFNAARLAMLPDKVIRLGLAKAKEFEKTTATFACVRRLLQGPVTVEDLRQWNSKLKAFL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.2	Very low	47.1	Very low	203 Å²	203	141.1 Å²	141.1	100%	1	69%	0.686	S	S	*	*				0	-64.3	0	-96.3	-169	-101.7	0	0	113.3	K3 S4 L5	M1-K3 VanDerWaalsContact C-N 3.34Å; M1-K3 PolarHBondContact O-N 2.97Å; M1-S4 WeakPolarHBondContact O-CB 3.29Å; M1-S4 PolarHBondContact O-N 3.22Å; M1-L5 PolarHBondContact O-N 3.36Å; M1-L5 VanDerWaalsContact O-N 3.14Å
2	Q	40.7	Very low	46.1	Very low	165 Å²	165	137.6 Å²	137.6	77%	0.771	69%	0.687	S	S	*	*	H	α-helix	trans	-55.2	-41	-179.8	-84.7	176.5	-25.8	0	0	114.4	S4 L5 L6	Q2-S4 VanDerWaalsContact C-N 3.32Å; Q2-S4 PolarHBondContact O-N 3.1Å; Q2-L5 PolarHBondContact O-N 3.34Å; Q2-L6 PolarHBondContact O-N 2.95Å
3	K	45.1	Very low	45.1	Very low	184 Å²	184	137.1 Å²	137.1	80%	0.8	70%	0.699	S	S	*	*	H	α-helix	trans	-61.5	-35.5	174.1	-102.4	-178.5	176.3	178.2	0	113.3	M1 T7	M1-K3 VanDerWaalsContact C-N 3.34Å; M1-K3 PolarHBondContact O-N 2.97Å; K3-T7 WeakPolarHBondContact O-CB 3.48Å; K3-T7 PolarHBondContact O-N 2.86Å; K3-T7 VanDerWaalsContact O-N 3.08Å; K3-T7 PolarHBondContact O-OG1 3.44Å
4	S	62.2	Low	44	Very low	93 Å²	93	141.3 Å²	141.3	65%	0.65	71%	0.71	S	S	*	*	H	α-helix	trans	-73.2	-39.5	-180	-142.2	0	0	0	0	111.5	M1 Q2 T7 F8	M1-S4 WeakPolarHBondContact O-CB 3.29Å; M1-S4 PolarHBondContact O-N 3.22Å; Q2-S4 VanDerWaalsContact C-N 3.32Å; Q2-S4 PolarHBondContact O-N 3.1Å; S4-T7 PolarHBondContact O-N 3.34Å; S4-F8 WeakPolarHBondContact O-CB 3.44Å; S4-F8 PolarHBondContact O-N 3.42Å
5	L	46.5	Very low	43.1	Very low	97 Å²	97	140 Å²	140	51%	0.508	72%	0.716	S	S	.	*	H	α-helix	trans	-64.5	-46.8	174.5	-84.4	156.4	0	0	0	111.8	M1 Q2 T7 F8 F9	M1-L5 PolarHBondContact O-N 3.36Å; M1-L5 VanDerWaalsContact O-N 3.14Å; Q2-L5 PolarHBondContact O-N 3.34Å; L5-T7 VanDerWaalsContact C-N 3.33Å; L5-T7 PolarHBondContact O-N 3.13Å; L5-F8 PolarHBondContact O-N 3.42Å; L5-F9 HydrophobicContact CD2-CD2 4.5Å; L5-F9 HydrophobicContact CD2-CE2 3.86Å; L5-F9 VanDerWaalsContact O-CD2 3.23Å; L5-F9 WeakPolarHBondContact O-CD2 3.34Å; L5-F9 PolarHBondContact O-N 3.4Å; L5-F9 VanDerWaalsContact O-N 3.11Å
6	L	49	Very low	42.3	Very low	116 Å²	116	142.6 Å²	142.6	61%	0.607	73%	0.73	S	S	*	*	H	α-helix	trans	-62.7	-38	176.6	-92.7	150.5	0	0	0	112.5	Q2 F8 T10	Q2-L6 PolarHBondContact O-N 2.95Å; L6-F8 VanDerWaalsContact C-N 3.33Å; L6-T10 WeakPolarHBondContact O-CB 3.42Å; L6-T10 WeakPolarHBondContact O-CG2 3.49Å; L6-T10 PolarHBondContact O-N 3.41Å; L6-T10 PolarHBondContact O-OG1 3.48Å
7	T	54.6	Low	41.3	Very low	73 Å²	73	140.4 Å²	140.4	45%	0.448	73%	0.731	S	S	.	*	H	α-helix	trans	-70.8	-29.9	178.1	-46.5	0	0	0	0	112.1	K3 S4 L5	K3-T7 WeakPolarHBondContact O-CB 3.48Å; K3-T7 PolarHBondContact O-N 2.86Å; K3-T7 VanDerWaalsContact O-N 3.08Å; K3-T7 PolarHBondContact O-OG1 3.44Å; S4-T7 PolarHBondContact O-N 3.34Å; L5-T7 VanDerWaalsContact C-N 3.33Å; L5-T7 PolarHBondContact O-N 3.13Å
8	F	58	Low	40.4	Very low	160 Å²	160	143.1 Å²	143.1	70%	0.702	74%	0.739	S	S	*	*	H	α-helix	trans	-72.7	-42.2	176.8	-172.9	-99.4	0	0	0	112.1	S4 L5 L6	S4-F8 WeakPolarHBondContact O-CB 3.44Å; S4-F8 PolarHBondContact O-N 3.42Å; L5-F8 PolarHBondContact O-N 3.42Å; L6-F8 VanDerWaalsContact C-N 3.33Å
9	F	47.2	Very low	39.7	Very low	159 Å²	159	142.3 Å²	142.3	70%	0.697	74%	0.741	S	S	*	*	H	α-helix	trans	-82.7	-15	-178.1	-73.6	-68.6	0	0	0	115.2	L5	L5-F9 HydrophobicContact CD2-CD2 4.5Å; L5-F9 HydrophobicContact CD2-CE2 3.86Å; L5-F9 VanDerWaalsContact O-CD2 3.23Å; L5-F9 WeakPolarHBondContact O-CD2 3.34Å; L5-F9 PolarHBondContact O-N 3.4Å; L5-F9 VanDerWaalsContact O-N 3.11Å
10	T	40.6	Very low	38.9	Very low	95 Å²	95	140.7 Å²	140.7	58%	0.583	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.8	1.1	-177	55	0	0	0	0	114.7	L6 S12	L6-T10 WeakPolarHBondContact O-CB 3.42Å; L6-T10 WeakPolarHBondContact O-CG2 3.49Å; L6-T10 PolarHBondContact O-N 3.41Å; L6-T10 PolarHBondContact O-OG1 3.48Å; T10-S12 PolarHBondContact O-N 2.91Å
11	R	32.8	Very low	38.2	Very low	207 Å²	207	142 Å²	142	78%	0.781	75%	0.75	S	S	*	*			trans	-77.1	87.7	174	-83.2	-177	175.9	-170.8	-0.6	110.7
12	S	34.9	Very low	37.4	Very low	99 Å²	99	141.6 Å²	141.6	69%	0.692	74%	0.743	S	S	*	*			trans	-67.3	143.2	149.9	49.3	0	0	0	0	109.2	T10 K14	T10-S12 PolarHBondContact O-N 2.91Å; S12-K14 PolarHBondContact O-N 3.42Å
13	P	33.9	Very low	36.7	Very low	131 Å²	131	142 Å²	142	85%	0.851	75%	0.749	S	S	*	*			trans	-69.4	115.8	-168.9	26.9	-32.1	0	0	0	110.1
14	K	29.8	Very low	35.5	Very low	196 Å²	196	138.7 Å²	138.7	85%	0.852	75%	0.748	S	S	*	*			trans	-80.6	136.7	164.7	-81.6	-173	175.7	-176.5	0	109.1	S12	S12-K14 PolarHBondContact O-N 3.42Å
15	P	30	Very low	33.7	Very low	122 Å²	122	139.5 Å²	139.5	79%	0.792	75%	0.75	S	S	*	*			trans	-69.8	139.3	-178.8	29.7	-34.3	0	0	0	110.7	S17	P15-S17 PolarHBondContact O-N 2.85Å; P15-S17 VanDerWaalsContact O-N 3.11Å
16	L	29.7	Very low	32.5	Very low	181 Å²	181	143.7 Å²	143.7	95%	0.948	77%	0.768	S	S	*	*			trans	-65.4	103.8	178.2	-77	152.4	0	0	0	109.5
17	S	26.1	Very low	31.4	Very low	106 Å²	106	143.5 Å²	143.5	74%	0.741	78%	0.776	S	S	*	*			trans	-83.2	124.4	166.7	57.8	0	0	0	0	110.1	P15	P15-S17 PolarHBondContact O-N 2.85Å; P15-S17 VanDerWaalsContact O-N 3.11Å
18	E	26	Very low	29.9	Very low	188 Å²	188	145 Å²	145	88%	0.879	79%	0.789	S	S	*	*			trans	-39.3	125.3	170.5	-60.7	168.6	154.6	0	0	113
19	T	25.8	Very low	28.2	Very low	128 Å²	128	146.8 Å²	146.8	79%	0.785	80%	0.796	S	S	*	*			trans	-155.1	116.7	151.6	10.5	0	0	0	0	112.3
20	S	24.7	Very low	26.8	Very low	110 Å²	110	146.6 Å²	146.6	77%	0.769	80%	0.803	S	S	*	*			trans	68.6	86.3	151	58	0	0	0	0	119.7	K22	S20-K22 PolarHBondContact O-N 2.92Å
21	N	24.4	Very low	26	Very low	168 Å²	168	148.6 Å²	148.6	90%	0.898	82%	0.815	S	S	*	*			trans	-36.8	118	134.4	-76.1	-36	0	0	0	112.1
22	K	22.8	Very low	25.4	Very low	196 Å²	196	146.8 Å²	146.8	85%	0.852	82%	0.821	S	S	*	*			trans	-171.7	90.9	153.6	-105.8	173.4	-169.9	-175.7	0	109.9	S20	S20-K22 PolarHBondContact O-N 2.92Å
23	I	26.3	Very low	24.8	Very low	174 Å²	174	147 Å²	147	89%	0.892	82%	0.822	S	S	*	*			trans	-129.5	116.2	153.5	-61.4	-179.2	0	0	0	107.1
24	C	20.5	Very low	24.4	Very low	114 Å²	114	147 Å²	147	77%	0.77	82%	0.822	S	S	*	*			trans	-69.2	155.5	176.5	-75.4	0	0	0	0	112
25	P	25.1	Very low	24.1	Very low	109 Å²	109	144 Å²	144	71%	0.708	82%	0.82	S	S	*	*			trans	-90.9	154.6	-173.7	37.4	-32.7	0	0	0	112.1
26	E	20.9	Very low	23.6	Very low	186 Å²	186	142.6 Å²	142.6	87%	0.869	82%	0.819	S	S	*	*			trans	163.4	158	132.6	-91.6	177.4	-178.2	0	0	113.4
27	S	24.4	Very low	23.2	Very low	112 Å²	112	139.3 Å²	139.3	78%	0.783	81%	0.809	S	S	*	*			trans	80.5	113.7	-173.8	75.7	0	0	0	0	114.8
28	S	23.5	Very low	23	Very low	103 Å²	103	142.4 Å²	142.4	72%	0.72	82%	0.817	S	S	*	*			cis	130.8	116.2	9	57.3	0	0	0	0	108.8
29	K	22.1	Very low	22.7	Very low	198 Å²	198	145 Å²	145	86%	0.861	82%	0.819	S	S	*	*			trans	70.8	105.8	140.3	-66.3	-177.8	176.8	179.6	0	120.8
30	N	19.4	Very low	22.5	Very low	155 Å²	155	144.8 Å²	144.8	83%	0.829	82%	0.819	S	S	*	*				15.5	122.3	119.7	-73.4	-2.2	0	0	0	118.7
31	T	23.5	Very low	22.4	Very low	138 Å²	138	145.8 Å²	145.8	85%	0.847	82%	0.823	S	S	*	*			trans	-142.9	108.4	138	46.5	0	0	0	0	109.6
32	N	20.9	Very low	22.2	Very low	169 Å²	169	141.2 Å²	141.2	90%	0.904	82%	0.816	S	S	*	*			trans	-85.4	128.9	162.2	-87.5	-19.2	0	0	0	108.3
33	S	22.4	Very low	22.1	Very low	102 Å²	102	140.4 Å²	140.4	71%	0.713	82%	0.815	S	S	*	*			trans	-154	125.1	156.1	56.3	0	0	0	0	109.5
34	P	24.2	Very low	21.8	Very low	131 Å²	131	137.1 Å²	137.1	85%	0.851	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-83.6	136.4	-176.7	32.7	-31.2	0	0	0	111.1
35	V	23	Very low	21.7	Very low	135 Å²	135	137.7 Å²	137.7	82%	0.818	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-84.6	118.3	178.1	176.1	0	0	0	0	109.3
36	A	19.8	Very low	21.5	Very low	91 Å²	91	139.2 Å²	139.2	75%	0.752	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-91.4	130.3	166.6	0	0	0	0	0	110
37	C	21	Very low	21.5	Very low	112 Å²	112	138.2 Å²	138.2	76%	0.757	80%	0.799	S	S	*	*			trans	-143.8	95.1	162.4	-87.3	0	0	0	0	106.6
38	L	21.5	Very low	21.2	Very low	171 Å²	171	140.1 Å²	140.1	90%	0.895	80%	0.801	S	S	*	*				63.8	100.7	96.9	-69.6	171.8	0	0	0	114.1
39	R	20.7	Very low	21.2	Very low	243 Å²	243	144 Å²	144	92%	0.917	81%	0.81	S	S	*	*			trans	-86.7	149	163.4	-79.9	-177.1	-178.8	178.7	-0.4	110.5
40	P	22.5	Very low	21.1	Very low	123 Å²	123	138.8 Å²	138.8	80%	0.799	80%	0.798	S	S	*	*			trans	-83.3	153.6	175.8	33	-31.5	0	0	0	112.8
41	P	21.5	Very low	21.1	Very low	131 Å²	131	136.7 Å²	136.7	85%	0.851	80%	0.795	S	S	*	*			trans	-105.7	164.3	-177.5	39.9	-31.5	0	0	0	113.7
42	G	21	Very low	21.1	Very low	72 Å²	72	135.6 Å²	135.6	74%	0.742	79%	0.791	S	S	*	*			trans	116.6	137.8	164.9	0	0	0	0	0	112.5
43	E	20.6	Very low	21.1	Very low	180 Å²	180	133.8 Å²	133.8	84%	0.841	79%	0.786	S	S	*	*			cis	-167.3	148.7	9.6	-102.7	170.9	170.9	0	0	107
44	C	19	Very low	21	Very low	105 Å²	105	135.9 Å²	135.9	71%	0.709	80%	0.795	S	S	*	*			trans	41.6	152.7	135	-58.4	0	0	0	0	120.8
45	D	19.4	Very low	21	Very low	126 Å²	126	134.6 Å²	134.6	67%	0.674	79%	0.789	S	S	*	*			cis	-172.2	152.4	-15.1	-101.1	-33.5	0	0	0	103.9
46	D	19.7	Very low	20.9	Very low	140 Å²	140	133.7 Å²	133.7	75%	0.749	79%	0.788	S	S	*	*			trans	71.4	136.1	140.6	-76.1	-29.8	0	0	0	125.2
47	E	20.7	Very low	21.2	Very low	166 Å²	166	135.5 Å²	135.5	78%	0.776	79%	0.79	S	S	*	*			trans	95.2	95.1	143.1	-77.7	-173.5	-162.9	0	0	121.8
48	N	18.6	Very low	21.2	Very low	152 Å²	152	135 Å²	135	81%	0.813	79%	0.787	S	S	*	*				41.4	105.2	118	-73.2	-28.7	0	0	0	118.5
49	M	23.3	Very low	21.3	Very low	184 Å²	184	136.3 Å²	136.3	91%	0.906	79%	0.786	S	S	*	*			trans	-153	143	133.6	-114.2	-75	166.6	0	0	111.7
50	S	20.6	Very low	21.3	Very low	89 Å²	89	136.4 Å²	136.4	62%	0.622	79%	0.786	S	S	*	*			trans	-71.7	149.5	-160.9	48.6	0	0	0	0	116.3
51	S	18.6	Very low	21.2	Very low	110 Å²	110	141.5 Å²	141.5	77%	0.769	79%	0.79	S	S	*	*			trans	-20.5	143.4	160.2	56	0	0	0	0	118.8
52	P	23.2	Very low	21.3	Very low	115 Å²	115	146.4 Å²	146.4	75%	0.747	79%	0.791	S	S	*	*			trans	-125.4	129.7	131.5	32.7	-20.1	0	0	0	112.6
53	T	21.3	Very low	21.4	Very low	132 Å²	132	148.4 Å²	148.4	81%	0.81	79%	0.789	S	S	*	*			trans	50.1	102.5	148.9	40.3	0	0	0	0	119.2	S55	T53-S55 PolarHBondContact O-N 2.92Å; T53-S55 VanDerWaalsContact O-N 3.07Å
54	T	21.4	Very low	21.5	Very low	146 Å²	146	147 Å²	147	90%	0.896	79%	0.785	S	S	*	*			trans	-47.1	101.5	159.9	51.1	0	0	0	0	112.7
55	S	23.1	Very low	21.8	Very low	103 Å²	103	148.5 Å²	148.5	72%	0.72	79%	0.785	S	S	*	*			trans	-79.1	123.6	154.2	58.9	0	0	0	0	107.6	T53 V57	T53-S55 PolarHBondContact O-N 2.92Å; T53-S55 VanDerWaalsContact O-N 3.07Å; S55-V57 PolarHBondContact O-N 2.89Å
56	S	22.3	Very low	21.9	Very low	116 Å²	116	150.7 Å²	150.7	81%	0.811	79%	0.791	S	S	*	*			trans	-63.6	98.4	178.3	55.5	0	0	0	0	109.5	S58	S56-S58 PolarHBondContact O-N 2.87Å
57	V	24.3	Very low	22.2	Very low	130 Å²	130	147.2 Å²	147.2	79%	0.788	78%	0.778	S	S	*	*			trans	-59.6	111.2	167.2	177.9	0	0	0	0	106.9	S55 K59	S55-V57 PolarHBondContact O-N 2.89Å; V57-K59 PolarHBondContact O-N 2.84Å
58	S	22.9	Very low	22.6	Very low	100 Å²	100	144.3 Å²	144.3	70%	0.699	78%	0.776	S	S	*	*			trans	-57.7	114	175.1	57.6	0	0	0	0	107.9	S56 R60	S56-S58 PolarHBondContact O-N 2.87Å; S58-R60 PolarHBondContact O-N 2.87Å
59	K	22	Very low	23.1	Very low	200 Å²	200	141.3 Å²	141.3	87%	0.87	76%	0.76	S	S	*	*			trans	-55.4	106.1	167.6	-70.9	177.6	178.7	175.8	0	106.3	V57 R61	V57-K59 PolarHBondContact O-N 2.84Å; K59-R61 PolarHBondContact O-N 3.5Å
60	R	21	Very low	23.3	Very low	244 Å²	244	137.9 Å²	137.9	92%	0.921	75%	0.745	S	S	*	*			trans	-52.5	106.9	166.7	-86.6	-175.7	175.8	176.6	-0.5	106.3	S58 R62	S58-R60 PolarHBondContact O-N 2.87Å; R60-R62 PolarHBondContact O-N 3.07Å; R60-R62 VanDerWaalsContact O-N 3.12Å
61	R	21.2	Very low	23.5	Very low	230 Å²	230	142 Å²	142	87%	0.868	76%	0.755	S	S	*	*			trans	-55.9	118.6	173	-89.7	178.1	168.6	166	-3.6	106.4	K59 V63	K59-R61 PolarHBondContact O-N 3.5Å; R61-V63 VanDerWaalsContact C-N 3.34Å; R61-V63 PolarHBondContact O-N 3.4Å
62	R	22.4	Very low	23.8	Very low	235 Å²	235	144.3 Å²	144.3	89%	0.887	76%	0.758	S	S	*	*			trans	-57.1	105.8	158.1	-85.8	-179.1	176.8	156.9	-1.7	106	R60 I64	R60-R62 PolarHBondContact O-N 3.07Å; R60-R62 VanDerWaalsContact O-N 3.12Å; R62-I64 PolarHBondContact O-N 3.08Å
63	V	23.8	Very low	23.9	Very low	114 Å²	114	147.8 Å²	147.8	69%	0.691	77%	0.765	S	S	*	*			trans	-77.7	101.8	168.3	173.2	0	0	0	0	105	R61 I65	R61-V63 VanDerWaalsContact C-N 3.34Å; R61-V63 PolarHBondContact O-N 3.4Å; V63-I65 HydrophobicContact CG1-CD1 3.52Å; V63-I65 HydrophobicContact CG1-CG1 3.58Å
64	I	22.8	Very low	23.8	Very low	149 Å²	149	146.7 Å²	146.7	76%	0.764	77%	0.769	S	S	*	*			trans	-81.4	111.3	165.6	-60.2	171.1	0	0	0	104.2	R62	R62-I64 PolarHBondContact O-N 3.08Å
65	I	24.6	Very low	23.9	Very low	138 Å²	138	145.1 Å²	145.1	71%	0.708	76%	0.764	S	S	*	*			trans	-108.1	122	165.7	-71.8	159.5	0	0	0	105.5	V63 S67	V63-I65 HydrophobicContact CG1-CD1 3.52Å; V63-I65 HydrophobicContact CG1-CG1 3.58Å; I65-S67 PolarHBondContact O-N 2.84Å
66	E	22.4	Very low	23.8	Very low	172 Å²	172	146.1 Å²	146.1	80%	0.804	77%	0.765	S	S	*	*			trans	-63.5	126.9	171.8	-70.9	165.4	168.5	0	0	108.5	S68	E66-S68 PolarHBondContact O-N 3.23Å
67	S	25.8	Very low	23.9	Very low	66 Å²	66	148.5 Å²	148.5	46%	0.462	77%	0.768	S	S	.	*			trans	-54.2	123.1	163.1	156.5	0	0	0	0	107.6	I65 D69 D70	I65-S67 PolarHBondContact O-N 2.84Å; S67-D69 PolarHBondContact O-N 3.2Å; S67-D69 VanDerWaalsContact O-N 3.1Å; S67-D69 PolarHBondContact OG-N 3.28Å; S67-D70 WeakPolarHBondContact CB-OD2 3.33Å; S67-D70 PolarHBondContact OG-OD2 3.31Å
68	S	28.7	Very low	23.7	Very low	105 Å²	105	147.3 Å²	147.3	73%	0.734	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-3.3	-180	63.8	0	0	0	0	113.9	E66	E66-S68 PolarHBondContact O-N 3.23Å
69	D	30	Very low	23.6	Very low	89 Å²	89	152.5 Å²	152.5	48%	0.476	78%	0.776	S	S	.	*	T	Hydrogen-bonded Turn	trans	-110.9	-1.3	-170.9	-66.9	4.8	0	0	0	112.6	S67	S67-D69 PolarHBondContact O-N 3.2Å; S67-D69 VanDerWaalsContact O-N 3.1Å; S67-D69 PolarHBondContact OG-N 3.28Å
70	D	27	Very low	23.6	Very low	113 Å²	113	151.5 Å²	151.5	60%	0.604	77%	0.774	S	S	*	*			trans	-112	51.5	176.3	-58.7	-56.5	0	0	0	111.9	S67 D72	S67-D70 WeakPolarHBondContact CB-OD2 3.33Å; S67-D70 PolarHBondContact OG-OD2 3.31Å; D70-D72 VanDerWaalsContact C-N 3.3Å; D70-D72 PolarHBondContact O-N 3.04Å
71	E	24.9	Very low	23.4	Very low	176 Å²	176	149.9 Å²	149.9	82%	0.822	77%	0.773	S	S	*	*			trans	-79.5	84.2	157.7	-73.3	-169.5	175.8	0	0	107.7
72	D	25.5	Very low	23.5	Very low	157 Å²	157	145.7 Å²	145.7	84%	0.84	77%	0.774	S	S	*	*	S	Bend	trans	164.1	76.7	151.1	-81.1	-26.8	0	0	0	110.6	D70	D70-D72 VanDerWaalsContact C-N 3.3Å; D70-D72 PolarHBondContact O-N 3.04Å
73	E	24	Very low	23.5	Very low	189 Å²	189	143.5 Å²	143.5	88%	0.883	77%	0.773	S	S	*	*			trans	-176.9	84.9	142.2	-103.3	-172.7	-158.8	0	0	110.3	S75	E73-S75 PolarHBondContact O-N 2.94Å
74	A	20.6	Very low	23.4	Very low	109 Å²	109	143.4 Å²	143.4	90%	0.901	78%	0.778	S	S	*	*			trans	-83.9	100.7	168.2	0	0	0	0	0	109.6
75	S	23.5	Very low	23.5	Very low	113 Å²	113	142.9 Å²	142.9	79%	0.79	78%	0.781	S	S	*	*			trans	-118.3	129.8	159.9	67.1	0	0	0	0	111.2	E73	E73-S75 PolarHBondContact O-N 2.94Å
76	V	20.3	Very low	23.5	Very low	124 Å²	124	143.5 Å²	143.5	75%	0.752	79%	0.786	S	S	*	*			trans	-97.8	145.5	-171.7	169.7	0	0	0	0	108.9
77	L	23.4	Very low	23.5	Very low	165 Å²	165	144.8 Å²	144.8	86%	0.864	79%	0.789	S	S	*	*			trans	98.7	138.5	171.9	-65.2	137.5	0	0	0	115.3
78	S	21.5	Very low	23.5	Very low	105 Å²	105	149.5 Å²	149.5	73%	0.734	80%	0.803	S	S	*	*			cis	-155.9	163.1	4.1	50.8	0	0	0	0	110.2	E80	S78-E80 PolarHBondContact O-N 3.02Å
79	K	19.8	Very low	23.3	Very low	210 Å²	210	151 Å²	151	91%	0.913	80%	0.804	S	S	*	*			trans	-77.6	108.7	-177.7	-70.6	170.9	176.6	170.6	0	111
80	E	21.4	Very low	23.2	Very low	179 Å²	179	155.3 Å²	155.3	84%	0.836	83%	0.826	S	S	*	*			trans	-104	135.2	158	-81.3	-172	161.3	0	0	111.3	S78	S78-E80 PolarHBondContact O-N 3.02Å
81	K	18.7	Very low	23.1	Very low	209 Å²	209	154.3 Å²	154.3	91%	0.909	83%	0.827	S	S	*	*			trans	-83.8	116.3	177.2	-68.2	173	176.3	176.9	0	107.4
82	T	22.8	Very low	23	Very low	143 Å²	143	154 Å²	154	88%	0.877	83%	0.826	S	S	*	*			trans	-105.9	133.6	163.1	32.2	0	0	0	0	110
83	E	21.7	Very low	22.8	Very low	188 Å²	188	156.5 Å²	156.5	88%	0.879	83%	0.825	S	S	*	*			trans	-68.8	148.2	-167.3	-68.9	173.3	148.3	0	0	113	V85	E83-V85 PolarHBondContact O-N 3.29Å
84	S	21.8	Very low	22.8	Very low	112 Å²	112	153 Å²	153	78%	0.783	82%	0.821	S	S	*	*			trans	-67.7	114.2	177.5	47.1	0	0	0	0	111.5
85	V	25.1	Very low	22.9	Very low	138 Å²	138	157.3 Å²	157.3	84%	0.836	82%	0.82	S	S	*	*			trans	-76.1	125.9	166.5	178.8	0	0	0	0	109	E83	E83-V85 PolarHBondContact O-N 3.29Å
86	N	24	Very low	22.8	Very low	152 Å²	152	156.3 Å²	156.3	81%	0.813	81%	0.813	S	S	*	*			trans	-59.2	130.7	-178.5	-84.6	-30.1	0	0	0	112.1
87	K	23.3	Very low	22.9	Very low	198 Å²	198	156.8 Å²	156.8	86%	0.861	82%	0.819	S	S	*	*			trans	-81	110.3	169.6	-69.7	177.3	175.1	-176.8	0	108.8
88	H	25.1	Very low	22.8	Very low	165 Å²	165	156.6 Å²	156.6	76%	0.764	81%	0.813	S	S	*	*			trans	-148.5	128.6	155.5	-95.7	-71.4	0	0	0	110.3
89	D	25.9	Very low	22.8	Very low	138 Å²	138	157.2 Å²	157.2	74%	0.738	82%	0.815	S	S	*	*			trans	64.6	95	157.5	-54.5	-17.7	0	0	0	120.1
90	L	26.6	Very low	23	Very low	179 Å²	179	153.6 Å²	153.6	94%	0.937	81%	0.81	S	S	*	*			trans	-105.8	14.6	170.7	-84.5	168.1	0	0	0	113.9
91	S	26	Very low	23	Very low	92 Å²	92	155.6 Å²	155.6	64%	0.643	81%	0.81	S	S	*	*			trans	-94.2	5.8	-171.7	57.8	0	0	0	0	116.4
92	H	21.9	Very low	23.3	Very low	170 Å²	170	154 Å²	154	79%	0.787	81%	0.806	S	S	*	*			trans	-133.7	74.5	179.2	-73.4	-65.4	0	0	0	113.3
93	Y	22.3	Very low	23.3	Very low	208 Å²	208	155 Å²	155	82%	0.816	81%	0.806	S	S	*	*			trans	-135.4	101.8	153.2	-87.1	-80.8	0	0	0	109.4	F95	Y93-F95 WeakPolarHBondContact O-CD2 3.4Å; Y93-F95 PolarHBondContact O-N 3.19Å
94	S	22.5	Very low	23.4	Very low	117 Å²	117	149.9 Å²	149.9	82%	0.818	80%	0.804	S	S	*	*			trans	-66.6	117.2	166.2	51.4	0	0	0	0	109	S96	S94-S96 PolarHBondContact O-N 3.25Å
95	F	23.3	Very low	23.7	Very low	198 Å²	198	153.9 Å²	153.9	87%	0.868	81%	0.807	S	S	*	*			trans	-76.8	116.7	-177.3	-77.5	-93.7	0	0	0	111.3	Y93	Y93-F95 WeakPolarHBondContact O-CD2 3.4Å; Y93-F95 PolarHBondContact O-N 3.19Å
96	S	21.1	Very low	23.7	Very low	93 Å²	93	157.1 Å²	157.1	65%	0.65	81%	0.81	S	S	*	*			trans	-129.5	131.1	155.2	-43.6	0	0	0	0	106.6	S94 Q98	S94-S96 PolarHBondContact O-N 3.25Å; S96-Q98 PolarHBondContact O-N 3.45Å
97	P	23.8	Very low	23.8	Very low	133 Å²	133	156.4 Å²	156.4	86%	0.864	81%	0.805	S	S	*	*			trans	-62.4	110.4	-178.7	22.5	-29.5	0	0	0	109.4
98	Q	19.8	Very low	24	Very low	161 Å²	161	153.2 Å²	153.2	75%	0.752	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-74.9	128.6	172.3	-69.5	-163.4	2.5	0	0	109	S96 V100	S96-Q98 PolarHBondContact O-N 3.45Å; Q98-V100 PolarHBondContact O-N 3.37Å
99	P	22.8	Very low	24.2	Very low	118 Å²	118	155 Å²	155	77%	0.766	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-63.7	135.4	168.9	24.9	-30.3	0	0	0	109.7	R101	P99-R101 PolarHBondContact O-N 3.13Å
100	V	23.8	Very low	24.3	Very low	134 Å²	134	153 Å²	153	81%	0.812	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-53.5	120	179.8	-180	0	0	0	0	109.7	Q98 Q102	Q98-V100 PolarHBondContact O-N 3.37Å; V100-Q102 PolarHBondContact O-N 2.83Å; V100-Q102 VanDerWaalsContact O-N 3.15Å
101	R	20.1	Very low	24.4	Very low	221 Å²	221	147.5 Å²	147.5	83%	0.834	78%	0.782	S	S	*	*			trans	-65.1	109.5	177.2	-72.5	-178.3	177.3	-175.8	-0.6	109.8	P99	P99-R101 PolarHBondContact O-N 3.13Å
102	Q	26.1	Very low	24.6	Very low	176 Å²	176	149.4 Å²	149.4	82%	0.822	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-85.4	118.2	172	-69.6	-178	-9.2	0	0	110.5	V100	V100-Q102 PolarHBondContact O-N 2.83Å; V100-Q102 VanDerWaalsContact O-N 3.15Å
103	N	23.3	Very low	25.2	Very low	163 Å²	163	147.5 Å²	147.5	87%	0.872	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-68.6	129.8	170.4	-86.7	-25.2	0	0	0	110.2	K105	N103-K105 PolarHBondContact O-N 3.26Å
104	G	23.1	Very low	25.7	Very low	82 Å²	82	140.7 Å²	140.7	85%	0.845	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-59.5	117	-169.1	0	0	0	0	0	115.1
105	K	27.6	Very low	26.1	Very low	195 Å²	195	139.7 Å²	139.7	85%	0.848	75%	0.745	S	S	*	*			trans	-123.5	135.8	154.4	-76.1	-178.6	-179.4	170.3	0	108.9	N103 I107	N103-K105 PolarHBondContact O-N 3.26Å; K105-I107 PolarHBondContact O-N 2.85Å
106	K	25.9	Very low	26.7	Very low	206 Å²	206	137 Å²	137	90%	0.896	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-57.3	124.1	-174.4	-69.2	177.3	175.1	-179.7	0	111
107	I	26.6	Very low	27.5	Very low	137 Å²	137	136.5 Å²	136.5	70%	0.703	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-79.6	116.5	-178.2	-61	168.2	0	0	0	108.8	K105	K105-I107 PolarHBondContact O-N 2.85Å
108	N	26.2	Very low	28.2	Very low	132 Å²	132	133.2 Å²	133.2	71%	0.706	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-93.3	131.6	164	-77.2	-16.6	0	0	0	108.2	A110 T111	N108-A110 PolarHBondContact O-N 2.91Å; N108-T111 PolarHBondContact O-OG1 3.09Å
109	E	30.5	Very low	29.4	Very low	201 Å²	201	126.4 Å²	126.4	94%	0.939	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	23.5	-168.4	-68.6	-179.8	148.7	0	0	116.8
110	A	27.6	Very low	30.6	Very low	97 Å²	97	123.7 Å²	123.7	80%	0.802	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.2	17.1	178.3	0	0	0	0	0	114.3	N108	N108-A110 PolarHBondContact O-N 2.91Å
111	T	27.5	Very low	31.9	Very low	63 Å²	63	117.4 Å²	117.4	39%	0.387	62%	0.617	S	S	.	*			trans	-124.6	14.6	-173.5	45.4	0	0	0	0	115.9	N108 E113 S114 L115	N108-T111 PolarHBondContact O-OG1 3.09Å; T111-E113 VanDerWaalsContact C-N 3.32Å; T111-E113 PolarHBondContact O-N 3Å; T111-S114 PolarHBondContact O-N 2.9Å; T111-S114 PolarHBondContact O-OG 3.49Å; T111-L115 PolarHBondContact O-N 3.15Å
112	D	31.9	Very low	33.3	Very low	133 Å²	133	107.3 Å²	107.3	71%	0.711	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	-26.2	-176.5	-101	1.7	0	0	0	114.6
113	E	32.6	Very low	34.5	Very low	130 Å²	130	103.9 Å²	103.9	61%	0.607	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	-36	174.9	-68.2	-170.1	157.1	0	0	112.1	T111 L115 L116 K394	T111-E113 VanDerWaalsContact C-N 3.32Å; T111-E113 PolarHBondContact O-N 3Å; E113-L115 VanDerWaalsContact C-N 3.33Å; E113-L115 PolarHBondContact O-N 3.43Å; E113-L116 PolarHBondContact O-N 3.24Å; E113-K394 IonicContact OE1-NZ 3.94Å; E113-K394 PolarHBondContact OE1-NZ 2.86Å
114	S	34	Very low	35.9	Very low	64 Å²	64	96.9 Å²	96.9	45%	0.448	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-24.9	-178.5	69.9	0	0	0	0	114.5	T111 L116 E117	T111-S114 PolarHBondContact O-N 2.9Å; T111-S114 PolarHBondContact O-OG 3.49Å; S114-L116 VanDerWaalsContact C-N 3.33Å; S114-E117 PolarHBondContact O-N 3.35Å
115	L	30.9	Very low	37.3	Very low	97 Å²	97	94.1 Å²	94.1	51%	0.508	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-24.8	-178.2	-76.1	169.8	0	0	0	112.9	T111 E113	T111-L115 PolarHBondContact O-N 3.15Å; E113-L115 VanDerWaalsContact C-N 3.33Å; E113-L115 PolarHBondContact O-N 3.43Å
116	L	34.8	Very low	38.5	Very low	141 Å²	141	91 Å²	91	74%	0.738	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-12.7	174.7	-71.8	166	0	0	0	112.6	E113 S114	E113-L116 PolarHBondContact O-N 3.24Å; S114-L116 VanDerWaalsContact C-N 3.33Å
117	E	39.8	Very low	39.7	Very low	82 Å²	82	84.3 Å²	84.3	38%	0.383	47%	0.465	S	S	.	.			trans	-112.5	13.5	-169.2	-67.6	-176.4	161.8	0	0	113.9	S114 S119	S114-E117 PolarHBondContact O-N 3.35Å; E117-S119 PolarHBondContact O-N 3.36Å
118	T	37.6	Very low	40.8	Very low	65 Å²	65	79.2 Å²	79.2	40%	0.399	44%	0.438	S	S	.	.			trans	-63.4	125.9	173.9	1.1	0	0	0	0	109.7	V120 Q123	T118-V120 PolarHBondContact O-N 3.03Å; T118-Q123 PolarHBondContact OG1-NE2 3.49Å
119	S	44.1	Very low	42	Very low	18 Å²	18	80.7 Å²	80.7	13%	0.126	44%	0.44	C	S	.	.			trans	-51.5	134.2	176.7	177.8	0	0	0	0	110.8	E117 V121 A122 Q123 I148	E117-S119 PolarHBondContact O-N 3.36Å; S119-V121 PolarHBondContact O-N 3.3Å; S119-V121 PolarHBondContact OG-N 3.03Å; S119-A122 WeakPolarHBondContact O-CA 3.22Å; S119-A122 WeakPolarHBondContact O-CB 3.42Å; S119-A122 PolarHBondContact O-N 2.74Å; S119-Q123 PolarHBondContact O-N 3.36Å; S119-I148 WeakPolarHBondContact OG-CD1 3.3Å
120	V	49.6	Very low	42.8	Very low	60 Å²	60	79.2 Å²	79.2	36%	0.364	44%	0.439	S	S	.	.	H	α-helix	trans	-48.5	-35.4	173.8	177.3	0	0	0	0	111.1	T118 A122 Q123 V124 D192	T118-V120 PolarHBondContact O-N 3.03Å; V120-A122 PolarHBondContact O-N 2.9Å; V120-Q123 PolarHBondContact O-N 3.21Å; V120-V124 HydrophobicContact CG1-CG2 4.12Å; V120-V124 WeakPolarHBondContact O-CB 3.26Å; V120-V124 VanDerWaalsContact O-CG2 3.24Å; V120-V124 WeakPolarHBondContact O-CG2 3.46Å; V120-V124 PolarHBondContact O-N 3.35Å; V120-D192 HydrophobicContact CG2-CB 4.28Å
121	V	49.8	Very low	43.8	Very low	3 Å²	3	80.1 Å²	80.1	2%	0.018	43%	0.426	C	S	.	.	H	α-helix	trans	-63.5	-40.3	177.7	-176.9	0	0	0	0	111.8	S119 N125 L143 T191 M208	S119-V121 PolarHBondContact O-N 3.3Å; S119-V121 PolarHBondContact OG-N 3.03Å; V121-N125 WeakPolarHBondContact O-CB 3.34Å; V121-N125 PolarHBondContact O-N 3.1Å; V121-N125 PolarHBondContact O-ND2 3.43Å; V121-N125 PolarHBondContact O-OD1 3.32Å; V121-L143 HydrophobicContact CG1-CD2 4.31Å; V121-T191 HydrophobicContact CG2-CG2 3.78Å; V121-M208 HydrophobicContact CG1-CE 3.94Å; V121-M208 HydrophobicContact CG2-CE 4.12Å
122	A	49.5	Very low	44.9	Very low	8 Å²	8	83.3 Å²	83.3	7%	0.066	45%	0.452	C	S	.	.	H	α-helix	trans	-67.1	-43.1	177.4	0	0	0	0	0	111.5	S119 V120 N125 E126 P145	S119-A122 WeakPolarHBondContact O-CA 3.22Å; S119-A122 WeakPolarHBondContact O-CB 3.42Å; S119-A122 PolarHBondContact O-N 2.74Å; V120-A122 PolarHBondContact O-N 2.9Å; A122-N125 PolarHBondContact O-N 2.9Å; A122-E126 WeakPolarHBondContact O-CG 3.34Å; A122-E126 PolarHBondContact O-N 3.37Å; A122-P145 HydrophobicContact CB-CG 4.13Å
123	Q	51	Low	46.4	Very low	104 Å²	104	80.2 Å²	80.2	49%	0.486	44%	0.437	S	S	.	.	H	α-helix	trans	-67.2	-40.6	179.3	-67.4	-177.9	-3.3	0	0	112.8	T118 S119 V120 A127	T118-Q123 PolarHBondContact OG1-NE2 3.49Å; S119-Q123 PolarHBondContact O-N 3.36Å; V120-Q123 PolarHBondContact O-N 3.21Å; Q123-A127 WeakPolarHBondContact O-CB 3.37Å; Q123-A127 PolarHBondContact O-N 2.97Å
124	V	52.8	Low	48.6	Very low	16 Å²	16	79 Å²	79	10%	0.097	44%	0.443	C	S	.	.	H	α-helix	trans	-64.9	-44.6	175.2	174.2	0	0	0	0	109.8	V120 E126 A127 F128 I212	V120-V124 HydrophobicContact CG1-CG2 4.12Å; V120-V124 WeakPolarHBondContact O-CB 3.26Å; V120-V124 VanDerWaalsContact O-CG2 3.24Å; V120-V124 WeakPolarHBondContact O-CG2 3.46Å; V120-V124 PolarHBondContact O-N 3.35Å; V124-E126 PolarHBondContact O-N 3.15Å; V124-A127 PolarHBondContact O-N 3.42Å; V124-F128 HydrophobicContact CG1-CD2 4.24Å; V124-F128 HydrophobicContact CG1-CE2 4.19Å; V124-F128 VanDerWaalsContact O-CD2 3.31Å; V124-F128 WeakPolarHBondContact O-CD2 3.28Å; V124-I212 HydrophobicContact CG1-CG1 4.44Å; V124-I212 HydrophobicContact CG2-CD1 4.12Å; V124-I212 HydrophobicContact CG2-CG1 4.37Å
125	N	52.9	Low	50.9	Low	24 Å²	24	77.4 Å²	77.4	13%	0.128	43%	0.428	C	S	.	.	H	α-helix	trans	-63.8	-39.7	-179.9	-68.8	-9.6	0	0	0	112.5	V121 A122 F128 L138	V121-N125 WeakPolarHBondContact O-CB 3.34Å; V121-N125 PolarHBondContact O-N 3.1Å; V121-N125 PolarHBondContact O-ND2 3.43Å; V121-N125 PolarHBondContact O-OD1 3.32Å; A122-N125 PolarHBondContact O-N 2.9Å; N125-F128 PolarHBondContact O-N 3.28Å; N125-L138 HydrophobicContact CB-CD2 3.83Å; N125-L138 VanDerWaalsContact OD1-CD2 3.31Å; N125-L138 WeakPolarHBondContact OD1-CD2 3.45Å
126	E	53.4	Low	53.5	Low	131 Å²	131	75.3 Å²	75.3	61%	0.612	42%	0.419	S	S	*	.	H	α-helix	trans	-65.6	-35.9	176.3	-76.2	-178.9	-179.8	0	0	112.8	A122 V124 F128	A122-E126 WeakPolarHBondContact O-CG 3.34Å; A122-E126 PolarHBondContact O-N 3.37Å; V124-E126 PolarHBondContact O-N 3.15Å; E126-F128 PolarHBondContact O-N 3.22Å
127	A	51	Low	55.8	Low	65 Å²	65	68.6 Å²	68.6	54%	0.537	38%	0.384	S	S	.	.	H	α-helix	trans	-70.9	-12.8	-177.4	0	0	0	0	0	114.5	Q123 V124	Q123-A127 WeakPolarHBondContact O-CB 3.37Å; Q123-A127 PolarHBondContact O-N 2.97Å; V124-A127 PolarHBondContact O-N 3.42Å
128	F	50.4	Low	57.9	Low	29 Å²	29	67.7 Å²	67.7	13%	0.127	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.2	12.3	-176.8	-75.1	-89.5	0	0	0	113.7	V124 N125 E126 D130 E131 M211 K215	V124-F128 HydrophobicContact CG1-CD2 4.24Å; V124-F128 HydrophobicContact CG1-CE2 4.19Å; V124-F128 VanDerWaalsContact O-CD2 3.31Å; V124-F128 WeakPolarHBondContact O-CD2 3.28Å; N125-F128 PolarHBondContact O-N 3.28Å; E126-F128 PolarHBondContact O-N 3.22Å; F128-D130 PolarHBondContact O-N 2.76Å; F128-D130 VanDerWaalsContact O-N 3.14Å; F128-E131 PolarHBondContact O-N 3.03Å; F128-M211 HydrophobicContact CB-CE 3.24Å; F128-M211 HydrophobicContact CD1-CE 3.52Å; F128-M211 HydrophobicContact CD2-CE 3.36Å; F128-M211 HydrophobicContact CE1-CE 4.07Å; F128-M211 HydrophobicContact CE2-CB 4.15Å; F128-M211 HydrophobicContact CE2-CE 3.94Å; F128-M211 HydrophobicContact CG-CE 3.1Å; F128-M211 HydrophobicContact CZ-CB 4.07Å; F128-M211 HydrophobicContact CZ-CE 4.25Å; F128-K215 HydrophobicContact CE1-CD 4.33Å; F128-K215 HydrophobicContact CE2-CD 4.17Å; F128-K215 HydrophobicContact CZ-CB 3.94Å; F128-K215 HydrophobicContact CZ-CD 3.58Å; F128-K215 HydrophobicContact CZ-CG 4.32Å
129	E	50.5	Low	60.1	Low	164 Å²	164	68.4 Å²	68.4	77%	0.766	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-17.7	173.3	-75.3	-167.9	158.3	0	0	113.4
130	D	47.7	Very low	62.2	Low	169 Å²	169	68.2 Å²	68.2	90%	0.904	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-7.4	-177.6	-82.8	-23.7	0	0	0	115.2	F128	F128-D130 PolarHBondContact O-N 2.76Å; F128-D130 VanDerWaalsContact O-N 3.14Å
131	E	48	Very low	63.8	Low	116 Å²	116	68.8 Å²	68.8	54%	0.542	39%	0.391	S	S	.	.	S	Bend	trans	-96.6	131.7	177.2	-74.1	-169.5	169.6	0	0	112.4	F128 V133	F128-E131 PolarHBondContact O-N 3.03Å; E131-V133 PolarHBondContact O-N 3.06Å
132	S	51.6	Low	65.6	Low	131 Å²	131	69.7 Å²	69.7	92%	0.916	40%	0.395	S	S	*	.	S	Bend	trans	-57.7	6	-176.8	56.7	0	0	0	0	117.6
133	V	63.1	Low	67.4	Low	68 Å²	68	69.4 Å²	69.4	41%	0.412	39%	0.392	S	S	.	.			trans	-113.3	104.7	-176.1	-172	0	0	0	0	110.4	E131 W135	E131-V133 PolarHBondContact O-N 3.06Å; V133-W135 HydrophobicContact CB-CZ2 4.37Å; V133-W135 HydrophobicContact CG1-CD2 3.88Å; V133-W135 HydrophobicContact CG1-CE3 4.1Å; V133-W135 HydrophobicContact CG1-CH2 3.89Å; V133-W135 HydrophobicContact CG1-CZ2 3.62Å; V133-W135 HydrophobicContact CG1-CZ3 4.11Å; V133-W135 PolarHBondContact O-N 2.91Å
134	S	77.1	Confident	69	Low	105 Å²	105	67.8 Å²	67.8	73%	0.734	39%	0.385	S	S	*	.			trans	-79.7	103.4	173.6	-173.2	0	0	0	0	110.4
135	W	84.1	Confident	70.4	Confident	30 Å²	30	71 Å²	71	11%	0.114	41%	0.405	C	S	.	.			trans	-80.3	149	176.6	-61.5	114.6	0	0	0	112.4	V133 H137 L138 F221 A227	V133-W135 HydrophobicContact CB-CZ2 4.37Å; V133-W135 HydrophobicContact CG1-CD2 3.88Å; V133-W135 HydrophobicContact CG1-CE3 4.1Å; V133-W135 HydrophobicContact CG1-CH2 3.89Å; V133-W135 HydrophobicContact CG1-CZ2 3.62Å; V133-W135 HydrophobicContact CG1-CZ3 4.11Å; V133-W135 PolarHBondContact O-N 2.91Å; W135-H137 VanDerWaalsContact C-N 3.26Å; W135-H137 VanDerWaalsContact CB-CE1 3.45Å; W135-H137 WeakPolarHBondContact CB-CE1 3.43Å; W135-H137 PolarHBondContact O-N 3.17Å; W135-L138 HydrophobicContact CB-CD1 4.44Å; W135-L138 WeakPolarHBondContact O-CB 3.49Å; W135-L138 PolarHBondContact O-N 2.77Å; W135-F221 HydrophobicContact CH2-CB 4.48Å; W135-F221 HydrophobicContact CH2-CD1 4.38Å; W135-F221 HydrophobicContact CH2-CG 4.24Å; W135-F221 HydrophobicContact CZ2-CD1 4.06Å; W135-F221 AromaticContact CZ2-CD2 3.95Å; W135-F221 HydrophobicContact CZ2-CD2 3.95Å; W135-F221 HydrophobicContact CZ2-CE1 4.14Å; W135-F221 HydrophobicContact CZ2-CE2 4.02Å; W135-F221 AromaticContact CZ2-CG 3.97Å; W135-F221 HydrophobicContact CZ2-CG 3.97Å; W135-F221 HydrophobicContact CZ2-CZ 4.12Å; W135-A227 HydrophobicContact CB-CB 4.43Å; W135-A227 HydrophobicContact CD2-CB 3.73Å; W135-A227 HydrophobicContact CE3-CB 4.08Å; W135-A227 VanDerWaalsContact CE3-N 3.32Å; W135-A227 HydrophobicContact CG-CB 3.9Å
136	T	84	Confident	71.7	Confident	53 Å²	53	73.3 Å²	73.3	33%	0.325	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-49.4	-40.6	-177.3	-49.3	0	0	0	0	114.6	L138 S139 S225	T136-L138 VanDerWaalsContact C-N 3.3Å; T136-L138 PolarHBondContact O-N 3.07Å; T136-S139 PolarHBondContact O-N 2.84Å; T136-S139 VanDerWaalsContact O-N 3.12Å; T136-S139 PolarHBondContact O-OG 3.33Å; T136-S225 PolarHBondContact OG1-O 2.83Å
137	H	84.7	Confident	73.3	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-69.8	-24.8	-175.5	64.3	-84.8	0	0	0	113.5	W135 S139 L140 L143 H207 M211	W135-H137 VanDerWaalsContact C-N 3.26Å; W135-H137 VanDerWaalsContact CB-CE1 3.45Å; W135-H137 WeakPolarHBondContact CB-CE1 3.43Å; W135-H137 PolarHBondContact O-N 3.17Å; H137-S139 PolarHBondContact O-N 2.71Å; H137-L140 HydrophobicContact CB-CD1 4.23Å; H137-L140 PolarHBondContact O-N 2.96Å; H137-L143 HydrophobicContact CB-CD1 4.23Å; H137-L143 WeakPolarHBondContact O-CD1 3.21Å; H137-H207 HydrophobicContact CB-CB 3.91Å; H137-M211 PolarHBondContact CE1-SD 3.16Å; H137-M211 PolarHBondContact NE2-SD 2.71Å
138	L	83.7	Confident	75.1	Confident	62 Å²	62	69 Å²	69	33%	0.325	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-67.7	-22.4	174.3	-59.5	175.4	0	0	0	111.9	N125 W135 T136	N125-L138 HydrophobicContact CB-CD2 3.83Å; N125-L138 VanDerWaalsContact OD1-CD2 3.31Å; N125-L138 WeakPolarHBondContact OD1-CD2 3.45Å; W135-L138 HydrophobicContact CB-CD1 4.44Å; W135-L138 WeakPolarHBondContact O-CB 3.49Å; W135-L138 PolarHBondContact O-N 2.77Å; T136-L138 VanDerWaalsContact C-N 3.3Å; T136-L138 PolarHBondContact O-N 3.07Å
139	S	82.7	Confident	77	Confident	80 Å²	80	71.5 Å²	71.5	56%	0.559	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-96.1	-0.2	-179.3	71.9	0	0	0	0	114.6	T136 H137 P141	T136-S139 PolarHBondContact O-N 2.84Å; T136-S139 VanDerWaalsContact O-N 3.12Å; T136-S139 PolarHBondContact O-OG 3.33Å; H137-S139 PolarHBondContact O-N 2.71Å; S139-P141 WeakPolarHBondContact O-CD 3.32Å
140	L	87.6	Confident	78.9	Confident	14 Å²	14	63.7 Å²	63.7	7%	0.073	37%	0.365	C	S	.	.			trans	-78	121.8	-175	-68	175.2	0	0	0	111.7	H137 F142 L143 F172 W184	H137-L140 HydrophobicContact CB-CD1 4.23Å; H137-L140 PolarHBondContact O-N 2.96Å; L140-F142 VanDerWaalsContact C-N 3.28Å; L140-F142 HydrophobicContact CB-CD1 4.4Å; L140-F142 HydrophobicContact CB-CE1 4.01Å; L140-F142 HydrophobicContact CB-CZ 4.2Å; L140-F142 HydrophobicContact CD1-CE1 4.19Å; L140-F142 HydrophobicContact CD1-CZ 3.79Å; L140-F142 HydrophobicContact CD2-CE1 4.21Å; L140-F142 HydrophobicContact CG-CE1 4.36Å; L140-F142 HydrophobicContact CG-CZ 4.41Å; L140-F142 PolarHBondContact O-N 3.12Å; L140-F142 VanDerWaalsContact O-N 3.15Å; L140-L143 HydrophobicContact CB-CB 4.36Å; L140-L143 HydrophobicContact CB-CD1 4.07Å; L140-L143 HydrophobicContact CB-CG 4.09Å; L140-L143 HydrophobicContact CD1-CD1 3.9Å; L140-L143 PolarHBondContact O-N 3.36Å; L140-F172 HydrophobicContact CD1-CE2 4.37Å; L140-F172 HydrophobicContact CD1-CZ 3.92Å; L140-F172 HydrophobicContact CD2-CD2 4.25Å; L140-F172 HydrophobicContact CD2-CE2 3.48Å; L140-F172 VanDerWaalsContact CD2-CE2 3.48Å; L140-F172 HydrophobicContact CD2-CZ 3.89Å; L140-W184 HydrophobicContact CD1-CH2 3.76Å; L140-W184 HydrophobicContact CD1-CZ2 3.82Å
141	P	84.7	Confident	80.8	Confident	72 Å²	72	59.1 Å²	59.1	47%	0.468	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-61	-30.5	-173.3	-26.4	34.1	0	0	0	115.2	S139 L143 K147	S139-P141 WeakPolarHBondContact O-CD 3.32Å; P141-L143 VanDerWaalsContact C-N 3.3Å; P141-K147 WeakPolarHBondContact O-CB 3.29Å; P141-K147 WeakPolarHBondContact O-CD 3.43Å
142	F	87.8	Confident	82.8	Confident	22 Å²	22	57.9 Å²	57.9	10%	0.096	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-81.1	-10.1	-179.5	62.2	-94	0	0	0	113.3	L140 V168 P169 F172 W184	L140-F142 VanDerWaalsContact C-N 3.28Å; L140-F142 HydrophobicContact CB-CD1 4.4Å; L140-F142 HydrophobicContact CB-CE1 4.01Å; L140-F142 HydrophobicContact CB-CZ 4.2Å; L140-F142 HydrophobicContact CD1-CE1 4.19Å; L140-F142 HydrophobicContact CD1-CZ 3.79Å; L140-F142 HydrophobicContact CD2-CE1 4.21Å; L140-F142 HydrophobicContact CG-CE1 4.36Å; L140-F142 HydrophobicContact CG-CZ 4.41Å; L140-F142 PolarHBondContact O-N 3.12Å; L140-F142 VanDerWaalsContact O-N 3.15Å; F142-V168 HydrophobicContact CE2-CB 4.45Å; F142-V168 HydrophobicContact CE2-CG1 4.1Å; F142-V168 HydrophobicContact CE2-CG2 4.08Å; F142-V168 HydrophobicContact CZ-CG1 4.01Å; F142-P169 HydrophobicContact CB-CG 4.14Å; F142-P169 HydrophobicContact CD1-CG 3.97Å; F142-P169 HydrophobicContact CG-CG 4.16Å; F142-F172 HydrophobicContact CE1-CB 4.29Å; F142-F172 AromaticContact CE1-CD1 3.81Å; F142-F172 HydrophobicContact CE1-CD1 3.81Å; F142-F172 HydrophobicContact CE1-CD2 4.04Å; F142-F172 HydrophobicContact CE1-CE1 4.11Å; F142-F172 HydrophobicContact CE1-CE2 4.32Å; F142-F172 AromaticContact CE1-CG 3.77Å; F142-F172 HydrophobicContact CE1-CG 3.77Å; F142-F172 HydrophobicContact CE1-CZ 4.35Å; F142-F172 AromaticContact CZ-CD1 3.75Å; F142-F172 HydrophobicContact CZ-CD1 3.75Å; F142-F172 AromaticContact CZ-CE1 3.76Å; F142-F172 HydrophobicContact CZ-CE1 3.76Å; F142-F172 HydrophobicContact CZ-CG 4.2Å; F142-F172 HydrophobicContact CZ-CZ 4.22Å; F142-W184 HydrophobicContact CE2-CZ3 4.11Å; F142-W184 HydrophobicContact CZ-CH2 4.41Å; F142-W184 HydrophobicContact CZ-CZ3 4.29Å
143	L	86.8	Confident	84.5	Confident	3 Å²	3	53.3 Å²	53.3	2%	0.016	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-95.3	-7.6	173.6	-63.3	-175.3	0	0	0	113	V121 H137 L140 P141 L166 W184 M208	V121-L143 HydrophobicContact CG1-CD2 4.31Å; H137-L143 HydrophobicContact CB-CD1 4.23Å; H137-L143 WeakPolarHBondContact O-CD1 3.21Å; L140-L143 HydrophobicContact CB-CB 4.36Å; L140-L143 HydrophobicContact CB-CD1 4.07Å; L140-L143 HydrophobicContact CB-CG 4.09Å; L140-L143 HydrophobicContact CD1-CD1 3.9Å; L140-L143 PolarHBondContact O-N 3.36Å; P141-L143 VanDerWaalsContact C-N 3.3Å; L143-L166 HydrophobicContact CD2-CD1 4.1Å; L143-L166 HydrophobicContact CD2-CD2 3.54Å; L143-L166 HydrophobicContact CD2-CG 4.44Å; L143-W184 HydrophobicContact CD1-CH2 4.15Å; L143-M208 HydrophobicContact CD1-CE 3.84Å; L143-M208 HydrophobicContact CD2-CE 4.36Å
144	E	84.9	Confident	85.7	Confident	70 Å²	70	53.2 Å²	53.2	33%	0.327	30%	0.303	S	S	.	.	S	Bend	trans	-58.3	134.5	173.5	-69.5	173.1	-153.7	0	0	110	S146 K147 I148	E144-S146 PolarHBondContact O-N 3.16Å; E144-K147 HydrophobicContact CB-CB 4.36Å; E144-K147 HydrophobicContact CB-CD 4.48Å; E144-K147 VanDerWaalsContact CD-NZ 3.28Å; E144-K147 PolarHBondContact O-N 3.39Å; E144-K147 IonicContact OE1-NZ 2.69Å; E144-K147 PolarHBondContact OE1-NZ 2.94Å; E144-K147 VanDerWaalsContact OE1-NZ 3.09Å; E144-K147 WeakPolarHBondContact OE2-CD 3.24Å; E144-K147 WeakPolarHBondContact OE2-CE 3.49Å; E144-K147 IonicContact OE2-NZ 2.85Å; E144-K147 PolarHBondContact OE2-NZ 3.11Å; E144-I148 PolarHBondContact O-N 3.47Å
145	P	80.6	Confident	86.3	Confident	82 Å²	82	53.1 Å²	53.1	53%	0.532	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-32.3	-179.8	-28.9	34.9	0	0	0	113.8	A122 K147	A122-P145 HydrophobicContact CB-CG 4.13Å; P145-K147 VanDerWaalsContact C-N 3.32Å; P145-K147 PolarHBondContact O-N 2.69Å
146	S	81.9	Confident	86.2	Confident	73 Å²	73	53.6 Å²	53.6	51%	0.51	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-13.5	177.3	50.1	0	0	0	0	115.1	E144 R155	E144-S146 PolarHBondContact O-N 3.16Å; S146-R155 VanDerWaalsContact O-CZ 3.26Å; S146-R155 PolarHBondContact O-NH1 3.33Å; S146-R155 PolarHBondContact O-NH2 3.16Å
147	K	86	Confident	86.2	Confident	101 Å²	101	57.3 Å²	57.3	44%	0.439	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.8	-5	-174.1	-68.5	173.8	-174.1	149.5	0	113.7	P141 E144 P145	P141-K147 WeakPolarHBondContact O-CB 3.29Å; P141-K147 WeakPolarHBondContact O-CD 3.43Å; E144-K147 HydrophobicContact CB-CB 4.36Å; E144-K147 HydrophobicContact CB-CD 4.48Å; E144-K147 VanDerWaalsContact CD-NZ 3.28Å; E144-K147 PolarHBondContact O-N 3.39Å; E144-K147 IonicContact OE1-NZ 2.69Å; E144-K147 PolarHBondContact OE1-NZ 2.94Å; E144-K147 VanDerWaalsContact OE1-NZ 3.09Å; E144-K147 WeakPolarHBondContact OE2-CD 3.24Å; E144-K147 WeakPolarHBondContact OE2-CE 3.49Å; E144-K147 IonicContact OE2-NZ 2.85Å; E144-K147 PolarHBondContact OE2-NZ 3.11Å; P145-K147 VanDerWaalsContact C-N 3.32Å; P145-K147 PolarHBondContact O-N 2.69Å
148	I	89	Confident	86.1	Confident	5 Å²	5	61 Å²	61	3%	0.026	33%	0.328	C	S	.	.			trans	-59.1	136.6	179.3	-159.3	168	0	0	0	111.4	S119 E144 P156 L166	S119-I148 WeakPolarHBondContact OG-CD1 3.3Å; E144-I148 PolarHBondContact O-N 3.47Å; I148-P156 HydrophobicContact CG2-CG 3.77Å; I148-L166 HydrophobicContact CD1-CD1 4.2Å; I148-L166 HydrophobicContact CG1-CD1 3.74Å
149	K	90.5	Very high	85.8	Confident	81 Å²	81	63 Å²	63	35%	0.352	35%	0.345	S	S	.	.			trans	-140.8	153.1	179.5	-67.7	175	-176.9	-174.6	0	109.9	R154 R155 L166 Y167	K149-R154 CarbonylContact C-O 3.58Å; K149-R154 WeakPolarHBondContact CA-O 3.39Å; K149-R155 HydrophobicContact CG-CG 4.02Å; K149-L166 CarbonylContact O-C 3.08Å; K149-L166 WeakPolarHBondContact O-CA 3.42Å; K149-Y167 PolarHBondContact O-N 3.27Å
150	D	89.7	Confident	85.7	Confident	0 Å²	0	64 Å²	64	0%	0	34%	0.341	C	S	.	.			trans	-77.4	173.4	171.6	77	1.7	0	0	0	111.1	N152 G153 R154 Y161 D162 T165 Y167	D150-N152 PolarHBondContact O-N 2.97Å; D150-N152 VanDerWaalsContact OD1-C 3.25Å; D150-N152 VanDerWaalsContact OD1-CA 3.29Å; D150-N152 WeakPolarHBondContact OD1-CA 3.42Å; D150-N152 WeakPolarHBondContact OD1-CB 3.46Å; D150-N152 PolarHBondContact OD1-N 3.23Å; D150-G153 PolarHBondContact O-N 3.28Å; D150-G153 PolarHBondContact OD1-N 3.31Å; D150-R154 PolarHBondContact N-O 3.29Å; D150-R154 WeakPolarHBondContact OD1-CB 3.49Å; D150-R154 PolarHBondContact OD1-N 2.79Å; D150-R154 WeakPolarHBondContact OD2-CB 3.44Å; D150-R154 WeakPolarHBondContact OD2-CD 3.38Å; D150-Y161 HydrophobicContact CB-CD2 3.69Å; D150-Y161 HydrophobicContact CB-CE2 3.62Å; D150-D162 HydrophobicContact CB-CB 4.4Å; D150-D162 WeakPolarHBondContact CB-O 3.32Å; D150-D162 PolarHBondContact OD2-N 3.38Å; D150-T165 WeakPolarHBondContact CB-OG1 3.35Å; D150-Y167 VanDerWaalsContact O-CB 3.29Å; D150-Y167 WeakPolarHBondContact O-CB 3.22Å
151	I	89.3	Confident	85.4	Confident	74 Å²	74	63.9 Å²	63.9	38%	0.379	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-22.7	-178.8	-161.6	166.1	0	0	0	113.7	G153 T165 R189	I151-G153 VanDerWaalsContact C-N 3.31Å; I151-T165 HydrophobicContact CB-CG2 4.49Å; I151-T165 HydrophobicContact CG2-CG2 4.06Å; I151-T165 WeakPolarHBondContact CG2-OG1 3.46Å; I151-T165 PolarHBondContact N-OG1 2.75Å; I151-R189 HydrophobicContact CD1-CG 4.31Å
152	N	88.4	Confident	85.3	Confident	90 Å²	90	61.8 Å²	61.8	48%	0.481	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	7.5	177.5	-56.6	-59.5	0	0	0	112.7	D150 R154	D150-N152 PolarHBondContact O-N 2.97Å; D150-N152 VanDerWaalsContact OD1-C 3.25Å; D150-N152 VanDerWaalsContact OD1-CA 3.29Å; D150-N152 WeakPolarHBondContact OD1-CA 3.42Å; D150-N152 WeakPolarHBondContact OD1-CB 3.46Å; D150-N152 PolarHBondContact OD1-N 3.23Å; N152-R154 VanDerWaalsContact C-N 3.27Å; N152-R154 HydrophobicContact CB-CG 4.13Å; N152-R154 PolarHBondContact O-N 2.73Å
153	G	87.2	Confident	85.1	Confident	34 Å²	34	63 Å²	63	35%	0.351	34%	0.336	S	S	.	.	S	Bend	trans	75.8	12	179.4	0	0	0	0	0	114.4	D150 I151	D150-G153 PolarHBondContact O-N 3.28Å; D150-G153 PolarHBondContact OD1-N 3.31Å; I151-G153 VanDerWaalsContact C-N 3.31Å
154	R	89.2	Confident	85.1	Confident	67 Å²	67	63.4 Å²	63.4	25%	0.253	34%	0.338	S	S	.	.			trans	-84.8	145.2	-179.4	-53.2	164	-179.5	-171.2	-14.3	109.1	K149 D150 N152 H158 E160 Y161	K149-R154 CarbonylContact C-O 3.58Å; K149-R154 WeakPolarHBondContact CA-O 3.39Å; D150-R154 PolarHBondContact N-O 3.29Å; D150-R154 WeakPolarHBondContact OD1-CB 3.49Å; D150-R154 PolarHBondContact OD1-N 2.79Å; D150-R154 WeakPolarHBondContact OD2-CB 3.44Å; D150-R154 WeakPolarHBondContact OD2-CD 3.38Å; N152-R154 VanDerWaalsContact C-N 3.27Å; N152-R154 HydrophobicContact CB-CG 4.13Å; N152-R154 PolarHBondContact O-N 2.73Å; R154-H158 HydrophobicContact CB-CB 3.99Å; R154-E160 WeakPolarHBondContact CD-O 3.45Å; R154-E160 IonicContact CZ-OE2 3.03Å; R154-E160 PolarHBondContact NH1-O 2.99Å; R154-E160 IonicContact NH1-OE2 3.34Å; R154-E160 PolarHBondContact NH1-OE2 3.09Å; R154-E160 IonicContact NH2-OE2 3.72Å; R154-E160 PolarHBondContact NH2-OE2 2.87Å; R154-Y161 HydrophobicContact CB-CD2 4.43Å; R154-Y161 VanDerWaalsContact O-CD2 3.3Å; R154-Y161 WeakPolarHBondContact O-CD2 3.21Å; R154-Y161 WeakPolarHBondContact O-CE2 3.43Å
155	R	88.9	Confident	85.3	Confident	103 Å²	103	60.8 Å²	60.8	39%	0.389	33%	0.326	S	S	.	.			trans	-93.9	162.4	177.7	-66.5	175.5	64.7	102.5	11.8	110.1	S146 K149 D157 H158 Y161	S146-R155 VanDerWaalsContact O-CZ 3.26Å; S146-R155 PolarHBondContact O-NH1 3.33Å; S146-R155 PolarHBondContact O-NH2 3.16Å; K149-R155 HydrophobicContact CG-CG 4.02Å; R155-D157 WeakPolarHBondContact CB-OD1 3.31Å; R155-D157 IonicContact NE-OD1 3.07Å; R155-D157 PolarHBondContact O-N 3.46Å; R155-H158 VanDerWaalsContact O-CB 3.23Å; R155-H158 WeakPolarHBondContact O-CB 3.44Å; R155-H158 PolarHBondContact O-N 2.73Å; R155-Y161 WeakPolarHBondContact O-CB 3.22Å; R155-Y161 WeakPolarHBondContact O-CD2 3.46Å
156	P	82.3	Confident	85.8	Confident	40 Å²	40	56.9 Å²	56.9	26%	0.26	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-27.2	179.8	-28.5	35.6	0	0	0	115.2	I148 H158 Y161	I148-P156 HydrophobicContact CG2-CG 3.77Å; P156-H158 PolarHBondContact O-N 3.47Å; P156-Y161 HydrophobicContact CB-CD1 4.3Å; P156-Y161 HydrophobicContact CB-CE1 4.17Å; P156-Y161 HydrophobicContact CG-CE1 4.1Å; P156-Y161 HydrophobicContact CG-CE2 4.12Å
157	D	83.6	Confident	86.4	Confident	131 Å²	131	58.4 Å²	58.4	70%	0.701	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-8.3	175.9	54	-59.1	0	0	0	114.5	R155	R155-D157 WeakPolarHBondContact CB-OD1 3.31Å; R155-D157 IonicContact NE-OD1 3.07Å; R155-D157 PolarHBondContact O-N 3.46Å
158	H	83.9	Confident	86.6	Confident	78 Å²	78	53.7 Å²	53.7	36%	0.361	28%	0.276	S	S	.	.	S	Bend	trans	-85.2	134.7	179.7	-170.1	-81.3	0	0	0	111.4	R154 R155 P156 E160 Y161	R154-H158 HydrophobicContact CB-CB 3.99Å; R155-H158 VanDerWaalsContact O-CB 3.23Å; R155-H158 WeakPolarHBondContact O-CB 3.44Å; R155-H158 PolarHBondContact O-N 2.73Å; P156-H158 PolarHBondContact O-N 3.47Å; H158-E160 VanDerWaalsContact C-N 3.26Å; H158-E160 PolarHBondContact ND1-N 3.22Å; H158-E160 VanDerWaalsContact ND1-N 3.13Å; H158-E160 PolarHBondContact O-N 3.4Å; H158-E160 VanDerWaalsContact O-N 3.15Å; H158-Y161 WeakPolarHBondContact O-CB 3.33Å; H158-Y161 PolarHBondContact O-N 3.07Å
159	P	76.5	Confident	86.8	Confident	104 Å²	104	55.1 Å²	55.1	68%	0.675	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-33	-175	22.1	-34	0	0	0	113.9	R386	P159-R386 PolarHBondContact O-NH1 2.98Å
160	E	80.1	Confident	86.8	Confident	99 Å²	99	55.9 Å²	55.9	46%	0.463	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	23.4	175.7	-51.1	-176.1	177.4	0	0	114	R154 H158 D162	R154-E160 WeakPolarHBondContact CD-O 3.45Å; R154-E160 IonicContact CZ-OE2 3.03Å; R154-E160 PolarHBondContact NH1-O 2.99Å; R154-E160 IonicContact NH1-OE2 3.34Å; R154-E160 PolarHBondContact NH1-OE2 3.09Å; R154-E160 IonicContact NH2-OE2 3.72Å; R154-E160 PolarHBondContact NH2-OE2 2.87Å; H158-E160 VanDerWaalsContact C-N 3.26Å; H158-E160 PolarHBondContact ND1-N 3.22Å; H158-E160 VanDerWaalsContact ND1-N 3.13Å; H158-E160 PolarHBondContact O-N 3.4Å; H158-E160 VanDerWaalsContact O-N 3.15Å; E160-D162 PolarHBondContact O-N 3.03Å
161	Y	83.2	Confident	86.8	Confident	13 Å²	13	63 Å²	63	5%	0.051	32%	0.324	C	S	.	.			trans	-64.2	128.3	173.8	174.6	-105.9	0	0	0	111	D150 R154 R155 P156 H158 R386	D150-Y161 HydrophobicContact CB-CD2 3.69Å; D150-Y161 HydrophobicContact CB-CE2 3.62Å; R154-Y161 HydrophobicContact CB-CD2 4.43Å; R154-Y161 VanDerWaalsContact O-CD2 3.3Å; R154-Y161 WeakPolarHBondContact O-CD2 3.21Å; R154-Y161 WeakPolarHBondContact O-CE2 3.43Å; R155-Y161 WeakPolarHBondContact O-CB 3.22Å; R155-Y161 WeakPolarHBondContact O-CD2 3.46Å; P156-Y161 HydrophobicContact CB-CD1 4.3Å; P156-Y161 HydrophobicContact CB-CE1 4.17Å; P156-Y161 HydrophobicContact CG-CE1 4.1Å; P156-Y161 HydrophobicContact CG-CE2 4.12Å; H158-Y161 WeakPolarHBondContact O-CB 3.33Å; H158-Y161 PolarHBondContact O-N 3.07Å; Y161-R386 PolarHBondContact O-NH1 2.95Å; Y161-R386 PolarHBondContact O-NH2 2.89Å; Y161-R386 VanDerWaalsContact O-NH2 3.08Å
162	D	82.5	Confident	86.9	Confident	27 Å²	27	61.3 Å²	61.3	14%	0.144	31%	0.313	C	S	.	.			trans	-99.9	102.6	177.1	-172.1	-8.8	0	0	0	111.3	D150 E160 H164 T165	D150-D162 HydrophobicContact CB-CB 4.4Å; D150-D162 WeakPolarHBondContact CB-O 3.32Å; D150-D162 PolarHBondContact OD2-N 3.38Å; E160-D162 PolarHBondContact O-N 3.03Å; D162-H164 PolarHBondContact O-N 2.97Å; D162-H164 WeakPolarHBondContact OD1-CB 3.47Å; D162-H164 IonicContact OD1-CD2 3.76Å; D162-H164 PolarHBondContact OD1-CD2 2.83Å; D162-H164 IonicContact OD1-CG 3.6Å; D162-H164 PolarHBondContact OD1-N 3.39Å; D162-T165 PolarHBondContact O-N 2.88Å; D162-T165 VanDerWaalsContact O-N 3.12Å; D162-T165 PolarHBondContact O-OG1 2.96Å
163	S	83.8	Confident	86.9	Confident	49 Å²	49	57.9 Å²	57.9	34%	0.343	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-16	-179.9	51.8	0	0	0	0	114.2	T165	S163-T165 PolarHBondContact O-N 2.86Å
164	H	85.6	Confident	87	Confident	11 Å²	11	60.4 Å²	60.4	5%	0.051	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-15.2	176	-55.2	-63.5	0	0	0	112.2	D162 R189 Y190 T191 D192 E407	D162-H164 PolarHBondContact O-N 2.97Å; D162-H164 WeakPolarHBondContact OD1-CB 3.47Å; D162-H164 IonicContact OD1-CD2 3.76Å; D162-H164 PolarHBondContact OD1-CD2 2.83Å; D162-H164 IonicContact OD1-CG 3.6Å; D162-H164 PolarHBondContact OD1-N 3.39Å; H164-R189 CarbonylContact O-C 3.46Å; H164-R189 VanDerWaalsContact O-C 3.3Å; H164-R189 VanDerWaalsContact O-O 3.06Å; H164-Y190 PolarHBondContact O-N 3.25Å; H164-T191 WeakPolarHBondContact O-CB 3.45Å; H164-T191 PolarHBondContact O-N 2.89Å; H164-T191 PolarHBondContact O-OG1 3.29Å; H164-D192 WeakPolarHBondContact CA-OD1 3.37Å; H164-D192 IonicContact CE1-OD2 3.16Å; H164-D192 PolarHBondContact CE1-OD2 3.01Å; H164-D192 IonicContact CG-OD1 2.85Å; H164-D192 IonicContact CG-OD2 2.7Å; H164-D192 VanDerWaalsContact ND1-CG 3.33Å; H164-D192 IonicContact ND1-OD1 3.04Å; H164-D192 PolarHBondContact ND1-OD1 2.86Å; H164-D192 IonicContact ND1-OD2 2.84Å; H164-D192 PolarHBondContact ND1-OD2 3.2Å; H164-E407 IonicContact CE1-OE2 3.57Å; H164-E407 PolarHBondContact CE1-OE2 3.23Å; H164-E407 VanDerWaalsContact CE1-OE2 3.26Å; H164-E407 IonicContact NE2-OE2 3.84Å
165	T	89.6	Confident	87	Confident	14 Å²	14	65.1 Å²	65.1	9%	0.086	33%	0.325	C	S	.	.			trans	-120.4	155.7	-172.9	74	0	0	0	0	112.2	D150 I151 D162 S163 S188 T191	D150-T165 WeakPolarHBondContact CB-OG1 3.35Å; I151-T165 HydrophobicContact CB-CG2 4.49Å; I151-T165 HydrophobicContact CG2-CG2 4.06Å; I151-T165 WeakPolarHBondContact CG2-OG1 3.46Å; I151-T165 PolarHBondContact N-OG1 2.75Å; D162-T165 PolarHBondContact O-N 2.88Å; D162-T165 VanDerWaalsContact O-N 3.12Å; D162-T165 PolarHBondContact O-OG1 2.96Å; S163-T165 PolarHBondContact O-N 2.86Å; T165-S188 CarbonylContact C-O 3.56Å; T165-S188 VanDerWaalsContact CA-O 3.26Å; T165-S188 WeakPolarHBondContact CA-O 3.43Å; T165-S188 WeakPolarHBondContact CB-O 3.38Å; T165-T191 WeakPolarHBondContact CA-OG1 3.49Å
166	L	91.8	Very high	87	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.005	32%	0.319	C	S	.	.			trans	-137.2	129.1	-176.8	172.5	71.9	0	0	0	109.4	L143 I148 K149 V168 S188 T191	L143-L166 HydrophobicContact CD2-CD1 4.1Å; L143-L166 HydrophobicContact CD2-CD2 3.54Å; L143-L166 HydrophobicContact CD2-CG 4.44Å; I148-L166 HydrophobicContact CD1-CD1 4.2Å; I148-L166 HydrophobicContact CG1-CD1 3.74Å; K149-L166 CarbonylContact O-C 3.08Å; K149-L166 WeakPolarHBondContact O-CA 3.42Å; L166-V168 HydrophobicContact CD2-CG2 3.87Å; L166-V168 HydrophobicContact CG-CG2 4.03Å; L166-V168 PolarHBondContact O-N 3.12Å; L166-S188 PolarHBondContact N-O 3.29Å; L166-S188 WeakPolarHBondContact O-CA 3.28Å; L166-S188 VanDerWaalsContact O-CB 3.23Å; L166-S188 WeakPolarHBondContact O-CB 3.31Å; L166-T191 HydrophobicContact CB-CG2 3.87Å; L166-T191 WeakPolarHBondContact CB-OG1 3.43Å; L166-T191 HydrophobicContact CD2-CG2 4.39Å; L166-T191 PolarHBondContact N-OG1 3.39Å; L166-T191 VanDerWaalsContact N-OG1 3.14Å
167	Y	92.9	Very high	87.4	Confident	105 Å²	105	64.2 Å²	64.2	41%	0.412	33%	0.327	S	S	.	.			trans	-71.4	112.7	167.8	-175.4	-106.2	0	0	0	110.1	K149 D150 P169	K149-Y167 PolarHBondContact O-N 3.27Å; D150-Y167 VanDerWaalsContact O-CB 3.29Å; D150-Y167 WeakPolarHBondContact O-CB 3.22Å; Y167-P169 HydrophobicContact CD1-CG 4.44Å; Y167-P169 HydrophobicContact CE1-CB 4.42Å; Y167-P169 HydrophobicContact CE1-CG 4.04Å
168	V	91.6	Very high	87.7	Confident	2 Å²	2	60.6 Å²	60.6	1%	0.012	31%	0.311	C	S	.	.			trans	-108.4	120.4	170.1	-178.1	0	0	0	0	107.7	F142 L166 E170 F172 K173 W184	F142-V168 HydrophobicContact CE2-CB 4.45Å; F142-V168 HydrophobicContact CE2-CG1 4.1Å; F142-V168 HydrophobicContact CE2-CG2 4.08Å; F142-V168 HydrophobicContact CZ-CG1 4.01Å; L166-V168 HydrophobicContact CD2-CG2 3.87Å; L166-V168 HydrophobicContact CG-CG2 4.03Å; L166-V168 PolarHBondContact O-N 3.12Å; V168-E170 PolarHBondContact O-N 2.96Å; V168-F172 HydrophobicContact CG1-CD1 3.72Å; V168-F172 HydrophobicContact CG1-CE1 4.35Å; V168-K173 HydrophobicContact CB-CG 4.42Å; V168-K173 HydrophobicContact CG1-CD 4.41Å; V168-K173 HydrophobicContact CG1-CG 3.73Å; V168-K173 WeakPolarHBondContact O-CE 3.05Å; V168-W184 HydrophobicContact CG1-CE3 4.32Å; V168-W184 HydrophobicContact CG2-CE3 4Å
169	P	91.8	Very high	87.9	Confident	34 Å²	34	57.5 Å²	57.5	22%	0.221	30%	0.3	C	S	.	.			trans	-56.9	135.6	-179.3	-25.3	33.5	0	0	0	112.7	F142 Y167 E171 F172 K173	F142-P169 HydrophobicContact CB-CG 4.14Å; F142-P169 HydrophobicContact CD1-CG 3.97Å; F142-P169 HydrophobicContact CG-CG 4.16Å; Y167-P169 HydrophobicContact CD1-CG 4.44Å; Y167-P169 HydrophobicContact CE1-CB 4.42Å; Y167-P169 HydrophobicContact CE1-CG 4.04Å; P169-E171 VanDerWaalsContact C-N 3.26Å; P169-E171 PolarHBondContact O-N 3.22Å; P169-F172 HydrophobicContact CB-CB 4.33Å; P169-F172 WeakPolarHBondContact O-CB 3.39Å; P169-F172 PolarHBondContact O-N 3.3Å; P169-K173 PolarHBondContact O-N 3.02Å; P169-K173 VanDerWaalsContact O-N 3.11Å
170	E	90.1	Very high	88.6	Confident	97 Å²	97	53.1 Å²	53.1	45%	0.453	27%	0.27	S	S	.	.	H	α-helix	trans	-63.2	-32.2	179.3	-71.4	-54.7	144.5	0	0	112.8	V168 F172 K173 T174	V168-E170 PolarHBondContact O-N 2.96Å; E170-F172 PolarHBondContact O-N 3.37Å; E170-K173 PolarHBondContact O-N 3.48Å; E170-K173 IonicContact OE1-NZ 3.01Å; E170-K173 PolarHBondContact OE1-NZ 2.95Å; E170-T174 WeakPolarHBondContact O-CB 3.36Å; E170-T174 VanDerWaalsContact O-CG2 3.31Å; E170-T174 WeakPolarHBondContact O-CG2 3.34Å; E170-T174 PolarHBondContact O-N 3.39Å; E170-T174 PolarHBondContact O-OG1 2.91Å
171	E	89.6	Confident	89.2	Confident	151 Å²	151	51.1 Å²	51.1	71%	0.706	26%	0.259	S	S	*	.	H	α-helix	trans	-61.2	-29.1	172.4	-64.8	-179	-170.7	0	0	113.1	P169 T174 K175	P169-E171 VanDerWaalsContact C-N 3.26Å; P169-E171 PolarHBondContact O-N 3.22Å; E171-T174 WeakPolarHBondContact CA-OG1 3.41Å; E171-T174 PolarHBondContact O-OG1 3.46Å; E171-K175 WeakPolarHBondContact O-CD 3.43Å; E171-K175 WeakPolarHBondContact O-CG 3.28Å
172	F	91.4	Very high	89.7	Confident	37 Å²	37	51.6 Å²	51.6	16%	0.162	26%	0.261	C	S	.	.	H	α-helix	trans	-79.9	-45.8	175.7	175.2	-97.5	0	0	0	110.7	L140 F142 V168 P169 E170 T174 K175 Q176 W184	L140-F172 HydrophobicContact CD1-CE2 4.37Å; L140-F172 HydrophobicContact CD1-CZ 3.92Å; L140-F172 HydrophobicContact CD2-CD2 4.25Å; L140-F172 HydrophobicContact CD2-CE2 3.48Å; L140-F172 VanDerWaalsContact CD2-CE2 3.48Å; L140-F172 HydrophobicContact CD2-CZ 3.89Å; F142-F172 HydrophobicContact CE1-CB 4.29Å; F142-F172 AromaticContact CE1-CD1 3.81Å; F142-F172 HydrophobicContact CE1-CD1 3.81Å; F142-F172 HydrophobicContact CE1-CD2 4.04Å; F142-F172 HydrophobicContact CE1-CE1 4.11Å; F142-F172 HydrophobicContact CE1-CE2 4.32Å; F142-F172 AromaticContact CE1-CG 3.77Å; F142-F172 HydrophobicContact CE1-CG 3.77Å; F142-F172 HydrophobicContact CE1-CZ 4.35Å; F142-F172 AromaticContact CZ-CD1 3.75Å; F142-F172 HydrophobicContact CZ-CD1 3.75Å; F142-F172 AromaticContact CZ-CE1 3.76Å; F142-F172 HydrophobicContact CZ-CE1 3.76Å; F142-F172 HydrophobicContact CZ-CG 4.2Å; F142-F172 HydrophobicContact CZ-CZ 4.22Å; V168-F172 HydrophobicContact CG1-CD1 3.72Å; V168-F172 HydrophobicContact CG1-CE1 4.35Å; P169-F172 HydrophobicContact CB-CB 4.33Å; P169-F172 WeakPolarHBondContact O-CB 3.39Å; P169-F172 PolarHBondContact O-N 3.3Å; E170-F172 PolarHBondContact O-N 3.37Å; F172-T174 VanDerWaalsContact C-N 3.32Å; F172-T174 PolarHBondContact O-N 3.19Å; F172-K175 PolarHBondContact O-N 3.02Å; F172-K175 VanDerWaalsContact O-N 3.16Å; F172-Q176 HydrophobicContact CE1-CG 4.15Å; F172-Q176 VanDerWaalsContact CE2-NE2 3.32Å; F172-Q176 HydrophobicContact CZ-CG 4.4Å; F172-Q176 VanDerWaalsContact CZ-NE2 3.35Å; F172-Q176 WeakPolarHBondContact O-CG 3.48Å; F172-Q176 PolarHBondContact O-NE2 3.23Å; F172-W184 AromaticContact CE1-CD1 3.98Å; F172-W184 AromaticContact CE1-CD2 3.88Å; F172-W184 HydrophobicContact CE1-CD2 3.88Å; F172-W184 AromaticContact CE1-CE2 3.6Å; F172-W184 HydrophobicContact CE1-CG 4.12Å; F172-W184 HydrophobicContact CE1-CZ2 4.04Å; F172-W184 AromaticContact CE1-NE1 3.69Å; F172-W184 HydrophobicContact CZ-CZ2 4.15Å
173	K	89.5	Confident	90.3	Very high	19 Å²	19	50.3 Å²	50.3	8%	0.083	26%	0.255	C	S	.	.	H	α-helix	trans	-59.2	-41.1	178.5	-65.7	-174.9	-164.7	162.4	0	112.6	V168 P169 E170 K175 Q176 R181 E185	V168-K173 HydrophobicContact CB-CG 4.42Å; V168-K173 HydrophobicContact CG1-CD 4.41Å; V168-K173 HydrophobicContact CG1-CG 3.73Å; V168-K173 WeakPolarHBondContact O-CE 3.05Å; P169-K173 PolarHBondContact O-N 3.02Å; P169-K173 VanDerWaalsContact O-N 3.11Å; E170-K173 PolarHBondContact O-N 3.48Å; E170-K173 IonicContact OE1-NZ 3.01Å; E170-K173 PolarHBondContact OE1-NZ 2.95Å; K173-K175 PolarHBondContact O-N 2.76Å; K173-Q176 WeakPolarHBondContact O-CB 3.49Å; K173-Q176 PolarHBondContact O-N 2.79Å; K173-Q176 VanDerWaalsContact O-N 3.16Å; K173-R181 HydrophobicContact CB-CG 4.33Å; K173-E185 HydrophobicContact CD-CG 4.13Å
174	T	88.3	Confident	90.8	Very high	87 Å²	87	48 Å²	48	53%	0.534	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-20.9	179.3	47.7	0	0	0	0	113.8	E170 E171 F172	E170-T174 WeakPolarHBondContact O-CB 3.36Å; E170-T174 VanDerWaalsContact O-CG2 3.31Å; E170-T174 WeakPolarHBondContact O-CG2 3.34Å; E170-T174 PolarHBondContact O-N 3.39Å; E170-T174 PolarHBondContact O-OG1 2.91Å; E171-T174 WeakPolarHBondContact CA-OG1 3.41Å; E171-T174 PolarHBondContact O-OG1 3.46Å; F172-T174 VanDerWaalsContact C-N 3.32Å; F172-T174 PolarHBondContact O-N 3.19Å
175	K	89.8	Confident	91.2	Very high	165 Å²	165	50.4 Å²	50.4	72%	0.717	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-11	174.3	-69.6	173.9	-174.7	174.7	0	113.5	E171 F172 K173	E171-K175 WeakPolarHBondContact O-CD 3.43Å; E171-K175 WeakPolarHBondContact O-CG 3.28Å; F172-K175 PolarHBondContact O-N 3.02Å; F172-K175 VanDerWaalsContact O-N 3.16Å; K173-K175 PolarHBondContact O-N 2.76Å
176	Q	89.8	Confident	91.5	Very high	54 Å²	54	50.7 Å²	50.7	25%	0.252	25%	0.25	S	S	.	.	S	Bend	trans	-81.9	157.1	179.5	-59.3	-50.5	-54.9	0	0	111.4	F172 K173 M180 R181	F172-Q176 HydrophobicContact CE1-CG 4.15Å; F172-Q176 VanDerWaalsContact CE2-NE2 3.32Å; F172-Q176 HydrophobicContact CZ-CG 4.4Å; F172-Q176 VanDerWaalsContact CZ-NE2 3.35Å; F172-Q176 WeakPolarHBondContact O-CG 3.48Å; F172-Q176 PolarHBondContact O-NE2 3.23Å; K173-Q176 WeakPolarHBondContact O-CB 3.49Å; K173-Q176 PolarHBondContact O-N 2.79Å; K173-Q176 VanDerWaalsContact O-N 3.16Å; Q176-M180 HydrophobicContact CB-CB 4.17Å; Q176-M180 HydrophobicContact CB-CG 4.23Å; Q176-M180 HydrophobicContact CG-CG 4.37Å; Q176-R181 HydrophobicContact CB-CB 4.27Å
177	T	90.3	Very high	91.6	Very high	71 Å²	71	50.8 Å²	50.8	44%	0.436	25%	0.251	S	S	.	.			trans	-59.2	150.9	167.7	65.4	0	0	0	0	109.7	G179 M180 R181	T177-G179 VanDerWaalsContact C-N 3.25Å; T177-G179 PolarHBondContact O-N 3.01Å; T177-G179 VanDerWaalsContact O-N 3.17Å; T177-M180 CarbonylContact O-C 3.58Å; T177-M180 PolarHBondContact O-N 2.8Å; T177-M180 VanDerWaalsContact OG1-CB 3.24Å; T177-M180 WeakPolarHBondContact OG1-CB 3.47Å; T177-M180 PolarHBondContact OG1-N 3.07Å; T177-R181 WeakPolarHBondContact O-CB 3.47Å; T177-R181 PolarHBondContact O-N 3.43Å
178	P	88.6	Confident	91.7	Very high	55 Å²	55	46 Å²	46	36%	0.357	23%	0.233	S	C	.	.	H	α-helix	trans	-54.8	-37.1	-177.7	-29.9	37.3	0	0	0	114.5	Q182 E273 V275	P178-Q182 PolarHBondContact O-N 3.36Å; P178-Q182 VanDerWaalsContact O-N 3.17Å; P178-E273 HydrophobicContact CB-CB 4.29Å; P178-V275 HydrophobicContact CB-CB 3.68Å; P178-V275 HydrophobicContact CB-CG1 3.52Å; P178-V275 HydrophobicContact CB-CG2 4.3Å
179	G	88.8	Confident	91.7	Very high	13 Å²	13	52.9 Å²	52.9	13%	0.134	26%	0.258	C	S	.	.	H	α-helix	trans	-66.7	-47	174.5	0	0	0	0	0	112.7	T177 R181 Q182 W183	T177-G179 VanDerWaalsContact C-N 3.25Å; T177-G179 PolarHBondContact O-N 3.01Å; T177-G179 VanDerWaalsContact O-N 3.17Å; G179-R181 VanDerWaalsContact C-N 3.31Å; G179-R181 PolarHBondContact O-N 3.11Å; G179-Q182 PolarHBondContact O-N 3.48Å; G179-W183 PolarHBondContact O-N 2.54Å; G179-W183 VanDerWaalsContact O-N 3.09Å
180	M	92.4	Very high	91.8	Very high	12 Å²	12	53.3 Å²	53.3	6%	0.059	26%	0.256	C	S	.	.	H	α-helix	trans	-67.6	-33	178.2	-172.3	54.6	66.9	0	0	112	Q176 T177 W183 W184 Y206 F226	Q176-M180 HydrophobicContact CB-CB 4.17Å; Q176-M180 HydrophobicContact CB-CG 4.23Å; Q176-M180 HydrophobicContact CG-CG 4.37Å; T177-M180 CarbonylContact O-C 3.58Å; T177-M180 PolarHBondContact O-N 2.8Å; T177-M180 VanDerWaalsContact OG1-CB 3.24Å; T177-M180 WeakPolarHBondContact OG1-CB 3.47Å; T177-M180 PolarHBondContact OG1-N 3.07Å; M180-W183 WeakPolarHBondContact O-CB 3.49Å; M180-W183 PolarHBondContact O-N 3.23Å; M180-W183 HydrophobicContact SD-CB 4.28Å; M180-W183 HydrophobicContact SD-CD2 4.39Å; M180-W183 HydrophobicContact SD-CE3 4.06Å; M180-W184 PolarHBondContact O-N 3.06Å; M180-Y206 HydrophobicContact CE-CD1 3.96Å; M180-Y206 HydrophobicContact CE-CD2 4.1Å; M180-Y206 HydrophobicContact CE-CE1 4.26Å; M180-Y206 HydrophobicContact CE-CE2 4.39Å; M180-Y206 HydrophobicContact CE-CG 3.86Å; M180-F226 HydrophobicContact CE-CD2 4.35Å; M180-F226 HydrophobicContact CE-CE1 4.27Å; M180-F226 HydrophobicContact CE-CE2 3.65Å; M180-F226 HydrophobicContact CE-CZ 3.6Å
181	R	92.5	Very high	91.9	Very high	57 Å²	57	49 Å²	49	22%	0.215	24%	0.236	C	C	.	.	H	α-helix	trans	-60.3	-48.5	171.9	178.5	177.7	176.2	175.4	-1.6	111.5	K173 Q176 T177 G179 W183 W184 E185 E273	K173-R181 HydrophobicContact CB-CG 4.33Å; Q176-R181 HydrophobicContact CB-CB 4.27Å; T177-R181 WeakPolarHBondContact O-CB 3.47Å; T177-R181 PolarHBondContact O-N 3.43Å; G179-R181 VanDerWaalsContact C-N 3.31Å; G179-R181 PolarHBondContact O-N 3.11Å; R181-W183 VanDerWaalsContact C-N 3.27Å; R181-W183 PolarHBondContact O-N 3.46Å; R181-W184 PolarHBondContact O-N 2.89Å; R181-E185 HydrophobicContact CG-CG 4.49Å; R181-E185 IonicContact CZ-OE1 3.85Å; R181-E185 IonicContact NE-OE1 2.7Å; R181-E185 PolarHBondContact NE-OE1 2.91Å; R181-E185 IonicContact NH2-OE1 3.52Å; R181-E185 WeakPolarHBondContact O-CG 3.45Å; R181-E185 PolarHBondContact O-N 3.4Å; R181-E273 IonicContact CZ-OE1 3.92Å; R181-E273 IonicContact NE-OE1 3.98Å; R181-E273 IonicContact NH1-OE1 3.52Å; R181-E273 PolarHBondContact NH1-OE1 3.46Å
182	Q	93.5	Very high	91.9	Very high	23 Å²	23	43 Å²	43	11%	0.107	21%	0.209	C	C	.	.	H	α-helix	trans	-58.2	-41.6	174.3	-74.2	-173.2	31.2	0	0	111.4	P178 G179 E185 L186 F197 V276 R278	P178-Q182 PolarHBondContact O-N 3.36Å; P178-Q182 VanDerWaalsContact O-N 3.17Å; G179-Q182 PolarHBondContact O-N 3.48Å; Q182-E185 PolarHBondContact O-N 2.78Å; Q182-L186 WeakPolarHBondContact O-CG 3.46Å; Q182-L186 PolarHBondContact O-N 3.5Å; Q182-F197 HydrophobicContact CB-CZ 4.35Å; Q182-V276 PolarHBondContact NE2-O 3.34Å; Q182-V276 PolarHBondContact OE1-O 2.97Å; Q182-R278 VanDerWaalsContact OE1-N 3.13Å
183	W	95.2	Very high	92.1	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-60	-47.3	175.6	-175.6	89.2	0	0	0	111.8	G179 M180 R181 E185 L186 K187 F197 Y206 H207 M208	G179-W183 PolarHBondContact O-N 2.54Å; G179-W183 VanDerWaalsContact O-N 3.09Å; M180-W183 WeakPolarHBondContact O-CB 3.49Å; M180-W183 PolarHBondContact O-N 3.23Å; M180-W183 HydrophobicContact SD-CB 4.28Å; M180-W183 HydrophobicContact SD-CD2 4.39Å; M180-W183 HydrophobicContact SD-CE3 4.06Å; R181-W183 VanDerWaalsContact C-N 3.27Å; R181-W183 PolarHBondContact O-N 3.46Å; W183-E185 VanDerWaalsContact C-N 3.33Å; W183-E185 PolarHBondContact O-N 2.93Å; W183-L186 PolarHBondContact O-N 3.25Å; W183-K187 HydrophobicContact CD2-CB 4.48Å; W183-K187 HydrophobicContact CE3-CB 4.22Å; W183-K187 HydrophobicContact CH2-CB 4.09Å; W183-K187 HydrophobicContact CH2-CD 4.13Å; W183-K187 HydrophobicContact CH2-CG 3.73Å; W183-K187 HydrophobicContact CZ2-CB 4.37Å; W183-K187 HydrophobicContact CZ2-CD 4.13Å; W183-K187 HydrophobicContact CZ2-CG 4.16Å; W183-K187 HydrophobicContact CZ3-CB 3.99Å; W183-K187 HydrophobicContact CZ3-CG 4.03Å; W183-K187 WeakPolarHBondContact O-CB 3.39Å; W183-K187 PolarHBondContact O-N 3.2Å; W183-F197 HydrophobicContact CB-CD2 4.29Å; W183-F197 HydrophobicContact CB-CE2 3.96Å; W183-F197 HydrophobicContact CB-CZ 4.14Å; W183-F197 AromaticContact CD1-CD2 3.68Å; W183-F197 AromaticContact CD1-CG 3.84Å; W183-F197 HydrophobicContact CG-CD2 4.4Å; W183-Y206 AromaticContact CD1-CD2 3.53Å; W183-Y206 HydrophobicContact CD2-CD2 4.23Å; W183-Y206 AromaticContact CG-CD2 3.84Å; W183-Y206 HydrophobicContact CG-CD2 3.84Å; W183-Y206 WeakPolarHBondContact CZ2-O 3.35Å; W183-Y206 AromaticContact NE1-CD2 3.71Å; W183-H207 AromaticContact CE3-CD2 3.97Å; W183-H207 HydrophobicContact CH2-CB 3.92Å; W183-H207 AromaticContact CH2-CD2 3.74Å; W183-H207 HydrophobicContact CZ3-CB 4.42Å; W183-H207 AromaticContact CZ3-CD2 3.43Å; W183-H207 VanDerWaalsContact CZ3-CD2 3.43Å; W183-H207 WeakPolarHBondContact CZ3-CD2 3.48Å; W183-M208 HydrophobicContact CH2-SD 3.71Å
184	W	94.6	Very high	92.4	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-65	-34.1	176.3	-81.4	107.5	0	0	0	113.2	L140 F142 L143 V168 F172 M180 R181 S188 H207 M208	L140-W184 HydrophobicContact CD1-CH2 3.76Å; L140-W184 HydrophobicContact CD1-CZ2 3.82Å; F142-W184 HydrophobicContact CE2-CZ3 4.11Å; F142-W184 HydrophobicContact CZ-CH2 4.41Å; F142-W184 HydrophobicContact CZ-CZ3 4.29Å; L143-W184 HydrophobicContact CD1-CH2 4.15Å; V168-W184 HydrophobicContact CG1-CE3 4.32Å; V168-W184 HydrophobicContact CG2-CE3 4Å; F172-W184 AromaticContact CE1-CD1 3.98Å; F172-W184 AromaticContact CE1-CD2 3.88Å; F172-W184 HydrophobicContact CE1-CD2 3.88Å; F172-W184 AromaticContact CE1-CE2 3.6Å; F172-W184 HydrophobicContact CE1-CG 4.12Å; F172-W184 HydrophobicContact CE1-CZ2 4.04Å; F172-W184 AromaticContact CE1-NE1 3.69Å; F172-W184 HydrophobicContact CZ-CZ2 4.15Å; M180-W184 PolarHBondContact O-N 3.06Å; R181-W184 PolarHBondContact O-N 2.89Å; W184-S188 VanDerWaalsContact O-CB 3.23Å; W184-S188 WeakPolarHBondContact O-CB 3.48Å; W184-S188 PolarHBondContact O-N 3.4Å; W184-S188 PolarHBondContact O-OG 2.75Å; W184-H207 AromaticContact CE2-CD2 3.98Å; W184-H207 AromaticContact CE2-NE2 3.8Å; W184-H207 AromaticContact CZ2-CD2 3.6Å; W184-H207 AromaticContact CZ2-CE1 3.97Å; W184-H207 AromaticContact CZ2-CG 4Å; W184-H207 AromaticContact CZ2-NE2 3.57Å; W184-H207 AromaticContact NE1-NE2 3.56Å; W184-M208 HydrophobicContact CH2-CE 4.44Å
185	E	94.2	Very high	92.9	Very high	62 Å²	62	36.3 Å²	36.3	29%	0.29	17%	0.172	S	C	.	.	H	α-helix	trans	-65.2	-43.3	173.4	-74.6	174.7	-172.8	0	0	111.5	K173 R181 Q182 W183 S188	K173-E185 HydrophobicContact CD-CG 4.13Å; R181-E185 HydrophobicContact CG-CG 4.49Å; R181-E185 IonicContact CZ-OE1 3.85Å; R181-E185 IonicContact NE-OE1 2.7Å; R181-E185 PolarHBondContact NE-OE1 2.91Å; R181-E185 IonicContact NH2-OE1 3.52Å; R181-E185 WeakPolarHBondContact O-CG 3.45Å; R181-E185 PolarHBondContact O-N 3.4Å; Q182-E185 PolarHBondContact O-N 2.78Å; W183-E185 VanDerWaalsContact C-N 3.33Å; W183-E185 PolarHBondContact O-N 2.93Å; E185-S188 PolarHBondContact O-N 3.14Å; E185-S188 PolarHBondContact O-OG 2.71Å
186	L	94.5	Very high	93.2	Very high	19 Å²	19	28.5 Å²	28.5	10%	0.099	14%	0.138	C	C	.	.	H	α-helix	trans	-67.1	-45.9	174	-67.9	177.8	0	0	0	111.2	Q182 W183 S188 R189 Y190 L195 F197 I253 V280	Q182-L186 WeakPolarHBondContact O-CG 3.46Å; Q182-L186 PolarHBondContact O-N 3.5Å; W183-L186 PolarHBondContact O-N 3.25Å; L186-S188 PolarHBondContact O-N 3.08Å; L186-R189 PolarHBondContact O-N 2.92Å; L186-Y190 WeakPolarHBondContact O-CD2 3.45Å; L186-Y190 PolarHBondContact O-N 3.45Å; L186-L195 HydrophobicContact CB-CD1 3.96Å; L186-F197 HydrophobicContact CD1-CD2 4.38Å; L186-F197 HydrophobicContact CD1-CE2 4.11Å; L186-I253 HydrophobicContact CD1-CD1 3.76Å; L186-I253 HydrophobicContact CD1-CG1 4.13Å; L186-I253 HydrophobicContact CD1-CG2 3.83Å; L186-V280 HydrophobicContact CD2-CG2 4.16Å
187	K	94.9	Very high	93.5	Very high	4 Å²	4	26 Å²	26	2%	0.017	13%	0.127	C	C	.	.	H	α-helix	trans	-62	-33.3	178.6	-167	64.1	178.1	174.7	0	112.1	W183 R189 Y190 T191 V193 L195 D209	W183-K187 HydrophobicContact CD2-CB 4.48Å; W183-K187 HydrophobicContact CE3-CB 4.22Å; W183-K187 HydrophobicContact CH2-CB 4.09Å; W183-K187 HydrophobicContact CH2-CD 4.13Å; W183-K187 HydrophobicContact CH2-CG 3.73Å; W183-K187 HydrophobicContact CZ2-CB 4.37Å; W183-K187 HydrophobicContact CZ2-CD 4.13Å; W183-K187 HydrophobicContact CZ2-CG 4.16Å; W183-K187 HydrophobicContact CZ3-CB 3.99Å; W183-K187 HydrophobicContact CZ3-CG 4.03Å; W183-K187 WeakPolarHBondContact O-CB 3.39Å; W183-K187 PolarHBondContact O-N 3.2Å; K187-R189 PolarHBondContact O-N 3.47Å; K187-Y190 CarbonylContact O-C 3.28Å; K187-Y190 PolarHBondContact O-N 3.39Å; K187-T191 VanDerWaalsContact CE-O 3.29Å; K187-T191 WeakPolarHBondContact CE-O 3.31Å; K187-T191 PolarHBondContact NZ-O 3.28Å; K187-T191 VanDerWaalsContact O-CA 3.32Å; K187-T191 WeakPolarHBondContact O-CA 3.43Å; K187-T191 PolarHBondContact O-N 3.09Å; K187-T191 PolarHBondContact O-OG1 2.88Å; K187-T191 VanDerWaalsContact O-OG1 3.13Å; K187-V193 PolarHBondContact NZ-O 3.02Å; K187-L195 HydrophobicContact CB-CD1 3.9Å; K187-L195 HydrophobicContact CD-CD1 3.94Å; K187-L195 HydrophobicContact CD-CG 4.11Å; K187-D209 IonicContact NZ-OD1 3.91Å; K187-D209 PolarHBondContact NZ-OD1 3.49Å; K187-D209 IonicContact NZ-OD2 3.77Å; K187-D209 PolarHBondContact NZ-OD2 3.39Å
188	S	93.8	Very high	93.6	Very high	4 Å²	4	22.6 Å²	22.6	3%	0.028	11%	0.106	C	C	.	.	H	α-helix	trans	-62.6	-23.4	173.3	77.4	0	0	0	0	113.7	T165 L166 W184 E185 L186	T165-S188 CarbonylContact C-O 3.56Å; T165-S188 VanDerWaalsContact CA-O 3.26Å; T165-S188 WeakPolarHBondContact CA-O 3.43Å; T165-S188 WeakPolarHBondContact CB-O 3.38Å; L166-S188 PolarHBondContact N-O 3.29Å; L166-S188 WeakPolarHBondContact O-CA 3.28Å; L166-S188 VanDerWaalsContact O-CB 3.23Å; L166-S188 WeakPolarHBondContact O-CB 3.31Å; W184-S188 VanDerWaalsContact O-CB 3.23Å; W184-S188 WeakPolarHBondContact O-CB 3.48Å; W184-S188 PolarHBondContact O-N 3.4Å; W184-S188 PolarHBondContact O-OG 2.75Å; E185-S188 PolarHBondContact O-N 3.14Å; E185-S188 PolarHBondContact O-OG 2.71Å; L186-S188 PolarHBondContact O-N 3.08Å
189	R	92.6	Very high	93.7	Very high	147 Å²	147	21.8 Å²	21.8	56%	0.555	10%	0.1	S	C	*	.	H	α-helix	trans	-100.5	-21.2	178.2	-63.3	179	-175.7	179.2	2.9	113.5	I151 H164 L186 K187	I151-R189 HydrophobicContact CD1-CG 4.31Å; H164-R189 CarbonylContact O-C 3.46Å; H164-R189 VanDerWaalsContact O-C 3.3Å; H164-R189 VanDerWaalsContact O-O 3.06Å; L186-R189 PolarHBondContact O-N 2.92Å; K187-R189 PolarHBondContact O-N 3.47Å
190	Y	93.6	Very high	93.6	Very high	43 Å²	43	22.4 Å²	22.4	17%	0.169	11%	0.106	C	C	.	.			trans	-134.1	59	-173.7	-58	-72.5	0	0	0	110	H164 L186 K187 V193 V280 I283 Y495	H164-Y190 PolarHBondContact O-N 3.25Å; L186-Y190 WeakPolarHBondContact O-CD2 3.45Å; L186-Y190 PolarHBondContact O-N 3.45Å; K187-Y190 CarbonylContact O-C 3.28Å; K187-Y190 PolarHBondContact O-N 3.39Å; Y190-V193 HydrophobicContact CD1-CG2 4.45Å; Y190-V193 PolarHBondContact O-N 3.24Å; Y190-V280 HydrophobicContact CD2-CG2 3.89Å; Y190-V280 HydrophobicContact CE2-CB 4.3Å; Y190-V280 HydrophobicContact CE2-CG2 3.53Å; Y190-I283 HydrophobicContact CD1-CD1 3.73Å; Y190-I283 HydrophobicContact CE1-CD1 3.5Å; Y190-I283 VanDerWaalsContact CE1-CD1 3.5Å; Y190-Y495 HydrophobicContact CD1-CE2 4.08Å; Y190-Y495 AromaticContact CE1-CE2 3.9Å; Y190-Y495 HydrophobicContact CE1-CE2 3.9Å
191	T	91.7	Very high	93.4	Very high	5 Å²	5	27.2 Å²	27.2	3%	0.031	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-40.4	-170.1	-54.1	0	0	0	0	111.6	V121 H164 T165 L166 K187 V193	V121-T191 HydrophobicContact CG2-CG2 3.78Å; H164-T191 WeakPolarHBondContact O-CB 3.45Å; H164-T191 PolarHBondContact O-N 2.89Å; H164-T191 PolarHBondContact O-OG1 3.29Å; T165-T191 WeakPolarHBondContact CA-OG1 3.49Å; L166-T191 HydrophobicContact CB-CG2 3.87Å; L166-T191 WeakPolarHBondContact CB-OG1 3.43Å; L166-T191 HydrophobicContact CD2-CG2 4.39Å; L166-T191 PolarHBondContact N-OG1 3.39Å; L166-T191 VanDerWaalsContact N-OG1 3.14Å; K187-T191 VanDerWaalsContact CE-O 3.29Å; K187-T191 WeakPolarHBondContact CE-O 3.31Å; K187-T191 PolarHBondContact NZ-O 3.28Å; K187-T191 VanDerWaalsContact O-CA 3.32Å; K187-T191 WeakPolarHBondContact O-CA 3.43Å; K187-T191 PolarHBondContact O-N 3.09Å; K187-T191 PolarHBondContact O-OG1 2.88Å; K187-T191 VanDerWaalsContact O-OG1 3.13Å; T191-V193 VanDerWaalsContact C-N 3.27Å; T191-V193 PolarHBondContact O-N 3.17Å
192	D	91.1	Very high	93.4	Very high	25 Å²	25	29 Å²	29	13%	0.134	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	2.9	179.7	64.2	-41.9	0	0	0	113.6	V120 H164 K249	V120-D192 HydrophobicContact CG2-CB 4.28Å; H164-D192 WeakPolarHBondContact CA-OD1 3.37Å; H164-D192 IonicContact CE1-OD2 3.16Å; H164-D192 PolarHBondContact CE1-OD2 3.01Å; H164-D192 IonicContact CG-OD1 2.85Å; H164-D192 IonicContact CG-OD2 2.7Å; H164-D192 VanDerWaalsContact ND1-CG 3.33Å; H164-D192 IonicContact ND1-OD1 3.04Å; H164-D192 PolarHBondContact ND1-OD1 2.86Å; H164-D192 IonicContact ND1-OD2 2.84Å; H164-D192 PolarHBondContact ND1-OD2 3.2Å; D192-K249 IonicContact OD2-NZ 2.99Å; D192-K249 PolarHBondContact OD2-NZ 2.62Å
193	V	94.9	Very high	93.5	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	135.7	-178.6	-170	0	0	0	0	110.1	K187 Y190 T191 L195 K249 A251 I283	K187-V193 PolarHBondContact NZ-O 3.02Å; Y190-V193 HydrophobicContact CD1-CG2 4.45Å; Y190-V193 PolarHBondContact O-N 3.24Å; T191-V193 VanDerWaalsContact C-N 3.27Å; T191-V193 PolarHBondContact O-N 3.17Å; V193-L195 HydrophobicContact CB-CD2 4.39Å; V193-L195 HydrophobicContact CG1-CD2 4.46Å; V193-K249 HydrophobicContact CB-CB 4.28Å; V193-K249 HydrophobicContact CG1-CB 3.99Å; V193-K249 HydrophobicContact CG2-CB 4.04Å; V193-K249 HydrophobicContact CG2-CD 4.21Å; V193-A251 HydrophobicContact CG1-CB 3.59Å; V193-A251 VanDerWaalsContact CG1-N 3.34Å; V193-I283 HydrophobicContact CG1-CG2 4.01Å; V193-I283 HydrophobicContact CG2-CG2 4.45Å
194	I	96.2	Very high	93.5	Very high	4 Å²	4	29.7 Å²	29.7	2%	0.021	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	122.1	173.6	-62.1	175.7	0	0	0	108.4	F196 M205 D209 I212 L243 Y248 K249 V250 A251	I194-F196 HydrophobicContact CG2-CD1 4.13Å; I194-F196 HydrophobicContact CG2-CE1 3.96Å; I194-M205 HydrophobicContact CG2-CE 3.43Å; I194-M205 VanDerWaalsContact CG2-CE 3.43Å; I194-D209 HydrophobicContact CG2-CB 4.16Å; I194-I212 HydrophobicContact CD1-CB 4.25Å; I194-I212 HydrophobicContact CD1-CD1 4.04Å; I194-I212 HydrophobicContact CD1-CG2 3.65Å; I194-I212 HydrophobicContact CG1-CD1 4.16Å; I194-L243 HydrophobicContact CD1-CD1 3.86Å; I194-L243 HydrophobicContact CD1-CD2 4.23Å; I194-L243 HydrophobicContact CG2-CD1 4.12Å; I194-Y248 HydrophobicContact CD1-CD1 3.71Å; I194-Y248 HydrophobicContact CD1-CD2 4.46Å; I194-Y248 HydrophobicContact CD1-CE1 4.48Å; I194-Y248 HydrophobicContact CD1-CG 3.7Å; I194-K249 WeakPolarHBondContact CB-O 3.4Å; I194-K249 PolarHBondContact N-O 3.26Å; I194-V250 WeakPolarHBondContact O-CA 3.4Å; I194-A251 PolarHBondContact O-N 2.79Å
195	L	97.2	Very high	93.7	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	108.4	-175.5	-56.6	-166.2	0	0	0	110.3	L186 K187 V193 F197 D209 A251 I253	L186-L195 HydrophobicContact CB-CD1 3.96Å; K187-L195 HydrophobicContact CB-CD1 3.9Å; K187-L195 HydrophobicContact CD-CD1 3.94Å; K187-L195 HydrophobicContact CD-CG 4.11Å; V193-L195 HydrophobicContact CB-CD2 4.39Å; V193-L195 HydrophobicContact CG1-CD2 4.46Å; L195-F197 PolarHBondContact O-N 3.15Å; L195-F197 VanDerWaalsContact O-N 3.17Å; L195-D209 WeakPolarHBondContact CB-OD2 3.3Å; L195-D209 PolarHBondContact N-OD2 2.93Å; L195-A251 HydrophobicContact CD2-CB 3.85Å; L195-I253 HydrophobicContact CB-CD1 3.62Å; L195-I253 HydrophobicContact CD1-CD1 4.07Å; L195-I253 HydrophobicContact CD2-CD1 4.07Å; L195-I253 HydrophobicContact CG-CD1 4.11Å
196	F	96.7	Very high	93.7	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	91	165.5	-73.2	0.2	0	0	0	108	I194 Y203 M205 L217 F231 F236 M239 A240 L243 V250 A251 I253	I194-F196 HydrophobicContact CG2-CD1 4.13Å; I194-F196 HydrophobicContact CG2-CE1 3.96Å; F196-Y203 HydrophobicContact CB-CD1 3.81Å; F196-Y203 HydrophobicContact CB-CG 4.07Å; F196-Y203 WeakPolarHBondContact O-CD1 3.23Å; F196-M205 HydrophobicContact CD1-CE 4.48Å; F196-M205 HydrophobicContact CD1-CG 3.88Å; F196-M205 HydrophobicContact CD1-SD 3.77Å; F196-M205 HydrophobicContact CE1-CE 3.99Å; F196-M205 HydrophobicContact CE1-CG 4.19Å; F196-M205 HydrophobicContact CE1-SD 3.43Å; F196-M205 WeakPolarHBondContact CE1-SD 3.44Å; F196-M205 HydrophobicContact CZ-SD 4.48Å; F196-L217 HydrophobicContact CZ-CD1 4.4Å; F196-F231 HydrophobicContact CD1-CE1 4.3Å; F196-F231 HydrophobicContact CD1-CZ 4.29Å; F196-F231 HydrophobicContact CD2-CE1 4.4Å; F196-F231 AromaticContact CD2-CZ 3.64Å; F196-F231 HydrophobicContact CD2-CZ 3.64Å; F196-F231 AromaticContact CE1-CE1 4Å; F196-F231 HydrophobicContact CE1-CE1 4Å; F196-F231 HydrophobicContact CE1-CZ 4.16Å; F196-F231 HydrophobicContact CE2-CE1 4.09Å; F196-F231 HydrophobicContact CE2-CE2 4.49Å; F196-F231 AromaticContact CE2-CZ 3.47Å; F196-F231 HydrophobicContact CE2-CZ 3.47Å; F196-F231 VanDerWaalsContact CE2-CZ 3.47Å; F196-F231 HydrophobicContact CG-CE1 4.49Å; F196-F231 HydrophobicContact CG-CZ 4.04Å; F196-F231 AromaticContact CZ-CE1 3.86Å; F196-F231 HydrophobicContact CZ-CE1 3.86Å; F196-F231 AromaticContact CZ-CZ 3.73Å; F196-F231 HydrophobicContact CZ-CZ 3.73Å; F196-F236 AromaticContact CD2-CD2 3.58Å; F196-F236 HydrophobicContact CD2-CD2 3.58Å; F196-F236 AromaticContact CD2-CE2 3.62Å; F196-F236 HydrophobicContact CD2-CE2 3.62Å; F196-F236 HydrophobicContact CE2-CD2 4.21Å; F196-F236 HydrophobicContact CE2-CE2 4.33Å; F196-M239 HydrophobicContact CE2-CB 4.13Å; F196-M239 HydrophobicContact CZ-CB 4.11Å; F196-A240 HydrophobicContact CE2-CB 4.04Å; F196-L243 HydrophobicContact CE1-CD1 3.62Å; F196-L243 HydrophobicContact CZ-CD1 3.55Å; F196-V250 HydrophobicContact CD1-CG1 4.04Å; F196-V250 HydrophobicContact CD2-CG1 3.53Å; F196-V250 HydrophobicContact CE1-CG1 4.02Å; F196-V250 HydrophobicContact CE2-CG1 3.54Å; F196-V250 HydrophobicContact CG-CG1 3.82Å; F196-V250 HydrophobicContact CZ-CG1 3.82Å; F196-A251 WeakPolarHBondContact CB-O 3.22Å; F196-A251 PolarHBondContact N-O 2.74Å; F196-I253 WeakPolarHBondContact O-CB 3.27Å; F196-I253 PolarHBondContact O-N 3.47Å; F196-I253 VanDerWaalsContact O-N 3.11Å
197	F	95.7	Very high	93.7	Very high	2 Å²	2	27.2 Å²	27.2	1%	0.009	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	111.4	-171.1	-167.2	-100.1	0	0	0	110.9	Q182 W183 L186 L195 V199 E204 Y206 I253 R278	Q182-F197 HydrophobicContact CB-CZ 4.35Å; W183-F197 HydrophobicContact CB-CD2 4.29Å; W183-F197 HydrophobicContact CB-CE2 3.96Å; W183-F197 HydrophobicContact CB-CZ 4.14Å; W183-F197 AromaticContact CD1-CD2 3.68Å; W183-F197 AromaticContact CD1-CG 3.84Å; W183-F197 HydrophobicContact CG-CD2 4.4Å; L186-F197 HydrophobicContact CD1-CD2 4.38Å; L186-F197 HydrophobicContact CD1-CE2 4.11Å; L195-F197 PolarHBondContact O-N 3.15Å; L195-F197 VanDerWaalsContact O-N 3.17Å; F197-V199 HydrophobicContact CD1-CG2 3.76Å; F197-V199 HydrophobicContact CE1-CG2 4.17Å; F197-V199 PolarHBondContact O-N 3.44Å; F197-E204 VanDerWaalsContact CB-O 3.31Å; F197-E204 WeakPolarHBondContact CB-O 3.09Å; F197-E204 PolarHBondContact N-O 2.89Å; F197-E204 PolarHBondContact O-N 3.07Å; F197-Y206 HydrophobicContact CB-CE2 4.35Å; F197-Y206 AromaticContact CD1-CE2 3.78Å; F197-Y206 HydrophobicContact CD1-CE2 3.78Å; F197-Y206 HydrophobicContact CE1-CE2 4.36Å; F197-Y206 HydrophobicContact CG-CE2 4.28Å; F197-I253 HydrophobicContact CD2-CD1 3.97Å; F197-I253 HydrophobicContact CD2-CG2 3.99Å; F197-I253 HydrophobicContact CE2-CG2 4.38Å; F197-R278 VanDerWaalsContact CE1-CD 3.47Å; F197-R278 HydrophobicContact CE2-CB 4.41Å; F197-R278 HydrophobicContact CZ-CG 4.5Å
198	K	93.5	Very high	93.6	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	121.3	-175.6	-168.7	167.5	-165	-177.3	0	113.2	G200 F202 Y203 E233 I253 E254 R278 I647	K198-G200 WeakPolarHBondContact CG-O 3.45Å; K198-F202 CarbonylContact C-O 3.32Å; K198-F202 WeakPolarHBondContact CA-O 3.26Å; K198-Y203 HydrophobicContact CB-CD1 4.02Å; K198-Y203 HydrophobicContact CB-CE1 3.91Å; K198-Y203 HydrophobicContact CD-CE1 4.23Å; K198-Y203 HydrophobicContact CG-CE1 4.31Å; K198-E233 VanDerWaalsContact CE-CD 3.47Å; K198-E233 WeakPolarHBondContact CE-OE2 3.33Å; K198-E233 IonicContact NZ-OE1 2.99Å; K198-E233 PolarHBondContact NZ-OE1 3.4Å; K198-E233 IonicContact NZ-OE2 3.62Å; K198-E233 PolarHBondContact NZ-OE2 2.88Å; K198-I253 WeakPolarHBondContact CB-O 3.44Å; K198-I253 PolarHBondContact N-O 2.81Å; K198-E254 WeakPolarHBondContact CD-OE2 3.26Å; K198-E254 WeakPolarHBondContact CE-OE2 3.32Å; K198-E254 IonicContact NZ-OE2 3.85Å; K198-E254 PolarHBondContact NZ-OE2 2.83Å; K198-R278 PolarHBondContact O-NE 3.24Å; K198-I647 PolarHBondContact NZ-O 3.35Å
199	V	89.9	Confident	93.7	Very high	38 Å²	38	27.1 Å²	27.1	23%	0.23	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	99.9	174.2	-174.1	0	0	0	0	108.1	F197 K201 F202 E204	F197-V199 HydrophobicContact CD1-CG2 3.76Å; F197-V199 HydrophobicContact CE1-CG2 4.17Å; F197-V199 PolarHBondContact O-N 3.44Å; V199-K201 PolarHBondContact O-N 3.01Å; V199-F202 PolarHBondContact N-O 3.02Å; V199-F202 PolarHBondContact O-N 2.75Å; V199-F202 VanDerWaalsContact O-N 3.16Å; V199-E204 HydrophobicContact CB-CG 4.25Å; V199-E204 HydrophobicContact CG2-CB 4.27Å; V199-E204 HydrophobicContact CG2-CG 4.2Å
200	G	86.7	Confident	93.8	Very high	25 Å²	25	20.1 Å²	20.1	26%	0.258	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	-123.4	-171.5	0	0	0	0	0	111.1	K198 F202 F649	K198-G200 WeakPolarHBondContact CG-O 3.45Å; G200-F202 VanDerWaalsContact C-N 3.33Å; G200-F649 WeakPolarHBondContact O-CD2 3.36Å; G200-F649 WeakPolarHBondContact O-CE2 3.35Å
201	K	88	Confident	93.8	Very high	114 Å²	114	18.2 Å²	18.2	50%	0.496	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	10.4	-178.9	-60.6	-170.3	175.3	-165.2	0	114.5	V199 E233 F649	V199-K201 PolarHBondContact O-N 3.01Å; K201-E233 WeakPolarHBondContact O-CB 2.89Å; K201-E233 PolarHBondContact O-N 3.25Å; K201-F649 HydrophobicContact CG-CB 4.01Å; K201-F649 HydrophobicContact CG-CD1 4.26Å; K201-F649 HydrophobicContact CG-CG 4.14Å
202	F	93.1	Very high	93.9	Very high	95 Å²	95	18.4 Å²	18.4	42%	0.417	9%	0.092	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	147.2	-175.5	-67.8	-97.7	0	0	0	110.3	K198 V199 G200 F231 P232	K198-F202 CarbonylContact C-O 3.32Å; K198-F202 WeakPolarHBondContact CA-O 3.26Å; V199-F202 PolarHBondContact N-O 3.02Å; V199-F202 PolarHBondContact O-N 2.75Å; V199-F202 VanDerWaalsContact O-N 3.16Å; G200-F202 VanDerWaalsContact C-N 3.33Å; F202-F231 WeakPolarHBondContact CA-O 3.29Å; F202-P232 HydrophobicContact CD1-CB 4.48Å; F202-P232 HydrophobicContact CD1-CG 4.29Å; F202-P232 HydrophobicContact CE1-CB 4.31Å; F202-P232 HydrophobicContact CE1-CG 3.86Å
203	Y	95.9	Very high	94	Very high	5 Å²	5	17.2 Å²	17.2	2%	0.02	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	122.3	160	-67.8	-74.4	0	0	0	108.2	F196 K198 G230 F231 E233 F236 R252 E254	F196-Y203 HydrophobicContact CB-CD1 3.81Å; F196-Y203 HydrophobicContact CB-CG 4.07Å; F196-Y203 WeakPolarHBondContact O-CD1 3.23Å; K198-Y203 HydrophobicContact CB-CD1 4.02Å; K198-Y203 HydrophobicContact CB-CE1 3.91Å; K198-Y203 HydrophobicContact CD-CE1 4.23Å; K198-Y203 HydrophobicContact CG-CE1 4.31Å; Y203-G230 CarbonylContact O-C 3.35Å; Y203-G230 WeakPolarHBondContact O-CA 3.46Å; Y203-F231 AromaticContact CD2-CE2 3.83Å; Y203-F231 HydrophobicContact CD2-CE2 3.83Å; Y203-F231 HydrophobicContact CD2-CZ 4.34Å; Y203-F231 HydrophobicContact CG-CE2 4.28Å; Y203-F231 HydrophobicContact CG-CZ 4.39Å; Y203-F231 PolarHBondContact N-O 3.37Å; Y203-F231 PolarHBondContact O-N 3.33Å; Y203-E233 HydrophobicContact CD2-CB 4.45Å; Y203-E233 HydrophobicContact CE2-CB 4.05Å; Y203-E233 HydrophobicContact CE2-CG 3.85Å; Y203-F236 HydrophobicContact CD2-CB 3.92Å; Y203-F236 HydrophobicContact CD2-CD2 4.05Å; Y203-F236 HydrophobicContact CD2-CG 4.44Å; Y203-F236 HydrophobicContact CE1-CD2 4.37Å; Y203-F236 HydrophobicContact CE2-CB 3.49Å; Y203-F236 VanDerWaalsContact CE2-CB 3.49Å; Y203-F236 AromaticContact CE2-CD2 3.65Å; Y203-F236 HydrophobicContact CE2-CD2 3.65Å; Y203-F236 AromaticContact CE2-CG 3.86Å; Y203-F236 HydrophobicContact CE2-CG 3.86Å; Y203-F236 AromaticContact CZ-CD2 3.81Å; Y203-R252 HydrophobicContact CE1-CG 4.16Å; Y203-E254 PolarHBondContact OH-OE1 2.94Å
204	E	95.8	Very high	93.9	Very high	32 Å²	32	18.7 Å²	18.7	15%	0.15	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	149.6	177	-64.8	-176	-171.5	0	0	109.8	F197 V199 Y206 M222 H228 C229	F197-E204 VanDerWaalsContact CB-O 3.31Å; F197-E204 WeakPolarHBondContact CB-O 3.09Å; F197-E204 PolarHBondContact N-O 2.89Å; F197-E204 PolarHBondContact O-N 3.07Å; V199-E204 HydrophobicContact CB-CG 4.25Å; V199-E204 HydrophobicContact CG2-CB 4.27Å; V199-E204 HydrophobicContact CG2-CG 4.2Å; E204-Y206 HydrophobicContact CB-CE1 4.27Å; E204-Y206 HydrophobicContact CB-CE2 4.29Å; E204-Y206 PolarHBondContact OE2-OH 3.01Å; E204-M222 HydrophobicContact CG-CE 4.48Å; E204-H228 IonicContact OE2-CE1 3.7Å; E204-H228 IonicContact OE2-NE2 2.79Å; E204-H228 PolarHBondContact OE2-NE2 2.91Å; E204-C229 WeakPolarHBondContact CA-O 3.11Å
205	M	97	Very high	93.7	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	135.2	178.6	-63.4	165.2	64.4	0	0	107	I194 F196 D209 A210 H228 C229 F231	I194-M205 HydrophobicContact CG2-CE 3.43Å; I194-M205 VanDerWaalsContact CG2-CE 3.43Å; F196-M205 HydrophobicContact CD1-CE 4.48Å; F196-M205 HydrophobicContact CD1-CG 3.88Å; F196-M205 HydrophobicContact CD1-SD 3.77Å; F196-M205 HydrophobicContact CE1-CE 3.99Å; F196-M205 HydrophobicContact CE1-CG 4.19Å; F196-M205 HydrophobicContact CE1-SD 3.43Å; F196-M205 WeakPolarHBondContact CE1-SD 3.44Å; F196-M205 HydrophobicContact CZ-SD 4.48Å; M205-D209 HydrophobicContact CB-CB 4.25Å; M205-D209 HydrophobicContact CE-CB 4.37Å; M205-D209 WeakPolarHBondContact CE-O 3.48Å; M205-A210 HydrophobicContact CB-CB 4.46Å; M205-A210 WeakPolarHBondContact O-CB 3.09Å; M205-H228 WeakPolarHBondContact O-CA 3.23Å; M205-H228 PolarHBondContact O-CD2 3.2Å; M205-C229 PolarHBondContact N-O 3.06Å; M205-C229 PolarHBondContact O-N 3.03Å; M205-F231 HydrophobicContact SD-CE1 4.21Å
206	Y	95.7	Very high	93.5	Very high	23 Å²	23	25.9 Å²	25.9	9%	0.09	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	157.9	-175.5	-54.6	-68.7	0	0	0	111.9	M180 W183 F197 E204 M208 D209 A210 F226 A227 H228	M180-Y206 HydrophobicContact CE-CD1 3.96Å; M180-Y206 HydrophobicContact CE-CD2 4.1Å; M180-Y206 HydrophobicContact CE-CE1 4.26Å; M180-Y206 HydrophobicContact CE-CE2 4.39Å; M180-Y206 HydrophobicContact CE-CG 3.86Å; W183-Y206 AromaticContact CD1-CD2 3.53Å; W183-Y206 HydrophobicContact CD2-CD2 4.23Å; W183-Y206 AromaticContact CG-CD2 3.84Å; W183-Y206 HydrophobicContact CG-CD2 3.84Å; W183-Y206 WeakPolarHBondContact CZ2-O 3.35Å; W183-Y206 AromaticContact NE1-CD2 3.71Å; F197-Y206 HydrophobicContact CB-CE2 4.35Å; F197-Y206 AromaticContact CD1-CE2 3.78Å; F197-Y206 HydrophobicContact CD1-CE2 3.78Å; F197-Y206 HydrophobicContact CE1-CE2 4.36Å; F197-Y206 HydrophobicContact CG-CE2 4.28Å; E204-Y206 HydrophobicContact CB-CE1 4.27Å; E204-Y206 HydrophobicContact CB-CE2 4.29Å; E204-Y206 PolarHBondContact OE2-OH 3.01Å; Y206-M208 PolarHBondContact O-N 3.45Å; Y206-D209 WeakPolarHBondContact O-CB 3.39Å; Y206-D209 PolarHBondContact O-N 3.19Å; Y206-A210 PolarHBondContact O-N 3.44Å; Y206-F226 HydrophobicContact CD1-CD2 4.27Å; Y206-F226 AromaticContact CD1-CE2 3.63Å; Y206-F226 HydrophobicContact CD1-CE2 3.63Å; Y206-F226 HydrophobicContact CE1-CE2 4.14Å; Y206-F226 HydrophobicContact CG-CE2 4.47Å; Y206-A227 CarbonylContact C-O 3.55Å; Y206-A227 WeakPolarHBondContact CA-O 3.32Å; Y206-H228 HydrophobicContact CD1-CB 4.23Å; Y206-H228 AromaticContact CD1-CD2 3.43Å; Y206-H228 VanDerWaalsContact CD1-CD2 3.43Å; Y206-H228 WeakPolarHBondContact CD1-CD2 3.46Å; Y206-H228 AromaticContact CD1-CG 3.86Å; Y206-H228 AromaticContact CE1-CD2 3.28Å; Y206-H228 WeakPolarHBondContact CE1-CD2 3.38Å; Y206-H228 AromaticContact CE1-CE1 3.89Å; Y206-H228 AromaticContact CE1-CG 3.85Å; Y206-H228 AromaticContact CE1-NE2 3.36Å; Y206-H228 WeakPolarHBondContact CE1-NE2 3.23Å
207	H	94.1	Very high	93.3	Very high	5 Å²	5	26.8 Å²	26.8	2%	0.023	13%	0.131	C	C	.	.	H	α-helix	trans	52.4	-124.5	174.9	-59	-71.9	0	0	0	112.6	H137 W183 W184 D209 A210 M211 F226 A227	H137-H207 HydrophobicContact CB-CB 3.91Å; W183-H207 AromaticContact CE3-CD2 3.97Å; W183-H207 HydrophobicContact CH2-CB 3.92Å; W183-H207 AromaticContact CH2-CD2 3.74Å; W183-H207 HydrophobicContact CZ3-CB 4.42Å; W183-H207 AromaticContact CZ3-CD2 3.43Å; W183-H207 VanDerWaalsContact CZ3-CD2 3.43Å; W183-H207 WeakPolarHBondContact CZ3-CD2 3.48Å; W184-H207 AromaticContact CE2-CD2 3.98Å; W184-H207 AromaticContact CE2-NE2 3.8Å; W184-H207 AromaticContact CZ2-CD2 3.6Å; W184-H207 AromaticContact CZ2-CE1 3.97Å; W184-H207 AromaticContact CZ2-CG 4Å; W184-H207 AromaticContact CZ2-NE2 3.57Å; W184-H207 AromaticContact NE1-NE2 3.56Å; H207-D209 PolarHBondContact O-N 2.94Å; H207-A210 WeakPolarHBondContact O-CB 3.41Å; H207-A210 PolarHBondContact O-N 2.89Å; H207-M211 PolarHBondContact O-N 3.4Å; H207-F226 AromaticContact CE1-CG 3.83Å; H207-A227 PolarHBondContact N-O 3.09Å; H207-A227 WeakPolarHBondContact O-CB 3.41Å
208	M	92.6	Very high	93	Very high	5 Å²	5	29.8 Å²	29.8	3%	0.025	16%	0.163	C	C	.	.	H	α-helix	trans	-61.8	-31.1	-179.3	57.5	-78.9	-88.6	0	0	112.7	V121 L143 W183 W184 Y206 M211 I212	V121-M208 HydrophobicContact CG1-CE 3.94Å; V121-M208 HydrophobicContact CG2-CE 4.12Å; L143-M208 HydrophobicContact CD1-CE 3.84Å; L143-M208 HydrophobicContact CD2-CE 4.36Å; W183-M208 HydrophobicContact CH2-SD 3.71Å; W184-M208 HydrophobicContact CH2-CE 4.44Å; Y206-M208 PolarHBondContact O-N 3.45Å; M208-M211 PolarHBondContact O-N 3.4Å; M208-I212 WeakPolarHBondContact O-CG1 3.1Å; M208-I212 PolarHBondContact O-N 3.43Å
209	D	95.6	Very high	93	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.011	17%	0.171	C	C	.	.	H	α-helix	trans	-70.3	-41.5	179.5	-65.6	-8.5	0	0	0	109.8	K187 I194 L195 M205 Y206 H207 M211 I212 G213	K187-D209 IonicContact NZ-OD1 3.91Å; K187-D209 PolarHBondContact NZ-OD1 3.49Å; K187-D209 IonicContact NZ-OD2 3.77Å; K187-D209 PolarHBondContact NZ-OD2 3.39Å; I194-D209 HydrophobicContact CG2-CB 4.16Å; L195-D209 WeakPolarHBondContact CB-OD2 3.3Å; L195-D209 PolarHBondContact N-OD2 2.93Å; M205-D209 HydrophobicContact CB-CB 4.25Å; M205-D209 HydrophobicContact CE-CB 4.37Å; M205-D209 WeakPolarHBondContact CE-O 3.48Å; Y206-D209 WeakPolarHBondContact O-CB 3.39Å; Y206-D209 PolarHBondContact O-N 3.19Å; H207-D209 PolarHBondContact O-N 2.94Å; D209-M211 VanDerWaalsContact C-N 3.29Å; D209-M211 PolarHBondContact O-N 2.81Å; D209-I212 PolarHBondContact O-N 2.69Å; D209-G213 PolarHBondContact O-N 3.14Å
210	A	94.9	Very high	93.1	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-60.1	-37.8	178	0	0	0	0	0	112.8	M205 Y206 H207 I212 G213 V214 F221 A227 C229	M205-A210 HydrophobicContact CB-CB 4.46Å; M205-A210 WeakPolarHBondContact O-CB 3.09Å; Y206-A210 PolarHBondContact O-N 3.44Å; H207-A210 WeakPolarHBondContact O-CB 3.41Å; H207-A210 PolarHBondContact O-N 2.89Å; A210-I212 VanDerWaalsContact C-N 3.34Å; A210-G213 PolarHBondContact O-N 2.92Å; A210-V214 WeakPolarHBondContact O-CG2 3.31Å; A210-V214 PolarHBondContact O-N 3.04Å; A210-F221 HydrophobicContact CB-CE1 4.45Å; A210-A227 HydrophobicContact CB-CB 4.02Å; A210-A227 WeakPolarHBondContact CB-O 3.32Å; A210-C229 PolarHBondContact O-SG 3.48Å
211	M	93.4	Very high	93.4	Very high	3 Å²	3	37 Å²	37	2%	0.015	20%	0.195	C	C	.	.	H	α-helix	trans	-63.2	-42.3	177.3	-67.6	177	73.4	0	0	111.7	F128 H137 H207 M208 D209 K215 F221 A227	F128-M211 HydrophobicContact CB-CE 3.24Å; F128-M211 HydrophobicContact CD1-CE 3.52Å; F128-M211 HydrophobicContact CD2-CE 3.36Å; F128-M211 HydrophobicContact CE1-CE 4.07Å; F128-M211 HydrophobicContact CE2-CB 4.15Å; F128-M211 HydrophobicContact CE2-CE 3.94Å; F128-M211 HydrophobicContact CG-CE 3.1Å; F128-M211 HydrophobicContact CZ-CB 4.07Å; F128-M211 HydrophobicContact CZ-CE 4.25Å; H137-M211 PolarHBondContact CE1-SD 3.16Å; H137-M211 PolarHBondContact NE2-SD 2.71Å; H207-M211 PolarHBondContact O-N 3.4Å; M208-M211 PolarHBondContact O-N 3.4Å; D209-M211 VanDerWaalsContact C-N 3.29Å; D209-M211 PolarHBondContact O-N 2.81Å; M211-K215 WeakPolarHBondContact O-CB 3.35Å; M211-K215 PolarHBondContact O-N 3.46Å; M211-F221 HydrophobicContact CG-CZ 4.4Å; M211-A227 HydrophobicContact CG-CB 4.11Å
212	I	93.7	Very high	93.5	Very high	8 Å²	8	35 Å²	35	4%	0.041	19%	0.189	C	C	.	.	H	α-helix	trans	-65.1	-43.9	174	-58.5	166.5	0	0	0	109.9	V124 I194 M208 D209 A210 V214 K215 E216 L243 Y248	V124-I212 HydrophobicContact CG1-CG1 4.44Å; V124-I212 HydrophobicContact CG2-CD1 4.12Å; V124-I212 HydrophobicContact CG2-CG1 4.37Å; I194-I212 HydrophobicContact CD1-CB 4.25Å; I194-I212 HydrophobicContact CD1-CD1 4.04Å; I194-I212 HydrophobicContact CD1-CG2 3.65Å; I194-I212 HydrophobicContact CG1-CD1 4.16Å; M208-I212 WeakPolarHBondContact O-CG1 3.1Å; M208-I212 PolarHBondContact O-N 3.43Å; D209-I212 PolarHBondContact O-N 2.69Å; A210-I212 VanDerWaalsContact C-N 3.34Å; I212-V214 PolarHBondContact O-N 2.98Å; I212-K215 PolarHBondContact O-N 3.21Å; I212-E216 HydrophobicContact CG2-CB 4.33Å; I212-E216 HydrophobicContact CG2-CG 3.84Å; I212-E216 VanDerWaalsContact O-CB 3.27Å; I212-E216 WeakPolarHBondContact O-CB 3.32Å; I212-E216 WeakPolarHBondContact O-CG 3.47Å; I212-E216 PolarHBondContact O-N 3.49Å; I212-L243 HydrophobicContact CG2-CD2 4.08Å; I212-Y248 HydrophobicContact CD1-CE1 4.09Å; I212-Y248 HydrophobicContact CG2-CD1 4.36Å; I212-Y248 HydrophobicContact CG2-CD2 4.45Å; I212-Y248 HydrophobicContact CG2-CE1 3.93Å; I212-Y248 HydrophobicContact CG2-CE2 4.05Å
213	G	93.1	Very high	93.1	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-57.7	-45.3	177.5	0	0	0	0	0	113.1	D209 A210 L217	D209-G213 PolarHBondContact O-N 3.14Å; A210-G213 PolarHBondContact O-N 2.92Å; G213-L217 WeakPolarHBondContact O-CA 3.31Å; G213-L217 WeakPolarHBondContact O-CB 3.5Å; G213-L217 PolarHBondContact O-N 3.05Å
214	V	93.4	Very high	92.5	Very high	31 Å²	31	42.7 Å²	42.7	19%	0.188	24%	0.237	C	C	.	.	H	α-helix	trans	-65.4	-48.6	177.2	167.2	0	0	0	0	111.6	A210 I212 G218 L219 F221 C229	A210-V214 WeakPolarHBondContact O-CG2 3.31Å; A210-V214 PolarHBondContact O-N 3.04Å; I212-V214 PolarHBondContact O-N 2.98Å; V214-G218 WeakPolarHBondContact O-CA 3.43Å; V214-G218 PolarHBondContact O-N 2.91Å; V214-L219 WeakPolarHBondContact CG1-O 3.39Å; V214-L219 HydrophobicContact CG2-CB 4.35Å; V214-F221 HydrophobicContact CB-CE1 4.07Å; V214-F221 HydrophobicContact CB-CE2 4.03Å; V214-F221 HydrophobicContact CB-CZ 3.77Å; V214-F221 HydrophobicContact CG1-CD2 4.1Å; V214-F221 HydrophobicContact CG1-CE2 3.66Å; V214-F221 HydrophobicContact CG1-CZ 3.93Å; V214-F221 HydrophobicContact CG2-CD1 3.62Å; V214-F221 HydrophobicContact CG2-CD2 4.05Å; V214-F221 HydrophobicContact CG2-CE1 3.52Å; V214-F221 HydrophobicContact CG2-CE2 3.98Å; V214-F221 HydrophobicContact CG2-CG 3.87Å; V214-F221 HydrophobicContact CG2-CZ 3.71Å; V214-C229 HydrophobicContact CG2-CB 3.97Å
215	K	92.4	Very high	91.9	Very high	117 Å²	117	45.5 Å²	45.5	51%	0.509	26%	0.26	S	S	.	.	H	α-helix	trans	-65.5	-46.9	-177.9	180	-178.9	173.1	-177.1	0	112.6	F128 M211 I212	F128-K215 HydrophobicContact CE1-CD 4.33Å; F128-K215 HydrophobicContact CE2-CD 4.17Å; F128-K215 HydrophobicContact CZ-CB 3.94Å; F128-K215 HydrophobicContact CZ-CD 3.58Å; F128-K215 HydrophobicContact CZ-CG 4.32Å; M211-K215 WeakPolarHBondContact O-CB 3.35Å; M211-K215 PolarHBondContact O-N 3.46Å; I212-K215 PolarHBondContact O-N 3.21Å
216	E	92.3	Very high	91.5	Very high	39 Å²	39	48 Å²	48	18%	0.182	27%	0.271	C	S	.	.	H	α-helix	trans	-96.6	-25.8	-167.4	-58.1	-58.7	157	0	0	113.8	I212 L243 K246 Y248	I212-E216 HydrophobicContact CG2-CB 4.33Å; I212-E216 HydrophobicContact CG2-CG 3.84Å; I212-E216 VanDerWaalsContact O-CB 3.27Å; I212-E216 WeakPolarHBondContact O-CB 3.32Å; I212-E216 WeakPolarHBondContact O-CG 3.47Å; I212-E216 PolarHBondContact O-N 3.49Å; E216-L243 HydrophobicContact CB-CD2 3.88Å; E216-K246 HydrophobicContact CB-CD 4.05Å; E216-K246 HydrophobicContact CG-CD 4.36Å; E216-K246 PolarHBondContact O-NZ 2.79Å; E216-K246 VanDerWaalsContact OE2-CD 3.29Å; E216-K246 WeakPolarHBondContact OE2-CD 3.4Å; E216-K246 WeakPolarHBondContact OE2-CE 3.18Å; E216-K246 IonicContact OE2-NZ 2.71Å; E216-K246 PolarHBondContact OE2-NZ 3.28Å; E216-Y248 HydrophobicContact CG-CE2 3.96Å
217	L	92	Very high	91.3	Very high	19 Å²	19	46.9 Å²	46.9	10%	0.099	27%	0.266	C	S	.	.	H	α-helix	trans	-105.6	-1.7	178	-58.2	174.1	0	0	0	113.4	F196 G213 L219 M239 Q242 L243	F196-L217 HydrophobicContact CZ-CD1 4.4Å; G213-L217 WeakPolarHBondContact O-CA 3.31Å; G213-L217 WeakPolarHBondContact O-CB 3.5Å; G213-L217 PolarHBondContact O-N 3.05Å; L217-L219 HydrophobicContact CB-CD1 4.19Å; L217-L219 HydrophobicContact CB-CG 3.94Å; L217-L219 HydrophobicContact CD1-CD1 4.11Å; L217-L219 PolarHBondContact O-N 2.84Å; L217-M239 HydrophobicContact CB-SD 4.28Å; L217-M239 HydrophobicContact CD1-CB 4.05Å; L217-M239 HydrophobicContact CD1-SD 4.13Å; L217-M239 HydrophobicContact CD2-CB 4.44Å; L217-M239 HydrophobicContact CD2-SD 4.22Å; L217-M239 HydrophobicContact CG-SD 4.47Å; L217-Q242 HydrophobicContact CD2-CB 3.64Å; L217-Q242 VanDerWaalsContact CD2-OE1 3.3Å; L217-L243 HydrophobicContact CD1-CD1 4Å; L217-L243 HydrophobicContact CD1-CD2 4.4Å; L217-L243 HydrophobicContact CD1-CG 4.1Å; L217-L243 HydrophobicContact CD2-CD2 4.17Å; L217-L243 HydrophobicContact CD2-CG 3.94Å; L217-L243 HydrophobicContact CG-CD1 4.49Å; L217-L243 HydrophobicContact CG-CD2 4.02Å; L217-L243 HydrophobicContact CG-CG 4.08Å
218	G	89.8	Confident	91.3	Very high	65 Å²	65	47.8 Å²	47.8	67%	0.67	27%	0.271	S	S	*	.			trans	65.1	26.7	-177.9	0	0	0	0	0	113.4	V214	V214-G218 WeakPolarHBondContact O-CA 3.43Å; V214-G218 PolarHBondContact O-N 2.91Å
219	L	93	Very high	91.4	Very high	34 Å²	34	47.6 Å²	47.6	18%	0.178	27%	0.269	C	S	.	.			trans	-74.4	166.6	174.9	-62.5	174.8	0	0	0	110.6	V214 L217 C229 F231	V214-L219 WeakPolarHBondContact CG1-O 3.39Å; V214-L219 HydrophobicContact CG2-CB 4.35Å; L217-L219 HydrophobicContact CB-CD1 4.19Å; L217-L219 HydrophobicContact CB-CG 3.94Å; L217-L219 HydrophobicContact CD1-CD1 4.11Å; L217-L219 PolarHBondContact O-N 2.84Å; L219-C229 HydrophobicContact CB-CB 4.23Å; L219-C229 HydrophobicContact CD1-CB 4.45Å; L219-F231 HydrophobicContact CD1-CD1 3.94Å; L219-F231 HydrophobicContact CD2-CB 4.36Å
220	V	92.4	Very high	91.4	Very high	121 Å²	121	48.6 Å²	48.6	73%	0.733	28%	0.28	S	S	*	.			trans	-113	138.3	176.9	-177.2	0	0	0	0	109	M222	V220-M222 PolarHBondContact O-N 3.33Å
221	F	93.1	Very high	91.4	Very high	58 Å²	58	49 Å²	49	25%	0.254	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-59.8	133.5	173.2	-69	-65.8	0	0	0	111.3	W135 A210 M211 V214 A227 H228	W135-F221 HydrophobicContact CH2-CB 4.48Å; W135-F221 HydrophobicContact CH2-CD1 4.38Å; W135-F221 HydrophobicContact CH2-CG 4.24Å; W135-F221 HydrophobicContact CZ2-CD1 4.06Å; W135-F221 AromaticContact CZ2-CD2 3.95Å; W135-F221 HydrophobicContact CZ2-CD2 3.95Å; W135-F221 HydrophobicContact CZ2-CE1 4.14Å; W135-F221 HydrophobicContact CZ2-CE2 4.02Å; W135-F221 AromaticContact CZ2-CG 3.97Å; W135-F221 HydrophobicContact CZ2-CG 3.97Å; W135-F221 HydrophobicContact CZ2-CZ 4.12Å; A210-F221 HydrophobicContact CB-CE1 4.45Å; M211-F221 HydrophobicContact CG-CZ 4.4Å; V214-F221 HydrophobicContact CB-CE1 4.07Å; V214-F221 HydrophobicContact CB-CE2 4.03Å; V214-F221 HydrophobicContact CB-CZ 3.77Å; V214-F221 HydrophobicContact CG1-CD2 4.1Å; V214-F221 HydrophobicContact CG1-CE2 3.66Å; V214-F221 HydrophobicContact CG1-CZ 3.93Å; V214-F221 HydrophobicContact CG2-CD1 3.62Å; V214-F221 HydrophobicContact CG2-CD2 4.05Å; V214-F221 HydrophobicContact CG2-CE1 3.52Å; V214-F221 HydrophobicContact CG2-CE2 3.98Å; V214-F221 HydrophobicContact CG2-CG 3.87Å; V214-F221 HydrophobicContact CG2-CZ 3.71Å; F221-A227 HydrophobicContact CD1-CB 4.44Å; F221-A227 HydrophobicContact CE1-CB 4Å; F221-H228 CarbonylContact C-O 3.59Å; F221-H228 WeakPolarHBondContact CA-O 3.37Å
222	M	90.2	Very high	91.3	Very high	73 Å²	73	51.6 Å²	51.6	36%	0.36	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-78.2	162.6	167	-68.7	-167.4	-100.5	0	0	110.3	E204 V220 H228	E204-M222 HydrophobicContact CG-CE 4.48Å; V220-M222 PolarHBondContact O-N 3.33Å; M222-H228 HydrophobicContact CB-CB 4.47Å; M222-H228 WeakPolarHBondContact CE-CE1 3.48Å; M222-H228 WeakPolarHBondContact CE-NE2 3.49Å; M222-H228 PolarHBondContact N-O 3.15Å
223	K	85.1	Confident	91	Very high	210 Å²	210	52.2 Å²	52.2	91%	0.913	30%	0.302	S	S	*	.	S	Bend	trans	-71.5	134.8	177.4	-65.1	-176.2	175.8	-172	0	109.7
224	G	84	Confident	90.6	Very high	51 Å²	51	56.3 Å²	56.3	53%	0.526	33%	0.327	S	S	.	.	S	Bend	trans	171.5	172.4	177.2	0	0	0	0	0	112.3
225	S	82.5	Confident	90.3	Very high	91 Å²	91	55.8 Å²	55.8	64%	0.636	33%	0.326	S	S	*	.	S	Bend	trans	-77.6	-25.3	174.6	55	0	0	0	0	112.6	T136	T136-S225 PolarHBondContact OG1-O 2.83Å
226	F	87.7	Confident	90.1	Very high	53 Å²	53	50.8 Å²	50.8	23%	0.232	30%	0.304	C	S	.	.	S	Bend	trans	-115.4	157.8	175.9	51.7	-94	0	0	0	111.4	M180 Y206 H207 H228	M180-F226 HydrophobicContact CE-CD2 4.35Å; M180-F226 HydrophobicContact CE-CE1 4.27Å; M180-F226 HydrophobicContact CE-CE2 3.65Å; M180-F226 HydrophobicContact CE-CZ 3.6Å; Y206-F226 HydrophobicContact CD1-CD2 4.27Å; Y206-F226 AromaticContact CD1-CE2 3.63Å; Y206-F226 HydrophobicContact CD1-CE2 3.63Å; Y206-F226 HydrophobicContact CE1-CE2 4.14Å; Y206-F226 HydrophobicContact CG-CE2 4.47Å; H207-F226 AromaticContact CE1-CG 3.83Å; F226-H228 HydrophobicContact CD2-CB 4.24Å; F226-H228 HydrophobicContact CE2-CB 4.16Å; F226-H228 PolarHBondContact O-N 2.79Å
227	A	91.9	Very high	89.7	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	31%	0.306	C	S	.	.			trans	-59.5	126.5	175.3	0	0	0	0	0	110.3	W135 Y206 H207 A210 M211 F221	W135-A227 HydrophobicContact CB-CB 4.43Å; W135-A227 HydrophobicContact CD2-CB 3.73Å; W135-A227 HydrophobicContact CE3-CB 4.08Å; W135-A227 VanDerWaalsContact CE3-N 3.32Å; W135-A227 HydrophobicContact CG-CB 3.9Å; Y206-A227 CarbonylContact C-O 3.55Å; Y206-A227 WeakPolarHBondContact CA-O 3.32Å; H207-A227 PolarHBondContact N-O 3.09Å; H207-A227 WeakPolarHBondContact O-CB 3.41Å; A210-A227 HydrophobicContact CB-CB 4.02Å; A210-A227 WeakPolarHBondContact CB-O 3.32Å; M211-A227 HydrophobicContact CG-CB 4.11Å; F221-A227 HydrophobicContact CD1-CB 4.44Å; F221-A227 HydrophobicContact CE1-CB 4Å
228	H	93.8	Very high	89.4	Confident	24 Å²	24	57 Å²	57	11%	0.111	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	130.1	-174.2	176.4	-156.4	0	0	0	109.8	E204 M205 Y206 F221 M222 F226	E204-H228 IonicContact OE2-CE1 3.7Å; E204-H228 IonicContact OE2-NE2 2.79Å; E204-H228 PolarHBondContact OE2-NE2 2.91Å; M205-H228 WeakPolarHBondContact O-CA 3.23Å; M205-H228 PolarHBondContact O-CD2 3.2Å; Y206-H228 HydrophobicContact CD1-CB 4.23Å; Y206-H228 AromaticContact CD1-CD2 3.43Å; Y206-H228 VanDerWaalsContact CD1-CD2 3.43Å; Y206-H228 WeakPolarHBondContact CD1-CD2 3.46Å; Y206-H228 AromaticContact CD1-CG 3.86Å; Y206-H228 AromaticContact CE1-CD2 3.28Å; Y206-H228 WeakPolarHBondContact CE1-CD2 3.38Å; Y206-H228 AromaticContact CE1-CE1 3.89Å; Y206-H228 AromaticContact CE1-CG 3.85Å; Y206-H228 AromaticContact CE1-NE2 3.36Å; Y206-H228 WeakPolarHBondContact CE1-NE2 3.23Å; F221-H228 CarbonylContact C-O 3.59Å; F221-H228 WeakPolarHBondContact CA-O 3.37Å; M222-H228 HydrophobicContact CB-CB 4.47Å; M222-H228 WeakPolarHBondContact CE-CE1 3.48Å; M222-H228 WeakPolarHBondContact CE-NE2 3.49Å; M222-H228 PolarHBondContact N-O 3.15Å; F226-H228 HydrophobicContact CD2-CB 4.24Å; F226-H228 HydrophobicContact CE2-CB 4.16Å; F226-H228 PolarHBondContact O-N 2.79Å
229	C	95.5	Very high	89.4	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	168.2	169.5	68.1	0	0	0	0	110.3	E204 M205 A210 V214 L219	E204-C229 WeakPolarHBondContact CA-O 3.11Å; M205-C229 PolarHBondContact N-O 3.06Å; M205-C229 PolarHBondContact O-N 3.03Å; A210-C229 PolarHBondContact O-SG 3.48Å; V214-C229 HydrophobicContact CG2-CB 3.97Å; L219-C229 HydrophobicContact CB-CB 4.23Å; L219-C229 HydrophobicContact CD1-CB 4.45Å
230	G	94.7	Very high	89.3	Confident	23 Å²	23	52.6 Å²	52.6	24%	0.237	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171	167.2	-178.8	0	0	0	0	0	112.9	Y203	Y203-G230 CarbonylContact O-C 3.35Å; Y203-G230 WeakPolarHBondContact O-CA 3.46Å
231	F	95.1	Very high	89	Confident	8 Å²	8	48.7 Å²	48.7	4%	0.035	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	159.9	-178.3	59.4	-94.9	0	0	0	111.4	F196 F202 Y203 M205 L219 A235 F236 M239	F196-F231 HydrophobicContact CD1-CE1 4.3Å; F196-F231 HydrophobicContact CD1-CZ 4.29Å; F196-F231 HydrophobicContact CD2-CE1 4.4Å; F196-F231 AromaticContact CD2-CZ 3.64Å; F196-F231 HydrophobicContact CD2-CZ 3.64Å; F196-F231 AromaticContact CE1-CE1 4Å; F196-F231 HydrophobicContact CE1-CE1 4Å; F196-F231 HydrophobicContact CE1-CZ 4.16Å; F196-F231 HydrophobicContact CE2-CE1 4.09Å; F196-F231 HydrophobicContact CE2-CE2 4.49Å; F196-F231 AromaticContact CE2-CZ 3.47Å; F196-F231 HydrophobicContact CE2-CZ 3.47Å; F196-F231 VanDerWaalsContact CE2-CZ 3.47Å; F196-F231 HydrophobicContact CG-CE1 4.49Å; F196-F231 HydrophobicContact CG-CZ 4.04Å; F196-F231 AromaticContact CZ-CE1 3.86Å; F196-F231 HydrophobicContact CZ-CE1 3.86Å; F196-F231 AromaticContact CZ-CZ 3.73Å; F196-F231 HydrophobicContact CZ-CZ 3.73Å; F202-F231 WeakPolarHBondContact CA-O 3.29Å; Y203-F231 AromaticContact CD2-CE2 3.83Å; Y203-F231 HydrophobicContact CD2-CE2 3.83Å; Y203-F231 HydrophobicContact CD2-CZ 4.34Å; Y203-F231 HydrophobicContact CG-CE2 4.28Å; Y203-F231 HydrophobicContact CG-CZ 4.39Å; Y203-F231 PolarHBondContact N-O 3.37Å; Y203-F231 PolarHBondContact O-N 3.33Å; M205-F231 HydrophobicContact SD-CE1 4.21Å; L219-F231 HydrophobicContact CD1-CD1 3.94Å; L219-F231 HydrophobicContact CD2-CB 4.36Å; F231-A235 HydrophobicContact CD2-CB 3.98Å; F231-F236 HydrophobicContact CE2-CB 4.39Å; F231-M239 HydrophobicContact CD1-CB 4.47Å; F231-M239 HydrophobicContact CD1-CG 3.99Å; F231-M239 HydrophobicContact CD2-CB 4.46Å; F231-M239 HydrophobicContact CD2-CG 3.77Å; F231-M239 HydrophobicContact CE1-CB 3.97Å; F231-M239 HydrophobicContact CE1-CG 3.99Å; F231-M239 HydrophobicContact CE2-CB 3.99Å; F231-M239 HydrophobicContact CE2-CG 3.79Å; F231-M239 HydrophobicContact CG-CG 3.89Å; F231-M239 HydrophobicContact CZ-CB 3.72Å; F231-M239 HydrophobicContact CZ-CG 3.9Å
232	P	92.1	Very high	88.7	Confident	59 Å²	59	49.3 Å²	49.3	38%	0.383	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	146.3	-179.5	-21.1	33	0	0	0	113.5	F202 V234 A235	F202-P232 HydrophobicContact CD1-CB 4.48Å; F202-P232 HydrophobicContact CD1-CG 4.29Å; F202-P232 HydrophobicContact CE1-CB 4.31Å; F202-P232 HydrophobicContact CE1-CG 3.86Å; P232-V234 HydrophobicContact CB-CG2 4.12Å; P232-V234 PolarHBondContact O-N 2.9Å; P232-V234 VanDerWaalsContact O-N 3.11Å; P232-A235 WeakPolarHBondContact O-CB 3.15Å; P232-A235 PolarHBondContact O-N 3.24Å
233	E	87.1	Confident	88.7	Confident	21 Å²	21	45.8 Å²	45.8	10%	0.098	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-49.2	-40.6	179.8	177.1	175	-178.5	0	0	113.5	K198 K201 Y203 A235 F236	K198-E233 VanDerWaalsContact CE-CD 3.47Å; K198-E233 WeakPolarHBondContact CE-OE2 3.33Å; K198-E233 IonicContact NZ-OE1 2.99Å; K198-E233 PolarHBondContact NZ-OE1 3.4Å; K198-E233 IonicContact NZ-OE2 3.62Å; K198-E233 PolarHBondContact NZ-OE2 2.88Å; K201-E233 WeakPolarHBondContact O-CB 2.89Å; K201-E233 PolarHBondContact O-N 3.25Å; Y203-E233 HydrophobicContact CD2-CB 4.45Å; Y203-E233 HydrophobicContact CE2-CB 4.05Å; Y203-E233 HydrophobicContact CE2-CG 3.85Å; E233-A235 PolarHBondContact O-N 2.99Å; E233-A235 VanDerWaalsContact O-N 3.13Å; E233-F236 WeakPolarHBondContact O-CB 3.49Å; E233-F236 PolarHBondContact O-N 3Å
234	V	83.5	Confident	88.9	Confident	86 Å²	86	36 Å²	36	52%	0.521	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-57.7	-26.9	177.9	-119.4	0	0	0	0	114	P232 F236 E650	P232-V234 HydrophobicContact CB-CG2 4.12Å; P232-V234 PolarHBondContact O-N 2.9Å; P232-V234 VanDerWaalsContact O-N 3.11Å; V234-F236 VanDerWaalsContact C-N 3.33Å; V234-E650 WeakPolarHBondContact CG1-OE2 3.39Å
235	A	87.5	Confident	88.9	Confident	19 Å²	19	40.9 Å²	40.9	16%	0.157	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-85.6	-4.3	179.4	0	0	0	0	0	113.2	F231 P232 E233 R238 M239	F231-A235 HydrophobicContact CD2-CB 3.98Å; P232-A235 WeakPolarHBondContact O-CB 3.15Å; P232-A235 PolarHBondContact O-N 3.24Å; E233-A235 PolarHBondContact O-N 2.99Å; E233-A235 VanDerWaalsContact O-N 3.13Å; A235-R238 PolarHBondContact O-N 2.92Å; A235-M239 HydrophobicContact CB-CG 4.22Å; A235-M239 VanDerWaalsContact O-CG 3.32Å; A235-M239 WeakPolarHBondContact O-CG 3.49Å; A235-M239 PolarHBondContact O-N 2.98Å
236	F	89.4	Confident	89.1	Confident	13 Å²	13	41.3 Å²	41.3	6%	0.057	20%	0.203	C	C	.	.	H	α-helix	trans	-49.4	-53	-177.4	168.7	-87.3	0	0	0	114.2	F196 Y203 F231 E233 V234 R238 M239 A240 R252 I284	F196-F236 AromaticContact CD2-CD2 3.58Å; F196-F236 HydrophobicContact CD2-CD2 3.58Å; F196-F236 AromaticContact CD2-CE2 3.62Å; F196-F236 HydrophobicContact CD2-CE2 3.62Å; F196-F236 HydrophobicContact CE2-CD2 4.21Å; F196-F236 HydrophobicContact CE2-CE2 4.33Å; Y203-F236 HydrophobicContact CD2-CB 3.92Å; Y203-F236 HydrophobicContact CD2-CD2 4.05Å; Y203-F236 HydrophobicContact CD2-CG 4.44Å; Y203-F236 HydrophobicContact CE1-CD2 4.37Å; Y203-F236 HydrophobicContact CE2-CB 3.49Å; Y203-F236 VanDerWaalsContact CE2-CB 3.49Å; Y203-F236 AromaticContact CE2-CD2 3.65Å; Y203-F236 HydrophobicContact CE2-CD2 3.65Å; Y203-F236 AromaticContact CE2-CG 3.86Å; Y203-F236 HydrophobicContact CE2-CG 3.86Å; Y203-F236 AromaticContact CZ-CD2 3.81Å; F231-F236 HydrophobicContact CE2-CB 4.39Å; E233-F236 WeakPolarHBondContact O-CB 3.49Å; E233-F236 PolarHBondContact O-N 3Å; V234-F236 VanDerWaalsContact C-N 3.33Å; F236-R238 VanDerWaalsContact C-N 3.27Å; F236-R238 PolarHBondContact O-N 3.21Å; F236-M239 PolarHBondContact O-N 2.62Å; F236-A240 HydrophobicContact CE1-CB 4.44Å; F236-A240 HydrophobicContact CE2-CB 4.46Å; F236-A240 HydrophobicContact CZ-CB 4.24Å; F236-A240 VanDerWaalsContact O-CB 3.29Å; F236-A240 WeakPolarHBondContact O-CB 3.28Å; F236-A240 PolarHBondContact O-N 3.07Å; F236-R252 HydrophobicContact CD2-CG 4.35Å; F236-R252 HydrophobicContact CE2-CB 3.68Å; F236-R252 HydrophobicContact CE2-CG 3.66Å; F236-R252 HydrophobicContact CZ-CB 3.7Å; F236-R252 HydrophobicContact CZ-CG 3.84Å; F236-I284 HydrophobicContact CE1-CD1 4.05Å; F236-I284 HydrophobicContact CZ-CD1 3.69Å
237	P	83.9	Confident	89	Confident	34 Å²	34	40.3 Å²	40.3	22%	0.221	21%	0.207	C	C	.	.	H	α-helix	trans	-58.4	-40.7	-176.7	-27.6	37.7	0	0	0	112.6	D241	P237-D241 VanDerWaalsContact O-CB 3.26Å; P237-D241 WeakPolarHBondContact O-CB 3.49Å; P237-D241 PolarHBondContact O-N 3.31Å; P237-D241 VanDerWaalsContact O-N 3.08Å
238	R	85.1	Confident	89.1	Confident	153 Å²	153	43.1 Å²	43.1	58%	0.577	22%	0.218	S	C	*	.	H	α-helix	trans	-69.2	-44	-179.9	-173.3	-179.8	68.3	138.9	7.4	111.8	A235 F236 Q242	A235-R238 PolarHBondContact O-N 2.92Å; F236-R238 VanDerWaalsContact C-N 3.27Å; F236-R238 PolarHBondContact O-N 3.21Å; R238-Q242 WeakPolarHBondContact O-CG 3.49Å; R238-Q242 PolarHBondContact O-N 3.39Å
239	M	89.5	Confident	89.1	Confident	5 Å²	5	42.8 Å²	42.8	3%	0.025	22%	0.217	C	C	.	.	H	α-helix	trans	-70.7	-40.4	-179.4	-60.3	-66.5	85.7	0	0	111.6	F196 L217 F231 A235 F236 Q242 L243	F196-M239 HydrophobicContact CE2-CB 4.13Å; F196-M239 HydrophobicContact CZ-CB 4.11Å; L217-M239 HydrophobicContact CB-SD 4.28Å; L217-M239 HydrophobicContact CD1-CB 4.05Å; L217-M239 HydrophobicContact CD1-SD 4.13Å; L217-M239 HydrophobicContact CD2-CB 4.44Å; L217-M239 HydrophobicContact CD2-SD 4.22Å; L217-M239 HydrophobicContact CG-SD 4.47Å; F231-M239 HydrophobicContact CD1-CB 4.47Å; F231-M239 HydrophobicContact CD1-CG 3.99Å; F231-M239 HydrophobicContact CD2-CB 4.46Å; F231-M239 HydrophobicContact CD2-CG 3.77Å; F231-M239 HydrophobicContact CE1-CB 3.97Å; F231-M239 HydrophobicContact CE1-CG 3.99Å; F231-M239 HydrophobicContact CE2-CB 3.99Å; F231-M239 HydrophobicContact CE2-CG 3.79Å; F231-M239 HydrophobicContact CG-CG 3.89Å; F231-M239 HydrophobicContact CZ-CB 3.72Å; F231-M239 HydrophobicContact CZ-CG 3.9Å; A235-M239 HydrophobicContact CB-CG 4.22Å; A235-M239 VanDerWaalsContact O-CG 3.32Å; A235-M239 WeakPolarHBondContact O-CG 3.49Å; A235-M239 PolarHBondContact O-N 2.98Å; F236-M239 PolarHBondContact O-N 2.62Å; M239-Q242 PolarHBondContact O-N 2.71Å; M239-L243 PolarHBondContact O-N 3.32Å
240	A	90.2	Very high	89.1	Confident	3 Å²	3	42.8 Å²	42.8	3%	0.025	22%	0.217	C	C	.	.	H	α-helix	trans	-63	-48.7	176.7	0	0	0	0	0	111.1	F196 F236 Q242 L243 V244 V250 I284	F196-A240 HydrophobicContact CE2-CB 4.04Å; F236-A240 HydrophobicContact CE1-CB 4.44Å; F236-A240 HydrophobicContact CE2-CB 4.46Å; F236-A240 HydrophobicContact CZ-CB 4.24Å; F236-A240 VanDerWaalsContact O-CB 3.29Å; F236-A240 WeakPolarHBondContact O-CB 3.28Å; F236-A240 PolarHBondContact O-N 3.07Å; A240-Q242 VanDerWaalsContact C-N 3.32Å; A240-Q242 PolarHBondContact O-N 2.94Å; A240-L243 PolarHBondContact O-N 3.29Å; A240-V244 WeakPolarHBondContact O-CB 3.46Å; A240-V244 WeakPolarHBondContact O-CG2 3.06Å; A240-V244 PolarHBondContact O-N 3.18Å; A240-V250 HydrophobicContact CB-CG1 4.34Å; A240-I284 HydrophobicContact CB-CD1 4.11Å
241	D	86.1	Confident	89.1	Confident	39 Å²	39	41.7 Å²	41.7	21%	0.209	21%	0.205	C	C	.	.	H	α-helix	trans	-59	-40.3	178.8	179.2	62.3	0	0	0	112.4	P237 L243 V244 R245	P237-D241 VanDerWaalsContact O-CB 3.26Å; P237-D241 WeakPolarHBondContact O-CB 3.49Å; P237-D241 PolarHBondContact O-N 3.31Å; P237-D241 VanDerWaalsContact O-N 3.08Å; D241-L243 PolarHBondContact O-N 3.24Å; D241-V244 PolarHBondContact O-N 3.43Å; D241-R245 VanDerWaalsContact CG-NE 3.32Å; D241-R245 WeakPolarHBondContact O-CB 3.36Å; D241-R245 VanDerWaalsContact O-CG 3.27Å; D241-R245 WeakPolarHBondContact O-CG 3.41Å; D241-R245 PolarHBondContact O-N 3.02Å; D241-R245 IonicContact OD1-CZ 3.92Å; D241-R245 IonicContact OD1-NE 2.73Å; D241-R245 PolarHBondContact OD1-NE 3.38Å; D241-R245 VanDerWaalsContact OD1-NE 3.12Å; D241-R245 IonicContact OD1-NH2 3.18Å; D241-R245 IonicContact OD2-CZ 2.69Å; D241-R245 IonicContact OD2-NE 2.65Å; D241-R245 PolarHBondContact OD2-NE 3.02Å; D241-R245 IonicContact OD2-NH2 3.91Å; D241-R245 PolarHBondContact OD2-NH2 3.37Å
242	Q	87.6	Confident	89	Confident	70 Å²	70	43.1 Å²	43.1	33%	0.327	21%	0.21	S	C	.	.	H	α-helix	trans	-62	-44.3	176.4	-76.4	-178.8	8.6	0	0	113.3	L217 R238 M239 A240 K246	L217-Q242 HydrophobicContact CD2-CB 3.64Å; L217-Q242 VanDerWaalsContact CD2-OE1 3.3Å; R238-Q242 WeakPolarHBondContact O-CG 3.49Å; R238-Q242 PolarHBondContact O-N 3.39Å; M239-Q242 PolarHBondContact O-N 2.71Å; A240-Q242 VanDerWaalsContact C-N 3.32Å; A240-Q242 PolarHBondContact O-N 2.94Å; Q242-K246 WeakPolarHBondContact O-CG 3.46Å; Q242-K246 PolarHBondContact O-N 3.29Å
243	L	90.9	Very high	89.2	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-68.6	-41.4	177	-72.6	178.1	0	0	0	111.6	I194 F196 I212 E216 L217 M239 A240 D241 K246 G247 Y248 V250	I194-L243 HydrophobicContact CD1-CD1 3.86Å; I194-L243 HydrophobicContact CD1-CD2 4.23Å; I194-L243 HydrophobicContact CG2-CD1 4.12Å; F196-L243 HydrophobicContact CE1-CD1 3.62Å; F196-L243 HydrophobicContact CZ-CD1 3.55Å; I212-L243 HydrophobicContact CG2-CD2 4.08Å; E216-L243 HydrophobicContact CB-CD2 3.88Å; L217-L243 HydrophobicContact CD1-CD1 4Å; L217-L243 HydrophobicContact CD1-CD2 4.4Å; L217-L243 HydrophobicContact CD1-CG 4.1Å; L217-L243 HydrophobicContact CD2-CD2 4.17Å; L217-L243 HydrophobicContact CD2-CG 3.94Å; L217-L243 HydrophobicContact CG-CD1 4.49Å; L217-L243 HydrophobicContact CG-CD2 4.02Å; L217-L243 HydrophobicContact CG-CG 4.08Å; M239-L243 PolarHBondContact O-N 3.32Å; A240-L243 PolarHBondContact O-N 3.29Å; D241-L243 PolarHBondContact O-N 3.24Å; L243-K246 CarbonylContact O-C 3.58Å; L243-K246 WeakPolarHBondContact O-CA 3.17Å; L243-K246 WeakPolarHBondContact O-CB 3.17Å; L243-K246 PolarHBondContact O-N 3.5Å; L243-K246 VanDerWaalsContact O-N 3.08Å; L243-G247 PolarHBondContact O-N 3.49Å; L243-Y248 HydrophobicContact CB-CD2 4.47Å; L243-Y248 HydrophobicContact CD2-CD2 4.09Å; L243-Y248 WeakPolarHBondContact O-CB 3.47Å; L243-Y248 WeakPolarHBondContact O-CD2 3.35Å; L243-Y248 PolarHBondContact O-N 3.28Å; L243-Y248 VanDerWaalsContact O-N 3.11Å; L243-V250 HydrophobicContact CB-CG2 3.69Å; L243-V250 HydrophobicContact CD1-CG2 3.88Å; L243-V250 HydrophobicContact CG-CG2 4.46Å
244	V	89.4	Confident	89.4	Confident	5 Å²	5	39.5 Å²	39.5	3%	0.03	19%	0.189	C	C	.	.	H	α-helix	trans	-67.2	-39.1	-178.1	175.2	0	0	0	0	111.6	A240 D241 K246 G247 V250 I284 T285 P286 C289	A240-V244 WeakPolarHBondContact O-CB 3.46Å; A240-V244 WeakPolarHBondContact O-CG2 3.06Å; A240-V244 PolarHBondContact O-N 3.18Å; D241-V244 PolarHBondContact O-N 3.43Å; V244-K246 PolarHBondContact O-N 2.85Å; V244-G247 PolarHBondContact O-N 2.78Å; V244-V250 HydrophobicContact CG2-CB 4.44Å; V244-V250 HydrophobicContact CG2-CG2 3.99Å; V244-I284 HydrophobicContact CG2-CB 4.22Å; V244-I284 HydrophobicContact CG2-CG2 3.81Å; V244-T285 VanDerWaalsContact CG1-C 3.48Å; V244-P286 HydrophobicContact CG1-CB 4.33Å; V244-P286 HydrophobicContact CG1-CG 4.1Å; V244-C289 WeakPolarHBondContact CG1-SG 3.41Å
245	R	83.6	Confident	89.8	Confident	153 Å²	153	36 Å²	36	58%	0.577	17%	0.167	S	C	*	.	H	α-helix	trans	-61.2	-25.9	172.3	-73.4	179.2	-166.7	-166.3	8.5	113.3	D241 G247	D241-R245 VanDerWaalsContact CG-NE 3.32Å; D241-R245 WeakPolarHBondContact O-CB 3.36Å; D241-R245 VanDerWaalsContact O-CG 3.27Å; D241-R245 WeakPolarHBondContact O-CG 3.41Å; D241-R245 PolarHBondContact O-N 3.02Å; D241-R245 IonicContact OD1-CZ 3.92Å; D241-R245 IonicContact OD1-NE 2.73Å; D241-R245 PolarHBondContact OD1-NE 3.38Å; D241-R245 VanDerWaalsContact OD1-NE 3.12Å; D241-R245 IonicContact OD1-NH2 3.18Å; D241-R245 IonicContact OD2-CZ 2.69Å; D241-R245 IonicContact OD2-NE 2.65Å; D241-R245 PolarHBondContact OD2-NE 3.02Å; D241-R245 IonicContact OD2-NH2 3.91Å; D241-R245 PolarHBondContact OD2-NH2 3.37Å; R245-G247 VanDerWaalsContact C-N 3.27Å
246	K	85.6	Confident	89.8	Confident	99 Å²	99	36.1 Å²	36.1	43%	0.43	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	2.2	174.3	-68	177.1	174.8	-171.8	0	113.4	E216 Q242 L243 V244 Y248	E216-K246 HydrophobicContact CB-CD 4.05Å; E216-K246 HydrophobicContact CG-CD 4.36Å; E216-K246 PolarHBondContact O-NZ 2.79Å; E216-K246 VanDerWaalsContact OE2-CD 3.29Å; E216-K246 WeakPolarHBondContact OE2-CD 3.4Å; E216-K246 WeakPolarHBondContact OE2-CE 3.18Å; E216-K246 IonicContact OE2-NZ 2.71Å; E216-K246 PolarHBondContact OE2-NZ 3.28Å; Q242-K246 WeakPolarHBondContact O-CG 3.46Å; Q242-K246 PolarHBondContact O-N 3.29Å; L243-K246 CarbonylContact O-C 3.58Å; L243-K246 WeakPolarHBondContact O-CA 3.17Å; L243-K246 WeakPolarHBondContact O-CB 3.17Å; L243-K246 PolarHBondContact O-N 3.5Å; L243-K246 VanDerWaalsContact O-N 3.08Å; V244-K246 PolarHBondContact O-N 2.85Å; K246-Y248 HydrophobicContact CB-CD2 3.83Å; K246-Y248 HydrophobicContact CB-CE2 3.92Å
247	G	87.3	Confident	89.6	Confident	32 Å²	32	36.5 Å²	36.5	33%	0.33	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	93.4	1.1	176.9	0	0	0	0	0	114.9	L243 V244 R245	L243-G247 PolarHBondContact O-N 3.49Å; V244-G247 PolarHBondContact O-N 2.78Å; R245-G247 VanDerWaalsContact C-N 3.27Å
248	Y	92.2	Very high	89.5	Confident	59 Å²	59	37.2 Å²	37.2	23%	0.231	17%	0.173	C	C	.	.			trans	-78.7	152.5	179.5	-64	-77.7	0	0	0	112.4	I194 I212 E216 L243 K246	I194-Y248 HydrophobicContact CD1-CD1 3.71Å; I194-Y248 HydrophobicContact CD1-CD2 4.46Å; I194-Y248 HydrophobicContact CD1-CE1 4.48Å; I194-Y248 HydrophobicContact CD1-CG 3.7Å; I212-Y248 HydrophobicContact CD1-CE1 4.09Å; I212-Y248 HydrophobicContact CG2-CD1 4.36Å; I212-Y248 HydrophobicContact CG2-CD2 4.45Å; I212-Y248 HydrophobicContact CG2-CE1 3.93Å; I212-Y248 HydrophobicContact CG2-CE2 4.05Å; E216-Y248 HydrophobicContact CG-CE2 3.96Å; L243-Y248 HydrophobicContact CB-CD2 4.47Å; L243-Y248 HydrophobicContact CD2-CD2 4.09Å; L243-Y248 WeakPolarHBondContact O-CB 3.47Å; L243-Y248 WeakPolarHBondContact O-CD2 3.35Å; L243-Y248 PolarHBondContact O-N 3.28Å; L243-Y248 VanDerWaalsContact O-N 3.11Å; K246-Y248 HydrophobicContact CB-CD2 3.83Å; K246-Y248 HydrophobicContact CB-CE2 3.92Å
249	K	94.4	Very high	89.1	Confident	18 Å²	18	34.1 Å²	34.1	8%	0.078	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	135.4	168.1	-55.5	176.2	-170.7	176	0	108.9	D192 V193 I194 T285 E407	D192-K249 IonicContact OD2-NZ 2.99Å; D192-K249 PolarHBondContact OD2-NZ 2.62Å; V193-K249 HydrophobicContact CB-CB 4.28Å; V193-K249 HydrophobicContact CG1-CB 3.99Å; V193-K249 HydrophobicContact CG2-CB 4.04Å; V193-K249 HydrophobicContact CG2-CD 4.21Å; I194-K249 WeakPolarHBondContact CB-O 3.4Å; I194-K249 PolarHBondContact N-O 3.26Å; K249-T285 HydrophobicContact CB-CG2 4.16Å; K249-T285 HydrophobicContact CD-CG2 4.29Å; K249-T285 HydrophobicContact CG-CG2 3.84Å; K249-E407 WeakPolarHBondContact CE-OE1 3.35Å; K249-E407 IonicContact NZ-OE1 2.92Å; K249-E407 PolarHBondContact NZ-OE1 3.43Å; K249-E407 IonicContact NZ-OE2 2.81Å; K249-E407 PolarHBondContact NZ-OE2 3.5Å
250	V	94.9	Very high	88.5	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	124.3	-178	-178.6	0	0	0	0	109.8	I194 F196 A240 L243 V244 I283 I284	I194-V250 WeakPolarHBondContact O-CA 3.4Å; F196-V250 HydrophobicContact CD1-CG1 4.04Å; F196-V250 HydrophobicContact CD2-CG1 3.53Å; F196-V250 HydrophobicContact CE1-CG1 4.02Å; F196-V250 HydrophobicContact CE2-CG1 3.54Å; F196-V250 HydrophobicContact CG-CG1 3.82Å; F196-V250 HydrophobicContact CZ-CG1 3.82Å; A240-V250 HydrophobicContact CB-CG1 4.34Å; L243-V250 HydrophobicContact CB-CG2 3.69Å; L243-V250 HydrophobicContact CD1-CG2 3.88Å; L243-V250 HydrophobicContact CG-CG2 4.46Å; V244-V250 HydrophobicContact CG2-CB 4.44Å; V244-V250 HydrophobicContact CG2-CG2 3.99Å; V250-I283 CarbonylContact O-C 3.59Å; V250-I283 WeakPolarHBondContact O-CA 3.03Å; V250-I284 PolarHBondContact N-O 2.84Å; V250-I284 PolarHBondContact O-N 3.41Å
251	A	95.5	Very high	88	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	126.7	173.5	0	0	0	0	0	110.4	V193 I194 L195 F196 V280 Q282 I283	V193-A251 HydrophobicContact CG1-CB 3.59Å; V193-A251 VanDerWaalsContact CG1-N 3.34Å; I194-A251 PolarHBondContact O-N 2.79Å; L195-A251 HydrophobicContact CD2-CB 3.85Å; F196-A251 WeakPolarHBondContact CB-O 3.22Å; F196-A251 PolarHBondContact N-O 2.74Å; A251-V280 HydrophobicContact CB-CG1 4.15Å; A251-Q282 WeakPolarHBondContact CA-O 3.34Å; A251-I283 HydrophobicContact CB-CG1 4.41Å
252	R	94.1	Very high	87.8	Confident	37 Å²	37	38.8 Å²	38.8	14%	0.14	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	112.5	166.8	-171.9	176.9	73.5	-156.7	2.3	108.8	Y203 F236 E254 C281 Q282 D643	Y203-R252 HydrophobicContact CE1-CG 4.16Å; F236-R252 HydrophobicContact CD2-CG 4.35Å; F236-R252 HydrophobicContact CE2-CB 3.68Å; F236-R252 HydrophobicContact CE2-CG 3.66Å; F236-R252 HydrophobicContact CZ-CB 3.7Å; F236-R252 HydrophobicContact CZ-CG 3.84Å; R252-E254 WeakPolarHBondContact CD-OE1 2.91Å; R252-E254 HydrophobicContact CG-CG 4.3Å; R252-E254 VanDerWaalsContact CG-OE1 3.28Å; R252-E254 WeakPolarHBondContact CG-OE1 3.49Å; R252-E254 IonicContact NE-OE1 2.83Å; R252-C281 PolarHBondContact O-N 2.84Å; R252-Q282 HydrophobicContact CB-CB 4.43Å; R252-Q282 PolarHBondContact N-O 3.01Å; R252-D643 IonicContact CZ-OD1 3.35Å; R252-D643 VanDerWaalsContact NH2-CG 3.25Å; R252-D643 IonicContact NH2-OD1 2.74Å; R252-D643 PolarHBondContact NH2-OD1 3.19Å; R252-D643 IonicContact NH2-OD2 2.77Å; R252-D643 PolarHBondContact NH2-OD2 3.03Å
253	I	94.6	Very high	87.5	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	119.6	177.3	-63.3	160.1	0	0	0	108.2	L186 L195 F196 F197 K198 R278 E279 V280	L186-I253 HydrophobicContact CD1-CD1 3.76Å; L186-I253 HydrophobicContact CD1-CG1 4.13Å; L186-I253 HydrophobicContact CD1-CG2 3.83Å; L195-I253 HydrophobicContact CB-CD1 3.62Å; L195-I253 HydrophobicContact CD1-CD1 4.07Å; L195-I253 HydrophobicContact CD2-CD1 4.07Å; L195-I253 HydrophobicContact CG-CD1 4.11Å; F196-I253 WeakPolarHBondContact O-CB 3.27Å; F196-I253 PolarHBondContact O-N 3.47Å; F196-I253 VanDerWaalsContact O-N 3.11Å; F197-I253 HydrophobicContact CD2-CD1 3.97Å; F197-I253 HydrophobicContact CD2-CG2 3.99Å; F197-I253 HydrophobicContact CE2-CG2 4.38Å; K198-I253 WeakPolarHBondContact CB-O 3.44Å; K198-I253 PolarHBondContact N-O 2.81Å; I253-R278 HydrophobicContact CG2-CB 3.75Å; I253-E279 WeakPolarHBondContact CA-O 3.48Å; I253-V280 HydrophobicContact CG1-CG2 3.88Å
254	E	92.8	Very high	87	Confident	5 Å²	5	43 Å²	43	2%	0.023	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	158.6	179.7	-62.8	-65.7	142.7	0	0	111.2	K198 Y203 R252 R278 E279 C281 A646	K198-E254 WeakPolarHBondContact CD-OE2 3.26Å; K198-E254 WeakPolarHBondContact CE-OE2 3.32Å; K198-E254 IonicContact NZ-OE2 3.85Å; K198-E254 PolarHBondContact NZ-OE2 2.83Å; Y203-E254 PolarHBondContact OH-OE1 2.94Å; R252-E254 WeakPolarHBondContact CD-OE1 2.91Å; R252-E254 HydrophobicContact CG-CG 4.3Å; R252-E254 VanDerWaalsContact CG-OE1 3.28Å; R252-E254 WeakPolarHBondContact CG-OE1 3.49Å; R252-E254 IonicContact NE-OE1 2.83Å; E254-R278 WeakPolarHBondContact O-CA 3.44Å; E254-E279 PolarHBondContact N-O 2.8Å; E254-E279 PolarHBondContact O-N 3.43Å; E254-E279 VanDerWaalsContact O-N 3.1Å; E254-C281 VanDerWaalsContact CB-SG 3.52Å; E254-C281 HydrophobicContact CG-CB 4.05Å; E254-C281 VanDerWaalsContact CG-SG 3.55Å; E254-A646 HydrophobicContact CB-CB 3.59Å; E254-A646 HydrophobicContact CG-CB 3.77Å
255	Q	91.4	Very high	86.6	Confident	13 Å²	13	44.6 Å²	44.6	6%	0.061	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	124.3	165.7	-67.3	-176	-23.3	0	0	108.7	V276 R278 A646 I647	Q255-V276 HydrophobicContact CB-CG1 3.81Å; Q255-V276 HydrophobicContact CG-CG1 3.83Å; Q255-R278 HydrophobicContact CG-CG 4.11Å; Q255-A646 CarbonylContact O-C 3.6Å; Q255-I647 HydrophobicContact CB-CB 4.46Å; Q255-I647 WeakPolarHBondContact O-CB 3.38Å; Q255-I647 PolarHBondContact O-N 3.03Å
256	T	88.1	Confident	86.4	Confident	20 Å²	20	38.7 Å²	38.7	12%	0.123	21%	0.206	C	C	.	.			trans	-106.8	5.4	-179.1	56.3	0	0	0	0	113.7	R277 E279 R645	T256-R277 PolarHBondContact N-O 2.65Å; T256-E279 HydrophobicContact CG2-CB 3.75Å; T256-E279 HydrophobicContact CG2-CG 3.96Å; T256-R645 WeakPolarHBondContact CA-O 3.03Å; T256-R645 HydrophobicContact CG2-CB 4.25Å
257	E	85.5	Confident	86.1	Confident	21 Å²	21	42.5 Å²	42.5	10%	0.098	22%	0.222	C	C	.	.	S	Bend	trans	-136	132.3	-179.8	179.8	-176.3	-139	0	0	109.2	A261 M262 R265 V276 R277 I647	E257-A261 HydrophobicContact CG-CB 3.77Å; E257-M262 HydrophobicContact CG-CB 4.27Å; E257-M262 WeakPolarHBondContact OE1-CA 3.21Å; E257-R265 IonicContact OE1-CZ 2.76Å; E257-R265 IonicContact OE1-NE 3.79Å; E257-R265 IonicContact OE1-NH1 2.7Å; E257-R265 PolarHBondContact OE1-NH1 3.18Å; E257-R265 IonicContact OE2-CZ 4Å; E257-R265 IonicContact OE2-NH1 3.81Å; E257-R265 PolarHBondContact OE2-NH1 2.96Å; E257-R265 IonicContact OE2-NH2 3.23Å; E257-V276 HydrophobicContact CB-CG1 4.4Å; E257-V276 WeakPolarHBondContact O-CG1 3.43Å; E257-R277 HydrophobicContact CB-CB 3.9Å; E257-R277 WeakPolarHBondContact OE2-CG 3.42Å; E257-R277 PolarHBondContact OE2-N 2.99Å; E257-I647 VanDerWaalsContact O-CD1 3.3Å; E257-I647 WeakPolarHBondContact O-CD1 3.46Å
258	S	80.5	Confident	85.7	Confident	50 Å²	50	50.5 Å²	50.5	35%	0.35	24%	0.242	S	C	.	.			trans	-74.9	158.4	177.2	72.1	0	0	0	0	110.4	D260 A261 M262	S258-D260 PolarHBondContact O-N 3.38Å; S258-A261 PolarHBondContact O-N 3.34Å; S258-A261 VanDerWaalsContact O-N 3.15Å; S258-A261 WeakPolarHBondContact OG-CB 3.39Å; S258-A261 PolarHBondContact OG-N 2.62Å; S258-A261 VanDerWaalsContact OG-N 3.09Å; S258-M262 PolarHBondContact O-N 2.99Å
259	I	77.5	Confident	84.8	Confident	88 Å²	88	54.3 Å²	54.3	45%	0.451	26%	0.26	S	S	.	.	H	α-helix	trans	-58.3	-33.6	175.7	-58.8	170.9	0	0	0	110.4	M262 N263 V276 R773	I259-M262 HydrophobicContact CG2-CE 4.44Å; I259-N263 WeakPolarHBondContact O-CB 3.45Å; I259-N263 VanDerWaalsContact O-CG 3.23Å; I259-N263 PolarHBondContact O-N 3Å; I259-N263 PolarHBondContact O-ND2 2.97Å; I259-V276 HydrophobicContact CG1-CG2 4.42Å; I259-R773 VanDerWaalsContact CG2-NH2 3.34Å
260	D	77.1	Confident	83.5	Confident	83 Å²	83	59.5 Å²	59.5	44%	0.444	30%	0.298	S	S	.	.	H	α-helix	trans	-68.1	-47.7	175.5	-71.5	-56.6	0	0	0	112.1	S258 M262 N263 E264 R773	S258-D260 PolarHBondContact O-N 3.38Å; D260-M262 VanDerWaalsContact C-N 3.29Å; D260-M262 PolarHBondContact O-N 3.33Å; D260-N263 WeakPolarHBondContact O-CB 3.5Å; D260-N263 PolarHBondContact O-N 3.46Å; D260-N263 VanDerWaalsContact O-N 3.11Å; D260-E264 PolarHBondContact O-N 3.37Å; D260-R773 VanDerWaalsContact CG-CZ 3.47Å; D260-R773 IonicContact OD1-CZ 3.9Å; D260-R773 IonicContact OD1-NE 2.76Å; D260-R773 PolarHBondContact OD1-NE 3.33Å; D260-R773 IonicContact OD1-NH1 3.36Å; D260-R773 IonicContact OD1-NH2 3.09Å; D260-R773 PolarHBondContact OD1-NH2 3.12Å; D260-R773 IonicContact OD2-CZ 3.4Å; D260-R773 IonicContact OD2-NE 2.91Å; D260-R773 PolarHBondContact OD2-NE 3.02Å; D260-R773 IonicContact OD2-NH2 2.73Å; D260-R773 PolarHBondContact OD2-NH2 2.72Å
261	A	79.6	Confident	82.2	Confident	39 Å²	39	64.6 Å²	64.6	32%	0.322	33%	0.334	S	S	.	.	H	α-helix	trans	-60.6	-38.9	176.6	0	0	0	0	0	112	E257 S258 E264 R265	E257-A261 HydrophobicContact CG-CB 3.77Å; S258-A261 PolarHBondContact O-N 3.34Å; S258-A261 VanDerWaalsContact O-N 3.15Å; S258-A261 WeakPolarHBondContact OG-CB 3.39Å; S258-A261 PolarHBondContact OG-N 2.62Å; S258-A261 VanDerWaalsContact OG-N 3.09Å; A261-E264 PolarHBondContact O-N 2.81Å; A261-R265 WeakPolarHBondContact O-CB 3.47Å; A261-R265 PolarHBondContact O-N 2.69Å
262	M	81.1	Confident	80.8	Confident	23 Å²	23	65.9 Å²	65.9	11%	0.113	34%	0.343	C	S	.	.	H	α-helix	trans	-61.3	-47.3	173.1	-178	-159.7	71	0	0	111.3	E257 S258 I259 D260 E264 R265 C266 V276	E257-M262 HydrophobicContact CG-CB 4.27Å; E257-M262 WeakPolarHBondContact OE1-CA 3.21Å; S258-M262 PolarHBondContact O-N 2.99Å; I259-M262 HydrophobicContact CG2-CE 4.44Å; D260-M262 VanDerWaalsContact C-N 3.29Å; D260-M262 PolarHBondContact O-N 3.33Å; M262-E264 VanDerWaalsContact C-N 3.33Å; M262-E264 PolarHBondContact O-N 2.92Å; M262-R265 WeakPolarHBondContact O-CB 3.32Å; M262-R265 PolarHBondContact O-N 3.31Å; M262-C266 WeakPolarHBondContact O-CB 3.32Å; M262-C266 PolarHBondContact O-N 3.38Å; M262-C266 PolarHBondContact O-SG 3.48Å; M262-V276 HydrophobicContact SD-CG2 3.87Å; M262-V276 PolarHBondContact SD-N 3.21Å
263	N	81.1	Confident	79.8	Confident	61 Å²	61	67.6 Å²	67.6	33%	0.326	35%	0.353	S	S	.	.	H	α-helix	trans	-62.2	-41.3	178.4	-75.5	-25.6	0	0	0	111.7	I259 D260 C266 K267	I259-N263 WeakPolarHBondContact O-CB 3.45Å; I259-N263 VanDerWaalsContact O-CG 3.23Å; I259-N263 PolarHBondContact O-N 3Å; I259-N263 PolarHBondContact O-ND2 2.97Å; D260-N263 WeakPolarHBondContact O-CB 3.5Å; D260-N263 PolarHBondContact O-N 3.46Å; D260-N263 VanDerWaalsContact O-N 3.11Å; N263-C266 PolarHBondContact O-N 3.04Å; N263-K267 WeakPolarHBondContact O-CG 3.33Å; N263-K267 PolarHBondContact O-N 2.91Å
264	E	80.6	Confident	79.2	Confident	98 Å²	98	75.9 Å²	75.9	46%	0.458	39%	0.389	S	S	.	.	H	α-helix	trans	-64.2	-42	174.3	-72.3	-164.2	176.3	0	0	112.6	D260 A261 M262 C266 K267 R268	D260-E264 PolarHBondContact O-N 3.37Å; A261-E264 PolarHBondContact O-N 2.81Å; M262-E264 VanDerWaalsContact C-N 3.33Å; M262-E264 PolarHBondContact O-N 2.92Å; E264-C266 VanDerWaalsContact C-N 3.33Å; E264-C266 PolarHBondContact O-N 3.34Å; E264-K267 PolarHBondContact O-N 3.49Å; E264-R268 WeakPolarHBondContact O-CG 3.24Å; E264-R268 PolarHBondContact O-N 2.85Å; E264-R268 IonicContact OE2-CZ 2.82Å; E264-R268 IonicContact OE2-NH2 3.44Å; E264-R268 PolarHBondContact OE2-NH2 2.99Å
265	R	80.7	Confident	78.9	Confident	38 Å²	38	75.9 Å²	75.9	14%	0.143	39%	0.389	C	S	.	.	H	α-helix	trans	-59	-46.2	174.5	-176.2	-170.6	71.8	-152.8	1.6	111.1	E257 A261 M262 K267 R268 K269 S272 E273 V275	E257-R265 IonicContact OE1-CZ 2.76Å; E257-R265 IonicContact OE1-NE 3.79Å; E257-R265 IonicContact OE1-NH1 2.7Å; E257-R265 PolarHBondContact OE1-NH1 3.18Å; E257-R265 IonicContact OE2-CZ 4Å; E257-R265 IonicContact OE2-NH1 3.81Å; E257-R265 PolarHBondContact OE2-NH1 2.96Å; E257-R265 IonicContact OE2-NH2 3.23Å; A261-R265 WeakPolarHBondContact O-CB 3.47Å; A261-R265 PolarHBondContact O-N 2.69Å; M262-R265 WeakPolarHBondContact O-CB 3.32Å; M262-R265 PolarHBondContact O-N 3.31Å; R265-K267 VanDerWaalsContact C-N 3.29Å; R265-K267 PolarHBondContact O-N 3.41Å; R265-R268 PolarHBondContact O-N 3.31Å; R265-K269 PolarHBondContact O-N 2.96Å; R265-S272 PolarHBondContact O-OG 2.93Å; R265-E273 PolarHBondContact NH2-O 3.33Å; R265-V275 PolarHBondContact NH2-O 3.16Å
266	C	80.2	Confident	78.7	Confident	29 Å²	29	76 Å²	76	20%	0.196	39%	0.39	C	S	.	.	H	α-helix	trans	-63.8	-33.9	177.9	-64.3	0	0	0	0	112.4	M262 N263 E264 K269 S272	M262-C266 WeakPolarHBondContact O-CB 3.32Å; M262-C266 PolarHBondContact O-N 3.38Å; M262-C266 PolarHBondContact O-SG 3.48Å; N263-C266 PolarHBondContact O-N 3.04Å; E264-C266 VanDerWaalsContact C-N 3.33Å; E264-C266 PolarHBondContact O-N 3.34Å; C266-K269 CarbonylContact O-C 3.5Å; C266-S272 VanDerWaalsContact CA-OG 3.29Å; C266-S272 WeakPolarHBondContact CA-OG 3.29Å
267	K	79.2	Confident	78.8	Confident	179 Å²	179	81.4 Å²	81.4	78%	0.778	41%	0.409	S	S	*	.	H	α-helix	trans	-69	-40.9	172.4	-73.6	173.5	-178.1	178.4	0	112.6	N263 E264 R265	N263-K267 WeakPolarHBondContact O-CG 3.33Å; N263-K267 PolarHBondContact O-N 2.91Å; E264-K267 PolarHBondContact O-N 3.49Å; R265-K267 VanDerWaalsContact C-N 3.29Å; R265-K267 PolarHBondContact O-N 3.41Å
268	R	78.7	Confident	79.2	Confident	199 Å²	199	81.3 Å²	81.3	75%	0.751	41%	0.407	S	S	*	.	H	α-helix	trans	-77	-33.3	-178.1	-69.3	179.5	-168.4	167.9	11.5	113.1	E264 R265	E264-R268 WeakPolarHBondContact O-CG 3.24Å; E264-R268 PolarHBondContact O-N 2.85Å; E264-R268 IonicContact OE2-CZ 2.82Å; E264-R268 IonicContact OE2-NH2 3.44Å; E264-R268 PolarHBondContact OE2-NH2 2.99Å; R265-R268 PolarHBondContact O-N 3.31Å
269	K	73.7	Confident	79.8	Confident	140 Å²	140	81.4 Å²	81.4	61%	0.609	40%	0.402	S	S	*	.			trans	-128.6	102.1	179.3	-71.5	-176	178.9	-179	0	109.3	R265 C266 S271 S272	R265-K269 PolarHBondContact O-N 2.96Å; C266-K269 CarbonylContact O-C 3.5Å; K269-S271 PolarHBondContact O-N 3.11Å; K269-S271 VanDerWaalsContact O-N 3.16Å; K269-S272 WeakPolarHBondContact O-CB 3.34Å; K269-S272 PolarHBondContact O-N 2.88Å; K269-S272 PolarHBondContact O-OG 2.9Å
270	S	67.3	Low	80.5	Confident	126 Å²	126	77.6 Å²	77.6	88%	0.881	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-23	174.7	47.9	0	0	0	0	113.5	S272	S270-S272 VanDerWaalsContact C-N 3.33Å
271	S	68.1	Low	81.2	Confident	108 Å²	108	73.7 Å²	73.7	76%	0.755	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-1.1	174.5	60.2	0	0	0	0	114.8	K269	K269-S271 PolarHBondContact O-N 3.11Å; K269-S271 VanDerWaalsContact O-N 3.16Å
272	S	65.6	Low	81.8	Confident	26 Å²	26	72.2 Å²	72.2	18%	0.182	35%	0.349	C	S	.	.	S	Bend	trans	-83.5	136.7	-179.1	64.6	0	0	0	0	112	R265 C266 K269 S270	R265-S272 PolarHBondContact O-OG 2.93Å; C266-S272 VanDerWaalsContact CA-OG 3.29Å; C266-S272 WeakPolarHBondContact CA-OG 3.29Å; K269-S272 WeakPolarHBondContact O-CB 3.34Å; K269-S272 PolarHBondContact O-N 2.88Å; K269-S272 PolarHBondContact O-OG 2.9Å; S270-S272 VanDerWaalsContact C-N 3.33Å
273	E	72.9	Confident	82.3	Confident	74 Å²	74	71.1 Å²	71.1	35%	0.346	34%	0.344	S	S	.	.			trans	-65.7	138	179.2	-62.9	177.1	-176.4	0	0	110.4	P178 R181 R265 V275	P178-E273 HydrophobicContact CB-CB 4.29Å; R181-E273 IonicContact CZ-OE1 3.92Å; R181-E273 IonicContact NE-OE1 3.98Å; R181-E273 IonicContact NH1-OE1 3.52Å; R181-E273 PolarHBondContact NH1-OE1 3.46Å; R265-E273 PolarHBondContact NH2-O 3.33Å; E273-V275 HydrophobicContact CB-CG1 3.91Å; E273-V275 PolarHBondContact O-N 2.9Å
274	K	82.1	Confident	82.9	Confident	173 Å²	173	68.4 Å²	68.4	75%	0.752	33%	0.329	S	S	*	.	S	Bend	trans	-79.6	66.7	177.2	-69.8	-176.6	-179.7	177.3	0	110.9
275	V	86.3	Confident	83.4	Confident	5 Å²	5	63.8 Å²	63.8	3%	0.03	31%	0.307	C	S	.	.	S	Bend	trans	-145.5	139	177.9	59.8	0	0	0	0	111	P178 R265 E273 R277	P178-V275 HydrophobicContact CB-CB 3.68Å; P178-V275 HydrophobicContact CB-CG1 3.52Å; P178-V275 HydrophobicContact CB-CG2 4.3Å; R265-V275 PolarHBondContact NH2-O 3.16Å; E273-V275 HydrophobicContact CB-CG1 3.91Å; E273-V275 PolarHBondContact O-N 2.9Å; V275-R277 PolarHBondContact O-N 3.18Å
276	V	87.9	Confident	83.8	Confident	15 Å²	15	62.7 Å²	62.7	9%	0.091	31%	0.305	C	S	.	.			trans	-63.6	130.9	174.4	171.8	0	0	0	0	109.7	Q182 Q255 E257 I259 M262 R278	Q182-V276 PolarHBondContact NE2-O 3.34Å; Q182-V276 PolarHBondContact OE1-O 2.97Å; Q255-V276 HydrophobicContact CB-CG1 3.81Å; Q255-V276 HydrophobicContact CG-CG1 3.83Å; E257-V276 HydrophobicContact CB-CG1 4.4Å; E257-V276 WeakPolarHBondContact O-CG1 3.43Å; I259-V276 HydrophobicContact CG1-CG2 4.42Å; M262-V276 HydrophobicContact SD-CG2 3.87Å; M262-V276 PolarHBondContact SD-N 3.21Å; V276-R278 PolarHBondContact O-NH1 2.78Å
277	R	89.3	Confident	84.2	Confident	134 Å²	134	61.3 Å²	61.3	51%	0.506	30%	0.296	S	S	.	.			trans	-66.1	139.6	173.7	-73.4	170.3	-177.4	-157	-3.5	111.5	T256 E257 V275	T256-R277 PolarHBondContact N-O 2.65Å; E257-R277 HydrophobicContact CB-CB 3.9Å; E257-R277 WeakPolarHBondContact OE2-CG 3.42Å; E257-R277 PolarHBondContact OE2-N 2.99Å; V275-R277 PolarHBondContact O-N 3.18Å
278	R	93.2	Very high	84.7	Confident	19 Å²	19	52.8 Å²	52.8	7%	0.072	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	140.2	176.2	-68.4	166.5	179.5	93	-13	110.2	Q182 F197 K198 I253 E254 Q255 V276	Q182-R278 VanDerWaalsContact OE1-N 3.13Å; F197-R278 VanDerWaalsContact CE1-CD 3.47Å; F197-R278 HydrophobicContact CE2-CB 4.41Å; F197-R278 HydrophobicContact CZ-CG 4.5Å; K198-R278 PolarHBondContact O-NE 3.24Å; I253-R278 HydrophobicContact CG2-CB 3.75Å; E254-R278 WeakPolarHBondContact O-CA 3.44Å; Q255-R278 HydrophobicContact CG-CG 4.11Å; V276-R278 PolarHBondContact O-NH1 2.78Å
279	E	92.8	Very high	84.8	Confident	52 Å²	52	43.7 Å²	43.7	24%	0.243	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	151.9	178.9	-62.2	179.1	-159.8	0	0	109.7	I253 E254 T256 C281 P642 R645	I253-E279 WeakPolarHBondContact CA-O 3.48Å; E254-E279 PolarHBondContact N-O 2.8Å; E254-E279 PolarHBondContact O-N 3.43Å; E254-E279 VanDerWaalsContact O-N 3.1Å; T256-E279 HydrophobicContact CG2-CB 3.75Å; T256-E279 HydrophobicContact CG2-CG 3.96Å; E279-C281 PolarHBondContact O-N 2.8Å; E279-P642 HydrophobicContact CB-CB 4Å; E279-R645 IonicContact OE1-CZ 3.66Å; E279-R645 IonicContact OE1-NH1 3.47Å; E279-R645 PolarHBondContact OE1-NH1 3.35Å; E279-R645 IonicContact OE1-NH2 2.93Å; E279-R645 IonicContact OE2-CZ 3.75Å; E279-R645 VanDerWaalsContact OE2-CZ 3.25Å; E279-R645 IonicContact OE2-NH1 2.93Å; E279-R645 PolarHBondContact OE2-NH1 3.42Å; E279-R645 IonicContact OE2-NH2 3.39Å; E279-R645 PolarHBondContact OE2-NH2 2.92Å
280	V	93.8	Very high	84.9	Confident	8 Å²	8	37.2 Å²	37.2	5%	0.048	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	123.9	170.2	178.1	0	0	0	0	107.5	L186 Y190 A251 I253 I283 L497 P642	L186-V280 HydrophobicContact CD2-CG2 4.16Å; Y190-V280 HydrophobicContact CD2-CG2 3.89Å; Y190-V280 HydrophobicContact CE2-CB 4.3Å; Y190-V280 HydrophobicContact CE2-CG2 3.53Å; A251-V280 HydrophobicContact CB-CG1 4.15Å; I253-V280 HydrophobicContact CG1-CG2 3.88Å; V280-I283 HydrophobicContact CG1-CD1 4.45Å; V280-I283 HydrophobicContact CG1-CG1 3.85Å; V280-L497 HydrophobicContact CB-CD1 4.43Å; V280-L497 HydrophobicContact CG1-CD1 4.08Å; V280-L497 WeakPolarHBondContact O-CD1 3.47Å; V280-P642 WeakPolarHBondContact O-CB 3.26Å; V280-P642 WeakPolarHBondContact O-CG 3.41Å
281	C	90.9	Very high	84.8	Confident	1 Å²	1	31.3 Å²	31.3	1%	0.007	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	-29.3	178.6	-71.4	0	0	0	0	112.5	R252 E254 E279 H641 D643	R252-C281 PolarHBondContact O-N 2.84Å; E254-C281 VanDerWaalsContact CB-SG 3.52Å; E254-C281 HydrophobicContact CG-CB 4.05Å; E254-C281 VanDerWaalsContact CG-SG 3.55Å; E279-C281 PolarHBondContact O-N 2.8Å; C281-H641 PolarHBondContact O-CE1 2.85Å; C281-D643 HydrophobicContact CB-CB 4.21Å; C281-D643 WeakPolarHBondContact CB-OD1 3.46Å
282	Q	91.5	Very high	84.4	Confident	8 Å²	8	28 Å²	28	4%	0.037	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	144.7	-178.9	-170.2	173.4	34.9	0	0	110.3	A251 R252 I284 I498	A251-Q282 WeakPolarHBondContact CA-O 3.34Å; R252-Q282 HydrophobicContact CB-CB 4.43Å; R252-Q282 PolarHBondContact N-O 3.01Å; Q282-I284 HydrophobicContact CG-CG1 4.3Å; Q282-I498 HydrophobicContact CG-CG2 4Å
283	I	93	Very high	84.1	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.005	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	121.1	167.3	-49.3	179.4	0	0	0	108.9	Y190 V193 V250 A251 V280 T285 T288 Y495 C496	Y190-I283 HydrophobicContact CD1-CD1 3.73Å; Y190-I283 HydrophobicContact CE1-CD1 3.5Å; Y190-I283 VanDerWaalsContact CE1-CD1 3.5Å; V193-I283 HydrophobicContact CG1-CG2 4.01Å; V193-I283 HydrophobicContact CG2-CG2 4.45Å; V250-I283 CarbonylContact O-C 3.59Å; V250-I283 WeakPolarHBondContact O-CA 3.03Å; A251-I283 HydrophobicContact CB-CG1 4.41Å; V280-I283 HydrophobicContact CG1-CD1 4.45Å; V280-I283 HydrophobicContact CG1-CG1 3.85Å; I283-T285 HydrophobicContact CG2-CG2 4.01Å; I283-T288 PolarHBondContact O-OG1 2.9Å; I283-Y495 HydrophobicContact CD1-CD1 4.21Å; I283-Y495 HydrophobicContact CD1-CE1 3.78Å; I283-Y495 HydrophobicContact CD1-CE2 4.39Å; I283-Y495 VanDerWaalsContact CD1-O 3.32Å; I283-Y495 WeakPolarHBondContact CD1-O 3.46Å; I283-C496 HydrophobicContact CB-CB 4.3Å; I283-C496 PolarHBondContact N-O 3.48Å; I283-C496 WeakPolarHBondContact O-CB 3.44Å
284	I	92.4	Very high	83.5	Confident	4 Å²	4	26.9 Å²	26.9	2%	0.021	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	124.4	179.5	-48.2	175.6	0	0	0	107.9	F236 A240 V244 V250 Q282 T293	F236-I284 HydrophobicContact CE1-CD1 4.05Å; F236-I284 HydrophobicContact CZ-CD1 3.69Å; A240-I284 HydrophobicContact CB-CD1 4.11Å; V244-I284 HydrophobicContact CG2-CB 4.22Å; V244-I284 HydrophobicContact CG2-CG2 3.81Å; V250-I284 PolarHBondContact N-O 2.84Å; V250-I284 PolarHBondContact O-N 3.41Å; Q282-I284 HydrophobicContact CG-CG1 4.3Å; I284-T293 HydrophobicContact CD1-CG2 3.68Å; I284-T293 HydrophobicContact CG1-CG2 3.97Å
285	T	92.7	Very high	82	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.102	C	C	.	.			trans	-128.3	167.1	177.2	77.9	0	0	0	0	110.3	V244 K249 I283 G287 T288 C289 Q381 Y492	V244-T285 VanDerWaalsContact CG1-C 3.48Å; K249-T285 HydrophobicContact CB-CG2 4.16Å; K249-T285 HydrophobicContact CD-CG2 4.29Å; K249-T285 HydrophobicContact CG-CG2 3.84Å; I283-T285 HydrophobicContact CG2-CG2 4.01Å; T285-G287 PolarHBondContact O-N 3.1Å; T285-G287 VanDerWaalsContact O-N 3.12Å; T285-T288 PolarHBondContact N-OG1 3.17Å; T285-T288 PolarHBondContact O-N 2.97Å; T285-T288 PolarHBondContact OG1-N 3.05Å; T285-T288 PolarHBondContact OG1-OG1 2.73Å; T285-C289 PolarHBondContact O-N 3.17Å; T285-C289 PolarHBondContact O-SG 3.49Å; T285-Q381 VanDerWaalsContact CB-OE1 3.24Å; T285-Q381 PolarHBondContact OG1-OE1 3.23Å; T285-Y492 WeakPolarHBondContact CG2-OH 3.41Å
286	P	88.7	Confident	80.4	Confident	15 Å²	15	24.3 Å²	24.3	10%	0.097	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-29.3	-179.7	-27.3	36.4	0	0	0	113.6	V244 S326 N380 P405	V244-P286 HydrophobicContact CG1-CB 4.33Å; V244-P286 HydrophobicContact CG1-CG 4.1Å; P286-S326 PolarHBondContact O-OG 3.11Å; P286-N380 HydrophobicContact CB-CB 4.32Å; P286-N380 WeakPolarHBondContact O-CB 3.34Å; P286-P405 HydrophobicContact CG-CG 4.27Å
287	G	88.5	Confident	78.8	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-17.3	175.7	0	0	0	0	0	115.1	T285 S326 A351	T285-G287 PolarHBondContact O-N 3.1Å; T285-G287 VanDerWaalsContact O-N 3.12Å; G287-S326 WeakPolarHBondContact CA-OG 3.3Å; G287-S326 PolarHBondContact O-OG 2.96Å; G287-A351 VanDerWaalsContact O-CB 3.27Å; G287-A351 WeakPolarHBondContact O-CB 3.47Å
288	T	88.8	Confident	76.9	Confident	1 Å²	1	18.7 Å²	18.7	1%	0.006	10%	0.099	C	C	.	.			trans	-113.1	21	-173.8	64.6	0	0	0	0	114.2	I283 T285 T290 L328 Y492 I498	I283-T288 PolarHBondContact O-OG1 2.9Å; T285-T288 PolarHBondContact N-OG1 3.17Å; T285-T288 PolarHBondContact O-N 2.97Å; T285-T288 PolarHBondContact OG1-N 3.05Å; T285-T288 PolarHBondContact OG1-OG1 2.73Å; T288-T290 PolarHBondContact O-N 2.79Å; T288-L328 HydrophobicContact CG2-CD2 4.1Å; T288-Y492 HydrophobicContact CG2-CD1 4.07Å; T288-Y492 HydrophobicContact CG2-CE1 3.8Å; T288-I498 HydrophobicContact CG2-CD1 4.13Å
289	C	82.5	Confident	74.7	Confident	8 Å²	8	21.6 Å²	21.6	5%	0.054	12%	0.116	C	C	.	.			trans	-67.8	92.5	174.6	-72.8	0	0	0	0	111.3	V244 T285 S326	V244-C289 WeakPolarHBondContact CG1-SG 3.41Å; T285-C289 PolarHBondContact O-N 3.17Å; T285-C289 PolarHBondContact O-SG 3.49Å; C289-S326 PolarHBondContact N-OG 2.93Å
290	T	75.5	Confident	72.4	Confident	4 Å²	4	22.6 Å²	22.6	3%	0.025	13%	0.126	C	C	.	.			trans	-76.7	160.2	178.4	67.4	0	0	0	0	112.1	T288 S292 T293 A351 I498	T288-T290 PolarHBondContact O-N 2.79Å; T290-S292 PolarHBondContact O-N 3.39Å; T290-T293 PolarHBondContact O-N 2.8Å; T290-T293 VanDerWaalsContact O-N 3.08Å; T290-T293 PolarHBondContact O-OG1 3.47Å; T290-A351 WeakPolarHBondContact CA-O 3.11Å; T290-I498 HydrophobicContact CG2-CD1 3.81Å
291	A	64.4	Low	69.8	Low	1 Å²	1	28.9 Å²	28.9	1%	0.008	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-52.6	-37.1	174.8	0	0	0	0	0	112.6	T293 R294 I297 R625 K629	A291-T293 VanDerWaalsContact C-N 3.25Å; A291-T293 PolarHBondContact O-N 2.93Å; A291-R294 PolarHBondContact O-N 3.36Å; A291-I297 HydrophobicContact CB-CD1 3.98Å; A291-I297 WeakPolarHBondContact O-CD1 3.49Å; A291-R625 HydrophobicContact CB-CB 4Å; A291-R625 HydrophobicContact CB-CG 4.41Å; A291-K629 HydrophobicContact CB-CB 4.37Å
292	S	60.5	Low	66.8	Low	38 Å²	38	31.8 Å²	31.8	27%	0.266	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-61.4	-30.1	179.6	-58	0	0	0	0	114	T290 L632	T290-S292 PolarHBondContact O-N 3.39Å; S292-L632 WeakPolarHBondContact OG-CD1 3.23Å
293	T	58.2	Low	64	Low	18 Å²	18	36 Å²	36	11%	0.11	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-80.6	-18	-177.4	62.4	0	0	0	0	113.7	I284 T290 A291	I284-T293 HydrophobicContact CD1-CG2 3.68Å; I284-T293 HydrophobicContact CG1-CG2 3.97Å; T290-T293 PolarHBondContact O-N 2.8Å; T290-T293 VanDerWaalsContact O-N 3.08Å; T290-T293 PolarHBondContact O-OG1 3.47Å; A291-T293 VanDerWaalsContact C-N 3.25Å; A291-T293 PolarHBondContact O-N 2.93Å
294	R	60.5	Low	60.9	Low	60 Å²	60	42.7 Å²	42.7	23%	0.226	23%	0.234	C	C	.	.			trans	-87.6	124.7	-176.8	-68.6	-169.2	174.8	-167.1	6.3	111.2	A291 E296 I297 P324	A291-R294 PolarHBondContact O-N 3.36Å; R294-E296 VanDerWaalsContact C-N 3.34Å; R294-E296 PolarHBondContact O-N 3.47Å; R294-I297 HydrophobicContact CB-CD1 4.44Å; R294-I297 HydrophobicContact CB-CG1 4.29Å; R294-P324 VanDerWaalsContact CZ-O 3.25Å; R294-P324 PolarHBondContact NH1-O 2.88Å; R294-P324 PolarHBondContact NH2-O 2.95Å
295	S	50.5	Low	57.9	Low	40 Å²	40	48.7 Å²	48.7	28%	0.28	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-30.2	-176.7	-159.5	0	0	0	0	113.7	K657	S295-K657 WeakPolarHBondContact O-CE 3.37Å; S295-K657 PolarHBondContact O-NZ 3.42Å; S295-K657 PolarHBondContact OG-NZ 3.3Å
296	E	52.9	Low	54.6	Low	84 Å²	84	50.9 Å²	50.9	39%	0.393	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	24.6	-157	-66.2	168.3	-172.6	0	0	114.4	R294 S298 I319	R294-E296 VanDerWaalsContact C-N 3.34Å; R294-E296 PolarHBondContact O-N 3.47Å; E296-S298 PolarHBondContact O-N 3.18Å; E296-I319 WeakPolarHBondContact OE2-CD1 3.43Å
297	I	54.3	Low	51.6	Low	11 Å²	11	58.2 Å²	58.2	6%	0.056	33%	0.332	C	S	.	.	S	Bend	trans	-67.5	-36.7	-177.3	-56.9	179	0	0	0	111.7	A291 R294 D622 R625 L626	A291-I297 HydrophobicContact CB-CD1 3.98Å; A291-I297 WeakPolarHBondContact O-CD1 3.49Å; R294-I297 HydrophobicContact CB-CD1 4.44Å; R294-I297 HydrophobicContact CB-CG1 4.29Å; I297-D622 HydrophobicContact CG2-CB 4.21Å; I297-R625 HydrophobicContact CD1-CB 4.14Å; I297-R625 HydrophobicContact CG2-CB 4.32Å; I297-L626 HydrophobicContact CB-CD2 4.29Å; I297-L626 HydrophobicContact CG2-CD1 4.37Å; I297-L626 HydrophobicContact CG2-CD2 3.48Å; I297-L626 VanDerWaalsContact CG2-CD2 3.48Å; I297-L626 HydrophobicContact CG2-CG 3.56Å
298	S	50	Low	48.7	Very low	19 Å²	19	63.7 Å²	63.7	13%	0.133	37%	0.365	C	S	.	.	S	Bend	trans	-101.3	-24.8	-179.6	49.5	0	0	0	0	114.8	E296 V300 D661	E296-S298 PolarHBondContact O-N 3.18Å; S298-V300 PolarHBondContact O-N 2.79Å; S298-V300 VanDerWaalsContact O-N 3.1Å; S298-D661 WeakPolarHBondContact CB-OD1 3.39Å; S298-D661 PolarHBondContact OG-OD1 3.14Å
299	D	46.3	Very low	46	Very low	80 Å²	80	72.8 Å²	72.8	43%	0.428	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-76.4	8.1	-171	-77.4	-30.8	0	0	0	115.1	K301 A302	D299-K301 PolarHBondContact O-N 3.29Å; D299-K301 VanDerWaalsContact O-N 3.07Å; D299-A302 PolarHBondContact O-N 3.13Å
300	V	45.6	Very low	43.4	Very low	73 Å²	73	78.9 Å²	78.9	44%	0.442	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-57.3	-26.6	175.4	-175.1	0	0	0	0	111.7	S298 F573	S298-V300 PolarHBondContact O-N 2.79Å; S298-V300 VanDerWaalsContact O-N 3.1Å; V300-F573 HydrophobicContact CG2-CE2 4.35Å; V300-F573 HydrophobicContact CG2-CZ 4.27Å
301	K	37.4	Very low	41.1	Very low	141 Å²	141	82.1 Å²	82.1	61%	0.613	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-72.5	-26	174.5	-68.8	-173.5	177.2	-179.9	0	114.6	D299 V303 E304 T305	D299-K301 PolarHBondContact O-N 3.29Å; D299-K301 VanDerWaalsContact O-N 3.07Å; K301-V303 VanDerWaalsContact C-N 3.29Å; K301-V303 PolarHBondContact O-N 3.25Å; K301-E304 PolarHBondContact O-N 3.32Å; K301-T305 PolarHBondContact O-OG1 2.97Å
302	A	29.9	Very low	39.6	Very low	61 Å²	61	88 Å²	88	50%	0.504	51%	0.506	S	S	.	.	H	α-helix	trans	-75.8	-18.7	-175.4	0	0	0	0	0	113.1	D299 E304	D299-A302 PolarHBondContact O-N 3.13Å; A302-E304 VanDerWaalsContact C-N 3.33Å
303	V	31.6	Very low	38.1	Very low	96 Å²	96	94.8 Å²	94.8	58%	0.582	53%	0.533	S	S	*	.	H	α-helix	trans	-80.9	-14.9	176.8	-175.8	0	0	0	0	111.9	K301	K301-V303 VanDerWaalsContact C-N 3.29Å; K301-V303 PolarHBondContact O-N 3.25Å
304	E	27.8	Very low	36.7	Very low	142 Å²	142	95.8 Å²	95.8	66%	0.664	55%	0.547	S	S	*	.	H	α-helix	trans	-92	-17.4	-179.9	-68.2	-170.2	154	0	0	114.4	K301 A302	K301-E304 PolarHBondContact O-N 3.32Å; A302-E304 VanDerWaalsContact C-N 3.33Å
305	T	28.8	Very low	35.5	Very low	130 Å²	130	97.2 Å²	97.2	80%	0.798	56%	0.555	S	S	*	*	H	α-helix	trans	-134.5	13.1	-167	52.1	0	0	0	0	116.8	K301	K301-T305 PolarHBondContact O-OG1 2.97Å
306	G	24.4	Very low	34.5	Very low	47 Å²	47	102.5 Å²	102.5	49%	0.485	57%	0.569	S	S	.	*	S	Bend	trans	-128.8	116.5	-179.9	0	0	0	0	0	114	V308	G306-V308 PolarHBondContact O-N 3.46Å
307	D	25	Very low	33.6	Very low	168 Å²	168	102.9 Å²	102.9	90%	0.898	57%	0.574	S	S	*	*			trans	-20.4	78.3	163.5	-60.9	-35.1	0	0	0	116.8
308	V	29	Very low	32.6	Very low	116 Å²	116	107.4 Å²	107.4	70%	0.703	60%	0.597	S	S	*	*			trans	-117.3	83.2	161.9	-173.1	0	0	0	0	107.7	G306 N310	G306-V308 PolarHBondContact O-N 3.46Å; V308-N310 HydrophobicContact CG1-CB 4.33Å; V308-N310 WeakPolarHBondContact CG1-O 3.33Å; V308-N310 PolarHBondContact O-N 2.93Å
309	E	30.6	Very low	32.1	Very low	192 Å²	192	109.3 Å²	109.3	90%	0.897	61%	0.606	S	S	*	*			trans	-68.1	18.3	169.1	-72.2	-172.7	147.9	0	0	113.3
310	N	28.1	Very low	31.7	Very low	135 Å²	135	109.4 Å²	109.4	72%	0.722	61%	0.606	S	S	*	*	S	Bend	trans	-120.3	110.6	177.7	-68.7	-46.6	0	0	0	109.5	V308 D312	V308-N310 HydrophobicContact CG1-CB 4.33Å; V308-N310 WeakPolarHBondContact CG1-O 3.33Å; V308-N310 PolarHBondContact O-N 2.93Å; N310-D312 PolarHBondContact O-N 3.24Å
311	G	27.9	Very low	31.3	Very low	73 Å²	73	109.7 Å²	109.7	75%	0.753	61%	0.605	S	S	*	*			trans	-51.7	125.8	-170.6	0	0	0	0	0	114.6
312	D	31.9	Very low	31.4	Very low	125 Å²	125	106 Å²	106	67%	0.668	60%	0.601	S	S	*	*			trans	-148.5	57.3	160.1	-109.4	-15.7	0	0	0	108.1	N310 G314 F315	N310-D312 PolarHBondContact O-N 3.24Å; D312-G314 PolarHBondContact O-N 3.04Å; D312-F315 HydrophobicContact CB-CB 4Å; D312-F315 WeakPolarHBondContact O-CB 3.41Å; D312-F315 PolarHBondContact O-N 3.37Å
313	E	28.9	Very low	32.4	Very low	179 Å²	179	105.7 Å²	105.7	84%	0.836	59%	0.589	S	S	*	*	H	α-helix	trans	-55.9	-28.7	168.8	-68.1	-170.9	154.4	0	0	110.9	F315 R316	E313-F315 VanDerWaalsContact C-N 3.28Å; E313-F315 PolarHBondContact O-N 3.14Å; E313-R316 PolarHBondContact O-N 2.8Å
314	G	29.8	Very low	33.7	Very low	40 Å²	40	103.2 Å²	103.2	41%	0.412	58%	0.575	S	S	.	*	H	α-helix	trans	-65.3	-22.5	173	0	0	0	0	0	115	D312 L318	D312-G314 PolarHBondContact O-N 3.04Å; G314-L318 WeakPolarHBondContact O-CB 3.42Å; G314-L318 WeakPolarHBondContact O-CD1 3.4Å; G314-L318 WeakPolarHBondContact O-CG 3.48Å; G314-L318 PolarHBondContact O-N 3.4Å
315	F	34.7	Very low	36	Very low	89 Å²	89	97.6 Å²	97.6	39%	0.39	55%	0.549	S	S	.	.	H	α-helix	trans	-74.8	-35.3	179.4	-168	-102.4	0	0	0	112	D312 E313 D317 L318 I319	D312-F315 HydrophobicContact CB-CB 4Å; D312-F315 WeakPolarHBondContact O-CB 3.41Å; D312-F315 PolarHBondContact O-N 3.37Å; E313-F315 VanDerWaalsContact C-N 3.28Å; E313-F315 PolarHBondContact O-N 3.14Å; F315-D317 VanDerWaalsContact C-N 3.31Å; F315-D317 PolarHBondContact O-N 3.12Å; F315-L318 PolarHBondContact O-N 3.21Å; F315-I319 HydrophobicContact CD1-CD1 3.83Å; F315-I319 HydrophobicContact CE1-CD1 3.37Å; F315-I319 HydrophobicContact CE1-CG1 4.44Å; F315-I319 HydrophobicContact CZ-CD1 3.8Å; F315-I319 PolarHBondContact O-N 3.21Å
316	R	29.7	Very low	38.7	Very low	151 Å²	151	91.5 Å²	91.5	57%	0.57	51%	0.512	S	S	*	.	H	α-helix	trans	-67	-34.6	176.4	-156.6	173.9	174.1	171.5	1.4	111.4	E313 N320	E313-R316 PolarHBondContact O-N 2.8Å; R316-N320 WeakPolarHBondContact O-CB 3.29Å; R316-N320 PolarHBondContact O-ND2 3.03Å
317	D	33.3	Very low	42	Very low	93 Å²	93	90.2 Å²	90.2	50%	0.497	49%	0.493	S	S	.	.	H	α-helix	trans	-78.5	-36.6	174.6	-81.6	-13.1	0	0	0	112.5	F315 I319 N320 L321	F315-D317 VanDerWaalsContact C-N 3.31Å; F315-D317 PolarHBondContact O-N 3.12Å; D317-I319 PolarHBondContact O-N 3.48Å; D317-N320 PolarHBondContact O-N 3.25Å; D317-L321 HydrophobicContact CB-CD1 3.41Å; D317-L321 VanDerWaalsContact CB-CD1 3.41Å; D317-L321 VanDerWaalsContact CG-CD1 3.41Å; D317-L321 VanDerWaalsContact O-CB 3.25Å; D317-L321 WeakPolarHBondContact O-CB 3.18Å; D317-L321 WeakPolarHBondContact O-CD1 3.34Å; D317-L321 PolarHBondContact O-N 3.25Å; D317-L321 WeakPolarHBondContact OD1-CD1 3.3Å
318	L	34.8	Very low	45.3	Very low	105 Å²	105	82.2 Å²	82.2	55%	0.55	45%	0.45	S	S	.	.	H	α-helix	trans	-62.8	-35.1	177.9	-89.8	159.7	0	0	0	114.2	G314 F315	G314-L318 WeakPolarHBondContact O-CB 3.42Å; G314-L318 WeakPolarHBondContact O-CD1 3.4Å; G314-L318 WeakPolarHBondContact O-CG 3.48Å; G314-L318 PolarHBondContact O-N 3.4Å; F315-L318 PolarHBondContact O-N 3.21Å
319	I	39.4	Very low	48.5	Very low	60 Å²	60	76.7 Å²	76.7	31%	0.308	42%	0.417	S	S	.	.	H	α-helix	trans	-77.3	-31.8	176.5	-64.9	168.6	0	0	0	111.2	E296 F315 D317	E296-I319 WeakPolarHBondContact OE2-CD1 3.43Å; F315-I319 HydrophobicContact CD1-CD1 3.83Å; F315-I319 HydrophobicContact CE1-CD1 3.37Å; F315-I319 HydrophobicContact CE1-CG1 4.44Å; F315-I319 HydrophobicContact CZ-CD1 3.8Å; F315-I319 PolarHBondContact O-N 3.21Å; D317-I319 PolarHBondContact O-N 3.48Å
320	N	36.9	Very low	51.7	Low	81 Å²	81	67.6 Å²	67.6	43%	0.433	37%	0.374	S	S	.	.	H	α-helix	trans	-94.8	-26.3	-172.6	-73.9	-44.6	0	0	0	114.9	R316 D317	R316-N320 WeakPolarHBondContact O-CB 3.29Å; R316-N320 PolarHBondContact O-ND2 3.03Å; D317-N320 PolarHBondContact O-N 3.25Å
321	L	37	Very low	54.8	Low	79 Å²	79	61.5 Å²	61.5	41%	0.414	34%	0.342	S	S	.	.	H	α-helix	trans	-99.6	-15.9	-170.2	-82.9	131.8	0	0	0	116.1	D317 Q559	D317-L321 HydrophobicContact CB-CD1 3.41Å; D317-L321 VanDerWaalsContact CB-CD1 3.41Å; D317-L321 VanDerWaalsContact CG-CD1 3.41Å; D317-L321 VanDerWaalsContact O-CB 3.25Å; D317-L321 WeakPolarHBondContact O-CB 3.18Å; D317-L321 WeakPolarHBondContact O-CD1 3.34Å; D317-L321 PolarHBondContact O-N 3.25Å; D317-L321 WeakPolarHBondContact OD1-CD1 3.3Å; L321-Q559 PolarHBondContact O-NE2 2.9Å
322	A	40.7	Very low	58	Low	65 Å²	65	58.1 Å²	58.1	54%	0.537	31%	0.306	S	S	.	.	S	Bend	trans	-115.8	98.4	-174.3	0	0	0	0	0	112.7
323	H	50.4	Low	60.8	Low	53 Å²	53	53.4 Å²	53.4	25%	0.245	28%	0.28	C	S	.	.			trans	18.8	89.4	163.4	-61.1	-77.4	0	0	0	115.5	D325 R552 R580	H323-D325 VanDerWaalsContact C-N 3.29Å; H323-D325 PolarHBondContact O-N 3.38Å; H323-R552 PolarHBondContact CD2-NH2 3.05Å; H323-R552 PolarHBondContact NE2-NE 3.13Å; H323-R552 PolarHBondContact NE2-NH2 3.37Å; H323-R580 PolarHBondContact CE1-NH1 2.88Å; H323-R580 PolarHBondContact ND1-NH1 3.33Å
324	P	59.4	Low	63.8	Low	44 Å²	44	47.2 Å²	47.2	29%	0.286	26%	0.257	S	S	.	.			trans	-75.8	-16.1	-174	30	-34.5	0	0	0	113	R294 S352 R625	R294-P324 VanDerWaalsContact CZ-O 3.25Å; R294-P324 PolarHBondContact NH1-O 2.88Å; R294-P324 PolarHBondContact NH2-O 2.95Å; P324-S352 PolarHBondContact O-OG 3.19Å; P324-R625 VanDerWaalsContact C-NH2 3.3Å; P324-R625 PolarHBondContact O-NH2 3.01Å
325	D	74.8	Confident	66.6	Low	25 Å²	25	53.4 Å²	53.4	13%	0.134	28%	0.275	C	S	.	.			trans	-76.8	138.8	-178.4	-66.1	-36.4	0	0	0	112.5	H323 F327 N380 R577	H323-D325 VanDerWaalsContact C-N 3.29Å; H323-D325 PolarHBondContact O-N 3.38Å; D325-F327 HydrophobicContact CB-CD2 4.1Å; D325-F327 HydrophobicContact CB-CE2 3.47Å; D325-F327 VanDerWaalsContact CB-CE2 3.47Å; D325-F327 HydrophobicContact CB-CZ 3.75Å; D325-N380 PolarHBondContact O-OD1 3.46Å; D325-R577 WeakPolarHBondContact OD1-CD 3.47Å; D325-R577 WeakPolarHBondContact OD2-CD 3.21Å
326	S	86.1	Confident	68.9	Low	1 Å²	1	50.4 Å²	50.4	1%	0.007	27%	0.269	C	S	.	.			trans	-106.7	103.4	177.3	170.4	0	0	0	0	108.3	P286 G287 C289 N350 A351 N380	P286-S326 PolarHBondContact O-OG 3.11Å; G287-S326 WeakPolarHBondContact CA-OG 3.3Å; G287-S326 PolarHBondContact O-OG 2.96Å; C289-S326 PolarHBondContact N-OG 2.93Å; S326-N350 CarbonylContact O-C 3.49Å; S326-A351 PolarHBondContact O-N 3.34Å; S326-N380 WeakPolarHBondContact CA-OD1 3.47Å
327	F	93.1	Very high	71.4	Confident	20 Å²	20	48.7 Å²	48.7	9%	0.088	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	120.9	-180	-69	-67.5	0	0	0	111.6	D325 L348 L349 N350 Y377 P378 N380 Q381	D325-F327 HydrophobicContact CB-CD2 4.1Å; D325-F327 HydrophobicContact CB-CE2 3.47Å; D325-F327 VanDerWaalsContact CB-CE2 3.47Å; D325-F327 HydrophobicContact CB-CZ 3.75Å; F327-L348 HydrophobicContact CB-CD1 3.92Å; F327-L348 HydrophobicContact CD1-CD1 3.76Å; F327-L348 HydrophobicContact CD1-CD2 4.05Å; F327-L348 HydrophobicContact CD1-CG 3.97Å; F327-L348 HydrophobicContact CE1-CD2 4.21Å; F327-L348 HydrophobicContact CG-CD1 4.13Å; F327-L349 CarbonylContact C-O 3.6Å; F327-L349 VanDerWaalsContact CA-O 3.31Å; F327-L349 WeakPolarHBondContact CA-O 3.48Å; F327-N350 HydrophobicContact CD1-CB 4.03Å; F327-N350 HydrophobicContact CE1-CB 3.72Å; F327-Y377 HydrophobicContact CE1-CD1 4.18Å; F327-Y377 HydrophobicContact CZ-CD1 4.12Å; F327-P378 WeakPolarHBondContact CD2-O 3.14Å; F327-N380 PolarHBondContact N-OD1 2.83Å; F327-N380 PolarHBondContact O-N 3.46Å; F327-Q381 PolarHBondContact O-N 3.4Å
328	L	95.4	Very high	73.6	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	120.5	166.4	177.7	68	0	0	0	108.4	T288 L348 L349 Q381 L383 L489 Y492	T288-L328 HydrophobicContact CG2-CD2 4.1Å; L328-L348 WeakPolarHBondContact O-CA 3.38Å; L328-L349 HydrophobicContact CB-CB 4.25Å; L328-L349 HydrophobicContact CB-CD2 4.48Å; L328-L349 HydrophobicContact CD2-CD2 4.28Å; L328-L349 PolarHBondContact N-O 3.13Å; L328-L349 PolarHBondContact O-N 3.01Å; L328-Q381 HydrophobicContact CD1-CB 3.87Å; L328-Q381 HydrophobicContact CD1-CG 4.01Å; L328-L383 HydrophobicContact CD1-CD1 4.04Å; L328-L383 HydrophobicContact CD1-CD2 3.97Å; L328-L383 HydrophobicContact CD1-CG 3.77Å; L328-L383 HydrophobicContact CD2-CD1 4.13Å; L328-L383 HydrophobicContact CG-CD1 4.16Å; L328-L383 HydrophobicContact CG-CG 4.34Å; L328-L489 HydrophobicContact CD2-CD2 3.79Å; L328-L489 HydrophobicContact CG-CD2 3.82Å; L328-Y492 HydrophobicContact CD1-CD1 4.24Å; L328-Y492 HydrophobicContact CD1-CE1 4.27Å; L328-Y492 HydrophobicContact CD2-CD1 3.65Å; L328-Y492 HydrophobicContact CD2-CE1 4.28Å
329	L	96.4	Very high	75.5	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.005	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	125.5	-176.8	176	61.4	0	0	0	110.5	V331 I346 G347 L348 F373 L374 P379 Q381 L382 L383	L329-V331 HydrophobicContact CD1-CG2 3.92Å; L329-V331 HydrophobicContact CD2-CG2 3.77Å; L329-V331 HydrophobicContact CG-CG2 3.6Å; L329-I346 HydrophobicContact CD1-CB 4.47Å; L329-G347 CarbonylContact C-O 3.51Å; L329-G347 WeakPolarHBondContact CA-O 3.37Å; L329-L348 HydrophobicContact CB-CD1 4.24Å; L329-L348 HydrophobicContact CD1-CB 4.35Å; L329-L348 HydrophobicContact CD1-CD1 4.24Å; L329-F373 HydrophobicContact CD1-CE1 3.55Å; L329-F373 HydrophobicContact CD1-CZ 3.87Å; L329-F373 HydrophobicContact CD2-CE1 3.84Å; L329-F373 HydrophobicContact CG-CE1 4.35Å; L329-L374 HydrophobicContact CD2-CD2 3.51Å; L329-P379 HydrophobicContact CB-CB 3.78Å; L329-P379 HydrophobicContact CD2-CB 4.15Å; L329-P379 HydrophobicContact CD2-CG 4.13Å; L329-Q381 PolarHBondContact N-O 3.44Å; L329-L382 HydrophobicContact CB-CD1 4.2Å; L329-L382 HydrophobicContact CD2-CD1 3.94Å; L329-L382 HydrophobicContact CG-CD1 3.95Å; L329-L382 CarbonylContact O-C 3.52Å; L329-L382 WeakPolarHBondContact O-CA 3.48Å; L329-L383 PolarHBondContact O-N 3.42Å
330	A	96.4	Very high	77.6	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	131.7	165.9	0	0	0	0	0	110	I346 G347 L383 C485 A488 L489	A330-I346 CarbonylContact O-C 3.44Å; A330-I346 WeakPolarHBondContact O-CA 3.46Å; A330-G347 PolarHBondContact N-O 3.15Å; A330-G347 PolarHBondContact O-N 2.95Å; A330-L383 WeakPolarHBondContact CA-O 3.46Å; A330-L383 HydrophobicContact CB-CB 4.11Å; A330-L383 HydrophobicContact CB-CD1 4.44Å; A330-C485 HydrophobicContact CB-CB 4.01Å; A330-A488 HydrophobicContact CB-CB 4.09Å; A330-L489 HydrophobicContact CB-CD2 4.08Å; A330-L489 HydrophobicContact CB-CG 4.07Å
331	V	94.9	Very high	79.9	Confident	7 Å²	7	53.5 Å²	53.5	4%	0.042	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	137.2	178.9	-171.7	0	0	0	0	110.6	L329 F344 G345 L382 L383 I393	L329-V331 HydrophobicContact CD1-CG2 3.92Å; L329-V331 HydrophobicContact CD2-CG2 3.77Å; L329-V331 HydrophobicContact CG-CG2 3.6Å; V331-F344 HydrophobicContact CG1-CD1 4.25Å; V331-G345 WeakPolarHBondContact CA-O 3.39Å; V331-L382 HydrophobicContact CG2-CD1 3.95Å; V331-L383 PolarHBondContact N-O 3.44Å; V331-L383 VanDerWaalsContact N-O 3.09Å; V331-I393 HydrophobicContact CB-CD1 4.47Å; V331-I393 HydrophobicContact CG1-CD1 3.77Å
332	V	93.3	Very high	82.5	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.012	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	138.5	169.8	71.5	0	0	0	0	109.9	F344 G345 F415 L481	V332-F344 WeakPolarHBondContact O-CA 3.39Å; V332-G345 PolarHBondContact N-O 2.98Å; V332-G345 PolarHBondContact O-N 3.04Å; V332-F415 HydrophobicContact CB-CE1 4.2Å; V332-F415 HydrophobicContact CB-CZ 4.05Å; V332-F415 HydrophobicContact CG2-CE1 4.4Å; V332-L481 HydrophobicContact CG1-CB 3.81Å; V332-L481 HydrophobicContact CG1-CD2 4.06Å; V332-L481 HydrophobicContact CG1-CG 4.41Å
333	E	92.4	Very high	84.9	Confident	26 Å²	26	48.4 Å²	48.4	12%	0.121	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	140.5	175.7	-176.9	178.3	159.1	0	0	109.9	F342 F344 G390 I393	E333-F342 HydrophobicContact CG-CD1 4.36Å; E333-F342 VanDerWaalsContact OE1-CD1 3.28Å; E333-F342 WeakPolarHBondContact OE1-CD1 3.32Å; E333-F342 VanDerWaalsContact OE1-CE1 3.31Å; E333-F342 WeakPolarHBondContact OE1-CE1 3.28Å; E333-F344 HydrophobicContact CB-CD1 4.23Å; E333-F344 HydrophobicContact CB-CE1 3.98Å; E333-F344 HydrophobicContact CG-CD1 4.44Å; E333-F344 HydrophobicContact CG-CE1 3.87Å; E333-G390 WeakPolarHBondContact OE2-CA 3.16Å; E333-G390 PolarHBondContact OE2-N 3.29Å; E333-I393 HydrophobicContact CB-CD1 3.64Å; E333-I393 HydrophobicContact CB-CG1 4.29Å; E333-I393 PolarHBondContact OE2-N 3.39Å
334	S	90.9	Very high	87	Confident	50 Å²	50	45.9 Å²	45.9	35%	0.35	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	165.4	170.7	-171.9	0	0	0	0	110	A343	S334-A343 PolarHBondContact N-O 3.48Å; S334-A343 PolarHBondContact O-N 2.93Å
335	H	88	Confident	88.7	Confident	170 Å²	170	43.8 Å²	43.8	79%	0.787	23%	0.231	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-74.9	128	176.3	-67.5	-61.7	0	0	0	110.8
336	G	84.7	Confident	89.7	Confident	26 Å²	26	42.6 Å²	42.6	27%	0.268	23%	0.225	S	C	.	.			trans	-94.9	-157.2	171.7	0	0	0	0	0	113	Y340 P341	G336-Y340 CarbonylContact C-O 3.59Å; G336-Y340 VanDerWaalsContact C-O 3.32Å; G336-Y340 VanDerWaalsContact CA-O 3.24Å; G336-Y340 WeakPolarHBondContact CA-O 3.36Å; G336-P341 PolarHBondContact N-O 3Å
337	D	82.1	Confident	90.2	Very high	114 Å²	114	42.6 Å²	42.6	61%	0.61	23%	0.225	S	C	*	.			trans	-88.8	176.4	-179.1	-70.8	-35.6	0	0	0	113	S339 Y340 P341	D337-S339 VanDerWaalsContact C-N 3.25Å; D337-S339 PolarHBondContact O-N 2.86Å; D337-Y340 PolarHBondContact N-O 3.42Å; D337-Y340 CarbonylContact O-C 3.47Å; D337-Y340 PolarHBondContact O-N 3.11Å; D337-P341 WeakPolarHBondContact O-CA 3.29Å
338	K	77.8	Confident	90.4	Very high	218 Å²	218	41.6 Å²	41.6	95%	0.948	22%	0.221	S	C	*	.	S	Bend	trans	-55.5	-35.9	178.3	-70.1	-176.5	179.6	176.8	0	114.1
339	S	75.7	Confident	90.4	Very high	98 Å²	98	41.6 Å²	41.6	69%	0.685	22%	0.221	S	C	*	.	S	Bend	trans	-83.2	-31.7	-179.4	-57	0	0	0	0	112.7	D337	D337-S339 VanDerWaalsContact C-N 3.25Å; D337-S339 PolarHBondContact O-N 2.86Å
340	Y	83.1	Confident	90.2	Very high	77 Å²	77	42.2 Å²	42.2	30%	0.302	22%	0.224	S	C	.	.	S	Bend	trans	-128.8	87.6	-178.3	-65.1	-78.3	0	0	0	108	G336 D337 F342 L362 D363	G336-Y340 CarbonylContact C-O 3.59Å; G336-Y340 VanDerWaalsContact C-O 3.32Å; G336-Y340 VanDerWaalsContact CA-O 3.24Å; G336-Y340 WeakPolarHBondContact CA-O 3.36Å; D337-Y340 PolarHBondContact N-O 3.42Å; D337-Y340 CarbonylContact O-C 3.47Å; D337-Y340 PolarHBondContact O-N 3.11Å; Y340-F342 PolarHBondContact O-N 2.95Å; Y340-F342 VanDerWaalsContact O-N 3.16Å; Y340-L362 HydrophobicContact CD2-CD1 4.46Å; Y340-L362 HydrophobicContact CG-CB 4.06Å; Y340-D363 CarbonylContact C-O 3.3Å; Y340-D363 VanDerWaalsContact CA-O 3.28Å; Y340-D363 WeakPolarHBondContact CA-O 3.36Å; Y340-D363 WeakPolarHBondContact CB-O 3.48Å
341	P	85.5	Confident	89.8	Confident	48 Å²	48	42.4 Å²	42.4	31%	0.312	23%	0.225	S	C	.	.			trans	-66.9	-18.6	-168.5	26.7	-35.2	0	0	0	113.6	G336 D337 D363 R365	G336-P341 PolarHBondContact N-O 3Å; D337-P341 WeakPolarHBondContact O-CA 3.29Å; P341-D363 WeakPolarHBondContact CD-O 3.49Å; P341-R365 HydrophobicContact CG-CB 4.19Å
342	F	90.5	Very high	89.2	Confident	30 Å²	30	42 Å²	42	13%	0.132	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	141.3	-178.6	-56.7	-67	0	0	0	110.7	E333 Y340 F344 L362 D363 D364 A392	E333-F342 HydrophobicContact CG-CD1 4.36Å; E333-F342 VanDerWaalsContact OE1-CD1 3.28Å; E333-F342 WeakPolarHBondContact OE1-CD1 3.32Å; E333-F342 VanDerWaalsContact OE1-CE1 3.31Å; E333-F342 WeakPolarHBondContact OE1-CE1 3.28Å; Y340-F342 PolarHBondContact O-N 2.95Å; Y340-F342 VanDerWaalsContact O-N 3.16Å; F342-F344 HydrophobicContact CB-CD2 4.45Å; F342-F344 HydrophobicContact CB-CE2 3.76Å; F342-F344 HydrophobicContact CB-CZ 3.86Å; F342-F344 HydrophobicContact CG-CE2 4.49Å; F342-F344 HydrophobicContact CG-CZ 4.26Å; F342-L362 CarbonylContact O-C 3.52Å; F342-L362 WeakPolarHBondContact O-CA 3.34Å; F342-D363 HydrophobicContact CB-CB 4.45Å; F342-D363 PolarHBondContact N-O 3.2Å; F342-D363 PolarHBondContact O-N 3.11Å; F342-D364 WeakPolarHBondContact CD2-O 3.45Å; F342-A392 HydrophobicContact CD1-CB 4.16Å; F342-A392 HydrophobicContact CE1-CB 3.79Å; F342-A392 HydrophobicContact CE2-CB 4.21Å; F342-A392 HydrophobicContact CZ-CB 3.82Å
343	A	92	Very high	88.8	Confident	7 Å²	7	42.3 Å²	42.3	6%	0.058	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	127.2	166.4	0	0	0	0	0	108	S334 L362 L481	S334-A343 PolarHBondContact N-O 3.48Å; S334-A343 PolarHBondContact O-N 2.93Å; A343-L362 HydrophobicContact CB-CD2 3.72Å; A343-L481 HydrophobicContact CB-CD1 4.16Å
344	F	94.6	Very high	88.6	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	135.3	-180	-66.3	-66	0	0	0	110.7	V331 V332 E333 F342 Q360 F361 D363 C367 L370 A392 I393	V331-F344 HydrophobicContact CG1-CD1 4.25Å; V332-F344 WeakPolarHBondContact O-CA 3.39Å; E333-F344 HydrophobicContact CB-CD1 4.23Å; E333-F344 HydrophobicContact CB-CE1 3.98Å; E333-F344 HydrophobicContact CG-CD1 4.44Å; E333-F344 HydrophobicContact CG-CE1 3.87Å; F342-F344 HydrophobicContact CB-CD2 4.45Å; F342-F344 HydrophobicContact CB-CE2 3.76Å; F342-F344 HydrophobicContact CB-CZ 3.86Å; F342-F344 HydrophobicContact CG-CE2 4.49Å; F342-F344 HydrophobicContact CG-CZ 4.26Å; F344-Q360 VanDerWaalsContact O-CA 3.29Å; F344-Q360 WeakPolarHBondContact O-CA 3.31Å; F344-F361 HydrophobicContact CB-CE2 4.06Å; F344-F361 HydrophobicContact CB-CZ 4.1Å; F344-F361 AromaticContact CD2-CE2 3.98Å; F344-F361 HydrophobicContact CD2-CE2 3.98Å; F344-F361 HydrophobicContact CG-CE2 4.48Å; F344-F361 PolarHBondContact N-O 3.37Å; F344-F361 PolarHBondContact O-N 3.43Å; F344-D363 HydrophobicContact CD2-CB 3.69Å; F344-D363 HydrophobicContact CE2-CB 3.63Å; F344-C367 HydrophobicContact CE2-CB 4.27Å; F344-C367 HydrophobicContact CZ-CB 4.48Å; F344-L370 HydrophobicContact CD1-CD2 3.97Å; F344-L370 HydrophobicContact CD2-CB 4.15Å; F344-L370 HydrophobicContact CD2-CD2 4.07Å; F344-L370 HydrophobicContact CE1-CD2 3.72Å; F344-L370 HydrophobicContact CE2-CB 4.1Å; F344-L370 HydrophobicContact CE2-CD2 3.8Å; F344-L370 HydrophobicContact CG-CD2 4.15Å; F344-L370 HydrophobicContact CZ-CD2 3.63Å; F344-A392 HydrophobicContact CZ-CB 4.34Å; F344-I393 HydrophobicContact CE1-CD1 4.21Å; F344-I393 HydrophobicContact CE1-CG1 3.97Å
345	G	94.8	Very high	88.5	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	137.2	158	0	0	0	0	0	109.3	V331 V332 G359 C485	V331-G345 WeakPolarHBondContact CA-O 3.39Å; V332-G345 PolarHBondContact N-O 2.98Å; V332-G345 PolarHBondContact O-N 3.04Å; G345-G359 WeakPolarHBondContact CA-O 3.36Å; G345-C485 PolarHBondContact O-SG 2.74Å
346	I	95.8	Very high	88.9	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	145.7	176.4	66.6	157.7	0	0	0	111.1	L329 A330 I358 G359 F361 F373 Y511	L329-I346 HydrophobicContact CD1-CB 4.47Å; A330-I346 CarbonylContact O-C 3.44Å; A330-I346 WeakPolarHBondContact O-CA 3.46Å; I346-I358 WeakPolarHBondContact O-CA 3.5Å; I346-G359 PolarHBondContact N-O 2.85Å; I346-G359 PolarHBondContact O-N 2.68Å; I346-F361 HydrophobicContact CD1-CE1 4.07Å; I346-F361 HydrophobicContact CG1-CE1 4.08Å; I346-F361 HydrophobicContact CG2-CE1 3.9Å; I346-F361 HydrophobicContact CG2-CZ 4.18Å; I346-F373 HydrophobicContact CD1-CD1 4.43Å; I346-F373 HydrophobicContact CD1-CD2 3.89Å; I346-F373 HydrophobicContact CD1-CE1 4.12Å; I346-F373 HydrophobicContact CD1-CE2 3.49Å; I346-F373 VanDerWaalsContact CD1-CE2 3.49Å; I346-F373 HydrophobicContact CD1-CG 4.32Å; I346-F373 HydrophobicContact CD1-CZ 3.63Å; I346-Y511 HydrophobicContact CD1-CD1 3.22Å; I346-Y511 HydrophobicContact CD1-CE1 3.79Å; I346-Y511 HydrophobicContact CD1-CG 3.63Å; I346-Y511 HydrophobicContact CG1-CD1 4.16Å
347	G	96.5	Very high	89.4	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	114.6	167.2	0	0	0	0	0	109.1	L329 A330 N357	L329-G347 CarbonylContact C-O 3.51Å; L329-G347 WeakPolarHBondContact CA-O 3.37Å; A330-G347 PolarHBondContact N-O 3.15Å; A330-G347 PolarHBondContact O-N 2.95Å; G347-N357 CarbonylContact C-O 3.3Å; G347-N357 WeakPolarHBondContact CA-O 3.29Å
348	L	96.7	Very high	90.1	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	114.8	-178	-179.9	74.4	0	0	0	110	F327 L328 L329 I356 N357 F373 Y377	F327-L348 HydrophobicContact CB-CD1 3.92Å; F327-L348 HydrophobicContact CD1-CD1 3.76Å; F327-L348 HydrophobicContact CD1-CD2 4.05Å; F327-L348 HydrophobicContact CD1-CG 3.97Å; F327-L348 HydrophobicContact CE1-CD2 4.21Å; F327-L348 HydrophobicContact CG-CD1 4.13Å; L328-L348 WeakPolarHBondContact O-CA 3.38Å; L329-L348 HydrophobicContact CB-CD1 4.24Å; L329-L348 HydrophobicContact CD1-CB 4.35Å; L329-L348 HydrophobicContact CD1-CD1 4.24Å; L348-I356 CarbonylContact O-C 3.58Å; L348-I356 WeakPolarHBondContact O-CA 3.48Å; L348-N357 HydrophobicContact CB-CB 4.39Å; L348-N357 PolarHBondContact N-O 2.98Å; L348-N357 PolarHBondContact O-N 3.19Å; L348-F373 HydrophobicContact CB-CZ 4.01Å; L348-F373 HydrophobicContact CD1-CZ 4.17Å; L348-F373 HydrophobicContact CD2-CE2 4.08Å; L348-F373 HydrophobicContact CD2-CZ 3.91Å; L348-F373 HydrophobicContact CG-CZ 4.25Å; L348-Y377 HydrophobicContact CD2-CD1 3.77Å; L348-Y377 HydrophobicContact CD2-CD2 4.16Å; L348-Y377 HydrophobicContact CD2-CE1 4.46Å; L348-Y377 HydrophobicContact CD2-CG 3.58Å
349	L	95.6	Very high	90.9	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	126.4	168.7	166.5	65.3	0	0	0	109.8	F327 L328 A351 I356 L489 L493 V502	F327-L349 CarbonylContact C-O 3.6Å; F327-L349 VanDerWaalsContact CA-O 3.31Å; F327-L349 WeakPolarHBondContact CA-O 3.48Å; L328-L349 HydrophobicContact CB-CB 4.25Å; L328-L349 HydrophobicContact CB-CD2 4.48Å; L328-L349 HydrophobicContact CD2-CD2 4.28Å; L328-L349 PolarHBondContact N-O 3.13Å; L328-L349 PolarHBondContact O-N 3.01Å; L349-A351 HydrophobicContact CD2-CB 4.46Å; L349-A351 HydrophobicContact CG-CB 4.46Å; L349-I356 HydrophobicContact CB-CG1 4.39Å; L349-I356 HydrophobicContact CD1-CG1 3.75Å; L349-L489 HydrophobicContact CB-CD1 4.45Å; L349-L489 HydrophobicContact CB-CD2 4.35Å; L349-L493 HydrophobicContact CD2-CD1 4.23Å; L349-L493 HydrophobicContact CD2-CD2 3.59Å; L349-L493 HydrophobicContact CD2-CG 4.31Å; L349-V502 HydrophobicContact CD1-CG1 3.46Å; L349-V502 VanDerWaalsContact CD1-CG1 3.46Å; L349-V502 HydrophobicContact CD2-CG1 4.28Å
350	N	92.1	Very high	91.8	Very high	14 Å²	14	15.8 Å²	15.8	8%	0.075	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	99	157.9	-174.1	-14.9	0	0	0	108.8	S326 F327 S352 T353 G354 K355	S326-N350 CarbonylContact O-C 3.49Å; F327-N350 HydrophobicContact CD1-CB 4.03Å; F327-N350 HydrophobicContact CE1-CB 3.72Å; N350-S352 PolarHBondContact O-N 3.33Å; N350-S352 VanDerWaalsContact OD1-CB 3.28Å; N350-S352 WeakPolarHBondContact OD1-CB 3.1Å; N350-S352 PolarHBondContact OD1-N 2.79Å; N350-T353 WeakPolarHBondContact CB-OG1 3.4Å; N350-T353 PolarHBondContact ND2-OG1 2.77Å; N350-T353 PolarHBondContact O-N 2.89Å; N350-G354 WeakPolarHBondContact O-CA 3.41Å; N350-G354 PolarHBondContact O-N 3.47Å; N350-K355 PolarHBondContact N-O 3.26Å
351	A	88.3	Confident	92.2	Very high	3 Å²	3	12.4 Å²	12.4	3%	0.025	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-23.2	-178.5	0	0	0	0	0	112.9	G287 T290 S326 L349	G287-A351 VanDerWaalsContact O-CB 3.27Å; G287-A351 WeakPolarHBondContact O-CB 3.47Å; T290-A351 WeakPolarHBondContact CA-O 3.11Å; S326-A351 PolarHBondContact O-N 3.34Å; L349-A351 HydrophobicContact CD2-CB 4.46Å; L349-A351 HydrophobicContact CG-CB 4.46Å
352	S	82.8	Confident	92.5	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-34.1	176.6	-72.8	0	0	0	0	113.2	P324 N350 R625	P324-S352 PolarHBondContact O-OG 3.19Å; N350-S352 PolarHBondContact O-N 3.33Å; N350-S352 VanDerWaalsContact OD1-CB 3.28Å; N350-S352 WeakPolarHBondContact OD1-CB 3.1Å; N350-S352 PolarHBondContact OD1-N 2.79Å; S352-R625 PolarHBondContact OG-NH2 3.41Å
353	T	84.4	Confident	92.5	Very high	8 Å²	8	11.6 Å²	11.6	5%	0.049	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110	-16	-176.1	64.9	0	0	0	0	112.8	N350 K355 E624 T628	N350-T353 WeakPolarHBondContact CB-OG1 3.4Å; N350-T353 PolarHBondContact ND2-OG1 2.77Å; N350-T353 PolarHBondContact O-N 2.89Å; T353-K355 VanDerWaalsContact C-N 3.26Å; T353-K355 PolarHBondContact OG1-N 2.85Å; T353-E624 HydrophobicContact CG2-CG 3.94Å; T353-E624 WeakPolarHBondContact CG2-OE1 3.37Å; T353-T628 PolarHBondContact O-OG1 2.93Å
354	G	87.6	Confident	92.1	Very high	3 Å²	3	11.9 Å²	11.9	3%	0.031	6%	0.06	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.1	4.5	-174.2	0	0	0	0	0	113.9	N350	N350-G354 WeakPolarHBondContact O-CA 3.41Å; N350-G354 PolarHBondContact O-N 3.47Å
355	K	90.9	Very high	91.4	Very high	73 Å²	73	20.7 Å²	20.7	32%	0.317	9%	0.093	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	128.7	-179.7	-175.9	172.3	-177.5	162.3	0	111.5	N350 T353 N357 D509	N350-K355 PolarHBondContact N-O 3.26Å; T353-K355 VanDerWaalsContact C-N 3.26Å; T353-K355 PolarHBondContact OG1-N 2.85Å; K355-N357 VanDerWaalsContact CE-OD1 3.28Å; K355-N357 WeakPolarHBondContact CE-OD1 3.32Å; K355-D509 WeakPolarHBondContact CE-OD2 3.34Å; K355-D509 IonicContact NZ-OD2 3.96Å; K355-D509 PolarHBondContact NZ-OD2 3.22Å
356	I	95.2	Very high	90.6	Very high	2 Å²	2	22.9 Å²	22.9	1%	0.01	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	126.8	174.4	-62.8	173	0	0	0	108.6	L348 L349 I358 L486 L489 V502 L503 F507 I508 D509	L348-I356 CarbonylContact O-C 3.58Å; L348-I356 WeakPolarHBondContact O-CA 3.48Å; L349-I356 HydrophobicContact CB-CG1 4.39Å; L349-I356 HydrophobicContact CD1-CG1 3.75Å; I356-I358 HydrophobicContact CG2-CG2 3.95Å; I356-L486 HydrophobicContact CG2-CD1 4.22Å; I356-L489 HydrophobicContact CG2-CD1 4.09Å; I356-V502 HydrophobicContact CD1-CG1 3.99Å; I356-V502 HydrophobicContact CG1-CG1 4.3Å; I356-L503 HydrophobicContact CD1-CD2 3.72Å; I356-F507 PolarHBondContact N-O 3.3Å; I356-I508 HydrophobicContact CB-CG1 4.28Å; I356-I508 CarbonylContact O-C 3.5Å; I356-I508 VanDerWaalsContact O-CA 3.31Å; I356-I508 WeakPolarHBondContact O-CA 3.44Å; I356-D509 PolarHBondContact O-N 2.91Å
357	N	95.5	Very high	90.1	Very high	22 Å²	22	23.2 Å²	23.2	12%	0.118	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	124.7	169.9	-55.7	-79.6	0	0	0	109.4	G347 L348 K355 D509	G347-N357 CarbonylContact C-O 3.3Å; G347-N357 WeakPolarHBondContact CA-O 3.29Å; L348-N357 HydrophobicContact CB-CB 4.39Å; L348-N357 PolarHBondContact N-O 2.98Å; L348-N357 PolarHBondContact O-N 3.19Å; K355-N357 VanDerWaalsContact CE-OD1 3.28Å; K355-N357 WeakPolarHBondContact CE-OD1 3.32Å; N357-D509 CarbonylContact C-O 3.57Å; N357-D509 VanDerWaalsContact CA-O 3.29Å; N357-D509 WeakPolarHBondContact CA-O 3.15Å
358	I	96.2	Very high	89.5	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	143.4	176	56.8	172.4	0	0	0	110.2	I346 I356 L461 M464 A482 L486 I508 D509 V510 Y511	I346-I358 WeakPolarHBondContact O-CA 3.5Å; I356-I358 HydrophobicContact CG2-CG2 3.95Å; I358-L461 HydrophobicContact CD1-CD2 3.82Å; I358-M464 HydrophobicContact CD1-CE 3.99Å; I358-M464 HydrophobicContact CD1-SD 3.69Å; I358-M464 HydrophobicContact CG1-CE 4.18Å; I358-M464 HydrophobicContact CG1-SD 4.48Å; I358-A482 HydrophobicContact CB-CB 4.43Å; I358-L486 HydrophobicContact CD1-CD2 4.42Å; I358-L486 HydrophobicContact CG2-CB 4.13Å; I358-L486 HydrophobicContact CG2-CD1 4.16Å; I358-I508 HydrophobicContact CD1-CG2 4.11Å; I358-I508 HydrophobicContact CG1-CG2 4.18Å; I358-D509 PolarHBondContact N-O 3.48Å; I358-V510 CarbonylContact O-C 3.39Å; I358-V510 WeakPolarHBondContact O-CA 3.48Å; I358-Y511 PolarHBondContact O-N 2.5Å
359	G	94.3	Very high	89.1	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160	156.4	-177.7	0	0	0	0	0	112.7	G345 I346	G345-G359 WeakPolarHBondContact CA-O 3.36Å; I346-G359 PolarHBondContact N-O 2.85Å; I346-G359 PolarHBondContact O-N 2.68Å
360	Q	94.6	Very high	88.9	Confident	45 Å²	45	25.8 Å²	25.8	21%	0.21	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	130.5	172.2	174.7	171	-35.5	0	0	108.7	F344 S477 E478 W479 L481 A482	F344-Q360 VanDerWaalsContact O-CA 3.29Å; F344-Q360 WeakPolarHBondContact O-CA 3.31Å; Q360-S477 PolarHBondContact NE2-O 2.85Å; Q360-E478 WeakPolarHBondContact CB-O 3.17Å; Q360-E478 WeakPolarHBondContact CG-O 3.45Å; Q360-E478 PolarHBondContact NE2-O 3.17Å; Q360-E478 PolarHBondContact OE1-O 3.15Å; Q360-W479 VanDerWaalsContact OE1-C 3.32Å; Q360-L481 HydrophobicContact CG-CB 4.21Å; Q360-L481 HydrophobicContact CG-CD1 4.26Å; Q360-L481 HydrophobicContact CG-CG 4.49Å; Q360-L481 VanDerWaalsContact OE1-CB 3.27Å; Q360-A482 HydrophobicContact CB-CB 4.26Å
361	F	93.3	Very high	88.7	Confident	5 Å²	5	26.8 Å²	26.8	2%	0.022	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	151.5	-179.5	56	-92.2	0	0	0	112.4	F344 I346 D363 R369 L370 Y511 P513 M516	F344-F361 HydrophobicContact CB-CE2 4.06Å; F344-F361 HydrophobicContact CB-CZ 4.1Å; F344-F361 AromaticContact CD2-CE2 3.98Å; F344-F361 HydrophobicContact CD2-CE2 3.98Å; F344-F361 HydrophobicContact CG-CE2 4.48Å; F344-F361 PolarHBondContact N-O 3.37Å; F344-F361 PolarHBondContact O-N 3.43Å; I346-F361 HydrophobicContact CD1-CE1 4.07Å; I346-F361 HydrophobicContact CG1-CE1 4.08Å; I346-F361 HydrophobicContact CG2-CE1 3.9Å; I346-F361 HydrophobicContact CG2-CZ 4.18Å; F361-D363 HydrophobicContact CD2-CB 4.48Å; F361-D363 HydrophobicContact CE2-CB 4.49Å; F361-R369 HydrophobicContact CD2-CB 3.88Å; F361-R369 HydrophobicContact CE2-CB 3.67Å; F361-L370 HydrophobicContact CE2-CB 4.43Å; F361-Y511 HydrophobicContact CD1-CD1 4.37Å; F361-Y511 HydrophobicContact CD1-CE1 4.23Å; F361-Y511 HydrophobicContact CE1-CD1 4.16Å; F361-Y511 AromaticContact CE1-CE1 3.87Å; F361-Y511 HydrophobicContact CE1-CE1 3.87Å; F361-P513 HydrophobicContact CB-CG 3.53Å; F361-P513 HydrophobicContact CD1-CG 3.68Å; F361-P513 HydrophobicContact CD2-CG 4.08Å; F361-P513 HydrophobicContact CE1-CG 4.4Å; F361-P513 HydrophobicContact CG-CG 3.49Å; F361-P513 VanDerWaalsContact CG-CG 3.49Å; F361-M516 HydrophobicContact CB-SD 4.13Å
362	L	91.5	Very high	88.7	Confident	60 Å²	60	27.2 Å²	27.2	31%	0.314	12%	0.123	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	148.3	169.1	-61.5	-180	0	0	0	109.9	Y340 F342 A343 R369	Y340-L362 HydrophobicContact CD2-CD1 4.46Å; Y340-L362 HydrophobicContact CG-CB 4.06Å; F342-L362 CarbonylContact O-C 3.52Å; F342-L362 WeakPolarHBondContact O-CA 3.34Å; A343-L362 HydrophobicContact CB-CD2 3.72Å; L362-R369 WeakPolarHBondContact O-CD 3.34Å; L362-R369 PolarHBondContact O-NH1 3.03Å
363	D	89.6	Confident	89.2	Confident	2 Å²	2	27.2 Å²	27.2	1%	0.011	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	155.2	-179.3	-151.4	-9	0	0	0	112.1	Y340 P341 F342 F344 F361 C367 S368 R369 L370	Y340-D363 CarbonylContact C-O 3.3Å; Y340-D363 VanDerWaalsContact CA-O 3.28Å; Y340-D363 WeakPolarHBondContact CA-O 3.36Å; Y340-D363 WeakPolarHBondContact CB-O 3.48Å; P341-D363 WeakPolarHBondContact CD-O 3.49Å; F342-D363 HydrophobicContact CB-CB 4.45Å; F342-D363 PolarHBondContact N-O 3.2Å; F342-D363 PolarHBondContact O-N 3.11Å; F344-D363 HydrophobicContact CD2-CB 3.69Å; F344-D363 HydrophobicContact CE2-CB 3.63Å; F361-D363 HydrophobicContact CD2-CB 4.48Å; F361-D363 HydrophobicContact CE2-CB 4.49Å; D363-C367 VanDerWaalsContact CG-CA 3.49Å; D363-C367 WeakPolarHBondContact OD2-CA 3.13Å; D363-S368 PolarHBondContact OD1-N 3.36Å; D363-S368 VanDerWaalsContact OD1-N 3.11Å; D363-R369 PolarHBondContact OD1-N 3.17Å; D363-R369 PolarHBondContact OD2-N 3.38Å; D363-L370 WeakPolarHBondContact OD2-CB 3.26Å; D363-L370 PolarHBondContact OD2-N 3Å
364	D	83.7	Confident	89.4	Confident	13 Å²	13	27.7 Å²	27.7	7%	0.07	13%	0.125	C	C	.	.			trans	-76.8	174.1	-178.1	72.1	12	0	0	0	111.7	F342 H366 C367 S368 H1013	F342-D364 WeakPolarHBondContact CD2-O 3.45Å; D364-H366 PolarHBondContact O-N 2.85Å; D364-H366 WeakPolarHBondContact OD1-CA 3.39Å; D364-H366 WeakPolarHBondContact OD1-CB 3.27Å; D364-H366 PolarHBondContact OD1-N 2.89Å; D364-C367 PolarHBondContact O-N 3.31Å; D364-C367 PolarHBondContact OD1-N 3.23Å; D364-S368 VanDerWaalsContact CG-OG 3.29Å; D364-S368 PolarHBondContact OD1-N 3.43Å; D364-S368 PolarHBondContact OD1-OG 3.44Å; D364-S368 VanDerWaalsContact OD2-CB 3.31Å; D364-S368 WeakPolarHBondContact OD2-CB 3.38Å; D364-S368 PolarHBondContact OD2-OG 2.78Å; D364-H1013 IonicContact OD2-CE1 3.86Å; D364-H1013 PolarHBondContact OD2-CE1 2.83Å
365	R	80.7	Confident	89.3	Confident	185 Å²	185	28.4 Å²	28.4	70%	0.698	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-15.5	178.7	71.3	-178.2	-64.7	-149.3	0.9	114.9	P341	P341-R365 HydrophobicContact CG-CB 4.19Å
366	H	77.5	Confident	89.2	Confident	46 Å²	46	25.4 Å²	25.4	21%	0.213	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-1.9	-177.8	-59.9	-58.8	0	0	0	112.4	D364 S368 R371 S1005	D364-H366 PolarHBondContact O-N 2.85Å; D364-H366 WeakPolarHBondContact OD1-CA 3.39Å; D364-H366 WeakPolarHBondContact OD1-CB 3.27Å; D364-H366 PolarHBondContact OD1-N 2.89Å; H366-S368 VanDerWaalsContact C-N 3.27Å; H366-S368 PolarHBondContact O-N 2.69Å; H366-R371 PolarHBondContact O-NE 3.47Å; H366-S1005 PolarHBondContact CE1-OG 2.7Å; H366-S1005 PolarHBondContact ND1-OG 3.14Å; H366-S1005 VanDerWaalsContact ND1-OG 3.08Å; H366-S1005 PolarHBondContact NE2-OG 2.93Å
367	C	85.8	Confident	88.9	Confident	6 Å²	6	27.8 Å²	27.8	4%	0.041	13%	0.126	C	C	.	.			trans	54.7	43.1	-173.5	-50	0	0	0	0	111.9	F344 D363 D364 R369 L370 R371 L396	F344-C367 HydrophobicContact CE2-CB 4.27Å; F344-C367 HydrophobicContact CZ-CB 4.48Å; D363-C367 VanDerWaalsContact CG-CA 3.49Å; D363-C367 WeakPolarHBondContact OD2-CA 3.13Å; D364-C367 PolarHBondContact O-N 3.31Å; D364-C367 PolarHBondContact OD1-N 3.23Å; C367-R369 VanDerWaalsContact C-N 3.31Å; C367-R369 PolarHBondContact O-N 3.21Å; C367-L370 HydrophobicContact CB-CB 4.26Å; C367-L370 PolarHBondContact O-N 3.15Å; C367-R371 WeakPolarHBondContact O-CB 3.41Å; C367-R371 VanDerWaalsContact O-CG 3.31Å; C367-R371 WeakPolarHBondContact O-CG 3.43Å; C367-R371 PolarHBondContact O-N 3.22Å; C367-L396 HydrophobicContact CB-CD1 4.15Å
368	S	83	Confident	88.5	Confident	20 Å²	20	28.5 Å²	28.5	14%	0.14	13%	0.132	C	C	.	.	H	α-helix	trans	-58	-41	-174.4	-65.4	0	0	0	0	112.5	D363 D364 H366 T372	D363-S368 PolarHBondContact OD1-N 3.36Å; D363-S368 VanDerWaalsContact OD1-N 3.11Å; D364-S368 VanDerWaalsContact CG-OG 3.29Å; D364-S368 PolarHBondContact OD1-N 3.43Å; D364-S368 PolarHBondContact OD1-OG 3.44Å; D364-S368 VanDerWaalsContact OD2-CB 3.31Å; D364-S368 WeakPolarHBondContact OD2-CB 3.38Å; D364-S368 PolarHBondContact OD2-OG 2.78Å; H366-S368 VanDerWaalsContact C-N 3.27Å; H366-S368 PolarHBondContact O-N 2.69Å; S368-T372 WeakPolarHBondContact O-CB 3.47Å; S368-T372 PolarHBondContact O-N 3.02Å; S368-T372 PolarHBondContact O-OG1 2.97Å
369	R	88.9	Confident	88.3	Confident	29 Å²	29	29 Å²	29	11%	0.109	14%	0.135	C	C	.	.	H	α-helix	trans	-70.4	-45	179.6	-70.6	173.9	171.2	165.4	1.4	111.5	F361 L362 D363 C367 R371 T372 F373 P513 D515	F361-R369 HydrophobicContact CD2-CB 3.88Å; F361-R369 HydrophobicContact CE2-CB 3.67Å; L362-R369 WeakPolarHBondContact O-CD 3.34Å; L362-R369 PolarHBondContact O-NH1 3.03Å; D363-R369 PolarHBondContact OD1-N 3.17Å; D363-R369 PolarHBondContact OD2-N 3.38Å; C367-R369 VanDerWaalsContact C-N 3.31Å; C367-R369 PolarHBondContact O-N 3.21Å; R369-R371 PolarHBondContact O-N 3.45Å; R369-T372 PolarHBondContact O-N 3.25Å; R369-F373 WeakPolarHBondContact O-CB 3.44Å; R369-F373 PolarHBondContact O-N 3.26Å; R369-P513 HydrophobicContact CG-CB 4.31Å; R369-D515 IonicContact CZ-OD1 3.56Å; R369-D515 IonicContact CZ-OD2 2.86Å; R369-D515 VanDerWaalsContact NE-CG 3.33Å; R369-D515 IonicContact NE-OD1 3.13Å; R369-D515 PolarHBondContact NE-OD1 2.81Å; R369-D515 VanDerWaalsContact NE-OD1 3.1Å; R369-D515 IonicContact NE-OD2 3.89Å; R369-D515 PolarHBondContact NE-OD2 3.2Å; R369-D515 IonicContact NH2-OD1 3.33Å; R369-D515 IonicContact NH2-OD2 2.79Å; R369-D515 PolarHBondContact NH2-OD2 3.36Å
370	L	91	Very high	88.2	Confident	5 Å²	5	31.6 Å²	31.6	3%	0.026	15%	0.149	C	C	.	.	H	α-helix	trans	-63.1	-41.6	177.7	-179.5	56.9	0	0	0	111.7	F344 F361 D363 C367 F373 L374 L396	F344-L370 HydrophobicContact CD1-CD2 3.97Å; F344-L370 HydrophobicContact CD2-CB 4.15Å; F344-L370 HydrophobicContact CD2-CD2 4.07Å; F344-L370 HydrophobicContact CE1-CD2 3.72Å; F344-L370 HydrophobicContact CE2-CB 4.1Å; F344-L370 HydrophobicContact CE2-CD2 3.8Å; F344-L370 HydrophobicContact CG-CD2 4.15Å; F344-L370 HydrophobicContact CZ-CD2 3.63Å; F361-L370 HydrophobicContact CE2-CB 4.43Å; D363-L370 WeakPolarHBondContact OD2-CB 3.26Å; D363-L370 PolarHBondContact OD2-N 3Å; C367-L370 HydrophobicContact CB-CB 4.26Å; C367-L370 PolarHBondContact O-N 3.15Å; L370-F373 HydrophobicContact CD1-CD1 4.29Å; L370-F373 WeakPolarHBondContact O-CB 3.46Å; L370-F373 PolarHBondContact O-N 3.28Å; L370-L374 HydrophobicContact CD1-CG 4.42Å; L370-L374 HydrophobicContact CG-CD1 4.36Å; L370-L374 VanDerWaalsContact O-CG 3.3Å; L370-L374 WeakPolarHBondContact O-CG 3.22Å; L370-L374 PolarHBondContact O-N 3.15Å; L370-L396 HydrophobicContact CD2-CD1 3.36Å; L370-L396 HydrophobicContact CG-CD1 3.97Å
371	R	87.8	Confident	88.1	Confident	35 Å²	35	29.5 Å²	29.5	13%	0.132	14%	0.14	C	C	.	.	H	α-helix	trans	-62.9	-43.2	175	-73	178.1	-178.1	-77.6	0.1	112.2	H366 C367 R369 F373 L374 S375 L396 N542	H366-R371 PolarHBondContact O-NE 3.47Å; C367-R371 WeakPolarHBondContact O-CB 3.41Å; C367-R371 VanDerWaalsContact O-CG 3.31Å; C367-R371 WeakPolarHBondContact O-CG 3.43Å; C367-R371 PolarHBondContact O-N 3.22Å; R369-R371 PolarHBondContact O-N 3.45Å; R371-F373 VanDerWaalsContact C-N 3.34Å; R371-L374 PolarHBondContact O-N 3.32Å; R371-S375 PolarHBondContact O-N 2.92Å; R371-S375 PolarHBondContact O-OG 2.86Å; R371-L396 HydrophobicContact CG-CD2 3.65Å; R371-N542 HydrophobicContact CB-CB 4.08Å
372	T	89	Confident	88.1	Confident	12 Å²	12	29.5 Å²	29.5	7%	0.074	14%	0.14	C	C	.	.	H	α-helix	trans	-62.1	-45	177	-56.7	0	0	0	0	110.4	S368 R369 L374 S375 H376	S368-T372 WeakPolarHBondContact O-CB 3.47Å; S368-T372 PolarHBondContact O-N 3.02Å; S368-T372 PolarHBondContact O-OG1 2.97Å; R369-T372 PolarHBondContact O-N 3.25Å; T372-L374 PolarHBondContact O-N 3.31Å; T372-S375 PolarHBondContact O-N 2.76Å; T372-S375 PolarHBondContact O-OG 2.81Å; T372-H376 PolarHBondContact O-CD2 3.35Å; T372-H376 PolarHBondContact O-N 2.81Å; T372-H376 VanDerWaalsContact O-N 3.11Å
373	F	92	Very high	88.2	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-55.1	-50.3	173.3	171.8	-100.9	0	0	0	112.8	L329 I346 L348 R369 L370 R371 S375 H376 Y377 Y511	L329-F373 HydrophobicContact CD1-CE1 3.55Å; L329-F373 HydrophobicContact CD1-CZ 3.87Å; L329-F373 HydrophobicContact CD2-CE1 3.84Å; L329-F373 HydrophobicContact CG-CE1 4.35Å; I346-F373 HydrophobicContact CD1-CD1 4.43Å; I346-F373 HydrophobicContact CD1-CD2 3.89Å; I346-F373 HydrophobicContact CD1-CE1 4.12Å; I346-F373 HydrophobicContact CD1-CE2 3.49Å; I346-F373 VanDerWaalsContact CD1-CE2 3.49Å; I346-F373 HydrophobicContact CD1-CG 4.32Å; I346-F373 HydrophobicContact CD1-CZ 3.63Å; L348-F373 HydrophobicContact CB-CZ 4.01Å; L348-F373 HydrophobicContact CD1-CZ 4.17Å; L348-F373 HydrophobicContact CD2-CE2 4.08Å; L348-F373 HydrophobicContact CD2-CZ 3.91Å; L348-F373 HydrophobicContact CG-CZ 4.25Å; R369-F373 WeakPolarHBondContact O-CB 3.44Å; R369-F373 PolarHBondContact O-N 3.26Å; L370-F373 HydrophobicContact CD1-CD1 4.29Å; L370-F373 WeakPolarHBondContact O-CB 3.46Å; L370-F373 PolarHBondContact O-N 3.28Å; R371-F373 VanDerWaalsContact C-N 3.34Å; F373-S375 VanDerWaalsContact C-N 3.26Å; F373-S375 PolarHBondContact O-N 3.03Å; F373-H376 PolarHBondContact O-N 2.76Å; F373-H376 VanDerWaalsContact O-N 3.16Å; F373-Y377 AromaticContact CD2-CD2 3.62Å; F373-Y377 HydrophobicContact CD2-CD2 3.62Å; F373-Y377 HydrophobicContact CD2-CE2 4.18Å; F373-Y377 AromaticContact CE2-CD2 3.49Å; F373-Y377 HydrophobicContact CE2-CD2 3.49Å; F373-Y377 VanDerWaalsContact CE2-CD2 3.49Å; F373-Y377 HydrophobicContact CE2-CE2 4.14Å; F373-Y377 HydrophobicContact CE2-CG 4.21Å; F373-Y377 HydrophobicContact CZ-CD2 4.3Å; F373-Y377 PolarHBondContact O-N 3Å; F373-Y511 HydrophobicContact CB-CE1 4.49Å; F373-Y511 HydrophobicContact CD2-CD1 4.3Å; F373-Y511 HydrophobicContact CD2-CD2 4.06Å; F373-Y511 AromaticContact CD2-CE1 3.77Å; F373-Y511 HydrophobicContact CD2-CE1 3.77Å; F373-Y511 AromaticContact CD2-CE2 3.53Å; F373-Y511 HydrophobicContact CD2-CE2 3.53Å; F373-Y511 HydrophobicContact CD2-CG 4.41Å; F373-Y511 AromaticContact CD2-CZ 3.35Å; F373-Y511 HydrophobicContact CE2-CD2 4.09Å; F373-Y511 HydrophobicContact CE2-CE1 4.43Å; F373-Y511 HydrophobicContact CE2-CE2 4.02Å; F373-Y511 HydrophobicContact CE2-CG 4.34Å; F373-Y511 HydrophobicContact CG-CE1 4.37Å
374	L	90	Very high	88.4	Confident	19 Å²	19	26.7 Å²	26.7	10%	0.099	13%	0.125	C	C	.	.	H	α-helix	trans	-62.3	-31.9	179.5	-69.6	171.2	0	0	0	113.1	L329 L370 R371 T372 Y377 P378 P379 L401	L329-L374 HydrophobicContact CD2-CD2 3.51Å; L370-L374 HydrophobicContact CD1-CG 4.42Å; L370-L374 HydrophobicContact CG-CD1 4.36Å; L370-L374 VanDerWaalsContact O-CG 3.3Å; L370-L374 WeakPolarHBondContact O-CG 3.22Å; L370-L374 PolarHBondContact O-N 3.15Å; R371-L374 PolarHBondContact O-N 3.32Å; T372-L374 PolarHBondContact O-N 3.31Å; L374-Y377 CarbonylContact O-C 3.54Å; L374-Y377 VanDerWaalsContact O-C 3.31Å; L374-P378 WeakPolarHBondContact O-CA 3.44Å; L374-P379 HydrophobicContact CD2-CG 4.02Å; L374-L401 HydrophobicContact CD1-CD1 4.02Å; L374-L401 HydrophobicContact CD1-CG 4.47Å; L374-L401 HydrophobicContact CD2-CD1 4.03Å; L374-L401 HydrophobicContact CD2-CD2 4.35Å
375	S	85.3	Confident	88.7	Confident	18 Å²	18	26.5 Å²	26.5	13%	0.126	12%	0.124	C	C	.	.	H	α-helix	trans	-73.1	-32.8	176.7	67.9	0	0	0	0	112.9	R371 T372 F373 N542 L545	R371-S375 PolarHBondContact O-N 2.92Å; R371-S375 PolarHBondContact O-OG 2.86Å; T372-S375 PolarHBondContact O-N 2.76Å; T372-S375 PolarHBondContact O-OG 2.81Å; F373-S375 VanDerWaalsContact C-N 3.26Å; F373-S375 PolarHBondContact O-N 3.03Å; S375-N542 WeakPolarHBondContact CB-OD1 3.2Å; S375-L545 WeakPolarHBondContact OG-CD1 3.44Å
376	H	87.6	Confident	88.9	Confident	10 Å²	10	19.8 Å²	19.8	5%	0.046	10%	0.098	C	C	.	.	H	α-helix	trans	-73.7	-46.9	175.3	-73.1	-146.3	0	0	0	110.3	T372 F373 P378 I514 R580 T584	T372-H376 PolarHBondContact O-CD2 3.35Å; T372-H376 PolarHBondContact O-N 2.81Å; T372-H376 VanDerWaalsContact O-N 3.11Å; F373-H376 PolarHBondContact O-N 2.76Å; F373-H376 VanDerWaalsContact O-N 3.16Å; H376-P378 WeakPolarHBondContact O-CD 3.41Å; H376-I514 WeakPolarHBondContact CE1-CD1 3.27Å; H376-R580 PolarHBondContact O-NH2 3.16Å; H376-T584 PolarHBondContact CE1-O 3.27Å; H376-T584 PolarHBondContact NE2-O 3.23Å
377	Y	89.9	Confident	89.1	Confident	51 Å²	51	21.4 Å²	21.4	20%	0.2	13%	0.128	C	C	.	.	S	Bend	trans	-120.1	80.3	-175.9	-52.3	-76.3	0	0	0	110.5	F327 L348 F373 L374 P379 Y511	F327-Y377 HydrophobicContact CE1-CD1 4.18Å; F327-Y377 HydrophobicContact CZ-CD1 4.12Å; L348-Y377 HydrophobicContact CD2-CD1 3.77Å; L348-Y377 HydrophobicContact CD2-CD2 4.16Å; L348-Y377 HydrophobicContact CD2-CE1 4.46Å; L348-Y377 HydrophobicContact CD2-CG 3.58Å; F373-Y377 AromaticContact CD2-CD2 3.62Å; F373-Y377 HydrophobicContact CD2-CD2 3.62Å; F373-Y377 HydrophobicContact CD2-CE2 4.18Å; F373-Y377 AromaticContact CE2-CD2 3.49Å; F373-Y377 HydrophobicContact CE2-CD2 3.49Å; F373-Y377 VanDerWaalsContact CE2-CD2 3.49Å; F373-Y377 HydrophobicContact CE2-CE2 4.14Å; F373-Y377 HydrophobicContact CE2-CG 4.21Å; F373-Y377 HydrophobicContact CZ-CD2 4.3Å; F373-Y377 PolarHBondContact O-N 3Å; L374-Y377 CarbonylContact O-C 3.54Å; L374-Y377 VanDerWaalsContact O-C 3.31Å; Y377-P379 VanDerWaalsContact O-CD 3.31Å; Y377-P379 WeakPolarHBondContact O-CD 3.37Å; Y377-Y511 HydrophobicContact CE2-CD2 4.44Å; Y377-Y511 HydrophobicContact CE2-CE2 4.04Å
378	P	87.6	Confident	88.6	Confident	38 Å²	38	23.8 Å²	23.8	25%	0.247	14%	0.142	C	C	.	.			trans	-66.3	118.6	179.4	26.9	-33.7	0	0	0	109.6	F327 L374 H376 R580	F327-P378 WeakPolarHBondContact CD2-O 3.14Å; L374-P378 WeakPolarHBondContact O-CA 3.44Å; H376-P378 WeakPolarHBondContact O-CD 3.41Å; P378-R580 VanDerWaalsContact CD-NH2 3.27Å
379	P	91.8	Very high	88.1	Confident	9 Å²	9	23.5 Å²	23.5	6%	0.058	14%	0.141	C	C	.	.			trans	-72.4	140.5	-179.2	30.1	-34.6	0	0	0	111	L329 L374 Y377 L401 V404	L329-P379 HydrophobicContact CB-CB 3.78Å; L329-P379 HydrophobicContact CD2-CB 4.15Å; L329-P379 HydrophobicContact CD2-CG 4.13Å; L374-P379 HydrophobicContact CD2-CG 4.02Å; Y377-P379 VanDerWaalsContact O-CD 3.31Å; Y377-P379 WeakPolarHBondContact O-CD 3.37Å; P379-L401 HydrophobicContact CG-CD1 4.32Å; P379-L401 HydrophobicContact CG-CD2 3.78Å; P379-V404 HydrophobicContact CG-CG1 4.43Å
380	N	90.8	Very high	87.6	Confident	56 Å²	56	23 Å²	23	30%	0.299	15%	0.145	S	C	.	.	S	Bend	trans	-87.7	-22.9	168.6	-60.3	81.9	0	0	0	111.4	P286 D325 S326 F327 P405	P286-N380 HydrophobicContact CB-CB 4.32Å; P286-N380 WeakPolarHBondContact O-CB 3.34Å; D325-N380 PolarHBondContact O-OD1 3.46Å; S326-N380 WeakPolarHBondContact CA-OD1 3.47Å; F327-N380 PolarHBondContact N-OD1 2.83Å; F327-N380 PolarHBondContact O-N 3.46Å; N380-P405 WeakPolarHBondContact O-CD 3.46Å
381	Q	92.6	Very high	86.9	Confident	1 Å²	1	27.4 Å²	27.4	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	145.5	174.3	-170.3	172.7	8.3	0	0	110.5	T285 F327 L328 L329 P405 E407 Y492	T285-Q381 VanDerWaalsContact CB-OE1 3.24Å; T285-Q381 PolarHBondContact OG1-OE1 3.23Å; F327-Q381 PolarHBondContact O-N 3.4Å; L328-Q381 HydrophobicContact CD1-CB 3.87Å; L328-Q381 HydrophobicContact CD1-CG 4.01Å; L329-Q381 PolarHBondContact N-O 3.44Å; Q381-P405 WeakPolarHBondContact CA-O 3.33Å; Q381-P405 HydrophobicContact CG-CB 4.41Å; Q381-P405 WeakPolarHBondContact CG-O 3.18Å; Q381-E407 VanDerWaalsContact NE2-CG 3.34Å; Q381-E407 PolarHBondContact NE2-OE1 2.91Å; Q381-Y492 PolarHBondContact NE2-OH 2.89Å
382	L	93.8	Very high	86.5	Confident	5 Å²	5	26.2 Å²	26.2	3%	0.026	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	136	-176.6	-174.7	63.1	0	0	0	110.9	L329 V331 I384 I397 L401 V404 P405 T406 E407	L329-L382 HydrophobicContact CB-CD1 4.2Å; L329-L382 HydrophobicContact CD2-CD1 3.94Å; L329-L382 HydrophobicContact CG-CD1 3.95Å; L329-L382 CarbonylContact O-C 3.52Å; L329-L382 WeakPolarHBondContact O-CA 3.48Å; V331-L382 HydrophobicContact CG2-CD1 3.95Å; L382-I384 HydrophobicContact CD1-CG1 4.48Å; L382-I384 HydrophobicContact CD2-CD1 3.66Å; L382-I384 HydrophobicContact CD2-CG1 4.05Å; L382-I384 HydrophobicContact CG-CD1 4.01Å; L382-I384 HydrophobicContact CG-CG1 3.82Å; L382-I397 HydrophobicContact CD2-CD1 4.25Å; L382-I397 HydrophobicContact CD2-CG1 3.91Å; L382-L401 HydrophobicContact CD2-CD1 4.06Å; L382-V404 HydrophobicContact CB-CG1 4.37Å; L382-P405 PolarHBondContact N-O 3.21Å; L382-T406 HydrophobicContact CB-CG2 4.2Å; L382-T406 HydrophobicContact CD2-CG2 4.04Å; L382-T406 HydrophobicContact CG-CG2 4.19Å; L382-T406 CarbonylContact O-C 3.5Å; L382-T406 WeakPolarHBondContact O-CA 3.11Å; L382-E407 PolarHBondContact O-N 3.37Å
383	L	94.2	Very high	86.3	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	125.5	173.2	-52.5	-179.1	0	0	0	109.2	L328 L329 A330 V331 E407 L409 L489 Y492	L328-L383 HydrophobicContact CD1-CD1 4.04Å; L328-L383 HydrophobicContact CD1-CD2 3.97Å; L328-L383 HydrophobicContact CD1-CG 3.77Å; L328-L383 HydrophobicContact CD2-CD1 4.13Å; L328-L383 HydrophobicContact CG-CD1 4.16Å; L328-L383 HydrophobicContact CG-CG 4.34Å; L329-L383 PolarHBondContact O-N 3.42Å; A330-L383 WeakPolarHBondContact CA-O 3.46Å; A330-L383 HydrophobicContact CB-CB 4.11Å; A330-L383 HydrophobicContact CB-CD1 4.44Å; V331-L383 PolarHBondContact N-O 3.44Å; V331-L383 VanDerWaalsContact N-O 3.09Å; L383-E407 HydrophobicContact CD2-CB 3.68Å; L383-E407 HydrophobicContact CD2-CG 3.76Å; L383-L409 HydrophobicContact CB-CD1 4.19Å; L383-L409 HydrophobicContact CD1-CD1 4.34Å; L383-L489 HydrophobicContact CD1-CD2 4.19Å; L383-Y492 HydrophobicContact CD1-CD1 4.3Å; L383-Y492 HydrophobicContact CD1-CD2 4.4Å; L383-Y492 HydrophobicContact CD1-CG 3.85Å; L383-Y492 HydrophobicContact CD2-CD1 4.25Å; L383-Y492 HydrophobicContact CD2-CD2 3.72Å; L383-Y492 HydrophobicContact CD2-CE1 4.47Å; L383-Y492 HydrophobicContact CD2-CE2 3.97Å; L383-Y492 HydrophobicContact CD2-CG 3.87Å
384	I	92.8	Very high	85.9	Confident	2 Å²	2	31.1 Å²	31.1	1%	0.01	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	144.5	-178.6	-51.8	-178.3	0	0	0	108.9	L382 A389 I393 I397 T406 E407 F408 L409	L382-I384 HydrophobicContact CD1-CG1 4.48Å; L382-I384 HydrophobicContact CD2-CD1 3.66Å; L382-I384 HydrophobicContact CD2-CG1 4.05Å; L382-I384 HydrophobicContact CG-CD1 4.01Å; L382-I384 HydrophobicContact CG-CG1 3.82Å; I384-A389 HydrophobicContact CG2-CB 4.04Å; I384-I393 HydrophobicContact CD1-CG2 3.88Å; I384-I397 HydrophobicContact CD1-CD1 3.27Å; I384-I397 HydrophobicContact CD1-CG1 4.27Å; I384-T406 HydrophobicContact CD1-CG2 3.58Å; I384-T406 HydrophobicContact CG1-CG2 3.98Å; I384-E407 PolarHBondContact N-O 3.5Å; I384-F408 HydrophobicContact CB-CD1 4.14Å; I384-F408 HydrophobicContact CB-CE1 4.28Å; I384-F408 HydrophobicContact CD1-CE1 4.17Å; I384-F408 HydrophobicContact CG2-CD1 4.41Å; I384-F408 HydrophobicContact CG2-CE1 4.41Å; I384-F408 CarbonylContact O-C 3.39Å; I384-F408 WeakPolarHBondContact O-CA 3.38Å; I384-L409 PolarHBondContact O-N 3.25Å
385	E	91.4	Very high	85.5	Confident	10 Å²	10	32.3 Å²	32.3	5%	0.047	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	128.5	169.6	178.8	-179.2	-128.7	0	0	111.2	G387 T388 P411 F415 R484	E385-G387 PolarHBondContact O-N 3.38Å; E385-T388 WeakPolarHBondContact CB-OG1 3.45Å; E385-T388 HydrophobicContact CG-CG2 4.07Å; E385-T388 VanDerWaalsContact CG-OG1 3.29Å; E385-T388 WeakPolarHBondContact CG-OG1 3.2Å; E385-T388 PolarHBondContact O-N 3.5Å; E385-T388 PolarHBondContact O-OG1 3.21Å; E385-T388 WeakPolarHBondContact OE2-CB 3.44Å; E385-T388 VanDerWaalsContact OE2-CG2 3.24Å; E385-T388 WeakPolarHBondContact OE2-CG2 2.88Å; E385-T388 PolarHBondContact OE2-OG1 2.87Å; E385-P411 HydrophobicContact CG-CB 4.12Å; E385-P411 HydrophobicContact CG-CG 3.77Å; E385-F415 HydrophobicContact CB-CB 4.12Å; E385-F415 HydrophobicContact CB-CD1 4.02Å; E385-F415 HydrophobicContact CB-CD2 3.68Å; E385-F415 HydrophobicContact CB-CE1 4.33Å; E385-F415 HydrophobicContact CB-CE2 4.03Å; E385-F415 HydrophobicContact CB-CG 3.67Å; E385-F415 HydrophobicContact CB-CZ 4.35Å; E385-F415 HydrophobicContact CG-CB 4.15Å; E385-F415 HydrophobicContact CG-CD1 4.42Å; E385-F415 HydrophobicContact CG-CG 4.16Å; E385-R484 IonicContact OE1-CZ 3.82Å; E385-R484 IonicContact OE1-NH2 2.79Å; E385-R484 PolarHBondContact OE1-NH2 2.58Å; E385-R484 IonicContact OE2-CZ 3.1Å; E385-R484 IonicContact OE2-NH2 2.74Å; E385-R484 PolarHBondContact OE2-NH2 3.37Å
386	R	84.1	Confident	85.3	Confident	43 Å²	43	31.7 Å²	31.7	16%	0.162	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	134.9	-178.4	-171.7	-177	-71.5	-176.3	-4.7	110.7	P159 Y161 T388 F408 L409 P411	P159-R386 PolarHBondContact O-NH1 2.98Å; Y161-R386 PolarHBondContact O-NH1 2.95Å; Y161-R386 PolarHBondContact O-NH2 2.89Å; Y161-R386 VanDerWaalsContact O-NH2 3.08Å; R386-T388 PolarHBondContact O-N 3.06Å; R386-F408 HydrophobicContact CB-CB 4.3Å; R386-F408 HydrophobicContact CG-CB 4.47Å; R386-L409 WeakPolarHBondContact CB-O 3.42Å; R386-L409 PolarHBondContact N-O 2.94Å; R386-P411 WeakPolarHBondContact O-CG 3.45Å
387	G	80.8	Confident	85	Confident	81 Å²	81	32.8 Å²	32.8	84%	0.835	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	78	-9	177.2	0	0	0	0	0	115.4	E385	E385-G387 PolarHBondContact O-N 3.38Å
388	T	75.6	Confident	84.5	Confident	56 Å²	56	36.1 Å²	36.1	34%	0.344	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	-1.1	179.8	61.7	0	0	0	0	114	E385 R386 G390	E385-T388 WeakPolarHBondContact CB-OG1 3.45Å; E385-T388 HydrophobicContact CG-CG2 4.07Å; E385-T388 VanDerWaalsContact CG-OG1 3.29Å; E385-T388 WeakPolarHBondContact CG-OG1 3.2Å; E385-T388 PolarHBondContact O-N 3.5Å; E385-T388 PolarHBondContact O-OG1 3.21Å; E385-T388 WeakPolarHBondContact OE2-CB 3.44Å; E385-T388 VanDerWaalsContact OE2-CG2 3.24Å; E385-T388 WeakPolarHBondContact OE2-CG2 2.88Å; E385-T388 PolarHBondContact OE2-OG1 2.87Å; R386-T388 PolarHBondContact O-N 3.06Å; T388-G390 PolarHBondContact O-N 3.2Å
389	A	74	Confident	83.9	Confident	13 Å²	13	36 Å²	36	11%	0.107	22%	0.22	C	C	.	.			trans	-60.2	101.1	172.1	0	0	0	0	0	110	I384 I393 K394	I384-A389 HydrophobicContact CG2-CB 4.04Å; A389-I393 HydrophobicContact CB-CG2 4.29Å; A389-K394 HydrophobicContact CB-CG 3.98Å; A389-K394 VanDerWaalsContact O-CE 3.22Å; A389-K394 WeakPolarHBondContact O-CE 3.42Å
390	G	76.9	Confident	83.1	Confident	20 Å²	20	38.5 Å²	38.5	21%	0.206	24%	0.237	C	C	.	.			trans	-68.4	173.9	177.6	0	0	0	0	0	111.9	E333 T388 A392 I393 K394	E333-G390 WeakPolarHBondContact OE2-CA 3.16Å; E333-G390 PolarHBondContact OE2-N 3.29Å; T388-G390 PolarHBondContact O-N 3.2Å; G390-A392 PolarHBondContact O-N 3.49Å; G390-A392 VanDerWaalsContact O-N 3.16Å; G390-I393 PolarHBondContact O-N 3.19Å; G390-K394 WeakPolarHBondContact O-CG 3.31Å; G390-K394 PolarHBondContact O-N 3.05Å
391	S	77.4	Confident	82.7	Confident	97 Å²	97	36.6 Å²	36.6	68%	0.678	23%	0.227	S	C	*	.	H	α-helix	trans	-57.9	-29.9	-179	64.9	0	0	0	0	112.8	S395	S391-S395 VanDerWaalsContact O-CB 3.26Å; S391-S395 WeakPolarHBondContact O-CB 3.41Å; S391-S395 PolarHBondContact O-N 3.18Å; S391-S395 VanDerWaalsContact O-N 3.12Å
392	A	79.5	Confident	81.9	Confident	10 Å²	10	40.5 Å²	40.5	8%	0.083	26%	0.255	C	S	.	.	H	α-helix	trans	-68	-54.9	177.9	0	0	0	0	0	111.9	F342 F344 G390 K394 S395 L396	F342-A392 HydrophobicContact CD1-CB 4.16Å; F342-A392 HydrophobicContact CE1-CB 3.79Å; F342-A392 HydrophobicContact CE2-CB 4.21Å; F342-A392 HydrophobicContact CZ-CB 3.82Å; F344-A392 HydrophobicContact CZ-CB 4.34Å; G390-A392 PolarHBondContact O-N 3.49Å; G390-A392 VanDerWaalsContact O-N 3.16Å; A392-K394 PolarHBondContact O-N 3.39Å; A392-S395 PolarHBondContact O-N 2.94Å; A392-L396 WeakPolarHBondContact O-CG 3.19Å; A392-L396 PolarHBondContact O-N 2.71Å
393	I	84.2	Confident	81.2	Confident	9 Å²	9	46 Å²	46	5%	0.046	29%	0.292	C	S	.	.	H	α-helix	trans	-61.3	-45.8	178.7	-71.7	-178.9	0	0	0	111.1	V331 E333 F344 I384 A389 G390 S395 L396 I397	V331-I393 HydrophobicContact CB-CD1 4.47Å; V331-I393 HydrophobicContact CG1-CD1 3.77Å; E333-I393 HydrophobicContact CB-CD1 3.64Å; E333-I393 HydrophobicContact CB-CG1 4.29Å; E333-I393 PolarHBondContact OE2-N 3.39Å; F344-I393 HydrophobicContact CE1-CD1 4.21Å; F344-I393 HydrophobicContact CE1-CG1 3.97Å; I384-I393 HydrophobicContact CD1-CG2 3.88Å; A389-I393 HydrophobicContact CB-CG2 4.29Å; G390-I393 PolarHBondContact O-N 3.19Å; I393-S395 VanDerWaalsContact C-N 3.28Å; I393-S395 PolarHBondContact O-N 3.39Å; I393-L396 PolarHBondContact O-N 3.24Å; I393-L396 VanDerWaalsContact O-N 3.11Å; I393-I397 HydrophobicContact CG2-CD1 3.68Å; I393-I397 HydrophobicContact CG2-CG1 4.25Å; I393-I397 VanDerWaalsContact O-CG1 3.31Å; I393-I397 WeakPolarHBondContact O-CG1 3.38Å; I393-I397 PolarHBondContact O-N 2.99Å
394	K	84.3	Confident	80.9	Confident	106 Å²	106	47.3 Å²	47.3	46%	0.461	30%	0.3	S	S	.	.	H	α-helix	trans	-57.1	-42	178	-72.1	-176.1	174.1	-171.7	0	111.8	E113 A389 G390 A392 K398	E113-K394 IonicContact OE1-NZ 3.94Å; E113-K394 PolarHBondContact OE1-NZ 2.86Å; A389-K394 HydrophobicContact CB-CG 3.98Å; A389-K394 VanDerWaalsContact O-CE 3.22Å; A389-K394 WeakPolarHBondContact O-CE 3.42Å; G390-K394 WeakPolarHBondContact O-CG 3.31Å; G390-K394 PolarHBondContact O-N 3.05Å; A392-K394 PolarHBondContact O-N 3.39Å; K394-K398 PolarHBondContact O-N 3.07Å
395	S	80.5	Confident	80.7	Confident	44 Å²	44	49.1 Å²	49.1	31%	0.308	31%	0.312	S	S	.	.	H	α-helix	trans	-66	-41.6	175.9	-178.7	0	0	0	0	112.7	S391 A392 I393 K398 T399	S391-S395 VanDerWaalsContact O-CB 3.26Å; S391-S395 WeakPolarHBondContact O-CB 3.41Å; S391-S395 PolarHBondContact O-N 3.18Å; S391-S395 VanDerWaalsContact O-N 3.12Å; A392-S395 PolarHBondContact O-N 2.94Å; I393-S395 VanDerWaalsContact C-N 3.28Å; I393-S395 PolarHBondContact O-N 3.39Å; S395-K398 PolarHBondContact O-N 3.17Å; S395-T399 WeakPolarHBondContact O-CB 3.23Å; S395-T399 PolarHBondContact O-N 3.37Å; S395-T399 PolarHBondContact O-OG1 3.46Å
396	L	80.7	Confident	80.6	Confident	5 Å²	5	50.2 Å²	50.2	3%	0.026	32%	0.319	C	S	.	.	H	α-helix	trans	-64.2	-43.2	177.9	-75.5	168.9	0	0	0	112.5	C367 L370 R371 A392 I393 T399 S400 L401	C367-L396 HydrophobicContact CB-CD1 4.15Å; L370-L396 HydrophobicContact CD2-CD1 3.36Å; L370-L396 HydrophobicContact CG-CD1 3.97Å; R371-L396 HydrophobicContact CG-CD2 3.65Å; A392-L396 WeakPolarHBondContact O-CG 3.19Å; A392-L396 PolarHBondContact O-N 2.71Å; I393-L396 PolarHBondContact O-N 3.24Å; I393-L396 VanDerWaalsContact O-N 3.11Å; L396-T399 PolarHBondContact O-N 2.94Å; L396-S400 PolarHBondContact O-N 3.22Å; L396-L401 PolarHBondContact O-N 3.35Å
397	I	81.7	Confident	80.9	Confident	32 Å²	32	49 Å²	49	16%	0.164	32%	0.316	C	S	.	.	H	α-helix	trans	-59.2	-50	176.3	-65.1	163.3	0	0	0	110.1	L382 I384 I393 T399 L401 S402	L382-I397 HydrophobicContact CD2-CD1 4.25Å; L382-I397 HydrophobicContact CD2-CG1 3.91Å; I384-I397 HydrophobicContact CD1-CD1 3.27Å; I384-I397 HydrophobicContact CD1-CG1 4.27Å; I393-I397 HydrophobicContact CG2-CD1 3.68Å; I393-I397 HydrophobicContact CG2-CG1 4.25Å; I393-I397 VanDerWaalsContact O-CG1 3.31Å; I393-I397 WeakPolarHBondContact O-CG1 3.38Å; I393-I397 PolarHBondContact O-N 2.99Å; I397-T399 VanDerWaalsContact C-N 3.29Å; I397-T399 PolarHBondContact O-N 3.33Å; I397-L401 CarbonylContact O-C 3.43Å; I397-L401 PolarHBondContact O-N 3.08Å; I397-S402 WeakPolarHBondContact O-CA 3.32Å; I397-S402 PolarHBondContact O-N 2.99Å
398	K	79.5	Confident	81.3	Confident	121 Å²	121	48.2 Å²	48.2	53%	0.526	29%	0.289	S	S	.	.	H	α-helix	trans	-62.9	-34.2	-178.8	-169	178.8	-178	-174.2	0	113.1	K394 S395 L994	K394-K398 PolarHBondContact O-N 3.07Å; S395-K398 PolarHBondContact O-N 3.17Å; K398-L994 WeakPolarHBondContact CE-O 3.49Å; K398-L994 PolarHBondContact NZ-O 2.92Å
399	T	74.6	Confident	82	Confident	37 Å²	37	45.6 Å²	45.6	23%	0.227	27%	0.273	C	S	.	.	H	α-helix	trans	-91.6	-48.7	-171.8	-50.9	0	0	0	0	113	S395 L396 I397	S395-T399 WeakPolarHBondContact O-CB 3.23Å; S395-T399 PolarHBondContact O-N 3.37Å; S395-T399 PolarHBondContact O-OG1 3.46Å; L396-T399 PolarHBondContact O-N 2.94Å; I397-T399 VanDerWaalsContact C-N 3.29Å; I397-T399 PolarHBondContact O-N 3.33Å
400	S	74.7	Confident	82.7	Confident	61 Å²	61	46.4 Å²	46.4	43%	0.427	28%	0.277	S	S	.	.	H	α-helix	trans	-114.9	-21.6	-166.9	-60.3	0	0	0	0	113.6	L396	L396-S400 PolarHBondContact O-N 3.22Å
401	L	82.5	Confident	83.2	Confident	16 Å²	16	47.6 Å²	47.6	8%	0.084	28%	0.281	C	S	.	.			trans	-121.2	25.6	-175.7	-51.9	174.4	0	0	0	112.3	L374 P379 L382 L396 I397 C403 V404	L374-L401 HydrophobicContact CD1-CD1 4.02Å; L374-L401 HydrophobicContact CD1-CG 4.47Å; L374-L401 HydrophobicContact CD2-CD1 4.03Å; L374-L401 HydrophobicContact CD2-CD2 4.35Å; P379-L401 HydrophobicContact CG-CD1 4.32Å; P379-L401 HydrophobicContact CG-CD2 3.78Å; L382-L401 HydrophobicContact CD2-CD1 4.06Å; L396-L401 PolarHBondContact O-N 3.35Å; I397-L401 CarbonylContact O-C 3.43Å; I397-L401 PolarHBondContact O-N 3.08Å; L401-C403 PolarHBondContact O-N 3.08Å; L401-V404 HydrophobicContact CB-CB 4.15Å; L401-V404 HydrophobicContact CB-CG2 4.02Å; L401-V404 HydrophobicContact CD2-CG2 4.1Å; L401-V404 WeakPolarHBondContact O-CB 3.27Å; L401-V404 PolarHBondContact O-N 3.46Å
402	S	77.6	Confident	83.6	Confident	83 Å²	83	47.5 Å²	47.5	58%	0.58	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-25.9	-173.5	57.4	0	0	0	0	113.8	I397	I397-S402 WeakPolarHBondContact O-CA 3.32Å; I397-S402 PolarHBondContact O-N 2.99Å
403	C	78.8	Confident	84	Confident	121 Å²	121	53.4 Å²	53.4	82%	0.818	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-1.9	177.4	-58.2	0	0	0	0	113.1	L401 P405	L401-C403 PolarHBondContact O-N 3.08Å; C403-P405 WeakPolarHBondContact O-CD 3.04Å
404	V	86.8	Confident	84.2	Confident	27 Å²	27	53.3 Å²	53.3	16%	0.164	30%	0.3	C	S	.	.	S	Bend	trans	-92	121.2	-175.1	-178	0	0	0	0	109.3	P379 L382 L401 T406	P379-V404 HydrophobicContact CG-CG1 4.43Å; L382-V404 HydrophobicContact CB-CG1 4.37Å; L401-V404 HydrophobicContact CB-CB 4.15Å; L401-V404 HydrophobicContact CB-CG2 4.02Å; L401-V404 HydrophobicContact CD2-CG2 4.1Å; L401-V404 WeakPolarHBondContact O-CB 3.27Å; L401-V404 PolarHBondContact O-N 3.46Å; V404-T406 PolarHBondContact O-N 2.93Å; V404-T406 PolarHBondContact O-OG1 3.11Å
405	P	88.6	Confident	84.6	Confident	39 Å²	39	48.3 Å²	48.3	25%	0.253	28%	0.278	S	S	.	.			trans	-53.7	126.4	172.5	-26.3	35.4	0	0	0	110.9	P286 N380 Q381 L382 C403	P286-P405 HydrophobicContact CG-CG 4.27Å; N380-P405 WeakPolarHBondContact O-CD 3.46Å; Q381-P405 WeakPolarHBondContact CA-O 3.33Å; Q381-P405 HydrophobicContact CG-CB 4.41Å; Q381-P405 WeakPolarHBondContact CG-O 3.18Å; L382-P405 PolarHBondContact N-O 3.21Å; C403-P405 WeakPolarHBondContact O-CD 3.04Å
406	T	90.4	Very high	85.2	Confident	34 Å²	34	47.1 Å²	47.1	21%	0.209	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	127.7	-175.7	-59.2	0	0	0	0	110	L382 I384 V404 F408	L382-T406 HydrophobicContact CB-CG2 4.2Å; L382-T406 HydrophobicContact CD2-CG2 4.04Å; L382-T406 HydrophobicContact CG-CG2 4.19Å; L382-T406 CarbonylContact O-C 3.5Å; L382-T406 WeakPolarHBondContact O-CA 3.11Å; I384-T406 HydrophobicContact CD1-CG2 3.58Å; I384-T406 HydrophobicContact CG1-CG2 3.98Å; V404-T406 PolarHBondContact O-N 2.93Å; V404-T406 PolarHBondContact O-OG1 3.11Å; T406-F408 HydrophobicContact CG2-CE1 4.39Å; T406-F408 HydrophobicContact CG2-CE2 4.13Å; T406-F408 HydrophobicContact CG2-CZ 3.97Å
407	E	90.3	Very high	85.8	Confident	18 Å²	18	48.8 Å²	48.8	8%	0.084	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	128.2	177.6	-53.9	-60.5	153.4	0	0	110.6	H164 K249 Q381 L382 L383 I384 L409 Y492	H164-E407 IonicContact CE1-OE2 3.57Å; H164-E407 PolarHBondContact CE1-OE2 3.23Å; H164-E407 VanDerWaalsContact CE1-OE2 3.26Å; H164-E407 IonicContact NE2-OE2 3.84Å; K249-E407 WeakPolarHBondContact CE-OE1 3.35Å; K249-E407 IonicContact NZ-OE1 2.92Å; K249-E407 PolarHBondContact NZ-OE1 3.43Å; K249-E407 IonicContact NZ-OE2 2.81Å; K249-E407 PolarHBondContact NZ-OE2 3.5Å; Q381-E407 VanDerWaalsContact NE2-CG 3.34Å; Q381-E407 PolarHBondContact NE2-OE1 2.91Å; L382-E407 PolarHBondContact O-N 3.37Å; L383-E407 HydrophobicContact CD2-CB 3.68Å; L383-E407 HydrophobicContact CD2-CG 3.76Å; I384-E407 PolarHBondContact N-O 3.5Å; E407-L409 HydrophobicContact CB-CD2 4.42Å; E407-Y492 HydrophobicContact CG-CE2 4.01Å
408	F	89.8	Confident	86.3	Confident	63 Å²	63	47.6 Å²	47.6	28%	0.276	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	100	174.8	-65.1	-79	0	0	0	110.5	I384 R386 T406	I384-F408 HydrophobicContact CB-CD1 4.14Å; I384-F408 HydrophobicContact CB-CE1 4.28Å; I384-F408 HydrophobicContact CD1-CE1 4.17Å; I384-F408 HydrophobicContact CG2-CD1 4.41Å; I384-F408 HydrophobicContact CG2-CE1 4.41Å; I384-F408 CarbonylContact O-C 3.39Å; I384-F408 WeakPolarHBondContact O-CA 3.38Å; R386-F408 HydrophobicContact CB-CB 4.3Å; R386-F408 HydrophobicContact CG-CB 4.47Å; T406-F408 HydrophobicContact CG2-CE1 4.39Å; T406-F408 HydrophobicContact CG2-CE2 4.13Å; T406-F408 HydrophobicContact CG2-CZ 3.97Å
409	L	90.2	Very high	86.9	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	136.9	-177	-59.2	-176.1	0	0	0	111.5	L383 I384 R386 E407 Q414 F415 A488 Y491	L383-L409 HydrophobicContact CB-CD1 4.19Å; L383-L409 HydrophobicContact CD1-CD1 4.34Å; I384-L409 PolarHBondContact O-N 3.25Å; R386-L409 WeakPolarHBondContact CB-O 3.42Å; R386-L409 PolarHBondContact N-O 2.94Å; E407-L409 HydrophobicContact CB-CD2 4.42Å; L409-Q414 HydrophobicContact CB-CB 3.86Å; L409-Q414 HydrophobicContact CD2-CB 4.34Å; L409-F415 HydrophobicContact CB-CB 4.11Å; L409-F415 HydrophobicContact CB-CD2 4.18Å; L409-F415 HydrophobicContact CD1-CD2 4.16Å; L409-A488 HydrophobicContact CD1-CB 4.1Å; L409-Y491 HydrophobicContact CD1-CD1 4.3Å; L409-Y491 HydrophobicContact CD2-CD1 4.42Å; L409-Y491 HydrophobicContact CD2-CE1 4.19Å
410	T	88.8	Confident	87.7	Confident	31 Å²	31	49.3 Å²	49.3	19%	0.19	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-63.3	127.9	177.8	-52.7	0	0	0	0	111	K413 Q414 F415	T410-K413 HydrophobicContact CG2-CB 4.38Å; T410-Q414 VanDerWaalsContact CB-OE1 3.27Å; T410-Q414 PolarHBondContact O-N 2.92Å; T410-Q414 PolarHBondContact OG1-OE1 3.31Å; T410-F415 PolarHBondContact O-N 2.65Å
411	P	87	Confident	88.7	Confident	44 Å²	44	46.4 Å²	46.4	29%	0.286	26%	0.26	S	S	.	.	B	Isolated β-bridge	trans	-54.2	144.2	177.9	-25.4	32.2	0	0	0	112.5	E385 R386 K413	E385-P411 HydrophobicContact CG-CB 4.12Å; E385-P411 HydrophobicContact CG-CG 3.77Å; R386-P411 WeakPolarHBondContact O-CG 3.45Å; P411-K413 PolarHBondContact O-N 3.38Å
412	T	85.6	Confident	89.1	Confident	96 Å²	96	45.6 Å²	45.6	59%	0.589	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.1	-33.4	179.4	68.6	0	0	0	0	116.6	F415	T412-F415 VanDerWaalsContact CA-O 3.28Å; T412-F415 WeakPolarHBondContact CA-O 3.46Å; T412-F415 PolarHBondContact N-O 3.15Å
413	K	87.1	Confident	89.7	Confident	134 Å²	134	46 Å²	46	58%	0.583	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-48.9	-178.8	-174.9	-177.7	179	-172.1	0	112.3	T410 P411 W416	T410-K413 HydrophobicContact CG2-CB 4.38Å; P411-K413 PolarHBondContact O-N 3.38Å; K413-W416 PolarHBondContact O-NE1 3.2Å
414	Q	88.9	Confident	90.3	Very high	7 Å²	7	43.2 Å²	43.2	3%	0.033	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.2	-37.6	-179.1	-58.5	-178.8	-61.5	0	0	110.7	L409 T410 Y491	L409-Q414 HydrophobicContact CB-CB 3.86Å; L409-Q414 HydrophobicContact CD2-CB 4.34Å; T410-Q414 VanDerWaalsContact CB-OE1 3.27Å; T410-Q414 PolarHBondContact O-N 2.92Å; T410-Q414 PolarHBondContact OG1-OE1 3.31Å; Q414-Y491 HydrophobicContact CB-CD1 3.78Å; Q414-Y491 HydrophobicContact CB-CD2 4.41Å; Q414-Y491 HydrophobicContact CB-CE1 3.48Å; Q414-Y491 VanDerWaalsContact CB-CE1 3.48Å; Q414-Y491 HydrophobicContact CB-CE2 4.16Å; Q414-Y491 HydrophobicContact CB-CG 4.25Å; Q414-Y491 HydrophobicContact CG-CD1 4.43Å; Q414-Y491 HydrophobicContact CG-CE1 3.68Å; Q414-Y491 HydrophobicContact CG-CE2 3.96Å; Q414-Y491 VanDerWaalsContact CG-CZ 3.42Å; Q414-Y491 WeakPolarHBondContact CG-OH 3.15Å; Q414-Y491 PolarHBondContact NE2-OH 3.18Å; Q414-Y491 WeakPolarHBondContact O-CB 3.4Å; Q414-Y491 WeakPolarHBondContact O-CD1 3.46Å
415	F	92.6	Very high	90.5	Very high	1 Å²	1	42 Å²	42	0%	0.004	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-100.1	93.2	171	-151.6	-73.4	0	0	0	109.1	V332 E385 L409 T410 T412 R484 A488	V332-F415 HydrophobicContact CB-CE1 4.2Å; V332-F415 HydrophobicContact CB-CZ 4.05Å; V332-F415 HydrophobicContact CG2-CE1 4.4Å; E385-F415 HydrophobicContact CB-CB 4.12Å; E385-F415 HydrophobicContact CB-CD1 4.02Å; E385-F415 HydrophobicContact CB-CD2 3.68Å; E385-F415 HydrophobicContact CB-CE1 4.33Å; E385-F415 HydrophobicContact CB-CE2 4.03Å; E385-F415 HydrophobicContact CB-CG 3.67Å; E385-F415 HydrophobicContact CB-CZ 4.35Å; E385-F415 HydrophobicContact CG-CB 4.15Å; E385-F415 HydrophobicContact CG-CD1 4.42Å; E385-F415 HydrophobicContact CG-CG 4.16Å; L409-F415 HydrophobicContact CB-CB 4.11Å; L409-F415 HydrophobicContact CB-CD2 4.18Å; L409-F415 HydrophobicContact CD1-CD2 4.16Å; T410-F415 PolarHBondContact O-N 2.65Å; T412-F415 VanDerWaalsContact CA-O 3.28Å; T412-F415 WeakPolarHBondContact CA-O 3.46Å; T412-F415 PolarHBondContact N-O 3.15Å; F415-R484 HydrophobicContact CD1-CB 4.45Å; F415-R484 HydrophobicContact CE1-CB 3.88Å; F415-A488 HydrophobicContact CD1-CB 4.29Å; F415-A488 HydrophobicContact CD2-CB 3.46Å; F415-A488 VanDerWaalsContact CD2-CB 3.46Å; F415-A488 HydrophobicContact CE1-CB 4.24Å; F415-A488 HydrophobicContact CE2-CB 3.39Å; F415-A488 HydrophobicContact CG-CB 3.93Å; F415-A488 HydrophobicContact CZ-CB 3.81Å
416	W	94.1	Very high	90.5	Very high	19 Å²	19	43.5 Å²	43.5	7%	0.072	22%	0.22	C	C	.	.			trans	-69	153.1	-170.6	-59.9	-23.5	0	0	0	113.4	K413 N420 E424 I490 Y491	K413-W416 PolarHBondContact O-NE1 3.2Å; W416-N420 HydrophobicContact CB-CB 4.09Å; W416-E424 HydrophobicContact CD2-CG 4.27Å; W416-E424 HydrophobicContact CE3-CB 3.99Å; W416-E424 HydrophobicContact CE3-CG 3.98Å; W416-E424 HydrophobicContact CH2-CB 3.96Å; W416-E424 HydrophobicContact CH2-CG 3.93Å; W416-E424 HydrophobicContact CZ2-CG 4.2Å; W416-E424 HydrophobicContact CZ3-CB 3.54Å; W416-E424 HydrophobicContact CZ3-CG 3.8Å; W416-I490 HydrophobicContact CH2-CB 4.42Å; W416-I490 HydrophobicContact CH2-CG2 3.87Å; W416-I490 HydrophobicContact CZ3-CB 3.89Å; W416-I490 HydrophobicContact CZ3-CG2 3.64Å; W416-Y491 HydrophobicContact CZ2-CD2 4.07Å; W416-Y491 HydrophobicContact CZ2-CG 4.5Å
417	S	93	Very high	90.4	Very high	39 Å²	39	46.7 Å²	46.7	27%	0.273	24%	0.24	S	C	.	.			trans	-71.5	157.8	166.1	69.9	0	0	0	0	110.1	K419 N420 T421	S417-K419 VanDerWaalsContact C-N 3.25Å; S417-K419 PolarHBondContact O-N 3.28Å; S417-N420 PolarHBondContact O-N 2.89Å; S417-N420 WeakPolarHBondContact OG-CB 3.46Å; S417-N420 PolarHBondContact OG-N 3.47Å; S417-N420 PolarHBondContact OG-OD1 2.78Å; S417-T421 PolarHBondContact O-N 3.02Å; S417-T421 PolarHBondContact O-OG1 3.24Å; S417-T421 VanDerWaalsContact O-OG1 3.1Å
418	A	92.1	Very high	90.2	Very high	8 Å²	8	46.7 Å²	46.7	7%	0.066	24%	0.243	C	C	.	.	H	α-helix	trans	-55.2	-42.1	179.9	0	0	0	0	0	112.6	T421 V422 V475 E480 F483 R484	A418-T421 WeakPolarHBondContact O-CB 3.3Å; A418-T421 PolarHBondContact O-N 3.5Å; A418-V422 WeakPolarHBondContact O-CG2 3.4Å; A418-V422 PolarHBondContact O-N 2.94Å; A418-V422 VanDerWaalsContact O-N 3.17Å; A418-V475 HydrophobicContact CB-CB 4.41Å; A418-V475 HydrophobicContact CB-CG2 4.14Å; A418-E480 HydrophobicContact CB-CG 3.88Å; A418-F483 HydrophobicContact CB-CB 3.72Å; A418-R484 HydrophobicContact CB-CG 4.36Å
419	K	91.6	Very high	90	Very high	136 Å²	136	48.1 Å²	48.1	59%	0.591	25%	0.253	S	S	*	.	H	α-helix	trans	-61.9	-45.2	175.5	-176.7	179	178.4	178.3	0	112.3	S417 T421 V422 Q423	S417-K419 VanDerWaalsContact C-N 3.25Å; S417-K419 PolarHBondContact O-N 3.28Å; K419-T421 VanDerWaalsContact C-N 3.33Å; K419-V422 PolarHBondContact O-N 3.14Å; K419-Q423 PolarHBondContact O-N 2.91Å; K419-Q423 VanDerWaalsContact O-N 3.1Å
420	N	92.2	Very high	89.7	Confident	57 Å²	57	48.5 Å²	48.5	31%	0.305	26%	0.255	S	S	.	.	H	α-helix	trans	-64.7	-40.1	178.2	-70.6	7.5	0	0	0	110.7	W416 S417 V422 Q423 E424	W416-N420 HydrophobicContact CB-CB 4.09Å; S417-N420 PolarHBondContact O-N 2.89Å; S417-N420 WeakPolarHBondContact OG-CB 3.46Å; S417-N420 PolarHBondContact OG-N 3.47Å; S417-N420 PolarHBondContact OG-OD1 2.78Å; N420-V422 VanDerWaalsContact C-N 3.33Å; N420-V422 PolarHBondContact O-N 2.92Å; N420-Q423 PolarHBondContact O-N 2.93Å; N420-E424 WeakPolarHBondContact O-CB 3.35Å; N420-E424 VanDerWaalsContact O-CG 3.3Å; N420-E424 WeakPolarHBondContact O-CG 3.19Å; N420-E424 PolarHBondContact O-N 2.7Å
421	T	94.2	Very high	89.5	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-55.7	-46.9	175.1	-55.6	0	0	0	0	111.7	S417 A418 K419 E424 L425 F483 L486 G487 I490	S417-T421 PolarHBondContact O-N 3.02Å; S417-T421 PolarHBondContact O-OG1 3.24Å; S417-T421 VanDerWaalsContact O-OG1 3.1Å; A418-T421 WeakPolarHBondContact O-CB 3.3Å; A418-T421 PolarHBondContact O-N 3.5Å; K419-T421 VanDerWaalsContact C-N 3.33Å; T421-E424 PolarHBondContact O-N 2.67Å; T421-L425 HydrophobicContact CG2-CD1 4.2Å; T421-L425 WeakPolarHBondContact O-CB 3.39Å; T421-L425 WeakPolarHBondContact O-CG 3.48Å; T421-L425 PolarHBondContact O-N 2.93Å; T421-F483 WeakPolarHBondContact CB-O 3.39Å; T421-F483 HydrophobicContact CG2-CD1 4.29Å; T421-F483 WeakPolarHBondContact CG2-O 3.2Å; T421-F483 PolarHBondContact OG1-O 3.46Å; T421-L486 HydrophobicContact CG2-CB 4.35Å; T421-L486 HydrophobicContact CG2-CD2 4.33Å; T421-L486 HydrophobicContact CG2-CG 4.21Å; T421-G487 VanDerWaalsContact OG1-CA 3.27Å; T421-G487 WeakPolarHBondContact OG1-CA 3.22Å; T421-I490 HydrophobicContact CG2-CD1 4.06Å
422	V	91.9	Very high	88.8	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63.9	-43	178.7	178.9	0	0	0	0	111.4	A418 K419 N420 E424 L425 E426 W457 L465 G472 V475 F483	A418-V422 WeakPolarHBondContact O-CG2 3.4Å; A418-V422 PolarHBondContact O-N 2.94Å; A418-V422 VanDerWaalsContact O-N 3.17Å; K419-V422 PolarHBondContact O-N 3.14Å; N420-V422 VanDerWaalsContact C-N 3.33Å; N420-V422 PolarHBondContact O-N 2.92Å; V422-E424 PolarHBondContact O-N 2.84Å; V422-L425 PolarHBondContact O-N 3.38Å; V422-E426 WeakPolarHBondContact O-CB 3.43Å; V422-E426 PolarHBondContact O-N 3.49Å; V422-W457 HydrophobicContact CG1-CH2 3.98Å; V422-W457 HydrophobicContact CG1-CZ3 4.3Å; V422-L465 HydrophobicContact CG1-CD2 4.44Å; V422-L465 HydrophobicContact CG2-CD2 4.04Å; V422-G472 WeakPolarHBondContact CG1-O 3.49Å; V422-V475 HydrophobicContact CG2-CG2 3.63Å; V422-F483 HydrophobicContact CG2-CD1 3.76Å; V422-F483 HydrophobicContact CG2-CE1 3.69Å
423	Q	91	Very high	87.7	Confident	92 Å²	92	51.4 Å²	51.4	43%	0.43	26%	0.261	S	S	.	.	H	α-helix	trans	-64	-39.5	177.5	-177.2	176.1	-7.2	0	0	112.4	K419 N420 E426 T427	K419-Q423 PolarHBondContact O-N 2.91Å; K419-Q423 VanDerWaalsContact O-N 3.1Å; N420-Q423 PolarHBondContact O-N 2.93Å; Q423-E426 PolarHBondContact O-N 3.31Å; Q423-T427 WeakPolarHBondContact O-CB 3.35Å; Q423-T427 PolarHBondContact O-N 3.26Å; Q423-T427 PolarHBondContact O-OG1 2.85Å
424	E	90.9	Very high	86.3	Confident	61 Å²	61	53.2 Å²	53.2	29%	0.285	27%	0.271	S	S	.	.	H	α-helix	trans	-70.6	-35.1	178.2	-74.6	-64.1	158.9	0	0	112.5	W416 N420 T421 V422 A428 R494	W416-E424 HydrophobicContact CD2-CG 4.27Å; W416-E424 HydrophobicContact CE3-CB 3.99Å; W416-E424 HydrophobicContact CE3-CG 3.98Å; W416-E424 HydrophobicContact CH2-CB 3.96Å; W416-E424 HydrophobicContact CH2-CG 3.93Å; W416-E424 HydrophobicContact CZ2-CG 4.2Å; W416-E424 HydrophobicContact CZ3-CB 3.54Å; W416-E424 HydrophobicContact CZ3-CG 3.8Å; N420-E424 WeakPolarHBondContact O-CB 3.35Å; N420-E424 VanDerWaalsContact O-CG 3.3Å; N420-E424 WeakPolarHBondContact O-CG 3.19Å; N420-E424 PolarHBondContact O-N 2.7Å; T421-E424 PolarHBondContact O-N 2.67Å; V422-E424 PolarHBondContact O-N 2.84Å; E424-A428 VanDerWaalsContact O-CB 3.27Å; E424-A428 WeakPolarHBondContact O-CB 3.39Å; E424-A428 PolarHBondContact O-N 3.2Å; E424-R494 PolarHBondContact O-NH2 3.02Å; E424-R494 IonicContact OE2-CZ 3.72Å; E424-R494 IonicContact OE2-NH1 3.63Å; E424-R494 PolarHBondContact OE2-NH1 2.95Å; E424-R494 IonicContact OE2-NH2 2.8Å; E424-R494 PolarHBondContact OE2-NH2 3.47Å
425	L	90.7	Very high	84.1	Confident	2 Å²	2	59.1 Å²	59.1	1%	0.01	31%	0.308	C	S	.	.	H	α-helix	trans	-64.5	-43	171.2	-76.8	172	0	0	0	111.7	T421 V422 D429 Y430 F431 W457 L461 L486 I490	T421-L425 HydrophobicContact CG2-CD1 4.2Å; T421-L425 WeakPolarHBondContact O-CB 3.39Å; T421-L425 WeakPolarHBondContact O-CG 3.48Å; T421-L425 PolarHBondContact O-N 2.93Å; V422-L425 PolarHBondContact O-N 3.38Å; L425-D429 PolarHBondContact O-N 2.89Å; L425-Y430 HydrophobicContact CD2-CD2 3.81Å; L425-Y430 HydrophobicContact CD2-CE2 4.21Å; L425-F431 HydrophobicContact CD2-CE2 4.45Å; L425-W457 HydrophobicContact CB-CH2 3.79Å; L425-W457 HydrophobicContact CB-CZ2 3.9Å; L425-W457 HydrophobicContact CD1-CH2 4.4Å; L425-L461 HydrophobicContact CD1-CD1 4.41Å; L425-L486 HydrophobicContact CD1-CD2 4.26Å; L425-I490 HydrophobicContact CD1-CD1 4.32Å; L425-I490 HydrophobicContact CD2-CD1 3.56Å; L425-I490 HydrophobicContact CG-CD1 3.91Å
426	E	87.9	Confident	81.6	Confident	70 Å²	70	63.6 Å²	63.6	33%	0.327	34%	0.34	S	S	.	.	H	α-helix	trans	-63.9	-41.7	176	-170.9	-177	158.9	0	0	111.4	V422 Q423 W457 R473	V422-E426 WeakPolarHBondContact O-CB 3.43Å; V422-E426 PolarHBondContact O-N 3.49Å; Q423-E426 PolarHBondContact O-N 3.31Å; E426-W457 HydrophobicContact CB-CZ2 4.39Å; E426-R473 IonicContact OE1-CZ 3.39Å; E426-R473 IonicContact OE1-NE 2.59Å; E426-R473 IonicContact OE1-NH2 3.24Å; E426-R473 PolarHBondContact OE1-NH2 2.9Å; E426-R473 IonicContact OE2-CZ 3.31Å; E426-R473 IonicContact OE2-NE 3.17Å; E426-R473 PolarHBondContact OE2-NE 3.11Å; E426-R473 IonicContact OE2-NH2 3.35Å; E426-R473 PolarHBondContact OE2-NH2 2.94Å
427	T	88.6	Confident	78.7	Confident	102 Å²	102	70.6 Å²	70.6	63%	0.626	38%	0.378	S	S	*	.	H	α-helix	trans	-73.1	-37.1	-177.1	-56	0	0	0	0	112.8	Q423	Q423-T427 WeakPolarHBondContact O-CB 3.35Å; Q423-T427 PolarHBondContact O-N 3.26Å; Q423-T427 PolarHBondContact O-OG1 2.85Å
428	A	86.1	Confident	75.7	Confident	18 Å²	18	74.3 Å²	74.3	15%	0.149	40%	0.4	C	S	.	.	H	α-helix	trans	-81.7	-15.2	-175.7	0	0	0	0	0	114.6	E424 Y430 R494	E424-A428 VanDerWaalsContact O-CB 3.27Å; E424-A428 WeakPolarHBondContact O-CB 3.39Å; E424-A428 PolarHBondContact O-N 3.2Å; A428-Y430 HydrophobicContact CB-CD2 3.84Å; A428-Y430 HydrophobicContact CB-CE1 4.16Å; A428-Y430 HydrophobicContact CB-CE2 3.36Å; A428-Y430 HydrophobicContact CB-CG 4.42Å; A428-Y430 PolarHBondContact O-N 2.83Å; A428-R494 VanDerWaalsContact CB-NH2 3.26Å
429	D	85.1	Confident	72.7	Confident	93 Å²	93	80.1 Å²	80.1	50%	0.497	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	50.6	177.3	-166.1	31.9	0	0	0	113.1	L425 F431	L425-D429 PolarHBondContact O-N 2.89Å; D429-F431 PolarHBondContact O-N 3.08Å
430	Y	85.4	Confident	69.8	Low	8 Å²	8	79.6 Å²	79.6	3%	0.031	44%	0.442	C	S	.	.	S	Bend	trans	-66.7	-20.6	177.5	-65.2	-64.3	0	0	0	113.5	L425 A428 P432 I490 R494 D499 R500 L503	L425-Y430 HydrophobicContact CD2-CD2 3.81Å; L425-Y430 HydrophobicContact CD2-CE2 4.21Å; A428-Y430 HydrophobicContact CB-CD2 3.84Å; A428-Y430 HydrophobicContact CB-CE1 4.16Å; A428-Y430 HydrophobicContact CB-CE2 3.36Å; A428-Y430 HydrophobicContact CB-CG 4.42Å; A428-Y430 PolarHBondContact O-N 2.83Å; Y430-P432 VanDerWaalsContact C-CD 3.5Å; Y430-P432 VanDerWaalsContact O-CD 3.26Å; Y430-P432 WeakPolarHBondContact O-CD 3.4Å; Y430-I490 HydrophobicContact CE2-CG2 4.19Å; Y430-R494 PolarHBondContact OH-NE 3.41Å; Y430-R494 PolarHBondContact OH-NH2 3.11Å; Y430-D499 HydrophobicContact CE1-CB 4.17Å; Y430-D499 WeakPolarHBondContact CE1-OD2 3.34Å; Y430-D499 VanDerWaalsContact CZ-OD2 3.29Å; Y430-D499 PolarHBondContact OH-OD2 3.38Å; Y430-R500 HydrophobicContact CD1-CG 4.05Å; Y430-R500 HydrophobicContact CE1-CG 3.8Å; Y430-L503 HydrophobicContact CD1-CB 3.96Å; Y430-L503 HydrophobicContact CD1-CD1 3.95Å; Y430-L503 HydrophobicContact CD2-CB 4.43Å; Y430-L503 HydrophobicContact CD2-CD1 3.68Å; Y430-L503 HydrophobicContact CE1-CD1 3.8Å; Y430-L503 HydrophobicContact CE2-CD1 3.5Å; Y430-L503 HydrophobicContact CG-CB 3.9Å; Y430-L503 HydrophobicContact CG-CD1 3.89Å
431	F	84.1	Confident	66.8	Low	17 Å²	17	83.7 Å²	83.7	8%	0.075	46%	0.464	C	S	.	.	S	Bend	trans	-117.7	73.7	-175.8	-52.3	-62.4	0	0	0	109.9	L425 D429 N456 W457 P458 L461 L503 I508	L425-F431 HydrophobicContact CD2-CE2 4.45Å; D429-F431 PolarHBondContact O-N 3.08Å; F431-N456 HydrophobicContact CB-CB 4.47Å; F431-W457 AromaticContact CD2-CD1 3.63Å; F431-W457 HydrophobicContact CD2-CD2 4.48Å; F431-W457 HydrophobicContact CD2-CG 4.01Å; F431-W457 AromaticContact CD2-NE1 3.89Å; F431-P458 HydrophobicContact CE1-CG 3.97Å; F431-P458 HydrophobicContact CZ-CG 4.01Å; F431-L461 HydrophobicContact CE2-CD1 4.26Å; F431-L503 VanDerWaalsContact CE1-O 3.24Å; F431-L503 WeakPolarHBondContact CE1-O 3.44Å; F431-I508 HydrophobicContact CZ-CD1 4.2Å
432	P	71.1	Confident	63.9	Low	84 Å²	84	89.5 Å²	89.5	55%	0.545	51%	0.505	S	S	.	.			trans	-63.7	147.7	-171.3	26	-35.1	0	0	0	112.1	Y430 Q434	Y430-P432 VanDerWaalsContact C-CD 3.5Å; Y430-P432 VanDerWaalsContact O-CD 3.26Å; Y430-P432 WeakPolarHBondContact O-CD 3.4Å; P432-Q434 PolarHBondContact O-N 2.83Å
433	K	64.4	Low	60.9	Low	132 Å²	132	96.8 Å²	96.8	57%	0.574	54%	0.544	S	S	*	.			trans	-63.1	119.6	172.9	-64.5	-177.9	178.7	-175.6	0	110.4	T435 D453 N456	K433-T435 PolarHBondContact O-N 3.17Å; K433-D453 IonicContact NZ-OD1 3.57Å; K433-N456 VanDerWaalsContact CA-ND2 3.3Å; K433-N456 WeakPolarHBondContact CA-ND2 3.49Å; K433-N456 WeakPolarHBondContact CG-ND2 3.47Å
434	Q	55.9	Low	58.2	Low	171 Å²	171	100.9 Å²	100.9	80%	0.799	56%	0.563	S	S	*	*			trans	-66	106.4	170.1	-68.7	-172.7	-6	0	0	108.6	P432 S436	P432-Q434 PolarHBondContact O-N 2.83Å; Q434-S436 PolarHBondContact O-N 3.42Å
435	T	42.7	Very low	55.4	Low	131 Å²	131	104.2 Å²	104.2	80%	0.804	59%	0.587	S	S	*	*			trans	-70	93.4	164.5	42.6	0	0	0	0	108.2	K433 N437	K433-T435 PolarHBondContact O-N 3.17Å; T435-N437 PolarHBondContact O-N 3.13Å; T435-N437 VanDerWaalsContact O-N 3.14Å
436	S	40.2	Very low	52.9	Low	96 Å²	96	109 Å²	109	67%	0.671	62%	0.621	S	S	*	*			trans	-68.9	105.6	165.2	49.4	0	0	0	0	108.7	Q434	Q434-S436 PolarHBondContact O-N 3.42Å
437	N	33.3	Very low	50.8	Low	165 Å²	165	113.5 Å²	113.5	88%	0.882	64%	0.639	S	S	*	*			trans	-84.3	12.8	161	-97.7	-4.1	0	0	0	112.1	T435	T435-N437 PolarHBondContact O-N 3.13Å; T435-N437 VanDerWaalsContact O-N 3.14Å
438	T	31.4	Very low	48.6	Very low	118 Å²	118	115.4 Å²	115.4	72%	0.724	65%	0.65	S	S	*	*			trans	-107.8	101.9	176.8	18.3	0	0	0	0	110.3
439	T	28.9	Very low	47.1	Very low	129 Å²	129	116.1 Å²	116.1	79%	0.791	65%	0.654	S	S	*	*			trans	-54.4	143.7	152.9	46.8	0	0	0	0	109.7
440	V	29.7	Very low	46	Very low	125 Å²	125	115.2 Å²	115.2	76%	0.758	66%	0.655	S	S	*	*			trans	93.2	90	169.6	-162.6	0	0	0	0	115.4
441	D	29.2	Very low	45.5	Very low	143 Å²	143	115.3 Å²	115.3	77%	0.765	66%	0.656	S	S	*	*				-170.3	106.5	114.3	-95.6	-21.5	0	0	0	110.6	N443	D441-N443 PolarHBondContact O-N 2.88Å
442	S	33	Very low	44.8	Very low	122 Å²	122	118.4 Å²	118.4	85%	0.853	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	32.2	-173.4	49.4	0	0	0	0	114.9
443	N	30.1	Very low	44.8	Very low	154 Å²	154	120.1 Å²	120.1	82%	0.824	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120	3.2	-179.6	-83.9	-9	0	0	0	115.4	D441 V445	D441-N443 PolarHBondContact O-N 2.88Å; N443-V445 PolarHBondContact O-N 2.86Å; N443-V445 VanDerWaalsContact O-N 3.17Å
444	H	34	Very low	45.5	Very low	178 Å²	178	114.1 Å²	114.1	82%	0.824	66%	0.656	S	S	*	*	S	Bend	trans	-77	101.5	159.3	-94.3	-78.5	0	0	0	108.4	S446	H444-S446 VanDerWaalsContact C-N 3.34Å; H444-S446 PolarHBondContact O-N 3.46Å
445	V	31.3	Very low	46.4	Very low	130 Å²	130	111.6 Å²	111.6	79%	0.788	64%	0.644	S	S	*	*			trans	-48.1	106.8	160.4	176.1	0	0	0	0	106.1	N443 K447	N443-V445 PolarHBondContact O-N 2.86Å; N443-V445 VanDerWaalsContact O-N 3.17Å; V445-K447 VanDerWaalsContact C-N 3.26Å; V445-K447 PolarHBondContact O-N 2.99Å
446	S	38	Very low	48.2	Very low	104 Å²	104	108.6 Å²	108.6	73%	0.727	62%	0.623	S	S	*	*			trans	-58.8	96.4	172.1	-45.5	0	0	0	0	105.9	H444 V448	H444-S446 VanDerWaalsContact C-N 3.34Å; H444-S446 PolarHBondContact O-N 3.46Å; S446-V448 PolarHBondContact O-N 2.84Å
447	K	43.9	Very low	50.5	Low	163 Å²	163	105 Å²	105	71%	0.709	60%	0.595	S	S	*	*			trans	-55.1	111.5	163.9	-81.7	-179.6	177.8	176.8	0	104	V445 S449 D459	V445-K447 VanDerWaalsContact C-N 3.26Å; V445-K447 PolarHBondContact O-N 2.99Å; K447-S449 VanDerWaalsContact C-N 3.25Å; K447-S449 PolarHBondContact O-N 2.9Å; K447-D459 IonicContact NZ-OD2 2.79Å
448	V	42.4	Very low	53	Low	143 Å²	143	98 Å²	98	87%	0.867	56%	0.558	S	S	*	*			trans	-58	99.5	169.9	177.8	0	0	0	0	105	S446	S446-V448 PolarHBondContact O-N 2.84Å
449	S	54.9	Low	55.6	Low	33 Å²	33	96.9 Å²	96.9	23%	0.231	55%	0.548	C	S	.	.			trans	-69.3	136.7	176.6	69.8	0	0	0	0	106.8	K447 F451 E455	K447-S449 VanDerWaalsContact C-N 3.25Å; K447-S449 PolarHBondContact O-N 2.9Å; S449-F451 PolarHBondContact O-N 3.04Å; S449-E455 VanDerWaalsContact OG-CG 3.29Å; S449-E455 WeakPolarHBondContact OG-CG 3.11Å; S449-E455 PolarHBondContact OG-OE1 3.19Å
450	S	63	Low	58.4	Low	74 Å²	74	92.2 Å²	92.2	52%	0.517	52%	0.52	S	S	.	.	S	Bend	trans	-64.6	-16	174.7	42.2	0	0	0	0	112.5
451	F	73.2	Confident	61.3	Low	9 Å²	9	86.3 Å²	86.3	4%	0.039	48%	0.484	C	S	.	.			trans	-133.8	93.9	-174.3	-53.4	-66.4	0	0	0	111.6	S449 D453 K454 L462 L465 S466 D469 G472	S449-F451 PolarHBondContact O-N 3.04Å; F451-D453 VanDerWaalsContact C-N 3.28Å; F451-D453 PolarHBondContact O-N 2.7Å; F451-K454 HydrophobicContact CB-CB 4.11Å; F451-K454 HydrophobicContact CB-CD 4.38Å; F451-K454 PolarHBondContact O-N 3.2Å; F451-L462 HydrophobicContact CD2-CD2 4.24Å; F451-L465 HydrophobicContact CD2-CD1 4.29Å; F451-L465 HydrophobicContact CE2-CB 3.85Å; F451-L465 HydrophobicContact CE2-CD1 4.23Å; F451-L465 HydrophobicContact CZ-CB 4.03Å; F451-S466 WeakPolarHBondContact CZ-O 3.47Å; F451-D469 WeakPolarHBondContact CE1-O 3.21Å; F451-G472 VanDerWaalsContact CE1-CA 3.44Å
452	P	69.3	Low	64.1	Low	83 Å²	83	80.5 Å²	80.5	54%	0.539	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-63.8	-26.4	-173.4	21.9	-32	0	0	0	114.5	K454	P452-K454 VanDerWaalsContact C-N 3.3Å; P452-K454 PolarHBondContact O-N 2.98Å
453	D	72.9	Confident	66.7	Low	120 Å²	120	80 Å²	80	64%	0.642	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-80.6	-9.2	177.7	-72.5	-40.8	0	0	0	113.8	K433 F451	K433-D453 IonicContact NZ-OD1 3.57Å; F451-D453 VanDerWaalsContact C-N 3.28Å; F451-D453 PolarHBondContact O-N 2.7Å
454	K	78.6	Confident	69.6	Low	6 Å²	6	72.9 Å²	72.9	3%	0.026	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-120.9	18.6	-171.2	-65.5	173.2	173.8	155.7	0	113.7	F451 P452 N456 W457 L462 L465 L471 G472	F451-K454 HydrophobicContact CB-CB 4.11Å; F451-K454 HydrophobicContact CB-CD 4.38Å; F451-K454 PolarHBondContact O-N 3.2Å; P452-K454 VanDerWaalsContact C-N 3.3Å; P452-K454 PolarHBondContact O-N 2.98Å; K454-N456 PolarHBondContact O-N 3.04Å; K454-N456 VanDerWaalsContact O-N 3.08Å; K454-W457 HydrophobicContact CB-CD2 4.04Å; K454-W457 HydrophobicContact CB-CG 4.02Å; K454-W457 HydrophobicContact CD-CD2 4.25Å; K454-W457 HydrophobicContact CD-CE3 4.12Å; K454-W457 HydrophobicContact CD-CH2 4.12Å; K454-W457 HydrophobicContact CD-CZ2 4.22Å; K454-W457 HydrophobicContact CD-CZ3 4.06Å; K454-W457 HydrophobicContact CG-CD2 4.05Å; K454-W457 HydrophobicContact CG-CE3 4.42Å; K454-W457 HydrophobicContact CG-CG 4.47Å; K454-W457 HydrophobicContact CG-CZ2 4.18Å; K454-W457 WeakPolarHBondContact O-CB 3.44Å; K454-W457 PolarHBondContact O-N 2.89Å; K454-L462 HydrophobicContact CB-CD2 3.77Å; K454-L465 HydrophobicContact CD-CD1 4.04Å; K454-L471 PolarHBondContact NZ-O 3.33Å; K454-G472 PolarHBondContact NZ-O 2.95Å
455	E	74.8	Confident	72.2	Confident	118 Å²	118	64.4 Å²	64.4	55%	0.551	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-28.2	-173.6	-71.7	-177.8	166	0	0	115.3	S449	S449-E455 VanDerWaalsContact OG-CG 3.29Å; S449-E455 WeakPolarHBondContact OG-CG 3.11Å; S449-E455 PolarHBondContact OG-OE1 3.19Å
456	N	81.1	Confident	74.8	Confident	68 Å²	68	58.9 Å²	58.9	36%	0.364	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	0.3	179.7	-51.8	-65.8	0	0	0	113.6	F431 K433 K454	F431-N456 HydrophobicContact CB-CB 4.47Å; K433-N456 VanDerWaalsContact CA-ND2 3.3Å; K433-N456 WeakPolarHBondContact CA-ND2 3.49Å; K433-N456 WeakPolarHBondContact CG-ND2 3.47Å; K454-N456 PolarHBondContact O-N 3.04Å; K454-N456 VanDerWaalsContact O-N 3.08Å
457	W	86.8	Confident	77	Confident	19 Å²	19	61.1 Å²	61.1	7%	0.072	33%	0.329	C	S	.	.	S	Bend	trans	-66.7	147.6	173.6	-73.9	23.7	0	0	0	109.2	V422 L425 E426 F431 K454 D459 L461 L462 L465	V422-W457 HydrophobicContact CG1-CH2 3.98Å; V422-W457 HydrophobicContact CG1-CZ3 4.3Å; L425-W457 HydrophobicContact CB-CH2 3.79Å; L425-W457 HydrophobicContact CB-CZ2 3.9Å; L425-W457 HydrophobicContact CD1-CH2 4.4Å; E426-W457 HydrophobicContact CB-CZ2 4.39Å; F431-W457 AromaticContact CD2-CD1 3.63Å; F431-W457 HydrophobicContact CD2-CD2 4.48Å; F431-W457 HydrophobicContact CD2-CG 4.01Å; F431-W457 AromaticContact CD2-NE1 3.89Å; K454-W457 HydrophobicContact CB-CD2 4.04Å; K454-W457 HydrophobicContact CB-CG 4.02Å; K454-W457 HydrophobicContact CD-CD2 4.25Å; K454-W457 HydrophobicContact CD-CE3 4.12Å; K454-W457 HydrophobicContact CD-CH2 4.12Å; K454-W457 HydrophobicContact CD-CZ2 4.22Å; K454-W457 HydrophobicContact CD-CZ3 4.06Å; K454-W457 HydrophobicContact CG-CD2 4.05Å; K454-W457 HydrophobicContact CG-CE3 4.42Å; K454-W457 HydrophobicContact CG-CG 4.47Å; K454-W457 HydrophobicContact CG-CZ2 4.18Å; K454-W457 WeakPolarHBondContact O-CB 3.44Å; K454-W457 PolarHBondContact O-N 2.89Å; W457-D459 PolarHBondContact O-N 3.17Å; W457-L461 HydrophobicContact CE3-CB 4.33Å; W457-L461 HydrophobicContact CE3-CD1 4.48Å; W457-L462 HydrophobicContact CB-CD1 4.47Å; W457-L462 HydrophobicContact CB-CD2 3.96Å; W457-L462 HydrophobicContact CB-CG 4.01Å; W457-L465 HydrophobicContact CE3-CD1 4.43Å; W457-L465 HydrophobicContact CZ3-CD1 4.26Å
458	P	87	Confident	78.8	Confident	18 Å²	18	60.7 Å²	60.7	12%	0.117	33%	0.334	C	S	.	.			trans	-51.5	132.2	171.9	-27.2	34.6	0	0	0	111.2	F431 V460 L461 L462 I508	F431-P458 HydrophobicContact CE1-CG 3.97Å; F431-P458 HydrophobicContact CZ-CG 4.01Å; P458-V460 PolarHBondContact O-N 2.88Å; P458-L461 PolarHBondContact O-N 3.31Å; P458-L462 PolarHBondContact O-N 2.9Å; P458-I508 HydrophobicContact CG-CD1 4.3Å
459	D	85.8	Confident	80.7	Confident	96 Å²	96	55.1 Å²	55.1	51%	0.513	30%	0.3	S	S	.	.	H	α-helix	trans	-48.8	-34.5	179.1	-81.1	-18.8	0	0	0	111.7	K447 W457 L461 L462 N463	K447-D459 IonicContact NZ-OD2 2.79Å; W457-D459 PolarHBondContact O-N 3.17Å; D459-L461 PolarHBondContact O-N 3.49Å; D459-L462 PolarHBondContact O-N 3.4Å; D459-N463 WeakPolarHBondContact O-CB 3.42Å; D459-N463 PolarHBondContact O-N 3.38Å; D459-N463 PolarHBondContact O-ND2 3.21Å; D459-N463 VanDerWaalsContact O-ND2 3.1Å
460	V	87.5	Confident	81.7	Confident	31 Å²	31	58.8 Å²	58.8	19%	0.188	32%	0.323	C	S	.	.	H	α-helix	trans	-57.5	-47.6	176.2	174.4	0	0	0	0	112.2	P458 M464 I508 V510	P458-V460 PolarHBondContact O-N 2.88Å; V460-M464 HydrophobicContact CG1-CE 3.82Å; V460-M464 WeakPolarHBondContact O-CG 3.43Å; V460-I508 HydrophobicContact CG1-CG2 4.48Å; V460-I508 WeakPolarHBondContact CG2-O 3.38Å; V460-V510 HydrophobicContact CG1-CG2 3.4Å
461	L	90.8	Very high	82.5	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-68.9	-40.6	179	-66.4	-175.4	0	0	0	111.1	I358 L425 F431 W457 P458 D459 N463 M464 L465 F483 L486 I508	I358-L461 HydrophobicContact CD1-CD2 3.82Å; L425-L461 HydrophobicContact CD1-CD1 4.41Å; F431-L461 HydrophobicContact CE2-CD1 4.26Å; W457-L461 HydrophobicContact CE3-CB 4.33Å; W457-L461 HydrophobicContact CE3-CD1 4.48Å; P458-L461 PolarHBondContact O-N 3.31Å; D459-L461 PolarHBondContact O-N 3.49Å; L461-N463 VanDerWaalsContact C-N 3.32Å; L461-N463 PolarHBondContact O-N 2.92Å; L461-M464 PolarHBondContact O-N 3.13Å; L461-M464 VanDerWaalsContact O-N 3.16Å; L461-L465 PolarHBondContact O-N 3.33Å; L461-F483 HydrophobicContact CD2-CE1 4.46Å; L461-F483 HydrophobicContact CD2-CZ 3.96Å; L461-L486 HydrophobicContact CD2-CD2 3.92Å; L461-I508 HydrophobicContact CD1-CD1 3.78Å; L461-I508 HydrophobicContact CD2-CD1 4.43Å; L461-I508 HydrophobicContact CD2-CG2 4.16Å; L461-I508 HydrophobicContact CG-CD1 4.21Å
462	L	88.5	Confident	82.8	Confident	22 Å²	22	59.7 Å²	59.7	12%	0.115	32%	0.322	C	S	.	.	H	α-helix	trans	-59.8	-42.5	178.9	-67	176.7	0	0	0	111.8	F451 K454 W457 P458 D459 M464 L465	F451-L462 HydrophobicContact CD2-CD2 4.24Å; K454-L462 HydrophobicContact CB-CD2 3.77Å; W457-L462 HydrophobicContact CB-CD1 4.47Å; W457-L462 HydrophobicContact CB-CD2 3.96Å; W457-L462 HydrophobicContact CB-CG 4.01Å; P458-L462 PolarHBondContact O-N 2.9Å; D459-L462 PolarHBondContact O-N 3.4Å; L462-M464 PolarHBondContact O-N 2.87Å; L462-L465 HydrophobicContact CD2-CD1 4.37Å; L462-L465 PolarHBondContact O-N 2.97Å
463	N	87.6	Confident	83.6	Confident	111 Å²	111	60.2 Å²	60.2	59%	0.594	31%	0.313	S	S	*	.	H	α-helix	trans	-65.8	-21.3	179.3	-70.2	-28.3	0	0	0	113.8	D459 L461 K476	D459-N463 WeakPolarHBondContact O-CB 3.42Å; D459-N463 PolarHBondContact O-N 3.38Å; D459-N463 PolarHBondContact O-ND2 3.21Å; D459-N463 VanDerWaalsContact O-ND2 3.1Å; L461-N463 VanDerWaalsContact C-N 3.32Å; L461-N463 PolarHBondContact O-N 2.92Å; N463-K476 PolarHBondContact O-NZ 3.49Å
464	M	90.5	Very high	84.3	Confident	4 Å²	4	57.9 Å²	57.9	2%	0.02	30%	0.303	C	S	.	.	H	α-helix	trans	-88.9	-14.8	179.3	-64.8	178.5	179	0	0	113.6	I358 V460 L461 L462 K476 W479 F483 V510	I358-M464 HydrophobicContact CD1-CE 3.99Å; I358-M464 HydrophobicContact CD1-SD 3.69Å; I358-M464 HydrophobicContact CG1-CE 4.18Å; I358-M464 HydrophobicContact CG1-SD 4.48Å; V460-M464 HydrophobicContact CG1-CE 3.82Å; V460-M464 WeakPolarHBondContact O-CG 3.43Å; L461-M464 PolarHBondContact O-N 3.13Å; L461-M464 VanDerWaalsContact O-N 3.16Å; L462-M464 PolarHBondContact O-N 2.87Å; M464-K476 WeakPolarHBondContact O-CG 3.38Å; M464-K476 PolarHBondContact O-N 3.28Å; M464-W479 HydrophobicContact CB-CB 4.08Å; M464-W479 HydrophobicContact CB-CG 3.86Å; M464-W479 HydrophobicContact CE-CD2 3.89Å; M464-W479 HydrophobicContact CE-CE3 3.59Å; M464-W479 HydrophobicContact CE-CH2 4.14Å; M464-W479 HydrophobicContact CE-CZ2 4.39Å; M464-W479 HydrophobicContact CE-CZ3 3.73Å; M464-W479 HydrophobicContact CG-CB 4.22Å; M464-W479 HydrophobicContact CG-CD2 3.78Å; M464-W479 HydrophobicContact CG-CE3 4.39Å; M464-W479 HydrophobicContact CG-CG 3.64Å; M464-W479 HydrophobicContact SD-CB 4.3Å; M464-W479 HydrophobicContact SD-CD2 3.92Å; M464-W479 HydrophobicContact SD-CE3 3.95Å; M464-W479 HydrophobicContact SD-CG 4.05Å; M464-F483 HydrophobicContact CB-CE2 3.56Å; M464-F483 HydrophobicContact CB-CZ 4.13Å; M464-F483 HydrophobicContact CG-CE2 4.24Å; M464-F483 HydrophobicContact SD-CD2 4.43Å; M464-F483 HydrophobicContact SD-CE2 3.67Å; M464-V510 HydrophobicContact CE-CB 4.33Å; M464-V510 HydrophobicContact CE-CG1 4.16Å; M464-V510 HydrophobicContact CE-CG2 3.39Å
465	L	89.6	Confident	84.9	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.005	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-73.8	148.1	175.1	-60.8	177.2	0	0	0	110.5	V422 F451 K454 W457 L461 L462 G472 V475 K476 F483	V422-L465 HydrophobicContact CG1-CD2 4.44Å; V422-L465 HydrophobicContact CG2-CD2 4.04Å; F451-L465 HydrophobicContact CD2-CD1 4.29Å; F451-L465 HydrophobicContact CE2-CB 3.85Å; F451-L465 HydrophobicContact CE2-CD1 4.23Å; F451-L465 HydrophobicContact CZ-CB 4.03Å; K454-L465 HydrophobicContact CD-CD1 4.04Å; W457-L465 HydrophobicContact CE3-CD1 4.43Å; W457-L465 HydrophobicContact CZ3-CD1 4.26Å; L461-L465 PolarHBondContact O-N 3.33Å; L462-L465 HydrophobicContact CD2-CD1 4.37Å; L462-L465 PolarHBondContact O-N 2.97Å; L465-G472 WeakPolarHBondContact CD1-O 3.39Å; L465-V475 HydrophobicContact CD2-CG2 4.25Å; L465-K476 WeakPolarHBondContact O-CE 3.41Å; L465-F483 HydrophobicContact CD2-CE1 4.42Å; L465-F483 HydrophobicContact CD2-CZ 4.28Å
466	S	85.8	Confident	85.6	Confident	14 Å²	14	55.8 Å²	55.8	10%	0.098	29%	0.294	C	S	.	.			trans	-76.4	130.5	175.7	-174	0	0	0	0	110.7	F451 D468 D469 T474	F451-S466 WeakPolarHBondContact CZ-O 3.47Å; S466-D468 PolarHBondContact O-N 3.38Å; S466-D468 WeakPolarHBondContact OG-CB 3.28Å; S466-D468 PolarHBondContact OG-N 2.74Å; S466-D468 PolarHBondContact OG-OD2 3.43Å; S466-D469 PolarHBondContact O-N 2.97Å; S466-T474 PolarHBondContact N-O 3.12Å
467	E	82.4	Confident	86	Confident	150 Å²	150	57.3 Å²	57.3	70%	0.701	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-16.6	173.3	-65	175.9	-166.6	0	0	112.3	D469	E467-D469 PolarHBondContact O-N 2.99Å
468	D	81.9	Confident	86	Confident	154 Å²	154	61.5 Å²	61.5	82%	0.824	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-22.9	177.7	-60.9	-40.9	0	0	0	112.7	S466	S466-D468 PolarHBondContact O-N 3.38Å; S466-D468 WeakPolarHBondContact OG-CB 3.28Å; S466-D468 PolarHBondContact OG-N 2.74Å; S466-D468 PolarHBondContact OG-OD2 3.43Å
469	D	82.6	Confident	86.3	Confident	27 Å²	27	62.9 Å²	62.9	14%	0.144	33%	0.333	C	S	.	.			trans	-103.1	107.1	-179.8	178.2	6.6	0	0	0	110	F451 S466 E467 L471 G472 R473 T474	F451-D469 WeakPolarHBondContact CE1-O 3.21Å; S466-D469 PolarHBondContact O-N 2.97Å; E467-D469 PolarHBondContact O-N 2.99Å; D469-L471 PolarHBondContact O-N 2.98Å; D469-L471 VanDerWaalsContact O-N 3.1Å; D469-L471 PolarHBondContact OD1-N 3.38Å; D469-G472 WeakPolarHBondContact O-CA 3.4Å; D469-G472 PolarHBondContact O-N 3.38Å; D469-R473 WeakPolarHBondContact OD2-CA 3.35Å; D469-R473 PolarHBondContact OD2-N 3.13Å; D469-T474 PolarHBondContact OD2-N 2.9Å; D469-T474 PolarHBondContact OD2-OG1 2.65Å
470	P	76.4	Confident	86.7	Confident	110 Å²	110	63 Å²	63	71%	0.714	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-19.7	-178	25.9	-34.4	0	0	0	113.7	G472	P470-G472 VanDerWaalsContact C-N 3.32Å
471	L	79.8	Confident	87	Confident	102 Å²	102	62.1 Å²	62.1	53%	0.534	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-10.1	173.9	-63.2	173.8	0	0	0	112.3	K454 D469 R473	K454-L471 PolarHBondContact NZ-O 3.33Å; D469-L471 PolarHBondContact O-N 2.98Å; D469-L471 VanDerWaalsContact O-N 3.1Å; D469-L471 PolarHBondContact OD1-N 3.38Å; L471-R473 HydrophobicContact CB-CG 4.13Å; L471-R473 PolarHBondContact O-N 2.71Å
472	G	80.4	Confident	87.2	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.325	C	S	.	.			trans	57.9	31.8	-176.2	0	0	0	0	0	113.3	V422 F451 K454 L465 D469 P470	V422-G472 WeakPolarHBondContact CG1-O 3.49Å; F451-G472 VanDerWaalsContact CE1-CA 3.44Å; K454-G472 PolarHBondContact NZ-O 2.95Å; L465-G472 WeakPolarHBondContact CD1-O 3.39Å; D469-G472 WeakPolarHBondContact O-CA 3.4Å; D469-G472 PolarHBondContact O-N 3.38Å; P470-G472 VanDerWaalsContact C-N 3.32Å
473	R	85.1	Confident	87.5	Confident	93 Å²	93	61.1 Å²	61.1	35%	0.351	32%	0.319	S	S	.	.			trans	-92	-9.1	179.4	-71	-177.6	176.3	163.6	4.8	112.8	E426 D469 L471	E426-R473 IonicContact OE1-CZ 3.39Å; E426-R473 IonicContact OE1-NE 2.59Å; E426-R473 IonicContact OE1-NH2 3.24Å; E426-R473 PolarHBondContact OE1-NH2 2.9Å; E426-R473 IonicContact OE2-CZ 3.31Å; E426-R473 IonicContact OE2-NE 3.17Å; E426-R473 PolarHBondContact OE2-NE 3.11Å; E426-R473 IonicContact OE2-NH2 3.35Å; E426-R473 PolarHBondContact OE2-NH2 2.94Å; D469-R473 WeakPolarHBondContact OD2-CA 3.35Å; D469-R473 PolarHBondContact OD2-N 3.13Å; L471-R473 HydrophobicContact CB-CG 4.13Å; L471-R473 PolarHBondContact O-N 2.71Å
474	T	87.8	Confident	87.9	Confident	72 Å²	72	58.1 Å²	58.1	44%	0.442	30%	0.3	S	S	.	.	S	Bend	trans	-102.2	129.1	178.6	-51.5	0	0	0	0	109.9	S466 D469	S466-T474 PolarHBondContact N-O 3.12Å; D469-T474 PolarHBondContact OD2-N 2.9Å; D469-T474 PolarHBondContact OD2-OG1 2.65Å
475	V	90.1	Very high	88.2	Confident	18 Å²	18	58 Å²	58	11%	0.109	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-91.4	145.6	176.2	-175.9	0	0	0	0	108.6	A418 V422 L465 W479 F483	A418-V475 HydrophobicContact CB-CB 4.41Å; A418-V475 HydrophobicContact CB-CG2 4.14Å; V422-V475 HydrophobicContact CG2-CG2 3.63Å; L465-V475 HydrophobicContact CD2-CG2 4.25Å; V475-W479 HydrophobicContact CG1-CB 3.79Å; V475-F483 HydrophobicContact CB-CD2 4.4Å; V475-F483 HydrophobicContact CB-CG 4.44Å; V475-F483 HydrophobicContact CG1-CB 4.38Å; V475-F483 HydrophobicContact CG1-CD2 3.43Å; V475-F483 VanDerWaalsContact CG1-CD2 3.43Å; V475-F483 HydrophobicContact CG1-CE2 3.75Å; V475-F483 HydrophobicContact CG1-CG 3.9Å; V475-F483 HydrophobicContact CG1-CZ 4.46Å; V475-F483 HydrophobicContact CG2-CB 4.19Å; V475-F483 HydrophobicContact CG2-CD1 3.7Å; V475-F483 HydrophobicContact CG2-CD2 4.03Å; V475-F483 HydrophobicContact CG2-CE1 4.02Å; V475-F483 HydrophobicContact CG2-CE2 4.31Å; V475-F483 HydrophobicContact CG2-CG 3.7Å; V475-F483 HydrophobicContact CG2-CZ 4.3Å
476	K	91.3	Very high	88.5	Confident	62 Å²	62	58 Å²	58	27%	0.27	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-60.3	145.3	171.5	-66.7	170.3	176.2	166.7	0	110.2	N463 M464 L465 E478 W479 E480	N463-K476 PolarHBondContact O-NZ 3.49Å; M464-K476 WeakPolarHBondContact O-CG 3.38Å; M464-K476 PolarHBondContact O-N 3.28Å; L465-K476 WeakPolarHBondContact O-CE 3.41Å; K476-E478 HydrophobicContact CB-CG 3.84Å; K476-E478 PolarHBondContact O-N 3.25Å; K476-E478 VanDerWaalsContact O-N 3.17Å; K476-W479 PolarHBondContact O-N 3.08Å; K476-E480 PolarHBondContact O-N 2.73Å
477	S	88.2	Confident	89	Confident	100 Å²	100	57.3 Å²	57.3	70%	0.699	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-58.9	-31	-177.4	53.3	0	0	0	0	113.9	Q360 W479	Q360-S477 PolarHBondContact NE2-O 2.85Å; S477-W479 PolarHBondContact O-N 3.24Å
478	E	88.1	Confident	89.6	Confident	106 Å²	106	50.1 Å²	50.1	50%	0.495	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-66.6	-14.4	174.6	47.1	170.4	-147.3	0	0	114.5	Q360 K476	Q360-E478 WeakPolarHBondContact CB-O 3.17Å; Q360-E478 WeakPolarHBondContact CG-O 3.45Å; Q360-E478 PolarHBondContact NE2-O 3.17Å; Q360-E478 PolarHBondContact OE1-O 3.15Å; K476-E478 HydrophobicContact CB-CG 3.84Å; K476-E478 PolarHBondContact O-N 3.25Å; K476-E478 VanDerWaalsContact O-N 3.17Å
479	W	92.8	Very high	90.3	Very high	47 Å²	47	42.9 Å²	42.9	18%	0.178	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-122.1	5	-179.2	-58.9	108.8	0	0	0	113.5	Q360 M464 V475 K476 S477 L481 A482 F483 V510	Q360-W479 VanDerWaalsContact OE1-C 3.32Å; M464-W479 HydrophobicContact CB-CB 4.08Å; M464-W479 HydrophobicContact CB-CG 3.86Å; M464-W479 HydrophobicContact CE-CD2 3.89Å; M464-W479 HydrophobicContact CE-CE3 3.59Å; M464-W479 HydrophobicContact CE-CH2 4.14Å; M464-W479 HydrophobicContact CE-CZ2 4.39Å; M464-W479 HydrophobicContact CE-CZ3 3.73Å; M464-W479 HydrophobicContact CG-CB 4.22Å; M464-W479 HydrophobicContact CG-CD2 3.78Å; M464-W479 HydrophobicContact CG-CE3 4.39Å; M464-W479 HydrophobicContact CG-CG 3.64Å; M464-W479 HydrophobicContact SD-CB 4.3Å; M464-W479 HydrophobicContact SD-CD2 3.92Å; M464-W479 HydrophobicContact SD-CE3 3.95Å; M464-W479 HydrophobicContact SD-CG 4.05Å; V475-W479 HydrophobicContact CG1-CB 3.79Å; K476-W479 PolarHBondContact O-N 3.08Å; S477-W479 PolarHBondContact O-N 3.24Å; W479-L481 PolarHBondContact O-N 2.88Å; W479-A482 HydrophobicContact CE3-CB 4.17Å; W479-A482 WeakPolarHBondContact O-CB 3.41Å; W479-A482 PolarHBondContact O-N 3.12Å; W479-F483 HydrophobicContact CB-CD2 4.3Å; W479-F483 WeakPolarHBondContact O-CD2 3.42Å; W479-F483 PolarHBondContact O-N 3.3Å; W479-V510 HydrophobicContact CH2-CG1 3.43Å; W479-V510 VanDerWaalsContact CH2-CG1 3.43Å; W479-V510 HydrophobicContact CZ3-CG1 3.63Å
480	E	93.8	Very high	90.9	Very high	100 Å²	100	41.6 Å²	41.6	47%	0.467	22%	0.215	S	C	.	.	H	α-helix	trans	-58.6	-46.4	-176.5	-173.2	-179.7	169.2	0	0	112.2	A418 K476 A482 F483 R484	A418-E480 HydrophobicContact CB-CG 3.88Å; K476-E480 PolarHBondContact O-N 2.73Å; E480-A482 VanDerWaalsContact C-N 3.34Å; E480-A482 PolarHBondContact O-N 2.95Å; E480-F483 PolarHBondContact O-N 3.01Å; E480-R484 WeakPolarHBondContact O-CG 3.47Å; E480-R484 PolarHBondContact O-N 3.34Å; E480-R484 VanDerWaalsContact O-N 3.13Å
481	L	93.8	Very high	91.8	Very high	12 Å²	12	38.8 Å²	38.8	6%	0.063	19%	0.191	C	C	.	.	H	α-helix	trans	-68.5	-35.3	179.5	-55.5	179.4	0	0	0	111.5	V332 A343 Q360 W479 R484 C485	V332-L481 HydrophobicContact CG1-CB 3.81Å; V332-L481 HydrophobicContact CG1-CD2 4.06Å; V332-L481 HydrophobicContact CG1-CG 4.41Å; A343-L481 HydrophobicContact CB-CD1 4.16Å; Q360-L481 HydrophobicContact CG-CB 4.21Å; Q360-L481 HydrophobicContact CG-CD1 4.26Å; Q360-L481 HydrophobicContact CG-CG 4.49Å; Q360-L481 VanDerWaalsContact OE1-CB 3.27Å; W479-L481 PolarHBondContact O-N 2.88Å; L481-R484 PolarHBondContact O-N 3.24Å; L481-C485 PolarHBondContact O-N 2.83Å; L481-C485 VanDerWaalsContact O-N 3.1Å
482	A	95	Very high	92.6	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62.1	-43.9	175.6	0	0	0	0	0	111.4	I358 Q360 W479 E480 R484 C485 L486	I358-A482 HydrophobicContact CB-CB 4.43Å; Q360-A482 HydrophobicContact CB-CB 4.26Å; W479-A482 HydrophobicContact CE3-CB 4.17Å; W479-A482 WeakPolarHBondContact O-CB 3.41Å; W479-A482 PolarHBondContact O-N 3.12Å; E480-A482 VanDerWaalsContact C-N 3.34Å; E480-A482 PolarHBondContact O-N 2.95Å; A482-R484 PolarHBondContact O-N 2.9Å; A482-C485 PolarHBondContact O-N 2.98Å; A482-L486 PolarHBondContact O-N 2.94Å
483	F	95.4	Very high	93.2	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-69.2	-29	176.9	-91.6	-103.6	0	0	0	113.7	A418 T421 V422 L461 M464 L465 V475 W479 E480 L486 G487	A418-F483 HydrophobicContact CB-CB 3.72Å; T421-F483 WeakPolarHBondContact CB-O 3.39Å; T421-F483 HydrophobicContact CG2-CD1 4.29Å; T421-F483 WeakPolarHBondContact CG2-O 3.2Å; T421-F483 PolarHBondContact OG1-O 3.46Å; V422-F483 HydrophobicContact CG2-CD1 3.76Å; V422-F483 HydrophobicContact CG2-CE1 3.69Å; L461-F483 HydrophobicContact CD2-CE1 4.46Å; L461-F483 HydrophobicContact CD2-CZ 3.96Å; M464-F483 HydrophobicContact CB-CE2 3.56Å; M464-F483 HydrophobicContact CB-CZ 4.13Å; M464-F483 HydrophobicContact CG-CE2 4.24Å; M464-F483 HydrophobicContact SD-CD2 4.43Å; M464-F483 HydrophobicContact SD-CE2 3.67Å; L465-F483 HydrophobicContact CD2-CE1 4.42Å; L465-F483 HydrophobicContact CD2-CZ 4.28Å; V475-F483 HydrophobicContact CB-CD2 4.4Å; V475-F483 HydrophobicContact CB-CG 4.44Å; V475-F483 HydrophobicContact CG1-CB 4.38Å; V475-F483 HydrophobicContact CG1-CD2 3.43Å; V475-F483 VanDerWaalsContact CG1-CD2 3.43Å; V475-F483 HydrophobicContact CG1-CE2 3.75Å; V475-F483 HydrophobicContact CG1-CG 3.9Å; V475-F483 HydrophobicContact CG1-CZ 4.46Å; V475-F483 HydrophobicContact CG2-CB 4.19Å; V475-F483 HydrophobicContact CG2-CD1 3.7Å; V475-F483 HydrophobicContact CG2-CD2 4.03Å; V475-F483 HydrophobicContact CG2-CE1 4.02Å; V475-F483 HydrophobicContact CG2-CE2 4.31Å; V475-F483 HydrophobicContact CG2-CG 3.7Å; V475-F483 HydrophobicContact CG2-CZ 4.3Å; W479-F483 HydrophobicContact CB-CD2 4.3Å; W479-F483 WeakPolarHBondContact O-CD2 3.42Å; W479-F483 PolarHBondContact O-N 3.3Å; E480-F483 PolarHBondContact O-N 3.01Å; F483-L486 HydrophobicContact CD1-CD2 4.48Å; F483-G487 PolarHBondContact O-N 3.24Å
484	R	95.5	Very high	93.6	Very high	49 Å²	49	32.6 Å²	32.6	19%	0.185	16%	0.16	C	C	.	.	H	α-helix	trans	-66	-45.6	171.3	-67.5	177.6	67.8	-169.7	-1.8	111.1	E385 F415 A418 E480 L481 A482 L486 G487 A488	E385-R484 IonicContact OE1-CZ 3.82Å; E385-R484 IonicContact OE1-NH2 2.79Å; E385-R484 PolarHBondContact OE1-NH2 2.58Å; E385-R484 IonicContact OE2-CZ 3.1Å; E385-R484 IonicContact OE2-NH2 2.74Å; E385-R484 PolarHBondContact OE2-NH2 3.37Å; F415-R484 HydrophobicContact CD1-CB 4.45Å; F415-R484 HydrophobicContact CE1-CB 3.88Å; A418-R484 HydrophobicContact CB-CG 4.36Å; E480-R484 WeakPolarHBondContact O-CG 3.47Å; E480-R484 PolarHBondContact O-N 3.34Å; E480-R484 VanDerWaalsContact O-N 3.13Å; L481-R484 PolarHBondContact O-N 3.24Å; A482-R484 PolarHBondContact O-N 2.9Å; R484-L486 PolarHBondContact O-N 3.37Å; R484-G487 PolarHBondContact O-N 2.83Å; R484-A488 PolarHBondContact O-N 3.34Å
485	C	96.2	Very high	93.8	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-64.2	-38.8	174.9	-69.7	0	0	0	0	112.4	A330 G345 L481 A482 G487 A488 L489	A330-C485 HydrophobicContact CB-CB 4.01Å; G345-C485 PolarHBondContact O-SG 2.74Å; L481-C485 PolarHBondContact O-N 2.83Å; L481-C485 VanDerWaalsContact O-N 3.1Å; A482-C485 PolarHBondContact O-N 2.98Å; C485-G487 VanDerWaalsContact C-N 3.31Å; C485-G487 PolarHBondContact O-N 2.98Å; C485-A488 WeakPolarHBondContact O-CB 3.4Å; C485-A488 PolarHBondContact O-N 3.18Å; C485-L489 PolarHBondContact O-N 2.54Å
486	L	96.5	Very high	93.9	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-58.8	-44.4	171.6	-178.3	59.6	0	0	0	111.3	I356 I358 T421 L425 L461 A482 F483 R484 A488 L489 I490	I356-L486 HydrophobicContact CG2-CD1 4.22Å; I358-L486 HydrophobicContact CD1-CD2 4.42Å; I358-L486 HydrophobicContact CG2-CB 4.13Å; I358-L486 HydrophobicContact CG2-CD1 4.16Å; T421-L486 HydrophobicContact CG2-CB 4.35Å; T421-L486 HydrophobicContact CG2-CD2 4.33Å; T421-L486 HydrophobicContact CG2-CG 4.21Å; L425-L486 HydrophobicContact CD1-CD2 4.26Å; L461-L486 HydrophobicContact CD2-CD2 3.92Å; A482-L486 PolarHBondContact O-N 2.94Å; F483-L486 HydrophobicContact CD1-CD2 4.48Å; R484-L486 PolarHBondContact O-N 3.37Å; L486-A488 VanDerWaalsContact C-N 3.33Å; L486-A488 PolarHBondContact O-N 3.03Å; L486-L489 PolarHBondContact O-N 2.9Å; L486-I490 HydrophobicContact CD1-CD1 4.14Å; L486-I490 HydrophobicContact CD1-CG1 4.33Å; L486-I490 HydrophobicContact CG-CD1 3.82Å; L486-I490 HydrophobicContact CG-CG1 4.46Å; L486-I490 VanDerWaalsContact O-CG1 3.26Å; L486-I490 WeakPolarHBondContact O-CG1 3.48Å; L486-I490 PolarHBondContact O-N 3.23Å
487	G	95.9	Very high	93.9	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-59.6	-41.7	175.8	0	0	0	0	0	113	T421 F483 R484 C485 I490 Y491	T421-G487 VanDerWaalsContact OG1-CA 3.27Å; T421-G487 WeakPolarHBondContact OG1-CA 3.22Å; F483-G487 PolarHBondContact O-N 3.24Å; R484-G487 PolarHBondContact O-N 2.83Å; C485-G487 VanDerWaalsContact C-N 3.31Å; C485-G487 PolarHBondContact O-N 2.98Å; G487-I490 PolarHBondContact O-N 3.14Å; G487-Y491 WeakPolarHBondContact O-CB 3.29Å; G487-Y491 PolarHBondContact O-N 3.24Å
488	A	96	Very high	93.9	Very high	0 Å²	0	24 Å²	24	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-62.6	-42.7	175.1	0	0	0	0	0	112.5	A330 L409 F415 R484 C485 L486 Y492	A330-A488 HydrophobicContact CB-CB 4.09Å; L409-A488 HydrophobicContact CD1-CB 4.1Å; F415-A488 HydrophobicContact CD1-CB 4.29Å; F415-A488 HydrophobicContact CD2-CB 3.46Å; F415-A488 VanDerWaalsContact CD2-CB 3.46Å; F415-A488 HydrophobicContact CE1-CB 4.24Å; F415-A488 HydrophobicContact CE2-CB 3.39Å; F415-A488 HydrophobicContact CG-CB 3.93Å; F415-A488 HydrophobicContact CZ-CB 3.81Å; R484-A488 PolarHBondContact O-N 3.34Å; C485-A488 WeakPolarHBondContact O-CB 3.4Å; C485-A488 PolarHBondContact O-N 3.18Å; L486-A488 VanDerWaalsContact C-N 3.33Å; L486-A488 PolarHBondContact O-N 3.03Å; A488-Y492 WeakPolarHBondContact O-CB 3.18Å; A488-Y492 PolarHBondContact O-N 3.01Å
489	L	96.7	Very high	94	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.005	9%	0.085	C	C	.	.	H	α-helix	trans	-60.9	-49.5	173.6	-68.7	177.5	0	0	0	111.1	L328 A330 L349 I356 L383 C485 L486 Y491 Y492 L493	L328-L489 HydrophobicContact CD2-CD2 3.79Å; L328-L489 HydrophobicContact CG-CD2 3.82Å; A330-L489 HydrophobicContact CB-CD2 4.08Å; A330-L489 HydrophobicContact CB-CG 4.07Å; L349-L489 HydrophobicContact CB-CD1 4.45Å; L349-L489 HydrophobicContact CB-CD2 4.35Å; I356-L489 HydrophobicContact CG2-CD1 4.09Å; L383-L489 HydrophobicContact CD1-CD2 4.19Å; C485-L489 PolarHBondContact O-N 2.54Å; L486-L489 PolarHBondContact O-N 2.9Å; L489-Y491 PolarHBondContact O-N 2.79Å; L489-Y492 PolarHBondContact O-N 3.42Å; L489-L493 WeakPolarHBondContact O-CB 3.25Å; L489-L493 WeakPolarHBondContact O-CG 3.49Å; L489-L493 PolarHBondContact O-N 2.7Å
490	I	95.3	Very high	93.6	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-61.1	-46	-178.7	-63.6	162.9	0	0	0	110.8	W416 T421 L425 Y430 L486 G487 Y492 L493 R494 L503	W416-I490 HydrophobicContact CH2-CB 4.42Å; W416-I490 HydrophobicContact CH2-CG2 3.87Å; W416-I490 HydrophobicContact CZ3-CB 3.89Å; W416-I490 HydrophobicContact CZ3-CG2 3.64Å; T421-I490 HydrophobicContact CG2-CD1 4.06Å; L425-I490 HydrophobicContact CD1-CD1 4.32Å; L425-I490 HydrophobicContact CD2-CD1 3.56Å; L425-I490 HydrophobicContact CG-CD1 3.91Å; Y430-I490 HydrophobicContact CE2-CG2 4.19Å; L486-I490 HydrophobicContact CD1-CD1 4.14Å; L486-I490 HydrophobicContact CD1-CG1 4.33Å; L486-I490 HydrophobicContact CG-CD1 3.82Å; L486-I490 HydrophobicContact CG-CG1 4.46Å; L486-I490 VanDerWaalsContact O-CG1 3.26Å; L486-I490 WeakPolarHBondContact O-CG1 3.48Å; L486-I490 PolarHBondContact O-N 3.23Å; G487-I490 PolarHBondContact O-N 3.14Å; I490-Y492 VanDerWaalsContact C-N 3.31Å; I490-Y492 PolarHBondContact O-N 3.45Å; I490-L493 PolarHBondContact O-N 2.88Å; I490-R494 WeakPolarHBondContact O-CG 3.1Å; I490-R494 PolarHBondContact O-N 2.8Å; I490-L503 HydrophobicContact CG1-CD1 3.94Å; I490-L503 HydrophobicContact CG1-CD2 4.28Å; I490-L503 HydrophobicContact CG2-CD1 4.07Å
491	Y	95.1	Very high	93	Very high	51 Å²	51	19.4 Å²	19.4	20%	0.2	8%	0.081	C	C	.	.	H	α-helix	trans	-55.9	-47.9	175	171	-95.2	0	0	0	111.4	L409 Q414 W416 G487 L489 R494 Y495	L409-Y491 HydrophobicContact CD1-CD1 4.3Å; L409-Y491 HydrophobicContact CD2-CD1 4.42Å; L409-Y491 HydrophobicContact CD2-CE1 4.19Å; Q414-Y491 HydrophobicContact CB-CD1 3.78Å; Q414-Y491 HydrophobicContact CB-CD2 4.41Å; Q414-Y491 HydrophobicContact CB-CE1 3.48Å; Q414-Y491 VanDerWaalsContact CB-CE1 3.48Å; Q414-Y491 HydrophobicContact CB-CE2 4.16Å; Q414-Y491 HydrophobicContact CB-CG 4.25Å; Q414-Y491 HydrophobicContact CG-CD1 4.43Å; Q414-Y491 HydrophobicContact CG-CE1 3.68Å; Q414-Y491 HydrophobicContact CG-CE2 3.96Å; Q414-Y491 VanDerWaalsContact CG-CZ 3.42Å; Q414-Y491 WeakPolarHBondContact CG-OH 3.15Å; Q414-Y491 PolarHBondContact NE2-OH 3.18Å; Q414-Y491 WeakPolarHBondContact O-CB 3.4Å; Q414-Y491 WeakPolarHBondContact O-CD1 3.46Å; W416-Y491 HydrophobicContact CZ2-CD2 4.07Å; W416-Y491 HydrophobicContact CZ2-CG 4.5Å; G487-Y491 WeakPolarHBondContact O-CB 3.29Å; G487-Y491 PolarHBondContact O-N 3.24Å; L489-Y491 PolarHBondContact O-N 2.79Å; Y491-R494 WeakPolarHBondContact O-CB 3.28Å; Y491-R494 PolarHBondContact O-N 2.96Å; Y491-Y495 PolarHBondContact O-N 3.26Å
492	Y	95.2	Very high	92.6	Very high	3 Å²	3	19.2 Å²	19.2	1%	0.012	8%	0.08	C	C	.	.	H	α-helix	trans	-69.1	-35.4	-177.4	-165.7	-98.5	0	0	0	112.4	T285 T288 L328 Q381 L383 E407 A488 L489 I490 Y495 C496	T285-Y492 WeakPolarHBondContact CG2-OH 3.41Å; T288-Y492 HydrophobicContact CG2-CD1 4.07Å; T288-Y492 HydrophobicContact CG2-CE1 3.8Å; L328-Y492 HydrophobicContact CD1-CD1 4.24Å; L328-Y492 HydrophobicContact CD1-CE1 4.27Å; L328-Y492 HydrophobicContact CD2-CD1 3.65Å; L328-Y492 HydrophobicContact CD2-CE1 4.28Å; Q381-Y492 PolarHBondContact NE2-OH 2.89Å; L383-Y492 HydrophobicContact CD1-CD1 4.3Å; L383-Y492 HydrophobicContact CD1-CD2 4.4Å; L383-Y492 HydrophobicContact CD1-CG 3.85Å; L383-Y492 HydrophobicContact CD2-CD1 4.25Å; L383-Y492 HydrophobicContact CD2-CD2 3.72Å; L383-Y492 HydrophobicContact CD2-CE1 4.47Å; L383-Y492 HydrophobicContact CD2-CE2 3.97Å; L383-Y492 HydrophobicContact CD2-CG 3.87Å; E407-Y492 HydrophobicContact CG-CE2 4.01Å; A488-Y492 WeakPolarHBondContact O-CB 3.18Å; A488-Y492 PolarHBondContact O-N 3.01Å; L489-Y492 PolarHBondContact O-N 3.42Å; I490-Y492 VanDerWaalsContact C-N 3.31Å; I490-Y492 PolarHBondContact O-N 3.45Å; Y492-Y495 HydrophobicContact CD2-CD1 4.45Å; Y492-Y495 HydrophobicContact CE2-CD1 4.16Å; Y492-Y495 WeakPolarHBondContact O-CB 3.36Å; Y492-Y495 PolarHBondContact O-N 2.81Å; Y492-C496 VanDerWaalsContact CE1-SG 3.58Å; Y492-C496 PolarHBondContact O-N 3.41Å; Y492-C496 PolarHBondContact O-SG 2.82Å
493	L	94.1	Very high	92.3	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-65.1	-38.6	172.2	-68.7	171.7	0	0	0	112	L349 L489 I490 C496 L497 I498 D499 V502	L349-L493 HydrophobicContact CD2-CD1 4.23Å; L349-L493 HydrophobicContact CD2-CD2 3.59Å; L349-L493 HydrophobicContact CD2-CG 4.31Å; L489-L493 WeakPolarHBondContact O-CB 3.25Å; L489-L493 WeakPolarHBondContact O-CG 3.49Å; L489-L493 PolarHBondContact O-N 2.7Å; I490-L493 PolarHBondContact O-N 2.88Å; L493-C496 CarbonylContact O-C 3.6Å; L493-C496 PolarHBondContact O-N 2.82Å; L493-L497 PolarHBondContact O-N 2.86Å; L493-I498 HydrophobicContact CB-CG1 4.43Å; L493-I498 HydrophobicContact CD2-CD1 3.51Å; L493-I498 HydrophobicContact CD2-CG1 3.64Å; L493-I498 PolarHBondContact O-N 2.94Å; L493-D499 HydrophobicContact CB-CB 3.83Å; L493-D499 PolarHBondContact O-N 3.43Å; L493-V502 HydrophobicContact CD1-CB 4.09Å; L493-V502 HydrophobicContact CD1-CG1 4.06Å; L493-V502 HydrophobicContact CD2-CG2 4.1Å
494	R	92.9	Very high	91.8	Very high	63 Å²	63	20.9 Å²	20.9	24%	0.238	9%	0.091	C	C	.	.	H	α-helix	trans	-63.9	-42.5	172.7	-77.7	179.2	-176	-177.2	6	111.2	E424 A428 Y430 I490 Y491 C496 L497 D499	E424-R494 PolarHBondContact O-NH2 3.02Å; E424-R494 IonicContact OE2-CZ 3.72Å; E424-R494 IonicContact OE2-NH1 3.63Å; E424-R494 PolarHBondContact OE2-NH1 2.95Å; E424-R494 IonicContact OE2-NH2 2.8Å; E424-R494 PolarHBondContact OE2-NH2 3.47Å; A428-R494 VanDerWaalsContact CB-NH2 3.26Å; Y430-R494 PolarHBondContact OH-NE 3.41Å; Y430-R494 PolarHBondContact OH-NH2 3.11Å; I490-R494 WeakPolarHBondContact O-CG 3.1Å; I490-R494 PolarHBondContact O-N 2.8Å; Y491-R494 WeakPolarHBondContact O-CB 3.28Å; Y491-R494 PolarHBondContact O-N 2.96Å; R494-C496 PolarHBondContact O-N 2.78Å; R494-L497 PolarHBondContact O-N 2.95Å; R494-L497 VanDerWaalsContact O-N 3.11Å; R494-D499 HydrophobicContact CB-CB 4.44Å; R494-D499 HydrophobicContact CG-CB 3.7Å; R494-D499 VanDerWaalsContact CG-OD2 3.28Å; R494-D499 WeakPolarHBondContact CG-OD2 3.34Å; R494-D499 IonicContact NE-OD2 2.71Å
495	Y	92.5	Very high	91.2	Very high	33 Å²	33	19.3 Å²	19.3	13%	0.129	9%	0.087	C	C	.	.	H	α-helix	trans	-58.2	-39.6	173.3	171.5	-97.4	0	0	0	111.3	Y190 I283 Y491 Y492 L497	Y190-Y495 HydrophobicContact CD1-CE2 4.08Å; Y190-Y495 AromaticContact CE1-CE2 3.9Å; Y190-Y495 HydrophobicContact CE1-CE2 3.9Å; I283-Y495 HydrophobicContact CD1-CD1 4.21Å; I283-Y495 HydrophobicContact CD1-CE1 3.78Å; I283-Y495 HydrophobicContact CD1-CE2 4.39Å; I283-Y495 VanDerWaalsContact CD1-O 3.32Å; I283-Y495 WeakPolarHBondContact CD1-O 3.46Å; Y491-Y495 PolarHBondContact O-N 3.26Å; Y492-Y495 HydrophobicContact CD2-CD1 4.45Å; Y492-Y495 HydrophobicContact CE2-CD1 4.16Å; Y492-Y495 WeakPolarHBondContact O-CB 3.36Å; Y492-Y495 PolarHBondContact O-N 2.81Å; Y495-L497 VanDerWaalsContact C-N 3.31Å; Y495-L497 PolarHBondContact O-N 3.17Å
496	C	92.3	Very high	90.6	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-5.8	177.4	-62.2	0	0	0	0	115.1	I283 Y492 L493 R494 I498	I283-C496 HydrophobicContact CB-CB 4.3Å; I283-C496 PolarHBondContact N-O 3.48Å; I283-C496 WeakPolarHBondContact O-CB 3.44Å; Y492-C496 VanDerWaalsContact CE1-SG 3.58Å; Y492-C496 PolarHBondContact O-N 3.41Å; Y492-C496 PolarHBondContact O-SG 2.82Å; L493-C496 CarbonylContact O-C 3.6Å; L493-C496 PolarHBondContact O-N 2.82Å; R494-C496 PolarHBondContact O-N 2.78Å; C496-I498 VanDerWaalsContact C-N 3.35Å; C496-I498 HydrophobicContact CB-CD1 4.4Å; C496-I498 HydrophobicContact CB-CG1 3.87Å
497	L	90.4	Very high	90.2	Very high	36 Å²	36	22.8 Å²	22.8	19%	0.188	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	61	37.3	-176.6	-56.5	173	0	0	0	113.7	V280 L493 R494 Y495 H641 P642	V280-L497 HydrophobicContact CB-CD1 4.43Å; V280-L497 HydrophobicContact CG1-CD1 4.08Å; V280-L497 WeakPolarHBondContact O-CD1 3.47Å; L493-L497 PolarHBondContact O-N 2.86Å; R494-L497 PolarHBondContact O-N 2.95Å; R494-L497 VanDerWaalsContact O-N 3.11Å; Y495-L497 VanDerWaalsContact C-N 3.31Å; Y495-L497 PolarHBondContact O-N 3.17Å; L497-H641 PolarHBondContact O-NE2 2.89Å; L497-P642 HydrophobicContact CD1-CG 3.84Å
498	I	88.2	Confident	90	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.005	11%	0.11	C	C	.	.			trans	-132.3	13.8	178.8	60.6	160.4	0	0	0	112.8	Q282 T288 T290 L493 C496 E501 V502	Q282-I498 HydrophobicContact CG-CG2 4Å; T288-I498 HydrophobicContact CG2-CD1 4.13Å; T290-I498 HydrophobicContact CG2-CD1 3.81Å; L493-I498 HydrophobicContact CB-CG1 4.43Å; L493-I498 HydrophobicContact CD2-CD1 3.51Å; L493-I498 HydrophobicContact CD2-CG1 3.64Å; L493-I498 PolarHBondContact O-N 2.94Å; C496-I498 VanDerWaalsContact C-N 3.35Å; C496-I498 HydrophobicContact CB-CD1 4.4Å; C496-I498 HydrophobicContact CB-CG1 3.87Å; I498-E501 HydrophobicContact CB-CB 4.38Å; I498-E501 WeakPolarHBondContact O-CB 3.25Å; I498-E501 PolarHBondContact O-N 3.07Å; I498-V502 HydrophobicContact CD1-CG2 4.33Å; I498-V502 WeakPolarHBondContact O-CG2 3.41Å; I498-V502 PolarHBondContact O-N 3.27Å; I498-V502 VanDerWaalsContact O-N 3.09Å
499	D	90	Very high	89.9	Confident	19 Å²	19	26.5 Å²	26.5	10%	0.102	13%	0.128	C	C	.	.	H	α-helix	trans	-61.2	-47.5	-179.8	60.6	-44.2	0	0	0	112.6	Y430 L493 R494 E501 V502 L503	Y430-D499 HydrophobicContact CE1-CB 4.17Å; Y430-D499 WeakPolarHBondContact CE1-OD2 3.34Å; Y430-D499 VanDerWaalsContact CZ-OD2 3.29Å; Y430-D499 PolarHBondContact OH-OD2 3.38Å; L493-D499 HydrophobicContact CB-CB 3.83Å; L493-D499 PolarHBondContact O-N 3.43Å; R494-D499 HydrophobicContact CB-CB 4.44Å; R494-D499 HydrophobicContact CG-CB 3.7Å; R494-D499 VanDerWaalsContact CG-OD2 3.28Å; R494-D499 WeakPolarHBondContact CG-OD2 3.34Å; R494-D499 IonicContact NE-OD2 2.71Å; D499-E501 VanDerWaalsContact C-N 3.3Å; D499-E501 PolarHBondContact O-N 3.26Å; D499-V502 PolarHBondContact O-N 3.41Å; D499-L503 HydrophobicContact CB-CD1 4.34Å; D499-L503 WeakPolarHBondContact O-CB 3.28Å; D499-L503 WeakPolarHBondContact O-CD1 3.5Å; D499-L503 VanDerWaalsContact O-CG 3.28Å; D499-L503 WeakPolarHBondContact O-CG 3.46Å; D499-L503 PolarHBondContact O-N 3.1Å
500	R	85.2	Confident	89.7	Confident	95 Å²	95	28.9 Å²	28.9	36%	0.358	14%	0.142	S	C	.	.	H	α-helix	trans	-65.7	-36.1	176.6	-70.2	-175	176.6	-113.6	-4	112.1	Y430 S504 D638	Y430-R500 HydrophobicContact CD1-CG 4.05Å; Y430-R500 HydrophobicContact CE1-CG 3.8Å; R500-S504 WeakPolarHBondContact O-CB 3.5Å; R500-S504 PolarHBondContact O-N 3.43Å; R500-S504 VanDerWaalsContact O-N 3.08Å; R500-S504 PolarHBondContact O-OG 2.94Å; R500-S504 VanDerWaalsContact O-OG 3.08Å; R500-D638 IonicContact CZ-OD2 3.68Å; R500-D638 IonicContact NE-OD2 3.49Å; R500-D638 IonicContact NH2-OD2 2.79Å
501	E	80.9	Confident	89.5	Confident	44 Å²	44	29.9 Å²	29.9	21%	0.206	15%	0.146	C	C	.	.	H	α-helix	trans	-60	-49	177.9	-66.9	-174.7	-175	0	0	111.1	I498 D499 L632	I498-E501 HydrophobicContact CB-CB 4.38Å; I498-E501 WeakPolarHBondContact O-CB 3.25Å; I498-E501 PolarHBondContact O-N 3.07Å; D499-E501 VanDerWaalsContact C-N 3.3Å; D499-E501 PolarHBondContact O-N 3.26Å; E501-L632 VanDerWaalsContact C-CD2 3.45Å; E501-L632 HydrophobicContact CB-CD1 4.32Å; E501-L632 HydrophobicContact CB-CD2 3.43Å; E501-L632 VanDerWaalsContact CB-CD2 3.43Å; E501-L632 HydrophobicContact CB-CG 4.46Å; E501-L632 HydrophobicContact CG-CD2 4.01Å; E501-L632 WeakPolarHBondContact O-CD2 3.5Å
502	V	86.3	Confident	89.2	Confident	7 Å²	7	30.6 Å²	30.6	4%	0.042	16%	0.155	C	C	.	.	H	α-helix	trans	-78.3	-44.9	-176	176	0	0	0	0	111.4	L349 I356 L493 I498 D499	L349-V502 HydrophobicContact CD1-CG1 3.46Å; L349-V502 VanDerWaalsContact CD1-CG1 3.46Å; L349-V502 HydrophobicContact CD2-CG1 4.28Å; I356-V502 HydrophobicContact CD1-CG1 3.99Å; I356-V502 HydrophobicContact CG1-CG1 4.3Å; L493-V502 HydrophobicContact CD1-CB 4.09Å; L493-V502 HydrophobicContact CD1-CG1 4.06Å; L493-V502 HydrophobicContact CD2-CG2 4.1Å; I498-V502 HydrophobicContact CD1-CG2 4.33Å; I498-V502 WeakPolarHBondContact O-CG2 3.41Å; I498-V502 PolarHBondContact O-N 3.27Å; I498-V502 VanDerWaalsContact O-N 3.09Å; D499-V502 PolarHBondContact O-N 3.41Å
503	L	88.7	Confident	88.9	Confident	3 Å²	3	30.6 Å²	30.6	2%	0.016	16%	0.156	C	C	.	.	H	α-helix	trans	-76.3	-25.9	-172.5	-64.8	165.7	0	0	0	113	I356 Y430 F431 I490 D499 L505 G506	I356-L503 HydrophobicContact CD1-CD2 3.72Å; Y430-L503 HydrophobicContact CD1-CB 3.96Å; Y430-L503 HydrophobicContact CD1-CD1 3.95Å; Y430-L503 HydrophobicContact CD2-CB 4.43Å; Y430-L503 HydrophobicContact CD2-CD1 3.68Å; Y430-L503 HydrophobicContact CE1-CD1 3.8Å; Y430-L503 HydrophobicContact CE2-CD1 3.5Å; Y430-L503 HydrophobicContact CG-CB 3.9Å; Y430-L503 HydrophobicContact CG-CD1 3.89Å; F431-L503 VanDerWaalsContact CE1-O 3.24Å; F431-L503 WeakPolarHBondContact CE1-O 3.44Å; I490-L503 HydrophobicContact CG1-CD1 3.94Å; I490-L503 HydrophobicContact CG1-CD2 4.28Å; I490-L503 HydrophobicContact CG2-CD1 4.07Å; D499-L503 HydrophobicContact CB-CD1 4.34Å; D499-L503 WeakPolarHBondContact O-CB 3.28Å; D499-L503 WeakPolarHBondContact O-CD1 3.5Å; D499-L503 VanDerWaalsContact O-CG 3.28Å; D499-L503 WeakPolarHBondContact O-CG 3.46Å; D499-L503 PolarHBondContact O-N 3.1Å; L503-L505 PolarHBondContact O-N 2.85Å; L503-L505 VanDerWaalsContact O-N 3.16Å; L503-G506 PolarHBondContact O-N 3.46Å; L503-G506 VanDerWaalsContact O-N 3.07Å
504	S	84.4	Confident	88.4	Confident	32 Å²	32	31.7 Å²	31.7	22%	0.224	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-20.7	178.3	70.5	0	0	0	0	113.5	R500 G506 H631	R500-S504 WeakPolarHBondContact O-CB 3.5Å; R500-S504 PolarHBondContact O-N 3.43Å; R500-S504 VanDerWaalsContact O-N 3.08Å; R500-S504 PolarHBondContact O-OG 2.94Å; R500-S504 VanDerWaalsContact O-OG 3.08Å; S504-G506 VanDerWaalsContact C-N 3.27Å; S504-G506 PolarHBondContact O-N 2.56Å; S504-H631 PolarHBondContact OG-NE2 3.17Å; S504-H631 VanDerWaalsContact OG-NE2 3.1Å
505	L	83.1	Confident	87.8	Confident	17 Å²	17	30.5 Å²	30.5	9%	0.089	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-26.4	175.9	-67.3	162.7	0	0	0	112.5	L503 F507 T628 H631 F842	L503-L505 PolarHBondContact O-N 2.85Å; L503-L505 VanDerWaalsContact O-N 3.16Å; L505-F507 HydrophobicContact CB-CB 4.26Å; L505-F507 HydrophobicContact CB-CD1 4.48Å; L505-F507 HydrophobicContact CB-CG 4.18Å; L505-F507 WeakPolarHBondContact O-CD1 3.06Å; L505-F507 PolarHBondContact O-N 3.5Å; L505-F507 VanDerWaalsContact O-N 3.15Å; L505-T628 HydrophobicContact CD1-CG2 3.87Å; L505-H631 HydrophobicContact CD2-CB 4.05Å; L505-H631 WeakPolarHBondContact CD2-CD2 3.46Å; L505-H631 VanDerWaalsContact CD2-CG 3.49Å; L505-F842 HydrophobicContact CD2-CD2 4.36Å; L505-F842 HydrophobicContact CD2-CE2 3.82Å; L505-F842 HydrophobicContact CD2-CZ 4.11Å
506	G	83.8	Confident	87.1	Confident	22 Å²	22	32.6 Å²	32.6	23%	0.227	17%	0.172	C	C	.	.			trans	63.7	14.8	-175.5	0	0	0	0	0	114.7	L503 S504 I508	L503-G506 PolarHBondContact O-N 3.46Å; L503-G506 VanDerWaalsContact O-N 3.07Å; S504-G506 VanDerWaalsContact C-N 3.27Å; S504-G506 PolarHBondContact O-N 2.56Å; G506-I508 PolarHBondContact O-N 3.4Å
507	F	87.2	Confident	86	Confident	52 Å²	52	38.6 Å²	38.6	23%	0.228	20%	0.198	C	C	.	.			trans	-81.6	68.8	-175.3	-81.3	11.1	0	0	0	111.7	I356 L505 F842 H846	I356-F507 PolarHBondContact N-O 3.3Å; L505-F507 HydrophobicContact CB-CB 4.26Å; L505-F507 HydrophobicContact CB-CD1 4.48Å; L505-F507 HydrophobicContact CB-CG 4.18Å; L505-F507 WeakPolarHBondContact O-CD1 3.06Å; L505-F507 PolarHBondContact O-N 3.5Å; L505-F507 VanDerWaalsContact O-N 3.15Å; F507-F842 HydrophobicContact CD2-CE1 4.29Å; F507-F842 HydrophobicContact CE1-CD1 4Å; F507-F842 AromaticContact CE1-CE1 3.97Å; F507-F842 HydrophobicContact CE1-CE1 3.97Å; F507-F842 HydrophobicContact CE2-CD1 4.04Å; F507-F842 AromaticContact CE2-CE1 3.17Å; F507-F842 HydrophobicContact CE2-CE1 3.17Å; F507-F842 AromaticContact CE2-CZ 3.75Å; F507-F842 HydrophobicContact CE2-CZ 3.75Å; F507-F842 AromaticContact CZ-CD1 3.39Å; F507-F842 HydrophobicContact CZ-CD1 3.39Å; F507-F842 AromaticContact CZ-CE1 3Å; F507-F842 HydrophobicContact CZ-CE1 3Å; F507-F842 AromaticContact CZ-CZ 3.99Å; F507-F842 HydrophobicContact CZ-CZ 3.99Å; F507-H846 AromaticContact CE2-CD2 3.71Å
508	I	92.3	Very high	84.7	Confident	8 Å²	8	41 Å²	41	4%	0.041	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	118.7	-178.7	-55.3	179.3	0	0	0	109.2	I356 I358 F431 P458 V460 L461 G506	I356-I508 HydrophobicContact CB-CG1 4.28Å; I356-I508 CarbonylContact O-C 3.5Å; I356-I508 VanDerWaalsContact O-CA 3.31Å; I356-I508 WeakPolarHBondContact O-CA 3.44Å; I358-I508 HydrophobicContact CD1-CG2 4.11Å; I358-I508 HydrophobicContact CG1-CG2 4.18Å; F431-I508 HydrophobicContact CZ-CD1 4.2Å; P458-I508 HydrophobicContact CG-CD1 4.3Å; V460-I508 HydrophobicContact CG1-CG2 4.48Å; V460-I508 WeakPolarHBondContact CG2-O 3.38Å; L461-I508 HydrophobicContact CD1-CD1 3.78Å; L461-I508 HydrophobicContact CD2-CD1 4.43Å; L461-I508 HydrophobicContact CD2-CG2 4.16Å; L461-I508 HydrophobicContact CG-CD1 4.21Å; G506-I508 PolarHBondContact O-N 3.4Å
509	D	92.7	Very high	83	Confident	69 Å²	69	45.7 Å²	45.7	37%	0.369	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	159.9	177.6	-84.7	-27.2	0	0	0	112	K355 I356 N357 I358	K355-D509 WeakPolarHBondContact CE-OD2 3.34Å; K355-D509 IonicContact NZ-OD2 3.96Å; K355-D509 PolarHBondContact NZ-OD2 3.22Å; I356-D509 PolarHBondContact O-N 2.91Å; N357-D509 CarbonylContact C-O 3.57Å; N357-D509 VanDerWaalsContact CA-O 3.29Å; N357-D509 WeakPolarHBondContact CA-O 3.15Å; I358-D509 PolarHBondContact N-O 3.48Å
510	V	92.7	Very high	81.1	Confident	52 Å²	52	52 Å²	52	32%	0.315	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	122.9	174.5	-170.8	0	0	0	0	109.9	I358 V460 M464 W479 V512	I358-V510 CarbonylContact O-C 3.39Å; I358-V510 WeakPolarHBondContact O-CA 3.48Å; V460-V510 HydrophobicContact CG1-CG2 3.4Å; M464-V510 HydrophobicContact CE-CB 4.33Å; M464-V510 HydrophobicContact CE-CG1 4.16Å; M464-V510 HydrophobicContact CE-CG2 3.39Å; W479-V510 HydrophobicContact CH2-CG1 3.43Å; W479-V510 VanDerWaalsContact CH2-CG1 3.43Å; W479-V510 HydrophobicContact CZ3-CG1 3.63Å; V510-V512 HydrophobicContact CG1-CG2 3.91Å
511	Y	92.6	Very high	79.5	Confident	21 Å²	21	50.5 Å²	50.5	8%	0.082	29%	0.288	C	S	.	.			trans	-81.5	119.9	164.1	178	-97.7	0	0	0	110.1	I346 I358 F361 F373 Y377 P513	I346-Y511 HydrophobicContact CD1-CD1 3.22Å; I346-Y511 HydrophobicContact CD1-CE1 3.79Å; I346-Y511 HydrophobicContact CD1-CG 3.63Å; I346-Y511 HydrophobicContact CG1-CD1 4.16Å; I358-Y511 PolarHBondContact O-N 2.5Å; F361-Y511 HydrophobicContact CD1-CD1 4.37Å; F361-Y511 HydrophobicContact CD1-CE1 4.23Å; F361-Y511 HydrophobicContact CE1-CD1 4.16Å; F361-Y511 AromaticContact CE1-CE1 3.87Å; F361-Y511 HydrophobicContact CE1-CE1 3.87Å; F373-Y511 HydrophobicContact CB-CE1 4.49Å; F373-Y511 HydrophobicContact CD2-CD1 4.3Å; F373-Y511 HydrophobicContact CD2-CD2 4.06Å; F373-Y511 AromaticContact CD2-CE1 3.77Å; F373-Y511 HydrophobicContact CD2-CE1 3.77Å; F373-Y511 AromaticContact CD2-CE2 3.53Å; F373-Y511 HydrophobicContact CD2-CE2 3.53Å; F373-Y511 HydrophobicContact CD2-CG 4.41Å; F373-Y511 AromaticContact CD2-CZ 3.35Å; F373-Y511 HydrophobicContact CE2-CD2 4.09Å; F373-Y511 HydrophobicContact CE2-CE1 4.43Å; F373-Y511 HydrophobicContact CE2-CE2 4.02Å; F373-Y511 HydrophobicContact CE2-CG 4.34Å; F373-Y511 HydrophobicContact CG-CE1 4.37Å; Y377-Y511 HydrophobicContact CE2-CD2 4.44Å; Y377-Y511 HydrophobicContact CE2-CE2 4.04Å; Y511-P513 HydrophobicContact CE1-CG 4.07Å
512	V	88.9	Confident	77.8	Confident	65 Å²	65	57.5 Å²	57.5	39%	0.394	32%	0.321	S	S	.	.			trans	-115.1	127.9	170.4	-177.6	0	0	0	0	107.9	V510 M516	V510-V512 HydrophobicContact CG1-CG2 3.91Å; V512-M516 HydrophobicContact CG1-CB 3.92Å
513	P	87.7	Confident	75.9	Confident	4 Å²	4	67.4 Å²	67.4	3%	0.026	36%	0.357	C	S	.	.			trans	-54.9	141.1	173.2	-24.2	32.5	0	0	0	111.9	F361 R369 Y511 D515 M516	F361-P513 HydrophobicContact CB-CG 3.53Å; F361-P513 HydrophobicContact CD1-CG 3.68Å; F361-P513 HydrophobicContact CD2-CG 4.08Å; F361-P513 HydrophobicContact CE1-CG 4.4Å; F361-P513 HydrophobicContact CG-CG 3.49Å; F361-P513 VanDerWaalsContact CG-CG 3.49Å; R369-P513 HydrophobicContact CG-CB 4.31Å; Y511-P513 HydrophobicContact CE1-CG 4.07Å; P513-D515 WeakPolarHBondContact CB-OD1 3.41Å; P513-D515 PolarHBondContact O-N 2.87Å; P513-D515 VanDerWaalsContact O-N 3.16Å; P513-M516 HydrophobicContact CB-CG 4.14Å; P513-M516 HydrophobicContact CB-SD 4.45Å; P513-M516 HydrophobicContact CG-CG 4.26Å; P513-M516 HydrophobicContact CG-SD 3.91Å; P513-M516 WeakPolarHBondContact O-CB 3.39Å; P513-M516 PolarHBondContact O-N 3.47Å
514	I	84.4	Confident	74.1	Confident	22 Å²	22	71.4 Å²	71.4	11%	0.113	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-28.7	-171.5	-58.2	172.3	0	0	0	112.4	H376 Q537 V539 A585	H376-I514 WeakPolarHBondContact CE1-CD1 3.27Å; I514-Q537 HydrophobicContact CG2-CB 3.73Å; I514-V539 HydrophobicContact CB-CG2 4.34Å; I514-V539 HydrophobicContact CG2-CG2 3.87Å; I514-A585 HydrophobicContact CD1-CB 4.04Å
515	D	79.7	Confident	72	Confident	38 Å²	38	76.2 Å²	76.2	20%	0.203	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-9	178.6	69.7	-53	0	0	0	113.6	R369 P513 K517 V539	R369-D515 IonicContact CZ-OD1 3.56Å; R369-D515 IonicContact CZ-OD2 2.86Å; R369-D515 VanDerWaalsContact NE-CG 3.33Å; R369-D515 IonicContact NE-OD1 3.13Å; R369-D515 PolarHBondContact NE-OD1 2.81Å; R369-D515 VanDerWaalsContact NE-OD1 3.1Å; R369-D515 IonicContact NE-OD2 3.89Å; R369-D515 PolarHBondContact NE-OD2 3.2Å; R369-D515 IonicContact NH2-OD1 3.33Å; R369-D515 IonicContact NH2-OD2 2.79Å; R369-D515 PolarHBondContact NH2-OD2 3.36Å; P513-D515 WeakPolarHBondContact CB-OD1 3.41Å; P513-D515 PolarHBondContact O-N 2.87Å; P513-D515 VanDerWaalsContact O-N 3.16Å; D515-K517 PolarHBondContact O-N 3.38Å; D515-V539 HydrophobicContact CB-CG2 3.87Å
516	M	78.1	Confident	70.5	Confident	77 Å²	77	79.5 Å²	79.5	38%	0.379	45%	0.454	S	S	.	.	S	Bend	trans	-78.7	121.5	174.9	-74.5	-171.5	77.8	0	0	110.5	F361 V512 P513	F361-M516 HydrophobicContact CB-SD 4.13Å; V512-M516 HydrophobicContact CG1-CB 3.92Å; P513-M516 HydrophobicContact CB-CG 4.14Å; P513-M516 HydrophobicContact CB-SD 4.45Å; P513-M516 HydrophobicContact CG-CG 4.26Å; P513-M516 HydrophobicContact CG-SD 3.91Å; P513-M516 WeakPolarHBondContact O-CB 3.39Å; P513-M516 PolarHBondContact O-N 3.47Å
517	K	69.2	Low	69.2	Low	126 Å²	126	82.5 Å²	82.5	55%	0.548	47%	0.471	S	S	.	.			trans	-70.7	130.9	177.5	-68.9	-174.9	177.8	-171.8	0	110.9	D515 A519	D515-K517 PolarHBondContact O-N 3.38Å; K517-A519 PolarHBondContact O-N 3.49Å; K517-A519 VanDerWaalsContact O-N 3.14Å
518	N	62.3	Low	67.9	Low	87 Å²	87	84.6 Å²	84.6	47%	0.465	48%	0.484	S	S	.	.			trans	-66	110.4	173.6	-77.1	-21.9	0	0	0	110.5	N520 T534	N518-N520 PolarHBondContact O-N 3.26Å; N518-T534 PolarHBondContact N-O 3.35Å
519	A	54	Low	66.8	Low	100 Å²	100	90.5 Å²	90.5	83%	0.826	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-20.3	176.6	0	0	0	0	0	113.3	K517 S521	K517-A519 PolarHBondContact O-N 3.49Å; K517-A519 VanDerWaalsContact O-N 3.14Å; A519-S521 PolarHBondContact O-N 3.2Å
520	N	49	Very low	66.2	Low	150 Å²	150	88.9 Å²	88.9	80%	0.802	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	10.3	-171	-74.5	-6	0	0	0	115.4	N518 Q522	N518-N520 PolarHBondContact O-N 3.26Å; N520-Q522 PolarHBondContact O-N 3.47Å
521	S	51.6	Low	65.7	Low	65 Å²	65	87.4 Å²	87.4	46%	0.455	49%	0.492	S	S	.	.			trans	-66.1	105.1	173.7	-167.9	0	0	0	0	109.5	A519 R523	A519-S521 PolarHBondContact O-N 3.2Å; S521-R523 PolarHBondContact O-N 2.88Å
522	Q	46.4	Very low	65.4	Low	191 Å²	191	87.2 Å²	87.2	89%	0.893	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-62	117.1	-179	-70.5	-156.1	-7.3	0	0	110.2	N520	N520-Q522 PolarHBondContact O-N 3.47Å
523	R	46.3	Very low	65.1	Low	215 Å²	215	87.8 Å²	87.8	81%	0.811	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-75.9	138.6	-172.6	-69.2	175.4	174.7	178.6	-4.2	112.4	S521	S521-R523 PolarHBondContact O-N 2.88Å
524	S	49.2	Very low	64.8	Low	86 Å²	86	88.1 Å²	88.1	60%	0.601	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-90.6	121.4	147.9	-60.9	0	0	0	0	108.2	G526 S527	S524-G526 PolarHBondContact O-N 3.44Å; S524-G526 VanDerWaalsContact O-N 3.16Å; S524-S527 PolarHBondContact O-N 3.29Å; S524-S527 PolarHBondContact O-OG 3.09Å
525	P	40.7	Very low	64.8	Low	134 Å²	134	87.8 Å²	87.8	87%	0.87	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	120	178.7	21.9	-30.2	0	0	0	110.5
526	G	51.7	Low	65.1	Low	86 Å²	86	89.3 Å²	89.3	89%	0.887	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	110.4	-1.7	178.8	0	0	0	0	0	116.7	S524	S524-G526 PolarHBondContact O-N 3.44Å; S524-G526 VanDerWaalsContact O-N 3.16Å
527	S	56.1	Low	65.8	Low	84 Å²	84	89.1 Å²	89.1	59%	0.587	50%	0.504	S	S	*	.			trans	-83.6	141.4	175.3	47.9	0	0	0	0	112.5	S524	S524-S527 PolarHBondContact O-N 3.29Å; S524-S527 PolarHBondContact O-OG 3.09Å
528	I	61.5	Low	67	Low	97 Å²	97	83.1 Å²	83.1	50%	0.497	48%	0.478	S	S	.	.			trans	-67.2	128.5	175.7	-63.6	166.4	0	0	0	108.2	L530	I528-L530 HydrophobicContact CG2-CD2 4.15Å; I528-L530 HydrophobicContact CG2-CG 4.47Å; I528-L530 PolarHBondContact O-N 3.34Å
529	E	67.3	Low	68.5	Low	131 Å²	131	79.2 Å²	79.2	61%	0.612	46%	0.457	S	S	*	.			trans	-74.6	91	177.2	-168.3	178.8	168.9	0	0	109.8	T534	E529-T534 HydrophobicContact CG-CG2 4.37Å
530	L	80.2	Confident	70.4	Confident	36 Å²	36	74.5 Å²	74.5	19%	0.188	42%	0.418	C	S	.	.			trans	-75.9	138.1	175.3	-60.1	164.2	0	0	0	108.8	I528 Y532 D533 L880	I528-L530 HydrophobicContact CG2-CD2 4.15Å; I528-L530 HydrophobicContact CG2-CG 4.47Å; I528-L530 PolarHBondContact O-N 3.34Å; L530-Y532 HydrophobicContact CB-CD2 4.23Å; L530-Y532 HydrophobicContact CB-CE1 4.34Å; L530-Y532 HydrophobicContact CB-CE2 3.86Å; L530-Y532 HydrophobicContact CD1-CE2 3.79Å; L530-Y532 WeakPolarHBondContact CD1-OH 3.45Å; L530-Y532 HydrophobicContact CG-CE2 4.4Å; L530-Y532 PolarHBondContact O-N 3.31Å; L530-D533 WeakPolarHBondContact O-CB 3.42Å; L530-D533 PolarHBondContact O-N 3.05Å; L530-L880 HydrophobicContact CD2-CB 3.79Å; L530-L880 WeakPolarHBondContact CD2-O 3.4Å
531	F	83.8	Confident	72.3	Confident	21 Å²	21	68 Å²	68	9%	0.092	38%	0.383	C	S	.	.	H	α-helix	trans	-59.6	-37.7	-173.9	81	-98.6	0	0	0	111.9	D533 T534 Q535 C588 L880 P979 D981 H1017	F531-D533 PolarHBondContact O-N 3.47Å; F531-T534 PolarHBondContact O-N 2.98Å; F531-T534 PolarHBondContact O-OG1 3Å; F531-Q535 PolarHBondContact O-N 3.19Å; F531-C588 HydrophobicContact CE2-CB 3.84Å; F531-C588 HydrophobicContact CZ-CB 4.46Å; F531-L880 HydrophobicContact CD1-CD1 3.69Å; F531-L880 HydrophobicContact CE1-CD1 3.52Å; F531-P979 HydrophobicContact CE1-CB 3.95Å; F531-P979 HydrophobicContact CZ-CB 3.64Å; F531-D981 HydrophobicContact CD2-CB 3.65Å; F531-D981 HydrophobicContact CE1-CB 4.49Å; F531-D981 HydrophobicContact CE2-CB 3.4Å; F531-D981 VanDerWaalsContact CE2-CB 3.4Å; F531-D981 HydrophobicContact CG-CB 4.34Å; F531-D981 HydrophobicContact CZ-CB 3.86Å; F531-H1017 HydrophobicContact CD1-CB 4.28Å; F531-H1017 AromaticContact CD1-CD2 3.61Å; F531-H1017 HydrophobicContact CE1-CB 3.89Å; F531-H1017 AromaticContact CE1-CD2 3.96Å; F531-H1017 AromaticContact CE1-CG 3.87Å
532	Y	86.3	Confident	73.9	Confident	17 Å²	17	67.2 Å²	67.2	7%	0.067	37%	0.374	C	S	.	.	H	α-helix	trans	-75	-2.7	-178	53.9	-111.9	0	0	0	114.7	L530 Q535 P590 L880 P979	L530-Y532 HydrophobicContact CB-CD2 4.23Å; L530-Y532 HydrophobicContact CB-CE1 4.34Å; L530-Y532 HydrophobicContact CB-CE2 3.86Å; L530-Y532 HydrophobicContact CD1-CE2 3.79Å; L530-Y532 WeakPolarHBondContact CD1-OH 3.45Å; L530-Y532 HydrophobicContact CG-CE2 4.4Å; L530-Y532 PolarHBondContact O-N 3.31Å; Y532-Q535 WeakPolarHBondContact CA-O 3.29Å; Y532-P590 HydrophobicContact CE1-CG 4.23Å; Y532-L880 HydrophobicContact CD1-CD1 4.32Å; Y532-L880 HydrophobicContact CE1-CB 4.18Å; Y532-L880 HydrophobicContact CE1-CD1 3.88Å; Y532-L880 HydrophobicContact CE1-CG 4.07Å; Y532-P979 HydrophobicContact CD1-CB 4.19Å; Y532-P979 HydrophobicContact CD1-CG 4.19Å; Y532-P979 HydrophobicContact CE1-CG 4.09Å
533	D	82.1	Confident	75.8	Confident	76 Å²	76	59.9 Å²	59.9	41%	0.406	34%	0.341	S	S	.	.	H	α-helix	trans	-83.1	-23.4	167.8	-65.1	-24	0	0	0	111.6	L530 F531	L530-D533 WeakPolarHBondContact O-CB 3.42Å; L530-D533 PolarHBondContact O-N 3.05Å; F531-D533 PolarHBondContact O-N 3.47Å
534	T	80.4	Confident	78	Confident	12 Å²	12	49.7 Å²	49.7	7%	0.074	30%	0.302	C	S	.	.	H	α-helix	trans	-104	-28.3	178.8	64	0	0	0	0	113	N518 E529 F531	N518-T534 PolarHBondContact N-O 3.35Å; E529-T534 HydrophobicContact CG-CG2 4.37Å; F531-T534 PolarHBondContact O-N 2.98Å; F531-T534 PolarHBondContact O-OG1 3Å
535	Q	85.6	Confident	80	Confident	14 Å²	14	46 Å²	46	7%	0.065	28%	0.275	C	S	.	.			trans	-117.9	111.3	-179.8	-177.3	-174.3	-41.1	0	0	109.3	F531 Y532 Q537 D981	F531-Q535 PolarHBondContact O-N 3.19Å; Y532-Q535 WeakPolarHBondContact CA-O 3.29Å; Q535-Q537 VanDerWaalsContact CG-O 3.27Å; Q535-Q537 WeakPolarHBondContact CG-O 2.98Å; Q535-Q537 PolarHBondContact NE2-O 3.12Å; Q535-D981 PolarHBondContact NE2-O 3.37Å
536	S	86.3	Confident	82.2	Confident	71 Å²	71	41.7 Å²	41.7	50%	0.497	25%	0.249	S	C	.	.			trans	-77.3	-28.9	-176.9	55.2	0	0	0	0	113.5	P587 C588	S536-P587 WeakPolarHBondContact O-CA 3.47Å; S536-C588 PolarHBondContact O-N 3.39Å
537	Q	92.6	Very high	84	Confident	73 Å²	73	38.3 Å²	38.3	34%	0.341	21%	0.21	S	C	.	.	B	Isolated β-bridge	trans	-128.1	148.7	-167.3	-72.3	170.3	-11	0	0	112.2	I514 Q535 A585 P586 C588	I514-Q537 HydrophobicContact CG2-CB 3.73Å; Q535-Q537 VanDerWaalsContact CG-O 3.27Å; Q535-Q537 WeakPolarHBondContact CG-O 2.98Å; Q535-Q537 PolarHBondContact NE2-O 3.12Å; Q537-A585 HydrophobicContact CB-CB 4.22Å; Q537-A585 HydrophobicContact CG-CB 4.12Å; Q537-P586 CarbonylContact C-O 3.59Å; Q537-P586 VanDerWaalsContact CA-O 3.23Å; Q537-P586 WeakPolarHBondContact CA-O 3.31Å; Q537-C588 PolarHBondContact O-SG 3.39Å; Q537-C588 VanDerWaalsContact O-SG 3.4Å
538	M	94.7	Very high	85.8	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.183	C	C	.	.			trans	-73.5	133.2	175.3	175.8	-174.1	-67.1	0	0	109.2	L540 P586 C588 V961 I962 H965 V980 D981 I983	M538-L540 HydrophobicContact CG-CD2 4.23Å; M538-L540 HydrophobicContact CG-CG 4.5Å; M538-L540 PolarHBondContact O-N 3.4Å; M538-L540 HydrophobicContact SD-CD2 3.88Å; M538-L540 HydrophobicContact SD-CG 4.49Å; M538-P586 HydrophobicContact CB-CB 4.37Å; M538-P586 PolarHBondContact N-O 3.17Å; M538-C588 WeakPolarHBondContact CA-SG 3.44Å; M538-C588 PolarHBondContact N-SG 3Å; M538-V961 HydrophobicContact CE-CG1 4.14Å; M538-I962 HydrophobicContact SD-CG1 4.34Å; M538-H965 HydrophobicContact CE-CB 4Å; M538-H965 VanDerWaalsContact CE-CD2 3.42Å; M538-H965 WeakPolarHBondContact CE-CD2 3.31Å; M538-H965 VanDerWaalsContact CE-CE1 3.48Å; M538-H965 WeakPolarHBondContact CE-CE1 3.47Å; M538-H965 WeakPolarHBondContact CE-ND1 3.27Å; M538-V980 HydrophobicContact CE-CB 3.77Å; M538-V980 HydrophobicContact CE-CG1 3.99Å; M538-V980 WeakPolarHBondContact CE-O 3.45Å; M538-D981 WeakPolarHBondContact CA-O 3.33Å; M538-I983 HydrophobicContact CE-CD1 4.46Å; M538-I983 HydrophobicContact SD-CD1 3.63Å; M538-I983 HydrophobicContact SD-CG1 3.76Å
539	V	93	Very high	87.2	Confident	5 Å²	5	30.8 Å²	30.8	3%	0.03	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	117.3	177.5	-178.6	0	0	0	0	109.2	I514 D515 D981 R982 I983	I514-V539 HydrophobicContact CB-CG2 4.34Å; I514-V539 HydrophobicContact CG2-CG2 3.87Å; D515-V539 HydrophobicContact CB-CG2 3.87Å; V539-D981 PolarHBondContact N-O 3.25Å; V539-R982 HydrophobicContact CB-CB 4.13Å; V539-R982 HydrophobicContact CB-CG 3.81Å; V539-R982 HydrophobicContact CG1-CG 4.12Å; V539-R982 WeakPolarHBondContact O-CG 3.14Å; V539-I983 PolarHBondContact O-N 2.94Å
540	L	93.2	Very high	88.4	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	103.2	168.5	-59.2	178.6	0	0	0	107.5	M538 T544 L545 I550 P586 I962 I983	M538-L540 HydrophobicContact CG-CD2 4.23Å; M538-L540 HydrophobicContact CG-CG 4.5Å; M538-L540 PolarHBondContact O-N 3.4Å; M538-L540 HydrophobicContact SD-CD2 3.88Å; M538-L540 HydrophobicContact SD-CG 4.49Å; L540-T544 HydrophobicContact CD2-CG2 4.31Å; L540-L545 HydrophobicContact CB-CD2 3.93Å; L540-L545 HydrophobicContact CB-CG 4.09Å; L540-L545 HydrophobicContact CD1-CD2 4.2Å; L540-I550 HydrophobicContact CD1-CD1 4.06Å; L540-P586 HydrophobicContact CD1-CG 4.18Å; L540-I962 HydrophobicContact CD1-CD1 4.13Å; L540-I962 HydrophobicContact CD1-CG1 4.4Å; L540-I962 HydrophobicContact CD2-CD1 4.12Å; L540-I962 HydrophobicContact CD2-CG1 4.32Å; L540-I983 HydrophobicContact CD2-CB 3.91Å; L540-I983 HydrophobicContact CD2-CD1 4.02Å; L540-I983 HydrophobicContact CD2-CG1 4.12Å
541	D	88.6	Confident	88.8	Confident	13 Å²	13	23.6 Å²	23.6	7%	0.07	13%	0.13	C	C	.	.			trans	-73.6	166.6	-179.9	59.6	28.6	0	0	0	112.4	I543 T544 L545 R982	D541-I543 PolarHBondContact O-N 3.5Å; D541-T544 CarbonylContact O-C 3.59Å; D541-T544 WeakPolarHBondContact O-CA 3.49Å; D541-T544 PolarHBondContact O-N 2.84Å; D541-T544 WeakPolarHBondContact OD1-CB 3.28Å; D541-T544 PolarHBondContact OD1-N 3.39Å; D541-T544 PolarHBondContact OD1-OG1 3.34Å; D541-L545 WeakPolarHBondContact O-CG 3.43Å; D541-L545 PolarHBondContact O-N 3.46Å; D541-R982 IonicContact OD2-NH2 2.96Å; D541-R982 PolarHBondContact OD2-NH2 3.16Å; D541-R982 VanDerWaalsContact OD2-NH2 3.17Å
542	N	85.6	Confident	88.8	Confident	50 Å²	50	27.7 Å²	27.7	27%	0.267	15%	0.145	S	C	.	.	H	α-helix	trans	-54.2	-39.5	-178.9	172.9	79	0	0	0	113.1	R371 S375 T544 S546	R371-N542 HydrophobicContact CB-CB 4.08Å; S375-N542 WeakPolarHBondContact CB-OD1 3.2Å; N542-T544 VanDerWaalsContact C-N 3.31Å; N542-S546 WeakPolarHBondContact O-CB 3.21Å; N542-S546 PolarHBondContact O-N 3.4Å; N542-S546 VanDerWaalsContact O-N 3.07Å
543	I	87.1	Confident	88.6	Confident	37 Å²	37	28.7 Å²	28.7	19%	0.19	15%	0.152	C	C	.	.	H	α-helix	trans	-65.2	-41.1	178.8	-66	158.1	0	0	0	109.6	D541 S546 N547 S985 E1006	D541-I543 PolarHBondContact O-N 3.5Å; I543-S546 PolarHBondContact O-N 2.79Å; I543-N547 VanDerWaalsContact CG2-ND2 3.29Å; I543-N547 WeakPolarHBondContact CG2-ND2 3.45Å; I543-N547 WeakPolarHBondContact O-CB 3.35Å; I543-N547 PolarHBondContact O-N 3.09Å; I543-N547 PolarHBondContact O-ND2 3.45Å; I543-S985 WeakPolarHBondContact CG2-O 3.27Å; I543-E1006 HydrophobicContact CD1-CG 3.77Å
544	T	91.4	Very high	88.3	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-70.8	-41.1	179.1	-58.3	0	0	0	0	113.2	L540 D541 N542 S546 L548 I983 S985	L540-T544 HydrophobicContact CD2-CG2 4.31Å; D541-T544 CarbonylContact O-C 3.59Å; D541-T544 WeakPolarHBondContact O-CA 3.49Å; D541-T544 PolarHBondContact O-N 2.84Å; D541-T544 WeakPolarHBondContact OD1-CB 3.28Å; D541-T544 PolarHBondContact OD1-N 3.39Å; D541-T544 PolarHBondContact OD1-OG1 3.34Å; N542-T544 VanDerWaalsContact C-N 3.31Å; T544-S546 VanDerWaalsContact C-N 3.29Å; T544-S546 PolarHBondContact O-N 2.98Å; T544-L548 HydrophobicContact CG2-CD1 3.55Å; T544-L548 HydrophobicContact CG2-CG 4.15Å; T544-L548 VanDerWaalsContact O-CB 3.26Å; T544-L548 WeakPolarHBondContact O-CB 3.39Å; T544-L548 VanDerWaalsContact O-CG 3.32Å; T544-L548 WeakPolarHBondContact O-CG 3.26Å; T544-L548 PolarHBondContact O-N 3.47Å; T544-I983 HydrophobicContact CG2-CB 4.19Å; T544-I983 HydrophobicContact CG2-CG2 3.88Å; T544-I983 PolarHBondContact OG1-O 3.19Å; T544-S985 WeakPolarHBondContact CA-OG 3.36Å; T544-S985 PolarHBondContact OG1-N 2.83Å; T544-S985 PolarHBondContact OG1-OG 3.15Å
545	L	91.3	Very high	88.1	Confident	8 Å²	8	34.8 Å²	34.8	4%	0.042	19%	0.188	C	C	.	.	H	α-helix	trans	-60	-40.3	173.4	-69.6	167.1	0	0	0	112.3	S375 L540 D541 D549 I550 T584	S375-L545 WeakPolarHBondContact OG-CD1 3.44Å; L540-L545 HydrophobicContact CB-CD2 3.93Å; L540-L545 HydrophobicContact CB-CG 4.09Å; L540-L545 HydrophobicContact CD1-CD2 4.2Å; D541-L545 WeakPolarHBondContact O-CG 3.43Å; D541-L545 PolarHBondContact O-N 3.46Å; L545-D549 PolarHBondContact O-N 3.08Å; L545-I550 HydrophobicContact CD2-CB 3.99Å; L545-I550 HydrophobicContact CD2-CD1 3.88Å; L545-I550 HydrophobicContact CD2-CG1 4.49Å; L545-I550 HydrophobicContact CD2-CG2 3.88Å; L545-I550 PolarHBondContact O-N 2.97Å; L545-T584 HydrophobicContact CD2-CG2 4.29Å
546	S	88.1	Confident	87.7	Confident	44 Å²	44	38.5 Å²	38.5	31%	0.308	21%	0.209	S	C	.	.	H	α-helix	trans	-69.9	-60	175.1	171.1	0	0	0	0	110.7	N542 I543 T544 L548 D549 N554	N542-S546 WeakPolarHBondContact O-CB 3.21Å; N542-S546 PolarHBondContact O-N 3.4Å; N542-S546 VanDerWaalsContact O-N 3.07Å; I543-S546 PolarHBondContact O-N 2.79Å; T544-S546 VanDerWaalsContact C-N 3.29Å; T544-S546 PolarHBondContact O-N 2.98Å; S546-L548 PolarHBondContact O-N 2.82Å; S546-D549 PolarHBondContact O-N 2.9Å; S546-N554 PolarHBondContact O-ND2 2.8Å; S546-N554 PolarHBondContact O-OD1 3.32Å; S546-N554 PolarHBondContact OG-OD1 2.87Å
547	N	89.9	Confident	87.2	Confident	15 Å²	15	37 Å²	37	8%	0.08	21%	0.205	C	C	.	.	H	α-helix	trans	-56.6	-29.1	-175.4	-77.1	-12.9	0	0	0	114.8	I543 R955 S985 L987	I543-N547 VanDerWaalsContact CG2-ND2 3.29Å; I543-N547 WeakPolarHBondContact CG2-ND2 3.45Å; I543-N547 WeakPolarHBondContact O-CB 3.35Å; I543-N547 PolarHBondContact O-N 3.09Å; I543-N547 PolarHBondContact O-ND2 3.45Å; N547-R955 PolarHBondContact O-NE 2.84Å; N547-S985 WeakPolarHBondContact CB-OG 3.44Å; N547-S985 PolarHBondContact ND2-O 3.32Å; N547-S985 VanDerWaalsContact ND2-O 3.15Å; N547-S985 PolarHBondContact ND2-OG 2.88Å; N547-S985 VanDerWaalsContact ND2-OG 3.12Å; N547-L987 HydrophobicContact CB-CB 4.13Å; N547-L987 HydrophobicContact CB-CD1 4.35Å; N547-L987 PolarHBondContact ND2-N 2.78Å
548	L	92.4	Very high	86.5	Confident	3 Å²	3	35.1 Å²	35.1	2%	0.016	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	2.6	179	-62	-178.5	0	0	0	113.5	T544 S546 I550 R955 A958 L959 I962 I983 L987 L1021	T544-L548 HydrophobicContact CG2-CD1 3.55Å; T544-L548 HydrophobicContact CG2-CG 4.15Å; T544-L548 VanDerWaalsContact O-CB 3.26Å; T544-L548 WeakPolarHBondContact O-CB 3.39Å; T544-L548 VanDerWaalsContact O-CG 3.32Å; T544-L548 WeakPolarHBondContact O-CG 3.26Å; T544-L548 PolarHBondContact O-N 3.47Å; S546-L548 PolarHBondContact O-N 2.82Å; L548-I550 VanDerWaalsContact C-N 3.3Å; L548-I550 HydrophobicContact CB-CD1 3.92Å; L548-I550 HydrophobicContact CB-CG1 3.76Å; L548-I550 HydrophobicContact CD1-CD1 4.03Å; L548-I550 PolarHBondContact O-N 3.08Å; L548-R955 HydrophobicContact CD2-CB 4.22Å; L548-R955 HydrophobicContact CD2-CG 3.99Å; L548-A958 HydrophobicContact CD1-CB 3.59Å; L548-A958 HydrophobicContact CD2-CB 3.91Å; L548-A958 HydrophobicContact CG-CB 4.44Å; L548-L959 HydrophobicContact CB-CD2 4.27Å; L548-I962 HydrophobicContact CD1-CD1 4.05Å; L548-I983 HydrophobicContact CD1-CG2 4.44Å; L548-L987 HydrophobicContact CD2-CD1 3.69Å; L548-L1021 HydrophobicContact CD2-CD1 4.31Å
549	D	91.1	Very high	85.8	Confident	20 Å²	20	36.7 Å²	36.7	11%	0.107	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	51	46.6	-178.2	-58.6	-56.2	0	0	0	111.9	L545 S546 R552 N554 S562 L563 R955	L545-D549 PolarHBondContact O-N 3.08Å; S546-D549 PolarHBondContact O-N 2.9Å; D549-R552 WeakPolarHBondContact CA-O 3.27Å; D549-N554 PolarHBondContact OD1-N 3.19Å; D549-N554 PolarHBondContact OD1-ND2 3.4Å; D549-S562 WeakPolarHBondContact O-CA 3.39Å; D549-S562 VanDerWaalsContact O-CB 3.28Å; D549-S562 WeakPolarHBondContact O-CB 3.47Å; D549-L563 PolarHBondContact O-N 3.28Å; D549-L563 VanDerWaalsContact O-N 3.12Å; D549-R955 IonicContact OD2-CZ 3.22Å; D549-R955 IonicContact OD2-NH1 2.77Å; D549-R955 PolarHBondContact OD2-NH1 2.84Å
550	I	92.1	Very high	85.3	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.234	C	C	.	.	S	Bend	trans	-73.9	-49.1	-170.9	-70.6	175.4	0	0	0	111.9	L540 L545 L548 L563 L564 I583 L959 I962	L540-I550 HydrophobicContact CD1-CD1 4.06Å; L545-I550 HydrophobicContact CD2-CB 3.99Å; L545-I550 HydrophobicContact CD2-CD1 3.88Å; L545-I550 HydrophobicContact CD2-CG1 4.49Å; L545-I550 HydrophobicContact CD2-CG2 3.88Å; L545-I550 PolarHBondContact O-N 2.97Å; L548-I550 VanDerWaalsContact C-N 3.3Å; L548-I550 HydrophobicContact CB-CD1 3.92Å; L548-I550 HydrophobicContact CB-CG1 3.76Å; L548-I550 HydrophobicContact CD1-CD1 4.03Å; L548-I550 PolarHBondContact O-N 3.08Å; I550-L563 PolarHBondContact O-N 3.44Å; I550-L564 WeakPolarHBondContact O-CB 3.48Å; I550-L564 PolarHBondContact O-N 3.4Å; I550-I583 HydrophobicContact CG2-CG2 3.45Å; I550-I583 VanDerWaalsContact CG2-CG2 3.45Å; I550-L959 HydrophobicContact CG1-CD2 4.28Å; I550-I962 HydrophobicContact CD1-CD1 3.59Å
551	I	88.5	Confident	84.8	Confident	16 Å²	16	44.5 Å²	44.5	8%	0.082	25%	0.253	C	S	.	.	S	Bend	trans	-100.6	-39.7	-177.5	-51.6	176.6	0	0	0	110.9	L564 T584	I551-L564 HydrophobicContact CG2-CD2 4.11Å; I551-T584 HydrophobicContact CD1-CG2 3.47Å; I551-T584 VanDerWaalsContact CD1-CG2 3.47Å; I551-T584 HydrophobicContact CG1-CG2 3.91Å
552	R	84.5	Confident	84.9	Confident	108 Å²	108	43.9 Å²	43.9	41%	0.408	25%	0.25	S	C	.	.	S	Bend	trans	-143.7	153	-175.4	-62.1	-176.3	-174.7	-174.2	1.3	109.6	H323 D549 G557 S558	H323-R552 PolarHBondContact CD2-NH2 3.05Å; H323-R552 PolarHBondContact NE2-NE 3.13Å; H323-R552 PolarHBondContact NE2-NH2 3.37Å; D549-R552 WeakPolarHBondContact CA-O 3.27Å; R552-G557 WeakPolarHBondContact CD-O 3.3Å; R552-S558 CarbonylContact C-O 3.5Å; R552-S558 VanDerWaalsContact CA-O 3.26Å; R552-S558 WeakPolarHBondContact CA-O 3.26Å
553	N	81.2	Confident	85.2	Confident	38 Å²	38	41.5 Å²	41.5	20%	0.203	24%	0.237	C	C	.	.			trans	-77.4	135.9	172.2	-175.1	-19.2	0	0	0	110.2	V555 D556 G557 S558 E560	N553-V555 VanDerWaalsContact C-N 3.26Å; N553-V555 PolarHBondContact O-N 2.98Å; N553-V555 WeakPolarHBondContact OD1-CG2 3.34Å; N553-V555 PolarHBondContact OD1-N 3.22Å; N553-D556 WeakPolarHBondContact CB-OD1 3.31Å; N553-G557 VanDerWaalsContact O-CA 3.23Å; N553-G557 WeakPolarHBondContact O-CA 3.27Å; N553-G557 PolarHBondContact O-N 3.31Å; N553-S558 PolarHBondContact N-O 3.33Å; N553-E560 WeakPolarHBondContact CB-O 3.46Å; N553-E560 PolarHBondContact ND2-O 3.02Å
554	N	77.4	Confident	85.5	Confident	81 Å²	81	40.1 Å²	40.1	43%	0.433	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-16.9	178.2	-66.1	-50.6	0	0	0	114.8	S546 D549	S546-N554 PolarHBondContact O-ND2 2.8Å; S546-N554 PolarHBondContact O-OD1 3.32Å; S546-N554 PolarHBondContact OG-OD1 2.87Å; D549-N554 PolarHBondContact OD1-N 3.19Å; D549-N554 PolarHBondContact OD1-ND2 3.4Å
555	V	76.3	Confident	85.4	Confident	134 Å²	134	44.9 Å²	44.9	81%	0.812	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-49.7	-173.2	-178.8	0	0	0	0	112	N553	N553-V555 VanDerWaalsContact C-N 3.26Å; N553-V555 PolarHBondContact O-N 2.98Å; N553-V555 WeakPolarHBondContact OD1-CG2 3.34Å; N553-V555 PolarHBondContact OD1-N 3.22Å
556	D	76.8	Confident	85.4	Confident	93 Å²	93	46.7 Å²	46.7	50%	0.497	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.8	-9.1	-174.7	64	-8.6	0	0	0	113.1	N553 S558	N553-D556 WeakPolarHBondContact CB-OD1 3.31Å; D556-S558 PolarHBondContact O-N 3.27Å; D556-S558 WeakPolarHBondContact OD1-CB 3.38Å; D556-S558 PolarHBondContact OD1-N 3.38Å; D556-S558 PolarHBondContact OD1-OG 2.74Å; D556-S558 WeakPolarHBondContact OD2-CB 3.39Å; D556-S558 PolarHBondContact OD2-OG 2.77Å
557	G	74.8	Confident	85.6	Confident	40 Å²	40	44.7 Å²	44.7	41%	0.412	24%	0.244	S	C	.	.	S	Bend	trans	74.3	5.8	-174.5	0	0	0	0	0	114.3	R552 N553	R552-G557 WeakPolarHBondContact CD-O 3.3Å; N553-G557 VanDerWaalsContact O-CA 3.23Å; N553-G557 WeakPolarHBondContact O-CA 3.27Å; N553-G557 PolarHBondContact O-N 3.31Å
558	S	79.2	Confident	85.7	Confident	32 Å²	32	45.6 Å²	45.6	22%	0.224	25%	0.249	C	C	.	.	S	Bend	trans	-76	171.2	178.2	80	0	0	0	0	111.1	R552 N553 D556 E560	R552-S558 CarbonylContact C-O 3.5Å; R552-S558 VanDerWaalsContact CA-O 3.26Å; R552-S558 WeakPolarHBondContact CA-O 3.26Å; N553-S558 PolarHBondContact N-O 3.33Å; D556-S558 PolarHBondContact O-N 3.27Å; D556-S558 WeakPolarHBondContact OD1-CB 3.38Å; D556-S558 PolarHBondContact OD1-N 3.38Å; D556-S558 PolarHBondContact OD1-OG 2.74Å; D556-S558 WeakPolarHBondContact OD2-CB 3.39Å; D556-S558 PolarHBondContact OD2-OG 2.77Å; S558-E560 VanDerWaalsContact C-N 3.27Å; S558-E560 WeakPolarHBondContact OG-CB 3.24Å; S558-E560 PolarHBondContact OG-N 3.23Å; S558-E560 VanDerWaalsContact OG-N 3.09Å
559	Q	79.8	Confident	85.7	Confident	33 Å²	33	47.7 Å²	47.7	15%	0.154	26%	0.262	C	S	.	.	S	Bend	trans	-83.4	-4.8	169.6	-64	-172.7	9.4	0	0	112.1	L321 G561 S562 Q565	L321-Q559 PolarHBondContact O-NE2 2.9Å; Q559-G561 PolarHBondContact O-N 3.26Å; Q559-S562 VanDerWaalsContact O-CB 3.28Å; Q559-S562 WeakPolarHBondContact O-CB 3.22Å; Q559-S562 PolarHBondContact O-N 3.35Å; Q559-S562 VanDerWaalsContact O-N 3.15Å; Q559-S562 PolarHBondContact O-OG 2.93Å; Q559-Q565 HydrophobicContact CB-CB 4.45Å; Q559-Q565 WeakPolarHBondContact O-CB 3.26Å
560	E	81.5	Confident	85.8	Confident	131 Å²	131	46.8 Å²	46.8	61%	0.612	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	131	-175.1	-61.7	-169.9	168.3	0	0	111.6	N553 S558 S562	N553-E560 WeakPolarHBondContact CB-O 3.46Å; N553-E560 PolarHBondContact ND2-O 3.02Å; S558-E560 VanDerWaalsContact C-N 3.27Å; S558-E560 WeakPolarHBondContact OG-CB 3.24Å; S558-E560 PolarHBondContact OG-N 3.23Å; S558-E560 VanDerWaalsContact OG-N 3.09Å; E560-S562 PolarHBondContact O-N 3.43Å
561	G	83.5	Confident	85.8	Confident	39 Å²	39	48 Å²	48	40%	0.402	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.7	-1.2	-176.6	0	0	0	0	0	114.2	Q559	Q559-G561 PolarHBondContact O-N 3.26Å
562	S	90.1	Very high	86	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.262	C	S	.	.			trans	-75.6	155.6	176.8	72.6	0	0	0	0	112.9	D549 Q559 E560 L564 Q565 R566	D549-S562 WeakPolarHBondContact O-CA 3.39Å; D549-S562 VanDerWaalsContact O-CB 3.28Å; D549-S562 WeakPolarHBondContact O-CB 3.47Å; Q559-S562 VanDerWaalsContact O-CB 3.28Å; Q559-S562 WeakPolarHBondContact O-CB 3.22Å; Q559-S562 PolarHBondContact O-N 3.35Å; Q559-S562 VanDerWaalsContact O-N 3.15Å; Q559-S562 PolarHBondContact O-OG 2.93Å; E560-S562 PolarHBondContact O-N 3.43Å; S562-L564 VanDerWaalsContact C-N 3.27Å; S562-L564 PolarHBondContact O-N 3.47Å; S562-Q565 PolarHBondContact O-N 2.95Å; S562-Q565 WeakPolarHBondContact OG-CB 3.33Å; S562-Q565 PolarHBondContact OG-N 3.02Å; S562-R566 PolarHBondContact O-N 2.92Å; S562-R566 VanDerWaalsContact O-N 3.17Å
563	L	92.9	Very high	86.2	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60.5	-38.5	174	-175.5	64.6	0	0	0	111.7	D549 I550 R566 L567 I583 P896 L959 I962 L963	D549-L563 PolarHBondContact O-N 3.28Å; D549-L563 VanDerWaalsContact O-N 3.12Å; I550-L563 PolarHBondContact O-N 3.44Å; L563-R566 WeakPolarHBondContact O-CB 3.42Å; L563-R566 PolarHBondContact O-N 3.38Å; L563-L567 HydrophobicContact CD1-CD1 4.06Å; L563-L567 HydrophobicContact CD1-CG 4.28Å; L563-L567 HydrophobicContact CD2-CD1 4.35Å; L563-L567 HydrophobicContact CG-CD1 3.88Å; L563-L567 HydrophobicContact CG-CG 4.44Å; L563-L567 WeakPolarHBondContact O-CG 3.31Å; L563-L567 PolarHBondContact O-N 3.3Å; L563-L567 VanDerWaalsContact O-N 3.07Å; L563-I583 HydrophobicContact CD2-CG2 4.18Å; L563-P896 HydrophobicContact CD1-CG 4.46Å; L563-L959 HydrophobicContact CB-CD2 4.27Å; L563-L959 HydrophobicContact CD1-CD2 4.46Å; L563-L959 HydrophobicContact CD2-CD2 3.93Å; L563-L959 HydrophobicContact CG-CD2 4.44Å; L563-I962 HydrophobicContact CD2-CG2 3.94Å; L563-L963 HydrophobicContact CD1-CD2 4.12Å; L563-L963 HydrophobicContact CD1-CG 4.43Å
564	L	92.1	Very high	86.6	Confident	7 Å²	7	42.5 Å²	42.5	4%	0.037	24%	0.242	C	C	.	.	H	α-helix	trans	-59.5	-49.3	177.6	177.3	62.3	0	0	0	111.7	I550 I551 S562 R566 L567 N568 R580 I583	I550-L564 WeakPolarHBondContact O-CB 3.48Å; I550-L564 PolarHBondContact O-N 3.4Å; I551-L564 HydrophobicContact CG2-CD2 4.11Å; S562-L564 VanDerWaalsContact C-N 3.27Å; S562-L564 PolarHBondContact O-N 3.47Å; L564-R566 PolarHBondContact O-N 3.22Å; L564-L567 PolarHBondContact O-N 3.31Å; L564-N568 HydrophobicContact CD1-CB 4.41Å; L564-N568 WeakPolarHBondContact O-CB 3.33Å; L564-N568 PolarHBondContact O-N 3.13Å; L564-R580 HydrophobicContact CD1-CB 4.25Å; L564-R580 HydrophobicContact CD2-CG 4.41Å; L564-I583 HydrophobicContact CD1-CD1 3.63Å
565	Q	90.2	Very high	87.4	Confident	100 Å²	100	38.6 Å²	38.6	47%	0.467	22%	0.222	S	C	.	.	H	α-helix	trans	-59.4	-38.3	177.3	-178.5	-123.2	-6.9	0	0	111.3	Q559 S562 L567	Q559-Q565 HydrophobicContact CB-CB 4.45Å; Q559-Q565 WeakPolarHBondContact O-CB 3.26Å; S562-Q565 PolarHBondContact O-N 2.95Å; S562-Q565 WeakPolarHBondContact OG-CB 3.33Å; S562-Q565 PolarHBondContact OG-N 3.02Å; Q565-L567 PolarHBondContact O-N 3.42Å
566	R	90.4	Very high	88.1	Confident	47 Å²	47	36.2 Å²	36.2	18%	0.177	20%	0.198	C	C	.	.	H	α-helix	trans	-66.5	-34.4	179.4	-174.4	63	-173.9	99.7	-16.2	113.9	S562 L563 L564 Y864 A868	S562-R566 PolarHBondContact O-N 2.92Å; S562-R566 VanDerWaalsContact O-N 3.17Å; L563-R566 WeakPolarHBondContact O-CB 3.42Å; L563-R566 PolarHBondContact O-N 3.38Å; L564-R566 PolarHBondContact O-N 3.22Å; R566-Y864 HydrophobicContact CG-CD2 4.43Å; R566-Y864 HydrophobicContact CG-CE2 3.92Å; R566-A868 VanDerWaalsContact NH2-CA 3.29Å; R566-A868 PolarHBondContact NH2-O 3.38Å
567	L	92.9	Very high	88.7	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-93	-24.1	-176.4	-70.4	176.2	0	0	0	113.8	L563 L564 Q565 T569 L579 I583 L861 Y864 L963 L966	L563-L567 HydrophobicContact CD1-CD1 4.06Å; L563-L567 HydrophobicContact CD1-CG 4.28Å; L563-L567 HydrophobicContact CD2-CD1 4.35Å; L563-L567 HydrophobicContact CG-CD1 3.88Å; L563-L567 HydrophobicContact CG-CG 4.44Å; L563-L567 WeakPolarHBondContact O-CG 3.31Å; L563-L567 PolarHBondContact O-N 3.3Å; L563-L567 VanDerWaalsContact O-N 3.07Å; L564-L567 PolarHBondContact O-N 3.31Å; Q565-L567 PolarHBondContact O-N 3.42Å; L567-T569 PolarHBondContact O-N 3.07Å; L567-L579 HydrophobicContact CB-CD2 4.46Å; L567-I583 HydrophobicContact CB-CD1 4.04Å; L567-I583 HydrophobicContact CD1-CD1 3.67Å; L567-I583 HydrophobicContact CD1-CG1 3.88Å; L567-I583 HydrophobicContact CG-CD1 4.49Å; L567-L861 HydrophobicContact CD2-CD2 4.46Å; L567-Y864 HydrophobicContact CD2-CD1 3.86Å; L567-Y864 HydrophobicContact CD2-CD2 3.62Å; L567-Y864 HydrophobicContact CD2-CE1 4.25Å; L567-Y864 HydrophobicContact CD2-CE2 4.04Å; L567-Y864 HydrophobicContact CD2-CG 3.52Å; L567-L963 HydrophobicContact CD1-CD2 3.85Å; L567-L963 HydrophobicContact CD2-CD2 3.73Å; L567-L963 HydrophobicContact CG-CD2 4.25Å; L567-L966 HydrophobicContact CD1-CD1 3.72Å
568	N	92.2	Very high	89.6	Confident	35 Å²	35	32.2 Å²	32.2	19%	0.187	17%	0.166	C	C	.	.			trans	-79	79.3	-169.7	-174.9	6.6	0	0	0	113.3	L564 R576 L579	L564-N568 HydrophobicContact CD1-CB 4.41Å; L564-N568 WeakPolarHBondContact O-CB 3.33Å; L564-N568 PolarHBondContact O-N 3.13Å; N568-R576 VanDerWaalsContact CG-NH1 3.35Å; N568-R576 PolarHBondContact ND2-NH1 3.18Å; N568-R576 WeakPolarHBondContact OD1-CG 3.41Å; N568-R576 PolarHBondContact OD1-NH1 2.95Å; N568-L579 HydrophobicContact CB-CD2 4.16Å
569	T	92.4	Very high	90.4	Very high	47 Å²	47	30.7 Å²	30.7	29%	0.288	16%	0.155	S	C	.	.			trans	-103.8	11.4	169	64.6	0	0	0	0	113.4	L567 R614 A860 L863	L567-T569 PolarHBondContact O-N 3.07Å; T569-R614 PolarHBondContact O-NH2 2.81Å; T569-A860 VanDerWaalsContact OG1-CA 3.29Å; T569-A860 WeakPolarHBondContact OG1-CA 3.39Å; T569-A860 WeakPolarHBondContact OG1-CB 3.42Å; T569-L863 WeakPolarHBondContact OG1-CD1 3.47Å
570	C	93.6	Very high	91	Very high	1 Å²	1	31 Å²	31	1%	0.007	16%	0.155	C	C	.	.			trans	-56.1	139.7	177.2	-64.9	0	0	0	0	110.2	R576 D856	C570-R576 HydrophobicContact CB-CG 3.74Å; C570-R576 PolarHBondContact O-NE 3.01Å; C570-R576 PolarHBondContact O-NH1 3.5Å; C570-R576 PolarHBondContact O-NH2 3.1Å; C570-D856 WeakPolarHBondContact CA-OD1 3.33Å; C570-D856 WeakPolarHBondContact CB-OD2 3.12Å
571	C	91.9	Very high	91.4	Very high	26 Å²	26	29.1 Å²	29.1	18%	0.176	15%	0.146	C	C	.	.	S	Bend	trans	-87.7	-31	179.7	-54.2	0	0	0	0	111.4	R614 L617 A618 D856	C571-R614 PolarHBondContact SG-NE 3.07Å; C571-L617 HydrophobicContact CB-CB 3.74Å; C571-A618 HydrophobicContact CB-CB 4.25Å; C571-D856 PolarHBondContact N-OD1 3.07Å; C571-D856 PolarHBondContact N-OD2 3.08Å
572	T	91.9	Very high	92	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.006	13%	0.132	C	C	.	.	S	Bend	trans	-96.6	145.7	-173.4	67.5	0	0	0	0	112.2	F574 G575 R576 L617 L620 D856	T572-F574 HydrophobicContact CG2-CE1 4.21Å; T572-F574 HydrophobicContact CG2-CE2 3.85Å; T572-F574 HydrophobicContact CG2-CZ 3.58Å; T572-F574 PolarHBondContact O-N 2.76Å; T572-F574 WeakPolarHBondContact OG1-CD2 3.45Å; T572-F574 WeakPolarHBondContact OG1-CE2 3.34Å; T572-G575 PolarHBondContact O-N 3.02Å; T572-G575 WeakPolarHBondContact OG1-CA 3.44Å; T572-G575 PolarHBondContact OG1-N 3.2Å; T572-R576 WeakPolarHBondContact O-CG 3.19Å; T572-R576 PolarHBondContact O-N 3.42Å; T572-L617 HydrophobicContact CG2-CB 4.2Å; T572-L617 HydrophobicContact CG2-CD2 4.05Å; T572-L620 HydrophobicContact CG2-CB 4.46Å; T572-L620 HydrophobicContact CG2-CD1 4.06Å; T572-D856 WeakPolarHBondContact CB-OD2 3.23Å; T572-D856 PolarHBondContact N-OD2 2.87Å; T572-D856 PolarHBondContact OG1-OD2 3.3Å
573	F	88.3	Confident	92.2	Very high	41 Å²	41	28.6 Å²	28.6	18%	0.18	13%	0.132	C	C	.	.	H	α-helix	trans	-61.6	-42.8	177.7	-66.1	-76.7	0	0	0	112.8	V300 R576 R577 D622	V300-F573 HydrophobicContact CG2-CE2 4.35Å; V300-F573 HydrophobicContact CG2-CZ 4.27Å; F573-R576 PolarHBondContact O-N 2.92Å; F573-R577 PolarHBondContact O-N 2.88Å; F573-R577 VanDerWaalsContact O-N 3.1Å; F573-D622 HydrophobicContact CB-CB 4.11Å; F573-D622 HydrophobicContact CD2-CB 3.65Å; F573-D622 HydrophobicContact CE2-CB 4.38Å; F573-D622 HydrophobicContact CG-CB 4.08Å
574	F	91	Very high	92.2	Very high	3 Å²	3	28.9 Å²	28.9	1%	0.013	13%	0.134	C	C	.	.	H	α-helix	trans	-68.9	-33.8	177.7	48.3	-96	0	0	0	112.1	T572 R577 L578 L620 L623 E624 M849 L852 A853	T572-F574 HydrophobicContact CG2-CE1 4.21Å; T572-F574 HydrophobicContact CG2-CE2 3.85Å; T572-F574 HydrophobicContact CG2-CZ 3.58Å; T572-F574 PolarHBondContact O-N 2.76Å; T572-F574 WeakPolarHBondContact OG1-CD2 3.45Å; T572-F574 WeakPolarHBondContact OG1-CE2 3.34Å; F574-R577 PolarHBondContact O-N 3.35Å; F574-L578 WeakPolarHBondContact O-CB 3.45Å; F574-L578 PolarHBondContact O-N 3.11Å; F574-L620 HydrophobicContact CZ-CD1 4.29Å; F574-L623 HydrophobicContact CD1-CB 4.27Å; F574-L623 HydrophobicContact CE1-CB 3.86Å; F574-L623 HydrophobicContact CE1-CD1 4.13Å; F574-L623 HydrophobicContact CE1-CG 4.13Å; F574-L623 HydrophobicContact CZ-CD1 4.23Å; F574-E624 HydrophobicContact CB-CB 4.06Å; F574-E624 WeakPolarHBondContact CB-OE2 3.13Å; F574-M849 HydrophobicContact CB-SD 3.88Å; F574-M849 HydrophobicContact CD1-CG 4.25Å; F574-M849 HydrophobicContact CD2-CG 4.17Å; F574-M849 HydrophobicContact CD2-SD 4.12Å; F574-M849 HydrophobicContact CE2-CG 4.44Å; F574-M849 HydrophobicContact CG-CG 4.06Å; F574-M849 HydrophobicContact CG-SD 3.99Å; F574-L852 HydrophobicContact CE2-CB 3.81Å; F574-L852 HydrophobicContact CZ-CB 4.33Å; F574-A853 HydrophobicContact CD2-CB 3.65Å; F574-A853 HydrophobicContact CE2-CB 4.35Å
575	G	93.3	Very high	92.2	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-64.4	-40.3	170.2	0	0	0	0	0	112.8	T572 L578 L579 C857	T572-G575 PolarHBondContact O-N 3.02Å; T572-G575 WeakPolarHBondContact OG1-CA 3.44Å; T572-G575 PolarHBondContact OG1-N 3.2Å; G575-L578 PolarHBondContact O-N 2.96Å; G575-L579 WeakPolarHBondContact O-CB 3.4Å; G575-L579 PolarHBondContact O-N 3.36Å; G575-C857 PolarHBondContact O-SG 3.3Å
576	R	91.7	Very high	92.5	Very high	83 Å²	83	24.2 Å²	24.2	31%	0.313	11%	0.114	S	C	.	.	H	α-helix	trans	-62	-43.7	174.6	-65.9	-177.4	-172.2	-88.2	12.4	112.1	N568 C570 T572 F573 L579 R580	N568-R576 VanDerWaalsContact CG-NH1 3.35Å; N568-R576 PolarHBondContact ND2-NH1 3.18Å; N568-R576 WeakPolarHBondContact OD1-CG 3.41Å; N568-R576 PolarHBondContact OD1-NH1 2.95Å; C570-R576 HydrophobicContact CB-CG 3.74Å; C570-R576 PolarHBondContact O-NE 3.01Å; C570-R576 PolarHBondContact O-NH1 3.5Å; C570-R576 PolarHBondContact O-NH2 3.1Å; T572-R576 WeakPolarHBondContact O-CG 3.19Å; T572-R576 PolarHBondContact O-N 3.42Å; F573-R576 PolarHBondContact O-N 2.92Å; R576-L579 PolarHBondContact O-N 2.75Å; R576-R580 PolarHBondContact O-N 3.09Å
577	R	89.6	Confident	92.7	Very high	18 Å²	18	22.5 Å²	22.5	7%	0.068	11%	0.108	C	C	.	.	H	α-helix	trans	-62.3	-44.2	177.1	-73.1	-174.4	-70.3	-104.1	-3.9	111.3	D325 F573 F574 Q581 D622 E624	D325-R577 WeakPolarHBondContact OD1-CD 3.47Å; D325-R577 WeakPolarHBondContact OD2-CD 3.21Å; F573-R577 PolarHBondContact O-N 2.88Å; F573-R577 VanDerWaalsContact O-N 3.1Å; F574-R577 PolarHBondContact O-N 3.35Å; R577-Q581 PolarHBondContact O-N 3.2Å; R577-D622 IonicContact CZ-OD1 3.49Å; R577-D622 IonicContact CZ-OD2 2.64Å; R577-D622 IonicContact NH1-OD1 2.69Å; R577-D622 IonicContact NH1-OD2 2.68Å; R577-D622 PolarHBondContact NH1-OD2 2.84Å; R577-D622 IonicContact NH2-OD1 3.63Å; R577-D622 PolarHBondContact NH2-OD1 2.91Å; R577-D622 IonicContact NH2-OD2 2.65Å; R577-D622 PolarHBondContact NH2-OD2 3.07Å; R577-E624 IonicContact CZ-OE2 3.44Å; R577-E624 IonicContact NE-OE2 2.78Å; R577-E624 PolarHBondContact NE-OE2 2.88Å; R577-E624 IonicContact NH2-OE2 3.89Å; R577-E624 PolarHBondContact NH2-OE2 2.88Å
578	L	93.4	Very high	92.7	Very high	32 Å²	32	22.4 Å²	22.4	17%	0.168	11%	0.108	C	C	.	.	H	α-helix	trans	-66.7	-43.3	177.5	-177.1	62.2	0	0	0	112.7	F574 G575 R580 Q581 W582 A853 E854	F574-L578 WeakPolarHBondContact O-CB 3.45Å; F574-L578 PolarHBondContact O-N 3.11Å; G575-L578 PolarHBondContact O-N 2.96Å; L578-R580 VanDerWaalsContact C-N 3.29Å; L578-R580 PolarHBondContact O-N 3.12Å; L578-Q581 WeakPolarHBondContact O-CB 3.21Å; L578-Q581 PolarHBondContact O-N 2.87Å; L578-W582 HydrophobicContact CD2-CZ2 4.12Å; L578-W582 HydrophobicContact CG-CZ2 4.46Å; L578-W582 PolarHBondContact O-N 3.5Å; L578-A853 HydrophobicContact CB-CB 4.44Å; L578-A853 HydrophobicContact CD2-CB 3.72Å; L578-E854 HydrophobicContact CD2-CB 4.47Å; L578-E854 HydrophobicContact CD2-CG 3.8Å
579	L	94.7	Very high	92.7	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-59.8	-41	179.9	179.2	63.1	0	0	0	111.7	L567 N568 G575 R576 Q581 W582 I583 C857 A860 L861	L567-L579 HydrophobicContact CB-CD2 4.46Å; N568-L579 HydrophobicContact CB-CD2 4.16Å; G575-L579 WeakPolarHBondContact O-CB 3.4Å; G575-L579 PolarHBondContact O-N 3.36Å; R576-L579 PolarHBondContact O-N 2.75Å; L579-Q581 VanDerWaalsContact C-N 3.3Å; L579-Q581 PolarHBondContact O-N 2.81Å; L579-W582 WeakPolarHBondContact O-CB 3.37Å; L579-W582 PolarHBondContact O-N 3.39Å; L579-I583 HydrophobicContact CD1-CD1 4.14Å; L579-I583 HydrophobicContact CD1-CG1 4.33Å; L579-I583 HydrophobicContact CD2-CD1 4.42Å; L579-I583 HydrophobicContact CG-CD1 3.86Å; L579-I583 HydrophobicContact CG-CG1 4.47Å; L579-I583 WeakPolarHBondContact O-CG1 3.28Å; L579-I583 PolarHBondContact O-N 3.43Å; L579-C857 PolarHBondContact N-SG 3.21Å; L579-A860 HydrophobicContact CD2-CB 4.42Å; L579-L861 HydrophobicContact CD1-CD2 4.45Å
580	R	92.7	Very high	92.8	Very high	38 Å²	38	20 Å²	20	14%	0.143	9%	0.093	C	C	.	.	H	α-helix	trans	-55.5	-47.3	173.9	177.9	-168.9	167.3	131.4	-2.6	111.1	H323 H376 P378 L564 R576 L578 W582 I583 T584	H323-R580 PolarHBondContact CE1-NH1 2.88Å; H323-R580 PolarHBondContact ND1-NH1 3.33Å; H376-R580 PolarHBondContact O-NH2 3.16Å; P378-R580 VanDerWaalsContact CD-NH2 3.27Å; L564-R580 HydrophobicContact CD1-CB 4.25Å; L564-R580 HydrophobicContact CD2-CG 4.41Å; R576-R580 PolarHBondContact O-N 3.09Å; L578-R580 VanDerWaalsContact C-N 3.29Å; L578-R580 PolarHBondContact O-N 3.12Å; R580-W582 VanDerWaalsContact C-N 3.31Å; R580-W582 PolarHBondContact O-N 3.27Å; R580-I583 PolarHBondContact O-N 3.49Å; R580-T584 PolarHBondContact O-N 3.05Å; R580-T584 PolarHBondContact O-OG1 3.31Å; R580-T584 VanDerWaalsContact O-OG1 3.13Å
581	Q	90.9	Very high	92.8	Very high	93 Å²	93	24.3 Å²	24.3	44%	0.435	12%	0.116	S	C	.	.	H	α-helix	trans	-60.8	-42.3	178.6	-66	176.1	-8.2	0	0	111.3	R577 L578 L579 I583 T584 A585	R577-Q581 PolarHBondContact O-N 3.2Å; L578-Q581 WeakPolarHBondContact O-CB 3.21Å; L578-Q581 PolarHBondContact O-N 2.87Å; L579-Q581 VanDerWaalsContact C-N 3.3Å; L579-Q581 PolarHBondContact O-N 2.81Å; Q581-I583 VanDerWaalsContact C-N 3.33Å; Q581-I583 PolarHBondContact O-N 2.7Å; Q581-T584 PolarHBondContact O-N 2.76Å; Q581-T584 PolarHBondContact O-OG1 3.04Å; Q581-T584 VanDerWaalsContact O-OG1 3.07Å; Q581-A585 PolarHBondContact O-N 3.23Å
582	W	94.9	Very high	92.9	Very high	26 Å²	26	25.8 Å²	25.8	10%	0.098	13%	0.125	C	C	.	.	H	α-helix	trans	-61.8	-38.7	176.4	-73.4	10.3	0	0	0	112.7	L578 L579 R580 A585 P586 R596 E854 C857 I858 L861 L966	L578-W582 HydrophobicContact CD2-CZ2 4.12Å; L578-W582 HydrophobicContact CG-CZ2 4.46Å; L578-W582 PolarHBondContact O-N 3.5Å; L579-W582 WeakPolarHBondContact O-CB 3.37Å; L579-W582 PolarHBondContact O-N 3.39Å; R580-W582 VanDerWaalsContact C-N 3.31Å; R580-W582 PolarHBondContact O-N 3.27Å; W582-A585 CarbonylContact O-C 3.59Å; W582-A585 VanDerWaalsContact O-C 3.28Å; W582-P586 VanDerWaalsContact O-CA 3.31Å; W582-P586 WeakPolarHBondContact O-CA 3.26Å; W582-P586 VanDerWaalsContact O-N 3.12Å; W582-R596 VanDerWaalsContact CD2-NH2 3.3Å; W582-E854 HydrophobicContact CZ2-CB 4.49Å; W582-E854 HydrophobicContact CZ2-CG 4.11Å; W582-C857 HydrophobicContact CD2-CB 4.43Å; W582-C857 HydrophobicContact CE3-CB 3.75Å; W582-C857 HydrophobicContact CH2-CB 3.69Å; W582-C857 HydrophobicContact CZ2-CB 4.37Å; W582-C857 HydrophobicContact CZ3-CB 3.33Å; W582-I858 HydrophobicContact CH2-CD1 3.89Å; W582-I858 HydrophobicContact CH2-CG1 4.07Å; W582-I858 HydrophobicContact CZ3-CD1 3.79Å; W582-I858 HydrophobicContact CZ3-CG1 4.23Å; W582-L861 HydrophobicContact CE3-CD1 4.26Å; W582-L861 HydrophobicContact CZ3-CD1 4.19Å; W582-L966 HydrophobicContact CB-CD2 4.11Å; W582-L966 VanDerWaalsContact O-CD2 3.23Å; W582-L966 WeakPolarHBondContact O-CD2 3.42Å
583	I	94.8	Very high	93.1	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.005	12%	0.124	C	C	.	.	H	α-helix	trans	-70.4	-40.6	179.3	-68.4	165.9	0	0	0	111.5	I550 L563 L564 L567 L579 R580 Q581 L966	I550-I583 HydrophobicContact CG2-CG2 3.45Å; I550-I583 VanDerWaalsContact CG2-CG2 3.45Å; L563-I583 HydrophobicContact CD2-CG2 4.18Å; L564-I583 HydrophobicContact CD1-CD1 3.63Å; L567-I583 HydrophobicContact CB-CD1 4.04Å; L567-I583 HydrophobicContact CD1-CD1 3.67Å; L567-I583 HydrophobicContact CD1-CG1 3.88Å; L567-I583 HydrophobicContact CG-CD1 4.49Å; L579-I583 HydrophobicContact CD1-CD1 4.14Å; L579-I583 HydrophobicContact CD1-CG1 4.33Å; L579-I583 HydrophobicContact CD2-CD1 4.42Å; L579-I583 HydrophobicContact CG-CD1 3.86Å; L579-I583 HydrophobicContact CG-CG1 4.47Å; L579-I583 WeakPolarHBondContact O-CG1 3.28Å; L579-I583 PolarHBondContact O-N 3.43Å; R580-I583 PolarHBondContact O-N 3.49Å; Q581-I583 VanDerWaalsContact C-N 3.33Å; Q581-I583 PolarHBondContact O-N 2.7Å; I583-L966 HydrophobicContact CG1-CD1 4.06Å
584	T	92.4	Very high	93.5	Very high	6 Å²	6	27 Å²	27	4%	0.037	13%	0.128	C	C	.	.	H	α-helix	trans	-75.6	-24.8	178.9	53	0	0	0	0	113.3	H376 L545 I551 R580 Q581	H376-T584 PolarHBondContact CE1-O 3.27Å; H376-T584 PolarHBondContact NE2-O 3.23Å; L545-T584 HydrophobicContact CD2-CG2 4.29Å; I551-T584 HydrophobicContact CD1-CG2 3.47Å; I551-T584 VanDerWaalsContact CD1-CG2 3.47Å; I551-T584 HydrophobicContact CG1-CG2 3.91Å; R580-T584 PolarHBondContact O-N 3.05Å; R580-T584 PolarHBondContact O-OG1 3.31Å; R580-T584 VanDerWaalsContact O-OG1 3.13Å; Q581-T584 PolarHBondContact O-N 2.76Å; Q581-T584 PolarHBondContact O-OG1 3.04Å; Q581-T584 VanDerWaalsContact O-OG1 3.07Å
585	A	93.1	Very high	93.8	Very high	10 Å²	10	31.3 Å²	31.3	8%	0.083	15%	0.148	C	C	.	.	S	Bend	trans	-136.3	71.5	178.2	0	0	0	0	0	111.4	I514 Q537 Q581 W582	I514-A585 HydrophobicContact CD1-CB 4.04Å; Q537-A585 HydrophobicContact CB-CB 4.22Å; Q537-A585 HydrophobicContact CG-CB 4.12Å; Q581-A585 PolarHBondContact O-N 3.23Å; W582-A585 CarbonylContact O-C 3.59Å; W582-A585 VanDerWaalsContact O-C 3.28Å
586	P	96.2	Very high	93.9	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.152	C	C	.	.			trans	-61.7	149	178.7	-20.5	32.3	0	0	0	111.5	Q537 M538 L540 W582 I962 H965 L966	Q537-P586 CarbonylContact C-O 3.59Å; Q537-P586 VanDerWaalsContact CA-O 3.23Å; Q537-P586 WeakPolarHBondContact CA-O 3.31Å; M538-P586 HydrophobicContact CB-CB 4.37Å; M538-P586 PolarHBondContact N-O 3.17Å; L540-P586 HydrophobicContact CD1-CG 4.18Å; W582-P586 VanDerWaalsContact O-CA 3.31Å; W582-P586 WeakPolarHBondContact O-CA 3.26Å; W582-P586 VanDerWaalsContact O-N 3.12Å; P586-I962 HydrophobicContact CG-CG2 4.03Å; P586-H965 HydrophobicContact CB-CB 3.84Å; P586-L966 HydrophobicContact CB-CD2 4.31Å
587	P	95.2	Very high	94.2	Very high	10 Å²	10	29.1 Å²	29.1	7%	0.065	14%	0.14	C	C	.	.	B	Isolated β-bridge	trans	-70.8	144	177.8	28.5	-34	0	0	0	112.3	S536 V592 I593 H965	S536-P587 WeakPolarHBondContact O-CA 3.47Å; P587-V592 HydrophobicContact CB-CB 4.36Å; P587-V592 HydrophobicContact CB-CG1 3.92Å; P587-V592 HydrophobicContact CG-CG1 4.2Å; P587-I593 HydrophobicContact CB-CG1 4.49Å; P587-I593 HydrophobicContact CG-CG1 4.04Å; P587-I593 WeakPolarHBondContact O-CD1 3.38Å; P587-H965 VanDerWaalsContact CD-O 3.28Å; P587-H965 WeakPolarHBondContact CD-O 3.47Å; P587-H965 VanDerWaalsContact CG-O 3.24Å; P587-H965 WeakPolarHBondContact CG-O 3.19Å; P587-H965 PolarHBondContact O-CD2 3.18Å
588	C	92.6	Very high	94.5	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.163	C	C	.	.			trans	-91	-28.6	174.7	-76.5	0	0	0	0	113.5	F531 S536 Q537 M538 P590 V980	F531-C588 HydrophobicContact CE2-CB 3.84Å; F531-C588 HydrophobicContact CZ-CB 4.46Å; S536-C588 PolarHBondContact O-N 3.39Å; Q537-C588 PolarHBondContact O-SG 3.39Å; Q537-C588 VanDerWaalsContact O-SG 3.4Å; M538-C588 WeakPolarHBondContact CA-SG 3.44Å; M538-C588 PolarHBondContact N-SG 3Å; C588-P590 VanDerWaalsContact O-CD 3.31Å; C588-P590 WeakPolarHBondContact O-CD 3.17Å; C588-V980 PolarHBondContact SG-O 2.82Å
589	N	93	Very high	94.6	Very high	30 Å²	30	31.7 Å²	31.7	16%	0.16	16%	0.155	C	C	.	.			trans	-74.5	118.3	-171.4	-171	-44.4	0	0	0	110.9	N591 V592 I593	N589-N591 PolarHBondContact O-N 3.28Å; N589-N591 VanDerWaalsContact O-N 3.08Å; N589-N591 WeakPolarHBondContact OD1-CB 3.47Å; N589-N591 PolarHBondContact OD1-N 3.14Å; N589-V592 HydrophobicContact CB-CB 4.42Å; N589-V592 HydrophobicContact CB-CG2 4.04Å; N589-V592 PolarHBondContact O-N 2.96Å; N589-I593 WeakPolarHBondContact O-CG1 3.26Å; N589-I593 PolarHBondContact O-N 3.48Å; N589-I593 VanDerWaalsContact O-N 3.14Å
590	P	94	Very high	94.7	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-52.1	-34.2	179.2	-29	35.9	0	0	0	114.2	Y532 C588 I593 R594 F877 D879 P979	Y532-P590 HydrophobicContact CE1-CG 4.23Å; C588-P590 VanDerWaalsContact O-CD 3.31Å; C588-P590 WeakPolarHBondContact O-CD 3.17Å; P590-I593 PolarHBondContact O-N 3.45Å; P590-R594 VanDerWaalsContact O-CB 3.3Å; P590-R594 WeakPolarHBondContact O-CB 3.49Å; P590-R594 WeakPolarHBondContact O-CG 3.15Å; P590-R594 PolarHBondContact O-N 3.19Å; P590-F877 HydrophobicContact CB-CB 4.35Å; P590-D879 WeakPolarHBondContact CB-OD1 3.47Å; P590-P979 HydrophobicContact CG-CG 3.48Å; P590-P979 VanDerWaalsContact CG-CG 3.48Å
591	N	93.4	Very high	94.8	Very high	92 Å²	92	32.4 Å²	32.4	49%	0.492	16%	0.16	S	C	.	.	H	α-helix	trans	-67.6	-40.2	-179.1	-64.5	-38.4	0	0	0	111.8	N589 Q595	N589-N591 PolarHBondContact O-N 3.28Å; N589-N591 VanDerWaalsContact O-N 3.08Å; N589-N591 WeakPolarHBondContact OD1-CB 3.47Å; N589-N591 PolarHBondContact OD1-N 3.14Å; N591-Q595 WeakPolarHBondContact O-CB 3.46Å; N591-Q595 VanDerWaalsContact O-CG 3.23Å; N591-Q595 WeakPolarHBondContact O-CG 3.32Å; N591-Q595 PolarHBondContact O-N 3.01Å
592	V	94.5	Very high	95	Very high	58 Å²	58	28 Å²	28	35%	0.352	14%	0.14	S	C	.	.	H	α-helix	trans	-66.3	-42.6	175.6	178	0	0	0	0	110	P587 N589 Q595 R596	P587-V592 HydrophobicContact CB-CB 4.36Å; P587-V592 HydrophobicContact CB-CG1 3.92Å; P587-V592 HydrophobicContact CG-CG1 4.2Å; N589-V592 HydrophobicContact CB-CB 4.42Å; N589-V592 HydrophobicContact CB-CG2 4.04Å; N589-V592 PolarHBondContact O-N 2.96Å; V592-Q595 PolarHBondContact O-N 2.88Å; V592-R596 PolarHBondContact O-N 2.72Å; V592-R596 VanDerWaalsContact O-N 3.16Å
593	I	96.4	Very high	94.9	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-62.6	-49.1	178.1	-58.5	167.5	0	0	0	110.5	P587 N589 P590 Q595 R596 Q597 F877 A964 H965	P587-I593 HydrophobicContact CB-CG1 4.49Å; P587-I593 HydrophobicContact CG-CG1 4.04Å; P587-I593 WeakPolarHBondContact O-CD1 3.38Å; N589-I593 WeakPolarHBondContact O-CG1 3.26Å; N589-I593 PolarHBondContact O-N 3.48Å; N589-I593 VanDerWaalsContact O-N 3.14Å; P590-I593 PolarHBondContact O-N 3.45Å; I593-Q595 VanDerWaalsContact C-N 3.31Å; I593-Q595 PolarHBondContact O-N 2.86Å; I593-R596 WeakPolarHBondContact O-CB 3.28Å; I593-R596 PolarHBondContact O-N 3.28Å; I593-R596 VanDerWaalsContact O-N 3.09Å; I593-Q597 HydrophobicContact CG2-CG 4.46Å; I593-Q597 WeakPolarHBondContact O-CG 3.45Å; I593-Q597 PolarHBondContact O-N 3Å; I593-F877 HydrophobicContact CD1-CD1 4.19Å; I593-F877 HydrophobicContact CD1-CE1 3.69Å; I593-F877 HydrophobicContact CD1-CE2 4.28Å; I593-F877 HydrophobicContact CD1-CZ 3.74Å; I593-F877 HydrophobicContact CG2-CD2 4.03Å; I593-F877 HydrophobicContact CG2-CE2 3.57Å; I593-F877 HydrophobicContact CG2-CZ 4.02Å; I593-A964 WeakPolarHBondContact CG2-O 3.49Å; I593-H965 HydrophobicContact CD1-CB 4.44Å
594	R	96.7	Very high	94.8	Very high	68 Å²	68	28.9 Å²	28.9	26%	0.257	15%	0.146	S	C	.	.	H	α-helix	trans	-61.3	-36.9	177.5	-72.8	170.3	-170.9	145	2.8	112.2	P590 R596 Q597 L598 F877 D879	P590-R594 VanDerWaalsContact O-CB 3.3Å; P590-R594 WeakPolarHBondContact O-CB 3.49Å; P590-R594 WeakPolarHBondContact O-CG 3.15Å; P590-R594 PolarHBondContact O-N 3.19Å; R594-R596 VanDerWaalsContact C-N 3.32Å; R594-R596 PolarHBondContact O-N 2.99Å; R594-Q597 WeakPolarHBondContact O-CB 3.25Å; R594-Q597 PolarHBondContact O-N 3.41Å; R594-L598 WeakPolarHBondContact O-CB 3.39Å; R594-L598 VanDerWaalsContact O-CG 3.26Å; R594-L598 WeakPolarHBondContact O-CG 3.39Å; R594-L598 PolarHBondContact O-N 3.4Å; R594-F877 PolarHBondContact NH2-O 3.19Å; R594-D879 IonicContact CZ-OD1 3.55Å; R594-D879 IonicContact CZ-OD2 2.71Å; R594-D879 IonicContact NH1-OD1 3.61Å; R594-D879 PolarHBondContact NH1-OD1 2.95Å; R594-D879 IonicContact NH1-OD2 2.77Å; R594-D879 PolarHBondContact NH1-OD2 2.65Å; R594-D879 IonicContact NH2-OD1 3.03Å; R594-D879 PolarHBondContact NH2-OD1 3Å; R594-D879 IonicContact NH2-OD2 3.04Å; R594-D879 PolarHBondContact NH2-OD2 3.33Å; R594-D879 VanDerWaalsContact NH2-OD2 3.13Å
595	Q	96	Very high	94.8	Very high	92 Å²	92	32.5 Å²	32.5	43%	0.43	17%	0.171	S	C	.	.	H	α-helix	trans	-61.3	-40.4	173.8	-79	173.6	3.5	0	0	112.1	N591 V592 I593 A599 Y688	N591-Q595 WeakPolarHBondContact O-CB 3.46Å; N591-Q595 VanDerWaalsContact O-CG 3.23Å; N591-Q595 WeakPolarHBondContact O-CG 3.32Å; N591-Q595 PolarHBondContact O-N 3.01Å; V592-Q595 PolarHBondContact O-N 2.88Å; I593-Q595 VanDerWaalsContact C-N 3.31Å; I593-Q595 PolarHBondContact O-N 2.86Å; Q595-A599 WeakPolarHBondContact O-CB 3.36Å; Q595-A599 PolarHBondContact O-N 3.35Å; Q595-Y688 HydrophobicContact CB-CG 4.36Å
596	R	96.6	Very high	94.8	Very high	22 Å²	22	32.5 Å²	32.5	8%	0.083	17%	0.17	C	C	.	.	H	α-helix	trans	-67	-44.5	173.1	-67.1	-176.6	175.9	-179.7	-2.7	111.9	W582 V592 I593 R594 L598 A599 I600 Y688 I858 L966	W582-R596 VanDerWaalsContact CD2-NH2 3.3Å; V592-R596 PolarHBondContact O-N 2.72Å; V592-R596 VanDerWaalsContact O-N 3.16Å; I593-R596 WeakPolarHBondContact O-CB 3.28Å; I593-R596 PolarHBondContact O-N 3.28Å; I593-R596 VanDerWaalsContact O-N 3.09Å; R594-R596 VanDerWaalsContact C-N 3.32Å; R594-R596 PolarHBondContact O-N 2.99Å; R596-L598 PolarHBondContact O-N 3.15Å; R596-A599 WeakPolarHBondContact O-CB 3.23Å; R596-A599 PolarHBondContact O-N 2.88Å; R596-A599 VanDerWaalsContact O-N 3.16Å; R596-I600 WeakPolarHBondContact O-CG1 3.34Å; R596-I600 PolarHBondContact O-N 3.09Å; R596-Y688 HydrophobicContact CG-CE1 4.36Å; R596-I858 HydrophobicContact CB-CD1 4.19Å; R596-I858 HydrophobicContact CG-CD1 3.92Å; R596-L966 WeakPolarHBondContact CD-O 3.48Å; R596-L966 PolarHBondContact NH1-O 3.46Å
597	Q	96.9	Very high	94.6	Very high	15 Å²	15	34.8 Å²	34.8	7%	0.07	19%	0.186	C	C	.	.	H	α-helix	trans	-55.9	-50	175.1	-71.7	177.8	-26.4	0	0	111.3	I593 R594 A599 I600 E601 L874 P875 G967	I593-Q597 HydrophobicContact CG2-CG 4.46Å; I593-Q597 WeakPolarHBondContact O-CG 3.45Å; I593-Q597 PolarHBondContact O-N 3Å; R594-Q597 WeakPolarHBondContact O-CB 3.25Å; R594-Q597 PolarHBondContact O-N 3.41Å; Q597-A599 VanDerWaalsContact C-N 3.31Å; Q597-A599 PolarHBondContact O-N 3.34Å; Q597-I600 PolarHBondContact O-N 3.23Å; Q597-E601 WeakPolarHBondContact O-CG 3.36Å; Q597-E601 PolarHBondContact O-N 2.93Å; Q597-L874 HydrophobicContact CB-CD1 3.96Å; Q597-L874 HydrophobicContact CG-CD1 3.75Å; Q597-L874 HydrophobicContact CG-CG 4.48Å; Q597-P875 PolarHBondContact NE2-O 3.37Å; Q597-G967 WeakPolarHBondContact CA-O 3.41Å; Q597-G967 WeakPolarHBondContact CG-O 3.5Å
598	L	96.6	Very high	94.4	Very high	104 Å²	104	41.5 Å²	41.5	55%	0.545	22%	0.221	S	C	.	.	H	α-helix	trans	-61.8	-38.3	177.2	-70.7	172.5	0	0	0	112.3	R594 R596 N602	R594-L598 WeakPolarHBondContact O-CB 3.39Å; R594-L598 VanDerWaalsContact O-CG 3.26Å; R594-L598 WeakPolarHBondContact O-CG 3.39Å; R594-L598 PolarHBondContact O-N 3.4Å; R596-L598 PolarHBondContact O-N 3.15Å; L598-N602 WeakPolarHBondContact O-CB 3.41Å; L598-N602 PolarHBondContact O-N 3.45Å
599	A	95.9	Very high	94.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-63.5	-43.8	174.5	0	0	0	0	0	111.7	Q595 R596 Q597 N602 L603 S686 Y688 L689 I858	Q595-A599 WeakPolarHBondContact O-CB 3.36Å; Q595-A599 PolarHBondContact O-N 3.35Å; R596-A599 WeakPolarHBondContact O-CB 3.23Å; R596-A599 PolarHBondContact O-N 2.88Å; R596-A599 VanDerWaalsContact O-N 3.16Å; Q597-A599 VanDerWaalsContact C-N 3.31Å; Q597-A599 PolarHBondContact O-N 3.34Å; A599-N602 PolarHBondContact O-N 3.33Å; A599-L603 WeakPolarHBondContact O-CG 3.31Å; A599-L603 PolarHBondContact O-N 2.69Å; A599-S686 WeakPolarHBondContact CA-OG 3.18Å; A599-S686 PolarHBondContact N-OG 3.06Å; A599-Y688 HydrophobicContact CB-CD1 4.06Å; A599-L689 HydrophobicContact CB-CB 4.08Å; A599-I858 HydrophobicContact CB-CG2 3.98Å
600	I	95.7	Very high	94.4	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-63.3	-46.8	176.5	-70.1	168.8	0	0	0	111.1	R596 Q597 N602 L603 I604 I858 L861 G967 C968	R596-I600 WeakPolarHBondContact O-CG1 3.34Å; R596-I600 PolarHBondContact O-N 3.09Å; Q597-I600 PolarHBondContact O-N 3.23Å; I600-N602 VanDerWaalsContact C-N 3.26Å; I600-N602 PolarHBondContact O-N 2.68Å; I600-L603 WeakPolarHBondContact O-CB 3.5Å; I600-L603 PolarHBondContact O-N 3.38Å; I600-I604 HydrophobicContact CG2-CD1 4.29Å; I600-I604 WeakPolarHBondContact O-CG1 3.34Å; I600-I604 PolarHBondContact O-N 2.89Å; I600-I858 HydrophobicContact CG1-CG2 4.04Å; I600-L861 HydrophobicContact CD1-CB 3.65Å; I600-L861 HydrophobicContact CD1-CD1 4.46Å; I600-L861 HydrophobicContact CG1-CB 4.41Å; I600-G967 WeakPolarHBondContact CD1-O 3.41Å; I600-C968 HydrophobicContact CD1-CB 4.08Å
601	E	95.2	Very high	94.4	Very high	53 Å²	53	44.4 Å²	44.4	25%	0.248	24%	0.241	C	C	.	.	H	α-helix	trans	-60.7	-36.9	176.6	-68.3	-59	141.9	0	0	112	Q597 I604 S605 L874 R969	Q597-E601 WeakPolarHBondContact O-CG 3.36Å; Q597-E601 PolarHBondContact O-N 2.93Å; E601-I604 WeakPolarHBondContact O-CB 3.33Å; E601-I604 PolarHBondContact O-N 3.2Å; E601-S605 PolarHBondContact O-N 3.4Å; E601-S605 VanDerWaalsContact O-N 3.14Å; E601-L874 HydrophobicContact CG-CD2 4.31Å; E601-R969 IonicContact OE1-CZ 3.26Å; E601-R969 VanDerWaalsContact OE1-CZ 3.25Å; E601-R969 IonicContact OE1-NE 2.85Å; E601-R969 PolarHBondContact OE1-NE 2.97Å; E601-R969 IonicContact OE1-NH2 2.65Å; E601-R969 PolarHBondContact OE1-NH2 3.18Å; E601-R969 IonicContact OE2-CZ 3.96Å; E601-R969 IonicContact OE2-NH2 3.41Å; E601-R969 PolarHBondContact OE2-NH2 3.27Å
602	N	94.5	Very high	94.4	Very high	2 Å²	2	46 Å²	46	1%	0.011	24%	0.244	C	C	.	.	H	α-helix	trans	-67.1	-40	173.3	-165.7	-178.9	0	0	0	111.4	L598 A599 I600 I604 S605 I606 P683 L684 S685 S686 L689	L598-N602 WeakPolarHBondContact O-CB 3.41Å; L598-N602 PolarHBondContact O-N 3.45Å; A599-N602 PolarHBondContact O-N 3.33Å; I600-N602 VanDerWaalsContact C-N 3.26Å; I600-N602 PolarHBondContact O-N 2.68Å; N602-I604 VanDerWaalsContact C-N 3.3Å; N602-I604 PolarHBondContact O-N 3.43Å; N602-S605 PolarHBondContact ND2-OG 2.95Å; N602-S605 WeakPolarHBondContact O-CB 3.24Å; N602-S605 PolarHBondContact O-N 3.21Å; N602-S605 VanDerWaalsContact O-N 3.14Å; N602-S605 PolarHBondContact O-OG 2.86Å; N602-I606 PolarHBondContact O-N 3.33Å; N602-P683 PolarHBondContact ND2-O 3.1Å; N602-P683 VanDerWaalsContact ND2-O 3.13Å; N602-L684 WeakPolarHBondContact OD1-CA 3.26Å; N602-S685 PolarHBondContact OD1-N 3.32Å; N602-S686 PolarHBondContact OD1-N 3.39Å; N602-S686 VanDerWaalsContact OD1-N 3.16Å; N602-L689 HydrophobicContact CB-CD2 4.28Å
603	L	94.5	Very high	94.4	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-62.1	-36.2	172.9	-68	-175.2	0	0	0	112.5	A599 I600 S605 I606 S607 I610 L689 I858 I859 Y862	A599-L603 WeakPolarHBondContact O-CG 3.31Å; A599-L603 PolarHBondContact O-N 2.69Å; I600-L603 WeakPolarHBondContact O-CB 3.5Å; I600-L603 PolarHBondContact O-N 3.38Å; L603-S605 VanDerWaalsContact C-N 3.31Å; L603-S605 PolarHBondContact O-N 3.23Å; L603-I606 HydrophobicContact CD2-CD1 4.1Å; L603-I606 HydrophobicContact CD2-CG1 4.4Å; L603-I606 CarbonylContact O-C 3.55Å; L603-I606 VanDerWaalsContact O-C 3.3Å; L603-I606 PolarHBondContact O-N 3.44Å; L603-I606 VanDerWaalsContact O-N 3.12Å; L603-S607 PolarHBondContact O-N 3.31Å; L603-S607 VanDerWaalsContact O-N 3.1Å; L603-I610 HydrophobicContact CB-CD1 4.4Å; L603-I610 HydrophobicContact CD2-CD1 3.99Å; L603-L689 HydrophobicContact CD2-CD2 3.74Å; L603-L689 HydrophobicContact CG-CD2 4.2Å; L603-I858 HydrophobicContact CD1-CG2 3.76Å; L603-I859 HydrophobicContact CD1-CG1 3.83Å; L603-Y862 HydrophobicContact CB-CD2 3.94Å; L603-Y862 HydrophobicContact CB-CG 3.97Å; L603-Y862 HydrophobicContact CD1-CG 4.29Å
604	I	92.7	Very high	94.3	Very high	43 Å²	43	47.3 Å²	47.3	22%	0.221	24%	0.242	C	C	.	.	H	α-helix	trans	-59.1	-43.6	172.9	-64	169.8	0	0	0	110.7	I600 E601 N602 I606 S607 Y862 T866	I600-I604 HydrophobicContact CG2-CD1 4.29Å; I600-I604 WeakPolarHBondContact O-CG1 3.34Å; I600-I604 PolarHBondContact O-N 2.89Å; E601-I604 WeakPolarHBondContact O-CB 3.33Å; E601-I604 PolarHBondContact O-N 3.2Å; N602-I604 VanDerWaalsContact C-N 3.3Å; N602-I604 PolarHBondContact O-N 3.43Å; I604-I606 PolarHBondContact O-N 2.88Å; I604-S607 WeakPolarHBondContact O-CB 3.5Å; I604-S607 PolarHBondContact O-N 2.7Å; I604-S607 PolarHBondContact O-OG 2.92Å; I604-Y862 HydrophobicContact CB-CE2 4.22Å; I604-Y862 HydrophobicContact CG1-CD2 3.6Å; I604-Y862 HydrophobicContact CG1-CE2 3.58Å; I604-T866 HydrophobicContact CD1-CG2 4.43Å; I604-T866 HydrophobicContact CG1-CG2 4.06Å
605	S	92.4	Very high	94.2	Very high	82 Å²	82	50 Å²	50	57%	0.573	26%	0.258	S	S	*	.	H	α-helix	trans	-64	-20	177.5	71.3	0	0	0	0	114.5	E601 N602 L603	E601-S605 PolarHBondContact O-N 3.4Å; E601-S605 VanDerWaalsContact O-N 3.14Å; N602-S605 PolarHBondContact ND2-OG 2.95Å; N602-S605 WeakPolarHBondContact O-CB 3.24Å; N602-S605 PolarHBondContact O-N 3.21Å; N602-S605 VanDerWaalsContact O-N 3.14Å; N602-S605 PolarHBondContact O-OG 2.86Å; L603-S605 VanDerWaalsContact C-N 3.31Å; L603-S605 PolarHBondContact O-N 3.23Å
606	I	92.2	Very high	94.1	Very high	10 Å²	10	48.4 Å²	48.4	5%	0.051	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117	29	177.9	66.1	172.3	0	0	0	111.8	N602 L603 I604 D608 I609 Y682 L684	N602-I606 PolarHBondContact O-N 3.33Å; L603-I606 HydrophobicContact CD2-CD1 4.1Å; L603-I606 HydrophobicContact CD2-CG1 4.4Å; L603-I606 CarbonylContact O-C 3.55Å; L603-I606 VanDerWaalsContact O-C 3.3Å; L603-I606 PolarHBondContact O-N 3.44Å; L603-I606 VanDerWaalsContact O-N 3.12Å; I604-I606 PolarHBondContact O-N 2.88Å; I606-D608 PolarHBondContact O-N 3.15Å; I606-I609 HydrophobicContact CB-CG2 4.48Å; I606-I609 HydrophobicContact CD1-CG2 4.35Å; I606-I609 HydrophobicContact CG1-CG2 4.46Å; I606-I609 WeakPolarHBondContact O-CG2 3.39Å; I606-I609 PolarHBondContact O-N 2.98Å; I606-Y682 HydrophobicContact CB-CD1 4.44Å; I606-Y682 HydrophobicContact CG2-CD1 4.09Å; I606-Y682 HydrophobicContact CG2-CG 4.34Å; I606-L684 HydrophobicContact CD1-CD2 4.46Å
607	S	91.6	Very high	94	Very high	48 Å²	48	47.4 Å²	47.4	34%	0.336	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-53.6	-30.7	-174.2	55.1	0	0	0	0	114.7	L603 I604 I609 I610 P611 Y862	L603-S607 PolarHBondContact O-N 3.31Å; L603-S607 VanDerWaalsContact O-N 3.1Å; I604-S607 WeakPolarHBondContact O-CB 3.5Å; I604-S607 PolarHBondContact O-N 2.7Å; I604-S607 PolarHBondContact O-OG 2.92Å; S607-I609 PolarHBondContact O-N 3.01Å; S607-I610 PolarHBondContact O-N 2.68Å; S607-P611 WeakPolarHBondContact O-CD 3.32Å; S607-Y862 WeakPolarHBondContact CB-OH 3.3Å
608	D	92	Very high	93.7	Very high	151 Å²	151	49.7 Å²	49.7	81%	0.807	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-58.1	-30.4	-179.6	-66.1	-27.4	0	0	0	114.2	I606	I606-D608 PolarHBondContact O-N 3.15Å
609	I	92.5	Very high	93.5	Very high	4 Å²	4	49 Å²	49	2%	0.021	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-88.6	-21.6	-179	-158.1	-178.5	0	0	0	113	I606 S607 P611 K612 L613 E678 Y682	I606-I609 HydrophobicContact CB-CG2 4.48Å; I606-I609 HydrophobicContact CD1-CG2 4.35Å; I606-I609 HydrophobicContact CG1-CG2 4.46Å; I606-I609 WeakPolarHBondContact O-CG2 3.39Å; I606-I609 PolarHBondContact O-N 2.98Å; S607-I609 PolarHBondContact O-N 3.01Å; I609-P611 VanDerWaalsContact C-CD 3.48Å; I609-K612 HydrophobicContact CG1-CB 4.47Å; I609-K612 WeakPolarHBondContact O-CB 3.47Å; I609-K612 PolarHBondContact O-N 2.86Å; I609-L613 HydrophobicContact CD1-CD2 4.09Å; I609-L613 HydrophobicContact CD1-CG 4.24Å; I609-L613 HydrophobicContact CG1-CD1 4.46Å; I609-L613 HydrophobicContact CG1-CD2 4.37Å; I609-L613 HydrophobicContact CG1-CG 4.04Å; I609-L613 HydrophobicContact CG2-CD1 3.73Å; I609-L613 HydrophobicContact CG2-CG 4.22Å; I609-L613 PolarHBondContact O-N 3.28Å; I609-E678 HydrophobicContact CD1-CG 3.65Å; I609-Y682 HydrophobicContact CD1-CD2 4.25Å; I609-Y682 HydrophobicContact CD1-CE2 3.44Å; I609-Y682 VanDerWaalsContact CD1-CE2 3.44Å
610	I	93.4	Very high	93.3	Very high	2 Å²	2	49.3 Å²	49.3	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-55.5	-42.3	-172	-53	-61.5	0	0	0	112.9	L603 S607 K612 L613 R614 I859 Y862	L603-I610 HydrophobicContact CB-CD1 4.4Å; L603-I610 HydrophobicContact CD2-CD1 3.99Å; S607-I610 PolarHBondContact O-N 2.68Å; I610-K612 VanDerWaalsContact C-N 3.33Å; I610-K612 PolarHBondContact O-N 2.95Å; I610-L613 HydrophobicContact CD1-CD1 4.18Å; I610-L613 PolarHBondContact O-N 2.99Å; I610-R614 HydrophobicContact CG2-CG 4.16Å; I610-R614 WeakPolarHBondContact O-CB 3.07Å; I610-R614 VanDerWaalsContact O-CG 3.31Å; I610-R614 WeakPolarHBondContact O-CG 3.44Å; I610-R614 PolarHBondContact O-N 3.06Å; I610-I859 HydrophobicContact CG2-CG2 3.93Å; I610-Y862 HydrophobicContact CB-CE1 4.05Å; I610-Y862 HydrophobicContact CG1-CD1 4.42Å; I610-Y862 HydrophobicContact CG1-CE1 3.75Å; I610-Y862 HydrophobicContact CG2-CD1 4.16Å; I610-Y862 HydrophobicContact CG2-CE1 3.72Å
611	P	93.7	Very high	93	Very high	85 Å²	85	50.3 Å²	50.3	55%	0.552	27%	0.27	S	S	*	.	H	α-helix	trans	-57.6	-43.2	175.6	-25.4	35.4	0	0	0	113.1	S607 I609 R614 E615	S607-P611 WeakPolarHBondContact O-CD 3.32Å; I609-P611 VanDerWaalsContact C-CD 3.48Å; P611-R614 PolarHBondContact O-N 2.92Å; P611-E615 PolarHBondContact O-N 3.42Å
612	K	93.6	Very high	92.7	Very high	127 Å²	127	48 Å²	48	55%	0.552	26%	0.259	S	S	*	.	H	α-helix	trans	-67.2	-40	178.2	-63.5	179.5	-178.8	174.7	0	111.8	I609 I610 R614 E615 K616	I609-K612 HydrophobicContact CG1-CB 4.47Å; I609-K612 WeakPolarHBondContact O-CB 3.47Å; I609-K612 PolarHBondContact O-N 2.86Å; I610-K612 VanDerWaalsContact C-N 3.33Å; I610-K612 PolarHBondContact O-N 2.95Å; K612-R614 VanDerWaalsContact C-N 3.34Å; K612-E615 PolarHBondContact O-N 3.44Å; K612-K616 WeakPolarHBondContact O-CG 3.42Å; K612-K616 PolarHBondContact O-N 3.19Å; K612-K616 VanDerWaalsContact O-N 3.15Å
613	L	93.6	Very high	92.6	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-63.8	-42.3	175.8	-65	175.3	0	0	0	111.2	I609 I610 K616 L617 I675 I679	I609-L613 HydrophobicContact CD1-CD2 4.09Å; I609-L613 HydrophobicContact CD1-CG 4.24Å; I609-L613 HydrophobicContact CG1-CD1 4.46Å; I609-L613 HydrophobicContact CG1-CD2 4.37Å; I609-L613 HydrophobicContact CG1-CG 4.04Å; I609-L613 HydrophobicContact CG2-CD1 3.73Å; I609-L613 HydrophobicContact CG2-CG 4.22Å; I609-L613 PolarHBondContact O-N 3.28Å; I610-L613 HydrophobicContact CD1-CD1 4.18Å; I610-L613 PolarHBondContact O-N 2.99Å; L613-K616 CarbonylContact O-C 3.6Å; L613-K616 PolarHBondContact O-N 3.02Å; L613-L617 WeakPolarHBondContact O-CG 3.36Å; L613-L617 PolarHBondContact O-N 3.1Å; L613-I675 HydrophobicContact CD2-CG2 4.33Å; L613-I679 HydrophobicContact CD1-CD1 3.76Å; L613-I679 HydrophobicContact CD1-CG1 3.51Å; L613-I679 HydrophobicContact CD2-CD1 4.08Å; L613-I679 HydrophobicContact CD2-CG1 3.68Å; L613-I679 HydrophobicContact CG-CG1 4.25Å
614	R	94.2	Very high	92.3	Very high	85 Å²	85	49.5 Å²	49.5	32%	0.321	27%	0.266	S	S	.	.	H	α-helix	trans	-64.8	-39.9	177.6	-72.6	-175.4	72.2	-134.4	0.3	112.5	T569 C571 I610 P611 K612 K616 L617 A618 I859	T569-R614 PolarHBondContact O-NH2 2.81Å; C571-R614 PolarHBondContact SG-NE 3.07Å; I610-R614 HydrophobicContact CG2-CG 4.16Å; I610-R614 WeakPolarHBondContact O-CB 3.07Å; I610-R614 VanDerWaalsContact O-CG 3.31Å; I610-R614 WeakPolarHBondContact O-CG 3.44Å; I610-R614 PolarHBondContact O-N 3.06Å; P611-R614 PolarHBondContact O-N 2.92Å; K612-R614 VanDerWaalsContact C-N 3.34Å; R614-K616 VanDerWaalsContact C-N 3.27Å; R614-K616 PolarHBondContact O-N 3.2Å; R614-L617 PolarHBondContact O-N 3.03Å; R614-A618 VanDerWaalsContact O-CB 3.31Å; R614-A618 WeakPolarHBondContact O-CB 3.43Å; R614-A618 PolarHBondContact O-N 2.97Å; R614-I859 HydrophobicContact CG-CG2 4.1Å
615	E	94.3	Very high	92.1	Very high	125 Å²	125	48.2 Å²	48.2	58%	0.584	26%	0.258	S	S	*	.	H	α-helix	trans	-56.7	-44.2	172.4	-170.6	-174.1	169.8	0	0	110.9	P611 K612 Q619	P611-E615 PolarHBondContact O-N 3.42Å; K612-E615 PolarHBondContact O-N 3.44Å; E615-Q619 WeakPolarHBondContact O-CG 3.48Å; E615-Q619 PolarHBondContact O-N 2.83Å
616	K	94.1	Very high	91.9	Very high	58 Å²	58	44.3 Å²	44.3	25%	0.252	23%	0.231	S	C	.	.	H	α-helix	trans	-68.4	-41.1	175.2	-67.4	177.8	-179.8	176.9	0	113	K612 L613 R614 A618 Q619 L671 I675 E678	K612-K616 WeakPolarHBondContact O-CG 3.42Å; K612-K616 PolarHBondContact O-N 3.19Å; K612-K616 VanDerWaalsContact O-N 3.15Å; L613-K616 CarbonylContact O-C 3.6Å; L613-K616 PolarHBondContact O-N 3.02Å; R614-K616 VanDerWaalsContact C-N 3.27Å; R614-K616 PolarHBondContact O-N 3.2Å; K616-A618 VanDerWaalsContact C-N 3.32Å; K616-A618 PolarHBondContact O-N 3.19Å; K616-Q619 WeakPolarHBondContact O-CB 3.43Å; K616-Q619 PolarHBondContact O-N 3.37Å; K616-L671 HydrophobicContact CB-CD1 4.17Å; K616-L671 HydrophobicContact CD-CD1 4.3Å; K616-L671 HydrophobicContact CG-CD1 4.21Å; K616-L671 WeakPolarHBondContact O-CD2 3.33Å; K616-I675 HydrophobicContact CB-CD1 3.85Å; K616-I675 HydrophobicContact CB-CG1 3.77Å; K616-I675 HydrophobicContact CD-CG1 4.18Å; K616-E678 IonicContact NZ-OE1 3.25Å; K616-E678 PolarHBondContact NZ-OE1 3.11Å; K616-E678 IonicContact NZ-OE2 2.65Å; K616-E678 PolarHBondContact NZ-OE2 2.79Å
617	L	93.9	Very high	91.8	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63.9	-37.7	177.1	-73.3	166.8	0	0	0	111.6	C571 T572 L613 R614 Q619 L620 I675 L852 I859	C571-L617 HydrophobicContact CB-CB 3.74Å; T572-L617 HydrophobicContact CG2-CB 4.2Å; T572-L617 HydrophobicContact CG2-CD2 4.05Å; L613-L617 WeakPolarHBondContact O-CG 3.36Å; L613-L617 PolarHBondContact O-N 3.1Å; R614-L617 PolarHBondContact O-N 3.03Å; L617-Q619 PolarHBondContact O-N 2.99Å; L617-L620 HydrophobicContact CD2-CD1 3.92Å; L617-L620 WeakPolarHBondContact O-CB 3.38Å; L617-L620 PolarHBondContact O-N 3.37Å; L617-L620 VanDerWaalsContact O-N 3.14Å; L617-I675 HydrophobicContact CD2-CD1 4.01Å; L617-I675 HydrophobicContact CG-CD1 4.27Å; L617-L852 HydrophobicContact CD2-CD2 4.01Å; L617-I859 HydrophobicContact CD1-CD1 3.75Å
618	A	92.1	Very high	91.5	Very high	64 Å²	64	41.9 Å²	41.9	53%	0.529	22%	0.215	S	C	.	.	H	α-helix	trans	-67	-24.7	176.8	0	0	0	0	0	112.8	C571 R614 K616 L620	C571-A618 HydrophobicContact CB-CB 4.25Å; R614-A618 VanDerWaalsContact O-CB 3.31Å; R614-A618 WeakPolarHBondContact O-CB 3.43Å; R614-A618 PolarHBondContact O-N 2.97Å; K616-A618 VanDerWaalsContact C-N 3.32Å; K616-A618 PolarHBondContact O-N 3.19Å; A618-L620 VanDerWaalsContact C-N 3.27Å; A618-L620 PolarHBondContact O-N 3.16Å
619	Q	91.5	Very high	91.2	Very high	88 Å²	88	35.2 Å²	35.2	41%	0.411	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-12.7	174.4	-67.5	168.7	26.9	0	0	113.3	E615 K616 L617 L671	E615-Q619 WeakPolarHBondContact O-CG 3.48Å; E615-Q619 PolarHBondContact O-N 2.83Å; K616-Q619 WeakPolarHBondContact O-CB 3.43Å; K616-Q619 PolarHBondContact O-N 3.37Å; L617-Q619 PolarHBondContact O-N 2.99Å; Q619-L671 HydrophobicContact CB-CD2 3.87Å
620	L	92.4	Very high	90.9	Very high	7 Å²	7	35 Å²	35	4%	0.037	18%	0.178	C	C	.	.			trans	-72.6	131.1	179.4	-66.4	173.8	0	0	0	110.2	T572 F574 L617 A618 L623 G668 L671 I675 L852	T572-L620 HydrophobicContact CG2-CB 4.46Å; T572-L620 HydrophobicContact CG2-CD1 4.06Å; F574-L620 HydrophobicContact CZ-CD1 4.29Å; L617-L620 HydrophobicContact CD2-CD1 3.92Å; L617-L620 WeakPolarHBondContact O-CB 3.38Å; L617-L620 PolarHBondContact O-N 3.37Å; L617-L620 VanDerWaalsContact O-N 3.14Å; A618-L620 VanDerWaalsContact C-N 3.27Å; A618-L620 PolarHBondContact O-N 3.16Å; L620-L623 HydrophobicContact CD2-CD1 4.4Å; L620-G668 WeakPolarHBondContact CD2-O 3.46Å; L620-L671 HydrophobicContact CD2-CB 4.04Å; L620-L671 HydrophobicContact CD2-CD2 3.95Å; L620-L671 HydrophobicContact CD2-CG 4.11Å; L620-L671 HydrophobicContact CG-CD2 4.41Å; L620-I675 HydrophobicContact CD1-CD1 4.06Å; L620-I675 HydrophobicContact CG-CD1 4.49Å; L620-L852 HydrophobicContact CD1-CD2 4.23Å
621	P	89.8	Confident	90.5	Very high	22 Å²	22	35.9 Å²	35.9	14%	0.143	18%	0.182	C	C	.	.			trans	-71.3	177.5	171.7	33.3	-36.1	0	0	0	110.8	L623 L626	P621-L623 HydrophobicContact CG-CD2 4.03Å; P621-L623 HydrophobicContact CG-CG 4.46Å; P621-L623 PolarHBondContact O-N 3.45Å; P621-L626 HydrophobicContact CB-CD1 3.59Å; P621-L626 HydrophobicContact CG-CD1 3.55Å
622	D	88.2	Confident	89.8	Confident	5 Å²	5	33.1 Å²	33.1	3%	0.027	16%	0.162	C	C	.	.			trans	-69.4	77	171.5	-166.9	-16.6	0	0	0	110.7	I297 F573 R577 E624 R625 L626	I297-D622 HydrophobicContact CG2-CB 4.21Å; F573-D622 HydrophobicContact CB-CB 4.11Å; F573-D622 HydrophobicContact CD2-CB 3.65Å; F573-D622 HydrophobicContact CE2-CB 4.38Å; F573-D622 HydrophobicContact CG-CB 4.08Å; R577-D622 IonicContact CZ-OD1 3.49Å; R577-D622 IonicContact CZ-OD2 2.64Å; R577-D622 IonicContact NH1-OD1 2.69Å; R577-D622 IonicContact NH1-OD2 2.68Å; R577-D622 PolarHBondContact NH1-OD2 2.84Å; R577-D622 IonicContact NH2-OD1 3.63Å; R577-D622 PolarHBondContact NH2-OD1 2.91Å; R577-D622 IonicContact NH2-OD2 2.65Å; R577-D622 PolarHBondContact NH2-OD2 3.07Å; D622-E624 VanDerWaalsContact C-N 3.25Å; D622-E624 PolarHBondContact O-N 3.41Å; D622-R625 HydrophobicContact CB-CB 4.41Å; D622-R625 PolarHBondContact O-N 3.38Å; D622-R625 VanDerWaalsContact O-N 3.15Å; D622-R625 PolarHBondContact OD1-N 3.16Å; D622-R625 WeakPolarHBondContact OD2-CD 3.38Å; D622-R625 WeakPolarHBondContact OD2-CG 3.41Å; D622-R625 IonicContact OD2-CZ 3.83Å; D622-R625 IonicContact OD2-NE 3.25Å; D622-R625 IonicContact OD2-NH1 3.78Å; D622-R625 PolarHBondContact OD2-NH1 2.77Å; D622-L626 WeakPolarHBondContact O-CG 3.46Å; D622-L626 PolarHBondContact O-N 2.84Å
623	L	91.6	Very high	89.1	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-56.5	-39.3	-175.7	-72.6	176.7	0	0	0	112	F574 L620 P621 R625 L626 I627 T665 F669 M849	F574-L623 HydrophobicContact CD1-CB 4.27Å; F574-L623 HydrophobicContact CE1-CB 3.86Å; F574-L623 HydrophobicContact CE1-CD1 4.13Å; F574-L623 HydrophobicContact CE1-CG 4.13Å; F574-L623 HydrophobicContact CZ-CD1 4.23Å; L620-L623 HydrophobicContact CD2-CD1 4.4Å; P621-L623 HydrophobicContact CG-CD2 4.03Å; P621-L623 HydrophobicContact CG-CG 4.46Å; P621-L623 PolarHBondContact O-N 3.45Å; L623-R625 VanDerWaalsContact C-N 3.32Å; L623-R625 PolarHBondContact O-N 3.05Å; L623-L626 PolarHBondContact O-N 3.17Å; L623-I627 WeakPolarHBondContact O-CG1 3.49Å; L623-I627 WeakPolarHBondContact O-CG2 3.47Å; L623-I627 PolarHBondContact O-N 2.85Å; L623-T665 HydrophobicContact CD2-CG2 4.43Å; L623-F669 HydrophobicContact CD1-CE1 4.29Å; L623-F669 HydrophobicContact CD2-CD2 4.36Å; L623-F669 HydrophobicContact CD2-CE2 4.2Å; L623-F669 HydrophobicContact CD2-CZ 4.44Å; L623-M849 HydrophobicContact CB-CG 4.28Å
624	E	89.3	Confident	88.2	Confident	34 Å²	34	28.9 Å²	28.9	16%	0.159	15%	0.145	C	C	.	.	H	α-helix	trans	-60.8	-40.2	179.9	-175	178.6	-163.8	0	0	111.8	T353 F574 R577 D622 I627 T628 M849	T353-E624 HydrophobicContact CG2-CG 3.94Å; T353-E624 WeakPolarHBondContact CG2-OE1 3.37Å; F574-E624 HydrophobicContact CB-CB 4.06Å; F574-E624 WeakPolarHBondContact CB-OE2 3.13Å; R577-E624 IonicContact CZ-OE2 3.44Å; R577-E624 IonicContact NE-OE2 2.78Å; R577-E624 PolarHBondContact NE-OE2 2.88Å; R577-E624 IonicContact NH2-OE2 3.89Å; R577-E624 PolarHBondContact NH2-OE2 2.88Å; D622-E624 VanDerWaalsContact C-N 3.25Å; D622-E624 PolarHBondContact O-N 3.41Å; E624-I627 WeakPolarHBondContact O-CG1 3.49Å; E624-T628 PolarHBondContact O-OG1 2.77Å; E624-M849 HydrophobicContact CB-CE 3.99Å; E624-M849 HydrophobicContact CB-CG 4.4Å; E624-M849 HydrophobicContact CB-SD 4.09Å; E624-M849 HydrophobicContact CG-CE 3.81Å; E624-M849 HydrophobicContact CG-SD 4.38Å
625	R	87.4	Confident	87.2	Confident	15 Å²	15	26.9 Å²	26.9	6%	0.057	14%	0.144	C	C	.	.	H	α-helix	trans	-76.2	-36.4	174.6	-70.7	-172.1	171.1	150.4	-9	113	A291 I297 P324 S352 D622 L623 T628 K629	A291-R625 HydrophobicContact CB-CB 4Å; A291-R625 HydrophobicContact CB-CG 4.41Å; I297-R625 HydrophobicContact CD1-CB 4.14Å; I297-R625 HydrophobicContact CG2-CB 4.32Å; P324-R625 VanDerWaalsContact C-NH2 3.3Å; P324-R625 PolarHBondContact O-NH2 3.01Å; S352-R625 PolarHBondContact OG-NH2 3.41Å; D622-R625 HydrophobicContact CB-CB 4.41Å; D622-R625 PolarHBondContact O-N 3.38Å; D622-R625 VanDerWaalsContact O-N 3.15Å; D622-R625 PolarHBondContact OD1-N 3.16Å; D622-R625 WeakPolarHBondContact OD2-CD 3.38Å; D622-R625 WeakPolarHBondContact OD2-CG 3.41Å; D622-R625 IonicContact OD2-CZ 3.83Å; D622-R625 IonicContact OD2-NE 3.25Å; D622-R625 IonicContact OD2-NH1 3.78Å; D622-R625 PolarHBondContact OD2-NH1 2.77Å; L623-R625 VanDerWaalsContact C-N 3.32Å; L623-R625 PolarHBondContact O-N 3.05Å; R625-T628 PolarHBondContact O-N 3.09Å; R625-K629 WeakPolarHBondContact O-CB 3.31Å; R625-K629 PolarHBondContact O-N 3.04Å
626	L	88.9	Confident	85.7	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-66.2	-43.6	-179.6	-75.6	174.7	0	0	0	112.4	I297 P621 D622 L623 T628 K629 I630 D661 T665	I297-L626 HydrophobicContact CB-CD2 4.29Å; I297-L626 HydrophobicContact CG2-CD1 4.37Å; I297-L626 HydrophobicContact CG2-CD2 3.48Å; I297-L626 VanDerWaalsContact CG2-CD2 3.48Å; I297-L626 HydrophobicContact CG2-CG 3.56Å; P621-L626 HydrophobicContact CB-CD1 3.59Å; P621-L626 HydrophobicContact CG-CD1 3.55Å; D622-L626 WeakPolarHBondContact O-CG 3.46Å; D622-L626 PolarHBondContact O-N 2.84Å; L623-L626 PolarHBondContact O-N 3.17Å; L626-T628 VanDerWaalsContact C-N 3.28Å; L626-T628 PolarHBondContact O-N 3.39Å; L626-K629 PolarHBondContact O-N 3.16Å; L626-I630 WeakPolarHBondContact O-CD1 3.34Å; L626-I630 WeakPolarHBondContact O-CG1 3.45Å; L626-I630 PolarHBondContact O-N 2.9Å; L626-D661 HydrophobicContact CD2-CB 3.9Å; L626-T665 HydrophobicContact CB-CG2 4.43Å; L626-T665 WeakPolarHBondContact CB-OG1 3.31Å
627	I	89.9	Confident	84.2	Confident	1 Å²	1	28.7 Å²	28.7	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-60	-42.2	176	61.2	-179.9	0	0	0	110.9	L623 E624 I630 H631 T665 F669 F842 W845 H846 M849	L623-I627 WeakPolarHBondContact O-CG1 3.49Å; L623-I627 WeakPolarHBondContact O-CG2 3.47Å; L623-I627 PolarHBondContact O-N 2.85Å; E624-I627 WeakPolarHBondContact O-CG1 3.49Å; I627-I630 PolarHBondContact O-N 3.31Å; I627-H631 WeakPolarHBondContact O-CB 3.43Å; I627-H631 PolarHBondContact O-N 3.13Å; I627-T665 HydrophobicContact CG2-CG2 4.3Å; I627-F669 HydrophobicContact CG2-CE2 3.55Å; I627-F669 HydrophobicContact CG2-CZ 3.63Å; I627-F842 HydrophobicContact CB-CE2 4.04Å; I627-F842 HydrophobicContact CB-CZ 4.33Å; I627-F842 HydrophobicContact CD1-CE1 4.08Å; I627-F842 HydrophobicContact CD1-CE2 4.29Å; I627-F842 HydrophobicContact CD1-CZ 3.71Å; I627-F842 HydrophobicContact CG1-CE2 3.97Å; I627-F842 HydrophobicContact CG1-CZ 3.78Å; I627-W845 HydrophobicContact CG2-CB 4.04Å; I627-H846 HydrophobicContact CD1-CB 4.36Å; I627-M849 HydrophobicContact CD1-CE 4.39Å
628	T	85.8	Confident	82.9	Confident	7 Å²	7	30.8 Å²	30.8	4%	0.043	17%	0.174	C	C	.	.	H	α-helix	trans	-62.1	-49.9	175.3	-61.2	0	0	0	0	109.8	T353 L505 E624 R625 L626 I630 H631 L632	T353-T628 PolarHBondContact O-OG1 2.93Å; L505-T628 HydrophobicContact CD1-CG2 3.87Å; E624-T628 PolarHBondContact O-OG1 2.77Å; R625-T628 PolarHBondContact O-N 3.09Å; L626-T628 VanDerWaalsContact C-N 3.28Å; L626-T628 PolarHBondContact O-N 3.39Å; T628-I630 PolarHBondContact O-N 3.48Å; T628-H631 WeakPolarHBondContact O-CB 3.37Å; T628-H631 PolarHBondContact O-N 3.1Å; T628-L632 VanDerWaalsContact O-CG 3.28Å; T628-L632 WeakPolarHBondContact O-CG 3.28Å; T628-L632 PolarHBondContact O-N 3.47Å
629	K	85.2	Confident	81.8	Confident	10 Å²	10	36.6 Å²	36.6	4%	0.043	19%	0.188	C	C	.	.	H	α-helix	trans	-57.2	-43.6	178.1	-175.9	175.9	179.3	177.1	0	113.1	A291 R625 L626 L632 L633 D661	A291-K629 HydrophobicContact CB-CB 4.37Å; R625-K629 WeakPolarHBondContact O-CB 3.31Å; R625-K629 PolarHBondContact O-N 3.04Å; L626-K629 PolarHBondContact O-N 3.16Å; K629-L632 WeakPolarHBondContact O-CB 3.34Å; K629-L632 PolarHBondContact O-N 2.99Å; K629-L633 WeakPolarHBondContact O-CG 3.49Å; K629-L633 PolarHBondContact O-N 3.1Å; K629-L633 VanDerWaalsContact O-N 3.12Å; K629-D661 WeakPolarHBondContact CE-OD2 3.43Å; K629-D661 IonicContact NZ-OD2 3.69Å; K629-D661 PolarHBondContact NZ-OD2 3.32Å
630	I	86.6	Confident	81	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-70.1	-38.9	-179.8	-65.8	156.7	0	0	0	111.2	L626 I627 T628 L632 L633 G634 F662 T665 F835 F838	L626-I630 WeakPolarHBondContact O-CD1 3.34Å; L626-I630 WeakPolarHBondContact O-CG1 3.45Å; L626-I630 PolarHBondContact O-N 2.9Å; I627-I630 PolarHBondContact O-N 3.31Å; T628-I630 PolarHBondContact O-N 3.48Å; I630-L632 PolarHBondContact O-N 2.83Å; I630-L633 PolarHBondContact O-N 3.39Å; I630-L633 VanDerWaalsContact O-N 3.16Å; I630-G634 PolarHBondContact O-N 2.8Å; I630-F662 HydrophobicContact CD1-CD2 3.77Å; I630-F662 HydrophobicContact CG1-CD2 4.04Å; I630-F662 HydrophobicContact CG2-CD2 3.74Å; I630-F662 HydrophobicContact CG2-CE2 3.95Å; I630-T665 HydrophobicContact CD1-CG2 3.64Å; I630-T665 WeakPolarHBondContact CD1-OG1 3.14Å; I630-F835 HydrophobicContact CG2-CB 4.43Å; I630-F835 HydrophobicContact CG2-CD1 4.19Å; I630-F835 HydrophobicContact CG2-CG 4.48Å; I630-F838 HydrophobicContact CB-CD1 4.17Å; I630-F838 HydrophobicContact CB-CE1 4.22Å; I630-F838 HydrophobicContact CD1-CE1 4.24Å; I630-F838 HydrophobicContact CG2-CB 4.33Å; I630-F838 HydrophobicContact CG2-CD1 3.4Å; I630-F838 HydrophobicContact CG2-CE1 3.91Å; I630-F838 HydrophobicContact CG2-CG 4.02Å
631	H	84.4	Confident	80.6	Confident	20 Å²	20	39.5 Å²	39.5	9%	0.093	21%	0.205	C	C	.	.	H	α-helix	trans	-55	-44.1	172.3	176.6	96.2	0	0	0	111	S504 L505 I627 T628 L633 G634 S635 S839 F842	S504-H631 PolarHBondContact OG-NE2 3.17Å; S504-H631 VanDerWaalsContact OG-NE2 3.1Å; L505-H631 HydrophobicContact CD2-CB 4.05Å; L505-H631 WeakPolarHBondContact CD2-CD2 3.46Å; L505-H631 VanDerWaalsContact CD2-CG 3.49Å; I627-H631 WeakPolarHBondContact O-CB 3.43Å; I627-H631 PolarHBondContact O-N 3.13Å; T628-H631 WeakPolarHBondContact O-CB 3.37Å; T628-H631 PolarHBondContact O-N 3.1Å; H631-L633 PolarHBondContact O-N 3.49Å; H631-G634 PolarHBondContact O-N 2.98Å; H631-S635 PolarHBondContact O-N 3.34Å; H631-S839 PolarHBondContact CE1-OG 2.59Å; H631-S839 VanDerWaalsContact CE1-OG 3.31Å; H631-S839 PolarHBondContact ND1-OG 3.24Å; H631-F842 HydrophobicContact CB-CD2 3.86Å; H631-F842 HydrophobicContact CB-CE2 3.95Å; H631-F842 AromaticContact ND1-CD2 3.82Å
632	L	78.2	Confident	80.2	Confident	26 Å²	26	39.1 Å²	39.1	14%	0.136	20%	0.202	C	C	.	.	H	α-helix	trans	-61.2	-44.5	176.5	-62.2	179	0	0	0	112.4	S292 E501 T628 K629 I630 G634 S635	S292-L632 WeakPolarHBondContact OG-CD1 3.23Å; E501-L632 VanDerWaalsContact C-CD2 3.45Å; E501-L632 HydrophobicContact CB-CD1 4.32Å; E501-L632 HydrophobicContact CB-CD2 3.43Å; E501-L632 VanDerWaalsContact CB-CD2 3.43Å; E501-L632 HydrophobicContact CB-CG 4.46Å; E501-L632 HydrophobicContact CG-CD2 4.01Å; E501-L632 WeakPolarHBondContact O-CD2 3.5Å; T628-L632 VanDerWaalsContact O-CG 3.28Å; T628-L632 WeakPolarHBondContact O-CG 3.28Å; T628-L632 PolarHBondContact O-N 3.47Å; K629-L632 WeakPolarHBondContact O-CB 3.34Å; K629-L632 PolarHBondContact O-N 2.99Å; I630-L632 PolarHBondContact O-N 2.83Å; L632-G634 VanDerWaalsContact C-N 3.28Å; L632-G634 PolarHBondContact O-N 3.36Å; L632-S635 PolarHBondContact O-N 3.37Å
633	L	79.4	Confident	79.9	Confident	38 Å²	38	41.1 Å²	41.1	20%	0.199	21%	0.213	C	C	.	.	H	α-helix	trans	-66.8	-28.3	178.2	-66.5	171.6	0	0	0	113.2	K629 I630 H631 N658 F835	K629-L633 WeakPolarHBondContact O-CG 3.49Å; K629-L633 PolarHBondContact O-N 3.1Å; K629-L633 VanDerWaalsContact O-N 3.12Å; I630-L633 PolarHBondContact O-N 3.39Å; I630-L633 VanDerWaalsContact O-N 3.16Å; H631-L633 PolarHBondContact O-N 3.49Å; L633-N658 HydrophobicContact CD1-CB 3.82Å; L633-F835 HydrophobicContact CB-CD2 3.59Å; L633-F835 HydrophobicContact CB-CE2 4.05Å; L633-F835 HydrophobicContact CB-CG 4.27Å; L633-F835 HydrophobicContact CD1-CD2 4.43Å; L633-F835 HydrophobicContact CD1-CE2 4.11Å
634	G	74.8	Confident	79.2	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-85.8	-21.7	178.1	0	0	0	0	0	114.6	I630 H631 L632 F835 S836	I630-G634 PolarHBondContact O-N 2.8Å; H631-G634 PolarHBondContact O-N 2.98Å; L632-G634 VanDerWaalsContact C-N 3.28Å; L632-G634 PolarHBondContact O-N 3.36Å; G634-F835 VanDerWaalsContact CA-CB 3.44Å; G634-S836 WeakPolarHBondContact O-CB 3.34Å
635	S	73.2	Confident	78.8	Confident	42 Å²	42	48 Å²	48	29%	0.294	25%	0.249	S	C	.	.	S	Bend	trans	-61.8	142	179.2	-167.8	0	0	0	0	110.8	H631 L632 G637	H631-S635 PolarHBondContact O-N 3.34Å; L632-S635 PolarHBondContact O-N 3.37Å; S635-G637 VanDerWaalsContact C-N 3.26Å; S635-G637 PolarHBondContact O-N 3.21Å
636	K	62.1	Low	78.5	Confident	176 Å²	176	48.2 Å²	48.2	77%	0.765	25%	0.254	S	S	*	.			trans	-69.9	89.3	171.9	-71.4	-178.9	-177.3	173.4	0	107.6
637	G	63	Low	77.9	Confident	45 Å²	45	50.6 Å²	50.6	46%	0.464	27%	0.266	S	S	.	.			trans	-49.9	144.1	173.2	0	0	0	0	0	110.6	S635 K639	S635-G637 VanDerWaalsContact C-N 3.26Å; S635-G637 PolarHBondContact O-N 3.21Å; G637-K639 PolarHBondContact O-N 2.87Å
638	D	67.6	Low	77	Confident	45 Å²	45	53 Å²	53	24%	0.241	28%	0.278	C	S	.	.			trans	-60.7	126.5	174	-177.5	0.7	0	0	0	108.7	R500 N640 H641 S644	R500-D638 IonicContact CZ-OD2 3.68Å; R500-D638 IonicContact NE-OD2 3.49Å; R500-D638 IonicContact NH2-OD2 2.79Å; D638-N640 PolarHBondContact O-N 3.39Å; D638-N640 VanDerWaalsContact O-N 3.14Å; D638-N640 WeakPolarHBondContact OD1-CB 3.34Å; D638-N640 PolarHBondContact OD1-N 2.93Å; D638-H641 HydrophobicContact CB-CB 4.21Å; D638-H641 WeakPolarHBondContact O-CB 3.25Å; D638-H641 PolarHBondContact O-N 3.04Å; D638-S644 PolarHBondContact O-OG 3.5Å
639	K	68.3	Low	76.1	Confident	186 Å²	186	56.3 Å²	56.3	81%	0.809	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-24.4	176.1	-68.5	-174.9	177.7	-177.9	0	111.6	G637	G637-K639 PolarHBondContact O-N 2.87Å
640	N	75.3	Confident	75.5	Confident	123 Å²	123	57.9 Å²	57.9	66%	0.658	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-12.3	177.1	-60.6	-34.8	0	0	0	113.2	D638 R645	D638-N640 PolarHBondContact O-N 3.39Å; D638-N640 VanDerWaalsContact O-N 3.14Å; D638-N640 WeakPolarHBondContact OD1-CB 3.34Å; D638-N640 PolarHBondContact OD1-N 2.93Å; N640-R645 PolarHBondContact O-NH2 3.48Å
641	H	82.9	Confident	74.7	Confident	32 Å²	32	60.9 Å²	60.9	15%	0.148	31%	0.314	C	S	.	.	S	Bend	trans	-61.1	135.1	179.2	-162	-98.7	0	0	0	110.4	C281 L497 D638 D643 S644	C281-H641 PolarHBondContact O-CE1 2.85Å; L497-H641 PolarHBondContact O-NE2 2.89Å; D638-H641 HydrophobicContact CB-CB 4.21Å; D638-H641 WeakPolarHBondContact O-CB 3.25Å; D638-H641 PolarHBondContact O-N 3.04Å; H641-D643 WeakPolarHBondContact ND1-CB 3.05Å; H641-D643 PolarHBondContact ND1-N 3.24Å; H641-D643 VanDerWaalsContact ND1-N 3.2Å; H641-D643 PolarHBondContact O-N 3.44Å; H641-S644 WeakPolarHBondContact O-CB 3.44Å; H641-S644 PolarHBondContact O-N 3.46Å; H641-S644 VanDerWaalsContact O-N 3.15Å
642	P	81.4	Confident	74.1	Confident	14 Å²	14	63.7 Å²	63.7	9%	0.091	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-58.5	-34.9	179	21.2	-32.6	0	0	0	112.5	E279 V280 L497 S644 R645 A646	E279-P642 HydrophobicContact CB-CB 4Å; V280-P642 WeakPolarHBondContact O-CB 3.26Å; V280-P642 WeakPolarHBondContact O-CG 3.41Å; L497-P642 HydrophobicContact CD1-CG 3.84Å; P642-S644 VanDerWaalsContact C-N 3.3Å; P642-S644 PolarHBondContact O-N 3.5Å; P642-R645 CarbonylContact O-C 3.52Å; P642-R645 PolarHBondContact O-N 3.14Å; P642-A646 PolarHBondContact O-N 3.28Å
643	D	82	Confident	73.9	Confident	48 Å²	48	67.4 Å²	67.4	26%	0.257	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-63.8	-32.9	178.3	-151.5	49.2	0	0	0	113.2	R252 C281 H641 R645 A646	R252-D643 IonicContact CZ-OD1 3.35Å; R252-D643 VanDerWaalsContact NH2-CG 3.25Å; R252-D643 IonicContact NH2-OD1 2.74Å; R252-D643 PolarHBondContact NH2-OD1 3.19Å; R252-D643 IonicContact NH2-OD2 2.77Å; R252-D643 PolarHBondContact NH2-OD2 3.03Å; C281-D643 HydrophobicContact CB-CB 4.21Å; C281-D643 WeakPolarHBondContact CB-OD1 3.46Å; H641-D643 WeakPolarHBondContact ND1-CB 3.05Å; H641-D643 PolarHBondContact ND1-N 3.24Å; H641-D643 VanDerWaalsContact ND1-N 3.2Å; H641-D643 PolarHBondContact O-N 3.44Å; D643-R645 PolarHBondContact O-N 3.29Å; D643-A646 VanDerWaalsContact O-CB 3.31Å; D643-A646 WeakPolarHBondContact O-CB 3.41Å; D643-A646 PolarHBondContact O-N 2.89Å; D643-A646 VanDerWaalsContact O-N 3.15Å
644	S	78.1	Confident	73.8	Confident	72 Å²	72	70.1 Å²	70.1	50%	0.503	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-65.4	-19.6	174.3	-55.9	0	0	0	0	113	D638 H641 P642	D638-S644 PolarHBondContact O-OG 3.5Å; H641-S644 WeakPolarHBondContact O-CB 3.44Å; H641-S644 PolarHBondContact O-N 3.46Å; H641-S644 VanDerWaalsContact O-N 3.15Å; P642-S644 VanDerWaalsContact C-N 3.3Å; P642-S644 PolarHBondContact O-N 3.5Å
645	R	79.4	Confident	73.9	Confident	106 Å²	106	70.3 Å²	70.3	40%	0.4	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-103.1	-4.1	178.3	-66.2	179.9	-78.9	139.3	1.7	112.6	T256 E279 N640 P642 D643	T256-R645 WeakPolarHBondContact CA-O 3.03Å; T256-R645 HydrophobicContact CG2-CB 4.25Å; E279-R645 IonicContact OE1-CZ 3.66Å; E279-R645 IonicContact OE1-NH1 3.47Å; E279-R645 PolarHBondContact OE1-NH1 3.35Å; E279-R645 IonicContact OE1-NH2 2.93Å; E279-R645 IonicContact OE2-CZ 3.75Å; E279-R645 VanDerWaalsContact OE2-CZ 3.25Å; E279-R645 IonicContact OE2-NH1 2.93Å; E279-R645 PolarHBondContact OE2-NH1 3.42Å; E279-R645 IonicContact OE2-NH2 3.39Å; E279-R645 PolarHBondContact OE2-NH2 2.92Å; N640-R645 PolarHBondContact O-NH2 3.48Å; P642-R645 CarbonylContact O-C 3.52Å; P642-R645 PolarHBondContact O-N 3.14Å; D643-R645 PolarHBondContact O-N 3.29Å
646	A	81.3	Confident	74.3	Confident	20 Å²	20	74.2 Å²	74.2	17%	0.165	37%	0.366	C	S	.	.			trans	-67.3	138.7	-176.2	0	0	0	0	0	112.2	E254 Q255 P642 D643	E254-A646 HydrophobicContact CB-CB 3.59Å; E254-A646 HydrophobicContact CG-CB 3.77Å; Q255-A646 CarbonylContact O-C 3.6Å; P642-A646 PolarHBondContact O-N 3.28Å; D643-A646 VanDerWaalsContact O-CB 3.31Å; D643-A646 WeakPolarHBondContact O-CB 3.41Å; D643-A646 PolarHBondContact O-N 2.89Å; D643-A646 VanDerWaalsContact O-N 3.15Å
647	I	76.6	Confident	75.3	Confident	50 Å²	50	68.3 Å²	68.3	26%	0.256	34%	0.341	S	S	.	.			trans	-98.1	103.4	176.1	-60.1	177.2	0	0	0	108.7	K198 Q255 E257	K198-I647 PolarHBondContact NZ-O 3.35Å; Q255-I647 HydrophobicContact CB-CB 4.46Å; Q255-I647 WeakPolarHBondContact O-CB 3.38Å; Q255-I647 PolarHBondContact O-N 3.03Å; E257-I647 VanDerWaalsContact O-CD1 3.3Å; E257-I647 WeakPolarHBondContact O-CD1 3.46Å
648	I	72.1	Confident	76.3	Confident	52 Å²	52	66.3 Å²	66.3	27%	0.267	32%	0.319	S	S	.	.			trans	-88.6	113.1	177.1	-55.6	176.8	0	0	0	108	E650 E651 Y654	I648-E650 PolarHBondContact O-N 3.13Å; I648-E651 PolarHBondContact O-N 3.45Å; I648-Y654 HydrophobicContact CD1-CD1 4.14Å; I648-Y654 HydrophobicContact CD1-CE1 4.37Å; I648-Y654 HydrophobicContact CD1-CG 4.47Å
649	F	66.8	Low	77.1	Confident	75 Å²	75	64.2 Å²	64.2	33%	0.329	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-21.4	-178	-75	-93	0	0	0	112.6	G200 K201	G200-F649 WeakPolarHBondContact O-CD2 3.36Å; G200-F649 WeakPolarHBondContact O-CE2 3.35Å; K201-F649 HydrophobicContact CG-CB 4.01Å; K201-F649 HydrophobicContact CG-CD1 4.26Å; K201-F649 HydrophobicContact CG-CG 4.14Å
650	E	71.5	Confident	78	Confident	44 Å²	44	58 Å²	58	21%	0.206	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.2	43.9	176.3	-58.4	-161.8	156.2	0	0	112.1	V234 I648 V652 Q653 Y654	V234-E650 WeakPolarHBondContact CG1-OE2 3.39Å; I648-E650 PolarHBondContact O-N 3.13Å; E650-V652 PolarHBondContact O-N 3.05Å; E650-V652 VanDerWaalsContact O-N 3.11Å; E650-Q653 HydrophobicContact CB-CB 4.2Å; E650-Q653 HydrophobicContact CB-CG 4.32Å; E650-Q653 PolarHBondContact O-N 3.4Å; E650-Q653 PolarHBondContact OE2-NE2 3.46Å; E650-Q653 VanDerWaalsContact OE2-NE2 3.15Å; E650-Q653 PolarHBondContact OE2-OE1 2.75Å; E650-Q653 VanDerWaalsContact OE2-OE1 3.11Å; E650-Y654 PolarHBondContact O-N 2.89Å
651	E	70.3	Confident	78.6	Confident	63 Å²	63	52.2 Å²	52.2	29%	0.294	25%	0.252	S	S	.	.	H	α-helix	trans	-52.4	-35.7	-179.1	-165.8	-169.7	176.1	0	0	113	I648 S655 R726 R828	I648-E651 PolarHBondContact O-N 3.45Å; E651-S655 WeakPolarHBondContact O-CB 3.11Å; E651-S655 PolarHBondContact O-N 2.88Å; E651-R726 VanDerWaalsContact CG-NH2 3.33Å; E651-R726 PolarHBondContact O-NH1 2.79Å; E651-R726 IonicContact OE1-NH2 2.62Å; E651-R726 PolarHBondContact OE1-NH2 2.8Å; E651-R726 IonicContact OE2-NH2 3.88Å; E651-R726 PolarHBondContact OE2-NH2 3.41Å; E651-R828 IonicContact OE1-CZ 3.64Å; E651-R828 IonicContact OE1-NH1 3.31Å; E651-R828 PolarHBondContact OE1-NH1 3.28Å; E651-R828 IonicContact OE2-NH1 3.72Å
652	V	72.7	Confident	78.9	Confident	80 Å²	80	50.7 Å²	50.7	49%	0.485	25%	0.245	S	C	.	.	H	α-helix	trans	-66.4	-42.7	177.1	-180	0	0	0	0	111.1	E650 R656	E650-V652 PolarHBondContact O-N 3.05Å; E650-V652 VanDerWaalsContact O-N 3.11Å; V652-R656 WeakPolarHBondContact O-CB 3.44Å; V652-R656 PolarHBondContact O-N 3.34Å
653	Q	73.6	Confident	79.3	Confident	103 Å²	103	50.4 Å²	50.4	48%	0.481	24%	0.243	S	C	.	.	H	α-helix	trans	-70.4	-42.9	179.3	-63.9	-170.3	29.2	0	0	111.5	E650 R656 K657	E650-Q653 HydrophobicContact CB-CB 4.2Å; E650-Q653 HydrophobicContact CB-CG 4.32Å; E650-Q653 PolarHBondContact O-N 3.4Å; E650-Q653 PolarHBondContact OE2-NE2 3.46Å; E650-Q653 VanDerWaalsContact OE2-NE2 3.15Å; E650-Q653 PolarHBondContact OE2-OE1 2.75Å; E650-Q653 VanDerWaalsContact OE2-OE1 3.11Å; Q653-R656 PolarHBondContact O-N 3.01Å; Q653-K657 PolarHBondContact O-N 3.29Å
654	Y	76.2	Confident	79.7	Confident	95 Å²	95	49.3 Å²	49.3	37%	0.373	24%	0.241	S	C	.	.	H	α-helix	trans	-61	-49.9	177.1	179.1	-102.2	0	0	0	111.7	I648 E650 R656 K657 N658	I648-Y654 HydrophobicContact CD1-CD1 4.14Å; I648-Y654 HydrophobicContact CD1-CE1 4.37Å; I648-Y654 HydrophobicContact CD1-CG 4.47Å; E650-Y654 PolarHBondContact O-N 2.89Å; Y654-R656 PolarHBondContact O-N 3.15Å; Y654-K657 WeakPolarHBondContact O-CB 3.27Å; Y654-K657 PolarHBondContact O-N 3.36Å; Y654-N658 WeakPolarHBondContact CE1-ND2 3.46Å; Y654-N658 PolarHBondContact O-N 2.7Å
655	S	78.3	Confident	80.4	Confident	5 Å²	5	45.9 Å²	45.9	4%	0.035	22%	0.217	C	C	.	.	H	α-helix	trans	-65.2	-39.8	177.2	-179.4	0	0	0	0	111.9	E651 K657 N658 I659 G725 R726 M831	E651-S655 WeakPolarHBondContact O-CB 3.11Å; E651-S655 PolarHBondContact O-N 2.88Å; S655-K657 VanDerWaalsContact C-N 3.31Å; S655-K657 PolarHBondContact O-N 2.66Å; S655-N658 PolarHBondContact O-N 3Å; S655-I659 VanDerWaalsContact O-CG1 3.3Å; S655-I659 WeakPolarHBondContact O-CG1 3.28Å; S655-I659 PolarHBondContact O-N 3.23Å; S655-G725 WeakPolarHBondContact CB-O 3.49Å; S655-G725 PolarHBondContact OG-O 3.19Å; S655-R726 PolarHBondContact OG-NH1 3.25Å; S655-M831 PolarHBondContact OG-SD 3.41Å
656	R	81.5	Confident	81	Confident	124 Å²	124	41 Å²	41	47%	0.468	20%	0.199	S	C	.	.	H	α-helix	trans	-56.1	-44.9	172	175.1	174.7	176	-167.2	-3.6	111.7	V652 Q653 Y654 I659 I660 K722	V652-R656 WeakPolarHBondContact O-CB 3.44Å; V652-R656 PolarHBondContact O-N 3.34Å; Q653-R656 PolarHBondContact O-N 3.01Å; Y654-R656 PolarHBondContact O-N 3.15Å; R656-I659 PolarHBondContact O-N 3.44Å; R656-I660 HydrophobicContact CG-CD1 3.86Å; R656-I660 HydrophobicContact CG-CG1 4.47Å; R656-I660 VanDerWaalsContact O-CG1 3.25Å; R656-I660 WeakPolarHBondContact O-CG1 3.11Å; R656-I660 PolarHBondContact O-N 3.32Å; R656-K722 VanDerWaalsContact CD-O 3.23Å; R656-K722 WeakPolarHBondContact CD-O 3.25Å; R656-K722 VanDerWaalsContact CG-O 3.32Å; R656-K722 WeakPolarHBondContact CG-O 3.18Å; R656-K722 PolarHBondContact NE-O 2.93Å
657	K	81.9	Confident	81.5	Confident	52 Å²	52	43 Å²	43	23%	0.226	21%	0.207	C	C	.	.	H	α-helix	trans	-61.6	-44.9	176.6	-176.4	169.7	-175.2	150.3	0	111.8	S295 Q653 Y654 S655 I659 I660 D661	S295-K657 WeakPolarHBondContact O-CE 3.37Å; S295-K657 PolarHBondContact O-NZ 3.42Å; S295-K657 PolarHBondContact OG-NZ 3.3Å; Q653-K657 PolarHBondContact O-N 3.29Å; Y654-K657 WeakPolarHBondContact O-CB 3.27Å; Y654-K657 PolarHBondContact O-N 3.36Å; S655-K657 VanDerWaalsContact C-N 3.31Å; S655-K657 PolarHBondContact O-N 2.66Å; K657-I659 VanDerWaalsContact C-N 3.3Å; K657-I659 PolarHBondContact O-N 3.15Å; K657-I660 WeakPolarHBondContact O-CB 3.46Å; K657-I660 PolarHBondContact O-N 2.84Å; K657-I660 VanDerWaalsContact O-N 3.17Å; K657-D661 VanDerWaalsContact O-CG 3.29Å; K657-D661 PolarHBondContact O-N 3.1Å
658	N	84.2	Confident	82.3	Confident	3 Å²	3	40.9 Å²	40.9	2%	0.016	20%	0.197	C	C	.	.	H	α-helix	trans	-62.4	-38.1	176.9	-67.1	-20.9	0	0	0	112.4	L633 Y654 S655 D661 F662	L633-N658 HydrophobicContact CD1-CB 3.82Å; Y654-N658 WeakPolarHBondContact CE1-ND2 3.46Å; Y654-N658 PolarHBondContact O-N 2.7Å; S655-N658 PolarHBondContact O-N 3Å; N658-D661 PolarHBondContact O-N 3.4Å; N658-F662 WeakPolarHBondContact O-CB 3.49Å; N658-F662 PolarHBondContact O-N 3.38Å
659	I	84.9	Confident	83.5	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-66.7	-42.3	174	-66.8	163.9	0	0	0	110.7	S655 R656 K657 D661 F662 V663 A721 K722 G725	S655-I659 VanDerWaalsContact O-CG1 3.3Å; S655-I659 WeakPolarHBondContact O-CG1 3.28Å; S655-I659 PolarHBondContact O-N 3.23Å; R656-I659 PolarHBondContact O-N 3.44Å; K657-I659 VanDerWaalsContact C-N 3.3Å; K657-I659 PolarHBondContact O-N 3.15Å; I659-D661 VanDerWaalsContact C-N 3.33Å; I659-D661 PolarHBondContact O-N 2.9Å; I659-F662 PolarHBondContact O-N 2.96Å; I659-V663 HydrophobicContact CG2-CG2 4.34Å; I659-V663 VanDerWaalsContact O-CG2 3.31Å; I659-V663 WeakPolarHBondContact O-CG2 3.44Å; I659-V663 PolarHBondContact O-N 3.11Å; I659-A721 HydrophobicContact CG2-CB 3.96Å; I659-K722 HydrophobicContact CG2-CG 4.47Å; I659-G725 VanDerWaalsContact CD1-C 3.45Å
660	I	86.7	Confident	84.8	Confident	55 Å²	55	37.2 Å²	37.2	28%	0.282	18%	0.18	S	C	.	.	H	α-helix	trans	-58.7	-47	175.2	-71.3	164.3	0	0	0	110.4	R656 K657 F662 V663 A664 K722	R656-I660 HydrophobicContact CG-CD1 3.86Å; R656-I660 HydrophobicContact CG-CG1 4.47Å; R656-I660 VanDerWaalsContact O-CG1 3.25Å; R656-I660 WeakPolarHBondContact O-CG1 3.11Å; R656-I660 PolarHBondContact O-N 3.32Å; K657-I660 WeakPolarHBondContact O-CB 3.46Å; K657-I660 PolarHBondContact O-N 2.84Å; K657-I660 VanDerWaalsContact O-N 3.17Å; I660-F662 PolarHBondContact O-N 3.13Å; I660-V663 PolarHBondContact O-N 3.44Å; I660-A664 VanDerWaalsContact O-CB 3.28Å; I660-A664 WeakPolarHBondContact O-CB 3.28Å; I660-A664 PolarHBondContact O-N 3.23Å; I660-K722 HydrophobicContact CG1-CG 4.13Å
661	D	87.5	Confident	85.9	Confident	2 Å²	2	36.3 Å²	36.3	1%	0.011	18%	0.176	C	C	.	.	H	α-helix	trans	-63.6	-40.9	178.3	-69.1	-13	0	0	0	111.8	S298 L626 K629 K657 N658 I659 A664 T665	S298-D661 WeakPolarHBondContact CB-OD1 3.39Å; S298-D661 PolarHBondContact OG-OD1 3.14Å; L626-D661 HydrophobicContact CD2-CB 3.9Å; K629-D661 WeakPolarHBondContact CE-OD2 3.43Å; K629-D661 IonicContact NZ-OD2 3.69Å; K629-D661 PolarHBondContact NZ-OD2 3.32Å; K657-D661 VanDerWaalsContact O-CG 3.29Å; K657-D661 PolarHBondContact O-N 3.1Å; N658-D661 PolarHBondContact O-N 3.4Å; I659-D661 VanDerWaalsContact C-N 3.33Å; I659-D661 PolarHBondContact O-N 2.9Å; D661-A664 PolarHBondContact O-N 3.24Å; D661-T665 PolarHBondContact O-N 3.21Å; D661-T665 PolarHBondContact O-OG1 2.95Å
662	F	90.1	Very high	87	Confident	1 Å²	1	33.3 Å²	33.3	0%	0.004	16%	0.162	C	C	.	.	H	α-helix	trans	-63.2	-48.1	175.7	-175.8	-113.1	0	0	0	112.2	I630 N658 I659 I660 A664 T665 L666 F712 F716 I834 F835 F838	I630-F662 HydrophobicContact CD1-CD2 3.77Å; I630-F662 HydrophobicContact CG1-CD2 4.04Å; I630-F662 HydrophobicContact CG2-CD2 3.74Å; I630-F662 HydrophobicContact CG2-CE2 3.95Å; N658-F662 WeakPolarHBondContact O-CB 3.49Å; N658-F662 PolarHBondContact O-N 3.38Å; I659-F662 PolarHBondContact O-N 2.96Å; I660-F662 PolarHBondContact O-N 3.13Å; F662-A664 VanDerWaalsContact C-N 3.35Å; F662-A664 PolarHBondContact O-N 2.95Å; F662-T665 WeakPolarHBondContact O-CB 3.16Å; F662-T665 PolarHBondContact O-N 3.04Å; F662-T665 VanDerWaalsContact O-N 3.14Å; F662-L666 HydrophobicContact CD1-CD1 4.06Å; F662-L666 HydrophobicContact CE1-CD1 3.61Å; F662-L666 HydrophobicContact CE1-CG 4.3Å; F662-L666 HydrophobicContact CZ-CD1 3.98Å; F662-L666 HydrophobicContact CZ-CD2 4.38Å; F662-L666 HydrophobicContact CZ-CG 4.3Å; F662-L666 PolarHBondContact O-N 3.46Å; F662-F712 HydrophobicContact CZ-CB 4.48Å; F662-F712 HydrophobicContact CZ-CD1 4.1Å; F662-F712 HydrophobicContact CZ-CG 4.3Å; F662-F716 HydrophobicContact CD1-CE1 4.22Å; F662-F716 AromaticContact CD1-CZ 3.79Å; F662-F716 HydrophobicContact CD1-CZ 3.79Å; F662-F716 AromaticContact CE1-CE1 3.72Å; F662-F716 HydrophobicContact CE1-CE1 3.72Å; F662-F716 AromaticContact CE1-CZ 3.75Å; F662-F716 HydrophobicContact CE1-CZ 3.75Å; F662-I834 HydrophobicContact CE1-CG2 3.91Å; F662-I834 HydrophobicContact CZ-CG2 3.89Å; F662-F835 HydrophobicContact CB-CE1 3.75Å; F662-F835 HydrophobicContact CB-CZ 4.36Å; F662-F835 HydrophobicContact CD1-CD1 4.48Å; F662-F835 AromaticContact CD1-CE1 3.88Å; F662-F835 HydrophobicContact CD1-CE1 3.88Å; F662-F835 AromaticContact CD2-CD1 3.76Å; F662-F835 HydrophobicContact CD2-CD1 3.76Å; F662-F835 AromaticContact CD2-CE1 3.67Å; F662-F835 HydrophobicContact CD2-CE1 3.67Å; F662-F835 HydrophobicContact CE1-CE1 4.38Å; F662-F835 AromaticContact CE2-CD1 3.94Å; F662-F835 HydrophobicContact CE2-CD1 3.94Å; F662-F835 HydrophobicContact CE2-CE1 4.22Å; F662-F835 HydrophobicContact CG-CD1 4.07Å; F662-F835 AromaticContact CG-CE1 3.49Å; F662-F835 HydrophobicContact CG-CE1 3.49Å; F662-F835 VanDerWaalsContact CG-CE1 3.49Å; F662-F835 HydrophobicContact CZ-CD1 4.37Å; F662-F838 HydrophobicContact CE2-CB 3.89Å; F662-F838 HydrophobicContact CE2-CD1 4.4Å; F662-F838 AromaticContact CE2-CD2 3.67Å; F662-F838 HydrophobicContact CE2-CD2 3.67Å; F662-F838 HydrophobicContact CE2-CE2 4.3Å; F662-F838 AromaticContact CE2-CG 3.73Å; F662-F838 HydrophobicContact CE2-CG 3.73Å; F662-F838 HydrophobicContact CZ-CB 4.35Å; F662-F838 HydrophobicContact CZ-CD2 4.17Å; F662-F838 HydrophobicContact CZ-CG 4.45Å
663	V	89.5	Confident	88.1	Confident	7 Å²	7	32.3 Å²	32.3	4%	0.042	15%	0.15	C	C	.	.	H	α-helix	trans	-63.5	-42.3	176.7	174.9	0	0	0	0	110.8	I659 I660 T665 L666 D667 F716 A718 K722	I659-V663 HydrophobicContact CG2-CG2 4.34Å; I659-V663 VanDerWaalsContact O-CG2 3.31Å; I659-V663 WeakPolarHBondContact O-CG2 3.44Å; I659-V663 PolarHBondContact O-N 3.11Å; I660-V663 PolarHBondContact O-N 3.44Å; V663-T665 PolarHBondContact O-N 3.46Å; V663-L666 PolarHBondContact O-N 3.39Å; V663-D667 WeakPolarHBondContact CG1-OD2 3.36Å; V663-D667 WeakPolarHBondContact O-CB 3.48Å; V663-D667 PolarHBondContact O-N 2.91Å; V663-F716 HydrophobicContact CG2-CE2 4.12Å; V663-F716 HydrophobicContact CG2-CZ 4.25Å; V663-A718 HydrophobicContact CG1-CB 4.41Å; V663-A718 HydrophobicContact CG2-CB 4.07Å; V663-K722 VanDerWaalsContact CG1-CE 3.48Å
664	A	90.3	Very high	89	Confident	26 Å²	26	32 Å²	32	22%	0.215	15%	0.147	C	C	.	.	H	α-helix	trans	-59.6	-34.2	175.1	0	0	0	0	0	112.3	I660 D661 F662 G668	I660-A664 VanDerWaalsContact O-CB 3.28Å; I660-A664 WeakPolarHBondContact O-CB 3.28Å; I660-A664 PolarHBondContact O-N 3.23Å; D661-A664 PolarHBondContact O-N 3.24Å; F662-A664 VanDerWaalsContact C-N 3.35Å; F662-A664 PolarHBondContact O-N 2.95Å; A664-G668 PolarHBondContact O-N 3.4Å
665	T	92.4	Very high	89.9	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-68.3	-47.4	175	-54.6	0	0	0	0	111.7	L623 L626 I627 I630 D661 F662 V663 G668 F669 F838	L623-T665 HydrophobicContact CD2-CG2 4.43Å; L626-T665 HydrophobicContact CB-CG2 4.43Å; L626-T665 WeakPolarHBondContact CB-OG1 3.31Å; I627-T665 HydrophobicContact CG2-CG2 4.3Å; I630-T665 HydrophobicContact CD1-CG2 3.64Å; I630-T665 WeakPolarHBondContact CD1-OG1 3.14Å; D661-T665 PolarHBondContact O-N 3.21Å; D661-T665 PolarHBondContact O-OG1 2.95Å; F662-T665 WeakPolarHBondContact O-CB 3.16Å; F662-T665 PolarHBondContact O-N 3.04Å; F662-T665 VanDerWaalsContact O-N 3.14Å; V663-T665 PolarHBondContact O-N 3.46Å; T665-G668 PolarHBondContact O-N 2.65Å; T665-F669 HydrophobicContact CG2-CD2 3.78Å; T665-F669 HydrophobicContact CG2-CE2 3.61Å; T665-F669 VanDerWaalsContact O-CD2 3.25Å; T665-F669 WeakPolarHBondContact O-CD2 3.42Å; T665-F669 PolarHBondContact O-N 2.71Å; T665-F838 HydrophobicContact CG2-CZ 3.82Å
666	L	92.2	Very high	90.6	Very high	4 Å²	4	27.3 Å²	27.3	2%	0.021	13%	0.128	C	C	.	.	H	α-helix	trans	-62.2	-45.6	177.2	-67	176.7	0	0	0	111.7	F662 V663 G668 F669 E670 F712 F838	F662-L666 HydrophobicContact CD1-CD1 4.06Å; F662-L666 HydrophobicContact CE1-CD1 3.61Å; F662-L666 HydrophobicContact CE1-CG 4.3Å; F662-L666 HydrophobicContact CZ-CD1 3.98Å; F662-L666 HydrophobicContact CZ-CD2 4.38Å; F662-L666 HydrophobicContact CZ-CG 4.3Å; F662-L666 PolarHBondContact O-N 3.46Å; V663-L666 PolarHBondContact O-N 3.39Å; L666-G668 VanDerWaalsContact C-N 3.31Å; L666-G668 PolarHBondContact O-N 2.84Å; L666-F669 PolarHBondContact O-N 3.03Å; L666-E670 WeakPolarHBondContact O-CB 3.29Å; L666-E670 PolarHBondContact O-N 3.44Å; L666-F712 HydrophobicContact CD1-CB 3.74Å; L666-F712 HydrophobicContact CD2-CB 3.85Å; L666-F712 HydrophobicContact CD2-CD2 4.19Å; L666-F712 HydrophobicContact CD2-CG 4.28Å; L666-F712 HydrophobicContact CG-CB 4.47Å; L666-F838 HydrophobicContact CD2-CD2 4.23Å; L666-F838 HydrophobicContact CD2-CE2 3.95Å
667	D	92.5	Very high	91	Very high	62 Å²	62	25.6 Å²	25.6	33%	0.332	13%	0.125	S	C	.	.	H	α-helix	trans	-64.6	-37.5	176.5	-72.6	-24.7	0	0	0	111.4	V663 E670 L671 K713	V663-D667 WeakPolarHBondContact CG1-OD2 3.36Å; V663-D667 WeakPolarHBondContact O-CB 3.48Å; V663-D667 PolarHBondContact O-N 2.91Å; D667-E670 PolarHBondContact O-N 2.96Å; D667-L671 WeakPolarHBondContact O-CB 3.36Å; D667-L671 PolarHBondContact O-N 3.39Å; D667-K713 WeakPolarHBondContact OD1-CE 3.38Å; D667-K713 IonicContact OD1-NZ 3.23Å; D667-K713 PolarHBondContact OD1-NZ 2.8Å
668	G	93.7	Very high	91.5	Very high	4 Å²	4	25.4 Å²	25.4	4%	0.041	13%	0.125	C	C	.	.	H	α-helix	trans	-62.7	-42.6	173.8	0	0	0	0	0	112.6	L620 A664 T665 L666 L671 S672	L620-G668 WeakPolarHBondContact CD2-O 3.46Å; A664-G668 PolarHBondContact O-N 3.4Å; T665-G668 PolarHBondContact O-N 2.65Å; L666-G668 VanDerWaalsContact C-N 3.31Å; L666-G668 PolarHBondContact O-N 2.84Å; G668-L671 PolarHBondContact O-N 2.83Å; G668-S672 VanDerWaalsContact O-CB 3.29Å; G668-S672 WeakPolarHBondContact O-CB 3.44Å; G668-S672 PolarHBondContact O-N 3.04Å; G668-S672 PolarHBondContact O-OG 3.29Å
669	F	95.8	Very high	91.9	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-72.6	-31.2	175.5	-80.4	-61.6	0	0	0	113.6	L623 I627 T665 L666 S672 Y673 I705 I709 F838 W845 A848 M849	L623-F669 HydrophobicContact CD1-CE1 4.29Å; L623-F669 HydrophobicContact CD2-CD2 4.36Å; L623-F669 HydrophobicContact CD2-CE2 4.2Å; L623-F669 HydrophobicContact CD2-CZ 4.44Å; I627-F669 HydrophobicContact CG2-CE2 3.55Å; I627-F669 HydrophobicContact CG2-CZ 3.63Å; T665-F669 HydrophobicContact CG2-CD2 3.78Å; T665-F669 HydrophobicContact CG2-CE2 3.61Å; T665-F669 VanDerWaalsContact O-CD2 3.25Å; T665-F669 WeakPolarHBondContact O-CD2 3.42Å; T665-F669 PolarHBondContact O-N 2.71Å; L666-F669 PolarHBondContact O-N 3.03Å; F669-S672 VanDerWaalsContact O-CB 3.31Å; F669-S672 WeakPolarHBondContact O-CB 3.43Å; F669-S672 PolarHBondContact O-N 3.45Å; F669-Y673 PolarHBondContact O-N 2.77Å; F669-I705 HydrophobicContact CB-CD1 4.08Å; F669-I705 HydrophobicContact CD1-CD1 3.98Å; F669-I705 HydrophobicContact CG-CD1 4.37Å; F669-I709 HydrophobicContact CB-CD1 4Å; F669-I709 HydrophobicContact CB-CG1 4.46Å; F669-F838 HydrophobicContact CE2-CZ 4.33Å; F669-W845 HydrophobicContact CB-CE3 4.3Å; F669-W845 HydrophobicContact CB-CZ3 3.95Å; F669-W845 AromaticContact CD1-CE3 3.85Å; F669-W845 HydrophobicContact CD1-CE3 3.85Å; F669-W845 HydrophobicContact CD1-CZ3 4.31Å; F669-W845 HydrophobicContact CD2-CD2 4.29Å; F669-W845 AromaticContact CD2-CE3 3.58Å; F669-W845 HydrophobicContact CD2-CE3 3.58Å; F669-W845 AromaticContact CD2-CZ3 3.94Å; F669-W845 HydrophobicContact CD2-CZ3 3.94Å; F669-W845 HydrophobicContact CE1-CB 4.33Å; F669-W845 HydrophobicContact CE1-CE3 4.04Å; F669-W845 WeakPolarHBondContact CE1-O 3.2Å; F669-W845 HydrophobicContact CE2-CB 4.05Å; F669-W845 HydrophobicContact CE2-CD2 4.15Å; F669-W845 AromaticContact CE2-CE3 3.78Å; F669-W845 HydrophobicContact CE2-CE3 3.78Å; F669-W845 HydrophobicContact CE2-CG 4.28Å; F669-W845 AromaticContact CG-CE3 3.64Å; F669-W845 HydrophobicContact CG-CE3 3.64Å; F669-W845 AromaticContact CG-CZ3 3.81Å; F669-W845 HydrophobicContact CG-CZ3 3.81Å; F669-W845 HydrophobicContact CZ-CB 3.7Å; F669-W845 HydrophobicContact CZ-CD2 4.44Å; F669-W845 HydrophobicContact CZ-CE3 4.02Å; F669-W845 HydrophobicContact CZ-CG 4.36Å; F669-A848 HydrophobicContact CD1-CB 4.26Å; F669-A848 HydrophobicContact CE1-CB 4.04Å; F669-M849 HydrophobicContact CE1-CB 4.48Å
670	E	94.6	Very high	92.1	Very high	50 Å²	50	28 Å²	28	23%	0.234	14%	0.139	C	C	.	.	H	α-helix	trans	-66.4	-44.7	171	-170.6	-163.8	-123.3	0	0	111	L666 D667 S672 Y673 K674 I709 K713	L666-E670 WeakPolarHBondContact O-CB 3.29Å; L666-E670 PolarHBondContact O-N 3.44Å; D667-E670 PolarHBondContact O-N 2.96Å; E670-S672 VanDerWaalsContact C-N 3.28Å; E670-S672 PolarHBondContact O-N 2.89Å; E670-Y673 PolarHBondContact O-N 3.05Å; E670-K674 WeakPolarHBondContact O-CG 3.31Å; E670-K674 PolarHBondContact O-N 3.18Å; E670-K674 IonicContact OE1-NZ 3.2Å; E670-K674 IonicContact OE2-NZ 3.29Å; E670-K674 PolarHBondContact OE2-NZ 2.85Å; E670-I709 HydrophobicContact CB-CD1 4.5Å; E670-I709 HydrophobicContact CB-CG2 4.25Å; E670-K713 IonicContact OE1-NZ 3.92Å; E670-K713 PolarHBondContact OE1-NZ 2.85Å; E670-K713 IonicContact OE2-NZ 3.36Å; E670-K713 PolarHBondContact OE2-NZ 2.86Å
671	L	94.7	Very high	92.2	Very high	26 Å²	26	31.7 Å²	31.7	14%	0.136	16%	0.155	C	C	.	.	H	α-helix	trans	-62.8	-39.3	174.8	-176	58	0	0	0	111.3	K616 Q619 L620 D667 G668 Y673 K674 I675	K616-L671 HydrophobicContact CB-CD1 4.17Å; K616-L671 HydrophobicContact CD-CD1 4.3Å; K616-L671 HydrophobicContact CG-CD1 4.21Å; K616-L671 WeakPolarHBondContact O-CD2 3.33Å; Q619-L671 HydrophobicContact CB-CD2 3.87Å; L620-L671 HydrophobicContact CD2-CB 4.04Å; L620-L671 HydrophobicContact CD2-CD2 3.95Å; L620-L671 HydrophobicContact CD2-CG 4.11Å; L620-L671 HydrophobicContact CG-CD2 4.41Å; D667-L671 WeakPolarHBondContact O-CB 3.36Å; D667-L671 PolarHBondContact O-N 3.39Å; G668-L671 PolarHBondContact O-N 2.83Å; L671-Y673 PolarHBondContact O-N 3.15Å; L671-K674 WeakPolarHBondContact O-CB 3.47Å; L671-K674 PolarHBondContact O-N 2.91Å; L671-I675 HydrophobicContact CG-CD1 4.11Å; L671-I675 HydrophobicContact CG-CG1 4.5Å; L671-I675 VanDerWaalsContact O-CG1 3.27Å; L671-I675 WeakPolarHBondContact O-CG1 3.3Å; L671-I675 PolarHBondContact O-N 3.26Å
672	S	94.7	Very high	92.3	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-56.3	-48.9	173.5	-66.5	0	0	0	0	112.2	G668 F669 E670 K674 I675 I676 L852	G668-S672 VanDerWaalsContact O-CB 3.29Å; G668-S672 WeakPolarHBondContact O-CB 3.44Å; G668-S672 PolarHBondContact O-N 3.04Å; G668-S672 PolarHBondContact O-OG 3.29Å; F669-S672 VanDerWaalsContact O-CB 3.31Å; F669-S672 WeakPolarHBondContact O-CB 3.43Å; F669-S672 PolarHBondContact O-N 3.45Å; E670-S672 VanDerWaalsContact C-N 3.28Å; E670-S672 PolarHBondContact O-N 2.89Å; S672-K674 VanDerWaalsContact C-N 3.34Å; S672-K674 PolarHBondContact O-N 3.49Å; S672-I675 PolarHBondContact O-N 3.07Å; S672-I676 WeakPolarHBondContact O-CG1 3.25Å; S672-I676 PolarHBondContact O-N 2.66Å; S672-L852 VanDerWaalsContact CB-CD1 3.43Å; S672-L852 VanDerWaalsContact OG-CD1 3.25Å; S672-L852 WeakPolarHBondContact OG-CD1 3.43Å
673	Y	93.9	Very high	92.2	Very high	58 Å²	58	41.2 Å²	41.2	23%	0.227	21%	0.205	C	C	.	.	H	α-helix	trans	-60.7	-43.4	174.9	-179.9	-92	0	0	0	111.6	F669 E670 L671 I675 I676 H677 L695 F702 T706	F669-Y673 PolarHBondContact O-N 2.77Å; E670-Y673 PolarHBondContact O-N 3.05Å; L671-Y673 PolarHBondContact O-N 3.15Å; Y673-I675 PolarHBondContact O-N 3.41Å; Y673-I676 PolarHBondContact O-N 3.06Å; Y673-H677 HydrophobicContact CE1-CB 4.43Å; Y673-H677 VanDerWaalsContact O-CB 3.27Å; Y673-H677 WeakPolarHBondContact O-CB 3.35Å; Y673-H677 PolarHBondContact O-N 3.42Å; Y673-L695 HydrophobicContact CE2-CD1 4.42Å; Y673-L695 HydrophobicContact CE2-CD2 4.05Å; Y673-F702 HydrophobicContact CD2-CE1 4.19Å; Y673-T706 WeakPolarHBondContact CE2-OG1 3.42Å
674	K	93.7	Very high	92.2	Very high	96 Å²	96	42.1 Å²	42.1	42%	0.417	21%	0.209	S	C	.	.	H	α-helix	trans	-59.8	-44.3	176.5	-70.9	165.8	179.5	164.2	0	112.1	E670 L671 S672 H677 E678	E670-K674 WeakPolarHBondContact O-CG 3.31Å; E670-K674 PolarHBondContact O-N 3.18Å; E670-K674 IonicContact OE1-NZ 3.2Å; E670-K674 IonicContact OE2-NZ 3.29Å; E670-K674 PolarHBondContact OE2-NZ 2.85Å; L671-K674 WeakPolarHBondContact O-CB 3.47Å; L671-K674 PolarHBondContact O-N 2.91Å; S672-K674 VanDerWaalsContact C-N 3.34Å; S672-K674 PolarHBondContact O-N 3.49Å; K674-H677 PolarHBondContact O-N 2.88Å; K674-E678 VanDerWaalsContact O-CB 3.23Å; K674-E678 WeakPolarHBondContact O-CB 3.32Å; K674-E678 PolarHBondContact O-N 3.22Å
675	I	94.1	Very high	92.1	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-59	-51.4	177.2	-71	163.9	0	0	0	110.1	L613 K616 L617 L620 L671 S672 Y673 H677 E678 I679 L852 L855	L613-I675 HydrophobicContact CD2-CG2 4.33Å; K616-I675 HydrophobicContact CB-CD1 3.85Å; K616-I675 HydrophobicContact CB-CG1 3.77Å; K616-I675 HydrophobicContact CD-CG1 4.18Å; L617-I675 HydrophobicContact CD2-CD1 4.01Å; L617-I675 HydrophobicContact CG-CD1 4.27Å; L620-I675 HydrophobicContact CD1-CD1 4.06Å; L620-I675 HydrophobicContact CG-CD1 4.49Å; L671-I675 HydrophobicContact CG-CD1 4.11Å; L671-I675 HydrophobicContact CG-CG1 4.5Å; L671-I675 VanDerWaalsContact O-CG1 3.27Å; L671-I675 WeakPolarHBondContact O-CG1 3.3Å; L671-I675 PolarHBondContact O-N 3.26Å; S672-I675 PolarHBondContact O-N 3.07Å; Y673-I675 PolarHBondContact O-N 3.41Å; I675-H677 PolarHBondContact O-N 3.47Å; I675-E678 PolarHBondContact O-N 3.49Å; I675-I679 HydrophobicContact CG2-CD1 3.97Å; I675-I679 WeakPolarHBondContact O-CG1 3.21Å; I675-I679 PolarHBondContact O-N 3.21Å; I675-I679 VanDerWaalsContact O-N 3.08Å; I675-L852 HydrophobicContact CD1-CD2 4.46Å; I675-L852 HydrophobicContact CG2-CD2 4.37Å; I675-L855 HydrophobicContact CG2-CD2 4.28Å
676	I	93.6	Very high	92.1	Very high	3 Å²	3	46 Å²	46	2%	0.015	24%	0.235	C	C	.	.	H	α-helix	trans	-62.6	-45.6	-178.2	-69.3	-66	0	0	0	111.3	S672 Y673 E678 I679 N680 V693 F702 L855	S672-I676 WeakPolarHBondContact O-CG1 3.25Å; S672-I676 PolarHBondContact O-N 2.66Å; Y673-I676 PolarHBondContact O-N 3.06Å; I676-E678 PolarHBondContact O-N 2.9Å; I676-I679 PolarHBondContact O-N 3.43Å; I676-N680 WeakPolarHBondContact O-CB 3.44Å; I676-N680 PolarHBondContact O-N 2.86Å; I676-N680 VanDerWaalsContact O-N 3.07Å; I676-V693 HydrophobicContact CD1-CB 4.33Å; I676-V693 HydrophobicContact CD1-CG1 3.94Å; I676-V693 HydrophobicContact CG2-CB 4.02Å; I676-V693 WeakPolarHBondContact CG2-O 3.45Å; I676-F702 HydrophobicContact CB-CD2 4.5Å; I676-F702 HydrophobicContact CD1-CD2 4.12Å; I676-F702 HydrophobicContact CD1-CE2 4.37Å; I676-F702 HydrophobicContact CG1-CD2 3.74Å; I676-F702 HydrophobicContact CG1-CE2 3.65Å; I676-F702 HydrophobicContact CG1-CG 4.34Å; I676-F702 HydrophobicContact CG1-CZ 4.18Å; I676-F702 HydrophobicContact CG2-CB 4.4Å; I676-F702 HydrophobicContact CG2-CD1 4.34Å; I676-F702 HydrophobicContact CG2-CD2 4.32Å; I676-F702 HydrophobicContact CG2-CG 4.09Å; I676-L855 HydrophobicContact CD1-CD2 4.03Å
677	H	90.9	Very high	92	Very high	88 Å²	88	49.1 Å²	49.1	41%	0.407	26%	0.261	S	S	.	.	H	α-helix	trans	-62.5	-42	177.8	-170.8	68.3	0	0	0	112.1	Y673 K674 I675 N680 H681	Y673-H677 HydrophobicContact CE1-CB 4.43Å; Y673-H677 VanDerWaalsContact O-CB 3.27Å; Y673-H677 WeakPolarHBondContact O-CB 3.35Å; Y673-H677 PolarHBondContact O-N 3.42Å; K674-H677 PolarHBondContact O-N 2.88Å; I675-H677 PolarHBondContact O-N 3.47Å; H677-N680 PolarHBondContact O-N 3.05Å; H677-H681 AromaticContact CD2-CD2 3.92Å; H677-H681 AromaticContact CD2-NE2 3.34Å; H677-H681 PolarHBondContact CD2-NE2 2.96Å; H677-H681 VanDerWaalsContact CD2-NE2 3.34Å; H677-H681 AromaticContact CE1-NE2 3.52Å; H677-H681 AromaticContact NE2-CD2 3.92Å; H677-H681 AromaticContact NE2-CE1 3.74Å; H677-H681 AromaticContact NE2-NE2 2.92Å; H677-H681 PolarHBondContact NE2-NE2 3.08Å; H677-H681 PolarHBondContact O-CD2 3.2Å; H677-H681 PolarHBondContact O-N 3.31Å
678	E	92.1	Very high	92.1	Very high	47 Å²	47	47.8 Å²	47.8	22%	0.22	25%	0.252	C	S	.	.	H	α-helix	trans	-63.9	-41.5	179.2	-170.6	179.8	-158.6	0	0	112.4	I609 K616 K674 I675 I676 N680 H681 Y682	I609-E678 HydrophobicContact CD1-CG 3.65Å; K616-E678 IonicContact NZ-OE1 3.25Å; K616-E678 PolarHBondContact NZ-OE1 3.11Å; K616-E678 IonicContact NZ-OE2 2.65Å; K616-E678 PolarHBondContact NZ-OE2 2.79Å; K674-E678 VanDerWaalsContact O-CB 3.23Å; K674-E678 WeakPolarHBondContact O-CB 3.32Å; K674-E678 PolarHBondContact O-N 3.22Å; I675-E678 PolarHBondContact O-N 3.49Å; I676-E678 PolarHBondContact O-N 2.9Å; E678-N680 VanDerWaalsContact C-N 3.34Å; E678-H681 PolarHBondContact O-N 3.16Å; E678-Y682 VanDerWaalsContact O-CD2 3.26Å; E678-Y682 WeakPolarHBondContact O-CD2 3.3Å; E678-Y682 WeakPolarHBondContact O-CE2 3.41Å
679	I	91.7	Very high	92.1	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-65.5	-40.2	175.5	-63.8	164.8	0	0	0	110.8	L613 I675 I676 H681 Y682 L684 V693 L855	L613-I679 HydrophobicContact CD1-CD1 3.76Å; L613-I679 HydrophobicContact CD1-CG1 3.51Å; L613-I679 HydrophobicContact CD2-CD1 4.08Å; L613-I679 HydrophobicContact CD2-CG1 3.68Å; L613-I679 HydrophobicContact CG-CG1 4.25Å; I675-I679 HydrophobicContact CG2-CD1 3.97Å; I675-I679 WeakPolarHBondContact O-CG1 3.21Å; I675-I679 PolarHBondContact O-N 3.21Å; I675-I679 VanDerWaalsContact O-N 3.08Å; I676-I679 PolarHBondContact O-N 3.43Å; I679-H681 PolarHBondContact O-N 2.93Å; I679-Y682 PolarHBondContact O-N 3Å; I679-Y682 VanDerWaalsContact O-N 3.07Å; I679-L684 HydrophobicContact CG2-CD2 4.22Å; I679-V693 HydrophobicContact CB-CG1 4.27Å; I679-V693 HydrophobicContact CD1-CG1 4.46Å; I679-V693 HydrophobicContact CG2-CG1 3.95Å; I679-V693 HydrophobicContact CG2-CG2 4.37Å; I679-L855 HydrophobicContact CD1-CD1 4.16Å; I679-L855 HydrophobicContact CD1-CD2 3.48Å; I679-L855 VanDerWaalsContact CD1-CD2 3.48Å; I679-L855 HydrophobicContact CD1-CG 4.39Å
680	N	89.8	Confident	92	Very high	58 Å²	58	53 Å²	53	31%	0.31	27%	0.273	S	S	.	.	H	α-helix	trans	-67.4	-14.4	-177.4	-165.8	48.1	0	0	0	114	I676 H677 E678 Y682 V693	I676-N680 WeakPolarHBondContact O-CB 3.44Å; I676-N680 PolarHBondContact O-N 2.86Å; I676-N680 VanDerWaalsContact O-N 3.07Å; H677-N680 PolarHBondContact O-N 3.05Å; E678-N680 VanDerWaalsContact C-N 3.34Å; N680-Y682 VanDerWaalsContact C-N 3.25Å; N680-Y682 PolarHBondContact O-N 3.32Å; N680-V693 HydrophobicContact CB-CG2 4.07Å
681	H	89.4	Confident	91.9	Very high	133 Å²	133	56 Å²	56	62%	0.616	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-15.9	171.7	-79.3	-68.1	0	0	0	113.8	H677 E678 I679	H677-H681 AromaticContact CD2-CD2 3.92Å; H677-H681 AromaticContact CD2-NE2 3.34Å; H677-H681 PolarHBondContact CD2-NE2 2.96Å; H677-H681 VanDerWaalsContact CD2-NE2 3.34Å; H677-H681 AromaticContact CE1-NE2 3.52Å; H677-H681 AromaticContact NE2-CD2 3.92Å; H677-H681 AromaticContact NE2-CE1 3.74Å; H677-H681 AromaticContact NE2-NE2 2.92Å; H677-H681 PolarHBondContact NE2-NE2 3.08Å; H677-H681 PolarHBondContact O-CD2 3.2Å; H677-H681 PolarHBondContact O-N 3.31Å; E678-H681 PolarHBondContact O-N 3.16Å; I679-H681 PolarHBondContact O-N 2.93Å
682	Y	89	Confident	91.8	Very high	99 Å²	99	54.7 Å²	54.7	39%	0.388	28%	0.279	S	S	.	.	S	Bend	trans	-90.2	157.2	-179.7	-70.3	-98.1	0	0	0	111.3	I606 I609 E678 I679 N680 L684	I606-Y682 HydrophobicContact CB-CD1 4.44Å; I606-Y682 HydrophobicContact CG2-CD1 4.09Å; I606-Y682 HydrophobicContact CG2-CG 4.34Å; I609-Y682 HydrophobicContact CD1-CD2 4.25Å; I609-Y682 HydrophobicContact CD1-CE2 3.44Å; I609-Y682 VanDerWaalsContact CD1-CE2 3.44Å; E678-Y682 VanDerWaalsContact O-CD2 3.26Å; E678-Y682 WeakPolarHBondContact O-CD2 3.3Å; E678-Y682 WeakPolarHBondContact O-CE2 3.41Å; I679-Y682 PolarHBondContact O-N 3Å; I679-Y682 VanDerWaalsContact O-N 3.07Å; N680-Y682 VanDerWaalsContact C-N 3.25Å; N680-Y682 PolarHBondContact O-N 3.32Å; Y682-L684 WeakPolarHBondContact O-CG 3.31Å; Y682-L684 PolarHBondContact O-N 2.7Å
683	P	87.2	Confident	91.7	Very high	105 Å²	105	54.8 Å²	54.8	68%	0.682	28%	0.28	S	S	*	.			trans	-66.6	106.8	176.3	26.2	-33.7	0	0	0	111	N602	N602-P683 PolarHBondContact ND2-O 3.1Å; N602-P683 VanDerWaalsContact ND2-O 3.13Å
684	L	89.6	Confident	91.6	Very high	26 Å²	26	52.7 Å²	52.7	14%	0.136	27%	0.273	C	S	.	.			trans	-98.6	105.2	178	-59.1	174	0	0	0	110.9	N602 I606 I679 Y682 L689 K690 V693	N602-L684 WeakPolarHBondContact OD1-CA 3.26Å; I606-L684 HydrophobicContact CD1-CD2 4.46Å; I679-L684 HydrophobicContact CG2-CD2 4.22Å; Y682-L684 WeakPolarHBondContact O-CG 3.31Å; Y682-L684 PolarHBondContact O-N 2.7Å; L684-L689 HydrophobicContact CD2-CD2 3.79Å; L684-L689 HydrophobicContact CD2-CG 4.19Å; L684-K690 HydrophobicContact CB-CB 4.23Å; L684-V693 HydrophobicContact CD1-CG2 3.26Å
685	S	89.4	Confident	91.5	Very high	103 Å²	103	49.6 Å²	49.6	72%	0.72	26%	0.26	S	S	*	.			trans	-82.1	-29.5	175.5	58.8	0	0	0	0	112.5	N602 A687	N602-S685 PolarHBondContact OD1-N 3.32Å; S685-A687 PolarHBondContact O-N 3.33Å
686	S	90.8	Very high	91.3	Very high	4 Å²	4	52.1 Å²	52.1	3%	0.028	28%	0.276	C	S	.	.			trans	-77.4	118.4	179.7	176.1	0	0	0	0	111.2	A599 N602 Y688 L689 K690	A599-S686 WeakPolarHBondContact CA-OG 3.18Å; A599-S686 PolarHBondContact N-OG 3.06Å; N602-S686 PolarHBondContact OD1-N 3.39Å; N602-S686 VanDerWaalsContact OD1-N 3.16Å; S686-Y688 PolarHBondContact O-N 2.74Å; S686-L689 PolarHBondContact O-N 3.49Å; S686-L689 PolarHBondContact OG-N 3.29Å; S686-K690 VanDerWaalsContact O-CB 3.22Å; S686-K690 WeakPolarHBondContact O-CB 3.38Å; S686-K690 PolarHBondContact O-N 3.36Å
687	A	91.7	Very high	91	Very high	70 Å²	70	57.7 Å²	57.7	58%	0.579	31%	0.306	S	S	*	.	H	α-helix	trans	-60.6	-33.9	176.4	0	0	0	0	0	112.6	S685 K691	S685-A687 PolarHBondContact O-N 3.33Å; A687-K691 WeakPolarHBondContact O-CB 3.44Å; A687-K691 VanDerWaalsContact O-CG 3.3Å; A687-K691 WeakPolarHBondContact O-CG 3.29Å; A687-K691 PolarHBondContact O-N 3Å
688	Y	93.5	Very high	90.8	Very high	34 Å²	34	59.5 Å²	59.5	13%	0.133	32%	0.318	C	S	.	.	H	α-helix	trans	-69.6	-51.1	178.6	175.2	-124.1	0	0	0	111.2	Q595 R596 A599 S686 K690 K691 L692 E854 I858	Q595-Y688 HydrophobicContact CB-CG 4.36Å; R596-Y688 HydrophobicContact CG-CE1 4.36Å; A599-Y688 HydrophobicContact CB-CD1 4.06Å; S686-Y688 PolarHBondContact O-N 2.74Å; Y688-K690 VanDerWaalsContact C-N 3.32Å; Y688-K690 PolarHBondContact O-N 2.89Å; Y688-K691 PolarHBondContact O-N 2.81Å; Y688-L692 HydrophobicContact CE1-CD1 4.06Å; Y688-L692 HydrophobicContact CE2-CD1 4.09Å; Y688-L692 HydrophobicContact CE2-CD2 4.38Å; Y688-L692 HydrophobicContact CE2-CG 4.22Å; Y688-L692 PolarHBondContact O-N 3.49Å; Y688-L692 VanDerWaalsContact O-N 3.07Å; Y688-E854 PolarHBondContact OH-OE2 2.91Å; Y688-I858 HydrophobicContact CE1-CD1 4.07Å; Y688-I858 HydrophobicContact CE1-CG1 4.23Å
689	L	93.3	Very high	90.6	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-60.7	-43.2	176.2	-176.2	59	0	0	0	111.2	A599 N602 L603 L684 S686 K691 L692 V693 L855	A599-L689 HydrophobicContact CB-CB 4.08Å; N602-L689 HydrophobicContact CB-CD2 4.28Å; L603-L689 HydrophobicContact CD2-CD2 3.74Å; L603-L689 HydrophobicContact CG-CD2 4.2Å; L684-L689 HydrophobicContact CD2-CD2 3.79Å; L684-L689 HydrophobicContact CD2-CG 4.19Å; S686-L689 PolarHBondContact O-N 3.49Å; S686-L689 PolarHBondContact OG-N 3.29Å; L689-K691 VanDerWaalsContact C-N 3.34Å; L689-K691 PolarHBondContact O-N 2.97Å; L689-L692 PolarHBondContact O-N 3.21Å; L689-L692 VanDerWaalsContact O-N 3.16Å; L689-V693 HydrophobicContact CD1-CG1 4.38Å; L689-V693 WeakPolarHBondContact O-CG2 3.49Å; L689-V693 PolarHBondContact O-N 3.42Å; L689-V693 VanDerWaalsContact O-N 3.13Å; L689-L855 HydrophobicContact CD1-CD1 3.77Å
690	K	93.5	Very high	90.5	Very high	112 Å²	112	60.6 Å²	60.6	49%	0.487	34%	0.342	S	S	.	.	H	α-helix	trans	-57.9	-44.5	175.8	-173	173.5	-177.7	175.4	0	111.7	L684 S686 Y688 L692 V693 T694	L684-K690 HydrophobicContact CB-CB 4.23Å; S686-K690 VanDerWaalsContact O-CB 3.22Å; S686-K690 WeakPolarHBondContact O-CB 3.38Å; S686-K690 PolarHBondContact O-N 3.36Å; Y688-K690 VanDerWaalsContact C-N 3.32Å; Y688-K690 PolarHBondContact O-N 2.89Å; K690-L692 PolarHBondContact O-N 2.71Å; K690-V693 PolarHBondContact O-N 3.03Å; K690-T694 WeakPolarHBondContact O-CB 3.5Å; K690-T694 PolarHBondContact O-N 2.9Å; K690-T694 PolarHBondContact O-OG1 3.43Å
691	K	93.3	Very high	90.6	Very high	113 Å²	113	61.2 Å²	61.2	49%	0.491	35%	0.345	S	S	.	.	H	α-helix	trans	-61.2	-41.9	175.6	-79.9	-179.8	178.1	-171.4	0	112.4	A687 Y688 L689 V693 G700 N701	A687-K691 WeakPolarHBondContact O-CB 3.44Å; A687-K691 VanDerWaalsContact O-CG 3.3Å; A687-K691 WeakPolarHBondContact O-CG 3.29Å; A687-K691 PolarHBondContact O-N 3Å; Y688-K691 PolarHBondContact O-N 2.81Å; L689-K691 VanDerWaalsContact C-N 3.34Å; L689-K691 PolarHBondContact O-N 2.97Å; K691-V693 VanDerWaalsContact C-N 3.3Å; K691-V693 PolarHBondContact O-N 3.42Å; K691-G700 CarbonylContact O-C 3.55Å; K691-G700 WeakPolarHBondContact O-CA 3.49Å; K691-N701 PolarHBondContact O-N 3.06Å
692	L	92.8	Very high	90.8	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-63.2	-34.5	179.3	-69.6	176.5	0	0	0	113.2	Y688 L689 K690 E854	Y688-L692 HydrophobicContact CE1-CD1 4.06Å; Y688-L692 HydrophobicContact CE2-CD1 4.09Å; Y688-L692 HydrophobicContact CE2-CD2 4.38Å; Y688-L692 HydrophobicContact CE2-CG 4.22Å; Y688-L692 PolarHBondContact O-N 3.49Å; Y688-L692 VanDerWaalsContact O-N 3.07Å; L689-L692 PolarHBondContact O-N 3.21Å; L689-L692 VanDerWaalsContact O-N 3.16Å; K690-L692 PolarHBondContact O-N 2.71Å; L692-E854 HydrophobicContact CD1-CB 4.11Å; L692-E854 HydrophobicContact CD2-CB 4.2Å
693	V	92.6	Very high	91	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.012	30%	0.297	C	S	.	.	H	α-helix	trans	-102.9	-0.7	-176.3	-51.3	0	0	0	0	114.7	I676 I679 N680 L684 L689 K690 K691	I676-V693 HydrophobicContact CD1-CB 4.33Å; I676-V693 HydrophobicContact CD1-CG1 3.94Å; I676-V693 HydrophobicContact CG2-CB 4.02Å; I676-V693 WeakPolarHBondContact CG2-O 3.45Å; I679-V693 HydrophobicContact CB-CG1 4.27Å; I679-V693 HydrophobicContact CD1-CG1 4.46Å; I679-V693 HydrophobicContact CG2-CG1 3.95Å; I679-V693 HydrophobicContact CG2-CG2 4.37Å; N680-V693 HydrophobicContact CB-CG2 4.07Å; L684-V693 HydrophobicContact CD1-CG2 3.26Å; L689-V693 HydrophobicContact CD1-CG1 4.38Å; L689-V693 WeakPolarHBondContact O-CG2 3.49Å; L689-V693 PolarHBondContact O-N 3.42Å; L689-V693 VanDerWaalsContact O-N 3.13Å; K690-V693 PolarHBondContact O-N 3.03Å; K691-V693 VanDerWaalsContact C-N 3.3Å; K691-V693 PolarHBondContact O-N 3.42Å
694	T	92.7	Very high	91.1	Very high	14 Å²	14	47.8 Å²	47.8	9%	0.086	28%	0.279	C	S	.	.	S	Bend	trans	-94.9	144.2	175.9	-61	0	0	0	0	109.8	K690 L698 G700 N701 F702	K690-T694 WeakPolarHBondContact O-CB 3.5Å; K690-T694 PolarHBondContact O-N 2.9Å; K690-T694 PolarHBondContact O-OG1 3.43Å; T694-L698 HydrophobicContact CG2-CB 3.54Å; T694-L698 HydrophobicContact CG2-CD1 4.5Å; T694-G700 CarbonylContact O-C 3.56Å; T694-G700 VanDerWaalsContact O-CA 3.29Å; T694-G700 WeakPolarHBondContact O-CA 3.2Å; T694-N701 PolarHBondContact O-N 3.19Å; T694-F702 PolarHBondContact O-N 2.98Å; T694-F702 VanDerWaalsContact O-N 3.14Å
695	L	91.5	Very high	91.2	Very high	30 Å²	30	46.5 Å²	46.5	16%	0.157	27%	0.272	C	S	.	.	B	Isolated β-bridge	trans	-68.5	149.6	178	-58.7	179.2	0	0	0	111.9	Y673 N697 L698 G699 G700 F702	Y673-L695 HydrophobicContact CE2-CD1 4.42Å; Y673-L695 HydrophobicContact CE2-CD2 4.05Å; L695-N697 PolarHBondContact O-N 3.17Å; L695-L698 HydrophobicContact CB-CD1 4.49Å; L695-L698 CarbonylContact O-C 3.52Å; L695-L698 WeakPolarHBondContact O-CA 3.49Å; L695-L698 PolarHBondContact O-N 3.37Å; L695-G699 PolarHBondContact O-N 3.47Å; L695-G700 PolarHBondContact O-N 3.25Å; L695-F702 CarbonylContact C-O 3.55Å; L695-F702 WeakPolarHBondContact CA-O 3.36Å; L695-F702 HydrophobicContact CD2-CD1 3.76Å
696	T	89.1	Confident	91.2	Very high	53 Å²	53	43.4 Å²	43.4	33%	0.325	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-53.7	-38.1	175.5	47.2	0	0	0	0	112.7	L698 G699 G700 F702 P703 M847	T696-L698 PolarHBondContact O-N 3.36Å; T696-G699 PolarHBondContact O-N 2.89Å; T696-G700 WeakPolarHBondContact CA-O 3.47Å; T696-F702 PolarHBondContact N-O 2.98Å; T696-P703 HydrophobicContact CG2-CB 4.48Å; T696-M847 HydrophobicContact CG2-CE 4.45Å
697	N	87	Confident	91.1	Very high	121 Å²	121	50.9 Å²	50.9	65%	0.647	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-66.3	-20.5	178.8	-57.5	-8.5	0	0	0	112.7	L695	L695-N697 PolarHBondContact O-N 3.17Å
698	L	87.1	Confident	91	Very high	126 Å²	126	50.7 Å²	50.7	66%	0.66	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-105.1	11.8	177.5	-60.6	175.7	0	0	0	112	T694 L695 T696	T694-L698 HydrophobicContact CG2-CB 3.54Å; T694-L698 HydrophobicContact CG2-CD1 4.5Å; L695-L698 HydrophobicContact CB-CD1 4.49Å; L695-L698 CarbonylContact O-C 3.52Å; L695-L698 WeakPolarHBondContact O-CA 3.49Å; L695-L698 PolarHBondContact O-N 3.37Å; T696-L698 PolarHBondContact O-N 3.36Å
699	G	86.9	Confident	90.8	Very high	60 Å²	60	49.2 Å²	49.2	62%	0.619	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.5	15.8	179.1	0	0	0	0	0	115.5	L695 T696	L695-G699 PolarHBondContact O-N 3.47Å; T696-G699 PolarHBondContact O-N 2.89Å
700	G	90.2	Very high	90.5	Very high	10 Å²	10	52.8 Å²	52.8	10%	0.103	28%	0.283	C	S	.	.	S	Bend	trans	-93.8	-168.9	170.9	0	0	0	0	0	113.6	K691 T694 L695 T696	K691-G700 CarbonylContact O-C 3.55Å; K691-G700 WeakPolarHBondContact O-CA 3.49Å; T694-G700 CarbonylContact O-C 3.56Å; T694-G700 VanDerWaalsContact O-CA 3.29Å; T694-G700 WeakPolarHBondContact O-CA 3.2Å; L695-G700 PolarHBondContact O-N 3.25Å; T696-G700 WeakPolarHBondContact CA-O 3.47Å
701	N	92.2	Very high	90.3	Very high	70 Å²	70	53.7 Å²	53.7	37%	0.374	28%	0.284	S	S	.	.	S	Bend	trans	-103.6	-19.1	-176.3	-67.9	4.4	0	0	0	112.9	K691 T694 P703	K691-N701 PolarHBondContact O-N 3.06Å; T694-N701 PolarHBondContact O-N 3.19Å; N701-P703 WeakPolarHBondContact O-CD 3.45Å
702	F	94.1	Very high	90	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-79.3	120.5	-177.4	-166.7	-87.7	0	0	0	110.3	Y673 I676 T694 L695 T696 I705 A848 C851 L852	Y673-F702 HydrophobicContact CD2-CE1 4.19Å; I676-F702 HydrophobicContact CB-CD2 4.5Å; I676-F702 HydrophobicContact CD1-CD2 4.12Å; I676-F702 HydrophobicContact CD1-CE2 4.37Å; I676-F702 HydrophobicContact CG1-CD2 3.74Å; I676-F702 HydrophobicContact CG1-CE2 3.65Å; I676-F702 HydrophobicContact CG1-CG 4.34Å; I676-F702 HydrophobicContact CG1-CZ 4.18Å; I676-F702 HydrophobicContact CG2-CB 4.4Å; I676-F702 HydrophobicContact CG2-CD1 4.34Å; I676-F702 HydrophobicContact CG2-CD2 4.32Å; I676-F702 HydrophobicContact CG2-CG 4.09Å; T694-F702 PolarHBondContact O-N 2.98Å; T694-F702 VanDerWaalsContact O-N 3.14Å; L695-F702 CarbonylContact C-O 3.55Å; L695-F702 WeakPolarHBondContact CA-O 3.36Å; L695-F702 HydrophobicContact CD2-CD1 3.76Å; T696-F702 PolarHBondContact N-O 2.98Å; F702-I705 HydrophobicContact CE1-CD1 4.04Å; F702-I705 HydrophobicContact CE1-CG1 4.18Å; F702-I705 HydrophobicContact CZ-CD1 3.95Å; F702-A848 HydrophobicContact CD2-CB 4.38Å; F702-A848 HydrophobicContact CE1-CB 4.49Å; F702-A848 HydrophobicContact CE2-CB 3.7Å; F702-A848 HydrophobicContact CZ-CB 3.78Å; F702-C851 HydrophobicContact CD2-CB 3.9Å; F702-L852 HydrophobicContact CE2-CD1 4.26Å
703	P	93	Very high	89.6	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.006	27%	0.274	C	S	.	.			trans	-70.7	144	-178.7	27.4	-31.5	0	0	0	111.4	T696 N701 I705 H844 M847 A848	T696-P703 HydrophobicContact CG2-CB 4.48Å; N701-P703 WeakPolarHBondContact O-CD 3.45Å; P703-I705 HydrophobicContact CB-CG2 4.32Å; P703-I705 HydrophobicContact CG-CG2 4.14Å; P703-I705 PolarHBondContact O-N 3.21Å; P703-I705 VanDerWaalsContact O-N 3.1Å; P703-H844 HydrophobicContact CB-CB 4.31Å; P703-H844 HydrophobicContact CG-CB 4.42Å; P703-H844 WeakPolarHBondContact CG-O 3.33Å; P703-M847 HydrophobicContact CG-CB 3.94Å; P703-A848 HydrophobicContact CG-CB 3.92Å
704	D	89.8	Confident	89.1	Confident	54 Å²	54	57.9 Å²	57.9	29%	0.289	31%	0.309	S	S	.	.			trans	-74.8	101.9	172.1	-166.7	-4.5	0	0	0	110.4	T706	D704-T706 WeakPolarHBondContact OD1-CB 3.43Å; D704-T706 PolarHBondContact OD1-N 3.02Å; D704-T706 PolarHBondContact OD1-OG1 2.69Å
705	I	90.4	Very high	88.5	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.324	C	S	.	.			trans	-103.1	1.9	-177.2	55.9	-179.9	0	0	0	112.6	F669 F702 P703 E707 K708 I709 H844 W845 A848	F669-I705 HydrophobicContact CB-CD1 4.08Å; F669-I705 HydrophobicContact CD1-CD1 3.98Å; F669-I705 HydrophobicContact CG-CD1 4.37Å; F702-I705 HydrophobicContact CE1-CD1 4.04Å; F702-I705 HydrophobicContact CE1-CG1 4.18Å; F702-I705 HydrophobicContact CZ-CD1 3.95Å; P703-I705 HydrophobicContact CB-CG2 4.32Å; P703-I705 HydrophobicContact CG-CG2 4.14Å; P703-I705 PolarHBondContact O-N 3.21Å; P703-I705 VanDerWaalsContact O-N 3.1Å; I705-E707 PolarHBondContact O-N 3.49Å; I705-K708 PolarHBondContact O-N 2.82Å; I705-I709 HydrophobicContact CB-CD1 4.3Å; I705-I709 HydrophobicContact CD1-CD1 3.95Å; I705-I709 HydrophobicContact CG1-CD1 3.8Å; I705-I709 VanDerWaalsContact O-CG1 3.3Å; I705-I709 WeakPolarHBondContact O-CG1 3.46Å; I705-I709 PolarHBondContact O-N 3.43Å; I705-H844 HydrophobicContact CG2-CB 4.41Å; I705-W845 HydrophobicContact CB-CE3 4.43Å; I705-W845 HydrophobicContact CB-CH2 4.28Å; I705-W845 HydrophobicContact CB-CZ3 3.75Å; I705-W845 HydrophobicContact CD1-CE3 4.39Å; I705-W845 HydrophobicContact CD1-CZ3 4.01Å; I705-W845 HydrophobicContact CG1-CZ3 4.38Å; I705-W845 HydrophobicContact CG2-CE3 4.11Å; I705-W845 HydrophobicContact CG2-CZ3 3.92Å; I705-A848 HydrophobicContact CD1-CB 4.12Å
706	T	89	Confident	87.9	Confident	38 Å²	38	59 Å²	59	23%	0.233	32%	0.321	C	S	.	.	H	α-helix	trans	-62.1	-47.9	-170.3	-43.9	0	0	0	0	112.2	Y673 D704 K708 I709 N710	Y673-T706 WeakPolarHBondContact CE2-OG1 3.42Å; D704-T706 WeakPolarHBondContact OD1-CB 3.43Å; D704-T706 PolarHBondContact OD1-N 3.02Å; D704-T706 PolarHBondContact OD1-OG1 2.69Å; T706-K708 VanDerWaalsContact C-N 3.32Å; T706-K708 PolarHBondContact O-N 3.37Å; T706-I709 PolarHBondContact O-N 2.88Å; T706-N710 WeakPolarHBondContact O-CB 3.44Å; T706-N710 PolarHBondContact O-N 3.49Å; T706-N710 PolarHBondContact O-ND2 3.02Å
707	E	89.3	Confident	87.5	Confident	160 Å²	160	61 Å²	61	75%	0.748	33%	0.329	S	S	*	.	H	α-helix	trans	-62.6	-40.7	179.3	-64.1	-173.9	165.2	0	0	111.6	I705 N710 Y711	I705-E707 PolarHBondContact O-N 3.49Å; E707-N710 PolarHBondContact O-N 2.83Å; E707-Y711 WeakPolarHBondContact O-CB 3.24Å; E707-Y711 PolarHBondContact O-N 2.9Å
708	K	88.9	Confident	87.1	Confident	66 Å²	66	56.7 Å²	56.7	29%	0.287	31%	0.311	S	S	.	.	H	α-helix	trans	-65.3	-44.8	177.9	-66.1	176.4	-177.8	-77.8	0	111.5	I705 T706 N710 Y711 F712 S841 W845	I705-K708 PolarHBondContact O-N 2.82Å; T706-K708 VanDerWaalsContact C-N 3.32Å; T706-K708 PolarHBondContact O-N 3.37Å; K708-N710 PolarHBondContact O-N 3.08Å; K708-Y711 WeakPolarHBondContact O-CB 3.39Å; K708-Y711 PolarHBondContact O-N 2.79Å; K708-F712 WeakPolarHBondContact O-CD2 3.42Å; K708-F712 PolarHBondContact O-N 3.16Å; K708-F712 VanDerWaalsContact O-N 3.13Å; K708-S841 PolarHBondContact NZ-OG 2.97Å; K708-W845 HydrophobicContact CB-CH2 3.99Å; K708-W845 HydrophobicContact CB-CZ2 4.11Å; K708-W845 HydrophobicContact CD-CZ2 4.46Å
709	I	89.2	Confident	86.9	Confident	4 Å²	4	55.9 Å²	55.9	2%	0.021	30%	0.303	C	S	.	.	H	α-helix	trans	-60.9	-46.9	176.7	-66.8	165.9	0	0	0	110.2	F669 E670 I705 T706 Y711 F712 K713 W845	F669-I709 HydrophobicContact CB-CD1 4Å; F669-I709 HydrophobicContact CB-CG1 4.46Å; E670-I709 HydrophobicContact CB-CD1 4.5Å; E670-I709 HydrophobicContact CB-CG2 4.25Å; I705-I709 HydrophobicContact CB-CD1 4.3Å; I705-I709 HydrophobicContact CD1-CD1 3.95Å; I705-I709 HydrophobicContact CG1-CD1 3.8Å; I705-I709 VanDerWaalsContact O-CG1 3.3Å; I705-I709 WeakPolarHBondContact O-CG1 3.46Å; I705-I709 PolarHBondContact O-N 3.43Å; T706-I709 PolarHBondContact O-N 2.88Å; I709-Y711 VanDerWaalsContact C-N 3.32Å; I709-Y711 PolarHBondContact O-N 3.03Å; I709-F712 PolarHBondContact O-N 2.96Å; I709-K713 HydrophobicContact CG2-CD 4.13Å; I709-K713 HydrophobicContact CG2-CG 4.24Å; I709-K713 WeakPolarHBondContact O-CB 3.41Å; I709-K713 WeakPolarHBondContact O-CG 3.49Å; I709-K713 PolarHBondContact O-N 2.98Å; I709-W845 HydrophobicContact CD1-CZ3 4.48Å; I709-W845 HydrophobicContact CG1-CH2 3.9Å; I709-W845 HydrophobicContact CG1-CZ3 4.02Å
710	N	88.9	Confident	86.5	Confident	75 Å²	75	56.5 Å²	56.5	40%	0.401	29%	0.289	S	S	.	.	H	α-helix	trans	-62.9	-39.2	179.5	-73.2	-23	0	0	0	112.1	T706 E707 K708 K713 N714	T706-N710 WeakPolarHBondContact O-CB 3.44Å; T706-N710 PolarHBondContact O-N 3.49Å; T706-N710 PolarHBondContact O-ND2 3.02Å; E707-N710 PolarHBondContact O-N 2.83Å; K708-N710 PolarHBondContact O-N 3.08Å; N710-K713 PolarHBondContact O-N 2.9Å; N710-N714 WeakPolarHBondContact O-CB 3.48Å; N710-N714 VanDerWaalsContact O-CG 3.3Å; N710-N714 PolarHBondContact O-N 3.17Å; N710-N714 PolarHBondContact O-ND2 3.27Å
711	Y	88.3	Confident	86.1	Confident	130 Å²	130	56.1 Å²	56.1	51%	0.51	29%	0.285	S	S	.	.	H	α-helix	trans	-55.5	-52.7	172.6	170.4	-99.6	0	0	0	111.2	E707 K708 I709 N714 A715	E707-Y711 WeakPolarHBondContact O-CB 3.24Å; E707-Y711 PolarHBondContact O-N 2.9Å; K708-Y711 WeakPolarHBondContact O-CB 3.39Å; K708-Y711 PolarHBondContact O-N 2.79Å; I709-Y711 VanDerWaalsContact C-N 3.32Å; I709-Y711 PolarHBondContact O-N 3.03Å; Y711-N714 PolarHBondContact O-N 3.24Å; Y711-A715 WeakPolarHBondContact O-CB 3.43Å; Y711-A715 PolarHBondContact O-N 3.4Å
712	F	86.6	Confident	85.5	Confident	3 Å²	3	55.2 Å²	55.2	1%	0.013	28%	0.278	C	S	.	.	H	α-helix	trans	-70.7	-34.9	-178.5	-68.1	-65	0	0	0	113.8	F662 L666 K708 I709 N714 A715 F716 I834 F838 W845	F662-F712 HydrophobicContact CZ-CB 4.48Å; F662-F712 HydrophobicContact CZ-CD1 4.1Å; F662-F712 HydrophobicContact CZ-CG 4.3Å; L666-F712 HydrophobicContact CD1-CB 3.74Å; L666-F712 HydrophobicContact CD2-CB 3.85Å; L666-F712 HydrophobicContact CD2-CD2 4.19Å; L666-F712 HydrophobicContact CD2-CG 4.28Å; L666-F712 HydrophobicContact CG-CB 4.47Å; K708-F712 WeakPolarHBondContact O-CD2 3.42Å; K708-F712 PolarHBondContact O-N 3.16Å; K708-F712 VanDerWaalsContact O-N 3.13Å; I709-F712 PolarHBondContact O-N 2.96Å; F712-N714 VanDerWaalsContact C-N 3.35Å; F712-A715 PolarHBondContact O-N 3.28Å; F712-F716 VanDerWaalsContact O-CE1 3.26Å; F712-F716 WeakPolarHBondContact O-CE1 3.45Å; F712-I834 HydrophobicContact CD1-CG2 4.16Å; F712-I834 HydrophobicContact CE1-CG2 4.39Å; F712-F838 HydrophobicContact CD2-CD2 4.18Å; F712-F838 HydrophobicContact CE1-CB 4.2Å; F712-F838 HydrophobicContact CE2-CB 4.33Å; F712-F838 AromaticContact CE2-CD2 4Å; F712-F838 HydrophobicContact CE2-CD2 4Å; F712-F838 HydrophobicContact CZ-CB 3.9Å; F712-F838 HydrophobicContact CZ-CD2 4.41Å; F712-W845 HydrophobicContact CE2-CZ2 4.31Å
713	K	84.1	Confident	84.7	Confident	62 Å²	62	64.4 Å²	64.4	27%	0.27	31%	0.312	S	S	.	.	H	α-helix	trans	-67.9	-33.7	176.8	-77	-164.3	172.9	-159.7	0	112.9	D667 E670 I709 N710	D667-K713 WeakPolarHBondContact OD1-CE 3.38Å; D667-K713 IonicContact OD1-NZ 3.23Å; D667-K713 PolarHBondContact OD1-NZ 2.8Å; E670-K713 IonicContact OE1-NZ 3.92Å; E670-K713 PolarHBondContact OE1-NZ 2.85Å; E670-K713 IonicContact OE2-NZ 3.36Å; E670-K713 PolarHBondContact OE2-NZ 2.86Å; I709-K713 HydrophobicContact CG2-CD 4.13Å; I709-K713 HydrophobicContact CG2-CG 4.24Å; I709-K713 WeakPolarHBondContact O-CB 3.41Å; I709-K713 WeakPolarHBondContact O-CG 3.49Å; I709-K713 PolarHBondContact O-N 2.98Å; N710-K713 PolarHBondContact O-N 2.9Å
714	N	83.6	Confident	84	Confident	139 Å²	139	68.5 Å²	68.5	74%	0.743	33%	0.331	S	S	*	.	H	α-helix	trans	-86.8	-14.7	177.2	-66.3	-27.5	0	0	0	112.9	N710 Y711 F712 F716	N710-N714 WeakPolarHBondContact O-CB 3.48Å; N710-N714 VanDerWaalsContact O-CG 3.3Å; N710-N714 PolarHBondContact O-N 3.17Å; N710-N714 PolarHBondContact O-ND2 3.27Å; Y711-N714 PolarHBondContact O-N 3.24Å; F712-N714 VanDerWaalsContact C-N 3.35Å; N714-F716 VanDerWaalsContact C-N 3.27Å; N714-F716 PolarHBondContact O-N 2.86Å
715	A	78.8	Confident	83.2	Confident	49 Å²	49	65.9 Å²	65.9	41%	0.405	32%	0.318	S	S	.	.	H	α-helix	trans	-67.4	-26	-178.9	0	0	0	0	0	113.2	Y711 F712	Y711-A715 WeakPolarHBondContact O-CB 3.43Å; Y711-A715 PolarHBondContact O-N 3.4Å; F712-A715 PolarHBondContact O-N 3.28Å
716	F	79.6	Confident	82.5	Confident	18 Å²	18	67.3 Å²	67.3	8%	0.079	32%	0.323	C	S	.	.	S	Bend	trans	-156.1	153.6	178.9	63.2	-79.7	0	0	0	112.8	F662 V663 F712 N714 A718 A721 I727 I834	F662-F716 HydrophobicContact CD1-CE1 4.22Å; F662-F716 AromaticContact CD1-CZ 3.79Å; F662-F716 HydrophobicContact CD1-CZ 3.79Å; F662-F716 AromaticContact CE1-CE1 3.72Å; F662-F716 HydrophobicContact CE1-CE1 3.72Å; F662-F716 AromaticContact CE1-CZ 3.75Å; F662-F716 HydrophobicContact CE1-CZ 3.75Å; V663-F716 HydrophobicContact CG2-CE2 4.12Å; V663-F716 HydrophobicContact CG2-CZ 4.25Å; F712-F716 VanDerWaalsContact O-CE1 3.26Å; F712-F716 WeakPolarHBondContact O-CE1 3.45Å; N714-F716 VanDerWaalsContact C-N 3.27Å; N714-F716 PolarHBondContact O-N 2.86Å; F716-A718 HydrophobicContact CE2-CB 4.33Å; F716-A718 PolarHBondContact O-N 2.93Å; F716-A721 HydrophobicContact CD2-CB 3.85Å; F716-A721 HydrophobicContact CE2-CB 4.25Å; F716-I727 HydrophobicContact CB-CG1 4.45Å; F716-I727 HydrophobicContact CB-CG2 3.51Å; F716-I727 HydrophobicContact CD1-CD1 4.3Å; F716-I727 HydrophobicContact CD2-CD1 4.35Å; F716-I727 HydrophobicContact CD2-CG1 4.14Å; F716-I727 HydrophobicContact CG-CD1 4.2Å; F716-I727 HydrophobicContact CG-CG1 4.21Å; F716-I727 HydrophobicContact CG-CG2 4.12Å; F716-I834 HydrophobicContact CD1-CD1 4.4Å
717	D	80.9	Confident	82	Confident	95 Å²	95	65.8 Å²	65.8	51%	0.508	31%	0.313	S	S	.	.			trans	-72	107.1	170.8	-179.4	-21.3	0	0	0	110.1	E719 K720 A721	D717-E719 PolarHBondContact O-N 3.27Å; D717-E719 PolarHBondContact OD1-N 2.85Å; D717-K720 HydrophobicContact CB-CB 3.81Å; D717-K720 PolarHBondContact OD1-N 3.1Å; D717-K720 WeakPolarHBondContact OD2-CB 3.37Å; D717-A721 WeakPolarHBondContact O-CB 3.27Å; D717-A721 PolarHBondContact O-N 2.85Å
718	A	79.1	Confident	81.3	Confident	31 Å²	31	59.6 Å²	59.6	26%	0.256	29%	0.287	S	S	.	.	H	α-helix	trans	-62.3	-37.2	-178.1	0	0	0	0	0	113.5	V663 F716 K722	V663-A718 HydrophobicContact CG1-CB 4.41Å; V663-A718 HydrophobicContact CG2-CB 4.07Å; F716-A718 HydrophobicContact CE2-CB 4.33Å; F716-A718 PolarHBondContact O-N 2.93Å; A718-K722 WeakPolarHBondContact O-CB 3.49Å; A718-K722 WeakPolarHBondContact O-CG 3.29Å; A718-K722 PolarHBondContact O-N 3.16Å
719	E	81.5	Confident	80.6	Confident	108 Å²	108	57.3 Å²	57.3	51%	0.505	28%	0.279	S	S	.	.	H	α-helix	trans	-78.8	-37.8	-176.7	-72	-56.5	123.9	0	0	111.5	D717 K722 R723	D717-E719 PolarHBondContact O-N 3.27Å; D717-E719 PolarHBondContact OD1-N 2.85Å; E719-K722 IonicContact OE1-NZ 3.85Å; E719-K722 PolarHBondContact OE1-NZ 2.84Å; E719-R723 WeakPolarHBondContact O-CB 3.31Å; E719-R723 PolarHBondContact O-N 3.22Å; E719-R723 VanDerWaalsContact O-N 3.17Å
720	K	79.8	Confident	79.9	Confident	73 Å²	73	63.3 Å²	63.3	32%	0.317	31%	0.306	S	S	.	.	H	α-helix	trans	-62.5	-46.5	169	-170.6	-177.5	-179.5	-166.2	0	110.6	D717 K722 R723 E724 T728	D717-K720 HydrophobicContact CB-CB 3.81Å; D717-K720 PolarHBondContact OD1-N 3.1Å; D717-K720 WeakPolarHBondContact OD2-CB 3.37Å; K720-K722 PolarHBondContact O-N 3.04Å; K720-R723 PolarHBondContact O-N 3.06Å; K720-R723 VanDerWaalsContact O-N 3.13Å; K720-E724 WeakPolarHBondContact CE-OE1 3.47Å; K720-E724 WeakPolarHBondContact CE-OE2 3.36Å; K720-E724 HydrophobicContact CG-CG 4.32Å; K720-E724 WeakPolarHBondContact CG-OE1 3.42Å; K720-E724 WeakPolarHBondContact O-CB 3.3Å; K720-E724 PolarHBondContact O-N 2.61Å; K720-T728 VanDerWaalsContact CE-OG1 3.31Å; K720-T728 WeakPolarHBondContact CE-OG1 3.31Å; K720-T728 PolarHBondContact NZ-OG1 3.2Å
721	A	80.1	Confident	79.1	Confident	3 Å²	3	64.9 Å²	64.9	3%	0.025	32%	0.321	C	S	.	.	H	α-helix	trans	-64.3	-40	-179.9	0	0	0	0	0	113.1	I659 F716 D717 R723 G725 R726 I727	I659-A721 HydrophobicContact CG2-CB 3.96Å; F716-A721 HydrophobicContact CD2-CB 3.85Å; F716-A721 HydrophobicContact CE2-CB 4.25Å; D717-A721 WeakPolarHBondContact O-CB 3.27Å; D717-A721 PolarHBondContact O-N 2.85Å; A721-R723 VanDerWaalsContact C-N 3.29Å; A721-R723 PolarHBondContact O-N 3.11Å; A721-G725 VanDerWaalsContact O-CA 3.27Å; A721-G725 WeakPolarHBondContact O-CA 3.37Å; A721-G725 PolarHBondContact O-N 2.63Å; A721-R726 WeakPolarHBondContact CA-O 3.49Å; A721-I727 HydrophobicContact CB-CG1 4.3Å
722	K	80.6	Confident	78.3	Confident	50 Å²	50	61.7 Å²	61.7	22%	0.217	33%	0.328	C	S	.	.	H	α-helix	trans	-63.6	-32.5	173.3	-77.1	172.9	-166.9	167.4	0	112.9	R656 I659 I660 V663 A718 E719 K720	R656-K722 VanDerWaalsContact CD-O 3.23Å; R656-K722 WeakPolarHBondContact CD-O 3.25Å; R656-K722 VanDerWaalsContact CG-O 3.32Å; R656-K722 WeakPolarHBondContact CG-O 3.18Å; R656-K722 PolarHBondContact NE-O 2.93Å; I659-K722 HydrophobicContact CG2-CG 4.47Å; I660-K722 HydrophobicContact CG1-CG 4.13Å; V663-K722 VanDerWaalsContact CG1-CE 3.48Å; A718-K722 WeakPolarHBondContact O-CB 3.49Å; A718-K722 WeakPolarHBondContact O-CG 3.29Å; A718-K722 PolarHBondContact O-N 3.16Å; E719-K722 IonicContact OE1-NZ 3.85Å; E719-K722 PolarHBondContact OE1-NZ 2.84Å; K720-K722 PolarHBondContact O-N 3.04Å
723	R	76.9	Confident	77.5	Confident	193 Å²	193	67.1 Å²	67.1	73%	0.728	36%	0.356	S	S	*	.	H	α-helix	trans	-80.6	-46.2	-178.6	-171.5	-172.6	-46.5	-126.9	-3	112.1	E719 K720 A721	E719-R723 WeakPolarHBondContact O-CB 3.31Å; E719-R723 PolarHBondContact O-N 3.22Å; E719-R723 VanDerWaalsContact O-N 3.17Å; K720-R723 PolarHBondContact O-N 3.06Å; K720-R723 VanDerWaalsContact O-N 3.13Å; A721-R723 VanDerWaalsContact C-N 3.29Å; A721-R723 PolarHBondContact O-N 3.11Å
724	E	77.9	Confident	77.2	Confident	87 Å²	87	65.7 Å²	65.7	41%	0.407	35%	0.351	S	S	.	.	H	α-helix	trans	-83.5	-20.2	-176.7	-65	179.8	179.6	0	0	112.2	K720 R726 T728	K720-E724 WeakPolarHBondContact CE-OE1 3.47Å; K720-E724 WeakPolarHBondContact CE-OE2 3.36Å; K720-E724 HydrophobicContact CG-CG 4.32Å; K720-E724 WeakPolarHBondContact CG-OE1 3.42Å; K720-E724 WeakPolarHBondContact O-CB 3.3Å; K720-E724 PolarHBondContact O-N 2.61Å; E724-R726 PolarHBondContact O-N 3.08Å; E724-T728 WeakPolarHBondContact OE2-CG2 3.38Å
725	G	73.4	Confident	77.2	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	35%	0.346	C	S	.	.	S	Bend	trans	68.2	22.6	-174.6	0	0	0	0	0	113	S655 I659 A721	S655-G725 WeakPolarHBondContact CB-O 3.49Å; S655-G725 PolarHBondContact OG-O 3.19Å; I659-G725 VanDerWaalsContact CD1-C 3.45Å; A721-G725 VanDerWaalsContact O-CA 3.27Å; A721-G725 WeakPolarHBondContact O-CA 3.37Å; A721-G725 PolarHBondContact O-N 2.63Å
726	R	76.8	Confident	77.3	Confident	30 Å²	30	67 Å²	67	11%	0.113	35%	0.353	C	S	.	.	S	Bend	trans	-149.3	149.7	-179	-67.4	-64.5	-175	-93.7	2.6	110.3	E651 S655 A721 E724	E651-R726 VanDerWaalsContact CG-NH2 3.33Å; E651-R726 PolarHBondContact O-NH1 2.79Å; E651-R726 IonicContact OE1-NH2 2.62Å; E651-R726 PolarHBondContact OE1-NH2 2.8Å; E651-R726 IonicContact OE2-NH2 3.88Å; E651-R726 PolarHBondContact OE2-NH2 3.41Å; S655-R726 PolarHBondContact OG-NH1 3.25Å; A721-R726 WeakPolarHBondContact CA-O 3.49Å; E724-R726 PolarHBondContact O-N 3.08Å
727	I	77.4	Confident	77.5	Confident	6 Å²	6	67.2 Å²	67.2	3%	0.031	35%	0.353	C	S	.	.			trans	-92.9	101.9	173.5	-64.5	172.4	0	0	0	107.7	F716 A721 P729 L827 I830 I834	F716-I727 HydrophobicContact CB-CG1 4.45Å; F716-I727 HydrophobicContact CB-CG2 3.51Å; F716-I727 HydrophobicContact CD1-CD1 4.3Å; F716-I727 HydrophobicContact CD2-CD1 4.35Å; F716-I727 HydrophobicContact CD2-CG1 4.14Å; F716-I727 HydrophobicContact CG-CD1 4.2Å; F716-I727 HydrophobicContact CG-CG1 4.21Å; F716-I727 HydrophobicContact CG-CG2 4.12Å; A721-I727 HydrophobicContact CB-CG1 4.3Å; I727-P729 WeakPolarHBondContact O-CD 3.35Å; I727-L827 WeakPolarHBondContact O-CD2 3.48Å; I727-I830 HydrophobicContact CG2-CG2 4.35Å; I727-I834 HydrophobicContact CD1-CD1 3.6Å; I727-I834 HydrophobicContact CG2-CD1 4.01Å
728	T	75.6	Confident	77.8	Confident	30 Å²	30	64.3 Å²	64.3	18%	0.184	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-80.7	120.5	174.7	51.7	0	0	0	0	110	K720 E724	K720-T728 VanDerWaalsContact CE-OG1 3.31Å; K720-T728 WeakPolarHBondContact CE-OG1 3.31Å; K720-T728 PolarHBondContact NZ-OG1 3.2Å; E724-T728 WeakPolarHBondContact OE2-CG2 3.38Å
729	P	74	Confident	78.3	Confident	18 Å²	18	69 Å²	69	12%	0.117	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-68.4	153.8	171	30.8	-35	0	0	0	110.5	I727 I733 Y737 I830	I727-P729 WeakPolarHBondContact O-CD 3.35Å; P729-I733 HydrophobicContact CB-CB 4.14Å; P729-I733 HydrophobicContact CB-CG2 4.34Å; P729-Y737 HydrophobicContact CG-CD1 3.41Å; P729-Y737 VanDerWaalsContact CG-CD1 3.41Å; P729-Y737 HydrophobicContact CG-CD2 4.43Å; P729-Y737 HydrophobicContact CG-CE1 3.59Å; P729-Y737 HydrophobicContact CG-CG 3.85Å; P729-I830 HydrophobicContact CB-CD1 4.27Å; P729-I830 HydrophobicContact CG-CD1 3.82Å
730	E	74.9	Confident	78.6	Confident	129 Å²	129	63.9 Å²	63.9	60%	0.603	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-68.7	151.2	166.2	-69.3	-63.1	147.1	0	0	110.4	G732 I733	E730-G732 PolarHBondContact O-N 3.15Å; E730-I733 HydrophobicContact CB-CD1 3.79Å; E730-I733 HydrophobicContact CB-CG1 4.32Å; E730-I733 WeakPolarHBondContact O-CG1 3.43Å; E730-I733 PolarHBondContact O-N 3.43Å
731	P	71.9	Confident	79	Confident	108 Å²	108	63.6 Å²	63.6	70%	0.701	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	127.5	177.6	-22.9	32.9	0	0	0	111.7
732	G	70.8	Confident	79.5	Confident	64 Å²	64	67.2 Å²	67.2	66%	0.66	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.4	-7	178.6	0	0	0	0	0	115.5	E730 D738	E730-G732 PolarHBondContact O-N 3.15Å; G732-D738 WeakPolarHBondContact CA-OD2 3.09Å; G732-D738 PolarHBondContact N-OD2 3Å
733	I	69.7	Low	80.1	Confident	117 Å²	117	66.9 Å²	66.9	60%	0.6	36%	0.356	S	S	*	.	S	Bend	trans	-79.2	-43.4	179.6	-64.5	-179.2	0	0	0	111.4	P729 E730	P729-I733 HydrophobicContact CB-CB 4.14Å; P729-I733 HydrophobicContact CB-CG2 4.34Å; E730-I733 HydrophobicContact CB-CD1 3.79Å; E730-I733 HydrophobicContact CB-CG1 4.32Å; E730-I733 WeakPolarHBondContact O-CG1 3.43Å; E730-I733 PolarHBondContact O-N 3.43Å
734	D	77.8	Confident	80.7	Confident	31 Å²	31	59.1 Å²	59.1	17%	0.166	33%	0.329	C	S	.	.			trans	-122.7	108.7	-178.7	-173.7	-54.5	0	0	0	109.4	E736 Y737 D738 I830	D734-E736 VanDerWaalsContact C-N 3.29Å; D734-E736 PolarHBondContact O-N 3Å; D734-E736 WeakPolarHBondContact OD1-CA 3.49Å; D734-E736 WeakPolarHBondContact OD1-CB 3.47Å; D734-E736 PolarHBondContact OD1-N 2.83Å; D734-Y737 PolarHBondContact O-N 3.47Å; D734-Y737 PolarHBondContact OD1-N 2.86Å; D734-D738 PolarHBondContact O-N 3.45Å; D734-I830 HydrophobicContact CB-CD1 4.14Å
735	P	82.8	Confident	81.4	Confident	98 Å²	98	61.3 Å²	61.3	64%	0.636	34%	0.337	S	S	*	.	H	α-helix	trans	-66	-31.4	-175.7	26.2	-33.5	0	0	0	112.7	E739	P735-E739 VanDerWaalsContact O-CB 3.27Å; P735-E739 WeakPolarHBondContact O-CB 3.38Å; P735-E739 PolarHBondContact O-N 3.29Å
736	E	82.8	Confident	82.4	Confident	119 Å²	119	66.6 Å²	66.6	56%	0.556	36%	0.357	S	S	*	.	H	α-helix	trans	-71.6	-37.9	179.4	-62.6	-174.3	171.5	0	0	110.9	D734 S740	D734-E736 VanDerWaalsContact C-N 3.29Å; D734-E736 PolarHBondContact O-N 3Å; D734-E736 WeakPolarHBondContact OD1-CA 3.49Å; D734-E736 WeakPolarHBondContact OD1-CB 3.47Å; D734-E736 PolarHBondContact OD1-N 2.83Å; E736-S740 WeakPolarHBondContact O-CB 3.47Å; E736-S740 PolarHBondContact O-N 3.46Å; E736-S740 PolarHBondContact O-OG 3.5Å
737	Y	83.7	Confident	83.1	Confident	21 Å²	21	65.2 Å²	65.2	8%	0.082	35%	0.352	C	S	.	.	H	α-helix	trans	-66	-46.4	174.1	177.7	-101.9	0	0	0	111.8	P729 D734 E739 S740 L741 K823 L827	P729-Y737 HydrophobicContact CG-CD1 3.41Å; P729-Y737 VanDerWaalsContact CG-CD1 3.41Å; P729-Y737 HydrophobicContact CG-CD2 4.43Å; P729-Y737 HydrophobicContact CG-CE1 3.59Å; P729-Y737 HydrophobicContact CG-CG 3.85Å; D734-Y737 PolarHBondContact O-N 3.47Å; D734-Y737 PolarHBondContact OD1-N 2.86Å; Y737-E739 PolarHBondContact O-N 3.18Å; Y737-S740 PolarHBondContact O-N 3.49Å; Y737-L741 HydrophobicContact CD1-CD1 3.89Å; Y737-L741 HydrophobicContact CD1-CG 4.37Å; Y737-L741 HydrophobicContact CE1-CD1 3.28Å; Y737-L741 HydrophobicContact CE1-CG 4.01Å; Y737-L741 HydrophobicContact CE2-CD1 4.43Å; Y737-L741 HydrophobicContact CE2-CG 4.39Å; Y737-L741 WeakPolarHBondContact O-CG 3.36Å; Y737-L741 PolarHBondContact O-N 3.41Å; Y737-K823 HydrophobicContact CD2-CG 3.75Å; Y737-K823 HydrophobicContact CE2-CD 4.21Å; Y737-K823 HydrophobicContact CE2-CG 3.53Å; Y737-L827 HydrophobicContact CD2-CD2 4.08Å; Y737-L827 HydrophobicContact CD2-CG 4.14Å; Y737-L827 HydrophobicContact CE2-CD1 4.16Å; Y737-L827 HydrophobicContact CE2-CD2 3.66Å; Y737-L827 HydrophobicContact CE2-CG 3.86Å
738	D	86	Confident	83.7	Confident	35 Å²	35	67.2 Å²	67.2	19%	0.187	36%	0.364	C	S	.	.	H	α-helix	trans	-65.5	-38.6	179.7	-70	-31.6	0	0	0	112.6	G732 D734 L741 S742	G732-D738 WeakPolarHBondContact CA-OD2 3.09Å; G732-D738 PolarHBondContact N-OD2 3Å; D734-D738 PolarHBondContact O-N 3.45Å; D738-L741 PolarHBondContact O-N 3.32Å; D738-S742 WeakPolarHBondContact O-CB 3.45Å; D738-S742 PolarHBondContact O-N 2.66Å; D738-S742 PolarHBondContact O-OG 3.43Å
739	E	89.7	Confident	84.6	Confident	129 Å²	129	69.6 Å²	69.6	60%	0.603	37%	0.374	S	S	*	.	H	α-helix	trans	-61.3	-47.1	172.9	-177.1	174.3	-161.1	0	0	110.5	P735 Y737 L741 S742 E743	P735-E739 VanDerWaalsContact O-CB 3.27Å; P735-E739 WeakPolarHBondContact O-CB 3.38Å; P735-E739 PolarHBondContact O-N 3.29Å; Y737-E739 PolarHBondContact O-N 3.18Å; E739-L741 VanDerWaalsContact C-N 3.35Å; E739-L741 PolarHBondContact O-N 3.43Å; E739-S742 PolarHBondContact O-N 2.85Å; E739-E743 WeakPolarHBondContact O-CB 3.25Å; E739-E743 PolarHBondContact O-N 2.98Å
740	S	87.9	Confident	85.4	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-61.9	-40.9	178.3	-56.5	0	0	0	0	112	E736 Y737 E743 I744 R822	E736-S740 WeakPolarHBondContact O-CB 3.47Å; E736-S740 PolarHBondContact O-N 3.46Å; E736-S740 PolarHBondContact O-OG 3.5Å; Y737-S740 PolarHBondContact O-N 3.49Å; S740-E743 PolarHBondContact O-N 3.37Å; S740-I744 WeakPolarHBondContact O-CB 3.44Å; S740-I744 WeakPolarHBondContact O-CD1 3.42Å; S740-I744 WeakPolarHBondContact O-CG1 3.41Å; S740-I744 PolarHBondContact O-N 3Å; S740-R822 WeakPolarHBondContact OG-CD 3.42Å; S740-R822 WeakPolarHBondContact OG-CG 3.44Å
741	L	89	Confident	86.2	Confident	67 Å²	67	64.8 Å²	64.8	35%	0.351	35%	0.351	S	S	.	.	H	α-helix	trans	-65	-42	174.7	-75.6	-176.9	0	0	0	112.6	Y737 D738 E739 E743 I744 K745 K823	Y737-L741 HydrophobicContact CD1-CD1 3.89Å; Y737-L741 HydrophobicContact CD1-CG 4.37Å; Y737-L741 HydrophobicContact CE1-CD1 3.28Å; Y737-L741 HydrophobicContact CE1-CG 4.01Å; Y737-L741 HydrophobicContact CE2-CD1 4.43Å; Y737-L741 HydrophobicContact CE2-CG 4.39Å; Y737-L741 WeakPolarHBondContact O-CG 3.36Å; Y737-L741 PolarHBondContact O-N 3.41Å; D738-L741 PolarHBondContact O-N 3.32Å; E739-L741 VanDerWaalsContact C-N 3.35Å; E739-L741 PolarHBondContact O-N 3.43Å; L741-E743 VanDerWaalsContact C-N 3.33Å; L741-I744 PolarHBondContact O-N 3.49Å; L741-K745 WeakPolarHBondContact O-CB 3.49Å; L741-K745 PolarHBondContact O-N 3.36Å; L741-K823 HydrophobicContact CD2-CD 3.98Å; L741-K823 HydrophobicContact CD2-CG 4.45Å
742	S	90.4	Very high	87.1	Confident	80 Å²	80	63.9 Å²	63.9	56%	0.559	34%	0.34	S	S	*	.	H	α-helix	trans	-65.4	-39.4	178.3	-61.2	0	0	0	0	111.3	D738 E739 K745 R746	D738-S742 WeakPolarHBondContact O-CB 3.45Å; D738-S742 PolarHBondContact O-N 2.66Å; D738-S742 PolarHBondContact O-OG 3.43Å; E739-S742 PolarHBondContact O-N 2.85Å; S742-K745 PolarHBondContact O-N 2.94Å; S742-R746 WeakPolarHBondContact O-CB 3.36Å; S742-R746 PolarHBondContact O-N 3.46Å
743	E	91.8	Very high	88	Confident	43 Å²	43	67 Å²	67	20%	0.201	33%	0.332	C	S	.	.	H	α-helix	trans	-64.4	-49.4	174.5	-176.6	168	-140.9	0	0	111.7	E739 S740 L741 K745 R746 I747 A819 R822	E739-E743 WeakPolarHBondContact O-CB 3.25Å; E739-E743 PolarHBondContact O-N 2.98Å; S740-E743 PolarHBondContact O-N 3.37Å; L741-E743 VanDerWaalsContact C-N 3.33Å; E743-K745 VanDerWaalsContact C-N 3.29Å; E743-K745 PolarHBondContact O-N 3.44Å; E743-R746 WeakPolarHBondContact O-CB 3.38Å; E743-R746 PolarHBondContact O-N 3.27Å; E743-R746 IonicContact OE1-NH2 2.74Å; E743-I747 HydrophobicContact CG-CD1 3.88Å; E743-I747 WeakPolarHBondContact O-CD1 3.49Å; E743-I747 VanDerWaalsContact O-CG1 3.28Å; E743-I747 WeakPolarHBondContact O-CG1 3.48Å; E743-I747 PolarHBondContact O-N 2.9Å; E743-A819 HydrophobicContact CB-CB 4.46Å; E743-A819 HydrophobicContact CG-CB 4.07Å; E743-R822 IonicContact OE2-CZ 2.62Å; E743-R822 IonicContact OE2-NH1 3.49Å; E743-R822 PolarHBondContact OE2-NH1 3.24Å
744	I	90.7	Very high	89	Confident	30 Å²	30	62.5 Å²	62.5	15%	0.154	31%	0.308	C	S	.	.	H	α-helix	trans	-55.1	-46.8	174.8	-71.5	165.2	0	0	0	110.6	S740 L741 I747 V748 L816 A819 E820 K823	S740-I744 WeakPolarHBondContact O-CB 3.44Å; S740-I744 WeakPolarHBondContact O-CD1 3.42Å; S740-I744 WeakPolarHBondContact O-CG1 3.41Å; S740-I744 PolarHBondContact O-N 3Å; L741-I744 PolarHBondContact O-N 3.49Å; I744-I747 PolarHBondContact O-N 3.43Å; I744-V748 HydrophobicContact CG2-CG2 4.49Å; I744-V748 WeakPolarHBondContact O-CG2 3.26Å; I744-V748 PolarHBondContact O-N 3.2Å; I744-L816 HydrophobicContact CB-CD1 4.32Å; I744-L816 HydrophobicContact CG1-CD1 4.17Å; I744-L816 HydrophobicContact CG2-CD1 3.9Å; I744-A819 HydrophobicContact CD1-CB 4.44Å; I744-A819 HydrophobicContact CG1-CB 3.72Å; I744-E820 HydrophobicContact CD1-CG 4.25Å; I744-K823 HydrophobicContact CD1-CB 4.39Å; I744-K823 HydrophobicContact CD1-CD 4.08Å
745	K	92.6	Very high	89.7	Confident	132 Å²	132	62.1 Å²	62.1	57%	0.574	31%	0.306	S	S	*	.	H	α-helix	trans	-62.3	-45.3	179.4	-174.7	179.4	176.2	-175.8	0	111.8	L741 S742 E743 I747 V748 E749	L741-K745 WeakPolarHBondContact O-CB 3.49Å; L741-K745 PolarHBondContact O-N 3.36Å; S742-K745 PolarHBondContact O-N 2.94Å; E743-K745 VanDerWaalsContact C-N 3.29Å; E743-K745 PolarHBondContact O-N 3.44Å; K745-I747 VanDerWaalsContact C-N 3.35Å; K745-I747 PolarHBondContact O-N 3.16Å; K745-V748 PolarHBondContact O-N 3.46Å; K745-E749 WeakPolarHBondContact CE-OE1 2.9Å; K745-E749 WeakPolarHBondContact O-CG 3.28Å; K745-E749 PolarHBondContact O-N 2.99Å
746	R	94.4	Very high	90.1	Very high	112 Å²	112	62.1 Å²	62.1	42%	0.423	30%	0.3	S	S	.	.	H	α-helix	trans	-57.1	-47.6	176.6	179.6	-178.2	65.7	96.9	-1.9	111.3	S742 E743 E749 D750 E815	S742-R746 WeakPolarHBondContact O-CB 3.36Å; S742-R746 PolarHBondContact O-N 3.46Å; E743-R746 WeakPolarHBondContact O-CB 3.38Å; E743-R746 PolarHBondContact O-N 3.27Å; E743-R746 IonicContact OE1-NH2 2.74Å; R746-E749 PolarHBondContact O-N 3.05Å; R746-D750 PolarHBondContact O-N 2.81Å; R746-E815 IonicContact CZ-OE1 3.39Å; R746-E815 IonicContact NH1-OE1 2.69Å; R746-E815 IonicContact NH2-OE1 3.59Å; R746-E815 PolarHBondContact NH2-OE1 3.1Å
747	I	91.7	Very high	90.4	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-63.1	-47.4	-179.4	-64	161.5	0	0	0	110.5	E743 I744 K745 E749 D750 M751 W812 E815 L816	E743-I747 HydrophobicContact CG-CD1 3.88Å; E743-I747 WeakPolarHBondContact O-CD1 3.49Å; E743-I747 VanDerWaalsContact O-CG1 3.28Å; E743-I747 WeakPolarHBondContact O-CG1 3.48Å; E743-I747 PolarHBondContact O-N 2.9Å; I744-I747 PolarHBondContact O-N 3.43Å; K745-I747 VanDerWaalsContact C-N 3.35Å; K745-I747 PolarHBondContact O-N 3.16Å; I747-E749 VanDerWaalsContact C-N 3.31Å; I747-E749 PolarHBondContact O-N 2.64Å; I747-D750 PolarHBondContact O-N 3.01Å; I747-M751 HydrophobicContact CG2-CG 4.38Å; I747-M751 HydrophobicContact CG2-SD 4.13Å; I747-M751 VanDerWaalsContact O-CG 3.26Å; I747-M751 WeakPolarHBondContact O-CG 3.35Å; I747-M751 PolarHBondContact O-N 3.25Å; I747-W812 HydrophobicContact CG2-CB 4Å; I747-W812 HydrophobicContact CG2-CG 4.26Å; I747-E815 HydrophobicContact CD1-CB 3.96Å; I747-E815 HydrophobicContact CD1-CG 3.64Å; I747-E815 HydrophobicContact CG1-CG 4.34Å; I747-L816 HydrophobicContact CG2-CB 4.16Å; I747-L816 HydrophobicContact CG2-CD1 4.46Å
748	V	90.4	Very high	90.7	Very high	49 Å²	49	64 Å²	64	30%	0.297	31%	0.306	S	S	.	.	H	α-helix	trans	-60	-41.7	178.1	172.5	0	0	0	0	111.3	I744 K745 M751 D752 L816	I744-V748 HydrophobicContact CG2-CG2 4.49Å; I744-V748 WeakPolarHBondContact O-CG2 3.26Å; I744-V748 PolarHBondContact O-N 3.2Å; K745-V748 PolarHBondContact O-N 3.46Å; V748-M751 PolarHBondContact O-N 2.9Å; V748-D752 PolarHBondContact O-N 2.85Å; V748-L816 HydrophobicContact CG2-CD1 4.47Å
749	E	92.7	Very high	90.8	Very high	80 Å²	80	63.3 Å²	63.3	37%	0.374	30%	0.303	S	S	.	.	H	α-helix	trans	-65.7	-38.4	176.2	-72.5	178.6	-171	0	0	113	K745 R746 I747 D752 R753	K745-E749 WeakPolarHBondContact CE-OE1 2.9Å; K745-E749 WeakPolarHBondContact O-CG 3.28Å; K745-E749 PolarHBondContact O-N 2.99Å; R746-E749 PolarHBondContact O-N 3.05Å; I747-E749 VanDerWaalsContact C-N 3.31Å; I747-E749 PolarHBondContact O-N 2.64Å; E749-D752 PolarHBondContact O-N 3.42Å; E749-R753 WeakPolarHBondContact O-CB 3.2Å; E749-R753 VanDerWaalsContact O-CG 3.32Å; E749-R753 WeakPolarHBondContact O-CG 3.29Å; E749-R753 PolarHBondContact O-N 3Å; E749-R753 IonicContact OE2-NH1 3.83Å
750	D	92.2	Very high	90.7	Very high	44 Å²	44	64.7 Å²	64.7	24%	0.235	31%	0.307	C	S	.	.	H	α-helix	trans	-63.7	-42.2	173.8	-83.2	-37.8	0	0	0	111.8	R746 I747 R753 F754 W812	R746-D750 PolarHBondContact O-N 2.81Å; I747-D750 PolarHBondContact O-N 3.01Å; D750-R753 VanDerWaalsContact CG-NH2 3.33Å; D750-R753 PolarHBondContact O-N 2.79Å; D750-R753 IonicContact OD1-CZ 3.51Å; D750-R753 IonicContact OD1-NE 3.01Å; D750-R753 PolarHBondContact OD1-NE 3.24Å; D750-R753 IonicContact OD1-NH2 3.83Å; D750-R753 PolarHBondContact OD1-NH2 3.07Å; D750-R753 IonicContact OD2-NH2 3.8Å; D750-F754 WeakPolarHBondContact O-CB 3.2Å; D750-F754 PolarHBondContact O-N 3.23Å; D750-W812 HydrophobicContact CB-CZ2 4.29Å
751	M	90.4	Very high	90.6	Very high	1 Å²	1	68 Å²	68	1%	0.005	33%	0.328	C	S	.	.	H	α-helix	trans	-63.6	-43.8	174.6	-66.8	-176.1	87.3	0	0	111.6	I747 V748 R753 F754 L755 Y768 Y776 W812	I747-M751 HydrophobicContact CG2-CG 4.38Å; I747-M751 HydrophobicContact CG2-SD 4.13Å; I747-M751 VanDerWaalsContact O-CG 3.26Å; I747-M751 WeakPolarHBondContact O-CG 3.35Å; I747-M751 PolarHBondContact O-N 3.25Å; V748-M751 PolarHBondContact O-N 2.9Å; M751-R753 PolarHBondContact O-N 2.68Å; M751-F754 WeakPolarHBondContact O-CB 3.12Å; M751-F754 PolarHBondContact O-N 3.22Å; M751-L755 WeakPolarHBondContact O-CB 3.47Å; M751-L755 PolarHBondContact O-N 3.33Å; M751-Y768 HydrophobicContact CB-CE2 4.06Å; M751-Y768 HydrophobicContact CE-CE1 4.34Å; M751-Y768 PolarHBondContact O-OH 3.18Å; M751-Y776 HydrophobicContact CE-CD1 3.29Å; M751-Y776 HydrophobicContact CE-CD2 3.92Å; M751-Y776 HydrophobicContact CE-CE1 3.97Å; M751-Y776 HydrophobicContact CE-CG 3.26Å; M751-Y776 HydrophobicContact SD-CD1 3.92Å; M751-Y776 HydrophobicContact SD-CD2 4.49Å; M751-Y776 HydrophobicContact SD-CE1 3.97Å; M751-Y776 HydrophobicContact SD-CG 4.19Å; M751-W812 HydrophobicContact CE-CB 4.2Å; M751-W812 HydrophobicContact CG-CB 3.98Å; M751-W812 HydrophobicContact CG-CD2 3.88Å; M751-W812 HydrophobicContact CG-CE3 3.8Å; M751-W812 HydrophobicContact CG-CG 3.98Å; M751-W812 HydrophobicContact SD-CB 3.93Å
752	D	91	Very high	90.5	Very high	89 Å²	89	65.1 Å²	65.1	48%	0.476	31%	0.312	S	S	.	.	H	α-helix	trans	-64.4	-40.7	176.9	-78.6	-21.5	0	0	0	112	V748 E749 F754 L755 L756	V748-D752 PolarHBondContact O-N 2.85Å; E749-D752 PolarHBondContact O-N 3.42Å; D752-F754 VanDerWaalsContact C-N 3.31Å; D752-F754 PolarHBondContact O-N 3.17Å; D752-L755 PolarHBondContact O-N 3.36Å; D752-L756 VanDerWaalsContact O-CB 3.26Å; D752-L756 WeakPolarHBondContact O-CB 3.48Å; D752-L756 PolarHBondContact O-N 3.17Å
753	R	91.1	Very high	90.2	Very high	131 Å²	131	64.7 Å²	64.7	49%	0.494	32%	0.321	S	S	.	.	H	α-helix	trans	-59.7	-42.1	172.5	-77.8	-172.3	-73.8	-94.2	10.8	111.4	E749 D750 M751 K757	E749-R753 WeakPolarHBondContact O-CB 3.2Å; E749-R753 VanDerWaalsContact O-CG 3.32Å; E749-R753 WeakPolarHBondContact O-CG 3.29Å; E749-R753 PolarHBondContact O-N 3Å; E749-R753 IonicContact OE2-NH1 3.83Å; D750-R753 VanDerWaalsContact CG-NH2 3.33Å; D750-R753 PolarHBondContact O-N 2.79Å; D750-R753 IonicContact OD1-CZ 3.51Å; D750-R753 IonicContact OD1-NE 3.01Å; D750-R753 PolarHBondContact OD1-NE 3.24Å; D750-R753 IonicContact OD1-NH2 3.83Å; D750-R753 PolarHBondContact OD1-NH2 3.07Å; D750-R753 IonicContact OD2-NH2 3.8Å; M751-R753 PolarHBondContact O-N 2.68Å; R753-K757 WeakPolarHBondContact O-CB 3.15Å; R753-K757 PolarHBondContact O-N 2.91Å
754	F	90.8	Very high	89.9	Confident	21 Å²	21	65 Å²	65	9%	0.092	33%	0.326	C	S	.	.	H	α-helix	trans	-65.2	-48.1	176.9	-178.2	-92.1	0	0	0	112	D750 M751 D752 L756 K757 W758 I778 W792 E808 T809 W812	D750-F754 WeakPolarHBondContact O-CB 3.2Å; D750-F754 PolarHBondContact O-N 3.23Å; M751-F754 WeakPolarHBondContact O-CB 3.12Å; M751-F754 PolarHBondContact O-N 3.22Å; D752-F754 VanDerWaalsContact C-N 3.31Å; D752-F754 PolarHBondContact O-N 3.17Å; F754-L756 VanDerWaalsContact C-N 3.29Å; F754-L756 PolarHBondContact O-N 3.38Å; F754-K757 WeakPolarHBondContact O-CB 3.41Å; F754-K757 PolarHBondContact O-N 3.49Å; F754-W758 AromaticContact CD1-CD1 3.71Å; F754-W758 AromaticContact CD2-NE1 3.84Å; F754-W758 AromaticContact CE1-CD1 3.42Å; F754-W758 VanDerWaalsContact CE1-CD1 3.42Å; F754-W758 AromaticContact CE1-NE1 3.58Å; F754-W758 AromaticContact CE2-CD1 3.78Å; F754-W758 AromaticContact CE2-NE1 3.23Å; F754-W758 AromaticContact CZ-CD1 3.48Å; F754-W758 VanDerWaalsContact CZ-CD1 3.48Å; F754-W758 AromaticContact CZ-NE1 3.09Å; F754-W758 VanDerWaalsContact O-CD1 3.27Å; F754-W758 PolarHBondContact O-N 3.49Å; F754-W758 VanDerWaalsContact O-N 3.07Å; F754-I778 HydrophobicContact CE1-CD1 3.82Å; F754-W792 HydrophobicContact CE1-CH2 4.48Å; F754-W792 HydrophobicContact CE1-CZ2 4.11Å; F754-W792 AromaticContact CZ-CZ2 3.9Å; F754-W792 HydrophobicContact CZ-CZ2 3.9Å; F754-E808 HydrophobicContact CE2-CB 4.29Å; F754-E808 HydrophobicContact CE2-CG 4.3Å; F754-T809 HydrophobicContact CE1-CG2 4.4Å; F754-W812 HydrophobicContact CB-CH2 3.68Å; F754-W812 HydrophobicContact CB-CZ3 3.77Å; F754-W812 HydrophobicContact CD1-CZ3 4.01Å; F754-W812 AromaticContact CD2-CH2 3.62Å; F754-W812 HydrophobicContact CD2-CH2 3.62Å; F754-W812 AromaticContact CD2-CZ3 3.82Å; F754-W812 HydrophobicContact CD2-CZ3 3.82Å; F754-W812 HydrophobicContact CE2-CH2 4.33Å; F754-W812 HydrophobicContact CE2-CZ3 4.34Å; F754-W812 AromaticContact CG-CH2 3.73Å; F754-W812 HydrophobicContact CG-CH2 3.73Å; F754-W812 AromaticContact CG-CZ3 3.61Å; F754-W812 HydrophobicContact CG-CZ3 3.61Å
755	L	90.9	Very high	89.7	Confident	24 Å²	24	74.5 Å²	74.5	13%	0.126	36%	0.36	C	S	.	.	H	α-helix	trans	-60.7	-40.8	177.6	-167.8	71.3	0	0	0	111.1	M751 D752 W758 S759 L766 Y768 I778	M751-L755 WeakPolarHBondContact O-CB 3.47Å; M751-L755 PolarHBondContact O-N 3.33Å; D752-L755 PolarHBondContact O-N 3.36Å; L755-W758 PolarHBondContact O-N 2.88Å; L755-S759 VanDerWaalsContact O-CB 3.32Å; L755-S759 WeakPolarHBondContact O-CB 3.22Å; L755-S759 PolarHBondContact O-N 3.2Å; L755-S759 PolarHBondContact O-OG 3Å; L755-L766 HydrophobicContact CD1-CB 3.62Å; L755-L766 HydrophobicContact CG-CB 4.21Å; L755-Y768 HydrophobicContact CB-CE2 3.77Å; L755-Y768 HydrophobicContact CD1-CD1 4.41Å; L755-Y768 HydrophobicContact CD1-CD2 4.34Å; L755-Y768 HydrophobicContact CD1-CE1 4.18Å; L755-Y768 HydrophobicContact CD1-CE2 4.07Å; L755-Y768 HydrophobicContact CD1-CG 4.5Å; L755-Y768 HydrophobicContact CD2-CD2 3.76Å; L755-Y768 HydrophobicContact CD2-CE2 3.78Å; L755-Y768 HydrophobicContact CD2-CG 4.46Å; L755-Y768 HydrophobicContact CG-CD2 4.45Å; L755-Y768 HydrophobicContact CG-CE2 4.08Å; L755-I778 HydrophobicContact CD1-CG2 4.34Å
756	L	91.1	Very high	89.5	Confident	97 Å²	97	68.5 Å²	68.5	51%	0.508	33%	0.334	S	S	.	.	H	α-helix	trans	-64.8	-43.4	177	-171.1	67.1	0	0	0	111.7	D752 F754 W758 S759 K760	D752-L756 VanDerWaalsContact O-CB 3.26Å; D752-L756 WeakPolarHBondContact O-CB 3.48Å; D752-L756 PolarHBondContact O-N 3.17Å; F754-L756 VanDerWaalsContact C-N 3.29Å; F754-L756 PolarHBondContact O-N 3.38Å; L756-W758 PolarHBondContact O-N 3.22Å; L756-S759 WeakPolarHBondContact CA-OG 2.84Å; L756-S759 PolarHBondContact O-N 3.39Å; L756-S759 PolarHBondContact O-OG 3.42Å; L756-K760 WeakPolarHBondContact O-CG 3.42Å; L756-K760 PolarHBondContact O-N 2.72Å
757	K	90.5	Very high	89.2	Confident	136 Å²	136	65.3 Å²	65.3	59%	0.591	33%	0.331	S	S	*	.	H	α-helix	trans	-56	-49	175	178.6	-175.9	177	-176.7	0	111.1	R753 F754 K760 T761	R753-K757 WeakPolarHBondContact O-CB 3.15Å; R753-K757 PolarHBondContact O-N 2.91Å; F754-K757 WeakPolarHBondContact O-CB 3.41Å; F754-K757 PolarHBondContact O-N 3.49Å; K757-K760 PolarHBondContact O-N 3.36Å; K757-T761 PolarHBondContact O-N 2.85Å; K757-T761 PolarHBondContact O-OG1 3.36Å; K757-T761 VanDerWaalsContact O-OG1 3.13Å
758	W	88.9	Confident	89.2	Confident	45 Å²	45	67.6 Å²	67.6	17%	0.17	34%	0.341	C	S	.	.	H	α-helix	trans	-72.4	-35.7	-179.5	-74.3	105.5	0	0	0	113	F754 L755 L756 K760 T761 F762 L766 P789 W792	F754-W758 AromaticContact CD1-CD1 3.71Å; F754-W758 AromaticContact CD2-NE1 3.84Å; F754-W758 AromaticContact CE1-CD1 3.42Å; F754-W758 VanDerWaalsContact CE1-CD1 3.42Å; F754-W758 AromaticContact CE1-NE1 3.58Å; F754-W758 AromaticContact CE2-CD1 3.78Å; F754-W758 AromaticContact CE2-NE1 3.23Å; F754-W758 AromaticContact CZ-CD1 3.48Å; F754-W758 VanDerWaalsContact CZ-CD1 3.48Å; F754-W758 AromaticContact CZ-NE1 3.09Å; F754-W758 VanDerWaalsContact O-CD1 3.27Å; F754-W758 PolarHBondContact O-N 3.49Å; F754-W758 VanDerWaalsContact O-N 3.07Å; L755-W758 PolarHBondContact O-N 2.88Å; L756-W758 PolarHBondContact O-N 3.22Å; W758-K760 PolarHBondContact O-N 3.37Å; W758-T761 HydrophobicContact CE3-CG2 4.24Å; W758-T761 HydrophobicContact CZ3-CG2 4.25Å; W758-T761 WeakPolarHBondContact O-CB 3.47Å; W758-T761 PolarHBondContact O-N 3.32Å; W758-F762 HydrophobicContact CB-CD2 4.33Å; W758-F762 HydrophobicContact CB-CE2 4.38Å; W758-F762 HydrophobicContact CD2-CE2 4.4Å; W758-F762 HydrophobicContact CE3-CD2 4.2Å; W758-F762 AromaticContact CE3-CE2 3.6Å; W758-F762 HydrophobicContact CE3-CE2 3.6Å; W758-F762 HydrophobicContact CE3-CZ 4.39Å; W758-F762 HydrophobicContact CZ3-CE2 4.3Å; W758-F762 VanDerWaalsContact O-CD2 3.26Å; W758-F762 WeakPolarHBondContact O-CD2 3.41Å; W758-F762 PolarHBondContact O-N 2.95Å; W758-L766 HydrophobicContact CB-CD1 3.66Å; W758-P789 HydrophobicContact CH2-CG 3.31Å; W758-P789 HydrophobicContact CZ2-CG 4.15Å; W758-P789 HydrophobicContact CZ3-CG 3.67Å; W758-W792 HydrophobicContact CB-CH2 4.41Å; W758-W792 AromaticContact CD1-CZ2 3.96Å; W758-W792 AromaticContact CD2-CH2 3.84Å; W758-W792 HydrophobicContact CD2-CH2 3.84Å; W758-W792 AromaticContact CD2-CZ2 3.75Å; W758-W792 HydrophobicContact CD2-CZ2 3.75Å; W758-W792 AromaticContact CE2-CZ2 3.49Å; W758-W792 VanDerWaalsContact CE2-CZ2 3.49Å; W758-W792 HydrophobicContact CE3-CH2 4.29Å; W758-W792 HydrophobicContact CE3-CZ2 4.32Å; W758-W792 AromaticContact CG-CH2 3.87Å; W758-W792 HydrophobicContact CG-CH2 3.87Å; W758-W792 HydrophobicContact CG-CZ2 4.05Å; W758-W792 HydrophobicContact CH2-CZ2 4.43Å; W758-W792 AromaticContact CZ2-CZ2 3.87Å; W758-W792 HydrophobicContact CZ2-CZ2 3.87Å; W758-W792 AromaticContact NE1-CZ2 3.63Å
759	S	88.4	Confident	89.1	Confident	20 Å²	20	70 Å²	70	14%	0.14	34%	0.344	C	S	.	.	H	α-helix	trans	-56.9	-38.4	174.8	74.1	0	0	0	0	112.3	L755 L756 G763 T764	L755-S759 VanDerWaalsContact O-CB 3.32Å; L755-S759 WeakPolarHBondContact O-CB 3.22Å; L755-S759 PolarHBondContact O-N 3.2Å; L755-S759 PolarHBondContact O-OG 3Å; L756-S759 WeakPolarHBondContact CA-OG 2.84Å; L756-S759 PolarHBondContact O-N 3.39Å; L756-S759 PolarHBondContact O-OG 3.42Å; S759-G763 PolarHBondContact O-N 3.49Å; S759-T764 CarbonylContact C-O 3.55Å; S759-T764 VanDerWaalsContact CA-O 3.22Å; S759-T764 WeakPolarHBondContact CA-O 3.35Å; S759-T764 VanDerWaalsContact CB-O 3.3Å; S759-T764 WeakPolarHBondContact CB-O 3.35Å; S759-T764 PolarHBondContact O-N 2.88Å
760	K	88.5	Confident	88.6	Confident	157 Å²	157	67.3 Å²	67.3	68%	0.683	34%	0.338	S	S	*	.	H	α-helix	trans	-66.2	-43.3	173.5	-68.7	176	-179	178.9	0	112	L756 K757 W758 G763	L756-K760 WeakPolarHBondContact O-CG 3.42Å; L756-K760 PolarHBondContact O-N 2.72Å; K757-K760 PolarHBondContact O-N 3.36Å; W758-K760 PolarHBondContact O-N 3.37Å; K760-G763 PolarHBondContact O-N 3.47Å
761	T	86	Confident	87.9	Confident	70 Å²	70	70.9 Å²	70.9	43%	0.429	36%	0.362	S	S	.	.	H	α-helix	trans	-63.1	-43.6	179.5	-53.9	0	0	0	0	112.7	K757 W758 G763 R787	K757-T761 PolarHBondContact O-N 2.85Å; K757-T761 PolarHBondContact O-OG1 3.36Å; K757-T761 VanDerWaalsContact O-OG1 3.13Å; W758-T761 HydrophobicContact CE3-CG2 4.24Å; W758-T761 HydrophobicContact CZ3-CG2 4.25Å; W758-T761 WeakPolarHBondContact O-CB 3.47Å; W758-T761 PolarHBondContact O-N 3.32Å; T761-G763 VanDerWaalsContact C-N 3.33Å; T761-R787 PolarHBondContact O-NH1 3.12Å; T761-R787 PolarHBondContact O-NH2 3.29Å
762	F	86.5	Confident	87	Confident	6 Å²	6	73.1 Å²	73.1	3%	0.026	39%	0.385	C	S	.	.	H	α-helix	trans	-78.4	-18	179	-74.4	-78.5	0	0	0	113	W758 T764 L766 I780 L784 R787 V788 W792	W758-F762 HydrophobicContact CB-CD2 4.33Å; W758-F762 HydrophobicContact CB-CE2 4.38Å; W758-F762 HydrophobicContact CD2-CE2 4.4Å; W758-F762 HydrophobicContact CE3-CD2 4.2Å; W758-F762 AromaticContact CE3-CE2 3.6Å; W758-F762 HydrophobicContact CE3-CE2 3.6Å; W758-F762 HydrophobicContact CE3-CZ 4.39Å; W758-F762 HydrophobicContact CZ3-CE2 4.3Å; W758-F762 VanDerWaalsContact O-CD2 3.26Å; W758-F762 WeakPolarHBondContact O-CD2 3.41Å; W758-F762 PolarHBondContact O-N 2.95Å; F762-T764 VanDerWaalsContact C-N 3.27Å; F762-T764 HydrophobicContact CB-CG2 4.06Å; F762-L766 HydrophobicContact CD2-CD1 3.82Å; F762-L766 HydrophobicContact CD2-CD2 4.5Å; F762-L766 HydrophobicContact CE2-CD1 4.26Å; F762-I780 HydrophobicContact CE1-CG2 4.32Å; F762-I780 HydrophobicContact CE2-CD1 4.49Å; F762-I780 HydrophobicContact CZ-CD1 4.14Å; F762-L784 HydrophobicContact CB-CD1 4.35Å; F762-L784 HydrophobicContact CD1-CB 4.13Å; F762-R787 HydrophobicContact CD1-CB 4.12Å; F762-R787 HydrophobicContact CE1-CB 3.77Å; F762-R787 PolarHBondContact O-NH1 3.25Å; F762-V788 HydrophobicContact CE1-CG2 4.09Å; F762-V788 HydrophobicContact CZ-CG2 4.03Å; F762-W792 HydrophobicContact CE2-CH2 4.43Å; F762-W792 HydrophobicContact CE2-CZ3 4.44Å
763	G	82.8	Confident	86.1	Confident	72 Å²	72	75 Å²	75	74%	0.742	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.4	18.2	-176.4	0	0	0	0	0	113.4	S759 K760 T761	S759-G763 PolarHBondContact O-N 3.49Å; K760-G763 PolarHBondContact O-N 3.47Å; T761-G763 VanDerWaalsContact C-N 3.33Å
764	T	85.8	Confident	85.5	Confident	50 Å²	50	73 Å²	73	31%	0.307	39%	0.385	S	S	.	.	S	Bend	trans	-140.1	152.2	178.8	-172.3	0	0	0	0	109.9	S759 F762 L766 P781 L784	S759-T764 CarbonylContact C-O 3.55Å; S759-T764 VanDerWaalsContact CA-O 3.22Å; S759-T764 WeakPolarHBondContact CA-O 3.35Å; S759-T764 VanDerWaalsContact CB-O 3.3Å; S759-T764 WeakPolarHBondContact CB-O 3.35Å; S759-T764 PolarHBondContact O-N 2.88Å; F762-T764 VanDerWaalsContact C-N 3.27Å; F762-T764 HydrophobicContact CB-CG2 4.06Å; T764-L766 HydrophobicContact CG2-CD2 4.02Å; T764-L766 PolarHBondContact O-N 3.42Å; T764-P781 HydrophobicContact CG2-CG 4.25Å; T764-L784 HydrophobicContact CG2-CD1 3.46Å; T764-L784 VanDerWaalsContact CG2-CD1 3.46Å
765	R	86.4	Confident	85.1	Confident	228 Å²	228	75 Å²	75	86%	0.86	39%	0.392	S	S	*	.			trans	-65.5	123.1	170.4	-171.7	176.6	-179.2	-180	0.6	108.9
766	L	88.9	Confident	85	Confident	6 Å²	6	76.5 Å²	76.5	3%	0.031	40%	0.396	C	S	.	.			trans	-94.9	156	170.6	-60.6	178.8	0	0	0	109.3	L755 W758 F762 T764 I778 E779 I780	L755-L766 HydrophobicContact CD1-CB 3.62Å; L755-L766 HydrophobicContact CG-CB 4.21Å; W758-L766 HydrophobicContact CB-CD1 3.66Å; F762-L766 HydrophobicContact CD2-CD1 3.82Å; F762-L766 HydrophobicContact CD2-CD2 4.5Å; F762-L766 HydrophobicContact CE2-CD1 4.26Å; T764-L766 HydrophobicContact CG2-CD2 4.02Å; T764-L766 PolarHBondContact O-N 3.42Å; L766-I778 HydrophobicContact CB-CG2 4.35Å; L766-I778 HydrophobicContact CD1-CG2 4.04Å; L766-E779 WeakPolarHBondContact CD2-O 3.47Å; L766-I780 HydrophobicContact CD2-CG1 4.2Å
767	A	89	Confident	84.9	Confident	45 Å²	45	72.3 Å²	72.3	37%	0.372	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	147.6	176.2	0	0	0	0	0	110.1	E779	A767-E779 PolarHBondContact O-N 3.44Å
768	Y	91.3	Very high	85	Confident	49 Å²	49	65.9 Å²	65.9	19%	0.192	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	142.7	166	-72.6	-57.9	0	0	0	110.2	M751 L755 Y776 Q777 I778 T809	M751-Y768 HydrophobicContact CB-CE2 4.06Å; M751-Y768 HydrophobicContact CE-CE1 4.34Å; M751-Y768 PolarHBondContact O-OH 3.18Å; L755-Y768 HydrophobicContact CB-CE2 3.77Å; L755-Y768 HydrophobicContact CD1-CD1 4.41Å; L755-Y768 HydrophobicContact CD1-CD2 4.34Å; L755-Y768 HydrophobicContact CD1-CE1 4.18Å; L755-Y768 HydrophobicContact CD1-CE2 4.07Å; L755-Y768 HydrophobicContact CD1-CG 4.5Å; L755-Y768 HydrophobicContact CD2-CD2 3.76Å; L755-Y768 HydrophobicContact CD2-CE2 3.78Å; L755-Y768 HydrophobicContact CD2-CG 4.46Å; L755-Y768 HydrophobicContact CG-CD2 4.45Å; L755-Y768 HydrophobicContact CG-CE2 4.08Å; Y768-Y776 HydrophobicContact CD1-CD1 4.08Å; Y768-Y776 HydrophobicContact CD1-CG 4.47Å; Y768-Y776 VanDerWaalsContact CD1-O 3.31Å; Y768-Y776 WeakPolarHBondContact CD1-O 3.45Å; Y768-Y776 AromaticContact CD2-CD1 3.83Å; Y768-Y776 HydrophobicContact CD2-CD1 3.83Å; Y768-Y776 HydrophobicContact CD2-CE1 4.45Å; Y768-Y776 HydrophobicContact CE2-CD1 4.3Å; Y768-Y776 AromaticContact CG-CD1 3.71Å; Y768-Y776 HydrophobicContact CG-CD1 3.71Å; Y768-Y776 HydrophobicContact CG-CG 4.47Å; Y768-Q777 CarbonylContact C-O 3.59Å; Y768-Q777 WeakPolarHBondContact CA-O 3.29Å; Y768-I778 HydrophobicContact CD1-CG1 4.06Å; Y768-I778 HydrophobicContact CE1-CD1 4.4Å; Y768-I778 HydrophobicContact CE1-CG1 3.76Å; Y768-T809 HydrophobicContact CE1-CG2 4.17Å
769	W	88.1	Confident	85.1	Confident	98 Å²	98	66 Å²	66	37%	0.371	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	151.7	179.1	-178.6	90.7	0	0	0	111.7	Y776 Q777 E779 R803	W769-Y776 PolarHBondContact O-N 3.36Å; W769-Q777 HydrophobicContact CE3-CB 4.49Å; W769-Q777 PolarHBondContact N-O 3.04Å; W769-Q777 PolarHBondContact O-N 3.12Å; W769-E779 HydrophobicContact CB-CG 3.57Å; W769-E779 HydrophobicContact CG-CG 4.19Å; W769-R803 VanDerWaalsContact CD2-CZ 3.43Å; W769-R803 VanDerWaalsContact CD2-NE 3.34Å; W769-R803 VanDerWaalsContact CH2-NH1 3.35Å
770	G	81	Confident	85.2	Confident	24 Å²	24	65.1 Å²	65.1	25%	0.247	34%	0.342	C	S	.	.			trans	110	170	166.5	0	0	0	0	0	114.5	N774	G770-N774 VanDerWaalsContact CA-O 3.28Å; G770-N774 WeakPolarHBondContact CA-O 3.39Å
771	T	78	Confident	85.3	Confident	120 Å²	120	59.3 Å²	59.3	74%	0.736	32%	0.321	S	S	*	.	S	Bend	trans	-135.2	153.2	-174.6	52.9	0	0	0	0	110.2	R773 N774	T771-R773 PolarHBondContact O-N 3.28Å; T771-N774 PolarHBondContact O-N 2.74Å
772	G	72.9	Confident	85.5	Confident	48 Å²	48	60.4 Å²	60.4	50%	0.495	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	60.3	-120.9	-177.4	0	0	0	0	0	113	N774 R775	G772-N774 VanDerWaalsContact C-N 3.29Å; G772-N774 PolarHBondContact O-N 2.78Å; G772-R775 VanDerWaalsContact O-CG 3.23Å; G772-R775 WeakPolarHBondContact O-CG 3.19Å; G772-R775 PolarHBondContact O-NE 3Å
773	R	70.4	Confident	85.4	Confident	128 Å²	128	65 Å²	65	48%	0.483	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-72.6	-18.9	179.1	-65.7	-172.1	-176.1	158.5	7.2	114.4	I259 D260 T771	I259-R773 VanDerWaalsContact CG2-NH2 3.34Å; D260-R773 VanDerWaalsContact CG-CZ 3.47Å; D260-R773 IonicContact OD1-CZ 3.9Å; D260-R773 IonicContact OD1-NE 2.76Å; D260-R773 PolarHBondContact OD1-NE 3.33Å; D260-R773 IonicContact OD1-NH1 3.36Å; D260-R773 IonicContact OD1-NH2 3.09Å; D260-R773 PolarHBondContact OD1-NH2 3.12Å; D260-R773 IonicContact OD2-CZ 3.4Å; D260-R773 IonicContact OD2-NE 2.91Å; D260-R773 PolarHBondContact OD2-NE 3.02Å; D260-R773 IonicContact OD2-NH2 2.73Å; D260-R773 PolarHBondContact OD2-NH2 2.72Å; T771-R773 PolarHBondContact O-N 3.28Å
774	N	79.4	Confident	85.6	Confident	89 Å²	89	63.1 Å²	63.1	48%	0.476	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-97.9	16.6	-179	-69.9	-32.6	0	0	0	112.2	G770 T771 G772 Q777	G770-N774 VanDerWaalsContact CA-O 3.28Å; G770-N774 WeakPolarHBondContact CA-O 3.39Å; T771-N774 PolarHBondContact O-N 2.74Å; G772-N774 VanDerWaalsContact C-N 3.29Å; G772-N774 PolarHBondContact O-N 2.78Å; N774-Q777 WeakPolarHBondContact O-CG 3.16Å; N774-Q777 PolarHBondContact OD1-NE2 2.91Å
775	R	82.4	Confident	85.5	Confident	64 Å²	64	61.4 Å²	61.4	24%	0.242	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	151.6	178.9	-74.1	-176	-73.7	171.1	1.9	111.1	G772 Q777 L813 E820	G772-R775 VanDerWaalsContact O-CG 3.23Å; G772-R775 WeakPolarHBondContact O-CG 3.19Å; G772-R775 PolarHBondContact O-NE 3Å; R775-Q777 VanDerWaalsContact C-N 3.3Å; R775-Q777 PolarHBondContact O-N 3.4Å; R775-L813 HydrophobicContact CB-CD1 3.93Å; R775-E820 IonicContact CZ-OE2 3.45Å; R775-E820 IonicContact NH1-OE1 3.6Å; R775-E820 PolarHBondContact NH1-OE1 2.73Å; R775-E820 IonicContact NH1-OE2 3.67Å; R775-E820 PolarHBondContact NH1-OE2 2.97Å; R775-E820 IonicContact NH2-OE2 2.86Å; R775-E820 PolarHBondContact NH2-OE2 2.98Å
776	Y	88.3	Confident	85.3	Confident	55 Å²	55	55.8 Å²	55.8	22%	0.216	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	60	29.2	174.6	-55.1	-84.1	0	0	0	116.3	M751 Y768 W769 L813 L816	M751-Y776 HydrophobicContact CE-CD1 3.29Å; M751-Y776 HydrophobicContact CE-CD2 3.92Å; M751-Y776 HydrophobicContact CE-CE1 3.97Å; M751-Y776 HydrophobicContact CE-CG 3.26Å; M751-Y776 HydrophobicContact SD-CD1 3.92Å; M751-Y776 HydrophobicContact SD-CD2 4.49Å; M751-Y776 HydrophobicContact SD-CE1 3.97Å; M751-Y776 HydrophobicContact SD-CG 4.19Å; Y768-Y776 HydrophobicContact CD1-CD1 4.08Å; Y768-Y776 HydrophobicContact CD1-CG 4.47Å; Y768-Y776 VanDerWaalsContact CD1-O 3.31Å; Y768-Y776 WeakPolarHBondContact CD1-O 3.45Å; Y768-Y776 AromaticContact CD2-CD1 3.83Å; Y768-Y776 HydrophobicContact CD2-CD1 3.83Å; Y768-Y776 HydrophobicContact CD2-CE1 4.45Å; Y768-Y776 HydrophobicContact CE2-CD1 4.3Å; Y768-Y776 AromaticContact CG-CD1 3.71Å; Y768-Y776 HydrophobicContact CG-CD1 3.71Å; Y768-Y776 HydrophobicContact CG-CG 4.47Å; W769-Y776 PolarHBondContact O-N 3.36Å; Y776-L813 HydrophobicContact CD2-CD1 4.1Å; Y776-L816 HydrophobicContact CD2-CD2 4.3Å; Y776-L816 HydrophobicContact CE2-CD2 3.34Å; Y776-L816 WeakPolarHBondContact OH-CD2 3.5Å
777	Q	90.3	Very high	85.1	Confident	8 Å²	8	62 Å²	62	4%	0.037	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	137.2	164.8	-62.1	-179	-2.1	0	0	109.8	Y768 W769 N774 R775 R803 T805	Y768-Q777 CarbonylContact C-O 3.59Å; Y768-Q777 WeakPolarHBondContact CA-O 3.29Å; W769-Q777 HydrophobicContact CE3-CB 4.49Å; W769-Q777 PolarHBondContact N-O 3.04Å; W769-Q777 PolarHBondContact O-N 3.12Å; N774-Q777 WeakPolarHBondContact O-CG 3.16Å; N774-Q777 PolarHBondContact OD1-NE2 2.91Å; R775-Q777 VanDerWaalsContact C-N 3.3Å; R775-Q777 PolarHBondContact O-N 3.4Å; Q777-R803 HydrophobicContact CB-CB 4.36Å; Q777-T805 HydrophobicContact CG-CG2 3.83Å
778	I	90.8	Very high	85	Confident	1 Å²	1	60.7 Å²	60.7	1%	0.005	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	119.1	-176.6	-56.9	170.9	0	0	0	109.2	F754 L755 L766 Y768 I780 W792 R803 Y804 T809	F754-I778 HydrophobicContact CE1-CD1 3.82Å; L755-I778 HydrophobicContact CD1-CG2 4.34Å; L766-I778 HydrophobicContact CB-CG2 4.35Å; L766-I778 HydrophobicContact CD1-CG2 4.04Å; Y768-I778 HydrophobicContact CD1-CG1 4.06Å; Y768-I778 HydrophobicContact CE1-CD1 4.4Å; Y768-I778 HydrophobicContact CE1-CG1 3.76Å; I778-I780 HydrophobicContact CG2-CD1 4.44Å; I778-I780 HydrophobicContact CG2-CG1 4Å; I778-W792 HydrophobicContact CB-CZ3 4.39Å; I778-W792 HydrophobicContact CD1-CE3 4.5Å; I778-W792 HydrophobicContact CD1-CH2 3.6Å; I778-W792 HydrophobicContact CD1-CZ2 4.19Å; I778-W792 HydrophobicContact CD1-CZ3 3.77Å; I778-W792 HydrophobicContact CG2-CZ3 4.19Å; I778-R803 WeakPolarHBondContact O-CA 3.34Å; I778-Y804 PolarHBondContact N-O 3.45Å; I778-Y804 PolarHBondContact O-N 3.22Å; I778-T809 HydrophobicContact CD1-CG2 3.99Å; I778-T809 HydrophobicContact CG1-CG2 4.34Å
779	E	91.3	Very high	84.7	Confident	49 Å²	49	60 Å²	60	23%	0.229	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	120.6	173.6	-73.2	-162.7	149.6	0	0	111.1	L766 A767 W769 V801 R803	L766-E779 WeakPolarHBondContact CD2-O 3.47Å; A767-E779 PolarHBondContact O-N 3.44Å; W769-E779 HydrophobicContact CB-CG 3.57Å; W769-E779 HydrophobicContact CG-CG 4.19Å; E779-V801 HydrophobicContact CB-CG1 3.66Å; E779-V801 HydrophobicContact CG-CG1 3.88Å; E779-R803 HydrophobicContact CG-CG 4.12Å; E779-R803 IonicContact OE1-CZ 3.12Å; E779-R803 IonicContact OE1-NE 3.91Å; E779-R803 PolarHBondContact OE1-NE 3.13Å; E779-R803 IonicContact OE1-NH2 3.26Å; E779-R803 PolarHBondContact OE1-NH2 3.42Å
780	I	90.7	Very high	84.4	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	128.4	179.4	-53.1	176.7	0	0	0	108.3	F762 L766 I778 E782 L784 V788 W792 V801 K802 Y804	F762-I780 HydrophobicContact CE1-CG2 4.32Å; F762-I780 HydrophobicContact CE2-CD1 4.49Å; F762-I780 HydrophobicContact CZ-CD1 4.14Å; L766-I780 HydrophobicContact CD2-CG1 4.2Å; I778-I780 HydrophobicContact CG2-CD1 4.44Å; I778-I780 HydrophobicContact CG2-CG1 4Å; I780-E782 PolarHBondContact O-N 3.04Å; I780-L784 HydrophobicContact CG2-CB 3.99Å; I780-V788 HydrophobicContact CD1-CG1 4.32Å; I780-V788 HydrophobicContact CD1-CG2 3.48Å; I780-V788 VanDerWaalsContact CD1-CG2 3.48Å; I780-V788 HydrophobicContact CG2-CG2 4.23Å; I780-W792 HydrophobicContact CD1-CE3 3.93Å; I780-W792 HydrophobicContact CD1-CZ3 3.61Å; I780-V801 WeakPolarHBondContact O-CA 3.25Å; I780-K802 PolarHBondContact N-O 3.32Å; I780-K802 PolarHBondContact O-N 2.63Å; I780-Y804 HydrophobicContact CB-CD2 4.28Å; I780-Y804 HydrophobicContact CB-CE2 4.26Å; I780-Y804 HydrophobicContact CD1-CD2 3.43Å; I780-Y804 VanDerWaalsContact CD1-CD2 3.43Å; I780-Y804 HydrophobicContact CD1-CE2 3.89Å; I780-Y804 HydrophobicContact CD1-CG 4.17Å; I780-Y804 HydrophobicContact CG1-CD2 4Å; I780-Y804 HydrophobicContact CG1-CE2 4.43Å
781	P	90.9	Very high	84.6	Confident	36 Å²	36	66.2 Å²	66.2	23%	0.234	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.4	138.3	173.3	-26.8	35.3	0	0	0	111.4	T764 S783 L784 A785	T764-P781 HydrophobicContact CG2-CG 4.25Å; P781-S783 PolarHBondContact O-N 3.18Å; P781-S783 VanDerWaalsContact O-N 3.1Å; P781-L784 HydrophobicContact CB-CD1 4.37Å; P781-L784 HydrophobicContact CG-CD1 4.2Å; P781-L784 PolarHBondContact O-N 3.01Å; P781-A785 PolarHBondContact O-N 3.36Å
782	E	89.4	Confident	85.2	Confident	92 Å²	92	61.3 Å²	61.3	43%	0.43	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-58.6	-29.3	-175.9	-177.5	161.9	-154.3	0	0	112.9	I780 L784 A785 G800	I780-E782 PolarHBondContact O-N 3.04Å; E782-L784 VanDerWaalsContact C-N 3.26Å; E782-L784 PolarHBondContact O-N 3.33Å; E782-A785 VanDerWaalsContact O-CB 3.29Å; E782-A785 WeakPolarHBondContact O-CB 3.31Å; E782-A785 PolarHBondContact O-N 2.97Å; E782-G800 PolarHBondContact N-O 3.49Å; E782-G800 PolarHBondContact OE2-N 3.23Å
783	S	85.6	Confident	85.9	Confident	102 Å²	102	65 Å²	65	71%	0.713	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-63.7	-25.8	173.1	51.7	0	0	0	0	114.4	P781	P781-S783 PolarHBondContact O-N 3.18Å; P781-S783 VanDerWaalsContact O-N 3.1Å
784	L	86.6	Confident	86.8	Confident	33 Å²	33	63.2 Å²	63.2	17%	0.173	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-102.8	-0.6	-178.3	-66.7	169.9	0	0	0	112.6	F762 T764 I780 P781 E782 S786 R787	F762-L784 HydrophobicContact CB-CD1 4.35Å; F762-L784 HydrophobicContact CD1-CB 4.13Å; T764-L784 HydrophobicContact CG2-CD1 3.46Å; T764-L784 VanDerWaalsContact CG2-CD1 3.46Å; I780-L784 HydrophobicContact CG2-CB 3.99Å; P781-L784 HydrophobicContact CB-CD1 4.37Å; P781-L784 HydrophobicContact CG-CD1 4.2Å; P781-L784 PolarHBondContact O-N 3.01Å; E782-L784 VanDerWaalsContact C-N 3.26Å; E782-L784 PolarHBondContact O-N 3.33Å; L784-S786 PolarHBondContact O-N 3.36Å; L784-S786 VanDerWaalsContact O-N 3.13Å; L784-R787 PolarHBondContact O-N 3.07Å
785	A	83.3	Confident	87.1	Confident	15 Å²	15	61.2 Å²	61.2	12%	0.124	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-58.6	-26.7	-178.5	0	0	0	0	0	113.7	P781 E782 R787 V788 K802	P781-A785 PolarHBondContact O-N 3.36Å; E782-A785 VanDerWaalsContact O-CB 3.29Å; E782-A785 WeakPolarHBondContact O-CB 3.31Å; E782-A785 PolarHBondContact O-N 2.97Å; A785-R787 VanDerWaalsContact C-N 3.26Å; A785-R787 PolarHBondContact O-N 3.39Å; A785-V788 WeakPolarHBondContact O-CB 3.21Å; A785-V788 WeakPolarHBondContact O-CG2 3.44Å; A785-V788 PolarHBondContact O-N 3.4Å; A785-K802 HydrophobicContact CB-CD 3.74Å
786	S	82.1	Confident	87.3	Confident	110 Å²	110	60 Å²	60	77%	0.769	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-71.1	-17.6	175.8	56.7	0	0	0	0	114	L784	L784-S786 PolarHBondContact O-N 3.36Å; L784-S786 VanDerWaalsContact O-N 3.13Å
787	R	85.5	Confident	87.3	Confident	137 Å²	137	63.6 Å²	63.6	52%	0.517	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-93.4	0.6	178.9	-62.8	-178.4	69.9	-161.4	-4.1	112.9	T761 F762 L784 A785	T761-R787 PolarHBondContact O-NH1 3.12Å; T761-R787 PolarHBondContact O-NH2 3.29Å; F762-R787 HydrophobicContact CD1-CB 4.12Å; F762-R787 HydrophobicContact CE1-CB 3.77Å; F762-R787 PolarHBondContact O-NH1 3.25Å; L784-R787 PolarHBondContact O-N 3.07Å; A785-R787 VanDerWaalsContact C-N 3.26Å; A785-R787 PolarHBondContact O-N 3.39Å
788	V	86.4	Confident	87.2	Confident	16 Å²	16	71.7 Å²	71.7	10%	0.097	38%	0.381	C	S	.	.	S	Bend	trans	-72.4	133.9	-178.8	-178.4	0	0	0	0	109.5	F762 I780 A785 W792 Y804	F762-V788 HydrophobicContact CE1-CG2 4.09Å; F762-V788 HydrophobicContact CZ-CG2 4.03Å; I780-V788 HydrophobicContact CD1-CG1 4.32Å; I780-V788 HydrophobicContact CD1-CG2 3.48Å; I780-V788 VanDerWaalsContact CD1-CG2 3.48Å; I780-V788 HydrophobicContact CG2-CG2 4.23Å; A785-V788 WeakPolarHBondContact O-CB 3.21Å; A785-V788 WeakPolarHBondContact O-CG2 3.44Å; A785-V788 PolarHBondContact O-N 3.4Å; V788-W792 HydrophobicContact CG1-CB 3.77Å; V788-W792 HydrophobicContact CG1-CD2 4.02Å; V788-W792 HydrophobicContact CG1-CE3 3.65Å; V788-W792 HydrophobicContact CG1-CG 4.11Å; V788-Y804 HydrophobicContact CB-CE1 4.39Å; V788-Y804 HydrophobicContact CG1-CD1 3.86Å; V788-Y804 HydrophobicContact CG1-CD2 4.46Å; V788-Y804 HydrophobicContact CG1-CE1 3.86Å; V788-Y804 HydrophobicContact CG1-CE2 4.46Å; V788-Y804 HydrophobicContact CG1-CG 4.16Å; V788-Y804 HydrophobicContact CG2-CD2 4.4Å; V788-Y804 HydrophobicContact CG2-CE1 4.48Å; V788-Y804 HydrophobicContact CG2-CE2 3.91Å
789	P	85.5	Confident	86.9	Confident	36 Å²	36	81.5 Å²	81.5	23%	0.234	42%	0.424	C	S	.	.			trans	-57.8	144.6	175.9	-23.4	33	0	0	0	112.5	W758 S791 W792	W758-P789 HydrophobicContact CH2-CG 3.31Å; W758-P789 HydrophobicContact CZ2-CG 4.15Å; W758-P789 HydrophobicContact CZ3-CG 3.67Å; P789-S791 PolarHBondContact O-N 3.49Å; P789-S791 VanDerWaalsContact O-N 3.08Å; P789-W792 HydrophobicContact CG-CD2 4.48Å; P789-W792 PolarHBondContact O-N 3.33Å; P789-W792 VanDerWaalsContact O-N 3.07Å
790	N	82.5	Confident	86.7	Confident	175 Å²	175	80.9 Å²	80.9	94%	0.936	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-16.5	175.8	-66.8	-13.1	0	0	0	113.6	W792	N790-W792 VanDerWaalsContact C-N 3.26Å; N790-W792 PolarHBondContact O-N 3.07Å
791	S	84.9	Confident	86.7	Confident	77 Å²	77	82.7 Å²	82.7	54%	0.538	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-15.1	176.2	53.5	0	0	0	0	113.5	P789	P789-S791 PolarHBondContact O-N 3.49Å; P789-S791 VanDerWaalsContact O-N 3.08Å
792	W	90.7	Very high	86.7	Confident	17 Å²	17	83.4 Å²	83.4	6%	0.064	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-91.4	136.9	-176.7	-67.2	16	0	0	0	110.6	F754 W758 F762 I778 I780 V788 P789 N790 Y804 C806	F754-W792 HydrophobicContact CE1-CH2 4.48Å; F754-W792 HydrophobicContact CE1-CZ2 4.11Å; F754-W792 AromaticContact CZ-CZ2 3.9Å; F754-W792 HydrophobicContact CZ-CZ2 3.9Å; W758-W792 HydrophobicContact CB-CH2 4.41Å; W758-W792 AromaticContact CD1-CZ2 3.96Å; W758-W792 AromaticContact CD2-CH2 3.84Å; W758-W792 HydrophobicContact CD2-CH2 3.84Å; W758-W792 AromaticContact CD2-CZ2 3.75Å; W758-W792 HydrophobicContact CD2-CZ2 3.75Å; W758-W792 AromaticContact CE2-CZ2 3.49Å; W758-W792 VanDerWaalsContact CE2-CZ2 3.49Å; W758-W792 HydrophobicContact CE3-CH2 4.29Å; W758-W792 HydrophobicContact CE3-CZ2 4.32Å; W758-W792 AromaticContact CG-CH2 3.87Å; W758-W792 HydrophobicContact CG-CH2 3.87Å; W758-W792 HydrophobicContact CG-CZ2 4.05Å; W758-W792 HydrophobicContact CH2-CZ2 4.43Å; W758-W792 AromaticContact CZ2-CZ2 3.87Å; W758-W792 HydrophobicContact CZ2-CZ2 3.87Å; W758-W792 AromaticContact NE1-CZ2 3.63Å; F762-W792 HydrophobicContact CE2-CH2 4.43Å; F762-W792 HydrophobicContact CE2-CZ3 4.44Å; I778-W792 HydrophobicContact CB-CZ3 4.39Å; I778-W792 HydrophobicContact CD1-CE3 4.5Å; I778-W792 HydrophobicContact CD1-CH2 3.6Å; I778-W792 HydrophobicContact CD1-CZ2 4.19Å; I778-W792 HydrophobicContact CD1-CZ3 3.77Å; I778-W792 HydrophobicContact CG2-CZ3 4.19Å; I780-W792 HydrophobicContact CD1-CE3 3.93Å; I780-W792 HydrophobicContact CD1-CZ3 3.61Å; V788-W792 HydrophobicContact CG1-CB 3.77Å; V788-W792 HydrophobicContact CG1-CD2 4.02Å; V788-W792 HydrophobicContact CG1-CE3 3.65Å; V788-W792 HydrophobicContact CG1-CG 4.11Å; P789-W792 HydrophobicContact CG-CD2 4.48Å; P789-W792 PolarHBondContact O-N 3.33Å; P789-W792 VanDerWaalsContact O-N 3.07Å; N790-W792 VanDerWaalsContact C-N 3.26Å; N790-W792 PolarHBondContact O-N 3.07Å; W792-Y804 HydrophobicContact CB-CD1 4.21Å; W792-Y804 HydrophobicContact CE3-CG 4.4Å; W792-C806 HydrophobicContact CD2-CB 4.17Å; W792-C806 HydrophobicContact CG-CB 3.82Å; W792-C806 VanDerWaalsContact NE1-CB 3.35Å
793	Q	87.3	Confident	86.8	Confident	125 Å²	125	80 Å²	80	58%	0.584	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.5	133	-179.9	-63.6	175.6	5.4	0	0	109.9	S795 Y804 T805	Q793-S795 PolarHBondContact O-N 3.4Å; Q793-Y804 CarbonylContact O-C 3.56Å; Q793-Y804 VanDerWaalsContact O-CA 3.28Å; Q793-Y804 WeakPolarHBondContact O-CA 3.49Å; Q793-T805 PolarHBondContact N-O 3.05Å; Q793-T805 PolarHBondContact O-N 3.15Å
794	L	89.4	Confident	87.1	Confident	90 Å²	90	76.2 Å²	76.2	47%	0.471	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	117.7	175.7	-178.3	73	0	0	0	109.6	K802 R803 Y804	L794-K802 HydrophobicContact CD1-CB 3.82Å; L794-K802 HydrophobicContact CD1-CD 4.31Å; L794-K802 HydrophobicContact CD1-CG 4.25Å; L794-R803 WeakPolarHBondContact CD1-O 3.4Å; L794-Y804 HydrophobicContact CB-CD1 4.25Å; L794-Y804 HydrophobicContact CB-CE1 4.02Å; L794-Y804 HydrophobicContact CD1-CD1 4.27Å; L794-Y804 HydrophobicContact CD1-CE1 3.83Å; L794-Y804 HydrophobicContact CD1-CE2 4.12Å
795	S	85.4	Confident	87.2	Confident	48 Å²	48	75.7 Å²	75.7	34%	0.336	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	-43.1	-176.2	-33.5	0	0	0	0	112.4	Q793 R803 T805	Q793-S795 PolarHBondContact O-N 3.4Å; S795-R803 PolarHBondContact N-O 3.12Å; S795-T805 WeakPolarHBondContact OG-CG2 3.42Å; S795-T805 PolarHBondContact OG-N 2.8Å; S795-T805 PolarHBondContact OG-OG1 3.07Å
796	S	87	Confident	87.5	Confident	37 Å²	37	75.1 Å²	75.1	26%	0.259	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	168.5	176.4	67.4	0	0	0	0	111.4	R803	S796-R803 WeakPolarHBondContact O-CB 3.46Å; S796-R803 PolarHBondContact O-N 2.65Å; S796-R803 WeakPolarHBondContact OG-CD 3.28Å; S796-R803 PolarHBondContact OG-NH1 3.17Å; S796-R803 VanDerWaalsContact OG-NH1 3.09Å
797	Q	87.7	Confident	87.8	Confident	132 Å²	132	72.7 Å²	72.7	62%	0.617	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141	143.4	177.5	61.5	-176.3	-4.3	0	0	111.4	K802	Q797-K802 HydrophobicContact CB-CG 4.36Å
798	R	87.6	Confident	87.9	Confident	178 Å²	178	69.3 Å²	69.3	67%	0.672	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.9	154.5	168.1	-177.8	-179	-179.2	-163.4	1	107.2	G800 V801	R798-G800 PolarHBondContact O-N 2.64Å; R798-V801 PolarHBondContact N-O 2.83Å; R798-V801 CarbonylContact O-C 3.54Å; R798-V801 PolarHBondContact O-N 3.2Å
799	K	85.7	Confident	88	Confident	207 Å²	207	68.8 Å²	68.8	90%	0.9	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.5	114.6	174.1	-170.9	176.3	-178.2	178.4	0	110.7
800	G	87.2	Confident	88.1	Confident	36 Å²	36	71.5 Å²	71.5	37%	0.371	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.7	-10.3	179.8	0	0	0	0	0	116.8	E782 R798	E782-G800 PolarHBondContact N-O 3.49Å; E782-G800 PolarHBondContact OE2-N 3.23Å; R798-G800 PolarHBondContact O-N 2.64Å
801	V	90.4	Very high	88.4	Confident	37 Å²	37	69.6 Å²	69.6	22%	0.224	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	129.2	-177.4	179.2	0	0	0	0	110.9	E779 I780 R798	E779-V801 HydrophobicContact CB-CG1 3.66Å; E779-V801 HydrophobicContact CG-CG1 3.88Å; I780-V801 WeakPolarHBondContact O-CA 3.25Å; R798-V801 PolarHBondContact N-O 2.83Å; R798-V801 CarbonylContact O-C 3.54Å; R798-V801 PolarHBondContact O-N 3.2Å
802	K	90.8	Very high	88.8	Confident	51 Å²	51	68.1 Å²	68.1	22%	0.222	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	138.3	170.9	-70.6	-175.3	-178.5	173	0	109.7	I780 A785 L794 Q797 Y804	I780-K802 PolarHBondContact N-O 3.32Å; I780-K802 PolarHBondContact O-N 2.63Å; A785-K802 HydrophobicContact CB-CD 3.74Å; L794-K802 HydrophobicContact CD1-CB 3.82Å; L794-K802 HydrophobicContact CD1-CD 4.31Å; L794-K802 HydrophobicContact CD1-CG 4.25Å; Q797-K802 HydrophobicContact CB-CG 4.36Å; K802-Y804 HydrophobicContact CB-CD2 4.36Å; K802-Y804 HydrophobicContact CB-CE2 3.48Å; K802-Y804 VanDerWaalsContact CB-CE2 3.48Å
803	R	91.4	Very high	88.6	Confident	22 Å²	22	68.8 Å²	68.8	8%	0.083	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	130.6	-176.4	-49.7	-159.6	-177.1	115	-10.6	110.6	W769 Q777 I778 E779 L794 S795 S796	W769-R803 VanDerWaalsContact CD2-CZ 3.43Å; W769-R803 VanDerWaalsContact CD2-NE 3.34Å; W769-R803 VanDerWaalsContact CH2-NH1 3.35Å; Q777-R803 HydrophobicContact CB-CB 4.36Å; I778-R803 WeakPolarHBondContact O-CA 3.34Å; E779-R803 HydrophobicContact CG-CG 4.12Å; E779-R803 IonicContact OE1-CZ 3.12Å; E779-R803 IonicContact OE1-NE 3.91Å; E779-R803 PolarHBondContact OE1-NE 3.13Å; E779-R803 IonicContact OE1-NH2 3.26Å; E779-R803 PolarHBondContact OE1-NH2 3.42Å; L794-R803 WeakPolarHBondContact CD1-O 3.4Å; S795-R803 PolarHBondContact N-O 3.12Å; S796-R803 WeakPolarHBondContact O-CB 3.46Å; S796-R803 PolarHBondContact O-N 2.65Å; S796-R803 WeakPolarHBondContact OG-CD 3.28Å; S796-R803 PolarHBondContact OG-NH1 3.17Å; S796-R803 VanDerWaalsContact OG-NH1 3.09Å
804	Y	91.5	Very high	88.6	Confident	22 Å²	22	66.8 Å²	66.8	9%	0.086	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	149	-174.6	-64.8	-94.3	0	0	0	112	I778 I780 V788 W792 Q793 L794 K802	I778-Y804 PolarHBondContact N-O 3.45Å; I778-Y804 PolarHBondContact O-N 3.22Å; I780-Y804 HydrophobicContact CB-CD2 4.28Å; I780-Y804 HydrophobicContact CB-CE2 4.26Å; I780-Y804 HydrophobicContact CD1-CD2 3.43Å; I780-Y804 VanDerWaalsContact CD1-CD2 3.43Å; I780-Y804 HydrophobicContact CD1-CE2 3.89Å; I780-Y804 HydrophobicContact CD1-CG 4.17Å; I780-Y804 HydrophobicContact CG1-CD2 4Å; I780-Y804 HydrophobicContact CG1-CE2 4.43Å; V788-Y804 HydrophobicContact CB-CE1 4.39Å; V788-Y804 HydrophobicContact CG1-CD1 3.86Å; V788-Y804 HydrophobicContact CG1-CD2 4.46Å; V788-Y804 HydrophobicContact CG1-CE1 3.86Å; V788-Y804 HydrophobicContact CG1-CE2 4.46Å; V788-Y804 HydrophobicContact CG1-CG 4.16Å; V788-Y804 HydrophobicContact CG2-CD2 4.4Å; V788-Y804 HydrophobicContact CG2-CE1 4.48Å; V788-Y804 HydrophobicContact CG2-CE2 3.91Å; W792-Y804 HydrophobicContact CB-CD1 4.21Å; W792-Y804 HydrophobicContact CE3-CG 4.4Å; Q793-Y804 CarbonylContact O-C 3.56Å; Q793-Y804 VanDerWaalsContact O-CA 3.28Å; Q793-Y804 WeakPolarHBondContact O-CA 3.49Å; L794-Y804 HydrophobicContact CB-CD1 4.25Å; L794-Y804 HydrophobicContact CB-CE1 4.02Å; L794-Y804 HydrophobicContact CD1-CD1 4.27Å; L794-Y804 HydrophobicContact CD1-CE1 3.83Å; L794-Y804 HydrophobicContact CD1-CE2 4.12Å; K802-Y804 HydrophobicContact CB-CD2 4.36Å; K802-Y804 HydrophobicContact CB-CE2 3.48Å; K802-Y804 VanDerWaalsContact CB-CE2 3.48Å
805	T	88.8	Confident	88.7	Confident	22 Å²	22	65.5 Å²	65.5	14%	0.135	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	137.6	167.8	46.8	0	0	0	0	109.3	Q777 Q793 S795	Q777-T805 HydrophobicContact CG-CG2 3.83Å; Q793-T805 PolarHBondContact N-O 3.05Å; Q793-T805 PolarHBondContact O-N 3.15Å; S795-T805 WeakPolarHBondContact OG-CG2 3.42Å; S795-T805 PolarHBondContact OG-N 2.8Å; S795-T805 PolarHBondContact OG-OG1 3.07Å
806	C	89.4	Confident	88.9	Confident	2 Å²	2	63.3 Å²	63.3	1%	0.014	32%	0.315	C	S	.	.			trans	-118	167.5	172.3	71	0	0	0	0	111.2	W792 E808 T809 Q810	W792-C806 HydrophobicContact CD2-CB 4.17Å; W792-C806 HydrophobicContact CG-CB 3.82Å; W792-C806 VanDerWaalsContact NE1-CB 3.35Å; C806-E808 VanDerWaalsContact C-N 3.25Å; C806-E808 WeakPolarHBondContact CB-OE2 3.46Å; C806-E808 PolarHBondContact O-N 2.97Å; C806-E808 PolarHBondContact SG-OE2 3.49Å; C806-T809 PolarHBondContact N-OG1 2.84Å; C806-T809 PolarHBondContact O-N 2.84Å; C806-T809 PolarHBondContact O-OG1 3.2Å; C806-T809 PolarHBondContact SG-N 3.09Å; C806-T809 PolarHBondContact SG-OG1 3.5Å; C806-Q810 WeakPolarHBondContact O-CG 3.22Å; C806-Q810 PolarHBondContact O-N 3.29Å
807	S	88.2	Confident	88.9	Confident	60 Å²	60	63.6 Å²	63.6	42%	0.42	32%	0.316	S	S	.	.	H	α-helix	trans	-52.6	-44.6	178.4	37.3	0	0	0	0	111.9	T809 Q810 E811	S807-T809 PolarHBondContact O-N 3.48Å; S807-Q810 PolarHBondContact O-N 2.83Å; S807-E811 WeakPolarHBondContact O-CG 3.34Å; S807-E811 PolarHBondContact O-N 3.47Å
808	E	88.4	Confident	88.9	Confident	66 Å²	66	59.3 Å²	59.3	31%	0.308	30%	0.303	S	S	.	.	H	α-helix	trans	-64.3	-44.7	-178.8	-55.2	92.9	140.8	0	0	111.4	F754 C806 Q810 E811 W812	F754-E808 HydrophobicContact CE2-CB 4.29Å; F754-E808 HydrophobicContact CE2-CG 4.3Å; C806-E808 VanDerWaalsContact C-N 3.25Å; C806-E808 WeakPolarHBondContact CB-OE2 3.46Å; C806-E808 PolarHBondContact O-N 2.97Å; C806-E808 PolarHBondContact SG-OE2 3.49Å; E808-Q810 VanDerWaalsContact C-N 3.29Å; E808-Q810 PolarHBondContact O-N 3.44Å; E808-E811 PolarHBondContact O-N 3.2Å; E808-W812 VanDerWaalsContact C-CE3 3.49Å; E808-W812 HydrophobicContact CB-CE3 4.03Å; E808-W812 HydrophobicContact CB-CH2 3.84Å; E808-W812 HydrophobicContact CB-CZ2 4.47Å; E808-W812 HydrophobicContact CB-CZ3 3.59Å; E808-W812 VanDerWaalsContact O-CD2 3.29Å; E808-W812 PolarHBondContact O-N 3.13Å
809	T	87.9	Confident	89	Confident	5 Å²	5	50.9 Å²	50.9	3%	0.031	27%	0.271	C	S	.	.	H	α-helix	trans	-65	-31.6	176.1	52.2	0	0	0	0	113.2	F754 Y768 I778 C806 S807 L813	F754-T809 HydrophobicContact CE1-CG2 4.4Å; Y768-T809 HydrophobicContact CE1-CG2 4.17Å; I778-T809 HydrophobicContact CD1-CG2 3.99Å; I778-T809 HydrophobicContact CG1-CG2 4.34Å; C806-T809 PolarHBondContact N-OG1 2.84Å; C806-T809 PolarHBondContact O-N 2.84Å; C806-T809 PolarHBondContact O-OG1 3.2Å; C806-T809 PolarHBondContact SG-N 3.09Å; C806-T809 PolarHBondContact SG-OG1 3.5Å; S807-T809 PolarHBondContact O-N 3.48Å; T809-L813 VanDerWaalsContact O-CB 3.22Å; T809-L813 WeakPolarHBondContact O-CB 3.33Å; T809-L813 PolarHBondContact O-N 3.36Å
810	Q	87.8	Confident	89.1	Confident	93 Å²	93	43.1 Å²	43.1	44%	0.435	24%	0.238	S	C	.	.	H	α-helix	trans	-74	-42.2	177.5	-72.2	177	-9.7	0	0	111.3	C806 S807 E808 L813 S814	C806-Q810 WeakPolarHBondContact O-CG 3.22Å; C806-Q810 PolarHBondContact O-N 3.29Å; S807-Q810 PolarHBondContact O-N 2.83Å; E808-Q810 VanDerWaalsContact C-N 3.29Å; E808-Q810 PolarHBondContact O-N 3.44Å; Q810-L813 PolarHBondContact O-N 3.35Å; Q810-S814 PolarHBondContact O-N 3.29Å
811	E	89.7	Confident	89	Confident	135 Å²	135	47.5 Å²	47.5	63%	0.631	25%	0.249	S	C	*	.	H	α-helix	trans	-61.3	-50.3	174.6	-74.3	173.3	-171.1	0	0	111.1	S807 E808 L813 S814 E815	S807-E811 WeakPolarHBondContact O-CG 3.34Å; S807-E811 PolarHBondContact O-N 3.47Å; E808-E811 PolarHBondContact O-N 3.2Å; E811-L813 VanDerWaalsContact C-N 3.34Å; E811-L813 PolarHBondContact O-N 3.17Å; E811-S814 WeakPolarHBondContact O-CB 3.23Å; E811-S814 PolarHBondContact O-N 3.5Å; E811-S814 VanDerWaalsContact O-N 3.14Å; E811-E815 PolarHBondContact O-N 2.86Å
812	W	91.8	Very high	88.8	Confident	46 Å²	46	50.4 Å²	50.4	17%	0.174	26%	0.256	C	S	.	.	H	α-helix	trans	-62.5	-37.7	176.1	-71	-42.9	0	0	0	113	I747 D750 M751 F754 E808 S814 E815 L816	I747-W812 HydrophobicContact CG2-CB 4Å; I747-W812 HydrophobicContact CG2-CG 4.26Å; D750-W812 HydrophobicContact CB-CZ2 4.29Å; M751-W812 HydrophobicContact CE-CB 4.2Å; M751-W812 HydrophobicContact CG-CB 3.98Å; M751-W812 HydrophobicContact CG-CD2 3.88Å; M751-W812 HydrophobicContact CG-CE3 3.8Å; M751-W812 HydrophobicContact CG-CG 3.98Å; M751-W812 HydrophobicContact SD-CB 3.93Å; F754-W812 HydrophobicContact CB-CH2 3.68Å; F754-W812 HydrophobicContact CB-CZ3 3.77Å; F754-W812 HydrophobicContact CD1-CZ3 4.01Å; F754-W812 AromaticContact CD2-CH2 3.62Å; F754-W812 HydrophobicContact CD2-CH2 3.62Å; F754-W812 AromaticContact CD2-CZ3 3.82Å; F754-W812 HydrophobicContact CD2-CZ3 3.82Å; F754-W812 HydrophobicContact CE2-CH2 4.33Å; F754-W812 HydrophobicContact CE2-CZ3 4.34Å; F754-W812 AromaticContact CG-CH2 3.73Å; F754-W812 HydrophobicContact CG-CH2 3.73Å; F754-W812 AromaticContact CG-CZ3 3.61Å; F754-W812 HydrophobicContact CG-CZ3 3.61Å; E808-W812 VanDerWaalsContact C-CE3 3.49Å; E808-W812 HydrophobicContact CB-CE3 4.03Å; E808-W812 HydrophobicContact CB-CH2 3.84Å; E808-W812 HydrophobicContact CB-CZ2 4.47Å; E808-W812 HydrophobicContact CB-CZ3 3.59Å; E808-W812 VanDerWaalsContact O-CD2 3.29Å; E808-W812 PolarHBondContact O-N 3.13Å; W812-S814 VanDerWaalsContact C-N 3.3Å; W812-S814 PolarHBondContact O-N 3Å; W812-E815 PolarHBondContact O-N 3.46Å; W812-L816 WeakPolarHBondContact O-CB 3.49Å; W812-L816 PolarHBondContact O-N 3.4Å
813	L	88.3	Confident	88.6	Confident	30 Å²	30	50.4 Å²	50.4	16%	0.157	26%	0.256	C	S	.	.	H	α-helix	trans	-63.1	-39.4	175.4	177.6	62.7	0	0	0	111.4	R775 Y776 T809 Q810 E811 T817	R775-L813 HydrophobicContact CB-CD1 3.93Å; Y776-L813 HydrophobicContact CD2-CD1 4.1Å; T809-L813 VanDerWaalsContact O-CB 3.22Å; T809-L813 WeakPolarHBondContact O-CB 3.33Å; T809-L813 PolarHBondContact O-N 3.36Å; Q810-L813 PolarHBondContact O-N 3.35Å; E811-L813 VanDerWaalsContact C-N 3.34Å; E811-L813 PolarHBondContact O-N 3.17Å; L813-T817 WeakPolarHBondContact O-CB 3.48Å; L813-T817 PolarHBondContact O-N 2.75Å; L813-T817 PolarHBondContact O-OG1 3.21Å
814	S	87.3	Confident	88.1	Confident	84 Å²	84	51.8 Å²	51.8	59%	0.587	27%	0.265	S	S	*	.	H	α-helix	trans	-67.2	-46.1	176.2	-170.4	0	0	0	0	111.8	Q810 E811 W812 T817 A818	Q810-S814 PolarHBondContact O-N 3.29Å; E811-S814 WeakPolarHBondContact O-CB 3.23Å; E811-S814 PolarHBondContact O-N 3.5Å; E811-S814 VanDerWaalsContact O-N 3.14Å; W812-S814 VanDerWaalsContact C-N 3.3Å; W812-S814 PolarHBondContact O-N 3Å; S814-T817 PolarHBondContact O-N 3.42Å; S814-A818 PolarHBondContact O-N 3.38Å
815	E	90.8	Very high	87.7	Confident	63 Å²	63	53 Å²	53	29%	0.294	28%	0.279	S	S	.	.	H	α-helix	trans	-63.5	-43.9	178	-161.2	-175.5	179.3	0	0	110.9	R746 I747 E811 W812 T817 A818 A819	R746-E815 IonicContact CZ-OE1 3.39Å; R746-E815 IonicContact NH1-OE1 2.69Å; R746-E815 IonicContact NH2-OE1 3.59Å; R746-E815 PolarHBondContact NH2-OE1 3.1Å; I747-E815 HydrophobicContact CD1-CB 3.96Å; I747-E815 HydrophobicContact CD1-CG 3.64Å; I747-E815 HydrophobicContact CG1-CG 4.34Å; E811-E815 PolarHBondContact O-N 2.86Å; W812-E815 PolarHBondContact O-N 3.46Å; E815-T817 PolarHBondContact O-N 3.25Å; E815-A818 PolarHBondContact O-N 3.38Å; E815-A819 WeakPolarHBondContact O-CB 3.38Å; E815-A819 PolarHBondContact O-N 2.98Å
816	L	89.9	Confident	87.5	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-62.1	-44.4	176.6	-177.7	68.6	0	0	0	111.5	I744 I747 V748 Y776 W812 A818 A819 E820	I744-L816 HydrophobicContact CB-CD1 4.32Å; I744-L816 HydrophobicContact CG1-CD1 4.17Å; I744-L816 HydrophobicContact CG2-CD1 3.9Å; I747-L816 HydrophobicContact CG2-CB 4.16Å; I747-L816 HydrophobicContact CG2-CD1 4.46Å; V748-L816 HydrophobicContact CG2-CD1 4.47Å; Y776-L816 HydrophobicContact CD2-CD2 4.3Å; Y776-L816 HydrophobicContact CE2-CD2 3.34Å; Y776-L816 WeakPolarHBondContact OH-CD2 3.5Å; W812-L816 WeakPolarHBondContact O-CB 3.49Å; W812-L816 PolarHBondContact O-N 3.4Å; L816-A818 VanDerWaalsContact C-N 3.35Å; L816-A819 PolarHBondContact O-N 2.99Å; L816-E820 HydrophobicContact CG-CG 4.45Å; L816-E820 WeakPolarHBondContact O-CB 3.45Å; L816-E820 VanDerWaalsContact O-CG 3.3Å; L816-E820 WeakPolarHBondContact O-CG 3.27Å; L816-E820 PolarHBondContact O-N 3.34Å
817	T	86.5	Confident	87.1	Confident	43 Å²	43	52.4 Å²	52.4	26%	0.264	28%	0.276	S	S	.	.	H	α-helix	trans	-63.8	-42.1	178.8	-56	0	0	0	0	110.7	L813 S814 E815 A819 E820 E821	L813-T817 WeakPolarHBondContact O-CB 3.48Å; L813-T817 PolarHBondContact O-N 2.75Å; L813-T817 PolarHBondContact O-OG1 3.21Å; S814-T817 PolarHBondContact O-N 3.42Å; E815-T817 PolarHBondContact O-N 3.25Å; T817-A819 PolarHBondContact O-N 3.2Å; T817-E820 PolarHBondContact O-N 2.96Å; T817-E821 WeakPolarHBondContact O-CB 3.4Å; T817-E821 WeakPolarHBondContact O-CG 3.31Å; T817-E821 PolarHBondContact O-N 3.13Å
818	A	88.4	Confident	86.6	Confident	43 Å²	43	54.4 Å²	54.4	36%	0.355	27%	0.274	S	S	.	.	H	α-helix	trans	-63.8	-39.3	176.1	0	0	0	0	0	112.6	S814 E815 L816 R822	S814-A818 PolarHBondContact O-N 3.38Å; E815-A818 PolarHBondContact O-N 3.38Å; L816-A818 VanDerWaalsContact C-N 3.35Å; A818-R822 PolarHBondContact O-N 3.2Å
819	A	88.7	Confident	86.3	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-69.5	-39	175.7	0	0	0	0	0	112.3	E743 I744 E815 L816 T817 R822 K823	E743-A819 HydrophobicContact CB-CB 4.46Å; E743-A819 HydrophobicContact CG-CB 4.07Å; I744-A819 HydrophobicContact CD1-CB 4.44Å; I744-A819 HydrophobicContact CG1-CB 3.72Å; E815-A819 WeakPolarHBondContact O-CB 3.38Å; E815-A819 PolarHBondContact O-N 2.98Å; L816-A819 PolarHBondContact O-N 2.99Å; T817-A819 PolarHBondContact O-N 3.2Å; A819-R822 PolarHBondContact O-N 2.97Å; A819-K823 WeakPolarHBondContact O-CB 3.32Å; A819-K823 PolarHBondContact O-N 3.4Å
820	E	87.5	Confident	86.1	Confident	45 Å²	45	55.8 Å²	55.8	21%	0.21	29%	0.289	C	S	.	.	H	α-helix	trans	-60.3	-45.8	172.1	-75.8	176.8	161	0	0	111.4	I744 R775 L816 T817 K823 D824	I744-E820 HydrophobicContact CD1-CG 4.25Å; R775-E820 IonicContact CZ-OE2 3.45Å; R775-E820 IonicContact NH1-OE1 3.6Å; R775-E820 PolarHBondContact NH1-OE1 2.73Å; R775-E820 IonicContact NH1-OE2 3.67Å; R775-E820 PolarHBondContact NH1-OE2 2.97Å; R775-E820 IonicContact NH2-OE2 2.86Å; R775-E820 PolarHBondContact NH2-OE2 2.98Å; L816-E820 HydrophobicContact CG-CG 4.45Å; L816-E820 WeakPolarHBondContact O-CB 3.45Å; L816-E820 VanDerWaalsContact O-CG 3.3Å; L816-E820 WeakPolarHBondContact O-CG 3.27Å; L816-E820 PolarHBondContact O-N 3.34Å; T817-E820 PolarHBondContact O-N 2.96Å; E820-K823 WeakPolarHBondContact O-CB 3.23Å; E820-K823 PolarHBondContact O-N 3.49Å; E820-D824 PolarHBondContact O-N 2.75Å
821	E	85.7	Confident	85.7	Confident	127 Å²	127	53 Å²	53	59%	0.593	28%	0.276	S	S	*	.	H	α-helix	trans	-63.4	-40.4	177.5	-76.1	177.5	178.9	0	0	112.6	T817 D824 A825	T817-E821 WeakPolarHBondContact O-CB 3.4Å; T817-E821 WeakPolarHBondContact O-CG 3.31Å; T817-E821 PolarHBondContact O-N 3.13Å; E821-D824 PolarHBondContact O-N 3.21Å; E821-A825 WeakPolarHBondContact O-CB 3.28Å; E821-A825 PolarHBondContact O-N 2.65Å
822	R	87.1	Confident	85.3	Confident	98 Å²	98	50.3 Å²	50.3	37%	0.37	26%	0.263	S	S	.	.	H	α-helix	trans	-64	-47.2	175.5	-166.5	-179.7	-52.3	109	-0.9	111.1	S740 E743 A818 A819 D824 A825 S826	S740-R822 WeakPolarHBondContact OG-CD 3.42Å; S740-R822 WeakPolarHBondContact OG-CG 3.44Å; E743-R822 IonicContact OE2-CZ 2.62Å; E743-R822 IonicContact OE2-NH1 3.49Å; E743-R822 PolarHBondContact OE2-NH1 3.24Å; A818-R822 PolarHBondContact O-N 3.2Å; A819-R822 PolarHBondContact O-N 2.97Å; R822-D824 VanDerWaalsContact C-N 3.32Å; R822-D824 PolarHBondContact O-N 2.82Å; R822-A825 WeakPolarHBondContact O-CB 3.47Å; R822-A825 PolarHBondContact O-N 3.11Å; R822-A825 VanDerWaalsContact O-N 3.17Å; R822-S826 PolarHBondContact O-N 3.44Å; R822-S826 PolarHBondContact O-OG 3.01Å
823	K	85.6	Confident	84.9	Confident	51 Å²	51	53.9 Å²	53.9	22%	0.222	28%	0.282	C	S	.	.	H	α-helix	trans	-55	-47.2	174	-175.7	-154.9	71.5	-179.5	0	111.4	Y737 L741 I744 A819 E820 S826 L827	Y737-K823 HydrophobicContact CD2-CG 3.75Å; Y737-K823 HydrophobicContact CE2-CD 4.21Å; Y737-K823 HydrophobicContact CE2-CG 3.53Å; L741-K823 HydrophobicContact CD2-CD 3.98Å; L741-K823 HydrophobicContact CD2-CG 4.45Å; I744-K823 HydrophobicContact CD1-CB 4.39Å; I744-K823 HydrophobicContact CD1-CD 4.08Å; A819-K823 WeakPolarHBondContact O-CB 3.32Å; A819-K823 PolarHBondContact O-N 3.4Å; E820-K823 WeakPolarHBondContact O-CB 3.23Å; E820-K823 PolarHBondContact O-N 3.49Å; K823-S826 PolarHBondContact O-N 3.16Å; K823-L827 WeakPolarHBondContact O-CG 3.43Å; K823-L827 PolarHBondContact O-N 3.24Å
824	D	81.8	Confident	84.8	Confident	51 Å²	51	53.2 Å²	53.2	27%	0.273	28%	0.278	S	S	.	.	H	α-helix	trans	-68.4	-33.4	179.9	-71.3	-14.3	0	0	0	112.5	E820 E821 R822 R828	E820-D824 PolarHBondContact O-N 2.75Å; E821-D824 PolarHBondContact O-N 3.21Å; R822-D824 VanDerWaalsContact C-N 3.32Å; R822-D824 PolarHBondContact O-N 2.82Å; D824-R828 PolarHBondContact O-N 3.24Å
825	A	82.1	Confident	84.8	Confident	47 Å²	47	49.3 Å²	49.3	39%	0.388	25%	0.251	S	S	.	.	H	α-helix	trans	-65.8	-44.1	173.1	0	0	0	0	0	112.2	E821 R822 R828 S829	E821-A825 WeakPolarHBondContact O-CB 3.28Å; E821-A825 PolarHBondContact O-N 2.65Å; R822-A825 WeakPolarHBondContact O-CB 3.47Å; R822-A825 PolarHBondContact O-N 3.11Å; R822-A825 VanDerWaalsContact O-N 3.17Å; A825-R828 PolarHBondContact O-N 3.22Å; A825-S829 PolarHBondContact O-N 3.38Å
826	S	84.1	Confident	84.5	Confident	4 Å²	4	47.8 Å²	47.8	3%	0.028	25%	0.247	C	C	.	.	H	α-helix	trans	-60.6	-45.1	174.5	-55.8	0	0	0	0	111	R822 K823 R828 S829 I830	R822-S826 PolarHBondContact O-N 3.44Å; R822-S826 PolarHBondContact O-OG 3.01Å; K823-S826 PolarHBondContact O-N 3.16Å; S826-R828 PolarHBondContact O-N 3.39Å; S826-S829 WeakPolarHBondContact O-CB 3.32Å; S826-S829 PolarHBondContact O-N 2.94Å; S826-S829 VanDerWaalsContact O-N 3.13Å; S826-I830 WeakPolarHBondContact O-CG1 3.4Å; S826-I830 PolarHBondContact O-N 3.17Å
827	L	82.2	Confident	84.3	Confident	9 Å²	9	48.8 Å²	48.8	5%	0.047	25%	0.254	C	S	.	.	H	α-helix	trans	-60.4	-40.9	176.9	-70.8	173.9	0	0	0	113.2	I727 Y737 K823 M831	I727-L827 WeakPolarHBondContact O-CD2 3.48Å; Y737-L827 HydrophobicContact CD2-CD2 4.08Å; Y737-L827 HydrophobicContact CD2-CG 4.14Å; Y737-L827 HydrophobicContact CE2-CD1 4.16Å; Y737-L827 HydrophobicContact CE2-CD2 3.66Å; Y737-L827 HydrophobicContact CE2-CG 3.86Å; K823-L827 WeakPolarHBondContact O-CG 3.43Å; K823-L827 PolarHBondContact O-N 3.24Å; L827-M831 PolarHBondContact O-N 2.81Å; L827-M831 VanDerWaalsContact O-N 3.13Å
828	R	77.9	Confident	84.4	Confident	102 Å²	102	46.8 Å²	46.8	39%	0.385	24%	0.242	S	C	.	.	H	α-helix	trans	-64.7	-41	174.4	-78.3	-172.7	-69.7	-98.8	-6	111.8	E651 D824 A825 S826 M831 Q832	E651-R828 IonicContact OE1-CZ 3.64Å; E651-R828 IonicContact OE1-NH1 3.31Å; E651-R828 PolarHBondContact OE1-NH1 3.28Å; E651-R828 IonicContact OE2-NH1 3.72Å; D824-R828 PolarHBondContact O-N 3.24Å; A825-R828 PolarHBondContact O-N 3.22Å; S826-R828 PolarHBondContact O-N 3.39Å; R828-M831 PolarHBondContact O-N 3.47Å; R828-Q832 WeakPolarHBondContact O-CB 3.33Å; R828-Q832 PolarHBondContact O-N 2.73Å
829	S	81.3	Confident	84.2	Confident	71 Å²	71	45.6 Å²	45.6	50%	0.497	23%	0.231	S	C	.	.	H	α-helix	trans	-61.6	-45.6	177.8	-167.6	0	0	0	0	111.9	A825 S826 M831 Q832 H833	A825-S829 PolarHBondContact O-N 3.38Å; S826-S829 WeakPolarHBondContact O-CB 3.32Å; S826-S829 PolarHBondContact O-N 2.94Å; S826-S829 VanDerWaalsContact O-N 3.13Å; S829-M831 PolarHBondContact O-N 3.39Å; S829-Q832 PolarHBondContact O-N 2.67Å; S829-H833 WeakPolarHBondContact O-CB 3.3Å; S829-H833 PolarHBondContact O-N 3.2Å
830	I	82.8	Confident	84.1	Confident	29 Å²	29	52.4 Å²	52.4	15%	0.149	26%	0.263	C	S	.	.	H	α-helix	trans	-59.4	-47.9	176.3	-66.3	164.2	0	0	0	110.8	I727 P729 D734 S826 Q832 H833 I834	I727-I830 HydrophobicContact CG2-CG2 4.35Å; P729-I830 HydrophobicContact CB-CD1 4.27Å; P729-I830 HydrophobicContact CG-CD1 3.82Å; D734-I830 HydrophobicContact CB-CD1 4.14Å; S826-I830 WeakPolarHBondContact O-CG1 3.4Å; S826-I830 PolarHBondContact O-N 3.17Å; I830-Q832 VanDerWaalsContact C-N 3.35Å; I830-Q832 PolarHBondContact O-N 3.17Å; I830-H833 WeakPolarHBondContact O-CB 3.19Å; I830-H833 PolarHBondContact O-N 3.31Å; I830-I834 HydrophobicContact CG2-CD1 4.01Å; I830-I834 WeakPolarHBondContact O-CG1 3.5Å; I830-I834 PolarHBondContact O-N 3Å
831	M	81	Confident	84	Confident	34 Å²	34	50.9 Å²	50.9	17%	0.167	26%	0.257	C	S	.	.	H	α-helix	trans	-59.6	-45	178.3	-176.8	-179.1	67.4	0	0	111.7	S655 L827 R828 S829 H833 I834 F835	S655-M831 PolarHBondContact OG-SD 3.41Å; L827-M831 PolarHBondContact O-N 2.81Å; L827-M831 VanDerWaalsContact O-N 3.13Å; R828-M831 PolarHBondContact O-N 3.47Å; S829-M831 PolarHBondContact O-N 3.39Å; M831-H833 VanDerWaalsContact C-N 3.33Å; M831-H833 PolarHBondContact O-N 3.26Å; M831-I834 PolarHBondContact O-N 3.47Å; M831-F835 HydrophobicContact CE-CE2 4.49Å; M831-F835 HydrophobicContact CG-CD2 4.06Å; M831-F835 HydrophobicContact CG-CE2 3.49Å; M831-F835 VanDerWaalsContact CG-CE2 3.49Å; M831-F835 HydrophobicContact CG-CZ 3.8Å; M831-F835 WeakPolarHBondContact O-CG 3.4Å; M831-F835 PolarHBondContact O-N 3.38Å; M831-F835 VanDerWaalsContact O-N 3.09Å; M831-F835 HydrophobicContact SD-CE2 3.93Å; M831-F835 HydrophobicContact SD-CZ 4.27Å
832	Q	81	Confident	84.1	Confident	78 Å²	78	45.5 Å²	45.5	36%	0.364	23%	0.231	S	C	.	.	H	α-helix	trans	-62.7	-40.2	176.6	-172.8	178.3	13.6	0	0	111.7	R828 S829 I830 F835 S836	R828-Q832 WeakPolarHBondContact O-CB 3.33Å; R828-Q832 PolarHBondContact O-N 2.73Å; S829-Q832 PolarHBondContact O-N 2.67Å; I830-Q832 VanDerWaalsContact C-N 3.35Å; I830-Q832 PolarHBondContact O-N 3.17Å; Q832-F835 PolarHBondContact O-N 3.14Å; Q832-S836 VanDerWaalsContact O-CB 3.29Å; Q832-S836 WeakPolarHBondContact O-CB 3.09Å; Q832-S836 PolarHBondContact O-N 2.9Å
833	H	83.5	Confident	84.1	Confident	121 Å²	121	44.7 Å²	44.7	56%	0.56	24%	0.238	S	C	*	.	H	α-helix	trans	-62.9	-42.9	177	-175.5	57.1	0	0	0	112.1	S829 I830 M831 S836 S837	S829-H833 WeakPolarHBondContact O-CB 3.3Å; S829-H833 PolarHBondContact O-N 3.2Å; I830-H833 WeakPolarHBondContact O-CB 3.19Å; I830-H833 PolarHBondContact O-N 3.31Å; M831-H833 VanDerWaalsContact C-N 3.33Å; M831-H833 PolarHBondContact O-N 3.26Å; H833-S836 PolarHBondContact O-N 3.19Å; H833-S837 WeakPolarHBondContact O-CB 3.37Å; H833-S837 PolarHBondContact O-N 3.41Å
834	I	85.5	Confident	84.4	Confident	16 Å²	16	45.8 Å²	45.8	8%	0.082	24%	0.243	C	C	.	.	H	α-helix	trans	-61.1	-47.2	176.2	-69.7	169.2	0	0	0	110.9	F662 F712 F716 I727 I830 M831 S837 F838	F662-I834 HydrophobicContact CE1-CG2 3.91Å; F662-I834 HydrophobicContact CZ-CG2 3.89Å; F712-I834 HydrophobicContact CD1-CG2 4.16Å; F712-I834 HydrophobicContact CE1-CG2 4.39Å; F716-I834 HydrophobicContact CD1-CD1 4.4Å; I727-I834 HydrophobicContact CD1-CD1 3.6Å; I727-I834 HydrophobicContact CG2-CD1 4.01Å; I830-I834 HydrophobicContact CG2-CD1 4.01Å; I830-I834 WeakPolarHBondContact O-CG1 3.5Å; I830-I834 PolarHBondContact O-N 3Å; M831-I834 PolarHBondContact O-N 3.47Å; I834-S837 PolarHBondContact O-N 3.4Å; I834-F838 PolarHBondContact O-N 2.97Å
835	F	87.1	Confident	84.9	Confident	3 Å²	3	43.3 Å²	43.3	1%	0.013	23%	0.23	C	C	.	.	H	α-helix	trans	-67.3	-36.4	178	-63.1	-25.1	0	0	0	112.6	I630 L633 G634 F662 M831 Q832 F838 S839	I630-F835 HydrophobicContact CG2-CB 4.43Å; I630-F835 HydrophobicContact CG2-CD1 4.19Å; I630-F835 HydrophobicContact CG2-CG 4.48Å; L633-F835 HydrophobicContact CB-CD2 3.59Å; L633-F835 HydrophobicContact CB-CE2 4.05Å; L633-F835 HydrophobicContact CB-CG 4.27Å; L633-F835 HydrophobicContact CD1-CD2 4.43Å; L633-F835 HydrophobicContact CD1-CE2 4.11Å; G634-F835 VanDerWaalsContact CA-CB 3.44Å; F662-F835 HydrophobicContact CB-CE1 3.75Å; F662-F835 HydrophobicContact CB-CZ 4.36Å; F662-F835 HydrophobicContact CD1-CD1 4.48Å; F662-F835 AromaticContact CD1-CE1 3.88Å; F662-F835 HydrophobicContact CD1-CE1 3.88Å; F662-F835 AromaticContact CD2-CD1 3.76Å; F662-F835 HydrophobicContact CD2-CD1 3.76Å; F662-F835 AromaticContact CD2-CE1 3.67Å; F662-F835 HydrophobicContact CD2-CE1 3.67Å; F662-F835 HydrophobicContact CE1-CE1 4.38Å; F662-F835 AromaticContact CE2-CD1 3.94Å; F662-F835 HydrophobicContact CE2-CD1 3.94Å; F662-F835 HydrophobicContact CE2-CE1 4.22Å; F662-F835 HydrophobicContact CG-CD1 4.07Å; F662-F835 AromaticContact CG-CE1 3.49Å; F662-F835 HydrophobicContact CG-CE1 3.49Å; F662-F835 VanDerWaalsContact CG-CE1 3.49Å; F662-F835 HydrophobicContact CZ-CD1 4.37Å; M831-F835 HydrophobicContact CE-CE2 4.49Å; M831-F835 HydrophobicContact CG-CD2 4.06Å; M831-F835 HydrophobicContact CG-CE2 3.49Å; M831-F835 VanDerWaalsContact CG-CE2 3.49Å; M831-F835 HydrophobicContact CG-CZ 3.8Å; M831-F835 WeakPolarHBondContact O-CG 3.4Å; M831-F835 PolarHBondContact O-N 3.38Å; M831-F835 VanDerWaalsContact O-N 3.09Å; M831-F835 HydrophobicContact SD-CE2 3.93Å; M831-F835 HydrophobicContact SD-CZ 4.27Å; Q832-F835 PolarHBondContact O-N 3.14Å; F835-F838 PolarHBondContact O-N 3.39Å; F835-S839 VanDerWaalsContact O-CB 3.26Å; F835-S839 WeakPolarHBondContact O-CB 3.32Å; F835-S839 PolarHBondContact O-N 2.98Å
836	S	84.3	Confident	85.4	Confident	31 Å²	31	43.9 Å²	43.9	22%	0.217	22%	0.224	C	C	.	.	H	α-helix	trans	-61.7	-46.1	173.3	-175.3	0	0	0	0	111.1	G634 Q832 H833 F838 S839 E840	G634-S836 WeakPolarHBondContact O-CB 3.34Å; Q832-S836 VanDerWaalsContact O-CB 3.29Å; Q832-S836 WeakPolarHBondContact O-CB 3.09Å; Q832-S836 PolarHBondContact O-N 2.9Å; H833-S836 PolarHBondContact O-N 3.19Å; S836-F838 VanDerWaalsContact C-N 3.31Å; S836-F838 PolarHBondContact O-N 3.27Å; S836-S839 VanDerWaalsContact O-CB 3.31Å; S836-S839 WeakPolarHBondContact O-CB 3.49Å; S836-S839 PolarHBondContact O-N 3.37Å; S836-S839 VanDerWaalsContact O-N 3.15Å; S836-E840 WeakPolarHBondContact O-CG 3.29Å; S836-E840 PolarHBondContact O-N 3.46Å
837	S	85.9	Confident	85.8	Confident	22 Å²	22	47.7 Å²	47.7	15%	0.154	24%	0.243	C	C	.	.	H	α-helix	trans	-62.6	-37.7	176.9	179.5	0	0	0	0	112.2	H833 I834	H833-S837 WeakPolarHBondContact O-CB 3.37Å; H833-S837 PolarHBondContact O-N 3.41Å; I834-S837 PolarHBondContact O-N 3.4Å
838	F	88.8	Confident	86.5	Confident	1 Å²	1	47.2 Å²	47.2	0%	0.004	24%	0.241	C	C	.	.	H	α-helix	trans	-64	-43.7	173.1	-178.3	-88.1	0	0	0	111.7	I630 F662 T665 L666 F669 F712 I834 F835 S836 E840 S841 W845	I630-F838 HydrophobicContact CB-CD1 4.17Å; I630-F838 HydrophobicContact CB-CE1 4.22Å; I630-F838 HydrophobicContact CD1-CE1 4.24Å; I630-F838 HydrophobicContact CG2-CB 4.33Å; I630-F838 HydrophobicContact CG2-CD1 3.4Å; I630-F838 HydrophobicContact CG2-CE1 3.91Å; I630-F838 HydrophobicContact CG2-CG 4.02Å; F662-F838 HydrophobicContact CE2-CB 3.89Å; F662-F838 HydrophobicContact CE2-CD1 4.4Å; F662-F838 AromaticContact CE2-CD2 3.67Å; F662-F838 HydrophobicContact CE2-CD2 3.67Å; F662-F838 HydrophobicContact CE2-CE2 4.3Å; F662-F838 AromaticContact CE2-CG 3.73Å; F662-F838 HydrophobicContact CE2-CG 3.73Å; F662-F838 HydrophobicContact CZ-CB 4.35Å; F662-F838 HydrophobicContact CZ-CD2 4.17Å; F662-F838 HydrophobicContact CZ-CG 4.45Å; T665-F838 HydrophobicContact CG2-CZ 3.82Å; L666-F838 HydrophobicContact CD2-CD2 4.23Å; L666-F838 HydrophobicContact CD2-CE2 3.95Å; F669-F838 HydrophobicContact CE2-CZ 4.33Å; F712-F838 HydrophobicContact CD2-CD2 4.18Å; F712-F838 HydrophobicContact CE1-CB 4.2Å; F712-F838 HydrophobicContact CE2-CB 4.33Å; F712-F838 AromaticContact CE2-CD2 4Å; F712-F838 HydrophobicContact CE2-CD2 4Å; F712-F838 HydrophobicContact CZ-CB 3.9Å; F712-F838 HydrophobicContact CZ-CD2 4.41Å; I834-F838 PolarHBondContact O-N 2.97Å; F835-F838 PolarHBondContact O-N 3.39Å; S836-F838 VanDerWaalsContact C-N 3.31Å; S836-F838 PolarHBondContact O-N 3.27Å; F838-E840 VanDerWaalsContact C-N 3.33Å; F838-E840 PolarHBondContact O-N 2.99Å; F838-S841 PolarHBondContact O-N 3.37Å; F838-S841 VanDerWaalsContact O-N 3.13Å; F838-W845 AromaticContact CD1-NE1 3.95Å; F838-W845 AromaticContact CD2-CE2 3.88Å; F838-W845 AromaticContact CD2-CZ2 3.86Å; F838-W845 HydrophobicContact CD2-CZ2 3.86Å; F838-W845 AromaticContact CD2-NE1 3.69Å; F838-W845 AromaticContact CE1-CD1 3.71Å; F838-W845 HydrophobicContact CE1-CG 4.34Å; F838-W845 AromaticContact CE1-NE1 3.74Å; F838-W845 HydrophobicContact CE2-CD2 4.01Å; F838-W845 AromaticContact CE2-CE2 3.39Å; F838-W845 HydrophobicContact CE2-CG 4.46Å; F838-W845 HydrophobicContact CE2-CH2 4.21Å; F838-W845 AromaticContact CE2-CZ2 3.52Å; F838-W845 HydrophobicContact CE2-CZ2 3.52Å; F838-W845 AromaticContact CE2-NE1 3.46Å; F838-W845 AromaticContact CG-NE1 3.93Å; F838-W845 AromaticContact CZ-CD1 3.65Å; F838-W845 AromaticContact CZ-CD2 3.92Å; F838-W845 HydrophobicContact CZ-CD2 3.92Å; F838-W845 AromaticContact CZ-CE2 3.68Å; F838-W845 AromaticContact CZ-CG 3.94Å; F838-W845 HydrophobicContact CZ-CG 3.94Å; F838-W845 HydrophobicContact CZ-CZ2 4.28Å; F838-W845 AromaticContact CZ-NE1 3.49Å; F838-W845 PolarHBondContact O-NE1 3.36Å; F838-W845 VanDerWaalsContact O-NE1 3.15Å
839	S	84.5	Confident	87.3	Confident	17 Å²	17	42.6 Å²	42.6	12%	0.119	22%	0.223	C	C	.	.	H	α-helix	trans	-61.9	-35.1	-179.8	-179.5	0	0	0	0	113.2	H631 F835 S836 S841 F842	H631-S839 PolarHBondContact CE1-OG 2.59Å; H631-S839 VanDerWaalsContact CE1-OG 3.31Å; H631-S839 PolarHBondContact ND1-OG 3.24Å; F835-S839 VanDerWaalsContact O-CB 3.26Å; F835-S839 WeakPolarHBondContact O-CB 3.32Å; F835-S839 PolarHBondContact O-N 2.98Å; S836-S839 VanDerWaalsContact O-CB 3.31Å; S836-S839 WeakPolarHBondContact O-CB 3.49Å; S836-S839 PolarHBondContact O-N 3.37Å; S836-S839 VanDerWaalsContact O-N 3.15Å; S839-S841 PolarHBondContact O-N 2.9Å; S839-S841 VanDerWaalsContact O-N 3.11Å; S839-F842 VanDerWaalsContact O-CB 3.27Å; S839-F842 WeakPolarHBondContact O-CB 3.16Å; S839-F842 PolarHBondContact O-N 2.98Å
840	E	85.6	Confident	87.9	Confident	144 Å²	144	40.9 Å²	40.9	67%	0.673	21%	0.211	S	C	*	.	H	α-helix	trans	-57.6	-27.5	174.6	-73.5	167.7	-168.1	0	0	112.9	S836 F838	S836-E840 WeakPolarHBondContact O-CG 3.29Å; S836-E840 PolarHBondContact O-N 3.46Å; F838-E840 VanDerWaalsContact C-N 3.33Å; F838-E840 PolarHBondContact O-N 2.99Å
841	S	86.5	Confident	88.5	Confident	12 Å²	12	39.8 Å²	39.8	8%	0.084	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	15.6	179.2	-57.6	0	0	0	0	113.7	K708 F838 S839 T843 H844 W845	K708-S841 PolarHBondContact NZ-OG 2.97Å; F838-S841 PolarHBondContact O-N 3.37Å; F838-S841 VanDerWaalsContact O-N 3.13Å; S839-S841 PolarHBondContact O-N 2.9Å; S839-S841 VanDerWaalsContact O-N 3.11Å; S841-T843 VanDerWaalsContact C-N 3.25Å; S841-T843 PolarHBondContact O-N 3.25Å; S841-T843 VanDerWaalsContact O-N 3.12Å; S841-H844 PolarHBondContact O-N 3.47Å; S841-W845 VanDerWaalsContact C-CD1 3.49Å; S841-W845 PolarHBondContact O-N 3.5Å
842	F	87.1	Confident	89.3	Confident	14 Å²	14	38.2 Å²	38.2	6%	0.061	20%	0.198	C	C	.	.	H	α-helix	trans	-48	-44.7	-175.2	-166.5	-76.7	0	0	0	113.6	L505 F507 I627 H631 S839 H844 W845 H846	L505-F842 HydrophobicContact CD2-CD2 4.36Å; L505-F842 HydrophobicContact CD2-CE2 3.82Å; L505-F842 HydrophobicContact CD2-CZ 4.11Å; F507-F842 HydrophobicContact CD2-CE1 4.29Å; F507-F842 HydrophobicContact CE1-CD1 4Å; F507-F842 AromaticContact CE1-CE1 3.97Å; F507-F842 HydrophobicContact CE1-CE1 3.97Å; F507-F842 HydrophobicContact CE2-CD1 4.04Å; F507-F842 AromaticContact CE2-CE1 3.17Å; F507-F842 HydrophobicContact CE2-CE1 3.17Å; F507-F842 AromaticContact CE2-CZ 3.75Å; F507-F842 HydrophobicContact CE2-CZ 3.75Å; F507-F842 AromaticContact CZ-CD1 3.39Å; F507-F842 HydrophobicContact CZ-CD1 3.39Å; F507-F842 AromaticContact CZ-CE1 3Å; F507-F842 HydrophobicContact CZ-CE1 3Å; F507-F842 AromaticContact CZ-CZ 3.99Å; F507-F842 HydrophobicContact CZ-CZ 3.99Å; I627-F842 HydrophobicContact CB-CE2 4.04Å; I627-F842 HydrophobicContact CB-CZ 4.33Å; I627-F842 HydrophobicContact CD1-CE1 4.08Å; I627-F842 HydrophobicContact CD1-CE2 4.29Å; I627-F842 HydrophobicContact CD1-CZ 3.71Å; I627-F842 HydrophobicContact CG1-CE2 3.97Å; I627-F842 HydrophobicContact CG1-CZ 3.78Å; H631-F842 HydrophobicContact CB-CD2 3.86Å; H631-F842 HydrophobicContact CB-CE2 3.95Å; H631-F842 AromaticContact ND1-CD2 3.82Å; S839-F842 VanDerWaalsContact O-CB 3.27Å; S839-F842 WeakPolarHBondContact O-CB 3.16Å; S839-F842 PolarHBondContact O-N 2.98Å; F842-H844 VanDerWaalsContact C-N 3.3Å; F842-H844 PolarHBondContact O-N 3.33Å; F842-W845 PolarHBondContact O-N 3.47Å; F842-H846 HydrophobicContact CD1-CB 4.21Å; F842-H846 HydrophobicContact CE1-CB 3.93Å; F842-H846 WeakPolarHBondContact O-CB 3.31Å; F842-H846 PolarHBondContact O-N 3.22Å
843	T	87.5	Confident	90	Very high	82 Å²	82	34.7 Å²	34.7	50%	0.503	18%	0.183	S	C	.	.	H	α-helix	trans	-57.7	-41.8	-178.6	52.6	0	0	0	0	112.5	S841 H846 M847	S841-T843 VanDerWaalsContact C-N 3.25Å; S841-T843 PolarHBondContact O-N 3.25Å; S841-T843 VanDerWaalsContact O-N 3.12Å; T843-H846 PolarHBondContact O-N 3.49Å; T843-M847 WeakPolarHBondContact O-CB 3.18Å; T843-M847 VanDerWaalsContact O-CG 3.25Å; T843-M847 WeakPolarHBondContact O-CG 3.4Å; T843-M847 PolarHBondContact O-N 3.28Å
844	H	91.2	Very high	90.6	Very high	73 Å²	73	31.6 Å²	31.6	34%	0.338	17%	0.169	S	C	.	.	H	α-helix	trans	-68.9	-42	178.7	-61.4	78.8	0	0	0	110.9	P703 I705 S841 F842 H846 M847 A848	P703-H844 HydrophobicContact CB-CB 4.31Å; P703-H844 HydrophobicContact CG-CB 4.42Å; P703-H844 WeakPolarHBondContact CG-O 3.33Å; I705-H844 HydrophobicContact CG2-CB 4.41Å; S841-H844 PolarHBondContact O-N 3.47Å; F842-H844 VanDerWaalsContact C-N 3.3Å; F842-H844 PolarHBondContact O-N 3.33Å; H844-H846 PolarHBondContact O-N 2.81Å; H844-M847 PolarHBondContact O-N 3.07Å; H844-A848 PolarHBondContact O-N 2.92Å
845	W	93.7	Very high	91.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.4	-43.8	176.1	-57	128.7	0	0	0	111.9	I627 F669 I705 K708 I709 F712 F838 S841 F842 A848 M849	I627-W845 HydrophobicContact CG2-CB 4.04Å; F669-W845 HydrophobicContact CB-CE3 4.3Å; F669-W845 HydrophobicContact CB-CZ3 3.95Å; F669-W845 AromaticContact CD1-CE3 3.85Å; F669-W845 HydrophobicContact CD1-CE3 3.85Å; F669-W845 HydrophobicContact CD1-CZ3 4.31Å; F669-W845 HydrophobicContact CD2-CD2 4.29Å; F669-W845 AromaticContact CD2-CE3 3.58Å; F669-W845 HydrophobicContact CD2-CE3 3.58Å; F669-W845 AromaticContact CD2-CZ3 3.94Å; F669-W845 HydrophobicContact CD2-CZ3 3.94Å; F669-W845 HydrophobicContact CE1-CB 4.33Å; F669-W845 HydrophobicContact CE1-CE3 4.04Å; F669-W845 WeakPolarHBondContact CE1-O 3.2Å; F669-W845 HydrophobicContact CE2-CB 4.05Å; F669-W845 HydrophobicContact CE2-CD2 4.15Å; F669-W845 AromaticContact CE2-CE3 3.78Å; F669-W845 HydrophobicContact CE2-CE3 3.78Å; F669-W845 HydrophobicContact CE2-CG 4.28Å; F669-W845 AromaticContact CG-CE3 3.64Å; F669-W845 HydrophobicContact CG-CE3 3.64Å; F669-W845 AromaticContact CG-CZ3 3.81Å; F669-W845 HydrophobicContact CG-CZ3 3.81Å; F669-W845 HydrophobicContact CZ-CB 3.7Å; F669-W845 HydrophobicContact CZ-CD2 4.44Å; F669-W845 HydrophobicContact CZ-CE3 4.02Å; F669-W845 HydrophobicContact CZ-CG 4.36Å; I705-W845 HydrophobicContact CB-CE3 4.43Å; I705-W845 HydrophobicContact CB-CH2 4.28Å; I705-W845 HydrophobicContact CB-CZ3 3.75Å; I705-W845 HydrophobicContact CD1-CE3 4.39Å; I705-W845 HydrophobicContact CD1-CZ3 4.01Å; I705-W845 HydrophobicContact CG1-CZ3 4.38Å; I705-W845 HydrophobicContact CG2-CE3 4.11Å; I705-W845 HydrophobicContact CG2-CZ3 3.92Å; K708-W845 HydrophobicContact CB-CH2 3.99Å; K708-W845 HydrophobicContact CB-CZ2 4.11Å; K708-W845 HydrophobicContact CD-CZ2 4.46Å; I709-W845 HydrophobicContact CD1-CZ3 4.48Å; I709-W845 HydrophobicContact CG1-CH2 3.9Å; I709-W845 HydrophobicContact CG1-CZ3 4.02Å; F712-W845 HydrophobicContact CE2-CZ2 4.31Å; F838-W845 AromaticContact CD1-NE1 3.95Å; F838-W845 AromaticContact CD2-CE2 3.88Å; F838-W845 AromaticContact CD2-CZ2 3.86Å; F838-W845 HydrophobicContact CD2-CZ2 3.86Å; F838-W845 AromaticContact CD2-NE1 3.69Å; F838-W845 AromaticContact CE1-CD1 3.71Å; F838-W845 HydrophobicContact CE1-CG 4.34Å; F838-W845 AromaticContact CE1-NE1 3.74Å; F838-W845 HydrophobicContact CE2-CD2 4.01Å; F838-W845 AromaticContact CE2-CE2 3.39Å; F838-W845 HydrophobicContact CE2-CG 4.46Å; F838-W845 HydrophobicContact CE2-CH2 4.21Å; F838-W845 AromaticContact CE2-CZ2 3.52Å; F838-W845 HydrophobicContact CE2-CZ2 3.52Å; F838-W845 AromaticContact CE2-NE1 3.46Å; F838-W845 AromaticContact CG-NE1 3.93Å; F838-W845 AromaticContact CZ-CD1 3.65Å; F838-W845 AromaticContact CZ-CD2 3.92Å; F838-W845 HydrophobicContact CZ-CD2 3.92Å; F838-W845 AromaticContact CZ-CE2 3.68Å; F838-W845 AromaticContact CZ-CG 3.94Å; F838-W845 HydrophobicContact CZ-CG 3.94Å; F838-W845 HydrophobicContact CZ-CZ2 4.28Å; F838-W845 AromaticContact CZ-NE1 3.49Å; F838-W845 PolarHBondContact O-NE1 3.36Å; F838-W845 VanDerWaalsContact O-NE1 3.15Å; S841-W845 VanDerWaalsContact C-CD1 3.49Å; S841-W845 PolarHBondContact O-N 3.5Å; F842-W845 PolarHBondContact O-N 3.47Å; W845-A848 PolarHBondContact O-N 2.88Å; W845-M849 WeakPolarHBondContact O-CB 3.43Å; W845-M849 PolarHBondContact O-N 3.4Å
846	H	91.6	Very high	91.6	Very high	58 Å²	58	30.7 Å²	30.7	27%	0.269	16%	0.164	S	C	.	.	H	α-helix	trans	-64.5	-41.6	177.2	-173.5	-81.4	0	0	0	112	F507 I627 F842 T843 H844 M849 S850	F507-H846 AromaticContact CE2-CD2 3.71Å; I627-H846 HydrophobicContact CD1-CB 4.36Å; F842-H846 HydrophobicContact CD1-CB 4.21Å; F842-H846 HydrophobicContact CE1-CB 3.93Å; F842-H846 WeakPolarHBondContact O-CB 3.31Å; F842-H846 PolarHBondContact O-N 3.22Å; T843-H846 PolarHBondContact O-N 3.49Å; H844-H846 PolarHBondContact O-N 2.81Å; H846-M849 PolarHBondContact O-N 3.2Å; H846-S850 PolarHBondContact CE1-OG 3.39Å; H846-S850 PolarHBondContact ND1-OG 3.45Å; H846-S850 WeakPolarHBondContact O-CB 3.49Å; H846-S850 PolarHBondContact O-N 3.01Å; H846-S850 PolarHBondContact O-OG 3.29Å
847	M	93.5	Very high	92.2	Very high	84 Å²	84	29.2 Å²	29.2	41%	0.414	15%	0.154	S	C	.	.	H	α-helix	trans	-62.3	-44.6	175.8	-76.9	176.1	67.7	0	0	112.3	T696 P703 T843 H844 S850 C851	T696-M847 HydrophobicContact CG2-CE 4.45Å; P703-M847 HydrophobicContact CG-CB 3.94Å; T843-M847 WeakPolarHBondContact O-CB 3.18Å; T843-M847 VanDerWaalsContact O-CG 3.25Å; T843-M847 WeakPolarHBondContact O-CG 3.4Å; T843-M847 PolarHBondContact O-N 3.28Å; H844-M847 PolarHBondContact O-N 3.07Å; M847-S850 PolarHBondContact O-N 3.37Å; M847-C851 PolarHBondContact O-N 2.99Å; M847-C851 PolarHBondContact O-SG 2.87Å
848	A	95.4	Very high	92.7	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60	-48.8	175.7	0	0	0	0	0	111.5	F669 F702 P703 I705 H844 W845 S850 C851 L852	F669-A848 HydrophobicContact CD1-CB 4.26Å; F669-A848 HydrophobicContact CE1-CB 4.04Å; F702-A848 HydrophobicContact CD2-CB 4.38Å; F702-A848 HydrophobicContact CE1-CB 4.49Å; F702-A848 HydrophobicContact CE2-CB 3.7Å; F702-A848 HydrophobicContact CZ-CB 3.78Å; P703-A848 HydrophobicContact CG-CB 3.92Å; I705-A848 HydrophobicContact CD1-CB 4.12Å; H844-A848 PolarHBondContact O-N 2.92Å; W845-A848 PolarHBondContact O-N 2.88Å; A848-S850 VanDerWaalsContact C-N 3.33Å; A848-S850 PolarHBondContact O-N 2.77Å; A848-C851 PolarHBondContact O-N 3.22Å; A848-L852 VanDerWaalsContact O-CD1 3.31Å; A848-L852 WeakPolarHBondContact O-CD1 3.33Å; A848-L852 PolarHBondContact O-N 3.24Å
849	M	94.7	Very high	93	Very high	5 Å²	5	28.3 Å²	28.3	3%	0.025	15%	0.147	C	C	.	.	H	α-helix	trans	-58.9	-42.9	176.3	177.6	-82.9	-63.8	0	0	111.8	F574 L623 E624 I627 F669 W845 H846 C851 L852 A853	F574-M849 HydrophobicContact CB-SD 3.88Å; F574-M849 HydrophobicContact CD1-CG 4.25Å; F574-M849 HydrophobicContact CD2-CG 4.17Å; F574-M849 HydrophobicContact CD2-SD 4.12Å; F574-M849 HydrophobicContact CE2-CG 4.44Å; F574-M849 HydrophobicContact CG-CG 4.06Å; F574-M849 HydrophobicContact CG-SD 3.99Å; L623-M849 HydrophobicContact CB-CG 4.28Å; E624-M849 HydrophobicContact CB-CE 3.99Å; E624-M849 HydrophobicContact CB-CG 4.4Å; E624-M849 HydrophobicContact CB-SD 4.09Å; E624-M849 HydrophobicContact CG-CE 3.81Å; E624-M849 HydrophobicContact CG-SD 4.38Å; I627-M849 HydrophobicContact CD1-CE 4.39Å; F669-M849 HydrophobicContact CE1-CB 4.48Å; W845-M849 WeakPolarHBondContact O-CB 3.43Å; W845-M849 PolarHBondContact O-N 3.4Å; H846-M849 PolarHBondContact O-N 3.2Å; M849-C851 VanDerWaalsContact C-N 3.34Å; M849-C851 PolarHBondContact O-N 3.38Å; M849-L852 PolarHBondContact O-N 3.27Å; M849-L852 VanDerWaalsContact O-N 3.15Å; M849-A853 PolarHBondContact O-N 2.89Å
850	S	94.8	Very high	93.6	Very high	34 Å²	34	27.5 Å²	27.5	24%	0.238	14%	0.141	C	C	.	.	H	α-helix	trans	-61.2	-42.2	178.3	-57.9	0	0	0	0	111.8	H846 M847 A848 L852 A853 E854	H846-S850 PolarHBondContact CE1-OG 3.39Å; H846-S850 PolarHBondContact ND1-OG 3.45Å; H846-S850 WeakPolarHBondContact O-CB 3.49Å; H846-S850 PolarHBondContact O-N 3.01Å; H846-S850 PolarHBondContact O-OG 3.29Å; M847-S850 PolarHBondContact O-N 3.37Å; A848-S850 VanDerWaalsContact C-N 3.33Å; A848-S850 PolarHBondContact O-N 2.77Å; S850-L852 VanDerWaalsContact C-N 3.31Å; S850-L852 PolarHBondContact O-N 2.89Å; S850-A853 WeakPolarHBondContact O-CB 3.41Å; S850-A853 PolarHBondContact O-N 3.49Å; S850-E854 WeakPolarHBondContact O-CG 3.37Å; S850-E854 PolarHBondContact O-N 3.22Å
851	C	96	Very high	94.1	Very high	7 Å²	7	20.6 Å²	20.6	5%	0.047	11%	0.109	C	C	.	.	H	α-helix	trans	-61.6	-39	175.9	-66.1	0	0	0	0	112.1	F702 M847 A848 M849 L855	F702-C851 HydrophobicContact CD2-CB 3.9Å; M847-C851 PolarHBondContact O-N 2.99Å; M847-C851 PolarHBondContact O-SG 2.87Å; A848-C851 PolarHBondContact O-N 3.22Å; M849-C851 VanDerWaalsContact C-N 3.34Å; M849-C851 PolarHBondContact O-N 3.38Å; C851-L855 WeakPolarHBondContact O-CB 3.27Å; C851-L855 PolarHBondContact O-N 2.96Å
852	L	96.1	Very high	94.5	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-70.6	-38.9	175.3	-73.6	137.9	0	0	0	112.5	F574 L617 L620 S672 I675 F702 A848 M849 S850 E854 L855 D856	F574-L852 HydrophobicContact CE2-CB 3.81Å; F574-L852 HydrophobicContact CZ-CB 4.33Å; L617-L852 HydrophobicContact CD2-CD2 4.01Å; L620-L852 HydrophobicContact CD1-CD2 4.23Å; S672-L852 VanDerWaalsContact CB-CD1 3.43Å; S672-L852 VanDerWaalsContact OG-CD1 3.25Å; S672-L852 WeakPolarHBondContact OG-CD1 3.43Å; I675-L852 HydrophobicContact CD1-CD2 4.46Å; I675-L852 HydrophobicContact CG2-CD2 4.37Å; F702-L852 HydrophobicContact CE2-CD1 4.26Å; A848-L852 VanDerWaalsContact O-CD1 3.31Å; A848-L852 WeakPolarHBondContact O-CD1 3.33Å; A848-L852 PolarHBondContact O-N 3.24Å; M849-L852 PolarHBondContact O-N 3.27Å; M849-L852 VanDerWaalsContact O-N 3.15Å; S850-L852 VanDerWaalsContact C-N 3.31Å; S850-L852 PolarHBondContact O-N 2.89Å; L852-E854 VanDerWaalsContact C-N 3.31Å; L852-E854 PolarHBondContact O-N 3.3Å; L852-L855 PolarHBondContact O-N 3.48Å; L852-D856 WeakPolarHBondContact O-CB 3.45Å; L852-D856 PolarHBondContact O-N 3.28Å
853	A	95.9	Very high	94.9	Very high	5 Å²	5	21.1 Å²	21.1	4%	0.041	11%	0.111	C	C	.	.	H	α-helix	trans	-57.6	-48	175.9	0	0	0	0	0	110.3	F574 L578 M849 S850 C857	F574-A853 HydrophobicContact CD2-CB 3.65Å; F574-A853 HydrophobicContact CE2-CB 4.35Å; L578-A853 HydrophobicContact CB-CB 4.44Å; L578-A853 HydrophobicContact CD2-CB 3.72Å; M849-A853 PolarHBondContact O-N 2.89Å; S850-A853 WeakPolarHBondContact O-CB 3.41Å; S850-A853 PolarHBondContact O-N 3.49Å; A853-C857 PolarHBondContact O-N 2.99Å; A853-C857 PolarHBondContact O-SG 3.15Å
854	E	96.7	Very high	95.2	Very high	56 Å²	56	17.5 Å²	17.5	26%	0.262	9%	0.088	S	C	.	.	H	α-helix	trans	-63.5	-45.7	176.7	-71.5	-172.5	-145.9	0	0	111.6	L578 W582 Y688 L692 S850 L852 D856 C857 I858	L578-E854 HydrophobicContact CD2-CB 4.47Å; L578-E854 HydrophobicContact CD2-CG 3.8Å; W582-E854 HydrophobicContact CZ2-CB 4.49Å; W582-E854 HydrophobicContact CZ2-CG 4.11Å; Y688-E854 PolarHBondContact OH-OE2 2.91Å; L692-E854 HydrophobicContact CD1-CB 4.11Å; L692-E854 HydrophobicContact CD2-CB 4.2Å; S850-E854 WeakPolarHBondContact O-CG 3.37Å; S850-E854 PolarHBondContact O-N 3.22Å; L852-E854 VanDerWaalsContact C-N 3.31Å; L852-E854 PolarHBondContact O-N 3.3Å; E854-D856 PolarHBondContact O-N 3.07Å; E854-C857 PolarHBondContact O-N 3.47Å; E854-I858 VanDerWaalsContact O-CG1 3.31Å; E854-I858 WeakPolarHBondContact O-CG1 3.45Å; E854-I858 PolarHBondContact O-N 3.2Å
855	L	96.5	Very high	95.4	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-58	-47.4	177.3	175.4	64.6	0	0	0	112.2	I675 I676 I679 L689 C851 L852 C857 I858 I859	I675-L855 HydrophobicContact CG2-CD2 4.28Å; I676-L855 HydrophobicContact CD1-CD2 4.03Å; I679-L855 HydrophobicContact CD1-CD1 4.16Å; I679-L855 HydrophobicContact CD1-CD2 3.48Å; I679-L855 VanDerWaalsContact CD1-CD2 3.48Å; I679-L855 HydrophobicContact CD1-CG 4.39Å; L689-L855 HydrophobicContact CD1-CD1 3.77Å; C851-L855 WeakPolarHBondContact O-CB 3.27Å; C851-L855 PolarHBondContact O-N 2.96Å; L852-L855 PolarHBondContact O-N 3.48Å; L855-C857 VanDerWaalsContact C-N 3.34Å; L855-C857 PolarHBondContact O-N 3.4Å; L855-I858 PolarHBondContact O-N 3.26Å; L855-I859 HydrophobicContact CD1-CD1 4.14Å; L855-I859 HydrophobicContact CD1-CG1 4.42Å; L855-I859 HydrophobicContact CG-CD1 3.98Å; L855-I859 WeakPolarHBondContact O-CG1 3.32Å; L855-I859 PolarHBondContact O-N 3.43Å
856	D	96.5	Very high	95.3	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-63.8	-39.1	179.1	-168.7	23.7	0	0	0	111.4	C570 C571 T572 L852 E854 I858 I859 A860	C570-D856 WeakPolarHBondContact CA-OD1 3.33Å; C570-D856 WeakPolarHBondContact CB-OD2 3.12Å; C571-D856 PolarHBondContact N-OD1 3.07Å; C571-D856 PolarHBondContact N-OD2 3.08Å; T572-D856 WeakPolarHBondContact CB-OD2 3.23Å; T572-D856 PolarHBondContact N-OD2 2.87Å; T572-D856 PolarHBondContact OG1-OD2 3.3Å; L852-D856 WeakPolarHBondContact O-CB 3.45Å; L852-D856 PolarHBondContact O-N 3.28Å; E854-D856 PolarHBondContact O-N 3.07Å; D856-I858 PolarHBondContact O-N 3.46Å; D856-I859 PolarHBondContact O-N 3.1Å; D856-A860 PolarHBondContact O-N 3.25Å
857	C	97	Very high	95.2	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-62.1	-43.1	173.1	-66.9	0	0	0	0	112.2	G575 L579 W582 A853 E854 L855 I859 A860 L861	G575-C857 PolarHBondContact O-SG 3.3Å; L579-C857 PolarHBondContact N-SG 3.21Å; W582-C857 HydrophobicContact CD2-CB 4.43Å; W582-C857 HydrophobicContact CE3-CB 3.75Å; W582-C857 HydrophobicContact CH2-CB 3.69Å; W582-C857 HydrophobicContact CZ2-CB 4.37Å; W582-C857 HydrophobicContact CZ3-CB 3.33Å; A853-C857 PolarHBondContact O-N 2.99Å; A853-C857 PolarHBondContact O-SG 3.15Å; E854-C857 PolarHBondContact O-N 3.47Å; L855-C857 VanDerWaalsContact C-N 3.34Å; L855-C857 PolarHBondContact O-N 3.4Å; C857-I859 VanDerWaalsContact C-N 3.34Å; C857-A860 PolarHBondContact O-N 3.34Å; C857-L861 WeakPolarHBondContact O-CG 2.99Å; C857-L861 PolarHBondContact O-N 3.26Å
858	I	96.4	Very high	94.8	Very high	1 Å²	1	15.3 Å²	15.3	1%	0.005	9%	0.085	C	C	.	.	H	α-helix	trans	-66.9	-37.3	177.4	-62.9	-66.9	0	0	0	110.9	W582 R596 A599 I600 L603 Y688 E854 L855 D856 A860 L861 Y862	W582-I858 HydrophobicContact CH2-CD1 3.89Å; W582-I858 HydrophobicContact CH2-CG1 4.07Å; W582-I858 HydrophobicContact CZ3-CD1 3.79Å; W582-I858 HydrophobicContact CZ3-CG1 4.23Å; R596-I858 HydrophobicContact CB-CD1 4.19Å; R596-I858 HydrophobicContact CG-CD1 3.92Å; A599-I858 HydrophobicContact CB-CG2 3.98Å; I600-I858 HydrophobicContact CG1-CG2 4.04Å; L603-I858 HydrophobicContact CD1-CG2 3.76Å; Y688-I858 HydrophobicContact CE1-CD1 4.07Å; Y688-I858 HydrophobicContact CE1-CG1 4.23Å; E854-I858 VanDerWaalsContact O-CG1 3.31Å; E854-I858 WeakPolarHBondContact O-CG1 3.45Å; E854-I858 PolarHBondContact O-N 3.2Å; L855-I858 PolarHBondContact O-N 3.26Å; D856-I858 PolarHBondContact O-N 3.46Å; I858-A860 VanDerWaalsContact C-N 3.34Å; I858-L861 PolarHBondContact O-N 3.05Å; I858-Y862 WeakPolarHBondContact O-CB 3.08Å; I858-Y862 PolarHBondContact O-N 2.83Å
859	I	96.4	Very high	94.3	Very high	2 Å²	2	16.6 Å²	16.6	1%	0.01	9%	0.093	C	C	.	.	H	α-helix	trans	-62.2	-41.3	172	-70.1	167.2	0	0	0	110.8	L603 I610 R614 L617 L855 D856 C857 Y862 L863	L603-I859 HydrophobicContact CD1-CG1 3.83Å; I610-I859 HydrophobicContact CG2-CG2 3.93Å; R614-I859 HydrophobicContact CG-CG2 4.1Å; L617-I859 HydrophobicContact CD1-CD1 3.75Å; L855-I859 HydrophobicContact CD1-CD1 4.14Å; L855-I859 HydrophobicContact CD1-CG1 4.42Å; L855-I859 HydrophobicContact CG-CD1 3.98Å; L855-I859 WeakPolarHBondContact O-CG1 3.32Å; L855-I859 PolarHBondContact O-N 3.43Å; D856-I859 PolarHBondContact O-N 3.1Å; C857-I859 VanDerWaalsContact C-N 3.34Å; I859-Y862 WeakPolarHBondContact O-CB 3.25Å; I859-Y862 PolarHBondContact O-N 3.43Å; I859-L863 HydrophobicContact CG2-CD1 4.36Å; I859-L863 WeakPolarHBondContact O-CG 3.49Å; I859-L863 PolarHBondContact O-N 3.15Å
860	A	95.6	Very high	93.9	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-63.9	-43.7	177.1	0	0	0	0	0	112.3	T569 L579 D856 C857 I858 Y862 L863 Y864	T569-A860 VanDerWaalsContact OG1-CA 3.29Å; T569-A860 WeakPolarHBondContact OG1-CA 3.39Å; T569-A860 WeakPolarHBondContact OG1-CB 3.42Å; L579-A860 HydrophobicContact CD2-CB 4.42Å; D856-A860 PolarHBondContact O-N 3.25Å; C857-A860 PolarHBondContact O-N 3.34Å; I858-A860 VanDerWaalsContact C-N 3.34Å; A860-Y862 VanDerWaalsContact C-N 3.31Å; A860-Y862 PolarHBondContact O-N 3.13Å; A860-L863 PolarHBondContact O-N 3Å; A860-Y864 PolarHBondContact O-N 3.49Å
861	L	96.6	Very high	93.6	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.8	-35.3	174.1	-67.1	-179.8	0	0	0	112.4	L567 L579 W582 I600 C857 I858 S865 L966 C968	L567-L861 HydrophobicContact CD2-CD2 4.46Å; L579-L861 HydrophobicContact CD1-CD2 4.45Å; W582-L861 HydrophobicContact CE3-CD1 4.26Å; W582-L861 HydrophobicContact CZ3-CD1 4.19Å; I600-L861 HydrophobicContact CD1-CB 3.65Å; I600-L861 HydrophobicContact CD1-CD1 4.46Å; I600-L861 HydrophobicContact CG1-CB 4.41Å; C857-L861 WeakPolarHBondContact O-CG 2.99Å; C857-L861 PolarHBondContact O-N 3.26Å; I858-L861 PolarHBondContact O-N 3.05Å; L861-S865 WeakPolarHBondContact O-CB 3.32Å; L861-S865 PolarHBondContact O-N 3.44Å; L861-S865 PolarHBondContact O-OG 3.09Å; L861-L966 HydrophobicContact CD1-CB 4.47Å; L861-L966 HydrophobicContact CD2-CB 4.38Å; L861-L966 HydrophobicContact CD2-CD1 4.41Å; L861-C968 HydrophobicContact CB-CB 4.05Å; L861-C968 HydrophobicContact CD2-CB 4.16Å
862	Y	95.2	Very high	93.5	Very high	17 Å²	17	27.4 Å²	27.4	7%	0.067	15%	0.15	C	C	.	.	H	α-helix	trans	-61.5	-50.1	171.3	152.1	-99.2	0	0	0	111.7	L603 I604 S607 I610 I858 I859 A860 Y864 S865 T866	L603-Y862 HydrophobicContact CB-CD2 3.94Å; L603-Y862 HydrophobicContact CB-CG 3.97Å; L603-Y862 HydrophobicContact CD1-CG 4.29Å; I604-Y862 HydrophobicContact CB-CE2 4.22Å; I604-Y862 HydrophobicContact CG1-CD2 3.6Å; I604-Y862 HydrophobicContact CG1-CE2 3.58Å; S607-Y862 WeakPolarHBondContact CB-OH 3.3Å; I610-Y862 HydrophobicContact CB-CE1 4.05Å; I610-Y862 HydrophobicContact CG1-CD1 4.42Å; I610-Y862 HydrophobicContact CG1-CE1 3.75Å; I610-Y862 HydrophobicContact CG2-CD1 4.16Å; I610-Y862 HydrophobicContact CG2-CE1 3.72Å; I858-Y862 WeakPolarHBondContact O-CB 3.08Å; I858-Y862 PolarHBondContact O-N 2.83Å; I859-Y862 WeakPolarHBondContact O-CB 3.25Å; I859-Y862 PolarHBondContact O-N 3.43Å; A860-Y862 VanDerWaalsContact C-N 3.31Å; A860-Y862 PolarHBondContact O-N 3.13Å; Y862-Y864 VanDerWaalsContact C-N 3.3Å; Y862-Y864 PolarHBondContact O-N 2.91Å; Y862-S865 CarbonylContact O-C 3.52Å; Y862-S865 WeakPolarHBondContact O-CA 3.34Å; Y862-S865 VanDerWaalsContact O-CB 3.29Å; Y862-S865 WeakPolarHBondContact O-CB 3.32Å; Y862-S865 PolarHBondContact O-N 3.01Å; Y862-T866 HydrophobicContact CD2-CG2 3.95Å; Y862-T866 HydrophobicContact CE2-CG2 3.47Å; Y862-T866 VanDerWaalsContact CE2-CG2 3.47Å; Y862-T866 PolarHBondContact O-N 3Å; Y862-T866 PolarHBondContact O-OG1 3.47Å
863	L	94.9	Very high	93.5	Very high	20 Å²	20	28 Å²	28	11%	0.105	15%	0.154	C	C	.	.	H	α-helix	trans	-62	-39	-179.9	-75.3	175	0	0	0	112.3	T569 I859 A860 S865 T866 N867	T569-L863 WeakPolarHBondContact OG1-CD1 3.47Å; I859-L863 HydrophobicContact CG2-CD1 4.36Å; I859-L863 WeakPolarHBondContact O-CG 3.49Å; I859-L863 PolarHBondContact O-N 3.15Å; A860-L863 PolarHBondContact O-N 3Å; L863-S865 VanDerWaalsContact C-N 3.34Å; L863-T866 PolarHBondContact O-N 3.32Å; L863-T866 PolarHBondContact O-OG1 3.21Å; L863-N867 VanDerWaalsContact O-CB 3.28Å; L863-N867 WeakPolarHBondContact O-CB 3.31Å; L863-N867 PolarHBondContact O-N 3.45Å; L863-N867 PolarHBondContact O-ND2 2.85Å
864	Y	94.6	Very high	93.5	Very high	5 Å²	5	31.2 Å²	31.2	2%	0.02	17%	0.17	C	C	.	.	H	α-helix	trans	-61.2	-46.7	170.8	178.5	-96.7	0	0	0	110.7	R566 L567 A860 Y862 T866 N867 A868 M872 P896 L963	R566-Y864 HydrophobicContact CG-CD2 4.43Å; R566-Y864 HydrophobicContact CG-CE2 3.92Å; L567-Y864 HydrophobicContact CD2-CD1 3.86Å; L567-Y864 HydrophobicContact CD2-CD2 3.62Å; L567-Y864 HydrophobicContact CD2-CE1 4.25Å; L567-Y864 HydrophobicContact CD2-CE2 4.04Å; L567-Y864 HydrophobicContact CD2-CG 3.52Å; A860-Y864 PolarHBondContact O-N 3.49Å; Y862-Y864 VanDerWaalsContact C-N 3.3Å; Y862-Y864 PolarHBondContact O-N 2.91Å; Y864-T866 PolarHBondContact O-N 2.88Å; Y864-N867 PolarHBondContact O-N 3.14Å; Y864-A868 HydrophobicContact CD1-CB 4.36Å; Y864-A868 HydrophobicContact CD2-CB 3.67Å; Y864-A868 HydrophobicContact CE1-CB 4.19Å; Y864-A868 HydrophobicContact CE2-CB 3.46Å; Y864-A868 VanDerWaalsContact CE2-CB 3.46Å; Y864-A868 HydrophobicContact CG-CB 4.12Å; Y864-A868 WeakPolarHBondContact O-CB 3.42Å; Y864-A868 PolarHBondContact O-N 3.49Å; Y864-M872 HydrophobicContact CD1-CE 4.32Å; Y864-M872 HydrophobicContact CE1-CE 4.03Å; Y864-P896 WeakPolarHBondContact OH-CB 3.26Å; Y864-L963 HydrophobicContact CE1-CD1 4.02Å; Y864-L963 HydrophobicContact CE1-CD2 3.93Å; Y864-L963 VanDerWaalsContact OH-CD1 3.28Å; Y864-L963 WeakPolarHBondContact OH-CD1 3.28Å
865	S	94.4	Very high	93.5	Very high	2 Å²	2	28.7 Å²	28.7	1%	0.014	16%	0.159	C	C	.	.	H	α-helix	trans	-60.2	-28	-178.9	-61.3	0	0	0	0	114.1	L861 Y862 L863 R969	L861-S865 WeakPolarHBondContact O-CB 3.32Å; L861-S865 PolarHBondContact O-N 3.44Å; L861-S865 PolarHBondContact O-OG 3.09Å; Y862-S865 CarbonylContact O-C 3.52Å; Y862-S865 WeakPolarHBondContact O-CA 3.34Å; Y862-S865 VanDerWaalsContact O-CB 3.29Å; Y862-S865 WeakPolarHBondContact O-CB 3.32Å; Y862-S865 PolarHBondContact O-N 3.01Å; L863-S865 VanDerWaalsContact C-N 3.34Å; S865-R969 PolarHBondContact OG-N 3.13Å
866	T	91.8	Very high	93.5	Very high	51 Å²	51	33.3 Å²	33.3	31%	0.313	18%	0.18	S	C	.	.	H	α-helix	trans	-97.4	-31.4	-179.7	60.1	0	0	0	0	114.3	I604 Y862 L863 Y864	I604-T866 HydrophobicContact CD1-CG2 4.43Å; I604-T866 HydrophobicContact CG1-CG2 4.06Å; Y862-T866 HydrophobicContact CD2-CG2 3.95Å; Y862-T866 HydrophobicContact CE2-CG2 3.47Å; Y862-T866 VanDerWaalsContact CE2-CG2 3.47Å; Y862-T866 PolarHBondContact O-N 3Å; Y862-T866 PolarHBondContact O-OG1 3.47Å; L863-T866 PolarHBondContact O-N 3.32Å; L863-T866 PolarHBondContact O-OG1 3.21Å; Y864-T866 PolarHBondContact O-N 2.88Å
867	N	89.7	Confident	93.4	Very high	114 Å²	114	33.7 Å²	33.7	61%	0.61	18%	0.182	S	C	*	.	H	α-helix	trans	-112.2	-3.3	-169	-55.4	-31.6	0	0	0	113.6	L863 Y864	L863-N867 VanDerWaalsContact O-CB 3.28Å; L863-N867 WeakPolarHBondContact O-CB 3.31Å; L863-N867 PolarHBondContact O-N 3.45Å; L863-N867 PolarHBondContact O-ND2 2.85Å; Y864-N867 PolarHBondContact O-N 3.14Å
868	A	85.1	Confident	93.2	Very high	3 Å²	3	36.4 Å²	36.4	3%	0.025	20%	0.196	C	C	.	.	S	Bend	trans	-74.1	-38.5	-171	0	0	0	0	0	114.6	R566 Y864 M872 I899	R566-A868 VanDerWaalsContact NH2-CA 3.29Å; R566-A868 PolarHBondContact NH2-O 3.38Å; Y864-A868 HydrophobicContact CD1-CB 4.36Å; Y864-A868 HydrophobicContact CD2-CB 3.67Å; Y864-A868 HydrophobicContact CE1-CB 4.19Å; Y864-A868 HydrophobicContact CE2-CB 3.46Å; Y864-A868 VanDerWaalsContact CE2-CB 3.46Å; Y864-A868 HydrophobicContact CG-CB 4.12Å; Y864-A868 WeakPolarHBondContact O-CB 3.42Å; Y864-A868 PolarHBondContact O-N 3.49Å; A868-M872 HydrophobicContact CB-CE 3.83Å; A868-M872 HydrophobicContact CB-SD 4.04Å; A868-I899 WeakPolarHBondContact O-CD1 3.5Å; A868-I899 VanDerWaalsContact O-CG2 3.3Å; A868-I899 WeakPolarHBondContact O-CG2 3.32Å
869	S	86	Confident	92.9	Very high	26 Å²	26	39.9 Å²	39.9	18%	0.182	21%	0.214	C	C	.	.			trans	-156.6	158.9	-176.9	-177.6	0	0	0	0	109	V871 M872	S869-V871 VanDerWaalsContact C-N 3.25Å; S869-V871 PolarHBondContact O-N 3.37Å; S869-V871 PolarHBondContact OG-N 2.92Å; S869-V871 PolarHBondContact OG-O 3.49Å; S869-M872 VanDerWaalsContact O-CG 3.3Å; S869-M872 WeakPolarHBondContact O-CG 3.1Å
870	D	84.4	Confident	92.3	Very high	175 Å²	175	40.5 Å²	40.5	94%	0.936	22%	0.218	S	C	*	.	S	Bend	trans	-65.7	-31.7	172	-63.7	-34.4	0	0	0	112
871	V	89.1	Confident	91.5	Very high	68 Å²	68	44.3 Å²	44.3	41%	0.412	24%	0.238	S	C	.	.	S	Bend	trans	-109.4	108	179.5	-175.4	0	0	0	0	109	S869 P971 K973	S869-V871 VanDerWaalsContact C-N 3.25Å; S869-V871 PolarHBondContact O-N 3.37Å; S869-V871 PolarHBondContact OG-N 2.92Å; S869-V871 PolarHBondContact OG-O 3.49Å; V871-P971 WeakPolarHBondContact O-CA 3.46Å; V871-K973 HydrophobicContact CG1-CB 4.29Å
872	M	94.4	Very high	90.2	Very high	31 Å²	31	48.2 Å²	48.2	15%	0.153	27%	0.265	C	S	.	.			trans	-132.4	133.5	178.9	-61.7	-68.6	-74.6	0	0	109.5	Y864 A868 S869 R969 I970 P971 A972	Y864-M872 HydrophobicContact CD1-CE 4.32Å; Y864-M872 HydrophobicContact CE1-CE 4.03Å; A868-M872 HydrophobicContact CB-CE 3.83Å; A868-M872 HydrophobicContact CB-SD 4.04Å; S869-M872 VanDerWaalsContact O-CG 3.3Å; S869-M872 WeakPolarHBondContact O-CG 3.1Å; M872-R969 HydrophobicContact CB-CB 4.24Å; M872-R969 HydrophobicContact CE-CB 4.09Å; M872-R969 WeakPolarHBondContact CE-O 3.47Å; M872-I970 CarbonylContact C-O 3.15Å; M872-I970 WeakPolarHBondContact CA-O 3.5Å; M872-P971 VanDerWaalsContact SD-CA 3.53Å; M872-P971 HydrophobicContact SD-CB 3.76Å; M872-A972 CarbonylContact C-O 3.14Å
873	C	95.7	Very high	89	Confident	13 Å²	13	51 Å²	51	9%	0.088	29%	0.288	C	S	.	.	B	Isolated β-bridge	trans	-121.1	151.5	175.2	74.6	0	0	0	0	111.7	P875 R969 I970 A972 K973 S974 C975	C873-P875 WeakPolarHBondContact O-CD 3.47Å; C873-R969 CarbonylContact O-C 3.49Å; C873-R969 VanDerWaalsContact O-CA 3.28Å; C873-R969 WeakPolarHBondContact O-CA 3.41Å; C873-R969 WeakPolarHBondContact O-CB 3.23Å; C873-I970 PolarHBondContact N-O 3.32Å; C873-I970 PolarHBondContact O-N 2.98Å; C873-A972 WeakPolarHBondContact CB-O 3.5Å; C873-A972 PolarHBondContact N-O 2.91Å; C873-A972 VanDerWaalsContact N-O 3.13Å; C873-A972 PolarHBondContact SG-O 2.92Å; C873-A972 VanDerWaalsContact SG-O 3.4Å; C873-K973 WeakPolarHBondContact CB-O 3.27Å; C873-S974 VanDerWaalsContact SG-C 3.58Å; C873-S974 VanDerWaalsContact SG-CA 3.58Å; C873-C975 PolarHBondContact SG-N 3.27Å
874	L	96.2	Very high	88.1	Confident	71 Å²	71	51.1 Å²	51.1	37%	0.372	29%	0.289	S	S	.	.			trans	-83.4	118.7	168.8	-169	68	0	0	0	109.2	Q597 E601 R969	Q597-L874 HydrophobicContact CB-CD1 3.96Å; Q597-L874 HydrophobicContact CG-CD1 3.75Å; Q597-L874 HydrophobicContact CG-CG 4.48Å; E601-L874 HydrophobicContact CG-CD2 4.31Å; L874-R969 HydrophobicContact CB-CG 4.47Å; L874-R969 HydrophobicContact CD1-CG 4.09Å
875	P	97.1	Very high	87.5	Confident	3 Å²	3	52.8 Å²	52.8	2%	0.019	30%	0.297	C	S	.	.			trans	-66.8	134.5	-178.7	-23.2	36	0	0	0	112.9	Q597 C873 F877 A964 C968 I970 C975 L977	Q597-P875 PolarHBondContact NE2-O 3.37Å; C873-P875 WeakPolarHBondContact O-CD 3.47Å; P875-F877 HydrophobicContact CB-CE2 4.24Å; P875-A964 HydrophobicContact CB-CB 3.73Å; P875-A964 HydrophobicContact CG-CB 3.64Å; P875-C968 WeakPolarHBondContact CD-O 3.22Å; P875-I970 HydrophobicContact CG-CB 4.43Å; P875-I970 HydrophobicContact CG-CD1 3.97Å; P875-I970 HydrophobicContact CG-CG1 3.98Å; P875-I970 HydrophobicContact CG-CG2 3.72Å; P875-C975 WeakPolarHBondContact CA-O 3.43Å; P875-C975 HydrophobicContact CB-CB 4.22Å; P875-L977 HydrophobicContact CB-CD2 4.05Å
876	E	96.4	Very high	87.1	Confident	97 Å²	97	53 Å²	53	45%	0.453	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	112.2	177.4	-173.4	-173.6	168.4	0	0	110.3	C975 K976 L977	E876-C975 PolarHBondContact N-O 2.82Å; E876-K976 HydrophobicContact CB-CG 4.19Å; E876-K976 WeakPolarHBondContact O-CA 3.41Å; E876-K976 IonicContact OE1-NZ 3.79Å; E876-K976 WeakPolarHBondContact OE2-CD 3.27Å; E876-K976 WeakPolarHBondContact OE2-CE 3.28Å; E876-K976 IonicContact OE2-NZ 3Å; E876-K976 PolarHBondContact OE2-NZ 3.2Å; E876-L977 PolarHBondContact O-N 3.46Å
877	F	95.3	Very high	87.1	Confident	9 Å²	9	51.2 Å²	51.2	4%	0.039	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	122	175	-78.5	-96.1	0	0	0	111.3	P590 I593 R594 P875 A964 H965 L977 P979	P590-F877 HydrophobicContact CB-CB 4.35Å; I593-F877 HydrophobicContact CD1-CD1 4.19Å; I593-F877 HydrophobicContact CD1-CE1 3.69Å; I593-F877 HydrophobicContact CD1-CE2 4.28Å; I593-F877 HydrophobicContact CD1-CZ 3.74Å; I593-F877 HydrophobicContact CG2-CD2 4.03Å; I593-F877 HydrophobicContact CG2-CE2 3.57Å; I593-F877 HydrophobicContact CG2-CZ 4.02Å; R594-F877 PolarHBondContact NH2-O 3.19Å; P875-F877 HydrophobicContact CB-CE2 4.24Å; F877-A964 HydrophobicContact CE2-CB 4.17Å; F877-A964 WeakPolarHBondContact CE2-O 3.35Å; F877-A964 HydrophobicContact CZ-CB 3.99Å; F877-A964 WeakPolarHBondContact CZ-O 3.25Å; F877-H965 AromaticContact CE1-CE1 3.68Å; F877-H965 AromaticContact CE1-NE2 3.69Å; F877-H965 AromaticContact CZ-ND1 3.92Å; F877-L977 CarbonylContact C-O 3.58Å; F877-L977 VanDerWaalsContact CA-O 3.27Å; F877-L977 WeakPolarHBondContact CA-O 3.35Å; F877-L977 HydrophobicContact CD1-CD2 4.14Å; F877-L977 HydrophobicContact CD1-CG 4.11Å; F877-L977 HydrophobicContact CD2-CD2 4.11Å; F877-L977 HydrophobicContact CE1-CD1 3.99Å; F877-L977 HydrophobicContact CE1-CD2 3.99Å; F877-L977 HydrophobicContact CE1-CG 3.87Å; F877-L977 HydrophobicContact CE2-CD2 3.93Å; F877-L977 HydrophobicContact CG-CD2 4.21Å; F877-L977 HydrophobicContact CZ-CD1 4.1Å; F877-L977 HydrophobicContact CZ-CD2 3.88Å; F877-L977 HydrophobicContact CZ-CG 4.17Å; F877-P979 HydrophobicContact CD1-CG 4.24Å
878	I	92.1	Very high	87.4	Confident	56 Å²	56	45.8 Å²	45.8	29%	0.287	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-89.1	122.2	174.3	-58	171.5	0	0	0	108.8	T884 L887 L977 T978 P979	I878-T884 HydrophobicContact CG2-CG2 4.27Å; I878-L887 HydrophobicContact CD1-CD2 3.51Å; I878-L977 PolarHBondContact N-O 2.9Å; I878-T978 HydrophobicContact CB-CG2 4Å; I878-T978 HydrophobicContact CG2-CG2 4.28Å; I878-P979 VanDerWaalsContact O-CD 3.3Å; I878-P979 WeakPolarHBondContact O-CD 3.48Å
879	D	88.9	Confident	87.9	Confident	74 Å²	74	48.3 Å²	48.3	40%	0.396	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-67.9	145	179.2	-67.7	-33.5	0	0	0	111.8	P590 R594 T884	P590-D879 WeakPolarHBondContact CB-OD1 3.47Å; R594-D879 IonicContact CZ-OD1 3.55Å; R594-D879 IonicContact CZ-OD2 2.71Å; R594-D879 IonicContact NH1-OD1 3.61Å; R594-D879 PolarHBondContact NH1-OD1 2.95Å; R594-D879 IonicContact NH1-OD2 2.77Å; R594-D879 PolarHBondContact NH1-OD2 2.65Å; R594-D879 IonicContact NH2-OD1 3.03Å; R594-D879 PolarHBondContact NH2-OD1 3Å; R594-D879 IonicContact NH2-OD2 3.04Å; R594-D879 PolarHBondContact NH2-OD2 3.33Å; R594-D879 VanDerWaalsContact NH2-OD2 3.13Å; D879-T884 PolarHBondContact O-OG1 3.07Å
880	L	85.7	Confident	88.4	Confident	16 Å²	16	47.2 Å²	47.2	8%	0.084	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-83	134.4	-179.5	-66.1	-178.8	0	0	0	110.7	L530 F531 Y532 T884 T978	L530-L880 HydrophobicContact CD2-CB 3.79Å; L530-L880 WeakPolarHBondContact CD2-O 3.4Å; F531-L880 HydrophobicContact CD1-CD1 3.69Å; F531-L880 HydrophobicContact CE1-CD1 3.52Å; Y532-L880 HydrophobicContact CD1-CD1 4.32Å; Y532-L880 HydrophobicContact CE1-CB 4.18Å; Y532-L880 HydrophobicContact CE1-CD1 3.88Å; Y532-L880 HydrophobicContact CE1-CG 4.07Å; L880-T884 HydrophobicContact CD2-CG2 3.95Å; L880-T978 HydrophobicContact CD2-CG2 4.01Å
881	N	78.2	Confident	88.9	Confident	80 Å²	80	40.7 Å²	40.7	43%	0.428	23%	0.227	S	C	.	.			trans	-130.5	177.4	167.4	69.1	42.8	0	0	0	109.2	S883 T884	N881-S883 PolarHBondContact O-N 2.66Å; N881-S883 VanDerWaalsContact O-N 3.11Å; N881-S883 VanDerWaalsContact OD1-C 3.31Å; N881-S883 VanDerWaalsContact OD1-CA 3.31Å; N881-S883 WeakPolarHBondContact OD1-CA 3.46Å; N881-S883 PolarHBondContact OD1-N 3.43Å; N881-S883 PolarHBondContact OD1-OG 3.26Å; N881-T884 PolarHBondContact N-OG1 3.11Å; N881-T884 PolarHBondContact ND2-OG1 2.95Å; N881-T884 PolarHBondContact O-N 3.25Å; N881-T884 VanDerWaalsContact O-N 3.14Å; N881-T884 PolarHBondContact OD1-N 2.95Å; N881-T884 PolarHBondContact OD1-OG1 2.86Å
882	S	68.7	Low	89.2	Confident	81 Å²	81	39.7 Å²	39.7	57%	0.566	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-25.4	-178.6	49.8	0	0	0	0	114.2	N1054	S882-N1054 PolarHBondContact O-ND2 3.46Å
883	S	69.9	Low	89.2	Confident	77 Å²	77	38.2 Å²	38.2	54%	0.538	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-6.7	179.1	56.3	0	0	0	0	114.8	N881 E885	N881-S883 PolarHBondContact O-N 2.66Å; N881-S883 VanDerWaalsContact O-N 3.11Å; N881-S883 VanDerWaalsContact OD1-C 3.31Å; N881-S883 VanDerWaalsContact OD1-CA 3.31Å; N881-S883 WeakPolarHBondContact OD1-CA 3.46Å; N881-S883 PolarHBondContact OD1-N 3.43Å; N881-S883 PolarHBondContact OD1-OG 3.26Å; S883-E885 PolarHBondContact O-N 2.76Å
884	T	76.6	Confident	89	Confident	22 Å²	22	38.8 Å²	38.8	14%	0.135	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-72	118.4	-174.1	-56.7	0	0	0	0	109.7	I878 D879 L880 N881 T978	I878-T884 HydrophobicContact CG2-CG2 4.27Å; D879-T884 PolarHBondContact O-OG1 3.07Å; L880-T884 HydrophobicContact CD2-CG2 3.95Å; N881-T884 PolarHBondContact N-OG1 3.11Å; N881-T884 PolarHBondContact ND2-OG1 2.95Å; N881-T884 PolarHBondContact O-N 3.25Å; N881-T884 VanDerWaalsContact O-N 3.14Å; N881-T884 PolarHBondContact OD1-N 2.95Å; N881-T884 PolarHBondContact OD1-OG1 2.86Å; T884-T978 HydrophobicContact CG2-CG2 3.81Å
885	E	81.1	Confident	88.9	Confident	39 Å²	39	36.1 Å²	36.1	18%	0.182	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-81.4	146.1	174.1	-65.4	179.7	129.8	0	0	111	S883 L887 T916 S918	S883-E885 PolarHBondContact O-N 2.76Å; E885-L887 PolarHBondContact O-N 2.81Å; E885-T916 HydrophobicContact CB-CG2 4.01Å; E885-T916 HydrophobicContact CG-CG2 4.13Å; E885-T916 WeakPolarHBondContact OE1-CG2 3.3Å; E885-T916 WeakPolarHBondContact OE2-CB 3.34Å; E885-T916 WeakPolarHBondContact OE2-CG2 3.44Å; E885-T916 PolarHBondContact OE2-OG1 3.3Å; E885-S918 PolarHBondContact OE2-OG 2.91Å
886	P	87.8	Confident	88.6	Confident	8 Å²	8	36 Å²	36	5%	0.052	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-55.7	121.8	174.9	-25.7	35.1	0	0	0	111.5	G915 P1016 R1059	P886-G915 WeakPolarHBondContact O-CA 3.26Å; P886-P1016 WeakPolarHBondContact CB-O 3.13Å; P886-P1016 HydrophobicContact CG-CB 4.06Å; P886-P1016 WeakPolarHBondContact CG-O 3.45Å; P886-R1059 VanDerWaalsContact CA-NH1 3.29Å; P886-R1059 HydrophobicContact CB-CG 4.4Å
887	L	91.2	Very high	88.2	Confident	12 Å²	12	32.4 Å²	32.4	6%	0.063	19%	0.185	C	C	.	.			trans	-125	140.7	176.6	-176.1	70.8	0	0	0	111.6	I878 E885 L914 L977 T978	I878-L887 HydrophobicContact CD1-CD2 3.51Å; E885-L887 PolarHBondContact O-N 2.81Å; L887-L914 CarbonylContact C-O 3.57Å; L887-L914 WeakPolarHBondContact CA-O 3.42Å; L887-L977 WeakPolarHBondContact O-CA 3.32Å; L887-T978 HydrophobicContact CB-CG2 4.23Å; L887-T978 PolarHBondContact N-OG1 2.71Å; L887-T978 PolarHBondContact O-N 3.35Å; L887-T978 PolarHBondContact O-OG1 3.17Å
888	L	95	Very high	87.7	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	114.7	162.2	173.3	63.9	0	0	0	108.8	I890 K913 L914 V961 L977 L1019 R1059	L888-I890 HydrophobicContact CD1-CD1 4.02Å; L888-I890 HydrophobicContact CD1-CG1 3.98Å; L888-I890 HydrophobicContact CG-CD1 4.4Å; L888-I890 HydrophobicContact CG-CG1 4.44Å; L888-K913 CarbonylContact O-C 3.56Å; L888-K913 WeakPolarHBondContact O-CA 3.32Å; L888-L914 HydrophobicContact CB-CB 4.33Å; L888-L914 HydrophobicContact CD2-CD1 4.25Å; L888-L914 PolarHBondContact N-O 2.98Å; L888-L914 PolarHBondContact O-N 2.84Å; L888-V961 HydrophobicContact CD1-CG2 3.65Å; L888-V961 HydrophobicContact CD2-CG2 3.85Å; L888-V961 HydrophobicContact CG-CG2 4.43Å; L888-L977 HydrophobicContact CD1-CB 3.89Å; L888-L977 HydrophobicContact CD1-CD1 4.36Å; L888-L1019 HydrophobicContact CD2-CD1 4.18Å; L888-R1059 HydrophobicContact CB-CG 4.38Å
889	E	95.3	Very high	87.1	Confident	56 Å²	56	33.2 Å²	33.2	26%	0.262	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	121.7	176.8	-177.4	177.3	-160.4	0	0	108.6	V891 I912 K913 C975 K976	E889-V891 HydrophobicContact CG-CG2 4.44Å; E889-I912 CarbonylContact C-O 3.58Å; E889-I912 WeakPolarHBondContact CA-O 3.31Å; E889-K913 HydrophobicContact CG-CG 4.44Å; E889-C975 CarbonylContact O-C 3.5Å; E889-C975 VanDerWaalsContact O-CA 3.24Å; E889-C975 WeakPolarHBondContact O-CA 3.44Å; E889-K976 HydrophobicContact CB-CB 4.34Å; E889-K976 PolarHBondContact N-O 2.81Å; E889-K976 PolarHBondContact O-N 3.16Å
890	I	96.5	Very high	86.3	Confident	2 Å²	2	34.7 Å²	34.7	1%	0.01	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	123.7	176.8	-59.6	172.3	0	0	0	106.3	L888 D911 I912 L960 A972	L888-I890 HydrophobicContact CD1-CD1 4.02Å; L888-I890 HydrophobicContact CD1-CG1 3.98Å; L888-I890 HydrophobicContact CG-CD1 4.4Å; L888-I890 HydrophobicContact CG-CG1 4.44Å; I890-D911 CarbonylContact O-C 3.55Å; I890-D911 VanDerWaalsContact O-CA 3.3Å; I890-D911 WeakPolarHBondContact O-CA 3.26Å; I890-I912 HydrophobicContact CB-CB 4.39Å; I890-I912 PolarHBondContact N-O 2.97Å; I890-I912 PolarHBondContact O-N 2.8Å; I890-L960 HydrophobicContact CD1-CB 4.06Å; I890-L960 HydrophobicContact CD1-CD1 4.03Å; I890-L960 HydrophobicContact CG2-CD1 3.89Å; I890-A972 HydrophobicContact CG2-CB 4.07Å
891	V	96	Very high	85.5	Confident	38 Å²	38	38.7 Å²	38.7	23%	0.23	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	130	177.1	-177.8	0	0	0	0	108.6	E889 G893 D911 K973 S974	E889-V891 HydrophobicContact CG-CG2 4.44Å; V891-G893 PolarHBondContact O-N 3.1Å; V891-D911 WeakPolarHBondContact CA-OD1 3.37Å; V891-K973 HydrophobicContact CG1-CB 4.38Å; V891-K973 HydrophobicContact CG1-CD 4.18Å; V891-K973 WeakPolarHBondContact O-CB 3.15Å; V891-K973 PolarHBondContact O-N 3.5Å; V891-S974 WeakPolarHBondContact CB-OG 3.37Å; V891-S974 WeakPolarHBondContact CG2-OG 3.41Å; V891-S974 PolarHBondContact N-O 2.98Å; V891-S974 PolarHBondContact O-N 2.87Å
892	D	94.3	Very high	84.7	Confident	48 Å²	48	39.7 Å²	39.7	26%	0.257	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	48.1	43.6	-176.2	-74.3	-44.4	0	0	0	113.2	S909 D911 A972 K973 K1117	D892-S909 PolarHBondContact OD1-OG 2.78Å; D892-D911 PolarHBondContact N-OD1 2.87Å; D892-A972 WeakPolarHBondContact O-CA 3.33Å; D892-K973 HydrophobicContact CB-CB 3.89Å; D892-K1117 IonicContact OD1-NZ 2.7Å
893	G	94.7	Very high	83.8	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	145.6	176.6	0	0	0	0	0	112	V891 S909 N910 Q956 P971	V891-G893 PolarHBondContact O-N 3.1Å; G893-S909 CarbonylContact O-C 3.47Å; G893-S909 VanDerWaalsContact O-CA 3.27Å; G893-S909 WeakPolarHBondContact O-CA 3.41Å; G893-N910 PolarHBondContact N-O 3.35Å; G893-N910 PolarHBondContact O-N 3.11Å; G893-Q956 PolarHBondContact O-NE2 3Å; G893-P971 CarbonylContact C-O 3.5Å
894	I	92.8	Very high	82.8	Confident	25 Å²	25	40.8 Å²	40.8	13%	0.128	24%	0.241	C	C	.	.			trans	-123.3	144.4	177.9	-59.7	171.9	0	0	0	109.2	P896 I899 I907 P971	I894-P896 WeakPolarHBondContact O-CD 3.36Å; I894-I899 HydrophobicContact CG2-CD1 4.47Å; I894-I899 HydrophobicContact CG2-CG1 3.9Å; I894-I907 HydrophobicContact CG2-CG2 3.8Å; I894-P971 HydrophobicContact CB-CB 4.21Å; I894-P971 PolarHBondContact N-O 3.32Å
895	H	92.6	Very high	81.7	Confident	15 Å²	15	43.1 Å²	43.1	7%	0.069	27%	0.268	C	S	.	.			trans	-67.5	117.6	176.1	-169.5	-63.2	0	0	0	111.2	C897 L898 Q956 L959	H895-C897 PolarHBondContact ND1-N 3.23Å; H895-C897 PolarHBondContact O-N 3.3Å; H895-L898 HydrophobicContact CB-CB 4.27Å; H895-L898 HydrophobicContact CB-CD1 3.93Å; H895-L898 HydrophobicContact CB-CG 4.17Å; H895-L898 PolarHBondContact O-N 3.42Å; H895-L898 VanDerWaalsContact O-N 3.15Å; H895-Q956 HydrophobicContact CB-CB 4.07Å; H895-Q956 HydrophobicContact CB-CG 4.27Å; H895-L959 WeakPolarHBondContact CE1-CD1 3.28Å
896	P	91.3	Very high	81	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-33.7	-167.1	24.5	-34.8	0	0	0	114.7	L563 Y864 I894 L959 L963 P971	L563-P896 HydrophobicContact CD1-CG 4.46Å; Y864-P896 WeakPolarHBondContact OH-CB 3.26Å; I894-P896 WeakPolarHBondContact O-CD 3.36Å; P896-L959 HydrophobicContact CG-CB 3.69Å; P896-L959 HydrophobicContact CG-CD1 4.06Å; P896-L959 HydrophobicContact CG-CG 4.5Å; P896-L963 HydrophobicContact CB-CD1 3.68Å; P896-L963 HydrophobicContact CG-CD1 3.85Å; P896-P971 HydrophobicContact CB-CG 4.24Å
897	C	88.8	Confident	80.6	Confident	21 Å²	21	49 Å²	49	14%	0.142	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-15.3	179.8	-51	0	0	0	0	114.3	H895	H895-C897 PolarHBondContact ND1-N 3.23Å; H895-C897 PolarHBondContact O-N 3.3Å
898	L	85	Confident	80.3	Confident	52 Å²	52	51.4 Å²	51.4	27%	0.272	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-11.4	-174.4	-65.6	179.9	0	0	0	113.2	H895 N900 T901 F902 I907 T952	H895-L898 HydrophobicContact CB-CB 4.27Å; H895-L898 HydrophobicContact CB-CD1 3.93Å; H895-L898 HydrophobicContact CB-CG 4.17Å; H895-L898 PolarHBondContact O-N 3.42Å; H895-L898 VanDerWaalsContact O-N 3.15Å; L898-N900 VanDerWaalsContact C-N 3.31Å; L898-N900 PolarHBondContact O-N 2.92Å; L898-T901 PolarHBondContact O-N 2.77Å; L898-T901 VanDerWaalsContact O-N 3.16Å; L898-F902 HydrophobicContact CB-CD2 4.46Å; L898-F902 HydrophobicContact CB-CE2 4.33Å; L898-F902 HydrophobicContact CD2-CE2 4.47Å; L898-I907 VanDerWaalsContact C-CD1 3.45Å; L898-I907 HydrophobicContact CB-CD1 4.17Å; L898-I907 WeakPolarHBondContact O-CD1 3.48Å; L898-T952 HydrophobicContact CD1-CG2 3.85Å
899	I	79.6	Confident	80.1	Confident	30 Å²	30	52.8 Å²	52.8	15%	0.154	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-42.8	-169.3	-59.8	167	0	0	0	112.9	A868 I894 I907 P971	A868-I899 WeakPolarHBondContact O-CD1 3.5Å; A868-I899 VanDerWaalsContact O-CG2 3.3Å; A868-I899 WeakPolarHBondContact O-CG2 3.32Å; I894-I899 HydrophobicContact CG2-CD1 4.47Å; I894-I899 HydrophobicContact CG2-CG1 3.9Å; I899-I907 VanDerWaalsContact CA-CD1 3.45Å; I899-P971 HydrophobicContact CD1-CB 4Å; I899-P971 HydrophobicContact CD1-CG 4.11Å
900	N	70.5	Confident	80.1	Confident	106 Å²	106	50.5 Å²	50.5	57%	0.567	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-23.1	-175.7	-65.9	1.2	0	0	0	113.4	L898 F902 S903	L898-N900 VanDerWaalsContact C-N 3.31Å; L898-N900 PolarHBondContact O-N 2.92Å; N900-F902 VanDerWaalsContact C-N 3.29Å; N900-F902 PolarHBondContact O-N 2.79Å; N900-S903 PolarHBondContact O-OG 3.1Å
901	T	69	Low	79.9	Confident	99 Å²	99	53.1 Å²	53.1	61%	0.607	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-33.1	-175.2	-48.4	0	0	0	0	111.6	L898	L898-T901 PolarHBondContact O-N 2.77Å; L898-T901 VanDerWaalsContact O-N 3.16Å
902	F	61.8	Low	79.8	Confident	101 Å²	101	51.4 Å²	51.4	44%	0.443	32%	0.315	S	S	.	.			trans	-101.2	77	175.4	-59.7	-82.8	0	0	0	109.1	L898 N900 G904 G905 I907	L898-F902 HydrophobicContact CB-CD2 4.46Å; L898-F902 HydrophobicContact CB-CE2 4.33Å; L898-F902 HydrophobicContact CD2-CE2 4.47Å; N900-F902 VanDerWaalsContact C-N 3.29Å; N900-F902 PolarHBondContact O-N 2.79Å; F902-G904 PolarHBondContact O-N 2.83Å; F902-G905 PolarHBondContact O-N 3.28Å; F902-I907 HydrophobicContact CB-CD1 4.13Å; F902-I907 HydrophobicContact CB-CG1 3.8Å; F902-I907 HydrophobicContact CD2-CD1 3.8Å; F902-I907 HydrophobicContact CD2-CG1 3.59Å; F902-I907 HydrophobicContact CE2-CG1 4.49Å; F902-I907 HydrophobicContact CG-CD1 4.41Å; F902-I907 HydrophobicContact CG-CG1 3.96Å
903	S	49.6	Very low	79.7	Confident	122 Å²	122	51.1 Å²	51.1	85%	0.853	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	5.8	179.7	-38.7	0	0	0	0	114.7	N900	N900-S903 PolarHBondContact O-OG 3.1Å
904	G	49.7	Very low	79.5	Confident	60 Å²	60	51.1 Å²	51.1	62%	0.619	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.2	3.2	178.1	0	0	0	0	0	115.9	F902 D906	F902-G904 PolarHBondContact O-N 2.83Å; G904-D906 VanDerWaalsContact C-N 3.35Å; G904-D906 PolarHBondContact O-N 2.75Å
905	G	53.8	Low	78.9	Confident	70 Å²	70	50 Å²	50	72%	0.722	31%	0.307	S	S	*	.	S	Bend	trans	78.2	13.5	176.8	0	0	0	0	0	115.5	F902 I907	F902-G905 PolarHBondContact O-N 3.28Å; G905-I907 PolarHBondContact O-N 2.99Å
906	D	66.8	Low	77.7	Confident	129 Å²	129	50.1 Å²	50.1	69%	0.69	31%	0.309	S	S	*	.			trans	-78.2	7.8	-175.8	-67.5	-37.8	0	0	0	114.9	G904 I908	G904-D906 VanDerWaalsContact C-N 3.35Å; G904-D906 PolarHBondContact O-N 2.75Å; D906-I908 PolarHBondContact O-N 2.92Å
907	I	77.9	Confident	75.8	Confident	41 Å²	41	53.4 Å²	53.4	21%	0.21	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-83.2	119.1	-176.6	-53.7	172.1	0	0	0	109.9	I894 L898 I899 F902 G905	I894-I907 HydrophobicContact CG2-CG2 3.8Å; L898-I907 VanDerWaalsContact C-CD1 3.45Å; L898-I907 HydrophobicContact CB-CD1 4.17Å; L898-I907 WeakPolarHBondContact O-CD1 3.48Å; I899-I907 VanDerWaalsContact CA-CD1 3.45Å; F902-I907 HydrophobicContact CB-CD1 4.13Å; F902-I907 HydrophobicContact CB-CG1 3.8Å; F902-I907 HydrophobicContact CD2-CD1 3.8Å; F902-I907 HydrophobicContact CD2-CG1 3.59Å; F902-I907 HydrophobicContact CE2-CG1 4.49Å; F902-I907 HydrophobicContact CG-CD1 4.41Å; F902-I907 HydrophobicContact CG-CG1 3.96Å; G905-I907 PolarHBondContact O-N 2.99Å
908	I	85.6	Confident	73.8	Confident	63 Å²	63	56.6 Å²	56.6	32%	0.323	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-85.1	122.3	-174.6	-59	-176.8	0	0	0	109.7	D906 N910 L1115 Y1116 K1117	D906-I908 PolarHBondContact O-N 2.92Å; I908-N910 PolarHBondContact O-ND2 3.33Å; I908-L1115 WeakPolarHBondContact CD1-O 3.2Å; I908-Y1116 HydrophobicContact CD1-CD2 4.37Å; I908-K1117 HydrophobicContact CG2-CB 4.08Å; I908-K1117 HydrophobicContact CG2-CD 4.06Å
909	S	91.1	Very high	71.6	Confident	31 Å²	31	58.9 Å²	58.9	22%	0.217	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-70.9	146.1	176.6	65.8	0	0	0	0	111.2	D892 G893 K1117	D892-S909 PolarHBondContact OD1-OG 2.78Å; G893-S909 CarbonylContact O-C 3.47Å; G893-S909 VanDerWaalsContact O-CA 3.27Å; G893-S909 WeakPolarHBondContact O-CA 3.41Å; S909-K1117 WeakPolarHBondContact O-CD 3.38Å; S909-K1117 PolarHBondContact O-NZ 3.23Å
910	N	93.8	Very high	69.6	Low	7 Å²	7	61.8 Å²	61.8	4%	0.037	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	138	-178	-77	-65.9	0	0	0	112.4	G893 I908 L953 Y1116 K1117 F1118	G893-N910 PolarHBondContact N-O 3.35Å; G893-N910 PolarHBondContact O-N 3.11Å; I908-N910 PolarHBondContact O-ND2 3.33Å; N910-L953 HydrophobicContact CB-CD1 3.51Å; N910-Y1116 PolarHBondContact ND2-O 3.42Å; N910-Y1116 VanDerWaalsContact ND2-O 3.08Å; N910-Y1116 PolarHBondContact OD1-O 3.46Å; N910-K1117 WeakPolarHBondContact OD1-CA 3.46Å; N910-F1118 WeakPolarHBondContact OD1-CB 3.39Å; N910-F1118 PolarHBondContact OD1-N 3.16Å
911	D	94.1	Very high	68.4	Low	57 Å²	57	60.8 Å²	60.8	31%	0.305	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	133	175.4	-54.1	-61.2	0	0	0	108.8	I890 V891 D892 K1117 F1118	I890-D911 CarbonylContact O-C 3.55Å; I890-D911 VanDerWaalsContact O-CA 3.3Å; I890-D911 WeakPolarHBondContact O-CA 3.26Å; V891-D911 WeakPolarHBondContact CA-OD1 3.37Å; D892-D911 PolarHBondContact N-OD1 2.87Å; D911-K1117 IonicContact OD2-NZ 2.67Å; D911-K1117 PolarHBondContact OD2-NZ 3.24Å; D911-F1118 WeakPolarHBondContact O-CD1 3.37Å
912	I	93.8	Very high	66.9	Low	2 Å²	2	63.8 Å²	63.8	1%	0.01	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	120.3	178.6	-57.5	179.4	0	0	0	107.9	E889 I890 L914 L953 A957	E889-I912 CarbonylContact C-O 3.58Å; E889-I912 WeakPolarHBondContact CA-O 3.31Å; I890-I912 HydrophobicContact CB-CB 4.39Å; I890-I912 PolarHBondContact N-O 2.97Å; I890-I912 PolarHBondContact O-N 2.8Å; I912-L914 HydrophobicContact CG2-CD1 4.32Å; I912-L914 HydrophobicContact CG2-CG 4.24Å; I912-L953 HydrophobicContact CD1-CD1 3.83Å; I912-L953 HydrophobicContact CD1-CG 4.3Å; I912-L953 HydrophobicContact CG1-CD1 4.15Å; I912-A957 HydrophobicContact CD1-CB 3.53Å
913	K	92	Very high	65.7	Low	42 Å²	42	60.6 Å²	60.6	18%	0.183	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	115.9	174.1	-169.4	179.3	-179.6	-153.6	0	109.6	L888 E889 N935 I940	L888-K913 CarbonylContact O-C 3.56Å; L888-K913 WeakPolarHBondContact O-CA 3.32Å; E889-K913 HydrophobicContact CG-CG 4.44Å; K913-N935 HydrophobicContact CD-CB 4.3Å; K913-N935 VanDerWaalsContact CD-O 3.27Å; K913-N935 WeakPolarHBondContact CD-O 3.28Å; K913-N935 WeakPolarHBondContact CE-O 3.4Å; K913-N935 PolarHBondContact NZ-O 2.87Å; K913-I940 WeakPolarHBondContact O-CD1 3.34Å
914	L	89.6	Confident	65.4	Low	0 Å²	0	60.8 Å²	60.8	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	128.4	177.2	-65.6	170.5	0	0	0	108.9	L887 L888 I912 I940 L1019 R1059 L1061	L887-L914 CarbonylContact C-O 3.57Å; L887-L914 WeakPolarHBondContact CA-O 3.42Å; L888-L914 HydrophobicContact CB-CB 4.33Å; L888-L914 HydrophobicContact CD2-CD1 4.25Å; L888-L914 PolarHBondContact N-O 2.98Å; L888-L914 PolarHBondContact O-N 2.84Å; I912-L914 HydrophobicContact CG2-CD1 4.32Å; I912-L914 HydrophobicContact CG2-CG 4.24Å; L914-I940 HydrophobicContact CD2-CB 4.02Å; L914-I940 HydrophobicContact CD2-CD1 3.47Å; L914-I940 VanDerWaalsContact CD2-CD1 3.47Å; L914-I940 HydrophobicContact CD2-CG1 3.54Å; L914-I940 HydrophobicContact CG-CD1 4.41Å; L914-L1019 HydrophobicContact CD1-CD1 4.22Å; L914-R1059 HydrophobicContact CB-CB 4.15Å; L914-R1059 HydrophobicContact CB-CG 4.05Å; L914-R1059 HydrophobicContact CD1-CB 4.02Å; L914-L1061 HydrophobicContact CD1-CD2 4.04Å; L914-L1061 HydrophobicContact CD1-CG 4.02Å; L914-L1061 HydrophobicContact CD2-CD2 4.03Å; L914-L1061 HydrophobicContact CG-CD2 4.39Å
915	G	80.5	Confident	64.9	Low	2 Å²	2	64.1 Å²	64.1	2%	0.021	39%	0.389	C	S	.	.	S	Bend	trans	109.1	161.1	-179.7	0	0	0	0	0	114.6	P886 A937	P886-G915 WeakPolarHBondContact O-CA 3.26Å; G915-A937 PolarHBondContact N-O 3.47Å
916	T	67.4	Low	64.3	Low	17 Å²	17	66.4 Å²	66.4	10%	0.104	38%	0.381	C	S	.	.			trans	-99	135.2	-178.5	154.5	0	0	0	0	110.6	E885 I921	E885-T916 HydrophobicContact CB-CG2 4.01Å; E885-T916 HydrophobicContact CG-CG2 4.13Å; E885-T916 WeakPolarHBondContact OE1-CG2 3.3Å; E885-T916 WeakPolarHBondContact OE2-CB 3.34Å; E885-T916 WeakPolarHBondContact OE2-CG2 3.44Å; E885-T916 PolarHBondContact OE2-OG1 3.3Å; T916-I921 HydrophobicContact CG2-CD1 4.25Å
917	T	51.9	Low	63.3	Low	70 Å²	70	69.2 Å²	69.2	43%	0.429	39%	0.389	S	S	.	.			trans	-88.8	115.8	161.6	49.5	0	0	0	0	107.5	S919	T917-S919 PolarHBondContact O-N 3.04Å
918	S	46.1	Very low	62	Low	87 Å²	87	70 Å²	70	61%	0.608	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	46.5	-165.2	-46.8	0	0	0	0	118	E885	E885-S918 PolarHBondContact OE2-OG 2.91Å
919	S	40	Very low	60.6	Low	100 Å²	100	70.6 Å²	70.6	70%	0.699	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.1	-0.4	178.4	-167.8	0	0	0	0	116.3	T917	T917-S919 PolarHBondContact O-N 3.04Å
920	M	37.1	Very low	59	Low	91 Å²	91	73.6 Å²	73.6	45%	0.448	41%	0.412	S	S	.	.	S	Bend	trans	-125	-15	-173.6	-69.3	-66	-176	0	0	116.5	N922 S923	M920-N922 VanDerWaalsContact C-N 3.29Å; M920-N922 PolarHBondContact O-N 2.9Å; M920-S923 PolarHBondContact O-OG 2.87Å
921	I	43.9	Very low	57.2	Low	86 Å²	86	78.1 Å²	78.1	44%	0.441	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-18.7	-176.2	-55.8	175.8	0	0	0	112.1	T916	T916-I921 HydrophobicContact CG2-CD1 4.25Å
922	N	38	Very low	55.5	Low	162 Å²	162	78.1 Å²	78.1	87%	0.866	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	11.8	-178	-69.7	-18.1	0	0	0	114.9	M920 P924	M920-N922 VanDerWaalsContact C-N 3.29Å; M920-N922 PolarHBondContact O-N 2.9Å; N922-P924 WeakPolarHBondContact O-CD 3.13Å
923	S	37.7	Very low	54	Low	33 Å²	33	79.9 Å²	79.9	23%	0.231	44%	0.441	C	S	.	.			trans	-108.1	96.5	165.8	60.3	0	0	0	0	110.1	M920 T925	M920-S923 PolarHBondContact O-OG 2.87Å; S923-T925 PolarHBondContact O-N 3.46Å
924	P	42.4	Very low	52.6	Low	127 Å²	127	78.5 Å²	78.5	83%	0.825	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	0.6	179.1	-18.1	30.9	0	0	0	114.5	N922	N922-P924 WeakPolarHBondContact O-CD 3.13Å
925	T	38.7	Very low	51.5	Low	129 Å²	129	80.2 Å²	80.2	79%	0.791	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.9	6.9	-166.3	52.3	0	0	0	0	115.1	S923	S923-T925 PolarHBondContact O-N 3.46Å
926	Q	42.9	Very low	51.1	Low	118 Å²	118	81.8 Å²	81.8	55%	0.551	45%	0.452	S	S	*	.	S	Bend	trans	-106.6	125.8	172.3	-67.9	-173.9	6.5	0	0	110.5	H928	Q926-H928 PolarHBondContact O-N 3Å
927	H	44.5	Very low	51.8	Low	189 Å²	189	81 Å²	81	88%	0.875	45%	0.447	S	S	*	.			trans	-60	105.5	167.1	-80.9	-78.9	0	0	0	108.7	T929	H927-T929 PolarHBondContact O-N 3.16Å
928	H	51.4	Low	53.4	Low	58 Å²	58	78.1 Å²	78.1	27%	0.269	43%	0.43	S	S	.	.			trans	-69.7	123.1	173.4	-70.9	-63.3	0	0	0	109.4	Q926 D932 M933	Q926-H928 PolarHBondContact O-N 3Å; H928-D932 HydrophobicContact CB-CB 4.34Å; H928-M933 HydrophobicContact CB-CG 4.36Å
929	T	56	Low	55.5	Low	74 Å²	74	74 Å²	74	45%	0.454	40%	0.401	S	S	.	.			trans	-72.7	160.3	173.2	65	0	0	0	0	110.3	H927 H931 D932 M933	H927-T929 PolarHBondContact O-N 3.16Å; T929-H931 PolarHBondContact O-N 2.96Å; T929-D932 PolarHBondContact N-OD2 3.43Å; T929-D932 PolarHBondContact O-N 3.17Å; T929-D932 PolarHBondContact OG1-N 3.04Å; T929-D932 PolarHBondContact OG1-OD2 3.49Å; T929-M933 PolarHBondContact O-N 3.49Å; T929-M933 VanDerWaalsContact O-N 3.08Å
930	L	57.8	Low	58	Low	95 Å²	95	69.2 Å²	69.2	50%	0.497	37%	0.368	S	S	.	.	H	α-helix	trans	-51.9	-30.9	170.9	-78.5	171.7	0	0	0	112.5	F934	L930-F934 WeakPolarHBondContact O-CB 3.42Å; L930-F934 PolarHBondContact O-N 2.7Å; L930-F934 VanDerWaalsContact O-N 3.08Å
931	H	55.8	Low	60.6	Low	101 Å²	101	64.9 Å²	64.9	47%	0.468	35%	0.346	S	S	.	.	H	α-helix	trans	-71.5	-37.4	176.7	-172.3	-91.1	0	0	0	112.6	T929 F934 N935	T929-H931 PolarHBondContact O-N 2.96Å; H931-F934 PolarHBondContact O-N 3.47Å; H931-N935 PolarHBondContact CE1-ND2 3.2Å; H931-N935 PolarHBondContact ND1-ND2 3.17Å; H931-N935 VanDerWaalsContact ND1-ND2 3.18Å; H931-N935 PolarHBondContact O-N 3.37Å; H931-N935 VanDerWaalsContact O-N 3.16Å; H931-N935 PolarHBondContact O-ND2 3.46Å; H931-N935 VanDerWaalsContact O-ND2 3.08Å
932	D	57.6	Low	62.9	Low	58 Å²	58	60.8 Å²	60.8	31%	0.31	33%	0.325	S	S	.	.	H	α-helix	trans	-70	-36.5	175.9	-59.1	-43.1	0	0	0	111.8	H928 T929 N936	H928-D932 HydrophobicContact CB-CB 4.34Å; T929-D932 PolarHBondContact N-OD2 3.43Å; T929-D932 PolarHBondContact O-N 3.17Å; T929-D932 PolarHBondContact OG1-N 3.04Å; T929-D932 PolarHBondContact OG1-OD2 3.49Å; D932-N936 PolarHBondContact O-N 3.08Å; D932-N936 PolarHBondContact O-ND2 3.42Å
933	M	62	Low	65.4	Low	38 Å²	38	53.4 Å²	53.4	19%	0.187	29%	0.286	C	S	.	.	H	α-helix	trans	-65.1	-43.8	173.7	-67.2	-176.4	70.7	0	0	111.5	H928 T929 N935 A937	H928-M933 HydrophobicContact CB-CG 4.36Å; T929-M933 PolarHBondContact O-N 3.49Å; T929-M933 VanDerWaalsContact O-N 3.08Å; M933-N935 VanDerWaalsContact C-N 3.33Å; M933-N935 PolarHBondContact O-N 3.28Å; M933-A937 VanDerWaalsContact O-CB 3.3Å; M933-A937 WeakPolarHBondContact O-CB 3.35Å; M933-A937 PolarHBondContact O-N 3.32Å
934	F	64.1	Low	67.6	Low	13 Å²	13	52.4 Å²	52.4	6%	0.057	28%	0.281	C	S	.	.	H	α-helix	trans	-59.3	-43.1	176.6	177.9	-103.1	0	0	0	112.4	L930 H931 N936 I940 L1092 F1118 P1120	L930-F934 WeakPolarHBondContact O-CB 3.42Å; L930-F934 PolarHBondContact O-N 2.7Å; L930-F934 VanDerWaalsContact O-N 3.08Å; H931-F934 PolarHBondContact O-N 3.47Å; F934-N936 PolarHBondContact O-N 3.07Å; F934-I940 HydrophobicContact CD2-CD1 4.29Å; F934-I940 HydrophobicContact CD2-CG2 4.41Å; F934-I940 HydrophobicContact CE2-CD1 4.04Å; F934-I940 HydrophobicContact CE2-CG2 4.05Å; F934-L1092 WeakPolarHBondContact CD2-O 3.38Å; F934-F1118 AromaticContact CE2-CE1 3.78Å; F934-F1118 HydrophobicContact CE2-CE1 3.78Å; F934-F1118 AromaticContact CE2-CZ 3.82Å; F934-F1118 HydrophobicContact CE2-CZ 3.82Å; F934-F1118 HydrophobicContact CZ-CD1 4.15Å; F934-F1118 AromaticContact CZ-CE1 3.55Å; F934-F1118 HydrophobicContact CZ-CE1 3.55Å; F934-F1118 HydrophobicContact CZ-CZ 4.07Å; F934-P1120 HydrophobicContact CB-CB 4.11Å; F934-P1120 HydrophobicContact CD1-CB 3.67Å; F934-P1120 HydrophobicContact CD1-CG 4.42Å; F934-P1120 HydrophobicContact CD2-CB 4.16Å; F934-P1120 HydrophobicContact CE1-CB 4.03Å; F934-P1120 HydrophobicContact CE2-CB 4.48Å; F934-P1120 HydrophobicContact CG-CB 3.72Å; F934-P1120 HydrophobicContact CZ-CB 4.4Å
935	N	65.2	Low	69.5	Low	37 Å²	37	46.6 Å²	46.6	20%	0.198	24%	0.243	C	C	.	.	H	α-helix	trans	-81.1	-8.5	-173.3	-76.1	-39.6	0	0	0	115.5	K913 H931 M933	K913-N935 HydrophobicContact CD-CB 4.3Å; K913-N935 VanDerWaalsContact CD-O 3.27Å; K913-N935 WeakPolarHBondContact CD-O 3.28Å; K913-N935 WeakPolarHBondContact CE-O 3.4Å; K913-N935 PolarHBondContact NZ-O 2.87Å; H931-N935 PolarHBondContact CE1-ND2 3.2Å; H931-N935 PolarHBondContact ND1-ND2 3.17Å; H931-N935 VanDerWaalsContact ND1-ND2 3.18Å; H931-N935 PolarHBondContact O-N 3.37Å; H931-N935 VanDerWaalsContact O-N 3.16Å; H931-N935 PolarHBondContact O-ND2 3.46Å; H931-N935 VanDerWaalsContact O-ND2 3.08Å; M933-N935 VanDerWaalsContact C-N 3.33Å; M933-N935 PolarHBondContact O-N 3.28Å
936	N	72.5	Confident	71.3	Confident	35 Å²	35	43.8 Å²	43.8	19%	0.187	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.6	13.8	-177.9	-63.5	-44.4	0	0	0	112.9	D932 F934	D932-N936 PolarHBondContact O-N 3.08Å; D932-N936 PolarHBondContact O-ND2 3.42Å; F934-N936 PolarHBondContact O-N 3.07Å
937	A	82.6	Confident	73	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.223	C	C	.	.			trans	-85.5	138.2	-179.1	0	0	0	0	0	112.3	G915 M933 I940 C1089	G915-A937 PolarHBondContact N-O 3.47Å; M933-A937 VanDerWaalsContact O-CB 3.3Å; M933-A937 WeakPolarHBondContact O-CB 3.35Å; M933-A937 PolarHBondContact O-N 3.32Å; A937-I940 HydrophobicContact CB-CG1 4.27Å; A937-C1089 WeakPolarHBondContact CA-O 3.41Å; A937-C1089 WeakPolarHBondContact CB-O 3.33Å
938	S	85.3	Confident	74.8	Confident	9 Å²	9	34.6 Å²	34.6	6%	0.063	18%	0.183	C	C	.	.	S	Bend	trans	-76	-31.3	168.2	55.7	0	0	0	0	111.6	P1058 R1059 T1060 C1089	S938-P1058 VanDerWaalsContact O-O 3.12Å; S938-R1059 WeakPolarHBondContact O-CA 3.01Å; S938-T1060 PolarHBondContact O-N 3.43Å; S938-C1089 PolarHBondContact N-O 2.8Å; S938-C1089 VanDerWaalsContact N-O 3.15Å
939	V	90.2	Very high	76.5	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	123.5	-179.8	-178.4	0	0	0	0	109.4	V1042 L1045 A1046 T1060 C1089 I1090 G1091	V939-V1042 HydrophobicContact CG1-CG1 4.28Å; V939-L1045 HydrophobicContact CG2-CB 4.2Å; V939-A1046 HydrophobicContact CG2-CB 4.01Å; V939-T1060 HydrophobicContact CG1-CG2 4.05Å; V939-C1089 PolarHBondContact N-O 2.87Å; V939-I1090 HydrophobicContact CB-CG1 4.49Å; V939-I1090 CarbonylContact O-C 3.55Å; V939-I1090 VanDerWaalsContact O-CA 3.3Å; V939-I1090 WeakPolarHBondContact O-CA 3.29Å; V939-G1091 PolarHBondContact O-N 3.39Å
940	I	92.2	Very high	78.1	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	124.9	173	-64.8	177	0	0	0	109.9	K913 L914 F934 A937 V942 T1060 L1061 F1062 G1091 F1118	K913-I940 WeakPolarHBondContact O-CD1 3.34Å; L914-I940 HydrophobicContact CD2-CB 4.02Å; L914-I940 HydrophobicContact CD2-CD1 3.47Å; L914-I940 VanDerWaalsContact CD2-CD1 3.47Å; L914-I940 HydrophobicContact CD2-CG1 3.54Å; L914-I940 HydrophobicContact CG-CD1 4.41Å; F934-I940 HydrophobicContact CD2-CD1 4.29Å; F934-I940 HydrophobicContact CD2-CG2 4.41Å; F934-I940 HydrophobicContact CE2-CD1 4.04Å; F934-I940 HydrophobicContact CE2-CG2 4.05Å; A937-I940 HydrophobicContact CB-CG1 4.27Å; I940-V942 HydrophobicContact CG2-CG2 4.38Å; I940-V942 PolarHBondContact O-N 2.99Å; I940-T1060 PolarHBondContact N-O 3.34Å; I940-L1061 HydrophobicContact CB-CD2 4.24Å; I940-F1062 PolarHBondContact O-N 2.93Å; I940-G1091 WeakPolarHBondContact CA-O 3.29Å; I940-F1118 HydrophobicContact CG2-CZ 3.8Å
941	L	92	Very high	79.7	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	114.6	167.8	-68.2	169.8	0	0	0	109.1	V1042 F1062 T1064 L1069 V1073 I1090 G1091 L1092 G1093	L941-V1042 HydrophobicContact CD2-CG1 4.07Å; L941-V1042 HydrophobicContact CD2-CG2 3.79Å; L941-V1042 HydrophobicContact CG-CG1 4.47Å; L941-F1062 CarbonylContact C-O 3.17Å; L941-F1062 VanDerWaalsContact CA-O 3.28Å; L941-F1062 WeakPolarHBondContact CA-O 3.48Å; L941-F1062 HydrophobicContact CD2-CB 4.08Å; L941-F1062 HydrophobicContact CD2-CD1 3.74Å; L941-F1062 HydrophobicContact CD2-CG 4.14Å; L941-T1064 HydrophobicContact CD2-CG2 4.22Å; L941-L1069 HydrophobicContact CD1-CG 4.37Å; L941-L1069 HydrophobicContact CD2-CD2 4.22Å; L941-V1073 HydrophobicContact CD1-CB 4.45Å; L941-V1073 HydrophobicContact CD1-CG2 3.79Å; L941-I1090 HydrophobicContact CD1-CG2 3.86Å; L941-I1090 HydrophobicContact CG-CG2 4.03Å; L941-G1091 PolarHBondContact N-O 3.07Å; L941-L1092 HydrophobicContact CB-CD2 3.96Å; L941-L1092 HydrophobicContact CD1-CD2 3.93Å; L941-G1093 PolarHBondContact O-N 3.37Å
942	V	92	Very high	81.4	Confident	0 Å²	0	25 Å²	25	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	115.2	178.1	-178.2	0	0	0	0	108.6	I940 K950 L953 L1061 F1062 S1063 T1064 F1118	I940-V942 HydrophobicContact CG2-CG2 4.38Å; I940-V942 PolarHBondContact O-N 2.99Å; V942-K950 HydrophobicContact CG1-CB 4.39Å; V942-K950 HydrophobicContact CG1-CD 4.29Å; V942-K950 HydrophobicContact CG1-CG 4.12Å; V942-L953 HydrophobicContact CG1-CD2 4.44Å; V942-L1061 HydrophobicContact CG2-CB 4.39Å; V942-L1061 HydrophobicContact CG2-CD2 4.17Å; V942-F1062 PolarHBondContact N-O 3.02Å; V942-S1063 VanDerWaalsContact O-CA 3.27Å; V942-S1063 WeakPolarHBondContact O-CA 3.41Å; V942-T1064 PolarHBondContact O-N 3.18Å; V942-T1064 VanDerWaalsContact O-N 3.15Å; V942-F1118 HydrophobicContact CB-CE2 4.42Å; V942-F1118 HydrophobicContact CG1-CE2 3.99Å; V942-F1118 HydrophobicContact CG2-CE2 4.04Å; V942-F1118 HydrophobicContact CG2-CZ 4.08Å
943	T	89.7	Confident	83.1	Confident	8 Å²	8	22.3 Å²	22.3	5%	0.049	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	172.3	176.8	64.2	0	0	0	0	110.6	T1064 V1070 G1093 H1094 M1095 C1123	T943-T1064 HydrophobicContact CG2-CG2 4.25Å; T943-V1070 HydrophobicContact CG2-CG1 4.33Å; T943-V1070 HydrophobicContact CG2-CG2 3.42Å; T943-V1070 VanDerWaalsContact CG2-CG2 3.42Å; T943-G1093 PolarHBondContact N-O 3.03Å; T943-G1093 PolarHBondContact OG1-O 2.83Å; T943-G1093 VanDerWaalsContact OG1-O 3.1Å; T943-H1094 CarbonylContact O-C 3.51Å; T943-H1094 WeakPolarHBondContact O-CA 3.37Å; T943-H1094 WeakPolarHBondContact O-CB 3.18Å; T943-H1094 WeakPolarHBondContact OG1-CB 3.32Å; T943-M1095 PolarHBondContact O-N 3.22Å; T943-C1123 PolarHBondContact OG1-N 3.16Å; T943-C1123 VanDerWaalsContact OG1-N 3.14Å
944	G	85	Confident	84.7	Confident	12 Å²	12	20.5 Å²	20.5	12%	0.124	12%	0.12	C	C	.	.			trans	135	168.2	175.6	0	0	0	0	0	113.5	K950	G944-K950 PolarHBondContact O-NZ 3.49Å
945	P	81.3	Confident	86.2	Confident	5 Å²	5	23.1 Å²	23.1	3%	0.032	13%	0.13	C	C	.	.			trans	-57.9	152.3	-174.8	22.4	-32.3	0	0	0	113.1	G948 K950 C1097 F1114 Y1127	P945-G948 PolarHBondContact O-N 3.01Å; P945-G948 VanDerWaalsContact O-N 3.13Å; P945-K950 PolarHBondContact O-NZ 3.31Å; P945-C1097 HydrophobicContact CG-CB 4.14Å; P945-F1114 HydrophobicContact CB-CD1 4.35Å; P945-F1114 HydrophobicContact CB-CE1 3.64Å; P945-F1114 HydrophobicContact CG-CD1 3.81Å; P945-F1114 HydrophobicContact CG-CE1 3.61Å; P945-Y1127 HydrophobicContact CB-CD2 4.06Å; P945-Y1127 HydrophobicContact CG-CD2 4.39Å
946	N	77.5	Confident	87.6	Confident	70 Å²	70	21.6 Å²	21.6	37%	0.374	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	143.6	164.1	-72.6	-20.3	0	0	0	109.3	G948 H1065 A1131	N946-G948 PolarHBondContact O-N 3.46Å; N946-H1065 PolarHBondContact OD1-CE1 3.47Å; N946-H1065 PolarHBondContact OD1-NE2 3.38Å; N946-A1131 HydrophobicContact CB-CB 4.37Å
947	M	77.5	Confident	88.7	Confident	111 Å²	111	20 Å²	20	55%	0.547	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.8	-2.7	-171.1	-47	168.6	67.7	0	0	115.5	G949 F1114 Y1116 A1131 L1134	M947-G949 PolarHBondContact O-N 2.69Å; M947-G949 VanDerWaalsContact O-N 3.09Å; M947-F1114 HydrophobicContact CB-CE2 4.1Å; M947-F1114 HydrophobicContact CB-CZ 4.31Å; M947-Y1116 WeakPolarHBondContact O-CE1 3.48Å; M947-A1131 HydrophobicContact SD-CB 3.94Å; M947-L1134 HydrophobicContact CE-CB 4.31Å; M947-L1134 HydrophobicContact CE-CD1 4.32Å; M947-L1134 HydrophobicContact SD-CB 4.38Å; M947-L1134 HydrophobicContact SD-CD1 4.28Å
948	G	82	Confident	89.4	Confident	3 Å²	3	20 Å²	20	3%	0.031	11%	0.112	C	C	.	.	S	Bend	trans	-73	6.4	-179.9	0	0	0	0	0	116.1	P945 N946 M1095	P945-G948 PolarHBondContact O-N 3.01Å; P945-G948 VanDerWaalsContact O-N 3.13Å; N946-G948 PolarHBondContact O-N 3.46Å; G948-M1095 WeakPolarHBondContact O-CE 3.29Å; G948-M1095 WeakPolarHBondContact O-CG 3.41Å
949	G	88.1	Confident	90	Very high	14 Å²	14	19.6 Å²	19.6	14%	0.144	11%	0.11	C	C	.	.	S	Bend	trans	88.8	15.5	176	0	0	0	0	0	116.8	M947 S951 T952 L953	M947-G949 PolarHBondContact O-N 2.69Å; M947-G949 VanDerWaalsContact O-N 3.09Å; G949-S951 PolarHBondContact O-N 2.98Å; G949-T952 WeakPolarHBondContact O-CB 3.28Å; G949-T952 PolarHBondContact O-N 2.87Å; G949-L953 PolarHBondContact O-N 3.35Å
950	K	90.6	Very high	90.3	Very high	9 Å²	9	19.6 Å²	19.6	4%	0.039	11%	0.11	C	C	.	.	H	α-helix	trans	-55.2	-51.2	-179.8	-63	-171.4	-63.3	-77.6	0	113.1	V942 G944 P945 T952 L953 M954 S1063 M1095	V942-K950 HydrophobicContact CG1-CB 4.39Å; V942-K950 HydrophobicContact CG1-CD 4.29Å; V942-K950 HydrophobicContact CG1-CG 4.12Å; G944-K950 PolarHBondContact O-NZ 3.49Å; P945-K950 PolarHBondContact O-NZ 3.31Å; K950-T952 VanDerWaalsContact C-N 3.32Å; K950-T952 PolarHBondContact O-N 3.14Å; K950-L953 WeakPolarHBondContact O-CB 2.91Å; K950-L953 PolarHBondContact O-N 3.13Å; K950-M954 PolarHBondContact O-N 2.97Å; K950-M954 VanDerWaalsContact O-N 3.14Å; K950-S1063 WeakPolarHBondContact CE-OG 3.27Å; K950-M1095 HydrophobicContact CG-CG 3.76Å
951	S	90.6	Very high	90.6	Very high	41 Å²	41	19.6 Å²	19.6	29%	0.287	11%	0.11	S	C	.	.	H	α-helix	trans	-66.2	-36.9	179.3	-35.9	0	0	0	0	111.3	G949 M954 R955 D1023	G949-S951 PolarHBondContact O-N 2.98Å; S951-M954 PolarHBondContact O-N 2.96Å; S951-R955 WeakPolarHBondContact O-CG 3.43Å; S951-R955 PolarHBondContact O-N 2.82Å; S951-D1023 WeakPolarHBondContact CB-OD2 3.43Å; S951-D1023 PolarHBondContact OG-OD2 3.1Å
952	T	91.2	Very high	90.8	Very high	62 Å²	62	19.6 Å²	19.6	38%	0.38	11%	0.11	S	C	.	.	H	α-helix	trans	-62.2	-42.9	174.6	-48.5	0	0	0	0	112	L898 G949 K950 M954 R955 Q956	L898-T952 HydrophobicContact CD1-CG2 3.85Å; G949-T952 WeakPolarHBondContact O-CB 3.28Å; G949-T952 PolarHBondContact O-N 2.87Å; K950-T952 VanDerWaalsContact C-N 3.32Å; K950-T952 PolarHBondContact O-N 3.14Å; T952-M954 PolarHBondContact O-N 3.4Å; T952-R955 PolarHBondContact O-N 3.32Å; T952-Q956 VanDerWaalsContact O-CB 3.28Å; T952-Q956 WeakPolarHBondContact O-CB 3.35Å; T952-Q956 PolarHBondContact O-N 3.17Å
953	L	94.3	Very high	91.1	Very high	2 Å²	2	19.6 Å²	19.6	1%	0.01	11%	0.11	C	C	.	.	H	α-helix	trans	-59.6	-45.7	175.1	177.6	72.5	0	0	0	111.4	N910 I912 V942 G949 K950 Q956 A957 M1095 F1118	N910-L953 HydrophobicContact CB-CD1 3.51Å; I912-L953 HydrophobicContact CD1-CD1 3.83Å; I912-L953 HydrophobicContact CD1-CG 4.3Å; I912-L953 HydrophobicContact CG1-CD1 4.15Å; V942-L953 HydrophobicContact CG1-CD2 4.44Å; G949-L953 PolarHBondContact O-N 3.35Å; K950-L953 WeakPolarHBondContact O-CB 2.91Å; K950-L953 PolarHBondContact O-N 3.13Å; L953-Q956 WeakPolarHBondContact O-CB 3.44Å; L953-Q956 PolarHBondContact O-N 2.57Å; L953-A957 PolarHBondContact O-N 3.48Å; L953-M1095 HydrophobicContact CB-SD 4.48Å; L953-M1095 HydrophobicContact CD2-SD 3.9Å; L953-F1118 HydrophobicContact CD1-CB 4.13Å; L953-F1118 HydrophobicContact CD2-CB 3.86Å; L953-F1118 HydrophobicContact CD2-CD1 4.05Å; L953-F1118 HydrophobicContact CD2-CD2 3.57Å; L953-F1118 HydrophobicContact CD2-CE1 4.47Å; L953-F1118 HydrophobicContact CD2-CE2 4.06Å; L953-F1118 HydrophobicContact CD2-CG 3.56Å; L953-F1118 HydrophobicContact CD2-CZ 4.47Å
954	M	95.1	Very high	91.5	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-64.6	-44.4	178.3	-71.5	-173.3	-74.8	0	0	111.9	K950 S951 T952 Q956 A957 A958 L987 L1021 D1023 L1061	K950-M954 PolarHBondContact O-N 2.97Å; K950-M954 VanDerWaalsContact O-N 3.14Å; S951-M954 PolarHBondContact O-N 2.96Å; T952-M954 PolarHBondContact O-N 3.4Å; M954-Q956 PolarHBondContact O-N 3.4Å; M954-A957 WeakPolarHBondContact O-CB 3.35Å; M954-A957 PolarHBondContact O-N 3.16Å; M954-A958 PolarHBondContact O-N 3.07Å; M954-L987 HydrophobicContact CB-CD2 3.79Å; M954-L987 HydrophobicContact CE-CD2 3.65Å; M954-L987 HydrophobicContact SD-CD2 3.98Å; M954-L1021 HydrophobicContact CB-CB 4.36Å; M954-L1021 HydrophobicContact CB-CD1 4.2Å; M954-L1021 HydrophobicContact CB-CD2 4.12Å; M954-L1021 HydrophobicContact CB-CG 4.48Å; M954-L1021 HydrophobicContact CG-CD2 4.38Å; M954-L1021 WeakPolarHBondContact O-CD1 3.49Å; M954-L1021 HydrophobicContact SD-CB 4.43Å; M954-D1023 HydrophobicContact CE-CB 3.65Å; M954-D1023 VanDerWaalsContact CE-CG 3.42Å; M954-D1023 WeakPolarHBondContact CE-OD1 3.44Å; M954-L1061 HydrophobicContact CG-CB 3.96Å; M954-L1061 HydrophobicContact CG-CD1 4.08Å; M954-L1061 HydrophobicContact SD-CB 4.23Å
955	R	94.6	Very high	92.1	Very high	68 Å²	68	18.6 Å²	18.6	26%	0.257	10%	0.101	S	C	.	.	H	α-helix	trans	-59.3	-46.9	174.1	-70.2	-177.7	-171.4	-161.3	-2.9	111.5	N547 L548 D549 S951 T952 A957 A958 L959 L987	N547-R955 PolarHBondContact O-NE 2.84Å; L548-R955 HydrophobicContact CD2-CB 4.22Å; L548-R955 HydrophobicContact CD2-CG 3.99Å; D549-R955 IonicContact OD2-CZ 3.22Å; D549-R955 IonicContact OD2-NH1 2.77Å; D549-R955 PolarHBondContact OD2-NH1 2.84Å; S951-R955 WeakPolarHBondContact O-CG 3.43Å; S951-R955 PolarHBondContact O-N 2.82Å; T952-R955 PolarHBondContact O-N 3.32Å; R955-A957 VanDerWaalsContact C-N 3.31Å; R955-A957 PolarHBondContact O-N 3.32Å; R955-A958 PolarHBondContact O-N 2.83Å; R955-L959 WeakPolarHBondContact O-CB 3.22Å; R955-L959 VanDerWaalsContact O-CG 3.27Å; R955-L959 WeakPolarHBondContact O-CG 3.37Å; R955-L959 PolarHBondContact O-N 2.75Å; R955-L987 HydrophobicContact CG-CD1 3.58Å
956	Q	95.1	Very high	92.8	Very high	5 Å²	5	18.4 Å²	18.4	2%	0.023	10%	0.1	C	C	.	.	H	α-helix	trans	-53.8	-48.8	176	171.3	-177.7	-37.8	0	0	111	G893 H895 T952 L953 M954 A958 L959 L960	G893-Q956 PolarHBondContact O-NE2 3Å; H895-Q956 HydrophobicContact CB-CB 4.07Å; H895-Q956 HydrophobicContact CB-CG 4.27Å; T952-Q956 VanDerWaalsContact O-CB 3.28Å; T952-Q956 WeakPolarHBondContact O-CB 3.35Å; T952-Q956 PolarHBondContact O-N 3.17Å; L953-Q956 WeakPolarHBondContact O-CB 3.44Å; L953-Q956 PolarHBondContact O-N 2.57Å; M954-Q956 PolarHBondContact O-N 3.4Å; Q956-A958 PolarHBondContact O-N 2.91Å; Q956-L959 PolarHBondContact O-N 3.13Å; Q956-L960 HydrophobicContact CG-CD1 3.75Å; Q956-L960 HydrophobicContact CG-CG 4.31Å; Q956-L960 WeakPolarHBondContact O-CB 3.29Å; Q956-L960 WeakPolarHBondContact O-CG 3.47Å; Q956-L960 PolarHBondContact O-N 3.08Å
957	A	96.3	Very high	93.7	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-56.9	-49.5	179.7	0	0	0	0	0	112.3	I912 L953 M954 R955 V961 L1061	I912-A957 HydrophobicContact CD1-CB 3.53Å; L953-A957 PolarHBondContact O-N 3.48Å; M954-A957 WeakPolarHBondContact O-CB 3.35Å; M954-A957 PolarHBondContact O-N 3.16Å; R955-A957 VanDerWaalsContact C-N 3.31Å; R955-A957 PolarHBondContact O-N 3.32Å; A957-V961 WeakPolarHBondContact O-CG2 3.28Å; A957-V961 PolarHBondContact O-N 2.75Å; A957-V961 VanDerWaalsContact O-N 3.15Å; A957-L1061 HydrophobicContact CB-CD1 3.84Å
958	A	97.2	Very high	94.5	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-67.1	-43.1	179.6	0	0	0	0	0	112.9	L548 M954 R955 Q956 L960 V961 I962 I983 L1019 L1021	L548-A958 HydrophobicContact CD1-CB 3.59Å; L548-A958 HydrophobicContact CD2-CB 3.91Å; L548-A958 HydrophobicContact CG-CB 4.44Å; M954-A958 PolarHBondContact O-N 3.07Å; R955-A958 PolarHBondContact O-N 2.83Å; Q956-A958 PolarHBondContact O-N 2.91Å; A958-L960 VanDerWaalsContact C-N 3.33Å; A958-L960 PolarHBondContact O-N 2.96Å; A958-V961 PolarHBondContact O-N 3.44Å; A958-I962 WeakPolarHBondContact O-CG1 3.48Å; A958-I962 PolarHBondContact O-N 3.44Å; A958-I983 HydrophobicContact CB-CD1 4.26Å; A958-I983 HydrophobicContact CB-CG2 3.98Å; A958-L1019 HydrophobicContact CB-CD2 4.27Å; A958-L1021 HydrophobicContact CB-CD1 3.55Å
959	L	96.8	Very high	95.2	Very high	1 Å²	1	12.8 Å²	12.8	1%	0.005	7%	0.067	C	C	.	.	H	α-helix	trans	-63.6	-39.4	179.7	-67.5	173.2	0	0	0	111.7	L548 I550 L563 H895 P896 R955 Q956 V961 I962 L963	L548-L959 HydrophobicContact CB-CD2 4.27Å; I550-L959 HydrophobicContact CG1-CD2 4.28Å; L563-L959 HydrophobicContact CB-CD2 4.27Å; L563-L959 HydrophobicContact CD1-CD2 4.46Å; L563-L959 HydrophobicContact CD2-CD2 3.93Å; L563-L959 HydrophobicContact CG-CD2 4.44Å; H895-L959 WeakPolarHBondContact CE1-CD1 3.28Å; P896-L959 HydrophobicContact CG-CB 3.69Å; P896-L959 HydrophobicContact CG-CD1 4.06Å; P896-L959 HydrophobicContact CG-CG 4.5Å; R955-L959 WeakPolarHBondContact O-CB 3.22Å; R955-L959 VanDerWaalsContact O-CG 3.27Å; R955-L959 WeakPolarHBondContact O-CG 3.37Å; R955-L959 PolarHBondContact O-N 2.75Å; Q956-L959 PolarHBondContact O-N 3.13Å; L959-V961 VanDerWaalsContact C-N 3.35Å; L959-I962 PolarHBondContact O-N 3.27Å; L959-L963 VanDerWaalsContact O-CG 3.29Å; L959-L963 WeakPolarHBondContact O-CG 3.15Å; L959-L963 PolarHBondContact O-N 3.31Å
960	L	97.4	Very high	95.6	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-63.6	-39.8	174.6	-71.8	176.3	0	0	0	112.1	I890 Q956 A958 L963 A964 I970 P971	I890-L960 HydrophobicContact CD1-CB 4.06Å; I890-L960 HydrophobicContact CD1-CD1 4.03Å; I890-L960 HydrophobicContact CG2-CD1 3.89Å; Q956-L960 HydrophobicContact CG-CD1 3.75Å; Q956-L960 HydrophobicContact CG-CG 4.31Å; Q956-L960 WeakPolarHBondContact O-CB 3.29Å; Q956-L960 WeakPolarHBondContact O-CG 3.47Å; Q956-L960 PolarHBondContact O-N 3.08Å; A958-L960 VanDerWaalsContact C-N 3.33Å; A958-L960 PolarHBondContact O-N 2.96Å; L960-L963 PolarHBondContact O-N 3.35Å; L960-A964 WeakPolarHBondContact O-CB 3.43Å; L960-A964 PolarHBondContact O-N 3.45Å; L960-I970 HydrophobicContact CB-CD1 4.24Å; L960-I970 HydrophobicContact CD2-CB 4.03Å; L960-I970 HydrophobicContact CD2-CD1 4.19Å; L960-I970 HydrophobicContact CD2-CG1 4.36Å; L960-P971 HydrophobicContact CD2-CG 3.8Å
961	V	97.7	Very high	95.8	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-64.5	-41.7	174.3	168.1	0	0	0	0	111.6	M538 L888 A957 A958 L959 A964 H965 L977 V980 I983 L1019	M538-V961 HydrophobicContact CE-CG1 4.14Å; L888-V961 HydrophobicContact CD1-CG2 3.65Å; L888-V961 HydrophobicContact CD2-CG2 3.85Å; L888-V961 HydrophobicContact CG-CG2 4.43Å; A957-V961 WeakPolarHBondContact O-CG2 3.28Å; A957-V961 PolarHBondContact O-N 2.75Å; A957-V961 VanDerWaalsContact O-N 3.15Å; A958-V961 PolarHBondContact O-N 3.44Å; L959-V961 VanDerWaalsContact C-N 3.35Å; V961-A964 WeakPolarHBondContact O-CB 3.24Å; V961-A964 PolarHBondContact O-N 2.93Å; V961-H965 PolarHBondContact O-N 3.43Å; V961-H965 PolarHBondContact O-ND1 3.39Å; V961-L977 HydrophobicContact CG1-CD1 4.42Å; V961-L977 HydrophobicContact CG2-CD1 4.42Å; V961-V980 HydrophobicContact CG1-CB 4.13Å; V961-V980 HydrophobicContact CG1-CG1 4.44Å; V961-V980 HydrophobicContact CG1-CG2 3.83Å; V961-I983 HydrophobicContact CB-CD1 4.5Å; V961-I983 HydrophobicContact CG1-CD1 4.11Å; V961-L1019 HydrophobicContact CB-CD2 4.37Å; V961-L1019 HydrophobicContact CG2-CD2 4.13Å
962	I	97.6	Very high	96.1	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-62	-48.2	176.2	-69	164.6	0	0	0	110.3	M538 L540 L548 I550 L563 P586 A958 L959 A964 H965 L966 I983	M538-I962 HydrophobicContact SD-CG1 4.34Å; L540-I962 HydrophobicContact CD1-CD1 4.13Å; L540-I962 HydrophobicContact CD1-CG1 4.4Å; L540-I962 HydrophobicContact CD2-CD1 4.12Å; L540-I962 HydrophobicContact CD2-CG1 4.32Å; L548-I962 HydrophobicContact CD1-CD1 4.05Å; I550-I962 HydrophobicContact CD1-CD1 3.59Å; L563-I962 HydrophobicContact CD2-CG2 3.94Å; P586-I962 HydrophobicContact CG-CG2 4.03Å; A958-I962 WeakPolarHBondContact O-CG1 3.48Å; A958-I962 PolarHBondContact O-N 3.44Å; L959-I962 PolarHBondContact O-N 3.27Å; I962-A964 VanDerWaalsContact C-N 3.28Å; I962-A964 PolarHBondContact O-N 3.31Å; I962-H965 PolarHBondContact O-N 2.94Å; I962-H965 VanDerWaalsContact O-N 3.11Å; I962-L966 HydrophobicContact CG2-CD1 4.48Å; I962-L966 WeakPolarHBondContact O-CG 3.37Å; I962-L966 PolarHBondContact O-N 3.28Å; I962-I983 HydrophobicContact CD1-CD1 4.01Å; I962-I983 HydrophobicContact CG1-CD1 3.6Å
963	L	97.5	Very high	96.3	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-59.3	-39.4	176.7	-71.2	171.6	0	0	0	112.2	L563 L567 Y864 P896 L959 L960 L966 G967 C968 I970	L563-L963 HydrophobicContact CD1-CD2 4.12Å; L563-L963 HydrophobicContact CD1-CG 4.43Å; L567-L963 HydrophobicContact CD1-CD2 3.85Å; L567-L963 HydrophobicContact CD2-CD2 3.73Å; L567-L963 HydrophobicContact CG-CD2 4.25Å; Y864-L963 HydrophobicContact CE1-CD1 4.02Å; Y864-L963 HydrophobicContact CE1-CD2 3.93Å; Y864-L963 VanDerWaalsContact OH-CD1 3.28Å; Y864-L963 WeakPolarHBondContact OH-CD1 3.28Å; P896-L963 HydrophobicContact CB-CD1 3.68Å; P896-L963 HydrophobicContact CG-CD1 3.85Å; L959-L963 VanDerWaalsContact O-CG 3.29Å; L959-L963 WeakPolarHBondContact O-CG 3.15Å; L959-L963 PolarHBondContact O-N 3.31Å; L960-L963 PolarHBondContact O-N 3.35Å; L963-L966 HydrophobicContact CD2-CD1 4.38Å; L963-L966 WeakPolarHBondContact O-CB 3.35Å; L963-L966 PolarHBondContact O-N 3.26Å; L963-G967 PolarHBondContact O-N 3.11Å; L963-C968 PolarHBondContact O-SG 3.47Å; L963-I970 HydrophobicContact CB-CG2 3.58Å
964	A	97.5	Very high	96.4	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-61.8	-43.4	174.8	0	0	0	0	0	111.8	I593 P875 F877 L960 V961 I962 L966 G967 I970 L977	I593-A964 WeakPolarHBondContact CG2-O 3.49Å; P875-A964 HydrophobicContact CB-CB 3.73Å; P875-A964 HydrophobicContact CG-CB 3.64Å; F877-A964 HydrophobicContact CE2-CB 4.17Å; F877-A964 WeakPolarHBondContact CE2-O 3.35Å; F877-A964 HydrophobicContact CZ-CB 3.99Å; F877-A964 WeakPolarHBondContact CZ-O 3.25Å; L960-A964 WeakPolarHBondContact O-CB 3.43Å; L960-A964 PolarHBondContact O-N 3.45Å; V961-A964 WeakPolarHBondContact O-CB 3.24Å; V961-A964 PolarHBondContact O-N 2.93Å; I962-A964 VanDerWaalsContact C-N 3.28Å; I962-A964 PolarHBondContact O-N 3.31Å; A964-L966 VanDerWaalsContact C-N 3.32Å; A964-L966 PolarHBondContact O-N 2.93Å; A964-G967 PolarHBondContact O-N 3.46Å; A964-I970 HydrophobicContact CB-CG2 4.34Å; A964-L977 HydrophobicContact CB-CD1 4.19Å; A964-L977 HydrophobicContact CB-CD2 4.36Å
965	H	97.8	Very high	96.5	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-70.8	-24.8	177.2	-73.7	74.4	0	0	0	113.1	M538 P586 P587 I593 F877 V961 I962 G967 V980	M538-H965 HydrophobicContact CE-CB 4Å; M538-H965 VanDerWaalsContact CE-CD2 3.42Å; M538-H965 WeakPolarHBondContact CE-CD2 3.31Å; M538-H965 VanDerWaalsContact CE-CE1 3.48Å; M538-H965 WeakPolarHBondContact CE-CE1 3.47Å; M538-H965 WeakPolarHBondContact CE-ND1 3.27Å; P586-H965 HydrophobicContact CB-CB 3.84Å; P587-H965 VanDerWaalsContact CD-O 3.28Å; P587-H965 WeakPolarHBondContact CD-O 3.47Å; P587-H965 VanDerWaalsContact CG-O 3.24Å; P587-H965 WeakPolarHBondContact CG-O 3.19Å; P587-H965 PolarHBondContact O-CD2 3.18Å; I593-H965 HydrophobicContact CD1-CB 4.44Å; F877-H965 AromaticContact CE1-CE1 3.68Å; F877-H965 AromaticContact CE1-NE2 3.69Å; F877-H965 AromaticContact CZ-ND1 3.92Å; V961-H965 PolarHBondContact O-N 3.43Å; V961-H965 PolarHBondContact O-ND1 3.39Å; I962-H965 PolarHBondContact O-N 2.94Å; I962-H965 VanDerWaalsContact O-N 3.11Å; H965-G967 PolarHBondContact O-N 2.97Å; H965-V980 PolarHBondContact NE2-N 3.05Å
966	L	97.1	Very high	96.6	Very high	0 Å²	0	16 Å²	16	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-65.4	-20.9	169.2	-70.3	174.6	0	0	0	112.6	L567 W582 I583 P586 R596 L861 I962 L963 A964	L567-L966 HydrophobicContact CD1-CD1 3.72Å; W582-L966 HydrophobicContact CB-CD2 4.11Å; W582-L966 VanDerWaalsContact O-CD2 3.23Å; W582-L966 WeakPolarHBondContact O-CD2 3.42Å; I583-L966 HydrophobicContact CG1-CD1 4.06Å; P586-L966 HydrophobicContact CB-CD2 4.31Å; R596-L966 WeakPolarHBondContact CD-O 3.48Å; R596-L966 PolarHBondContact NH1-O 3.46Å; L861-L966 HydrophobicContact CD1-CB 4.47Å; L861-L966 HydrophobicContact CD2-CB 4.38Å; L861-L966 HydrophobicContact CD2-CD1 4.41Å; I962-L966 HydrophobicContact CG2-CD1 4.48Å; I962-L966 WeakPolarHBondContact O-CG 3.37Å; I962-L966 PolarHBondContact O-N 3.28Å; L963-L966 HydrophobicContact CD2-CD1 4.38Å; L963-L966 WeakPolarHBondContact O-CB 3.35Å; L963-L966 PolarHBondContact O-N 3.26Å; A964-L966 VanDerWaalsContact C-N 3.32Å; A964-L966 PolarHBondContact O-N 2.93Å
967	G	95.8	Very high	96.6	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.9	11.7	179.6	0	0	0	0	0	114.2	Q597 I600 L963 A964 H965	Q597-G967 WeakPolarHBondContact CA-O 3.41Å; Q597-G967 WeakPolarHBondContact CG-O 3.5Å; I600-G967 WeakPolarHBondContact CD1-O 3.41Å; L963-G967 PolarHBondContact O-N 3.11Å; A964-G967 PolarHBondContact O-N 3.46Å; H965-G967 PolarHBondContact O-N 2.97Å
968	C	94.6	Very high	96.5	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	7%	0.073	C	C	.	.	S	Bend	trans	-89.9	168.1	176.4	68.1	0	0	0	0	112.3	I600 L861 P875 L963	I600-C968 HydrophobicContact CD1-CB 4.08Å; L861-C968 HydrophobicContact CB-CB 4.05Å; L861-C968 HydrophobicContact CD2-CB 4.16Å; P875-C968 WeakPolarHBondContact CD-O 3.22Å; L963-C968 PolarHBondContact O-SG 3.47Å
969	R	96.4	Very high	96.4	Very high	67 Å²	67	15.8 Å²	15.8	25%	0.253	7%	0.073	S	C	.	.			trans	-70.3	148	166.1	-62.7	-175	177.7	-167.5	1.6	109.5	E601 S865 M872 C873 L874	E601-R969 IonicContact OE1-CZ 3.26Å; E601-R969 VanDerWaalsContact OE1-CZ 3.25Å; E601-R969 IonicContact OE1-NE 2.85Å; E601-R969 PolarHBondContact OE1-NE 2.97Å; E601-R969 IonicContact OE1-NH2 2.65Å; E601-R969 PolarHBondContact OE1-NH2 3.18Å; E601-R969 IonicContact OE2-CZ 3.96Å; E601-R969 IonicContact OE2-NH2 3.41Å; E601-R969 PolarHBondContact OE2-NH2 3.27Å; S865-R969 PolarHBondContact OG-N 3.13Å; M872-R969 HydrophobicContact CB-CB 4.24Å; M872-R969 HydrophobicContact CE-CB 4.09Å; M872-R969 WeakPolarHBondContact CE-O 3.47Å; C873-R969 CarbonylContact O-C 3.49Å; C873-R969 VanDerWaalsContact O-CA 3.28Å; C873-R969 WeakPolarHBondContact O-CA 3.41Å; C873-R969 WeakPolarHBondContact O-CB 3.23Å; L874-R969 HydrophobicContact CB-CG 4.47Å; L874-R969 HydrophobicContact CD1-CG 4.09Å
970	I	96.6	Very high	96.3	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	7%	0.073	C	C	.	.	B	Isolated β-bridge	trans	-117.3	151.7	-178.7	74.8	175.1	0	0	0	110.6	M872 C873 P875 L960 L963 A964 A972 C975	M872-I970 CarbonylContact C-O 3.15Å; M872-I970 WeakPolarHBondContact CA-O 3.5Å; C873-I970 PolarHBondContact N-O 3.32Å; C873-I970 PolarHBondContact O-N 2.98Å; P875-I970 HydrophobicContact CG-CB 4.43Å; P875-I970 HydrophobicContact CG-CD1 3.97Å; P875-I970 HydrophobicContact CG-CG1 3.98Å; P875-I970 HydrophobicContact CG-CG2 3.72Å; L960-I970 HydrophobicContact CB-CD1 4.24Å; L960-I970 HydrophobicContact CD2-CB 4.03Å; L960-I970 HydrophobicContact CD2-CD1 4.19Å; L960-I970 HydrophobicContact CD2-CG1 4.36Å; L963-I970 HydrophobicContact CB-CG2 3.58Å; A964-I970 HydrophobicContact CB-CG2 4.34Å; I970-A972 VanDerWaalsContact C-N 3.27Å; I970-A972 HydrophobicContact CD1-CB 4.3Å; I970-A972 HydrophobicContact CG1-CB 4.07Å; I970-A972 PolarHBondContact O-N 3.15Å; I970-C975 HydrophobicContact CD1-CB 3.51Å; I970-C975 HydrophobicContact CG1-CB 4.32Å
971	P	95.3	Very high	96.1	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.075	C	C	.	.	S	Bend	trans	-75.6	81.9	179.2	31.9	-35.9	0	0	0	110.4	V871 M872 G893 I894 P896 I899 L960	V871-P971 WeakPolarHBondContact O-CA 3.46Å; M872-P971 VanDerWaalsContact SD-CA 3.53Å; M872-P971 HydrophobicContact SD-CB 3.76Å; G893-P971 CarbonylContact C-O 3.5Å; I894-P971 HydrophobicContact CB-CB 4.21Å; I894-P971 PolarHBondContact N-O 3.32Å; P896-P971 HydrophobicContact CB-CG 4.24Å; I899-P971 HydrophobicContact CD1-CB 4Å; I899-P971 HydrophobicContact CD1-CG 4.11Å; L960-P971 HydrophobicContact CD2-CG 3.8Å
972	A	95.7	Very high	95.9	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	8%	0.079	C	C	.	.	S	Bend	trans	-156.1	159.7	177.3	0	0	0	0	0	108.8	M872 C873 I890 D892 I970	M872-A972 CarbonylContact C-O 3.14Å; C873-A972 WeakPolarHBondContact CB-O 3.5Å; C873-A972 PolarHBondContact N-O 2.91Å; C873-A972 VanDerWaalsContact N-O 3.13Å; C873-A972 PolarHBondContact SG-O 2.92Å; C873-A972 VanDerWaalsContact SG-O 3.4Å; I890-A972 HydrophobicContact CG2-CB 4.07Å; D892-A972 WeakPolarHBondContact O-CA 3.33Å; I970-A972 VanDerWaalsContact C-N 3.27Å; I970-A972 HydrophobicContact CD1-CB 4.3Å; I970-A972 HydrophobicContact CG1-CB 4.07Å; I970-A972 PolarHBondContact O-N 3.15Å
973	K	96.1	Very high	95.8	Very high	139 Å²	139	17.1 Å²	17.1	60%	0.604	8%	0.079	S	C	*	.	S	Bend	trans	-73.2	-40.5	174.4	179.4	179	-179.5	178.8	0	111.9	V871 C873 V891 D892	V871-K973 HydrophobicContact CG1-CB 4.29Å; C873-K973 WeakPolarHBondContact CB-O 3.27Å; V891-K973 HydrophobicContact CG1-CB 4.38Å; V891-K973 HydrophobicContact CG1-CD 4.18Å; V891-K973 WeakPolarHBondContact O-CB 3.15Å; V891-K973 PolarHBondContact O-N 3.5Å; D892-K973 HydrophobicContact CB-CB 3.89Å
974	S	96.8	Very high	95.7	Very high	45 Å²	45	17.1 Å²	17.1	32%	0.315	8%	0.079	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	149.1	172.2	58.9	0	0	0	0	110.4	C873 V891	C873-S974 VanDerWaalsContact SG-C 3.58Å; C873-S974 VanDerWaalsContact SG-CA 3.58Å; V891-S974 WeakPolarHBondContact CB-OG 3.37Å; V891-S974 WeakPolarHBondContact CG2-OG 3.41Å; V891-S974 PolarHBondContact N-O 2.98Å; V891-S974 PolarHBondContact O-N 2.87Å
975	C	97.3	Very high	95.5	Very high	4 Å²	4	17.3 Å²	17.3	3%	0.027	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	128.2	174.2	-179	0	0	0	0	110.3	C873 P875 E876 E889 I970	C873-C975 PolarHBondContact SG-N 3.27Å; P875-C975 WeakPolarHBondContact CA-O 3.43Å; P875-C975 HydrophobicContact CB-CB 4.22Å; E876-C975 PolarHBondContact N-O 2.82Å; E889-C975 CarbonylContact O-C 3.5Å; E889-C975 VanDerWaalsContact O-CA 3.24Å; E889-C975 WeakPolarHBondContact O-CA 3.44Å; I970-C975 HydrophobicContact CD1-CB 3.51Å; I970-C975 HydrophobicContact CG1-CB 4.32Å
976	K	96.2	Very high	95.1	Very high	76 Å²	76	17.4 Å²	17.4	33%	0.33	8%	0.08	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	130	173.2	-55.1	-166.7	176.5	-144.9	0	108.8	E876 E889	E876-K976 HydrophobicContact CB-CG 4.19Å; E876-K976 WeakPolarHBondContact O-CA 3.41Å; E876-K976 IonicContact OE1-NZ 3.79Å; E876-K976 WeakPolarHBondContact OE2-CD 3.27Å; E876-K976 WeakPolarHBondContact OE2-CE 3.28Å; E876-K976 IonicContact OE2-NZ 3Å; E876-K976 PolarHBondContact OE2-NZ 3.2Å; E889-K976 HydrophobicContact CB-CB 4.34Å; E889-K976 PolarHBondContact N-O 2.81Å; E889-K976 PolarHBondContact O-N 3.16Å
977	L	95.9	Very high	94.4	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	149.3	-179.6	72.3	172.8	0	0	0	111.9	P875 E876 F877 I878 L887 L888 V961 A964	P875-L977 HydrophobicContact CB-CD2 4.05Å; E876-L977 PolarHBondContact O-N 3.46Å; F877-L977 CarbonylContact C-O 3.58Å; F877-L977 VanDerWaalsContact CA-O 3.27Å; F877-L977 WeakPolarHBondContact CA-O 3.35Å; F877-L977 HydrophobicContact CD1-CD2 4.14Å; F877-L977 HydrophobicContact CD1-CG 4.11Å; F877-L977 HydrophobicContact CD2-CD2 4.11Å; F877-L977 HydrophobicContact CE1-CD1 3.99Å; F877-L977 HydrophobicContact CE1-CD2 3.99Å; F877-L977 HydrophobicContact CE1-CG 3.87Å; F877-L977 HydrophobicContact CE2-CD2 3.93Å; F877-L977 HydrophobicContact CG-CD2 4.21Å; F877-L977 HydrophobicContact CZ-CD1 4.1Å; F877-L977 HydrophobicContact CZ-CD2 3.88Å; F877-L977 HydrophobicContact CZ-CG 4.17Å; I878-L977 PolarHBondContact N-O 2.9Å; L887-L977 WeakPolarHBondContact O-CA 3.32Å; L888-L977 HydrophobicContact CD1-CB 3.89Å; L888-L977 HydrophobicContact CD1-CD1 4.36Å; V961-L977 HydrophobicContact CG1-CD1 4.42Å; V961-L977 HydrophobicContact CG2-CD1 4.42Å; A964-L977 HydrophobicContact CB-CD1 4.19Å; A964-L977 HydrophobicContact CB-CD2 4.36Å
978	T	93.9	Very high	93.5	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.098	C	C	.	.			trans	-82.6	152.4	159.1	54.5	0	0	0	0	109.2	I878 L880 T884 L887 R1059	I878-T978 HydrophobicContact CB-CG2 4Å; I878-T978 HydrophobicContact CG2-CG2 4.28Å; L880-T978 HydrophobicContact CD2-CG2 4.01Å; T884-T978 HydrophobicContact CG2-CG2 3.81Å; L887-T978 HydrophobicContact CB-CG2 4.23Å; L887-T978 PolarHBondContact N-OG1 2.71Å; L887-T978 PolarHBondContact O-N 3.35Å; L887-T978 PolarHBondContact O-OG1 3.17Å; T978-R1059 PolarHBondContact OG1-NH1 3.02Å
979	P	94.6	Very high	92.1	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.127	C	C	.	.			trans	-50.9	143.4	178.4	-31.6	39.2	0	0	0	113.4	F531 Y532 P590 F877 I878 R1059	F531-P979 HydrophobicContact CE1-CB 3.95Å; F531-P979 HydrophobicContact CZ-CB 3.64Å; Y532-P979 HydrophobicContact CD1-CB 4.19Å; Y532-P979 HydrophobicContact CD1-CG 4.19Å; Y532-P979 HydrophobicContact CE1-CG 4.09Å; P590-P979 HydrophobicContact CG-CG 3.48Å; P590-P979 VanDerWaalsContact CG-CG 3.48Å; F877-P979 HydrophobicContact CD1-CG 4.24Å; I878-P979 VanDerWaalsContact O-CD 3.3Å; I878-P979 WeakPolarHBondContact O-CD 3.48Å; P979-R1059 PolarHBondContact O-NH2 3.38Å
980	V	94.9	Very high	90.8	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.006	13%	0.131	C	C	.	.			trans	-111.7	124.3	178.6	176.6	0	0	0	0	108.4	M538 C588 V961 H965 R982 I983 H1017 L1019	M538-V980 HydrophobicContact CE-CB 3.77Å; M538-V980 HydrophobicContact CE-CG1 3.99Å; M538-V980 WeakPolarHBondContact CE-O 3.45Å; C588-V980 PolarHBondContact SG-O 2.82Å; V961-V980 HydrophobicContact CG1-CB 4.13Å; V961-V980 HydrophobicContact CG1-CG1 4.44Å; V961-V980 HydrophobicContact CG1-CG2 3.83Å; H965-V980 PolarHBondContact NE2-N 3.05Å; V980-R982 WeakPolarHBondContact CG1-O 3.15Å; V980-I983 HydrophobicContact CG1-CG1 4.06Å; V980-H1017 WeakPolarHBondContact CA-O 3.39Å; V980-L1019 HydrophobicContact CG1-CB 4.05Å
981	D	92.8	Very high	89.9	Confident	9 Å²	9	25.7 Å²	25.7	5%	0.048	15%	0.151	C	C	.	.	S	Bend	trans	-83.8	-34.7	-179.3	67.1	-27.4	0	0	0	112.4	F531 Q535 M538 V539 T1015 H1017 S1018	F531-D981 HydrophobicContact CD2-CB 3.65Å; F531-D981 HydrophobicContact CE1-CB 4.49Å; F531-D981 HydrophobicContact CE2-CB 3.4Å; F531-D981 VanDerWaalsContact CE2-CB 3.4Å; F531-D981 HydrophobicContact CG-CB 4.34Å; F531-D981 HydrophobicContact CZ-CB 3.86Å; Q535-D981 PolarHBondContact NE2-O 3.37Å; M538-D981 WeakPolarHBondContact CA-O 3.33Å; V539-D981 PolarHBondContact N-O 3.25Å; D981-T1015 PolarHBondContact OD1-OG1 3.4Å; D981-T1015 WeakPolarHBondContact OD2-CB 3.38Å; D981-T1015 WeakPolarHBondContact OD2-CG2 3.41Å; D981-T1015 PolarHBondContact OD2-OG1 2.86Å; D981-H1017 PolarHBondContact N-O 2.85Å; D981-S1018 WeakPolarHBondContact OD1-CA 3.43Å; D981-S1018 PolarHBondContact OD1-N 3.47Å; D981-S1018 PolarHBondContact OD1-OG 3.04Å
982	R	93.9	Very high	88.8	Confident	18 Å²	18	28.2 Å²	28.2	7%	0.068	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	141	-175.8	-174.2	156.9	-175.3	-175.4	-0.8	111.4	V539 D541 V980 F984 S1018 L1019	V539-R982 HydrophobicContact CB-CB 4.13Å; V539-R982 HydrophobicContact CB-CG 3.81Å; V539-R982 HydrophobicContact CG1-CG 4.12Å; V539-R982 WeakPolarHBondContact O-CG 3.14Å; D541-R982 IonicContact OD2-NH2 2.96Å; D541-R982 PolarHBondContact OD2-NH2 3.16Å; D541-R982 VanDerWaalsContact OD2-NH2 3.17Å; V980-R982 WeakPolarHBondContact CG1-O 3.15Å; R982-F984 HydrophobicContact CB-CE2 4.13Å; R982-F984 HydrophobicContact CB-CZ 4.43Å; R982-F984 HydrophobicContact CG-CD1 4.44Å; R982-F984 HydrophobicContact CG-CD2 4.15Å; R982-F984 HydrophobicContact CG-CE1 4.08Å; R982-F984 HydrophobicContact CG-CE2 3.73Å; R982-F984 HydrophobicContact CG-CZ 3.71Å; R982-F984 VanDerWaalsContact CZ-CE1 3.45Å; R982-S1018 WeakPolarHBondContact O-CA 3.23Å; R982-L1019 PolarHBondContact O-N 3.43Å
983	I	96.5	Very high	87.9	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	127.8	169.1	-57.2	-178.9	0	0	0	108.1	M538 V539 L540 T544 L548 A958 V961 I962 V980 L1019	M538-I983 HydrophobicContact CE-CD1 4.46Å; M538-I983 HydrophobicContact SD-CD1 3.63Å; M538-I983 HydrophobicContact SD-CG1 3.76Å; V539-I983 PolarHBondContact O-N 2.94Å; L540-I983 HydrophobicContact CD2-CB 3.91Å; L540-I983 HydrophobicContact CD2-CD1 4.02Å; L540-I983 HydrophobicContact CD2-CG1 4.12Å; T544-I983 HydrophobicContact CG2-CB 4.19Å; T544-I983 HydrophobicContact CG2-CG2 3.88Å; T544-I983 PolarHBondContact OG1-O 3.19Å; L548-I983 HydrophobicContact CD1-CG2 4.44Å; A958-I983 HydrophobicContact CB-CD1 4.26Å; A958-I983 HydrophobicContact CB-CG2 3.98Å; V961-I983 HydrophobicContact CB-CD1 4.5Å; V961-I983 HydrophobicContact CG1-CD1 4.11Å; I962-I983 HydrophobicContact CD1-CD1 4.01Å; I962-I983 HydrophobicContact CG1-CD1 3.6Å; V980-I983 HydrophobicContact CG1-CG1 4.06Å; I983-L1019 CarbonylContact C-O 3.59Å; I983-L1019 WeakPolarHBondContact CA-O 3.31Å; I983-L1019 HydrophobicContact CD1-CD2 4.34Å; I983-L1019 HydrophobicContact CG1-CB 4.27Å; I983-L1019 HydrophobicContact CG1-CD2 4.33Å; I983-L1019 HydrophobicContact CG2-CD2 4.36Å
984	F	94.8	Very high	86.8	Confident	0 Å²	0	34 Å²	34	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	134.5	172.7	-65.1	-78.8	0	0	0	109.3	R982 I1010 H1013 I1014 L1019 V1020 L1021	R982-F984 HydrophobicContact CB-CE2 4.13Å; R982-F984 HydrophobicContact CB-CZ 4.43Å; R982-F984 HydrophobicContact CG-CD1 4.44Å; R982-F984 HydrophobicContact CG-CD2 4.15Å; R982-F984 HydrophobicContact CG-CE1 4.08Å; R982-F984 HydrophobicContact CG-CE2 3.73Å; R982-F984 HydrophobicContact CG-CZ 3.71Å; R982-F984 VanDerWaalsContact CZ-CE1 3.45Å; F984-I1010 HydrophobicContact CB-CD1 4.05Å; F984-I1010 HydrophobicContact CB-CG1 3.84Å; F984-I1010 HydrophobicContact CB-CG2 4.1Å; F984-I1010 HydrophobicContact CD1-CB 4.18Å; F984-I1010 HydrophobicContact CD1-CG1 3.68Å; F984-I1010 HydrophobicContact CD1-CG2 4.25Å; F984-I1010 HydrophobicContact CD2-CG2 4.23Å; F984-I1010 HydrophobicContact CE1-CG1 4.45Å; F984-I1010 HydrophobicContact CG-CB 4.35Å; F984-I1010 HydrophobicContact CG-CG1 3.95Å; F984-I1010 HydrophobicContact CG-CG2 3.94Å; F984-H1013 HydrophobicContact CE1-CB 4.17Å; F984-H1013 HydrophobicContact CZ-CB 3.84Å; F984-I1014 HydrophobicContact CE2-CB 4.39Å; F984-I1014 HydrophobicContact CE2-CG1 4.38Å; F984-L1019 PolarHBondContact N-O 3.37Å; F984-V1020 HydrophobicContact CB-CG2 4.22Å; F984-V1020 HydrophobicContact CD2-CG2 3.94Å; F984-V1020 HydrophobicContact CG-CG2 4.48Å; F984-L1021 PolarHBondContact O-N 2.83Å
985	S	92.7	Very high	85.6	Confident	4 Å²	4	33.7 Å²	33.7	3%	0.028	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	138	176	73.3	0	0	0	0	112.5	I543 T544 N547 L1021	I543-S985 WeakPolarHBondContact CG2-O 3.27Å; T544-S985 WeakPolarHBondContact CA-OG 3.36Å; T544-S985 PolarHBondContact OG1-N 2.83Å; T544-S985 PolarHBondContact OG1-OG 3.15Å; N547-S985 WeakPolarHBondContact CB-OG 3.44Å; N547-S985 PolarHBondContact ND2-O 3.32Å; N547-S985 VanDerWaalsContact ND2-O 3.15Å; N547-S985 PolarHBondContact ND2-OG 2.88Å; N547-S985 VanDerWaalsContact ND2-OG 3.12Å; S985-L1021 CarbonylContact C-O 3.45Å; S985-L1021 WeakPolarHBondContact CA-O 3.21Å
986	R	88.9	Confident	84.6	Confident	2 Å²	2	36.6 Å²	36.6	1%	0.008	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	85.1	165.9	173.8	66.4	-170.4	148.3	-1.6	106.8	G988 E1006 L1021 D1023	R986-G988 PolarHBondContact NH1-O 3.4Å; R986-G988 PolarHBondContact NH2-O 2.77Å; R986-G988 VanDerWaalsContact NH2-O 3.1Å; R986-E1006 WeakPolarHBondContact CD-OE2 3.33Å; R986-E1006 IonicContact CZ-OE2 3.71Å; R986-E1006 VanDerWaalsContact CZ-OE2 3.31Å; R986-E1006 IonicContact NE-OE2 3.31Å; R986-E1006 PolarHBondContact NE-OE2 3.19Å; R986-E1006 IonicContact NH1-OE1 3.17Å; R986-E1006 IonicContact NH1-OE2 3.97Å; R986-E1006 PolarHBondContact NH1-OE2 3.45Å; R986-L1021 PolarHBondContact N-O 3.4Å; R986-D1023 WeakPolarHBondContact O-CB 3.39Å; R986-D1023 PolarHBondContact O-N 3.35Å
987	L	83.5	Confident	83.9	Confident	7 Å²	7	35.2 Å²	35.2	4%	0.037	22%	0.217	C	C	.	.			trans	-120.1	76.3	-174.6	-58.2	172.5	0	0	0	110.1	N547 L548 M954 R955 L1021 D1023	N547-L987 HydrophobicContact CB-CB 4.13Å; N547-L987 HydrophobicContact CB-CD1 4.35Å; N547-L987 PolarHBondContact ND2-N 2.78Å; L548-L987 HydrophobicContact CD2-CD1 3.69Å; M954-L987 HydrophobicContact CB-CD2 3.79Å; M954-L987 HydrophobicContact CE-CD2 3.65Å; M954-L987 HydrophobicContact SD-CD2 3.98Å; R955-L987 HydrophobicContact CG-CD1 3.58Å; L987-L1021 HydrophobicContact CD1-CD1 4.28Å; L987-L1021 HydrophobicContact CD2-CB 4.24Å; L987-D1023 HydrophobicContact CD2-CB 4.21Å
988	G	75.3	Confident	83.5	Confident	32 Å²	32	38.5 Å²	38.5	33%	0.33	24%	0.24	S	C	.	.	S	Bend	trans	143	177.4	173.5	0	0	0	0	0	115	R986 R1027	R986-G988 PolarHBondContact NH1-O 3.4Å; R986-G988 PolarHBondContact NH2-O 2.77Å; R986-G988 VanDerWaalsContact NH2-O 3.1Å; G988-R1027 VanDerWaalsContact C-NH2 3.29Å; G988-R1027 PolarHBondContact O-NH2 3.42Å
989	A	66.2	Low	83.1	Confident	73 Å²	73	40.7 Å²	40.7	60%	0.603	25%	0.254	S	S	*	.			trans	-114.9	88.2	177.8	0	0	0	0	0	110.7	T999	A989-T999 HydrophobicContact CB-CG2 4.46Å
990	S	70.1	Confident	82.8	Confident	49 Å²	49	42.9 Å²	42.9	34%	0.343	26%	0.264	S	S	.	.			trans	-102.9	129.1	167.9	46.7	0	0	0	0	109.6
991	D	75.8	Confident	82.4	Confident	80 Å²	80	47.2 Å²	47.2	43%	0.428	29%	0.286	S	S	.	.			trans	-92.4	163.9	153.8	59.8	-8.9	0	0	0	109.1
992	R	73.6	Confident	81.9	Confident	53 Å²	53	46.9 Å²	46.9	20%	0.2	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-123.7	83.7	172.6	-59.1	-170.5	-166	139.3	-3.4	108.7	L994 S995 G996 E997 V1002 E1006	R992-L994 VanDerWaalsContact C-N 3.3Å; R992-L994 PolarHBondContact O-N 2.81Å; R992-S995 WeakPolarHBondContact CB-OG 3.41Å; R992-S995 PolarHBondContact O-N 3.48Å; R992-S995 PolarHBondContact O-OG 2.8Å; R992-S995 VanDerWaalsContact O-OG 3.07Å; R992-G996 PolarHBondContact O-N 3.46Å; R992-G996 VanDerWaalsContact O-N 3.08Å; R992-E997 HydrophobicContact CB-CB 4.26Å; R992-E997 WeakPolarHBondContact CD-OE2 3.34Å; R992-E997 IonicContact CZ-OE2 3.53Å; R992-E997 PolarHBondContact N-O 2.93Å; R992-E997 VanDerWaalsContact N-O 3.09Å; R992-E997 IonicContact NE-OE2 3.44Å; R992-E997 IonicContact NH1-OE2 3.46Å; R992-E997 PolarHBondContact NH1-OE2 2.91Å; R992-E997 PolarHBondContact O-N 2.88Å; R992-E997 VanDerWaalsContact O-N 3.07Å; R992-V1002 HydrophobicContact CG-CG2 4.19Å; R992-E1006 IonicContact NH2-OE1 2.79Å
993	M	76	Confident	81.6	Confident	158 Å²	158	46 Å²	46	78%	0.778	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-57.9	-40.1	-176.5	-67.7	-173	-76	0	0	112.8	S995 G996	M993-S995 VanDerWaalsContact C-N 3.31Å; M993-S995 PolarHBondContact O-N 3.1Å; M993-G996 PolarHBondContact O-N 2.88Å; M993-G996 VanDerWaalsContact O-N 3.13Å
994	L	73.4	Confident	81.2	Confident	104 Å²	104	49 Å²	49	55%	0.545	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-67.1	-28.6	-178.5	-68.7	175.6	0	0	0	113.8	K398 R992	K398-L994 WeakPolarHBondContact CE-O 3.49Å; K398-L994 PolarHBondContact NZ-O 2.92Å; R992-L994 VanDerWaalsContact C-N 3.3Å; R992-L994 PolarHBondContact O-N 2.81Å
995	S	71.2	Confident	80.7	Confident	38 Å²	38	49.9 Å²	49.9	27%	0.266	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-94	-2.9	174.4	60	0	0	0	0	113.1	R992 M993 E997	R992-S995 WeakPolarHBondContact CB-OG 3.41Å; R992-S995 PolarHBondContact O-N 3.48Å; R992-S995 PolarHBondContact O-OG 2.8Å; R992-S995 VanDerWaalsContact O-OG 3.07Å; M993-S995 VanDerWaalsContact C-N 3.31Å; M993-S995 PolarHBondContact O-N 3.1Å; S995-E997 VanDerWaalsContact C-N 3.25Å; S995-E997 PolarHBondContact O-N 3.14Å; S995-E997 WeakPolarHBondContact OG-CG 3.4Å; S995-E997 PolarHBondContact OG-OE2 2.94Å
996	G	76.7	Confident	80.4	Confident	64 Å²	64	50.2 Å²	50.2	66%	0.66	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	19.3	-177.1	0	0	0	0	0	113.9	R992 M993	R992-G996 PolarHBondContact O-N 3.46Å; R992-G996 VanDerWaalsContact O-N 3.08Å; M993-G996 PolarHBondContact O-N 2.88Å; M993-G996 VanDerWaalsContact O-N 3.13Å
997	E	82	Confident	80.5	Confident	47 Å²	47	50.4 Å²	50.4	22%	0.22	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-90.6	119.7	-179.6	-60.3	176.2	151.7	0	0	110.5	R992 S995 L1001 V1002	R992-E997 HydrophobicContact CB-CB 4.26Å; R992-E997 WeakPolarHBondContact CD-OE2 3.34Å; R992-E997 IonicContact CZ-OE2 3.53Å; R992-E997 PolarHBondContact N-O 2.93Å; R992-E997 VanDerWaalsContact N-O 3.09Å; R992-E997 IonicContact NE-OE2 3.44Å; R992-E997 IonicContact NH1-OE2 3.46Å; R992-E997 PolarHBondContact NH1-OE2 2.91Å; R992-E997 PolarHBondContact O-N 2.88Å; R992-E997 VanDerWaalsContact O-N 3.07Å; S995-E997 VanDerWaalsContact C-N 3.25Å; S995-E997 PolarHBondContact O-N 3.14Å; S995-E997 WeakPolarHBondContact OG-CG 3.4Å; S995-E997 PolarHBondContact OG-OE2 2.94Å; E997-L1001 HydrophobicContact CB-CD2 4.31Å; E997-L1001 HydrophobicContact CG-CD2 4.25Å; E997-V1002 HydrophobicContact CB-CG2 3.62Å
998	S	87.3	Confident	80.7	Confident	69 Å²	69	51.3 Å²	51.3	48%	0.483	31%	0.314	S	S	.	.			trans	-70.2	157.8	175	69.3	0	0	0	0	111.6	F1000 L1001 V1002	S998-F1000 PolarHBondContact O-N 3.12Å; S998-F1000 VanDerWaalsContact O-N 3.16Å; S998-L1001 PolarHBondContact O-N 3.5Å; S998-L1001 WeakPolarHBondContact OG-CB 3.29Å; S998-L1001 PolarHBondContact OG-N 3.03Å; S998-V1002 WeakPolarHBondContact O-CG2 3.49Å; S998-V1002 PolarHBondContact O-N 3.29Å
999	T	85	Confident	81.1	Confident	47 Å²	47	50.3 Å²	50.3	29%	0.288	30%	0.302	S	S	.	.	H	α-helix	trans	-51.1	-42.4	179.2	-45.2	0	0	0	0	112.8	A989 E1003	A989-T999 HydrophobicContact CB-CG2 4.46Å; T999-E1003 VanDerWaalsContact O-CB 3.25Å; T999-E1003 WeakPolarHBondContact O-CB 3.4Å; T999-E1003 PolarHBondContact O-N 2.78Å
1000	F	88.3	Confident	82.2	Confident	45 Å²	45	47.2 Å²	47.2	20%	0.197	28%	0.275	C	S	.	.	H	α-helix	trans	-71.9	-37.3	179.9	-173.8	-121.7	0	0	0	112.7	S998 E1003 L1004 T1029 L1037	S998-F1000 PolarHBondContact O-N 3.12Å; S998-F1000 VanDerWaalsContact O-N 3.16Å; F1000-E1003 WeakPolarHBondContact CD2-OE2 3.37Å; F1000-E1003 PolarHBondContact O-N 3.13Å; F1000-L1004 HydrophobicContact CD1-CD1 4.1Å; F1000-L1004 HydrophobicContact CD2-CG 4.33Å; F1000-L1004 HydrophobicContact CE1-CD1 3.46Å; F1000-L1004 VanDerWaalsContact CE1-CD1 3.46Å; F1000-L1004 HydrophobicContact CE1-CG 4.17Å; F1000-L1004 HydrophobicContact CE2-CD1 4.05Å; F1000-L1004 HydrophobicContact CE2-CD2 4.09Å; F1000-L1004 HydrophobicContact CE2-CG 3.89Å; F1000-L1004 HydrophobicContact CZ-CD1 3.44Å; F1000-L1004 VanDerWaalsContact CZ-CD1 3.44Å; F1000-L1004 HydrophobicContact CZ-CD2 4.12Å; F1000-L1004 HydrophobicContact CZ-CG 3.82Å; F1000-L1004 WeakPolarHBondContact O-CG 3.21Å; F1000-L1004 PolarHBondContact O-N 3.26Å; F1000-T1029 HydrophobicContact CD2-CG2 4.02Å; F1000-T1029 HydrophobicContact CE1-CG2 4.28Å; F1000-T1029 HydrophobicContact CE2-CG2 3.39Å; F1000-T1029 HydrophobicContact CZ-CG2 3.53Å; F1000-L1037 HydrophobicContact CE2-CD1 4.37Å; F1000-L1037 HydrophobicContact CZ-CD1 3.79Å
1001	L	86.1	Confident	83.1	Confident	93 Å²	93	46.4 Å²	46.4	49%	0.487	27%	0.267	S	S	.	.	H	α-helix	trans	-65.4	-44.7	176.5	179.6	61.5	0	0	0	111	E997 S998 E1003 L1004 S1005	E997-L1001 HydrophobicContact CB-CD2 4.31Å; E997-L1001 HydrophobicContact CG-CD2 4.25Å; S998-L1001 PolarHBondContact O-N 3.5Å; S998-L1001 WeakPolarHBondContact OG-CB 3.29Å; S998-L1001 PolarHBondContact OG-N 3.03Å; L1001-E1003 VanDerWaalsContact C-N 3.34Å; L1001-L1004 PolarHBondContact O-N 3.42Å; L1001-S1005 WeakPolarHBondContact O-CB 3.39Å; L1001-S1005 PolarHBondContact O-N 2.85Å
1002	V	83.7	Confident	83.6	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.006	27%	0.274	C	S	.	.	H	α-helix	trans	-58.2	-49.1	174.8	174.6	0	0	0	0	109.9	R992 E997 S998 L1004 S1005 E1006	R992-V1002 HydrophobicContact CG-CG2 4.19Å; E997-V1002 HydrophobicContact CB-CG2 3.62Å; S998-V1002 WeakPolarHBondContact O-CG2 3.49Å; S998-V1002 PolarHBondContact O-N 3.29Å; V1002-L1004 PolarHBondContact O-N 3.31Å; V1002-S1005 WeakPolarHBondContact O-CB 3.47Å; V1002-S1005 PolarHBondContact O-N 3.01Å; V1002-E1006 HydrophobicContact CG1-CG 4.34Å; V1002-E1006 WeakPolarHBondContact CG1-OE1 3.44Å; V1002-E1006 VanDerWaalsContact O-CG 3.3Å; V1002-E1006 WeakPolarHBondContact O-CG 3.46Å; V1002-E1006 PolarHBondContact O-N 3.24Å
1003	E	87.4	Confident	84.1	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-57	-47.9	179	172.1	172.8	-135.5	0	0	113.3	T999 F1000 L1001 T1007 L1025 G1026 R1027	T999-E1003 VanDerWaalsContact O-CB 3.25Å; T999-E1003 WeakPolarHBondContact O-CB 3.4Å; T999-E1003 PolarHBondContact O-N 2.78Å; F1000-E1003 WeakPolarHBondContact CD2-OE2 3.37Å; F1000-E1003 PolarHBondContact O-N 3.13Å; L1001-E1003 VanDerWaalsContact C-N 3.34Å; E1003-T1007 WeakPolarHBondContact O-CB 3.45Å; E1003-T1007 PolarHBondContact O-N 3.32Å; E1003-T1007 PolarHBondContact O-OG1 2.98Å; E1003-L1025 HydrophobicContact CG-CD1 3.52Å; E1003-L1025 WeakPolarHBondContact OE1-CA 3.33Å; E1003-G1026 VanDerWaalsContact CD-N 3.26Å; E1003-G1026 PolarHBondContact OE1-N 3.07Å; E1003-G1026 PolarHBondContact OE2-N 3.48Å; E1003-R1027 IonicContact OE1-NH1 2.94Å; E1003-R1027 PolarHBondContact OE1-NH1 3.44Å
1004	L	88.1	Confident	84.7	Confident	63 Å²	63	40.9 Å²	40.9	33%	0.33	24%	0.239	S	C	.	.	H	α-helix	trans	-69.6	-33.9	177.3	-71.5	-174.1	0	0	0	112.8	F1000 L1001 V1002 A1008 L1037	F1000-L1004 HydrophobicContact CD1-CD1 4.1Å; F1000-L1004 HydrophobicContact CD2-CG 4.33Å; F1000-L1004 HydrophobicContact CE1-CD1 3.46Å; F1000-L1004 VanDerWaalsContact CE1-CD1 3.46Å; F1000-L1004 HydrophobicContact CE1-CG 4.17Å; F1000-L1004 HydrophobicContact CE2-CD1 4.05Å; F1000-L1004 HydrophobicContact CE2-CD2 4.09Å; F1000-L1004 HydrophobicContact CE2-CG 3.89Å; F1000-L1004 HydrophobicContact CZ-CD1 3.44Å; F1000-L1004 VanDerWaalsContact CZ-CD1 3.44Å; F1000-L1004 HydrophobicContact CZ-CD2 4.12Å; F1000-L1004 HydrophobicContact CZ-CG 3.82Å; F1000-L1004 WeakPolarHBondContact O-CG 3.21Å; F1000-L1004 PolarHBondContact O-N 3.26Å; L1001-L1004 PolarHBondContact O-N 3.42Å; V1002-L1004 PolarHBondContact O-N 3.31Å; L1004-A1008 VanDerWaalsContact O-CB 3.25Å; L1004-A1008 WeakPolarHBondContact O-CB 3.4Å; L1004-A1008 PolarHBondContact O-N 3.22Å; L1004-L1037 HydrophobicContact CD2-CD1 4.42Å
1005	S	83.9	Confident	85.3	Confident	18 Å²	18	37.7 Å²	37.7	13%	0.126	22%	0.224	C	C	.	.	H	α-helix	trans	-64.2	-45.5	175.9	-177.3	0	0	0	0	111.5	H366 L1001 V1002 A1008 S1009	H366-S1005 PolarHBondContact CE1-OG 2.7Å; H366-S1005 PolarHBondContact ND1-OG 3.14Å; H366-S1005 VanDerWaalsContact ND1-OG 3.08Å; H366-S1005 PolarHBondContact NE2-OG 2.93Å; L1001-S1005 WeakPolarHBondContact O-CB 3.39Å; L1001-S1005 PolarHBondContact O-N 2.85Å; V1002-S1005 WeakPolarHBondContact O-CB 3.47Å; V1002-S1005 PolarHBondContact O-N 3.01Å; S1005-A1008 PolarHBondContact O-N 3.21Å; S1005-S1009 PolarHBondContact O-N 3.48Å
1006	E	87.1	Confident	86	Confident	11 Å²	11	37.2 Å²	37.2	5%	0.051	22%	0.219	C	C	.	.	H	α-helix	trans	-65.7	-46	176.9	-67.4	178.1	177.3	0	0	110.2	I543 R986 R992 V1002 A1008 S1009 I1010	I543-E1006 HydrophobicContact CD1-CG 3.77Å; R986-E1006 WeakPolarHBondContact CD-OE2 3.33Å; R986-E1006 IonicContact CZ-OE2 3.71Å; R986-E1006 VanDerWaalsContact CZ-OE2 3.31Å; R986-E1006 IonicContact NE-OE2 3.31Å; R986-E1006 PolarHBondContact NE-OE2 3.19Å; R986-E1006 IonicContact NH1-OE1 3.17Å; R986-E1006 IonicContact NH1-OE2 3.97Å; R986-E1006 PolarHBondContact NH1-OE2 3.45Å; R992-E1006 IonicContact NH2-OE1 2.79Å; V1002-E1006 HydrophobicContact CG1-CG 4.34Å; V1002-E1006 WeakPolarHBondContact CG1-OE1 3.44Å; V1002-E1006 VanDerWaalsContact O-CG 3.3Å; V1002-E1006 WeakPolarHBondContact O-CG 3.46Å; V1002-E1006 PolarHBondContact O-N 3.24Å; E1006-A1008 VanDerWaalsContact C-N 3.3Å; E1006-A1008 PolarHBondContact O-N 3.47Å; E1006-S1009 PolarHBondContact O-N 3.27Å; E1006-S1009 VanDerWaalsContact O-N 3.11Å; E1006-I1010 WeakPolarHBondContact O-CG1 3.44Å; E1006-I1010 PolarHBondContact O-N 3.04Å
1007	T	90.1	Very high	86.6	Confident	6 Å²	6	35.9 Å²	35.9	4%	0.037	20%	0.196	C	C	.	.	H	α-helix	trans	-56.8	-44.4	174.3	-58.1	0	0	0	0	111.5	E1003 S1009 I1010 L1011 M1022 L1025 V1041	E1003-T1007 WeakPolarHBondContact O-CB 3.45Å; E1003-T1007 PolarHBondContact O-N 3.32Å; E1003-T1007 PolarHBondContact O-OG1 2.98Å; T1007-S1009 PolarHBondContact O-N 3.32Å; T1007-I1010 WeakPolarHBondContact O-CB 3.42Å; T1007-I1010 PolarHBondContact O-N 2.97Å; T1007-L1011 HydrophobicContact CG2-CD1 4.2Å; T1007-L1011 HydrophobicContact CG2-CG 4.45Å; T1007-L1011 VanDerWaalsContact O-CG 3.31Å; T1007-L1011 WeakPolarHBondContact O-CG 3.42Å; T1007-L1011 PolarHBondContact O-N 3.42Å; T1007-M1022 HydrophobicContact CG2-CE 3.91Å; T1007-L1025 HydrophobicContact CG2-CD1 4.44Å; T1007-L1025 HydrophobicContact CG2-CD2 4.13Å; T1007-L1025 VanDerWaalsContact OG1-CD1 3.26Å; T1007-L1025 WeakPolarHBondContact OG1-CD1 3.13Å; T1007-V1041 HydrophobicContact CG2-CG1 4.25Å; T1007-V1041 HydrophobicContact CG2-CG2 4.07Å
1008	A	87.5	Confident	87.2	Confident	27 Å²	27	33.6 Å²	33.6	22%	0.223	19%	0.186	C	C	.	.	H	α-helix	trans	-60	-47.8	176	0	0	0	0	0	110.9	L1004 S1005 E1006 I1010 L1011 H1012	L1004-A1008 VanDerWaalsContact O-CB 3.25Å; L1004-A1008 WeakPolarHBondContact O-CB 3.4Å; L1004-A1008 PolarHBondContact O-N 3.22Å; S1005-A1008 PolarHBondContact O-N 3.21Å; E1006-A1008 VanDerWaalsContact C-N 3.3Å; E1006-A1008 PolarHBondContact O-N 3.47Å; A1008-I1010 VanDerWaalsContact C-N 3.28Å; A1008-I1010 PolarHBondContact O-N 3.49Å; A1008-L1011 PolarHBondContact O-N 3.44Å; A1008-L1011 VanDerWaalsContact O-N 3.16Å; A1008-H1012 PolarHBondContact O-N 2.93Å; A1008-H1012 PolarHBondContact O-ND1 3.35Å
1009	S	84.1	Confident	87.6	Confident	11 Å²	11	30.3 Å²	30.3	8%	0.077	16%	0.163	C	C	.	.	H	α-helix	trans	-57.6	-41.5	178.4	-173.6	0	0	0	0	112.3	S1005 E1006 T1007 H1012 H1013	S1005-S1009 PolarHBondContact O-N 3.48Å; E1006-S1009 PolarHBondContact O-N 3.27Å; E1006-S1009 VanDerWaalsContact O-N 3.11Å; T1007-S1009 PolarHBondContact O-N 3.32Å; S1009-H1012 PolarHBondContact O-N 2.92Å; S1009-H1013 PolarHBondContact O-N 3.35Å; S1009-H1013 PolarHBondContact O-ND1 3.04Å
1010	I	89.6	Confident	88.1	Confident	7 Å²	7	28.1 Å²	28.1	4%	0.036	15%	0.149	C	C	.	.	H	α-helix	trans	-58	-56.2	174.1	-61.7	172	0	0	0	109.8	F984 E1006 T1007 A1008 H1012 H1013 I1014 V1020 M1022	F984-I1010 HydrophobicContact CB-CD1 4.05Å; F984-I1010 HydrophobicContact CB-CG1 3.84Å; F984-I1010 HydrophobicContact CB-CG2 4.1Å; F984-I1010 HydrophobicContact CD1-CB 4.18Å; F984-I1010 HydrophobicContact CD1-CG1 3.68Å; F984-I1010 HydrophobicContact CD1-CG2 4.25Å; F984-I1010 HydrophobicContact CD2-CG2 4.23Å; F984-I1010 HydrophobicContact CE1-CG1 4.45Å; F984-I1010 HydrophobicContact CG-CB 4.35Å; F984-I1010 HydrophobicContact CG-CG1 3.95Å; F984-I1010 HydrophobicContact CG-CG2 3.94Å; E1006-I1010 WeakPolarHBondContact O-CG1 3.44Å; E1006-I1010 PolarHBondContact O-N 3.04Å; T1007-I1010 WeakPolarHBondContact O-CB 3.42Å; T1007-I1010 PolarHBondContact O-N 2.97Å; A1008-I1010 VanDerWaalsContact C-N 3.28Å; A1008-I1010 PolarHBondContact O-N 3.49Å; I1010-H1012 VanDerWaalsContact C-N 3.26Å; I1010-H1012 PolarHBondContact O-N 3.26Å; I1010-H1013 PolarHBondContact O-N 2.93Å; I1010-I1014 HydrophobicContact CG2-CD1 4.23Å; I1010-I1014 VanDerWaalsContact O-CB 3.27Å; I1010-I1014 WeakPolarHBondContact O-CB 3.45Å; I1010-I1014 PolarHBondContact O-N 2.92Å; I1010-V1020 HydrophobicContact CG2-CG1 4.06Å; I1010-V1020 HydrophobicContact CG2-CG2 4Å; I1010-M1022 HydrophobicContact CB-CE 4.15Å; I1010-M1022 HydrophobicContact CD1-CE 3.55Å; I1010-M1022 HydrophobicContact CG1-CE 4.42Å; I1010-M1022 HydrophobicContact CG2-CE 4.02Å
1011	L	89.2	Confident	88.5	Confident	33 Å²	33	26 Å²	26	17%	0.173	14%	0.139	C	C	.	.	H	α-helix	trans	-62.1	-29.3	-176.5	-63.2	-178.5	0	0	0	113.9	T1007 A1008 V1041 Y1044 L1045 R1051	T1007-L1011 HydrophobicContact CG2-CD1 4.2Å; T1007-L1011 HydrophobicContact CG2-CG 4.45Å; T1007-L1011 VanDerWaalsContact O-CG 3.31Å; T1007-L1011 WeakPolarHBondContact O-CG 3.42Å; T1007-L1011 PolarHBondContact O-N 3.42Å; A1008-L1011 PolarHBondContact O-N 3.44Å; A1008-L1011 VanDerWaalsContact O-N 3.16Å; L1011-V1041 HydrophobicContact CD1-CG2 4.34Å; L1011-V1041 HydrophobicContact CD2-CG1 4.45Å; L1011-Y1044 HydrophobicContact CB-CE1 4.5Å; L1011-Y1044 HydrophobicContact CD2-CD1 3.64Å; L1011-Y1044 HydrophobicContact CD2-CE1 3.95Å; L1011-L1045 HydrophobicContact CD2-CD2 3.77Å; L1011-L1045 HydrophobicContact CD2-CG 4.23Å; L1011-R1051 PolarHBondContact O-NH1 2.9Å
1012	H	84.5	Confident	88.9	Confident	125 Å²	125	21.6 Å²	21.6	58%	0.579	12%	0.116	S	C	*	.	H	α-helix	trans	-73.1	-40.5	177.9	-75.7	82.6	0	0	0	112.4	A1008 S1009 I1010 R1051	A1008-H1012 PolarHBondContact O-N 2.93Å; A1008-H1012 PolarHBondContact O-ND1 3.35Å; S1009-H1012 PolarHBondContact O-N 2.92Å; I1010-H1012 VanDerWaalsContact C-N 3.26Å; I1010-H1012 PolarHBondContact O-N 3.26Å; H1012-R1051 PolarHBondContact O-NH2 3.45Å
1013	H	84.5	Confident	89.3	Confident	44 Å²	44	21.9 Å²	21.9	20%	0.204	12%	0.118	C	C	.	.	H	α-helix	trans	-102.4	-3.3	-170.4	-61	104.8	0	0	0	115	D364 F984 S1009 I1010	D364-H1013 IonicContact OD2-CE1 3.86Å; D364-H1013 PolarHBondContact OD2-CE1 2.83Å; F984-H1013 HydrophobicContact CE1-CB 4.17Å; F984-H1013 HydrophobicContact CZ-CB 3.84Å; S1009-H1013 PolarHBondContact O-N 3.35Å; S1009-H1013 PolarHBondContact O-ND1 3.04Å; I1010-H1013 PolarHBondContact O-N 2.93Å
1014	I	88.6	Confident	89.3	Confident	6 Å²	6	24 Å²	24	3%	0.031	13%	0.128	C	C	.	.			trans	-64.3	143.7	-176.2	-161.9	159.2	0	0	0	113.3	F984 I1010 V1020 L1045 F1052 P1058	F984-I1014 HydrophobicContact CE2-CB 4.39Å; F984-I1014 HydrophobicContact CE2-CG1 4.38Å; I1010-I1014 HydrophobicContact CG2-CD1 4.23Å; I1010-I1014 VanDerWaalsContact O-CB 3.27Å; I1010-I1014 WeakPolarHBondContact O-CB 3.45Å; I1010-I1014 PolarHBondContact O-N 2.92Å; I1014-V1020 HydrophobicContact CD1-CG2 3.43Å; I1014-V1020 VanDerWaalsContact CD1-CG2 3.43Å; I1014-V1020 HydrophobicContact CG1-CG2 4.29Å; I1014-L1045 HydrophobicContact CD1-CD2 3.4Å; I1014-F1052 HydrophobicContact CG2-CZ 4.23Å; I1014-F1052 WeakPolarHBondContact O-CZ 3.4Å; I1014-P1058 HydrophobicContact CD1-CB 3.68Å; I1014-P1058 HydrophobicContact CD1-CG 3.39Å; I1014-P1058 HydrophobicContact CG1-CB 3.92Å; I1014-P1058 HydrophobicContact CG1-CG 4.03Å
1015	T	87	Confident	89.4	Confident	37 Å²	37	21.2 Å²	21.2	23%	0.227	11%	0.113	C	C	.	.			trans	-124	168.9	171.1	82.5	0	0	0	0	110	D981 H1017 S1018	D981-T1015 PolarHBondContact OD1-OG1 3.4Å; D981-T1015 WeakPolarHBondContact OD2-CB 3.38Å; D981-T1015 WeakPolarHBondContact OD2-CG2 3.41Å; D981-T1015 PolarHBondContact OD2-OG1 2.86Å; T1015-H1017 PolarHBondContact O-N 3.2Å; T1015-H1017 PolarHBondContact OG1-N 3.45Å; T1015-H1017 VanDerWaalsContact OG1-N 3.12Å; T1015-S1018 PolarHBondContact N-OG 2.87Å; T1015-S1018 VanDerWaalsContact N-OG 3.1Å; T1015-S1018 PolarHBondContact O-N 2.93Å; T1015-S1018 PolarHBondContact O-OG 2.96Å; T1015-S1018 PolarHBondContact OG1-N 3.47Å; T1015-S1018 PolarHBondContact OG1-OG 3.3Å; T1015-S1018 VanDerWaalsContact OG1-OG 3.14Å
1016	P	86	Confident	89.6	Confident	27 Å²	27	20.4 Å²	20.4	18%	0.175	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-25.2	172.8	-21.2	33.5	0	0	0	112.8	P886 F1052	P886-P1016 WeakPolarHBondContact CB-O 3.13Å; P886-P1016 HydrophobicContact CG-CB 4.06Å; P886-P1016 WeakPolarHBondContact CG-O 3.45Å; P1016-F1052 HydrophobicContact CG-CB 3.85Å; P1016-F1052 HydrophobicContact CG-CD1 3.66Å; P1016-F1052 HydrophobicContact CG-CD2 3.78Å; P1016-F1052 HydrophobicContact CG-CE1 4.15Å; P1016-F1052 HydrophobicContact CG-CE2 4.23Å; P1016-F1052 HydrophobicContact CG-CG 3.51Å; P1016-F1052 HydrophobicContact CG-CZ 4.43Å
1017	H	90	Very high	89.5	Confident	36 Å²	36	23.4 Å²	23.4	17%	0.167	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95	7.1	-176.9	-55.2	-60.6	0	0	0	113	F531 V980 D981 T1015 R1059	F531-H1017 HydrophobicContact CD1-CB 4.28Å; F531-H1017 AromaticContact CD1-CD2 3.61Å; F531-H1017 HydrophobicContact CE1-CB 3.89Å; F531-H1017 AromaticContact CE1-CD2 3.96Å; F531-H1017 AromaticContact CE1-CG 3.87Å; V980-H1017 WeakPolarHBondContact CA-O 3.39Å; D981-H1017 PolarHBondContact N-O 2.85Å; T1015-H1017 PolarHBondContact O-N 3.2Å; T1015-H1017 PolarHBondContact OG1-N 3.45Å; T1015-H1017 VanDerWaalsContact OG1-N 3.12Å; H1017-R1059 PolarHBondContact O-NH2 3.36Å
1018	S	92.8	Very high	89.3	Confident	0 Å²	0	25 Å²	25	0%	0	14%	0.136	C	C	.	.			trans	-81.4	153.8	176.8	-55.1	0	0	0	0	111.8	D981 R982 T1015 R1059	D981-S1018 WeakPolarHBondContact OD1-CA 3.43Å; D981-S1018 PolarHBondContact OD1-N 3.47Å; D981-S1018 PolarHBondContact OD1-OG 3.04Å; R982-S1018 WeakPolarHBondContact O-CA 3.23Å; T1015-S1018 PolarHBondContact N-OG 2.87Å; T1015-S1018 VanDerWaalsContact N-OG 3.1Å; T1015-S1018 PolarHBondContact O-N 2.93Å; T1015-S1018 PolarHBondContact O-OG 2.96Å; T1015-S1018 PolarHBondContact OG1-N 3.47Å; T1015-S1018 PolarHBondContact OG1-OG 3.3Å; T1015-S1018 VanDerWaalsContact OG1-OG 3.14Å; S1018-R1059 PolarHBondContact O-N 2.82Å; S1018-R1059 VanDerWaalsContact O-N 3.15Å
1019	L	96.2	Very high	89.4	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	124	167.1	175.9	65.1	0	0	0	108.7	L888 L914 A958 V961 V980 R982 I983 F984 L1021 R1059	L888-L1019 HydrophobicContact CD2-CD1 4.18Å; L914-L1019 HydrophobicContact CD1-CD1 4.22Å; A958-L1019 HydrophobicContact CB-CD2 4.27Å; V961-L1019 HydrophobicContact CB-CD2 4.37Å; V961-L1019 HydrophobicContact CG2-CD2 4.13Å; V980-L1019 HydrophobicContact CG1-CB 4.05Å; R982-L1019 PolarHBondContact O-N 3.43Å; I983-L1019 CarbonylContact C-O 3.59Å; I983-L1019 WeakPolarHBondContact CA-O 3.31Å; I983-L1019 HydrophobicContact CD1-CD2 4.34Å; I983-L1019 HydrophobicContact CG1-CB 4.27Å; I983-L1019 HydrophobicContact CG1-CD2 4.33Å; I983-L1019 HydrophobicContact CG2-CD2 4.36Å; F984-L1019 PolarHBondContact N-O 3.37Å; L1019-L1021 HydrophobicContact CD1-CD2 4.39Å; L1019-L1021 HydrophobicContact CG-CD2 4.39Å; L1019-R1059 CarbonylContact C-O 3.58Å; L1019-R1059 WeakPolarHBondContact CA-O 3.13Å; L1019-R1059 HydrophobicContact CD1-CB 3.96Å
1020	V	96	Very high	89.6	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	127.9	179.8	179.6	0	0	0	0	110.6	F984 I1010 I1014 M1022 P1058 R1059 T1060 L1061	F984-V1020 HydrophobicContact CB-CG2 4.22Å; F984-V1020 HydrophobicContact CD2-CG2 3.94Å; F984-V1020 HydrophobicContact CG-CG2 4.48Å; I1010-V1020 HydrophobicContact CG2-CG1 4.06Å; I1010-V1020 HydrophobicContact CG2-CG2 4Å; I1014-V1020 HydrophobicContact CD1-CG2 3.43Å; I1014-V1020 VanDerWaalsContact CD1-CG2 3.43Å; I1014-V1020 HydrophobicContact CG1-CG2 4.29Å; V1020-M1022 HydrophobicContact CG1-CE 4.27Å; V1020-M1022 HydrophobicContact CG1-CG 3.85Å; V1020-M1022 HydrophobicContact CG1-SD 4.26Å; V1020-P1058 HydrophobicContact CG2-CB 4.35Å; V1020-R1059 PolarHBondContact N-O 2.85Å; V1020-T1060 HydrophobicContact CB-CG2 4.03Å; V1020-T1060 HydrophobicContact CG1-CG2 4.09Å; V1020-T1060 CarbonylContact O-C 3.55Å; V1020-T1060 VanDerWaalsContact O-CA 3.32Å; V1020-T1060 WeakPolarHBondContact O-CA 3.46Å; V1020-L1061 PolarHBondContact O-N 2.84Å
1021	L	96.1	Very high	89.4	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	113.8	172.7	-51.9	178.9	0	0	0	108.7	L548 M954 A958 F984 S985 R986 L987 L1019 L1061	L548-L1021 HydrophobicContact CD2-CD1 4.31Å; M954-L1021 HydrophobicContact CB-CB 4.36Å; M954-L1021 HydrophobicContact CB-CD1 4.2Å; M954-L1021 HydrophobicContact CB-CD2 4.12Å; M954-L1021 HydrophobicContact CB-CG 4.48Å; M954-L1021 HydrophobicContact CG-CD2 4.38Å; M954-L1021 WeakPolarHBondContact O-CD1 3.49Å; M954-L1021 HydrophobicContact SD-CB 4.43Å; A958-L1021 HydrophobicContact CB-CD1 3.55Å; F984-L1021 PolarHBondContact O-N 2.83Å; S985-L1021 CarbonylContact C-O 3.45Å; S985-L1021 WeakPolarHBondContact CA-O 3.21Å; R986-L1021 PolarHBondContact N-O 3.4Å; L987-L1021 HydrophobicContact CD1-CD1 4.28Å; L987-L1021 HydrophobicContact CD2-CB 4.24Å; L1019-L1021 HydrophobicContact CD1-CD2 4.39Å; L1019-L1021 HydrophobicContact CG-CD2 4.39Å; L1021-L1061 HydrophobicContact CD2-CB 3.97Å; L1021-L1061 HydrophobicContact CD2-CD1 3.89Å; L1021-L1061 HydrophobicContact CD2-CG 4.21Å
1022	M	94	Very high	89.3	Confident	1 Å²	1	38 Å²	38	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	122.7	178.7	-79.4	-176	167.8	0	0	110.6	T1007 I1010 V1020 L1025 V1041 L1045 L1061 F1062 S1063	T1007-M1022 HydrophobicContact CG2-CE 3.91Å; I1010-M1022 HydrophobicContact CB-CE 4.15Å; I1010-M1022 HydrophobicContact CD1-CE 3.55Å; I1010-M1022 HydrophobicContact CG1-CE 4.42Å; I1010-M1022 HydrophobicContact CG2-CE 4.02Å; V1020-M1022 HydrophobicContact CG1-CE 4.27Å; V1020-M1022 HydrophobicContact CG1-CG 3.85Å; V1020-M1022 HydrophobicContact CG1-SD 4.26Å; M1022-L1025 HydrophobicContact SD-CD2 4.5Å; M1022-V1041 HydrophobicContact CE-CG1 4.26Å; M1022-V1041 HydrophobicContact SD-CG1 4.01Å; M1022-L1045 HydrophobicContact CE-CD1 4.48Å; M1022-L1045 HydrophobicContact SD-CD1 3.95Å; M1022-L1061 PolarHBondContact N-O 3.34Å; M1022-F1062 HydrophobicContact CB-CD2 3.71Å; M1022-F1062 HydrophobicContact CB-CE2 4.02Å; M1022-F1062 HydrophobicContact CB-CG 4.25Å; M1022-F1062 HydrophobicContact CG-CD2 4.32Å; M1022-F1062 HydrophobicContact CG-CE2 4.44Å; M1022-F1062 CarbonylContact O-C 3.6Å; M1022-F1062 WeakPolarHBondContact O-CA 3.28Å; M1022-F1062 HydrophobicContact SD-CD2 3.74Å; M1022-F1062 HydrophobicContact SD-CE2 3.53Å; M1022-F1062 VanDerWaalsContact SD-CE2 3.53Å; M1022-S1063 PolarHBondContact O-N 2.92Å
1023	D	91.9	Very high	89.5	Confident	7 Å²	7	36.5 Å²	36.5	4%	0.037	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	117.3	177.4	-152.5	10.2	0	0	0	111.9	S951 M954 R986 L987 L1025 R1027 S1063	S951-D1023 WeakPolarHBondContact CB-OD2 3.43Å; S951-D1023 PolarHBondContact OG-OD2 3.1Å; M954-D1023 HydrophobicContact CE-CB 3.65Å; M954-D1023 VanDerWaalsContact CE-CG 3.42Å; M954-D1023 WeakPolarHBondContact CE-OD1 3.44Å; R986-D1023 WeakPolarHBondContact O-CB 3.39Å; R986-D1023 PolarHBondContact O-N 3.35Å; L987-D1023 HydrophobicContact CD2-CB 4.21Å; D1023-L1025 PolarHBondContact O-N 3.22Å; D1023-R1027 PolarHBondContact O-NH1 3.14Å; D1023-S1063 WeakPolarHBondContact OD1-CB 3.35Å; D1023-S1063 PolarHBondContact OD1-OG 3.14Å
1024	E	88	Confident	89.8	Confident	46 Å²	46	34.4 Å²	34.4	22%	0.215	19%	0.192	C	C	.	.	S	Bend	trans	55.3	49.8	167.8	-56.5	178.7	-173	0	0	114.3	G1026 R1027 S1063 H1065	E1024-G1026 PolarHBondContact O-N 3.07Å; E1024-R1027 PolarHBondContact O-NH1 3.14Å; E1024-S1063 PolarHBondContact N-O 3.08Å; E1024-H1065 VanDerWaalsContact CG-CD2 3.47Å; E1024-H1065 WeakPolarHBondContact CG-CD2 3.2Å; E1024-H1065 WeakPolarHBondContact CG-NE2 3.33Å; E1024-H1065 IonicContact OE1-CD2 3.1Å; E1024-H1065 PolarHBondContact OE1-CD2 3.21Å; E1024-H1065 IonicContact OE1-CE1 3.95Å; E1024-H1065 IonicContact OE1-NE2 3.91Å; E1024-H1065 PolarHBondContact OE1-NE2 3.12Å; E1024-H1065 IonicContact OE2-CD2 3.68Å; E1024-H1065 IonicContact OE2-NE2 2.8Å; E1024-H1065 PolarHBondContact OE2-NE2 3.32Å
1025	L	90.8	Very high	89.8	Confident	3 Å²	3	34.8 Å²	34.8	2%	0.016	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	128.8	-179.8	-178.2	61.2	0	0	0	111.8	E1003 T1007 M1022 D1023 V1041 F1062 Y1066	E1003-L1025 HydrophobicContact CG-CD1 3.52Å; E1003-L1025 WeakPolarHBondContact OE1-CA 3.33Å; T1007-L1025 HydrophobicContact CG2-CD1 4.44Å; T1007-L1025 HydrophobicContact CG2-CD2 4.13Å; T1007-L1025 VanDerWaalsContact OG1-CD1 3.26Å; T1007-L1025 WeakPolarHBondContact OG1-CD1 3.13Å; M1022-L1025 HydrophobicContact SD-CD2 4.5Å; D1023-L1025 PolarHBondContact O-N 3.22Å; L1025-V1041 HydrophobicContact CD2-CB 3.87Å; L1025-V1041 HydrophobicContact CD2-CG1 3.9Å; L1025-V1041 HydrophobicContact CD2-CG2 3.88Å; L1025-F1062 HydrophobicContact CB-CE1 4.32Å; L1025-F1062 HydrophobicContact CB-CE2 4.3Å; L1025-F1062 HydrophobicContact CB-CZ 3.63Å; L1025-F1062 HydrophobicContact CD2-CE2 4.03Å; L1025-F1062 HydrophobicContact CD2-CZ 3.88Å; L1025-F1062 HydrophobicContact CG-CZ 4.35Å; L1025-Y1066 WeakPolarHBondContact O-CE2 3.46Å
1026	G	88.5	Confident	89.9	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.01	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.1	11.1	172.6	0	0	0	0	0	114.5	E1003 E1024 G1028 T1029 G1034 Y1066	E1003-G1026 VanDerWaalsContact CD-N 3.26Å; E1003-G1026 PolarHBondContact OE1-N 3.07Å; E1003-G1026 PolarHBondContact OE2-N 3.48Å; E1024-G1026 PolarHBondContact O-N 3.07Å; G1026-G1028 VanDerWaalsContact C-N 3.25Å; G1026-G1028 PolarHBondContact O-N 3.32Å; G1026-T1029 WeakPolarHBondContact O-CG2 3.41Å; G1026-G1034 WeakPolarHBondContact O-CA 3.4Å; G1026-Y1066 VanDerWaalsContact C-OH 3.3Å; G1026-Y1066 PolarHBondContact O-OH 2.64Å
1027	R	85.2	Confident	90.2	Very high	75 Å²	75	38.1 Å²	38.1	28%	0.283	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-19.1	179.1	69.8	-179	177	-78.3	-4.8	114	G988 E1003 D1023 E1024 T1029	G988-R1027 VanDerWaalsContact C-NH2 3.29Å; G988-R1027 PolarHBondContact O-NH2 3.42Å; E1003-R1027 IonicContact OE1-NH1 2.94Å; E1003-R1027 PolarHBondContact OE1-NH1 3.44Å; D1023-R1027 PolarHBondContact O-NH1 3.14Å; E1024-R1027 PolarHBondContact O-NH1 3.14Å; R1027-T1029 VanDerWaalsContact C-N 3.27Å; R1027-T1029 PolarHBondContact O-N 3.19Å
1028	G	84.7	Confident	90.3	Very high	39 Å²	39	36.4 Å²	36.4	40%	0.402	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	3.4	-179.2	0	0	0	0	0	115.2	G1026	G1026-G1028 VanDerWaalsContact C-N 3.25Å; G1026-G1028 PolarHBondContact O-N 3.32Å
1029	T	89.8	Confident	90.1	Very high	47 Å²	47	36.8 Å²	36.8	29%	0.288	22%	0.215	S	C	.	.	S	Bend	trans	-132.5	-173.9	-177	-169.4	0	0	0	0	111.6	F1000 G1026 R1027 D1033	F1000-T1029 HydrophobicContact CD2-CG2 4.02Å; F1000-T1029 HydrophobicContact CE1-CG2 4.28Å; F1000-T1029 HydrophobicContact CE2-CG2 3.39Å; F1000-T1029 HydrophobicContact CZ-CG2 3.53Å; G1026-T1029 WeakPolarHBondContact O-CG2 3.41Å; R1027-T1029 VanDerWaalsContact C-N 3.27Å; R1027-T1029 PolarHBondContact O-N 3.19Å; T1029-D1033 HydrophobicContact CG2-CB 4.21Å
1030	S	89.3	Confident	89.8	Confident	54 Å²	54	39.7 Å²	39.7	38%	0.378	24%	0.239	S	C	.	.			trans	-56.7	144.4	174.7	88.7	0	0	0	0	110.9	H1032 D1033 G1034	S1030-H1032 PolarHBondContact O-N 2.92Å; S1030-D1033 PolarHBondContact O-N 3.06Å; S1030-D1033 WeakPolarHBondContact OG-CB 3.3Å; S1030-D1033 PolarHBondContact OG-N 2.56Å; S1030-D1033 PolarHBondContact OG-OD2 2.93Å; S1030-G1034 PolarHBondContact O-N 2.93Å
1031	T	84.8	Confident	89.6	Confident	96 Å²	96	40.5 Å²	40.5	59%	0.589	24%	0.244	S	C	*	.	H	α-helix	trans	-58.9	-35.5	-177.2	51.2	0	0	0	0	112.9	S1035	T1031-S1035 VanDerWaalsContact O-CB 3.26Å; T1031-S1035 WeakPolarHBondContact O-CB 3.42Å; T1031-S1035 PolarHBondContact O-N 3.13Å
1032	H	86.9	Confident	89.3	Confident	155 Å²	155	40.5 Å²	40.5	72%	0.718	24%	0.244	S	C	*	.	H	α-helix	trans	-70.6	-46.6	178.2	-67.6	-62.3	0	0	0	112.1	S1030 A1036	S1030-H1032 PolarHBondContact O-N 2.92Å; H1032-A1036 WeakPolarHBondContact O-CB 3.33Å; H1032-A1036 PolarHBondContact O-N 3.18Å
1033	D	88.8	Confident	88.9	Confident	92 Å²	92	42.2 Å²	42.2	49%	0.492	26%	0.256	S	S	.	.	H	α-helix	trans	-67.9	-41.7	178.2	-61.6	-38	0	0	0	110.7	T1029 S1030 A1036 L1037	T1029-D1033 HydrophobicContact CG2-CB 4.21Å; S1030-D1033 PolarHBondContact O-N 3.06Å; S1030-D1033 WeakPolarHBondContact OG-CB 3.3Å; S1030-D1033 PolarHBondContact OG-N 2.56Å; S1030-D1033 PolarHBondContact OG-OD2 2.93Å; D1033-A1036 PolarHBondContact O-N 2.9Å; D1033-L1037 WeakPolarHBondContact O-CB 3.47Å; D1033-L1037 VanDerWaalsContact O-CG 3.28Å; D1033-L1037 WeakPolarHBondContact O-CG 3.46Å; D1033-L1037 PolarHBondContact O-N 3.31Å
1034	G	90.1	Very high	88.6	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-60.6	-48.2	177.3	0	0	0	0	0	112.2	G1026 S1030 A1036 L1037 A1038	G1026-G1034 WeakPolarHBondContact O-CA 3.4Å; S1030-G1034 PolarHBondContact O-N 2.93Å; G1034-A1036 VanDerWaalsContact C-N 3.35Å; G1034-A1036 PolarHBondContact O-N 3.39Å; G1034-L1037 PolarHBondContact O-N 2.8Å; G1034-A1038 VanDerWaalsContact O-CB 3.28Å; G1034-A1038 WeakPolarHBondContact O-CB 3.48Å; G1034-A1038 PolarHBondContact O-N 2.89Å
1035	S	88.9	Confident	88.7	Confident	15 Å²	15	43.5 Å²	43.5	11%	0.105	26%	0.259	C	S	.	.	H	α-helix	trans	-63.8	-38.4	175.9	-179.6	0	0	0	0	112.4	T1031 G1039 S1068	T1031-S1035 VanDerWaalsContact O-CB 3.26Å; T1031-S1035 WeakPolarHBondContact O-CB 3.42Å; T1031-S1035 PolarHBondContact O-N 3.13Å; S1035-G1039 PolarHBondContact O-N 3.34Å; S1035-S1068 PolarHBondContact OG-OG 2.87Å
1036	A	90.2	Very high	88.3	Confident	64 Å²	64	43.6 Å²	43.6	53%	0.529	26%	0.26	S	S	.	.	H	α-helix	trans	-68.7	-43.4	179.4	0	0	0	0	0	111.7	H1032 D1033 G1034 G1039 A1040	H1032-A1036 WeakPolarHBondContact O-CB 3.33Å; H1032-A1036 PolarHBondContact O-N 3.18Å; D1033-A1036 PolarHBondContact O-N 2.9Å; G1034-A1036 VanDerWaalsContact C-N 3.35Å; G1034-A1036 PolarHBondContact O-N 3.39Å; A1036-G1039 PolarHBondContact O-N 3.16Å; A1036-A1040 WeakPolarHBondContact O-CB 3.34Å; A1036-A1040 PolarHBondContact O-N 3.41Å
1037	L	91.1	Very high	87.7	Confident	69 Å²	69	46.8 Å²	46.8	36%	0.361	27%	0.274	S	S	.	.	H	α-helix	trans	-64.8	-46.6	175.8	-73.1	170.6	0	0	0	111.5	F1000 L1004 D1033 G1034 G1039 A1040 V1041	F1000-L1037 HydrophobicContact CE2-CD1 4.37Å; F1000-L1037 HydrophobicContact CZ-CD1 3.79Å; L1004-L1037 HydrophobicContact CD2-CD1 4.42Å; D1033-L1037 WeakPolarHBondContact O-CB 3.47Å; D1033-L1037 VanDerWaalsContact O-CG 3.28Å; D1033-L1037 WeakPolarHBondContact O-CG 3.46Å; D1033-L1037 PolarHBondContact O-N 3.31Å; G1034-L1037 PolarHBondContact O-N 2.8Å; L1037-G1039 VanDerWaalsContact C-N 3.32Å; L1037-G1039 PolarHBondContact O-N 2.89Å; L1037-A1040 PolarHBondContact O-N 3.4Å; L1037-V1041 WeakPolarHBondContact O-CG2 3.3Å; L1037-V1041 PolarHBondContact O-N 3.4Å
1038	A	91.3	Very high	87	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-57.8	-46.1	175.7	0	0	0	0	0	111.4	G1034 A1040 V1041 V1042 F1062 Y1066 L1069	G1034-A1038 VanDerWaalsContact O-CB 3.28Å; G1034-A1038 WeakPolarHBondContact O-CB 3.48Å; G1034-A1038 PolarHBondContact O-N 2.89Å; A1038-A1040 PolarHBondContact O-N 2.64Å; A1038-V1041 PolarHBondContact O-N 3.3Å; A1038-V1042 WeakPolarHBondContact O-CB 3.49Å; A1038-V1042 VanDerWaalsContact O-CG2 3.23Å; A1038-V1042 WeakPolarHBondContact O-CG2 3.45Å; A1038-V1042 PolarHBondContact O-N 3.03Å; A1038-F1062 HydrophobicContact CB-CE1 4.29Å; A1038-F1062 HydrophobicContact CB-CZ 4.05Å; A1038-Y1066 HydrophobicContact CB-CD2 4.07Å; A1038-Y1066 HydrophobicContact CB-CE2 4.17Å; A1038-L1069 HydrophobicContact CB-CD2 4.37Å
1039	G	89.9	Confident	85.8	Confident	9 Å²	9	48.7 Å²	48.7	9%	0.093	28%	0.281	C	S	.	.	H	α-helix	trans	-60.4	-45.2	176.1	0	0	0	0	0	113.1	S1035 A1036 L1037 V1041 V1042 S1043	S1035-G1039 PolarHBondContact O-N 3.34Å; A1036-G1039 PolarHBondContact O-N 3.16Å; L1037-G1039 VanDerWaalsContact C-N 3.32Å; L1037-G1039 PolarHBondContact O-N 2.89Å; G1039-V1041 PolarHBondContact O-N 3.18Å; G1039-V1042 PolarHBondContact O-N 3.04Å; G1039-S1043 WeakPolarHBondContact O-CB 3.35Å; G1039-S1043 PolarHBondContact O-N 3.41Å; G1039-S1043 PolarHBondContact O-OG 2.85Å
1040	A	89.6	Confident	84.1	Confident	61 Å²	61	50.3 Å²	50.3	50%	0.504	31%	0.307	S	S	.	.	H	α-helix	trans	-62.7	-41.6	177.5	0	0	0	0	0	112.5	A1036 L1037 A1038 S1043 Y1044	A1036-A1040 WeakPolarHBondContact O-CB 3.34Å; A1036-A1040 PolarHBondContact O-N 3.41Å; L1037-A1040 PolarHBondContact O-N 3.4Å; A1038-A1040 PolarHBondContact O-N 2.64Å; A1040-S1043 PolarHBondContact O-N 2.94Å; A1040-Y1044 WeakPolarHBondContact O-CB 3.39Å; A1040-Y1044 PolarHBondContact O-N 2.8Å
1041	V	91.3	Very high	82.5	Confident	16 Å²	16	54 Å²	54	10%	0.097	31%	0.313	C	S	.	.	H	α-helix	trans	-66.6	-44.6	177.7	171.5	0	0	0	0	111.1	T1007 L1011 M1022 L1025 L1037 A1038 G1039 S1043 Y1044 L1045 F1062	T1007-V1041 HydrophobicContact CG2-CG1 4.25Å; T1007-V1041 HydrophobicContact CG2-CG2 4.07Å; L1011-V1041 HydrophobicContact CD1-CG2 4.34Å; L1011-V1041 HydrophobicContact CD2-CG1 4.45Å; M1022-V1041 HydrophobicContact CE-CG1 4.26Å; M1022-V1041 HydrophobicContact SD-CG1 4.01Å; L1025-V1041 HydrophobicContact CD2-CB 3.87Å; L1025-V1041 HydrophobicContact CD2-CG1 3.9Å; L1025-V1041 HydrophobicContact CD2-CG2 3.88Å; L1037-V1041 WeakPolarHBondContact O-CG2 3.3Å; L1037-V1041 PolarHBondContact O-N 3.4Å; A1038-V1041 PolarHBondContact O-N 3.3Å; G1039-V1041 PolarHBondContact O-N 3.18Å; V1041-S1043 VanDerWaalsContact C-N 3.34Å; V1041-S1043 PolarHBondContact O-N 2.98Å; V1041-Y1044 PolarHBondContact O-N 2.94Å; V1041-L1045 HydrophobicContact CG1-CD1 3.89Å; V1041-L1045 HydrophobicContact CG1-CG 4.28Å; V1041-L1045 WeakPolarHBondContact O-CB 3.45Å; V1041-L1045 VanDerWaalsContact O-CG 3.31Å; V1041-L1045 WeakPolarHBondContact O-CG 3.38Å; V1041-L1045 PolarHBondContact O-N 3.28Å; V1041-F1062 HydrophobicContact CG1-CE2 4.13Å
1042	V	90.1	Very high	81.2	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.006	29%	0.291	C	S	.	.	H	α-helix	trans	-59.3	-45.8	175.7	169	0	0	0	0	111	V939 L941 A1038 G1039 Y1044 L1045 A1046 F1062 L1069 I1090	V939-V1042 HydrophobicContact CG1-CG1 4.28Å; L941-V1042 HydrophobicContact CD2-CG1 4.07Å; L941-V1042 HydrophobicContact CD2-CG2 3.79Å; L941-V1042 HydrophobicContact CG-CG1 4.47Å; A1038-V1042 WeakPolarHBondContact O-CB 3.49Å; A1038-V1042 VanDerWaalsContact O-CG2 3.23Å; A1038-V1042 WeakPolarHBondContact O-CG2 3.45Å; A1038-V1042 PolarHBondContact O-N 3.03Å; G1039-V1042 PolarHBondContact O-N 3.04Å; V1042-Y1044 VanDerWaalsContact C-N 3.35Å; V1042-Y1044 PolarHBondContact O-N 2.91Å; V1042-L1045 PolarHBondContact O-N 3.22Å; V1042-A1046 WeakPolarHBondContact O-CB 3.39Å; V1042-A1046 PolarHBondContact O-N 2.96Å; V1042-F1062 HydrophobicContact CG2-CB 4.45Å; V1042-F1062 HydrophobicContact CG2-CD1 3.73Å; V1042-F1062 HydrophobicContact CG2-CD2 3.56Å; V1042-F1062 HydrophobicContact CG2-CE1 3.73Å; V1042-F1062 HydrophobicContact CG2-CE2 3.54Å; V1042-F1062 HydrophobicContact CG2-CG 3.65Å; V1042-F1062 HydrophobicContact CG2-CZ 3.61Å; V1042-L1069 HydrophobicContact CG2-CD2 4.31Å; V1042-I1090 HydrophobicContact CG1-CD1 3.88Å; V1042-I1090 HydrophobicContact CG1-CG1 4.41Å; V1042-I1090 HydrophobicContact CG1-CG2 4.49Å
1043	S	85.6	Confident	79.4	Confident	37 Å²	37	53.5 Å²	53.5	26%	0.259	30%	0.301	S	S	.	.	H	α-helix	trans	-60.5	-43.1	175.5	-70.6	0	0	0	0	112.3	G1039 A1040 V1041 A1046 K1047	G1039-S1043 WeakPolarHBondContact O-CB 3.35Å; G1039-S1043 PolarHBondContact O-N 3.41Å; G1039-S1043 PolarHBondContact O-OG 2.85Å; A1040-S1043 PolarHBondContact O-N 2.94Å; V1041-S1043 VanDerWaalsContact C-N 3.34Å; V1041-S1043 PolarHBondContact O-N 2.98Å; S1043-A1046 PolarHBondContact O-N 2.74Å; S1043-K1047 PolarHBondContact O-N 3.21Å
1044	Y	86.8	Confident	77.8	Confident	78 Å²	78	52.7 Å²	52.7	31%	0.306	30%	0.297	S	S	.	.	H	α-helix	trans	-65.1	-41.1	177.5	-175.4	-86.9	0	0	0	112.5	L1011 A1040 V1041 V1042 K1047 P1048	L1011-Y1044 HydrophobicContact CB-CE1 4.5Å; L1011-Y1044 HydrophobicContact CD2-CD1 3.64Å; L1011-Y1044 HydrophobicContact CD2-CE1 3.95Å; A1040-Y1044 WeakPolarHBondContact O-CB 3.39Å; A1040-Y1044 PolarHBondContact O-N 2.8Å; V1041-Y1044 PolarHBondContact O-N 2.94Å; V1042-Y1044 VanDerWaalsContact C-N 3.35Å; V1042-Y1044 PolarHBondContact O-N 2.91Å; Y1044-K1047 CarbonylContact O-C 3.31Å; Y1044-P1048 HydrophobicContact CE1-CB 4.27Å; Y1044-P1048 WeakPolarHBondContact O-CA 3.45Å; Y1044-P1048 WeakPolarHBondContact O-CD 3.4Å
1045	L	88.4	Confident	76.3	Confident	2 Å²	2	54.8 Å²	54.8	1%	0.01	32%	0.318	C	S	.	.	H	α-helix	trans	-67	-36.9	176.3	-69.6	172.9	0	0	0	111.6	V939 L1011 I1014 M1022 V1041 V1042 G1057 P1058 T1060 F1062	V939-L1045 HydrophobicContact CG2-CB 4.2Å; L1011-L1045 HydrophobicContact CD2-CD2 3.77Å; L1011-L1045 HydrophobicContact CD2-CG 4.23Å; I1014-L1045 HydrophobicContact CD1-CD2 3.4Å; M1022-L1045 HydrophobicContact CE-CD1 4.48Å; M1022-L1045 HydrophobicContact SD-CD1 3.95Å; V1041-L1045 HydrophobicContact CG1-CD1 3.89Å; V1041-L1045 HydrophobicContact CG1-CG 4.28Å; V1041-L1045 WeakPolarHBondContact O-CB 3.45Å; V1041-L1045 VanDerWaalsContact O-CG 3.31Å; V1041-L1045 WeakPolarHBondContact O-CG 3.38Å; V1041-L1045 PolarHBondContact O-N 3.28Å; V1042-L1045 PolarHBondContact O-N 3.22Å; L1045-G1057 VanDerWaalsContact O-CA 3.29Å; L1045-G1057 WeakPolarHBondContact O-CA 3.48Å; L1045-P1058 HydrophobicContact CD2-CG 4.08Å; L1045-P1058 WeakPolarHBondContact O-CD 3.31Å; L1045-T1060 HydrophobicContact CD1-CG2 3.93Å; L1045-F1062 HydrophobicContact CD1-CD2 4.41Å
1046	A	83.5	Confident	75.4	Confident	4 Å²	4	54.7 Å²	54.7	3%	0.033	32%	0.318	C	S	.	.	H	α-helix	trans	-68.3	-41.2	177.2	0	0	0	0	0	112.1	V939 V1042 S1043 C1089 I1090	V939-A1046 HydrophobicContact CG2-CB 4.01Å; V1042-A1046 WeakPolarHBondContact O-CB 3.39Å; V1042-A1046 PolarHBondContact O-N 2.96Å; S1043-A1046 PolarHBondContact O-N 2.74Å; A1046-C1089 HydrophobicContact CB-CB 4.37Å; A1046-I1090 HydrophobicContact CB-CD1 3.96Å; A1046-I1090 HydrophobicContact CB-CG1 3.66Å
1047	K	76.4	Confident	75	Confident	68 Å²	68	51.7 Å²	51.7	30%	0.296	29%	0.293	S	S	.	.			trans	-140.1	93.2	178	-77.7	-169.2	170.2	-158.5	0	111.5	S1043 Y1044 N1049 N1086	S1043-K1047 PolarHBondContact O-N 3.21Å; Y1044-K1047 CarbonylContact O-C 3.31Å; K1047-N1049 VanDerWaalsContact C-N 3.31Å; K1047-N1049 PolarHBondContact O-N 3.26Å; K1047-N1049 PolarHBondContact O-OD1 2.9Å; K1047-N1086 PolarHBondContact NZ-ND2 3.4Å
1048	P	69.1	Low	74.9	Confident	9 Å²	9	48.4 Å²	48.4	6%	0.058	28%	0.276	C	S	.	.			trans	-78.7	83.8	174.5	26.8	-29	0	0	0	109.5	Y1044 G1050 R1051 F1052	Y1044-P1048 HydrophobicContact CE1-CB 4.27Å; Y1044-P1048 WeakPolarHBondContact O-CA 3.45Å; Y1044-P1048 WeakPolarHBondContact O-CD 3.4Å; P1048-G1050 PolarHBondContact O-N 2.86Å; P1048-R1051 PolarHBondContact O-N 2.94Å; P1048-F1052 HydrophobicContact CB-CD2 4.13Å; P1048-F1052 HydrophobicContact CB-CE2 3.97Å; P1048-F1052 HydrophobicContact CG-CD2 3.12Å; P1048-F1052 HydrophobicContact CG-CE2 3.24Å; P1048-F1052 HydrophobicContact CG-CG 4.15Å; P1048-F1052 HydrophobicContact CG-CZ 4.33Å
1049	N	59.3	Low	75	Confident	145 Å²	145	48.5 Å²	48.5	78%	0.775	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-17	82.8	178.3	-66.1	-15.8	0	0	0	116.5	K1047 R1051	K1047-N1049 VanDerWaalsContact C-N 3.31Å; K1047-N1049 PolarHBondContact O-N 3.26Å; K1047-N1049 PolarHBondContact O-OD1 2.9Å; N1049-R1051 VanDerWaalsContact C-N 3.29Å; N1049-R1051 PolarHBondContact O-N 3.3Å
1050	G	55.8	Low	75.2	Confident	82 Å²	82	48 Å²	48	85%	0.845	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.8	4.9	173.2	0	0	0	0	0	116.5	P1048 F1052	P1048-G1050 PolarHBondContact O-N 2.86Å; G1050-F1052 VanDerWaalsContact C-N 3.35Å
1051	R	54.3	Low	75.5	Confident	130 Å²	130	45.1 Å²	45.1	49%	0.491	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-22	179	-156.6	176.1	177.2	-165.8	-7	112.6	L1011 H1012 P1048 N1049	L1011-R1051 PolarHBondContact O-NH1 2.9Å; H1012-R1051 PolarHBondContact O-NH2 3.45Å; P1048-R1051 PolarHBondContact O-N 2.94Å; N1049-R1051 VanDerWaalsContact C-N 3.29Å; N1049-R1051 PolarHBondContact O-N 3.3Å
1052	F	58.7	Low	75.6	Confident	30 Å²	30	44.4 Å²	44.4	13%	0.132	24%	0.243	C	C	.	.	S	Bend	trans	-121.1	137.6	-177.1	-57	-38	0	0	0	112.1	I1014 P1016 P1048 G1050 N1054 G1055	I1014-F1052 HydrophobicContact CG2-CZ 4.23Å; I1014-F1052 WeakPolarHBondContact O-CZ 3.4Å; P1016-F1052 HydrophobicContact CG-CB 3.85Å; P1016-F1052 HydrophobicContact CG-CD1 3.66Å; P1016-F1052 HydrophobicContact CG-CD2 3.78Å; P1016-F1052 HydrophobicContact CG-CE1 4.15Å; P1016-F1052 HydrophobicContact CG-CE2 4.23Å; P1016-F1052 HydrophobicContact CG-CG 3.51Å; P1016-F1052 HydrophobicContact CG-CZ 4.43Å; P1048-F1052 HydrophobicContact CB-CD2 4.13Å; P1048-F1052 HydrophobicContact CB-CE2 3.97Å; P1048-F1052 HydrophobicContact CG-CD2 3.12Å; P1048-F1052 HydrophobicContact CG-CE2 3.24Å; P1048-F1052 HydrophobicContact CG-CG 4.15Å; P1048-F1052 HydrophobicContact CG-CZ 4.33Å; G1050-F1052 VanDerWaalsContact C-N 3.35Å; F1052-N1054 VanDerWaalsContact C-N 3.25Å; F1052-N1054 PolarHBondContact O-N 3.16Å; F1052-G1055 PolarHBondContact O-N 3.09Å
1053	F	48.3	Very low	75.8	Confident	211 Å²	211	44.3 Å²	44.3	93%	0.925	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-30.8	-170.3	-154.3	-94.4	0	0	0	113.9
1054	N	54.9	Low	75.9	Confident	76 Å²	76	42.8 Å²	42.8	41%	0.406	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	0.3	-175.7	-66.8	-2.5	0	0	0	113.9	S882 F1052 S1056	S882-N1054 PolarHBondContact O-ND2 3.46Å; F1052-N1054 VanDerWaalsContact C-N 3.25Å; F1052-N1054 PolarHBondContact O-N 3.16Å; N1054-S1056 PolarHBondContact O-N 2.74Å
1055	G	59.6	Low	75.9	Confident	44 Å²	44	42.2 Å²	42.2	45%	0.454	23%	0.231	S	C	.	.			trans	68.1	-2.7	-178.5	0	0	0	0	0	116.1	F1052	F1052-G1055 PolarHBondContact O-N 3.09Å
1056	S	69.4	Low	75.8	Confident	13 Å²	13	43.7 Å²	43.7	9%	0.091	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-82.1	137.3	175.5	58.5	0	0	0	0	112	N1054	N1054-S1056 PolarHBondContact O-N 2.74Å
1057	G	81.2	Confident	75.7	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-77.1	167.3	174.5	0	0	0	0	0	114.1	L1045	L1045-G1057 VanDerWaalsContact O-CA 3.29Å; L1045-G1057 WeakPolarHBondContact O-CA 3.48Å
1058	P	90	Very high	75.9	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.006	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-53.1	158.5	166.3	30.7	-46.3	0	0	0	113.2	S938 I1014 V1020 L1045 T1060	S938-P1058 VanDerWaalsContact O-O 3.12Å; I1014-P1058 HydrophobicContact CD1-CB 3.68Å; I1014-P1058 HydrophobicContact CD1-CG 3.39Å; I1014-P1058 HydrophobicContact CG1-CB 3.92Å; I1014-P1058 HydrophobicContact CG1-CG 4.03Å; V1020-P1058 HydrophobicContact CG2-CB 4.35Å; L1045-P1058 HydrophobicContact CD2-CG 4.08Å; L1045-P1058 WeakPolarHBondContact O-CD 3.31Å; P1058-T1060 PolarHBondContact O-N 3.14Å; P1058-T1060 PolarHBondContact O-OG1 3.04Å
1059	R	93	Very high	76.6	Confident	1 Å²	1	46.7 Å²	46.7	0%	0.004	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	116.6	166.2	-69.2	160.9	-79.8	-103.5	13.9	109	P886 L888 L914 S938 T978 P979 H1017 S1018 L1019 V1020	P886-R1059 VanDerWaalsContact CA-NH1 3.29Å; P886-R1059 HydrophobicContact CB-CG 4.4Å; L888-R1059 HydrophobicContact CB-CG 4.38Å; L914-R1059 HydrophobicContact CB-CB 4.15Å; L914-R1059 HydrophobicContact CB-CG 4.05Å; L914-R1059 HydrophobicContact CD1-CB 4.02Å; S938-R1059 WeakPolarHBondContact O-CA 3.01Å; T978-R1059 PolarHBondContact OG1-NH1 3.02Å; P979-R1059 PolarHBondContact O-NH2 3.38Å; H1017-R1059 PolarHBondContact O-NH2 3.36Å; S1018-R1059 PolarHBondContact O-N 2.82Å; S1018-R1059 VanDerWaalsContact O-N 3.15Å; L1019-R1059 CarbonylContact C-O 3.58Å; L1019-R1059 WeakPolarHBondContact CA-O 3.13Å; L1019-R1059 HydrophobicContact CD1-CB 3.96Å; V1020-R1059 PolarHBondContact N-O 2.85Å
1060	T	94.5	Very high	77.8	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	128.1	-173.5	-54.2	0	0	0	0	112.4	S938 V939 I940 V1020 L1045 P1058 F1062	S938-T1060 PolarHBondContact O-N 3.43Å; V939-T1060 HydrophobicContact CG1-CG2 4.05Å; I940-T1060 PolarHBondContact N-O 3.34Å; V1020-T1060 HydrophobicContact CB-CG2 4.03Å; V1020-T1060 HydrophobicContact CG1-CG2 4.09Å; V1020-T1060 CarbonylContact O-C 3.55Å; V1020-T1060 VanDerWaalsContact O-CA 3.32Å; V1020-T1060 WeakPolarHBondContact O-CA 3.46Å; L1045-T1060 HydrophobicContact CD1-CG2 3.93Å; P1058-T1060 PolarHBondContact O-N 3.14Å; P1058-T1060 PolarHBondContact O-OG1 3.04Å; T1060-F1062 HydrophobicContact CG2-CB 4.19Å
1061	L	95.3	Very high	79	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	117.5	160.7	-63.8	176.6	0	0	0	108.5	L914 I940 V942 M954 A957 V1020 L1021 M1022	L914-L1061 HydrophobicContact CD1-CD2 4.04Å; L914-L1061 HydrophobicContact CD1-CG 4.02Å; L914-L1061 HydrophobicContact CD2-CD2 4.03Å; L914-L1061 HydrophobicContact CG-CD2 4.39Å; I940-L1061 HydrophobicContact CB-CD2 4.24Å; V942-L1061 HydrophobicContact CG2-CB 4.39Å; V942-L1061 HydrophobicContact CG2-CD2 4.17Å; M954-L1061 HydrophobicContact CG-CB 3.96Å; M954-L1061 HydrophobicContact CG-CD1 4.08Å; M954-L1061 HydrophobicContact SD-CB 4.23Å; A957-L1061 HydrophobicContact CB-CD1 3.84Å; V1020-L1061 PolarHBondContact O-N 2.84Å; L1021-L1061 HydrophobicContact CD2-CB 3.97Å; L1021-L1061 HydrophobicContact CD2-CD1 3.89Å; L1021-L1061 HydrophobicContact CD2-CG 4.21Å; M1022-L1061 PolarHBondContact N-O 3.34Å
1062	F	94.5	Very high	80.1	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	102.7	-176.8	-166.4	-69.7	0	0	0	109.8	I940 L941 V942 M1022 L1025 A1038 V1041 V1042 L1045 T1060	I940-F1062 PolarHBondContact O-N 2.93Å; L941-F1062 CarbonylContact C-O 3.17Å; L941-F1062 VanDerWaalsContact CA-O 3.28Å; L941-F1062 WeakPolarHBondContact CA-O 3.48Å; L941-F1062 HydrophobicContact CD2-CB 4.08Å; L941-F1062 HydrophobicContact CD2-CD1 3.74Å; L941-F1062 HydrophobicContact CD2-CG 4.14Å; V942-F1062 PolarHBondContact N-O 3.02Å; M1022-F1062 HydrophobicContact CB-CD2 3.71Å; M1022-F1062 HydrophobicContact CB-CE2 4.02Å; M1022-F1062 HydrophobicContact CB-CG 4.25Å; M1022-F1062 HydrophobicContact CG-CD2 4.32Å; M1022-F1062 HydrophobicContact CG-CE2 4.44Å; M1022-F1062 CarbonylContact O-C 3.6Å; M1022-F1062 WeakPolarHBondContact O-CA 3.28Å; M1022-F1062 HydrophobicContact SD-CD2 3.74Å; M1022-F1062 HydrophobicContact SD-CE2 3.53Å; M1022-F1062 VanDerWaalsContact SD-CE2 3.53Å; L1025-F1062 HydrophobicContact CB-CE1 4.32Å; L1025-F1062 HydrophobicContact CB-CE2 4.3Å; L1025-F1062 HydrophobicContact CB-CZ 3.63Å; L1025-F1062 HydrophobicContact CD2-CE2 4.03Å; L1025-F1062 HydrophobicContact CD2-CZ 3.88Å; L1025-F1062 HydrophobicContact CG-CZ 4.35Å; A1038-F1062 HydrophobicContact CB-CE1 4.29Å; A1038-F1062 HydrophobicContact CB-CZ 4.05Å; V1041-F1062 HydrophobicContact CG1-CE2 4.13Å; V1042-F1062 HydrophobicContact CG2-CB 4.45Å; V1042-F1062 HydrophobicContact CG2-CD1 3.73Å; V1042-F1062 HydrophobicContact CG2-CD2 3.56Å; V1042-F1062 HydrophobicContact CG2-CE1 3.73Å; V1042-F1062 HydrophobicContact CG2-CE2 3.54Å; V1042-F1062 HydrophobicContact CG2-CG 3.65Å; V1042-F1062 HydrophobicContact CG2-CZ 3.61Å; L1045-F1062 HydrophobicContact CD1-CD2 4.41Å; T1060-F1062 HydrophobicContact CG2-CB 4.19Å
1063	S	92.8	Very high	80.9	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	133.1	175.8	163.6	0	0	0	0	111.1	V942 K950 M1022 D1023 E1024	V942-S1063 VanDerWaalsContact O-CA 3.27Å; V942-S1063 WeakPolarHBondContact O-CA 3.41Å; K950-S1063 WeakPolarHBondContact CE-OG 3.27Å; M1022-S1063 PolarHBondContact O-N 2.92Å; D1023-S1063 WeakPolarHBondContact OD1-CB 3.35Å; D1023-S1063 PolarHBondContact OD1-OG 3.14Å; E1024-S1063 PolarHBondContact N-O 3.08Å
1064	T	89.3	Confident	82.2	Confident	5 Å²	5	30.3 Å²	30.3	3%	0.031	17%	0.172	C	C	.	.			trans	-143.2	147.8	-177.6	-175.1	0	0	0	0	112.9	L941 V942 T943 Y1066 V1070	L941-T1064 HydrophobicContact CD2-CG2 4.22Å; V942-T1064 PolarHBondContact O-N 3.18Å; V942-T1064 VanDerWaalsContact O-N 3.15Å; T943-T1064 HydrophobicContact CG2-CG2 4.25Å; T1064-Y1066 PolarHBondContact OG1-N 3.1Å; T1064-Y1066 VanDerWaalsContact OG1-N 3.1Å; T1064-V1070 HydrophobicContact CG2-CG2 4.16Å
1065	H	85.6	Confident	82.7	Confident	65 Å²	65	31.9 Å²	31.9	30%	0.301	18%	0.18	S	C	.	.			trans	-99.8	-7.7	169.6	-72.8	-53.6	0	0	0	113.7	N946 E1024 H1067	N946-H1065 PolarHBondContact OD1-CE1 3.47Å; N946-H1065 PolarHBondContact OD1-NE2 3.38Å; E1024-H1065 VanDerWaalsContact CG-CD2 3.47Å; E1024-H1065 WeakPolarHBondContact CG-CD2 3.2Å; E1024-H1065 WeakPolarHBondContact CG-NE2 3.33Å; E1024-H1065 IonicContact OE1-CD2 3.1Å; E1024-H1065 PolarHBondContact OE1-CD2 3.21Å; E1024-H1065 IonicContact OE1-CE1 3.95Å; E1024-H1065 IonicContact OE1-NE2 3.91Å; E1024-H1065 PolarHBondContact OE1-NE2 3.12Å; E1024-H1065 IonicContact OE2-CD2 3.68Å; E1024-H1065 IonicContact OE2-NE2 2.8Å; E1024-H1065 PolarHBondContact OE2-NE2 3.32Å; H1065-H1067 PolarHBondContact O-N 2.94Å; H1065-H1067 VanDerWaalsContact O-N 3.11Å; H1065-H1067 PolarHBondContact O-ND1 3.31Å
1066	Y	86.2	Confident	82.7	Confident	34 Å²	34	33.9 Å²	33.9	13%	0.133	18%	0.177	C	C	.	.			trans	-80.6	95.9	-175.6	-61.3	-58.3	0	0	0	111.1	L1025 G1026 A1038 T1064 S1068 L1069 V1070	L1025-Y1066 WeakPolarHBondContact O-CE2 3.46Å; G1026-Y1066 VanDerWaalsContact C-OH 3.3Å; G1026-Y1066 PolarHBondContact O-OH 2.64Å; A1038-Y1066 HydrophobicContact CB-CD2 4.07Å; A1038-Y1066 HydrophobicContact CB-CE2 4.17Å; T1064-Y1066 PolarHBondContact OG1-N 3.1Å; T1064-Y1066 VanDerWaalsContact OG1-N 3.1Å; Y1066-S1068 PolarHBondContact O-N 2.88Å; Y1066-L1069 WeakPolarHBondContact O-CB 3.33Å; Y1066-L1069 PolarHBondContact O-N 2.88Å; Y1066-V1070 PolarHBondContact O-N 2.95Å
1067	H	81.9	Confident	81.6	Confident	81 Å²	81	39.3 Å²	39.3	38%	0.375	21%	0.205	S	C	.	.	H	α-helix	trans	-59.1	-32	176.1	-66.2	68.3	0	0	0	111.6	H1065 L1069 V1070 D1071	H1065-H1067 PolarHBondContact O-N 2.94Å; H1065-H1067 VanDerWaalsContact O-N 3.11Å; H1065-H1067 PolarHBondContact O-ND1 3.31Å; H1067-L1069 VanDerWaalsContact C-N 3.28Å; H1067-L1069 PolarHBondContact O-N 3.28Å; H1067-V1070 WeakPolarHBondContact O-CB 3.04Å; H1067-V1070 PolarHBondContact O-N 3Å; H1067-V1070 VanDerWaalsContact O-N 3.13Å; H1067-D1071 WeakPolarHBondContact O-CB 3.46Å; H1067-D1071 VanDerWaalsContact O-CG 3.24Å; H1067-D1071 PolarHBondContact O-N 3.34Å
1068	S	81.3	Confident	79.7	Confident	54 Å²	54	50.6 Å²	50.6	38%	0.378	25%	0.247	S	C	.	.	H	α-helix	trans	-56	-39.2	172.5	46.7	0	0	0	0	113.4	S1035 Y1066 Q1072	S1035-S1068 PolarHBondContact OG-OG 2.87Å; Y1066-S1068 PolarHBondContact O-N 2.88Å; S1068-Q1072 WeakPolarHBondContact O-CB 3.47Å; S1068-Q1072 WeakPolarHBondContact O-CG 3.33Å; S1068-Q1072 PolarHBondContact O-N 3.07Å
1069	L	83	Confident	77.3	Confident	8 Å²	8	54.2 Å²	54.2	4%	0.042	27%	0.273	C	S	.	.	H	α-helix	trans	-71.9	-39.1	177.9	-178.8	61	0	0	0	110.9	L941 A1038 V1042 Y1066 H1067 Q1072 V1073	L941-L1069 HydrophobicContact CD1-CG 4.37Å; L941-L1069 HydrophobicContact CD2-CD2 4.22Å; A1038-L1069 HydrophobicContact CB-CD2 4.37Å; V1042-L1069 HydrophobicContact CG2-CD2 4.31Å; Y1066-L1069 WeakPolarHBondContact O-CB 3.33Å; Y1066-L1069 PolarHBondContact O-N 2.88Å; H1067-L1069 VanDerWaalsContact C-N 3.28Å; H1067-L1069 PolarHBondContact O-N 3.28Å; L1069-Q1072 WeakPolarHBondContact O-CB 3.18Å; L1069-Q1072 PolarHBondContact O-N 3.18Å; L1069-V1073 WeakPolarHBondContact O-CG2 3.45Å; L1069-V1073 PolarHBondContact O-N 3.27Å
1070	V	84.4	Confident	74.8	Confident	9 Å²	9	59.3 Å²	59.3	6%	0.055	30%	0.304	C	S	.	.	H	α-helix	trans	-64.9	-46.4	176.6	-177.3	0	0	0	0	110.6	T943 T1064 Y1066 H1067 Q1072 V1073 A1074 L1092 A1122	T943-V1070 HydrophobicContact CG2-CG1 4.33Å; T943-V1070 HydrophobicContact CG2-CG2 3.42Å; T943-V1070 VanDerWaalsContact CG2-CG2 3.42Å; T1064-V1070 HydrophobicContact CG2-CG2 4.16Å; Y1066-V1070 PolarHBondContact O-N 2.95Å; H1067-V1070 WeakPolarHBondContact O-CB 3.04Å; H1067-V1070 PolarHBondContact O-N 3Å; H1067-V1070 VanDerWaalsContact O-N 3.13Å; V1070-Q1072 VanDerWaalsContact C-N 3.29Å; V1070-Q1072 PolarHBondContact O-N 3.12Å; V1070-V1073 PolarHBondContact O-N 3.15Å; V1070-V1073 VanDerWaalsContact O-N 3.11Å; V1070-A1074 WeakPolarHBondContact O-CB 3.26Å; V1070-A1074 PolarHBondContact O-N 3.19Å; V1070-L1092 HydrophobicContact CG1-CD1 4.46Å; V1070-L1092 HydrophobicContact CG1-CD2 4.14Å; V1070-A1122 HydrophobicContact CG1-CB 3.41Å; V1070-A1122 VanDerWaalsContact CG1-CB 3.41Å
1071	D	80.7	Confident	72.1	Confident	87 Å²	87	64.9 Å²	64.9	47%	0.465	34%	0.343	S	S	.	.	H	α-helix	trans	-61	-37.4	176.1	-73.3	-22.7	0	0	0	112	H1067 V1073 A1074 N1075	H1067-D1071 WeakPolarHBondContact O-CB 3.46Å; H1067-D1071 VanDerWaalsContact O-CG 3.24Å; H1067-D1071 PolarHBondContact O-N 3.34Å; D1071-V1073 VanDerWaalsContact C-N 3.28Å; D1071-V1073 PolarHBondContact O-N 3.41Å; D1071-A1074 PolarHBondContact O-N 2.57Å; D1071-N1075 VanDerWaalsContact O-CB 3.24Å; D1071-N1075 WeakPolarHBondContact O-CB 3.23Å; D1071-N1075 PolarHBondContact O-N 3.19Å; D1071-N1075 PolarHBondContact O-ND2 2.9Å
1072	Q	76.7	Confident	69.5	Low	113 Å²	113	70.3 Å²	70.3	53%	0.528	37%	0.372	S	S	.	.	H	α-helix	trans	-64.5	-33.3	175.6	-79.9	170.2	19.3	0	0	112.5	S1068 L1069 V1070 K1076	S1068-Q1072 WeakPolarHBondContact O-CB 3.47Å; S1068-Q1072 WeakPolarHBondContact O-CG 3.33Å; S1068-Q1072 PolarHBondContact O-N 3.07Å; L1069-Q1072 WeakPolarHBondContact O-CB 3.18Å; L1069-Q1072 PolarHBondContact O-N 3.18Å; V1070-Q1072 VanDerWaalsContact C-N 3.29Å; V1070-Q1072 PolarHBondContact O-N 3.12Å; Q1072-K1076 WeakPolarHBondContact O-CE 3.46Å; Q1072-K1076 WeakPolarHBondContact O-CG 3.34Å
1073	V	77.1	Confident	67.1	Low	12 Å²	12	78.7 Å²	78.7	7%	0.073	41%	0.411	C	S	.	.	H	α-helix	trans	-81.8	-38.4	176.3	176.9	0	0	0	0	110.7	L941 L1069 V1070 D1071 I1090 L1092	L941-V1073 HydrophobicContact CD1-CB 4.45Å; L941-V1073 HydrophobicContact CD1-CG2 3.79Å; L1069-V1073 WeakPolarHBondContact O-CG2 3.45Å; L1069-V1073 PolarHBondContact O-N 3.27Å; V1070-V1073 PolarHBondContact O-N 3.15Å; V1070-V1073 VanDerWaalsContact O-N 3.11Å; D1071-V1073 VanDerWaalsContact C-N 3.28Å; D1071-V1073 PolarHBondContact O-N 3.41Å; V1073-I1090 HydrophobicContact CG1-CB 4.45Å; V1073-I1090 HydrophobicContact CG1-CG2 3.99Å; V1073-I1090 HydrophobicContact CG2-CG2 4.2Å; V1073-L1092 HydrophobicContact CB-CD1 4.37Å; V1073-L1092 HydrophobicContact CB-CD2 4.06Å; V1073-L1092 HydrophobicContact CB-CG 4.42Å; V1073-L1092 HydrophobicContact CG1-CD1 4.03Å; V1073-L1092 HydrophobicContact CG1-CD2 3.82Å; V1073-L1092 HydrophobicContact CG1-CG 3.8Å
1074	A	74.2	Confident	64.8	Low	33 Å²	33	86 Å²	86	27%	0.273	45%	0.45	S	S	.	.	H	α-helix	trans	-74.1	-36.6	-177.5	0	0	0	0	0	114.4	V1070 D1071 K1076 L1092	V1070-A1074 WeakPolarHBondContact O-CB 3.26Å; V1070-A1074 PolarHBondContact O-N 3.19Å; D1071-A1074 PolarHBondContact O-N 2.57Å; A1074-K1076 PolarHBondContact O-N 3.15Å; A1074-L1092 HydrophobicContact CB-CD1 3.83Å
1075	N	65.4	Low	62.6	Low	109 Å²	109	89.4 Å²	89.4	58%	0.583	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-87.1	10.3	-170.8	-69.7	-50.9	0	0	0	115.3	D1071	D1071-N1075 VanDerWaalsContact O-CB 3.24Å; D1071-N1075 WeakPolarHBondContact O-CB 3.23Å; D1071-N1075 PolarHBondContact O-N 3.19Å; D1071-N1075 PolarHBondContact O-ND2 2.9Å
1076	K	59.4	Low	60.7	Low	86 Å²	86	90.4 Å²	90.4	37%	0.374	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-81.8	-9.1	-171.1	-84.6	-173.4	-179.9	-137.9	0	116.9	Q1072 A1074 R1078 H1087	Q1072-K1076 WeakPolarHBondContact O-CE 3.46Å; Q1072-K1076 WeakPolarHBondContact O-CG 3.34Å; A1074-K1076 PolarHBondContact O-N 3.15Å; K1076-R1078 PolarHBondContact O-N 3.24Å; K1076-H1087 HydrophobicContact CD-CB 4.35Å; K1076-H1087 PolarHBondContact NZ-CD2 2.89Å; K1076-H1087 PolarHBondContact NZ-NE2 3.06Å
1077	D	47	Very low	59.2	Low	128 Å²	128	90.1 Å²	90.1	68%	0.684	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-60.6	-2	170.8	-80.5	-20.4	0	0	0	113.7
1078	R	42.1	Very low	58	Low	236 Å²	236	90.6 Å²	90.6	89%	0.891	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-135.3	-6.9	-172	-63.1	-169.2	-174.7	-159.1	1.6	119.1	K1076	K1076-R1078 PolarHBondContact O-N 3.24Å
1079	S	39.4	Very low	57.5	Low	78 Å²	78	89.3 Å²	89.3	55%	0.545	47%	0.471	S	S	.	.	S	Bend	trans	-156	136.7	-176.9	61.2	0	0	0	0	116
1080	T	39.1	Very low	57.5	Low	108 Å²	108	89.1 Å²	89.1	66%	0.663	47%	0.469	S	S	*	.			trans	85.2	118.2	163.5	60.6	0	0	0	0	119.1	D1082	T1080-D1082 PolarHBondContact O-N 3.07Å; T1080-D1082 VanDerWaalsContact O-N 3.12Å
1081	S	38.1	Very low	57.6	Low	116 Å²	116	88.7 Å²	88.7	81%	0.811	47%	0.467	S	S	*	.			trans	-74	43.1	172	55.3	0	0	0	0	113.3	E1083	S1081-E1083 PolarHBondContact O-N 3.39Å
1082	D	42.1	Very low	57.9	Low	114 Å²	114	85 Å²	85	61%	0.61	45%	0.447	S	S	*	.			trans	-82.1	96.1	169.5	-78	-17.7	0	0	0	107.7	T1080 D1084	T1080-D1082 PolarHBondContact O-N 3.07Å; T1080-D1082 VanDerWaalsContact O-N 3.12Å; D1082-D1084 PolarHBondContact O-N 2.97Å; D1082-D1084 VanDerWaalsContact O-N 3.12Å
1083	E	43	Very low	58.6	Low	177 Å²	177	79.6 Å²	79.6	83%	0.827	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-16.3	-179.5	-65.4	-172.9	157.6	0	0	113.5	S1081	S1081-E1083 PolarHBondContact O-N 3.39Å
1084	D	44.7	Very low	59.2	Low	152 Å²	152	80.3 Å²	80.3	81%	0.813	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-16.4	-170.2	-72.3	-28.1	0	0	0	115.1	D1082	D1082-D1084 PolarHBondContact O-N 2.97Å; D1082-D1084 VanDerWaalsContact O-N 3.12Å
1085	I	44.2	Very low	60	Low	77 Å²	77	78.9 Å²	78.9	40%	0.395	41%	0.412	S	S	.	.			trans	-125.6	80.3	-179.3	-38.1	175.7	0	0	0	111.1	H1087	I1085-H1087 VanDerWaalsContact CG2-CD2 3.45Å; I1085-H1087 WeakPolarHBondContact CG2-CD2 3.49Å; I1085-H1087 VanDerWaalsContact CG2-CE1 3.5Å; I1085-H1087 WeakPolarHBondContact CG2-CE1 3.47Å; I1085-H1087 WeakPolarHBondContact CG2-NE2 3.5Å; I1085-H1087 PolarHBondContact O-CD2 2.89Å; I1085-H1087 PolarHBondContact O-N 3.04Å
1086	N	45.7	Very low	61	Low	87 Å²	87	74.1 Å²	74.1	47%	0.465	39%	0.388	S	S	.	.			trans	-66.9	99.8	164.5	-68.6	-18.5	0	0	0	109.1	K1047 L1088	K1047-N1086 PolarHBondContact NZ-ND2 3.4Å; N1086-L1088 HydrophobicContact CB-CD1 4.49Å; N1086-L1088 PolarHBondContact O-N 3.46Å
1087	H	53.1	Low	62.1	Low	28 Å²	28	71.3 Å²	71.3	13%	0.13	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-75	9.2	173.8	-71.7	-91.5	0	0	0	114.1	K1076 I1085 C1089 I1090	K1076-H1087 HydrophobicContact CD-CB 4.35Å; K1076-H1087 PolarHBondContact NZ-CD2 2.89Å; K1076-H1087 PolarHBondContact NZ-NE2 3.06Å; I1085-H1087 VanDerWaalsContact CG2-CD2 3.45Å; I1085-H1087 WeakPolarHBondContact CG2-CD2 3.49Å; I1085-H1087 VanDerWaalsContact CG2-CE1 3.5Å; I1085-H1087 WeakPolarHBondContact CG2-CE1 3.47Å; I1085-H1087 WeakPolarHBondContact CG2-NE2 3.5Å; I1085-H1087 PolarHBondContact O-CD2 2.89Å; I1085-H1087 PolarHBondContact O-N 3.04Å; H1087-C1089 PolarHBondContact O-N 3.36Å; H1087-C1089 VanDerWaalsContact O-N 3.07Å; H1087-I1090 PolarHBondContact O-N 3.27Å; H1087-I1090 VanDerWaalsContact O-N 3.15Å
1088	L	57.3	Low	63.7	Low	90 Å²	90	69.6 Å²	69.6	47%	0.471	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-60	-18.4	179.3	-89.3	79.1	0	0	0	113.7	N1086	N1086-L1088 HydrophobicContact CB-CD1 4.49Å; N1086-L1088 PolarHBondContact O-N 3.46Å
1089	C	71.6	Confident	65.1	Low	28 Å²	28	60.8 Å²	60.8	19%	0.189	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-91.1	1.1	-179.2	-55.3	0	0	0	0	114.1	A937 S938 V939 A1046 H1087	A937-C1089 WeakPolarHBondContact CA-O 3.41Å; A937-C1089 WeakPolarHBondContact CB-O 3.33Å; S938-C1089 PolarHBondContact N-O 2.8Å; S938-C1089 VanDerWaalsContact N-O 3.15Å; V939-C1089 PolarHBondContact N-O 2.87Å; A1046-C1089 HydrophobicContact CB-CB 4.37Å; H1087-C1089 PolarHBondContact O-N 3.36Å; H1087-C1089 VanDerWaalsContact O-N 3.07Å
1090	I	82.2	Confident	66.6	Low	3 Å²	3	60.9 Å²	60.9	2%	0.015	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	117.4	-177.2	-57.4	166.5	0	0	0	110.3	V939 L941 V1042 A1046 V1073 H1087	V939-I1090 HydrophobicContact CB-CG1 4.49Å; V939-I1090 CarbonylContact O-C 3.55Å; V939-I1090 VanDerWaalsContact O-CA 3.3Å; V939-I1090 WeakPolarHBondContact O-CA 3.29Å; L941-I1090 HydrophobicContact CD1-CG2 3.86Å; L941-I1090 HydrophobicContact CG-CG2 4.03Å; V1042-I1090 HydrophobicContact CG1-CD1 3.88Å; V1042-I1090 HydrophobicContact CG1-CG1 4.41Å; V1042-I1090 HydrophobicContact CG1-CG2 4.49Å; A1046-I1090 HydrophobicContact CB-CD1 3.96Å; A1046-I1090 HydrophobicContact CB-CG1 3.66Å; V1073-I1090 HydrophobicContact CG1-CB 4.45Å; V1073-I1090 HydrophobicContact CG1-CG2 3.99Å; V1073-I1090 HydrophobicContact CG2-CG2 4.2Å; H1087-I1090 PolarHBondContact O-N 3.27Å; H1087-I1090 VanDerWaalsContact O-N 3.15Å
1091	G	86.2	Confident	67.6	Low	0 Å²	0	60.1 Å²	60.1	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	154.1	175.2	0	0	0	0	0	111.9	V939 I940 L941	V939-G1091 PolarHBondContact O-N 3.39Å; I940-G1091 WeakPolarHBondContact CA-O 3.29Å; L941-G1091 PolarHBondContact N-O 3.07Å
1092	L	88.6	Confident	67.9	Low	10 Å²	10	63.5 Å²	63.5	5%	0.052	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	122.7	174.2	-67.4	177.3	0	0	0	109.7	F934 L941 V1070 V1073 A1074 G1121 A1122	F934-L1092 WeakPolarHBondContact CD2-O 3.38Å; L941-L1092 HydrophobicContact CB-CD2 3.96Å; L941-L1092 HydrophobicContact CD1-CD2 3.93Å; V1070-L1092 HydrophobicContact CG1-CD1 4.46Å; V1070-L1092 HydrophobicContact CG1-CD2 4.14Å; V1073-L1092 HydrophobicContact CB-CD1 4.37Å; V1073-L1092 HydrophobicContact CB-CD2 4.06Å; V1073-L1092 HydrophobicContact CB-CG 4.42Å; V1073-L1092 HydrophobicContact CG1-CD1 4.03Å; V1073-L1092 HydrophobicContact CG1-CD2 3.82Å; V1073-L1092 HydrophobicContact CG1-CG 3.8Å; A1074-L1092 HydrophobicContact CB-CD1 3.83Å; L1092-G1121 PolarHBondContact O-N 2.9Å; L1092-A1122 HydrophobicContact CD1-CB 4.45Å
1093	G	90	Very high	68.1	Low	0 Å²	0	60.5 Å²	60.5	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	157.9	172.1	0	0	0	0	0	111.8	L941 T943 I1119 G1121	L941-G1093 PolarHBondContact O-N 3.37Å; T943-G1093 PolarHBondContact N-O 3.03Å; T943-G1093 PolarHBondContact OG1-O 2.83Å; T943-G1093 VanDerWaalsContact OG1-O 3.1Å; G1093-I1119 CarbonylContact C-O 3.57Å; G1093-I1119 WeakPolarHBondContact CA-O 3.35Å; G1093-G1121 CarbonylContact C-O 3.6Å; G1093-G1121 WeakPolarHBondContact CA-O 3.22Å
1094	H	90.7	Very high	68.2	Low	26 Å²	26	61.5 Å²	61.5	12%	0.12	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	154.1	175.3	72.5	-77.2	0	0	0	113.8	T943 A1096 I1119 G1121 C1123	T943-H1094 CarbonylContact O-C 3.51Å; T943-H1094 WeakPolarHBondContact O-CA 3.37Å; T943-H1094 WeakPolarHBondContact O-CB 3.18Å; T943-H1094 WeakPolarHBondContact OG1-CB 3.32Å; H1094-A1096 PolarHBondContact O-N 2.93Å; H1094-I1119 WeakPolarHBondContact CE1-CD1 3.19Å; H1094-I1119 VanDerWaalsContact CE1-CG1 3.45Å; H1094-I1119 WeakPolarHBondContact CE1-CG1 3.34Å; H1094-I1119 PolarHBondContact N-O 3.22Å; H1094-I1119 WeakPolarHBondContact NE2-CD1 3.36Å; H1094-I1119 WeakPolarHBondContact O-CG1 3.49Å; H1094-I1119 PolarHBondContact O-N 3.02Å; H1094-G1121 PolarHBondContact N-O 3.13Å; H1094-G1121 PolarHBondContact ND1-O 3.11Å; H1094-C1123 HydrophobicContact CB-CB 3.93Å
1095	M	90.5	Very high	68.2	Low	3 Å²	3	56.7 Å²	56.7	2%	0.015	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	119.5	168.2	-61.7	-55.1	-68.6	0	0	109.4	T943 G948 K950 L953 Y1116 F1118	T943-M1095 PolarHBondContact O-N 3.22Å; G948-M1095 WeakPolarHBondContact O-CE 3.29Å; G948-M1095 WeakPolarHBondContact O-CG 3.41Å; K950-M1095 HydrophobicContact CG-CG 3.76Å; L953-M1095 HydrophobicContact CB-SD 4.48Å; L953-M1095 HydrophobicContact CD2-SD 3.9Å; M1095-Y1116 VanDerWaalsContact CE-C 3.45Å; M1095-Y1116 WeakPolarHBondContact CE-O 3.41Å; M1095-F1118 HydrophobicContact SD-CB 4.1Å; M1095-F1118 HydrophobicContact SD-CD2 4Å
1096	A	86.8	Confident	68.4	Low	10 Å²	10	59.7 Å²	59.7	8%	0.083	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	138.6	-178.8	0	0	0	0	0	111.5	H1094 L1115 K1117 I1119	H1094-A1096 PolarHBondContact O-N 2.93Å; A1096-L1115 HydrophobicContact CB-CB 4.11Å; A1096-L1115 HydrophobicContact CB-CD1 4.07Å; A1096-L1115 WeakPolarHBondContact O-CB 3.3Å; A1096-L1115 PolarHBondContact O-N 3.05Å; A1096-L1115 VanDerWaalsContact O-N 3.13Å; A1096-K1117 HydrophobicContact CB-CB 4.42Å; A1096-K1117 WeakPolarHBondContact CB-O 3.15Å; A1096-K1117 PolarHBondContact N-O 3.45Å; A1096-I1119 HydrophobicContact CB-CD1 3.69Å; A1096-I1119 HydrophobicContact CB-CG1 3.98Å
1097	C	81.1	Confident	68.6	Low	26 Å²	26	60.3 Å²	60.3	18%	0.176	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	140.6	173.5	62	0	0	0	0	109.6	P945 I1112 T1113 Y1127	P945-C1097 HydrophobicContact CG-CB 4.14Å; C1097-I1112 HydrophobicContact CB-CG2 3.86Å; C1097-T1113 WeakPolarHBondContact CA-O 3.45Å; C1097-Y1127 WeakPolarHBondContact SG-CE2 3.38Å
1098	M	80.6	Confident	68.7	Low	92 Å²	92	62.8 Å²	62.8	45%	0.453	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	129.7	175	-173.6	172.1	70.2	0	0	109	E1100 I1112 T1113 L1115	M1098-E1100 HydrophobicContact CE-CG 4.3Å; M1098-I1112 WeakPolarHBondContact O-CA 3.34Å; M1098-T1113 PolarHBondContact N-O 3.37Å; M1098-T1113 PolarHBondContact O-N 3.34Å; M1098-L1115 HydrophobicContact CB-CD1 4.41Å; M1098-L1115 HydrophobicContact CB-CD2 4.44Å; M1098-L1115 HydrophobicContact CB-CG 4.49Å
1099	V	72.9	Confident	68.8	Low	52 Å²	52	59.7 Å²	59.7	32%	0.315	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	112.5	176.2	-172.7	0	0	0	0	108.1	A1101 E1110 N1111 I1112 Y1127	V1099-A1101 PolarHBondContact O-N 3.35Å; V1099-E1110 HydrophobicContact CG1-CB 3.81Å; V1099-E1110 HydrophobicContact CG1-CG 4.14Å; V1099-N1111 CarbonylContact C-O 3.57Å; V1099-N1111 WeakPolarHBondContact CA-O 3.48Å; V1099-I1112 HydrophobicContact CG2-CG1 4.25Å; V1099-Y1127 HydrophobicContact CG2-CE1 3.92Å; V1099-Y1127 WeakPolarHBondContact CG2-OH 3.45Å
1100	E	71	Confident	68.5	Low	79 Å²	79	62.5 Å²	62.5	37%	0.369	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	106.7	174.7	-69.2	173	-172.4	0	0	108.8	M1098 N1111	M1098-E1100 HydrophobicContact CE-CG 4.3Å; E1100-N1111 HydrophobicContact CB-CB 4.05Å; E1100-N1111 PolarHBondContact N-O 3.48Å; E1100-N1111 PolarHBondContact O-N 2.96Å
1101	A	59.1	Low	68	Low	92 Å²	92	64.2 Å²	64.2	76%	0.76	37%	0.372	S	S	*	.			trans	-81.3	-12.1	179.2	0	0	0	0	0	113.6	V1099	V1099-A1101 PolarHBondContact O-N 3.35Å
1102	E	45.7	Very low	67.4	Low	188 Å²	188	65.2 Å²	65.2	88%	0.879	38%	0.377	S	S	*	.			trans	-125.5	23.8	-159.3	-66.9	-171.4	163.9	0	0	115.9
1103	S	45.8	Very low	66.9	Low	50 Å²	50	67.4 Å²	67.4	35%	0.35	39%	0.391	S	S	.	.			trans	-84.8	126.4	161.7	53.7	0	0	0	0	108.7	S1105 N1111	S1103-S1105 PolarHBondContact O-N 3.22Å; S1103-N1111 PolarHBondContact OG-ND2 3.47Å
1104	E	44.8	Very low	66.6	Low	199 Å²	199	68.7 Å²	68.7	93%	0.93	40%	0.397	S	S	*	.			trans	-60.9	38.4	172.5	-62.9	-179.6	146.7	0	0	113	T1106	E1104-T1106 PolarHBondContact O-N 3.33Å
1105	S	45.7	Very low	66.3	Low	50 Å²	50	70.7 Å²	70.7	35%	0.35	41%	0.408	S	S	.	.			trans	-69	117.5	168.7	71.9	0	0	0	0	107.9	S1103 N1107	S1103-S1105 PolarHBondContact O-N 3.22Å; S1105-N1107 PolarHBondContact O-N 2.95Å
1106	T	46.7	Very low	66.2	Low	140 Å²	140	75.6 Å²	75.6	86%	0.859	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	4.4	-168.9	-20.3	0	0	0	0	115.3	E1104	E1104-T1106 PolarHBondContact O-N 3.33Å
1107	N	51	Low	66.4	Low	101 Å²	101	77.5 Å²	77.5	54%	0.54	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.1	3	-165.3	-69.1	-18.8	0	0	0	115.5	S1105 L1109	S1105-N1107 PolarHBondContact O-N 2.95Å; N1107-L1109 VanDerWaalsContact C-N 3.3Å; N1107-L1109 HydrophobicContact CB-CD1 3.96Å; N1107-L1109 HydrophobicContact CB-CG 4.34Å; N1107-L1109 PolarHBondContact O-N 3.01Å
1108	G	55.5	Low	67	Low	79 Å²	79	76.6 Å²	76.6	81%	0.814	43%	0.426	S	S	*	.			trans	64.3	31	175.9	0	0	0	0	0	114.4
1109	L	58.8	Low	67.5	Low	26 Å²	26	75 Å²	75	14%	0.136	42%	0.419	C	S	.	.			trans	-108.1	128.4	-178.2	-68.7	165	0	0	0	109.8	N1107 I1142 L1146	N1107-L1109 VanDerWaalsContact C-N 3.3Å; N1107-L1109 HydrophobicContact CB-CD1 3.96Å; N1107-L1109 HydrophobicContact CB-CG 4.34Å; N1107-L1109 PolarHBondContact O-N 3.01Å; L1109-I1142 HydrophobicContact CD2-CG2 4.42Å; L1109-L1146 HydrophobicContact CD2-CD1 3.37Å
1110	E	65.4	Low	68.2	Low	86 Å²	86	75 Å²	75	40%	0.402	42%	0.42	S	S	.	.			trans	-72.2	126.8	178.7	-64.5	175.1	177.5	0	0	110.9	V1099 N1130	V1099-E1110 HydrophobicContact CG1-CB 3.81Å; V1099-E1110 HydrophobicContact CG1-CG 4.14Å; E1110-N1130 PolarHBondContact O-ND2 2.76Å; E1110-N1130 PolarHBondContact O-OD1 3.47Å; E1110-N1130 VanDerWaalsContact O-OD1 3.07Å
1111	N	71.1	Confident	68.8	Low	40 Å²	40	72 Å²	72	21%	0.214	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	136.3	171.3	-85.1	-4.4	0	0	0	110.3	V1099 E1100 S1103 R1133	V1099-N1111 CarbonylContact C-O 3.57Å; V1099-N1111 WeakPolarHBondContact CA-O 3.48Å; E1100-N1111 HydrophobicContact CB-CB 4.05Å; E1100-N1111 PolarHBondContact N-O 3.48Å; E1100-N1111 PolarHBondContact O-N 2.96Å; S1103-N1111 PolarHBondContact OG-ND2 3.47Å; N1111-R1133 PolarHBondContact OD1-NH1 2.81Å; N1111-R1133 PolarHBondContact OD1-NH2 2.98Å
1112	I	73.1	Confident	69.8	Low	20 Å²	20	69.4 Å²	69.4	10%	0.103	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	128.9	178.8	-64	-179.1	0	0	0	110.4	C1097 M1098 V1099 F1114 Y1127 N1130	C1097-I1112 HydrophobicContact CB-CG2 3.86Å; M1098-I1112 WeakPolarHBondContact O-CA 3.34Å; V1099-I1112 HydrophobicContact CG2-CG1 4.25Å; I1112-F1114 HydrophobicContact CG2-CD1 4.14Å; I1112-F1114 HydrophobicContact CG2-CE1 3.94Å; I1112-Y1127 VanDerWaalsContact CD1-CB 3.47Å; I1112-Y1127 HydrophobicContact CD1-CD1 3.04Å; I1112-Y1127 HydrophobicContact CD1-CD2 4.04Å; I1112-Y1127 HydrophobicContact CD1-CE1 3.6Å; I1112-Y1127 HydrophobicContact CD1-CG 3.24Å; I1112-Y1127 HydrophobicContact CG1-CD1 4.37Å; I1112-N1130 HydrophobicContact CD1-CB 3.98Å; I1112-N1130 WeakPolarHBondContact CD1-ND2 3.42Å; I1112-N1130 HydrophobicContact CG1-CB 4.41Å; I1112-N1130 VanDerWaalsContact CG1-ND2 3.25Å; I1112-N1130 WeakPolarHBondContact CG1-ND2 3.49Å
1113	T	79.7	Confident	71.3	Confident	56 Å²	56	61 Å²	61	34%	0.344	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	120.8	171.1	-57.9	0	0	0	0	108.4	C1097 M1098 L1115	C1097-T1113 WeakPolarHBondContact CA-O 3.45Å; M1098-T1113 PolarHBondContact N-O 3.37Å; M1098-T1113 PolarHBondContact O-N 3.34Å; T1113-L1115 HydrophobicContact CG2-CD2 4.42Å
1114	F	82.3	Confident	72.4	Confident	27 Å²	27	63.4 Å²	63.4	12%	0.118	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	121.8	175.7	-59.2	-57.2	0	0	0	109.5	P945 M947 I1112 Y1116 L1134	P945-F1114 HydrophobicContact CB-CD1 4.35Å; P945-F1114 HydrophobicContact CB-CE1 3.64Å; P945-F1114 HydrophobicContact CG-CD1 3.81Å; P945-F1114 HydrophobicContact CG-CE1 3.61Å; M947-F1114 HydrophobicContact CB-CE2 4.1Å; M947-F1114 HydrophobicContact CB-CZ 4.31Å; I1112-F1114 HydrophobicContact CG2-CD1 4.14Å; I1112-F1114 HydrophobicContact CG2-CE1 3.94Å; F1114-Y1116 HydrophobicContact CB-CD2 4.34Å; F1114-Y1116 HydrophobicContact CB-CE1 4.15Å; F1114-Y1116 HydrophobicContact CB-CE2 3.88Å; F1114-L1134 HydrophobicContact CD2-CD1 4.49Å; F1114-L1134 HydrophobicContact CE2-CD1 3.44Å; F1114-L1134 VanDerWaalsContact CE2-CD1 3.44Å; F1114-L1134 HydrophobicContact CZ-CD1 3.96Å
1115	L	85.8	Confident	73.6	Confident	69 Å²	69	59.6 Å²	59.6	36%	0.361	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-4.9	-179	-58.4	179.6	0	0	0	112.6	I908 A1096 M1098 T1113 K1117	I908-L1115 WeakPolarHBondContact CD1-O 3.2Å; A1096-L1115 HydrophobicContact CB-CB 4.11Å; A1096-L1115 HydrophobicContact CB-CD1 4.07Å; A1096-L1115 WeakPolarHBondContact O-CB 3.3Å; A1096-L1115 PolarHBondContact O-N 3.05Å; A1096-L1115 VanDerWaalsContact O-N 3.13Å; M1098-L1115 HydrophobicContact CB-CD1 4.41Å; M1098-L1115 HydrophobicContact CB-CD2 4.44Å; M1098-L1115 HydrophobicContact CB-CG 4.49Å; T1113-L1115 HydrophobicContact CG2-CD2 4.42Å; L1115-K1117 PolarHBondContact O-N 3.04Å
1116	Y	87.7	Confident	74.7	Confident	106 Å²	106	61.2 Å²	61.2	42%	0.416	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	46.1	18.6	-178.7	-54.9	-76	0	0	0	116.4	I908 N910 M947 M1095 F1114	I908-Y1116 HydrophobicContact CD1-CD2 4.37Å; N910-Y1116 PolarHBondContact ND2-O 3.42Å; N910-Y1116 VanDerWaalsContact ND2-O 3.08Å; N910-Y1116 PolarHBondContact OD1-O 3.46Å; M947-Y1116 WeakPolarHBondContact O-CE1 3.48Å; M1095-Y1116 VanDerWaalsContact CE-C 3.45Å; M1095-Y1116 WeakPolarHBondContact CE-O 3.41Å; F1114-Y1116 HydrophobicContact CB-CD2 4.34Å; F1114-Y1116 HydrophobicContact CB-CE1 4.15Å; F1114-Y1116 HydrophobicContact CB-CE2 3.88Å
1117	K	91	Very high	76	Confident	49 Å²	49	55.8 Å²	55.8	21%	0.213	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	128.4	179.1	-171.4	70.3	-178.1	179.2	0	109.6	D892 I908 S909 N910 D911 A1096 L1115 I1119	D892-K1117 IonicContact OD1-NZ 2.7Å; I908-K1117 HydrophobicContact CG2-CB 4.08Å; I908-K1117 HydrophobicContact CG2-CD 4.06Å; S909-K1117 WeakPolarHBondContact O-CD 3.38Å; S909-K1117 PolarHBondContact O-NZ 3.23Å; N910-K1117 WeakPolarHBondContact OD1-CA 3.46Å; D911-K1117 IonicContact OD2-NZ 2.67Å; D911-K1117 PolarHBondContact OD2-NZ 3.24Å; A1096-K1117 HydrophobicContact CB-CB 4.42Å; A1096-K1117 WeakPolarHBondContact CB-O 3.15Å; A1096-K1117 PolarHBondContact N-O 3.45Å; L1115-K1117 PolarHBondContact O-N 3.04Å; K1117-I1119 HydrophobicContact CG-CG2 4.09Å
1118	F	92.9	Very high	77.2	Confident	7 Å²	7	52.7 Å²	52.7	3%	0.031	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	123.2	175.5	-173.4	-123.6	0	0	0	110	N910 D911 F934 I940 V942 L953 M1095	N910-F1118 WeakPolarHBondContact OD1-CB 3.39Å; N910-F1118 PolarHBondContact OD1-N 3.16Å; D911-F1118 WeakPolarHBondContact O-CD1 3.37Å; F934-F1118 AromaticContact CE2-CE1 3.78Å; F934-F1118 HydrophobicContact CE2-CE1 3.78Å; F934-F1118 AromaticContact CE2-CZ 3.82Å; F934-F1118 HydrophobicContact CE2-CZ 3.82Å; F934-F1118 HydrophobicContact CZ-CD1 4.15Å; F934-F1118 AromaticContact CZ-CE1 3.55Å; F934-F1118 HydrophobicContact CZ-CE1 3.55Å; F934-F1118 HydrophobicContact CZ-CZ 4.07Å; I940-F1118 HydrophobicContact CG2-CZ 3.8Å; V942-F1118 HydrophobicContact CB-CE2 4.42Å; V942-F1118 HydrophobicContact CG1-CE2 3.99Å; V942-F1118 HydrophobicContact CG2-CE2 4.04Å; V942-F1118 HydrophobicContact CG2-CZ 4.08Å; L953-F1118 HydrophobicContact CD1-CB 4.13Å; L953-F1118 HydrophobicContact CD2-CB 3.86Å; L953-F1118 HydrophobicContact CD2-CD1 4.05Å; L953-F1118 HydrophobicContact CD2-CD2 3.57Å; L953-F1118 HydrophobicContact CD2-CE1 4.47Å; L953-F1118 HydrophobicContact CD2-CE2 4.06Å; L953-F1118 HydrophobicContact CD2-CG 3.56Å; L953-F1118 HydrophobicContact CD2-CZ 4.47Å; M1095-F1118 HydrophobicContact SD-CB 4.1Å; M1095-F1118 HydrophobicContact SD-CD2 4Å
1119	I	90.8	Very high	78.4	Confident	58 Å²	58	52.1 Å²	52.1	30%	0.297	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	153.6	-176.6	56.7	168.8	0	0	0	111.4	G1093 H1094 A1096 K1117	G1093-I1119 CarbonylContact C-O 3.57Å; G1093-I1119 WeakPolarHBondContact CA-O 3.35Å; H1094-I1119 WeakPolarHBondContact CE1-CD1 3.19Å; H1094-I1119 VanDerWaalsContact CE1-CG1 3.45Å; H1094-I1119 WeakPolarHBondContact CE1-CG1 3.34Å; H1094-I1119 PolarHBondContact N-O 3.22Å; H1094-I1119 WeakPolarHBondContact NE2-CD1 3.36Å; H1094-I1119 WeakPolarHBondContact O-CG1 3.49Å; H1094-I1119 PolarHBondContact O-N 3.02Å; A1096-I1119 HydrophobicContact CB-CD1 3.69Å; A1096-I1119 HydrophobicContact CB-CG1 3.98Å; K1117-I1119 HydrophobicContact CG-CG2 4.09Å
1120	P	87.6	Confident	79.2	Confident	52 Å²	52	51.6 Å²	51.6	34%	0.338	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	151.8	176.3	23.9	-33.4	0	0	0	112.4	F934	F934-P1120 HydrophobicContact CB-CB 4.11Å; F934-P1120 HydrophobicContact CD1-CB 3.67Å; F934-P1120 HydrophobicContact CD1-CG 4.42Å; F934-P1120 HydrophobicContact CD2-CB 4.16Å; F934-P1120 HydrophobicContact CE1-CB 4.03Å; F934-P1120 HydrophobicContact CE2-CB 4.48Å; F934-P1120 HydrophobicContact CG-CB 3.72Å; F934-P1120 HydrophobicContact CZ-CB 4.4Å
1121	G	84.5	Confident	79.6	Confident	17 Å²	17	48.2 Å²	48.2	18%	0.175	27%	0.272	C	S	.	.	S	Bend	trans	104.3	170.8	176.9	0	0	0	0	0	113.7	L1092 G1093 H1094	L1092-G1121 PolarHBondContact O-N 2.9Å; G1093-G1121 CarbonylContact C-O 3.6Å; G1093-G1121 WeakPolarHBondContact CA-O 3.22Å; H1094-G1121 PolarHBondContact N-O 3.13Å; H1094-G1121 PolarHBondContact ND1-O 3.11Å
1122	A	80.3	Confident	80.1	Confident	37 Å²	37	47.3 Å²	47.3	31%	0.306	27%	0.271	S	S	.	.			trans	-85.7	141.2	176	0	0	0	0	0	111.2	V1070 L1092 P1124	V1070-A1122 HydrophobicContact CG1-CB 3.41Å; V1070-A1122 VanDerWaalsContact CG1-CB 3.41Å; L1092-A1122 HydrophobicContact CD1-CB 4.45Å; A1122-P1124 WeakPolarHBondContact O-CD 3.48Å
1123	C	77.1	Confident	80.5	Confident	11 Å²	11	49.5 Å²	49.5	7%	0.074	28%	0.278	C	S	.	.			trans	-63.8	124.3	168.5	-167.3	0	0	0	0	109.5	T943 H1094 K1125	T943-C1123 PolarHBondContact OG1-N 3.16Å; T943-C1123 VanDerWaalsContact OG1-N 3.14Å; H1094-C1123 HydrophobicContact CB-CB 3.93Å; C1123-K1125 VanDerWaalsContact C-N 3.33Å; C1123-K1125 PolarHBondContact O-N 2.79Å; C1123-K1125 PolarHBondContact SG-O 2.86Å; C1123-K1125 VanDerWaalsContact SG-O 3.37Å
1124	P	68.2	Low	80.5	Confident	102 Å²	102	50.7 Å²	50.7	66%	0.662	28%	0.282	S	S	*	.	S	Bend	trans	-72.2	-22.7	-171.5	25.5	-33.6	0	0	0	114.1	A1122	A1122-P1124 WeakPolarHBondContact O-CD 3.48Å
1125	K	70.1	Confident	80.5	Confident	118 Å²	118	52.8 Å²	52.8	51%	0.513	30%	0.304	S	S	.	.	S	Bend	trans	-147.1	151.2	-176.5	-71.7	-175	179.9	176.6	0	112.2	C1123 Y1127	C1123-K1125 VanDerWaalsContact C-N 3.33Å; C1123-K1125 PolarHBondContact O-N 2.79Å; C1123-K1125 PolarHBondContact SG-O 2.86Å; C1123-K1125 VanDerWaalsContact SG-O 3.37Å; K1125-Y1127 HydrophobicContact CB-CE1 4.01Å; K1125-Y1127 HydrophobicContact CB-CE2 4.4Å; K1125-Y1127 VanDerWaalsContact O-CD2 3.32Å; K1125-Y1127 WeakPolarHBondContact O-CD2 3.36Å; K1125-Y1127 VanDerWaalsContact O-CE2 3.25Å; K1125-Y1127 WeakPolarHBondContact O-CE2 3.36Å
1126	S	70.2	Confident	80.5	Confident	85 Å²	85	57.3 Å²	57.3	59%	0.594	33%	0.325	S	S	*	.			trans	-80.3	137.2	166.4	78.2	0	0	0	0	110.7
1127	Y	73.3	Confident	80.5	Confident	26 Å²	26	55.7 Å²	55.7	10%	0.102	32%	0.323	C	S	.	.			trans	-118.5	33.6	-175.9	-59.2	-69	0	0	0	113.5	P945 C1097 V1099 I1112 K1125 F1129 N1130 A1131	P945-Y1127 HydrophobicContact CB-CD2 4.06Å; P945-Y1127 HydrophobicContact CG-CD2 4.39Å; C1097-Y1127 WeakPolarHBondContact SG-CE2 3.38Å; V1099-Y1127 HydrophobicContact CG2-CE1 3.92Å; V1099-Y1127 WeakPolarHBondContact CG2-OH 3.45Å; I1112-Y1127 VanDerWaalsContact CD1-CB 3.47Å; I1112-Y1127 HydrophobicContact CD1-CD1 3.04Å; I1112-Y1127 HydrophobicContact CD1-CD2 4.04Å; I1112-Y1127 HydrophobicContact CD1-CE1 3.6Å; I1112-Y1127 HydrophobicContact CD1-CG 3.24Å; I1112-Y1127 HydrophobicContact CG1-CD1 4.37Å; K1125-Y1127 HydrophobicContact CB-CE1 4.01Å; K1125-Y1127 HydrophobicContact CB-CE2 4.4Å; K1125-Y1127 VanDerWaalsContact O-CD2 3.32Å; K1125-Y1127 WeakPolarHBondContact O-CD2 3.36Å; K1125-Y1127 VanDerWaalsContact O-CE2 3.25Å; K1125-Y1127 WeakPolarHBondContact O-CE2 3.36Å; Y1127-F1129 VanDerWaalsContact C-N 3.28Å; Y1127-F1129 PolarHBondContact O-N 2.97Å; Y1127-N1130 PolarHBondContact O-N 3.41Å; Y1127-N1130 VanDerWaalsContact O-N 3.12Å; Y1127-A1131 PolarHBondContact O-N 2.86Å
1128	G	75.9	Confident	80.5	Confident	36 Å²	36	57.4 Å²	57.4	37%	0.371	34%	0.34	S	S	.	.	H	α-helix	trans	-57.5	-35.3	-175.4	0	0	0	0	0	114.4	N1130 A1131 A1132	G1128-N1130 VanDerWaalsContact C-N 3.3Å; G1128-N1130 PolarHBondContact O-N 3.31Å; G1128-A1131 PolarHBondContact O-N 3.49Å; G1128-A1132 PolarHBondContact O-N 2.84Å
1129	F	80.2	Confident	80.3	Confident	67 Å²	67	61 Å²	61	29%	0.294	36%	0.359	S	S	.	.	H	α-helix	trans	-68.9	-27.1	179.4	-65.4	-68.9	0	0	0	113.7	Y1127 A1132 R1133 I1142 G1145 L1146 A1149	Y1127-F1129 VanDerWaalsContact C-N 3.28Å; Y1127-F1129 PolarHBondContact O-N 2.97Å; F1129-A1132 WeakPolarHBondContact O-CB 3.26Å; F1129-A1132 PolarHBondContact O-N 2.89Å; F1129-R1133 PolarHBondContact O-N 2.77Å; F1129-I1142 HydrophobicContact CB-CG2 4.34Å; F1129-I1142 HydrophobicContact CD1-CG2 4.43Å; F1129-G1145 VanDerWaalsContact CZ-O 3.22Å; F1129-G1145 WeakPolarHBondContact CZ-O 3.08Å; F1129-L1146 HydrophobicContact CB-CD2 4.05Å; F1129-L1146 HydrophobicContact CB-CG 4.33Å; F1129-L1146 HydrophobicContact CD1-CD2 4.37Å; F1129-L1146 HydrophobicContact CD1-CG 4.14Å; F1129-L1146 HydrophobicContact CD2-CD2 3.36Å; F1129-L1146 HydrophobicContact CD2-CG 4.02Å; F1129-L1146 HydrophobicContact CE2-CD2 3.88Å; F1129-L1146 HydrophobicContact CE2-CG 4.41Å; F1129-L1146 HydrophobicContact CG-CD2 3.64Å; F1129-L1146 HydrophobicContact CG-CG 3.87Å; F1129-A1149 HydrophobicContact CE2-CB 3.59Å; F1129-A1149 HydrophobicContact CZ-CB 3.8Å
1130	N	75.3	Confident	80.3	Confident	15 Å²	15	66.1 Å²	66.1	8%	0.08	38%	0.379	C	S	.	.	H	α-helix	trans	-76.6	-38.5	175.4	-77.5	-29.6	0	0	0	111.9	E1110 I1112 Y1127 G1128 A1132 R1133 L1134	E1110-N1130 PolarHBondContact O-ND2 2.76Å; E1110-N1130 PolarHBondContact O-OD1 3.47Å; E1110-N1130 VanDerWaalsContact O-OD1 3.07Å; I1112-N1130 HydrophobicContact CD1-CB 3.98Å; I1112-N1130 WeakPolarHBondContact CD1-ND2 3.42Å; I1112-N1130 HydrophobicContact CG1-CB 4.41Å; I1112-N1130 VanDerWaalsContact CG1-ND2 3.25Å; I1112-N1130 WeakPolarHBondContact CG1-ND2 3.49Å; Y1127-N1130 PolarHBondContact O-N 3.41Å; Y1127-N1130 VanDerWaalsContact O-N 3.12Å; G1128-N1130 VanDerWaalsContact C-N 3.3Å; G1128-N1130 PolarHBondContact O-N 3.31Å; N1130-A1132 VanDerWaalsContact C-N 3.29Å; N1130-A1132 PolarHBondContact O-N 2.83Å; N1130-R1133 WeakPolarHBondContact O-CB 3.38Å; N1130-R1133 PolarHBondContact O-N 2.85Å; N1130-L1134 WeakPolarHBondContact O-CG 3.49Å; N1130-L1134 PolarHBondContact O-N 2.77Å
1131	A	74.8	Confident	80.5	Confident	14 Å²	14	67.3 Å²	67.3	12%	0.116	39%	0.385	C	S	.	.	H	α-helix	trans	-60.2	-40.6	167.9	0	0	0	0	0	111.5	N946 M947 Y1127 G1128 R1133 L1134 A1135	N946-A1131 HydrophobicContact CB-CB 4.37Å; M947-A1131 HydrophobicContact SD-CB 3.94Å; Y1127-A1131 PolarHBondContact O-N 2.86Å; G1128-A1131 PolarHBondContact O-N 3.49Å; A1131-R1133 VanDerWaalsContact C-N 3.31Å; A1131-R1133 PolarHBondContact O-N 2.85Å; A1131-L1134 PolarHBondContact O-N 2.76Å; A1131-A1135 WeakPolarHBondContact O-CB 3.35Å; A1131-A1135 PolarHBondContact O-N 2.87Å
1132	A	81.8	Confident	80.7	Confident	22 Å²	22	66.8 Å²	66.8	18%	0.182	38%	0.378	C	S	.	.	H	α-helix	trans	-60.5	-39.8	175.1	0	0	0	0	0	112.4	G1128 F1129 N1130 A1135 M1136 L1137	G1128-A1132 PolarHBondContact O-N 2.84Å; F1129-A1132 WeakPolarHBondContact O-CB 3.26Å; F1129-A1132 PolarHBondContact O-N 2.89Å; N1130-A1132 VanDerWaalsContact C-N 3.29Å; N1130-A1132 PolarHBondContact O-N 2.83Å; A1132-A1135 CarbonylContact O-C 3.57Å; A1132-A1135 PolarHBondContact O-N 2.93Å; A1132-M1136 PolarHBondContact O-N 2.83Å; A1132-L1137 HydrophobicContact CB-CB 4.39Å; A1132-L1137 HydrophobicContact CB-CD1 3.93Å; A1132-L1137 HydrophobicContact CB-CD2 4.45Å; A1132-L1137 HydrophobicContact CB-CG 4.48Å; A1132-L1137 WeakPolarHBondContact O-CB 3.3Å; A1132-L1137 WeakPolarHBondContact O-CD1 3.24Å; A1132-L1137 PolarHBondContact O-N 3.44Å
1133	R	81.5	Confident	81	Confident	65 Å²	65	71.9 Å²	71.9	25%	0.245	39%	0.39	C	S	.	.	H	α-helix	trans	-66.2	-42.7	174.4	-168.8	178.3	61.8	165.1	3.1	112.6	N1111 F1129 N1130 A1131 A1135 M1136 I1142	N1111-R1133 PolarHBondContact OD1-NH1 2.81Å; N1111-R1133 PolarHBondContact OD1-NH2 2.98Å; F1129-R1133 PolarHBondContact O-N 2.77Å; N1130-R1133 WeakPolarHBondContact O-CB 3.38Å; N1130-R1133 PolarHBondContact O-N 2.85Å; A1131-R1133 VanDerWaalsContact C-N 3.31Å; A1131-R1133 PolarHBondContact O-N 2.85Å; R1133-A1135 PolarHBondContact O-N 2.95Å; R1133-M1136 WeakPolarHBondContact O-CA 3.18Å; R1133-M1136 PolarHBondContact O-N 2.9Å; R1133-I1142 HydrophobicContact CB-CD1 3.83Å; R1133-I1142 HydrophobicContact CG-CD1 4.21Å
1134	L	78.3	Confident	81.7	Confident	82 Å²	82	76.8 Å²	76.8	43%	0.429	41%	0.414	S	S	.	.	H	α-helix	trans	-62.7	-34.1	175.6	-70.9	171.3	0	0	0	112	M947 F1114 N1130 A1131 M1136	M947-L1134 HydrophobicContact CE-CB 4.31Å; M947-L1134 HydrophobicContact CE-CD1 4.32Å; M947-L1134 HydrophobicContact SD-CB 4.38Å; M947-L1134 HydrophobicContact SD-CD1 4.28Å; F1114-L1134 HydrophobicContact CD2-CD1 4.49Å; F1114-L1134 HydrophobicContact CE2-CD1 3.44Å; F1114-L1134 VanDerWaalsContact CE2-CD1 3.44Å; F1114-L1134 HydrophobicContact CZ-CD1 3.96Å; N1130-L1134 WeakPolarHBondContact O-CG 3.49Å; N1130-L1134 PolarHBondContact O-N 2.77Å; A1131-L1134 PolarHBondContact O-N 2.76Å; L1134-M1136 PolarHBondContact O-N 2.91Å
1135	A	82.9	Confident	82.7	Confident	70 Å²	70	72.9 Å²	72.9	58%	0.579	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	8.5	170.8	0	0	0	0	0	113.7	A1131 A1132 R1133 L1137	A1131-A1135 WeakPolarHBondContact O-CB 3.35Å; A1131-A1135 PolarHBondContact O-N 2.87Å; A1132-A1135 CarbonylContact O-C 3.57Å; A1132-A1135 PolarHBondContact O-N 2.93Å; R1133-A1135 PolarHBondContact O-N 2.95Å; A1135-L1137 VanDerWaalsContact C-N 3.32Å; A1135-L1137 HydrophobicContact CB-CD1 3.92Å; A1135-L1137 PolarHBondContact O-N 2.82Å
1136	M	86	Confident	83.4	Confident	164 Å²	164	69.9 Å²	69.9	81%	0.808	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.2	33.6	178.5	-56.6	-66.4	165.5	0	0	114.2	A1132 R1133 L1134	A1132-M1136 PolarHBondContact O-N 2.83Å; R1133-M1136 WeakPolarHBondContact O-CA 3.18Å; R1133-M1136 PolarHBondContact O-N 2.9Å; L1134-M1136 PolarHBondContact O-N 2.91Å
1137	L	88.5	Confident	84.2	Confident	73 Å²	73	68.5 Å²	68.5	38%	0.382	38%	0.376	S	S	.	.			trans	-64	144.8	170.9	-87	92.6	0	0	0	111	A1132 A1135 D1139 V1141 I1142	A1132-L1137 HydrophobicContact CB-CB 4.39Å; A1132-L1137 HydrophobicContact CB-CD1 3.93Å; A1132-L1137 HydrophobicContact CB-CD2 4.45Å; A1132-L1137 HydrophobicContact CB-CG 4.48Å; A1132-L1137 WeakPolarHBondContact O-CB 3.3Å; A1132-L1137 WeakPolarHBondContact O-CD1 3.24Å; A1132-L1137 PolarHBondContact O-N 3.44Å; A1135-L1137 VanDerWaalsContact C-N 3.32Å; A1135-L1137 HydrophobicContact CB-CD1 3.92Å; A1135-L1137 PolarHBondContact O-N 2.82Å; L1137-D1139 PolarHBondContact O-N 3.16Å; L1137-V1141 HydrophobicContact CD2-CG1 4.39Å; L1137-I1142 HydrophobicContact CB-CD1 4.26Å; L1137-I1142 HydrophobicContact CB-CG1 4.17Å; L1137-I1142 WeakPolarHBondContact O-CD1 3.23Å
1138	P	91.2	Very high	84.9	Confident	85 Å²	85	71.8 Å²	71.8	55%	0.552	39%	0.391	S	S	*	.			trans	-59.3	132.5	179.4	-23.8	32.8	0	0	0	112.7	K1140 V1141 I1142	P1138-K1140 PolarHBondContact O-N 2.85Å; P1138-V1141 HydrophobicContact CB-CG2 4.2Å; P1138-V1141 HydrophobicContact CG-CG2 4.42Å; P1138-V1141 WeakPolarHBondContact O-CA 3.32Å; P1138-V1141 WeakPolarHBondContact O-CB 3.34Å; P1138-V1141 PolarHBondContact O-N 2.78Å; P1138-I1142 PolarHBondContact O-N 2.69Å; P1138-I1142 VanDerWaalsContact O-N 3.16Å
1139	D	88.1	Confident	85.4	Confident	81 Å²	81	71.2 Å²	71.2	43%	0.433	38%	0.383	S	S	.	.	H	α-helix	trans	-54.7	-30.6	-178.7	-70	-31	0	0	0	114.2	L1137 V1141 I1142 R1143	L1137-D1139 PolarHBondContact O-N 3.16Å; D1139-V1141 VanDerWaalsContact C-N 3.31Å; D1139-I1142 PolarHBondContact O-N 3.01Å; D1139-R1143 WeakPolarHBondContact O-CB 3.27Å; D1139-R1143 WeakPolarHBondContact O-CG 3.39Å; D1139-R1143 PolarHBondContact O-N 3.23Å; D1139-R1143 PolarHBondContact O-NE 2.93Å
1140	K	90.7	Very high	85.6	Confident	167 Å²	167	74.7 Å²	74.7	73%	0.726	40%	0.398	S	S	*	.	H	α-helix	trans	-62.2	-40.5	175	-69.2	-177.9	-177.9	178.3	0	111.4	P1138 L1144	P1138-K1140 PolarHBondContact O-N 2.85Å; K1140-L1144 WeakPolarHBondContact O-CB 3.48Å; K1140-L1144 PolarHBondContact O-N 3.21Å; K1140-L1144 VanDerWaalsContact O-N 3.17Å
1141	V	91.8	Very high	86.1	Confident	77 Å²	77	78.6 Å²	78.6	47%	0.467	42%	0.415	S	S	.	.	H	α-helix	trans	-71	-42.7	178.1	179.4	0	0	0	0	110.2	L1137 P1138 D1139 R1143 L1144 G1145	L1137-V1141 HydrophobicContact CD2-CG1 4.39Å; P1138-V1141 HydrophobicContact CB-CG2 4.2Å; P1138-V1141 HydrophobicContact CG-CG2 4.42Å; P1138-V1141 WeakPolarHBondContact O-CA 3.32Å; P1138-V1141 WeakPolarHBondContact O-CB 3.34Å; P1138-V1141 PolarHBondContact O-N 2.78Å; D1139-V1141 VanDerWaalsContact C-N 3.31Å; V1141-R1143 PolarHBondContact O-N 2.92Å; V1141-L1144 PolarHBondContact O-N 3.39Å; V1141-G1145 PolarHBondContact O-N 3.15Å
1142	I	87.7	Confident	86.5	Confident	6 Å²	6	84.3 Å²	84.3	3%	0.031	44%	0.438	C	S	.	.	H	α-helix	trans	-60.6	-47.3	178	-61.8	173.5	0	0	0	110.7	L1109 F1129 R1133 L1137 P1138 D1139 L1144 G1145 L1146	L1109-I1142 HydrophobicContact CD2-CG2 4.42Å; F1129-I1142 HydrophobicContact CB-CG2 4.34Å; F1129-I1142 HydrophobicContact CD1-CG2 4.43Å; R1133-I1142 HydrophobicContact CB-CD1 3.83Å; R1133-I1142 HydrophobicContact CG-CD1 4.21Å; L1137-I1142 HydrophobicContact CB-CD1 4.26Å; L1137-I1142 HydrophobicContact CB-CG1 4.17Å; L1137-I1142 WeakPolarHBondContact O-CD1 3.23Å; P1138-I1142 PolarHBondContact O-N 2.69Å; P1138-I1142 VanDerWaalsContact O-N 3.16Å; D1139-I1142 PolarHBondContact O-N 3.01Å; I1142-L1144 PolarHBondContact O-N 3.44Å; I1142-G1145 PolarHBondContact O-N 2.98Å; I1142-L1146 HydrophobicContact CG2-CD1 4.15Å; I1142-L1146 WeakPolarHBondContact O-CG 3.33Å; I1142-L1146 PolarHBondContact O-N 3.38Å
1143	R	87.5	Confident	86.5	Confident	143 Å²	143	88.2 Å²	88.2	54%	0.54	45%	0.452	S	S	.	.	H	α-helix	trans	-60	-43.6	176.5	-77.8	-176.2	-71.6	161.5	-11	112.8	D1139 V1141 G1145 L1146 A1147	D1139-R1143 WeakPolarHBondContact O-CB 3.27Å; D1139-R1143 WeakPolarHBondContact O-CG 3.39Å; D1139-R1143 PolarHBondContact O-N 3.23Å; D1139-R1143 PolarHBondContact O-NE 2.93Å; V1141-R1143 PolarHBondContact O-N 2.92Å; R1143-G1145 VanDerWaalsContact C-N 3.34Å; R1143-L1146 PolarHBondContact O-N 3.45Å; R1143-A1147 PolarHBondContact O-N 2.97Å
1144	L	91	Very high	86.6	Confident	114 Å²	114	89.2 Å²	89.2	60%	0.597	46%	0.458	S	S	*	.	H	α-helix	trans	-63	-43	176.1	-176.9	66	0	0	0	111.3	K1140 V1141 I1142 A1147 K1148	K1140-L1144 WeakPolarHBondContact O-CB 3.48Å; K1140-L1144 PolarHBondContact O-N 3.21Å; K1140-L1144 VanDerWaalsContact O-N 3.17Å; V1141-L1144 PolarHBondContact O-N 3.39Å; I1142-L1144 PolarHBondContact O-N 3.44Å; L1144-A1147 PolarHBondContact O-N 3.46Å; L1144-K1148 PolarHBondContact O-N 3.15Å
1145	G	89.1	Confident	86.9	Confident	21 Å²	21	88 Å²	88	22%	0.216	46%	0.455	C	S	.	.	H	α-helix	trans	-61.1	-44.1	176.4	0	0	0	0	0	112.7	F1129 V1141 I1142 R1143 A1147 K1148 A1149	F1129-G1145 VanDerWaalsContact CZ-O 3.22Å; F1129-G1145 WeakPolarHBondContact CZ-O 3.08Å; V1141-G1145 PolarHBondContact O-N 3.15Å; I1142-G1145 PolarHBondContact O-N 2.98Å; R1143-G1145 VanDerWaalsContact C-N 3.34Å; G1145-A1147 PolarHBondContact O-N 3.18Å; G1145-K1148 PolarHBondContact O-N 2.89Å; G1145-A1149 PolarHBondContact O-N 2.95Å
1146	L	86.4	Confident	86.8	Confident	54 Å²	54	89.2 Å²	89.2	28%	0.283	46%	0.455	S	S	.	.	H	α-helix	trans	-61.5	-42.1	175	-77.3	167.3	0	0	0	112.2	L1109 F1129 I1142 R1143 K1148 A1149 K1150	L1109-L1146 HydrophobicContact CD2-CD1 3.37Å; F1129-L1146 HydrophobicContact CB-CD2 4.05Å; F1129-L1146 HydrophobicContact CB-CG 4.33Å; F1129-L1146 HydrophobicContact CD1-CD2 4.37Å; F1129-L1146 HydrophobicContact CD1-CG 4.14Å; F1129-L1146 HydrophobicContact CD2-CD2 3.36Å; F1129-L1146 HydrophobicContact CD2-CG 4.02Å; F1129-L1146 HydrophobicContact CE2-CD2 3.88Å; F1129-L1146 HydrophobicContact CE2-CG 4.41Å; F1129-L1146 HydrophobicContact CG-CD2 3.64Å; F1129-L1146 HydrophobicContact CG-CG 3.87Å; I1142-L1146 HydrophobicContact CG2-CD1 4.15Å; I1142-L1146 WeakPolarHBondContact O-CG 3.33Å; I1142-L1146 PolarHBondContact O-N 3.38Å; R1143-L1146 PolarHBondContact O-N 3.45Å; L1146-K1148 VanDerWaalsContact C-N 3.31Å; L1146-K1148 PolarHBondContact O-N 3.47Å; L1146-A1149 PolarHBondContact O-N 3.07Å; L1146-K1150 WeakPolarHBondContact O-CG 3.17Å; L1146-K1150 PolarHBondContact O-N 3.33Å; L1146-K1150 VanDerWaalsContact O-N 3.09Å
1147	A	86.9	Confident	86.6	Confident	57 Å²	57	81.9 Å²	81.9	47%	0.471	42%	0.42	S	S	.	.	H	α-helix	trans	-61	-42.1	175	0	0	0	0	0	111.4	R1143 L1144 G1145 K1150 E1151	R1143-A1147 PolarHBondContact O-N 2.97Å; L1144-A1147 PolarHBondContact O-N 3.46Å; G1145-A1147 PolarHBondContact O-N 3.18Å; A1147-K1150 PolarHBondContact O-N 3.19Å; A1147-E1151 PolarHBondContact O-N 3.37Å; A1147-E1151 VanDerWaalsContact O-N 3.13Å
1148	K	88.4	Confident	86.4	Confident	95 Å²	95	81 Å²	81	41%	0.413	42%	0.418	S	S	.	.	H	α-helix	trans	-67.9	-38.5	175.7	-75.1	-58.8	-172.7	-176.9	0	113.6	L1144 G1145 L1146 K1150 E1151 F1152	L1144-K1148 PolarHBondContact O-N 3.15Å; G1145-K1148 PolarHBondContact O-N 2.89Å; L1146-K1148 VanDerWaalsContact C-N 3.31Å; L1146-K1148 PolarHBondContact O-N 3.47Å; K1148-K1150 PolarHBondContact O-N 3.05Å; K1148-E1151 WeakPolarHBondContact CD-OE2 3.43Å; K1148-E1151 IonicContact NZ-OE1 2.76Å; K1148-E1151 IonicContact NZ-OE2 2.81Å; K1148-E1151 PolarHBondContact NZ-OE2 2.89Å; K1148-E1151 WeakPolarHBondContact O-CB 3.41Å; K1148-E1151 PolarHBondContact O-N 2.8Å; K1148-F1152 HydrophobicContact CB-CE2 4.37Å; K1148-F1152 WeakPolarHBondContact O-CD2 3.15Å; K1148-F1152 WeakPolarHBondContact O-CG 3.48Å; K1148-F1152 PolarHBondContact O-N 3.08Å
1149	A	85.2	Confident	85.9	Confident	23 Å²	23	83.8 Å²	83.8	19%	0.19	42%	0.422	C	S	.	.	H	α-helix	trans	-60.5	-45.6	174.8	0	0	0	0	0	111.5	F1129 G1145 L1146 E1151 F1152 E1153	F1129-A1149 HydrophobicContact CE2-CB 3.59Å; F1129-A1149 HydrophobicContact CZ-CB 3.8Å; G1145-A1149 PolarHBondContact O-N 2.95Å; L1146-A1149 PolarHBondContact O-N 3.07Å; A1149-E1151 VanDerWaalsContact C-N 3.3Å; A1149-E1151 PolarHBondContact O-N 2.95Å; A1149-F1152 PolarHBondContact O-N 2.96Å; A1149-F1152 VanDerWaalsContact O-N 3.13Å; A1149-E1153 WeakPolarHBondContact O-CG 3.3Å; A1149-E1153 PolarHBondContact O-N 2.84Å
1150	K	84.2	Confident	85.4	Confident	141 Å²	141	82.7 Å²	82.7	61%	0.613	42%	0.424	S	S	*	.	H	α-helix	trans	-59.5	-39.6	174.3	-70.9	-179.5	179.7	-175.5	0	112.5	L1146 A1147 K1148 E1153 K1154	L1146-K1150 WeakPolarHBondContact O-CG 3.17Å; L1146-K1150 PolarHBondContact O-N 3.33Å; L1146-K1150 VanDerWaalsContact O-N 3.09Å; A1147-K1150 PolarHBondContact O-N 3.19Å; K1148-K1150 PolarHBondContact O-N 3.05Å; K1150-E1153 PolarHBondContact O-N 3.41Å; K1150-K1154 WeakPolarHBondContact O-CB 3.32Å; K1150-K1154 PolarHBondContact O-N 3.29Å
1151	E	85.7	Confident	84.9	Confident	96 Å²	96	75.4 Å²	75.4	45%	0.449	39%	0.394	S	S	.	.	H	α-helix	trans	-61.5	-44	174.3	-170.6	-174.6	163.8	0	0	111.7	A1147 K1148 A1149 T1155	A1147-E1151 PolarHBondContact O-N 3.37Å; A1147-E1151 VanDerWaalsContact O-N 3.13Å; K1148-E1151 WeakPolarHBondContact CD-OE2 3.43Å; K1148-E1151 IonicContact NZ-OE1 2.76Å; K1148-E1151 IonicContact NZ-OE2 2.81Å; K1148-E1151 PolarHBondContact NZ-OE2 2.89Å; K1148-E1151 WeakPolarHBondContact O-CB 3.41Å; K1148-E1151 PolarHBondContact O-N 2.8Å; A1149-E1151 VanDerWaalsContact C-N 3.3Å; A1149-E1151 PolarHBondContact O-N 2.95Å; E1151-T1155 WeakPolarHBondContact O-CB 3.3Å; E1151-T1155 PolarHBondContact O-N 3.33Å; E1151-T1155 PolarHBondContact O-OG1 3.18Å
1152	F	83.8	Confident	84.5	Confident	134 Å²	134	75.2 Å²	75.2	59%	0.588	39%	0.393	S	S	*	.	H	α-helix	trans	-67.9	-41	177	-67.5	-45.9	0	0	0	113.1	K1148 A1149 T1155 T1156	K1148-F1152 HydrophobicContact CB-CE2 4.37Å; K1148-F1152 WeakPolarHBondContact O-CD2 3.15Å; K1148-F1152 WeakPolarHBondContact O-CG 3.48Å; K1148-F1152 PolarHBondContact O-N 3.08Å; A1149-F1152 PolarHBondContact O-N 2.96Å; A1149-F1152 VanDerWaalsContact O-N 3.13Å; F1152-T1155 PolarHBondContact O-N 3.3Å; F1152-T1156 WeakPolarHBondContact O-CB 3.45Å; F1152-T1156 PolarHBondContact O-N 3.08Å; F1152-T1156 PolarHBondContact O-OG1 3.13Å
1153	E	82.4	Confident	84	Confident	105 Å²	105	83.1 Å²	83.1	49%	0.491	42%	0.422	S	S	.	.	H	α-helix	trans	-61.7	-46.8	175.3	-73.3	175.7	-179.1	0	0	111.2	A1149 K1150 T1155 T1156 A1157 F1185	A1149-E1153 WeakPolarHBondContact O-CG 3.3Å; A1149-E1153 PolarHBondContact O-N 2.84Å; K1150-E1153 PolarHBondContact O-N 3.41Å; E1153-T1155 VanDerWaalsContact C-N 3.32Å; E1153-T1155 PolarHBondContact O-N 3.44Å; E1153-T1156 PolarHBondContact O-N 2.92Å; E1153-A1157 WeakPolarHBondContact O-CB 3.36Å; E1153-A1157 PolarHBondContact O-N 3.21Å; E1153-F1185 HydrophobicContact CB-CE1 3.57Å; E1153-F1185 HydrophobicContact CB-CZ 3.98Å
1154	K	83.3	Confident	83.4	Confident	85 Å²	85	82.3 Å²	82.3	37%	0.37	42%	0.419	S	S	.	.	H	α-helix	trans	-57.9	-45.8	175.1	-178.7	178.4	-178.5	171.7	0	111.3	K1150 T1158 F1185	K1150-K1154 WeakPolarHBondContact O-CB 3.32Å; K1150-K1154 PolarHBondContact O-N 3.29Å; K1154-T1158 WeakPolarHBondContact O-CB 3.45Å; K1154-T1158 PolarHBondContact O-N 3.23Å; K1154-T1158 PolarHBondContact O-OG1 3.43Å; K1154-F1185 HydrophobicContact CB-CB 4.15Å; K1154-F1185 HydrophobicContact CB-CD1 4.05Å; K1154-F1185 HydrophobicContact CB-CD2 4.48Å; K1154-F1185 HydrophobicContact CB-CG 3.99Å; K1154-F1185 HydrophobicContact CD-CB 4.14Å; K1154-F1185 HydrophobicContact CG-CB 4.03Å; K1154-F1185 HydrophobicContact CG-CG 4.27Å
1155	T	85.1	Confident	82.9	Confident	58 Å²	58	81.6 Å²	81.6	36%	0.356	42%	0.415	S	S	.	.	H	α-helix	trans	-62.3	-46.4	179.1	-59.1	0	0	0	0	111	E1151 F1152 E1153 T1158 F1159	E1151-T1155 WeakPolarHBondContact O-CB 3.3Å; E1151-T1155 PolarHBondContact O-N 3.33Å; E1151-T1155 PolarHBondContact O-OG1 3.18Å; F1152-T1155 PolarHBondContact O-N 3.3Å; E1153-T1155 VanDerWaalsContact C-N 3.32Å; E1153-T1155 PolarHBondContact O-N 3.44Å; T1155-T1158 WeakPolarHBondContact O-CB 3.08Å; T1155-T1158 PolarHBondContact O-N 2.79Å; T1155-F1159 HydrophobicContact CG2-CD2 3.66Å; T1155-F1159 HydrophobicContact CG2-CE2 3.48Å; T1155-F1159 VanDerWaalsContact CG2-CE2 3.48Å; T1155-F1159 WeakPolarHBondContact O-CD2 3.35Å; T1155-F1159 PolarHBondContact O-N 2.98Å
1156	T	80.6	Confident	82.6	Confident	94 Å²	94	87.1 Å²	87.1	58%	0.577	44%	0.439	S	S	*	.	H	α-helix	trans	-64.3	-44.7	179.2	-54.9	0	0	0	0	111.8	F1152 E1153 T1158 F1159 A1160	F1152-T1156 WeakPolarHBondContact O-CB 3.45Å; F1152-T1156 PolarHBondContact O-N 3.08Å; F1152-T1156 PolarHBondContact O-OG1 3.13Å; E1153-T1156 PolarHBondContact O-N 2.92Å; T1156-T1158 VanDerWaalsContact C-N 3.33Å; T1156-T1158 PolarHBondContact O-N 2.94Å; T1156-F1159 PolarHBondContact O-N 2.93Å; T1156-A1160 WeakPolarHBondContact O-CB 3.45Å; T1156-A1160 PolarHBondContact O-N 2.78Å
1157	A	81.5	Confident	82.3	Confident	10 Å²	10	90.1 Å²	90.1	8%	0.083	45%	0.452	C	S	.	.	H	α-helix	trans	-61.1	-43.1	175.3	0	0	0	0	0	111.4	E1153 A1160 C1161 L1182 F1185	E1153-A1157 WeakPolarHBondContact O-CB 3.36Å; E1153-A1157 PolarHBondContact O-N 3.21Å; A1157-A1160 PolarHBondContact O-N 3.04Å; A1157-C1161 PolarHBondContact O-N 2.77Å; A1157-C1161 PolarHBondContact O-SG 3.03Å; A1157-L1182 HydrophobicContact CB-CD2 4.21Å; A1157-F1185 HydrophobicContact CB-CE2 3.76Å; A1157-F1185 HydrophobicContact CB-CZ 4.27Å
1158	T	83.3	Confident	81.9	Confident	56 Å²	56	89 Å²	89	34%	0.344	45%	0.446	S	S	.	.	H	α-helix	trans	-60.6	-48.9	176.5	-55.5	0	0	0	0	111	K1154 T1155 T1156 A1160 C1161 V1162	K1154-T1158 WeakPolarHBondContact O-CB 3.45Å; K1154-T1158 PolarHBondContact O-N 3.23Å; K1154-T1158 PolarHBondContact O-OG1 3.43Å; T1155-T1158 WeakPolarHBondContact O-CB 3.08Å; T1155-T1158 PolarHBondContact O-N 2.79Å; T1156-T1158 VanDerWaalsContact C-N 3.33Å; T1156-T1158 PolarHBondContact O-N 2.94Å; T1158-A1160 VanDerWaalsContact C-N 3.34Å; T1158-A1160 PolarHBondContact O-N 3.06Å; T1158-C1161 PolarHBondContact O-N 3.08Å; T1158-V1162 WeakPolarHBondContact O-CG2 3.11Å; T1158-V1162 PolarHBondContact O-N 3.16Å
1159	F	81.1	Confident	81.2	Confident	143 Å²	143	90.9 Å²	90.9	63%	0.627	47%	0.468	S	S	*	.	H	α-helix	trans	-62.6	-37.9	177.3	-83.1	-64.2	0	0	0	113	T1155 T1156 V1162 R1163	T1155-F1159 HydrophobicContact CG2-CD2 3.66Å; T1155-F1159 HydrophobicContact CG2-CE2 3.48Å; T1155-F1159 VanDerWaalsContact CG2-CE2 3.48Å; T1155-F1159 WeakPolarHBondContact O-CD2 3.35Å; T1155-F1159 PolarHBondContact O-N 2.98Å; T1156-F1159 PolarHBondContact O-N 2.93Å; F1159-V1162 PolarHBondContact O-N 3.47Å; F1159-R1163 VanDerWaalsContact O-CB 3.29Å; F1159-R1163 WeakPolarHBondContact O-CB 3.24Å; F1159-R1163 PolarHBondContact O-N 3.2Å
1160	A	78.1	Confident	80.8	Confident	57 Å²	57	91.6 Å²	91.6	47%	0.471	47%	0.47	S	S	.	.	H	α-helix	trans	-62.8	-44.3	176	0	0	0	0	0	111.8	T1156 A1157 T1158 R1163 R1164	T1156-A1160 WeakPolarHBondContact O-CB 3.45Å; T1156-A1160 PolarHBondContact O-N 2.78Å; A1157-A1160 PolarHBondContact O-N 3.04Å; T1158-A1160 VanDerWaalsContact C-N 3.34Å; T1158-A1160 PolarHBondContact O-N 3.06Å; A1160-R1163 PolarHBondContact O-N 3.36Å; A1160-R1164 WeakPolarHBondContact O-CB 3.27Å; A1160-R1164 PolarHBondContact O-N 3.08Å
1161	C	80.3	Confident	80.7	Confident	15 Å²	15	88.6 Å²	88.6	10%	0.101	46%	0.464	C	S	.	.	H	α-helix	trans	-61.5	-47.4	174.5	-66.1	0	0	0	0	111.6	A1157 T1158 R1163 R1164 L1165 W1178	A1157-C1161 PolarHBondContact O-N 2.77Å; A1157-C1161 PolarHBondContact O-SG 3.03Å; T1158-C1161 PolarHBondContact O-N 3.08Å; C1161-R1163 PolarHBondContact O-N 3.33Å; C1161-R1164 PolarHBondContact O-N 3.18Å; C1161-L1165 WeakPolarHBondContact O-CB 3.44Å; C1161-L1165 PolarHBondContact O-N 2.96Å; C1161-W1178 HydrophobicContact CB-CD2 3.92Å; C1161-W1178 HydrophobicContact CB-CE3 3.69Å; C1161-W1178 HydrophobicContact CB-CG 4.32Å; C1161-W1178 HydrophobicContact CB-CZ3 4.24Å; C1161-W1178 VanDerWaalsContact O-CZ3 3.3Å; C1161-W1178 WeakPolarHBondContact O-CZ3 3.36Å
1162	V	81.9	Confident	80.5	Confident	72 Å²	72	88.8 Å²	88.8	44%	0.436	47%	0.471	S	S	.	.	H	α-helix	trans	-61	-45.6	177.9	172.1	0	0	0	0	111.2	T1158 F1159 R1164 L1165 L1166	T1158-V1162 WeakPolarHBondContact O-CG2 3.11Å; T1158-V1162 PolarHBondContact O-N 3.16Å; F1159-V1162 PolarHBondContact O-N 3.47Å; V1162-R1164 VanDerWaalsContact C-N 3.34Å; V1162-R1164 PolarHBondContact O-N 3.32Å; V1162-L1165 WeakPolarHBondContact O-CB 3.45Å; V1162-L1165 PolarHBondContact O-N 3.24Å; V1162-L1166 HydrophobicContact CG1-CD1 4.08Å; V1162-L1166 WeakPolarHBondContact O-CG 3.4Å; V1162-L1166 PolarHBondContact O-N 3.14Å
1163	R	78	Confident	80.3	Confident	172 Å²	172	87.1 Å²	87.1	65%	0.649	47%	0.465	S	S	*	.	H	α-helix	trans	-59.7	-44.5	178.5	-177.5	179.3	179	176.6	1.9	111.6	F1159 A1160 C1161 L1165 L1166 Q1167	F1159-R1163 VanDerWaalsContact O-CB 3.29Å; F1159-R1163 WeakPolarHBondContact O-CB 3.24Å; F1159-R1163 PolarHBondContact O-N 3.2Å; A1160-R1163 PolarHBondContact O-N 3.36Å; C1161-R1163 PolarHBondContact O-N 3.33Å; R1163-L1165 VanDerWaalsContact C-N 3.34Å; R1163-L1166 PolarHBondContact O-N 3.11Å; R1163-Q1167 WeakPolarHBondContact O-CG 3.5Å; R1163-Q1167 PolarHBondContact O-N 2.95Å; R1163-Q1167 VanDerWaalsContact O-N 3.16Å
1164	R	75.8	Confident	80.1	Confident	127 Å²	127	84 Å²	84	48%	0.479	45%	0.451	S	S	.	.	H	α-helix	trans	-68.4	-34.9	179.4	-175.4	54.4	175.5	173.6	2.5	111.9	A1160 C1161 V1162 L1166 Q1167 W1178	A1160-R1164 WeakPolarHBondContact O-CB 3.27Å; A1160-R1164 PolarHBondContact O-N 3.08Å; C1161-R1164 PolarHBondContact O-N 3.18Å; V1162-R1164 VanDerWaalsContact C-N 3.34Å; V1162-R1164 PolarHBondContact O-N 3.32Å; R1164-L1166 VanDerWaalsContact C-N 3.29Å; R1164-L1166 PolarHBondContact O-N 2.89Å; R1164-Q1167 PolarHBondContact O-N 3.22Å; R1164-W1178 HydrophobicContact CB-CH2 3.55Å; R1164-W1178 HydrophobicContact CB-CZ2 3.6Å; R1164-W1178 HydrophobicContact CG-CH2 3.5Å; R1164-W1178 VanDerWaalsContact CG-CH2 3.5Å; R1164-W1178 HydrophobicContact CG-CZ2 3.3Å
1165	L	79.4	Confident	79.9	Confident	98 Å²	98	83.9 Å²	83.9	51%	0.513	46%	0.455	S	S	.	.	H	α-helix	trans	-62.8	-33.4	172	-169.7	136	0	0	0	113	C1161 V1162 R1163 V1170 W1178	C1161-L1165 WeakPolarHBondContact O-CB 3.44Å; C1161-L1165 PolarHBondContact O-N 2.96Å; V1162-L1165 WeakPolarHBondContact O-CB 3.45Å; V1162-L1165 PolarHBondContact O-N 3.24Å; R1163-L1165 VanDerWaalsContact C-N 3.34Å; L1165-V1170 HydrophobicContact CB-CG2 4.32Å; L1165-V1170 HydrophobicContact CG-CG2 4.44Å; L1165-W1178 HydrophobicContact CB-CZ3 4.18Å
1166	L	83	Confident	79.8	Confident	137 Å²	137	88.7 Å²	88.7	72%	0.717	47%	0.466	S	S	*	.	H	α-helix	trans	-80.9	-19.7	176.9	-67.3	171.7	0	0	0	114.1	V1162 R1163 R1164	V1162-L1166 HydrophobicContact CG1-CD1 4.08Å; V1162-L1166 WeakPolarHBondContact O-CG 3.4Å; V1162-L1166 PolarHBondContact O-N 3.14Å; R1163-L1166 PolarHBondContact O-N 3.11Å; R1164-L1166 VanDerWaalsContact C-N 3.29Å; R1164-L1166 PolarHBondContact O-N 2.89Å
1167	Q	80.4	Confident	79.7	Confident	117 Å²	117	89.7 Å²	89.7	55%	0.547	46%	0.464	S	S	.	.	H	α-helix	trans	-83.3	-13.2	-174.8	-81	177.3	-17	0	0	114.5	R1163 R1164	R1163-Q1167 WeakPolarHBondContact O-CG 3.5Å; R1163-Q1167 PolarHBondContact O-N 2.95Å; R1163-Q1167 VanDerWaalsContact O-N 3.16Å; R1164-Q1167 PolarHBondContact O-N 3.22Å
1168	G	78.2	Confident	79.7	Confident	35 Å²	35	91.1 Å²	91.1	36%	0.361	47%	0.468	S	S	.	.	S	Bend	trans	159.1	-175	-179.4	0	0	0	0	0	113.5	V1170	G1168-V1170 PolarHBondContact O-N 3.04Å
1169	P	74.9	Confident	79.5	Confident	133 Å²	133	92.7 Å²	92.7	86%	0.864	47%	0.474	S	S	*	.	P	Polyproline II helix	trans	-61.8	127.7	179.8	24.5	-31.8	0	0	0	111.1
1170	V	76.4	Confident	79.4	Confident	39 Å²	39	89.9 Å²	89.9	24%	0.236	47%	0.472	C	S	.	.	P	Polyproline II helix	trans	-97	136.1	-179.9	-176.2	0	0	0	0	109.1	L1165 G1168 D1174 L1175 W1178	L1165-V1170 HydrophobicContact CB-CG2 4.32Å; L1165-V1170 HydrophobicContact CG-CG2 4.44Å; G1168-V1170 PolarHBondContact O-N 3.04Å; V1170-D1174 HydrophobicContact CG1-CB 3.53Å; V1170-L1175 HydrophobicContact CG1-CD2 4.04Å; V1170-L1175 HydrophobicContact CG1-CG 3.89Å; V1170-W1178 HydrophobicContact CB-CH2 4.46Å; V1170-W1178 HydrophobicContact CG1-CH2 3.62Å; V1170-W1178 HydrophobicContact CG1-CZ2 4.18Å; V1170-W1178 HydrophobicContact CG1-CZ3 3.93Å; V1170-W1178 HydrophobicContact CG2-CH2 3.89Å; V1170-W1178 HydrophobicContact CG2-CZ3 4.32Å
1171	T	82	Confident	79.2	Confident	78 Å²	78	93.1 Å²	93.1	48%	0.479	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-78	157.1	176.2	69.4	0	0	0	0	111.1	E1173 D1174 L1175	T1171-E1173 PolarHBondContact O-N 3.38Å; T1171-D1174 WeakPolarHBondContact CB-OD2 3.39Å; T1171-D1174 PolarHBondContact N-OD2 3.4Å; T1171-D1174 WeakPolarHBondContact O-CB 2.96Å; T1171-D1174 PolarHBondContact O-N 3.4Å; T1171-D1174 PolarHBondContact OG1-N 3.25Å; T1171-D1174 PolarHBondContact OG1-OD2 3.19Å; T1171-L1175 PolarHBondContact O-N 3.23Å
1172	V	81.1	Confident	79.1	Confident	99 Å²	99	94.8 Å²	94.8	60%	0.6	48%	0.483	S	S	*	.	H	α-helix	trans	-60	-31.3	174.6	176.7	0	0	0	0	111.4	L1175 R1176	V1172-L1175 PolarHBondContact O-N 3.06Å; V1172-R1176 WeakPolarHBondContact O-CG 3.15Å; V1172-R1176 PolarHBondContact O-N 2.86Å
1173	E	80	Confident	78.9	Confident	99 Å²	99	97.2 Å²	97.2	46%	0.463	49%	0.488	S	S	.	.	H	α-helix	trans	-69.2	-41.5	178.3	-164.1	58.5	-155.3	0	0	111.9	T1171 L1175 R1176 Q1177	T1171-E1173 PolarHBondContact O-N 3.38Å; E1173-L1175 VanDerWaalsContact C-N 3.31Å; E1173-L1175 PolarHBondContact O-N 3.16Å; E1173-R1176 PolarHBondContact O-N 2.93Å; E1173-R1176 IonicContact OE2-NH1 2.9Å; E1173-Q1177 PolarHBondContact O-N 3.22Å
1174	D	77.9	Confident	78.5	Confident	39 Å²	39	93 Å²	93	21%	0.209	49%	0.49	C	S	.	.	H	α-helix	trans	-57.1	-46.1	172.2	-63.2	-46.4	0	0	0	110.8	V1170 T1171 R1176 Q1177 W1178	V1170-D1174 HydrophobicContact CG1-CB 3.53Å; T1171-D1174 WeakPolarHBondContact CB-OD2 3.39Å; T1171-D1174 PolarHBondContact N-OD2 3.4Å; T1171-D1174 WeakPolarHBondContact O-CB 2.96Å; T1171-D1174 PolarHBondContact O-N 3.4Å; T1171-D1174 PolarHBondContact OG1-N 3.25Å; T1171-D1174 PolarHBondContact OG1-OD2 3.19Å; D1174-R1176 VanDerWaalsContact C-N 3.34Å; D1174-R1176 PolarHBondContact O-N 3.44Å; D1174-Q1177 PolarHBondContact O-N 3.18Å; D1174-W1178 HydrophobicContact CB-CZ2 4.08Å; D1174-W1178 WeakPolarHBondContact O-CB 3.27Å; D1174-W1178 PolarHBondContact O-N 2.67Å
1175	L	80.1	Confident	78.1	Confident	83 Å²	83	89.9 Å²	89.9	44%	0.435	48%	0.48	S	S	.	.	H	α-helix	trans	-62.6	-38	178.3	-70	173.8	0	0	0	112.6	V1170 T1171 V1172 E1173 W1178 N1179	V1170-L1175 HydrophobicContact CG1-CD2 4.04Å; V1170-L1175 HydrophobicContact CG1-CG 3.89Å; T1171-L1175 PolarHBondContact O-N 3.23Å; V1172-L1175 PolarHBondContact O-N 3.06Å; E1173-L1175 VanDerWaalsContact C-N 3.31Å; E1173-L1175 PolarHBondContact O-N 3.16Å; L1175-W1178 HydrophobicContact CD2-CE3 4.18Å; L1175-W1178 HydrophobicContact CD2-CZ3 4.27Å; L1175-N1179 VanDerWaalsContact O-CB 3.27Å; L1175-N1179 WeakPolarHBondContact O-CB 3.3Å; L1175-N1179 PolarHBondContact O-N 3.12Å
1176	R	82.3	Confident	77.1	Confident	159 Å²	159	93.9 Å²	93.9	60%	0.6	50%	0.501	S	S	*	.	H	α-helix	trans	-66.5	-45.9	175.8	-76.1	176.2	177.7	169.6	-2.4	111.8	V1172 E1173 D1174 W1178 N1179 S1180	V1172-R1176 WeakPolarHBondContact O-CG 3.15Å; V1172-R1176 PolarHBondContact O-N 2.86Å; E1173-R1176 PolarHBondContact O-N 2.93Å; E1173-R1176 IonicContact OE2-NH1 2.9Å; D1174-R1176 VanDerWaalsContact C-N 3.34Å; D1174-R1176 PolarHBondContact O-N 3.44Å; R1176-W1178 VanDerWaalsContact C-N 3.32Å; R1176-W1178 PolarHBondContact O-N 3.02Å; R1176-N1179 PolarHBondContact O-N 3.12Å; R1176-S1180 WeakPolarHBondContact O-CB 3.38Å; R1176-S1180 PolarHBondContact O-N 3.23Å
1177	Q	77.9	Confident	76.8	Confident	115 Å²	115	91.8 Å²	91.8	54%	0.537	49%	0.49	S	S	.	.	H	α-helix	trans	-60.8	-42.8	175.9	-73.3	-175.3	2	0	0	111.4	E1173 D1174 S1180 K1181	E1173-Q1177 PolarHBondContact O-N 3.22Å; D1174-Q1177 PolarHBondContact O-N 3.18Å; Q1177-S1180 PolarHBondContact O-N 2.72Å; Q1177-K1181 WeakPolarHBondContact O-CB 3.37Å; Q1177-K1181 PolarHBondContact O-N 2.7Å
1178	W	81.2	Confident	76.6	Confident	41 Å²	41	90.4 Å²	90.4	16%	0.155	49%	0.487	C	S	.	.	H	α-helix	trans	-67.2	-42.6	177.8	-63.8	-0.5	0	0	0	112.3	C1161 R1164 L1165 V1170 D1174 L1175 R1176 S1180 K1181 L1182	C1161-W1178 HydrophobicContact CB-CD2 3.92Å; C1161-W1178 HydrophobicContact CB-CE3 3.69Å; C1161-W1178 HydrophobicContact CB-CG 4.32Å; C1161-W1178 HydrophobicContact CB-CZ3 4.24Å; C1161-W1178 VanDerWaalsContact O-CZ3 3.3Å; C1161-W1178 WeakPolarHBondContact O-CZ3 3.36Å; R1164-W1178 HydrophobicContact CB-CH2 3.55Å; R1164-W1178 HydrophobicContact CB-CZ2 3.6Å; R1164-W1178 HydrophobicContact CG-CH2 3.5Å; R1164-W1178 VanDerWaalsContact CG-CH2 3.5Å; R1164-W1178 HydrophobicContact CG-CZ2 3.3Å; L1165-W1178 HydrophobicContact CB-CZ3 4.18Å; V1170-W1178 HydrophobicContact CB-CH2 4.46Å; V1170-W1178 HydrophobicContact CG1-CH2 3.62Å; V1170-W1178 HydrophobicContact CG1-CZ2 4.18Å; V1170-W1178 HydrophobicContact CG1-CZ3 3.93Å; V1170-W1178 HydrophobicContact CG2-CH2 3.89Å; V1170-W1178 HydrophobicContact CG2-CZ3 4.32Å; D1174-W1178 HydrophobicContact CB-CZ2 4.08Å; D1174-W1178 WeakPolarHBondContact O-CB 3.27Å; D1174-W1178 PolarHBondContact O-N 2.67Å; L1175-W1178 HydrophobicContact CD2-CE3 4.18Å; L1175-W1178 HydrophobicContact CD2-CZ3 4.27Å; R1176-W1178 VanDerWaalsContact C-N 3.32Å; R1176-W1178 PolarHBondContact O-N 3.02Å; W1178-S1180 VanDerWaalsContact C-N 3.31Å; W1178-S1180 PolarHBondContact O-N 2.97Å; W1178-K1181 PolarHBondContact O-N 3.4Å; W1178-L1182 WeakPolarHBondContact O-CB 2.99Å; W1178-L1182 VanDerWaalsContact O-CG 3.32Å; W1178-L1182 WeakPolarHBondContact O-CG 3.42Å; W1178-L1182 PolarHBondContact O-N 3.01Å
1179	N	79.2	Confident	76.5	Confident	89 Å²	89	93.5 Å²	93.5	48%	0.476	49%	0.494	S	S	.	.	H	α-helix	trans	-60.9	-42.6	175.4	-170.8	21	0	0	0	111	L1175 R1176 K1183	L1175-N1179 VanDerWaalsContact O-CB 3.27Å; L1175-N1179 WeakPolarHBondContact O-CB 3.3Å; L1175-N1179 PolarHBondContact O-N 3.12Å; R1176-N1179 PolarHBondContact O-N 3.12Å; N1179-K1183 VanDerWaalsContact O-CB 3.23Å; N1179-K1183 WeakPolarHBondContact O-CB 3.45Å; N1179-K1183 VanDerWaalsContact O-CG 3.26Å; N1179-K1183 WeakPolarHBondContact O-CG 3.47Å; N1179-K1183 PolarHBondContact O-N 2.81Å; N1179-K1183 WeakPolarHBondContact OD1-CE 3.46Å
1180	S	79.3	Confident	76.6	Confident	84 Å²	84	91.2 Å²	91.2	59%	0.587	47%	0.472	S	S	*	.	H	α-helix	trans	-60.5	-49	173.7	-172.5	0	0	0	0	111.7	R1176 Q1177 W1178 L1182 K1183 A1184	R1176-S1180 WeakPolarHBondContact O-CB 3.38Å; R1176-S1180 PolarHBondContact O-N 3.23Å; Q1177-S1180 PolarHBondContact O-N 2.72Å; W1178-S1180 VanDerWaalsContact C-N 3.31Å; W1178-S1180 PolarHBondContact O-N 2.97Å; S1180-L1182 PolarHBondContact O-N 2.83Å; S1180-K1183 PolarHBondContact O-N 2.69Å; S1180-A1184 PolarHBondContact O-N 3.38Å
1181	K	74.9	Confident	76.6	Confident	125 Å²	125	94.4 Å²	94.4	54%	0.543	49%	0.487	S	S	.	.	H	α-helix	trans	-62.8	-40.9	179.6	-169.6	174.7	-177.1	175.4	0	112.7	Q1177 W1178 F1185	Q1177-K1181 WeakPolarHBondContact O-CB 3.37Å; Q1177-K1181 PolarHBondContact O-N 2.7Å; W1178-K1181 PolarHBondContact O-N 3.4Å; K1181-F1185 WeakPolarHBondContact O-CD2 3.31Å; K1181-F1185 WeakPolarHBondContact O-CE2 3.38Å
1182	L	77.4	Confident	76.3	Confident	49 Å²	49	95.5 Å²	95.5	26%	0.257	49%	0.488	S	S	.	.	H	α-helix	trans	-74.7	-35.1	178.6	-70.2	172.6	0	0	0	112.3	A1157 W1178 S1180 A1184 F1185	A1157-L1182 HydrophobicContact CB-CD2 4.21Å; W1178-L1182 WeakPolarHBondContact O-CB 2.99Å; W1178-L1182 VanDerWaalsContact O-CG 3.32Å; W1178-L1182 WeakPolarHBondContact O-CG 3.42Å; W1178-L1182 PolarHBondContact O-N 3.01Å; S1180-L1182 PolarHBondContact O-N 2.83Å; L1182-A1184 VanDerWaalsContact C-N 3.3Å; L1182-A1184 PolarHBondContact O-N 2.78Å; L1182-F1185 PolarHBondContact O-N 2.95Å
1183	K	76.8	Confident	76	Confident	124 Å²	124	95.3 Å²	95.3	54%	0.539	48%	0.479	S	S	.	.	H	α-helix	trans	-65	-32.1	172.3	-81.6	-176.6	176.9	-172.7	0	112.8	N1179 S1180 F1185 L1186	N1179-K1183 VanDerWaalsContact O-CB 3.23Å; N1179-K1183 WeakPolarHBondContact O-CB 3.45Å; N1179-K1183 VanDerWaalsContact O-CG 3.26Å; N1179-K1183 WeakPolarHBondContact O-CG 3.47Å; N1179-K1183 PolarHBondContact O-N 2.81Å; N1179-K1183 WeakPolarHBondContact OD1-CE 3.46Å; S1180-K1183 PolarHBondContact O-N 2.69Å; K1183-F1185 PolarHBondContact O-N 2.82Å; K1183-F1185 VanDerWaalsContact O-N 3.12Å; K1183-L1186 PolarHBondContact O-N 3.45Å
1184	A	71.5	Confident	75.6	Confident	83 Å²	83	95 Å²	95	69%	0.686	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-16.4	176	0	0	0	0	0	113.8	S1180 L1182	S1180-A1184 PolarHBondContact O-N 3.38Å; L1182-A1184 VanDerWaalsContact C-N 3.3Å; L1182-A1184 PolarHBondContact O-N 2.78Å
1185	F	67.1	Low	75.5	Confident	61 Å²	61	99.7 Å²	99.7	27%	0.268	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-9.5	174.1	-65.4	-75.7	0	0	0	114.3	E1153 K1154 A1157 K1181 L1182 K1183	E1153-F1185 HydrophobicContact CB-CE1 3.57Å; E1153-F1185 HydrophobicContact CB-CZ 3.98Å; K1154-F1185 HydrophobicContact CB-CB 4.15Å; K1154-F1185 HydrophobicContact CB-CD1 4.05Å; K1154-F1185 HydrophobicContact CB-CD2 4.48Å; K1154-F1185 HydrophobicContact CB-CG 3.99Å; K1154-F1185 HydrophobicContact CD-CB 4.14Å; K1154-F1185 HydrophobicContact CG-CB 4.03Å; K1154-F1185 HydrophobicContact CG-CG 4.27Å; A1157-F1185 HydrophobicContact CB-CE2 3.76Å; A1157-F1185 HydrophobicContact CB-CZ 4.27Å; K1181-F1185 WeakPolarHBondContact O-CD2 3.31Å; K1181-F1185 WeakPolarHBondContact O-CE2 3.38Å; L1182-F1185 PolarHBondContact O-N 2.95Å; K1183-F1185 PolarHBondContact O-N 2.82Å; K1183-F1185 VanDerWaalsContact O-N 3.12Å
1186	L	58	Low	75	Confident	183 Å²	183	101.2 Å²	101.2	96%	0.958	51%	0.51	S	S	*	.			trans	-89.1	0	173.4	-71	170.8	0	0	0	109	K1183	K1183-L1186 PolarHBondContact O-N 3.45Å

Retrieved 1,186 of 1,186 residues in 564.8 ms (Link to these results)

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