F7HME6_MACMU Loading...

Anion exchange protein

AlphaFold DB , UniProt , Accession F7HME6, Species MACMU (Macaca mulatta, Rhesus macaque), Gene SLC4A8, Length 1,093 aa.

						>F7HME6_MACMU|F7HME6|SLC4A8
MPAAGSNEPDGVLSYQRPDEEAVVDQGGTSTILNIHYEKEELEGHRTLYVGVRMPLGRQSHRHHRTHGQKHRRRGRGKGASQGEEGLEALAHDTPSQRVQFILGTEEDEEHVPHELFTELDEICMKEGEDAEWKETARWLKFEEDVEDGGERWSKPYVATLSLHSLFELRSCLINGTVLLDMRANSIEEISDLILDQQELSSDLNDSMRVKVREALLKKHHHQNEKKRNNLIPIVRSFAEVGKKQSDPHSMDKHGQTVSPQSVPTTNLEVKNGVNCEHSPVDLSKVDLHFMKKIPTGAEASNVLVGEVDILDRPIVAFVRLSPAVLLSGLTEVPIPTRFLFILLGPVGKGQQYHEIGRSMATIMTDEIFHDVAYKAKERDDLLAGIDEFLDQVTVLPPGEWDPSIRIEPPKNVPSQEKRKMPGVPNGNVCHIEQEPHGGHSGPELQRTGRLFGGLVLDIKRKAPWYWSDYRDALSLQCLASFLFLYCACMSPVITFGGLLGEATEGRISAIESLFGASMTGIAYSLFAGQALTILGSTGPVLVFEKILFKFCKDYALSYLSLRACIGLWTAFLCIVLVATDASSLVCYITRFTEEAFASLICIIFIYEAIEKLIHLAETYPIHMHSQLDHLSLYYCRCTLPENPNNHTLQYWKDHNIVTAEVHWANLTVSECQEMHGEFMGSACGHHGPYTPDVLFWSCILFFTTFILSSTLKTFKTSRYFPTRVRSMVSDFAVFLTIFTMVIIDFLIGVPSPKLQVPSVFKPTRDDRGWIINPIGPNPWWTVIAAIIPALLCTILIFMDQQITAVIINRKEHKLKKGCGYHLDLLMVAIMLGVCSIMGLPWFVAATVLSITHVNSLKLESECSAPGEQPKFLGIREQRVTGLMIFVLMGCSVFMTAILKFIPMPVLYGVFLYMGVSSLQGIQFFDRLKLFGMPAKHQPDFIYLRHVPLRKVHLFTLIQLTCLVLLWVIKASPAAIVFPMMVLALVFVRKVMDLCFSKRELSWLDDLMPESKKKKLDDAKKKAKEEEEAEKMLEIGGDKFPLESRKLLSSPGKSVSCRCDPSEINISDEMPKTTVWKALSMNSGNAKEKSLFN
					

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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	39.9	Very low	32.4	Very low	244 Å²	244	130.7 Å²	130.7	100%	1.202	84%	0.837	S	S	*	*				0	132.7	0	-80.7	-168.9	165	0	0	107.5
2	P	45.2	Very low	31.9	Very low	127 Å²	127	132.4 Å²	132.4	83%	0.825	84%	0.843	S	S	*	*			cis	-120.5	166.9	17.5	22.9	-0	0	0	0	116.1
3	A	31.7	Very low	31.4	Very low	94 Å²	94	133.5 Å²	133.5	78%	0.777	84%	0.837	S	S	*	*			trans	18	122.8	157.7	0	0	0	0	0	120.8
4	A	34.8	Very low	30.9	Very low	109 Å²	109	131.9 Å²	131.9	90%	0.901	83%	0.833	S	S	*	*				87.6	123.5	57.6	0	0	0	0	0	114
5	G	28.7	Very low	30.6	Very low	75 Å²	75	137.7 Å²	137.7	77%	0.773	84%	0.835	S	S	*	*			trans	138.2	79.9	162	0	0	0	0	0	116.8
6	S	29.4	Very low	30.3	Very low	107 Å²	107	140.6 Å²	140.6	75%	0.748	84%	0.837	S	S	*	*			trans	1.3	134.1	151.6	54.3	0	0	0	0	121.3
7	N	25.5	Very low	30	Very low	163 Å²	163	145.8 Å²	145.8	87%	0.872	84%	0.838	S	S	*	*				-167.4	112.1	126.6	-93.4	-11.4	0	0	0	110.8
8	E	30.7	Very low	29.9	Very low	185 Å²	185	144.7 Å²	144.7	86%	0.864	84%	0.837	S	S	*	*			trans	-84.9	158.7	149.4	-99.9	-173.1	162.3	0	0	107.8
9	P	39.8	Very low	29.7	Very low	105 Å²	105	145.5 Å²	145.5	68%	0.682	84%	0.838	S	S	*	*				-153.2	174.6	57.1	40.3	-18	0	0	0	118.9
10	D	26.5	Very low	29.7	Very low	161 Å²	161	148.3 Å²	148.3	86%	0.861	84%	0.843	S	S	*	*			trans	60.5	132.4	154.3	-58	-26.3	0	0	0	119.3
11	G	24.6	Very low	29.6	Very low	68 Å²	68	150.1 Å²	150.1	70%	0.701	84%	0.844	S	S	*	*			cis	166.7	164.1	6.9	0	0	0	0	0	108.4
12	V	26.3	Very low	29.1	Very low	151 Å²	151	142.8 Å²	142.8	92%	0.915	82%	0.822	S	S	*	*			trans	162.4	126.1	140.7	162.9	0	0	0	0	110.1
13	L	25.4	Very low	28.2	Very low	146 Å²	146	143.1 Å²	143.1	76%	0.764	82%	0.822	S	S	*	*			trans	-59.6	142.1	-179.6	-78.9	105.7	0	0	0	115.4	Y15	L13-Y15 HydrophobicContact CD2-CD2 4.02Å; L13-Y15 HydrophobicContact CD2-CE2 4.07Å
14	S	24.4	Very low	28	Very low	111 Å²	111	144.4 Å²	144.4	78%	0.776	82%	0.82	S	S	*	*			trans	-124.9	127.6	145	63.6	0	0	0	0	110
15	Y	26.5	Very low	27.6	Very low	220 Å²	220	146.6 Å²	146.6	86%	0.863	82%	0.817	S	S	*	*			trans	-88.1	126	175.5	-115.8	-96.1	0	0	0	108.6	L13	L13-Y15 HydrophobicContact CD2-CD2 4.02Å; L13-Y15 HydrophobicContact CD2-CE2 4.07Å
16	Q	25.7	Very low	27.5	Very low	184 Å²	184	150.9 Å²	150.9	86%	0.86	82%	0.816	S	S	*	*			trans	-135.9	126.7	169.6	-148.8	153.8	-7.2	0	0	109.5
17	R	25.4	Very low	27.8	Very low	229 Å²	229	150.2 Å²	150.2	86%	0.864	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-65.8	149.9	-178.5	-74.3	176.3	175	159.9	-2	111.3
18	P	28.2	Very low	27.7	Very low	125 Å²	125	145.6 Å²	145.6	81%	0.812	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-84	125.8	169.9	31.2	-27.4	0	0	0	110.9
19	D	25.7	Very low	27.7	Very low	161 Å²	161	143.5 Å²	143.5	86%	0.861	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-73.2	131	165.2	-71	-44.4	0	0	0	109.5	E21	D19-E21 PolarHBondContact O-N 3.39Å
20	E	29.9	Very low	27.1	Very low	201 Å²	201	144.3 Å²	144.3	94%	0.939	83%	0.825	S	S	*	*			trans	-74.1	102.5	168.9	-74.7	-172.1	153.7	0	0	109.3
21	E	27.8	Very low	27.1	Very low	186 Å²	186	142.9 Å²	142.9	87%	0.869	82%	0.823	S	S	*	*			trans	-87.3	122.2	167.7	-144	170.6	-162.9	0	0	109	D19 V23	D19-E21 PolarHBondContact O-N 3.39Å; E21-V23 PolarHBondContact O-N 3.11Å
22	A	28.3	Very low	27.3	Very low	90 Å²	90	146.8 Å²	146.8	74%	0.744	83%	0.826	S	S	*	*			trans	-64.5	125.6	-177.6	0	0	0	0	0	111.4	V24	A22-V24 PolarHBondContact O-N 2.98Å; A22-V24 VanDerWaalsContact O-N 3.17Å
23	V	28	Very low	27.4	Very low	135 Å²	135	147 Å²	147	82%	0.818	82%	0.821	S	S	*	*			trans	-65.8	112.4	172.7	177.8	0	0	0	0	109.2	E21 D25	E21-V23 PolarHBondContact O-N 3.11Å; V23-D25 PolarHBondContact O-N 2.74Å
24	V	27.5	Very low	27.5	Very low	120 Å²	120	147.2 Å²	147.2	73%	0.727	82%	0.823	S	S	*	*			trans	-72.1	108.6	167.3	174.4	0	0	0	0	107.7	A22 Q26	A22-V24 PolarHBondContact O-N 2.98Å; A22-V24 VanDerWaalsContact O-N 3.17Å; V24-Q26 HydrophobicContact CG1-CG 4.49Å; V24-Q26 PolarHBondContact O-N 3.48Å
25	D	26.2	Very low	27.7	Very low	156 Å²	156	147.9 Å²	147.9	83%	0.834	82%	0.817	S	S	*	*			trans	-79.6	102.4	175.5	-140.6	0.9	0	0	0	109.3	V23	V23-D25 PolarHBondContact O-N 2.74Å
26	Q	26.8	Very low	27.6	Very low	165 Å²	165	146.3 Å²	146.3	77%	0.771	82%	0.817	S	S	*	*			trans	-76.5	129.5	170.1	-70.3	-175	-0.2	0	0	108.4	V24 G28	V24-Q26 HydrophobicContact CG1-CG 4.49Å; V24-Q26 PolarHBondContact O-N 3.48Å; Q26-G28 PolarHBondContact O-N 2.59Å
27	G	34	Very low	27.7	Very low	92 Å²	92	146.6 Å²	146.6	95%	0.948	81%	0.811	S	S	*	*			trans	-48.7	110.6	175.9	0	0	0	0	0	112
28	G	25.1	Very low	27.7	Very low	66 Å²	66	144.1 Å²	144.1	68%	0.68	81%	0.809	S	S	*	*			trans	-117.8	117.1	174	0	0	0	0	0	109.5	Q26 S30	Q26-G28 PolarHBondContact O-N 2.59Å; G28-S30 PolarHBondContact O-N 3.49Å; G28-S30 VanDerWaalsContact O-N 3.17Å
29	T	29.8	Very low	27.7	Very low	142 Å²	142	147.7 Å²	147.7	87%	0.871	81%	0.812	S	S	*	*			trans	-52.3	112.1	168.3	44.7	0	0	0	0	110.4	T31	T29-T31 PolarHBondContact O-N 2.67Å
30	S	27.6	Very low	27.9	Very low	121 Å²	121	149.1 Å²	149.1	85%	0.846	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-70.1	121.7	-179.3	55.4	0	0	0	0	111.2	G28	G28-S30 PolarHBondContact O-N 3.49Å; G28-S30 VanDerWaalsContact O-N 3.17Å
31	T	26.2	Very low	28	Very low	132 Å²	132	148.4 Å²	148.4	81%	0.81	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-70.5	137.1	177.3	-23.3	0	0	0	0	110.2	T29 L33	T29-T31 PolarHBondContact O-N 2.67Å; T31-L33 PolarHBondContact O-N 2.81Å
32	I	28.8	Very low	28.1	Very low	149 Å²	149	146.9 Å²	146.9	76%	0.764	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-57.6	116.6	174.4	-68.4	165.5	0	0	0	109.5
33	L	29.1	Very low	28.1	Very low	157 Å²	157	151.7 Å²	151.7	82%	0.822	81%	0.814	S	S	*	*			trans	-100.8	104.9	160.4	-114	133.8	0	0	0	107.3	T31 I35	T31-L33 PolarHBondContact O-N 2.81Å; L33-I35 PolarHBondContact O-N 2.77Å
34	N	26.4	Very low	28.3	Very low	150 Å²	150	148.2 Å²	148.2	80%	0.802	81%	0.805	S	S	*	*			trans	-61.3	100.5	172.7	-85	-30.3	0	0	0	109.6
35	I	28.8	Very low	28.7	Very low	125 Å²	125	150 Å²	150	64%	0.641	81%	0.805	S	S	*	*			trans	-97	116.7	157.3	-58.2	175.3	0	0	0	105.6	L33 Y37	L33-I35 PolarHBondContact O-N 2.77Å; I35-Y37 HydrophobicContact CB-CE2 4.45Å; I35-Y37 HydrophobicContact CG2-CD2 4.48Å; I35-Y37 HydrophobicContact CG2-CE2 4.16Å; I35-Y37 PolarHBondContact O-N 3.27Å
36	H	23.9	Very low	29.4	Very low	187 Å²	187	154.2 Å²	154.2	87%	0.866	81%	0.81	S	S	*	*			trans	-73.9	94.9	-174.7	-145.2	-59.1	0	0	0	108.7
37	Y	27.8	Very low	30.5	Very low	190 Å²	190	148.8 Å²	148.8	75%	0.745	79%	0.788	S	S	*	*			trans	-78.4	130.5	166.3	-78.7	-86.5	0	0	0	109.1	I35	I35-Y37 HydrophobicContact CB-CE2 4.45Å; I35-Y37 HydrophobicContact CG2-CD2 4.48Å; I35-Y37 HydrophobicContact CG2-CE2 4.16Å; I35-Y37 PolarHBondContact O-N 3.27Å
38	E	26.3	Very low	31.3	Very low	176 Å²	176	147.9 Å²	147.9	82%	0.822	76%	0.761	S	S	*	*			trans	-61.7	141.1	169.5	-78.5	-179.2	152.7	0	0	109.9	E40	E38-E40 VanDerWaalsContact C-N 3.25Å; E38-E40 PolarHBondContact O-N 3.25Å
39	K	27.5	Very low	32.8	Very low	201 Å²	201	147.4 Å²	147.4	87%	0.874	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	7.7	-164.2	-124.4	177.3	-177.5	179.3	0	114.3
40	E	31	Very low	34.2	Very low	190 Å²	190	140.8 Å²	140.8	89%	0.888	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.8	-7.1	-172.3	-74.4	-175.3	163.5	0	0	114.8	E38	E38-E40 VanDerWaalsContact C-N 3.25Å; E38-E40 PolarHBondContact O-N 3.25Å
41	E	30.8	Very low	35.3	Very low	186 Å²	186	135.3 Å²	135.3	87%	0.869	66%	0.661	S	S	*	*	S	Bend	trans	-100.7	2.2	172.9	-73.7	-172.8	155.5	0	0	114	E43	E41-E43 VanDerWaalsContact C-N 3.34Å; E41-E43 PolarHBondContact O-N 2.92Å
42	L	30.7	Very low	36.3	Very low	155 Å²	155	129.6 Å²	129.6	81%	0.812	63%	0.626	S	S	*	*			trans	-93.7	27.3	-175.3	-137.8	91.3	0	0	0	114.7
43	E	28.5	Very low	36.8	Very low	191 Å²	191	128.7 Å²	128.7	89%	0.893	61%	0.613	S	S	*	*			trans	-110.1	41	162.1	-78.2	-172	160.1	0	0	110.6	E41	E41-E43 VanDerWaalsContact C-N 3.34Å; E41-E43 PolarHBondContact O-N 2.92Å
44	G	30.8	Very low	37.5	Very low	61 Å²	61	122.1 Å²	122.1	63%	0.629	58%	0.578	S	S	*	*			trans	-83.9	120.3	168.8	0	0	0	0	0	111	R46	G44-R46 PolarHBondContact O-N 3.49Å
45	H	35.9	Very low	37.8	Very low	157 Å²	157	115.9 Å²	115.9	73%	0.727	55%	0.546	S	S	*	.			trans	-41.3	131.9	175.1	-67.5	-98.9	0	0	0	112.7	T47	H45-T47 VanDerWaalsContact C-N 3.35Å; H45-T47 PolarHBondContact O-N 3.16Å
46	R	41.8	Very low	38.2	Very low	246 Å²	246	110.2 Å²	110.2	93%	0.928	52%	0.517	S	S	*	.			trans	-63.3	93.5	169.1	-73.4	-179.5	173.6	177	-2.4	109.1	G44	G44-R46 PolarHBondContact O-N 3.49Å
47	T	50.1	Low	38.5	Very low	50 Å²	50	103 Å²	103	31%	0.307	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-81.8	120.3	179.3	50.7	0	0	0	0	110.3	H45 Y49	H45-T47 VanDerWaalsContact C-N 3.35Å; H45-T47 PolarHBondContact O-N 3.16Å; T47-Y49 PolarHBondContact OG1-OH 3.38Å
48	L	50	Low	38.7	Very low	73 Å²	73	102.9 Å²	102.9	38%	0.382	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-79.7	130.8	168.8	-73.9	159.2	0	0	0	108.5	L163 V395 P398	L48-L163 HydrophobicContact CB-CB 4.11Å; L48-L163 VanDerWaalsContact O-CB 3.29Å; L48-L163 WeakPolarHBondContact O-CB 3.46Å; L48-L163 PolarHBondContact O-N 3.07Å; L48-V395 HydrophobicContact CD2-CG1 4.06Å; L48-P398 HydrophobicContact CD2-CB 4.44Å; L48-P398 HydrophobicContact CD2-CG 3.81Å
49	Y	56.6	Low	38.7	Very low	56 Å²	56	99.5 Å²	99.5	22%	0.22	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	142.4	176.1	-65.6	-81.8	0	0	0	110.2	T47 L161 L396 P403	T47-Y49 PolarHBondContact OG1-OH 3.38Å; Y49-L161 CarbonylContact C-O 3.56Å; Y49-L161 WeakPolarHBondContact CA-O 3.42Å; Y49-L396 PolarHBondContact O-N 3.36Å; Y49-P403 HydrophobicContact CE1-CB 4.4Å; Y49-P403 HydrophobicContact CE1-CG 4.24Å; Y49-P403 HydrophobicContact CE2-CG 3.88Å; Y49-P403 WeakPolarHBondContact OH-CG 3.48Å
50	V	59.6	Low	38.6	Very low	4 Å²	4	95.6 Å²	95.6	2%	0.024	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	118	-177.6	-130.6	0	0	0	0	108.1	L161 L163 L166 V393 T394 V395	V50-L161 PolarHBondContact N-O 3.48Å; V50-L161 PolarHBondContact O-N 2.91Å; V50-L163 HydrophobicContact CG2-CB 3.56Å; V50-L163 HydrophobicContact CG2-CD1 4.02Å; V50-L163 HydrophobicContact CG2-CG 4.23Å; V50-L166 HydrophobicContact CG2-CD1 4.22Å; V50-V393 HydrophobicContact CB-CB 4.23Å; V50-V393 HydrophobicContact CB-CG1 3.51Å; V50-V393 HydrophobicContact CG1-CB 3.41Å; V50-V393 VanDerWaalsContact CG1-CB 3.41Å; V50-V393 HydrophobicContact CG1-CG1 3.17Å; V50-V393 HydrophobicContact CG1-CG2 4.47Å; V50-T394 CarbonylContact C-O 3.59Å; V50-T394 WeakPolarHBondContact CA-O 3.43Å; V50-V395 HydrophobicContact CG1-CG2 4.13Å
51	G	51.8	Low	38.4	Very low	6 Å²	6	92.9 Å²	92.9	6%	0.062	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	122.4	175.4	0	0	0	0	0	110.5	R53 V393 T394	G51-R53 PolarHBondContact O-N 2.84Å; G51-V393 WeakPolarHBondContact O-CG1 3.46Å; G51-T394 PolarHBondContact N-O 3.48Å; G51-T394 PolarHBondContact O-N 3.49Å; G51-T394 PolarHBondContact O-OG1 3.48Å; G51-T394 VanDerWaalsContact O-OG1 3.08Å
52	V	47	Very low	38.2	Very low	11 Å²	11	95.3 Å²	95.3	7%	0.067	46%	0.461	C	S	.	.			trans	-76	127	-178	179.8	0	0	0	0	110.8	M54 A159 L161 T362 F389 V393	V52-M54 PolarHBondContact O-N 3.2Å; V52-A159 PolarHBondContact N-O 2.8Å; V52-L161 HydrophobicContact CG2-CD1 3.61Å; V52-L161 HydrophobicContact CG2-CG 3.86Å; V52-T362 HydrophobicContact CB-CG2 4.18Å; V52-T362 HydrophobicContact CG1-CG2 3.99Å; V52-T362 HydrophobicContact CG2-CG2 3.73Å; V52-F389 HydrophobicContact CG1-CE2 3.99Å; V52-F389 HydrophobicContact CG1-CZ 3.85Å; V52-F389 HydrophobicContact CG2-CZ 3.97Å; V52-V393 HydrophobicContact CG2-CG1 4.49Å
53	R	39.4	Very low	38.1	Very low	131 Å²	131	96.8 Å²	96.8	49%	0.494	46%	0.463	S	S	.	.			trans	-78.9	103.5	177.6	-174.1	177.9	-177.4	175.8	5.6	109.6	G51	G51-R53 PolarHBondContact O-N 2.84Å
54	M	42	Very low	38	Very low	18 Å²	18	96.2 Å²	96.2	9%	0.089	46%	0.461	C	S	.	.			trans	-63.4	149.2	-171.4	-78.3	-175.5	153.8	0	0	116.1	V52 L56 K141 F142 V158 V413	V52-M54 PolarHBondContact O-N 3.2Å; M54-L56 WeakPolarHBondContact O-CD2 3.33Å; M54-L56 VanDerWaalsContact O-CG 3.25Å; M54-L56 WeakPolarHBondContact O-CG 3.46Å; M54-K141 WeakPolarHBondContact CE-O 3.46Å; M54-F142 HydrophobicContact CE-CB 4.15Å; M54-F142 HydrophobicContact CE-CD1 3.22Å; M54-F142 HydrophobicContact CE-CE1 3.79Å; M54-F142 HydrophobicContact CE-CG 3.92Å; M54-F142 HydrophobicContact SD-CD1 3.11Å; M54-F142 WeakPolarHBondContact SD-CD1 3.48Å; M54-F142 HydrophobicContact SD-CE1 2.95Å; M54-F142 WeakPolarHBondContact SD-CE1 3.29Å; M54-F142 HydrophobicContact SD-CG 4.18Å; M54-F142 HydrophobicContact SD-CZ 3.96Å; M54-V158 HydrophobicContact CE-CB 4.1Å; M54-V158 HydrophobicContact CE-CG1 3.97Å; M54-V158 HydrophobicContact CE-CG2 4.23Å; M54-V158 HydrophobicContact CG-CG1 4.21Å; M54-V158 HydrophobicContact SD-CB 4.19Å; M54-V158 HydrophobicContact SD-CG1 3.97Å; M54-V158 HydrophobicContact SD-CG2 3.75Å; M54-V413 HydrophobicContact CB-CG1 3.89Å; M54-V413 VanDerWaalsContact O-CG1 3.28Å; M54-V413 WeakPolarHBondContact O-CG1 3.39Å
55	P	33.5	Very low	37.8	Very low	19 Å²	19	105.2 Å²	105.2	12%	0.123	48%	0.475	C	S	.	.			trans	-67.5	138	-176.7	26	-34.9	0	0	0	112.7	G57 E367 V413	P55-G57 PolarHBondContact O-N 3.38Å; P55-E367 HydrophobicContact CB-CG 3.85Å; P55-V413 WeakPolarHBondContact O-CB 3.28Å; P55-V413 WeakPolarHBondContact O-CG1 3.47Å
56	L	36.9	Very low	37.3	Very low	7 Å²	7	104.1 Å²	104.1	4%	0.037	48%	0.48	C	S	.	.			trans	-108.2	77	-150.4	-53.1	152.6	0	0	0	111.2	M54 V413 P414 S415 Q416	M54-L56 WeakPolarHBondContact O-CD2 3.33Å; M54-L56 VanDerWaalsContact O-CG 3.25Å; M54-L56 WeakPolarHBondContact O-CG 3.46Å; L56-V413 CarbonylContact C-O 3.49Å; L56-V413 VanDerWaalsContact C-O 3.3Å; L56-V413 WeakPolarHBondContact CA-O 3.34Å; L56-V413 HydrophobicContact CB-CG1 4.35Å; L56-V413 VanDerWaalsContact CD2-C 3.49Å; L56-V413 HydrophobicContact CD2-CB 4.28Å; L56-V413 HydrophobicContact CD2-CG1 3.63Å; L56-V413 HydrophobicContact CG-CG1 4.22Å; L56-P414 WeakPolarHBondContact CB-O 3.36Å; L56-P414 WeakPolarHBondContact CD1-O 3.43Å; L56-P414 HydrophobicContact CD2-CB 4.12Å; L56-P414 HydrophobicContact CD2-CG 3.51Å; L56-P414 VanDerWaalsContact CD2-O 3.26Å; L56-P414 WeakPolarHBondContact CD2-O 3.44Å; L56-P414 VanDerWaalsContact CG-C 3.48Å; L56-P414 WeakPolarHBondContact CG-O 3.22Å; L56-S415 VanDerWaalsContact CB-CA 3.44Å; L56-S415 WeakPolarHBondContact O-CA 3.24Å; L56-S415 PolarHBondContact O-N 3.47Å; L56-Q416 HydrophobicContact CB-CG 4.17Å; L56-Q416 HydrophobicContact CD1-CB 4.24Å; L56-Q416 HydrophobicContact CD1-CG 3.23Å; L56-Q416 HydrophobicContact CG-CG 3.84Å
57	G	29.4	Very low	36.7	Very low	34 Å²	34	101.8 Å²	101.8	35%	0.351	48%	0.479	S	S	.	.			trans	-62.4	139.9	-161.4	0	0	0	0	0	117.5	P55	P55-G57 PolarHBondContact O-N 3.38Å
58	R	32.4	Very low	35.6	Very low	189 Å²	189	102.7 Å²	102.7	71%	0.713	50%	0.499	S	S	*	.			trans	-134.5	154.4	150.1	-148.9	-164.3	168.6	-171.7	-5.3	112.9
59	Q	26.9	Very low	34.7	Very low	105 Å²	105	108.2 Å²	108.2	49%	0.491	52%	0.523	S	S	.	.			trans	-41.3	131.7	176.1	-63.9	165.9	-40.4	0	0	117.1	H61	Q59-H61 PolarHBondContact O-N 3.41Å; Q59-H61 VanDerWaalsContact O-N 3.17Å
60	S	24.5	Very low	33.4	Very low	118 Å²	118	115 Å²	115	83%	0.825	55%	0.554	S	S	*	*			trans	-52.8	111.1	159.6	179.5	0	0	0	0	111.1
61	H	27.9	Very low	31.9	Very low	133 Å²	133	123.9 Å²	123.9	62%	0.616	59%	0.594	S	S	*	*			trans	-101	114.5	157.9	-84.3	-74.8	0	0	0	107.5	Q59 H63	Q59-H61 PolarHBondContact O-N 3.41Å; Q59-H61 VanDerWaalsContact O-N 3.17Å; H61-H63 PolarHBondContact O-N 3.39Å; H61-H63 VanDerWaalsContact O-N 3.15Å
62	R	27.1	Very low	30.9	Very low	237 Å²	237	135.1 Å²	135.1	89%	0.894	64%	0.635	S	S	*	*			trans	-49.6	118.6	166.1	-87.7	178.3	170.5	170.9	-3.1	109.3	H64	R62-H64 PolarHBondContact O-N 3.16Å; R62-H64 VanDerWaalsContact O-N 3.15Å
63	H	27.8	Very low	30	Very low	186 Å²	186	146.8 Å²	146.8	86%	0.861	68%	0.678	S	S	*	*			trans	-62.8	112.7	165.9	-85.1	-82	0	0	0	109.3	H61 R65	H61-H63 PolarHBondContact O-N 3.39Å; H61-H63 VanDerWaalsContact O-N 3.15Å; H63-R65 PolarHBondContact O-N 3.37Å
64	H	27.1	Very low	29.5	Very low	180 Å²	180	152.4 Å²	152.4	83%	0.833	70%	0.699	S	S	*	*			trans	-70.5	117.1	156.6	-101.1	-63.5	0	0	0	107.5	R62 T66	R62-H64 PolarHBondContact O-N 3.16Å; R62-H64 VanDerWaalsContact O-N 3.15Å; H64-T66 PolarHBondContact O-N 2.85Å; H64-T66 VanDerWaalsContact O-N 3.09Å
65	R	25.9	Very low	29	Very low	249 Å²	249	154.9 Å²	154.9	94%	0.94	73%	0.729	S	S	*	*			trans	-55	110.4	168.2	-79.2	179.5	168.5	171.1	-4.1	109.4	H63	H63-R65 PolarHBondContact O-N 3.37Å
66	T	25.1	Very low	28.9	Very low	135 Å²	135	166.4 Å²	166.4	83%	0.828	77%	0.77	S	S	*	*			trans	-90.1	127.9	160.8	29.3	0	0	0	0	109.2	H64 G68	H64-T66 PolarHBondContact O-N 2.85Å; H64-T66 VanDerWaalsContact O-N 3.09Å; T66-G68 PolarHBondContact O-N 3.45Å
67	H	29	Very low	28.4	Very low	196 Å²	196	169.5 Å²	169.5	91%	0.907	80%	0.803	S	S	*	*			trans	-63.4	112.4	-176.7	-151.1	-76.6	0	0	0	110.4	Q69	H67-Q69 PolarHBondContact O-N 3.06Å
68	G	27.7	Very low	28.4	Very low	70 Å²	70	178.5 Å²	178.5	72%	0.722	83%	0.833	S	S	*	*			trans	-79.2	115.9	178.3	0	0	0	0	0	112.4	T66	T66-G68 PolarHBondContact O-N 3.45Å
69	Q	30.1	Very low	28.1	Very low	189 Å²	189	173.1 Å²	173.1	88%	0.883	84%	0.837	S	S	*	*			trans	-78.9	121.9	171.1	-130.6	173.9	-11.1	0	0	109.5	H67 H71	H67-Q69 PolarHBondContact O-N 3.06Å; Q69-H71 PolarHBondContact O-N 3.07Å
70	K	29.2	Very low	28.2	Very low	199 Å²	199	173.3 Å²	173.3	87%	0.865	86%	0.856	S	S	*	*			trans	-61.3	126.4	176.8	-78.2	172.7	172.6	171.2	0	111.7
71	H	29.9	Very low	28.4	Very low	189 Å²	189	173.6 Å²	173.6	88%	0.875	86%	0.858	S	S	*	*			trans	-121.9	106.8	152.5	-97	-61.5	0	0	0	111.2	Q69	Q69-H71 PolarHBondContact O-N 3.07Å
72	R	29.1	Very low	28.4	Very low	242 Å²	242	177 Å²	177	91%	0.913	87%	0.874	S	S	*	*	P	Polyproline II helix	trans	-62.7	126.4	166.5	-82	175	162.1	167	-5.7	109.8
73	R	29.6	Very low	28.3	Very low	257 Å²	257	169.3 Å²	169.3	97%	0.97	87%	0.868	S	S	*	*	P	Polyproline II helix	trans	-96.3	128.9	156.3	-111	-177.1	178.2	-176.1	0.3	109.7
74	R	28.9	Very low	28.7	Very low	249 Å²	249	169.9 Å²	169.9	94%	0.94	87%	0.872	S	S	*	*	P	Polyproline II helix	trans	-95.5	129.1	-169.7	-157.3	179.8	-168.8	-179.2	2.6	108.3
75	G	31.5	Very low	28.7	Very low	70 Å²	70	170.8 Å²	170.8	72%	0.722	88%	0.876	S	S	*	*	P	Polyproline II helix	trans	-86.2	149	174.7	0	0	0	0	0	114
76	R	30	Very low	28.9	Very low	260 Å²	260	162 Å²	162	98%	0.981	86%	0.862	S	S	*	*			trans	160.1	134.3	153.2	-102.6	-179.2	166	179.9	-3.6	107.5
77	G	27.2	Very low	29.1	Very low	72 Å²	72	164.3 Å²	164.3	74%	0.742	87%	0.869	S	S	*	*			cis	153.4	142	4.6	0	0	0	0	0	109.3
78	K	29.7	Very low	29.1	Very low	223 Å²	223	163.6 Å²	163.6	97%	0.97	87%	0.866	S	S	*	*			trans	142.5	132.1	164.4	-88.4	177.1	175.6	-175.7	0	107.8
79	G	26.2	Very low	29.1	Very low	77 Å²	77	165.1 Å²	165.1	79%	0.794	87%	0.872	S	S	*	*			cis	148.4	100	8.5	0	0	0	0	0	108.2
80	A	29.4	Very low	29.2	Very low	108 Å²	108	164.6 Å²	164.6	89%	0.893	87%	0.874	S	S	*	*			trans	34.2	125.8	159	0	0	0	0	0	123.4
81	S	27.2	Very low	29.4	Very low	124 Å²	124	158.7 Å²	158.7	87%	0.867	86%	0.863	S	S	*	*				-160.2	137.1	128.5	53.6	0	0	0	0	110.9
82	Q	29	Very low	29.7	Very low	205 Å²	205	158.3 Å²	158.3	96%	0.958	86%	0.861	S	S	*	*			trans	-65.9	154.5	-174.6	-68.1	166.6	-23	0	0	114.2
83	G	24.9	Very low	30.8	Very low	75 Å²	75	152.9 Å²	152.9	77%	0.773	85%	0.85	S	S	*	*			trans	175.8	102.6	163.3	0	0	0	0	0	109.5	E85	G83-E85 PolarHBondContact O-N 3.49Å
84	E	36.5	Very low	32.8	Very low	199 Å²	199	143.5 Å²	143.5	93%	0.93	82%	0.822	S	S	*	*			trans	-57.8	119.2	167.7	-70.7	173.1	138.3	0	0	109.4
85	E	26.4	Very low	34.7	Very low	199 Å²	199	134 Å²	134	93%	0.93	79%	0.792	S	S	*	*			trans	-165.5	129.4	160.8	-109.1	169.8	-151.6	0	0	108.5	G83	G83-E85 PolarHBondContact O-N 3.49Å
86	G	29.7	Very low	36.5	Very low	63 Å²	63	132.2 Å²	132.2	65%	0.649	77%	0.768	S	S	*	*			trans	108.8	49.2	158.2	0	0	0	0	0	117.9	E88	G86-E88 PolarHBondContact O-N 3.21Å
87	L	30.6	Very low	38.6	Very low	185 Å²	185	124.3 Å²	124.3	97%	0.969	74%	0.743	S	S	*	*	S	Bend	trans	-65.5	64.7	150.5	-169.3	83.4	0	0	0	109.1
88	E	28	Very low	40.9	Very low	180 Å²	180	124.5 Å²	124.5	84%	0.841	72%	0.721	S	S	*	*			trans	-157.4	24	-172	-115.5	174.4	-150	0	0	114.6	G86	G86-E88 PolarHBondContact O-N 3.21Å
89	A	27.7	Very low	43.2	Very low	103 Å²	103	114 Å²	114	85%	0.851	68%	0.676	S	S	*	*	S	Bend	trans	-105.8	17.1	178.9	0	0	0	0	0	114.8
90	L	32.9	Very low	45.6	Very low	177 Å²	177	112.5 Å²	112.5	93%	0.927	65%	0.648	S	S	*	*	S	Bend	trans	-116.6	11	-173.2	-132	119.3	0	0	0	114.8
91	A	33.7	Very low	47.9	Very low	76 Å²	76	114.5 Å²	114.5	63%	0.628	64%	0.637	S	S	*	*	S	Bend	trans	-102.5	-14.4	-162.9	0	0	0	0	0	117.2
92	H	36.6	Very low	50.4	Low	180 Å²	180	109.3 Å²	109.3	83%	0.833	60%	0.599	S	S	*	*			trans	-149.1	70.6	-179.5	-68.9	-58.5	0	0	0	113.7
93	D	50.4	Low	52.6	Low	128 Å²	128	100.5 Å²	100.5	68%	0.684	56%	0.559	S	S	*	*			trans	-90.7	125.3	155.8	-78.5	-20.1	0	0	0	108
94	T	71.6	Confident	54.4	Low	61 Å²	61	99.8 Å²	99.8	37%	0.374	55%	0.551	S	S	.	*			trans	-65.8	148.4	170.2	59.9	0	0	0	0	109.3	S96 Q97 R98	T94-S96 PolarHBondContact O-N 3.35Å; T94-S96 VanDerWaalsContact O-N 3.1Å; T94-S96 PolarHBondContact OG1-OG 3.08Å; T94-Q97 WeakPolarHBondContact O-CB 3.4Å; T94-Q97 PolarHBondContact O-N 2.85Å; T94-Q97 VanDerWaalsContact OG1-CD 3.24Å; T94-Q97 WeakPolarHBondContact OG1-CG 3.3Å; T94-Q97 PolarHBondContact OG1-N 3.4Å; T94-Q97 PolarHBondContact OG1-OE1 3.44Å; T94-R98 PolarHBondContact O-N 2.9Å; T94-R98 VanDerWaalsContact O-N 3.07Å
95	P	69.6	Low	55.7	Low	50 Å²	50	93.2 Å²	93.2	33%	0.325	53%	0.525	S	S	.	.	H	α-helix	trans	-50.3	-39.4	177.8	-28.3	34.8	0	0	0	112.7	Q97 R98 V99 D387	P95-Q97 PolarHBondContact O-N 3.01Å; P95-R98 PolarHBondContact O-N 3.27Å; P95-V99 WeakPolarHBondContact O-CG2 3.31Å; P95-V99 PolarHBondContact O-N 3.29Å; P95-D387 HydrophobicContact CB-CB 4.05Å; P95-D387 HydrophobicContact CG-CB 4.27Å
96	S	70	Confident	56.9	Low	31 Å²	31	92.4 Å²	92.4	22%	0.217	52%	0.521	C	S	.	.	H	α-helix	trans	-59.7	-39.4	174.2	54.1	0	0	0	0	114.7	T94 Q100 E388	T94-S96 PolarHBondContact O-N 3.35Å; T94-S96 VanDerWaalsContact O-N 3.1Å; T94-S96 PolarHBondContact OG1-OG 3.08Å; S96-Q100 WeakPolarHBondContact O-CB 3.33Å; S96-Q100 VanDerWaalsContact O-CG 3.24Å; S96-Q100 WeakPolarHBondContact O-CG 3.39Å; S96-Q100 PolarHBondContact O-N 3.15Å; S96-E388 WeakPolarHBondContact CA-OE2 3.48Å; S96-E388 WeakPolarHBondContact CB-OE2 3.48Å
97	Q	73.2	Confident	58	Low	95 Å²	95	98.3 Å²	98.3	44%	0.444	53%	0.532	S	S	.	.	H	α-helix	trans	-72	-39.6	176.7	-75.3	167.9	-9	0	0	111.2	T94 P95 Q100 F101	T94-Q97 WeakPolarHBondContact O-CB 3.4Å; T94-Q97 PolarHBondContact O-N 2.85Å; T94-Q97 VanDerWaalsContact OG1-CD 3.24Å; T94-Q97 WeakPolarHBondContact OG1-CG 3.3Å; T94-Q97 PolarHBondContact OG1-N 3.4Å; T94-Q97 PolarHBondContact OG1-OE1 3.44Å; P95-Q97 PolarHBondContact O-N 3.01Å; Q97-Q100 PolarHBondContact O-N 3.17Å; Q97-F101 WeakPolarHBondContact O-CB 3.46Å; Q97-F101 PolarHBondContact O-N 2.91Å
98	R	75.4	Confident	59.3	Low	75 Å²	75	94 Å²	94	28%	0.283	51%	0.51	S	S	.	.	H	α-helix	trans	-62.2	-44.7	174.6	-174.4	173.7	177.2	156.9	3.8	111.4	T94 P95 F101 I102 E378 D380 D381 A384	T94-R98 PolarHBondContact O-N 2.9Å; T94-R98 VanDerWaalsContact O-N 3.07Å; P95-R98 PolarHBondContact O-N 3.27Å; R98-F101 WeakPolarHBondContact O-CB 3.48Å; R98-F101 PolarHBondContact O-N 3.47Å; R98-I102 HydrophobicContact CG-CD1 4.23Å; R98-I102 WeakPolarHBondContact O-CD1 3.2Å; R98-I102 VanDerWaalsContact O-CG1 3.29Å; R98-I102 WeakPolarHBondContact O-CG1 3.48Å; R98-I102 PolarHBondContact O-N 2.91Å; R98-E378 IonicContact NH2-OE2 2.72Å; R98-D380 VanDerWaalsContact NH2-CB 3.32Å; R98-D381 IonicContact CZ-OD1 3.85Å; R98-D381 IonicContact NE-OD1 3.39Å; R98-D381 PolarHBondContact NE-OD1 3.44Å; R98-D381 IonicContact NH2-OD1 2.72Å; R98-D381 PolarHBondContact NH2-OD1 3.05Å; R98-A384 HydrophobicContact CG-CB 4.44Å
99	V	78.6	Confident	60.7	Low	3 Å²	3	94.6 Å²	94.6	2%	0.018	51%	0.512	C	S	.	.	H	α-helix	trans	-62	-44	174.9	169.4	0	0	0	0	111.5	P95 F101 I102 L103 I368 V372 A384 E388	P95-V99 WeakPolarHBondContact O-CG2 3.31Å; P95-V99 PolarHBondContact O-N 3.29Å; V99-F101 VanDerWaalsContact C-N 3.32Å; V99-F101 PolarHBondContact O-N 3.42Å; V99-I102 PolarHBondContact O-N 3.16Å; V99-L103 HydrophobicContact CG1-CD1 3.95Å; V99-L103 HydrophobicContact CG1-CG 4.43Å; V99-L103 VanDerWaalsContact O-CG 3.3Å; V99-L103 WeakPolarHBondContact O-CG 3.47Å; V99-L103 PolarHBondContact O-N 3.11Å; V99-I368 HydrophobicContact CG1-CG2 3.72Å; V99-V372 HydrophobicContact CG1-CG2 3.77Å; V99-V372 HydrophobicContact CG2-CG2 4.42Å; V99-A384 HydrophobicContact CG2-CB 4.13Å; V99-E388 HydrophobicContact CG1-CG 4.46Å; V99-E388 HydrophobicContact CG2-CB 4.1Å
100	Q	77	Confident	62.1	Low	46 Å²	46	95.6 Å²	95.6	22%	0.215	50%	0.499	C	S	.	.	H	α-helix	trans	-62.2	-38.4	175.9	-75.7	171.2	30.4	0	0	112.6	S96 Q97 L103 G104	S96-Q100 WeakPolarHBondContact O-CB 3.33Å; S96-Q100 VanDerWaalsContact O-CG 3.24Å; S96-Q100 WeakPolarHBondContact O-CG 3.39Å; S96-Q100 PolarHBondContact O-N 3.15Å; Q97-Q100 PolarHBondContact O-N 3.17Å; Q100-L103 PolarHBondContact O-N 2.89Å; Q100-G104 PolarHBondContact O-N 3.21Å
101	F	77.9	Confident	63.8	Low	150 Å²	150	88.7 Å²	88.7	66%	0.658	46%	0.462	S	S	*	.	H	α-helix	trans	-62.7	-47.2	174.8	177.6	-98.1	0	0	0	111.4	Q97 R98 V99 L103 G104 T105	Q97-F101 WeakPolarHBondContact O-CB 3.46Å; Q97-F101 PolarHBondContact O-N 2.91Å; R98-F101 WeakPolarHBondContact O-CB 3.48Å; R98-F101 PolarHBondContact O-N 3.47Å; V99-F101 VanDerWaalsContact C-N 3.32Å; V99-F101 PolarHBondContact O-N 3.42Å; F101-L103 VanDerWaalsContact C-N 3.32Å; F101-L103 PolarHBondContact O-N 3.07Å; F101-G104 PolarHBondContact O-N 3.44Å; F101-G104 VanDerWaalsContact O-N 3.13Å; F101-T105 HydrophobicContact CE1-CG2 4.29Å; F101-T105 HydrophobicContact CZ-CG2 4.35Å; F101-T105 PolarHBondContact O-N 3.35Å
102	I	78.4	Confident	65.8	Low	14 Å²	14	88.7 Å²	88.7	7%	0.072	45%	0.454	C	S	.	.	H	α-helix	trans	-57.7	-46.9	176.5	-66.2	160.4	0	0	0	110.3	R98 V99 G104 T105 K375 D381	R98-I102 HydrophobicContact CG-CD1 4.23Å; R98-I102 WeakPolarHBondContact O-CD1 3.2Å; R98-I102 VanDerWaalsContact O-CG1 3.29Å; R98-I102 WeakPolarHBondContact O-CG1 3.48Å; R98-I102 PolarHBondContact O-N 2.91Å; V99-I102 PolarHBondContact O-N 3.16Å; I102-G104 VanDerWaalsContact C-N 3.3Å; I102-G104 PolarHBondContact O-N 2.88Å; I102-T105 PolarHBondContact O-N 3.26Å; I102-T105 PolarHBondContact O-OG1 3.21Å; I102-K375 HydrophobicContact CG2-CB 3.64Å; I102-K375 HydrophobicContact CG2-CD 4.32Å; I102-K375 WeakPolarHBondContact O-CD 3.38Å; I102-D381 HydrophobicContact CD1-CB 3.77Å
103	L	74.9	Confident	67.6	Low	21 Å²	21	82.9 Å²	82.9	11%	0.11	43%	0.432	C	S	.	.	H	α-helix	trans	-65.8	-31.5	178.9	-66.8	172.9	0	0	0	113	V99 Q100 F101 I368 D371 V372 K375 K420	V99-L103 HydrophobicContact CG1-CD1 3.95Å; V99-L103 HydrophobicContact CG1-CG 4.43Å; V99-L103 VanDerWaalsContact O-CG 3.3Å; V99-L103 WeakPolarHBondContact O-CG 3.47Å; V99-L103 PolarHBondContact O-N 3.11Å; Q100-L103 PolarHBondContact O-N 2.89Å; F101-L103 VanDerWaalsContact C-N 3.32Å; F101-L103 PolarHBondContact O-N 3.07Å; L103-I368 HydrophobicContact CD1-CG2 4.38Å; L103-D371 HydrophobicContact CD2-CB 3.49Å; L103-D371 VanDerWaalsContact CD2-CB 3.49Å; L103-V372 HydrophobicContact CD2-CG2 4.49Å; L103-K375 PolarHBondContact O-NZ 2.95Å; L103-K420 HydrophobicContact CD1-CG 4.28Å
104	G	62.8	Low	69.1	Low	60 Å²	60	80.2 Å²	80.2	62%	0.619	42%	0.416	S	S	*	.	H	α-helix	trans	-83.6	-8.4	-177.7	0	0	0	0	0	116.4	Q100 F101 I102	Q100-G104 PolarHBondContact O-N 3.21Å; F101-G104 PolarHBondContact O-N 3.44Å; F101-G104 VanDerWaalsContact O-N 3.13Å; I102-G104 VanDerWaalsContact C-N 3.3Å; I102-G104 PolarHBondContact O-N 2.88Å
105	T	63.9	Low	69.6	Low	61 Å²	61	82.2 Å²	82.2	37%	0.374	42%	0.421	S	S	.	.	S	Bend	trans	-68.9	144.9	173	52.5	0	0	0	0	111.8	F101 I102 K375	F101-T105 HydrophobicContact CE1-CG2 4.29Å; F101-T105 HydrophobicContact CZ-CG2 4.35Å; F101-T105 PolarHBondContact O-N 3.35Å; I102-T105 PolarHBondContact O-N 3.26Å; I102-T105 PolarHBondContact O-OG1 3.21Å; T105-K375 PolarHBondContact O-NZ 3.37Å
106	E	51.6	Low	70.3	Confident	182 Å²	182	80.5 Å²	80.5	85%	0.85	41%	0.409	S	S	*	.			trans	-53.3	148.1	-175.4	-66.3	-167.6	166.1	0	0	112.3	D108	E106-D108 PolarHBondContact O-N 3.24Å
107	E	53.5	Low	71.2	Confident	187 Å²	187	79.1 Å²	79.1	87%	0.874	40%	0.399	S	S	*	.			trans	-65.7	103.6	-175.9	-64.3	177.8	173.5	0	0	111.2	E109	E107-E109 PolarHBondContact O-N 2.89Å
108	D	57.4	Low	72	Confident	94 Å²	94	74.6 Å²	74.6	50%	0.503	38%	0.378	S	S	.	.			trans	-66	119.3	164.1	-74.3	-30.6	0	0	0	108.3	E106 E110 H111	E106-D108 PolarHBondContact O-N 3.24Å; D108-E110 PolarHBondContact O-N 3.47Å; D108-H111 PolarHBondContact O-N 3.32Å; D108-H111 VanDerWaalsContact O-N 3.17Å
109	E	57.2	Low	72.8	Confident	193 Å²	193	71.1 Å²	71.1	90%	0.902	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-16.2	-177.5	-71	-161.7	161.3	0	0	113.4	E107	E107-E109 PolarHBondContact O-N 2.89Å
110	E	56.8	Low	73.4	Confident	123 Å²	123	71 Å²	71	58%	0.575	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-17	-177.8	-157.3	169.5	-176.1	0	0	113.6	D108	D108-E110 PolarHBondContact O-N 3.47Å
111	H	69.5	Low	74.1	Confident	32 Å²	32	68.8 Å²	68.8	15%	0.148	35%	0.354	C	S	.	.			trans	-121.6	43.7	-173.7	-63	90.4	0	0	0	113	D108 P113 D181 Y374	D108-H111 PolarHBondContact O-N 3.32Å; D108-H111 VanDerWaalsContact O-N 3.17Å; H111-P113 WeakPolarHBondContact O-CD 3.36Å; H111-D181 IonicContact CD2-OD1 2.8Å; H111-D181 IonicContact NE2-OD1 2.89Å; H111-D181 PolarHBondContact NE2-OD1 3.02Å; H111-D181 IonicContact NE2-OD2 3.88Å; H111-Y374 PolarHBondContact CD2-O 3.44Å
112	V	74.4	Confident	74.7	Confident	77 Å²	77	64.3 Å²	64.3	47%	0.467	34%	0.335	S	S	.	.			trans	-70.6	125.3	175.8	-178.4	0	0	0	0	110	H114	V112-H114 PolarHBondContact O-CE1 2.83Å; V112-H114 PolarHBondContact O-N 2.89Å; V112-H114 PolarHBondContact O-ND1 2.87Å
113	P	75.8	Confident	75.3	Confident	57 Å²	57	64 Å²	64	37%	0.37	33%	0.333	S	S	.	.			trans	-68	128.2	179.1	24.3	-31.2	0	0	0	111.8	H111 H370 D371 Y374	H111-P113 WeakPolarHBondContact O-CD 3.36Å; P113-H370 VanDerWaalsContact CB-CE1 3.41Å; P113-H370 WeakPolarHBondContact CB-CE1 3.43Å; P113-D371 WeakPolarHBondContact CB-OD1 3.31Å; P113-Y374 HydrophobicContact CB-CD2 4.07Å; P113-Y374 HydrophobicContact CB-CE2 4.4Å; P113-Y374 HydrophobicContact CB-CG 4.45Å
114	H	81.4	Confident	75.8	Confident	73 Å²	73	65.7 Å²	65.7	34%	0.338	35%	0.346	S	S	.	.			trans	-116.3	147.3	177	-67.9	84.4	0	0	0	111	V112 L116 G297 E299 H370 Y374	V112-H114 PolarHBondContact O-CE1 2.83Å; V112-H114 PolarHBondContact O-N 2.89Å; V112-H114 PolarHBondContact O-ND1 2.87Å; H114-L116 PolarHBondContact O-N 3.12Å; H114-G297 PolarHBondContact CD2-O 3.01Å; H114-G297 VanDerWaalsContact CD2-O 3.27Å; H114-E299 HydrophobicContact CB-CG 3.99Å; H114-E299 IonicContact ND1-OE1 3.12Å; H114-H370 PolarHBondContact O-NE2 3.04Å; H114-Y374 PolarHBondContact O-OH 3.26Å
115	E	81.7	Confident	76.6	Confident	103 Å²	103	64.1 Å²	64.1	48%	0.481	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-56	129.6	177	-66.7	-169.1	-146.2	0	0	111	P295 A298 E299	E115-P295 HydrophobicContact CB-CB 4.25Å; E115-P295 HydrophobicContact CB-CG 3.89Å; E115-P295 VanDerWaalsContact CD-CG 3.43Å; E115-P295 HydrophobicContact CG-CB 4.45Å; E115-P295 HydrophobicContact CG-CG 4.2Å; E115-P295 WeakPolarHBondContact OE2-CG 3.26Å; E115-A298 CarbonylContact O-C 3.58Å; E115-A298 WeakPolarHBondContact O-CA 3.49Å; E115-A298 VanDerWaalsContact O-CB 3.3Å; E115-A298 WeakPolarHBondContact O-CB 3.35Å; E115-E299 PolarHBondContact O-N 3.19Å
116	L	83.9	Confident	77.2	Confident	14 Å²	14	66.2 Å²	66.2	7%	0.073	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	139.8	-177.3	-72	176.8	0	0	0	112.5	H114 E299 F339 M364	H114-L116 PolarHBondContact O-N 3.12Å; L116-E299 CarbonylContact C-O 3.48Å; L116-E299 VanDerWaalsContact CA-O 3.29Å; L116-E299 WeakPolarHBondContact CA-O 3.25Å; L116-E299 HydrophobicContact CD2-CB 4.05Å; L116-F339 HydrophobicContact CD1-CD2 4.02Å; L116-F339 HydrophobicContact CD1-CE2 4.02Å; L116-F339 HydrophobicContact CD2-CD2 3.88Å; L116-F339 HydrophobicContact CD2-CE2 4.02Å; L116-M364 HydrophobicContact CD1-CE 3.56Å
117	F	89.5	Confident	77.5	Confident	2 Å²	2	65.4 Å²	65.4	1%	0.009	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	116.8	161.5	175.1	-107.7	0	0	0	108.2	E119 R138 L140 F290 E299 A300 S301 I335	F117-E119 HydrophobicContact CE1-CB 4.26Å; F117-R138 HydrophobicContact CE2-CB 4.43Å; F117-R138 HydrophobicContact CZ-CB 4.4Å; F117-L140 HydrophobicContact CD2-CD1 4.33Å; F117-F290 HydrophobicContact CE2-CE1 4.17Å; F117-F290 HydrophobicContact CE2-CZ 4.06Å; F117-F290 HydrophobicContact CZ-CE1 4.33Å; F117-E299 PolarHBondContact N-O 3.45Å; F117-A300 CarbonylContact O-C 3.58Å; F117-A300 VanDerWaalsContact O-CA 3.28Å; F117-A300 WeakPolarHBondContact O-CA 3.41Å; F117-S301 PolarHBondContact O-N 2.84Å; F117-I335 HydrophobicContact CB-CD1 4.23Å; F117-I335 HydrophobicContact CD1-CD1 4.15Å; F117-I335 HydrophobicContact CG-CD1 4.27Å
118	T	89.9	Confident	77.7	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	137.6	179.7	58.7	0	0	0	0	111	R138 W139 S301 M364	T118-R138 CarbonylContact O-C 3.45Å; T118-R138 WeakPolarHBondContact O-CA 3.46Å; T118-W139 PolarHBondContact N-O 2.73Å; T118-W139 PolarHBondContact O-N 3.1Å; T118-W139 WeakPolarHBondContact OG1-CB 3.5Å; T118-W139 PolarHBondContact OG1-O 3.03Å; T118-S301 VanDerWaalsContact CA-O 3.27Å; T118-S301 WeakPolarHBondContact CA-O 3.28Å; T118-M364 HydrophobicContact CG2-CB 3.79Å
119	E	91.8	Very high	78	Confident	1 Å²	1	62.6 Å²	62.6	1%	0.005	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	133.3	-177.7	-172	172.3	178.5	0	0	108.4	F117 E135 H222 S301 V303 T331 E332	F117-E119 HydrophobicContact CE1-CB 4.26Å; E119-E135 HydrophobicContact CG-CG 4.04Å; E119-H222 IonicContact OE1-CE1 2.67Å; E119-H222 IonicContact OE1-ND1 2.81Å; E119-S301 PolarHBondContact N-O 2.78Å; E119-V303 PolarHBondContact O-N 3.15Å; E119-T331 VanDerWaalsContact OE2-CA 3.29Å; E119-T331 WeakPolarHBondContact OE2-CA 3.46Å; E119-T331 WeakPolarHBondContact OE2-CB 3.25Å; E119-T331 WeakPolarHBondContact OE2-CG2 3.47Å; E119-E332 PolarHBondContact OE1-N 3.4Å; E119-E332 PolarHBondContact OE2-N 3.15Å
120	L	92.3	Very high	78.4	Confident	0 Å²	0	61 Å²	61	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	119.4	178.1	176	67.8	0	0	0	109.5	T136 A137 W139 V303 V305 R358	L120-T136 PolarHBondContact O-N 3.1Å; L120-T136 PolarHBondContact O-OG1 3.3Å; L120-A137 HydrophobicContact CB-CB 4.33Å; L120-A137 HydrophobicContact CD2-CB 4.26Å; L120-A137 PolarHBondContact N-O 3.03Å; L120-W139 HydrophobicContact CB-CH2 3.97Å; L120-W139 HydrophobicContact CB-CZ3 3.68Å; L120-W139 HydrophobicContact CD2-CH2 4.1Å; L120-V303 WeakPolarHBondContact CA-O 3.24Å; L120-V303 HydrophobicContact CD1-CB 3.91Å; L120-V303 HydrophobicContact CD1-CG1 3.57Å; L120-V305 HydrophobicContact CD1-CB 4.39Å; L120-V305 HydrophobicContact CD1-CG2 3.76Å; L120-R358 HydrophobicContact CD2-CB 4.48Å
121	D	91.8	Very high	79.5	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	141.2	175.7	-67.2	-30	0	0	0	111.1	W133 K134 E135 H220 V303 L304 V305	D121-W133 HydrophobicContact CB-CB 4.42Å; D121-W133 HydrophobicContact CB-CE3 3.77Å; D121-W133 HydrophobicContact CB-CZ3 4.47Å; D121-K134 WeakPolarHBondContact CA-O 3.39Å; D121-E135 WeakPolarHBondContact OD1-CA 3.31Å; D121-H220 IonicContact OD2-CE1 2.59Å; D121-H220 PolarHBondContact OD2-CE1 3.25Å; D121-H220 IonicContact OD2-ND1 2.77Å; D121-H220 PolarHBondContact OD2-ND1 3.24Å; D121-V303 PolarHBondContact N-O 2.96Å; D121-L304 HydrophobicContact CB-CD2 3.78Å; D121-V305 PolarHBondContact O-N 3.5Å
122	E	90.5	Very high	80.3	Confident	55 Å²	55	57.8 Å²	57.8	26%	0.257	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	139.7	178.7	-79.8	167	-127.6	0	0	113.8	W133 K134 T136 V305 H354	E122-W133 CarbonylContact O-C 3.59Å; E122-W133 WeakPolarHBondContact O-CA 3.34Å; E122-K134 PolarHBondContact N-O 3.39Å; E122-K134 PolarHBondContact O-N 2.72Å; E122-T136 HydrophobicContact CB-CG2 3.98Å; E122-T136 VanDerWaalsContact CD-CG2 3.49Å; E122-T136 HydrophobicContact CG-CG2 4.09Å; E122-T136 WeakPolarHBondContact OE1-CB 3.47Å; E122-T136 VanDerWaalsContact OE1-CG2 3.26Å; E122-T136 WeakPolarHBondContact OE1-CG2 3.4Å; E122-T136 PolarHBondContact OE1-OG1 3.4Å; E122-V305 CarbonylContact C-O 3.3Å; E122-V305 WeakPolarHBondContact CA-O 3.45Å; E122-V305 HydrophobicContact CG-CB 4.43Å; E122-H354 IonicContact OE1-CE1 3.99Å; E122-H354 PolarHBondContact OE1-CE1 3.06Å; E122-H354 IonicContact OE1-CG 2.87Å; E122-H354 IonicContact OE1-ND1 2.75Å; E122-H354 PolarHBondContact OE1-ND1 2.81Å
123	I	90.2	Very high	81	Confident	7 Å²	7	54.1 Å²	54.1	4%	0.036	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	141.2	171.6	-166.1	166.6	0	0	0	111.2	A131 W133 K218 V305 G306 E307 L344	I123-A131 HydrophobicContact CD1-CB 4.1Å; I123-A131 HydrophobicContact CG1-CB 4.07Å; I123-W133 HydrophobicContact CB-CD2 3.74Å; I123-W133 HydrophobicContact CB-CE3 3.71Å; I123-W133 HydrophobicContact CB-CG 4.3Å; I123-W133 HydrophobicContact CB-CH2 4.18Å; I123-W133 HydrophobicContact CB-CZ2 4.21Å; I123-W133 HydrophobicContact CB-CZ3 3.94Å; I123-W133 HydrophobicContact CD1-CD2 4.26Å; I123-W133 HydrophobicContact CD1-CG 4.28Å; I123-W133 HydrophobicContact CG2-CD2 4.01Å; I123-W133 HydrophobicContact CG2-CE3 3.86Å; I123-W133 HydrophobicContact CG2-CH2 3.37Å; I123-W133 HydrophobicContact CG2-CZ2 3.54Å; I123-W133 HydrophobicContact CG2-CZ3 3.54Å; I123-K218 HydrophobicContact CD1-CB 4.07Å; I123-K218 HydrophobicContact CD1-CG 4.08Å; I123-V305 PolarHBondContact N-O 3.16Å; I123-G306 CarbonylContact O-C 3.54Å; I123-G306 WeakPolarHBondContact O-CA 3.46Å; I123-E307 PolarHBondContact O-N 2.8Å; I123-L344 HydrophobicContact CG2-CD2 4.16Å
124	C	85.5	Confident	81.6	Confident	57 Å²	57	57.7 Å²	57.7	39%	0.385	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	108.6	170.3	-175.1	0	0	0	0	107.2
125	M	79.9	Confident	81.9	Confident	28 Å²	28	54.7 Å²	54.7	14%	0.138	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	98.4	-175.8	-162.3	-172.7	-158.6	0	0	109.7	A131 A215 E307 V308 D309	M125-A131 HydrophobicContact CB-CB 4.14Å; M125-A131 HydrophobicContact CG-CB 3.96Å; M125-A215 HydrophobicContact SD-CB 4.09Å; M125-E307 PolarHBondContact N-O 2.87Å; M125-V308 HydrophobicContact SD-CG1 4.43Å; M125-D309 PolarHBondContact O-N 3.42Å
126	K	75.6	Confident	82.1	Confident	105 Å²	105	51.2 Å²	51.2	46%	0.457	28%	0.275	S	S	.	.			trans	-98.8	147.3	174.6	-66.9	-177.9	-177.6	175.7	0	111.6	G128 E129 D309	K126-G128 PolarHBondContact O-N 2.66Å; K126-E129 PolarHBondContact O-N 3.49Å; K126-D309 VanDerWaalsContact CA-OD2 3.25Å; K126-D309 WeakPolarHBondContact CA-OD2 3.3Å
127	E	58.8	Low	82.4	Confident	164 Å²	164	50.6 Å²	50.6	77%	0.766	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	109.5	178.1	-123.6	178.1	-171.1	0	0	112.1	D309	E127-D309 PolarHBondContact N-OD2 3.33Å
128	G	58.5	Low	82.4	Confident	88 Å²	88	51.4 Å²	51.4	91%	0.907	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	100	-0.3	174.8	0	0	0	0	0	116.9	K126	K126-G128 PolarHBondContact O-N 2.66Å
129	E	62.8	Low	82.4	Confident	134 Å²	134	51.5 Å²	51.5	63%	0.626	28%	0.275	S	S	*	.	S	Bend	trans	-104.5	140.9	176.1	-66.4	-174	161.5	0	0	112	K126 A131	K126-E129 PolarHBondContact O-N 3.49Å; E129-A131 PolarHBondContact O-N 3.2Å
130	D	66.2	Low	81.7	Confident	160 Å²	160	53.1 Å²	53.1	86%	0.856	28%	0.283	S	S	*	.			trans	-69.4	100.5	170.9	-84.9	-29.5	0	0	0	109.5
131	A	79.4	Confident	81	Confident	10 Å²	10	56.7 Å²	56.7	8%	0.083	30%	0.299	C	S	.	.			trans	-84	130.3	178.2	0	0	0	0	0	111.5	I123 M125 E129 K218	I123-A131 HydrophobicContact CD1-CB 4.1Å; I123-A131 HydrophobicContact CG1-CB 4.07Å; M125-A131 HydrophobicContact CB-CB 4.14Å; M125-A131 HydrophobicContact CG-CB 3.96Å; E129-A131 PolarHBondContact O-N 3.2Å; A131-K218 WeakPolarHBondContact O-CD 3.39Å
132	E	85.8	Confident	80.5	Confident	78 Å²	78	57.4 Å²	57.4	36%	0.364	30%	0.302	S	S	.	.			trans	-124.8	148.6	172.8	-63.4	-173.5	163.1	0	0	109	H221	E132-H221 HydrophobicContact CB-CB 4.47Å; E132-H221 IonicContact OE2-CG 3.21Å; E132-H221 IonicContact OE2-ND1 3.49Å; E132-H221 PolarHBondContact OE2-ND1 3.28Å; E132-H221 VanDerWaalsContact OE2-ND1 3.13Å
133	W	88.8	Confident	80.3	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	130.8	169.8	-71.7	96.4	0	0	0	109.1	D121 E122 I123 A215 L216 K219 H220 H221 L304 V305 L344	D121-W133 HydrophobicContact CB-CB 4.42Å; D121-W133 HydrophobicContact CB-CE3 3.77Å; D121-W133 HydrophobicContact CB-CZ3 4.47Å; E122-W133 CarbonylContact O-C 3.59Å; E122-W133 WeakPolarHBondContact O-CA 3.34Å; I123-W133 HydrophobicContact CB-CD2 3.74Å; I123-W133 HydrophobicContact CB-CE3 3.71Å; I123-W133 HydrophobicContact CB-CG 4.3Å; I123-W133 HydrophobicContact CB-CH2 4.18Å; I123-W133 HydrophobicContact CB-CZ2 4.21Å; I123-W133 HydrophobicContact CB-CZ3 3.94Å; I123-W133 HydrophobicContact CD1-CD2 4.26Å; I123-W133 HydrophobicContact CD1-CG 4.28Å; I123-W133 HydrophobicContact CG2-CD2 4.01Å; I123-W133 HydrophobicContact CG2-CE3 3.86Å; I123-W133 HydrophobicContact CG2-CH2 3.37Å; I123-W133 HydrophobicContact CG2-CZ2 3.54Å; I123-W133 HydrophobicContact CG2-CZ3 3.54Å; W133-A215 PolarHBondContact NE1-O 3.2Å; W133-L216 HydrophobicContact CZ2-CD2 4.38Å; W133-K219 PolarHBondContact N-O 3.38Å; W133-H220 HydrophobicContact CB-CB 4.25Å; W133-H220 AromaticContact CD1-CD2 3.84Å; W133-H220 AromaticContact CD1-CE1 3.77Å; W133-H220 AromaticContact CD1-NE2 3.47Å; W133-H220 AromaticContact CD2-CE1 3.95Å; W133-H220 AromaticContact CG-CE1 3.58Å; W133-H220 AromaticContact CG-ND1 3.89Å; W133-H220 AromaticContact CG-NE2 3.77Å; W133-H220 AromaticContact NE1-NE2 3.94Å; W133-H221 WeakPolarHBondContact O-CA 3.07Å; W133-H221 WeakPolarHBondContact O-CB 3.33Å; W133-H221 PolarHBondContact O-N 3.34Å; W133-L304 HydrophobicContact CE3-CD2 4.28Å; W133-L304 HydrophobicContact CH2-CB 3.65Å; W133-L304 HydrophobicContact CH2-CG 4.5Å; W133-L304 HydrophobicContact CZ2-CB 4.4Å; W133-L304 HydrophobicContact CZ3-CB 3.74Å; W133-L304 HydrophobicContact CZ3-CD2 4.26Å; W133-V305 VanDerWaalsContact CZ3-O 3.3Å; W133-V305 WeakPolarHBondContact CZ3-O 3.28Å; W133-L344 HydrophobicContact CH2-CD2 3.97Å; W133-L344 HydrophobicContact CZ2-CD2 4.38Å
134	K	88.3	Confident	80.2	Confident	132 Å²	132	55.5 Å²	55.5	57%	0.574	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.5	128.5	-179.7	-66	175.8	-174.8	168.3	0	109.8	D121 E122 T136	D121-K134 WeakPolarHBondContact CA-O 3.39Å; E122-K134 PolarHBondContact N-O 3.39Å; E122-K134 PolarHBondContact O-N 2.72Å; K134-T136 PolarHBondContact O-N 2.85Å
135	E	87.9	Confident	80.3	Confident	9 Å²	9	54 Å²	54	4%	0.042	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	124.2	173.5	-162.7	-170.9	172.8	0	0	109.7	E119 D121 W153	E119-E135 HydrophobicContact CG-CG 4.04Å; D121-E135 WeakPolarHBondContact OD1-CA 3.31Å; E135-W153 VanDerWaalsContact CD-CH2 3.45Å; E135-W153 HydrophobicContact CG-CH2 3.82Å; E135-W153 HydrophobicContact CG-CZ2 4.18Å; E135-W153 WeakPolarHBondContact OE1-CH2 3.43Å; E135-W153 WeakPolarHBondContact OE1-CZ2 3.44Å; E135-W153 WeakPolarHBondContact OE2-CZ2 3.44Å
136	T	87.3	Confident	80.5	Confident	31 Å²	31	54.2 Å²	54.2	19%	0.19	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	-35.8	-177.9	59.3	0	0	0	0	113.5	L120 E122 K134 V146	L120-T136 PolarHBondContact O-N 3.1Å; L120-T136 PolarHBondContact O-OG1 3.3Å; E122-T136 HydrophobicContact CB-CG2 3.98Å; E122-T136 VanDerWaalsContact CD-CG2 3.49Å; E122-T136 HydrophobicContact CG-CG2 4.09Å; E122-T136 WeakPolarHBondContact OE1-CB 3.47Å; E122-T136 VanDerWaalsContact OE1-CG2 3.26Å; E122-T136 WeakPolarHBondContact OE1-CG2 3.4Å; E122-T136 PolarHBondContact OE1-OG1 3.4Å; K134-T136 PolarHBondContact O-N 2.85Å; T136-V146 WeakPolarHBondContact O-CG2 3.18Å; T136-V146 PolarHBondContact O-N 2.98Å
137	A	89.5	Confident	80.6	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	156.3	-178.6	0	0	0	0	0	112.2	L120 W139 E144 D145	L120-A137 HydrophobicContact CB-CB 4.33Å; L120-A137 HydrophobicContact CD2-CB 4.26Å; L120-A137 PolarHBondContact N-O 3.03Å; A137-W139 HydrophobicContact CB-CH2 3.35Å; A137-W139 HydrophobicContact CB-CZ2 4.08Å; A137-W139 HydrophobicContact CB-CZ3 3.75Å; A137-E144 WeakPolarHBondContact CA-O 3.48Å; A137-D145 WeakPolarHBondContact CB-OD1 3.25Å
138	R	89.8	Confident	80.7	Confident	19 Å²	19	53 Å²	53	7%	0.072	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	155.1	176.1	68.7	-177.7	-171.5	-157.5	-10.1	112.8	F117 T118 E144 W153 E332	F117-R138 HydrophobicContact CE2-CB 4.43Å; F117-R138 HydrophobicContact CZ-CB 4.4Å; T118-R138 CarbonylContact O-C 3.45Å; T118-R138 WeakPolarHBondContact O-CA 3.46Å; R138-E144 HydrophobicContact CG-CB 4.08Å; R138-E144 IonicContact CZ-OE2 3.35Å; R138-E144 VanDerWaalsContact CZ-OE2 3.28Å; R138-E144 PolarHBondContact N-O 3.46Å; R138-E144 IonicContact NE-OE2 2.7Å; R138-E144 PolarHBondContact NE-OE2 2.9Å; R138-E144 IonicContact NH2-OE2 3.65Å; R138-E144 PolarHBondContact NH2-OE2 3.49Å; R138-E144 PolarHBondContact O-N 2.93Å; R138-W153 HydrophobicContact CG-CE3 4.46Å; R138-W153 HydrophobicContact CG-CH2 4.17Å; R138-W153 HydrophobicContact CG-CZ3 4Å; R138-E332 IonicContact NH1-OE2 2.86Å; R138-E332 PolarHBondContact NH1-OE2 3.21Å
139	W	88.9	Confident	80.7	Confident	3 Å²	3	52.2 Å²	52.2	1%	0.011	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	137.9	174.8	-45.6	-121.9	0	0	0	112.3	T118 L120 A137 E143 R358 A361 T362 T365	T118-W139 PolarHBondContact N-O 2.73Å; T118-W139 PolarHBondContact O-N 3.1Å; T118-W139 WeakPolarHBondContact OG1-CB 3.5Å; T118-W139 PolarHBondContact OG1-O 3.03Å; L120-W139 HydrophobicContact CB-CH2 3.97Å; L120-W139 HydrophobicContact CB-CZ3 3.68Å; L120-W139 HydrophobicContact CD2-CH2 4.1Å; A137-W139 HydrophobicContact CB-CH2 3.35Å; A137-W139 HydrophobicContact CB-CZ2 4.08Å; A137-W139 HydrophobicContact CB-CZ3 3.75Å; W139-E143 HydrophobicContact CZ2-CG 3.92Å; W139-E143 VanDerWaalsContact CZ2-OE1 3.29Å; W139-E143 WeakPolarHBondContact CZ2-OE1 2.96Å; W139-R358 HydrophobicContact CH2-CG 3.91Å; W139-R358 HydrophobicContact CZ2-CG 3.52Å; W139-A361 HydrophobicContact CD2-CB 3.93Å; W139-A361 HydrophobicContact CE3-CB 3.51Å; W139-A361 HydrophobicContact CH2-CB 3.6Å; W139-A361 HydrophobicContact CZ2-CB 3.95Å; W139-A361 HydrophobicContact CZ3-CB 3.36Å; W139-T362 PolarHBondContact NE1-OG1 3.48Å; W139-T365 HydrophobicContact CB-CG2 3.5Å; W139-T365 HydrophobicContact CG-CG2 3.99Å
140	L	78.9	Confident	80.6	Confident	34 Å²	34	46.7 Å²	46.7	18%	0.178	26%	0.256	C	S	.	.	S	Bend	trans	-114	-37.8	162	-170.4	68.9	0	0	0	110.9	F117 A865	F117-L140 HydrophobicContact CD2-CD1 4.33Å; L140-A865 HydrophobicContact CD2-CB 4.25Å
141	K	75.9	Confident	80.3	Confident	75 Å²	75	46.5 Å²	46.5	33%	0.326	25%	0.25	S	S	.	.	S	Bend	trans	-154.6	-35.3	173.3	-69.2	-170.2	179.8	174.5	0	111.1	M54	M54-K141 WeakPolarHBondContact CE-O 3.46Å
142	F	82.4	Confident	80.1	Confident	16 Å²	16	53.1 Å²	53.1	7%	0.07	27%	0.273	C	S	.	.	S	Bend	trans	-117.3	155.4	175.2	-57.7	-88.9	0	0	0	108	M54 P156 Y157 P409	M54-F142 HydrophobicContact CE-CB 4.15Å; M54-F142 HydrophobicContact CE-CD1 3.22Å; M54-F142 HydrophobicContact CE-CE1 3.79Å; M54-F142 HydrophobicContact CE-CG 3.92Å; M54-F142 HydrophobicContact SD-CD1 3.11Å; M54-F142 WeakPolarHBondContact SD-CD1 3.48Å; M54-F142 HydrophobicContact SD-CE1 2.95Å; M54-F142 WeakPolarHBondContact SD-CE1 3.29Å; M54-F142 HydrophobicContact SD-CG 4.18Å; M54-F142 HydrophobicContact SD-CZ 3.96Å; F142-P156 HydrophobicContact CB-CB 3.83Å; F142-Y157 WeakPolarHBondContact CB-O 3.39Å; F142-P409 HydrophobicContact CD1-CB 3.53Å; F142-P409 HydrophobicContact CD1-CG 4.5Å; F142-P409 HydrophobicContact CE1-CB 3.11Å; F142-P409 HydrophobicContact CE1-CG 4.37Å; F142-P409 HydrophobicContact CE2-CB 4.41Å; F142-P409 HydrophobicContact CG-CB 4.37Å; F142-P409 HydrophobicContact CZ-CB 3.66Å
143	E	86.6	Confident	79.8	Confident	2 Å²	2	51.3 Å²	51.3	1%	0.009	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	134.8	179.1	-178.6	170.4	-136.8	0	0	110.1	W139 D145 P156 Y157 A159 R358	W139-E143 HydrophobicContact CZ2-CG 3.92Å; W139-E143 VanDerWaalsContact CZ2-OE1 3.29Å; W139-E143 WeakPolarHBondContact CZ2-OE1 2.96Å; E143-D145 VanDerWaalsContact CG-OD1 3.24Å; E143-D145 WeakPolarHBondContact CG-OD1 3.49Å; E143-P156 WeakPolarHBondContact O-CA 3.41Å; E143-Y157 HydrophobicContact CB-CE2 4.23Å; E143-Y157 HydrophobicContact CG-CE2 4.06Å; E143-Y157 PolarHBondContact N-O 3.22Å; E143-Y157 VanDerWaalsContact N-O 3.13Å; E143-Y157 PolarHBondContact O-N 3.07Å; E143-Y157 WeakPolarHBondContact OE2-CE2 3.39Å; E143-A159 HydrophobicContact CB-CB 4.16Å; E143-A159 WeakPolarHBondContact OE2-CA 3.35Å; E143-A159 WeakPolarHBondContact OE2-CB 3.44Å; E143-R358 WeakPolarHBondContact OE1-CD 3.3Å; E143-R358 WeakPolarHBondContact OE1-CG 3.15Å; E143-R358 IonicContact OE1-NE 2.72Å
144	E	87.3	Confident	79.4	Confident	21 Å²	21	51.6 Å²	51.6	10%	0.098	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	112	168.9	-68.8	-175.7	151	0	0	109.1	A137 R138 W153 P156 P866	A137-E144 WeakPolarHBondContact CA-O 3.48Å; R138-E144 HydrophobicContact CG-CB 4.08Å; R138-E144 IonicContact CZ-OE2 3.35Å; R138-E144 VanDerWaalsContact CZ-OE2 3.28Å; R138-E144 PolarHBondContact N-O 3.46Å; R138-E144 IonicContact NE-OE2 2.7Å; R138-E144 PolarHBondContact NE-OE2 2.9Å; R138-E144 IonicContact NH2-OE2 3.65Å; R138-E144 PolarHBondContact NH2-OE2 3.49Å; R138-E144 PolarHBondContact O-N 2.93Å; E144-W153 HydrophobicContact CB-CE3 4.32Å; E144-W153 VanDerWaalsContact O-CZ3 3.25Å; E144-W153 WeakPolarHBondContact O-CZ3 3.37Å; E144-P156 HydrophobicContact CG-CB 3.87Å; E144-P866 VanDerWaalsContact OE1-CB 3.31Å; E144-P866 WeakPolarHBondContact OE1-CB 3.25Å
145	D	87.3	Confident	79	Confident	26 Å²	26	51.8 Å²	51.8	14%	0.139	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	156.5	176.9	-67.1	3.7	0	0	0	112.2	A137 E143 S154 Y157	A137-D145 WeakPolarHBondContact CB-OD1 3.25Å; E143-D145 VanDerWaalsContact CG-OD1 3.24Å; E143-D145 WeakPolarHBondContact CG-OD1 3.49Å; D145-S154 PolarHBondContact N-OG 2.68Å; D145-S154 WeakPolarHBondContact O-CB 3.34Å; D145-S154 PolarHBondContact O-N 3.33Å; D145-S154 PolarHBondContact O-OG 3.14Å; D145-Y157 PolarHBondContact OD2-OH 3.43Å
146	V	83.4	Confident	78.7	Confident	31 Å²	31	52.3 Å²	52.3	19%	0.188	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-75.4	127.9	169.6	-179.2	0	0	0	0	110	T136 W153	T136-V146 WeakPolarHBondContact O-CG2 3.18Å; T136-V146 PolarHBondContact O-N 2.98Å; V146-W153 HydrophobicContact CG2-CD2 4.38Å; V146-W153 HydrophobicContact CG2-CE3 3.87Å; V146-W153 HydrophobicContact CG2-CH2 3.65Å; V146-W153 HydrophobicContact CG2-CZ2 4.16Å; V146-W153 HydrophobicContact CG2-CZ3 3.48Å; V146-W153 VanDerWaalsContact CG2-CZ3 3.48Å
147	E	78.5	Confident	78.4	Confident	63 Å²	63	51.8 Å²	51.8	29%	0.294	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-72.2	149.2	-179.2	-65.4	-177.3	161.9	0	0	112.6	G149 G150 R152 R406	E147-G149 PolarHBondContact O-N 3.17Å; E147-G150 PolarHBondContact O-N 3.13Å; E147-R152 PolarHBondContact N-O 2.74Å; E147-R152 WeakPolarHBondContact OE2-CD 3.14Å; E147-R406 IonicContact OE1-NH1 3.68Å
148	D	61.7	Low	78.1	Confident	182 Å²	182	52.6 Å²	52.6	97%	0.973	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	100	177	-66.2	-38	0	0	0	111
149	G	58.6	Low	77.8	Confident	71 Å²	71	51.8 Å²	51.8	73%	0.732	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	138.3	-17.5	-167.5	0	0	0	0	0	113.1	E147 E151	E147-G149 PolarHBondContact O-N 3.17Å; G149-E151 VanDerWaalsContact C-N 3.31Å; G149-E151 PolarHBondContact O-N 3.08Å
150	G	59.5	Low	77.5	Confident	17 Å²	17	52.5 Å²	52.5	18%	0.175	27%	0.272	C	S	.	.	S	Bend	trans	65.9	27.6	164.7	0	0	0	0	0	114.9	E147 Q223 K226	E147-G150 PolarHBondContact O-N 3.13Å; G150-Q223 VanDerWaalsContact C-NE2 3.35Å; G150-Q223 PolarHBondContact O-NE2 2.79Å; G150-Q223 PolarHBondContact O-OE1 3.13Å; G150-K226 PolarHBondContact O-NZ 3.49Å
151	E	61.1	Low	77.8	Confident	157 Å²	157	50.9 Å²	50.9	73%	0.734	26%	0.263	S	S	*	.	S	Bend	trans	-120.5	-14.1	179.3	-69.3	-162.3	164.6	0	0	114.1	G149 Q223	G149-E151 VanDerWaalsContact C-N 3.31Å; G149-E151 PolarHBondContact O-N 3.08Å; E151-Q223 VanDerWaalsContact C-NE2 3.35Å
152	R	75.2	Confident	78.2	Confident	148 Å²	148	47.8 Å²	47.8	56%	0.558	25%	0.251	S	S	*	.			trans	-144.9	136.6	-168.6	178.3	173	179.6	-160.9	2	113.1	E147	E147-R152 PolarHBondContact N-O 2.74Å; E147-R152 WeakPolarHBondContact OE2-CD 3.14Å
153	W	79.8	Confident	78.2	Confident	40 Å²	40	49 Å²	49	15%	0.152	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-71.8	137.2	165	-68.7	107.4	0	0	0	111.9	E135 R138 E144 V146 Q223	E135-W153 VanDerWaalsContact CD-CH2 3.45Å; E135-W153 HydrophobicContact CG-CH2 3.82Å; E135-W153 HydrophobicContact CG-CZ2 4.18Å; E135-W153 WeakPolarHBondContact OE1-CH2 3.43Å; E135-W153 WeakPolarHBondContact OE1-CZ2 3.44Å; E135-W153 WeakPolarHBondContact OE2-CZ2 3.44Å; R138-W153 HydrophobicContact CG-CE3 4.46Å; R138-W153 HydrophobicContact CG-CH2 4.17Å; R138-W153 HydrophobicContact CG-CZ3 4Å; E144-W153 HydrophobicContact CB-CE3 4.32Å; E144-W153 VanDerWaalsContact O-CZ3 3.25Å; E144-W153 WeakPolarHBondContact O-CZ3 3.37Å; V146-W153 HydrophobicContact CG2-CD2 4.38Å; V146-W153 HydrophobicContact CG2-CE3 3.87Å; V146-W153 HydrophobicContact CG2-CH2 3.65Å; V146-W153 HydrophobicContact CG2-CZ2 4.16Å; V146-W153 HydrophobicContact CG2-CZ3 3.48Å; V146-W153 VanDerWaalsContact CG2-CZ3 3.48Å; W153-Q223 HydrophobicContact CZ2-CB 4.22Å
154	S	80.4	Confident	78.1	Confident	6 Å²	6	52.8 Å²	52.8	4%	0.042	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-64.3	169.2	171.4	63.5	0	0	0	0	112.4	D145 R406	D145-S154 PolarHBondContact N-OG 2.68Å; D145-S154 WeakPolarHBondContact O-CB 3.34Å; D145-S154 PolarHBondContact O-N 3.33Å; D145-S154 PolarHBondContact O-OG 3.14Å; S154-R406 VanDerWaalsContact CB-CZ 3.48Å
155	K	78.8	Confident	78.2	Confident	136 Å²	136	51.8 Å²	51.8	59%	0.591	27%	0.271	S	S	*	.	P	Polyproline II helix	trans	-73.8	145.3	166.2	-67.3	178.2	-172.5	163.8	0	108.2	Y157	K155-Y157 WeakPolarHBondContact O-CD1 3.45Å
156	P	81.3	Confident	78.1	Confident	21 Å²	21	50.6 Å²	50.6	14%	0.136	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-62.1	135.5	177.1	24	-34.3	0	0	0	112.4	F142 E143 E144 P866 G867	F142-P156 HydrophobicContact CB-CB 3.83Å; E143-P156 WeakPolarHBondContact O-CA 3.41Å; E144-P156 HydrophobicContact CG-CB 3.87Å; P156-P866 HydrophobicContact CG-CB 3.86Å; P156-P866 VanDerWaalsContact CG-O 3.28Å; P156-P866 WeakPolarHBondContact CG-O 3.11Å; P156-G867 VanDerWaalsContact CG-CA 3.42Å
157	Y	81.6	Confident	78.4	Confident	20 Å²	20	51.4 Å²	51.4	8%	0.078	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-140.2	172	179.5	57.5	-89.1	0	0	0	112.9	F142 E143 D145 K155 R406 I407	F142-Y157 WeakPolarHBondContact CB-O 3.39Å; E143-Y157 HydrophobicContact CB-CE2 4.23Å; E143-Y157 HydrophobicContact CG-CE2 4.06Å; E143-Y157 PolarHBondContact N-O 3.22Å; E143-Y157 VanDerWaalsContact N-O 3.13Å; E143-Y157 PolarHBondContact O-N 3.07Å; E143-Y157 WeakPolarHBondContact OE2-CE2 3.39Å; D145-Y157 PolarHBondContact OD2-OH 3.43Å; K155-Y157 WeakPolarHBondContact O-CD1 3.45Å; Y157-R406 HydrophobicContact CD1-CB 4.16Å; Y157-R406 HydrophobicContact CD1-CG 3.77Å; Y157-R406 HydrophobicContact CD2-CB 4.35Å; Y157-R406 HydrophobicContact CD2-CG 4.13Å; Y157-R406 HydrophobicContact CE1-CG 3.97Å; Y157-R406 HydrophobicContact CE2-CG 4.31Å; Y157-R406 HydrophobicContact CG-CB 3.9Å; Y157-R406 HydrophobicContact CG-CG 3.85Å; Y157-I407 WeakPolarHBondContact CB-O 3.31Å
158	V	82.9	Confident	78.9	Confident	16 Å²	16	50.5 Å²	50.5	10%	0.097	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-77.4	122	174.8	-173.4	0	0	0	0	110.2	M54 T160 I407	M54-V158 HydrophobicContact CE-CB 4.1Å; M54-V158 HydrophobicContact CE-CG1 3.97Å; M54-V158 HydrophobicContact CE-CG2 4.23Å; M54-V158 HydrophobicContact CG-CG1 4.21Å; M54-V158 HydrophobicContact SD-CB 4.19Å; M54-V158 HydrophobicContact SD-CG1 3.97Å; M54-V158 HydrophobicContact SD-CG2 3.75Å; V158-T160 PolarHBondContact O-N 3.04Å; V158-I407 HydrophobicContact CB-CB 4.09Å; V158-I407 HydrophobicContact CB-CG2 4.19Å; V158-I407 HydrophobicContact CG2-CB 4.35Å; V158-I407 HydrophobicContact CG2-CG2 3.99Å; V158-I407 PolarHBondContact N-O 3.23Å
159	A	82.8	Confident	80.2	Confident	2 Å²	2	41.9 Å²	41.9	2%	0.017	22%	0.215	C	C	.	.			trans	-62.7	127.7	179.1	0	0	0	0	0	112.2	V52 E143 T362	V52-A159 PolarHBondContact N-O 2.8Å; E143-A159 HydrophobicContact CB-CB 4.16Å; E143-A159 WeakPolarHBondContact OE2-CA 3.35Å; E143-A159 WeakPolarHBondContact OE2-CB 3.44Å; A159-T362 HydrophobicContact CB-CG2 3.79Å
160	T	84.3	Confident	81.7	Confident	19 Å²	19	41.2 Å²	41.2	12%	0.117	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	114.6	171.2	52.6	0	0	0	0	108.6	V158 R358 L396 I407	V158-T160 PolarHBondContact O-N 3.04Å; T160-R358 PolarHBondContact O-NH2 3.46Å; T160-L396 HydrophobicContact CG2-CD1 4.09Å; T160-I407 HydrophobicContact CG2-CD1 3.97Å
161	L	84.6	Confident	83.2	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	149.7	-177.6	-60.6	177.2	0	0	0	110.3	Y49 V50 V52 L166 T362	Y49-L161 CarbonylContact C-O 3.56Å; Y49-L161 WeakPolarHBondContact CA-O 3.42Å; V50-L161 PolarHBondContact N-O 3.48Å; V50-L161 PolarHBondContact O-N 2.91Å; V52-L161 HydrophobicContact CG2-CD1 3.61Å; V52-L161 HydrophobicContact CG2-CG 3.86Å; L161-L166 HydrophobicContact CB-CD1 4.41Å; L161-L166 HydrophobicContact CD1-CD1 4.37Å; L161-L166 HydrophobicContact CD1-CD2 4.09Å; L161-L166 HydrophobicContact CD1-CG 4.4Å; L161-T362 HydrophobicContact CD1-CG2 3.85Å; L161-T362 HydrophobicContact CD2-CG2 4.47Å; L161-T362 HydrophobicContact CG-CG2 4.32Å
162	S	84.1	Confident	84.4	Confident	10 Å²	10	36.6 Å²	36.6	7%	0.07	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	138.2	166.8	68	0	0	0	0	110	H164 S165 L166 E355	S162-H164 PolarHBondContact O-N 2.82Å; S162-S165 PolarHBondContact O-N 2.94Å; S162-S165 PolarHBondContact O-OG 3.46Å; S162-S165 VanDerWaalsContact OG-CB 3.31Å; S162-S165 WeakPolarHBondContact OG-CB 3.44Å; S162-S165 PolarHBondContact OG-N 3.02Å; S162-S165 PolarHBondContact OG-OG 2.91Å; S162-L166 PolarHBondContact O-N 2.87Å; S162-E355 PolarHBondContact OG-OE2 3.43Å
163	L	82.9	Confident	85.1	Confident	42 Å²	42	29.8 Å²	29.8	22%	0.22	15%	0.147	C	C	.	.	H	α-helix	trans	-61.1	-32.5	175.8	-173.3	127.7	0	0	0	110.8	L48 V50 L166 F167	L48-L163 HydrophobicContact CB-CB 4.11Å; L48-L163 VanDerWaalsContact O-CB 3.29Å; L48-L163 WeakPolarHBondContact O-CB 3.46Å; L48-L163 PolarHBondContact O-N 3.07Å; V50-L163 HydrophobicContact CG2-CB 3.56Å; V50-L163 HydrophobicContact CG2-CD1 4.02Å; V50-L163 HydrophobicContact CG2-CG 4.23Å; L163-L166 PolarHBondContact O-N 2.91Å; L163-F167 HydrophobicContact CD1-CE2 4.29Å; L163-F167 HydrophobicContact CD2-CD2 3.66Å; L163-F167 HydrophobicContact CD2-CE2 3.38Å; L163-F167 HydrophobicContact CG-CD2 4.01Å; L163-F167 HydrophobicContact CG-CE2 3.61Å; L163-F167 WeakPolarHBondContact O-CD2 3.23Å; L163-F167 PolarHBondContact O-N 2.96Å
164	H	84.9	Confident	85.5	Confident	80 Å²	80	30.7 Å²	30.7	37%	0.37	16%	0.155	S	C	.	.	H	α-helix	trans	-62.8	-46.5	178.1	-169.5	45.8	0	0	0	112.1	S162 L166 F167 E168	S162-H164 PolarHBondContact O-N 2.82Å; H164-L166 VanDerWaalsContact C-N 3.3Å; H164-L166 PolarHBondContact O-N 2.84Å; H164-F167 PolarHBondContact O-N 2.71Å; H164-F167 VanDerWaalsContact O-N 3.16Å; H164-E168 IonicContact CD2-OE1 3.35Å; H164-E168 IonicContact CE1-OE1 2.71Å; H164-E168 PolarHBondContact CE1-OE1 2.81Å; H164-E168 IonicContact NE2-OE1 3.79Å; H164-E168 PolarHBondContact NE2-OE1 2.88Å; H164-E168 WeakPolarHBondContact O-CG 3.29Å; H164-E168 PolarHBondContact O-N 3.41Å
165	S	87.6	Confident	85.7	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.007	19%	0.186	C	C	.	.	H	α-helix	trans	-67.2	-30.2	-179.2	68.1	0	0	0	0	113	S162 E168 L169 E355 S359	S162-S165 PolarHBondContact O-N 2.94Å; S162-S165 PolarHBondContact O-OG 3.46Å; S162-S165 VanDerWaalsContact OG-CB 3.31Å; S162-S165 WeakPolarHBondContact OG-CB 3.44Å; S162-S165 PolarHBondContact OG-N 3.02Å; S162-S165 PolarHBondContact OG-OG 2.91Å; S165-E168 PolarHBondContact O-N 2.81Å; S165-L169 VanDerWaalsContact O-CB 3.29Å; S165-L169 WeakPolarHBondContact O-CB 3.34Å; S165-L169 PolarHBondContact O-N 2.84Å; S165-E355 WeakPolarHBondContact CB-O 3.28Å; S165-E355 PolarHBondContact OG-O 3.16Å; S165-S359 PolarHBondContact OG-OG 3.49Å
166	L	86.9	Confident	85.9	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-66	-40.9	172	-72.9	168.5	0	0	0	112.6	V50 L161 S162 L163 H164 L169 R170 I363 F389 L390	V50-L166 HydrophobicContact CG2-CD1 4.22Å; L161-L166 HydrophobicContact CB-CD1 4.41Å; L161-L166 HydrophobicContact CD1-CD1 4.37Å; L161-L166 HydrophobicContact CD1-CD2 4.09Å; L161-L166 HydrophobicContact CD1-CG 4.4Å; S162-L166 PolarHBondContact O-N 2.87Å; L163-L166 PolarHBondContact O-N 2.91Å; H164-L166 VanDerWaalsContact C-N 3.3Å; H164-L166 PolarHBondContact O-N 2.84Å; L166-L169 PolarHBondContact O-N 2.91Å; L166-R170 PolarHBondContact O-N 2.76Å; L166-I363 HydrophobicContact CD2-CD1 3.33Å; L166-I363 HydrophobicContact CD2-CG1 4.09Å; L166-F389 HydrophobicContact CD1-CE1 4.29Å; L166-F389 HydrophobicContact CD2-CD1 4.46Å; L166-F389 HydrophobicContact CD2-CE1 4.07Å; L166-L390 HydrophobicContact CB-CD2 4.02Å; L166-L390 HydrophobicContact CD1-CD2 3.84Å; L166-L390 HydrophobicContact CG-CD2 4.47Å
167	F	88	Confident	86.2	Confident	48 Å²	48	30.8 Å²	30.8	21%	0.211	16%	0.163	C	C	.	.	H	α-helix	trans	-70	-36.3	175.2	-77.9	-62.4	0	0	0	112.6	L163 H164 R170 S171 L390 M1070	L163-F167 HydrophobicContact CD1-CE2 4.29Å; L163-F167 HydrophobicContact CD2-CD2 3.66Å; L163-F167 HydrophobicContact CD2-CE2 3.38Å; L163-F167 HydrophobicContact CG-CD2 4.01Å; L163-F167 HydrophobicContact CG-CE2 3.61Å; L163-F167 WeakPolarHBondContact O-CD2 3.23Å; L163-F167 PolarHBondContact O-N 2.96Å; H164-F167 PolarHBondContact O-N 2.71Å; H164-F167 VanDerWaalsContact O-N 3.16Å; F167-R170 PolarHBondContact O-N 2.84Å; F167-S171 PolarHBondContact O-N 3.48Å; F167-L390 HydrophobicContact CE1-CD1 3.98Å; F167-L390 HydrophobicContact CZ-CD1 4.15Å; F167-M1070 HydrophobicContact CD2-CE 4.28Å; F167-M1070 HydrophobicContact CE1-CE 3.84Å; F167-M1070 HydrophobicContact CE2-CE 3.31Å; F167-M1070 HydrophobicContact CZ-CE 3.05Å; F167-M1070 HydrophobicContact CZ-SD 3.94Å
168	E	89.4	Confident	86.6	Confident	45 Å²	45	31.1 Å²	31.1	21%	0.21	17%	0.167	C	C	.	.	H	α-helix	trans	-66.2	-41.8	173.2	-70.6	-172.3	150.9	0	0	111.4	H164 S165 R170 S171 C172 I356	H164-E168 IonicContact CD2-OE1 3.35Å; H164-E168 IonicContact CE1-OE1 2.71Å; H164-E168 PolarHBondContact CE1-OE1 2.81Å; H164-E168 IonicContact NE2-OE1 3.79Å; H164-E168 PolarHBondContact NE2-OE1 2.88Å; H164-E168 WeakPolarHBondContact O-CG 3.29Å; H164-E168 PolarHBondContact O-N 3.41Å; S165-E168 PolarHBondContact O-N 2.81Å; E168-R170 VanDerWaalsContact C-N 3.33Å; E168-R170 PolarHBondContact O-N 2.91Å; E168-S171 CarbonylContact O-C 3.55Å; E168-S171 WeakPolarHBondContact O-CB 3.46Å; E168-S171 PolarHBondContact O-N 2.84Å; E168-S171 VanDerWaalsContact O-N 3.15Å; E168-C172 WeakPolarHBondContact O-CB 3.35Å; E168-C172 PolarHBondContact O-N 2.89Å; E168-C172 PolarHBondContact O-SG 3.31Å; E168-I356 HydrophobicContact CB-CD1 3.82Å; E168-I356 HydrophobicContact CB-CG1 3.93Å
169	L	90.6	Very high	87	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-57.5	-46	172.7	177.4	63.4	0	0	0	111.4	S165 L166 S171 C172 L173 F341 I356 M360 I363	S165-L169 VanDerWaalsContact O-CB 3.29Å; S165-L169 WeakPolarHBondContact O-CB 3.34Å; S165-L169 PolarHBondContact O-N 2.84Å; L166-L169 PolarHBondContact O-N 2.91Å; L169-S171 VanDerWaalsContact C-N 3.34Å; L169-S171 PolarHBondContact O-N 3.4Å; L169-C172 WeakPolarHBondContact O-CB 3.35Å; L169-C172 PolarHBondContact O-N 2.88Å; L169-L173 HydrophobicContact CD1-CD1 4.37Å; L169-L173 HydrophobicContact CG-CD1 4.38Å; L169-L173 PolarHBondContact O-N 3.48Å; L169-F341 HydrophobicContact CD1-CE1 4.47Å; L169-F341 HydrophobicContact CD1-CE2 3.96Å; L169-F341 HydrophobicContact CD1-CZ 3.68Å; L169-I356 HydrophobicContact CB-CG2 4.14Å; L169-I356 HydrophobicContact CD1-CG2 3.96Å; L169-M360 HydrophobicContact CD1-CB 3.91Å; L169-M360 HydrophobicContact CD1-CG 4.35Å; L169-M360 HydrophobicContact CD1-SD 4.1Å; L169-M360 HydrophobicContact CD2-CB 4.06Å; L169-M360 HydrophobicContact CD2-SD 4.15Å; L169-I363 HydrophobicContact CD2-CD1 3.55Å
170	R	89.9	Confident	87.2	Confident	57 Å²	57	33.7 Å²	33.7	22%	0.215	18%	0.18	C	C	.	.	H	α-helix	trans	-58.2	-45.8	174.9	-173.7	-177.7	-178.2	-79.7	-2.8	111.3	L166 F167 E168 C172 L173 I174 L383 I386 D387	L166-R170 PolarHBondContact O-N 2.76Å; F167-R170 PolarHBondContact O-N 2.84Å; E168-R170 VanDerWaalsContact C-N 3.33Å; E168-R170 PolarHBondContact O-N 2.91Å; R170-C172 VanDerWaalsContact C-N 3.34Å; R170-C172 PolarHBondContact O-N 2.95Å; R170-L173 PolarHBondContact O-N 3.35Å; R170-I174 HydrophobicContact CG-CD1 4.18Å; R170-I174 WeakPolarHBondContact O-CD1 3.29Å; R170-I174 VanDerWaalsContact O-CG1 3.26Å; R170-I174 WeakPolarHBondContact O-CG1 3.3Å; R170-I174 PolarHBondContact O-N 2.8Å; R170-I174 VanDerWaalsContact O-N 3.08Å; R170-L383 HydrophobicContact CG-CD2 4.15Å; R170-I386 HydrophobicContact CB-CG2 4.47Å; R170-D387 IonicContact CZ-OD1 3.75Å; R170-D387 IonicContact NE-OD1 3.65Å; R170-D387 PolarHBondContact NE-OD1 2.74Å; R170-D387 IonicContact NE-OD2 3.16Å; R170-D387 IonicContact NH2-OD1 3.13Å; R170-D387 IonicContact NH2-OD2 3.4Å; R170-D387 PolarHBondContact NH2-OD2 2.8Å
171	S	89.3	Confident	87.4	Confident	57 Å²	57	35.6 Å²	35.6	40%	0.399	19%	0.189	S	C	.	.	H	α-helix	trans	-62.5	-40	175.8	-169.1	0	0	0	0	112.3	F167 E168 L169 L173 I174 N175	F167-S171 PolarHBondContact O-N 3.48Å; E168-S171 CarbonylContact O-C 3.55Å; E168-S171 WeakPolarHBondContact O-CB 3.46Å; E168-S171 PolarHBondContact O-N 2.84Å; E168-S171 VanDerWaalsContact O-N 3.15Å; L169-S171 VanDerWaalsContact C-N 3.34Å; L169-S171 PolarHBondContact O-N 3.4Å; S171-L173 PolarHBondContact O-N 3.45Å; S171-I174 PolarHBondContact O-N 2.87Å; S171-N175 PolarHBondContact O-N 2.92Å
172	C	88	Confident	87.5	Confident	21 Å²	21	36.6 Å²	36.6	14%	0.142	19%	0.194	C	C	.	.	H	α-helix	trans	-62.7	-40.8	177.2	-71.8	0	0	0	0	111.7	E168 L169 R170 G176 V316	E168-C172 WeakPolarHBondContact O-CB 3.35Å; E168-C172 PolarHBondContact O-N 2.89Å; E168-C172 PolarHBondContact O-SG 3.31Å; L169-C172 WeakPolarHBondContact O-CB 3.35Å; L169-C172 PolarHBondContact O-N 2.88Å; R170-C172 VanDerWaalsContact C-N 3.34Å; R170-C172 PolarHBondContact O-N 2.95Å; C172-G176 WeakPolarHBondContact O-CA 3.39Å; C172-G176 PolarHBondContact O-N 3.24Å; C172-V316 HydrophobicContact CB-CB 4.49Å; C172-V316 HydrophobicContact CB-CG1 3.93Å; C172-V316 HydrophobicContact CB-CG2 3.93Å
173	L	88.6	Confident	87.5	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.021	22%	0.223	C	C	.	.	H	α-helix	trans	-73.8	-30	176.5	-73.4	167	0	0	0	113.2	L169 R170 S171 F318 F341 R379 L383 I386	L169-L173 HydrophobicContact CD1-CD1 4.37Å; L169-L173 HydrophobicContact CG-CD1 4.38Å; L169-L173 PolarHBondContact O-N 3.48Å; R170-L173 PolarHBondContact O-N 3.35Å; S171-L173 PolarHBondContact O-N 3.45Å; L173-F318 HydrophobicContact CD2-CB 3.79Å; L173-F318 HydrophobicContact CD2-CG 4.27Å; L173-F341 HydrophobicContact CD2-CE2 4.33Å; L173-R379 VanDerWaalsContact O-CD 3.29Å; L173-R379 WeakPolarHBondContact O-CD 3.43Å; L173-L383 HydrophobicContact CB-CD2 4.07Å; L173-I386 HydrophobicContact CD1-CD1 3.3Å
174	I	88.1	Confident	87.6	Confident	59 Å²	59	42.8 Å²	42.8	30%	0.303	21%	0.213	S	C	.	.	H	α-helix	trans	-66.9	-46.7	174.4	-70.1	164.5	0	0	0	110.8	R170 S171 R379 L383	R170-I174 HydrophobicContact CG-CD1 4.18Å; R170-I174 WeakPolarHBondContact O-CD1 3.29Å; R170-I174 VanDerWaalsContact O-CG1 3.26Å; R170-I174 WeakPolarHBondContact O-CG1 3.3Å; R170-I174 PolarHBondContact O-N 2.8Å; R170-I174 VanDerWaalsContact O-N 3.08Å; S171-I174 PolarHBondContact O-N 2.87Å; I174-R379 PolarHBondContact O-NH1 3.24Å; I174-L383 HydrophobicContact CD1-CD1 4.48Å; I174-L383 HydrophobicContact CD1-CD2 4.41Å; I174-L383 HydrophobicContact CG1-CD1 3.63Å; I174-L383 HydrophobicContact CG1-CD2 3.75Å; I174-L383 HydrophobicContact CG1-CG 4.37Å
175	N	84.8	Confident	87.6	Confident	131 Å²	131	44.9 Å²	44.9	70%	0.701	23%	0.227	S	C	*	.	H	α-helix	trans	-90.3	-17.6	-175.4	-65.1	-24.2	0	0	0	113.4	S171	S171-N175 PolarHBondContact O-N 2.92Å
176	G	84.1	Confident	87.6	Confident	9 Å²	9	46.9 Å²	46.9	9%	0.093	24%	0.241	C	C	.	.	S	Bend	trans	-82.6	175.4	-175.1	0	0	0	0	0	114.6	C172 R379	C172-G176 WeakPolarHBondContact O-CA 3.39Å; C172-G176 PolarHBondContact O-N 3.24Å; G176-R379 VanDerWaalsContact O-CZ 3.27Å; G176-R379 PolarHBondContact O-NH2 3.17Å
177	T	87.6	Confident	87.5	Confident	26 Å²	26	48.7 Å²	48.7	16%	0.16	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	129.7	177	-43.3	0	0	0	0	109.2	L179 Q197 V316 A317 F318	T177-L179 HydrophobicContact CG2-CD2 4.25Å; T177-L179 HydrophobicContact CG2-CG 4.15Å; T177-Q197 HydrophobicContact CG2-CB 4.1Å; T177-V316 PolarHBondContact N-O 3.32Å; T177-A317 CarbonylContact O-C 3.58Å; T177-A317 VanDerWaalsContact O-CA 3.31Å; T177-A317 WeakPolarHBondContact O-CA 3.31Å; T177-F318 PolarHBondContact O-N 3.2Å
178	V	89.8	Confident	87.5	Confident	26 Å²	26	51.6 Å²	51.6	16%	0.158	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	113.4	179.6	177.7	0	0	0	0	107.8	L180 F318 R379 L382	V178-L180 HydrophobicContact CG1-CD2 4.22Å; V178-L180 HydrophobicContact CG1-CG 4.1Å; V178-F318 WeakPolarHBondContact CA-O 3.26Å; V178-F318 HydrophobicContact CG1-CD1 4.2Å; V178-F318 HydrophobicContact CG2-CB 4.49Å; V178-R379 HydrophobicContact CG2-CB 4.48Å; V178-R379 HydrophobicContact CG2-CG 4.12Å; V178-L382 HydrophobicContact CG1-CD1 4.02Å
179	L	89.7	Confident	87.4	Confident	30 Å²	30	53.4 Å²	53.4	16%	0.157	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	106.5	-177.1	-61.7	172.5	0	0	0	109	T177 M182 I194 Q197 F318 V319 R320	T177-L179 HydrophobicContact CG2-CD2 4.25Å; T177-L179 HydrophobicContact CG2-CG 4.15Å; L179-M182 HydrophobicContact CD1-SD 4.26Å; L179-I194 HydrophobicContact CD1-CG1 4Å; L179-Q197 HydrophobicContact CD2-CG 3.96Å; L179-F318 PolarHBondContact N-O 2.95Å; L179-V319 HydrophobicContact CB-CG2 4.39Å; L179-V319 HydrophobicContact CD1-CG2 4.39Å; L179-V319 CarbonylContact O-C 3.59Å; L179-V319 WeakPolarHBondContact O-CA 3.28Å; L179-R320 PolarHBondContact O-N 3.49Å
180	L	89	Confident	87.3	Confident	42 Å²	42	53.4 Å²	53.4	22%	0.22	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	138.6	-179.9	-59.8	175.2	0	0	0	110.4	V178 M182 F318 R320 A376 K377	V178-L180 HydrophobicContact CG1-CD2 4.22Å; V178-L180 HydrophobicContact CG1-CG 4.1Å; L180-M182 PolarHBondContact O-N 2.84Å; L180-F318 HydrophobicContact CD2-CD1 4.45Å; L180-F318 HydrophobicContact CD2-CE1 4.15Å; L180-R320 HydrophobicContact CD2-CB 4Å; L180-A376 HydrophobicContact CD1-CB 4.46Å; L180-K377 WeakPolarHBondContact CD1-O 3.42Å
181	D	86.8	Confident	87.2	Confident	60 Å²	60	50.7 Å²	50.7	32%	0.321	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	58.8	40.9	178.4	-55.9	-41.9	0	0	0	115	H111 R320	H111-D181 IonicContact CD2-OD1 2.8Å; H111-D181 IonicContact NE2-OD1 2.89Å; H111-D181 PolarHBondContact NE2-OD1 3.02Å; H111-D181 IonicContact NE2-OD2 3.88Å; D181-R320 WeakPolarHBondContact CA-O 3.22Å; D181-R320 PolarHBondContact N-O 2.96Å; D181-R320 IonicContact OD1-CZ 2.62Å; D181-R320 VanDerWaalsContact OD1-CZ 3.3Å; D181-R320 IonicContact OD1-NE 3.84Å; D181-R320 PolarHBondContact OD1-NE 3.06Å; D181-R320 IonicContact OD1-NH2 2.85Å; D181-R320 PolarHBondContact OD1-NH2 3.03Å; D181-R320 VanDerWaalsContact OD1-NH2 3.07Å; D181-R320 IonicContact OD2-CZ 3.75Å; D181-R320 IonicContact OD2-NE 2.94Å; D181-R320 IonicContact OD2-NH2 2.66Å; D181-R320 PolarHBondContact OD2-NH2 3.42Å
182	M	86.5	Confident	87.1	Confident	20 Å²	20	49.8 Å²	49.8	10%	0.099	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	138.2	176.5	-168.6	174.9	74.6	0	0	111.4	L179 L180 A184 I190 L193 V319 R320 L321 S322	L179-M182 HydrophobicContact CD1-SD 4.26Å; L180-M182 PolarHBondContact O-N 2.84Å; M182-A184 HydrophobicContact CE-CB 3.97Å; M182-I190 HydrophobicContact CE-CB 4Å; M182-I190 HydrophobicContact CE-CG1 3.58Å; M182-I190 HydrophobicContact CE-CG2 3.92Å; M182-L193 HydrophobicContact CG-CD1 3.95Å; M182-L193 HydrophobicContact SD-CB 3.98Å; M182-L193 HydrophobicContact SD-CD1 3.68Å; M182-L193 HydrophobicContact SD-CG 4.49Å; M182-V319 HydrophobicContact CB-CG1 4.36Å; M182-V319 HydrophobicContact CE-CG1 3.43Å; M182-V319 VanDerWaalsContact CE-CG1 3.43Å; M182-V319 HydrophobicContact SD-CG1 4.18Å; M182-R320 PolarHBondContact N-O 2.79Å; M182-L321 HydrophobicContact CB-CD2 4.37Å; M182-L321 HydrophobicContact CE-CD2 3.64Å; M182-L321 CarbonylContact O-C 3.51Å; M182-L321 VanDerWaalsContact O-CA 3.31Å; M182-L321 WeakPolarHBondContact O-CA 3.38Å; M182-S322 PolarHBondContact O-N 3Å
183	R	85.9	Confident	87.1	Confident	182 Å²	182	51.8 Å²	51.8	69%	0.687	26%	0.262	S	S	*	.			trans	-106.2	98.9	175.1	-68.3	-179.1	179	-173.8	0.6	109
184	A	84.9	Confident	87	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.008	26%	0.262	C	S	.	.			trans	-140.3	143.8	176.3	0	0	0	0	0	109.9	M182 E189 I190 L193 L321 V325	M182-A184 HydrophobicContact CE-CB 3.97Å; A184-E189 VanDerWaalsContact CA-OE2 3.29Å; A184-E189 WeakPolarHBondContact CA-OE2 2.99Å; A184-E189 HydrophobicContact CB-CB 4.17Å; A184-E189 HydrophobicContact CB-CG 3.89Å; A184-I190 HydrophobicContact CB-CG1 3.61Å; A184-L193 HydrophobicContact CB-CD1 4.35Å; A184-L321 HydrophobicContact CB-CD2 4.4Å; A184-V325 WeakPolarHBondContact O-CG2 3.41Å
185	N	84.1	Confident	86.8	Confident	123 Å²	123	49 Å²	49	66%	0.658	25%	0.248	S	C	*	.	S	Bend	trans	-108.2	-9.8	-175.3	-65.9	-32.8	0	0	0	113.7	E189	N185-E189 PolarHBondContact N-OE2 2.95Å
186	S	86.6	Confident	86.8	Confident	44 Å²	44	46.2 Å²	46.2	31%	0.308	23%	0.233	S	C	.	.	S	Bend	trans	-139.6	156.3	179	70.4	0	0	0	0	111.5	E188 E189 I190	S186-E188 PolarHBondContact O-N 3.27Å; S186-E189 PolarHBondContact O-N 3.39Å; S186-E189 PolarHBondContact OG-N 2.88Å; S186-E189 VanDerWaalsContact OG-N 3.16Å; S186-I190 VanDerWaalsContact O-CG1 3.3Å; S186-I190 WeakPolarHBondContact O-CG1 3.48Å; S186-I190 PolarHBondContact O-N 3.01Å
187	I	86.5	Confident	86.5	Confident	37 Å²	37	50.3 Å²	50.3	19%	0.19	25%	0.25	C	S	.	.	H	α-helix	trans	-63.1	-29	174.1	-173.2	60.6	0	0	0	112	I190 S191 L217 L340	I187-I190 HydrophobicContact CD1-CB 4.4Å; I187-I190 HydrophobicContact CD1-CG2 4.37Å; I187-I190 PolarHBondContact O-N 3Å; I187-S191 WeakPolarHBondContact O-CB 3.16Å; I187-S191 PolarHBondContact O-N 3.27Å; I187-S191 PolarHBondContact O-OG 3.27Å; I187-S191 VanDerWaalsContact O-OG 3.08Å; I187-L217 HydrophobicContact CG2-CD2 3.88Å; I187-L340 HydrophobicContact CD1-CD2 4.24Å
188	E	87.2	Confident	85.8	Confident	109 Å²	109	50 Å²	50	51%	0.509	25%	0.247	S	C	.	.	H	α-helix	trans	-62.2	-47.2	172.7	-66.3	175.8	-175	0	0	111.6	S186 S191 D192 L217	S186-E188 PolarHBondContact O-N 3.27Å; E188-S191 WeakPolarHBondContact CA-OG 3.2Å; E188-S191 PolarHBondContact O-N 3.39Å; E188-S191 PolarHBondContact O-OG 3.5Å; E188-D192 PolarHBondContact O-N 3.49Å; E188-L217 HydrophobicContact CB-CD2 4.37Å; E188-L217 HydrophobicContact CG-CD1 4.13Å; E188-L217 HydrophobicContact CG-CD2 3.54Å
189	E	88.2	Confident	84.4	Confident	83 Å²	83	54 Å²	54	39%	0.388	26%	0.264	S	S	.	.	H	α-helix	trans	-67	-38.6	178	-173.5	176.2	-156.8	0	0	111.5	A184 N185 S186 D192 L193	A184-E189 VanDerWaalsContact CA-OE2 3.29Å; A184-E189 WeakPolarHBondContact CA-OE2 2.99Å; A184-E189 HydrophobicContact CB-CB 4.17Å; A184-E189 HydrophobicContact CB-CG 3.89Å; N185-E189 PolarHBondContact N-OE2 2.95Å; S186-E189 PolarHBondContact O-N 3.39Å; S186-E189 PolarHBondContact OG-N 2.88Å; S186-E189 VanDerWaalsContact OG-N 3.16Å; E189-D192 PolarHBondContact O-N 3.17Å; E189-L193 HydrophobicContact CG-CD1 4.17Å; E189-L193 WeakPolarHBondContact O-CB 3.45Å; E189-L193 VanDerWaalsContact O-CG 3.28Å; E189-L193 WeakPolarHBondContact O-CG 3.36Å; E189-L193 PolarHBondContact O-N 3.17Å; E189-L193 VanDerWaalsContact O-N 3.07Å
190	I	88.1	Confident	83	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-60.5	-49.9	173.8	-66.4	168.5	0	0	0	110.6	M182 A184 S186 I187 D192 L193 I194 L321 L327 L340	M182-I190 HydrophobicContact CE-CB 4Å; M182-I190 HydrophobicContact CE-CG1 3.58Å; M182-I190 HydrophobicContact CE-CG2 3.92Å; A184-I190 HydrophobicContact CB-CG1 3.61Å; S186-I190 VanDerWaalsContact O-CG1 3.3Å; S186-I190 WeakPolarHBondContact O-CG1 3.48Å; S186-I190 PolarHBondContact O-N 3.01Å; I187-I190 HydrophobicContact CD1-CB 4.4Å; I187-I190 HydrophobicContact CD1-CG2 4.37Å; I187-I190 PolarHBondContact O-N 3Å; I190-D192 PolarHBondContact O-N 3.13Å; I190-L193 PolarHBondContact O-N 3.01Å; I190-I194 HydrophobicContact CG2-CD1 3.71Å; I190-I194 VanDerWaalsContact O-CG1 3.24Å; I190-I194 WeakPolarHBondContact O-CG1 3.14Å; I190-I194 PolarHBondContact O-N 2.98Å; I190-L321 HydrophobicContact CD1-CD1 4.31Å; I190-L321 HydrophobicContact CD1-CD2 4.19Å; I190-L321 HydrophobicContact CG1-CD2 4.34Å; I190-L327 HydrophobicContact CD1-CD1 3.87Å; I190-L327 HydrophobicContact CD1-CD2 4.07Å; I190-L340 HydrophobicContact CG2-CD2 3.77Å
191	S	87.1	Confident	81.7	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-63	-40.2	-179.4	59.4	0	0	0	0	112.3	I187 E188 I194 L195	I187-S191 WeakPolarHBondContact O-CB 3.16Å; I187-S191 PolarHBondContact O-N 3.27Å; I187-S191 PolarHBondContact O-OG 3.27Å; I187-S191 VanDerWaalsContact O-OG 3.08Å; E188-S191 WeakPolarHBondContact CA-OG 3.2Å; E188-S191 PolarHBondContact O-N 3.39Å; E188-S191 PolarHBondContact O-OG 3.5Å; S191-I194 PolarHBondContact O-N 2.88Å; S191-L195 WeakPolarHBondContact O-CB 3.35Å; S191-L195 WeakPolarHBondContact O-CD1 3.39Å; S191-L195 WeakPolarHBondContact O-CG 3.29Å; S191-L195 PolarHBondContact O-N 2.89Å
192	D	87.7	Confident	80.1	Confident	37 Å²	37	63.1 Å²	63.1	20%	0.198	33%	0.326	C	S	.	.	H	α-helix	trans	-64.6	-44.4	177	-79.3	-25	0	0	0	112.8	E188 E189 I190 I194 L195 D196 R213	E188-D192 PolarHBondContact O-N 3.49Å; E189-D192 PolarHBondContact O-N 3.17Å; I190-D192 PolarHBondContact O-N 3.13Å; D192-I194 VanDerWaalsContact C-N 3.34Å; D192-I194 PolarHBondContact O-N 2.89Å; D192-L195 PolarHBondContact O-N 2.75Å; D192-D196 WeakPolarHBondContact O-CB 3.15Å; D192-D196 PolarHBondContact O-N 3.3Å; D192-R213 VanDerWaalsContact CG-CZ 3.42Å; D192-R213 IonicContact OD1-CZ 3.78Å; D192-R213 IonicContact OD1-NE 3.5Å; D192-R213 PolarHBondContact OD1-NE 3.26Å; D192-R213 IonicContact OD1-NH1 3.55Å; D192-R213 PolarHBondContact OD1-NH1 2.97Å; D192-R213 IonicContact OD1-NH2 2.86Å; D192-R213 PolarHBondContact OD1-NH2 2.89Å; D192-R213 IonicContact OD2-CZ 2.62Å; D192-R213 IonicContact OD2-NH1 3.82Å; D192-R213 PolarHBondContact OD2-NH1 2.75Å; D192-R213 IonicContact OD2-NH2 3.4Å; D192-R213 PolarHBondContact OD2-NH2 2.86Å
193	L	87.6	Confident	78.7	Confident	63 Å²	63	66.7 Å²	66.7	33%	0.33	35%	0.346	S	S	.	.	H	α-helix	trans	-64.7	-36.9	177.9	-72.5	168.8	0	0	0	112.8	M182 A184 E189 I190 Q197	M182-L193 HydrophobicContact CG-CD1 3.95Å; M182-L193 HydrophobicContact SD-CB 3.98Å; M182-L193 HydrophobicContact SD-CD1 3.68Å; M182-L193 HydrophobicContact SD-CG 4.49Å; A184-L193 HydrophobicContact CB-CD1 4.35Å; E189-L193 HydrophobicContact CG-CD1 4.17Å; E189-L193 WeakPolarHBondContact O-CB 3.45Å; E189-L193 VanDerWaalsContact O-CG 3.28Å; E189-L193 WeakPolarHBondContact O-CG 3.36Å; E189-L193 PolarHBondContact O-N 3.17Å; E189-L193 VanDerWaalsContact O-N 3.07Å; I190-L193 PolarHBondContact O-N 3.01Å; L193-Q197 WeakPolarHBondContact O-CG 3.47Å; L193-Q197 PolarHBondContact O-N 3.29Å
194	I	86.6	Confident	77.8	Confident	4 Å²	4	60.1 Å²	60.1	2%	0.021	32%	0.324	C	S	.	.	H	α-helix	trans	-65.7	-45.2	175.5	-67.7	167.5	0	0	0	110.3	L179 I190 S191 D192 Q197 Q198 A317 V319 I342	L179-I194 HydrophobicContact CD1-CG1 4Å; I190-I194 HydrophobicContact CG2-CD1 3.71Å; I190-I194 VanDerWaalsContact O-CG1 3.24Å; I190-I194 WeakPolarHBondContact O-CG1 3.14Å; I190-I194 PolarHBondContact O-N 2.98Å; S191-I194 PolarHBondContact O-N 2.88Å; D192-I194 VanDerWaalsContact C-N 3.34Å; D192-I194 PolarHBondContact O-N 2.89Å; I194-Q197 PolarHBondContact O-N 3.24Å; I194-Q198 PolarHBondContact O-N 3.45Å; I194-Q198 VanDerWaalsContact O-N 3.16Å; I194-A317 HydrophobicContact CD1-CB 4.25Å; I194-A317 HydrophobicContact CG1-CB 4.44Å; I194-A317 HydrophobicContact CG2-CB 3.83Å; I194-V319 HydrophobicContact CD1-CG2 3.87Å; I194-V319 HydrophobicContact CG1-CG2 4.15Å; I194-I342 HydrophobicContact CD1-CD1 3.62Å
195	L	84.6	Confident	77.2	Confident	2 Å²	2	65.7 Å²	65.7	1%	0.01	35%	0.354	C	S	.	.	H	α-helix	trans	-66.6	-38.8	-179.8	-68.5	169.1	0	0	0	112	S191 D192 Q197 Q198 E199 R209 V212 R213	S191-L195 WeakPolarHBondContact O-CB 3.35Å; S191-L195 WeakPolarHBondContact O-CD1 3.39Å; S191-L195 WeakPolarHBondContact O-CG 3.29Å; S191-L195 PolarHBondContact O-N 2.89Å; D192-L195 PolarHBondContact O-N 2.75Å; L195-Q197 VanDerWaalsContact C-N 3.34Å; L195-Q197 PolarHBondContact O-N 3.47Å; L195-Q198 PolarHBondContact O-N 2.83Å; L195-E199 PolarHBondContact O-N 2.77Å; L195-E199 VanDerWaalsContact O-N 3.15Å; L195-R209 HydrophobicContact CB-CG 4.25Å; L195-R209 HydrophobicContact CD1-CG 3.97Å; L195-R209 HydrophobicContact CD2-CG 4.27Å; L195-R209 HydrophobicContact CG-CG 4.39Å; L195-V212 HydrophobicContact CD2-CB 4.26Å; L195-V212 HydrophobicContact CD2-CG1 3.91Å; L195-R213 HydrophobicContact CD1-CB 3.8Å; L195-R213 HydrophobicContact CD1-CG 4.39Å
196	D	83.8	Confident	76.9	Confident	71 Å²	71	66 Å²	66	38%	0.38	36%	0.355	S	S	.	.	H	α-helix	trans	-63.3	-38.3	176	-72.5	-17.8	0	0	0	112.4	D192 E199 R209	D192-D196 WeakPolarHBondContact O-CB 3.15Å; D192-D196 PolarHBondContact O-N 3.3Å; D196-E199 WeakPolarHBondContact O-CB 3.29Å; D196-E199 PolarHBondContact O-N 3.01Å; D196-R209 IonicContact OD1-CZ 3.1Å; D196-R209 IonicContact OD1-NH1 2.98Å; D196-R209 PolarHBondContact OD1-NH1 2.86Å; D196-R209 IonicContact OD1-NH2 2.74Å; D196-R209 PolarHBondContact OD1-NH2 3.43Å
197	Q	77.9	Confident	76.4	Confident	96 Å²	96	67.7 Å²	67.7	45%	0.449	37%	0.367	S	S	.	.	H	α-helix	trans	-71.9	-30.7	177.8	-73.3	-71.2	-33.3	0	0	112.5	T177 L179 L193 I194 L195	T177-Q197 HydrophobicContact CG2-CB 4.1Å; L179-Q197 HydrophobicContact CD2-CG 3.96Å; L193-Q197 WeakPolarHBondContact O-CG 3.47Å; L193-Q197 PolarHBondContact O-N 3.29Å; I194-Q197 PolarHBondContact O-N 3.24Å; L195-Q197 VanDerWaalsContact C-N 3.34Å; L195-Q197 PolarHBondContact O-N 3.47Å
198	Q	72.4	Confident	76	Confident	18 Å²	18	67 Å²	67	8%	0.084	36%	0.364	C	S	.	.	H	α-helix	trans	-72.9	-28.2	173.6	-75.1	-172.9	-51.4	0	0	113.1	I194 L195 L200 S201 L204	I194-Q198 PolarHBondContact O-N 3.45Å; I194-Q198 VanDerWaalsContact O-N 3.16Å; L195-Q198 PolarHBondContact O-N 2.83Å; Q198-L200 VanDerWaalsContact C-N 3.3Å; Q198-L200 PolarHBondContact O-N 3.22Å; Q198-S201 PolarHBondContact O-N 2.91Å; Q198-S201 PolarHBondContact O-OG 3.12Å; Q198-L204 HydrophobicContact CB-CD1 3.64Å; Q198-L204 HydrophobicContact CG-CD1 4.48Å
199	E	61.6	Low	75.7	Confident	110 Å²	110	64.1 Å²	64.1	51%	0.514	35%	0.348	S	S	.	.	H	α-helix	trans	-63.2	-36.6	177.7	-163.9	173.1	157.4	0	0	112.4	L195 D196 S201 S202 R209	L195-E199 PolarHBondContact O-N 2.77Å; L195-E199 VanDerWaalsContact O-N 3.15Å; D196-E199 WeakPolarHBondContact O-CB 3.29Å; D196-E199 PolarHBondContact O-N 3.01Å; E199-S201 PolarHBondContact O-N 2.84Å; E199-S201 VanDerWaalsContact O-N 3.1Å; E199-S202 PolarHBondContact O-N 3.43Å; E199-S202 VanDerWaalsContact O-N 3.17Å; E199-R209 IonicContact OE2-NH1 2.97Å; E199-R209 PolarHBondContact OE2-NH1 3.24Å
200	L	60.8	Low	75.4	Confident	144 Å²	144	64.8 Å²	64.8	75%	0.754	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-17.9	173.6	-78.8	148.5	0	0	0	113.4	Q198	Q198-L200 VanDerWaalsContact C-N 3.3Å; Q198-L200 PolarHBondContact O-N 3.22Å
201	S	60.5	Low	75.1	Confident	69 Å²	69	68 Å²	68	48%	0.483	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	4.7	179.7	69.5	0	0	0	0	115.1	Q198 E199 D203	Q198-S201 PolarHBondContact O-N 2.91Å; Q198-S201 PolarHBondContact O-OG 3.12Å; E199-S201 PolarHBondContact O-N 2.84Å; E199-S201 VanDerWaalsContact O-N 3.1Å; S201-D203 PolarHBondContact O-N 2.81Å
202	S	52.6	Low	74.9	Confident	112 Å²	112	68.1 Å²	68.1	78%	0.783	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.6	12.1	170.6	76	0	0	0	0	119.6	E199	E199-S202 PolarHBondContact O-N 3.43Å; E199-S202 VanDerWaalsContact O-N 3.17Å
203	D	58.7	Low	74.8	Confident	94 Å²	94	70.6 Å²	70.6	50%	0.503	38%	0.379	S	S	.	.			trans	-107.6	0.7	-168.1	-91.9	-1.7	0	0	0	116.6	S201 R313	S201-D203 PolarHBondContact O-N 2.81Å; D203-R313 IonicContact OD1-NH1 2.81Å; D203-R313 PolarHBondContact OD1-NH1 3Å; D203-R313 IonicContact OD2-CZ 2.82Å; D203-R313 IonicContact OD2-NH1 2.64Å; D203-R313 PolarHBondContact OD2-NH1 3.3Å
204	L	66.1	Low	74.7	Confident	44 Å²	44	71.9 Å²	71.9	23%	0.23	38%	0.383	C	S	.	.			trans	-121.1	127.7	-174.3	-69.6	171	0	0	0	114.3	Q198 M208 I315	Q198-L204 HydrophobicContact CB-CD1 3.64Å; Q198-L204 HydrophobicContact CG-CD1 4.48Å; L204-M208 HydrophobicContact CD2-CE 4.41Å; L204-I315 HydrophobicContact CD1-CD1 4.49Å; L204-I315 HydrophobicContact CD2-CD1 4.19Å
205	N	73.3	Confident	74.6	Confident	118 Å²	118	71.7 Å²	71.7	63%	0.631	38%	0.382	S	S	*	.			trans	-77.9	147.3	169.2	-70.5	-38.1	0	0	0	111.3	S207 M208 R209	N205-S207 PolarHBondContact O-N 2.97Å; N205-S207 VanDerWaalsContact O-N 3.11Å; N205-M208 HydrophobicContact CB-CG 4.06Å; N205-M208 HydrophobicContact CB-SD 4.01Å; N205-M208 WeakPolarHBondContact O-CB 3.24Å; N205-M208 PolarHBondContact O-N 3.43Å; N205-R209 PolarHBondContact O-N 2.87Å; N205-R209 VanDerWaalsContact O-N 3.16Å
206	D	76.3	Confident	74.6	Confident	129 Å²	129	71.8 Å²	71.8	69%	0.69	38%	0.383	S	S	*	.	H	α-helix	trans	-52.9	-36.3	179.1	-71.3	-26.1	0	0	0	113.8	M208 R209 V210	D206-M208 VanDerWaalsContact C-N 3.34Å; D206-M208 PolarHBondContact O-N 2.64Å; D206-R209 PolarHBondContact O-N 2.9Å; D206-V210 PolarHBondContact O-N 3.05Å
207	S	76.5	Confident	74.8	Confident	81 Å²	81	71.6 Å²	71.6	57%	0.566	38%	0.382	S	S	*	.	H	α-helix	trans	-70	-29	177.3	-177.3	0	0	0	0	113.4	N205	N205-S207 PolarHBondContact O-N 2.97Å; N205-S207 VanDerWaalsContact O-N 3.11Å
208	M	78	Confident	75.2	Confident	22 Å²	22	69.3 Å²	69.3	11%	0.108	37%	0.37	C	S	.	.	H	α-helix	trans	-76.1	-40	177.8	-60	174.7	70.1	0	0	109.8	L204 N205 D206 V210 K211 V212 I310 L311	L204-M208 HydrophobicContact CD2-CE 4.41Å; N205-M208 HydrophobicContact CB-CG 4.06Å; N205-M208 HydrophobicContact CB-SD 4.01Å; N205-M208 WeakPolarHBondContact O-CB 3.24Å; N205-M208 PolarHBondContact O-N 3.43Å; D206-M208 VanDerWaalsContact C-N 3.34Å; D206-M208 PolarHBondContact O-N 2.64Å; M208-V210 VanDerWaalsContact C-N 3.34Å; M208-V210 PolarHBondContact O-N 2.89Å; M208-K211 PolarHBondContact O-N 2.76Å; M208-K211 VanDerWaalsContact O-N 3.16Å; M208-V212 WeakPolarHBondContact O-CG2 3.15Å; M208-V212 PolarHBondContact O-N 2.67Å; M208-I310 VanDerWaalsContact CE-O 3.28Å; M208-I310 WeakPolarHBondContact CE-O 3.28Å; M208-I310 HydrophobicContact CG-CG2 3.92Å; M208-L311 HydrophobicContact CE-CD2 4.22Å
209	R	81	Confident	75.7	Confident	48 Å²	48	74 Å²	74	18%	0.181	39%	0.39	C	S	.	.	H	α-helix	trans	-55	-47.3	176.8	-176.6	178.2	170.2	135.1	9	112.1	L195 D196 E199 N205 D206 K211 V212 R213	L195-R209 HydrophobicContact CB-CG 4.25Å; L195-R209 HydrophobicContact CD1-CG 3.97Å; L195-R209 HydrophobicContact CD2-CG 4.27Å; L195-R209 HydrophobicContact CG-CG 4.39Å; D196-R209 IonicContact OD1-CZ 3.1Å; D196-R209 IonicContact OD1-NH1 2.98Å; D196-R209 PolarHBondContact OD1-NH1 2.86Å; D196-R209 IonicContact OD1-NH2 2.74Å; D196-R209 PolarHBondContact OD1-NH2 3.43Å; E199-R209 IonicContact OE2-NH1 2.97Å; E199-R209 PolarHBondContact OE2-NH1 3.24Å; N205-R209 PolarHBondContact O-N 2.87Å; N205-R209 VanDerWaalsContact O-N 3.16Å; D206-R209 PolarHBondContact O-N 2.9Å; R209-K211 VanDerWaalsContact C-N 3.34Å; R209-K211 PolarHBondContact O-N 2.73Å; R209-V212 PolarHBondContact O-N 3.47Å; R209-R213 WeakPolarHBondContact O-CB 3.19Å; R209-R213 PolarHBondContact O-N 2.62Å
210	V	83.3	Confident	76.8	Confident	97 Å²	97	69.5 Å²	69.5	59%	0.588	37%	0.369	S	S	*	.	H	α-helix	trans	-61.4	-42.4	178.8	176.4	0	0	0	0	111.5	D206 M208 R213 E214	D206-V210 PolarHBondContact O-N 3.05Å; M208-V210 VanDerWaalsContact C-N 3.34Å; M208-V210 PolarHBondContact O-N 2.89Å; V210-R213 PolarHBondContact O-N 3.17Å; V210-E214 WeakPolarHBondContact O-CB 3.29Å; V210-E214 PolarHBondContact O-N 3.2Å
211	K	80.4	Confident	77.9	Confident	68 Å²	68	64.6 Å²	64.6	30%	0.296	34%	0.342	S	S	.	.	H	α-helix	trans	-72.2	-37.1	-179.8	-67	-168.2	-177.7	-175.5	0	112.9	M208 R209 E214 A215 I310	M208-K211 PolarHBondContact O-N 2.76Å; M208-K211 VanDerWaalsContact O-N 3.16Å; R209-K211 VanDerWaalsContact C-N 3.34Å; R209-K211 PolarHBondContact O-N 2.73Å; K211-E214 PolarHBondContact O-N 3.28Å; K211-A215 WeakPolarHBondContact O-CB 3.38Å; K211-A215 PolarHBondContact O-N 3.46Å; K211-I310 HydrophobicContact CD-CD1 3.32Å; K211-I310 HydrophobicContact CD-CG1 3.84Å
212	V	82.9	Confident	78.8	Confident	4 Å²	4	62.1 Å²	62.1	2%	0.024	32%	0.323	C	S	.	.	H	α-helix	trans	-66.6	-41.8	174	174.8	0	0	0	0	110.6	L195 M208 R209 E214 A215 L216 L311 I315 L344	L195-V212 HydrophobicContact CD2-CB 4.26Å; L195-V212 HydrophobicContact CD2-CG1 3.91Å; M208-V212 WeakPolarHBondContact O-CG2 3.15Å; M208-V212 PolarHBondContact O-N 2.67Å; R209-V212 PolarHBondContact O-N 3.47Å; V212-E214 VanDerWaalsContact C-N 3.32Å; V212-E214 PolarHBondContact O-N 2.86Å; V212-A215 PolarHBondContact O-N 3.06Å; V212-L216 HydrophobicContact CG1-CD1 4.38Å; V212-L216 WeakPolarHBondContact O-CG 3.27Å; V212-L216 PolarHBondContact O-N 2.94Å; V212-L311 HydrophobicContact CG2-CD1 3.92Å; V212-L311 HydrophobicContact CG2-CG 4.36Å; V212-I315 HydrophobicContact CG1-CD1 4.03Å; V212-I315 HydrophobicContact CG2-CD1 3.92Å; V212-L344 HydrophobicContact CG1-CD1 3.98Å
213	R	85.6	Confident	79.6	Confident	88 Å²	88	57.7 Å²	57.7	33%	0.332	29%	0.29	S	S	.	.	H	α-helix	trans	-58.9	-44.2	172	-173.7	179.8	177.5	147.6	7.5	111.3	D192 L195 R209 V210 L216 L217	D192-R213 VanDerWaalsContact CG-CZ 3.42Å; D192-R213 IonicContact OD1-CZ 3.78Å; D192-R213 IonicContact OD1-NE 3.5Å; D192-R213 PolarHBondContact OD1-NE 3.26Å; D192-R213 IonicContact OD1-NH1 3.55Å; D192-R213 PolarHBondContact OD1-NH1 2.97Å; D192-R213 IonicContact OD1-NH2 2.86Å; D192-R213 PolarHBondContact OD1-NH2 2.89Å; D192-R213 IonicContact OD2-CZ 2.62Å; D192-R213 IonicContact OD2-NH1 3.82Å; D192-R213 PolarHBondContact OD2-NH1 2.75Å; D192-R213 IonicContact OD2-NH2 3.4Å; D192-R213 PolarHBondContact OD2-NH2 2.86Å; L195-R213 HydrophobicContact CD1-CB 3.8Å; L195-R213 HydrophobicContact CD1-CG 4.39Å; R209-R213 WeakPolarHBondContact O-CB 3.19Å; R209-R213 PolarHBondContact O-N 2.62Å; V210-R213 PolarHBondContact O-N 3.17Å; R213-L216 PolarHBondContact O-N 2.86Å; R213-L217 HydrophobicContact CG-CD1 4.01Å; R213-L217 VanDerWaalsContact O-CG 3.31Å; R213-L217 WeakPolarHBondContact O-CG 3.4Å; R213-L217 PolarHBondContact O-N 2.83Å
214	E	85.2	Confident	79.7	Confident	90 Å²	90	56.4 Å²	56.4	42%	0.421	28%	0.283	S	S	.	.	H	α-helix	trans	-62.1	-42.3	176.2	-165.6	-169.1	153.8	0	0	111.8	V210 K211 V212 L217 K218	V210-E214 WeakPolarHBondContact O-CB 3.29Å; V210-E214 PolarHBondContact O-N 3.2Å; K211-E214 PolarHBondContact O-N 3.28Å; V212-E214 VanDerWaalsContact C-N 3.32Å; V212-E214 PolarHBondContact O-N 2.86Å; E214-L217 PolarHBondContact O-N 3.45Å; E214-K218 WeakPolarHBondContact O-CG 3.36Å; E214-K218 PolarHBondContact O-N 3.12Å; E214-K218 WeakPolarHBondContact OE1-CE 3.21Å; E214-K218 IonicContact OE1-NZ 3.15Å; E214-K218 PolarHBondContact OE1-NZ 3.06Å
215	A	85.1	Confident	79.4	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-62	-43.2	178.1	0	0	0	0	0	112.4	M125 W133 K211 V212 L217 K218	M125-A215 HydrophobicContact SD-CB 4.09Å; W133-A215 PolarHBondContact NE1-O 3.2Å; K211-A215 WeakPolarHBondContact O-CB 3.38Å; K211-A215 PolarHBondContact O-N 3.46Å; V212-A215 PolarHBondContact O-N 3.06Å; A215-L217 VanDerWaalsContact C-N 3.27Å; A215-L217 PolarHBondContact O-N 2.75Å; A215-K218 PolarHBondContact O-N 3.16Å
216	L	85	Confident	78.2	Confident	5 Å²	5	57.2 Å²	57.2	3%	0.026	28%	0.28	C	S	.	.	H	α-helix	trans	-68	-23.9	177.7	-70	176.3	0	0	0	113.7	W133 V212 R213 I342 L344	W133-L216 HydrophobicContact CZ2-CD2 4.38Å; V212-L216 HydrophobicContact CG1-CD1 4.38Å; V212-L216 WeakPolarHBondContact O-CG 3.27Å; V212-L216 PolarHBondContact O-N 2.94Å; R213-L216 PolarHBondContact O-N 2.86Å; L216-I342 HydrophobicContact CD1-CD1 4.48Å; L216-I342 HydrophobicContact CD2-CD1 3.95Å; L216-I342 HydrophobicContact CD2-CG2 3.85Å; L216-L344 HydrophobicContact CD2-CD1 4.07Å; L216-L344 HydrophobicContact CG-CD1 4.34Å
217	L	87.2	Confident	76.9	Confident	67 Å²	67	58.1 Å²	58.1	35%	0.351	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	2.6	179.7	-63.4	175.5	0	0	0	113.4	I187 E188 R213 E214 A215	I187-L217 HydrophobicContact CG2-CD2 3.88Å; E188-L217 HydrophobicContact CB-CD2 4.37Å; E188-L217 HydrophobicContact CG-CD1 4.13Å; E188-L217 HydrophobicContact CG-CD2 3.54Å; R213-L217 HydrophobicContact CG-CD1 4.01Å; R213-L217 VanDerWaalsContact O-CG 3.31Å; R213-L217 WeakPolarHBondContact O-CG 3.4Å; R213-L217 PolarHBondContact O-N 2.83Å; E214-L217 PolarHBondContact O-N 3.45Å; A215-L217 VanDerWaalsContact C-N 3.27Å; A215-L217 PolarHBondContact O-N 2.75Å
218	K	87.6	Confident	75.4	Confident	48 Å²	48	61.8 Å²	61.8	21%	0.209	28%	0.279	C	S	.	.	S	Bend	trans	-61.6	154.4	173.7	-71.8	-61.4	-177.9	-175.3	0	110.9	I123 A131 E214 A215 H220	I123-K218 HydrophobicContact CD1-CB 4.07Å; I123-K218 HydrophobicContact CD1-CG 4.08Å; A131-K218 WeakPolarHBondContact O-CD 3.39Å; E214-K218 WeakPolarHBondContact O-CG 3.36Å; E214-K218 PolarHBondContact O-N 3.12Å; E214-K218 WeakPolarHBondContact OE1-CE 3.21Å; E214-K218 IonicContact OE1-NZ 3.15Å; E214-K218 PolarHBondContact OE1-NZ 3.06Å; A215-K218 PolarHBondContact O-N 3.16Å; K218-H220 PolarHBondContact O-CD2 3.16Å
219	K	82.4	Confident	73.8	Confident	117 Å²	117	67.6 Å²	67.6	51%	0.509	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-67	138.5	-179.8	-170.1	-174.4	171.6	-155.9	0	110.4	W133 E225	W133-K219 PolarHBondContact N-O 3.38Å; K219-E225 IonicContact NZ-OE2 3.48Å; K219-E225 PolarHBondContact NZ-OE2 3.46Å; K219-E225 VanDerWaalsContact NZ-OE2 3.12Å
220	H	85.3	Confident	71.9	Confident	14 Å²	14	71.6 Å²	71.6	7%	0.065	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	127.8	169.6	-64.9	-114.5	0	0	0	110.8	D121 W133 K218 G329 L330	D121-H220 IonicContact OD2-CE1 2.59Å; D121-H220 PolarHBondContact OD2-CE1 3.25Å; D121-H220 IonicContact OD2-ND1 2.77Å; D121-H220 PolarHBondContact OD2-ND1 3.24Å; W133-H220 HydrophobicContact CB-CB 4.25Å; W133-H220 AromaticContact CD1-CD2 3.84Å; W133-H220 AromaticContact CD1-CE1 3.77Å; W133-H220 AromaticContact CD1-NE2 3.47Å; W133-H220 AromaticContact CD2-CE1 3.95Å; W133-H220 AromaticContact CG-CE1 3.58Å; W133-H220 AromaticContact CG-ND1 3.89Å; W133-H220 AromaticContact CG-NE2 3.77Å; W133-H220 AromaticContact NE1-NE2 3.94Å; K218-H220 PolarHBondContact O-CD2 3.16Å; H220-G329 WeakPolarHBondContact CB-O 3.29Å; H220-L330 WeakPolarHBondContact CE1-CD1 3.36Å; H220-L330 WeakPolarHBondContact NE2-CD1 3.24Å
221	H	82	Confident	70	Confident	42 Å²	42	73 Å²	73	19%	0.194	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	102.6	-177.8	-170.2	97.5	0	0	0	109.7	E132 W133	E132-H221 HydrophobicContact CB-CB 4.47Å; E132-H221 IonicContact OE2-CG 3.21Å; E132-H221 IonicContact OE2-ND1 3.49Å; E132-H221 PolarHBondContact OE2-ND1 3.28Å; E132-H221 VanDerWaalsContact OE2-ND1 3.13Å; W133-H221 WeakPolarHBondContact O-CA 3.07Å; W133-H221 WeakPolarHBondContact O-CB 3.33Å; W133-H221 PolarHBondContact O-N 3.34Å
222	H	81.1	Confident	68	Low	16 Å²	16	76.2 Å²	76.2	7%	0.074	36%	0.359	C	S	.	.			trans	-86.6	137.9	-179.7	-63.1	-63	0	0	0	111.6	E119 N224 E225 G329 T331 E332	E119-H222 IonicContact OE1-CE1 2.67Å; E119-H222 IonicContact OE1-ND1 2.81Å; H222-N224 PolarHBondContact O-N 2.79Å; H222-E225 HydrophobicContact CB-CG 4.41Å; H222-E225 PolarHBondContact O-N 3.38Å; H222-G329 PolarHBondContact NE2-O 3.25Å; H222-T331 VanDerWaalsContact CE1-C 3.41Å; H222-E332 HydrophobicContact CB-CG 4.49Å; H222-E332 PolarHBondContact CE1-N 2.8Å; H222-E332 VanDerWaalsContact CE1-N 3.31Å; H222-E332 PolarHBondContact ND1-N 3.4Å
223	Q	68.3	Low	65.7	Low	20 Å²	20	82.1 Å²	82.1	9%	0.093	40%	0.397	C	S	.	.	H	α-helix	trans	-58	-29.3	-173	-175.9	55	39.2	0	0	113.8	G150 E151 W153 E225	G150-Q223 VanDerWaalsContact C-NE2 3.35Å; G150-Q223 PolarHBondContact O-NE2 2.79Å; G150-Q223 PolarHBondContact O-OE1 3.13Å; E151-Q223 VanDerWaalsContact C-NE2 3.35Å; W153-Q223 HydrophobicContact CZ2-CB 4.22Å; Q223-E225 PolarHBondContact O-N 3.18Å
224	N	60.5	Low	63.3	Low	66 Å²	66	84.7 Å²	84.7	35%	0.353	42%	0.416	S	S	.	.	H	α-helix	trans	-76.7	-13.9	180	-92.1	-28.1	0	0	0	115	H222 E332	H222-N224 PolarHBondContact O-N 2.79Å; N224-E332 WeakPolarHBondContact CB-OE1 3.14Å; N224-E332 VanDerWaalsContact CG-OE1 3.28Å; N224-E332 PolarHBondContact ND2-OE1 3.49Å
225	E	59.9	Low	61	Low	81 Å²	81	86.2 Å²	86.2	38%	0.379	43%	0.431	S	S	.	.	H	α-helix	trans	-68.9	-37.1	178.6	-67.6	-162.7	158.2	0	0	112.2	K219 H222 Q223 K227 R228	K219-E225 IonicContact NZ-OE2 3.48Å; K219-E225 PolarHBondContact NZ-OE2 3.46Å; K219-E225 VanDerWaalsContact NZ-OE2 3.12Å; H222-E225 HydrophobicContact CB-CG 4.41Å; H222-E225 PolarHBondContact O-N 3.38Å; Q223-E225 PolarHBondContact O-N 3.18Å; E225-K227 VanDerWaalsContact C-N 3.33Å; E225-K227 PolarHBondContact O-N 3.19Å; E225-R228 PolarHBondContact O-N 2.96Å
226	K	48.9	Very low	58.6	Low	98 Å²	98	97.7 Å²	97.7	43%	0.426	48%	0.475	S	S	.	.	H	α-helix	trans	-59.4	-37.9	177.7	-81.5	-178.8	-178.5	170.7	0	113.7	G150 R228	G150-K226 PolarHBondContact O-NZ 3.49Å; K226-R228 PolarHBondContact O-N 3.37Å
227	K	49.8	Very low	56.1	Low	148 Å²	148	101.6 Å²	101.6	64%	0.643	50%	0.502	S	S	*	.	H	α-helix	trans	-68	-23.3	-177.7	-144.3	173.6	-169.2	171.3	0	112.2	E225 L231	E225-K227 VanDerWaalsContact C-N 3.33Å; E225-K227 PolarHBondContact O-N 3.19Å; K227-L231 WeakPolarHBondContact O-CD1 3.4Å
228	R	44.8	Very low	53.7	Low	158 Å²	158	107.5 Å²	107.5	60%	0.596	53%	0.525	S	S	*	.	H	α-helix	trans	-84.5	-30.8	-175.6	-132.5	169.5	129.8	151.3	-10.5	113.1	E225 K226 K285	E225-R228 PolarHBondContact O-N 2.96Å; K226-R228 PolarHBondContact O-N 3.37Å; R228-K285 PolarHBondContact NH1-O 3.42Å
229	N	42.9	Very low	51.3	Low	144 Å²	144	109.8 Å²	109.8	77%	0.77	55%	0.553	S	S	*	*	H	α-helix	trans	-78.8	-22.5	179.4	-68.3	-9.4	0	0	0	113
230	N	42	Very low	48.9	Very low	132 Å²	132	112.7 Å²	112.7	71%	0.706	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95	2.5	-178.9	-72.2	-10.7	0	0	0	114.9
231	L	43.6	Very low	46.5	Very low	128 Å²	128	118.1 Å²	118.1	67%	0.67	60%	0.603	S	S	*	*			trans	-107.5	94.7	-179.4	-97.7	151.6	0	0	0	111.5	K227	K227-L231 WeakPolarHBondContact O-CD1 3.4Å
232	I	38.3	Very low	44.1	Very low	134 Å²	134	119.7 Å²	119.7	69%	0.687	63%	0.63	S	S	*	*			trans	-52.7	137.9	164.9	-60.3	166.7	0	0	0	109.4	I234	I232-I234 HydrophobicContact CG2-CD1 3.81Å; I232-I234 HydrophobicContact CG2-CG1 4.03Å; I232-I234 PolarHBondContact O-N 3.28Å; I232-I234 VanDerWaalsContact O-N 3.08Å
233	P	35.1	Very low	41.9	Very low	128 Å²	128	128.4 Å²	128.4	83%	0.831	67%	0.668	S	S	*	*	S	Bend	trans	-84.9	84.6	-173.6	34.3	-32.9	0	0	0	111
234	I	35.1	Very low	40.2	Very low	143 Å²	143	137 Å²	137	73%	0.733	71%	0.705	S	S	*	*			trans	-119.3	-10.4	179.1	-74.6	173.2	0	0	0	115.1	I232	I232-I234 HydrophobicContact CG2-CD1 3.81Å; I232-I234 HydrophobicContact CG2-CG1 4.03Å; I232-I234 PolarHBondContact O-N 3.28Å; I232-I234 VanDerWaalsContact O-N 3.08Å
235	V	35.4	Very low	38.7	Very low	122 Å²	122	142.8 Å²	142.8	74%	0.739	73%	0.73	S	S	*	*			trans	-141.5	77.7	178.1	-163.6	0	0	0	0	112.7
236	R	35.3	Very low	37.2	Very low	241 Å²	241	144.4 Å²	144.4	91%	0.909	75%	0.75	S	S	*	*			trans	-124.2	16.1	163.3	-123.1	-178	-161.4	138.5	3.7	114.5	F238	R236-F238 PolarHBondContact O-N 3.08Å
237	S	32.4	Very low	36.1	Very low	87 Å²	87	147.8 Å²	147.8	61%	0.608	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	-2	-173.6	-172.6	0	0	0	0	116.5
238	F	37.4	Very low	35.1	Very low	190 Å²	190	146.1 Å²	146.1	83%	0.833	78%	0.777	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.6	-0.7	-171.8	-68.9	-72.9	0	0	0	116	R236	R236-F238 PolarHBondContact O-N 3.08Å
239	A	36.3	Very low	34.2	Very low	97 Å²	97	147.1 Å²	147.1	80%	0.802	79%	0.788	S	S	*	*	S	Bend	trans	-106.2	-3.8	178.9	0	0	0	0	0	114.8
240	E	32.9	Very low	33.3	Very low	177 Å²	177	146.2 Å²	146.2	83%	0.827	79%	0.793	S	S	*	*	S	Bend	trans	-105.5	-0.5	-175.8	-120.1	178.9	171.5	0	0	115.1
241	V	35.2	Very low	32.5	Very low	129 Å²	129	146.6 Å²	146.6	78%	0.782	79%	0.792	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-7.3	-179	176.5	0	0	0	0	113.3
242	G	31.9	Very low	31.7	Very low	75 Å²	75	146.9 Å²	146.9	77%	0.773	79%	0.794	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	2.4	-173.6	0	0	0	0	0	117.5
243	K	34.1	Very low	31.1	Very low	198 Å²	198	150.7 Å²	150.7	86%	0.861	81%	0.806	S	S	*	*	S	Bend	trans	-121.5	26.6	-170.6	-100	-172.8	178.8	-176.8	0	116.1
244	K	32.5	Very low	30.5	Very low	200 Å²	200	154.1 Å²	154.1	87%	0.87	81%	0.811	S	S	*	*			trans	-137.6	79.9	166.9	-72	-173	179.5	178	0	111.1
245	Q	28.8	Very low	30.1	Very low	189 Å²	189	151 Å²	151	88%	0.883	81%	0.814	S	S	*	*			trans	-175.9	96.9	152.1	-108.4	170.3	12.2	0	0	109.9
246	S	28.6	Very low	29.5	Very low	114 Å²	114	154 Å²	154	80%	0.797	82%	0.82	S	S	*	*			trans	173.9	91.9	137	33.4	0	0	0	0	110.1
247	D	25.3	Very low	28.9	Very low	170 Å²	170	148.6 Å²	148.6	91%	0.909	81%	0.814	S	S	*	*			trans	-147.6	114.5	145.2	-92.2	-32.5	0	0	0	106.8
248	P	30.2	Very low	28.5	Very low	112 Å²	112	150.9 Å²	150.9	73%	0.727	82%	0.824	S	S	*	*			trans	-114.5	122.9	159.7	29.1	-14.2	0	0	0	111.3
249	H	24.6	Very low	27.9	Very low	180 Å²	180	146.2 Å²	146.2	83%	0.833	81%	0.814	S	S	*	*			trans	65.6	113.1	148.5	-79.3	-75.6	0	0	0	121
250	S	23.4	Very low	27.5	Very low	124 Å²	124	147.4 Å²	147.4	87%	0.867	81%	0.814	S	S	*	*			trans	-142.2	110.5	140.7	164.8	0	0	0	0	108.3
251	M	26.9	Very low	27.1	Very low	141 Å²	141	146.8 Å²	146.8	70%	0.695	81%	0.811	S	S	*	*			trans	-99	137.2	170.2	-76.3	-115.3	69	0	0	110.7
252	D	25.5	Very low	26.6	Very low	133 Å²	133	146.4 Å²	146.4	71%	0.711	81%	0.814	S	S	*	*			trans	62.3	111.5	149.9	-65.4	-30.2	0	0	0	122.1
253	K	26.2	Very low	26.3	Very low	214 Å²	214	148.3 Å²	148.3	93%	0.93	81%	0.81	S	S	*	*				-159.9	131.8	119.5	-120.6	173.3	179.4	176.4	0	113.8
254	H	23.1	Very low	26.6	Very low	201 Å²	201	144 Å²	144	93%	0.931	80%	0.802	S	S	*	*			trans	-54.8	144.2	170.4	-108.2	58.6	0	0	0	113.9
255	G	25.3	Very low	26.1	Very low	78 Å²	78	140.5 Å²	140.5	80%	0.804	80%	0.798	S	S	*	*			trans	174.9	103.1	167	0	0	0	0	0	113.8
256	Q	23.2	Very low	25.8	Very low	185 Å²	185	136.9 Å²	136.9	86%	0.864	79%	0.789	S	S	*	*			trans	-60	140	176.2	-150.6	172	23	0	0	112.5
257	T	23.3	Very low	25.5	Very low	127 Å²	127	137.9 Å²	137.9	78%	0.779	79%	0.786	S	S	*	*				169.3	122.4	125	33.3	0	0	0	0	114.9
258	V	23.8	Very low	25.6	Very low	135 Å²	135	137 Å²	137	82%	0.818	78%	0.78	S	S	*	*			trans	67.5	109.2	137.9	-170	0	0	0	0	120.8
259	S	23.9	Very low	25.3	Very low	91 Å²	91	140.5 Å²	140.5	64%	0.636	79%	0.787	S	S	*	*			trans	-83	161.7	153.5	177	0	0	0	0	110.7	Q261	S259-Q261 PolarHBondContact OG-N 3.5Å; S259-Q261 VanDerWaalsContact OG-N 3.11Å
260	P	28.9	Very low	25.5	Very low	122 Å²	122	138.4 Å²	138.4	79%	0.792	79%	0.786	S	S	*	*				-135.2	122.2	110.8	28.9	-13.6	0	0	0	111
261	Q	23.9	Very low	25.6	Very low	165 Å²	165	141.5 Å²	141.5	77%	0.771	78%	0.784	S	S	*	*				53.9	116.6	78	-100.1	-169.8	-2.8	0	0	116.6	S259	S259-Q261 PolarHBondContact OG-N 3.5Å; S259-Q261 VanDerWaalsContact OG-N 3.11Å
262	S	24.7	Very low	25.6	Very low	121 Å²	121	142.6 Å²	142.6	85%	0.846	79%	0.793	S	S	*	*			trans	-153	90.3	133.7	63.3	0	0	0	0	112
263	V	26.6	Very low	25.6	Very low	114 Å²	114	139.8 Å²	139.8	69%	0.691	80%	0.796	S	S	*	*			trans	5	149.3	145.2	-169.9	0	0	0	0	122
264	P	39.9	Very low	25.4	Very low	107 Å²	107	136.6 Å²	136.6	70%	0.695	79%	0.794	S	S	*	*			trans	-107.2	-179.2	-180	42.7	-32.2	0	0	0	114.6
265	T	21.8	Very low	25.6	Very low	127 Å²	127	134.1 Å²	134.1	78%	0.779	79%	0.787	S	S	*	*			trans	-170.9	115.3	159.5	30.9	0	0	0	0	111
266	T	22.1	Very low	25.6	Very low	113 Å²	113	135.9 Å²	135.9	69%	0.693	79%	0.786	S	S	*	*				70.6	137.2	84.7	55.9	0	0	0	0	114.3
267	N	23.3	Very low	25.7	Very low	136 Å²	136	135.5 Å²	135.5	73%	0.727	78%	0.784	S	S	*	*			cis	-157.4	177.1	26	-74.4	-60.8	0	0	0	107.9
268	L	26.3	Very low	25.7	Very low	150 Å²	150	137.7 Å²	137.7	79%	0.785	79%	0.785	S	S	*	*			cis	-174.7	137.3	41.3	-143.8	126.7	0	0	0	109.2
269	E	25.2	Very low	25.9	Very low	187 Å²	187	136.1 Å²	136.1	87%	0.874	78%	0.78	S	S	*	*			trans	-75.3	137.9	169.2	-71.3	178.7	141.4	0	0	111.3
270	V	28.1	Very low	26.2	Very low	135 Å²	135	137.7 Å²	137.7	82%	0.818	79%	0.788	S	S	*	*			trans	-134	121	149.4	178.6	0	0	0	0	109.3
271	K	26.2	Very low	26.6	Very low	189 Å²	189	137.4 Å²	137.4	82%	0.822	78%	0.784	S	S	*	*			trans	-78.2	128	175	-146	177.2	-172.8	176.3	0	109
272	N	25.3	Very low	26.8	Very low	164 Å²	164	134 Å²	134	88%	0.877	77%	0.771	S	S	*	*			trans	-175.4	122.5	140	-93.1	-13.2	0	0	0	109.4
273	G	25.6	Very low	27.5	Very low	75 Å²	75	134.9 Å²	134.9	77%	0.773	77%	0.765	S	S	*	*			trans	-84.5	153.9	-166.6	0	0	0	0	0	114.9
274	V	23.6	Very low	27.9	Very low	147 Å²	147	133.3 Å²	133.3	89%	0.891	76%	0.76	S	S	*	*			trans	-149.9	140.5	130.3	173	0	0	0	0	106.4
275	N	27.4	Very low	27.9	Very low	148 Å²	148	133.9 Å²	133.9	79%	0.791	75%	0.751	S	S	*	*			trans	-49.2	129.2	-177	-156.1	28.7	0	0	0	114.4
276	C	24.7	Very low	29	Very low	115 Å²	115	130.5 Å²	130.5	78%	0.777	73%	0.73	S	S	*	*			trans	-154.7	123	153.9	-145.3	0	0	0	0	109.6	H278	C276-H278 PolarHBondContact O-N 3.32Å
277	E	24.2	Very low	30.3	Very low	177 Å²	177	130.1 Å²	130.1	83%	0.827	72%	0.724	S	S	*	*			trans	-71.1	115.6	-175	-65.1	-175.8	141.7	0	0	111.5
278	H	24	Very low	31.7	Very low	174 Å²	174	129.6 Å²	129.6	81%	0.806	72%	0.721	S	S	*	*			trans	-133.9	97.2	156.5	-81.2	-77.8	0	0	0	108.2	C276	C276-H278 PolarHBondContact O-N 3.32Å
279	S	27.6	Very low	33.1	Very low	102 Å²	102	128.6 Å²	128.6	71%	0.713	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-73.2	126.3	162.8	52.8	0	0	0	0	108.9	V281	S279-V281 PolarHBondContact O-N 3.46Å
280	P	30.9	Very low	35	Very low	124 Å²	124	121 Å²	121	81%	0.805	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-66.4	120.9	167.5	27.7	-30.9	0	0	0	108	D282	P280-D282 PolarHBondContact O-N 2.75Å
281	V	36.8	Very low	36.7	Very low	116 Å²	116	118.5 Å²	118.5	70%	0.703	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-60.2	125.8	-179.7	-178.5	0	0	0	0	109.5	S279 L283	S279-V281 PolarHBondContact O-N 3.46Å; V281-L283 PolarHBondContact O-N 3.09Å
282	D	29.6	Very low	38.4	Very low	94 Å²	94	116.8 Å²	116.8	50%	0.503	65%	0.649	S	S	.	*			trans	-66.8	86.2	-176.8	-163	11.5	0	0	0	110.2	P280 S284 K285	P280-D282 PolarHBondContact O-N 2.75Å; D282-S284 PolarHBondContact O-N 2.96Å; D282-S284 PolarHBondContact OD1-OG 3.45Å; D282-S284 VanDerWaalsContact OD1-OG 3.07Å; D282-K285 IonicContact OD2-NZ 3.65Å; D282-K285 PolarHBondContact OD2-NZ 2.83Å
283	L	38.9	Very low	40.5	Very low	138 Å²	138	112.7 Å²	112.7	72%	0.723	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.5	-3.7	-178.6	-90	155	0	0	0	115.6	V281	V281-L283 PolarHBondContact O-N 3.09Å
284	S	34.9	Very low	42.8	Very low	82 Å²	82	109.9 Å²	109.9	57%	0.573	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-3.8	-173.3	64.9	0	0	0	0	114.8	D282	D282-S284 PolarHBondContact O-N 2.96Å; D282-S284 PolarHBondContact OD1-OG 3.45Å; D282-S284 VanDerWaalsContact OD1-OG 3.07Å
285	K	39.7	Very low	45	Very low	118 Å²	118	104.6 Å²	104.6	51%	0.513	56%	0.559	S	S	.	*			trans	-128.2	27.7	-169.6	-68.8	172.6	-173.1	138.1	0	115.2	R228 D282	R228-K285 PolarHBondContact NH1-O 3.42Å; D282-K285 IonicContact OD2-NZ 3.65Å; D282-K285 PolarHBondContact OD2-NZ 2.83Å
286	V	45.2	Very low	46.9	Very low	57 Å²	57	104.7 Å²	104.7	35%	0.345	57%	0.565	S	S	.	*	S	Bend	trans	-82.7	143.3	167.8	-174.4	0	0	0	0	109	L288	V286-L288 PolarHBondContact O-N 2.85Å
287	D	48.6	Very low	49.3	Very low	104 Å²	104	101.8 Å²	101.8	56%	0.556	55%	0.554	S	S	*	*			trans	-65.2	88.6	-174	-141.8	1.2	0	0	0	111	H289 F290	D287-H289 PolarHBondContact O-N 2.85Å; D287-F290 PolarHBondContact O-N 3.27Å
288	L	53.4	Low	52.1	Low	126 Å²	126	93.7 Å²	93.7	66%	0.66	52%	0.518	S	S	*	.	H	α-helix	trans	-51.7	-14.5	-176.4	-76.4	155.5	0	0	0	114.5	V286 K292	V286-L288 PolarHBondContact O-N 2.85Å; L288-K292 WeakPolarHBondContact O-CG 3.44Å
289	H	54.8	Low	55.2	Low	128 Å²	128	86.5 Å²	86.5	59%	0.593	49%	0.485	S	S	*	.	H	α-helix	trans	-77.8	-34.3	178.1	-173.2	-96.9	0	0	0	113	D287	D287-H289 PolarHBondContact O-N 2.85Å
290	F	64.8	Low	58.1	Low	28 Å²	28	81.7 Å²	81.7	12%	0.123	45%	0.451	C	S	.	.	H	α-helix	trans	-79.1	-40.8	177.6	-172.8	-112.9	0	0	0	111.5	F117 D287 K292 K293 I294 V333	F117-F290 HydrophobicContact CE2-CE1 4.17Å; F117-F290 HydrophobicContact CE2-CZ 4.06Å; F117-F290 HydrophobicContact CZ-CE1 4.33Å; D287-F290 PolarHBondContact O-N 3.27Å; F290-K292 PolarHBondContact O-N 3.17Å; F290-K292 VanDerWaalsContact O-N 3.09Å; F290-K293 HydrophobicContact CD2-CD 4.09Å; F290-K293 WeakPolarHBondContact O-CA 3.41Å; F290-K293 VanDerWaalsContact O-CB 3.28Å; F290-K293 WeakPolarHBondContact O-CB 3.36Å; F290-K293 PolarHBondContact O-N 3.43Å; F290-I294 HydrophobicContact CD1-CD1 4.02Å; F290-I294 HydrophobicContact CE1-CD1 3.75Å; F290-I294 HydrophobicContact CE1-CG1 4.39Å; F290-I294 HydrophobicContact CZ-CD1 4.45Å; F290-V333 HydrophobicContact CD1-CG2 3.71Å; F290-V333 HydrophobicContact CE1-CG2 3.82Å
291	M	65	Low	61	Low	83 Å²	83	75.9 Å²	75.9	41%	0.409	41%	0.414	S	S	.	.	H	α-helix	trans	-53.2	-30.7	172.1	-84.4	-74.4	-72.4	0	0	114.1	K293 I294 V333	M291-K293 VanDerWaalsContact C-N 3.26Å; M291-K293 PolarHBondContact O-N 3.36Å; M291-I294 PolarHBondContact O-N 2.94Å; M291-V333 HydrophobicContact CG-CG1 3.92Å; M291-V333 HydrophobicContact SD-CG1 3.21Å; M291-V333 WeakPolarHBondContact SD-CG1 3.34Å
292	K	61.8	Low	63.7	Low	152 Å²	152	70.4 Å²	70.4	66%	0.661	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-16.7	175.5	-76.7	175.8	-175.8	178.1	0	114.1	L288 F290	L288-K292 WeakPolarHBondContact O-CG 3.44Å; F290-K292 PolarHBondContact O-N 3.17Å; F290-K292 VanDerWaalsContact O-N 3.09Å
293	K	68.4	Low	66.8	Low	78 Å²	78	65.9 Å²	65.9	34%	0.339	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-20.4	178.1	-56.7	-177.8	-175.4	176.7	0	112	F290 M291 P866	F290-K293 HydrophobicContact CD2-CD 4.09Å; F290-K293 WeakPolarHBondContact O-CA 3.41Å; F290-K293 VanDerWaalsContact O-CB 3.28Å; F290-K293 WeakPolarHBondContact O-CB 3.36Å; F290-K293 PolarHBondContact O-N 3.43Å; M291-K293 VanDerWaalsContact C-N 3.26Å; M291-K293 PolarHBondContact O-N 3.36Å; K293-P866 HydrophobicContact CD-CG 3.93Å
294	I	74.1	Confident	69.3	Low	16 Å²	16	59.3 Å²	59.3	8%	0.082	32%	0.322	C	S	.	.	S	Bend	trans	-85.8	135.5	180	-55.9	179.3	0	0	0	108.8	F290 M291 A298 V333 I335	F290-I294 HydrophobicContact CD1-CD1 4.02Å; F290-I294 HydrophobicContact CE1-CD1 3.75Å; F290-I294 HydrophobicContact CE1-CG1 4.39Å; F290-I294 HydrophobicContact CZ-CD1 4.45Å; M291-I294 PolarHBondContact O-N 2.94Å; I294-A298 HydrophobicContact CG2-CB 3.63Å; I294-V333 HydrophobicContact CD1-CG1 4.13Å; I294-V333 HydrophobicContact CD1-CG2 4.38Å; I294-I335 HydrophobicContact CD1-CD1 3.58Å; I294-I335 HydrophobicContact CG2-CD1 3.93Å
295	P	70.9	Confident	72.1	Confident	37 Å²	37	55.5 Å²	55.5	24%	0.24	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-57.5	146.9	176.4	-18	26.6	0	0	0	112.5	E115 G297 A298	E115-P295 HydrophobicContact CB-CB 4.25Å; E115-P295 HydrophobicContact CB-CG 3.89Å; E115-P295 VanDerWaalsContact CD-CG 3.43Å; E115-P295 HydrophobicContact CG-CB 4.45Å; E115-P295 HydrophobicContact CG-CG 4.2Å; E115-P295 WeakPolarHBondContact OE2-CG 3.26Å; P295-G297 PolarHBondContact O-N 3Å; P295-A298 HydrophobicContact CB-CB 4.47Å; P295-A298 WeakPolarHBondContact O-CB 3.46Å; P295-A298 PolarHBondContact O-N 3.41Å
296	T	67.3	Low	74.5	Confident	150 Å²	150	50.1 Å²	50.1	92%	0.92	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	120.5	175.3	52.1	0	0	0	0	110.2
297	G	73.8	Confident	76.6	Confident	53 Å²	53	48.7 Å²	48.7	55%	0.546	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.9	17.9	-176.3	0	0	0	0	0	114.1	H114 P295	H114-G297 PolarHBondContact CD2-O 3.01Å; H114-G297 VanDerWaalsContact CD2-O 3.27Å; P295-G297 PolarHBondContact O-N 3Å
298	A	82.8	Confident	78.4	Confident	8 Å²	8	43.8 Å²	43.8	7%	0.066	24%	0.236	C	C	.	.			trans	-63.8	148.2	170.5	0	0	0	0	0	111.3	E115 I294 P295 I335	E115-A298 CarbonylContact O-C 3.58Å; E115-A298 WeakPolarHBondContact O-CA 3.49Å; E115-A298 VanDerWaalsContact O-CB 3.3Å; E115-A298 WeakPolarHBondContact O-CB 3.35Å; I294-A298 HydrophobicContact CG2-CB 3.63Å; P295-A298 HydrophobicContact CB-CB 4.47Å; P295-A298 WeakPolarHBondContact O-CB 3.46Å; P295-A298 PolarHBondContact O-N 3.41Å; A298-I335 VanDerWaalsContact O-CG2 3.24Å; A298-I335 WeakPolarHBondContact O-CG2 3.47Å
299	E	89.3	Confident	79.8	Confident	23 Å²	23	40.6 Å²	40.6	11%	0.107	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	155.6	173.7	-63.7	-173.4	166.2	0	0	109.6	H114 E115 L116 F117 A324 P336 R338 Y374	H114-E299 HydrophobicContact CB-CG 3.99Å; H114-E299 IonicContact ND1-OE1 3.12Å; E115-E299 PolarHBondContact O-N 3.19Å; L116-E299 CarbonylContact C-O 3.48Å; L116-E299 VanDerWaalsContact CA-O 3.29Å; L116-E299 WeakPolarHBondContact CA-O 3.25Å; L116-E299 HydrophobicContact CD2-CB 4.05Å; F117-E299 PolarHBondContact N-O 3.45Å; E299-A324 HydrophobicContact CG-CB 4.31Å; E299-P336 CarbonylContact C-O 3.58Å; E299-P336 WeakPolarHBondContact CA-O 3.21Å; E299-R338 HydrophobicContact CB-CB 4.07Å; E299-R338 WeakPolarHBondContact OE2-CB 3.49Å; E299-R338 WeakPolarHBondContact OE2-CD 3.49Å; E299-R338 WeakPolarHBondContact OE2-CG 3.48Å; E299-Y374 PolarHBondContact OE2-OH 3.46Å
300	A	89.7	Confident	80.8	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	146.2	179.8	0	0	0	0	0	112.1	F117 T331 I335 P336 T337 R338 F339	F117-A300 CarbonylContact O-C 3.58Å; F117-A300 VanDerWaalsContact O-CA 3.28Å; F117-A300 WeakPolarHBondContact O-CA 3.41Å; A300-T331 HydrophobicContact CB-CG2 3.99Å; A300-I335 HydrophobicContact CB-CB 4.24Å; A300-I335 HydrophobicContact CB-CG2 3.95Å; A300-P336 PolarHBondContact N-O 3.44Å; A300-T337 WeakPolarHBondContact O-CA 3.43Å; A300-R338 PolarHBondContact O-N 3.13Å; A300-F339 PolarHBondContact O-N 3.22Å
301	S	92.1	Very high	81.6	Confident	3 Å²	3	35.8 Å²	35.8	2%	0.021	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	105	171.9	169.5	0	0	0	0	108.9	F117 T118 E119 F339	F117-S301 PolarHBondContact O-N 2.84Å; T118-S301 VanDerWaalsContact CA-O 3.27Å; T118-S301 WeakPolarHBondContact CA-O 3.28Å; E119-S301 PolarHBondContact N-O 2.78Å; S301-F339 WeakPolarHBondContact CA-O 3.48Å
302	N	92.4	Very high	82.1	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	131.3	-176.7	-70.6	91.6	0	0	0	110.6	L330 T331 T337 F339 L340 F341	N302-L330 HydrophobicContact CB-CD2 3.86Å; N302-L330 HydrophobicContact CB-CG 4.45Å; N302-L330 VanDerWaalsContact CG-CD2 3.46Å; N302-T331 WeakPolarHBondContact ND2-CG2 3.21Å; N302-T331 WeakPolarHBondContact OD1-CG2 3.48Å; N302-T337 HydrophobicContact CB-CG2 4.4Å; N302-T337 WeakPolarHBondContact OD1-CG2 3.29Å; N302-T337 PolarHBondContact OD1-OG1 3.37Å; N302-F339 PolarHBondContact N-O 2.62Å; N302-L340 HydrophobicContact CB-CD1 3.57Å; N302-L340 WeakPolarHBondContact O-CA 3.38Å; N302-F341 PolarHBondContact O-N 2.92Å
303	V	94.3	Very high	83	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	111.2	177.7	-174.2	0	0	0	0	107.6	E119 L120 D121 V305 F341 A361	E119-V303 PolarHBondContact O-N 3.15Å; L120-V303 WeakPolarHBondContact CA-O 3.24Å; L120-V303 HydrophobicContact CD1-CB 3.91Å; L120-V303 HydrophobicContact CD1-CG1 3.57Å; D121-V303 PolarHBondContact N-O 2.96Å; V303-V305 HydrophobicContact CG1-CG2 4.15Å; V303-F341 HydrophobicContact CG1-CB 4.46Å; V303-F341 HydrophobicContact CG1-CD1 3.81Å; V303-A361 HydrophobicContact CG2-CB 4Å
304	L	93.1	Very high	83.9	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	117.3	-176	-58.6	-172.5	0	0	0	109.3	D121 W133 L330 L340 F341 I342 L343	D121-L304 HydrophobicContact CB-CD2 3.78Å; W133-L304 HydrophobicContact CE3-CD2 4.28Å; W133-L304 HydrophobicContact CH2-CB 3.65Å; W133-L304 HydrophobicContact CH2-CG 4.5Å; W133-L304 HydrophobicContact CZ2-CB 4.4Å; W133-L304 HydrophobicContact CZ3-CB 3.74Å; W133-L304 HydrophobicContact CZ3-CD2 4.26Å; L304-L330 HydrophobicContact CD1-CD1 4.4Å; L304-L330 HydrophobicContact CD2-CD1 4.47Å; L304-L340 HydrophobicContact CD1-CD1 3.89Å; L304-L340 HydrophobicContact CG-CD1 3.99Å; L304-F341 PolarHBondContact N-O 3.38Å; L304-I342 HydrophobicContact CB-CG1 4.43Å; L304-I342 HydrophobicContact CD1-CG1 4.37Å; L304-I342 CarbonylContact O-C 3.58Å; L304-I342 WeakPolarHBondContact O-CA 3.44Å; L304-L343 PolarHBondContact O-N 3.49Å
305	V	93.6	Very high	84.5	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.012	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	139.1	-177.5	-178.9	0	0	0	0	111.2	L120 D121 E122 I123 W133 V303 L343 Y353	L120-V305 HydrophobicContact CD1-CB 4.39Å; L120-V305 HydrophobicContact CD1-CG2 3.76Å; D121-V305 PolarHBondContact O-N 3.5Å; E122-V305 CarbonylContact C-O 3.3Å; E122-V305 WeakPolarHBondContact CA-O 3.45Å; E122-V305 HydrophobicContact CG-CB 4.43Å; I123-V305 PolarHBondContact N-O 3.16Å; W133-V305 VanDerWaalsContact CZ3-O 3.3Å; W133-V305 WeakPolarHBondContact CZ3-O 3.28Å; V303-V305 HydrophobicContact CG1-CG2 4.15Å; V305-L343 CarbonylContact C-O 3.56Å; V305-L343 VanDerWaalsContact CA-O 3.29Å; V305-L343 WeakPolarHBondContact CA-O 3.35Å; V305-L343 HydrophobicContact CG1-CD2 4.39Å; V305-L343 HydrophobicContact CG2-CB 4.41Å; V305-Y353 WeakPolarHBondContact CG1-O 3.47Å
306	G	89.7	Confident	85.4	Confident	5 Å²	5	37.1 Å²	37.1	5%	0.052	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.9	168.1	174.7	0	0	0	0	0	117.8	I123 L343 L344 G345	I123-G306 CarbonylContact O-C 3.54Å; I123-G306 WeakPolarHBondContact O-CA 3.46Å; G306-L343 PolarHBondContact N-O 2.92Å; G306-L344 WeakPolarHBondContact O-CA 3.43Å; G306-G345 PolarHBondContact O-N 3.41Å
307	E	89.8	Confident	86.6	Confident	27 Å²	27	30 Å²	30	13%	0.126	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	135.3	173.5	-61.6	-171.2	138.7	0	0	110.8	I123 M125 G345 V347 G348 K349 G350 Y353	I123-E307 PolarHBondContact O-N 2.8Å; M125-E307 PolarHBondContact N-O 2.87Å; E307-G345 CarbonylContact C-O 3.55Å; E307-G345 WeakPolarHBondContact CA-O 3.48Å; E307-V347 HydrophobicContact CB-CG1 3.98Å; E307-G348 PolarHBondContact OE1-N 2.95Å; E307-K349 PolarHBondContact OE1-N 3.21Å; E307-G350 VanDerWaalsContact OE1-CA 3.25Å; E307-G350 WeakPolarHBondContact OE1-CA 3.28Å; E307-G350 PolarHBondContact OE1-N 3.43Å; E307-Y353 HydrophobicContact CG-CD2 4.05Å; E307-Y353 HydrophobicContact CG-CE2 4.14Å
308	V	86.4	Confident	87.6	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.006	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	120.9	177.6	-177.6	0	0	0	0	109	M125 I310 L311 L344 G345	M125-V308 HydrophobicContact SD-CG1 4.43Å; V308-I310 HydrophobicContact CG1-CD1 4.37Å; V308-I310 PolarHBondContact O-N 3Å; V308-I310 VanDerWaalsContact O-N 3.07Å; V308-L311 HydrophobicContact CB-CD1 3.75Å; V308-L311 HydrophobicContact CB-CG 4.5Å; V308-L311 HydrophobicContact CG1-CD1 4.12Å; V308-L311 HydrophobicContact CG2-CD1 4.1Å; V308-L311 PolarHBondContact O-N 2.82Å; V308-L344 HydrophobicContact CG2-CB 4.46Å; V308-L344 HydrophobicContact CG2-CD2 4.22Å; V308-G345 PolarHBondContact N-O 3.26Å
309	D	81.6	Confident	88	Confident	59 Å²	59	27.2 Å²	27.2	32%	0.316	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-29.5	-173.7	-70.9	-6.7	0	0	0	115	M125 K126 E127 V347	M125-D309 PolarHBondContact O-N 3.42Å; K126-D309 VanDerWaalsContact CA-OD2 3.25Å; K126-D309 WeakPolarHBondContact CA-OD2 3.3Å; E127-D309 PolarHBondContact N-OD2 3.33Å; D309-V347 WeakPolarHBondContact OD1-CG1 3.3Å
310	I	76.8	Confident	88.2	Confident	49 Å²	49	26.3 Å²	26.3	25%	0.251	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-9.8	-171.9	-58.1	104.5	0	0	0	112.9	M208 K211 V308	M208-I310 VanDerWaalsContact CE-O 3.28Å; M208-I310 WeakPolarHBondContact CE-O 3.28Å; M208-I310 HydrophobicContact CG-CG2 3.92Å; K211-I310 HydrophobicContact CD-CD1 3.32Å; K211-I310 HydrophobicContact CD-CG1 3.84Å; V308-I310 HydrophobicContact CG1-CD1 4.37Å; V308-I310 PolarHBondContact O-N 3Å; V308-I310 VanDerWaalsContact O-N 3.07Å
311	L	80.1	Confident	88.2	Confident	6 Å²	6	26.4 Å²	26.4	3%	0.031	13%	0.133	C	C	.	.			trans	-88.5	111.3	-174.1	-90.9	157.7	0	0	0	111.8	M208 V212 V308 R313 I315 L344 P346	M208-L311 HydrophobicContact CE-CD2 4.22Å; V212-L311 HydrophobicContact CG2-CD1 3.92Å; V212-L311 HydrophobicContact CG2-CG 4.36Å; V308-L311 HydrophobicContact CB-CD1 3.75Å; V308-L311 HydrophobicContact CB-CG 4.5Å; V308-L311 HydrophobicContact CG1-CD1 4.12Å; V308-L311 HydrophobicContact CG2-CD1 4.1Å; V308-L311 PolarHBondContact O-N 2.82Å; L311-R313 VanDerWaalsContact C-N 3.35Å; L311-R313 WeakPolarHBondContact CD2-O 3.3Å; L311-I315 HydrophobicContact CD1-CD1 4.22Å; L311-I315 HydrophobicContact CD2-CD1 3.56Å; L311-I315 HydrophobicContact CD2-CG1 3.77Å; L311-L344 HydrophobicContact CD1-CB 4Å; L311-P346 WeakPolarHBondContact O-CA 3.49Å; L311-P346 WeakPolarHBondContact O-CB 3.41Å; L311-P346 WeakPolarHBondContact O-CD 3.44Å
312	D	76.8	Confident	87.8	Confident	145 Å²	145	27 Å²	27	78%	0.775	14%	0.137	S	C	*	.	S	Bend	trans	-74.5	-25.5	174.9	-68.7	-36.8	0	0	0	113.2
313	R	80.9	Confident	87.5	Confident	160 Å²	160	29.6 Å²	29.6	60%	0.604	15%	0.154	S	C	*	.	S	Bend	trans	-130.8	147.7	179.2	-68.8	-175.4	177.6	170.8	3.3	110.2	D203 L311	D203-R313 IonicContact OD1-NH1 2.81Å; D203-R313 PolarHBondContact OD1-NH1 3Å; D203-R313 IonicContact OD2-CZ 2.82Å; D203-R313 IonicContact OD2-NH1 2.64Å; D203-R313 PolarHBondContact OD2-NH1 3.3Å; L311-R313 VanDerWaalsContact C-N 3.35Å; L311-R313 WeakPolarHBondContact CD2-O 3.3Å
314	P	86.2	Confident	87.1	Confident	69 Å²	69	31 Å²	31	45%	0.448	17%	0.166	S	C	.	.			trans	-70.5	134.3	176.6	29.4	-33.9	0	0	0	111.8	L343 L344	P314-L343 HydrophobicContact CB-CD1 4.38Å; P314-L344 CarbonylContact C-O 3.6Å; P314-L344 VanDerWaalsContact CA-O 3.22Å; P314-L344 WeakPolarHBondContact CA-O 2.97Å
315	I	87.7	Confident	86.8	Confident	8 Å²	8	32 Å²	32	4%	0.041	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	124	168.7	-70.5	175	0	0	0	108.3	L204 V212 L311 L343 L344	L204-I315 HydrophobicContact CD1-CD1 4.49Å; L204-I315 HydrophobicContact CD2-CD1 4.19Å; V212-I315 HydrophobicContact CG1-CD1 4.03Å; V212-I315 HydrophobicContact CG2-CD1 3.92Å; L311-I315 HydrophobicContact CD1-CD1 4.22Å; L311-I315 HydrophobicContact CD2-CD1 3.56Å; L311-I315 HydrophobicContact CD2-CG1 3.77Å; I315-L343 WeakPolarHBondContact O-CA 2.89Å; I315-L344 HydrophobicContact CB-CB 4.47Å; I315-L344 PolarHBondContact N-O 3.2Å; I315-L344 PolarHBondContact O-N 2.88Å
316	V	90.4	Very high	86.5	Confident	12 Å²	12	36.6 Å²	36.6	7%	0.073	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	127.2	174.8	-171.6	0	0	0	0	109.4	C172 T177 F341 I342 L343	C172-V316 HydrophobicContact CB-CB 4.49Å; C172-V316 HydrophobicContact CB-CG1 3.93Å; C172-V316 HydrophobicContact CB-CG2 3.93Å; T177-V316 PolarHBondContact N-O 3.32Å; V316-F341 HydrophobicContact CG1-CE2 3.98Å; V316-F341 HydrophobicContact CG1-CZ 4.18Å; V316-I342 CarbonylContact C-O 3.59Å; V316-I342 WeakPolarHBondContact CA-O 3.28Å; V316-L343 HydrophobicContact CG2-CD1 3.69Å
317	A	91.4	Very high	86.1	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.008	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	129	172.2	0	0	0	0	0	111.1	T177 I194 F341 I342	T177-A317 CarbonylContact O-C 3.58Å; T177-A317 VanDerWaalsContact O-CA 3.31Å; T177-A317 WeakPolarHBondContact O-CA 3.31Å; I194-A317 HydrophobicContact CD1-CB 4.25Å; I194-A317 HydrophobicContact CG1-CB 4.44Å; I194-A317 HydrophobicContact CG2-CB 3.83Å; A317-F341 WeakPolarHBondContact O-CA 3.48Å; A317-I342 HydrophobicContact CB-CB 4.37Å; A317-I342 PolarHBondContact N-O 3.07Å; A317-I342 PolarHBondContact O-N 3.36Å
318	F	93.9	Very high	85.4	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.009	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	124.1	166.6	179.7	-97.8	0	0	0	109.3	L173 T177 V178 L179 L180 F339 F341 M360 L382	L173-F318 HydrophobicContact CD2-CB 3.79Å; L173-F318 HydrophobicContact CD2-CG 4.27Å; T177-F318 PolarHBondContact O-N 3.2Å; V178-F318 WeakPolarHBondContact CA-O 3.26Å; V178-F318 HydrophobicContact CG1-CD1 4.2Å; V178-F318 HydrophobicContact CG2-CB 4.49Å; L179-F318 PolarHBondContact N-O 2.95Å; L180-F318 HydrophobicContact CD2-CD1 4.45Å; L180-F318 HydrophobicContact CD2-CE1 4.15Å; F318-F339 HydrophobicContact CE2-CD1 4.49Å; F318-F339 AromaticContact CZ-CD1 3.85Å; F318-F339 HydrophobicContact CZ-CD1 3.85Å; F318-F339 HydrophobicContact CZ-CE1 4.4Å; F318-F341 HydrophobicContact CB-CD2 4.38Å; F318-F341 HydrophobicContact CD2-CD2 4.18Å; F318-M360 HydrophobicContact CD2-CE 3.47Å; F318-M360 VanDerWaalsContact CD2-CE 3.47Å; F318-M360 HydrophobicContact CE2-CE 3.2Å; F318-M360 HydrophobicContact CZ-CE 4.29Å; F318-L382 HydrophobicContact CD1-CD1 3.66Å; F318-L382 HydrophobicContact CE1-CD1 3.56Å; F318-L382 HydrophobicContact CE1-CD2 4.31Å; F318-L382 HydrophobicContact CZ-CD1 4.4Å
319	V	92.6	Very high	84.6	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	128.3	-173	-177.9	0	0	0	0	110.2	L179 M182 I194 L321 F339 L340	L179-V319 HydrophobicContact CB-CG2 4.39Å; L179-V319 HydrophobicContact CD1-CG2 4.39Å; L179-V319 CarbonylContact O-C 3.59Å; L179-V319 WeakPolarHBondContact O-CA 3.28Å; M182-V319 HydrophobicContact CB-CG1 4.36Å; M182-V319 HydrophobicContact CE-CG1 3.43Å; M182-V319 VanDerWaalsContact CE-CG1 3.43Å; M182-V319 HydrophobicContact SD-CG1 4.18Å; I194-V319 HydrophobicContact CD1-CG2 3.87Å; I194-V319 HydrophobicContact CG1-CG2 4.15Å; V319-L321 HydrophobicContact CG1-CD2 4.35Å; V319-F339 WeakPolarHBondContact O-CA 3.47Å; V319-L340 HydrophobicContact CB-CB 4.22Å; V319-L340 PolarHBondContact N-O 3.23Å; V319-L340 PolarHBondContact O-N 3.46Å
320	R	92.6	Very high	84.5	Confident	3 Å²	3	40.3 Å²	40.3	1%	0.011	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	122	166.1	179.4	178.6	79	-155.9	0.1	109.2	L179 L180 D181 M182 F339 A373 Y374 A376	L179-R320 PolarHBondContact O-N 3.49Å; L180-R320 HydrophobicContact CD2-CB 4Å; D181-R320 WeakPolarHBondContact CA-O 3.22Å; D181-R320 PolarHBondContact N-O 2.96Å; D181-R320 IonicContact OD1-CZ 2.62Å; D181-R320 VanDerWaalsContact OD1-CZ 3.3Å; D181-R320 IonicContact OD1-NE 3.84Å; D181-R320 PolarHBondContact OD1-NE 3.06Å; D181-R320 IonicContact OD1-NH2 2.85Å; D181-R320 PolarHBondContact OD1-NH2 3.03Å; D181-R320 VanDerWaalsContact OD1-NH2 3.07Å; D181-R320 IonicContact OD2-CZ 3.75Å; D181-R320 IonicContact OD2-NE 2.94Å; D181-R320 IonicContact OD2-NH2 2.66Å; D181-R320 PolarHBondContact OD2-NH2 3.42Å; M182-R320 PolarHBondContact N-O 2.79Å; R320-F339 HydrophobicContact CB-CD1 4.11Å; R320-F339 HydrophobicContact CB-CE1 4.1Å; R320-F339 HydrophobicContact CG-CD1 4.14Å; R320-F339 HydrophobicContact CG-CE1 3.75Å; R320-A373 PolarHBondContact NH1-O 3.23Å; R320-Y374 PolarHBondContact NH1-O 2.95Å; R320-Y374 VanDerWaalsContact NH1-O 3.13Å; R320-A376 VanDerWaalsContact CZ-O 3.28Å; R320-A376 PolarHBondContact NH1-O 3.1Å; R320-A376 PolarHBondContact NH2-O 3.01Å
321	L	90.4	Very high	84.6	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.01	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	144.8	175.8	-62.8	171.2	0	0	0	111.1	M182 A184 I190 V319 P323 V325 T337 R338	M182-L321 HydrophobicContact CB-CD2 4.37Å; M182-L321 HydrophobicContact CE-CD2 3.64Å; M182-L321 CarbonylContact O-C 3.51Å; M182-L321 VanDerWaalsContact O-CA 3.31Å; M182-L321 WeakPolarHBondContact O-CA 3.38Å; A184-L321 HydrophobicContact CB-CD2 4.4Å; I190-L321 HydrophobicContact CD1-CD1 4.31Å; I190-L321 HydrophobicContact CD1-CD2 4.19Å; I190-L321 HydrophobicContact CG1-CD2 4.34Å; V319-L321 HydrophobicContact CG1-CD2 4.35Å; L321-P323 VanDerWaalsContact CB-O 3.3Å; L321-P323 WeakPolarHBondContact CB-O 3.33Å; L321-V325 HydrophobicContact CD1-CB 4.5Å; L321-T337 WeakPolarHBondContact CD1-O 3.35Å; L321-R338 PolarHBondContact N-O 3.01Å; L321-R338 WeakPolarHBondContact O-CD 3.18Å; L321-R338 PolarHBondContact O-NE 3.31Å; L321-R338 PolarHBondContact O-NH1 3.28Å; L321-R338 VanDerWaalsContact O-NH1 3.14Å; L321-R338 PolarHBondContact O-NH2 3.32Å
322	S	83.2	Confident	84.3	Confident	15 Å²	15	39.7 Å²	39.7	11%	0.105	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	-46.4	179.6	161.4	0	0	0	0	112.6	M182 R338	M182-S322 PolarHBondContact O-N 3Å; S322-R338 PolarHBondContact O-NH1 3.27Å; S322-R338 PolarHBondContact O-NH2 3.49Å
323	P	86.8	Confident	84.3	Confident	55 Å²	55	33 Å²	33	36%	0.357	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	141.9	155.7	33.2	-29.5	0	0	0	110.4	L321 V325	L321-P323 VanDerWaalsContact CB-O 3.3Å; L321-P323 WeakPolarHBondContact CB-O 3.33Å; P323-V325 HydrophobicContact CG-CG2 4.17Å; P323-V325 PolarHBondContact O-N 2.92Å
324	A	85.6	Confident	84.2	Confident	31 Å²	31	27.9 Å²	27.9	26%	0.256	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	128	167.6	0	0	0	0	0	108.9	E299 P336 T337 R338	E299-A324 HydrophobicContact CG-CB 4.31Å; A324-P336 HydrophobicContact CB-CB 3.83Å; A324-P336 HydrophobicContact CB-CG 4.29Å; A324-T337 WeakPolarHBondContact CA-O 3.43Å; A324-R338 HydrophobicContact CB-CB 4.39Å
325	V	87.6	Confident	84.2	Confident	20 Å²	20	25 Å²	25	12%	0.121	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	136.5	-171.2	177.8	0	0	0	0	110.5	A184 L321 P323 L327 P336 T337	A184-V325 WeakPolarHBondContact O-CG2 3.41Å; L321-V325 HydrophobicContact CD1-CB 4.5Å; P323-V325 HydrophobicContact CG-CG2 4.17Å; P323-V325 PolarHBondContact O-N 2.92Å; V325-L327 HydrophobicContact CG1-CD2 4.25Å; V325-L327 PolarHBondContact O-N 3.49Å; V325-L327 VanDerWaalsContact O-N 3.1Å; V325-P336 CarbonylContact O-C 3.57Å; V325-P336 WeakPolarHBondContact O-CA 3.29Å; V325-T337 PolarHBondContact N-O 2.81Å; V325-T337 PolarHBondContact O-N 2.9Å
326	L	85.3	Confident	84.3	Confident	99 Å²	99	26.9 Å²	26.9	52%	0.518	18%	0.176	S	C	.	.			trans	-76.2	96.5	173.4	-175.1	69.7	0	0	0	109.9	S328 P334	L326-S328 PolarHBondContact O-N 3.47Å; L326-P334 VanDerWaalsContact CD1-C 3.48Å; L326-P334 HydrophobicContact CD1-CB 4.03Å
327	L	83.3	Confident	84.3	Confident	7 Å²	7	26.3 Å²	26.3	4%	0.037	17%	0.173	C	C	.	.			trans	-80.1	104.6	175.4	-64.3	174.8	0	0	0	109.3	I190 V325 G329 L330 T337	I190-L327 HydrophobicContact CD1-CD1 3.87Å; I190-L327 HydrophobicContact CD1-CD2 4.07Å; V325-L327 HydrophobicContact CG1-CD2 4.25Å; V325-L327 PolarHBondContact O-N 3.49Å; V325-L327 VanDerWaalsContact O-N 3.1Å; L327-G329 PolarHBondContact O-N 3.35Å; L327-L330 HydrophobicContact CB-CB 3.92Å; L327-L330 HydrophobicContact CB-CD2 4.1Å; L327-L330 HydrophobicContact CD1-CD2 3.59Å; L327-L330 HydrophobicContact CG-CD2 4.49Å; L327-L330 PolarHBondContact O-N 3.09Å; L327-T337 HydrophobicContact CD1-CG2 4.27Å
328	S	73.7	Confident	84.3	Confident	113 Å²	113	26.7 Å²	26.7	79%	0.79	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	119.4	-178.1	173.3	0	0	0	0	111.2	L326	L326-S328 PolarHBondContact O-N 3.47Å
329	G	71.1	Confident	84.2	Confident	43 Å²	43	26.7 Å²	26.7	44%	0.443	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.2	-8.3	174	0	0	0	0	0	115.1	H220 H222 L327	H220-G329 WeakPolarHBondContact CB-O 3.29Å; H222-G329 PolarHBondContact NE2-O 3.25Å; L327-G329 PolarHBondContact O-N 3.35Å
330	L	79	Confident	84.3	Confident	7 Å²	7	26.7 Å²	26.7	4%	0.037	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-38.5	-179.9	-167.1	76.1	0	0	0	112.7	H220 N302 L304 L327 L340	H220-L330 WeakPolarHBondContact CE1-CD1 3.36Å; H220-L330 WeakPolarHBondContact NE2-CD1 3.24Å; N302-L330 HydrophobicContact CB-CD2 3.86Å; N302-L330 HydrophobicContact CB-CG 4.45Å; N302-L330 VanDerWaalsContact CG-CD2 3.46Å; L304-L330 HydrophobicContact CD1-CD1 4.4Å; L304-L330 HydrophobicContact CD2-CD1 4.47Å; L327-L330 HydrophobicContact CB-CB 3.92Å; L327-L330 HydrophobicContact CB-CD2 4.1Å; L327-L330 HydrophobicContact CD1-CD2 3.59Å; L327-L330 HydrophobicContact CG-CD2 4.49Å; L327-L330 PolarHBondContact O-N 3.09Å; L330-L340 HydrophobicContact CD2-CD1 4.25Å
331	T	77.9	Confident	84.4	Confident	11 Å²	11	26.7 Å²	26.7	7%	0.067	17%	0.174	C	C	.	.	S	Bend	trans	-110.5	147.2	-179.7	46.2	0	0	0	0	111.2	E119 H222 A300 N302 V333	E119-T331 VanDerWaalsContact OE2-CA 3.29Å; E119-T331 WeakPolarHBondContact OE2-CA 3.46Å; E119-T331 WeakPolarHBondContact OE2-CB 3.25Å; E119-T331 WeakPolarHBondContact OE2-CG2 3.47Å; H222-T331 VanDerWaalsContact CE1-C 3.41Å; A300-T331 HydrophobicContact CB-CG2 3.99Å; N302-T331 WeakPolarHBondContact ND2-CG2 3.21Å; N302-T331 WeakPolarHBondContact OD1-CG2 3.48Å; T331-V333 WeakPolarHBondContact CB-O 3.21Å; T331-V333 PolarHBondContact O-N 3.15Å; T331-V333 PolarHBondContact OG1-O 2.91Å
332	E	74.3	Confident	84.5	Confident	30 Å²	30	26.7 Å²	26.7	14%	0.14	17%	0.174	C	C	.	.	S	Bend	trans	-57.6	-34.8	173.8	-179.5	-176.7	-157.6	0	0	111.5	E119 R138 H222 N224	E119-E332 PolarHBondContact OE1-N 3.4Å; E119-E332 PolarHBondContact OE2-N 3.15Å; R138-E332 IonicContact NH1-OE2 2.86Å; R138-E332 PolarHBondContact NH1-OE2 3.21Å; H222-E332 HydrophobicContact CB-CG 4.49Å; H222-E332 PolarHBondContact CE1-N 2.8Å; H222-E332 VanDerWaalsContact CE1-N 3.31Å; H222-E332 PolarHBondContact ND1-N 3.4Å; N224-E332 WeakPolarHBondContact CB-OE1 3.14Å; N224-E332 VanDerWaalsContact CG-OE1 3.28Å; N224-E332 PolarHBondContact ND2-OE1 3.49Å
333	V	76.7	Confident	85	Confident	4 Å²	4	26 Å²	26	2%	0.024	17%	0.17	C	C	.	.	S	Bend	trans	-115.2	136.7	-173	-171.1	0	0	0	0	109.7	F290 M291 I294 T331 I335	F290-V333 HydrophobicContact CD1-CG2 3.71Å; F290-V333 HydrophobicContact CE1-CG2 3.82Å; M291-V333 HydrophobicContact CG-CG1 3.92Å; M291-V333 HydrophobicContact SD-CG1 3.21Å; M291-V333 WeakPolarHBondContact SD-CG1 3.34Å; I294-V333 HydrophobicContact CD1-CG1 4.13Å; I294-V333 HydrophobicContact CD1-CG2 4.38Å; T331-V333 WeakPolarHBondContact CB-O 3.21Å; T331-V333 PolarHBondContact O-N 3.15Å; T331-V333 PolarHBondContact OG1-O 2.91Å; V333-I335 HydrophobicContact CB-CD1 4.08Å; V333-I335 HydrophobicContact CB-CG1 4.18Å; V333-I335 HydrophobicContact CG1-CD1 3.9Å; V333-I335 HydrophobicContact CG1-CG1 3.84Å; V333-I335 PolarHBondContact O-N 3.4Å
334	P	78.4	Confident	85.2	Confident	53 Å²	53	23.4 Å²	23.4	34%	0.344	15%	0.153	S	C	.	.			trans	-73.4	73.5	-176.7	31.6	-37.5	0	0	0	112.3	L326	L326-P334 VanDerWaalsContact CD1-C 3.48Å; L326-P334 HydrophobicContact CD1-CB 4.03Å
335	I	86.1	Confident	85.3	Confident	10 Å²	10	22 Å²	22	5%	0.051	14%	0.14	C	C	.	.			trans	-112.7	136.8	177.9	-59.7	175	0	0	0	107.4	F117 I294 A298 A300 V333 T337	F117-I335 HydrophobicContact CB-CD1 4.23Å; F117-I335 HydrophobicContact CD1-CD1 4.15Å; F117-I335 HydrophobicContact CG-CD1 4.27Å; I294-I335 HydrophobicContact CD1-CD1 3.58Å; I294-I335 HydrophobicContact CG2-CD1 3.93Å; A298-I335 VanDerWaalsContact O-CG2 3.24Å; A298-I335 WeakPolarHBondContact O-CG2 3.47Å; A300-I335 HydrophobicContact CB-CB 4.24Å; A300-I335 HydrophobicContact CB-CG2 3.95Å; V333-I335 HydrophobicContact CB-CD1 4.08Å; V333-I335 HydrophobicContact CB-CG1 4.18Å; V333-I335 HydrophobicContact CG1-CD1 3.9Å; V333-I335 HydrophobicContact CG1-CG1 3.84Å; V333-I335 PolarHBondContact O-N 3.4Å; I335-T337 PolarHBondContact O-N 2.96Å
336	P	89.4	Confident	85.3	Confident	46 Å²	46	22.8 Å²	22.8	30%	0.299	15%	0.146	S	C	.	.			trans	-67.2	128.9	178.2	29.8	-35.8	0	0	0	110.8	E299 A300 A324 V325	E299-P336 CarbonylContact C-O 3.58Å; E299-P336 WeakPolarHBondContact CA-O 3.21Å; A300-P336 PolarHBondContact N-O 3.44Å; A324-P336 HydrophobicContact CB-CB 3.83Å; A324-P336 HydrophobicContact CB-CG 4.29Å; V325-P336 CarbonylContact O-C 3.57Å; V325-P336 WeakPolarHBondContact O-CA 3.29Å
337	T	90.4	Very high	85.2	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	131.9	176.8	-56.8	0	0	0	0	110.2	A300 N302 L321 A324 V325 L327 I335 F339	A300-T337 WeakPolarHBondContact O-CA 3.43Å; N302-T337 HydrophobicContact CB-CG2 4.4Å; N302-T337 WeakPolarHBondContact OD1-CG2 3.29Å; N302-T337 PolarHBondContact OD1-OG1 3.37Å; L321-T337 WeakPolarHBondContact CD1-O 3.35Å; A324-T337 WeakPolarHBondContact CA-O 3.43Å; V325-T337 PolarHBondContact N-O 2.81Å; V325-T337 PolarHBondContact O-N 2.9Å; L327-T337 HydrophobicContact CD1-CG2 4.27Å; I335-T337 PolarHBondContact O-N 2.96Å; T337-F339 WeakPolarHBondContact CG2-O 3.46Å
338	R	91.3	Very high	85.1	Confident	10 Å²	10	24.4 Å²	24.4	4%	0.038	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	-41.5	176.2	-178.4	69.7	-179.7	-172.3	7.9	112.4	E299 A300 L321 S322 A324 Y374	E299-R338 HydrophobicContact CB-CB 4.07Å; E299-R338 WeakPolarHBondContact OE2-CB 3.49Å; E299-R338 WeakPolarHBondContact OE2-CD 3.49Å; E299-R338 WeakPolarHBondContact OE2-CG 3.48Å; A300-R338 PolarHBondContact O-N 3.13Å; L321-R338 PolarHBondContact N-O 3.01Å; L321-R338 WeakPolarHBondContact O-CD 3.18Å; L321-R338 PolarHBondContact O-NE 3.31Å; L321-R338 PolarHBondContact O-NH1 3.28Å; L321-R338 VanDerWaalsContact O-NH1 3.14Å; L321-R338 PolarHBondContact O-NH2 3.32Å; S322-R338 PolarHBondContact O-NH1 3.27Å; S322-R338 PolarHBondContact O-NH2 3.49Å; A324-R338 HydrophobicContact CB-CB 4.39Å; R338-Y374 HydrophobicContact CG-CE1 4.12Å
339	F	93.6	Very high	85.6	Confident	1 Å²	1	24.1 Å²	24.1	0%	0.004	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	141	-177.4	-58.9	-81.4	0	0	0	110.4	L116 A300 S301 N302 F318 V319 R320 T337 M364 A373 Y374	L116-F339 HydrophobicContact CD1-CD2 4.02Å; L116-F339 HydrophobicContact CD1-CE2 4.02Å; L116-F339 HydrophobicContact CD2-CD2 3.88Å; L116-F339 HydrophobicContact CD2-CE2 4.02Å; A300-F339 PolarHBondContact O-N 3.22Å; S301-F339 WeakPolarHBondContact CA-O 3.48Å; N302-F339 PolarHBondContact N-O 2.62Å; F318-F339 HydrophobicContact CE2-CD1 4.49Å; F318-F339 AromaticContact CZ-CD1 3.85Å; F318-F339 HydrophobicContact CZ-CD1 3.85Å; F318-F339 HydrophobicContact CZ-CE1 4.4Å; V319-F339 WeakPolarHBondContact O-CA 3.47Å; R320-F339 HydrophobicContact CB-CD1 4.11Å; R320-F339 HydrophobicContact CB-CE1 4.1Å; R320-F339 HydrophobicContact CG-CD1 4.14Å; R320-F339 HydrophobicContact CG-CE1 3.75Å; T337-F339 WeakPolarHBondContact CG2-O 3.46Å; F339-M364 HydrophobicContact CB-CE 3.94Å; F339-M364 HydrophobicContact CD1-CE 4.08Å; F339-M364 HydrophobicContact CD2-CE 3.56Å; F339-M364 HydrophobicContact CE1-CE 4.48Å; F339-M364 HydrophobicContact CE2-CE 4.03Å; F339-M364 HydrophobicContact CG-CE 3.58Å; F339-M364 HydrophobicContact CZ-CE 4.46Å; F339-A373 HydrophobicContact CE1-CB 3.99Å; F339-A373 HydrophobicContact CZ-CB 4.14Å; F339-Y374 HydrophobicContact CE2-CD2 4.19Å; F339-Y374 HydrophobicContact CE2-CE1 4.15Å; F339-Y374 AromaticContact CE2-CE2 3.64Å; F339-Y374 HydrophobicContact CE2-CE2 3.64Å; F339-Y374 AromaticContact CE2-CZ 3.65Å; F339-Y374 HydrophobicContact CZ-CD1 4.21Å; F339-Y374 AromaticContact CZ-CD2 3.94Å; F339-Y374 HydrophobicContact CZ-CD2 3.94Å; F339-Y374 HydrophobicContact CZ-CE1 4.19Å; F339-Y374 AromaticContact CZ-CE2 3.88Å; F339-Y374 HydrophobicContact CZ-CE2 3.88Å; F339-Y374 HydrophobicContact CZ-CG 4.1Å
340	L	93.1	Very high	86.2	Confident	1 Å²	1	23.3 Å²	23.3	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	124.9	174.6	-174.1	70.6	0	0	0	108.8	I187 I190 N302 L304 V319 L330 I342	I187-L340 HydrophobicContact CD1-CD2 4.24Å; I190-L340 HydrophobicContact CG2-CD2 3.77Å; N302-L340 HydrophobicContact CB-CD1 3.57Å; N302-L340 WeakPolarHBondContact O-CA 3.38Å; L304-L340 HydrophobicContact CD1-CD1 3.89Å; L304-L340 HydrophobicContact CG-CD1 3.99Å; V319-L340 HydrophobicContact CB-CB 4.22Å; V319-L340 PolarHBondContact N-O 3.23Å; V319-L340 PolarHBondContact O-N 3.46Å; L330-L340 HydrophobicContact CD2-CD1 4.25Å; L340-I342 HydrophobicContact CD2-CD1 3.79Å; L340-I342 HydrophobicContact CD2-CG1 4.09Å; L340-I342 HydrophobicContact CG-CD1 4.22Å; L340-I342 HydrophobicContact CG-CG1 3.93Å
341	F	94.9	Very high	86.5	Confident	2 Å²	2	30 Å²	30	1%	0.009	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	126.7	171.7	179.5	-97.3	0	0	0	108.8	L169 L173 N302 V303 L304 V316 A317 F318 L343 I356 M360	L169-F341 HydrophobicContact CD1-CE1 4.47Å; L169-F341 HydrophobicContact CD1-CE2 3.96Å; L169-F341 HydrophobicContact CD1-CZ 3.68Å; L173-F341 HydrophobicContact CD2-CE2 4.33Å; N302-F341 PolarHBondContact O-N 2.92Å; V303-F341 HydrophobicContact CG1-CB 4.46Å; V303-F341 HydrophobicContact CG1-CD1 3.81Å; L304-F341 PolarHBondContact N-O 3.38Å; V316-F341 HydrophobicContact CG1-CE2 3.98Å; V316-F341 HydrophobicContact CG1-CZ 4.18Å; A317-F341 WeakPolarHBondContact O-CA 3.48Å; F318-F341 HydrophobicContact CB-CD2 4.38Å; F318-F341 HydrophobicContact CD2-CD2 4.18Å; F341-L343 HydrophobicContact CE1-CB 3.91Å; F341-L343 HydrophobicContact CZ-CB 4.43Å; F341-I356 HydrophobicContact CE1-CG2 4.49Å; F341-I356 HydrophobicContact CZ-CG2 4.4Å; F341-M360 HydrophobicContact CB-CG 4.1Å; F341-M360 HydrophobicContact CD1-CB 4.3Å; F341-M360 HydrophobicContact CD1-CG 4.04Å; F341-M360 HydrophobicContact CD2-CE 4.31Å; F341-M360 HydrophobicContact CD2-CG 4.02Å; F341-M360 HydrophobicContact CD2-SD 4.43Å; F341-M360 HydrophobicContact CE1-CB 4.36Å; F341-M360 HydrophobicContact CE1-CG 4.44Å; F341-M360 HydrophobicContact CE2-CG 4.44Å; F341-M360 HydrophobicContact CG-CG 3.78Å
342	I	93.4	Very high	86.9	Confident	3 Å²	3	32.9 Å²	32.9	2%	0.015	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	126.9	-178.3	-51.4	-177.2	0	0	0	108.9	I194 L216 L304 V316 A317 L340 L344	I194-I342 HydrophobicContact CD1-CD1 3.62Å; L216-I342 HydrophobicContact CD1-CD1 4.48Å; L216-I342 HydrophobicContact CD2-CD1 3.95Å; L216-I342 HydrophobicContact CD2-CG2 3.85Å; L304-I342 HydrophobicContact CB-CG1 4.43Å; L304-I342 HydrophobicContact CD1-CG1 4.37Å; L304-I342 CarbonylContact O-C 3.58Å; L304-I342 WeakPolarHBondContact O-CA 3.44Å; V316-I342 CarbonylContact C-O 3.59Å; V316-I342 WeakPolarHBondContact CA-O 3.28Å; A317-I342 HydrophobicContact CB-CB 4.37Å; A317-I342 PolarHBondContact N-O 3.07Å; A317-I342 PolarHBondContact O-N 3.36Å; L340-I342 HydrophobicContact CD2-CD1 3.79Å; L340-I342 HydrophobicContact CD2-CG1 4.09Å; L340-I342 HydrophobicContact CG-CD1 4.22Å; L340-I342 HydrophobicContact CG-CG1 3.93Å; I342-L344 HydrophobicContact CG2-CD1 4.31Å; I342-L344 HydrophobicContact CG2-CG 4.11Å
343	L	92.9	Very high	87.7	Confident	1 Å²	1	32 Å²	32	1%	0.005	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	106.3	174	174.4	64.1	0	0	0	109.6	L304 V305 G306 P314 I315 V316 F341 Y353 I356	L304-L343 PolarHBondContact O-N 3.49Å; V305-L343 CarbonylContact C-O 3.56Å; V305-L343 VanDerWaalsContact CA-O 3.29Å; V305-L343 WeakPolarHBondContact CA-O 3.35Å; V305-L343 HydrophobicContact CG1-CD2 4.39Å; V305-L343 HydrophobicContact CG2-CB 4.41Å; G306-L343 PolarHBondContact N-O 2.92Å; P314-L343 HydrophobicContact CB-CD1 4.38Å; I315-L343 WeakPolarHBondContact O-CA 2.89Å; V316-L343 HydrophobicContact CG2-CD1 3.69Å; F341-L343 HydrophobicContact CE1-CB 3.91Å; F341-L343 HydrophobicContact CZ-CB 4.43Å; L343-Y353 HydrophobicContact CD2-CD1 3.93Å; L343-Y353 HydrophobicContact CD2-CG 4.31Å; L343-Y353 HydrophobicContact CG-CD1 4.25Å; L343-I356 HydrophobicContact CD2-CB 3.88Å; L343-I356 HydrophobicContact CD2-CD1 4.09Å; L343-I356 HydrophobicContact CD2-CG2 3.68Å
344	L	90.6	Very high	88.4	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	126.9	175.9	-64.4	173.9	0	0	0	109.3	I123 W133 V212 L216 G306 V308 L311 P314 I315 I342	I123-L344 HydrophobicContact CG2-CD2 4.16Å; W133-L344 HydrophobicContact CH2-CD2 3.97Å; W133-L344 HydrophobicContact CZ2-CD2 4.38Å; V212-L344 HydrophobicContact CG1-CD1 3.98Å; L216-L344 HydrophobicContact CD2-CD1 4.07Å; L216-L344 HydrophobicContact CG-CD1 4.34Å; G306-L344 WeakPolarHBondContact O-CA 3.43Å; V308-L344 HydrophobicContact CG2-CB 4.46Å; V308-L344 HydrophobicContact CG2-CD2 4.22Å; L311-L344 HydrophobicContact CD1-CB 4Å; P314-L344 CarbonylContact C-O 3.6Å; P314-L344 VanDerWaalsContact CA-O 3.22Å; P314-L344 WeakPolarHBondContact CA-O 2.97Å; I315-L344 HydrophobicContact CB-CB 4.47Å; I315-L344 PolarHBondContact N-O 3.2Å; I315-L344 PolarHBondContact O-N 2.88Å; I342-L344 HydrophobicContact CG2-CD1 4.31Å; I342-L344 HydrophobicContact CG2-CG 4.11Å
345	G	89.3	Confident	88.9	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	175.4	-177.6	0	0	0	0	0	115.1	G306 E307 V308	G306-G345 PolarHBondContact O-N 3.41Å; E307-G345 CarbonylContact C-O 3.55Å; E307-G345 WeakPolarHBondContact CA-O 3.48Å; V308-G345 PolarHBondContact N-O 3.26Å
346	P	87.7	Confident	89.2	Confident	37 Å²	37	32.4 Å²	32.4	24%	0.24	19%	0.187	C	C	.	.			trans	-58.8	152.3	173.6	17.5	-28.9	0	0	0	112	L311 Y353	L311-P346 WeakPolarHBondContact O-CA 3.49Å; L311-P346 WeakPolarHBondContact O-CB 3.41Å; L311-P346 WeakPolarHBondContact O-CD 3.44Å; P346-Y353 VanDerWaalsContact CD-OH 3.29Å; P346-Y353 WeakPolarHBondContact CD-OH 3.37Å; P346-Y353 WeakPolarHBondContact O-CE2 3.45Å; P346-Y353 PolarHBondContact O-OH 3.47Å
347	V	82.6	Confident	89.3	Confident	68 Å²	68	30.2 Å²	30.2	41%	0.412	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	147.3	172.5	-77.6	0	0	0	0	113.5	E307 D309	E307-V347 HydrophobicContact CB-CG1 3.98Å; D309-V347 WeakPolarHBondContact OD1-CG1 3.3Å
348	G	81.6	Confident	89.4	Confident	72 Å²	72	31.3 Å²	31.3	74%	0.742	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	105.1	0.9	176.1	0	0	0	0	0	114.3	E307	E307-G348 PolarHBondContact OE1-N 2.95Å
349	K	83.2	Confident	89.4	Confident	108 Å²	108	30.8 Å²	30.8	47%	0.47	18%	0.175	S	C	.	.			trans	-128	17	-179.1	-72	-173.3	172.9	-165.6	0	113.7	E307 Q351 Q352 Y353	E307-K349 PolarHBondContact OE1-N 3.21Å; K349-Q351 VanDerWaalsContact C-N 3.29Å; K349-Q351 PolarHBondContact O-N 3.22Å; K349-Q351 VanDerWaalsContact O-N 3.17Å; K349-Q352 VanDerWaalsContact CD-OE1 3.32Å; K349-Q352 WeakPolarHBondContact O-CA 3.29Å; K349-Q352 WeakPolarHBondContact O-CB 3.47Å; K349-Q352 PolarHBondContact O-N 2.91Å; K349-Y353 HydrophobicContact CB-CD2 4.34Å; K349-Y353 HydrophobicContact CB-CE1 4.08Å; K349-Y353 HydrophobicContact CB-CE2 3.75Å; K349-Y353 PolarHBondContact O-N 3.44Å
350	G	83.1	Confident	89.4	Confident	26 Å²	26	30.9 Å²	30.9	27%	0.268	18%	0.175	S	C	.	.	H	α-helix	trans	-54	-41.5	-172.6	0	0	0	0	0	113.9	E307 Q352 Y353 H354	E307-G350 VanDerWaalsContact OE1-CA 3.25Å; E307-G350 WeakPolarHBondContact OE1-CA 3.28Å; E307-G350 PolarHBondContact OE1-N 3.43Å; G350-Q352 VanDerWaalsContact C-N 3.34Å; G350-Q352 PolarHBondContact O-N 3.28Å; G350-Y353 PolarHBondContact O-N 3.03Å; G350-H354 WeakPolarHBondContact O-CB 3.36Å; G350-H354 PolarHBondContact O-N 3.16Å
351	Q	85.1	Confident	89.3	Confident	146 Å²	146	30.8 Å²	30.8	68%	0.682	18%	0.175	S	C	*	.	H	α-helix	trans	-63.6	-37.2	175.8	-70.3	-65	-19.3	0	0	112.9	K349 H354 E355	K349-Q351 VanDerWaalsContact C-N 3.29Å; K349-Q351 PolarHBondContact O-N 3.22Å; K349-Q351 VanDerWaalsContact O-N 3.17Å; Q351-H354 PolarHBondContact O-N 3.39Å; Q351-E355 WeakPolarHBondContact O-CB 3.45Å; Q351-E355 WeakPolarHBondContact O-CG 3.15Å; Q351-E355 PolarHBondContact O-N 3.05Å
352	Q	87.6	Confident	89	Confident	72 Å²	72	30.8 Å²	30.8	34%	0.336	18%	0.175	S	C	.	.	H	α-helix	trans	-67	-42.5	175.5	-64.9	176.8	-14.1	0	0	110.4	K349 G350 E355 I356	K349-Q352 VanDerWaalsContact CD-OE1 3.32Å; K349-Q352 WeakPolarHBondContact O-CA 3.29Å; K349-Q352 WeakPolarHBondContact O-CB 3.47Å; K349-Q352 PolarHBondContact O-N 2.91Å; G350-Q352 VanDerWaalsContact C-N 3.34Å; G350-Q352 PolarHBondContact O-N 3.28Å; Q352-E355 PolarHBondContact O-N 3.11Å; Q352-I356 VanDerWaalsContact O-CG1 3.24Å; Q352-I356 WeakPolarHBondContact O-CG1 3.31Å; Q352-I356 PolarHBondContact O-N 3.01Å
353	Y	90.6	Very high	88.9	Confident	13 Å²	13	30.7 Å²	30.7	5%	0.051	17%	0.174	C	C	.	.	H	α-helix	trans	-64.4	-42.8	177.3	-55	-38.1	0	0	0	111.6	V305 E307 L343 P346 K349 G350 E355 I356 G357	V305-Y353 WeakPolarHBondContact CG1-O 3.47Å; E307-Y353 HydrophobicContact CG-CD2 4.05Å; E307-Y353 HydrophobicContact CG-CE2 4.14Å; L343-Y353 HydrophobicContact CD2-CD1 3.93Å; L343-Y353 HydrophobicContact CD2-CG 4.31Å; L343-Y353 HydrophobicContact CG-CD1 4.25Å; P346-Y353 VanDerWaalsContact CD-OH 3.29Å; P346-Y353 WeakPolarHBondContact CD-OH 3.37Å; P346-Y353 WeakPolarHBondContact O-CE2 3.45Å; P346-Y353 PolarHBondContact O-OH 3.47Å; K349-Y353 HydrophobicContact CB-CD2 4.34Å; K349-Y353 HydrophobicContact CB-CE1 4.08Å; K349-Y353 HydrophobicContact CB-CE2 3.75Å; K349-Y353 PolarHBondContact O-N 3.44Å; G350-Y353 PolarHBondContact O-N 3.03Å; Y353-E355 VanDerWaalsContact C-N 3.35Å; Y353-E355 PolarHBondContact O-N 3.16Å; Y353-I356 HydrophobicContact CD1-CD1 4.45Å; Y353-I356 PolarHBondContact O-N 3.48Å; Y353-G357 PolarHBondContact O-N 3.15Å
354	H	90.8	Very high	88.7	Confident	26 Å²	26	30.7 Å²	30.7	12%	0.12	17%	0.174	C	C	.	.	H	α-helix	trans	-55.1	-50.2	173.3	170.7	74.1	0	0	0	111	E122 G350 Q351 I356 G357 R358	E122-H354 IonicContact OE1-CE1 3.99Å; E122-H354 PolarHBondContact OE1-CE1 3.06Å; E122-H354 IonicContact OE1-CG 2.87Å; E122-H354 IonicContact OE1-ND1 2.75Å; E122-H354 PolarHBondContact OE1-ND1 2.81Å; G350-H354 WeakPolarHBondContact O-CB 3.36Å; G350-H354 PolarHBondContact O-N 3.16Å; Q351-H354 PolarHBondContact O-N 3.39Å; H354-I356 VanDerWaalsContact C-N 3.32Å; H354-I356 PolarHBondContact O-N 2.86Å; H354-G357 PolarHBondContact O-N 2.65Å; H354-R358 PolarHBondContact CD2-NH1 2.94Å; H354-R358 VanDerWaalsContact CD2-NH1 3.32Å; H354-R358 PolarHBondContact NE2-NH1 3.4Å; H354-R358 WeakPolarHBondContact O-CB 3.19Å; H354-R358 PolarHBondContact O-N 3.42Å
355	E	89.5	Confident	88.4	Confident	42 Å²	42	32 Å²	32	20%	0.196	18%	0.183	C	C	.	.	H	α-helix	trans	-61	-36.4	177.8	-72.3	-77.9	150.9	0	0	113.2	S162 S165 Q351 Q352 Y353 R358 S359	S162-E355 PolarHBondContact OG-OE2 3.43Å; S165-E355 WeakPolarHBondContact CB-O 3.28Å; S165-E355 PolarHBondContact OG-O 3.16Å; Q351-E355 WeakPolarHBondContact O-CB 3.45Å; Q351-E355 WeakPolarHBondContact O-CG 3.15Å; Q351-E355 PolarHBondContact O-N 3.05Å; Q352-E355 PolarHBondContact O-N 3.11Å; Y353-E355 VanDerWaalsContact C-N 3.35Å; Y353-E355 PolarHBondContact O-N 3.16Å; E355-R358 VanDerWaalsContact CD-CZ 3.49Å; E355-R358 IonicContact OE1-CZ 2.74Å; E355-R358 IonicContact OE1-NH1 3.3Å; E355-R358 PolarHBondContact OE1-NH1 2.94Å; E355-R358 IonicContact OE1-NH2 2.82Å; E355-R358 PolarHBondContact OE1-NH2 2.95Å; E355-R358 IonicContact OE2-CZ 3.72Å; E355-R358 IonicContact OE2-NH1 3.96Å; E355-R358 IonicContact OE2-NH2 3.07Å; E355-R358 PolarHBondContact OE2-NH2 3.25Å; E355-S359 WeakPolarHBondContact O-CB 3.18Å; E355-S359 PolarHBondContact O-N 3.16Å; E355-S359 PolarHBondContact O-OG 3.34Å
356	I	92.1	Very high	88.1	Confident	6 Å²	6	32.4 Å²	32.4	3%	0.031	19%	0.185	C	C	.	.	H	α-helix	trans	-68	-44.9	175	-67.3	162.7	0	0	0	110.4	E168 L169 F341 L343 Q352 Y353 H354 S359 M360	E168-I356 HydrophobicContact CB-CD1 3.82Å; E168-I356 HydrophobicContact CB-CG1 3.93Å; L169-I356 HydrophobicContact CB-CG2 4.14Å; L169-I356 HydrophobicContact CD1-CG2 3.96Å; F341-I356 HydrophobicContact CE1-CG2 4.49Å; F341-I356 HydrophobicContact CZ-CG2 4.4Å; L343-I356 HydrophobicContact CD2-CB 3.88Å; L343-I356 HydrophobicContact CD2-CD1 4.09Å; L343-I356 HydrophobicContact CD2-CG2 3.68Å; Q352-I356 VanDerWaalsContact O-CG1 3.24Å; Q352-I356 WeakPolarHBondContact O-CG1 3.31Å; Q352-I356 PolarHBondContact O-N 3.01Å; Y353-I356 HydrophobicContact CD1-CD1 4.45Å; Y353-I356 PolarHBondContact O-N 3.48Å; H354-I356 VanDerWaalsContact C-N 3.32Å; H354-I356 PolarHBondContact O-N 2.86Å; I356-S359 WeakPolarHBondContact O-CB 3.24Å; I356-S359 PolarHBondContact O-N 3.38Å; I356-M360 PolarHBondContact O-N 2.99Å
357	G	92.2	Very high	87.7	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-59.8	-46.5	175	0	0	0	0	0	112.1	Y353 H354 S359 M360 A361	Y353-G357 PolarHBondContact O-N 3.15Å; H354-G357 PolarHBondContact O-N 2.65Å; G357-S359 VanDerWaalsContact C-N 3.32Å; G357-S359 PolarHBondContact O-N 2.96Å; G357-M360 PolarHBondContact O-N 2.91Å; G357-M360 VanDerWaalsContact O-N 3.17Å; G357-A361 WeakPolarHBondContact O-CB 3.49Å; G357-A361 PolarHBondContact O-N 3.18Å
358	R	91.9	Very high	87.8	Confident	23 Å²	23	30.4 Å²	30.4	9%	0.087	17%	0.168	C	C	.	.	H	α-helix	trans	-60.8	-40.7	176.6	-151	171.8	75.9	-124.8	-4.1	112.2	L120 W139 E143 T160 H354 E355 T362	L120-R358 HydrophobicContact CD2-CB 4.48Å; W139-R358 HydrophobicContact CH2-CG 3.91Å; W139-R358 HydrophobicContact CZ2-CG 3.52Å; E143-R358 WeakPolarHBondContact OE1-CD 3.3Å; E143-R358 WeakPolarHBondContact OE1-CG 3.15Å; E143-R358 IonicContact OE1-NE 2.72Å; T160-R358 PolarHBondContact O-NH2 3.46Å; H354-R358 PolarHBondContact CD2-NH1 2.94Å; H354-R358 VanDerWaalsContact CD2-NH1 3.32Å; H354-R358 PolarHBondContact NE2-NH1 3.4Å; H354-R358 WeakPolarHBondContact O-CB 3.19Å; H354-R358 PolarHBondContact O-N 3.42Å; E355-R358 VanDerWaalsContact CD-CZ 3.49Å; E355-R358 IonicContact OE1-CZ 2.74Å; E355-R358 IonicContact OE1-NH1 3.3Å; E355-R358 PolarHBondContact OE1-NH1 2.94Å; E355-R358 IonicContact OE1-NH2 2.82Å; E355-R358 PolarHBondContact OE1-NH2 2.95Å; E355-R358 IonicContact OE2-CZ 3.72Å; E355-R358 IonicContact OE2-NH1 3.96Å; E355-R358 IonicContact OE2-NH2 3.07Å; E355-R358 PolarHBondContact OE2-NH2 3.25Å; R358-T362 VanDerWaalsContact O-CB 3.29Å; R358-T362 WeakPolarHBondContact O-CB 3.31Å; R358-T362 PolarHBondContact O-N 3.13Å; R358-T362 PolarHBondContact O-OG1 2.78Å
359	S	91.6	Very high	88.1	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61.6	-45.8	172.6	-82.7	0	0	0	0	112.5	S165 E355 I356 G357 T362 I363	S165-S359 PolarHBondContact OG-OG 3.49Å; E355-S359 WeakPolarHBondContact O-CB 3.18Å; E355-S359 PolarHBondContact O-N 3.16Å; E355-S359 PolarHBondContact O-OG 3.34Å; I356-S359 WeakPolarHBondContact O-CB 3.24Å; I356-S359 PolarHBondContact O-N 3.38Å; G357-S359 VanDerWaalsContact C-N 3.32Å; G357-S359 PolarHBondContact O-N 2.96Å; S359-T362 PolarHBondContact O-N 3.25Å; S359-I363 WeakPolarHBondContact O-CB 3.32Å; S359-I363 WeakPolarHBondContact O-CD1 3.02Å; S359-I363 VanDerWaalsContact O-CG1 3.28Å; S359-I363 WeakPolarHBondContact O-CG1 3.16Å; S359-I363 PolarHBondContact O-N 3.24Å
360	M	92.9	Very high	88.2	Confident	2 Å²	2	23 Å²	23	1%	0.01	12%	0.116	C	C	.	.	H	α-helix	trans	-63.2	-47.9	177.1	-175.8	58	-174.6	0	0	111.6	L169 F318 F341 I356 G357 T362 I363 M364	L169-M360 HydrophobicContact CD1-CB 3.91Å; L169-M360 HydrophobicContact CD1-CG 4.35Å; L169-M360 HydrophobicContact CD1-SD 4.1Å; L169-M360 HydrophobicContact CD2-CB 4.06Å; L169-M360 HydrophobicContact CD2-SD 4.15Å; F318-M360 HydrophobicContact CD2-CE 3.47Å; F318-M360 VanDerWaalsContact CD2-CE 3.47Å; F318-M360 HydrophobicContact CE2-CE 3.2Å; F318-M360 HydrophobicContact CZ-CE 4.29Å; F341-M360 HydrophobicContact CB-CG 4.1Å; F341-M360 HydrophobicContact CD1-CB 4.3Å; F341-M360 HydrophobicContact CD1-CG 4.04Å; F341-M360 HydrophobicContact CD2-CE 4.31Å; F341-M360 HydrophobicContact CD2-CG 4.02Å; F341-M360 HydrophobicContact CD2-SD 4.43Å; F341-M360 HydrophobicContact CE1-CB 4.36Å; F341-M360 HydrophobicContact CE1-CG 4.44Å; F341-M360 HydrophobicContact CE2-CG 4.44Å; F341-M360 HydrophobicContact CG-CG 3.78Å; I356-M360 PolarHBondContact O-N 2.99Å; G357-M360 PolarHBondContact O-N 2.91Å; G357-M360 VanDerWaalsContact O-N 3.17Å; M360-T362 VanDerWaalsContact C-N 3.29Å; M360-T362 PolarHBondContact O-N 3.47Å; M360-I363 PolarHBondContact O-N 3.03Å; M360-M364 HydrophobicContact CE-CG 3.92Å; M360-M364 HydrophobicContact CE-SD 3.76Å; M360-M364 VanDerWaalsContact O-CG 3.31Å; M360-M364 WeakPolarHBondContact O-CG 3.44Å; M360-M364 PolarHBondContact O-N 2.77Å
361	A	91.5	Very high	88.3	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-60.1	-40.5	178.9	0	0	0	0	0	111.8	W139 V303 G357 M364	W139-A361 HydrophobicContact CD2-CB 3.93Å; W139-A361 HydrophobicContact CE3-CB 3.51Å; W139-A361 HydrophobicContact CH2-CB 3.6Å; W139-A361 HydrophobicContact CZ2-CB 3.95Å; W139-A361 HydrophobicContact CZ3-CB 3.36Å; V303-A361 HydrophobicContact CG2-CB 4Å; G357-A361 WeakPolarHBondContact O-CB 3.49Å; G357-A361 PolarHBondContact O-N 3.18Å; A361-M364 PolarHBondContact O-N 2.97Å
362	T	89.6	Confident	88.5	Confident	2 Å²	2	15.7 Å²	15.7	1%	0.012	8%	0.075	C	C	.	.	H	α-helix	trans	-69.1	-42.1	178	-59.5	0	0	0	0	112.1	V52 W139 A159 L161 R358 S359 M360 M364 T365	V52-T362 HydrophobicContact CB-CG2 4.18Å; V52-T362 HydrophobicContact CG1-CG2 3.99Å; V52-T362 HydrophobicContact CG2-CG2 3.73Å; W139-T362 PolarHBondContact NE1-OG1 3.48Å; A159-T362 HydrophobicContact CB-CG2 3.79Å; L161-T362 HydrophobicContact CD1-CG2 3.85Å; L161-T362 HydrophobicContact CD2-CG2 4.47Å; L161-T362 HydrophobicContact CG-CG2 4.32Å; R358-T362 VanDerWaalsContact O-CB 3.29Å; R358-T362 WeakPolarHBondContact O-CB 3.31Å; R358-T362 PolarHBondContact O-N 3.13Å; R358-T362 PolarHBondContact O-OG1 2.78Å; S359-T362 PolarHBondContact O-N 3.25Å; M360-T362 VanDerWaalsContact C-N 3.29Å; M360-T362 PolarHBondContact O-N 3.47Å; T362-M364 VanDerWaalsContact C-N 3.3Å; T362-M364 PolarHBondContact O-N 3.38Å; T362-T365 PolarHBondContact O-N 3.03Å; T362-T365 VanDerWaalsContact O-N 3.11Å; T362-T365 PolarHBondContact O-OG1 3.36Å
363	I	90.3	Very high	88.6	Confident	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-63.5	-36.9	177	-73.2	163.8	0	0	0	111.3	L166 L169 S359 M360 T365 D366 F369 F389	L166-I363 HydrophobicContact CD2-CD1 3.33Å; L166-I363 HydrophobicContact CD2-CG1 4.09Å; L169-I363 HydrophobicContact CD2-CD1 3.55Å; S359-I363 WeakPolarHBondContact O-CB 3.32Å; S359-I363 WeakPolarHBondContact O-CD1 3.02Å; S359-I363 VanDerWaalsContact O-CG1 3.28Å; S359-I363 WeakPolarHBondContact O-CG1 3.16Å; S359-I363 PolarHBondContact O-N 3.24Å; M360-I363 PolarHBondContact O-N 3.03Å; I363-T365 PolarHBondContact O-N 3.03Å; I363-T365 VanDerWaalsContact O-N 3.16Å; I363-D366 PolarHBondContact O-N 3.46Å; I363-F369 HydrophobicContact CG2-CB 3.79Å; I363-F369 HydrophobicContact CG2-CD1 3.28Å; I363-F369 HydrophobicContact CG2-CD2 3.62Å; I363-F369 HydrophobicContact CG2-CE1 3.64Å; I363-F369 HydrophobicContact CG2-CE2 3.99Å; I363-F369 HydrophobicContact CG2-CG 3.23Å; I363-F369 HydrophobicContact CG2-CZ 3.98Å; I363-F389 HydrophobicContact CD1-CD1 4.23Å; I363-F389 HydrophobicContact CD1-CE1 4.27Å; I363-F389 HydrophobicContact CG1-CD1 3.84Å; I363-F389 HydrophobicContact CG1-CD2 4.47Å; I363-F389 HydrophobicContact CG1-CE1 3.66Å; I363-F389 HydrophobicContact CG1-CE2 4.32Å; I363-F389 HydrophobicContact CG1-CG 4.24Å; I363-F389 HydrophobicContact CG1-CZ 3.91Å
364	M	88.9	Confident	88.5	Confident	1 Å²	1	11.8 Å²	11.8	1%	0.005	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-17.9	175.3	-69.7	-63.1	-66.6	0	0	113.7	L116 T118 F339 M360 A361 T362 F369	L116-M364 HydrophobicContact CD1-CE 3.56Å; T118-M364 HydrophobicContact CG2-CB 3.79Å; F339-M364 HydrophobicContact CB-CE 3.94Å; F339-M364 HydrophobicContact CD1-CE 4.08Å; F339-M364 HydrophobicContact CD2-CE 3.56Å; F339-M364 HydrophobicContact CE1-CE 4.48Å; F339-M364 HydrophobicContact CE2-CE 4.03Å; F339-M364 HydrophobicContact CG-CE 3.58Å; F339-M364 HydrophobicContact CZ-CE 4.46Å; M360-M364 HydrophobicContact CE-CG 3.92Å; M360-M364 HydrophobicContact CE-SD 3.76Å; M360-M364 VanDerWaalsContact O-CG 3.31Å; M360-M364 WeakPolarHBondContact O-CG 3.44Å; M360-M364 PolarHBondContact O-N 2.77Å; A361-M364 PolarHBondContact O-N 2.97Å; T362-M364 VanDerWaalsContact C-N 3.3Å; T362-M364 PolarHBondContact O-N 3.38Å; M364-F369 HydrophobicContact SD-CD1 3.98Å; M364-F369 HydrophobicContact SD-CE1 3.6Å; M364-F369 VanDerWaalsContact SD-CE1 3.6Å
365	T	83.6	Confident	88.3	Confident	28 Å²	28	13.1 Å²	13.1	17%	0.172	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-14.1	174.2	70	0	0	0	0	114.1	W139 T362 I363	W139-T365 HydrophobicContact CB-CG2 3.5Å; W139-T365 HydrophobicContact CG-CG2 3.99Å; T362-T365 PolarHBondContact O-N 3.03Å; T362-T365 VanDerWaalsContact O-N 3.11Å; T362-T365 PolarHBondContact O-OG1 3.36Å; I363-T365 PolarHBondContact O-N 3.03Å; I363-T365 VanDerWaalsContact O-N 3.16Å
366	D	84.7	Confident	88.2	Confident	8 Å²	8	11.1 Å²	11.1	4%	0.043	5%	0.053	C	C	.	.	S	Bend	trans	-76.3	132.9	178.2	-179.1	66.8	0	0	0	111.2	I363 I368 F369 H370 F389 Q416	I363-D366 PolarHBondContact O-N 3.46Å; D366-I368 VanDerWaalsContact C-N 3.26Å; D366-I368 PolarHBondContact O-N 3.42Å; D366-I368 WeakPolarHBondContact OD2-CB 3.46Å; D366-I368 PolarHBondContact OD2-N 2.86Å; D366-F369 HydrophobicContact CB-CB 4.45Å; D366-F369 PolarHBondContact O-N 3.3Å; D366-F369 PolarHBondContact OD2-N 3.07Å; D366-H370 WeakPolarHBondContact O-CB 3.48Å; D366-H370 PolarHBondContact O-N 3.31Å; D366-F389 HydrophobicContact CB-CD2 4.29Å; D366-F389 HydrophobicContact CB-CE2 4.3Å; D366-Q416 PolarHBondContact OD1-NE2 2.88Å
367	E	79.3	Confident	87.9	Confident	58 Å²	58	18.2 Å²	18.2	27%	0.271	8%	0.084	S	C	.	.	H	α-helix	trans	-61.7	-30.2	-175.3	-70.9	174.8	-163.7	0	0	113.2	P55 D371	P55-E367 HydrophobicContact CB-CG 3.85Å; E367-D371 WeakPolarHBondContact O-CB 3.36Å; E367-D371 PolarHBondContact O-N 2.82Å
368	I	83.3	Confident	87.6	Confident	6 Å²	6	23.9 Å²	23.9	3%	0.031	11%	0.11	C	C	.	.	H	α-helix	trans	-79.5	-51.6	-178.6	-63.3	164.3	0	0	0	109.7	V99 L103 D366 H370 D371 V372 E388 R419	V99-I368 HydrophobicContact CG1-CG2 3.72Å; L103-I368 HydrophobicContact CD1-CG2 4.38Å; D366-I368 VanDerWaalsContact C-N 3.26Å; D366-I368 PolarHBondContact O-N 3.42Å; D366-I368 WeakPolarHBondContact OD2-CB 3.46Å; D366-I368 PolarHBondContact OD2-N 2.86Å; I368-H370 VanDerWaalsContact C-N 3.29Å; I368-H370 PolarHBondContact O-N 2.64Å; I368-D371 PolarHBondContact O-N 2.81Å; I368-V372 HydrophobicContact CG2-CG2 4.41Å; I368-V372 VanDerWaalsContact O-CG2 3.28Å; I368-V372 WeakPolarHBondContact O-CG2 3.34Å; I368-V372 PolarHBondContact O-N 3.25Å; I368-E388 HydrophobicContact CG2-CG 4.48Å; I368-R419 HydrophobicContact CD1-CB 3.83Å; I368-R419 HydrophobicContact CD1-CG 4.19Å
369	F	88.1	Confident	87.4	Confident	2 Å²	2	27.3 Å²	27.3	1%	0.009	12%	0.123	C	C	.	.	H	α-helix	trans	-62.7	-41.5	-179.8	-173.9	-91.9	0	0	0	111.4	I363 M364 D366 D371 V372 A373 L382 I386	I363-F369 HydrophobicContact CG2-CB 3.79Å; I363-F369 HydrophobicContact CG2-CD1 3.28Å; I363-F369 HydrophobicContact CG2-CD2 3.62Å; I363-F369 HydrophobicContact CG2-CE1 3.64Å; I363-F369 HydrophobicContact CG2-CE2 3.99Å; I363-F369 HydrophobicContact CG2-CG 3.23Å; I363-F369 HydrophobicContact CG2-CZ 3.98Å; M364-F369 HydrophobicContact SD-CD1 3.98Å; M364-F369 HydrophobicContact SD-CE1 3.6Å; M364-F369 VanDerWaalsContact SD-CE1 3.6Å; D366-F369 HydrophobicContact CB-CB 4.45Å; D366-F369 PolarHBondContact O-N 3.3Å; D366-F369 PolarHBondContact OD2-N 3.07Å; F369-D371 PolarHBondContact O-N 3.49Å; F369-V372 CarbonylContact O-C 3.55Å; F369-V372 PolarHBondContact O-N 2.88Å; F369-A373 HydrophobicContact CE1-CB 4.39Å; F369-A373 WeakPolarHBondContact O-CB 3.42Å; F369-A373 PolarHBondContact O-N 2.93Å; F369-L382 WeakPolarHBondContact CE2-O 3.38Å; F369-L382 HydrophobicContact CZ-CD2 4.27Å; F369-I386 HydrophobicContact CD2-CG1 4.34Å; F369-I386 HydrophobicContact CE2-CD1 4.48Å; F369-I386 HydrophobicContact CE2-CG1 3.64Å; F369-I386 HydrophobicContact CZ-CG1 4.26Å
370	H	86.3	Confident	87.2	Confident	23 Å²	23	31.1 Å²	31.1	11%	0.106	14%	0.144	C	C	.	.	H	α-helix	trans	-49.2	-56.2	169.9	163.1	-103.1	0	0	0	112.2	P113 H114 D366 I368 V372 A373 Y374	P113-H370 VanDerWaalsContact CB-CE1 3.41Å; P113-H370 WeakPolarHBondContact CB-CE1 3.43Å; H114-H370 PolarHBondContact O-NE2 3.04Å; D366-H370 WeakPolarHBondContact O-CB 3.48Å; D366-H370 PolarHBondContact O-N 3.31Å; I368-H370 VanDerWaalsContact C-N 3.29Å; I368-H370 PolarHBondContact O-N 2.64Å; H370-V372 VanDerWaalsContact C-N 3.3Å; H370-V372 PolarHBondContact O-N 2.98Å; H370-A373 WeakPolarHBondContact O-CB 3.3Å; H370-A373 PolarHBondContact O-N 2.64Å; H370-A373 VanDerWaalsContact O-N 3.13Å; H370-Y374 AromaticContact CD2-CE2 3.55Å; H370-Y374 AromaticContact NE2-CD2 3.95Å; H370-Y374 AromaticContact NE2-CE2 3.3Å; H370-Y374 VanDerWaalsContact NE2-CE2 3.3Å; H370-Y374 WeakPolarHBondContact NE2-CE2 3.35Å; H370-Y374 VanDerWaalsContact O-CD2 3.3Å; H370-Y374 WeakPolarHBondContact O-CD2 2.89Å; H370-Y374 PolarHBondContact O-N 3.42Å; H370-Y374 VanDerWaalsContact O-N 3.16Å
371	D	85.7	Confident	87	Confident	18 Å²	18	31.9 Å²	31.9	10%	0.096	15%	0.148	C	C	.	.	H	α-helix	trans	-64.2	-36.9	-178.7	-72.2	-0	0	0	0	111.6	L103 P113 E367 I368 F369 Y374 K375 K420	L103-D371 HydrophobicContact CD2-CB 3.49Å; L103-D371 VanDerWaalsContact CD2-CB 3.49Å; P113-D371 WeakPolarHBondContact CB-OD1 3.31Å; E367-D371 WeakPolarHBondContact O-CB 3.36Å; E367-D371 PolarHBondContact O-N 2.82Å; I368-D371 PolarHBondContact O-N 2.81Å; F369-D371 PolarHBondContact O-N 3.49Å; D371-Y374 PolarHBondContact O-N 2.9Å; D371-K375 WeakPolarHBondContact O-CG 3.06Å; D371-K375 PolarHBondContact O-N 3.04Å; D371-K375 VanDerWaalsContact O-N 3.16Å; D371-K420 WeakPolarHBondContact OD2-CE 3.35Å; D371-K420 IonicContact OD2-NZ 3.12Å; D371-K420 PolarHBondContact OD2-NZ 3.35Å
372	V	88.5	Confident	86.9	Confident	0 Å²	0	32 Å²	32	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.6	-42.2	173.9	172.1	0	0	0	0	110.7	V99 L103 I368 F369 H370 Y374 K375 A376 D381	V99-V372 HydrophobicContact CG1-CG2 3.77Å; V99-V372 HydrophobicContact CG2-CG2 4.42Å; L103-V372 HydrophobicContact CD2-CG2 4.49Å; I368-V372 HydrophobicContact CG2-CG2 4.41Å; I368-V372 VanDerWaalsContact O-CG2 3.28Å; I368-V372 WeakPolarHBondContact O-CG2 3.34Å; I368-V372 PolarHBondContact O-N 3.25Å; F369-V372 CarbonylContact O-C 3.55Å; F369-V372 PolarHBondContact O-N 2.88Å; H370-V372 VanDerWaalsContact C-N 3.3Å; H370-V372 PolarHBondContact O-N 2.98Å; V372-Y374 VanDerWaalsContact C-N 3.32Å; V372-Y374 PolarHBondContact O-N 3.33Å; V372-K375 CarbonylContact O-C 3.38Å; V372-K375 PolarHBondContact O-N 3.29Å; V372-K375 VanDerWaalsContact O-N 3.12Å; V372-A376 WeakPolarHBondContact O-CA 3.4Å; V372-A376 VanDerWaalsContact O-CB 3.28Å; V372-A376 WeakPolarHBondContact O-CB 3.48Å; V372-A376 PolarHBondContact O-N 3.13Å; V372-D381 WeakPolarHBondContact CG1-O 3.13Å
373	A	89.3	Confident	86.9	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.1	-34.6	179.6	0	0	0	0	0	112.8	R320 F339 F369 H370 L382	R320-A373 PolarHBondContact NH1-O 3.23Å; F339-A373 HydrophobicContact CE1-CB 3.99Å; F339-A373 HydrophobicContact CZ-CB 4.14Å; F369-A373 HydrophobicContact CE1-CB 4.39Å; F369-A373 WeakPolarHBondContact O-CB 3.42Å; F369-A373 PolarHBondContact O-N 2.93Å; H370-A373 WeakPolarHBondContact O-CB 3.3Å; H370-A373 PolarHBondContact O-N 2.64Å; H370-A373 VanDerWaalsContact O-N 3.13Å; A373-L382 HydrophobicContact CB-CD2 4.13Å
374	Y	88.8	Confident	86.8	Confident	2 Å²	2	33 Å²	33	1%	0.008	16%	0.155	C	C	.	.	H	α-helix	trans	-68.6	-38.7	171.5	-81.8	-85.6	0	0	0	112.5	H111 P113 H114 E299 R320 R338 F339 H370 D371 V372	H111-Y374 PolarHBondContact CD2-O 3.44Å; P113-Y374 HydrophobicContact CB-CD2 4.07Å; P113-Y374 HydrophobicContact CB-CE2 4.4Å; P113-Y374 HydrophobicContact CB-CG 4.45Å; H114-Y374 PolarHBondContact O-OH 3.26Å; E299-Y374 PolarHBondContact OE2-OH 3.46Å; R320-Y374 PolarHBondContact NH1-O 2.95Å; R320-Y374 VanDerWaalsContact NH1-O 3.13Å; R338-Y374 HydrophobicContact CG-CE1 4.12Å; F339-Y374 HydrophobicContact CE2-CD2 4.19Å; F339-Y374 HydrophobicContact CE2-CE1 4.15Å; F339-Y374 AromaticContact CE2-CE2 3.64Å; F339-Y374 HydrophobicContact CE2-CE2 3.64Å; F339-Y374 AromaticContact CE2-CZ 3.65Å; F339-Y374 HydrophobicContact CZ-CD1 4.21Å; F339-Y374 AromaticContact CZ-CD2 3.94Å; F339-Y374 HydrophobicContact CZ-CD2 3.94Å; F339-Y374 HydrophobicContact CZ-CE1 4.19Å; F339-Y374 AromaticContact CZ-CE2 3.88Å; F339-Y374 HydrophobicContact CZ-CE2 3.88Å; F339-Y374 HydrophobicContact CZ-CG 4.1Å; H370-Y374 AromaticContact CD2-CE2 3.55Å; H370-Y374 AromaticContact NE2-CD2 3.95Å; H370-Y374 AromaticContact NE2-CE2 3.3Å; H370-Y374 VanDerWaalsContact NE2-CE2 3.3Å; H370-Y374 WeakPolarHBondContact NE2-CE2 3.35Å; H370-Y374 VanDerWaalsContact O-CD2 3.3Å; H370-Y374 WeakPolarHBondContact O-CD2 2.89Å; H370-Y374 PolarHBondContact O-N 3.42Å; H370-Y374 VanDerWaalsContact O-N 3.16Å; D371-Y374 PolarHBondContact O-N 2.9Å; V372-Y374 VanDerWaalsContact C-N 3.32Å; V372-Y374 PolarHBondContact O-N 3.33Å
375	K	86.8	Confident	86.7	Confident	54 Å²	54	33 Å²	33	24%	0.235	16%	0.155	C	C	.	.	H	α-helix	trans	-91	-13.2	-175.2	-67.1	-170.4	178.1	-160.5	0	115.2	I102 L103 T105 D371 V372 K377	I102-K375 HydrophobicContact CG2-CB 3.64Å; I102-K375 HydrophobicContact CG2-CD 4.32Å; I102-K375 WeakPolarHBondContact O-CD 3.38Å; L103-K375 PolarHBondContact O-NZ 2.95Å; T105-K375 PolarHBondContact O-NZ 3.37Å; D371-K375 WeakPolarHBondContact O-CG 3.06Å; D371-K375 PolarHBondContact O-N 3.04Å; D371-K375 VanDerWaalsContact O-N 3.16Å; V372-K375 CarbonylContact O-C 3.38Å; V372-K375 PolarHBondContact O-N 3.29Å; V372-K375 VanDerWaalsContact O-N 3.12Å; K375-K377 PolarHBondContact O-N 3.07Å
376	A	87.9	Confident	87	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.147	C	C	.	.			trans	-58.1	135.8	-174.6	0	0	0	0	0	111.2	L180 R320 V372 D381 L382	L180-A376 HydrophobicContact CD1-CB 4.46Å; R320-A376 VanDerWaalsContact CZ-O 3.28Å; R320-A376 PolarHBondContact NH1-O 3.1Å; R320-A376 PolarHBondContact NH2-O 3.01Å; V372-A376 WeakPolarHBondContact O-CA 3.4Å; V372-A376 VanDerWaalsContact O-CB 3.28Å; V372-A376 WeakPolarHBondContact O-CB 3.48Å; V372-A376 PolarHBondContact O-N 3.13Å; A376-D381 HydrophobicContact CB-CB 3.97Å; A376-L382 HydrophobicContact CB-CD2 3.89Å; A376-L382 HydrophobicContact CB-CG 4.04Å
377	K	85.1	Confident	87.1	Confident	155 Å²	155	33 Å²	33	67%	0.674	15%	0.154	S	C	*	.			trans	-111.9	-27.3	174	-66.4	-178.1	-179	178.5	0	111.4	L180 K375 D381	L180-K377 WeakPolarHBondContact CD1-O 3.42Å; K375-K377 PolarHBondContact O-N 3.07Å; K377-D381 PolarHBondContact N-OD2 3.02Å
378	E	85.9	Confident	87.4	Confident	119 Å²	119	31.4 Å²	31.4	56%	0.556	15%	0.146	S	C	*	.	S	Bend	trans	-126.2	161.5	-179.1	-63.3	178.9	178.6	0	0	111.3	R98 D380 D381	R98-E378 IonicContact NH2-OE2 2.72Å; E378-D380 PolarHBondContact O-N 2.92Å; E378-D381 PolarHBondContact N-OD2 3.16Å; E378-D381 WeakPolarHBondContact O-CB 3.18Å; E378-D381 PolarHBondContact O-N 2.89Å
379	R	88	Confident	87.5	Confident	95 Å²	95	31.6 Å²	31.6	36%	0.358	15%	0.147	S	C	.	.	H	α-helix	trans	-57.4	-38.6	174.8	176.1	-177.9	-60.6	174.6	5.8	112.2	L173 I174 G176 V178 D381 L382 L383	L173-R379 VanDerWaalsContact O-CD 3.29Å; L173-R379 WeakPolarHBondContact O-CD 3.43Å; I174-R379 PolarHBondContact O-NH1 3.24Å; G176-R379 VanDerWaalsContact O-CZ 3.27Å; G176-R379 PolarHBondContact O-NH2 3.17Å; V178-R379 HydrophobicContact CG2-CB 4.48Å; V178-R379 HydrophobicContact CG2-CG 4.12Å; R379-D381 PolarHBondContact O-N 3.39Å; R379-L382 PolarHBondContact O-N 3.45Å; R379-L383 HydrophobicContact CG-CD1 4.24Å; R379-L383 PolarHBondContact O-N 2.96Å
380	D	87.7	Confident	87.4	Confident	81 Å²	81	33.2 Å²	33.2	43%	0.433	16%	0.155	S	C	.	.	H	α-helix	trans	-64.7	-24.8	-177.2	-69.4	-13.4	0	0	0	112.7	R98 E378 L383 A384	R98-D380 VanDerWaalsContact NH2-CB 3.32Å; E378-D380 PolarHBondContact O-N 2.92Å; D380-L383 PolarHBondContact O-N 3.1Å; D380-A384 WeakPolarHBondContact O-CB 2.95Å; D380-A384 PolarHBondContact O-N 3.46Å
381	D	88.6	Confident	87.1	Confident	17 Å²	17	36.3 Å²	36.3	9%	0.091	17%	0.173	C	C	.	.	H	α-helix	trans	-69.8	-39.2	176.8	-61.3	-23.6	0	0	0	111.4	R98 I102 V372 A376 K377 E378 R379 A384 G385	R98-D381 IonicContact CZ-OD1 3.85Å; R98-D381 IonicContact NE-OD1 3.39Å; R98-D381 PolarHBondContact NE-OD1 3.44Å; R98-D381 IonicContact NH2-OD1 2.72Å; R98-D381 PolarHBondContact NH2-OD1 3.05Å; I102-D381 HydrophobicContact CD1-CB 3.77Å; V372-D381 WeakPolarHBondContact CG1-O 3.13Å; A376-D381 HydrophobicContact CB-CB 3.97Å; K377-D381 PolarHBondContact N-OD2 3.02Å; E378-D381 PolarHBondContact N-OD2 3.16Å; E378-D381 WeakPolarHBondContact O-CB 3.18Å; E378-D381 PolarHBondContact O-N 2.89Å; R379-D381 PolarHBondContact O-N 3.39Å; D381-A384 PolarHBondContact O-N 3.2Å; D381-G385 PolarHBondContact O-N 3.06Å
382	L	88.5	Confident	86.4	Confident	3 Å²	3	37.3 Å²	37.3	2%	0.016	18%	0.177	C	C	.	.	H	α-helix	trans	-67.3	-40.4	173.8	-64.3	172.6	0	0	0	110.8	V178 F318 F369 A373 A376 R379 G385 I386	V178-L382 HydrophobicContact CG1-CD1 4.02Å; F318-L382 HydrophobicContact CD1-CD1 3.66Å; F318-L382 HydrophobicContact CE1-CD1 3.56Å; F318-L382 HydrophobicContact CE1-CD2 4.31Å; F318-L382 HydrophobicContact CZ-CD1 4.4Å; F369-L382 WeakPolarHBondContact CE2-O 3.38Å; F369-L382 HydrophobicContact CZ-CD2 4.27Å; A373-L382 HydrophobicContact CB-CD2 4.13Å; A376-L382 HydrophobicContact CB-CD2 3.89Å; A376-L382 HydrophobicContact CB-CG 4.04Å; R379-L382 PolarHBondContact O-N 3.45Å; L382-G385 PolarHBondContact O-N 3.11Å; L382-G385 VanDerWaalsContact O-N 3.16Å; L382-I386 PolarHBondContact O-N 2.86Å
383	L	90.1	Very high	85.8	Confident	16 Å²	16	38.2 Å²	38.2	8%	0.084	18%	0.182	C	C	.	.	H	α-helix	trans	-63.9	-41.7	176.6	-65.5	174.4	0	0	0	111.8	R170 L173 I174 R379 D380 G385 I386 D387	R170-L383 HydrophobicContact CG-CD2 4.15Å; L173-L383 HydrophobicContact CB-CD2 4.07Å; I174-L383 HydrophobicContact CD1-CD1 4.48Å; I174-L383 HydrophobicContact CD1-CD2 4.41Å; I174-L383 HydrophobicContact CG1-CD1 3.63Å; I174-L383 HydrophobicContact CG1-CD2 3.75Å; I174-L383 HydrophobicContact CG1-CG 4.37Å; R379-L383 HydrophobicContact CG-CD1 4.24Å; R379-L383 PolarHBondContact O-N 2.96Å; D380-L383 PolarHBondContact O-N 3.1Å; L383-G385 VanDerWaalsContact C-N 3.26Å; L383-G385 PolarHBondContact O-N 3.3Å; L383-I386 PolarHBondContact O-N 3.16Å; L383-I386 VanDerWaalsContact O-N 3.16Å; L383-D387 PolarHBondContact O-N 3.5Å
384	A	87.2	Confident	85	Confident	7 Å²	7	42.1 Å²	42.1	6%	0.058	21%	0.206	C	C	.	.	H	α-helix	trans	-61.6	-35.9	173.3	0	0	0	0	0	112	R98 V99 D380 D381 D387 E388	R98-A384 HydrophobicContact CG-CB 4.44Å; V99-A384 HydrophobicContact CG2-CB 4.13Å; D380-A384 WeakPolarHBondContact O-CB 2.95Å; D380-A384 PolarHBondContact O-N 3.46Å; D381-A384 PolarHBondContact O-N 3.2Å; A384-D387 PolarHBondContact O-N 3.47Å; A384-E388 WeakPolarHBondContact O-CB 3.31Å; A384-E388 PolarHBondContact O-N 3.26Å
385	G	87.4	Confident	84.4	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.01	23%	0.226	C	C	.	.	H	α-helix	trans	-63.1	-40.5	172.5	0	0	0	0	0	113.4	D381 L382 L383 F389	D381-G385 PolarHBondContact O-N 3.06Å; L382-G385 PolarHBondContact O-N 3.11Å; L382-G385 VanDerWaalsContact O-N 3.16Å; L383-G385 VanDerWaalsContact C-N 3.26Å; L383-G385 PolarHBondContact O-N 3.3Å; G385-F389 WeakPolarHBondContact O-CB 3.11Å; G385-F389 PolarHBondContact O-N 2.84Å
386	I	89.4	Confident	83.8	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-68.7	-42.5	175.9	-65.7	176.1	0	0	0	111	R170 L173 F369 L382 L383 E388 F389 L390	R170-I386 HydrophobicContact CB-CG2 4.47Å; L173-I386 HydrophobicContact CD1-CD1 3.3Å; F369-I386 HydrophobicContact CD2-CG1 4.34Å; F369-I386 HydrophobicContact CE2-CD1 4.48Å; F369-I386 HydrophobicContact CE2-CG1 3.64Å; F369-I386 HydrophobicContact CZ-CG1 4.26Å; L382-I386 PolarHBondContact O-N 2.86Å; L383-I386 PolarHBondContact O-N 3.16Å; L383-I386 VanDerWaalsContact O-N 3.16Å; I386-E388 VanDerWaalsContact C-N 3.34Å; I386-E388 PolarHBondContact O-N 3.36Å; I386-F389 WeakPolarHBondContact O-CB 3.22Å; I386-F389 PolarHBondContact O-N 2.88Å; I386-F389 VanDerWaalsContact O-N 3.16Å; I386-L390 HydrophobicContact CG2-CD1 4.15Å; I386-L390 HydrophobicContact CG2-CG 4.4Å; I386-L390 WeakPolarHBondContact O-CG 3.13Å; I386-L390 PolarHBondContact O-N 3.33Å
387	D	87.6	Confident	82.9	Confident	37 Å²	37	47.4 Å²	47.4	20%	0.198	24%	0.243	C	C	.	.	H	α-helix	trans	-64.5	-40.3	179.1	-69.5	-18.5	0	0	0	110.5	P95 R170 L383 A384 F389 L390 D391	P95-D387 HydrophobicContact CB-CB 4.05Å; P95-D387 HydrophobicContact CG-CB 4.27Å; R170-D387 IonicContact CZ-OD1 3.75Å; R170-D387 IonicContact NE-OD1 3.65Å; R170-D387 PolarHBondContact NE-OD1 2.74Å; R170-D387 IonicContact NE-OD2 3.16Å; R170-D387 IonicContact NH2-OD1 3.13Å; R170-D387 IonicContact NH2-OD2 3.4Å; R170-D387 PolarHBondContact NH2-OD2 2.8Å; L383-D387 PolarHBondContact O-N 3.5Å; A384-D387 PolarHBondContact O-N 3.47Å; D387-F389 VanDerWaalsContact C-N 3.33Å; D387-F389 PolarHBondContact O-N 3.39Å; D387-L390 PolarHBondContact O-N 2.85Å; D387-D391 PolarHBondContact O-N 3.06Å; D387-D391 VanDerWaalsContact O-N 3.11Å
388	E	84.8	Confident	81.9	Confident	23 Å²	23	44.1 Å²	44.1	11%	0.107	24%	0.238	C	C	.	.	H	α-helix	trans	-63.9	-35.6	171.8	177.2	62.8	-160.5	0	0	112.7	S96 V99 I368 A384 I386 Q392	S96-E388 WeakPolarHBondContact CA-OE2 3.48Å; S96-E388 WeakPolarHBondContact CB-OE2 3.48Å; V99-E388 HydrophobicContact CG1-CG 4.46Å; V99-E388 HydrophobicContact CG2-CB 4.1Å; I368-E388 HydrophobicContact CG2-CG 4.48Å; A384-E388 WeakPolarHBondContact O-CB 3.31Å; A384-E388 PolarHBondContact O-N 3.26Å; I386-E388 VanDerWaalsContact C-N 3.34Å; I386-E388 PolarHBondContact O-N 3.36Å; E388-Q392 WeakPolarHBondContact O-CG 3.28Å; E388-Q392 PolarHBondContact OE1-NE2 3.42Å
389	F	85.8	Confident	80.6	Confident	11 Å²	11	42.3 Å²	42.3	5%	0.048	25%	0.251	C	S	.	.	H	α-helix	trans	-64.7	-48.5	174	177.3	-96.3	0	0	0	110.6	V52 L166 I363 D366 G385 I386 D387 D391 Q392 V393	V52-F389 HydrophobicContact CG1-CE2 3.99Å; V52-F389 HydrophobicContact CG1-CZ 3.85Å; V52-F389 HydrophobicContact CG2-CZ 3.97Å; L166-F389 HydrophobicContact CD1-CE1 4.29Å; L166-F389 HydrophobicContact CD2-CD1 4.46Å; L166-F389 HydrophobicContact CD2-CE1 4.07Å; I363-F389 HydrophobicContact CD1-CD1 4.23Å; I363-F389 HydrophobicContact CD1-CE1 4.27Å; I363-F389 HydrophobicContact CG1-CD1 3.84Å; I363-F389 HydrophobicContact CG1-CD2 4.47Å; I363-F389 HydrophobicContact CG1-CE1 3.66Å; I363-F389 HydrophobicContact CG1-CE2 4.32Å; I363-F389 HydrophobicContact CG1-CG 4.24Å; I363-F389 HydrophobicContact CG1-CZ 3.91Å; D366-F389 HydrophobicContact CB-CD2 4.29Å; D366-F389 HydrophobicContact CB-CE2 4.3Å; G385-F389 WeakPolarHBondContact O-CB 3.11Å; G385-F389 PolarHBondContact O-N 2.84Å; I386-F389 WeakPolarHBondContact O-CB 3.22Å; I386-F389 PolarHBondContact O-N 2.88Å; I386-F389 VanDerWaalsContact O-N 3.16Å; D387-F389 VanDerWaalsContact C-N 3.33Å; D387-F389 PolarHBondContact O-N 3.39Å; F389-D391 VanDerWaalsContact C-N 3.32Å; F389-D391 PolarHBondContact O-N 3.03Å; F389-Q392 PolarHBondContact O-N 3.36Å; F389-V393 HydrophobicContact CD1-CG2 3.73Å; F389-V393 HydrophobicContact CE1-CG2 3.55Å; F389-V393 HydrophobicContact CG-CG2 4.35Å; F389-V393 HydrophobicContact CZ-CG2 4.04Å; F389-V393 WeakPolarHBondContact O-CG2 3.47Å; F389-V393 PolarHBondContact O-N 3.29Å
390	L	84.9	Confident	79.3	Confident	35 Å²	35	46 Å²	46	18%	0.183	27%	0.272	C	S	.	.	H	α-helix	trans	-57.2	-40.2	179.9	-77.2	172.6	0	0	0	113	L166 F167 I386 D387 Q392 V393	L166-L390 HydrophobicContact CB-CD2 4.02Å; L166-L390 HydrophobicContact CD1-CD2 3.84Å; L166-L390 HydrophobicContact CG-CD2 4.47Å; F167-L390 HydrophobicContact CE1-CD1 3.98Å; F167-L390 HydrophobicContact CZ-CD1 4.15Å; I386-L390 HydrophobicContact CG2-CD1 4.15Å; I386-L390 HydrophobicContact CG2-CG 4.4Å; I386-L390 WeakPolarHBondContact O-CG 3.13Å; I386-L390 PolarHBondContact O-N 3.33Å; D387-L390 PolarHBondContact O-N 2.85Å; L390-Q392 PolarHBondContact O-N 3.27Å; L390-Q392 VanDerWaalsContact O-N 3.08Å; L390-V393 PolarHBondContact O-N 2.89Å
391	D	80.3	Confident	78.2	Confident	88 Å²	88	46.6 Å²	46.6	47%	0.471	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-17.7	177.3	-82.2	-14.3	0	0	0	113.4	D387 F389 S1067	D387-D391 PolarHBondContact O-N 3.06Å; D387-D391 VanDerWaalsContact O-N 3.11Å; F389-D391 VanDerWaalsContact C-N 3.32Å; F389-D391 PolarHBondContact O-N 3.03Å; D391-S1067 PolarHBondContact OD1-OG 3.2Å
392	Q	71.1	Confident	77	Confident	40 Å²	40	49.6 Å²	49.6	19%	0.187	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	-10.8	-173	-60.9	-177.4	20.7	0	0	115	E388 F389 L390	E388-Q392 WeakPolarHBondContact O-CG 3.28Å; E388-Q392 PolarHBondContact OE1-NE2 3.42Å; F389-Q392 PolarHBondContact O-N 3.36Å; L390-Q392 PolarHBondContact O-N 3.27Å; L390-Q392 VanDerWaalsContact O-N 3.08Å
393	V	75.5	Confident	75.9	Confident	18 Å²	18	52.7 Å²	52.7	11%	0.109	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-76.7	140.3	-176	-155	0	0	0	0	110.1	V50 G51 V52 F389 L390	V50-V393 HydrophobicContact CB-CB 4.23Å; V50-V393 HydrophobicContact CB-CG1 3.51Å; V50-V393 HydrophobicContact CG1-CB 3.41Å; V50-V393 VanDerWaalsContact CG1-CB 3.41Å; V50-V393 HydrophobicContact CG1-CG1 3.17Å; V50-V393 HydrophobicContact CG1-CG2 4.47Å; G51-V393 WeakPolarHBondContact O-CG1 3.46Å; V52-V393 HydrophobicContact CG2-CG1 4.49Å; F389-V393 HydrophobicContact CD1-CG2 3.73Å; F389-V393 HydrophobicContact CE1-CG2 3.55Å; F389-V393 HydrophobicContact CG-CG2 4.35Å; F389-V393 HydrophobicContact CZ-CG2 4.04Å; F389-V393 WeakPolarHBondContact O-CG2 3.47Å; F389-V393 PolarHBondContact O-N 3.29Å; L390-V393 PolarHBondContact O-N 2.89Å
394	T	73.3	Confident	74.7	Confident	82 Å²	82	56 Å²	56	50%	0.503	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	126	-179.9	49.2	0	0	0	0	110.7	V50 G51	V50-T394 CarbonylContact C-O 3.59Å; V50-T394 WeakPolarHBondContact CA-O 3.43Å; G51-T394 PolarHBondContact N-O 3.48Å; G51-T394 PolarHBondContact O-N 3.49Å; G51-T394 PolarHBondContact O-OG1 3.48Å; G51-T394 VanDerWaalsContact O-OG1 3.08Å
395	V	75.6	Confident	73.9	Confident	70 Å²	70	59.9 Å²	59.9	42%	0.424	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	131	177.4	-175.8	0	0	0	0	110.1	L48 V50	L48-V395 HydrophobicContact CD2-CG1 4.06Å; V50-V395 HydrophobicContact CG1-CG2 4.13Å
396	L	74.4	Confident	73.3	Confident	31 Å²	31	65 Å²	65	16%	0.162	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	137.5	171.3	-63.9	173.9	0	0	0	109.4	Y49 T160 W401	Y49-L396 PolarHBondContact O-N 3.36Å; T160-L396 HydrophobicContact CG2-CD1 4.09Å; L396-W401 HydrophobicContact CD1-CG 4.36Å
397	P	69.4	Low	72.6	Confident	67 Å²	67	67.3 Å²	67.3	44%	0.435	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-63.1	127.6	-177.5	24.1	-32.3	0	0	0	111.3	G399 E400	P397-G399 PolarHBondContact O-N 3.38Å; P397-E400 HydrophobicContact CG-CB 4.42Å
398	P	63.7	Low	71.7	Confident	86 Å²	86	73.3 Å²	73.3	56%	0.558	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	120.8	178.5	28.8	-33.3	0	0	0	109.9	L48	L48-P398 HydrophobicContact CD2-CB 4.44Å; L48-P398 HydrophobicContact CD2-CG 3.81Å
399	G	59.1	Low	70.9	Confident	80 Å²	80	73.5 Å²	73.5	83%	0.825	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	109.6	-14.6	174.2	0	0	0	0	0	116.6	P397	P397-G399 PolarHBondContact O-N 3.38Å
400	E	61.3	Low	69.6	Low	174 Å²	174	76.2 Å²	76.2	81%	0.813	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-15.8	172.2	-70.2	-176.6	173.5	0	0	112.9	P397	P397-E400 HydrophobicContact CG-CB 4.42Å
401	W	63.7	Low	68	Low	92 Å²	92	83 Å²	83	35%	0.348	46%	0.455	S	S	.	.	S	Bend	trans	-114.1	127.3	-176.8	-165.2	-87.1	0	0	0	110.8	L396 I405 I407	L396-W401 HydrophobicContact CD1-CG 4.36Å; W401-I405 HydrophobicContact CH2-CG2 4.47Å; W401-I405 HydrophobicContact CZ2-CB 4.39Å; W401-I405 HydrophobicContact CZ2-CG2 4.03Å; W401-I407 HydrophobicContact CH2-CD1 4.14Å; W401-I407 HydrophobicContact CH2-CG1 3.81Å; W401-I407 HydrophobicContact CZ2-CD1 3.65Å; W401-I407 HydrophobicContact CZ2-CG1 3.3Å
402	D	65	Low	66.3	Low	81 Å²	81	84.2 Å²	84.2	43%	0.433	46%	0.462	S	S	.	.			trans	-88	123.9	174.3	-178	-18.9	0	0	0	109.6	S404 I405	D402-S404 PolarHBondContact O-N 3.28Å; D402-S404 VanDerWaalsContact O-N 3.13Å; D402-S404 WeakPolarHBondContact OD1-CB 3.29Å; D402-S404 PolarHBondContact OD1-N 3.24Å; D402-S404 PolarHBondContact OD1-OG 3.24Å; D402-S404 PolarHBondContact OD2-OG 3.01Å; D402-I405 HydrophobicContact CB-CD1 3.73Å; D402-I405 HydrophobicContact CB-CG1 3.89Å; D402-I405 WeakPolarHBondContact O-CB 3.48Å; D402-I405 PolarHBondContact O-N 3.28Å
403	P	64.3	Low	65.4	Low	67 Å²	67	83.4 Å²	83.4	44%	0.435	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-22.4	179.3	-24.5	34.6	0	0	0	114.8	Y49 I405	Y49-P403 HydrophobicContact CE1-CB 4.4Å; Y49-P403 HydrophobicContact CE1-CG 4.24Å; Y49-P403 HydrophobicContact CE2-CG 3.88Å; Y49-P403 WeakPolarHBondContact OH-CG 3.48Å; P403-I405 VanDerWaalsContact C-N 3.32Å
404	S	65	Low	64	Low	86 Å²	86	86.5 Å²	86.5	60%	0.601	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-14.6	177.8	68	0	0	0	0	113.5	D402 R406	D402-S404 PolarHBondContact O-N 3.28Å; D402-S404 VanDerWaalsContact O-N 3.13Å; D402-S404 WeakPolarHBondContact OD1-CB 3.29Å; D402-S404 PolarHBondContact OD1-N 3.24Å; D402-S404 PolarHBondContact OD1-OG 3.24Å; D402-S404 PolarHBondContact OD2-OG 3.01Å; S404-R406 PolarHBondContact O-N 3Å
405	I	69.6	Low	62.5	Low	88 Å²	88	85 Å²	85	45%	0.451	47%	0.473	S	S	.	.			trans	-79.6	105	-179.9	-62.5	175.2	0	0	0	109.7	W401 D402 P403 I407	W401-I405 HydrophobicContact CH2-CG2 4.47Å; W401-I405 HydrophobicContact CZ2-CB 4.39Å; W401-I405 HydrophobicContact CZ2-CG2 4.03Å; D402-I405 HydrophobicContact CB-CD1 3.73Å; D402-I405 HydrophobicContact CB-CG1 3.89Å; D402-I405 WeakPolarHBondContact O-CB 3.48Å; D402-I405 PolarHBondContact O-N 3.28Å; P403-I405 VanDerWaalsContact C-N 3.32Å; I405-I407 PolarHBondContact O-N 3.3Å
406	R	74.6	Confident	61.4	Low	108 Å²	108	81.7 Å²	81.7	41%	0.408	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-70.6	121.5	175.8	-67.4	174.6	175.6	162.2	-2.1	111.1	E147 S154 Y157 S404 E408	E147-R406 IonicContact OE1-NH1 3.68Å; S154-R406 VanDerWaalsContact CB-CZ 3.48Å; Y157-R406 HydrophobicContact CD1-CB 4.16Å; Y157-R406 HydrophobicContact CD1-CG 3.77Å; Y157-R406 HydrophobicContact CD2-CB 4.35Å; Y157-R406 HydrophobicContact CD2-CG 4.13Å; Y157-R406 HydrophobicContact CE1-CG 3.97Å; Y157-R406 HydrophobicContact CE2-CG 4.31Å; Y157-R406 HydrophobicContact CG-CB 3.9Å; Y157-R406 HydrophobicContact CG-CG 3.85Å; S404-R406 PolarHBondContact O-N 3Å; R406-E408 PolarHBondContact O-N 3.36Å
407	I	75.6	Confident	60	Low	49 Å²	49	85.7 Å²	85.7	25%	0.251	47%	0.471	S	S	.	.	B	Isolated β-bridge	trans	-77.3	120.4	176.6	-60.9	172.2	0	0	0	109.2	Y157 V158 T160 W401 I405	Y157-I407 WeakPolarHBondContact CB-O 3.31Å; V158-I407 HydrophobicContact CB-CB 4.09Å; V158-I407 HydrophobicContact CB-CG2 4.19Å; V158-I407 HydrophobicContact CG2-CB 4.35Å; V158-I407 HydrophobicContact CG2-CG2 3.99Å; V158-I407 PolarHBondContact N-O 3.23Å; T160-I407 HydrophobicContact CG2-CD1 3.97Å; W401-I407 HydrophobicContact CH2-CD1 4.14Å; W401-I407 HydrophobicContact CH2-CG1 3.81Å; W401-I407 HydrophobicContact CZ2-CD1 3.65Å; W401-I407 HydrophobicContact CZ2-CG1 3.3Å; I405-I407 PolarHBondContact O-N 3.3Å
408	E	68.8	Low	59.2	Low	163 Å²	163	87 Å²	87	76%	0.762	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-63.7	139.9	174.8	-71	-164.2	164.5	0	0	111.1	R406	R406-E408 PolarHBondContact O-N 3.36Å
409	P	67.2	Low	58.8	Low	28 Å²	28	84.8 Å²	84.8	18%	0.182	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-62.9	140.5	-177.2	26.3	-36	0	0	0	112.3	F142 G867	F142-P409 HydrophobicContact CD1-CB 3.53Å; F142-P409 HydrophobicContact CD1-CG 4.5Å; F142-P409 HydrophobicContact CE1-CB 3.11Å; F142-P409 HydrophobicContact CE1-CG 4.37Å; F142-P409 HydrophobicContact CE2-CB 4.41Å; F142-P409 HydrophobicContact CG-CB 4.37Å; F142-P409 HydrophobicContact CZ-CB 3.66Å; P409-G867 WeakPolarHBondContact CG-O 3.43Å
410	P	59.6	Low	58.5	Low	67 Å²	67	84.5 Å²	84.5	44%	0.435	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-67.2	148.8	-179.6	27.4	-34.6	0	0	0	111.9	N412	P410-N412 VanDerWaalsContact C-N 3.26Å; P410-N412 PolarHBondContact O-N 3.46Å
411	K	50.4	Low	57.8	Low	177 Å²	177	81.7 Å²	81.7	77%	0.77	41%	0.414	S	S	*	.	S	Bend	trans	-62.2	-27.9	-177.2	-66.7	-180	-177.7	172.9	0	114.2
412	N	45.9	Very low	56.8	Low	114 Å²	114	81.9 Å²	81.9	61%	0.61	43%	0.428	S	S	*	.			trans	-145.6	139.1	178.2	-73.3	-43.4	0	0	0	109.9	P410 P414	P410-N412 VanDerWaalsContact C-N 3.26Å; P410-N412 PolarHBondContact O-N 3.46Å; N412-P414 WeakPolarHBondContact O-CD 3.36Å
413	V	52.5	Low	55.8	Low	23 Å²	23	80.6 Å²	80.6	14%	0.139	43%	0.433	C	S	.	.			trans	-109.8	107.4	-177.4	-143.6	0	0	0	0	108	M54 P55 L56	M54-V413 HydrophobicContact CB-CG1 3.89Å; M54-V413 VanDerWaalsContact O-CG1 3.28Å; M54-V413 WeakPolarHBondContact O-CG1 3.39Å; P55-V413 WeakPolarHBondContact O-CB 3.28Å; P55-V413 WeakPolarHBondContact O-CG1 3.47Å; L56-V413 CarbonylContact C-O 3.49Å; L56-V413 VanDerWaalsContact C-O 3.3Å; L56-V413 WeakPolarHBondContact CA-O 3.34Å; L56-V413 HydrophobicContact CB-CG1 4.35Å; L56-V413 VanDerWaalsContact CD2-C 3.49Å; L56-V413 HydrophobicContact CD2-CB 4.28Å; L56-V413 HydrophobicContact CD2-CG1 3.63Å; L56-V413 HydrophobicContact CG-CG1 4.22Å
414	P	44.9	Very low	54.4	Low	84 Å²	84	83.1 Å²	83.1	55%	0.545	45%	0.447	S	S	.	.			trans	-82.9	102.2	-169.4	24.2	-31.5	0	0	0	122.8	L56 N412	L56-P414 WeakPolarHBondContact CB-O 3.36Å; L56-P414 WeakPolarHBondContact CD1-O 3.43Å; L56-P414 HydrophobicContact CD2-CB 4.12Å; L56-P414 HydrophobicContact CD2-CG 3.51Å; L56-P414 VanDerWaalsContact CD2-O 3.26Å; L56-P414 WeakPolarHBondContact CD2-O 3.44Å; L56-P414 VanDerWaalsContact CG-C 3.48Å; L56-P414 WeakPolarHBondContact CG-O 3.22Å; N412-P414 WeakPolarHBondContact O-CD 3.36Å
415	S	42.5	Very low	53	Low	49 Å²	49	84.4 Å²	84.4	34%	0.343	45%	0.454	S	S	.	.			trans	-3.8	129.3	-175.6	56.4	0	0	0	0	123.4	L56 K1014	L56-S415 VanDerWaalsContact CB-CA 3.44Å; L56-S415 WeakPolarHBondContact O-CA 3.24Å; L56-S415 PolarHBondContact O-N 3.47Å; S415-K1014 PolarHBondContact O-NZ 3.41Å; S415-K1014 PolarHBondContact OG-NZ 2.95Å; S415-K1014 VanDerWaalsContact OG-NZ 3.12Å
416	Q	51.4	Low	51	Low	2 Å²	2	87.6 Å²	87.6	1%	0.009	47%	0.472	C	S	.	.			trans	-88.9	-3.7	175	-64.9	-166.6	-1.3	0	0	115.2	L56 D366 K418 R419	L56-Q416 HydrophobicContact CB-CG 4.17Å; L56-Q416 HydrophobicContact CD1-CB 4.24Å; L56-Q416 HydrophobicContact CD1-CG 3.23Å; L56-Q416 HydrophobicContact CG-CG 3.84Å; D366-Q416 PolarHBondContact OD1-NE2 2.88Å; Q416-K418 PolarHBondContact O-N 3.41Å; Q416-R419 VanDerWaalsContact CG-NH1 3.32Å; Q416-R419 WeakPolarHBondContact O-CB 3.19Å; Q416-R419 WeakPolarHBondContact O-CG 3.46Å; Q416-R419 PolarHBondContact O-N 3.49Å
417	E	45.3	Very low	49.1	Very low	114 Å²	114	85.9 Å²	85.9	53%	0.533	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-51.7	-28.1	-174.2	-69.5	174.9	179.6	0	0	116	R419 K420 M421	E417-R419 PolarHBondContact O-N 3.11Å; E417-R419 VanDerWaalsContact O-N 3.11Å; E417-K420 PolarHBondContact O-N 3.21Å; E417-K420 VanDerWaalsContact O-N 3.15Å; E417-M421 HydrophobicContact CB-CE 4.27Å; E417-M421 PolarHBondContact O-N 3.04Å
418	K	52.3	Low	46.7	Very low	96 Å²	96	91 Å²	91	42%	0.417	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-58	-24.5	175.4	-76.1	-172.5	166.1	-170.4	0	112.8	Q416 K1014 D1018	Q416-K418 PolarHBondContact O-N 3.41Å; K418-K1014 HydrophobicContact CD-CD 4.47Å; K418-K1014 VanDerWaalsContact CE-CE 3.44Å; K418-D1018 WeakPolarHBondContact CE-OD2 3.34Å; K418-D1018 IonicContact NZ-OD1 2.78Å; K418-D1018 PolarHBondContact NZ-OD1 3.43Å; K418-D1018 IonicContact NZ-OD2 3.65Å; K418-D1018 PolarHBondContact NZ-OD2 2.9Å
419	R	55.6	Low	44.7	Very low	38 Å²	38	89.3 Å²	89.3	14%	0.143	52%	0.516	C	S	.	.	G	3₁₀ helix	trans	-88.3	-21.5	-177	-52.7	170.8	-168.6	168.6	2.8	112.7	I368 Q416 E417	I368-R419 HydrophobicContact CD1-CB 3.83Å; I368-R419 HydrophobicContact CD1-CG 4.19Å; Q416-R419 VanDerWaalsContact CG-NH1 3.32Å; Q416-R419 WeakPolarHBondContact O-CB 3.19Å; Q416-R419 WeakPolarHBondContact O-CG 3.46Å; Q416-R419 PolarHBondContact O-N 3.49Å; E417-R419 PolarHBondContact O-N 3.11Å; E417-R419 VanDerWaalsContact O-N 3.11Å
420	K	54.1	Low	42.5	Very low	75 Å²	75	93.1 Å²	93.1	33%	0.326	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-12.9	176.5	-56.3	-166.9	-178.1	-170.5	0	112.9	L103 D371 E417	L103-K420 HydrophobicContact CD1-CG 4.28Å; D371-K420 WeakPolarHBondContact OD2-CE 3.35Å; D371-K420 IonicContact OD2-NZ 3.12Å; D371-K420 PolarHBondContact OD2-NZ 3.35Å; E417-K420 PolarHBondContact O-N 3.21Å; E417-K420 VanDerWaalsContact O-N 3.15Å
421	M	44.9	Very low	40.8	Very low	114 Å²	114	98.1 Å²	98.1	56%	0.562	56%	0.559	S	S	*	*	S	Bend	trans	-87.1	131.5	179.5	-64.2	-178.3	-158.2	0	0	109.8	E417 G423	E417-M421 HydrophobicContact CB-CE 4.27Å; E417-M421 PolarHBondContact O-N 3.04Å; M421-G423 PolarHBondContact O-N 2.76Å
422	P	44.1	Very low	39.7	Very low	97 Å²	97	96.7 Å²	96.7	63%	0.63	56%	0.558	S	S	*	*			trans	-60.7	127.3	174.5	22	-29.8	0	0	0	109.7	V424	P422-V424 PolarHBondContact O-N 3Å; P422-V424 VanDerWaalsContact O-N 3.08Å
423	G	44.3	Very low	38.6	Very low	53 Å²	53	99.7 Å²	99.7	55%	0.546	57%	0.569	S	S	.	*			trans	-62.2	108.9	163	0	0	0	0	0	108.1	M421 P425	M421-G423 PolarHBondContact O-N 2.76Å; G423-P425 WeakPolarHBondContact O-CD 3.37Å; G423-P425 VanDerWaalsContact O-N 3.09Å
424	V	34.8	Very low	37.3	Very low	120 Å²	120	107.8 Å²	107.8	73%	0.727	61%	0.605	S	S	*	*			trans	-57	115	178.6	-179.1	0	0	0	0	108.7	P422	P422-V424 PolarHBondContact O-N 3Å; P422-V424 VanDerWaalsContact O-N 3.08Å
425	P	34.6	Very low	36.3	Very low	114 Å²	114	112.3 Å²	112.3	74%	0.74	62%	0.619	S	S	*	*			trans	-79	124.9	169.6	1.5	17.6	0	0	0	107.4	G423	G423-P425 WeakPolarHBondContact O-CD 3.37Å; G423-P425 VanDerWaalsContact O-N 3.09Å
426	N	28.1	Very low	35.5	Very low	154 Å²	154	115.1 Å²	115.1	82%	0.824	64%	0.636	S	S	*	*	S	Bend	trans	64	109.4	173.2	-71.1	-19.7	0	0	0	117.8	N428	N426-N428 PolarHBondContact O-N 3.28Å
427	G	35.4	Very low	34.5	Very low	72 Å²	72	124.3 Å²	124.3	74%	0.742	68%	0.679	S	S	*	*			trans	39.6	74.2	133.1	0	0	0	0	0	117.3
428	N	24.1	Very low	33.8	Very low	157 Å²	157	121.5 Å²	121.5	84%	0.84	68%	0.68	S	S	*	*			trans	-158	105.2	136.9	-96.7	-23.4	0	0	0	108.7	N426 C430	N426-N428 PolarHBondContact O-N 3.28Å; N428-C430 PolarHBondContact O-N 2.89Å
429	V	26.6	Very low	33	Very low	127 Å²	127	118.6 Å²	118.6	77%	0.77	68%	0.677	S	S	*	*			trans	-57.5	104.4	171.5	177.6	0	0	0	0	107.6	H431	V429-H431 PolarHBondContact O-N 2.86Å
430	C	21.2	Very low	32.3	Very low	108 Å²	108	119.9 Å²	119.9	73%	0.73	69%	0.685	S	S	*	*			trans	-66.3	106.4	160.4	-164.6	0	0	0	0	105.9	N428 I432	N428-C430 PolarHBondContact O-N 2.89Å; C430-I432 PolarHBondContact O-N 3.1Å
431	H	24.3	Very low	31.7	Very low	172 Å²	172	119.2 Å²	119.2	80%	0.796	69%	0.69	S	S	*	*			trans	-58.7	90.4	170.9	-93.8	-88.6	0	0	0	108.6	V429 E433	V429-H431 PolarHBondContact O-N 2.86Å; H431-E433 PolarHBondContact O-N 2.94Å
432	I	26.6	Very low	32.2	Very low	147 Å²	147	114.7 Å²	114.7	75%	0.754	67%	0.672	S	S	*	*			trans	-78.6	110.6	156.3	-62.1	177.6	0	0	0	104.4	C430 Q434	C430-I432 PolarHBondContact O-N 3.1Å; I432-Q434 PolarHBondContact O-N 3.23Å; I432-Q434 VanDerWaalsContact O-N 3.12Å
433	E	22.8	Very low	32.7	Very low	177 Å²	177	115 Å²	115	83%	0.827	67%	0.674	S	S	*	*			trans	-42.8	120.6	174.3	-78.3	177.8	138.7	0	0	110.3	H431 E435	H431-E433 PolarHBondContact O-N 2.94Å; E433-E435 PolarHBondContact O-N 3.49Å
434	Q	25.1	Very low	33.3	Very low	193 Å²	193	115 Å²	115	90%	0.902	66%	0.66	S	S	*	*			trans	-64.8	101.2	166.9	-81.2	176.9	-15.2	0	0	107.9	I432	I432-Q434 PolarHBondContact O-N 3.23Å; I432-Q434 VanDerWaalsContact O-N 3.12Å
435	E	25.2	Very low	34.7	Very low	179 Å²	179	110.1 Å²	110.1	84%	0.836	63%	0.63	S	S	*	*			trans	-57.6	127.2	159.5	-86.8	-103.8	139.6	0	0	108.4	E433	E433-E435 PolarHBondContact O-N 3.49Å
436	P	25.2	Very low	36.2	Very low	109 Å²	109	111.2 Å²	111.2	71%	0.708	63%	0.625	S	S	*	*			trans	-66.8	158.9	-174.5	28.1	-33	0	0	0	111.3	G438	P436-G438 PolarHBondContact O-N 2.85Å
437	H	30.4	Very low	38.3	Very low	195 Å²	195	112.6 Å²	112.6	90%	0.903	62%	0.619	S	S	*	*			trans	-38.8	103.6	-175.5	-60.5	-17.9	0	0	0	114.8	G439	H437-G439 PolarHBondContact O-N 3.41Å
438	G	30.1	Very low	40	Very low	55 Å²	55	111.4 Å²	111.4	57%	0.567	60%	0.597	S	S	*	*			trans	-94.4	73.6	178.7	0	0	0	0	0	113.2	P436	P436-G438 PolarHBondContact O-N 2.85Å
439	G	35.5	Very low	42.3	Very low	34 Å²	34	107.4 Å²	107.4	35%	0.351	59%	0.593	S	S	.	*	S	Bend	trans	-70.6	128.3	153.9	0	0	0	0	0	108.4	H437 S441	H437-G439 PolarHBondContact O-N 3.41Å; G439-S441 WeakPolarHBondContact O-CB 3.42Å; G439-S441 PolarHBondContact O-N 3.2Å; G439-S441 PolarHBondContact O-OG 3.13Å
440	H	40.9	Very low	44.8	Very low	65 Å²	65	111 Å²	111	30%	0.301	59%	0.592	S	S	.	*	S	Bend	trans	46.6	-4.6	178.2	-73.2	-84.3	0	0	0	119.5	G442	H440-G442 PolarHBondContact O-N 2.94Å; H440-G442 VanDerWaalsContact O-N 3.15Å
441	S	41.8	Very low	47.7	Very low	61 Å²	61	112.5 Å²	112.5	43%	0.427	59%	0.593	S	S	.	*			trans	-97.1	82.4	-163.5	-58.9	0	0	0	0	109.9	G439	G439-S441 WeakPolarHBondContact O-CB 3.42Å; G439-S441 PolarHBondContact O-N 3.2Å; G439-S441 PolarHBondContact O-OG 3.13Å
442	G	54.4	Low	50.5	Low	19 Å²	19	108.1 Å²	108.1	20%	0.196	57%	0.572	C	S	.	*			trans	-65.6	162	152.7	0	0	0	0	0	109.7	H440 E444 L445	H440-G442 PolarHBondContact O-N 2.94Å; H440-G442 VanDerWaalsContact O-N 3.15Å; G442-E444 PolarHBondContact O-N 3.43Å; G442-L445 PolarHBondContact O-N 3.18Å
443	P	54.9	Low	53.1	Low	103 Å²	103	101.8 Å²	101.8	67%	0.669	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-2.7	172.6	26.4	-34.9	0	0	0	113.5
444	E	57.8	Low	56	Low	55 Å²	55	93.6 Å²	93.6	26%	0.257	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-21.1	-176.1	-40.3	-171.9	114.7	0	0	113.5	G442 R461 C819	G442-E444 PolarHBondContact O-N 3.43Å; E444-R461 VanDerWaalsContact CB-NH1 3.34Å; E444-R461 IonicContact OE1-CZ 2.62Å; E444-R461 IonicContact OE1-NE 3.6Å; E444-R461 IonicContact OE1-NH1 3.47Å; E444-R461 PolarHBondContact OE1-NH1 2.68Å; E444-C819 PolarHBondContact OE1-N 3.33Å; E444-C819 PolarHBondContact OE2-SG 3.04Å
445	L	64.6	Low	58.9	Low	17 Å²	17	85.2 Å²	85.2	9%	0.089	47%	0.467	C	S	.	.	S	Bend	trans	-115.6	6.8	-177.6	-69.7	117.3	0	0	0	113.8	G442 V586 C587 Y821	G442-L445 PolarHBondContact O-N 3.18Å; L445-V586 HydrophobicContact CD2-CB 3.79Å; L445-V586 HydrophobicContact CD2-CG1 4.12Å; L445-C587 WeakPolarHBondContact CB-SG 3.41Å; L445-Y821 HydrophobicContact CD1-CD2 4.49Å; L445-Y821 HydrophobicContact CD1-CE2 3.86Å; L445-Y821 HydrophobicContact CD2-CD2 4.24Å; L445-Y821 HydrophobicContact CD2-CE2 4.19Å; L445-Y821 HydrophobicContact CG-CD2 4.22Å; L445-Y821 HydrophobicContact CG-CE2 4.07Å
446	Q	66.4	Low	61.9	Low	137 Å²	137	80.9 Å²	80.9	64%	0.64	45%	0.452	S	S	*	.	S	Bend	trans	-72.5	134.7	176.1	-73.2	-176.5	-2.9	0	0	110.7	T448	Q446-T448 PolarHBondContact O-N 2.74Å
447	R	71.5	Confident	64.7	Low	183 Å²	183	79.6 Å²	79.6	69%	0.691	44%	0.439	S	S	*	.			trans	-66.5	119.3	179.6	-165.2	174	-170.8	172.1	3.1	109.7	D581	R447-D581 HydrophobicContact CG-CB 4.44Å
448	T	71.3	Confident	67.4	Low	46 Å²	46	70.4 Å²	70.4	28%	0.282	40%	0.396	S	S	.	.			trans	-84.2	-17.2	-173.6	66.8	0	0	0	0	113.5	Q446 R450 G453 G454 L457 D581	Q446-T448 PolarHBondContact O-N 2.74Å; T448-R450 PolarHBondContact O-N 3.37Å; T448-G453 WeakPolarHBondContact OG1-CA 3.42Å; T448-G454 PolarHBondContact OG1-N 3.47Å; T448-L457 HydrophobicContact CG2-CD1 3.64Å; T448-D581 PolarHBondContact N-OD2 3.28Å; T448-D581 PolarHBondContact OG1-OD2 3.24Å
449	G	71.8	Confident	70.2	Confident	73 Å²	73	71.7 Å²	71.7	75%	0.753	39%	0.39	S	S	*	.			trans	71.6	3.4	177.7	0	0	0	0	0	114.9
450	R	79.8	Confident	72.7	Confident	202 Å²	202	77.8 Å²	77.8	76%	0.762	41%	0.407	S	S	*	.	S	Bend	trans	-112	141.8	175.1	-63.3	-178.3	-178.1	-175.3	0.3	109.6	T448 F452 G453	T448-R450 PolarHBondContact O-N 3.37Å; R450-F452 PolarHBondContact O-N 3.06Å; R450-G453 PolarHBondContact O-N 3.34Å
451	L	82	Confident	74.8	Confident	141 Å²	141	77.9 Å²	77.9	74%	0.738	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	128.6	172.7	-67	173.8	0	0	0	109.7	G453	L451-G453 PolarHBondContact O-N 3.05Å
452	F	82.3	Confident	76.9	Confident	80 Å²	80	76.1 Å²	76.1	35%	0.351	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	15.5	-173.6	-61.3	-82.2	0	0	0	115.6	R450 G454 L455 V456 I575 V578 A579	R450-F452 PolarHBondContact O-N 3.06Å; F452-G454 PolarHBondContact O-N 3.08Å; F452-L455 HydrophobicContact CD1-CD2 3.82Å; F452-L455 PolarHBondContact O-N 3.34Å; F452-V456 WeakPolarHBondContact O-CG2 3.17Å; F452-V456 PolarHBondContact O-N 3.27Å; F452-I575 HydrophobicContact CZ-CG2 4.48Å; F452-V578 HydrophobicContact CD1-CG1 4.46Å; F452-A579 HydrophobicContact CD2-CB 4.39Å; F452-A579 HydrophobicContact CE1-CB 4.1Å; F452-A579 HydrophobicContact CE2-CB 3.96Å; F452-A579 HydrophobicContact CZ-CB 3.81Å; F452-A579 PolarHBondContact N-O 3.48Å
453	G	82.5	Confident	78.4	Confident	14 Å²	14	78.3 Å²	78.3	14%	0.144	41%	0.405	C	S	.	.	H	α-helix	trans	-62.5	-43.8	-179.3	0	0	0	0	0	112.8	T448 R450 L451 L455 V456 L457	T448-G453 WeakPolarHBondContact OG1-CA 3.42Å; R450-G453 PolarHBondContact O-N 3.34Å; L451-G453 PolarHBondContact O-N 3.05Å; G453-L455 PolarHBondContact O-N 3.2Å; G453-V456 PolarHBondContact O-N 3.41Å; G453-L457 WeakPolarHBondContact O-CG 3.34Å; G453-L457 PolarHBondContact O-N 2.66Å
454	G	83.2	Confident	80	Confident	5 Å²	5	77.9 Å²	77.9	5%	0.052	40%	0.402	C	S	.	.	H	α-helix	trans	-61.5	-42.8	176.3	0	0	0	0	0	113.1	T448 F452 V456 L457 D458 D581	T448-G454 PolarHBondContact OG1-N 3.47Å; F452-G454 PolarHBondContact O-N 3.08Å; G454-V456 PolarHBondContact O-N 2.87Å; G454-L457 PolarHBondContact O-N 2.94Å; G454-D458 PolarHBondContact O-N 2.63Å; G454-D581 PolarHBondContact N-OD1 2.98Å; G454-D581 VanDerWaalsContact N-OD1 3.09Å
455	L	86.2	Confident	81.3	Confident	16 Å²	16	80.9 Å²	80.9	8%	0.084	41%	0.411	C	S	.	.	H	α-helix	trans	-62	-45	179.7	-179.9	70.3	0	0	0	112.7	F452 G453 L457 D458 I459 V578 H822 L823 L826	F452-L455 HydrophobicContact CD1-CD2 3.82Å; F452-L455 PolarHBondContact O-N 3.34Å; G453-L455 PolarHBondContact O-N 3.2Å; L455-L457 VanDerWaalsContact C-N 3.29Å; L455-L457 PolarHBondContact O-N 2.95Å; L455-D458 PolarHBondContact O-N 3.17Å; L455-I459 HydrophobicContact CD1-CD1 4.36Å; L455-I459 HydrophobicContact CG-CD1 4.11Å; L455-I459 WeakPolarHBondContact O-CG1 3.33Å; L455-I459 PolarHBondContact O-N 3.49Å; L455-V578 HydrophobicContact CB-CG1 4.48Å; L455-H822 HydrophobicContact CB-CB 4.33Å; L455-H822 HydrophobicContact CD1-CB 4.35Å; L455-L823 HydrophobicContact CD1-CB 4.14Å; L455-L823 HydrophobicContact CD1-CD1 4.01Å; L455-L826 HydrophobicContact CD1-CB 4.42Å; L455-L826 HydrophobicContact CD1-CD2 3.83Å; L455-L826 HydrophobicContact CD2-CD2 3.65Å; L455-L826 HydrophobicContact CG-CD2 4.39Å
456	V	87	Confident	82.4	Confident	89 Å²	89	83.5 Å²	83.5	54%	0.539	42%	0.42	S	S	.	.	H	α-helix	trans	-64.8	-36.6	-179.3	174.6	0	0	0	0	111	F452 G453 G454 K460	F452-V456 WeakPolarHBondContact O-CG2 3.17Å; F452-V456 PolarHBondContact O-N 3.27Å; G453-V456 PolarHBondContact O-N 3.41Å; G454-V456 PolarHBondContact O-N 2.87Å; V456-K460 WeakPolarHBondContact O-CB 3.02Å; V456-K460 PolarHBondContact O-N 2.84Å
457	L	84.4	Confident	83.4	Confident	81 Å²	81	85.8 Å²	85.8	42%	0.424	42%	0.423	S	S	.	.	H	α-helix	trans	-66.6	-41.2	175.4	-67.8	177.1	0	0	0	112.1	T448 G453 G454 L455 K460 R461	T448-L457 HydrophobicContact CG2-CD1 3.64Å; G453-L457 WeakPolarHBondContact O-CG 3.34Å; G453-L457 PolarHBondContact O-N 2.66Å; G454-L457 PolarHBondContact O-N 2.94Å; L455-L457 VanDerWaalsContact C-N 3.29Å; L455-L457 PolarHBondContact O-N 2.95Å; L457-K460 PolarHBondContact O-N 3.2Å; L457-R461 WeakPolarHBondContact O-CB 3.34Å; L457-R461 PolarHBondContact O-N 3.07Å
458	D	87.4	Confident	84.1	Confident	2 Å²	2	78.6 Å²	78.6	1%	0.011	40%	0.401	C	S	.	.	H	α-helix	trans	-61	-46.1	176.3	-75.5	-5.4	0	0	0	111.1	G454 L455 R461 K462 G820 Y821 H822 L823	G454-D458 PolarHBondContact O-N 2.63Å; L455-D458 PolarHBondContact O-N 3.17Å; D458-R461 PolarHBondContact O-N 3.42Å; D458-K462 WeakPolarHBondContact O-CB 3.39Å; D458-K462 PolarHBondContact O-N 2.99Å; D458-K462 VanDerWaalsContact O-N 3.15Å; D458-G820 WeakPolarHBondContact OD2-CA 3.41Å; D458-Y821 PolarHBondContact OD2-N 3.15Å; D458-H822 WeakPolarHBondContact OD2-CB 3.24Å; D458-H822 IonicContact OD2-CG 3.96Å; D458-H822 PolarHBondContact OD2-N 3.11Å; D458-H822 IonicContact OD2-ND1 3.87Å; D458-H822 PolarHBondContact OD2-ND1 2.9Å; D458-L823 HydrophobicContact CB-CB 4.36Å
459	I	88.1	Confident	84.9	Confident	82 Å²	82	76.9 Å²	76.9	42%	0.421	39%	0.39	S	S	.	.	H	α-helix	trans	-63	-46.8	177.3	-66.4	169.5	0	0	0	110.8	L455 R461 K462 A463 L823	L455-I459 HydrophobicContact CD1-CD1 4.36Å; L455-I459 HydrophobicContact CG-CD1 4.11Å; L455-I459 WeakPolarHBondContact O-CG1 3.33Å; L455-I459 PolarHBondContact O-N 3.49Å; I459-R461 VanDerWaalsContact C-N 3.26Å; I459-R461 PolarHBondContact O-N 3.42Å; I459-K462 PolarHBondContact O-N 3.07Å; I459-K462 VanDerWaalsContact O-N 3.15Å; I459-A463 WeakPolarHBondContact O-CB 2.94Å; I459-A463 PolarHBondContact O-N 3.47Å; I459-L823 HydrophobicContact CD1-CD1 4.46Å; I459-L823 HydrophobicContact CG1-CD1 4.13Å; I459-L823 HydrophobicContact CG1-CD2 4.36Å
460	K	88.8	Confident	85.7	Confident	163 Å²	163	76.6 Å²	76.6	71%	0.709	37%	0.367	S	S	*	.	H	α-helix	trans	-60.9	-35.5	-179.5	-173.6	176.8	179.4	-179.5	0	112.2	V456 L457	V456-K460 WeakPolarHBondContact O-CB 3.02Å; V456-K460 PolarHBondContact O-N 2.84Å; L457-K460 PolarHBondContact O-N 3.2Å
461	R	84.8	Confident	86	Confident	67 Å²	67	76.2 Å²	76.2	25%	0.253	37%	0.365	S	S	.	.	H	α-helix	trans	-71.6	-35.5	177.4	-166.7	-179.6	-60.4	134	10.6	112.3	E444 L457 D458 I459	E444-R461 VanDerWaalsContact CB-NH1 3.34Å; E444-R461 IonicContact OE1-CZ 2.62Å; E444-R461 IonicContact OE1-NE 3.6Å; E444-R461 IonicContact OE1-NH1 3.47Å; E444-R461 PolarHBondContact OE1-NH1 2.68Å; L457-R461 WeakPolarHBondContact O-CB 3.34Å; L457-R461 PolarHBondContact O-N 3.07Å; D458-R461 PolarHBondContact O-N 3.42Å; I459-R461 VanDerWaalsContact C-N 3.26Å; I459-R461 PolarHBondContact O-N 3.42Å
462	K	85.9	Confident	86	Confident	24 Å²	24	73 Å²	73	10%	0.104	35%	0.349	C	S	.	.	H	α-helix	trans	-88.3	-32.6	-173.9	-78.3	-125	156.2	83.7	0	115.3	D458 I459 W465 G529 G818 G820	D458-K462 WeakPolarHBondContact O-CB 3.39Å; D458-K462 PolarHBondContact O-N 2.99Å; D458-K462 VanDerWaalsContact O-N 3.15Å; I459-K462 PolarHBondContact O-N 3.07Å; I459-K462 VanDerWaalsContact O-N 3.15Å; K462-W465 PolarHBondContact O-N 2.86Å; K462-G529 WeakPolarHBondContact CD-O 3.38Å; K462-G529 WeakPolarHBondContact CE-O 3.41Å; K462-G529 PolarHBondContact NZ-O 2.88Å; K462-G818 WeakPolarHBondContact CE-O 3.48Å; K462-G818 PolarHBondContact NZ-O 3.4Å; K462-G820 VanDerWaalsContact NZ-N 3.18Å
463	A	86.3	Confident	86.1	Confident	65 Å²	65	69.7 Å²	69.7	54%	0.537	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-46.3	-45.4	-178.5	0	0	0	0	0	115.2	I459 W465 Y466	I459-A463 WeakPolarHBondContact O-CB 2.94Å; I459-A463 PolarHBondContact O-N 3.47Å; A463-W465 VanDerWaalsContact C-N 3.3Å; A463-W465 PolarHBondContact O-N 3.46Å; A463-Y466 PolarHBondContact O-N 3.08Å
464	P	87.8	Confident	86.1	Confident	93 Å²	93	76.7 Å²	76.7	60%	0.604	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-69.9	-24.2	-177.4	26.9	-35.1	0	0	0	113.9
465	W	86.1	Confident	85.9	Confident	118 Å²	118	77.8 Å²	77.8	45%	0.447	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-86.1	-11.3	-175.9	-60.8	102.8	0	0	0	113.4	K462 A463 W467 S468 D469 K817	K462-W465 PolarHBondContact O-N 2.86Å; A463-W465 VanDerWaalsContact C-N 3.3Å; A463-W465 PolarHBondContact O-N 3.46Å; W465-W467 VanDerWaalsContact C-N 3.32Å; W465-W467 PolarHBondContact O-N 2.62Å; W465-S468 WeakPolarHBondContact O-CB 3.37Å; W465-S468 PolarHBondContact O-N 3.43Å; W465-S468 PolarHBondContact O-OG 3.32Å; W465-D469 PolarHBondContact O-N 3.17Å; W465-D469 VanDerWaalsContact O-N 3.17Å; W465-K817 HydrophobicContact CB-CD 4.11Å; W465-K817 HydrophobicContact CB-CG 4.28Å; W465-K817 HydrophobicContact CD2-CG 3.96Å; W465-K817 HydrophobicContact CE3-CD 4.45Å; W465-K817 HydrophobicContact CE3-CG 4.1Å; W465-K817 HydrophobicContact CG-CD 4.4Å; W465-K817 HydrophobicContact CG-CG 4.04Å
466	Y	86.9	Confident	85.7	Confident	72 Å²	72	81.9 Å²	81.9	28%	0.282	40%	0.398	S	S	.	.	H	α-helix	trans	-55.8	-42	-172.9	-161.7	-100.5	0	0	0	113.5	A463 D469 Y470 L526	A463-Y466 PolarHBondContact O-N 3.08Å; Y466-D469 PolarHBondContact O-N 2.9Å; Y466-Y470 HydrophobicContact CD1-CE2 4.14Å; Y466-Y470 AromaticContact CE1-CE2 3.7Å; Y466-Y470 HydrophobicContact CE1-CE2 3.7Å; Y466-Y470 WeakPolarHBondContact O-CD2 3.28Å; Y466-L526 VanDerWaalsContact CE2-O 3.31Å; Y466-L526 WeakPolarHBondContact CE2-O 3.31Å; Y466-L526 PolarHBondContact OH-O 3.45Å; Y466-L526 VanDerWaalsContact OH-O 3.08Å
467	W	86.9	Confident	85.6	Confident	186 Å²	186	78.6 Å²	78.6	71%	0.705	38%	0.377	S	S	*	.	H	α-helix	trans	-76.6	-25.5	178.6	-123.2	-144	0	0	0	113.9	W465 D469 Y470	W465-W467 VanDerWaalsContact C-N 3.32Å; W465-W467 PolarHBondContact O-N 2.62Å; W467-D469 VanDerWaalsContact C-N 3.32Å; W467-Y470 HydrophobicContact CE3-CD2 4.14Å; W467-Y470 HydrophobicContact CZ3-CD2 4.21Å; W467-Y470 HydrophobicContact CZ3-CE2 4.35Å
468	S	87.2	Confident	85.6	Confident	31 Å²	31	75 Å²	75	22%	0.217	36%	0.358	C	S	.	.	H	α-helix	trans	-67.7	-35.7	173.5	73.7	0	0	0	0	111.4	W465 Y470 R471 D472 K817	W465-S468 WeakPolarHBondContact O-CB 3.37Å; W465-S468 PolarHBondContact O-N 3.43Å; W465-S468 PolarHBondContact O-OG 3.32Å; S468-Y470 VanDerWaalsContact C-N 3.27Å; S468-Y470 PolarHBondContact O-N 3.08Å; S468-R471 PolarHBondContact O-N 2.84Å; S468-R471 VanDerWaalsContact O-N 3.13Å; S468-D472 VanDerWaalsContact O-CG 3.27Å; S468-D472 PolarHBondContact O-N 3Å; S468-K817 PolarHBondContact OG-NZ 3.27Å
469	D	88.4	Confident	85.6	Confident	11 Å²	11	78.3 Å²	78.3	6%	0.059	38%	0.376	C	S	.	.	H	α-helix	trans	-60.6	-33.7	-178.3	-63.5	-11.3	0	0	0	113	W465 Y466 W467 K817 Q878 R879	W465-D469 PolarHBondContact O-N 3.17Å; W465-D469 VanDerWaalsContact O-N 3.17Å; Y466-D469 PolarHBondContact O-N 2.9Å; W467-D469 VanDerWaalsContact C-N 3.32Å; D469-K817 WeakPolarHBondContact OD1-CD 3.25Å; D469-K817 WeakPolarHBondContact OD1-CE 3Å; D469-K817 IonicContact OD1-NZ 3.11Å; D469-K817 PolarHBondContact OD1-NZ 3.28Å; D469-Q878 WeakPolarHBondContact O-CB 3.21Å; D469-R879 HydrophobicContact CB-CB 4.47Å; D469-R879 HydrophobicContact CB-CG 3.98Å; D469-R879 WeakPolarHBondContact OD2-CD 3.44Å; D469-R879 IonicContact OD2-CZ 3.9Å; D469-R879 IonicContact OD2-NE 3Å; D469-R879 PolarHBondContact OD2-NE 3.15Å; D469-R879 IonicContact OD2-NH2 3.73Å
470	Y	87.8	Confident	85.3	Confident	67 Å²	67	74.5 Å²	74.5	26%	0.263	36%	0.356	S	S	.	.	H	α-helix	trans	-79.7	-32	177.7	-72.6	-85.1	0	0	0	112.9	Y466 W467 S468 V880	Y466-Y470 HydrophobicContact CD1-CE2 4.14Å; Y466-Y470 AromaticContact CE1-CE2 3.7Å; Y466-Y470 HydrophobicContact CE1-CE2 3.7Å; Y466-Y470 WeakPolarHBondContact O-CD2 3.28Å; W467-Y470 HydrophobicContact CE3-CD2 4.14Å; W467-Y470 HydrophobicContact CZ3-CD2 4.21Å; W467-Y470 HydrophobicContact CZ3-CE2 4.35Å; S468-Y470 VanDerWaalsContact C-N 3.27Å; S468-Y470 PolarHBondContact O-N 3.08Å; Y470-V880 HydrophobicContact CD1-CG2 3.5Å; Y470-V880 VanDerWaalsContact CD1-CG2 3.5Å; Y470-V880 HydrophobicContact CE1-CG2 3.92Å; Y470-V880 HydrophobicContact CG-CG2 4.32Å
471	R	85.2	Confident	85.1	Confident	194 Å²	194	67 Å²	67	73%	0.732	32%	0.324	S	S	*	.	H	α-helix	trans	-71.1	-40.8	173.9	-85.9	-165.1	178.2	118.7	-2.8	111.9	S468 A473 L474	S468-R471 PolarHBondContact O-N 2.84Å; S468-R471 VanDerWaalsContact O-N 3.13Å; R471-A473 PolarHBondContact O-N 3.15Å; R471-L474 PolarHBondContact O-N 2.96Å
472	D	82.7	Confident	85.3	Confident	73 Å²	73	65.7 Å²	65.7	39%	0.39	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-17.8	-178.5	-69	-21.6	0	0	0	112.9	S468 K817	S468-D472 VanDerWaalsContact O-CG 3.27Å; S468-D472 PolarHBondContact O-N 3Å; D472-K817 IonicContact OD2-NZ 3.64Å; D472-K817 PolarHBondContact OD2-NZ 2.97Å
473	A	84.4	Confident	85.3	Confident	11 Å²	11	66.7 Å²	66.7	9%	0.091	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-15.5	-179.1	0	0	0	0	0	115	R471 S475 C478 Q878 V880	R471-A473 PolarHBondContact O-N 3.15Å; A473-S475 PolarHBondContact O-N 3.48Å; A473-C478 WeakPolarHBondContact O-CB 3.14Å; A473-Q878 HydrophobicContact CB-CB 4.21Å; A473-V880 HydrophobicContact CB-CB 3.55Å; A473-V880 HydrophobicContact CB-CG1 4.2Å; A473-V880 HydrophobicContact CB-CG2 3.48Å; A473-V880 VanDerWaalsContact CB-CG2 3.48Å
474	L	82.4	Confident	85.3	Confident	160 Å²	160	64.4 Å²	64.4	84%	0.838	31%	0.305	S	S	*	.			trans	-80.4	55.8	-173.7	-68.5	171.2	0	0	0	112.8	R471	R471-L474 PolarHBondContact O-N 2.96Å
475	S	80.3	Confident	85.2	Confident	29 Å²	29	60 Å²	60	20%	0.203	28%	0.276	C	S	.	.	S	Bend	trans	-130.8	150.7	178	73.7	0	0	0	0	111.9	A473 Q477 C478 R876	A473-S475 PolarHBondContact O-N 3.48Å; S475-Q477 PolarHBondContact O-N 3.27Å; S475-C478 WeakPolarHBondContact O-CB 3.46Å; S475-C478 PolarHBondContact O-N 3.32Å; S475-C478 PolarHBondContact OG-SG 3.4Å; S475-R876 PolarHBondContact OG-NH1 3.21Å
476	L	81.1	Confident	85.3	Confident	102 Å²	102	55 Å²	55	53%	0.534	26%	0.257	S	S	.	.	H	α-helix	trans	-63.3	-29.1	-179.1	-147.5	103.3	0	0	0	112.8	C478 L479 A480 M728 F732	L476-C478 VanDerWaalsContact C-N 3.32Å; L476-C478 PolarHBondContact O-N 3.21Å; L476-L479 WeakPolarHBondContact O-CB 3.08Å; L476-L479 PolarHBondContact O-N 3.27Å; L476-A480 PolarHBondContact O-N 2.88Å; L476-M728 HydrophobicContact CD2-CE 4.21Å; L476-M728 HydrophobicContact CD2-SD 3.18Å; L476-M728 WeakPolarHBondContact CD2-SD 3.47Å; L476-M728 HydrophobicContact CG-SD 4.45Å; L476-F732 HydrophobicContact CD2-CE2 4.06Å; L476-F732 HydrophobicContact CD2-CZ 4.45Å
477	Q	84.6	Confident	85	Confident	20 Å²	20	52.2 Å²	52.2	9%	0.093	25%	0.248	C	C	.	.	H	α-helix	trans	-60.8	-40.6	173.5	-176.3	-178.5	1.8	0	0	111.6	S475 L479 A480 S481 S856 K858 L859	S475-Q477 PolarHBondContact O-N 3.27Å; Q477-L479 VanDerWaalsContact C-N 3.29Å; Q477-L479 PolarHBondContact O-N 3.37Å; Q477-A480 PolarHBondContact O-N 3.25Å; Q477-S481 PolarHBondContact O-N 2.73Å; Q477-S481 PolarHBondContact O-OG 2.85Å; Q477-S856 PolarHBondContact NE2-O 3.17Å; Q477-K858 PolarHBondContact NE2-O 3.31Å; Q477-L859 VanDerWaalsContact OE1-CD2 3.28Å
478	C	85.1	Confident	84.8	Confident	5 Å²	5	43.5 Å²	43.5	3%	0.034	22%	0.216	C	C	.	.	H	α-helix	trans	-64.5	-35.7	178.4	-65.2	0	0	0	0	111.9	A473 S475 L476 S481 F482 T881	A473-C478 WeakPolarHBondContact O-CB 3.14Å; S475-C478 WeakPolarHBondContact O-CB 3.46Å; S475-C478 PolarHBondContact O-N 3.32Å; S475-C478 PolarHBondContact OG-SG 3.4Å; L476-C478 VanDerWaalsContact C-N 3.32Å; L476-C478 PolarHBondContact O-N 3.21Å; C478-S481 PolarHBondContact O-N 3.21Å; C478-F482 VanDerWaalsContact O-CD1 3.24Å; C478-F482 WeakPolarHBondContact O-CD1 3.32Å; C478-F482 PolarHBondContact O-N 3.5Å; C478-T881 HydrophobicContact CB-CG2 3.94Å
479	L	86.4	Confident	84.6	Confident	72 Å²	72	42.3 Å²	42.3	38%	0.377	21%	0.207	S	C	.	.	H	α-helix	trans	-61.7	-47.5	173.9	174.3	60.7	0	0	0	111.8	L476 Q477 S481 F482 L483	L476-L479 WeakPolarHBondContact O-CB 3.08Å; L476-L479 PolarHBondContact O-N 3.27Å; Q477-L479 VanDerWaalsContact C-N 3.29Å; Q477-L479 PolarHBondContact O-N 3.37Å; L479-S481 VanDerWaalsContact C-N 3.35Å; L479-S481 PolarHBondContact O-N 3.09Å; L479-F482 HydrophobicContact CB-CE1 4.13Å; L479-F482 HydrophobicContact CD1-CD1 4.32Å; L479-F482 HydrophobicContact CD1-CE1 3.29Å; L479-F482 HydrophobicContact CD1-CE2 4.11Å; L479-F482 HydrophobicContact CD1-CZ 3.15Å; L479-F482 HydrophobicContact CG-CE1 4.28Å; L479-F482 HydrophobicContact CG-CZ 4.47Å; L479-L483 HydrophobicContact CD1-CD1 4Å; L479-L483 HydrophobicContact CD1-CG 4.36Å; L479-L483 HydrophobicContact CG-CD1 4.39Å; L479-L483 WeakPolarHBondContact O-CG 3.45Å; L479-L483 PolarHBondContact O-N 3.08Å
480	A	83.2	Confident	84.4	Confident	1 Å²	1	42 Å²	42	1%	0.008	21%	0.206	C	C	.	.	H	α-helix	trans	-59.1	-46.7	175.1	0	0	0	0	0	111.8	L476 Q477 F482 L483 F484 D731 F732	L476-A480 PolarHBondContact O-N 2.88Å; Q477-A480 PolarHBondContact O-N 3.25Å; A480-F482 PolarHBondContact O-N 3.01Å; A480-L483 PolarHBondContact O-N 3.24Å; A480-F484 WeakPolarHBondContact O-CB 3.09Å; A480-F484 PolarHBondContact O-N 2.87Å; A480-D731 HydrophobicContact CB-CB 4.2Å; A480-F732 VanDerWaalsContact CA-CE1 3.42Å; A480-F732 HydrophobicContact CB-CD1 3.66Å; A480-F732 HydrophobicContact CB-CD2 3.98Å; A480-F732 HydrophobicContact CB-CE1 3.46Å; A480-F732 VanDerWaalsContact CB-CE1 3.46Å; A480-F732 HydrophobicContact CB-CE2 3.77Å; A480-F732 HydrophobicContact CB-CG 3.92Å; A480-F732 HydrophobicContact CB-CZ 3.51Å
481	S	84.7	Confident	84	Confident	5 Å²	5	38.9 Å²	38.9	4%	0.035	19%	0.193	C	C	.	.	H	α-helix	trans	-58.9	-48.2	-179.3	-71	0	0	0	0	112.9	Q477 C478 L479 L485 S856	Q477-S481 PolarHBondContact O-N 2.73Å; Q477-S481 PolarHBondContact O-OG 2.85Å; C478-S481 PolarHBondContact O-N 3.21Å; L479-S481 VanDerWaalsContact C-N 3.35Å; L479-S481 PolarHBondContact O-N 3.09Å; S481-L485 VanDerWaalsContact O-CB 3.31Å; S481-L485 WeakPolarHBondContact O-CB 3.29Å; S481-L485 WeakPolarHBondContact O-CD1 3.44Å; S481-L485 VanDerWaalsContact O-CG 3.32Å; S481-L485 WeakPolarHBondContact O-CG 3.4Å; S481-L485 PolarHBondContact O-N 3.22Å; S481-S856 WeakPolarHBondContact CB-OG 3.09Å; S481-S856 WeakPolarHBondContact OG-CB 3.26Å; S481-S856 PolarHBondContact OG-O 3.28Å; S481-S856 PolarHBondContact OG-OG 3.05Å
482	F	87.8	Confident	83.7	Confident	40 Å²	40	30.1 Å²	30.1	18%	0.175	16%	0.162	C	C	.	.	H	α-helix	trans	-71.7	-34	-176	80.3	-114.2	0	0	0	112.6	C478 L479 A480 Y486 T881 M884 I885 L888	C478-F482 VanDerWaalsContact O-CD1 3.24Å; C478-F482 WeakPolarHBondContact O-CD1 3.32Å; C478-F482 PolarHBondContact O-N 3.5Å; L479-F482 HydrophobicContact CB-CE1 4.13Å; L479-F482 HydrophobicContact CD1-CD1 4.32Å; L479-F482 HydrophobicContact CD1-CE1 3.29Å; L479-F482 HydrophobicContact CD1-CE2 4.11Å; L479-F482 HydrophobicContact CD1-CZ 3.15Å; L479-F482 HydrophobicContact CG-CE1 4.28Å; L479-F482 HydrophobicContact CG-CZ 4.47Å; A480-F482 PolarHBondContact O-N 3.01Å; F482-Y486 VanDerWaalsContact O-CB 3.23Å; F482-Y486 WeakPolarHBondContact O-CB 3.4Å; F482-Y486 PolarHBondContact O-N 3.38Å; F482-T881 HydrophobicContact CB-CG2 4.41Å; F482-M884 HydrophobicContact CB-CB 4.42Å; F482-M884 HydrophobicContact CD1-CB 4.48Å; F482-M884 HydrophobicContact CD2-CB 4.38Å; F482-M884 HydrophobicContact CG-CB 4.22Å; F482-I885 HydrophobicContact CB-CG1 4Å; F482-L888 HydrophobicContact CD2-CD1 3.59Å; F482-L888 HydrophobicContact CE2-CD1 3.61Å
483	L	86	Confident	83.8	Confident	46 Å²	46	27 Å²	27	24%	0.241	15%	0.145	C	C	.	.	H	α-helix	trans	-67.3	-44.4	176.5	-72.1	174.3	0	0	0	111.6	L479 A480 C487 F735	L479-L483 HydrophobicContact CD1-CD1 4Å; L479-L483 HydrophobicContact CD1-CG 4.36Å; L479-L483 HydrophobicContact CG-CD1 4.39Å; L479-L483 WeakPolarHBondContact O-CG 3.45Å; L479-L483 PolarHBondContact O-N 3.08Å; A480-L483 PolarHBondContact O-N 3.24Å; L483-C487 PolarHBondContact O-N 3.14Å; L483-F735 HydrophobicContact CB-CD2 4.15Å; L483-F735 HydrophobicContact CB-CE2 4.37Å
484	F	85.4	Confident	83.6	Confident	16 Å²	16	27.2 Å²	27.2	7%	0.07	15%	0.145	C	C	.	.	H	α-helix	trans	-59.9	-51.5	173.7	158.8	-127.7	0	0	0	111.4	A480 Y486 C487 A488 V734 T852 M914	A480-F484 WeakPolarHBondContact O-CB 3.09Å; A480-F484 PolarHBondContact O-N 2.87Å; F484-Y486 VanDerWaalsContact C-N 3.29Å; F484-Y486 PolarHBondContact O-N 2.74Å; F484-C487 PolarHBondContact O-N 3.23Å; F484-A488 HydrophobicContact CE2-CB 4.28Å; F484-A488 PolarHBondContact O-N 2.98Å; F484-A488 VanDerWaalsContact O-N 3.1Å; F484-V734 HydrophobicContact CD2-CB 3.48Å; F484-V734 VanDerWaalsContact CD2-CB 3.48Å; F484-V734 HydrophobicContact CD2-CG1 3.55Å; F484-V734 HydrophobicContact CD2-CG2 4.08Å; F484-V734 HydrophobicContact CE2-CB 3.61Å; F484-V734 HydrophobicContact CE2-CG1 3.45Å; F484-V734 VanDerWaalsContact CE2-CG1 3.45Å; F484-V734 HydrophobicContact CE2-CG2 3.78Å; F484-V734 HydrophobicContact CG-CB 4.31Å; F484-V734 HydrophobicContact CZ-CB 4.47Å; F484-V734 HydrophobicContact CZ-CG2 4.2Å; F484-T852 HydrophobicContact CE1-CG2 3.41Å; F484-T852 VanDerWaalsContact CE1-CG2 3.41Å; F484-T852 HydrophobicContact CZ-CG2 3.39Å; F484-M914 HydrophobicContact CZ-SD 4.4Å
485	L	86.8	Confident	83.4	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-67.4	-30.1	-177.3	-75.8	160	0	0	0	112.7	S481 A488 C489 I534 T852 H853 I885	S481-L485 VanDerWaalsContact O-CB 3.31Å; S481-L485 WeakPolarHBondContact O-CB 3.29Å; S481-L485 WeakPolarHBondContact O-CD1 3.44Å; S481-L485 VanDerWaalsContact O-CG 3.32Å; S481-L485 WeakPolarHBondContact O-CG 3.4Å; S481-L485 PolarHBondContact O-N 3.22Å; L485-A488 PolarHBondContact O-N 3.47Å; L485-C489 VanDerWaalsContact O-CB 3.27Å; L485-C489 WeakPolarHBondContact O-CB 3.24Å; L485-C489 PolarHBondContact O-N 3.07Å; L485-C489 PolarHBondContact O-SG 2.56Å; L485-I534 HydrophobicContact CD1-CD1 4.39Å; L485-I534 HydrophobicContact CD2-CD1 3.94Å; L485-T852 HydrophobicContact CD2-CG2 4.34Å; L485-H853 HydrophobicContact CD1-CB 3.75Å; L485-H853 WeakPolarHBondContact CD1-CD2 3.16Å; L485-H853 HydrophobicContact CD2-CB 4.05Å; L485-I885 HydrophobicContact CB-CD1 3.43Å; L485-I885 VanDerWaalsContact CB-CD1 3.43Å; L485-I885 HydrophobicContact CB-CG1 3.95Å; L485-I885 HydrophobicContact CD1-CD1 3.79Å; L485-I885 HydrophobicContact CG-CD1 4.24Å
486	Y	88.1	Confident	83.4	Confident	14 Å²	14	19.7 Å²	19.7	6%	0.055	10%	0.103	C	C	.	.	H	α-helix	trans	-56.4	-52.5	172.3	165.7	-105.7	0	0	0	111.5	F482 F484 A488 C489 M490 L888 M889 S892 M895 L899	F482-Y486 VanDerWaalsContact O-CB 3.23Å; F482-Y486 WeakPolarHBondContact O-CB 3.4Å; F482-Y486 PolarHBondContact O-N 3.38Å; F484-Y486 VanDerWaalsContact C-N 3.29Å; F484-Y486 PolarHBondContact O-N 2.74Å; Y486-A488 VanDerWaalsContact C-N 3.31Å; Y486-A488 PolarHBondContact O-N 2.86Å; Y486-C489 PolarHBondContact O-N 3.04Å; Y486-M490 WeakPolarHBondContact O-CB 3.22Å; Y486-M490 PolarHBondContact O-N 2.86Å; Y486-L888 HydrophobicContact CD2-CB 3.65Å; Y486-L888 HydrophobicContact CE2-CB 3.91Å; Y486-L888 HydrophobicContact CG-CB 4.3Å; Y486-M889 HydrophobicContact CD2-CE 4.28Å; Y486-M889 HydrophobicContact CE2-SD 4.31Å; Y486-S892 VanDerWaalsContact OH-CB 3.23Å; Y486-S892 WeakPolarHBondContact OH-CB 3.49Å; Y486-M895 HydrophobicContact CE1-CE 4.33Å; Y486-L899 HydrophobicContact CE1-CD2 4.45Å; Y486-L899 WeakPolarHBondContact OH-CD1 3.34Å
487	C	81.2	Confident	83.4	Confident	14 Å²	14	14.9 Å²	14.9	10%	0.095	8%	0.078	C	C	.	.	H	α-helix	trans	-62.1	-39.6	177	-63.2	0	0	0	0	112	L483 F484 I738	L483-C487 PolarHBondContact O-N 3.14Å; F484-C487 PolarHBondContact O-N 3.23Å; C487-I738 HydrophobicContact CB-CD1 3.68Å
488	A	81.1	Confident	83.1	Confident	2 Å²	2	15.7 Å²	15.7	2%	0.017	9%	0.092	C	C	.	.	H	α-helix	trans	-67.6	-37.8	178.7	0	0	0	0	0	113.4	F484 L485 Y486 P492 M914	F484-A488 HydrophobicContact CE2-CB 4.28Å; F484-A488 PolarHBondContact O-N 2.98Å; F484-A488 VanDerWaalsContact O-N 3.1Å; L485-A488 PolarHBondContact O-N 3.47Å; Y486-A488 VanDerWaalsContact C-N 3.31Å; Y486-A488 PolarHBondContact O-N 2.86Å; A488-P492 WeakPolarHBondContact O-CD 3.49Å; A488-P492 WeakPolarHBondContact O-CG 3.07Å; A488-M914 HydrophobicContact CB-CE 3.95Å; A488-M914 HydrophobicContact CB-SD 3.61Å
489	C	83.9	Confident	82.8	Confident	6 Å²	6	19.2 Å²	19.2	4%	0.041	11%	0.11	C	C	.	.	H	α-helix	trans	-79.3	-29.8	-179.3	-65.2	0	0	0	0	112.4	L485 Y486 P492 V493 L849 I885 M889	L485-C489 VanDerWaalsContact O-CB 3.27Å; L485-C489 WeakPolarHBondContact O-CB 3.24Å; L485-C489 PolarHBondContact O-N 3.07Å; L485-C489 PolarHBondContact O-SG 2.56Å; Y486-C489 PolarHBondContact O-N 3.04Å; C489-P492 WeakPolarHBondContact O-CD 3.42Å; C489-V493 WeakPolarHBondContact O-CG2 3.48Å; C489-L849 HydrophobicContact CB-CD2 4.24Å; C489-L849 WeakPolarHBondContact SG-CD2 3.14Å; C489-I885 HydrophobicContact CB-CG2 4.24Å; C489-M889 HydrophobicContact CB-CE 3.63Å
490	M	83.9	Confident	82.6	Confident	5 Å²	5	16 Å²	16	3%	0.025	9%	0.093	C	C	.	.	H	α-helix	trans	-68.7	-41.5	-175.6	-174.1	-177.5	176.6	0	0	111.9	Y486 V493 I494 L755 V757 M889 L899	Y486-M490 WeakPolarHBondContact O-CB 3.22Å; Y486-M490 PolarHBondContact O-N 2.86Å; M490-V493 PolarHBondContact O-N 3.22Å; M490-I494 HydrophobicContact CE-CD1 3.42Å; M490-I494 VanDerWaalsContact CE-CD1 3.42Å; M490-I494 HydrophobicContact CG-CD1 3.67Å; M490-I494 HydrophobicContact CG-CG1 4.43Å; M490-I494 WeakPolarHBondContact O-CG1 3.13Å; M490-I494 PolarHBondContact O-N 2.91Å; M490-I494 HydrophobicContact SD-CD1 4.37Å; M490-L755 HydrophobicContact CE-CD2 3.61Å; M490-L755 HydrophobicContact SD-CD2 4.15Å; M490-V757 HydrophobicContact CE-CG2 3.73Å; M490-M889 VanDerWaalsContact CA-CE 3.49Å; M490-M889 HydrophobicContact CB-CE 3.79Å; M490-M889 HydrophobicContact CB-SD 3.75Å; M490-M889 HydrophobicContact CG-SD 3.84Å; M490-L899 HydrophobicContact CE-CB 4.16Å; M490-L899 HydrophobicContact CE-CD1 3.6Å; M490-L899 HydrophobicContact CE-CD2 3.61Å; M490-L899 HydrophobicContact CE-CG 3.95Å; M490-L899 HydrophobicContact SD-CD1 4.23Å; M490-L899 HydrophobicContact SD-CD2 3.43Å; M490-L899 WeakPolarHBondContact SD-CD2 3.19Å; M490-L899 HydrophobicContact SD-CG 4.35Å
491	S	78.9	Confident	82.6	Confident	1 Å²	1	16.5 Å²	16.5	1%	0.007	10%	0.098	C	C	.	.	H	α-helix	trans	-63.6	-47.6	-175.2	-177.3	0	0	0	0	113.5	V493 I494 T495 F911	S491-V493 PolarHBondContact O-N 3.44Å; S491-I494 PolarHBondContact O-N 3.43Å; S491-T495 WeakPolarHBondContact O-CB 3.31Å; S491-T495 WeakPolarHBondContact O-CG2 3.18Å; S491-T495 PolarHBondContact O-N 3.29Å; S491-T495 PolarHBondContact O-OG1 2.92Å; S491-F911 WeakPolarHBondContact OG-CE2 3.32Å; S491-F911 WeakPolarHBondContact OG-CZ 3.23Å
492	P	79.1	Confident	82.4	Confident	10 Å²	10	23.7 Å²	23.7	7%	0.065	13%	0.131	C	C	.	.	H	α-helix	trans	-64.7	-39.1	176.6	-21.6	33.3	0	0	0	112.1	A488 C489 I494 T495 F496 F911	A488-P492 WeakPolarHBondContact O-CD 3.49Å; A488-P492 WeakPolarHBondContact O-CG 3.07Å; C489-P492 WeakPolarHBondContact O-CD 3.42Å; P492-I494 VanDerWaalsContact C-N 3.32Å; P492-I494 PolarHBondContact O-N 3.04Å; P492-T495 WeakPolarHBondContact CA-OG1 3.37Å; P492-T495 PolarHBondContact O-N 2.98Å; P492-T495 PolarHBondContact O-OG1 3.11Å; P492-F496 HydrophobicContact CB-CD2 4.08Å; P492-F496 HydrophobicContact CB-CE2 4.02Å; P492-F496 VanDerWaalsContact O-CB 3.28Å; P492-F496 WeakPolarHBondContact O-CB 3.24Å; P492-F496 WeakPolarHBondContact O-CD2 3.37Å; P492-F496 WeakPolarHBondContact O-CG 3.17Å; P492-F496 PolarHBondContact O-N 3.15Å; P492-F911 HydrophobicContact CB-CZ 4.39Å; P492-F911 VanDerWaalsContact CD-CZ 3.44Å; P492-F911 HydrophobicContact CG-CE1 3.62Å; P492-F911 HydrophobicContact CG-CZ 3.51Å
493	V	84.6	Confident	82.1	Confident	8 Å²	8	23.1 Å²	23.1	5%	0.048	13%	0.133	C	C	.	.	H	α-helix	trans	-62.4	-40.8	-179.7	170.9	0	0	0	0	111.4	C489 M490 S491 G497 S513 L514 A517	C489-V493 WeakPolarHBondContact O-CG2 3.48Å; M490-V493 PolarHBondContact O-N 3.22Å; S491-V493 PolarHBondContact O-N 3.44Å; V493-G497 PolarHBondContact O-N 3.15Å; V493-S513 PolarHBondContact O-OG 3.34Å; V493-L514 HydrophobicContact CG1-CD1 4.36Å; V493-A517 HydrophobicContact CG1-CB 3.9Å; V493-A517 HydrophobicContact CG2-CB 4.03Å
494	I	81.7	Confident	82.1	Confident	15 Å²	15	20.9 Å²	20.9	8%	0.077	12%	0.122	C	C	.	.	H	α-helix	trans	-75.4	-45.8	178	-67.6	174.7	0	0	0	111.4	M490 S491 P492 G497 G498 L755 V757	M490-I494 HydrophobicContact CE-CD1 3.42Å; M490-I494 VanDerWaalsContact CE-CD1 3.42Å; M490-I494 HydrophobicContact CG-CD1 3.67Å; M490-I494 HydrophobicContact CG-CG1 4.43Å; M490-I494 WeakPolarHBondContact O-CG1 3.13Å; M490-I494 PolarHBondContact O-N 2.91Å; M490-I494 HydrophobicContact SD-CD1 4.37Å; S491-I494 PolarHBondContact O-N 3.43Å; P492-I494 VanDerWaalsContact C-N 3.32Å; P492-I494 PolarHBondContact O-N 3.04Å; I494-G497 CarbonylContact O-C 3.54Å; I494-G497 PolarHBondContact O-N 3.3Å; I494-G498 PolarHBondContact O-N 3.03Å; I494-L755 HydrophobicContact CB-CD1 4.41Å; I494-L755 HydrophobicContact CD1-CD1 3.99Å; I494-L755 HydrophobicContact CD1-CD2 4.08Å; I494-L755 HydrophobicContact CD1-CG 4.23Å; I494-L755 HydrophobicContact CG2-CD1 3.94Å; I494-V757 HydrophobicContact CD1-CG2 4.11Å
495	T	77.8	Confident	82	Confident	16 Å²	16	25.3 Å²	25.3	10%	0.098	14%	0.143	C	C	.	.	H	α-helix	trans	-64	-45	-179.5	51.8	0	0	0	0	111.6	S491 P492 G497 G498 L499	S491-T495 WeakPolarHBondContact O-CB 3.31Å; S491-T495 WeakPolarHBondContact O-CG2 3.18Å; S491-T495 PolarHBondContact O-N 3.29Å; S491-T495 PolarHBondContact O-OG1 2.92Å; P492-T495 WeakPolarHBondContact CA-OG1 3.37Å; P492-T495 PolarHBondContact O-N 2.98Å; P492-T495 PolarHBondContact O-OG1 3.11Å; T495-G497 VanDerWaalsContact C-N 3.35Å; T495-G498 PolarHBondContact O-N 3.02Å; T495-L499 WeakPolarHBondContact O-CG 3.44Å; T495-L499 PolarHBondContact O-N 3.37Å
496	F	79.6	Confident	81.7	Confident	16 Å²	16	26.2 Å²	26.2	7%	0.07	15%	0.152	C	C	.	.	H	α-helix	trans	-67.4	-35	173.4	-68.9	-50.2	0	0	0	112.6	P492 G498 L499 L500 L542	P492-F496 HydrophobicContact CB-CD2 4.08Å; P492-F496 HydrophobicContact CB-CE2 4.02Å; P492-F496 VanDerWaalsContact O-CB 3.28Å; P492-F496 WeakPolarHBondContact O-CB 3.24Å; P492-F496 WeakPolarHBondContact O-CD2 3.37Å; P492-F496 WeakPolarHBondContact O-CG 3.17Å; P492-F496 PolarHBondContact O-N 3.15Å; F496-G498 VanDerWaalsContact C-N 3.33Å; F496-L499 HydrophobicContact CD1-CD1 4.32Å; F496-L500 WeakPolarHBondContact O-CB 3.14Å; F496-L500 PolarHBondContact O-N 3.08Å; F496-L542 HydrophobicContact CD1-CD2 3.92Å; F496-L542 HydrophobicContact CE1-CD2 4.41Å
497	G	82.4	Confident	81.4	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-64.4	-35.9	173.4	0	0	0	0	0	113.3	V493 I494 T495 G501 S509 A510	V493-G497 PolarHBondContact O-N 3.15Å; I494-G497 CarbonylContact O-C 3.54Å; I494-G497 PolarHBondContact O-N 3.3Å; T495-G497 VanDerWaalsContact C-N 3.35Å; G497-G501 PolarHBondContact O-N 2.91Å; G497-S509 CarbonylContact O-C 3.38Å; G497-A510 PolarHBondContact O-N 3.34Å
498	G	77.7	Confident	81.6	Confident	38 Å²	38	28.5 Å²	28.5	39%	0.392	16%	0.159	S	C	.	.	H	α-helix	trans	-69.8	-48.4	174.1	0	0	0	0	0	112.5	I494 T495 F496 L500 G501 E502	I494-G498 PolarHBondContact O-N 3.03Å; T495-G498 PolarHBondContact O-N 3.02Å; F496-G498 VanDerWaalsContact C-N 3.33Å; G498-L500 VanDerWaalsContact C-N 3.28Å; G498-L500 PolarHBondContact O-N 3.27Å; G498-G501 WeakPolarHBondContact O-CA 3.47Å; G498-G501 PolarHBondContact O-N 3.35Å; G498-E502 PolarHBondContact O-N 2.96Å
499	L	79.4	Confident	81.8	Confident	78 Å²	78	29.5 Å²	29.5	41%	0.408	17%	0.166	S	C	.	.	H	α-helix	trans	-60.2	-37.7	175.5	-70.8	173.4	0	0	0	112.1	T495 F496 A503 L542	T495-L499 WeakPolarHBondContact O-CG 3.44Å; T495-L499 PolarHBondContact O-N 3.37Å; F496-L499 HydrophobicContact CD1-CD1 4.32Å; L499-A503 VanDerWaalsContact O-CB 3.26Å; L499-A503 WeakPolarHBondContact O-CB 3.34Å; L499-A503 PolarHBondContact O-N 2.79Å; L499-L542 HydrophobicContact CB-CD2 4.39Å; L499-L542 HydrophobicContact CD1-CD2 4.47Å
500	L	81.5	Confident	81.7	Confident	6 Å²	6	30.1 Å²	30.1	3%	0.031	17%	0.171	C	C	.	.	H	α-helix	trans	-68.8	-36.7	174.4	-173.9	63.3	0	0	0	111.6	F496 G498 A503 T504 I508 L542 E545 P841	F496-L500 WeakPolarHBondContact O-CB 3.14Å; F496-L500 PolarHBondContact O-N 3.08Å; G498-L500 VanDerWaalsContact C-N 3.28Å; G498-L500 PolarHBondContact O-N 3.27Å; L500-A503 PolarHBondContact O-N 3.19Å; L500-T504 HydrophobicContact CD1-CG2 3.71Å; L500-T504 HydrophobicContact CG-CG2 4.26Å; L500-T504 WeakPolarHBondContact O-CB 3.24Å; L500-T504 VanDerWaalsContact O-CG2 3.31Å; L500-T504 WeakPolarHBondContact O-CG2 3.46Å; L500-T504 PolarHBondContact O-N 3.4Å; L500-T504 PolarHBondContact O-OG1 3.37Å; L500-I508 CarbonylContact C-O 3.52Å; L500-I508 HydrophobicContact CD2-CB 4.11Å; L500-I508 HydrophobicContact CD2-CG2 3.55Å; L500-I508 HydrophobicContact CG-CB 4.31Å; L500-I508 HydrophobicContact CG-CG2 4.22Å; L500-L542 HydrophobicContact CB-CD1 3.79Å; L500-L542 HydrophobicContact CD1-CD1 3.87Å; L500-L542 HydrophobicContact CG-CD1 4.36Å; L500-E545 HydrophobicContact CD1-CB 3.88Å; L500-E545 HydrophobicContact CD1-CG 4.48Å; L500-P841 HydrophobicContact CD2-CB 4.15Å
501	G	83.2	Confident	81.8	Confident	10 Å²	10	30.3 Å²	30.3	10%	0.103	17%	0.172	C	C	.	.	H	α-helix	trans	-58.8	-48.8	172.9	0	0	0	0	0	112.4	G497 G498 T504 E505 G506 I508	G497-G501 PolarHBondContact O-N 2.91Å; G498-G501 WeakPolarHBondContact O-CA 3.47Å; G498-G501 PolarHBondContact O-N 3.35Å; G501-T504 PolarHBondContact O-N 2.86Å; G501-E505 PolarHBondContact O-N 3.5Å; G501-G506 PolarHBondContact O-N 3.47Å; G501-I508 WeakPolarHBondContact CA-O 3.49Å; G501-I508 PolarHBondContact N-O 3.32Å; G501-I508 VanDerWaalsContact N-O 3.15Å
502	E	80.9	Confident	82.2	Confident	156 Å²	156	30.2 Å²	30.2	73%	0.729	17%	0.172	S	C	*	.	H	α-helix	trans	-64.6	-46.1	177.1	-170.1	179.9	177.8	0	0	111.6	G498 T504 E505	G498-E502 PolarHBondContact O-N 2.96Å; E502-T504 VanDerWaalsContact C-N 3.29Å; E502-T504 PolarHBondContact O-N 2.81Å; E502-E505 PolarHBondContact O-N 2.95Å
503	A	81.6	Confident	82.6	Confident	28 Å²	28	29.8 Å²	29.8	23%	0.231	17%	0.169	C	C	.	.	H	α-helix	trans	-67.3	-26.5	-178.8	0	0	0	0	0	113.9	L499 L500 K546 F549	L499-A503 VanDerWaalsContact O-CB 3.26Å; L499-A503 WeakPolarHBondContact O-CB 3.34Å; L499-A503 PolarHBondContact O-N 2.79Å; L500-A503 PolarHBondContact O-N 3.19Å; A503-K546 HydrophobicContact CB-CG 4.34Å; A503-F549 WeakPolarHBondContact O-CD1 3.46Å; A503-F549 WeakPolarHBondContact O-CE1 3.48Å
504	T	84.9	Confident	82.8	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	13.1	-176.8	66.1	0	0	0	0	113.7	L500 G501 E502 G506 R507 I508 F549 Y559	L500-T504 HydrophobicContact CD1-CG2 3.71Å; L500-T504 HydrophobicContact CG-CG2 4.26Å; L500-T504 WeakPolarHBondContact O-CB 3.24Å; L500-T504 VanDerWaalsContact O-CG2 3.31Å; L500-T504 WeakPolarHBondContact O-CG2 3.46Å; L500-T504 PolarHBondContact O-N 3.4Å; L500-T504 PolarHBondContact O-OG1 3.37Å; G501-T504 PolarHBondContact O-N 2.86Å; E502-T504 VanDerWaalsContact C-N 3.29Å; E502-T504 PolarHBondContact O-N 2.81Å; T504-G506 VanDerWaalsContact C-N 3.25Å; T504-G506 PolarHBondContact O-N 3.25Å; T504-R507 WeakPolarHBondContact O-CB 3.2Å; T504-R507 VanDerWaalsContact O-CG 3.28Å; T504-R507 WeakPolarHBondContact O-CG 3.38Å; T504-R507 PolarHBondContact O-N 3.49Å; T504-R507 VanDerWaalsContact O-N 3.14Å; T504-I508 PolarHBondContact OG1-N 3.22Å; T504-I508 PolarHBondContact OG1-O 3.48Å; T504-F549 HydrophobicContact CG2-CB 4.4Å; T504-F549 HydrophobicContact CG2-CD2 4.35Å; T504-F549 HydrophobicContact CG2-CG 4.31Å; T504-Y559 HydrophobicContact CG2-CE1 4.17Å
505	E	84.6	Confident	83.1	Confident	109 Å²	109	31.5 Å²	31.5	51%	0.509	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	53	42.8	-178.2	-60.6	171.6	-178.5	0	0	112	G501 E502 R507 F549 K553	G501-E505 PolarHBondContact O-N 3.5Å; E502-E505 PolarHBondContact O-N 2.95Å; E505-R507 VanDerWaalsContact C-N 3.33Å; E505-R507 PolarHBondContact O-N 3.15Å; E505-F549 HydrophobicContact CB-CZ 4.22Å; E505-F549 HydrophobicContact CG-CE1 4.2Å; E505-F549 HydrophobicContact CG-CZ 4.02Å; E505-K553 IonicContact OE1-NZ 2.68Å; E505-K553 PolarHBondContact OE1-NZ 3.32Å
506	G	79.9	Confident	83.7	Confident	19 Å²	19	30.7 Å²	30.7	20%	0.196	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.4	15.2	178.6	0	0	0	0	0	115.2	G501 T504 T764	G501-G506 PolarHBondContact O-N 3.47Å; T504-G506 VanDerWaalsContact C-N 3.25Å; T504-G506 PolarHBondContact O-N 3.25Å; G506-T764 WeakPolarHBondContact O-CB 3.47Å; G506-T764 VanDerWaalsContact O-CG2 3.26Å; G506-T764 WeakPolarHBondContact O-CG2 3.12Å
507	R	82.2	Confident	84.2	Confident	74 Å²	74	30 Å²	30	28%	0.279	17%	0.168	S	C	.	.	S	Bend	trans	-73.1	-30.4	175.1	-70.2	-171.2	-164.4	-165.8	5.4	113.1	T504 E505 Y559 L560 R768	T504-R507 WeakPolarHBondContact O-CB 3.2Å; T504-R507 VanDerWaalsContact O-CG 3.28Å; T504-R507 WeakPolarHBondContact O-CG 3.38Å; T504-R507 PolarHBondContact O-N 3.49Å; T504-R507 VanDerWaalsContact O-N 3.14Å; E505-R507 VanDerWaalsContact C-N 3.33Å; E505-R507 PolarHBondContact O-N 3.15Å; R507-Y559 HydrophobicContact CB-CD1 4.3Å; R507-L560 HydrophobicContact CB-CD1 4.03Å; R507-L560 HydrophobicContact CG-CD1 4.42Å; R507-R768 PolarHBondContact O-NH2 3.03Å
508	I	85.1	Confident	84.7	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.005	17%	0.171	C	C	.	.	S	Bend	trans	-141.3	123.9	171.5	-61.4	175.4	0	0	0	107.5	L500 G501 T504 E512 Y559	L500-I508 CarbonylContact C-O 3.52Å; L500-I508 HydrophobicContact CD2-CB 4.11Å; L500-I508 HydrophobicContact CD2-CG2 3.55Å; L500-I508 HydrophobicContact CG-CB 4.31Å; L500-I508 HydrophobicContact CG-CG2 4.22Å; G501-I508 WeakPolarHBondContact CA-O 3.49Å; G501-I508 PolarHBondContact N-O 3.32Å; G501-I508 VanDerWaalsContact N-O 3.15Å; T504-I508 PolarHBondContact OG1-N 3.22Å; T504-I508 PolarHBondContact OG1-O 3.48Å; I508-E512 HydrophobicContact CG2-CB 4.17Å; I508-Y559 HydrophobicContact CD1-CE1 3.96Å; I508-Y559 HydrophobicContact CG1-CE1 4.44Å
509	S	84.4	Confident	85.4	Confident	24 Å²	24	30.8 Å²	30.8	17%	0.168	16%	0.163	C	C	.	.			trans	-125	-166.4	-177.4	-51	0	0	0	0	112.6	G497 I511 E512 S513 T764	G497-S509 CarbonylContact O-C 3.38Å; S509-I511 VanDerWaalsContact C-N 3.31Å; S509-I511 PolarHBondContact O-N 2.69Å; S509-E512 WeakPolarHBondContact CA-OE2 3.17Å; S509-E512 PolarHBondContact N-OE2 3.39Å; S509-E512 PolarHBondContact O-N 2.89Å; S509-S513 PolarHBondContact O-N 3.48Å; S509-T764 WeakPolarHBondContact CB-OG1 3.12Å; S509-T764 WeakPolarHBondContact OG-CG2 3.37Å; S509-T764 PolarHBondContact OG-OG1 3.41Å
510	A	83	Confident	86	Confident	18 Å²	18	27.2 Å²	27.2	15%	0.149	14%	0.144	C	C	.	.	H	α-helix	trans	-60.5	-32.1	-177.6	0	0	0	0	0	114.3	G497 S513 L514	G497-A510 PolarHBondContact O-N 3.34Å; A510-S513 PolarHBondContact O-N 3.35Å; A510-L514 WeakPolarHBondContact O-CB 2.81Å; A510-L514 PolarHBondContact O-N 2.93Å
511	I	84.4	Confident	86.5	Confident	9 Å²	9	27 Å²	27	5%	0.046	14%	0.143	C	C	.	.	H	α-helix	trans	-70.6	-42.1	-179.3	-169	69.6	0	0	0	112.1	S509 S513 L514 F515 P758 F761 K762 V893	S509-I511 VanDerWaalsContact C-N 3.31Å; S509-I511 PolarHBondContact O-N 2.69Å; I511-S513 VanDerWaalsContact C-N 3.31Å; I511-S513 PolarHBondContact O-N 3.17Å; I511-L514 PolarHBondContact O-N 3.43Å; I511-F515 PolarHBondContact O-N 2.86Å; I511-P758 HydrophobicContact CB-CG 4.01Å; I511-P758 HydrophobicContact CD1-CG 3.96Å; I511-P758 HydrophobicContact CG1-CG 4.5Å; I511-F761 HydrophobicContact CD1-CD2 4.06Å; I511-F761 HydrophobicContact CG1-CD2 4.48Å; I511-K762 WeakPolarHBondContact CG2-O 3.28Å; I511-V893 HydrophobicContact CD1-CG2 4.07Å
512	E	87.8	Confident	87	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-67.1	-35.4	175	-65.9	92.6	165.4	0	0	111.6	I508 S509 G516 T764 R768 L840	I508-E512 HydrophobicContact CG2-CB 4.17Å; S509-E512 WeakPolarHBondContact CA-OE2 3.17Å; S509-E512 PolarHBondContact N-OE2 3.39Å; S509-E512 PolarHBondContact O-N 2.89Å; E512-G516 PolarHBondContact O-N 3.47Å; E512-T764 VanDerWaalsContact CD-OG1 3.27Å; E512-T764 PolarHBondContact OE1-N 3.42Å; E512-T764 PolarHBondContact OE1-OG1 3.12Å; E512-T764 PolarHBondContact OE2-OG1 2.75Å; E512-R768 IonicContact OE1-CZ 2.83Å; E512-R768 IonicContact OE1-NH2 3.28Å; E512-R768 PolarHBondContact OE1-NH2 3.03Å; E512-L840 HydrophobicContact CB-CD2 3.96Å; E512-L840 HydrophobicContact CG-CD2 4.38Å
513	S	88	Confident	87.6	Confident	1 Å²	1	22.2 Å²	22.2	1%	0.007	12%	0.122	C	C	.	.	H	α-helix	trans	-62.6	-47.3	172.6	-172.5	0	0	0	0	112	V493 S509 A510 I511 F515 G516 A517 F843	V493-S513 PolarHBondContact O-OG 3.34Å; S509-S513 PolarHBondContact O-N 3.48Å; A510-S513 PolarHBondContact O-N 3.35Å; I511-S513 VanDerWaalsContact C-N 3.31Å; I511-S513 PolarHBondContact O-N 3.17Å; S513-F515 PolarHBondContact O-N 3.13Å; S513-G516 PolarHBondContact O-N 3.38Å; S513-A517 VanDerWaalsContact O-CB 3.32Å; S513-A517 WeakPolarHBondContact O-CB 3.15Å; S513-A517 PolarHBondContact O-N 2.73Å; S513-F843 WeakPolarHBondContact O-CZ 3.26Å
514	L	88.3	Confident	88.2	Confident	5 Å²	5	20.9 Å²	20.9	3%	0.026	11%	0.111	C	C	.	.	H	α-helix	trans	-62.8	-45.5	179.3	-172.1	72.9	0	0	0	112.1	V493 A510 I511 A517 S518 M889 V893	V493-L514 HydrophobicContact CG1-CD1 4.36Å; A510-L514 WeakPolarHBondContact O-CB 2.81Å; A510-L514 PolarHBondContact O-N 2.93Å; I511-L514 PolarHBondContact O-N 3.43Å; L514-A517 PolarHBondContact O-N 2.7Å; L514-S518 PolarHBondContact O-N 3.21Å; L514-M889 HydrophobicContact CD1-CG 3.54Å; L514-M889 HydrophobicContact CD1-SD 3.56Å; L514-M889 VanDerWaalsContact CD1-SD 3.56Å; L514-M889 HydrophobicContact CG-CG 4.45Å; L514-V893 HydrophobicContact CD2-CG2 3.5Å; L514-V893 VanDerWaalsContact CD2-CG2 3.5Å
515	F	88.6	Confident	88.5	Confident	53 Å²	53	20.9 Å²	20.9	23%	0.232	11%	0.111	C	C	.	.	H	α-helix	trans	-66.8	-43.8	178.5	179.1	-125.4	0	0	0	112.2	I511 S513 A517 S518 M519 F761 W770 M838 L840	I511-F515 PolarHBondContact O-N 2.86Å; S513-F515 PolarHBondContact O-N 3.13Å; F515-A517 VanDerWaalsContact C-N 3.34Å; F515-A517 PolarHBondContact O-N 3.34Å; F515-S518 PolarHBondContact O-N 3.46Å; F515-M519 HydrophobicContact CZ-SD 4.45Å; F515-M519 WeakPolarHBondContact O-CB 3.4Å; F515-M519 PolarHBondContact O-N 2.89Å; F515-F761 HydrophobicContact CB-CE2 3.96Å; F515-F761 HydrophobicContact CB-CZ 3.96Å; F515-F761 HydrophobicContact CD1-CZ 4.12Å; F515-F761 AromaticContact CD2-CE2 3.9Å; F515-F761 HydrophobicContact CD2-CE2 3.9Å; F515-F761 AromaticContact CD2-CZ 3.41Å; F515-F761 HydrophobicContact CD2-CZ 3.41Å; F515-F761 VanDerWaalsContact CD2-CZ 3.41Å; F515-F761 HydrophobicContact CE1-CZ 4.45Å; F515-F761 AromaticContact CE2-CZ 3.81Å; F515-F761 HydrophobicContact CE2-CZ 3.81Å; F515-F761 HydrophobicContact CG-CE2 4.04Å; F515-F761 AromaticContact CG-CZ 3.56Å; F515-F761 HydrophobicContact CG-CZ 3.56Å; F515-F761 HydrophobicContact CZ-CZ 4.32Å; F515-W770 HydrophobicContact CD1-CE3 4.13Å; F515-W770 AromaticContact CD1-CH2 3.85Å; F515-W770 HydrophobicContact CD1-CH2 3.85Å; F515-W770 AromaticContact CD1-CZ3 3.45Å; F515-W770 HydrophobicContact CD1-CZ3 3.45Å; F515-W770 VanDerWaalsContact CD1-CZ3 3.45Å; F515-W770 HydrophobicContact CE1-CE3 4.11Å; F515-W770 HydrophobicContact CE1-CH2 4.35Å; F515-W770 AromaticContact CE1-CZ3 3.87Å; F515-W770 HydrophobicContact CE1-CZ3 3.87Å; F515-W770 HydrophobicContact CG-CH2 4.39Å; F515-W770 HydrophobicContact CG-CZ3 4.36Å; F515-M838 HydrophobicContact CE1-CE 3.57Å; F515-M838 HydrophobicContact CZ-CE 4.14Å; F515-L840 HydrophobicContact CD1-CD1 3.96Å; F515-L840 HydrophobicContact CD1-CD2 3.92Å; F515-L840 HydrophobicContact CE1-CD1 4.19Å
516	G	90.1	Very high	88.8	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-61	-41.5	175.6	0	0	0	0	0	112.5	E512 S513 T520	E512-G516 PolarHBondContact O-N 3.47Å; S513-G516 PolarHBondContact O-N 3.38Å; G516-T520 WeakPolarHBondContact O-CB 3.28Å; G516-T520 VanDerWaalsContact O-CG2 3.28Å; G516-T520 WeakPolarHBondContact O-CG2 3.45Å; G516-T520 PolarHBondContact O-N 3.34Å; G516-T520 PolarHBondContact O-OG1 3.17Å
517	A	90.9	Very high	89.3	Confident	1 Å²	1	23 Å²	23	1%	0.008	12%	0.115	C	C	.	.	H	α-helix	trans	-62.7	-45.2	176.6	0	0	0	0	0	111.7	V493 S513 L514 F515 T520 G521 F843 F886	V493-A517 HydrophobicContact CG1-CB 3.9Å; V493-A517 HydrophobicContact CG2-CB 4.03Å; S513-A517 VanDerWaalsContact O-CB 3.32Å; S513-A517 WeakPolarHBondContact O-CB 3.15Å; S513-A517 PolarHBondContact O-N 2.73Å; L514-A517 PolarHBondContact O-N 2.7Å; F515-A517 VanDerWaalsContact C-N 3.34Å; F515-A517 PolarHBondContact O-N 3.34Å; A517-T520 PolarHBondContact O-OG1 3.12Å; A517-G521 PolarHBondContact O-N 3.46Å; A517-F843 HydrophobicContact CB-CD1 4.26Å; A517-F843 HydrophobicContact CB-CE1 3.62Å; A517-F843 HydrophobicContact CB-CZ 3.78Å; A517-F843 VanDerWaalsContact N-CE2 3.29Å; A517-F843 VanDerWaalsContact N-CZ 3.29Å; A517-F886 VanDerWaalsContact O-CD1 3.25Å; A517-F886 WeakPolarHBondContact O-CD1 3.27Å
518	S	92.3	Very high	89.6	Confident	11 Å²	11	19.4 Å²	19.4	8%	0.077	10%	0.102	C	C	.	.	H	α-helix	trans	-62.9	-50.1	178.1	-178.2	0	0	0	0	111.8	L514 F515 G521 I522 F886 G890	L514-S518 PolarHBondContact O-N 3.21Å; F515-S518 PolarHBondContact O-N 3.46Å; S518-G521 PolarHBondContact O-N 3.36Å; S518-I522 WeakPolarHBondContact O-CB 3.27Å; S518-I522 WeakPolarHBondContact O-CD1 3.42Å; S518-I522 WeakPolarHBondContact O-CG1 3.24Å; S518-I522 PolarHBondContact O-N 3.37Å; S518-F886 WeakPolarHBondContact CB-O 3.27Å; S518-F886 PolarHBondContact OG-O 3.09Å; S518-G890 WeakPolarHBondContact OG-CA 3.16Å; S518-G890 PolarHBondContact OG-N 3.48Å
519	M	92.5	Very high	89.5	Confident	44 Å²	44	19.4 Å²	19.4	22%	0.217	10%	0.102	C	C	.	.	H	α-helix	trans	-63.9	-49.7	-177.5	-176.4	179.6	66.9	0	0	112.1	F515 A523 V834 M838 L840	F515-M519 HydrophobicContact CZ-SD 4.45Å; F515-M519 WeakPolarHBondContact O-CB 3.4Å; F515-M519 PolarHBondContact O-N 2.89Å; M519-A523 WeakPolarHBondContact O-CB 3.26Å; M519-A523 PolarHBondContact O-N 3.15Å; M519-V834 HydrophobicContact CE-CG1 3.84Å; M519-V834 HydrophobicContact SD-CG1 4.35Å; M519-M838 HydrophobicContact CE-CE 4.39Å; M519-M838 HydrophobicContact CE-SD 3.68Å; M519-M838 HydrophobicContact SD-CE 4.17Å; M519-M838 HydrophobicContact SD-SD 3.81Å; M519-L840 HydrophobicContact CE-CD1 3.43Å; M519-L840 VanDerWaalsContact CE-CD1 3.43Å
520	T	92	Very high	89.7	Confident	3 Å²	3	18.9 Å²	18.9	2%	0.018	10%	0.097	C	C	.	.	H	α-helix	trans	-66.2	-39.9	-180	56	0	0	0	0	111.9	G516 A517 A523 Y524 M831 C835 F843	G516-T520 WeakPolarHBondContact O-CB 3.28Å; G516-T520 VanDerWaalsContact O-CG2 3.28Å; G516-T520 WeakPolarHBondContact O-CG2 3.45Å; G516-T520 PolarHBondContact O-N 3.34Å; G516-T520 PolarHBondContact O-OG1 3.17Å; A517-T520 PolarHBondContact O-OG1 3.12Å; T520-A523 PolarHBondContact O-N 2.75Å; T520-Y524 VanDerWaalsContact O-CB 3.23Å; T520-Y524 WeakPolarHBondContact O-CB 3.43Å; T520-Y524 PolarHBondContact O-N 3.46Å; T520-M831 HydrophobicContact CG2-CB 4.07Å; T520-C835 WeakPolarHBondContact CG2-SG 3.17Å; T520-F843 HydrophobicContact CG2-CD2 4.08Å
521	G	92.3	Very high	89.9	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-69.9	-37.7	-179.7	0	0	0	0	0	114.2	A517 S518 S525 F886	A517-G521 PolarHBondContact O-N 3.46Å; S518-G521 PolarHBondContact O-N 3.36Å; G521-S525 VanDerWaalsContact O-CB 3.31Å; G521-S525 WeakPolarHBondContact O-CB 3.32Å; G521-S525 PolarHBondContact O-N 2.97Å; G521-S525 PolarHBondContact O-OG 3.06Å; G521-F886 VanDerWaalsContact CA-CG 3.45Å; G521-F886 WeakPolarHBondContact O-CD2 3.45Å
522	I	94	Very high	90.1	Very high	50 Å²	50	17.9 Å²	17.9	26%	0.256	9%	0.09	S	C	.	.	H	α-helix	trans	-62.3	-50.1	172.9	-72	166.6	0	0	0	109.8	S518 Y524 S525 L526 L883 F886 V887	S518-I522 WeakPolarHBondContact O-CB 3.27Å; S518-I522 WeakPolarHBondContact O-CD1 3.42Å; S518-I522 WeakPolarHBondContact O-CG1 3.24Å; S518-I522 PolarHBondContact O-N 3.37Å; I522-Y524 PolarHBondContact O-N 3.44Å; I522-S525 PolarHBondContact O-N 3.34Å; I522-L526 HydrophobicContact CG2-CD1 4.12Å; I522-L526 WeakPolarHBondContact O-CG 3.41Å; I522-L526 PolarHBondContact O-N 2.91Å; I522-L526 VanDerWaalsContact O-N 3.15Å; I522-L883 HydrophobicContact CB-CD1 4.48Å; I522-L883 HydrophobicContact CG1-CD1 4.48Å; I522-L883 HydrophobicContact CG2-CD1 3.94Å; I522-F886 HydrophobicContact CG1-CB 3.84Å; I522-V887 HydrophobicContact CD1-CG2 3.89Å; I522-V887 HydrophobicContact CG1-CG2 4.02Å
523	A	93.6	Very high	90.2	Very high	16 Å²	16	18 Å²	18	13%	0.132	9%	0.091	C	C	.	.	H	α-helix	trans	-62.1	-45.7	-178.7	0	0	0	0	0	111	M519 T520 L526 F527 M827 M831	M519-A523 WeakPolarHBondContact O-CB 3.26Å; M519-A523 PolarHBondContact O-N 3.15Å; T520-A523 PolarHBondContact O-N 2.75Å; A523-L526 PolarHBondContact O-N 3.18Å; A523-F527 WeakPolarHBondContact O-CD2 3.4Å; A523-F527 PolarHBondContact O-N 2.95Å; A523-F527 VanDerWaalsContact O-N 3.14Å; A523-M827 VanDerWaalsContact C-CE 3.47Å; A523-M827 HydrophobicContact CB-CE 3.39Å; A523-M827 WeakPolarHBondContact O-CE 3.44Å; A523-M831 HydrophobicContact CB-CE 4.25Å; A523-M831 HydrophobicContact CB-CG 4.21Å; A523-M831 HydrophobicContact CB-SD 3.38Å; A523-M831 WeakPolarHBondContact CB-SD 3.22Å
524	Y	93	Very high	90.4	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-61.4	-47.1	176.6	-171.9	-90	0	0	0	111.8	T520 I522 L526 F527 A528 T533 L535 Q801 D824 M827 V828	T520-Y524 VanDerWaalsContact O-CB 3.23Å; T520-Y524 WeakPolarHBondContact O-CB 3.43Å; T520-Y524 PolarHBondContact O-N 3.46Å; I522-Y524 PolarHBondContact O-N 3.44Å; Y524-L526 PolarHBondContact O-N 2.88Å; Y524-F527 PolarHBondContact O-N 3.07Å; Y524-A528 HydrophobicContact CD1-CB 3.71Å; Y524-A528 HydrophobicContact CD2-CB 4.07Å; Y524-A528 HydrophobicContact CE1-CB 3.48Å; Y524-A528 VanDerWaalsContact CE1-CB 3.48Å; Y524-A528 HydrophobicContact CE2-CB 3.89Å; Y524-A528 HydrophobicContact CG-CB 3.99Å; Y524-A528 WeakPolarHBondContact O-CA 3.33Å; Y524-A528 WeakPolarHBondContact O-CB 3.44Å; Y524-A528 PolarHBondContact O-N 3.47Å; Y524-T533 HydrophobicContact CE1-CG2 4.38Å; Y524-T533 WeakPolarHBondContact CE1-O 3.48Å; Y524-T533 WeakPolarHBondContact OH-CB 3.23Å; Y524-L535 VanDerWaalsContact CB-CD1 3.46Å; Y524-L535 HydrophobicContact CD1-CD1 4.37Å; Y524-L535 HydrophobicContact CD1-CG 4.11Å; Y524-L535 HydrophobicContact CD2-CD1 3.73Å; Y524-L535 HydrophobicContact CD2-CD2 4.07Å; Y524-L535 HydrophobicContact CD2-CG 4.05Å; Y524-L535 HydrophobicContact CE2-CD2 4.13Å; Y524-L535 HydrophobicContact CG-CD1 3.59Å; Y524-L535 HydrophobicContact CG-CD2 4.28Å; Y524-L535 HydrophobicContact CG-CG 3.81Å; Y524-Q801 PolarHBondContact OH-NE2 3.39Å; Y524-D824 HydrophobicContact CE2-CB 4.48Å; Y524-D824 PolarHBondContact OH-OD1 3.49Å; Y524-M827 HydrophobicContact CD2-CB 4.32Å; Y524-M827 HydrophobicContact CD2-CG 4.15Å; Y524-V828 HydrophobicContact CD2-CG2 4.1Å; Y524-V828 HydrophobicContact CE2-CG2 3.86Å
525	S	91.3	Very high	90.5	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.007	9%	0.091	C	C	.	.	H	α-helix	trans	-60.5	-32.9	-179.5	-57.8	0	0	0	0	113	G521 I522 R879 G882 L883	G521-S525 VanDerWaalsContact O-CB 3.31Å; G521-S525 WeakPolarHBondContact O-CB 3.32Å; G521-S525 PolarHBondContact O-N 2.97Å; G521-S525 PolarHBondContact O-OG 3.06Å; I522-S525 PolarHBondContact O-N 3.34Å; S525-R879 PolarHBondContact O-NH1 3.25Å; S525-G882 VanDerWaalsContact OG-C 3.31Å; S525-L883 PolarHBondContact OG-N 3.47Å
526	L	90.6	Very high	90.5	Very high	42 Å²	42	15.9 Å²	15.9	22%	0.22	8%	0.083	C	C	.	.	H	α-helix	trans	-75.9	-42	178.6	-69.9	173.5	0	0	0	113.4	Y466 I522 A523 Y524 R879 L883	Y466-L526 VanDerWaalsContact CE2-O 3.31Å; Y466-L526 WeakPolarHBondContact CE2-O 3.31Å; Y466-L526 PolarHBondContact OH-O 3.45Å; Y466-L526 VanDerWaalsContact OH-O 3.08Å; I522-L526 HydrophobicContact CG2-CD1 4.12Å; I522-L526 WeakPolarHBondContact O-CG 3.41Å; I522-L526 PolarHBondContact O-N 2.91Å; I522-L526 VanDerWaalsContact O-N 3.15Å; A523-L526 PolarHBondContact O-N 3.18Å; Y524-L526 PolarHBondContact O-N 2.88Å; L526-R879 PolarHBondContact O-NH1 3.16Å; L526-L883 HydrophobicContact CD1-CD1 4.48Å; L526-L883 HydrophobicContact CD2-CD1 4.02Å; L526-L883 HydrophobicContact CD2-CD2 4.32Å; L526-L883 HydrophobicContact CG-CD1 4.02Å
527	F	90.3	Very high	90.2	Very high	129 Å²	129	16.6 Å²	16.6	57%	0.566	9%	0.088	S	C	*	.	H	α-helix	trans	-112.2	-9	-168.7	-63.1	-68.1	0	0	0	115.1	A523 Y524 M827	A523-F527 WeakPolarHBondContact O-CD2 3.4Å; A523-F527 PolarHBondContact O-N 2.95Å; A523-F527 VanDerWaalsContact O-N 3.14Å; Y524-F527 PolarHBondContact O-N 3.07Å; F527-M827 HydrophobicContact CB-CE 4.32Å; F527-M827 HydrophobicContact CB-CG 4.39Å; F527-M827 HydrophobicContact CB-SD 3.86Å; F527-M827 HydrophobicContact CD2-CE 4.02Å; F527-M827 HydrophobicContact CD2-SD 4.47Å
528	A	88.6	Confident	89.8	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.093	C	C	.	.			trans	-62.5	150.7	-177.5	0	0	0	0	0	112.5	Y524 D824 R879	Y524-A528 HydrophobicContact CD1-CB 3.71Å; Y524-A528 HydrophobicContact CD2-CB 4.07Å; Y524-A528 HydrophobicContact CE1-CB 3.48Å; Y524-A528 VanDerWaalsContact CE1-CB 3.48Å; Y524-A528 HydrophobicContact CE2-CB 3.89Å; Y524-A528 HydrophobicContact CG-CB 3.99Å; Y524-A528 WeakPolarHBondContact O-CA 3.33Å; Y524-A528 WeakPolarHBondContact O-CB 3.44Å; Y524-A528 PolarHBondContact O-N 3.47Å; A528-D824 WeakPolarHBondContact CB-OD1 3.08Å; A528-R879 PolarHBondContact O-NH1 2.93Å; A528-R879 PolarHBondContact O-NH2 3.08Å
529	G	84	Confident	89.2	Confident	1 Å²	1	18 Å²	18	1%	0.01	10%	0.101	C	C	.	.	S	Bend	trans	-54.9	-72.3	158	0	0	0	0	0	109.5	K462 D824	K462-G529 WeakPolarHBondContact CD-O 3.38Å; K462-G529 WeakPolarHBondContact CE-O 3.41Å; K462-G529 PolarHBondContact NZ-O 2.88Å; G529-D824 WeakPolarHBondContact CA-OD1 3.5Å; G529-D824 PolarHBondContact N-OD1 3.5Å
530	Q	88.8	Confident	88.7	Confident	12 Å²	12	16.8 Å²	16.8	6%	0.056	10%	0.096	C	C	.	.			trans	-99.4	99.9	-178.7	-175.5	56.8	-65.3	0	0	111.3	L532 T533 I808 N809 D824	Q530-L532 HydrophobicContact CG-CB 4.31Å; Q530-L532 PolarHBondContact O-N 3.02Å; Q530-T533 WeakPolarHBondContact O-CB 3.36Å; Q530-T533 PolarHBondContact O-N 2.87Å; Q530-T533 PolarHBondContact O-OG1 3.07Å; Q530-I808 HydrophobicContact CG-CG2 3.76Å; Q530-N809 PolarHBondContact NE2-OD1 3.47Å; Q530-D824 WeakPolarHBondContact CB-OD2 3.46Å; Q530-D824 PolarHBondContact N-OD1 2.78Å; Q530-D824 PolarHBondContact N-OD2 3.48Å; Q530-D824 VanDerWaalsContact N-OD2 3.14Å
531	A	86.1	Confident	88.3	Confident	6 Å²	6	17 Å²	17	5%	0.05	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-9.4	-177.9	0	0	0	0	0	114.2	T533 R879	A531-T533 PolarHBondContact O-N 3.17Å; A531-R879 HydrophobicContact CB-CB 4.31Å; A531-R879 HydrophobicContact CB-CG 3.61Å
532	L	88.9	Confident	87.8	Confident	1 Å²	1	18.4 Å²	18.4	1%	0.005	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-17.9	172.3	-64	175.7	0	0	0	112.5	Q530 I808 L815 H853 V854 L857 I875 E877	Q530-L532 HydrophobicContact CG-CB 4.31Å; Q530-L532 PolarHBondContact O-N 3.02Å; L532-I808 HydrophobicContact CB-CG2 4.14Å; L532-L815 HydrophobicContact CD1-CD2 4.07Å; L532-H853 PolarHBondContact O-ND1 2.95Å; L532-V854 HydrophobicContact CB-CG2 4.1Å; L532-V854 HydrophobicContact CD1-CG2 4.2Å; L532-L857 HydrophobicContact CD2-CD1 3.57Å; L532-I875 HydrophobicContact CD1-CG2 4.14Å; L532-E877 HydrophobicContact CD1-CG 4.29Å
533	T	90.8	Very high	87.3	Confident	2 Å²	2	18.5 Å²	18.5	1%	0.012	11%	0.107	C	C	.	.	P	Polyproline II helix	trans	-75.7	128.8	177.9	-49.8	0	0	0	0	110.9	Y524 Q530 A531 T804 I808 A845	Y524-T533 HydrophobicContact CE1-CG2 4.38Å; Y524-T533 WeakPolarHBondContact CE1-O 3.48Å; Y524-T533 WeakPolarHBondContact OH-CB 3.23Å; Q530-T533 WeakPolarHBondContact O-CB 3.36Å; Q530-T533 PolarHBondContact O-N 2.87Å; Q530-T533 PolarHBondContact O-OG1 3.07Å; A531-T533 PolarHBondContact O-N 3.17Å; T533-T804 HydrophobicContact CG2-CG2 4.15Å; T533-I808 HydrophobicContact CG2-CD1 4.02Å; T533-I808 WeakPolarHBondContact OG1-CD1 3.43Å; T533-A845 HydrophobicContact CG2-CB 3.37Å
534	I	91.4	Very high	86.9	Confident	3 Å²	3	18.6 Å²	18.6	2%	0.015	11%	0.105	C	C	.	.	P	Polyproline II helix	trans	-101.7	127.5	176.4	-61.9	-178.4	0	0	0	108.8	L485 A846 L849 S850 H853 I885 F886	L485-I534 HydrophobicContact CD1-CD1 4.39Å; L485-I534 HydrophobicContact CD2-CD1 3.94Å; I534-A846 PolarHBondContact O-N 2.91Å; I534-L849 HydrophobicContact CB-CB 4.42Å; I534-L849 HydrophobicContact CG2-CB 4.46Å; I534-S850 PolarHBondContact N-OG 3.32Å; I534-H853 HydrophobicContact CD1-CB 3.78Å; I534-H853 HydrophobicContact CG1-CB 4.38Å; I534-I885 HydrophobicContact CD1-CD1 4.34Å; I534-F886 HydrophobicContact CG2-CE1 4.5Å; I534-F886 HydrophobicContact CG2-CE2 4.4Å; I534-F886 HydrophobicContact CG2-CZ 3.72Å
535	L	90.5	Very high	86.7	Confident	5 Å²	5	18.7 Å²	18.7	3%	0.026	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	138.3	172.5	-61.3	-176.9	0	0	0	110.9	Y524 V828 F843 V844 A845	Y524-L535 VanDerWaalsContact CB-CD1 3.46Å; Y524-L535 HydrophobicContact CD1-CD1 4.37Å; Y524-L535 HydrophobicContact CD1-CG 4.11Å; Y524-L535 HydrophobicContact CD2-CD1 3.73Å; Y524-L535 HydrophobicContact CD2-CD2 4.07Å; Y524-L535 HydrophobicContact CD2-CG 4.05Å; Y524-L535 HydrophobicContact CE2-CD2 4.13Å; Y524-L535 HydrophobicContact CG-CD1 3.59Å; Y524-L535 HydrophobicContact CG-CD2 4.28Å; Y524-L535 HydrophobicContact CG-CG 3.81Å; L535-V828 HydrophobicContact CD2-CG2 4.11Å; L535-F843 HydrophobicContact CB-CB 4.32Å; L535-V844 CarbonylContact C-O 3.35Å; L535-V844 WeakPolarHBondContact CA-O 3.19Å; L535-A845 HydrophobicContact CD2-CB 4.44Å
536	G	88	Confident	86.4	Confident	6 Å²	6	25 Å²	25	6%	0.062	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	165.1	179.5	0	0	0	0	0	111.9	V844	G536-V844 PolarHBondContact N-O 3.01Å; G536-V844 PolarHBondContact O-N 3.26Å
537	S	83.3	Confident	86.2	Confident	15 Å²	15	26.3 Å²	26.3	11%	0.105	14%	0.139	C	C	.	.			trans	-74.3	131.2	169.7	-178.8	0	0	0	0	108.6
538	T	83.7	Confident	86.1	Confident	19 Å²	19	20.7 Å²	20.7	12%	0.117	12%	0.115	C	C	.	.			trans	-108.5	150.1	179.7	69.1	0	0	0	0	110.8	V541 L542 V844	T538-V541 PolarHBondContact O-N 3.18Å; T538-V541 WeakPolarHBondContact OG1-CG2 3.45Å; T538-L542 PolarHBondContact O-N 3.39Å; T538-L542 VanDerWaalsContact O-N 3.12Å; T538-V844 HydrophobicContact CG2-CB 4.43Å
539	G	80.4	Confident	86.1	Confident	24 Å²	24	21.3 Å²	21.3	25%	0.247	12%	0.118	C	C	.	.	H	α-helix	trans	-54.3	-43	178	0	0	0	0	0	114.4	V541 L542 V543	G539-V541 VanDerWaalsContact C-N 3.33Å; G539-V541 PolarHBondContact O-N 3.38Å; G539-L542 WeakPolarHBondContact O-CB 3.36Å; G539-L542 PolarHBondContact O-N 3.28Å; G539-L542 VanDerWaalsContact O-N 3.17Å; G539-V543 WeakPolarHBondContact O-CG2 3.09Å; G539-V543 PolarHBondContact O-N 3.48Å
540	P	80.1	Confident	86.3	Confident	17 Å²	17	27.7 Å²	27.7	11%	0.11	15%	0.145	C	C	.	.	H	α-helix	trans	-60	-39.1	177	-26	35.9	0	0	0	113.7	V543 F544 L796 F978	P540-V543 PolarHBondContact O-N 3.38Å; P540-F544 PolarHBondContact O-N 3.37Å; P540-L796 HydrophobicContact CB-CD1 3.79Å; P540-L796 HydrophobicContact CB-CD2 4.27Å; P540-L796 HydrophobicContact CB-CG 4.3Å; P540-F978 HydrophobicContact CG-CD1 4.41Å
541	V	83.6	Confident	86.2	Confident	7 Å²	7	31.5 Å²	31.5	4%	0.042	16%	0.162	C	C	.	.	H	α-helix	trans	-64.2	-44.2	174.5	175.8	0	0	0	0	110.2	T538 G539 V543 F544 E545 L796 W842 V844	T538-V541 PolarHBondContact O-N 3.18Å; T538-V541 WeakPolarHBondContact OG1-CG2 3.45Å; G539-V541 VanDerWaalsContact C-N 3.33Å; G539-V541 PolarHBondContact O-N 3.38Å; V541-V543 PolarHBondContact O-N 2.96Å; V541-F544 WeakPolarHBondContact O-CB 3.3Å; V541-F544 PolarHBondContact O-N 2.97Å; V541-E545 HydrophobicContact CG1-CG 4.48Å; V541-E545 VanDerWaalsContact O-CG 3.28Å; V541-E545 WeakPolarHBondContact O-CG 3.35Å; V541-E545 PolarHBondContact O-N 2.99Å; V541-L796 HydrophobicContact CG2-CD2 3.78Å; V541-W842 HydrophobicContact CG1-CB 4.23Å; V541-W842 HydrophobicContact CG1-CE3 4.29Å; V541-V844 HydrophobicContact CG2-CG2 4.17Å
542	L	83.5	Confident	86.3	Confident	30 Å²	30	31.4 Å²	31.4	16%	0.157	16%	0.16	C	C	.	.	H	α-helix	trans	-58.2	-44.1	176.3	-178.1	72.4	0	0	0	112.7	F496 L499 L500 T538 G539 F544 E545 K546	F496-L542 HydrophobicContact CD1-CD2 3.92Å; F496-L542 HydrophobicContact CE1-CD2 4.41Å; L499-L542 HydrophobicContact CB-CD2 4.39Å; L499-L542 HydrophobicContact CD1-CD2 4.47Å; L500-L542 HydrophobicContact CB-CD1 3.79Å; L500-L542 HydrophobicContact CD1-CD1 3.87Å; L500-L542 HydrophobicContact CG-CD1 4.36Å; T538-L542 PolarHBondContact O-N 3.39Å; T538-L542 VanDerWaalsContact O-N 3.12Å; G539-L542 WeakPolarHBondContact O-CB 3.36Å; G539-L542 PolarHBondContact O-N 3.28Å; G539-L542 VanDerWaalsContact O-N 3.17Å; L542-F544 VanDerWaalsContact C-N 3.35Å; L542-E545 PolarHBondContact O-N 2.92Å; L542-K546 PolarHBondContact O-N 3.03Å
543	V	83.5	Confident	86.3	Confident	52 Å²	52	37.3 Å²	37.3	32%	0.315	19%	0.186	S	C	.	.	H	α-helix	trans	-63.8	-42.3	178.3	173.8	0	0	0	0	111	G539 P540 V541 E545 K546 I547 A975	G539-V543 WeakPolarHBondContact O-CG2 3.09Å; G539-V543 PolarHBondContact O-N 3.48Å; P540-V543 PolarHBondContact O-N 3.38Å; V541-V543 PolarHBondContact O-N 2.96Å; V543-E545 VanDerWaalsContact C-N 3.31Å; V543-E545 PolarHBondContact O-N 3.21Å; V543-K546 PolarHBondContact O-N 3.37Å; V543-I547 HydrophobicContact CG1-CD1 3.86Å; V543-I547 WeakPolarHBondContact O-CG1 3.4Å; V543-I547 PolarHBondContact O-N 3.33Å; V543-I547 VanDerWaalsContact O-N 3.12Å; V543-A975 HydrophobicContact CG1-CB 4.35Å
544	F	85.5	Confident	86.3	Confident	18 Å²	18	42.6 Å²	42.6	8%	0.079	21%	0.214	C	C	.	.	H	α-helix	trans	-58.2	-44	174.7	177.7	-90.5	0	0	0	111.6	P540 V541 L542 I547 L548 I566 P789 L792 C793 W842	P540-F544 PolarHBondContact O-N 3.37Å; V541-F544 WeakPolarHBondContact O-CB 3.3Å; V541-F544 PolarHBondContact O-N 2.97Å; L542-F544 VanDerWaalsContact C-N 3.35Å; F544-I547 PolarHBondContact O-N 3.45Å; F544-L548 HydrophobicContact CE1-CD2 4.16Å; F544-L548 WeakPolarHBondContact O-CB 3.44Å; F544-L548 PolarHBondContact O-N 2.82Å; F544-I566 HydrophobicContact CZ-CG2 4.28Å; F544-P789 HydrophobicContact CE2-CB 4.35Å; F544-P789 HydrophobicContact CZ-CB 4.08Å; F544-L792 HydrophobicContact CD2-CD2 4.44Å; F544-C793 HydrophobicContact CE2-CB 4.3Å; F544-C793 HydrophobicContact CZ-CB 4.12Å; F544-W842 HydrophobicContact CD1-CH2 4.44Å; F544-W842 AromaticContact CD1-CZ3 3.7Å; F544-W842 HydrophobicContact CD1-CZ3 3.7Å; F544-W842 AromaticContact CE1-CH2 3.82Å; F544-W842 HydrophobicContact CE1-CH2 3.82Å; F544-W842 AromaticContact CE1-CZ3 3.49Å; F544-W842 HydrophobicContact CE1-CZ3 3.49Å; F544-W842 VanDerWaalsContact CE1-CZ3 3.49Å
545	E	86.8	Confident	86	Confident	3 Å²	3	49.9 Å²	49.9	1%	0.014	24%	0.243	C	C	.	.	H	α-helix	trans	-64.4	-42.4	178.7	-66.2	-68.6	-173	0	0	113.1	L500 V541 L542 V543 I547 L548 F549 Y559 R563 W842	L500-E545 HydrophobicContact CD1-CB 3.88Å; L500-E545 HydrophobicContact CD1-CG 4.48Å; V541-E545 HydrophobicContact CG1-CG 4.48Å; V541-E545 VanDerWaalsContact O-CG 3.28Å; V541-E545 WeakPolarHBondContact O-CG 3.35Å; V541-E545 PolarHBondContact O-N 2.99Å; L542-E545 PolarHBondContact O-N 2.92Å; V543-E545 VanDerWaalsContact C-N 3.31Å; V543-E545 PolarHBondContact O-N 3.21Å; E545-I547 VanDerWaalsContact C-N 3.28Å; E545-I547 PolarHBondContact O-N 3.28Å; E545-L548 PolarHBondContact O-N 3.02Å; E545-F549 WeakPolarHBondContact O-CB 3.19Å; E545-F549 PolarHBondContact O-N 2.95Å; E545-Y559 PolarHBondContact OE2-OH 3.25Å; E545-R563 IonicContact OE1-CZ 2.87Å; E545-R563 IonicContact OE1-NH1 3.22Å; E545-R563 PolarHBondContact OE1-NH1 2.79Å; E545-R563 IonicContact OE1-NH2 3.49Å; E545-R563 PolarHBondContact OE1-NH2 3.14Å; E545-R563 IonicContact OE2-CZ 2.8Å; E545-R563 IonicContact OE2-NH1 3.46Å; E545-R563 PolarHBondContact OE2-NH1 2.97Å; E545-W842 WeakPolarHBondContact OE1-CZ3 3.18Å
546	K	85.5	Confident	85.8	Confident	133 Å²	133	54.1 Å²	54.1	58%	0.578	28%	0.278	S	S	*	.	H	α-helix	trans	-60.1	-41.2	176.4	-175.1	172.5	-176.4	172.3	0	111.5	A503 L542 V543 K550	A503-K546 HydrophobicContact CB-CG 4.34Å; L542-K546 PolarHBondContact O-N 3.03Å; V543-K546 PolarHBondContact O-N 3.37Å; K546-K550 WeakPolarHBondContact O-CB 3.26Å; K546-K550 PolarHBondContact O-N 3.06Å
547	I	86.9	Confident	85.7	Confident	69 Å²	69	54.8 Å²	54.8	35%	0.354	28%	0.281	S	S	.	.	H	α-helix	trans	-72.7	-41.2	179.5	-66.4	170.1	0	0	0	110.7	V543 F544 E545 F549 K550 F551 I976	V543-I547 HydrophobicContact CG1-CD1 3.86Å; V543-I547 WeakPolarHBondContact O-CG1 3.4Å; V543-I547 PolarHBondContact O-N 3.33Å; V543-I547 VanDerWaalsContact O-N 3.12Å; F544-I547 PolarHBondContact O-N 3.45Å; E545-I547 VanDerWaalsContact C-N 3.28Å; E545-I547 PolarHBondContact O-N 3.28Å; I547-F549 VanDerWaalsContact C-N 3.3Å; I547-F549 PolarHBondContact O-N 3.06Å; I547-K550 PolarHBondContact O-N 2.93Å; I547-F551 WeakPolarHBondContact O-CB 3.3Å; I547-F551 PolarHBondContact O-N 3.33Å; I547-I976 HydrophobicContact CB-CD1 4.49Å; I547-I976 HydrophobicContact CD1-CD1 3.23Å; I547-I976 HydrophobicContact CD1-CG1 3.62Å; I547-I976 HydrophobicContact CG1-CD1 4.4Å; I547-I976 HydrophobicContact CG2-CD1 4.15Å
548	L	87.9	Confident	85.9	Confident	11 Å²	11	55.5 Å²	55.5	6%	0.058	29%	0.286	C	S	.	.	H	α-helix	trans	-59.9	-42.4	174.3	-178.9	62.7	0	0	0	111.2	F544 E545 F551 C552 Y559 L562 R563 I566	F544-L548 HydrophobicContact CE1-CD2 4.16Å; F544-L548 WeakPolarHBondContact O-CB 3.44Å; F544-L548 PolarHBondContact O-N 2.82Å; E545-L548 PolarHBondContact O-N 3.02Å; L548-F551 PolarHBondContact O-N 3.31Å; L548-C552 PolarHBondContact O-N 3.45Å; L548-C552 PolarHBondContact O-SG 3.08Å; L548-Y559 HydrophobicContact CB-CE2 4.38Å; L548-Y559 HydrophobicContact CD2-CD2 4.39Å; L548-Y559 HydrophobicContact CD2-CE2 3.93Å; L548-Y559 HydrophobicContact CG-CD2 4.19Å; L548-Y559 HydrophobicContact CG-CE2 4Å; L548-L562 HydrophobicContact CD1-CD2 3.88Å; L548-L562 HydrophobicContact CD1-CG 4.41Å; L548-R563 HydrophobicContact CD2-CB 4.35Å; L548-I566 HydrophobicContact CD1-CD1 3.47Å; L548-I566 VanDerWaalsContact CD1-CD1 3.47Å; L548-I566 HydrophobicContact CD2-CD1 3.81Å; L548-I566 HydrophobicContact CG-CD1 4.31Å
549	F	89.6	Confident	86.1	Confident	13 Å²	13	54.6 Å²	54.6	6%	0.057	28%	0.28	C	S	.	.	H	α-helix	trans	-64.3	-46.5	176.3	-178.4	-103.3	0	0	0	112	A503 T504 E505 E545 I547 F551 C552 K553 Y559	A503-F549 WeakPolarHBondContact O-CD1 3.46Å; A503-F549 WeakPolarHBondContact O-CE1 3.48Å; T504-F549 HydrophobicContact CG2-CB 4.4Å; T504-F549 HydrophobicContact CG2-CD2 4.35Å; T504-F549 HydrophobicContact CG2-CG 4.31Å; E505-F549 HydrophobicContact CB-CZ 4.22Å; E505-F549 HydrophobicContact CG-CE1 4.2Å; E505-F549 HydrophobicContact CG-CZ 4.02Å; E545-F549 WeakPolarHBondContact O-CB 3.19Å; E545-F549 PolarHBondContact O-N 2.95Å; I547-F549 VanDerWaalsContact C-N 3.3Å; I547-F549 PolarHBondContact O-N 3.06Å; F549-F551 VanDerWaalsContact C-N 3.34Å; F549-F551 PolarHBondContact O-N 3.31Å; F549-C552 WeakPolarHBondContact O-CB 3.25Å; F549-C552 PolarHBondContact O-N 2.88Å; F549-C552 VanDerWaalsContact O-N 3.15Å; F549-K553 PolarHBondContact O-N 3.45Å; F549-Y559 HydrophobicContact CB-CD2 4.21Å; F549-Y559 HydrophobicContact CB-CE2 4.16Å; F549-Y559 AromaticContact CD2-CD1 3.94Å; F549-Y559 HydrophobicContact CD2-CD1 3.94Å; F549-Y559 HydrophobicContact CD2-CD2 4.14Å; F549-Y559 HydrophobicContact CD2-CE1 4.43Å; F549-Y559 AromaticContact CD2-CG 3.82Å; F549-Y559 HydrophobicContact CD2-CG 3.82Å
550	K	87.6	Confident	86.4	Confident	135 Å²	135	55.1 Å²	55.1	59%	0.587	28%	0.277	S	S	*	.	H	α-helix	trans	-58.5	-45.9	175.6	-174.4	174.8	178.6	174.7	0	111.6	K546 I547 C552 K553 D554	K546-K550 WeakPolarHBondContact O-CB 3.26Å; K546-K550 PolarHBondContact O-N 3.06Å; I547-K550 PolarHBondContact O-N 2.93Å; K550-C552 VanDerWaalsContact C-N 3.34Å; K550-C552 PolarHBondContact O-N 2.83Å; K550-K553 WeakPolarHBondContact O-CB 3.44Å; K550-K553 PolarHBondContact O-N 3.48Å; K550-K553 VanDerWaalsContact O-N 3.12Å; K550-D554 VanDerWaalsContact O-CG 3.26Å; K550-D554 PolarHBondContact O-N 3.49Å
551	F	87.5	Confident	86.8	Confident	93 Å²	93	54.5 Å²	54.5	41%	0.408	27%	0.273	S	S	.	.	H	α-helix	trans	-58.8	-44.5	174.5	179.4	-92.8	0	0	0	111.8	I547 L548 F549 K553 D554 Y555 L557 L562	I547-F551 WeakPolarHBondContact O-CB 3.3Å; I547-F551 PolarHBondContact O-N 3.33Å; L548-F551 PolarHBondContact O-N 3.31Å; F549-F551 VanDerWaalsContact C-N 3.34Å; F549-F551 PolarHBondContact O-N 3.31Å; F551-K553 VanDerWaalsContact C-N 3.27Å; F551-K553 PolarHBondContact O-N 2.92Å; F551-D554 PolarHBondContact O-N 3.46Å; F551-Y555 HydrophobicContact CD1-CD2 4.26Å; F551-Y555 AromaticContact CD2-CD2 3.61Å; F551-Y555 HydrophobicContact CD2-CD2 3.61Å; F551-Y555 AromaticContact CD2-CE2 3.46Å; F551-Y555 HydrophobicContact CD2-CE2 3.46Å; F551-Y555 VanDerWaalsContact CD2-CE2 3.46Å; F551-Y555 HydrophobicContact CE1-CD2 4.08Å; F551-Y555 AromaticContact CE2-CD2 3.42Å; F551-Y555 HydrophobicContact CE2-CD2 3.42Å; F551-Y555 VanDerWaalsContact CE2-CD2 3.42Å; F551-Y555 AromaticContact CE2-CE2 3.13Å; F551-Y555 HydrophobicContact CE2-CE2 3.13Å; F551-Y555 HydrophobicContact CE2-CG 4.46Å; F551-Y555 AromaticContact CE2-CZ 3.97Å; F551-Y555 HydrophobicContact CG-CD2 4.03Å; F551-Y555 HydrophobicContact CG-CE2 4.33Å; F551-Y555 AromaticContact CZ-CD2 3.66Å; F551-Y555 HydrophobicContact CZ-CD2 3.66Å; F551-Y555 AromaticContact CZ-CE2 3.77Å; F551-Y555 HydrophobicContact CZ-CE2 3.77Å; F551-Y555 HydrophobicContact CZ-CG 4.34Å; F551-Y555 VanDerWaalsContact O-CD2 3.31Å; F551-Y555 WeakPolarHBondContact O-CD2 3.47Å; F551-Y555 PolarHBondContact O-N 3.27Å; F551-Y555 VanDerWaalsContact O-N 3.08Å; F551-L557 HydrophobicContact CE1-CD1 4.18Å; F551-L562 HydrophobicContact CD1-CD2 4.44Å; F551-L562 HydrophobicContact CE1-CD2 4.5Å
552	C	88.1	Confident	87.1	Confident	3 Å²	3	54.6 Å²	54.6	2%	0.02	27%	0.273	C	S	.	.	H	α-helix	trans	-62.4	-35.8	176.4	-67.8	0	0	0	0	112.4	L548 F549 K550 A556 L557 L562	L548-C552 PolarHBondContact O-N 3.45Å; L548-C552 PolarHBondContact O-SG 3.08Å; F549-C552 WeakPolarHBondContact O-CB 3.25Å; F549-C552 PolarHBondContact O-N 2.88Å; F549-C552 VanDerWaalsContact O-N 3.15Å; K550-C552 VanDerWaalsContact C-N 3.34Å; K550-C552 PolarHBondContact O-N 2.83Å; C552-A556 CarbonylContact O-C 3.5Å; C552-A556 WeakPolarHBondContact O-CA 3.48Å; C552-A556 PolarHBondContact O-N 2.95Å; C552-L557 HydrophobicContact CB-CB 4.48Å; C552-L557 PolarHBondContact O-N 3.17Å; C552-L562 VanDerWaalsContact SG-CD2 3.55Å
553	K	88.2	Confident	87.4	Confident	126 Å²	126	53.2 Å²	53.2	55%	0.548	27%	0.266	S	S	.	.	H	α-helix	trans	-68.5	-45.3	177.3	-169.3	171.6	-178.7	169.1	0	111.5	E505 F549 K550 F551 Y555 A556	E505-K553 IonicContact OE1-NZ 2.68Å; E505-K553 PolarHBondContact OE1-NZ 3.32Å; F549-K553 PolarHBondContact O-N 3.45Å; K550-K553 WeakPolarHBondContact O-CB 3.44Å; K550-K553 PolarHBondContact O-N 3.48Å; K550-K553 VanDerWaalsContact O-N 3.12Å; F551-K553 VanDerWaalsContact C-N 3.27Å; F551-K553 PolarHBondContact O-N 2.92Å; K553-Y555 VanDerWaalsContact C-N 3.34Å; K553-Y555 PolarHBondContact O-N 3.49Å; K553-A556 PolarHBondContact O-N 3.05Å
554	D	90.2	Very high	87.7	Confident	112 Å²	112	50.8 Å²	50.8	60%	0.599	25%	0.251	S	S	*	.	H	α-helix	trans	-64.8	-37.2	-179	-64.4	-19	0	0	0	112.2	K550 F551	K550-D554 VanDerWaalsContact O-CG 3.26Å; K550-D554 PolarHBondContact O-N 3.49Å; F551-D554 PolarHBondContact O-N 3.46Å
555	Y	86.1	Confident	88	Confident	156 Å²	156	50.3 Å²	50.3	61%	0.612	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.6	7.2	179.1	-68.8	-83.8	0	0	0	114.3	F551 K553 L557	F551-Y555 HydrophobicContact CD1-CD2 4.26Å; F551-Y555 AromaticContact CD2-CD2 3.61Å; F551-Y555 HydrophobicContact CD2-CD2 3.61Å; F551-Y555 AromaticContact CD2-CE2 3.46Å; F551-Y555 HydrophobicContact CD2-CE2 3.46Å; F551-Y555 VanDerWaalsContact CD2-CE2 3.46Å; F551-Y555 HydrophobicContact CE1-CD2 4.08Å; F551-Y555 AromaticContact CE2-CD2 3.42Å; F551-Y555 HydrophobicContact CE2-CD2 3.42Å; F551-Y555 VanDerWaalsContact CE2-CD2 3.42Å; F551-Y555 AromaticContact CE2-CE2 3.13Å; F551-Y555 HydrophobicContact CE2-CE2 3.13Å; F551-Y555 HydrophobicContact CE2-CG 4.46Å; F551-Y555 AromaticContact CE2-CZ 3.97Å; F551-Y555 HydrophobicContact CG-CD2 4.03Å; F551-Y555 HydrophobicContact CG-CE2 4.33Å; F551-Y555 AromaticContact CZ-CD2 3.66Å; F551-Y555 HydrophobicContact CZ-CD2 3.66Å; F551-Y555 AromaticContact CZ-CE2 3.77Å; F551-Y555 HydrophobicContact CZ-CE2 3.77Å; F551-Y555 HydrophobicContact CZ-CG 4.34Å; F551-Y555 VanDerWaalsContact O-CD2 3.31Å; F551-Y555 WeakPolarHBondContact O-CD2 3.47Å; F551-Y555 PolarHBondContact O-N 3.27Å; F551-Y555 VanDerWaalsContact O-N 3.08Å; K553-Y555 VanDerWaalsContact C-N 3.34Å; K553-Y555 PolarHBondContact O-N 3.49Å; Y555-L557 PolarHBondContact O-N 3.27Å
556	A	85.7	Confident	88.3	Confident	94 Å²	94	50.2 Å²	50.2	78%	0.777	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.4	35	-177	0	0	0	0	0	114.8	C552 K553	C552-A556 CarbonylContact O-C 3.5Å; C552-A556 WeakPolarHBondContact O-CA 3.48Å; C552-A556 PolarHBondContact O-N 2.95Å; K553-A556 PolarHBondContact O-N 3.05Å
557	L	85.8	Confident	88.7	Confident	21 Å²	21	43.9 Å²	43.9	11%	0.11	22%	0.222	C	C	.	.			trans	-88.9	151.1	176.7	-64.3	174.8	0	0	0	111.4	F551 C552 Y555 Y559 L562 T782	F551-L557 HydrophobicContact CE1-CD1 4.18Å; C552-L557 HydrophobicContact CB-CB 4.48Å; C552-L557 PolarHBondContact O-N 3.17Å; Y555-L557 PolarHBondContact O-N 3.27Å; L557-Y559 PolarHBondContact O-N 3.47Å; L557-L562 HydrophobicContact CD1-CD2 4.35Å; L557-T782 HydrophobicContact CD1-CG2 4.25Å; L557-T782 HydrophobicContact CD2-CG2 4.08Å
558	S	87.3	Confident	88.9	Confident	30 Å²	30	43.7 Å²	43.7	21%	0.21	22%	0.222	C	C	.	.			trans	-75.1	110.7	173.2	69.3	0	0	0	0	110.8	L560 S561 L562 P777 N778	S558-L560 PolarHBondContact O-N 2.89Å; S558-S561 PolarHBondContact O-N 2.96Å; S558-L562 PolarHBondContact O-N 3.06Å; S558-L562 VanDerWaalsContact O-N 3.16Å; S558-P777 WeakPolarHBondContact OG-CD 3.46Å; S558-P777 WeakPolarHBondContact OG-CG 3.39Å; S558-N778 WeakPolarHBondContact CB-OD1 3.28Å; S558-N778 PolarHBondContact N-OD1 3.44Å; S558-N778 PolarHBondContact O-ND2 3.25Å; S558-N778 VanDerWaalsContact O-ND2 3.09Å; S558-N778 PolarHBondContact OG-ND2 2.91Å; S558-N778 PolarHBondContact OG-OD1 3.32Å
559	Y	87.9	Confident	89.2	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-54.7	-47.4	-177.6	169.6	-117.3	0	0	0	113.7	T504 R507 I508 E545 L548 F549 L557 S561 L562 R563	T504-Y559 HydrophobicContact CG2-CE1 4.17Å; R507-Y559 HydrophobicContact CB-CD1 4.3Å; I508-Y559 HydrophobicContact CD1-CE1 3.96Å; I508-Y559 HydrophobicContact CG1-CE1 4.44Å; E545-Y559 PolarHBondContact OE2-OH 3.25Å; L548-Y559 HydrophobicContact CB-CE2 4.38Å; L548-Y559 HydrophobicContact CD2-CD2 4.39Å; L548-Y559 HydrophobicContact CD2-CE2 3.93Å; L548-Y559 HydrophobicContact CG-CD2 4.19Å; L548-Y559 HydrophobicContact CG-CE2 4Å; F549-Y559 HydrophobicContact CB-CD2 4.21Å; F549-Y559 HydrophobicContact CB-CE2 4.16Å; F549-Y559 AromaticContact CD2-CD1 3.94Å; F549-Y559 HydrophobicContact CD2-CD1 3.94Å; F549-Y559 HydrophobicContact CD2-CD2 4.14Å; F549-Y559 HydrophobicContact CD2-CE1 4.43Å; F549-Y559 AromaticContact CD2-CG 3.82Å; F549-Y559 HydrophobicContact CD2-CG 3.82Å; L557-Y559 PolarHBondContact O-N 3.47Å; Y559-S561 PolarHBondContact O-N 3.37Å; Y559-L562 PolarHBondContact O-N 2.98Å; Y559-R563 WeakPolarHBondContact O-CB 3.34Å; Y559-R563 PolarHBondContact O-N 3.39Å; Y559-R563 PolarHBondContact OH-NH1 2.72Å
560	L	87.4	Confident	89.4	Confident	34 Å²	34	46.2 Å²	46.2	18%	0.178	23%	0.23	C	C	.	.	H	α-helix	trans	-64.3	-42.2	-175.5	-90.3	67	0	0	0	112.8	R507 S558 A564 R768 I772	R507-L560 HydrophobicContact CB-CD1 4.03Å; R507-L560 HydrophobicContact CG-CD1 4.42Å; S558-L560 PolarHBondContact O-N 2.89Å; L560-A564 WeakPolarHBondContact O-CB 3.48Å; L560-A564 PolarHBondContact O-N 3.01Å; L560-R768 VanDerWaalsContact CD2-NH1 3.3Å; L560-I772 HydrophobicContact CB-CD1 4.03Å; L560-I772 HydrophobicContact CB-CG2 4.2Å; L560-I772 HydrophobicContact CD2-CD1 3.69Å; L560-I772 HydrophobicContact CD2-CG1 4.12Å; L560-I772 HydrophobicContact CG-CD1 3.89Å
561	S	88.6	Confident	89.8	Confident	4 Å²	4	40.2 Å²	40.2	3%	0.028	21%	0.205	C	C	.	.	H	α-helix	trans	-71.5	-40.3	179.2	152.3	0	0	0	0	111.3	S558 Y559 A564 C565 P774 N778	S558-S561 PolarHBondContact O-N 2.96Å; Y559-S561 PolarHBondContact O-N 3.37Å; S561-A564 PolarHBondContact O-N 3.24Å; S561-C565 PolarHBondContact O-N 2.66Å; S561-C565 PolarHBondContact O-SG 3.2Å; S561-P774 PolarHBondContact OG-O 3.34Å; S561-N778 PolarHBondContact OG-ND2 3.43Å
562	L	89.2	Confident	90.1	Very high	10 Å²	10	41 Å²	41	5%	0.052	21%	0.209	C	C	.	.	H	α-helix	trans	-64.5	-42.4	175.3	-173.7	64.2	0	0	0	111.3	L548 F551 C552 L557 S558 Y559 A564 C565 I566 N778 A786	L548-L562 HydrophobicContact CD1-CD2 3.88Å; L548-L562 HydrophobicContact CD1-CG 4.41Å; F551-L562 HydrophobicContact CD1-CD2 4.44Å; F551-L562 HydrophobicContact CE1-CD2 4.5Å; C552-L562 VanDerWaalsContact SG-CD2 3.55Å; L557-L562 HydrophobicContact CD1-CD2 4.35Å; S558-L562 PolarHBondContact O-N 3.06Å; S558-L562 VanDerWaalsContact O-N 3.16Å; Y559-L562 PolarHBondContact O-N 2.98Å; L562-A564 PolarHBondContact O-N 3.3Å; L562-C565 PolarHBondContact O-N 2.92Å; L562-I566 HydrophobicContact CD1-CD1 4.5Å; L562-I566 HydrophobicContact CG-CD1 3.98Å; L562-I566 WeakPolarHBondContact O-CG1 3.26Å; L562-I566 PolarHBondContact O-N 3.48Å; L562-N778 PolarHBondContact N-ND2 2.82Å; L562-A786 HydrophobicContact CD1-CB 4.42Å
563	R	90.6	Very high	90.4	Very high	1 Å²	1	43 Å²	43	0%	0.004	22%	0.219	C	C	.	.	H	α-helix	trans	-57	-47.1	173.2	179.7	-164.1	175.3	87.3	32.2	111.5	E545 L548 Y559 C565 I566 G567 L840 W842	E545-R563 IonicContact OE1-CZ 2.87Å; E545-R563 IonicContact OE1-NH1 3.22Å; E545-R563 PolarHBondContact OE1-NH1 2.79Å; E545-R563 IonicContact OE1-NH2 3.49Å; E545-R563 PolarHBondContact OE1-NH2 3.14Å; E545-R563 IonicContact OE2-CZ 2.8Å; E545-R563 IonicContact OE2-NH1 3.46Å; E545-R563 PolarHBondContact OE2-NH1 2.97Å; L548-R563 HydrophobicContact CD2-CB 4.35Å; Y559-R563 WeakPolarHBondContact O-CB 3.34Å; Y559-R563 PolarHBondContact O-N 3.39Å; Y559-R563 PolarHBondContact OH-NH1 2.72Å; R563-C565 VanDerWaalsContact C-N 3.34Å; R563-C565 PolarHBondContact O-N 3.46Å; R563-I566 PolarHBondContact O-N 3.35Å; R563-G567 PolarHBondContact O-N 3.34Å; R563-L840 PolarHBondContact NH2-O 2.84Å; R563-W842 HydrophobicContact CG-CZ2 3.96Å
564	A	90.1	Very high	90.5	Very high	1 Å²	1	37 Å²	37	1%	0.008	19%	0.193	C	C	.	.	H	α-helix	trans	-60.9	-42.5	178.1	0	0	0	0	0	111.7	L560 S561 L562 G567 L568 I772 P774	L560-A564 WeakPolarHBondContact O-CB 3.48Å; L560-A564 PolarHBondContact O-N 3.01Å; S561-A564 PolarHBondContact O-N 3.24Å; L562-A564 PolarHBondContact O-N 3.3Å; A564-G567 PolarHBondContact O-N 2.79Å; A564-L568 VanDerWaalsContact O-CG 3.31Å; A564-L568 WeakPolarHBondContact O-CG 2.99Å; A564-L568 PolarHBondContact O-N 2.72Å; A564-I772 HydrophobicContact CB-CG2 4.41Å; A564-P774 HydrophobicContact CB-CB 4.37Å
565	C	91.6	Very high	90.7	Very high	7 Å²	7	34.7 Å²	34.7	5%	0.047	18%	0.18	C	C	.	.	H	α-helix	trans	-63.7	-46.6	175.5	-72.9	0	0	0	0	112.9	S561 L562 R563 G567 L568 W569 P774 A786	S561-C565 PolarHBondContact O-N 2.66Å; S561-C565 PolarHBondContact O-SG 3.2Å; L562-C565 PolarHBondContact O-N 2.92Å; R563-C565 VanDerWaalsContact C-N 3.34Å; R563-C565 PolarHBondContact O-N 3.46Å; C565-G567 VanDerWaalsContact C-N 3.3Å; C565-G567 PolarHBondContact O-N 2.89Å; C565-L568 PolarHBondContact O-N 3.31Å; C565-W569 VanDerWaalsContact O-CD1 3.29Å; C565-W569 PolarHBondContact O-N 2.79Å; C565-W569 VanDerWaalsContact O-N 3.08Å; C565-P774 PolarHBondContact SG-O 3.3Å; C565-A786 HydrophobicContact CB-CB 4.28Å
566	I	92.5	Very high	91	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-59.2	-45.5	176.2	-68.2	167.3	0	0	0	109.8	F544 L548 L562 R563 L568 W569 T570 A786 P789 A790 W842	F544-I566 HydrophobicContact CZ-CG2 4.28Å; L548-I566 HydrophobicContact CD1-CD1 3.47Å; L548-I566 VanDerWaalsContact CD1-CD1 3.47Å; L548-I566 HydrophobicContact CD2-CD1 3.81Å; L548-I566 HydrophobicContact CG-CD1 4.31Å; L562-I566 HydrophobicContact CD1-CD1 4.5Å; L562-I566 HydrophobicContact CG-CD1 3.98Å; L562-I566 WeakPolarHBondContact O-CG1 3.26Å; L562-I566 PolarHBondContact O-N 3.48Å; R563-I566 PolarHBondContact O-N 3.35Å; I566-L568 PolarHBondContact O-N 3.29Å; I566-W569 PolarHBondContact O-N 2.81Å; I566-T570 HydrophobicContact CG2-CG2 4.27Å; I566-T570 VanDerWaalsContact O-CG2 3.31Å; I566-T570 WeakPolarHBondContact O-CG2 3.42Å; I566-T570 PolarHBondContact O-N 3.15Å; I566-T570 PolarHBondContact O-OG1 3.2Å; I566-A786 HydrophobicContact CG1-CB 3.78Å; I566-P789 HydrophobicContact CD1-CB 4.04Å; I566-P789 HydrophobicContact CD1-CG 4.46Å; I566-P789 HydrophobicContact CG1-CB 4.35Å; I566-P789 HydrophobicContact CG2-CB 4.49Å; I566-A790 HydrophobicContact CG2-CB 4.23Å; I566-W842 HydrophobicContact CB-CH2 4.48Å; I566-W842 HydrophobicContact CG2-CH2 3.87Å; I566-W842 HydrophobicContact CG2-CZ2 4.5Å
567	G	92.9	Very high	91.2	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-63.8	-36	179.3	0	0	0	0	0	114.8	R563 A564 C565 T570 A571 L832 S836	R563-G567 PolarHBondContact O-N 3.34Å; A564-G567 PolarHBondContact O-N 2.79Å; C565-G567 VanDerWaalsContact C-N 3.3Å; C565-G567 PolarHBondContact O-N 2.89Å; G567-T570 VanDerWaalsContact C-OG1 3.3Å; G567-T570 VanDerWaalsContact CA-OG1 3.23Å; G567-T570 WeakPolarHBondContact CA-OG1 3.42Å; G567-T570 PolarHBondContact O-OG1 3.47Å; G567-A571 WeakPolarHBondContact O-CB 3.44Å; G567-A571 PolarHBondContact O-N 2.87Å; G567-L832 WeakPolarHBondContact O-CD2 3.21Å; G567-S836 VanDerWaalsContact CA-OG 3.29Å; G567-S836 WeakPolarHBondContact CA-OG 2.79Å
568	L	92.3	Very high	91.4	Very high	66 Å²	66	26.9 Å²	26.9	35%	0.346	14%	0.138	S	C	.	.	H	α-helix	trans	-70.5	-40.2	174.6	-72.2	173.3	0	0	0	111.6	A564 C565 I566 A571 F572 P774 I837	A564-L568 VanDerWaalsContact O-CG 3.31Å; A564-L568 WeakPolarHBondContact O-CG 2.99Å; A564-L568 PolarHBondContact O-N 2.72Å; C565-L568 PolarHBondContact O-N 3.31Å; I566-L568 PolarHBondContact O-N 3.29Å; L568-A571 PolarHBondContact O-N 3.32Å; L568-F572 WeakPolarHBondContact O-CB 3.03Å; L568-F572 PolarHBondContact O-N 3.14Å; L568-P774 HydrophobicContact CD1-CB 4.03Å; L568-P774 HydrophobicContact CD1-CG 4.4Å; L568-I837 HydrophobicContact CD2-CD1 4.14Å; L568-I837 HydrophobicContact CD2-CG1 4.15Å
569	W	94.8	Very high	91.5	Very high	77 Å²	77	26.1 Å²	26.1	29%	0.292	13%	0.133	S	C	.	.	H	α-helix	trans	-65.6	-41.1	174	-82	117.8	0	0	0	112.5	C565 I566 F572 L573 V783 I787 A790	C565-W569 VanDerWaalsContact O-CD1 3.29Å; C565-W569 PolarHBondContact O-N 2.79Å; C565-W569 VanDerWaalsContact O-N 3.08Å; I566-W569 PolarHBondContact O-N 2.81Å; W569-F572 HydrophobicContact CE3-CD1 4.08Å; W569-F572 HydrophobicContact CZ3-CD1 4.07Å; W569-F572 HydrophobicContact CZ3-CE1 4.33Å; W569-F572 PolarHBondContact O-N 3.28Å; W569-L573 WeakPolarHBondContact O-CB 3.31Å; W569-L573 VanDerWaalsContact O-CG 3.28Å; W569-L573 WeakPolarHBondContact O-CG 3.48Å; W569-L573 PolarHBondContact O-N 3.37Å; W569-V783 PolarHBondContact NE1-O 2.89Å; W569-I787 HydrophobicContact CD2-CD1 4.46Å; W569-I787 HydrophobicContact CD2-CG1 3.76Å; W569-I787 HydrophobicContact CE3-CG1 4.18Å; W569-I787 HydrophobicContact CG-CG1 4.16Å; W569-I787 HydrophobicContact CH2-CD1 3.98Å; W569-I787 HydrophobicContact CH2-CG1 4.33Å; W569-I787 HydrophobicContact CZ2-CD1 3.78Å; W569-I787 HydrophobicContact CZ2-CG1 3.92Å; W569-I787 HydrophobicContact CZ3-CD1 4.38Å; W569-I787 HydrophobicContact CZ3-CG1 4.44Å; W569-A790 HydrophobicContact CB-CB 3.51Å
570	T	93.5	Very high	91.5	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.1	-44.4	175.5	51.5	0	0	0	0	111.4	I566 G567 F572 L573 C574 A790 C793 L832	I566-T570 HydrophobicContact CG2-CG2 4.27Å; I566-T570 VanDerWaalsContact O-CG2 3.31Å; I566-T570 WeakPolarHBondContact O-CG2 3.42Å; I566-T570 PolarHBondContact O-N 3.15Å; I566-T570 PolarHBondContact O-OG1 3.2Å; G567-T570 VanDerWaalsContact C-OG1 3.3Å; G567-T570 VanDerWaalsContact CA-OG1 3.23Å; G567-T570 WeakPolarHBondContact CA-OG1 3.42Å; G567-T570 PolarHBondContact O-OG1 3.47Å; T570-F572 VanDerWaalsContact C-N 3.32Å; T570-F572 PolarHBondContact O-N 3.16Å; T570-L573 PolarHBondContact O-N 2.74Å; T570-C574 WeakPolarHBondContact O-CB 3.46Å; T570-C574 PolarHBondContact O-N 3.49Å; T570-C574 PolarHBondContact O-SG 2.9Å; T570-C574 VanDerWaalsContact O-SG 3.34Å; T570-A790 HydrophobicContact CG2-CB 3.77Å; T570-A790 VanDerWaalsContact CG2-O 3.27Å; T570-A790 WeakPolarHBondContact CG2-O 3.38Å; T570-C793 HydrophobicContact CG2-CB 3.62Å; T570-L832 WeakPolarHBondContact OG1-CD2 3.38Å
571	A	94.6	Very high	91.3	Very high	8 Å²	8	27.8 Å²	27.8	7%	0.066	15%	0.145	C	C	.	.	H	α-helix	trans	-58.8	-44.3	175.6	0	0	0	0	0	111.5	G567 L568 C574 I575 A829 L832	G567-A571 WeakPolarHBondContact O-CB 3.44Å; G567-A571 PolarHBondContact O-N 2.87Å; L568-A571 PolarHBondContact O-N 3.32Å; A571-C574 PolarHBondContact O-N 3.11Å; A571-I575 VanDerWaalsContact O-CG1 3.31Å; A571-I575 WeakPolarHBondContact O-CG1 3.42Å; A571-I575 PolarHBondContact O-N 3.47Å; A571-A829 WeakPolarHBondContact CB-O 3.36Å; A571-L832 HydrophobicContact CB-CD2 4.15Å
572	F	94.4	Very high	91	Very high	111 Å²	111	28.1 Å²	28.1	49%	0.487	15%	0.148	S	C	.	.	H	α-helix	trans	-60.9	-48.7	175.2	176	-101.5	0	0	0	112.2	L568 W569 T570 C574 I575 V576	L568-F572 WeakPolarHBondContact O-CB 3.03Å; L568-F572 PolarHBondContact O-N 3.14Å; W569-F572 HydrophobicContact CE3-CD1 4.08Å; W569-F572 HydrophobicContact CZ3-CD1 4.07Å; W569-F572 HydrophobicContact CZ3-CE1 4.33Å; W569-F572 PolarHBondContact O-N 3.28Å; T570-F572 VanDerWaalsContact C-N 3.32Å; T570-F572 PolarHBondContact O-N 3.16Å; F572-C574 VanDerWaalsContact C-N 3.35Å; F572-C574 PolarHBondContact O-N 3.49Å; F572-I575 PolarHBondContact O-N 2.7Å; F572-V576 HydrophobicContact CD1-CG2 4.43Å; F572-V576 HydrophobicContact CE1-CG2 4.01Å; F572-V576 HydrophobicContact CE2-CG2 4.38Å; F572-V576 HydrophobicContact CZ-CG2 3.99Å; F572-V576 WeakPolarHBondContact O-CG2 3.22Å; F572-V576 PolarHBondContact O-N 2.71Å
573	L	93.6	Very high	90.4	Very high	44 Å²	44	27.7 Å²	27.7	23%	0.23	15%	0.145	C	C	.	.	H	α-helix	trans	-63.4	-38.9	178.9	-70.1	173.4	0	0	0	112.1	W569 T570 I575 V576 L577 A790 L791 T794	W569-L573 WeakPolarHBondContact O-CB 3.31Å; W569-L573 VanDerWaalsContact O-CG 3.28Å; W569-L573 WeakPolarHBondContact O-CG 3.48Å; W569-L573 PolarHBondContact O-N 3.37Å; T570-L573 PolarHBondContact O-N 2.74Å; L573-I575 PolarHBondContact O-N 2.96Å; L573-V576 WeakPolarHBondContact O-CB 3.07Å; L573-V576 PolarHBondContact O-N 2.74Å; L573-L577 WeakPolarHBondContact O-CG 2.93Å; L573-L577 PolarHBondContact O-N 2.99Å; L573-A790 HydrophobicContact CD1-CB 4.49Å; L573-L791 HydrophobicContact CD1-CB 4.42Å; L573-T794 HydrophobicContact CB-CG2 3.84Å
574	C	92.3	Very high	89.4	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.007	15%	0.154	C	C	.	.	H	α-helix	trans	-62	-40.8	173.4	-72.8	0	0	0	0	112.2	T570 A571 F572 V576 L577 V578 A829	T570-C574 WeakPolarHBondContact O-CB 3.46Å; T570-C574 PolarHBondContact O-N 3.49Å; T570-C574 PolarHBondContact O-SG 2.9Å; T570-C574 VanDerWaalsContact O-SG 3.34Å; A571-C574 PolarHBondContact O-N 3.11Å; F572-C574 VanDerWaalsContact C-N 3.35Å; F572-C574 PolarHBondContact O-N 3.49Å; C574-V576 VanDerWaalsContact C-N 3.3Å; C574-V576 PolarHBondContact O-N 3.48Å; C574-L577 WeakPolarHBondContact O-CB 3.37Å; C574-L577 PolarHBondContact O-N 3.32Å; C574-V578 WeakPolarHBondContact O-CG2 3.45Å; C574-V578 PolarHBondContact O-N 3.08Å; C574-A829 HydrophobicContact CB-CB 3.52Å
575	I	92.7	Very high	88.7	Confident	62 Å²	62	33.4 Å²	33.4	32%	0.318	18%	0.177	S	C	.	.	H	α-helix	trans	-63.2	-39	175	-68.3	164.3	0	0	0	110.6	F452 A571 F572 L573 V578 A579 L826 A829	F452-I575 HydrophobicContact CZ-CG2 4.48Å; A571-I575 VanDerWaalsContact O-CG1 3.31Å; A571-I575 WeakPolarHBondContact O-CG1 3.42Å; A571-I575 PolarHBondContact O-N 3.47Å; F572-I575 PolarHBondContact O-N 2.7Å; L573-I575 PolarHBondContact O-N 2.96Å; I575-V578 PolarHBondContact O-N 3.06Å; I575-A579 WeakPolarHBondContact O-CB 3.33Å; I575-A579 PolarHBondContact O-N 3.3Å; I575-L826 HydrophobicContact CG1-CD1 4.3Å; I575-A829 HydrophobicContact CG1-CB 4.2Å
576	V	92.7	Very high	87.9	Confident	60 Å²	60	33.3 Å²	33.3	36%	0.364	18%	0.177	S	C	.	.	H	α-helix	trans	-63.5	-40.4	174.2	173.8	0	0	0	0	111.5	F572 L573 C574 V578 A579 T580	F572-V576 HydrophobicContact CD1-CG2 4.43Å; F572-V576 HydrophobicContact CE1-CG2 4.01Å; F572-V576 HydrophobicContact CE2-CG2 4.38Å; F572-V576 HydrophobicContact CZ-CG2 3.99Å; F572-V576 WeakPolarHBondContact O-CG2 3.22Å; F572-V576 PolarHBondContact O-N 2.71Å; L573-V576 WeakPolarHBondContact O-CB 3.07Å; L573-V576 PolarHBondContact O-N 2.74Å; C574-V576 VanDerWaalsContact C-N 3.3Å; C574-V576 PolarHBondContact O-N 3.48Å; V576-V578 VanDerWaalsContact C-N 3.35Å; V576-V578 PolarHBondContact O-N 2.84Å; V576-A579 PolarHBondContact O-N 2.61Å; V576-T580 HydrophobicContact CG1-CG2 4.38Å; V576-T580 WeakPolarHBondContact O-CB 3.3Å; V576-T580 WeakPolarHBondContact O-CG2 3.48Å; V576-T580 PolarHBondContact O-N 3.09Å; V576-T580 PolarHBondContact O-OG1 3.46Å
577	L	90.2	Very high	86.8	Confident	48 Å²	48	34.6 Å²	34.6	25%	0.251	19%	0.186	S	C	.	.	H	α-helix	trans	-62.9	-39.4	174.6	-69.8	177.8	0	0	0	112.3	L573 C574 T580 D581 A582 T794 F798 L825	L573-L577 WeakPolarHBondContact O-CG 2.93Å; L573-L577 PolarHBondContact O-N 2.99Å; C574-L577 WeakPolarHBondContact O-CB 3.37Å; C574-L577 PolarHBondContact O-N 3.32Å; L577-T580 WeakPolarHBondContact CA-OG1 3.34Å; L577-T580 PolarHBondContact O-N 3.29Å; L577-T580 PolarHBondContact O-OG1 3.43Å; L577-D581 PolarHBondContact O-N 2.88Å; L577-A582 HydrophobicContact CB-CB 3.95Å; L577-A582 HydrophobicContact CD2-CB 3.8Å; L577-A582 HydrophobicContact CG-CB 4.45Å; L577-A582 VanDerWaalsContact O-CB 3.26Å; L577-A582 WeakPolarHBondContact O-CB 3.36Å; L577-A582 PolarHBondContact O-N 2.93Å; L577-T794 HydrophobicContact CD1-CG2 3.7Å; L577-F798 HydrophobicContact CD1-CB 4.44Å; L577-F798 HydrophobicContact CD1-CD2 4Å; L577-F798 HydrophobicContact CD1-CG 4.3Å; L577-L825 HydrophobicContact CB-CD2 4.47Å
578	V	90.3	Very high	85.9	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64.7	-43.8	172.9	174.3	0	0	0	0	111	F452 L455 C574 I575 V576 T580 D581 H822 L825 L826	F452-V578 HydrophobicContact CD1-CG1 4.46Å; L455-V578 HydrophobicContact CB-CG1 4.48Å; C574-V578 WeakPolarHBondContact O-CG2 3.45Å; C574-V578 PolarHBondContact O-N 3.08Å; I575-V578 PolarHBondContact O-N 3.06Å; V576-V578 VanDerWaalsContact C-N 3.35Å; V576-V578 PolarHBondContact O-N 2.84Å; V578-T580 VanDerWaalsContact C-N 3.27Å; V578-T580 PolarHBondContact O-N 3.28Å; V578-D581 PolarHBondContact O-N 3.31Å; V578-H822 HydrophobicContact CG1-CB 4.42Å; V578-L825 HydrophobicContact CG2-CB 3.96Å; V578-L825 HydrophobicContact CG2-CD2 3.66Å; V578-L825 HydrophobicContact CG2-CG 3.7Å; V578-L826 HydrophobicContact CG1-CB 4.36Å; V578-L826 HydrophobicContact CG2-CB 4.25Å
579	A	89.4	Confident	85.1	Confident	14 Å²	14	39.8 Å²	39.8	12%	0.116	20%	0.203	C	C	.	.	H	α-helix	trans	-66	-29.2	-179.2	0	0	0	0	0	113.1	F452 I575 V576 D581	F452-A579 HydrophobicContact CD2-CB 4.39Å; F452-A579 HydrophobicContact CE1-CB 4.1Å; F452-A579 HydrophobicContact CE2-CB 3.96Å; F452-A579 HydrophobicContact CZ-CB 3.81Å; F452-A579 PolarHBondContact N-O 3.48Å; I575-A579 WeakPolarHBondContact O-CB 3.33Å; I575-A579 PolarHBondContact O-N 3.3Å; V576-A579 PolarHBondContact O-N 2.61Å; A579-D581 VanDerWaalsContact C-N 3.35Å
580	T	88.1	Confident	84.3	Confident	64 Å²	64	37.5 Å²	37.5	39%	0.393	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	6.6	-179.3	51.4	0	0	0	0	114.1	V576 L577 V578 A582	V576-T580 HydrophobicContact CG1-CG2 4.38Å; V576-T580 WeakPolarHBondContact O-CB 3.3Å; V576-T580 WeakPolarHBondContact O-CG2 3.48Å; V576-T580 PolarHBondContact O-N 3.09Å; V576-T580 PolarHBondContact O-OG1 3.46Å; L577-T580 WeakPolarHBondContact CA-OG1 3.34Å; L577-T580 PolarHBondContact O-N 3.29Å; L577-T580 PolarHBondContact O-OG1 3.43Å; V578-T580 VanDerWaalsContact C-N 3.27Å; V578-T580 PolarHBondContact O-N 3.28Å; T580-A582 VanDerWaalsContact C-N 3.27Å; T580-A582 PolarHBondContact O-N 3.08Å
581	D	83.7	Confident	83.6	Confident	5 Å²	5	38.1 Å²	38.1	3%	0.027	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	39.1	-173.8	-71.7	-12	0	0	0	112.4	R447 T448 G454 L577 V578 A579 S583 S584 H822	R447-D581 HydrophobicContact CG-CB 4.44Å; T448-D581 PolarHBondContact N-OD2 3.28Å; T448-D581 PolarHBondContact OG1-OD2 3.24Å; G454-D581 PolarHBondContact N-OD1 2.98Å; G454-D581 VanDerWaalsContact N-OD1 3.09Å; L577-D581 PolarHBondContact O-N 2.88Å; V578-D581 PolarHBondContact O-N 3.31Å; A579-D581 VanDerWaalsContact C-N 3.35Å; D581-S583 PolarHBondContact O-N 3.45Å; D581-S583 VanDerWaalsContact O-N 3.11Å; D581-S584 PolarHBondContact O-N 2.86Å; D581-S584 VanDerWaalsContact O-N 3.11Å; D581-S584 PolarHBondContact O-OG 3.49Å; D581-H822 IonicContact OD1-NE2 2.7Å
582	A	81.6	Confident	83.1	Confident	11 Å²	11	37.9 Å²	37.9	9%	0.091	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-63.4	-18	-177.6	0	0	0	0	0	113.6	L577 T580 S584 L585 F798	L577-A582 HydrophobicContact CB-CB 3.95Å; L577-A582 HydrophobicContact CD2-CB 3.8Å; L577-A582 HydrophobicContact CG-CB 4.45Å; L577-A582 VanDerWaalsContact O-CB 3.26Å; L577-A582 WeakPolarHBondContact O-CB 3.36Å; L577-A582 PolarHBondContact O-N 2.93Å; T580-A582 VanDerWaalsContact C-N 3.27Å; T580-A582 PolarHBondContact O-N 3.08Å; A582-S584 PolarHBondContact O-N 3.42Å; A582-S584 VanDerWaalsContact O-N 3.11Å; A582-L585 VanDerWaalsContact O-CB 3.31Å; A582-L585 WeakPolarHBondContact O-CB 3.31Å; A582-L585 WeakPolarHBondContact O-CG 3.44Å; A582-L585 PolarHBondContact O-N 3.45Å; A582-F798 HydrophobicContact CB-CE2 4.33Å; A582-F798 HydrophobicContact CB-CZ 4.45Å
583	S	76.1	Confident	82.5	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-62.9	-12.6	173.8	-55.9	0	0	0	0	113	D581 L585 V586 Q802 H822	D581-S583 PolarHBondContact O-N 3.45Å; D581-S583 VanDerWaalsContact O-N 3.11Å; S583-L585 PolarHBondContact O-N 3.02Å; S583-V586 WeakPolarHBondContact O-CB 3.34Å; S583-V586 WeakPolarHBondContact O-CG2 3.41Å; S583-V586 PolarHBondContact O-N 3.14Å; S583-V586 VanDerWaalsContact O-N 3.14Å; S583-Q802 PolarHBondContact OG-NE2 3.19Å; S583-H822 WeakPolarHBondContact CB-NE2 3.31Å
584	S	71.1	Confident	81.9	Confident	27 Å²	27	31 Å²	31	19%	0.189	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-62.7	-22.3	169	74.2	0	0	0	0	113.1	D581 A582 V586 C587	D581-S584 PolarHBondContact O-N 2.86Å; D581-S584 VanDerWaalsContact O-N 3.11Å; D581-S584 PolarHBondContact O-OG 3.49Å; A582-S584 PolarHBondContact O-N 3.42Å; A582-S584 VanDerWaalsContact O-N 3.11Å; S584-V586 PolarHBondContact O-N 3.33Å; S584-C587 PolarHBondContact O-N 2.78Å
585	L	74.6	Confident	81.5	Confident	95 Å²	95	31.2 Å²	31.2	50%	0.497	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-64	-20.9	175.6	-69.1	171.5	0	0	0	112.6	A582 S583 C587 Y588	A582-L585 VanDerWaalsContact O-CB 3.31Å; A582-L585 WeakPolarHBondContact O-CB 3.31Å; A582-L585 WeakPolarHBondContact O-CG 3.44Å; A582-L585 PolarHBondContact O-N 3.45Å; S583-L585 PolarHBondContact O-N 3.02Å; L585-C587 PolarHBondContact O-N 3.45Å; L585-Y588 HydrophobicContact CD2-CD2 4.12Å; L585-Y588 HydrophobicContact CD2-CE2 4.13Å; L585-Y588 WeakPolarHBondContact O-CB 3.44Å; L585-Y588 PolarHBondContact O-N 3.29Å
586	V	74.3	Confident	81.1	Confident	5 Å²	5	28.2 Å²	28.2	3%	0.03	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-64.3	-26.1	179.2	-179.4	0	0	0	0	111.7	L445 S583 S584 Y588 I589 Q802 V806	L445-V586 HydrophobicContact CD2-CB 3.79Å; L445-V586 HydrophobicContact CD2-CG1 4.12Å; S583-V586 WeakPolarHBondContact O-CB 3.34Å; S583-V586 WeakPolarHBondContact O-CG2 3.41Å; S583-V586 PolarHBondContact O-N 3.14Å; S583-V586 VanDerWaalsContact O-N 3.14Å; S584-V586 PolarHBondContact O-N 3.33Å; V586-Y588 PolarHBondContact O-N 3.01Å; V586-Y588 VanDerWaalsContact O-N 3.15Å; V586-I589 HydrophobicContact CG1-CD1 4.48Å; V586-I589 WeakPolarHBondContact O-CB 3.46Å; V586-I589 PolarHBondContact O-N 3.4Å; V586-Q802 HydrophobicContact CG2-CB 3.69Å; V586-Q802 HydrophobicContact CG2-CG 3.8Å; V586-V806 HydrophobicContact CG1-CG2 3.06Å
587	C	69.4	Low	80.7	Confident	29 Å²	29	25.6 Å²	25.6	20%	0.196	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-61.3	-20.5	172.6	-73.9	0	0	0	0	113.9	L445 S584 L585	L445-C587 WeakPolarHBondContact CB-SG 3.41Å; S584-C587 PolarHBondContact O-N 2.78Å; L585-C587 PolarHBondContact O-N 3.45Å
588	Y	73.8	Confident	80.4	Confident	158 Å²	158	23.7 Å²	23.7	62%	0.62	13%	0.126	S	C	*	.	G	3₁₀ helix	trans	-83.6	-12.9	176.8	-63.2	-63.3	0	0	0	113.2	L585 V586 T590 V986	L585-Y588 HydrophobicContact CD2-CD2 4.12Å; L585-Y588 HydrophobicContact CD2-CE2 4.13Å; L585-Y588 WeakPolarHBondContact O-CB 3.44Å; L585-Y588 PolarHBondContact O-N 3.29Å; V586-Y588 PolarHBondContact O-N 3.01Å; V586-Y588 VanDerWaalsContact O-N 3.15Å; Y588-T590 PolarHBondContact O-N 3.38Å; Y588-V986 WeakPolarHBondContact O-CG1 3.43Å
589	I	76.5	Confident	80.2	Confident	16 Å²	16	23.9 Å²	23.9	8%	0.082	13%	0.127	C	C	.	.			trans	-77.2	106.5	173.9	-58.1	177.4	0	0	0	107	V586 T593 I803	V586-I589 HydrophobicContact CG1-CD1 4.48Å; V586-I589 WeakPolarHBondContact O-CB 3.46Å; V586-I589 PolarHBondContact O-N 3.4Å; I589-T593 VanDerWaalsContact CG2-OG1 3.32Å; I589-T593 WeakPolarHBondContact CG2-OG1 3.29Å; I589-I803 HydrophobicContact CD1-CG1 3.95Å
590	T	78.1	Confident	80	Confident	30 Å²	30	23.2 Å²	23.2	18%	0.184	12%	0.122	C	C	.	.			trans	-87	162.6	175.9	67.4	0	0	0	0	110.7	Y588 F592 T593 E594 R989	Y588-T590 PolarHBondContact O-N 3.38Å; T590-F592 PolarHBondContact O-N 3.06Å; T590-F592 VanDerWaalsContact O-N 3.14Å; T590-T593 PolarHBondContact N-OG1 3.29Å; T590-T593 PolarHBondContact O-N 3.45Å; T590-T593 PolarHBondContact O-OG1 3.1Å; T590-E594 PolarHBondContact O-N 3.17Å; T590-R989 HydrophobicContact CG2-CG 4.19Å
591	R	78.2	Confident	79.9	Confident	12 Å²	12	21.1 Å²	21.1	5%	0.045	11%	0.108	C	C	.	.	H	α-helix	trans	-50.1	-37.3	173.9	-172.4	-176.6	-170.4	151.4	18.6	113.9	T593 E594 E595 E812 Q923 D1005 L1007	R591-T593 VanDerWaalsContact C-N 3.33Å; R591-T593 PolarHBondContact O-N 3.4Å; R591-E594 PolarHBondContact O-N 3.1Å; R591-E595 HydrophobicContact CG-CG 3.92Å; R591-E595 IonicContact CZ-OE1 3.04Å; R591-E595 IonicContact NE-OE1 2.66Å; R591-E595 PolarHBondContact NE-OE1 2.63Å; R591-E595 IonicContact NH2-OE1 2.69Å; R591-E595 PolarHBondContact NH2-OE1 3.47Å; R591-E595 WeakPolarHBondContact O-CB 3.5Å; R591-E595 WeakPolarHBondContact O-CG 3.23Å; R591-E595 PolarHBondContact O-N 2.77Å; R591-E812 IonicContact CZ-OE1 2.78Å; R591-E812 IonicContact NH1-OE1 2.98Å; R591-E812 IonicContact NH2-OE1 3.71Å; R591-E812 PolarHBondContact NH2-OE1 2.93Å; R591-Q923 VanDerWaalsContact NH2-CG 3.31Å; R591-D1005 VanDerWaalsContact CB-O 3.23Å; R591-D1005 WeakPolarHBondContact CB-O 3.39Å; R591-D1005 WeakPolarHBondContact CD-O 3.47Å; R591-L1007 VanDerWaalsContact NH1-CG 3.32Å
592	F	84	Confident	80	Confident	3 Å²	3	21 Å²	21	1%	0.013	11%	0.107	C	C	.	.	H	α-helix	trans	-53.3	-50.1	174.8	174.8	-97.6	0	0	0	112.1	T590 A596 F955 Q959 R989 M992 D1005	T590-F592 PolarHBondContact O-N 3.06Å; T590-F592 VanDerWaalsContact O-N 3.14Å; F592-A596 VanDerWaalsContact O-CB 3.25Å; F592-A596 WeakPolarHBondContact O-CB 3Å; F592-A596 PolarHBondContact O-N 3.46Å; F592-A596 VanDerWaalsContact O-N 3.1Å; F592-F955 HydrophobicContact CB-CZ 4.43Å; F592-F955 AromaticContact CD2-CE1 3.86Å; F592-F955 HydrophobicContact CD2-CE1 3.86Å; F592-F955 HydrophobicContact CD2-CE2 4.08Å; F592-F955 AromaticContact CD2-CZ 3.45Å; F592-F955 HydrophobicContact CD2-CZ 3.45Å; F592-F955 VanDerWaalsContact CD2-CZ 3.45Å; F592-F955 HydrophobicContact CE2-CE1 4.31Å; F592-F955 HydrophobicContact CE2-CZ 4.14Å; F592-F955 HydrophobicContact CG-CZ 4.37Å; F592-Q959 HydrophobicContact CD2-CB 4.33Å; F592-Q959 HydrophobicContact CD2-CG 4.03Å; F592-Q959 HydrophobicContact CE2-CB 3.52Å; F592-Q959 HydrophobicContact CE2-CG 3.57Å; F592-Q959 HydrophobicContact CZ-CB 4.08Å; F592-Q959 HydrophobicContact CZ-CG 4.06Å; F592-Q959 PolarHBondContact O-NE2 3.1Å; F592-R989 HydrophobicContact CD1-CB 4.16Å; F592-M992 HydrophobicContact CD2-CE 4.23Å; F592-M992 HydrophobicContact CE2-CE 4.28Å; F592-M992 HydrophobicContact CG-CE 4.5Å; F592-D1005 WeakPolarHBondContact CB-OD1 3.34Å
593	T	81.9	Confident	80.3	Confident	2 Å²	2	23.4 Å²	23.4	1%	0.012	12%	0.118	C	C	.	.	H	α-helix	trans	-71.3	-37.7	-179.3	57.6	0	0	0	0	111.9	I589 T590 R591 F597 L985 V986	I589-T593 VanDerWaalsContact CG2-OG1 3.32Å; I589-T593 WeakPolarHBondContact CG2-OG1 3.29Å; T590-T593 PolarHBondContact N-OG1 3.29Å; T590-T593 PolarHBondContact O-N 3.45Å; T590-T593 PolarHBondContact O-OG1 3.1Å; R591-T593 VanDerWaalsContact C-N 3.33Å; R591-T593 PolarHBondContact O-N 3.4Å; T593-F597 WeakPolarHBondContact O-CB 3.27Å; T593-F597 PolarHBondContact O-N 3.03Å; T593-L985 HydrophobicContact CG2-CB 3.87Å; T593-V986 HydrophobicContact CG2-CG2 4.04Å
594	E	80.4	Confident	80.7	Confident	10 Å²	10	24.3 Å²	24.3	5%	0.047	12%	0.123	C	C	.	.	H	α-helix	trans	-63.2	-51.6	177.4	-173	-165.3	145.6	0	0	112	T590 R591 F597 A598 I807	T590-E594 PolarHBondContact O-N 3.17Å; R591-E594 PolarHBondContact O-N 3.1Å; E594-F597 PolarHBondContact O-N 3.43Å; E594-A598 WeakPolarHBondContact O-CB 3.48Å; E594-A598 PolarHBondContact O-N 3Å; E594-I807 HydrophobicContact CG-CD1 4.21Å; E594-I807 HydrophobicContact CG-CG1 3.38Å; E594-I807 WeakPolarHBondContact OE1-CA 3.46Å; E594-I807 WeakPolarHBondContact OE1-CG1 3.43Å
595	E	84.5	Confident	81.3	Confident	4 Å²	4	24.6 Å²	24.6	2%	0.019	12%	0.121	C	C	.	.	H	α-helix	trans	-69.3	-35.6	-179.1	-70.1	-169.1	170.2	0	0	112.1	R591 S599 R810 I922 Q923 F924	R591-E595 HydrophobicContact CG-CG 3.92Å; R591-E595 IonicContact CZ-OE1 3.04Å; R591-E595 IonicContact NE-OE1 2.66Å; R591-E595 PolarHBondContact NE-OE1 2.63Å; R591-E595 IonicContact NH2-OE1 2.69Å; R591-E595 PolarHBondContact NH2-OE1 3.47Å; R591-E595 WeakPolarHBondContact O-CB 3.5Å; R591-E595 WeakPolarHBondContact O-CG 3.23Å; R591-E595 PolarHBondContact O-N 2.77Å; E595-S599 VanDerWaalsContact O-CB 3.31Å; E595-S599 WeakPolarHBondContact O-CB 3.33Å; E595-S599 PolarHBondContact O-N 3.24Å; E595-S599 PolarHBondContact O-OG 2.81Å; E595-S599 VanDerWaalsContact O-OG 3.12Å; E595-R810 IonicContact OE1-NH2 3.94Å; E595-I922 HydrophobicContact CB-CG2 3.76Å; E595-I922 HydrophobicContact CG-CG2 3.89Å; E595-Q923 WeakPolarHBondContact OE1-CB 3.35Å; E595-Q923 PolarHBondContact OE1-N 3.01Å; E595-Q923 WeakPolarHBondContact OE2-CB 3.49Å; E595-F924 HydrophobicContact CB-CB 4.27Å; E595-F924 PolarHBondContact OE2-N 3.47Å
596	A	85	Confident	82	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-60.7	-47.3	171.8	0	0	0	0	0	110.7	F592 S599 L600 Q959 L963	F592-A596 VanDerWaalsContact O-CB 3.25Å; F592-A596 WeakPolarHBondContact O-CB 3Å; F592-A596 PolarHBondContact O-N 3.46Å; F592-A596 VanDerWaalsContact O-N 3.1Å; A596-S599 PolarHBondContact O-N 3.45Å; A596-S599 PolarHBondContact O-OG 3.18Å; A596-L600 WeakPolarHBondContact O-CB 3.27Å; A596-L600 PolarHBondContact O-N 3.01Å; A596-Q959 HydrophobicContact CB-CG 4.28Å; A596-L963 VanDerWaalsContact O-CD1 3.31Å; A596-L963 WeakPolarHBondContact O-CD1 3.47Å
597	F	83.8	Confident	82.7	Confident	4 Å²	4	27.2 Å²	27.2	2%	0.018	13%	0.126	C	C	.	.	H	α-helix	trans	-64.1	-47.3	177.4	-175.1	-100.2	0	0	0	112.4	T593 E594 S599 L600 I601 I803 T847 F978 V982	T593-F597 WeakPolarHBondContact O-CB 3.27Å; T593-F597 PolarHBondContact O-N 3.03Å; E594-F597 PolarHBondContact O-N 3.43Å; F597-S599 PolarHBondContact O-N 2.84Å; F597-L600 WeakPolarHBondContact O-CB 3.26Å; F597-L600 PolarHBondContact O-N 3.41Å; F597-I601 HydrophobicContact CD1-CG1 4.21Å; F597-I601 HydrophobicContact CE1-CD1 4.43Å; F597-I601 HydrophobicContact CE1-CG1 3.9Å; F597-I601 HydrophobicContact CE2-CD1 4.33Å; F597-I601 HydrophobicContact CE2-CG1 4.45Å; F597-I601 HydrophobicContact CZ-CD1 4.06Å; F597-I601 HydrophobicContact CZ-CG1 4.03Å; F597-I601 WeakPolarHBondContact O-CG1 3.48Å; F597-I601 PolarHBondContact O-N 2.91Å; F597-I803 HydrophobicContact CB-CG2 4.4Å; F597-I803 HydrophobicContact CD1-CB 4.39Å; F597-I803 HydrophobicContact CD1-CD1 4.48Å; F597-I803 HydrophobicContact CD1-CG2 3.39Å; F597-I803 HydrophobicContact CD2-CD1 4.37Å; F597-I803 HydrophobicContact CE1-CB 4.35Å; F597-I803 HydrophobicContact CE1-CD1 4.47Å; F597-I803 HydrophobicContact CE1-CG2 3.77Å; F597-I803 HydrophobicContact CE2-CD1 4.36Å; F597-I803 HydrophobicContact CG-CD1 4.41Å; F597-I803 HydrophobicContact CG-CG2 4.03Å; F597-I803 HydrophobicContact CZ-CD1 4.41Å; F597-T847 HydrophobicContact CE1-CG2 3.94Å; F597-F978 HydrophobicContact CD2-CZ 4.26Å; F597-F978 AromaticContact CE2-CE1 3.68Å; F597-F978 HydrophobicContact CE2-CE1 3.68Å; F597-F978 AromaticContact CE2-CZ 3.7Å; F597-F978 HydrophobicContact CE2-CZ 3.7Å; F597-F978 HydrophobicContact CZ-CE1 4.46Å; F597-V982 HydrophobicContact CD2-CG2 4.1Å; F597-V982 HydrophobicContact CE2-CG2 4.31Å
598	A	83.4	Confident	83.3	Confident	8 Å²	8	27.6 Å²	27.6	7%	0.066	13%	0.125	C	C	.	.	H	α-helix	trans	-57.9	-48.8	177.7	0	0	0	0	0	110.8	E594 L600 I601 C602 I807 I922	E594-A598 WeakPolarHBondContact O-CB 3.48Å; E594-A598 PolarHBondContact O-N 3Å; A598-L600 VanDerWaalsContact C-N 3.33Å; A598-L600 PolarHBondContact O-N 2.9Å; A598-I601 PolarHBondContact O-N 3.49Å; A598-C602 PolarHBondContact O-N 3.42Å; A598-C602 PolarHBondContact O-SG 3.19Å; A598-I807 HydrophobicContact CB-CD1 4.29Å; A598-I922 HydrophobicContact CB-CD1 3.98Å
599	S	85.9	Confident	83.8	Confident	4 Å²	4	20.1 Å²	20.1	3%	0.028	10%	0.096	C	C	.	.	H	α-helix	trans	-61.6	-39.1	177.4	70.4	0	0	0	0	112.8	E595 A596 F597 C602 I603 L963	E595-S599 VanDerWaalsContact O-CB 3.31Å; E595-S599 WeakPolarHBondContact O-CB 3.33Å; E595-S599 PolarHBondContact O-N 3.24Å; E595-S599 PolarHBondContact O-OG 2.81Å; E595-S599 VanDerWaalsContact O-OG 3.12Å; A596-S599 PolarHBondContact O-N 3.45Å; A596-S599 PolarHBondContact O-OG 3.18Å; F597-S599 PolarHBondContact O-N 2.84Å; S599-C602 PolarHBondContact O-N 3.32Å; S599-I603 WeakPolarHBondContact O-CD1 3.33Å; S599-I603 VanDerWaalsContact O-CG1 3.31Å; S599-I603 WeakPolarHBondContact O-CG1 3.43Å; S599-I603 PolarHBondContact O-N 2.87Å; S599-L963 WeakPolarHBondContact OG-CD1 3.25Å
600	L	86.1	Confident	84.5	Confident	1 Å²	1	22.9 Å²	22.9	1%	0.005	11%	0.11	C	C	.	.	H	α-helix	trans	-59.2	-52.1	176.2	-173.4	72.9	0	0	0	110.8	A596 F597 A598 C602 I603 I604 L963 L966 W967 F978	A596-L600 WeakPolarHBondContact O-CB 3.27Å; A596-L600 PolarHBondContact O-N 3.01Å; F597-L600 WeakPolarHBondContact O-CB 3.26Å; F597-L600 PolarHBondContact O-N 3.41Å; A598-L600 VanDerWaalsContact C-N 3.33Å; A598-L600 PolarHBondContact O-N 2.9Å; L600-C602 VanDerWaalsContact C-N 3.28Å; L600-C602 PolarHBondContact O-N 3.32Å; L600-I603 PolarHBondContact O-N 2.84Å; L600-I604 HydrophobicContact CD1-CD1 4.49Å; L600-I604 HydrophobicContact CD2-CD1 4.2Å; L600-I604 HydrophobicContact CG-CD1 3.76Å; L600-I604 HydrophobicContact CG-CG1 4.47Å; L600-I604 WeakPolarHBondContact O-CD1 3.43Å; L600-I604 WeakPolarHBondContact O-CG1 3.48Å; L600-I604 PolarHBondContact O-N 2.99Å; L600-L963 HydrophobicContact CB-CD1 3.57Å; L600-L963 HydrophobicContact CD1-CD1 3.81Å; L600-L963 HydrophobicContact CD1-CG 4.35Å; L600-L963 HydrophobicContact CG-CD1 4.26Å; L600-L966 HydrophobicContact CD1-CB 4.12Å; L600-L966 HydrophobicContact CD2-CB 3.83Å; L600-L966 HydrophobicContact CD2-CD1 3.99Å; L600-W967 HydrophobicContact CD1-CB 4.27Å; L600-W967 HydrophobicContact CD1-CE3 4.06Å; L600-F978 HydrophobicContact CD2-CE2 3.6Å; L600-F978 HydrophobicContact CD2-CZ 3.82Å
601	I	85.6	Confident	84.9	Confident	20 Å²	20	26.1 Å²	26.1	10%	0.103	12%	0.123	C	C	.	.	H	α-helix	trans	-61	-40.4	-179.6	-58.5	-61.4	0	0	0	110.7	F597 A598 I603 I604 F605 T847 V848	F597-I601 HydrophobicContact CD1-CG1 4.21Å; F597-I601 HydrophobicContact CE1-CD1 4.43Å; F597-I601 HydrophobicContact CE1-CG1 3.9Å; F597-I601 HydrophobicContact CE2-CD1 4.33Å; F597-I601 HydrophobicContact CE2-CG1 4.45Å; F597-I601 HydrophobicContact CZ-CD1 4.06Å; F597-I601 HydrophobicContact CZ-CG1 4.03Å; F597-I601 WeakPolarHBondContact O-CG1 3.48Å; F597-I601 PolarHBondContact O-N 2.91Å; A598-I601 PolarHBondContact O-N 3.49Å; I601-I603 PolarHBondContact O-N 2.92Å; I601-I604 HydrophobicContact CD1-CD1 4.05Å; I601-I604 WeakPolarHBondContact O-CB 3.31Å; I601-I604 PolarHBondContact O-N 2.67Å; I601-F605 HydrophobicContact CG2-CD2 3.86Å; I601-F605 HydrophobicContact CG2-CE2 3.92Å; I601-F605 WeakPolarHBondContact O-CD2 3.5Å; I601-F605 PolarHBondContact O-N 3.16Å; I601-T847 WeakPolarHBondContact CG2-OG1 3.41Å; I601-V848 HydrophobicContact CG2-CG2 3.69Å
602	C	85.4	Confident	85.1	Confident	1 Å²	1	27 Å²	27	1%	0.007	13%	0.127	C	C	.	.	H	α-helix	trans	-66.2	-39.7	178.6	-54.8	0	0	0	0	112.5	A598 S599 L600 I604 F605 I606 S918 L919	A598-C602 PolarHBondContact O-N 3.42Å; A598-C602 PolarHBondContact O-SG 3.19Å; S599-C602 PolarHBondContact O-N 3.32Å; L600-C602 VanDerWaalsContact C-N 3.28Å; L600-C602 PolarHBondContact O-N 3.32Å; C602-I604 VanDerWaalsContact C-N 3.34Å; C602-F605 PolarHBondContact O-N 3.26Å; C602-I606 WeakPolarHBondContact O-CG1 3.27Å; C602-I606 PolarHBondContact O-N 3.49Å; C602-S918 PolarHBondContact SG-OG 3.39Å; C602-L919 HydrophobicContact CB-CD1 3.27Å; C602-L919 HydrophobicContact CB-CG 4.17Å
603	I	87.4	Confident	85.2	Confident	63 Å²	63	27.7 Å²	27.7	32%	0.323	13%	0.131	S	C	.	.	H	α-helix	trans	-65.1	-39.2	174.6	-67.3	161	0	0	0	110.7	S599 L600 I601 F605 I606 Y607 L963 W967	S599-I603 WeakPolarHBondContact O-CD1 3.33Å; S599-I603 VanDerWaalsContact O-CG1 3.31Å; S599-I603 WeakPolarHBondContact O-CG1 3.43Å; S599-I603 PolarHBondContact O-N 2.87Å; L600-I603 PolarHBondContact O-N 2.84Å; I601-I603 PolarHBondContact O-N 2.92Å; I603-F605 VanDerWaalsContact C-N 3.33Å; I603-F605 PolarHBondContact O-N 3.36Å; I603-I606 PolarHBondContact O-N 3.05Å; I603-Y607 WeakPolarHBondContact O-CB 3.43Å; I603-Y607 PolarHBondContact O-N 3.48Å; I603-L963 HydrophobicContact CD1-CD2 3.85Å; I603-W967 HydrophobicContact CB-CZ3 4.28Å; I603-W967 HydrophobicContact CG2-CE3 4.12Å; I603-W967 HydrophobicContact CG2-CH2 4.1Å; I603-W967 HydrophobicContact CG2-CZ3 3.57Å
604	I	85.3	Confident	85.4	Confident	18 Å²	18	32 Å²	32	9%	0.092	15%	0.153	C	C	.	.	H	α-helix	trans	-59.8	-45.4	175	-67.7	156.6	0	0	0	110.4	L600 I601 C602 I606 Y607 E608 W967 K970	L600-I604 HydrophobicContact CD1-CD1 4.49Å; L600-I604 HydrophobicContact CD2-CD1 4.2Å; L600-I604 HydrophobicContact CG-CD1 3.76Å; L600-I604 HydrophobicContact CG-CG1 4.47Å; L600-I604 WeakPolarHBondContact O-CD1 3.43Å; L600-I604 WeakPolarHBondContact O-CG1 3.48Å; L600-I604 PolarHBondContact O-N 2.99Å; I601-I604 HydrophobicContact CD1-CD1 4.05Å; I601-I604 WeakPolarHBondContact O-CB 3.31Å; I601-I604 PolarHBondContact O-N 2.67Å; C602-I604 VanDerWaalsContact C-N 3.34Å; I604-I606 PolarHBondContact O-N 3Å; I604-Y607 PolarHBondContact O-N 3.49Å; I604-E608 WeakPolarHBondContact O-CB 3.4Å; I604-E608 PolarHBondContact O-N 3.03Å; I604-W967 HydrophobicContact CB-CZ3 4.28Å; I604-W967 HydrophobicContact CG1-CE3 4.1Å; I604-W967 HydrophobicContact CG1-CH2 4.35Å; I604-W967 HydrophobicContact CG1-CZ3 3.52Å; I604-K970 HydrophobicContact CD1-CD 3.29Å; I604-K970 HydrophobicContact CG1-CD 3.79Å
605	F	83.4	Confident	85.6	Confident	33 Å²	33	37.1 Å²	37.1	15%	0.145	18%	0.177	C	C	.	.	H	α-helix	trans	-63.5	-40.8	178.6	-96.2	-104.1	0	0	0	112.7	I601 C602 I603 A609 V848	I601-F605 HydrophobicContact CG2-CD2 3.86Å; I601-F605 HydrophobicContact CG2-CE2 3.92Å; I601-F605 WeakPolarHBondContact O-CD2 3.5Å; I601-F605 PolarHBondContact O-N 3.16Å; C602-F605 PolarHBondContact O-N 3.26Å; I603-F605 VanDerWaalsContact C-N 3.33Å; I603-F605 PolarHBondContact O-N 3.36Å; F605-A609 WeakPolarHBondContact O-CB 3.46Å; F605-A609 PolarHBondContact O-N 3.49Å; F605-V848 HydrophobicContact CD2-CG2 4.01Å; F605-V848 HydrophobicContact CE2-CB 4.46Å; F605-V848 HydrophobicContact CE2-CG2 4.14Å; F605-V848 HydrophobicContact CG-CG2 4.37Å; F605-V848 HydrophobicContact CZ-CB 4.47Å
606	I	89.3	Confident	85.5	Confident	35 Å²	35	37.6 Å²	37.6	18%	0.179	18%	0.18	C	C	.	.	H	α-helix	trans	-63.3	-45.9	175.4	-69.4	168.9	0	0	0	110.3	C602 I603 I604 A609 I610 L912 V916 L919	C602-I606 WeakPolarHBondContact O-CG1 3.27Å; C602-I606 PolarHBondContact O-N 3.49Å; I603-I606 PolarHBondContact O-N 3.05Å; I604-I606 PolarHBondContact O-N 3Å; I606-A609 PolarHBondContact O-N 3.12Å; I606-I610 HydrophobicContact CG2-CD1 4.06Å; I606-I610 WeakPolarHBondContact O-CG1 3.2Å; I606-I610 PolarHBondContact O-N 3.25Å; I606-L912 HydrophobicContact CB-CD1 4.42Å; I606-L912 HydrophobicContact CG1-CD1 4.32Å; I606-L912 HydrophobicContact CG2-CD1 3.86Å; I606-V916 HydrophobicContact CD1-CG2 3.92Å; I606-V916 HydrophobicContact CG1-CG2 4.29Å; I606-L919 HydrophobicContact CD1-CD1 3.71Å
607	Y	88.6	Confident	85.3	Confident	120 Å²	120	39.2 Å²	39.2	47%	0.471	19%	0.193	S	C	.	.	H	α-helix	trans	-61.6	-47.7	177.6	175	-96.8	0	0	0	111.8	I603 I604 A609 I610 E611 W967	I603-Y607 WeakPolarHBondContact O-CB 3.43Å; I603-Y607 PolarHBondContact O-N 3.48Å; I604-Y607 PolarHBondContact O-N 3.49Å; Y607-A609 VanDerWaalsContact C-N 3.3Å; Y607-A609 PolarHBondContact O-N 2.99Å; Y607-I610 PolarHBondContact O-N 3.33Å; Y607-I610 VanDerWaalsContact O-N 3.11Å; Y607-E611 HydrophobicContact CE1-CB 4.39Å; Y607-E611 VanDerWaalsContact CE1-OE2 3.25Å; Y607-E611 WeakPolarHBondContact CE1-OE2 3.44Å; Y607-E611 WeakPolarHBondContact O-CB 3.19Å; Y607-E611 PolarHBondContact O-N 2.85Å; Y607-W967 HydrophobicContact CD1-CH2 4.04Å; Y607-W967 HydrophobicContact CD1-CZ2 4.19Å; Y607-W967 HydrophobicContact CD2-CH2 4.26Å; Y607-W967 HydrophobicContact CD2-CZ2 4.06Å; Y607-W967 HydrophobicContact CE2-CZ2 4.5Å; Y607-W967 AromaticContact CG-CH2 3.7Å; Y607-W967 HydrophobicContact CG-CH2 3.7Å; Y607-W967 AromaticContact CG-CZ2 3.9Å; Y607-W967 HydrophobicContact CG-CZ2 3.9Å
608	E	82.1	Confident	85.3	Confident	37 Å²	37	45.9 Å²	45.9	17%	0.173	22%	0.224	C	C	.	.	H	α-helix	trans	-62.2	-36.7	179.8	-172.6	-179.4	161.1	0	0	111.8	I604 I610 K612	I604-E608 WeakPolarHBondContact O-CB 3.4Å; I604-E608 PolarHBondContact O-N 3.03Å; E608-I610 VanDerWaalsContact C-N 3.35Å; E608-K612 HydrophobicContact CG-CD 4.44Å; E608-K612 WeakPolarHBondContact O-CB 3.12Å; E608-K612 WeakPolarHBondContact O-CG 3.45Å; E608-K612 PolarHBondContact O-N 3.05Å; E608-K612 VanDerWaalsContact OE1-CE 3.28Å; E608-K612 WeakPolarHBondContact OE1-CE 3.42Å; E608-K612 IonicContact OE1-NZ 3.23Å; E608-K612 PolarHBondContact OE1-NZ 3.02Å
609	A	85.6	Confident	85	Confident	1 Å²	1	49 Å²	49	1%	0.008	24%	0.243	C	C	.	.	H	α-helix	trans	-64.3	-39.4	175.1	0	0	0	0	0	112.2	F605 I606 Y607 L613 F911 L912	F605-A609 WeakPolarHBondContact O-CB 3.46Å; F605-A609 PolarHBondContact O-N 3.49Å; I606-A609 PolarHBondContact O-N 3.12Å; Y607-A609 VanDerWaalsContact C-N 3.3Å; Y607-A609 PolarHBondContact O-N 2.99Å; A609-L613 PolarHBondContact O-N 3.35Å; A609-F911 HydrophobicContact CB-CB 4.13Å; A609-L912 HydrophobicContact CB-CB 4.34Å
610	I	89.8	Confident	84.7	Confident	74 Å²	74	52.1 Å²	52.1	38%	0.379	25%	0.254	S	S	.	.	H	α-helix	trans	-73.8	-42.4	177.2	-65.3	168.8	0	0	0	110.7	I606 Y607 E608 K612 L613 I614	I606-I610 HydrophobicContact CG2-CD1 4.06Å; I606-I610 WeakPolarHBondContact O-CG1 3.2Å; I606-I610 PolarHBondContact O-N 3.25Å; Y607-I610 PolarHBondContact O-N 3.33Å; Y607-I610 VanDerWaalsContact O-N 3.11Å; E608-I610 VanDerWaalsContact C-N 3.35Å; I610-K612 VanDerWaalsContact C-N 3.33Å; I610-K612 PolarHBondContact O-N 3.32Å; I610-L613 WeakPolarHBondContact O-CB 3.33Å; I610-L613 PolarHBondContact O-N 3.49Å; I610-L613 VanDerWaalsContact O-N 3.08Å; I610-I614 HydrophobicContact CG2-CD1 3.88Å; I610-I614 HydrophobicContact CG2-CG1 4.4Å; I610-I614 WeakPolarHBondContact O-CG1 3.35Å; I610-I614 PolarHBondContact O-N 2.83Å
611	E	86.3	Confident	84.3	Confident	98 Å²	98	55.4 Å²	55.4	46%	0.458	28%	0.276	S	S	.	.	H	α-helix	trans	-58.6	-43.9	177.4	-175.4	-178.4	-170.5	0	0	111.2	Y607 L613 I614 H615	Y607-E611 HydrophobicContact CE1-CB 4.39Å; Y607-E611 VanDerWaalsContact CE1-OE2 3.25Å; Y607-E611 WeakPolarHBondContact CE1-OE2 3.44Å; Y607-E611 WeakPolarHBondContact O-CB 3.19Å; Y607-E611 PolarHBondContact O-N 2.85Å; E611-L613 VanDerWaalsContact C-N 3.29Å; E611-L613 PolarHBondContact O-N 3.09Å; E611-I614 PolarHBondContact O-N 3.41Å; E611-I614 VanDerWaalsContact O-N 3.16Å; E611-H615 WeakPolarHBondContact O-CB 3.43Å; E611-H615 PolarHBondContact O-N 3.46Å
612	K	82.3	Confident	83.7	Confident	30 Å²	30	58.2 Å²	58.2	13%	0.13	29%	0.29	C	S	.	.	H	α-helix	trans	-64.2	-32.2	175.3	-73.5	178.9	-175.7	166.5	0	113.2	E608 I610 L616 Y908	E608-K612 HydrophobicContact CG-CD 4.44Å; E608-K612 WeakPolarHBondContact O-CB 3.12Å; E608-K612 WeakPolarHBondContact O-CG 3.45Å; E608-K612 PolarHBondContact O-N 3.05Å; E608-K612 VanDerWaalsContact OE1-CE 3.28Å; E608-K612 WeakPolarHBondContact OE1-CE 3.42Å; E608-K612 IonicContact OE1-NZ 3.23Å; E608-K612 PolarHBondContact OE1-NZ 3.02Å; I610-K612 VanDerWaalsContact C-N 3.33Å; I610-K612 PolarHBondContact O-N 3.32Å; K612-L616 PolarHBondContact O-N 3.08Å; K612-L616 VanDerWaalsContact O-N 3.15Å; K612-Y908 HydrophobicContact CB-CD1 4.48Å; K612-Y908 HydrophobicContact CB-CD2 4.13Å; K612-Y908 HydrophobicContact CB-CE1 4.19Å; K612-Y908 HydrophobicContact CB-CE2 3.8Å; K612-Y908 HydrophobicContact CB-CG 4.47Å; K612-Y908 HydrophobicContact CD-CD1 4.15Å; K612-Y908 HydrophobicContact CD-CE1 3.59Å; K612-Y908 HydrophobicContact CG-CE1 4.47Å
613	L	86.2	Confident	82.8	Confident	18 Å²	18	61.1 Å²	61.1	9%	0.094	30%	0.304	C	S	.	.	H	α-helix	trans	-70	-40.1	173.1	-176.3	67.5	0	0	0	111.2	A609 I610 E611 L616 A617 F702	A609-L613 PolarHBondContact O-N 3.35Å; I610-L613 WeakPolarHBondContact O-CB 3.33Å; I610-L613 PolarHBondContact O-N 3.49Å; I610-L613 VanDerWaalsContact O-N 3.08Å; E611-L613 VanDerWaalsContact C-N 3.29Å; E611-L613 PolarHBondContact O-N 3.09Å; L613-L616 WeakPolarHBondContact O-CB 3.41Å; L613-L616 PolarHBondContact O-N 3.48Å; L613-A617 PolarHBondContact O-N 3.47Å; L613-A617 VanDerWaalsContact O-N 3.08Å; L613-F702 HydrophobicContact CD1-CB 4.37Å; L613-F702 HydrophobicContact CD1-CG 4.39Å; L613-F702 HydrophobicContact CD2-CD1 3.75Å; L613-F702 HydrophobicContact CD2-CE1 3.9Å; L613-F702 HydrophobicContact CD2-CG 4.12Å; L613-F702 HydrophobicContact CD2-CZ 4.38Å
614	I	87.6	Confident	81.8	Confident	92 Å²	92	66 Å²	66	47%	0.472	33%	0.327	S	S	.	.	H	α-helix	trans	-66	-44.2	176.1	-65.6	167.2	0	0	0	110.6	I610 E611 L616 A617 E618	I610-I614 HydrophobicContact CG2-CD1 3.88Å; I610-I614 HydrophobicContact CG2-CG1 4.4Å; I610-I614 WeakPolarHBondContact O-CG1 3.35Å; I610-I614 PolarHBondContact O-N 2.83Å; E611-I614 PolarHBondContact O-N 3.41Å; E611-I614 VanDerWaalsContact O-N 3.16Å; I614-L616 PolarHBondContact O-N 3.43Å; I614-A617 WeakPolarHBondContact O-CA 3.42Å; I614-A617 VanDerWaalsContact O-CB 3.23Å; I614-A617 WeakPolarHBondContact O-CB 3.39Å; I614-A617 PolarHBondContact O-N 3.22Å; I614-E618 PolarHBondContact O-N 2.95Å
615	H	83.4	Confident	80.5	Confident	119 Å²	119	72.7 Å²	72.7	55%	0.551	36%	0.358	S	S	*	.	H	α-helix	trans	-58.5	-35.8	174.7	-174.6	-76.9	0	0	0	111.7	E611 A617 E618 T619	E611-H615 WeakPolarHBondContact O-CB 3.43Å; E611-H615 PolarHBondContact O-N 3.46Å; H615-A617 VanDerWaalsContact C-N 3.33Å; H615-E618 PolarHBondContact O-N 3.15Å; H615-T619 PolarHBondContact O-N 3.08Å; H615-T619 PolarHBondContact O-OG1 2.98Å
616	L	82.6	Confident	79.1	Confident	14 Å²	14	74.8 Å²	74.8	7%	0.073	38%	0.376	C	S	.	.	H	α-helix	trans	-67.2	-34.5	174	-169.9	66.4	0	0	0	112.3	K612 L613 I614 E618 T619 Y620 P753 P905	K612-L616 PolarHBondContact O-N 3.08Å; K612-L616 VanDerWaalsContact O-N 3.15Å; L613-L616 WeakPolarHBondContact O-CB 3.41Å; L613-L616 PolarHBondContact O-N 3.48Å; I614-L616 PolarHBondContact O-N 3.43Å; L616-E618 VanDerWaalsContact C-N 3.33Å; L616-T619 PolarHBondContact O-N 3.29Å; L616-Y620 HydrophobicContact CD1-CD2 3.44Å; L616-Y620 VanDerWaalsContact CD1-CD2 3.44Å; L616-Y620 HydrophobicContact CD1-CE2 3.45Å; L616-Y620 VanDerWaalsContact CD1-CE2 3.45Å; L616-Y620 HydrophobicContact CG-CD2 4.07Å; L616-Y620 PolarHBondContact O-N 3.04Å; L616-P753 HydrophobicContact CD1-CB 4.39Å; L616-P753 HydrophobicContact CD1-CG 3.79Å; L616-P753 HydrophobicContact CD2-CG 4.03Å; L616-P905 HydrophobicContact CD2-CG 4.04Å
617	A	81.9	Confident	77.6	Confident	34 Å²	34	80.5 Å²	80.5	28%	0.281	40%	0.402	S	S	.	.	H	α-helix	trans	-66.3	-33.3	173.3	0	0	0	0	0	113	L613 I614 H615 Y620 P621 L695	L613-A617 PolarHBondContact O-N 3.47Å; L613-A617 VanDerWaalsContact O-N 3.08Å; I614-A617 WeakPolarHBondContact O-CA 3.42Å; I614-A617 VanDerWaalsContact O-CB 3.23Å; I614-A617 WeakPolarHBondContact O-CB 3.39Å; I614-A617 PolarHBondContact O-N 3.22Å; H615-A617 VanDerWaalsContact C-N 3.33Å; A617-Y620 CarbonylContact O-C 3.54Å; A617-P621 WeakPolarHBondContact O-CA 3.42Å; A617-L695 VanDerWaalsContact CA-CD1 3.49Å; A617-L695 HydrophobicContact CB-CD1 3.72Å; A617-L695 HydrophobicContact CB-CD2 3.74Å; A617-L695 HydrophobicContact CB-CG 4.39Å
618	E	82.4	Confident	76.1	Confident	144 Å²	144	81.8 Å²	81.8	67%	0.673	42%	0.416	S	S	*	.	H	α-helix	trans	-73.8	-37.5	173.4	-67.2	178.9	178.4	0	0	111.9	I614 H615 L616	I614-E618 PolarHBondContact O-N 2.95Å; H615-E618 PolarHBondContact O-N 3.15Å; L616-E618 VanDerWaalsContact C-N 3.33Å
619	T	77.6	Confident	74.9	Confident	74 Å²	74	87.7 Å²	87.7	45%	0.454	45%	0.449	S	S	.	.	H	α-helix	trans	-69	-37.9	178.6	-50.6	0	0	0	0	111.8	H615 L616 P621	H615-T619 PolarHBondContact O-N 3.08Å; H615-T619 PolarHBondContact O-OG1 2.98Å; L616-T619 PolarHBondContact O-N 3.29Å; T619-P621 WeakPolarHBondContact O-CD 3.46Å
620	Y	80.4	Confident	73.5	Confident	69 Å²	69	93.2 Å²	93.2	27%	0.271	48%	0.475	S	S	.	.	S	Bend	trans	-120.8	77.7	178.6	-59.5	-76.8	0	0	0	109.9	L616 A617 T691 V694	L616-Y620 HydrophobicContact CD1-CD2 3.44Å; L616-Y620 VanDerWaalsContact CD1-CD2 3.44Å; L616-Y620 HydrophobicContact CD1-CE2 3.45Å; L616-Y620 VanDerWaalsContact CD1-CE2 3.45Å; L616-Y620 HydrophobicContact CG-CD2 4.07Å; L616-Y620 PolarHBondContact O-N 3.04Å; A617-Y620 CarbonylContact O-C 3.54Å; Y620-T691 WeakPolarHBondContact CD1-OG1 3.43Å; Y620-V694 HydrophobicContact CD1-CB 4.46Å; Y620-V694 HydrophobicContact CD1-CG1 4.22Å; Y620-V694 HydrophobicContact CD2-CG1 4.19Å; Y620-V694 HydrophobicContact CE1-CG1 4.44Å; Y620-V694 HydrophobicContact CE2-CG1 4.42Å; Y620-V694 HydrophobicContact CG-CB 4.46Å; Y620-V694 HydrophobicContact CG-CG1 4.08Å
621	P	77.1	Confident	71.5	Confident	70 Å²	70	97.2 Å²	97.2	46%	0.455	50%	0.496	S	S	.	.			trans	-62.6	165.2	-175.9	24.7	-33.5	0	0	0	112.3	A617 T619 Y690	A617-P621 WeakPolarHBondContact O-CA 3.42Å; T619-P621 WeakPolarHBondContact O-CD 3.46Å; P621-Y690 WeakPolarHBondContact O-CE2 3.35Å; P621-Y690 VanDerWaalsContact O-CZ 3.27Å; P621-Y690 PolarHBondContact O-OH 3.42Å
622	I	72.2	Confident	69.7	Low	78 Å²	78	97.6 Å²	97.6	40%	0.4	51%	0.509	S	S	.	.			trans	-95.1	130.4	171	-62.4	163.3	0	0	0	109.5	M624 Y690 L695 F696	I622-M624 PolarHBondContact O-N 3.44Å; I622-Y690 VanDerWaalsContact CA-OH 3.24Å; I622-Y690 WeakPolarHBondContact CA-OH 3.48Å; I622-L695 HydrophobicContact CD1-CD2 3.77Å; I622-L695 HydrophobicContact CG1-CD2 3.77Å; I622-F696 HydrophobicContact CD1-CE1 3.95Å; I622-F696 HydrophobicContact CD1-CE2 4.02Å; I622-F696 HydrophobicContact CD1-CZ 3.51Å; I622-F696 HydrophobicContact CG1-CE2 4.1Å; I622-F696 HydrophobicContact CG1-CZ 4.1Å; I622-F696 HydrophobicContact CG2-CE2 4.22Å; I622-F696 HydrophobicContact CG2-CZ 4.27Å
623	H	67.1	Low	68.3	Low	63 Å²	63	100.4 Å²	100.4	29%	0.292	53%	0.525	S	S	.	.			trans	-77.5	102.4	172.3	-164.3	73.7	0	0	0	109.1	H625 S682 Y690	H623-H625 VanDerWaalsContact C-N 3.3Å; H623-H625 PolarHBondContact NE2-O 3.05Å; H623-H625 PolarHBondContact O-N 3.36Å; H623-S682 PolarHBondContact CE1-O 3.39Å; H623-Y690 HydrophobicContact CB-CD1 4.32Å; H623-Y690 HydrophobicContact CB-CD2 4.19Å; H623-Y690 HydrophobicContact CB-CE1 3.83Å; H623-Y690 HydrophobicContact CB-CE2 3.68Å; H623-Y690 VanDerWaalsContact N-CE2 3.26Å; H623-Y690 PolarHBondContact N-OH 2.97Å
624	M	65.9	Low	67.1	Low	165 Å²	165	105.8 Å²	105.8	81%	0.813	55%	0.545	S	S	*	.			trans	-83.5	0.7	-178.2	-63.2	-152.3	76.2	0	0	113.9	I622	I622-M624 PolarHBondContact O-N 3.44Å
625	H	59.2	Low	66.2	Low	159 Å²	159	106.7 Å²	106.7	74%	0.736	54%	0.544	S	S	*	.			trans	-113.3	57.6	-172.5	-68	15.7	0	0	0	111.9	H623 Q627	H623-H625 VanDerWaalsContact C-N 3.3Å; H623-H625 PolarHBondContact NE2-O 3.05Å; H623-H625 PolarHBondContact O-N 3.36Å; H625-Q627 PolarHBondContact O-N 2.99Å
626	S	53.8	Low	65.8	Low	77 Å²	77	102.8 Å²	102.8	54%	0.538	53%	0.529	S	S	.	.			trans	-86.8	94	172.7	65.9	0	0	0	0	110.9	L628	S626-L628 PolarHBondContact O-N 3.47Å
627	Q	56.7	Low	65.5	Low	154 Å²	154	109.3 Å²	109.3	72%	0.72	55%	0.553	S	S	*	*			trans	-79.6	106.4	160.9	-79.4	-177.4	-44.5	0	0	108.6	H625 D629 H630	H625-Q627 PolarHBondContact O-N 2.99Å; Q627-D629 PolarHBondContact O-N 2.93Å; Q627-D629 VanDerWaalsContact O-N 3.15Å; Q627-H630 PolarHBondContact O-N 2.94Å
628	L	57	Low	65.5	Low	147 Å²	147	108.2 Å²	108.2	77%	0.77	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-22.5	-175.7	-131.1	72.7	0	0	0	113.4	S626	S626-L628 PolarHBondContact O-N 3.47Å
629	D	57.1	Low	65.4	Low	161 Å²	161	103.1 Å²	103.1	86%	0.861	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-14.1	-178.2	-71.5	-24.8	0	0	0	114.4	Q627	Q627-D629 PolarHBondContact O-N 2.93Å; Q627-D629 VanDerWaalsContact O-N 3.15Å
630	H	56	Low	65.6	Low	118 Å²	118	103.2 Å²	103.2	55%	0.546	52%	0.519	S	S	.	.			trans	-106.8	62.5	178.6	-88.5	-156.3	0	0	0	111.4	Q627 S632	Q627-H630 PolarHBondContact O-N 2.94Å; H630-S632 PolarHBondContact O-N 2.89Å
631	L	49.4	Very low	65.5	Low	157 Å²	157	100.5 Å²	100.5	82%	0.822	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-8.5	-176.9	-145.5	74.5	0	0	0	114.7
632	S	47.3	Very low	65.2	Low	106 Å²	106	104.6 Å²	104.6	74%	0.741	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.4	7.4	-167	56.8	0	0	0	0	116.6	H630	H630-S632 PolarHBondContact O-N 2.89Å
633	L	53.8	Low	65.3	Low	90 Å²	90	107.8 Å²	107.8	47%	0.471	54%	0.541	S	S	.	.			trans	-131.2	45.1	-178.3	-68.8	166.9	0	0	0	113.1	Y635 S682	L633-Y635 HydrophobicContact CD2-CD1 4.31Å; L633-Y635 HydrophobicContact CD2-CE1 3.73Å; L633-S682 PolarHBondContact O-OG 3.41Å
634	Y	60	Low	65.7	Low	131 Å²	131	107.1 Å²	107.1	51%	0.514	54%	0.542	S	S	.	.			trans	-96.1	91.6	160.6	-83.7	-88.4	0	0	0	108.8	A683	Y634-A683 HydrophobicContact CD1-CB 4.1Å
635	Y	68.3	Low	66.3	Low	111 Å²	111	105.1 Å²	105.1	44%	0.435	54%	0.535	S	S	.	.			trans	-138.8	147.6	170.1	69.3	-88	0	0	0	110.2	L633 R637 G681	L633-Y635 HydrophobicContact CD2-CD1 4.31Å; L633-Y635 HydrophobicContact CD2-CE1 3.73Å; Y635-R637 HydrophobicContact CD2-CG 4.07Å; Y635-G681 VanDerWaalsContact O-CA 3.3Å; Y635-G681 WeakPolarHBondContact O-CA 3.42Å
636	C	76.1	Confident	67.2	Low	36 Å²	36	103.9 Å²	103.9	24%	0.243	53%	0.533	C	S	.	.			trans	-128.2	119.3	166.7	-174.8	0	0	0	0	107.3	A683 C684 P689	C636-A683 HydrophobicContact CB-CB 4.46Å; C636-C684 WeakPolarHBondContact CA-SG 3.48Å; C636-C684 HydrophobicContact CB-CB 4.15Å; C636-C684 WeakPolarHBondContact CB-SG 3.49Å; C636-C684 VanDerWaalsContact SG-CA 3.51Å; C636-C684 WeakPolarHBondContact SG-CB 3.1Å; C636-C684 CovalentContact SG-SG 2.02Å; C636-C684 PolarHBondContact SG-SG 2.9Å; C636-P689 HydrophobicContact CB-CB 3.91Å
637	R	76.6	Confident	68.2	Low	152 Å²	152	106.3 Å²	106.3	57%	0.574	54%	0.536	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.8	141.4	179.9	-75.3	-179.5	176.4	168.7	0.3	109.7	Y635 M680	Y635-R637 HydrophobicContact CD2-CG 4.07Å; R637-M680 PolarHBondContact N-O 2.99Å; R637-M680 PolarHBondContact O-N 3.43Å
638	C	82	Confident	69.2	Low	11 Å²	11	99.9 Å²	99.9	7%	0.074	51%	0.507	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	132.1	167.3	-174	0	0	0	0	109	W664 C672	C638-W664 WeakPolarHBondContact O-CB 3.23Å; C638-C672 HydrophobicContact CB-CB 3.68Å; C638-C672 WeakPolarHBondContact CB-SG 3.34Å; C638-C672 WeakPolarHBondContact SG-CB 3.42Å; C638-C672 CovalentContact SG-SG 2.01Å; C638-C672 PolarHBondContact SG-SG 3.37Å
639	T	80.2	Confident	70.1	Confident	37 Å²	37	96.9 Å²	96.9	23%	0.227	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	157.8	179.2	47.2	0	0	0	0	110.6	E678 M680	T639-E678 PolarHBondContact N-O 2.95Å; T639-E678 PolarHBondContact O-N 3.21Å; T639-E678 PolarHBondContact OG1-O 3.08Å; T639-M680 HydrophobicContact CG2-CB 4.44Å; T639-M680 HydrophobicContact CG2-CE 4.03Å; T639-M680 WeakPolarHBondContact OG1-CE 3.25Å; T639-M680 WeakPolarHBondContact OG1-CG 3.41Å
640	L	80.7	Confident	71.1	Confident	76 Å²	76	95.1 Å²	95.1	40%	0.398	48%	0.478	S	S	.	.			trans	-61.1	134.4	172.6	-174.6	77.5	0	0	0	109.7	E642 W652 T659 W664	L640-E642 PolarHBondContact O-N 3.45Å; L640-W652 HydrophobicContact CD1-CH2 3.67Å; L640-W652 HydrophobicContact CD1-CZ2 4.37Å; L640-W652 HydrophobicContact CD1-CZ3 4.22Å; L640-T659 HydrophobicContact CD1-CG2 4.1Å; L640-W664 HydrophobicContact CB-CZ2 4.28Å; L640-W664 HydrophobicContact CD1-CH2 3.89Å; L640-W664 HydrophobicContact CD1-CZ2 3.34Å; L640-W664 HydrophobicContact CG-CZ2 4.43Å
641	P	78.5	Confident	72.1	Confident	12 Å²	12	92.3 Å²	92.3	8%	0.078	46%	0.463	C	S	.	.			trans	-60.4	133.9	174.1	-17.2	28.2	0	0	0	111	N643 W652 H676 E678	P641-N643 VanDerWaalsContact C-N 3.25Å; P641-N643 PolarHBondContact O-N 3.32Å; P641-W652 HydrophobicContact CG-CH2 4.47Å; P641-H676 WeakPolarHBondContact CG-O 3.36Å; P641-E678 HydrophobicContact CB-CG 4Å; P641-E678 HydrophobicContact CG-CG 4.16Å
642	E	72	Confident	73.7	Confident	156 Å²	156	85.8 Å²	85.8	73%	0.729	43%	0.427	S	S	*	.	S	Bend	trans	-66.9	-27.8	178.6	-72	-172.3	165.4	0	0	112.2	L640	L640-E642 PolarHBondContact O-N 3.45Å
643	N	74.3	Confident	75.1	Confident	144 Å²	144	88.5 Å²	88.5	77%	0.77	43%	0.426	S	S	*	.	S	Bend	trans	-133.1	90.8	177.1	-67.4	-61.7	0	0	0	111.6	P641	P641-N643 VanDerWaalsContact C-N 3.25Å; P641-N643 PolarHBondContact O-N 3.32Å
644	P	74.8	Confident	76.3	Confident	49 Å²	49	90.5 Å²	90.5	32%	0.318	44%	0.437	S	S	.	.			trans	-70.5	134.4	179.9	27.5	-33.3	0	0	0	111.7	L649 W652	P644-L649 HydrophobicContact CB-CD1 4.38Å; P644-L649 HydrophobicContact CB-CG 4.18Å; P644-L649 HydrophobicContact CG-CD1 4.13Å; P644-L649 HydrophobicContact CG-CG 4.21Å; P644-W652 HydrophobicContact CB-CH2 4.24Å; P644-W652 HydrophobicContact CB-CZ3 4.06Å
645	N	78.4	Confident	77.1	Confident	124 Å²	124	89.4 Å²	89.4	66%	0.663	44%	0.436	S	S	*	.			trans	-68.7	151.7	176.7	-130.4	1.9	0	0	0	110.4	H647 T648 L649	N645-H647 PolarHBondContact O-N 3.4Å; N645-H647 VanDerWaalsContact O-N 3.08Å; N645-T648 WeakPolarHBondContact CB-OG1 3.48Å; N645-T648 PolarHBondContact N-OG1 2.97Å; N645-T648 WeakPolarHBondContact O-CA 3.48Å; N645-T648 WeakPolarHBondContact O-CB 3.19Å; N645-T648 PolarHBondContact O-N 2.7Å; N645-T648 PolarHBondContact O-OG1 3.07Å; N645-L649 PolarHBondContact O-N 2.97Å; N645-L649 VanDerWaalsContact O-N 3.09Å
646	N	79.4	Confident	77.6	Confident	132 Å²	132	90.9 Å²	90.9	71%	0.706	45%	0.452	S	S	*	.	H	α-helix	trans	-55.3	-31.8	179.6	-85.2	-13.2	0	0	0	113.1	Q650	N646-Q650 PolarHBondContact O-N 2.89Å; N646-Q650 VanDerWaalsContact O-N 3.14Å
647	H	74.7	Confident	77.5	Confident	129 Å²	129	90.9 Å²	90.9	60%	0.597	45%	0.449	S	S	*	.	H	α-helix	trans	-68.8	-37.8	175.1	-170.8	-88.1	0	0	0	112.6	N645 Q650 Y651	N645-H647 PolarHBondContact O-N 3.4Å; N645-H647 VanDerWaalsContact O-N 3.08Å; H647-Q650 PolarHBondContact O-N 3.45Å; H647-Y651 WeakPolarHBondContact O-CB 3.38Å; H647-Y651 PolarHBondContact O-N 3.17Å
648	T	77.3	Confident	77.4	Confident	18 Å²	18	87.4 Å²	87.4	11%	0.11	45%	0.445	C	S	.	.	H	α-helix	trans	-69.2	-40.3	178.4	-30.8	0	0	0	0	111.3	N645 Y651 W652 H676	N645-T648 WeakPolarHBondContact CB-OG1 3.48Å; N645-T648 PolarHBondContact N-OG1 2.97Å; N645-T648 WeakPolarHBondContact O-CA 3.48Å; N645-T648 WeakPolarHBondContact O-CB 3.19Å; N645-T648 PolarHBondContact O-N 2.7Å; N645-T648 PolarHBondContact O-OG1 3.07Å; T648-Y651 PolarHBondContact O-N 3.14Å; T648-W652 HydrophobicContact CG2-CH2 4.49Å; T648-W652 HydrophobicContact CG2-CZ2 3.96Å; T648-W652 PolarHBondContact O-N 3.34Å; T648-H676 HydrophobicContact CG2-CB 3.32Å
649	L	75.9	Confident	76.8	Confident	84 Å²	84	89.5 Å²	89.5	44%	0.44	46%	0.457	S	S	.	.	H	α-helix	trans	-63.7	-39.2	173.6	-82.9	156.3	0	0	0	112.4	P644 N645 K653	P644-L649 HydrophobicContact CB-CD1 4.38Å; P644-L649 HydrophobicContact CB-CG 4.18Å; P644-L649 HydrophobicContact CG-CD1 4.13Å; P644-L649 HydrophobicContact CG-CG 4.21Å; N645-L649 PolarHBondContact O-N 2.97Å; N645-L649 VanDerWaalsContact O-N 3.09Å; L649-K653 VanDerWaalsContact O-CB 3.32Å; L649-K653 WeakPolarHBondContact O-CB 3.48Å; L649-K653 PolarHBondContact O-N 3.32Å; L649-K653 VanDerWaalsContact O-N 3.15Å
650	Q	76.6	Confident	76.1	Confident	124 Å²	124	92.3 Å²	92.3	58%	0.579	48%	0.484	S	S	*	.	H	α-helix	trans	-64.6	-44.6	172.8	-81	178.7	-27.9	0	0	111.6	N646 H647 W652 K653 D654	N646-Q650 PolarHBondContact O-N 2.89Å; N646-Q650 VanDerWaalsContact O-N 3.14Å; H647-Q650 PolarHBondContact O-N 3.45Å; Q650-W652 PolarHBondContact O-N 2.91Å; Q650-K653 WeakPolarHBondContact O-CB 3.38Å; Q650-K653 PolarHBondContact O-N 2.92Å; Q650-D654 PolarHBondContact O-N 3.11Å
651	Y	78.6	Confident	75.4	Confident	59 Å²	59	96 Å²	96	23%	0.231	50%	0.499	C	S	.	.	H	α-helix	trans	-60.2	-46.1	178.3	-179.7	-98.2	0	0	0	113	H647 T648 K653 D654 H655 I657 H676	H647-Y651 WeakPolarHBondContact O-CB 3.38Å; H647-Y651 PolarHBondContact O-N 3.17Å; T648-Y651 PolarHBondContact O-N 3.14Å; Y651-K653 VanDerWaalsContact C-N 3.28Å; Y651-K653 PolarHBondContact O-N 3.34Å; Y651-D654 PolarHBondContact O-N 3.01Å; Y651-H655 AromaticContact CD2-CE1 3.6Å; Y651-H655 AromaticContact CD2-ND1 3.64Å; Y651-H655 AromaticContact CE2-CE1 3.23Å; Y651-H655 WeakPolarHBondContact CE2-CE1 3.23Å; Y651-H655 AromaticContact CE2-ND1 3.54Å; Y651-H655 AromaticContact CZ-CE1 3.81Å; Y651-H655 AromaticContact CZ-ND1 3.86Å; Y651-H655 PolarHBondContact O-N 3Å; Y651-H655 VanDerWaalsContact O-N 3.08Å; Y651-H655 PolarHBondContact O-ND1 3.49Å; Y651-I657 HydrophobicContact CE1-CD1 4.39Å; Y651-H676 AromaticContact CD1-CD2 3.7Å; Y651-H676 AromaticContact CE1-CD2 4Å
652	W	81.6	Confident	75.2	Confident	20 Å²	20	96.9 Å²	96.9	8%	0.076	50%	0.504	C	S	.	.	H	α-helix	trans	-65.2	-32.8	176.6	-66.8	-20.4	0	0	0	112.6	L640 P641 P644 T648 Q650 N656 I657 T659 W664 M675	L640-W652 HydrophobicContact CD1-CH2 3.67Å; L640-W652 HydrophobicContact CD1-CZ2 4.37Å; L640-W652 HydrophobicContact CD1-CZ3 4.22Å; P641-W652 HydrophobicContact CG-CH2 4.47Å; P644-W652 HydrophobicContact CB-CH2 4.24Å; P644-W652 HydrophobicContact CB-CZ3 4.06Å; T648-W652 HydrophobicContact CG2-CH2 4.49Å; T648-W652 HydrophobicContact CG2-CZ2 3.96Å; T648-W652 PolarHBondContact O-N 3.34Å; Q650-W652 PolarHBondContact O-N 2.91Å; W652-N656 PolarHBondContact O-N 3.35Å; W652-N656 VanDerWaalsContact O-N 3.15Å; W652-I657 HydrophobicContact CB-CB 4.32Å; W652-I657 PolarHBondContact O-N 2.87Å; W652-T659 HydrophobicContact CD2-CG2 4.2Å; W652-T659 HydrophobicContact CE3-CG2 3.71Å; W652-T659 HydrophobicContact CH2-CG2 4.33Å; W652-T659 HydrophobicContact CZ3-CG2 3.79Å; W652-W664 HydrophobicContact CZ2-CH2 4.35Å; W652-M675 PolarHBondContact NE1-O 3.4Å
653	K	78.4	Confident	75.4	Confident	163 Å²	163	96.5 Å²	96.5	71%	0.709	50%	0.502	S	S	*	.	H	α-helix	trans	-71.9	-40.8	176.3	-167.7	178.3	-178	-178.6	0	112.3	L649 Q650 Y651 H655 N656	L649-K653 VanDerWaalsContact O-CB 3.32Å; L649-K653 WeakPolarHBondContact O-CB 3.48Å; L649-K653 PolarHBondContact O-N 3.32Å; L649-K653 VanDerWaalsContact O-N 3.15Å; Q650-K653 WeakPolarHBondContact O-CB 3.38Å; Q650-K653 PolarHBondContact O-N 2.92Å; Y651-K653 VanDerWaalsContact C-N 3.28Å; Y651-K653 PolarHBondContact O-N 3.34Å; K653-H655 VanDerWaalsContact C-N 3.32Å; K653-N656 PolarHBondContact O-N 2.92Å
654	D	79	Confident	75.5	Confident	133 Å²	133	91.4 Å²	91.4	71%	0.711	47%	0.472	S	S	*	.	H	α-helix	trans	-68.2	-31.7	177.7	-76.3	-9.9	0	0	0	112.1	Q650 Y651	Q650-D654 PolarHBondContact O-N 3.11Å; Y651-D654 PolarHBondContact O-N 3.01Å
655	H	75.1	Confident	75.2	Confident	107 Å²	107	92.6 Å²	92.6	50%	0.495	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	5.7	178.5	-67	82.7	0	0	0	114.4	Y651 K653 I657	Y651-H655 AromaticContact CD2-CE1 3.6Å; Y651-H655 AromaticContact CD2-ND1 3.64Å; Y651-H655 AromaticContact CE2-CE1 3.23Å; Y651-H655 WeakPolarHBondContact CE2-CE1 3.23Å; Y651-H655 AromaticContact CE2-ND1 3.54Å; Y651-H655 AromaticContact CZ-CE1 3.81Å; Y651-H655 AromaticContact CZ-ND1 3.86Å; Y651-H655 PolarHBondContact O-N 3Å; Y651-H655 VanDerWaalsContact O-N 3.08Å; Y651-H655 PolarHBondContact O-ND1 3.49Å; K653-H655 VanDerWaalsContact C-N 3.32Å; H655-I657 VanDerWaalsContact C-N 3.27Å; H655-I657 HydrophobicContact CB-CD1 3.74Å; H655-I657 HydrophobicContact CB-CG1 3.9Å; H655-I657 PolarHBondContact O-N 3.48Å
656	N	78.9	Confident	75.2	Confident	143 Å²	143	93.5 Å²	93.5	77%	0.765	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	40	-177	-70.3	-40.9	0	0	0	114.2	W652 K653 V658	W652-N656 PolarHBondContact O-N 3.35Å; W652-N656 VanDerWaalsContact O-N 3.15Å; K653-N656 PolarHBondContact O-N 2.92Å; N656-V658 PolarHBondContact O-N 3.5Å
657	I	74.1	Confident	75	Confident	36 Å²	36	89.2 Å²	89.2	19%	0.185	47%	0.468	C	S	.	.			trans	-83.4	118.2	-178.5	-64.5	165.3	0	0	0	109.7	Y651 W652 H655 V662 M675	Y651-I657 HydrophobicContact CE1-CD1 4.39Å; W652-I657 HydrophobicContact CB-CB 4.32Å; W652-I657 PolarHBondContact O-N 2.87Å; H655-I657 VanDerWaalsContact C-N 3.27Å; H655-I657 HydrophobicContact CB-CD1 3.74Å; H655-I657 HydrophobicContact CB-CG1 3.9Å; H655-I657 PolarHBondContact O-N 3.48Å; I657-V662 HydrophobicContact CG2-CG2 4.08Å; I657-M675 HydrophobicContact CB-CE 4.43Å; I657-M675 HydrophobicContact CD1-CE 3.76Å; I657-M675 HydrophobicContact CD1-SD 3.84Å; I657-M675 HydrophobicContact CG1-CE 4.12Å; I657-M675 HydrophobicContact CG2-CE 3.46Å; I657-M675 VanDerWaalsContact CG2-CE 3.46Å
658	V	75.9	Confident	75.1	Confident	79 Å²	79	86.3 Å²	86.3	48%	0.479	46%	0.46	S	S	.	.			trans	-89.2	105.2	172.8	-176.2	0	0	0	0	109.1	N656 A660 E661	N656-V658 PolarHBondContact O-N 3.5Å; V658-A660 HydrophobicContact CG1-CB 4.41Å; V658-A660 PolarHBondContact O-N 3.21Å; V658-E661 HydrophobicContact CB-CB 4.46Å; V658-E661 HydrophobicContact CB-CG 4.35Å; V658-E661 HydrophobicContact CG1-CG 4.14Å; V658-E661 PolarHBondContact O-N 3.02Å
659	T	67.9	Low	74.8	Confident	55 Å²	55	88.5 Å²	88.5	34%	0.337	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-22.5	-174.7	52.6	0	0	0	0	114.8	L640 W652 W664	L640-T659 HydrophobicContact CD1-CG2 4.1Å; W652-T659 HydrophobicContact CD2-CG2 4.2Å; W652-T659 HydrophobicContact CE3-CG2 3.71Å; W652-T659 HydrophobicContact CH2-CG2 4.33Å; W652-T659 HydrophobicContact CZ3-CG2 3.79Å; T659-W664 PolarHBondContact O-NE1 2.7Å
660	A	65.8	Low	74.6	Confident	95 Å²	95	88.2 Å²	88.2	79%	0.785	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-20.2	178.5	0	0	0	0	0	114.4	V658	V658-A660 HydrophobicContact CG1-CB 4.41Å; V658-A660 PolarHBondContact O-N 3.21Å
661	E	67.1	Low	74.5	Confident	154 Å²	154	86.5 Å²	86.5	72%	0.72	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-14.2	177.7	-69.7	-176.5	168.2	0	0	112.5	V658 H663	V658-E661 HydrophobicContact CB-CB 4.46Å; V658-E661 HydrophobicContact CB-CG 4.35Å; V658-E661 HydrophobicContact CG1-CG 4.14Å; V658-E661 PolarHBondContact O-N 3.02Å; E661-H663 PolarHBondContact O-N 2.72Å
662	V	73.4	Confident	74.5	Confident	30 Å²	30	83.7 Å²	83.7	18%	0.182	46%	0.459	C	S	.	.			trans	-78.1	115.6	179.1	-179.7	0	0	0	0	109.8	I657 W664 L667 M675	I657-V662 HydrophobicContact CG2-CG2 4.08Å; V662-W664 VanDerWaalsContact C-N 3.33Å; V662-W664 HydrophobicContact CB-CZ2 4.43Å; V662-W664 HydrophobicContact CG1-CD2 4.18Å; V662-W664 HydrophobicContact CG1-CG 4.48Å; V662-W664 HydrophobicContact CG1-CZ2 4.31Å; V662-W664 PolarHBondContact O-N 3.42Å; V662-W664 PolarHBondContact O-NE1 3.43Å; V662-L667 HydrophobicContact CG1-CD1 3.64Å; V662-L667 HydrophobicContact CG1-CD2 4.38Å; V662-M675 HydrophobicContact CG1-CE 4.44Å; V662-M675 HydrophobicContact CG2-CE 3.9Å
663	H	75.8	Confident	74.2	Confident	148 Å²	148	87.5 Å²	87.5	69%	0.685	48%	0.477	S	S	*	.			trans	-78.9	78.1	174.4	-75.4	-66	0	0	0	111.7	E661 A665 N666 L667	E661-H663 PolarHBondContact O-N 2.72Å; H663-A665 PolarHBondContact O-N 3.16Å; H663-N666 HydrophobicContact CB-CB 4.47Å; H663-N666 PolarHBondContact O-N 2.7Å; H663-L667 WeakPolarHBondContact O-CD1 3.28Å
664	W	76.4	Confident	74.1	Confident	37 Å²	37	85.9 Å²	85.9	14%	0.14	47%	0.472	C	S	.	.	G	3₁₀ helix	trans	-44.5	-33.2	-176.9	-63.3	92.7	0	0	0	115.6	C638 L640 W652 T659 V662	C638-W664 WeakPolarHBondContact O-CB 3.23Å; L640-W664 HydrophobicContact CB-CZ2 4.28Å; L640-W664 HydrophobicContact CD1-CH2 3.89Å; L640-W664 HydrophobicContact CD1-CZ2 3.34Å; L640-W664 HydrophobicContact CG-CZ2 4.43Å; W652-W664 HydrophobicContact CZ2-CH2 4.35Å; T659-W664 PolarHBondContact O-NE1 2.7Å; V662-W664 VanDerWaalsContact C-N 3.33Å; V662-W664 HydrophobicContact CB-CZ2 4.43Å; V662-W664 HydrophobicContact CG1-CD2 4.18Å; V662-W664 HydrophobicContact CG1-CG 4.48Å; V662-W664 HydrophobicContact CG1-CZ2 4.31Å; V662-W664 PolarHBondContact O-N 3.42Å; V662-W664 PolarHBondContact O-NE1 3.43Å
665	A	69.7	Low	73.8	Confident	75 Å²	75	81.3 Å²	81.3	62%	0.62	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-75.6	-19.9	-179.8	0	0	0	0	0	115.3	H663	H663-A665 PolarHBondContact O-N 3.16Å
666	N	77.6	Confident	73.9	Confident	143 Å²	143	79.8 Å²	79.8	77%	0.765	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-100	-2.9	-178.6	-78.6	0.3	0	0	0	113.1	H663	H663-N666 HydrophobicContact CB-CB 4.47Å; H663-N666 PolarHBondContact O-N 2.7Å
667	L	74.9	Confident	73.8	Confident	41 Å²	41	73.6 Å²	73.6	22%	0.215	41%	0.41	C	S	.	.			trans	-72.5	141.5	177	-76	98.2	0	0	0	110.7	V662 H663 E671 M675	V662-L667 HydrophobicContact CG1-CD1 3.64Å; V662-L667 HydrophobicContact CG1-CD2 4.38Å; H663-L667 WeakPolarHBondContact O-CD1 3.28Å; L667-E671 HydrophobicContact CB-CB 4.31Å; L667-E671 HydrophobicContact CD2-CB 3.84Å; L667-E671 HydrophobicContact CG-CB 4.41Å; L667-M675 HydrophobicContact CD2-CB 4.38Å; L667-M675 HydrophobicContact CD2-CG 3.9Å
668	T	77	Confident	74	Confident	69 Å²	69	76.7 Å²	76.7	42%	0.423	42%	0.424	S	S	.	.			trans	-69.2	162.7	166	62.1	0	0	0	0	110.7	S670 E671 C672	T668-S670 VanDerWaalsContact C-N 3.26Å; T668-S670 PolarHBondContact O-N 2.81Å; T668-S670 PolarHBondContact OG1-OG 3.02Å; T668-E671 WeakPolarHBondContact CB-OE2 3.49Å; T668-E671 PolarHBondContact N-OE2 3.5Å; T668-E671 PolarHBondContact O-N 2.98Å; T668-E671 WeakPolarHBondContact OG1-CG 3.15Å; T668-E671 PolarHBondContact OG1-N 2.8Å; T668-E671 PolarHBondContact OG1-OE2 3.28Å; T668-C672 WeakPolarHBondContact O-CB 3.35Å; T668-C672 PolarHBondContact O-N 2.78Å
669	V	71.8	Confident	74.1	Confident	64 Å²	64	75 Å²	75	39%	0.388	41%	0.41	S	S	.	.	H	α-helix	trans	-57.5	-39.1	-179.1	-179.6	0	0	0	0	111.8	Q673 F679 P689	V669-Q673 PolarHBondContact O-N 3.06Å; V669-F679 HydrophobicContact CB-CZ 4.5Å; V669-F679 HydrophobicContact CG1-CE1 4.12Å; V669-F679 HydrophobicContact CG1-CZ 3.7Å; V669-P689 HydrophobicContact CG1-CG 4.43Å; V669-P689 HydrophobicContact CG2-CG 3.69Å
670	S	71.7	Confident	74.4	Confident	78 Å²	78	76.3 Å²	76.3	55%	0.545	41%	0.413	S	S	.	.	H	α-helix	trans	-69.4	-44.5	177.8	43.8	0	0	0	0	112.5	T668 C672 Q673 E674	T668-S670 VanDerWaalsContact C-N 3.26Å; T668-S670 PolarHBondContact O-N 2.81Å; T668-S670 PolarHBondContact OG1-OG 3.02Å; S670-C672 VanDerWaalsContact C-N 3.3Å; S670-C672 PolarHBondContact O-N 3.38Å; S670-Q673 PolarHBondContact O-N 2.74Å; S670-E674 WeakPolarHBondContact O-CB 3.26Å; S670-E674 PolarHBondContact O-N 2.95Å
671	E	74	Confident	74.8	Confident	88 Å²	88	73.2 Å²	73.2	41%	0.411	39%	0.391	S	S	.	.	H	α-helix	trans	-67.9	-34	178.4	-63.4	162.4	155.1	0	0	110.7	L667 T668 E674 M675	L667-E671 HydrophobicContact CB-CB 4.31Å; L667-E671 HydrophobicContact CD2-CB 3.84Å; L667-E671 HydrophobicContact CG-CB 4.41Å; T668-E671 WeakPolarHBondContact CB-OE2 3.49Å; T668-E671 PolarHBondContact N-OE2 3.5Å; T668-E671 PolarHBondContact O-N 2.98Å; T668-E671 WeakPolarHBondContact OG1-CG 3.15Å; T668-E671 PolarHBondContact OG1-N 2.8Å; T668-E671 PolarHBondContact OG1-OE2 3.28Å; E671-E674 PolarHBondContact O-N 2.88Å; E671-M675 VanDerWaalsContact O-CB 3.28Å; E671-M675 WeakPolarHBondContact O-CB 3.39Å; E671-M675 WeakPolarHBondContact O-CG 3.44Å; E671-M675 PolarHBondContact O-N 2.83Å
672	C	77.6	Confident	74.8	Confident	0 Å²	0	69 Å²	69	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-60.6	-44.2	172.7	178.1	0	0	0	0	112.3	C638 T668 S670 M675 H676 G677 F679	C638-C672 HydrophobicContact CB-CB 3.68Å; C638-C672 WeakPolarHBondContact CB-SG 3.34Å; C638-C672 WeakPolarHBondContact SG-CB 3.42Å; C638-C672 CovalentContact SG-SG 2.01Å; C638-C672 PolarHBondContact SG-SG 3.37Å; T668-C672 WeakPolarHBondContact O-CB 3.35Å; T668-C672 PolarHBondContact O-N 2.78Å; S670-C672 VanDerWaalsContact C-N 3.3Å; S670-C672 PolarHBondContact O-N 3.38Å; C672-M675 PolarHBondContact O-N 3.37Å; C672-H676 PolarHBondContact O-N 3.46Å; C672-G677 PolarHBondContact O-N 2.96Å; C672-F679 HydrophobicContact CB-CE1 4.05Å; C672-F679 HydrophobicContact CB-CZ 4.03Å; C672-F679 VanDerWaalsContact SG-CE1 3.56Å
673	Q	75.3	Confident	74.4	Confident	99 Å²	99	68.1 Å²	68.1	46%	0.463	37%	0.374	S	S	.	.	H	α-helix	trans	-68.4	-41.2	177.5	-74.9	178.7	-15.1	0	0	112.2	V669 S670 M675 H676 F679 H687	V669-Q673 PolarHBondContact O-N 3.06Å; S670-Q673 PolarHBondContact O-N 2.74Å; Q673-M675 VanDerWaalsContact C-N 3.26Å; Q673-M675 PolarHBondContact O-N 3.16Å; Q673-H676 PolarHBondContact O-N 3.05Å; Q673-F679 HydrophobicContact CG-CE2 3.92Å; Q673-F679 HydrophobicContact CG-CZ 4.07Å; Q673-H687 PolarHBondContact NE2-O 3.32Å
674	E	76.6	Confident	74.2	Confident	129 Å²	129	62.5 Å²	62.5	60%	0.603	35%	0.351	S	S	*	.	H	α-helix	trans	-63.1	-34.6	176.6	-170.7	173.5	-167.5	0	0	111.9	S670 E671 H676	S670-E674 WeakPolarHBondContact O-CB 3.26Å; S670-E674 PolarHBondContact O-N 2.95Å; E671-E674 PolarHBondContact O-N 2.88Å; E674-H676 PolarHBondContact O-N 3.39Å
675	M	73.7	Confident	73.7	Confident	37 Å²	37	62.6 Å²	62.6	18%	0.182	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	4	175.2	-63.9	-65	-74.9	0	0	113.4	W652 I657 V662 L667 E671 C672 Q673 G677	W652-M675 PolarHBondContact NE1-O 3.4Å; I657-M675 HydrophobicContact CB-CE 4.43Å; I657-M675 HydrophobicContact CD1-CE 3.76Å; I657-M675 HydrophobicContact CD1-SD 3.84Å; I657-M675 HydrophobicContact CG1-CE 4.12Å; I657-M675 HydrophobicContact CG2-CE 3.46Å; I657-M675 VanDerWaalsContact CG2-CE 3.46Å; V662-M675 HydrophobicContact CG1-CE 4.44Å; V662-M675 HydrophobicContact CG2-CE 3.9Å; L667-M675 HydrophobicContact CD2-CB 4.38Å; L667-M675 HydrophobicContact CD2-CG 3.9Å; E671-M675 VanDerWaalsContact O-CB 3.28Å; E671-M675 WeakPolarHBondContact O-CB 3.39Å; E671-M675 WeakPolarHBondContact O-CG 3.44Å; E671-M675 PolarHBondContact O-N 2.83Å; C672-M675 PolarHBondContact O-N 3.37Å; Q673-M675 VanDerWaalsContact C-N 3.26Å; Q673-M675 PolarHBondContact O-N 3.16Å; M675-G677 VanDerWaalsContact C-N 3.32Å; M675-G677 PolarHBondContact O-N 3.39Å
676	H	75.9	Confident	73.3	Confident	76 Å²	76	68.1 Å²	68.1	35%	0.352	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	54	41.8	-175.6	-67.3	-73.6	0	0	0	114	P641 T648 Y651 C672 Q673 E674	P641-H676 WeakPolarHBondContact CG-O 3.36Å; T648-H676 HydrophobicContact CG2-CB 3.32Å; Y651-H676 AromaticContact CD1-CD2 3.7Å; Y651-H676 AromaticContact CE1-CD2 4Å; C672-H676 PolarHBondContact O-N 3.46Å; Q673-H676 PolarHBondContact O-N 3.05Å; E674-H676 PolarHBondContact O-N 3.39Å
677	G	77.4	Confident	72.6	Confident	13 Å²	13	69.2 Å²	69.2	13%	0.134	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-78.3	156.3	171.3	0	0	0	0	0	113.3	C672 M675	C672-G677 PolarHBondContact O-N 2.96Å; M675-G677 VanDerWaalsContact C-N 3.32Å; M675-G677 PolarHBondContact O-N 3.39Å
678	E	78.1	Confident	72.2	Confident	101 Å²	101	67.9 Å²	67.9	47%	0.472	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	139.7	172.1	-79.7	-174.8	158.6	0	0	110.8	T639 P641	T639-E678 PolarHBondContact N-O 2.95Å; T639-E678 PolarHBondContact O-N 3.21Å; T639-E678 PolarHBondContact OG1-O 3.08Å; P641-E678 HydrophobicContact CB-CG 4Å; P641-E678 HydrophobicContact CG-CG 4.16Å
679	F	79.3	Confident	71.8	Confident	43 Å²	43	67.2 Å²	67.2	19%	0.189	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	116.1	176.9	-65.6	-72.6	0	0	0	110.3	V669 C672 Q673 C684	V669-F679 HydrophobicContact CB-CZ 4.5Å; V669-F679 HydrophobicContact CG1-CE1 4.12Å; V669-F679 HydrophobicContact CG1-CZ 3.7Å; C672-F679 HydrophobicContact CB-CE1 4.05Å; C672-F679 HydrophobicContact CB-CZ 4.03Å; C672-F679 VanDerWaalsContact SG-CE1 3.56Å; Q673-F679 HydrophobicContact CG-CE2 3.92Å; Q673-F679 HydrophobicContact CG-CZ 4.07Å; F679-C684 HydrophobicContact CB-CB 3.89Å
680	M	74.1	Confident	71.6	Confident	83 Å²	83	67 Å²	67	41%	0.409	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	131.2	175.8	-80.5	-154.4	-90.4	0	0	111.9	R637 T639 C684	R637-M680 PolarHBondContact N-O 2.99Å; R637-M680 PolarHBondContact O-N 3.43Å; T639-M680 HydrophobicContact CG2-CB 4.44Å; T639-M680 HydrophobicContact CG2-CE 4.03Å; T639-M680 WeakPolarHBondContact OG1-CE 3.25Å; T639-M680 WeakPolarHBondContact OG1-CG 3.41Å; M680-C684 PolarHBondContact O-SG 3.01Å; M680-C684 VanDerWaalsContact O-SG 3.42Å
681	G	73.9	Confident	71.3	Confident	30 Å²	30	65.9 Å²	65.9	31%	0.309	35%	0.352	S	S	.	.	S	Bend	trans	149.6	157.4	177.5	0	0	0	0	0	113.2	Y635 A683 C684	Y635-G681 VanDerWaalsContact O-CA 3.3Å; Y635-G681 WeakPolarHBondContact O-CA 3.42Å; G681-A683 PolarHBondContact O-N 3.03Å; G681-C684 PolarHBondContact O-N 3.25Å; G681-C684 VanDerWaalsContact O-N 3.17Å
682	S	67.3	Low	71.1	Confident	64 Å²	64	65.3 Å²	65.3	45%	0.448	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-22.4	175.4	51.6	0	0	0	0	113.5	H623 L633	H623-S682 PolarHBondContact CE1-O 3.39Å; L633-S682 PolarHBondContact O-OG 3.41Å
683	A	65.1	Low	71.1	Confident	12 Å²	12	70.2 Å²	70.2	10%	0.099	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	14.7	179.1	0	0	0	0	0	113.2	Y634 C636 G681 Y690	Y634-A683 HydrophobicContact CD1-CB 4.1Å; C636-A683 HydrophobicContact CB-CB 4.46Å; G681-A683 PolarHBondContact O-N 3.03Å; A683-Y690 VanDerWaalsContact O-CB 3.23Å; A683-Y690 WeakPolarHBondContact O-CB 3.37Å; A683-Y690 PolarHBondContact O-N 3.14Å
684	C	70.1	Confident	71.6	Confident	30 Å²	30	65.6 Å²	65.6	20%	0.203	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	136.5	174.2	-57.9	0	0	0	0	111.1	C636 F679 M680 G681	C636-C684 WeakPolarHBondContact CA-SG 3.48Å; C636-C684 HydrophobicContact CB-CB 4.15Å; C636-C684 WeakPolarHBondContact CB-SG 3.49Å; C636-C684 VanDerWaalsContact SG-CA 3.51Å; C636-C684 WeakPolarHBondContact SG-CB 3.1Å; C636-C684 CovalentContact SG-SG 2.02Å; C636-C684 PolarHBondContact SG-SG 2.9Å; F679-C684 HydrophobicContact CB-CB 3.89Å; M680-C684 PolarHBondContact O-SG 3.01Å; M680-C684 VanDerWaalsContact O-SG 3.42Å; G681-C684 PolarHBondContact O-N 3.25Å; G681-C684 VanDerWaalsContact O-N 3.17Å
685	G	66.6	Low	72	Confident	40 Å²	40	60.3 Å²	60.3	41%	0.412	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	179.6	164.8	0	0	0	0	0	112.2	H687 G688	G685-H687 PolarHBondContact O-N 3.17Å; G685-H687 VanDerWaalsContact O-N 3.1Å; G685-G688 PolarHBondContact N-O 2.99Å; G685-G688 PolarHBondContact O-N 3.29Å
686	H	62.2	Low	72.7	Confident	191 Å²	191	63.8 Å²	63.8	88%	0.884	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-22	179.8	-93.8	-72.2	0	0	0	114.7
687	H	61.3	Low	73.4	Confident	166 Å²	166	61.6 Å²	61.6	77%	0.769	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.5	0.6	-174.9	-63.3	-58.3	0	0	0	114.6	Q673 G685	Q673-H687 PolarHBondContact NE2-O 3.32Å; G685-H687 PolarHBondContact O-N 3.17Å; G685-H687 VanDerWaalsContact O-N 3.1Å
688	G	67.6	Low	74	Confident	13 Å²	13	61 Å²	61	13%	0.134	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	154.4	-176	-179.5	0	0	0	0	0	114.6	G685	G685-G688 PolarHBondContact N-O 2.99Å; G685-G688 PolarHBondContact O-N 3.29Å
689	P	67.7	Low	74.6	Confident	55 Å²	55	58 Å²	58	36%	0.357	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	145.2	178.5	28.4	-33.8	0	0	0	112.4	C636 V669 T691	C636-P689 HydrophobicContact CB-CB 3.91Å; V669-P689 HydrophobicContact CG1-CG 4.43Å; V669-P689 HydrophobicContact CG2-CG 3.69Å; P689-T691 PolarHBondContact O-N 3.48Å
690	Y	68.1	Low	75.2	Confident	58 Å²	58	60.1 Å²	60.1	23%	0.227	34%	0.335	C	S	.	.			trans	-67.5	121.6	175.4	-173	-94.8	0	0	0	111.2	P621 I622 H623 A683 P692	P621-Y690 WeakPolarHBondContact O-CE2 3.35Å; P621-Y690 VanDerWaalsContact O-CZ 3.27Å; P621-Y690 PolarHBondContact O-OH 3.42Å; I622-Y690 VanDerWaalsContact CA-OH 3.24Å; I622-Y690 WeakPolarHBondContact CA-OH 3.48Å; H623-Y690 HydrophobicContact CB-CD1 4.32Å; H623-Y690 HydrophobicContact CB-CD2 4.19Å; H623-Y690 HydrophobicContact CB-CE1 3.83Å; H623-Y690 HydrophobicContact CB-CE2 3.68Å; H623-Y690 VanDerWaalsContact N-CE2 3.26Å; H623-Y690 PolarHBondContact N-OH 2.97Å; A683-Y690 VanDerWaalsContact O-CB 3.23Å; A683-Y690 WeakPolarHBondContact O-CB 3.37Å; A683-Y690 PolarHBondContact O-N 3.14Å; Y690-P692 HydrophobicContact CD1-CB 4.4Å; Y690-P692 HydrophobicContact CE1-CB 3.94Å; Y690-P692 WeakPolarHBondContact O-CD 3.45Å
691	T	65.8	Low	76.1	Confident	55 Å²	55	56.2 Å²	56.2	34%	0.337	32%	0.316	S	S	.	.			trans	-98.7	108	170.5	53.6	0	0	0	0	109.8	Y620 P689	Y620-T691 WeakPolarHBondContact CD1-OG1 3.43Å; P689-T691 PolarHBondContact O-N 3.48Å
692	P	69.9	Low	77	Confident	77 Å²	77	54.9 Å²	54.9	50%	0.5	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	155.1	-179.5	27.1	-33.6	0	0	0	112.3	Y690 V694	Y690-P692 HydrophobicContact CD1-CB 4.4Å; Y690-P692 HydrophobicContact CE1-CB 3.94Å; Y690-P692 WeakPolarHBondContact O-CD 3.45Å; P692-V694 PolarHBondContact O-N 3.46Å
693	D	78.1	Confident	78.3	Confident	102 Å²	102	56.8 Å²	56.8	55%	0.545	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	66	-10.3	168.5	-51.5	-37	0	0	0	118.3	L695 F696 W697	D693-L695 VanDerWaalsContact C-N 3.34Å; D693-L695 PolarHBondContact O-N 3.17Å; D693-F696 PolarHBondContact O-N 3.27Å; D693-W697 WeakPolarHBondContact O-CB 3.32Å; D693-W697 PolarHBondContact O-N 3.02Å
694	V	84.4	Confident	79.7	Confident	2 Å²	2	58.9 Å²	58.9	1%	0.012	31%	0.314	C	S	.	.	H	α-helix	trans	-59.4	-41.7	-179.5	179	0	0	0	0	112.2	Y620 P692 S698 V750 P751	Y620-V694 HydrophobicContact CD1-CB 4.46Å; Y620-V694 HydrophobicContact CD1-CG1 4.22Å; Y620-V694 HydrophobicContact CD2-CG1 4.19Å; Y620-V694 HydrophobicContact CE1-CG1 4.44Å; Y620-V694 HydrophobicContact CE2-CG1 4.42Å; Y620-V694 HydrophobicContact CG-CB 4.46Å; Y620-V694 HydrophobicContact CG-CG1 4.08Å; P692-V694 PolarHBondContact O-N 3.46Å; V694-S698 VanDerWaalsContact O-CB 3.29Å; V694-S698 WeakPolarHBondContact O-CB 3.41Å; V694-S698 PolarHBondContact O-N 2.95Å; V694-S698 PolarHBondContact O-OG 3.5Å; V694-V750 HydrophobicContact CG2-CG1 4.39Å; V694-P751 HydrophobicContact CG2-CG 4.15Å
695	L	85.3	Confident	80.7	Confident	18 Å²	18	57.4 Å²	57.4	9%	0.094	30%	0.304	C	S	.	.	H	α-helix	trans	-68.7	-47.2	-179.5	-178.4	60.1	0	0	0	112	A617 I622 D693 W697 S698 C699	A617-L695 VanDerWaalsContact CA-CD1 3.49Å; A617-L695 HydrophobicContact CB-CD1 3.72Å; A617-L695 HydrophobicContact CB-CD2 3.74Å; A617-L695 HydrophobicContact CB-CG 4.39Å; I622-L695 HydrophobicContact CD1-CD2 3.77Å; I622-L695 HydrophobicContact CG1-CD2 3.77Å; D693-L695 VanDerWaalsContact C-N 3.34Å; D693-L695 PolarHBondContact O-N 3.17Å; L695-W697 VanDerWaalsContact C-N 3.3Å; L695-W697 PolarHBondContact O-N 2.83Å; L695-S698 PolarHBondContact O-N 3.46Å; L695-C699 PolarHBondContact O-N 2.93Å; L695-C699 PolarHBondContact O-SG 3.3Å; L695-C699 VanDerWaalsContact O-SG 3.42Å
696	F	88.1	Confident	82	Confident	110 Å²	110	57.8 Å²	57.8	48%	0.482	30%	0.295	S	S	.	.	H	α-helix	trans	-60.4	-44.2	178.1	-69.4	-64.8	0	0	0	110.9	I622 D693 S698 C699 I700	I622-F696 HydrophobicContact CD1-CE1 3.95Å; I622-F696 HydrophobicContact CD1-CE2 4.02Å; I622-F696 HydrophobicContact CD1-CZ 3.51Å; I622-F696 HydrophobicContact CG1-CE2 4.1Å; I622-F696 HydrophobicContact CG1-CZ 4.1Å; I622-F696 HydrophobicContact CG2-CE2 4.22Å; I622-F696 HydrophobicContact CG2-CZ 4.27Å; D693-F696 PolarHBondContact O-N 3.27Å; F696-S698 VanDerWaalsContact C-N 3.34Å; F696-S698 PolarHBondContact O-N 3.19Å; F696-C699 PolarHBondContact O-N 3.28Å; F696-I700 VanDerWaalsContact O-CG1 3.27Å; F696-I700 WeakPolarHBondContact O-CG1 3.21Å; F696-I700 PolarHBondContact O-N 2.9Å
697	W	90.6	Very high	83.5	Confident	30 Å²	30	53.3 Å²	53.3	11%	0.114	28%	0.276	C	S	.	.	H	α-helix	trans	-61.1	-43	175.6	-173.1	-121.8	0	0	0	112.4	D693 L695 C699 I700 L701 I744 D745 I748 V750	D693-W697 WeakPolarHBondContact O-CB 3.32Å; D693-W697 PolarHBondContact O-N 3.02Å; L695-W697 VanDerWaalsContact C-N 3.3Å; L695-W697 PolarHBondContact O-N 2.83Å; W697-C699 PolarHBondContact O-N 3.22Å; W697-I700 HydrophobicContact CE3-CB 4.43Å; W697-I700 HydrophobicContact CE3-CD1 4.34Å; W697-I700 HydrophobicContact CE3-CG2 4.44Å; W697-I700 HydrophobicContact CZ3-CB 4.49Å; W697-I700 HydrophobicContact CZ3-CG2 4.01Å; W697-I700 PolarHBondContact O-N 3.26Å; W697-L701 HydrophobicContact CD2-CG 4.42Å; W697-L701 HydrophobicContact CH2-CD2 4.21Å; W697-L701 HydrophobicContact CH2-CG 4.5Å; W697-L701 HydrophobicContact CZ2-CD1 4.24Å; W697-L701 HydrophobicContact CZ2-CD2 3.72Å; W697-L701 HydrophobicContact CZ2-CG 3.93Å; W697-L701 WeakPolarHBondContact O-CG 3.3Å; W697-L701 PolarHBondContact O-N 2.77Å; W697-I744 HydrophobicContact CH2-CG2 3.62Å; W697-I744 HydrophobicContact CZ2-CG2 3.94Å; W697-D745 PolarHBondContact NE1-OD1 2.92Å; W697-I748 HydrophobicContact CD2-CG2 4.32Å; W697-I748 HydrophobicContact CE3-CD1 4.42Å; W697-I748 HydrophobicContact CE3-CG2 4.5Å; W697-I748 HydrophobicContact CH2-CB 4.47Å; W697-I748 HydrophobicContact CH2-CD1 3.05Å; W697-I748 HydrophobicContact CH2-CG1 4.3Å; W697-I748 HydrophobicContact CH2-CG2 4.48Å; W697-I748 HydrophobicContact CZ2-CB 4.14Å; W697-I748 HydrophobicContact CZ2-CD1 3.55Å; W697-I748 HydrophobicContact CZ2-CG1 4.43Å; W697-I748 HydrophobicContact CZ2-CG2 4.19Å; W697-I748 HydrophobicContact CZ3-CD1 3.53Å; W697-V750 HydrophobicContact CB-CG1 4.08Å; W697-V750 HydrophobicContact CG-CB 4.19Å; W697-V750 HydrophobicContact CG-CG1 4.09Å
698	S	89.8	Confident	85	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-63.3	-41.8	176.8	-62	0	0	0	0	112.6	V694 L695 F696 L701 F702 P905	V694-S698 VanDerWaalsContact O-CB 3.29Å; V694-S698 WeakPolarHBondContact O-CB 3.41Å; V694-S698 PolarHBondContact O-N 2.95Å; V694-S698 PolarHBondContact O-OG 3.5Å; L695-S698 PolarHBondContact O-N 3.46Å; F696-S698 VanDerWaalsContact C-N 3.34Å; F696-S698 PolarHBondContact O-N 3.19Å; S698-L701 PolarHBondContact O-N 3.47Å; S698-F702 WeakPolarHBondContact O-CB 3.28Å; S698-F702 PolarHBondContact O-N 2.93Å; S698-P905 WeakPolarHBondContact O-CB 3.47Å
699	C	91.3	Very high	86	Confident	38 Å²	38	46.9 Å²	46.9	26%	0.257	24%	0.244	S	C	.	.	H	α-helix	trans	-63.9	-41.9	174.5	-73	0	0	0	0	112	L695 F696 W697 F702 F703	L695-C699 PolarHBondContact O-N 2.93Å; L695-C699 PolarHBondContact O-SG 3.3Å; L695-C699 VanDerWaalsContact O-SG 3.42Å; F696-C699 PolarHBondContact O-N 3.28Å; W697-C699 PolarHBondContact O-N 3.22Å; C699-F702 PolarHBondContact O-N 3.02Å; C699-F703 VanDerWaalsContact O-CD2 3.28Å; C699-F703 WeakPolarHBondContact O-CD2 3.2Å; C699-F703 PolarHBondContact O-N 2.95Å
700	I	93.1	Very high	87	Confident	88 Å²	88	46.4 Å²	46.4	45%	0.451	24%	0.242	S	C	.	.	H	α-helix	trans	-61.4	-49.9	176.3	-69.8	165.1	0	0	0	110.1	F696 W697 F702 T704	F696-I700 VanDerWaalsContact O-CG1 3.27Å; F696-I700 WeakPolarHBondContact O-CG1 3.21Å; F696-I700 PolarHBondContact O-N 2.9Å; W697-I700 HydrophobicContact CE3-CB 4.43Å; W697-I700 HydrophobicContact CE3-CD1 4.34Å; W697-I700 HydrophobicContact CE3-CG2 4.44Å; W697-I700 HydrophobicContact CZ3-CB 4.49Å; W697-I700 HydrophobicContact CZ3-CG2 4.01Å; W697-I700 PolarHBondContact O-N 3.26Å; I700-F702 VanDerWaalsContact C-N 3.31Å; I700-F702 PolarHBondContact O-N 3.39Å; I700-T704 WeakPolarHBondContact O-CB 2.94Å; I700-T704 PolarHBondContact O-N 3.33Å; I700-T704 PolarHBondContact O-OG1 3.21Å
701	L	92.1	Very high	88	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-58.6	-43.1	177.4	-75.3	176.5	0	0	0	111.7	W697 S698 T705 M741 D745 P903 P905 V906	W697-L701 HydrophobicContact CD2-CG 4.42Å; W697-L701 HydrophobicContact CH2-CD2 4.21Å; W697-L701 HydrophobicContact CH2-CG 4.5Å; W697-L701 HydrophobicContact CZ2-CD1 4.24Å; W697-L701 HydrophobicContact CZ2-CD2 3.72Å; W697-L701 HydrophobicContact CZ2-CG 3.93Å; W697-L701 WeakPolarHBondContact O-CG 3.3Å; W697-L701 PolarHBondContact O-N 2.77Å; S698-L701 PolarHBondContact O-N 3.47Å; L701-T705 WeakPolarHBondContact O-CB 3.41Å; L701-T705 PolarHBondContact O-N 2.99Å; L701-T705 PolarHBondContact O-OG1 3.09Å; L701-M741 HydrophobicContact CD2-CB 4.39Å; L701-M741 HydrophobicContact CD2-SD 4.25Å; L701-D745 HydrophobicContact CD1-CB 4.36Å; L701-P903 HydrophobicContact CD1-CB 4.32Å; L701-P903 HydrophobicContact CD1-CG 4.2Å; L701-P905 HydrophobicContact CB-CB 4.24Å; L701-V906 HydrophobicContact CB-CG2 4.06Å; L701-V906 HydrophobicContact CD1-CG2 4.42Å; L701-V906 HydrophobicContact CD2-CG2 4.12Å; L701-V906 HydrophobicContact CG-CG2 4.44Å
702	F	92.5	Very high	89.1	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.009	24%	0.243	C	C	.	.	H	α-helix	trans	-60.4	-57.1	179.1	176.3	-96.6	0	0	0	112.5	L613 S698 C699 I700 T705 F706 Y908 G909 L912	L613-F702 HydrophobicContact CD1-CB 4.37Å; L613-F702 HydrophobicContact CD1-CG 4.39Å; L613-F702 HydrophobicContact CD2-CD1 3.75Å; L613-F702 HydrophobicContact CD2-CE1 3.9Å; L613-F702 HydrophobicContact CD2-CG 4.12Å; L613-F702 HydrophobicContact CD2-CZ 4.38Å; S698-F702 WeakPolarHBondContact O-CB 3.28Å; S698-F702 PolarHBondContact O-N 2.93Å; C699-F702 PolarHBondContact O-N 3.02Å; I700-F702 VanDerWaalsContact C-N 3.31Å; I700-F702 PolarHBondContact O-N 3.39Å; F702-T705 PolarHBondContact O-N 3.31Å; F702-F706 PolarHBondContact O-N 3.36Å; F702-Y908 WeakPolarHBondContact CE2-O 3.23Å; F702-G909 VanDerWaalsContact CD2-N 3.32Å; F702-L912 HydrophobicContact CE1-CD2 3.79Å; F702-L912 HydrophobicContact CE2-CB 4.39Å; F702-L912 HydrophobicContact CZ-CB 4.06Å; F702-L912 HydrophobicContact CZ-CD2 3.68Å; F702-L912 HydrophobicContact CZ-CG 4.38Å
703	F	94.1	Very high	89.7	Confident	105 Å²	105	45.4 Å²	45.4	46%	0.461	23%	0.234	S	C	.	.	H	α-helix	trans	-70.8	-37.4	-177.1	-74	-66.7	0	0	0	112.4	C699 T705 F706 I707	C699-F703 VanDerWaalsContact O-CD2 3.28Å; C699-F703 WeakPolarHBondContact O-CD2 3.2Å; C699-F703 PolarHBondContact O-N 2.95Å; F703-T705 VanDerWaalsContact C-N 3.33Å; F703-T705 PolarHBondContact O-N 3.19Å; F703-F706 PolarHBondContact O-N 3.31Å; F703-I707 VanDerWaalsContact O-CG1 3.31Å; F703-I707 WeakPolarHBondContact O-CG1 2.96Å; F703-I707 PolarHBondContact O-N 3.45Å
704	T	94.1	Very high	89.9	Confident	55 Å²	55	44.6 Å²	44.6	34%	0.337	23%	0.232	S	C	.	.	H	α-helix	trans	-64.9	-40.3	177.8	-53.9	0	0	0	0	110.9	I700 F706 I707 L708 M741	I700-T704 WeakPolarHBondContact O-CB 2.94Å; I700-T704 PolarHBondContact O-N 3.33Å; I700-T704 PolarHBondContact O-OG1 3.21Å; T704-F706 VanDerWaalsContact C-N 3.34Å; T704-F706 PolarHBondContact O-N 3.17Å; T704-I707 PolarHBondContact O-N 2.63Å; T704-L708 WeakPolarHBondContact O-CB 3.47Å; T704-L708 PolarHBondContact O-N 3.21Å; T704-M741 HydrophobicContact CG2-CE 3.48Å; T704-M741 VanDerWaalsContact CG2-CE 3.48Å; T704-M741 HydrophobicContact CG2-SD 3.79Å
705	T	92.9	Very high	89.8	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60.5	-43.7	174.9	-61.5	0	0	0	0	111.8	L701 F702 F703 S709 T737 M741 V906 V910	L701-T705 WeakPolarHBondContact O-CB 3.41Å; L701-T705 PolarHBondContact O-N 2.99Å; L701-T705 PolarHBondContact O-OG1 3.09Å; F702-T705 PolarHBondContact O-N 3.31Å; F703-T705 VanDerWaalsContact C-N 3.33Å; F703-T705 PolarHBondContact O-N 3.19Å; T705-S709 VanDerWaalsContact O-CB 3.27Å; T705-S709 WeakPolarHBondContact O-CB 3.39Å; T705-S709 PolarHBondContact O-N 3.35Å; T705-S709 PolarHBondContact O-OG 3.25Å; T705-T737 HydrophobicContact CG2-CG2 3.77Å; T705-T737 WeakPolarHBondContact O-CG2 3.19Å; T705-M741 WeakPolarHBondContact OG1-CG 3.43Å; T705-V906 HydrophobicContact CG2-CG1 4Å; T705-V906 WeakPolarHBondContact CG2-O 3.48Å; T705-V910 HydrophobicContact CG2-CG2 3.66Å
706	F	92.8	Very high	89.4	Confident	48 Å²	48	47.3 Å²	47.3	21%	0.211	24%	0.244	C	C	.	.	H	α-helix	trans	-63.7	-49.8	177.2	170.8	-104.7	0	0	0	111.9	F702 F703 T704 S709 S710 L912 V916	F702-F706 PolarHBondContact O-N 3.36Å; F703-F706 PolarHBondContact O-N 3.31Å; T704-F706 VanDerWaalsContact C-N 3.34Å; T704-F706 PolarHBondContact O-N 3.17Å; F706-S709 PolarHBondContact O-N 3.01Å; F706-S710 WeakPolarHBondContact O-CB 3.44Å; F706-S710 PolarHBondContact O-N 3.36Å; F706-L912 HydrophobicContact CB-CD2 4.27Å; F706-L912 HydrophobicContact CD1-CD2 4.37Å; F706-L912 HydrophobicContact CD2-CB 4.34Å; F706-L912 HydrophobicContact CD2-CD2 3.88Å; F706-L912 HydrophobicContact CD2-CG 3.9Å; F706-L912 HydrophobicContact CE2-CD2 4.32Å; F706-L912 HydrophobicContact CE2-CG 4.16Å; F706-L912 HydrophobicContact CG-CD2 3.91Å; F706-L912 HydrophobicContact CG-CG 4.43Å; F706-V916 HydrophobicContact CE2-CB 4.16Å; F706-V916 HydrophobicContact CE2-CG1 4.43Å; F706-V916 HydrophobicContact CE2-CG2 4.07Å; F706-V916 HydrophobicContact CZ-CG1 4.47Å; F706-V916 HydrophobicContact CZ-CG2 4.4Å
707	I	93.8	Very high	88.7	Confident	97 Å²	97	47.6 Å²	47.6	50%	0.497	25%	0.254	S	S	.	.	H	α-helix	trans	-62.8	-48.9	-179.1	-67.5	168	0	0	0	110.2	F703 T704 S709 S710 T711	F703-I707 VanDerWaalsContact O-CG1 3.31Å; F703-I707 WeakPolarHBondContact O-CG1 2.96Å; F703-I707 PolarHBondContact O-N 3.45Å; T704-I707 PolarHBondContact O-N 2.63Å; I707-S709 PolarHBondContact O-N 3.11Å; I707-S710 PolarHBondContact O-N 3.48Å; I707-T711 HydrophobicContact CG2-CG2 4.21Å; I707-T711 WeakPolarHBondContact O-CG2 3.43Å; I707-T711 PolarHBondContact O-N 3.21Å; I707-T711 PolarHBondContact O-OG1 3.12Å
708	L	92.8	Very high	88.1	Confident	44 Å²	44	47.7 Å²	47.7	23%	0.23	26%	0.259	C	S	.	.	H	α-helix	trans	-63.8	-39.8	-178.5	-173.7	58.4	0	0	0	112	T704 S710 T711 L712 T737 M741	T704-L708 WeakPolarHBondContact O-CB 3.47Å; T704-L708 PolarHBondContact O-N 3.21Å; L708-S710 PolarHBondContact O-N 3.47Å; L708-T711 WeakPolarHBondContact CA-OG1 3.25Å; L708-T711 PolarHBondContact O-N 3.25Å; L708-T711 PolarHBondContact O-OG1 2.95Å; L708-T711 VanDerWaalsContact O-OG1 3.05Å; L708-L712 HydrophobicContact CD1-CD1 4.04Å; L708-L712 HydrophobicContact CD1-CG 4Å; L708-L712 HydrophobicContact CG-CD1 3.94Å; L708-L712 HydrophobicContact CG-CG 4.34Å; L708-L712 VanDerWaalsContact O-CB 3.3Å; L708-L712 WeakPolarHBondContact O-CB 3.43Å; L708-L712 VanDerWaalsContact O-CG 3.25Å; L708-L712 WeakPolarHBondContact O-CG 3.42Å; L708-L712 PolarHBondContact O-N 3.43Å; L708-T737 HydrophobicContact CB-CG2 3.97Å; L708-T737 HydrophobicContact CD2-CG2 4.05Å; L708-T737 HydrophobicContact CG-CG2 4.13Å; L708-M741 HydrophobicContact CD2-CE 3.68Å
709	S	89.3	Confident	87.5	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64.4	-40.1	174.7	-59.1	0	0	0	0	112.1	T705 F706 I707 K713 T737	T705-S709 VanDerWaalsContact O-CB 3.27Å; T705-S709 WeakPolarHBondContact O-CB 3.39Å; T705-S709 PolarHBondContact O-N 3.35Å; T705-S709 PolarHBondContact O-OG 3.25Å; F706-S709 PolarHBondContact O-N 3.01Å; I707-S709 PolarHBondContact O-N 3.11Å; S709-K713 WeakPolarHBondContact O-CB 3.47Å; S709-K713 PolarHBondContact O-N 3.37Å; S709-T737 PolarHBondContact N-OG1 2.97Å; S709-T737 WeakPolarHBondContact OG-CB 3.36Å; S709-T737 WeakPolarHBondContact OG-CG2 2.95Å; S709-T737 PolarHBondContact OG-OG1 3.09Å
710	S	88.2	Confident	87	Confident	45 Å²	45	66 Å²	66	32%	0.315	33%	0.325	S	S	.	.	H	α-helix	trans	-67.3	-43.4	177.3	-172.1	0	0	0	0	112.5	F706 I707 L708 K713 T714	F706-S710 WeakPolarHBondContact O-CB 3.44Å; F706-S710 PolarHBondContact O-N 3.36Å; I707-S710 PolarHBondContact O-N 3.48Å; L708-S710 PolarHBondContact O-N 3.47Å; S710-K713 PolarHBondContact O-N 3.42Å; S710-T714 WeakPolarHBondContact O-CB 3.4Å; S710-T714 PolarHBondContact O-N 3.01Å; S710-T714 PolarHBondContact O-OG1 3.35Å
711	T	89.1	Confident	86.4	Confident	73 Å²	73	66.8 Å²	66.8	45%	0.448	33%	0.325	S	S	.	.	H	α-helix	trans	-69.5	-44.8	179.4	56.7	0	0	0	0	111.8	I707 L708 K713 T714 F715	I707-T711 HydrophobicContact CG2-CG2 4.21Å; I707-T711 WeakPolarHBondContact O-CG2 3.43Å; I707-T711 PolarHBondContact O-N 3.21Å; I707-T711 PolarHBondContact O-OG1 3.12Å; L708-T711 WeakPolarHBondContact CA-OG1 3.25Å; L708-T711 PolarHBondContact O-N 3.25Å; L708-T711 PolarHBondContact O-OG1 2.95Å; L708-T711 VanDerWaalsContact O-OG1 3.05Å; T711-K713 PolarHBondContact O-N 3.48Å; T711-T714 CarbonylContact O-C 3.39Å; T711-T714 PolarHBondContact O-N 3.43Å; T711-F715 PolarHBondContact O-N 2.98Å
712	L	88.3	Confident	85.8	Confident	26 Å²	26	70.9 Å²	70.9	14%	0.136	35%	0.352	C	S	.	.	H	α-helix	trans	-63.5	-29.9	174.8	-70.3	176.1	0	0	0	112.2	L708 F715 V729 A733 L736	L708-L712 HydrophobicContact CD1-CD1 4.04Å; L708-L712 HydrophobicContact CD1-CG 4Å; L708-L712 HydrophobicContact CG-CD1 3.94Å; L708-L712 HydrophobicContact CG-CG 4.34Å; L708-L712 VanDerWaalsContact O-CB 3.3Å; L708-L712 WeakPolarHBondContact O-CB 3.43Å; L708-L712 VanDerWaalsContact O-CG 3.25Å; L708-L712 WeakPolarHBondContact O-CG 3.42Å; L708-L712 PolarHBondContact O-N 3.43Å; L712-F715 VanDerWaalsContact O-CB 3.26Å; L712-F715 WeakPolarHBondContact O-CB 3.44Å; L712-V729 HydrophobicContact CD2-CG1 3.89Å; L712-A733 HydrophobicContact CB-CB 3.57Å; L712-L736 HydrophobicContact CD1-CD2 3.67Å
713	K	84	Confident	84.9	Confident	70 Å²	70	75.4 Å²	75.4	30%	0.304	38%	0.38	S	S	.	.	H	α-helix	trans	-72.7	-45.6	172.5	-157.9	74.5	-172.7	169.5	0	111.9	S709 S710 T711 F715 K716 S730 A733 Y913	S709-K713 WeakPolarHBondContact O-CB 3.47Å; S709-K713 PolarHBondContact O-N 3.37Å; S710-K713 PolarHBondContact O-N 3.42Å; T711-K713 PolarHBondContact O-N 3.48Å; K713-F715 PolarHBondContact O-N 2.83Å; K713-K716 VanDerWaalsContact O-CB 3.32Å; K713-K716 WeakPolarHBondContact O-CB 3.46Å; K713-K716 PolarHBondContact O-N 3.46Å; K713-K716 VanDerWaalsContact O-N 3.11Å; K713-S730 PolarHBondContact NZ-O 3.43Å; K713-S730 PolarHBondContact O-OG 3.49Å; K713-A733 HydrophobicContact CD-CB 4.47Å; K713-Y913 WeakPolarHBondContact CD-OH 2.86Å; K713-Y913 WeakPolarHBondContact CG-OH 3.45Å
714	T	82.1	Confident	83.9	Confident	84 Å²	84	80.1 Å²	80.1	52%	0.515	39%	0.394	S	S	.	.	H	α-helix	trans	-64.9	-23.5	177.1	-52.7	0	0	0	0	112.1	S710 T711 K716 T717	S710-T714 WeakPolarHBondContact O-CB 3.4Å; S710-T714 PolarHBondContact O-N 3.01Å; S710-T714 PolarHBondContact O-OG1 3.35Å; T711-T714 CarbonylContact O-C 3.39Å; T711-T714 PolarHBondContact O-N 3.43Å; T714-K716 PolarHBondContact O-N 3.48Å; T714-T717 PolarHBondContact O-N 3.24Å; T714-T717 PolarHBondContact O-OG1 3.17Å
715	F	82.7	Confident	83.3	Confident	42 Å²	42	80.7 Å²	80.7	18%	0.184	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-52.9	-25.2	171.7	-168.8	-107.9	0	0	0	112.7	T711 L712 K713 T717 S718 F721 R726 V729	T711-F715 PolarHBondContact O-N 2.98Å; L712-F715 VanDerWaalsContact O-CB 3.26Å; L712-F715 WeakPolarHBondContact O-CB 3.44Å; K713-F715 PolarHBondContact O-N 2.83Å; F715-T717 PolarHBondContact O-N 3.34Å; F715-S718 VanDerWaalsContact O-CB 3.23Å; F715-S718 WeakPolarHBondContact O-CB 3.38Å; F715-S718 PolarHBondContact O-N 2.86Å; F715-F721 HydrophobicContact CE1-CB 4.36Å; F715-F721 HydrophobicContact CE1-CD2 4.06Å; F715-F721 HydrophobicContact CE1-CG 4.23Å; F715-F721 AromaticContact CE2-CD2 3.33Å; F715-F721 HydrophobicContact CE2-CD2 3.33Å; F715-F721 AromaticContact CE2-CE2 3.42Å; F715-F721 HydrophobicContact CE2-CE2 3.42Å; F715-F721 VanDerWaalsContact CE2-CE2 3.42Å; F715-F721 HydrophobicContact CE2-CG 4.28Å; F715-F721 HydrophobicContact CE2-CZ 4.42Å; F715-F721 HydrophobicContact CZ-CB 4.05Å; F715-F721 HydrophobicContact CZ-CD1 4.24Å; F715-F721 AromaticContact CZ-CD2 3Å; F715-F721 HydrophobicContact CZ-CD2 3Å; F715-F721 HydrophobicContact CZ-CE1 4.48Å; F715-F721 AromaticContact CZ-CE2 3.31Å; F715-F721 HydrophobicContact CZ-CE2 3.31Å; F715-F721 AromaticContact CZ-CG 3.51Å; F715-F721 HydrophobicContact CZ-CG 3.51Å; F715-F721 HydrophobicContact CZ-CZ 4.06Å; F715-R726 HydrophobicContact CD1-CG 4.34Å; F715-R726 VanDerWaalsContact O-CD 3.24Å; F715-R726 WeakPolarHBondContact O-CD 3.27Å; F715-R726 WeakPolarHBondContact O-CG 3.34Å; F715-V729 HydrophobicContact CD1-CB 4.04Å; F715-V729 HydrophobicContact CD1-CG1 3.84Å; F715-V729 HydrophobicContact CE1-CB 3.99Å; F715-V729 HydrophobicContact CE1-CG1 3.98Å; F715-V729 HydrophobicContact CE1-CG2 4.36Å
716	K	76.6	Confident	82.8	Confident	36 Å²	36	83.3 Å²	83.3	16%	0.157	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	-57.3	-29.2	172.5	-155.4	179.5	179.4	-173.7	0	113.5	K713 T714 R726 S730 E860	K713-K716 VanDerWaalsContact O-CB 3.32Å; K713-K716 WeakPolarHBondContact O-CB 3.46Å; K713-K716 PolarHBondContact O-N 3.46Å; K713-K716 VanDerWaalsContact O-N 3.11Å; T714-K716 PolarHBondContact O-N 3.48Å; K716-R726 WeakPolarHBondContact O-CD 3.38Å; K716-R726 PolarHBondContact O-NE 3.12Å; K716-R726 PolarHBondContact O-NH1 3.1Å; K716-S730 WeakPolarHBondContact CB-OG 3.45Å; K716-E860 WeakPolarHBondContact CE-OE2 3.31Å; K716-E860 IonicContact NZ-OE1 2.81Å; K716-E860 PolarHBondContact NZ-OE1 3.35Å; K716-E860 IonicContact NZ-OE2 2.7Å; K716-E860 PolarHBondContact NZ-OE2 3.42Å
717	T	72.6	Confident	82	Confident	116 Å²	116	82.7 Å²	82.7	71%	0.712	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-98	-1.8	178.2	54.9	0	0	0	0	112.5	T714 F715	T714-T717 PolarHBondContact O-N 3.24Å; T714-T717 PolarHBondContact O-OG1 3.17Å; F715-T717 PolarHBondContact O-N 3.34Å
718	S	78.8	Confident	81.4	Confident	31 Å²	31	81 Å²	81	22%	0.217	40%	0.4	C	S	.	.			trans	-70.5	146.9	-178.6	-172.2	0	0	0	0	112.6	F715 Y720 R726	F715-S718 VanDerWaalsContact O-CB 3.23Å; F715-S718 WeakPolarHBondContact O-CB 3.38Å; F715-S718 PolarHBondContact O-N 2.86Å; S718-Y720 WeakPolarHBondContact OG-CD2 3.28Å; S718-R726 WeakPolarHBondContact O-CD 3.31Å
719	R	77.3	Confident	81	Confident	216 Å²	216	80.9 Å²	80.9	82%	0.815	40%	0.401	S	S	*	.	S	Bend	trans	-92.9	-8.4	-177.8	-63.1	-179.8	-179.8	167.4	-0.4	113.6	F721	R719-F721 PolarHBondContact O-N 2.62Å
720	Y	79.6	Confident	80.7	Confident	207 Å²	207	80.9 Å²	80.9	81%	0.812	40%	0.401	S	S	*	.	S	Bend	trans	-75	-18	-170.3	-62.5	-67.6	0	0	0	115	S718	S718-Y720 WeakPolarHBondContact OG-CD2 3.28Å
721	F	80.1	Confident	80.4	Confident	104 Å²	104	79.9 Å²	79.9	46%	0.456	39%	0.392	S	S	.	.	S	Bend	trans	-128.1	155.4	-173	-71.8	-94.6	0	0	0	113.6	F715 R719 V725	F715-F721 HydrophobicContact CE1-CB 4.36Å; F715-F721 HydrophobicContact CE1-CD2 4.06Å; F715-F721 HydrophobicContact CE1-CG 4.23Å; F715-F721 AromaticContact CE2-CD2 3.33Å; F715-F721 HydrophobicContact CE2-CD2 3.33Å; F715-F721 AromaticContact CE2-CE2 3.42Å; F715-F721 HydrophobicContact CE2-CE2 3.42Å; F715-F721 VanDerWaalsContact CE2-CE2 3.42Å; F715-F721 HydrophobicContact CE2-CG 4.28Å; F715-F721 HydrophobicContact CE2-CZ 4.42Å; F715-F721 HydrophobicContact CZ-CB 4.05Å; F715-F721 HydrophobicContact CZ-CD1 4.24Å; F715-F721 AromaticContact CZ-CD2 3Å; F715-F721 HydrophobicContact CZ-CD2 3Å; F715-F721 HydrophobicContact CZ-CE1 4.48Å; F715-F721 AromaticContact CZ-CE2 3.31Å; F715-F721 HydrophobicContact CZ-CE2 3.31Å; F715-F721 AromaticContact CZ-CG 3.51Å; F715-F721 HydrophobicContact CZ-CG 3.51Å; F715-F721 HydrophobicContact CZ-CZ 4.06Å; R719-F721 PolarHBondContact O-N 2.62Å; F721-V725 HydrophobicContact CD1-CG1 4.44Å
722	P	80	Confident	80.2	Confident	88 Å²	88	78.5 Å²	78.5	57%	0.571	38%	0.38	S	S	*	.			trans	-56.3	145.2	173.3	-23.4	33.2	0	0	0	112.5	R724 V725 R726	P722-R724 VanDerWaalsContact C-N 3.29Å; P722-R724 PolarHBondContact O-N 3.36Å; P722-V725 PolarHBondContact O-N 3.02Å; P722-V725 VanDerWaalsContact O-N 3.1Å; P722-R726 WeakPolarHBondContact O-CB 3.31Å; P722-R726 PolarHBondContact O-N 3.42Å
723	T	73.5	Confident	80.1	Confident	97 Å²	97	77.3 Å²	77.3	60%	0.595	37%	0.374	S	S	*	.	H	α-helix	trans	-54.4	-39.4	-174.7	53.4	0	0	0	0	113.6	S727	T723-S727 WeakPolarHBondContact O-CB 3.43Å; T723-S727 PolarHBondContact O-N 3.01Å
724	R	74.2	Confident	80.2	Confident	203 Å²	203	74.3 Å²	74.3	77%	0.766	36%	0.361	S	S	*	.	H	α-helix	trans	-64.2	-49.6	176.2	-79.9	-168	176.7	154.5	-1.7	113	P722 R726 S727 M728	P722-R724 VanDerWaalsContact C-N 3.29Å; P722-R724 PolarHBondContact O-N 3.36Å; R724-R726 VanDerWaalsContact C-N 3.32Å; R724-R726 PolarHBondContact O-N 3.03Å; R724-S727 PolarHBondContact O-N 3.4Å; R724-M728 VanDerWaalsContact O-CG 3.22Å; R724-M728 WeakPolarHBondContact O-CG 3.45Å; R724-M728 PolarHBondContact O-N 2.83Å
725	V	81.1	Confident	80.4	Confident	68 Å²	68	73.6 Å²	73.6	41%	0.412	35%	0.351	S	S	.	.	H	α-helix	trans	-64.2	-43.2	-179.9	178.5	0	0	0	0	109.9	F721 P722 S727 M728 V729	F721-V725 HydrophobicContact CD1-CG1 4.44Å; P722-V725 PolarHBondContact O-N 3.02Å; P722-V725 VanDerWaalsContact O-N 3.1Å; V725-S727 PolarHBondContact O-N 2.85Å; V725-M728 PolarHBondContact O-N 3.32Å; V725-V729 HydrophobicContact CG1-CG2 4.22Å; V725-V729 WeakPolarHBondContact O-CG2 3.41Å; V725-V729 PolarHBondContact O-N 2.88Å
726	R	81.3	Confident	80.7	Confident	54 Å²	54	75 Å²	75	20%	0.204	36%	0.36	C	S	.	.	H	α-helix	trans	-58.1	-45.6	176	177.9	171.3	68.4	58.9	-5.2	112.9	F715 K716 S718 P722 R724 S730	F715-R726 HydrophobicContact CD1-CG 4.34Å; F715-R726 VanDerWaalsContact O-CD 3.24Å; F715-R726 WeakPolarHBondContact O-CD 3.27Å; F715-R726 WeakPolarHBondContact O-CG 3.34Å; K716-R726 WeakPolarHBondContact O-CD 3.38Å; K716-R726 PolarHBondContact O-NE 3.12Å; K716-R726 PolarHBondContact O-NH1 3.1Å; S718-R726 WeakPolarHBondContact O-CD 3.31Å; P722-R726 WeakPolarHBondContact O-CB 3.31Å; P722-R726 PolarHBondContact O-N 3.42Å; R724-R726 VanDerWaalsContact C-N 3.32Å; R724-R726 PolarHBondContact O-N 3.03Å; R726-S730 WeakPolarHBondContact O-CB 3.43Å; R726-S730 PolarHBondContact O-N 3.3Å; R726-S730 VanDerWaalsContact O-N 3.07Å
727	S	76.8	Confident	81.4	Confident	36 Å²	36	73.3 Å²	73.3	25%	0.252	35%	0.353	S	S	.	.	H	α-helix	trans	-63.7	-47.6	176.5	-162.4	0	0	0	0	110.8	T723 R724 V725 V729 S730 D731	T723-S727 WeakPolarHBondContact O-CB 3.43Å; T723-S727 PolarHBondContact O-N 3.01Å; R724-S727 PolarHBondContact O-N 3.4Å; V725-S727 PolarHBondContact O-N 2.85Å; S727-V729 PolarHBondContact O-N 3.32Å; S727-S730 PolarHBondContact O-N 3.34Å; S727-D731 WeakPolarHBondContact O-CB 3.46Å; S727-D731 PolarHBondContact O-N 3.42Å; S727-D731 VanDerWaalsContact O-OD2 3.08Å; S727-D731 PolarHBondContact OG-OD2 3.46Å
728	M	81.3	Confident	82.2	Confident	61 Å²	61	68.1 Å²	68.1	30%	0.3	32%	0.321	S	S	.	.	H	α-helix	trans	-59.6	-49.1	179.6	-67.4	-68.8	91.3	0	0	112.8	L476 R724 V725 S730 D731 F732	L476-M728 HydrophobicContact CD2-CE 4.21Å; L476-M728 HydrophobicContact CD2-SD 3.18Å; L476-M728 WeakPolarHBondContact CD2-SD 3.47Å; L476-M728 HydrophobicContact CG-SD 4.45Å; R724-M728 VanDerWaalsContact O-CG 3.22Å; R724-M728 WeakPolarHBondContact O-CG 3.45Å; R724-M728 PolarHBondContact O-N 2.83Å; V725-M728 PolarHBondContact O-N 3.32Å; M728-S730 VanDerWaalsContact C-N 3.3Å; M728-S730 PolarHBondContact O-N 2.86Å; M728-D731 PolarHBondContact O-N 2.87Å; M728-F732 VanDerWaalsContact O-CD2 3.29Å; M728-F732 WeakPolarHBondContact O-CD2 3.45Å; M728-F732 PolarHBondContact O-N 3.04Å; M728-F732 HydrophobicContact SD-CE2 4.45Å
729	V	84.6	Confident	82.7	Confident	42 Å²	42	72.4 Å²	72.4	26%	0.255	34%	0.336	S	S	.	.	H	α-helix	trans	-62.7	-38.5	178.2	173.7	0	0	0	0	111.4	L712 F715 V725 S727 A733	L712-V729 HydrophobicContact CD2-CG1 3.89Å; F715-V729 HydrophobicContact CD1-CB 4.04Å; F715-V729 HydrophobicContact CD1-CG1 3.84Å; F715-V729 HydrophobicContact CE1-CB 3.99Å; F715-V729 HydrophobicContact CE1-CG1 3.98Å; F715-V729 HydrophobicContact CE1-CG2 4.36Å; V725-V729 HydrophobicContact CG1-CG2 4.22Å; V725-V729 WeakPolarHBondContact O-CG2 3.41Å; V725-V729 PolarHBondContact O-N 2.88Å; S727-V729 PolarHBondContact O-N 3.32Å; V729-A733 WeakPolarHBondContact O-CA 3.32Å; V729-A733 PolarHBondContact O-N 2.94Å
730	S	81.9	Confident	83.4	Confident	0 Å²	0	64 Å²	64	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-70.9	-31.8	177.4	-172.9	0	0	0	0	113.7	K713 K716 R726 S727 M728 A733	K713-S730 PolarHBondContact NZ-O 3.43Å; K713-S730 PolarHBondContact O-OG 3.49Å; K716-S730 WeakPolarHBondContact CB-OG 3.45Å; R726-S730 WeakPolarHBondContact O-CB 3.43Å; R726-S730 PolarHBondContact O-N 3.3Å; R726-S730 VanDerWaalsContact O-N 3.07Å; S727-S730 PolarHBondContact O-N 3.34Å; M728-S730 VanDerWaalsContact C-N 3.3Å; M728-S730 PolarHBondContact O-N 2.86Å; S730-A733 WeakPolarHBondContact O-CB 3.48Å
731	D	81.8	Confident	84	Confident	23 Å²	23	54.5 Å²	54.5	12%	0.123	27%	0.272	C	S	.	.	H	α-helix	trans	-74.6	-37.7	178.5	-65.9	-26.6	0	0	0	110.9	A480 S727 M728	A480-D731 HydrophobicContact CB-CB 4.2Å; S727-D731 WeakPolarHBondContact O-CB 3.46Å; S727-D731 PolarHBondContact O-N 3.42Å; S727-D731 VanDerWaalsContact O-OD2 3.08Å; S727-D731 PolarHBondContact OG-OD2 3.46Å; M728-D731 PolarHBondContact O-N 2.87Å
732	F	85.9	Confident	84.5	Confident	44 Å²	44	50.9 Å²	50.9	19%	0.193	26%	0.258	C	S	.	.	S	Bend	trans	-88.5	2.6	175.2	-72.7	-79.9	0	0	0	114.5	L476 A480 M728 V734 F735 L736	L476-F732 HydrophobicContact CD2-CE2 4.06Å; L476-F732 HydrophobicContact CD2-CZ 4.45Å; A480-F732 VanDerWaalsContact CA-CE1 3.42Å; A480-F732 HydrophobicContact CB-CD1 3.66Å; A480-F732 HydrophobicContact CB-CD2 3.98Å; A480-F732 HydrophobicContact CB-CE1 3.46Å; A480-F732 VanDerWaalsContact CB-CE1 3.46Å; A480-F732 HydrophobicContact CB-CE2 3.77Å; A480-F732 HydrophobicContact CB-CG 3.92Å; A480-F732 HydrophobicContact CB-CZ 3.51Å; M728-F732 VanDerWaalsContact O-CD2 3.29Å; M728-F732 WeakPolarHBondContact O-CD2 3.45Å; M728-F732 PolarHBondContact O-N 3.04Å; M728-F732 HydrophobicContact SD-CE2 4.45Å; F732-V734 PolarHBondContact O-N 2.96Å; F732-F735 HydrophobicContact CD1-CD1 4.43Å; F732-F735 PolarHBondContact O-N 2.85Å; F732-F735 VanDerWaalsContact O-N 3.14Å; F732-L736 WeakPolarHBondContact O-CB 3.26Å; F732-L736 PolarHBondContact O-N 3.4Å
733	A	86.7	Confident	85	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.008	25%	0.249	C	C	.	.	H	α-helix	trans	-46.9	-55.3	-169.6	0	0	0	0	0	113.9	L712 K713 V729 S730 L736 T737	L712-A733 HydrophobicContact CB-CB 3.57Å; K713-A733 HydrophobicContact CD-CB 4.47Å; V729-A733 WeakPolarHBondContact O-CA 3.32Å; V729-A733 PolarHBondContact O-N 2.94Å; S730-A733 WeakPolarHBondContact O-CB 3.48Å; A733-L736 PolarHBondContact O-N 3.27Å; A733-T737 PolarHBondContact O-N 3.42Å; A733-T737 PolarHBondContact O-OG1 2.86Å
734	V	85.3	Confident	85.9	Confident	7 Å²	7	48.5 Å²	48.5	4%	0.042	24%	0.235	C	C	.	.	H	α-helix	trans	-70.3	-38.8	-175.4	-174.6	0	0	0	0	112	F484 F732 T737 I738 V910 Y913	F484-V734 HydrophobicContact CD2-CB 3.48Å; F484-V734 VanDerWaalsContact CD2-CB 3.48Å; F484-V734 HydrophobicContact CD2-CG1 3.55Å; F484-V734 HydrophobicContact CD2-CG2 4.08Å; F484-V734 HydrophobicContact CE2-CB 3.61Å; F484-V734 HydrophobicContact CE2-CG1 3.45Å; F484-V734 VanDerWaalsContact CE2-CG1 3.45Å; F484-V734 HydrophobicContact CE2-CG2 3.78Å; F484-V734 HydrophobicContact CG-CB 4.31Å; F484-V734 HydrophobicContact CZ-CB 4.47Å; F484-V734 HydrophobicContact CZ-CG2 4.2Å; F732-V734 PolarHBondContact O-N 2.96Å; V734-T737 PolarHBondContact O-N 3.45Å; V734-I738 HydrophobicContact CG1-CD1 4.31Å; V734-I738 WeakPolarHBondContact O-CG1 3.45Å; V734-I738 PolarHBondContact O-N 3.5Å; V734-V910 HydrophobicContact CG1-CG1 3.74Å; V734-V910 HydrophobicContact CG1-CG2 4.02Å; V734-Y913 HydrophobicContact CG2-CD1 3.93Å; V734-Y913 HydrophobicContact CG2-CE1 3.43Å; V734-Y913 VanDerWaalsContact CG2-CE1 3.43Å
735	F	87.4	Confident	86.7	Confident	69 Å²	69	39 Å²	39	30%	0.303	20%	0.2	S	C	.	.	H	α-helix	trans	-64.6	-44.3	176.9	176.4	-100.2	0	0	0	111.3	L483 F732 T737 I738 F739	L483-F735 HydrophobicContact CB-CD2 4.15Å; L483-F735 HydrophobicContact CB-CE2 4.37Å; F732-F735 HydrophobicContact CD1-CD1 4.43Å; F732-F735 PolarHBondContact O-N 2.85Å; F732-F735 VanDerWaalsContact O-N 3.14Å; F735-T737 VanDerWaalsContact C-N 3.34Å; F735-T737 PolarHBondContact O-N 3.02Å; F735-I738 PolarHBondContact O-N 2.99Å; F735-F739 WeakPolarHBondContact O-CB 3.4Å; F735-F739 PolarHBondContact O-N 3.26Å
736	L	89.1	Confident	87.1	Confident	72 Å²	72	42.3 Å²	42.3	38%	0.377	21%	0.209	S	C	.	.	H	α-helix	trans	-63	-40.6	176.4	-171.2	137.6	0	0	0	111.1	L712 F732 A733 F739 T740	L712-L736 HydrophobicContact CD1-CD2 3.67Å; F732-L736 WeakPolarHBondContact O-CB 3.26Å; F732-L736 PolarHBondContact O-N 3.4Å; A733-L736 PolarHBondContact O-N 3.27Å; L736-F739 PolarHBondContact O-N 3.45Å; L736-T740 HydrophobicContact CD2-CG2 4.04Å; L736-T740 HydrophobicContact CG-CG2 4.41Å; L736-T740 WeakPolarHBondContact O-CB 3.46Å; L736-T740 VanDerWaalsContact O-CG2 3.24Å; L736-T740 WeakPolarHBondContact O-CG2 3.39Å; L736-T740 PolarHBondContact O-N 3.46Å; L736-T740 PolarHBondContact O-OG1 2.83Å; L736-T740 VanDerWaalsContact O-OG1 3.08Å
737	T	90.8	Very high	87.5	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-57.8	-51.6	172.6	-59.3	0	0	0	0	111.7	T705 L708 S709 A733 V734 F735 F739 T740 M741	T705-T737 HydrophobicContact CG2-CG2 3.77Å; T705-T737 WeakPolarHBondContact O-CG2 3.19Å; L708-T737 HydrophobicContact CB-CG2 3.97Å; L708-T737 HydrophobicContact CD2-CG2 4.05Å; L708-T737 HydrophobicContact CG-CG2 4.13Å; S709-T737 PolarHBondContact N-OG1 2.97Å; S709-T737 WeakPolarHBondContact OG-CB 3.36Å; S709-T737 WeakPolarHBondContact OG-CG2 2.95Å; S709-T737 PolarHBondContact OG-OG1 3.09Å; A733-T737 PolarHBondContact O-N 3.42Å; A733-T737 PolarHBondContact O-OG1 2.86Å; V734-T737 PolarHBondContact O-N 3.45Å; F735-T737 VanDerWaalsContact C-N 3.34Å; F735-T737 PolarHBondContact O-N 3.02Å; T737-F739 VanDerWaalsContact C-N 3.31Å; T737-F739 PolarHBondContact O-N 3.27Å; T737-T740 WeakPolarHBondContact CA-OG1 3.15Å; T737-T740 PolarHBondContact O-N 3.04Å; T737-T740 PolarHBondContact O-OG1 2.68Å; T737-M741 HydrophobicContact CG2-CG 4.16Å; T737-M741 WeakPolarHBondContact O-CB 3.46Å; T737-M741 VanDerWaalsContact O-CG 3.3Å; T737-M741 WeakPolarHBondContact O-CG 3.35Å; T737-M741 PolarHBondContact O-N 3.21Å
738	I	89.4	Confident	88.1	Confident	8 Å²	8	48.4 Å²	48.4	4%	0.041	24%	0.241	C	C	.	.	H	α-helix	trans	-57.6	-48	179.8	-65.2	166.4	0	0	0	110	C487 V734 F735 T740 M741 V742 V906 V910	C487-I738 HydrophobicContact CB-CD1 3.68Å; V734-I738 HydrophobicContact CG1-CD1 4.31Å; V734-I738 WeakPolarHBondContact O-CG1 3.45Å; V734-I738 PolarHBondContact O-N 3.5Å; F735-I738 PolarHBondContact O-N 2.99Å; I738-T740 PolarHBondContact O-N 3.26Å; I738-M741 PolarHBondContact O-N 3.04Å; I738-V742 HydrophobicContact CG2-CG2 4.21Å; I738-V742 WeakPolarHBondContact O-CB 3.39Å; I738-V742 WeakPolarHBondContact O-CG2 3.42Å; I738-V742 PolarHBondContact O-N 3.43Å; I738-V906 HydrophobicContact CB-CG1 4.49Å; I738-V906 HydrophobicContact CG1-CG1 4.26Å; I738-V906 HydrophobicContact CG2-CG1 4.39Å; I738-V910 HydrophobicContact CD1-CG2 4.01Å; I738-V910 HydrophobicContact CG1-CG2 3.78Å
739	F	89.6	Confident	88.1	Confident	121 Å²	121	48.3 Å²	48.3	53%	0.531	26%	0.256	S	S	.	.	H	α-helix	trans	-59.4	-46.8	179.7	-178.3	-106.7	0	0	0	112.3	F735 L736 T737 V742 I743	F735-F739 WeakPolarHBondContact O-CB 3.4Å; F735-F739 PolarHBondContact O-N 3.26Å; L736-F739 PolarHBondContact O-N 3.45Å; T737-F739 VanDerWaalsContact C-N 3.31Å; T737-F739 PolarHBondContact O-N 3.27Å; F739-V742 PolarHBondContact O-N 2.95Å; F739-I743 HydrophobicContact CD1-CD1 3.74Å; F739-I743 HydrophobicContact CD2-CD1 4.43Å; F739-I743 HydrophobicContact CE1-CD1 3.3Å; F739-I743 HydrophobicContact CE2-CD1 4.05Å; F739-I743 HydrophobicContact CG-CD1 4.3Å; F739-I743 HydrophobicContact CZ-CD1 3.49Å; F739-I743 VanDerWaalsContact CZ-CD1 3.49Å; F739-I743 HydrophobicContact CZ-CG1 4.48Å; F739-I743 WeakPolarHBondContact O-CG1 3.34Å; F739-I743 PolarHBondContact O-N 2.88Å
740	T	91.3	Very high	88.1	Confident	39 Å²	39	47.9 Å²	47.9	24%	0.239	25%	0.253	C	S	.	.	H	α-helix	trans	-64	-42	177.9	57.3	0	0	0	0	112.5	L736 T737 I738 I743 I744	L736-T740 HydrophobicContact CD2-CG2 4.04Å; L736-T740 HydrophobicContact CG-CG2 4.41Å; L736-T740 WeakPolarHBondContact O-CB 3.46Å; L736-T740 VanDerWaalsContact O-CG2 3.24Å; L736-T740 WeakPolarHBondContact O-CG2 3.39Å; L736-T740 PolarHBondContact O-N 3.46Å; L736-T740 PolarHBondContact O-OG1 2.83Å; L736-T740 VanDerWaalsContact O-OG1 3.08Å; T737-T740 WeakPolarHBondContact CA-OG1 3.15Å; T737-T740 PolarHBondContact O-N 3.04Å; T737-T740 PolarHBondContact O-OG1 2.68Å; I738-T740 PolarHBondContact O-N 3.26Å; T740-I743 PolarHBondContact O-N 2.89Å; T740-I744 VanDerWaalsContact O-CG1 3.26Å; T740-I744 WeakPolarHBondContact O-CG1 3.23Å; T740-I744 PolarHBondContact O-N 2.9Å
741	M	91.9	Very high	87.9	Confident	8 Å²	8	52.2 Å²	52.2	4%	0.039	28%	0.281	C	S	.	.	H	α-helix	trans	-69.9	-35	179.9	-67.1	-66.3	127	0	0	112.4	L701 T704 T705 L708 T737 I738 I744 D745 V906	L701-M741 HydrophobicContact CD2-CB 4.39Å; L701-M741 HydrophobicContact CD2-SD 4.25Å; T704-M741 HydrophobicContact CG2-CE 3.48Å; T704-M741 VanDerWaalsContact CG2-CE 3.48Å; T704-M741 HydrophobicContact CG2-SD 3.79Å; T705-M741 WeakPolarHBondContact OG1-CG 3.43Å; L708-M741 HydrophobicContact CD2-CE 3.68Å; T737-M741 HydrophobicContact CG2-CG 4.16Å; T737-M741 WeakPolarHBondContact O-CB 3.46Å; T737-M741 VanDerWaalsContact O-CG 3.3Å; T737-M741 WeakPolarHBondContact O-CG 3.35Å; T737-M741 PolarHBondContact O-N 3.21Å; I738-M741 PolarHBondContact O-N 3.04Å; M741-I744 HydrophobicContact CE-CD1 3.73Å; M741-I744 PolarHBondContact O-N 3.2Å; M741-I744 HydrophobicContact SD-CD1 4.34Å; M741-D745 WeakPolarHBondContact O-CB 3.05Å; M741-D745 PolarHBondContact O-N 3.43Å; M741-V906 HydrophobicContact CB-CG1 4.09Å; M741-V906 HydrophobicContact CB-CG2 3.64Å; M741-V906 HydrophobicContact CG-CG2 4.45Å
742	V	90.8	Very high	87.9	Confident	28 Å²	28	51.6 Å²	51.6	17%	0.17	28%	0.279	C	S	.	.	H	α-helix	trans	-64.6	-41.8	172.5	170.9	0	0	0	0	111.1	I738 F739 D745 F746 F901 I902	I738-V742 HydrophobicContact CG2-CG2 4.21Å; I738-V742 WeakPolarHBondContact O-CB 3.39Å; I738-V742 WeakPolarHBondContact O-CG2 3.42Å; I738-V742 PolarHBondContact O-N 3.43Å; F739-V742 PolarHBondContact O-N 2.95Å; V742-D745 PolarHBondContact O-N 2.87Å; V742-F746 WeakPolarHBondContact O-CB 3.23Å; V742-F746 PolarHBondContact O-N 3.09Å; V742-F901 HydrophobicContact CG1-CB 4.36Å; V742-I902 HydrophobicContact CG2-CB 4.46Å; V742-I902 HydrophobicContact CG2-CG1 4.21Å; V742-I902 HydrophobicContact CG2-CG2 4.36Å
743	I	91.4	Very high	87.7	Confident	73 Å²	73	50.7 Å²	50.7	37%	0.374	28%	0.277	S	S	.	.	H	α-helix	trans	-63.1	-44.2	175.1	-70.9	167	0	0	0	110.6	F739 T740 F746 L747	F739-I743 HydrophobicContact CD1-CD1 3.74Å; F739-I743 HydrophobicContact CD2-CD1 4.43Å; F739-I743 HydrophobicContact CE1-CD1 3.3Å; F739-I743 HydrophobicContact CE2-CD1 4.05Å; F739-I743 HydrophobicContact CG-CD1 4.3Å; F739-I743 HydrophobicContact CZ-CD1 3.49Å; F739-I743 VanDerWaalsContact CZ-CD1 3.49Å; F739-I743 HydrophobicContact CZ-CG1 4.48Å; F739-I743 WeakPolarHBondContact O-CG1 3.34Å; F739-I743 PolarHBondContact O-N 2.88Å; T740-I743 PolarHBondContact O-N 2.89Å; I743-F746 PolarHBondContact O-N 3.36Å; I743-L747 HydrophobicContact CG2-CD1 3.89Å; I743-L747 HydrophobicContact CG2-CG 4.25Å; I743-L747 VanDerWaalsContact O-CG 3.28Å; I743-L747 WeakPolarHBondContact O-CG 3.39Å; I743-L747 PolarHBondContact O-N 3.1Å
744	I	91.9	Very high	87.4	Confident	61 Å²	61	54.6 Å²	54.6	31%	0.313	29%	0.294	S	S	.	.	H	α-helix	trans	-63	-43.6	179.1	-69.8	166	0	0	0	111.1	W697 T740 M741 F746 L747 I748	W697-I744 HydrophobicContact CH2-CG2 3.62Å; W697-I744 HydrophobicContact CZ2-CG2 3.94Å; T740-I744 VanDerWaalsContact O-CG1 3.26Å; T740-I744 WeakPolarHBondContact O-CG1 3.23Å; T740-I744 PolarHBondContact O-N 2.9Å; M741-I744 HydrophobicContact CE-CD1 3.73Å; M741-I744 PolarHBondContact O-N 3.2Å; M741-I744 HydrophobicContact SD-CD1 4.34Å; I744-F746 VanDerWaalsContact C-N 3.33Å; I744-F746 PolarHBondContact O-N 2.7Å; I744-L747 PolarHBondContact O-N 3.41Å; I744-I748 HydrophobicContact CG2-CD1 3.74Å; I744-I748 WeakPolarHBondContact O-CB 3.24Å; I744-I748 PolarHBondContact O-N 3.45Å
745	D	91.1	Very high	86.8	Confident	3 Å²	3	54.4 Å²	54.4	2%	0.016	29%	0.293	C	S	.	.	H	α-helix	trans	-61.1	-41.3	174.6	-174.7	68.9	0	0	0	111.9	W697 L701 M741 V742 I748 G749 S752 P903	W697-D745 PolarHBondContact NE1-OD1 2.92Å; L701-D745 HydrophobicContact CD1-CB 4.36Å; M741-D745 WeakPolarHBondContact O-CB 3.05Å; M741-D745 PolarHBondContact O-N 3.43Å; V742-D745 PolarHBondContact O-N 2.87Å; D745-I748 PolarHBondContact O-N 3.32Å; D745-G749 PolarHBondContact O-N 2.98Å; D745-S752 VanDerWaalsContact CG-OG 3.31Å; D745-S752 WeakPolarHBondContact OD1-CB 3.33Å; D745-S752 PolarHBondContact OD1-OG 3.44Å; D745-S752 PolarHBondContact OD2-OG 2.78Å; D745-P903 HydrophobicContact CB-CG 4.23Å
746	F	88.5	Confident	85.8	Confident	139 Å²	139	59.3 Å²	59.3	61%	0.61	32%	0.317	S	S	*	.	H	α-helix	trans	-64.5	-39.6	175.4	-178.1	-98.2	0	0	0	112.8	V742 I743 I744	V742-F746 WeakPolarHBondContact O-CB 3.23Å; V742-F746 PolarHBondContact O-N 3.09Å; I743-F746 PolarHBondContact O-N 3.36Å; I744-F746 VanDerWaalsContact C-N 3.33Å; I744-F746 PolarHBondContact O-N 2.7Å
747	L	89.9	Confident	84.7	Confident	132 Å²	132	56.2 Å²	56.2	69%	0.691	30%	0.301	S	S	*	.	H	α-helix	trans	-70.2	-36.1	179	-71.8	173.2	0	0	0	112.9	I743 I744	I743-L747 HydrophobicContact CG2-CD1 3.89Å; I743-L747 HydrophobicContact CG2-CG 4.25Å; I743-L747 VanDerWaalsContact O-CG 3.28Å; I743-L747 WeakPolarHBondContact O-CG 3.39Å; I743-L747 PolarHBondContact O-N 3.1Å; I744-L747 PolarHBondContact O-N 3.41Å
748	I	88.9	Confident	83.6	Confident	85 Å²	85	58.6 Å²	58.6	44%	0.436	32%	0.316	S	S	.	.	H	α-helix	trans	-82.2	-28.7	-178.1	-75.2	165.3	0	0	0	111.8	W697 I744 D745 V750	W697-I748 HydrophobicContact CD2-CG2 4.32Å; W697-I748 HydrophobicContact CE3-CD1 4.42Å; W697-I748 HydrophobicContact CE3-CG2 4.5Å; W697-I748 HydrophobicContact CH2-CB 4.47Å; W697-I748 HydrophobicContact CH2-CD1 3.05Å; W697-I748 HydrophobicContact CH2-CG1 4.3Å; W697-I748 HydrophobicContact CH2-CG2 4.48Å; W697-I748 HydrophobicContact CZ2-CB 4.14Å; W697-I748 HydrophobicContact CZ2-CD1 3.55Å; W697-I748 HydrophobicContact CZ2-CG1 4.43Å; W697-I748 HydrophobicContact CZ2-CG2 4.19Å; W697-I748 HydrophobicContact CZ3-CD1 3.53Å; I744-I748 HydrophobicContact CG2-CD1 3.74Å; I744-I748 WeakPolarHBondContact O-CB 3.24Å; I744-I748 PolarHBondContact O-N 3.45Å; D745-I748 PolarHBondContact O-N 3.32Å; I748-V750 HydrophobicContact CG2-CB 4.24Å; I748-V750 HydrophobicContact CG2-CG2 3.61Å; I748-V750 PolarHBondContact O-N 3.19Å; I748-V750 VanDerWaalsContact O-N 3.16Å
749	G	81.3	Confident	82.6	Confident	59 Å²	59	62.1 Å²	62.1	61%	0.608	34%	0.341	S	S	*	.			trans	69.7	11.1	168.4	0	0	0	0	0	115.5	D745	D745-G749 PolarHBondContact O-N 2.98Å
750	V	84.9	Confident	81.7	Confident	34 Å²	34	60.2 Å²	60.2	21%	0.206	34%	0.34	C	S	.	.			trans	-68.6	138	173.2	171.8	0	0	0	0	109.1	V694 W697 I748 S752	V694-V750 HydrophobicContact CG2-CG1 4.39Å; W697-V750 HydrophobicContact CB-CG1 4.08Å; W697-V750 HydrophobicContact CG-CB 4.19Å; W697-V750 HydrophobicContact CG-CG1 4.09Å; I748-V750 HydrophobicContact CG2-CB 4.24Å; I748-V750 HydrophobicContact CG2-CG2 3.61Å; I748-V750 PolarHBondContact O-N 3.19Å; I748-V750 VanDerWaalsContact O-N 3.16Å; V750-S752 PolarHBondContact O-N 2.99Å
751	P	77.4	Confident	80.8	Confident	91 Å²	91	62.9 Å²	62.9	59%	0.591	35%	0.348	S	S	*	.			trans	-72.3	75.9	-178.8	30.2	-35.9	0	0	0	111.5	V694	V694-P751 HydrophobicContact CG2-CG 4.15Å
752	S	81.9	Confident	79.9	Confident	9 Å²	9	68.2 Å²	68.2	6%	0.063	37%	0.371	C	S	.	.			trans	-71.3	151.8	172	63.3	0	0	0	0	111.1	D745 V750 K754	D745-S752 VanDerWaalsContact CG-OG 3.31Å; D745-S752 WeakPolarHBondContact OD1-CB 3.33Å; D745-S752 PolarHBondContact OD1-OG 3.44Å; D745-S752 PolarHBondContact OD2-OG 2.78Å; V750-S752 PolarHBondContact O-N 2.99Å; S752-K754 PolarHBondContact O-N 3.34Å; S752-K754 VanDerWaalsContact O-N 3.17Å
753	P	81.5	Confident	79.2	Confident	26 Å²	26	67.9 Å²	67.9	17%	0.169	37%	0.369	C	S	.	.			trans	-69.2	113.2	176.1	29.1	-35.9	0	0	0	109.8	L616 M904 P905	L616-P753 HydrophobicContact CD1-CB 4.39Å; L616-P753 HydrophobicContact CD1-CG 3.79Å; L616-P753 HydrophobicContact CD2-CG 4.03Å; P753-M904 WeakPolarHBondContact O-CB 3.47Å; P753-M904 WeakPolarHBondContact O-CG 3.28Å; P753-M904 PolarHBondContact O-N 3.48Å; P753-P905 HydrophobicContact CG-CG 4.12Å
754	K	81.8	Confident	78.3	Confident	82 Å²	82	67.1 Å²	67.1	36%	0.357	37%	0.368	S	S	.	.	B	Isolated β-bridge	trans	-96.2	157.8	-176.9	-65.7	178.1	-172.9	-175.7	0	112.6	S752 Q756 K900	S752-K754 PolarHBondContact O-N 3.34Å; S752-K754 VanDerWaalsContact O-N 3.17Å; K754-Q756 PolarHBondContact O-N 3.32Å; K754-Q756 VanDerWaalsContact O-N 3.08Å; K754-K900 WeakPolarHBondContact CB-O 3.24Å; K754-K900 VanDerWaalsContact CD-O 3.25Å; K754-K900 WeakPolarHBondContact CD-O 2.88Å
755	L	72.3	Confident	77.4	Confident	3 Å²	3	69.9 Å²	69.9	2%	0.016	38%	0.375	C	S	.	.			trans	-63.8	107.2	176.9	-170.6	66.6	0	0	0	110.8	M490 I494 V757 I902 M904 L907	M490-L755 HydrophobicContact CE-CD2 3.61Å; M490-L755 HydrophobicContact SD-CD2 4.15Å; I494-L755 HydrophobicContact CB-CD1 4.41Å; I494-L755 HydrophobicContact CD1-CD1 3.99Å; I494-L755 HydrophobicContact CD1-CD2 4.08Å; I494-L755 HydrophobicContact CD1-CG 4.23Å; I494-L755 HydrophobicContact CG2-CD1 3.94Å; L755-V757 HydrophobicContact CD2-CG2 4Å; L755-V757 HydrophobicContact CG-CG2 3.86Å; L755-V757 PolarHBondContact O-N 3.23Å; L755-I902 PolarHBondContact N-O 3.49Å; L755-M904 HydrophobicContact CB-SD 4.39Å; L755-M904 HydrophobicContact CD1-CE 3.58Å; L755-M904 HydrophobicContact CD1-SD 3.62Å; L755-L907 HydrophobicContact CD1-CD1 4.35Å; L755-L907 HydrophobicContact CD2-CD1 4.45Å
756	Q	66	Low	76.1	Confident	172 Å²	172	76.6 Å²	76.6	80%	0.804	41%	0.411	S	S	*	.			trans	-82.8	101	175.4	-66.3	-172.8	-0.9	0	0	109.9	K754	K754-Q756 PolarHBondContact O-N 3.32Å; K754-Q756 VanDerWaalsContact O-N 3.08Å
757	V	67	Low	75	Confident	8 Å²	8	76.2 Å²	76.2	5%	0.048	42%	0.415	C	S	.	.			trans	-101.2	129.2	174.3	-170.4	0	0	0	0	109.1	M490 I494 L755 S759 T896 L899	M490-V757 HydrophobicContact CE-CG2 3.73Å; I494-V757 HydrophobicContact CD1-CG2 4.11Å; L755-V757 HydrophobicContact CD2-CG2 4Å; L755-V757 HydrophobicContact CG-CG2 3.86Å; L755-V757 PolarHBondContact O-N 3.23Å; V757-S759 PolarHBondContact O-N 3Å; V757-T896 HydrophobicContact CB-CG2 3.83Å; V757-T896 HydrophobicContact CG1-CG2 3.52Å; V757-L899 HydrophobicContact CG2-CB 4.25Å
758	P	67	Low	74.2	Confident	50 Å²	50	72.3 Å²	72.3	33%	0.325	39%	0.391	S	S	.	.			trans	-63.6	134.8	176.9	25	-32.7	0	0	0	110.8	I511	I511-P758 HydrophobicContact CB-CG 4.01Å; I511-P758 HydrophobicContact CD1-CG 3.96Å; I511-P758 HydrophobicContact CG1-CG 4.5Å
759	S	67.7	Low	73.5	Confident	81 Å²	81	70.5 Å²	70.5	57%	0.566	39%	0.394	S	S	*	.	S	Bend	trans	-86.9	-7.7	-175.3	51	0	0	0	0	114.3	V757	V757-S759 PolarHBondContact O-N 3Å
760	V	71.9	Confident	73.5	Confident	82 Å²	82	71.2 Å²	71.2	50%	0.497	38%	0.378	S	S	.	.	S	Bend	trans	-126	125	-173.9	-175.5	0	0	0	0	110.3	K762	V760-K762 VanDerWaalsContact C-N 3.33Å; V760-K762 HydrophobicContact CG1-CB 4.34Å; V760-K762 HydrophobicContact CG1-CD 3.83Å; V760-K762 HydrophobicContact CG1-CG 3.8Å; V760-K762 PolarHBondContact O-N 2.87Å
761	F	71.4	Confident	73.5	Confident	94 Å²	94	75.7 Å²	75.7	41%	0.412	40%	0.399	S	S	.	.			trans	-79.3	79.9	177.1	-162.8	-93	0	0	0	110.2	I511 F515 W770 V893	I511-F761 HydrophobicContact CD1-CD2 4.06Å; I511-F761 HydrophobicContact CG1-CD2 4.48Å; F515-F761 HydrophobicContact CB-CE2 3.96Å; F515-F761 HydrophobicContact CB-CZ 3.96Å; F515-F761 HydrophobicContact CD1-CZ 4.12Å; F515-F761 AromaticContact CD2-CE2 3.9Å; F515-F761 HydrophobicContact CD2-CE2 3.9Å; F515-F761 AromaticContact CD2-CZ 3.41Å; F515-F761 HydrophobicContact CD2-CZ 3.41Å; F515-F761 VanDerWaalsContact CD2-CZ 3.41Å; F515-F761 HydrophobicContact CE1-CZ 4.45Å; F515-F761 AromaticContact CE2-CZ 3.81Å; F515-F761 HydrophobicContact CE2-CZ 3.81Å; F515-F761 HydrophobicContact CG-CE2 4.04Å; F515-F761 AromaticContact CG-CZ 3.56Å; F515-F761 HydrophobicContact CG-CZ 3.56Å; F515-F761 HydrophobicContact CZ-CZ 4.32Å; F761-W770 AromaticContact CD1-CZ2 3.89Å; F761-W770 HydrophobicContact CD1-CZ2 3.89Å; F761-W770 AromaticContact CE1-CH2 3.83Å; F761-W770 HydrophobicContact CE1-CH2 3.83Å; F761-W770 AromaticContact CE1-CZ2 3.4Å; F761-W770 HydrophobicContact CE1-CZ2 3.4Å; F761-W770 AromaticContact CZ-CH2 3.88Å; F761-W770 HydrophobicContact CZ-CH2 3.88Å; F761-W770 AromaticContact CZ-CZ2 3.95Å; F761-W770 HydrophobicContact CZ-CZ2 3.95Å; F761-V893 HydrophobicContact CD2-CG2 4.31Å
762	K	72.4	Confident	73.8	Confident	121 Å²	121	72.3 Å²	72.3	53%	0.526	38%	0.376	S	S	.	.	S	Bend	trans	-136.5	150.8	174.9	-75.6	-179.6	-176.2	-174.1	0	110.3	I511 V760	I511-K762 WeakPolarHBondContact CG2-O 3.28Å; V760-K762 VanDerWaalsContact C-N 3.33Å; V760-K762 HydrophobicContact CG1-CB 4.34Å; V760-K762 HydrophobicContact CG1-CD 3.83Å; V760-K762 HydrophobicContact CG1-CG 3.8Å; V760-K762 PolarHBondContact O-N 2.87Å
763	P	76.5	Confident	73.8	Confident	20 Å²	20	77.8 Å²	77.8	13%	0.13	41%	0.405	C	S	.	.			trans	-54.3	144.7	167.9	-21	32.4	0	0	0	110.4	R765 R768 W770	P763-R765 PolarHBondContact O-N 2.8Å; P763-R765 VanDerWaalsContact O-N 3.09Å; P763-R768 HydrophobicContact CB-CG 4.01Å; P763-W770 HydrophobicContact CG-CD2 4.36Å; P763-W770 HydrophobicContact CG-CZ2 4.38Å
764	T	72.6	Confident	73.4	Confident	57 Å²	57	78.6 Å²	78.6	35%	0.35	41%	0.41	S	S	.	.	S	Bend	trans	-56.1	-32.1	-174.8	-55.1	0	0	0	0	113.1	G506 S509 E512	G506-T764 WeakPolarHBondContact O-CB 3.47Å; G506-T764 VanDerWaalsContact O-CG2 3.26Å; G506-T764 WeakPolarHBondContact O-CG2 3.12Å; S509-T764 WeakPolarHBondContact CB-OG1 3.12Å; S509-T764 WeakPolarHBondContact OG-CG2 3.37Å; S509-T764 PolarHBondContact OG-OG1 3.41Å; E512-T764 VanDerWaalsContact CD-OG1 3.27Å; E512-T764 PolarHBondContact OE1-N 3.42Å; E512-T764 PolarHBondContact OE1-OG1 3.12Å; E512-T764 PolarHBondContact OE2-OG1 2.75Å
765	R	72.5	Confident	73	Confident	120 Å²	120	80.7 Å²	80.7	45%	0.453	42%	0.424	S	S	.	.	S	Bend	trans	-109.5	131.7	173.9	-73.9	-177.6	65.2	149	0.2	110.5	P763 D767 R768	P763-R765 PolarHBondContact O-N 2.8Å; P763-R765 VanDerWaalsContact O-N 3.09Å; R765-D767 IonicContact CZ-OD2 3.53Å; R765-D767 IonicContact NE-OD2 3.41Å; R765-D767 PolarHBondContact NE-OD2 3.26Å; R765-D767 IonicContact NH2-OD2 2.77Å; R765-D767 PolarHBondContact NH2-OD2 3.46Å; R765-D767 PolarHBondContact O-N 3.45Å; R765-R768 PolarHBondContact O-N 3.04Å
766	D	65.4	Low	73.1	Confident	143 Å²	143	82.3 Å²	82.3	77%	0.765	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-18.2	177.3	-65.9	-48.1	0	0	0	113.1	R768	D766-R768 PolarHBondContact O-N 2.71Å
767	D	65.3	Low	73.5	Confident	131 Å²	131	79.6 Å²	79.6	70%	0.701	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-7	-179.3	-54.6	-37.2	0	0	0	114.6	R765	R765-D767 IonicContact CZ-OD2 3.53Å; R765-D767 IonicContact NE-OD2 3.41Å; R765-D767 PolarHBondContact NE-OD2 3.26Å; R765-D767 IonicContact NH2-OD2 2.77Å; R765-D767 PolarHBondContact NH2-OD2 3.46Å; R765-D767 PolarHBondContact O-N 3.45Å
768	R	71.5	Confident	74.2	Confident	50 Å²	50	80 Å²	80	19%	0.189	44%	0.44	C	S	.	.			trans	-129	148.6	-172.1	76.7	171.6	-172.1	152.9	-1.4	114.6	R507 E512 L560 P763 R765 D766	R507-R768 PolarHBondContact O-NH2 3.03Å; E512-R768 IonicContact OE1-CZ 2.83Å; E512-R768 IonicContact OE1-NH2 3.28Å; E512-R768 PolarHBondContact OE1-NH2 3.03Å; L560-R768 VanDerWaalsContact CD2-NH1 3.3Å; P763-R768 HydrophobicContact CB-CG 4.01Å; R765-R768 PolarHBondContact O-N 3.04Å; D766-R768 PolarHBondContact O-N 2.71Å
769	G	76.1	Confident	75	Confident	48 Å²	48	80 Å²	80	50%	0.495	44%	0.441	S	S	.	.			trans	-87.6	176.7	164.6	0	0	0	0	0	113.2	I771	G769-I771 VanDerWaalsContact C-N 3.3Å; G769-I771 PolarHBondContact O-N 3.36Å
770	W	79.9	Confident	75.8	Confident	73 Å²	73	85.4 Å²	85.4	28%	0.277	45%	0.449	S	S	.	.	S	Bend	trans	-73.5	-13.5	178.4	-72.1	98	0	0	0	114.6	F515 F761 P763 M838 L840	F515-W770 HydrophobicContact CD1-CE3 4.13Å; F515-W770 AromaticContact CD1-CH2 3.85Å; F515-W770 HydrophobicContact CD1-CH2 3.85Å; F515-W770 AromaticContact CD1-CZ3 3.45Å; F515-W770 HydrophobicContact CD1-CZ3 3.45Å; F515-W770 VanDerWaalsContact CD1-CZ3 3.45Å; F515-W770 HydrophobicContact CE1-CE3 4.11Å; F515-W770 HydrophobicContact CE1-CH2 4.35Å; F515-W770 AromaticContact CE1-CZ3 3.87Å; F515-W770 HydrophobicContact CE1-CZ3 3.87Å; F515-W770 HydrophobicContact CG-CH2 4.39Å; F515-W770 HydrophobicContact CG-CZ3 4.36Å; F761-W770 AromaticContact CD1-CZ2 3.89Å; F761-W770 HydrophobicContact CD1-CZ2 3.89Å; F761-W770 AromaticContact CE1-CH2 3.83Å; F761-W770 HydrophobicContact CE1-CH2 3.83Å; F761-W770 AromaticContact CE1-CZ2 3.4Å; F761-W770 HydrophobicContact CE1-CZ2 3.4Å; F761-W770 AromaticContact CZ-CH2 3.88Å; F761-W770 HydrophobicContact CZ-CH2 3.88Å; F761-W770 AromaticContact CZ-CZ2 3.95Å; F761-W770 HydrophobicContact CZ-CZ2 3.95Å; P763-W770 HydrophobicContact CG-CD2 4.36Å; P763-W770 HydrophobicContact CG-CZ2 4.38Å; W770-M838 CarbonylContact O-C 3.58Å; W770-M838 WeakPolarHBondContact O-CA 3.24Å; W770-M838 VanDerWaalsContact O-O 3.05Å; W770-L840 HydrophobicContact CE3-CD2 4.39Å; W770-L840 HydrophobicContact CZ3-CD2 3.93Å
771	I	84.6	Confident	76.5	Confident	128 Å²	128	88 Å²	88	66%	0.656	45%	0.45	S	S	*	.			trans	-110.7	129.7	-179.3	-61.6	172.4	0	0	0	108.9	G769 I837	G769-I771 VanDerWaalsContact C-N 3.3Å; G769-I771 PolarHBondContact O-N 3.36Å; I771-I837 HydrophobicContact CG2-CG2 4.16Å
772	I	84.3	Confident	77.1	Confident	20 Å²	20	83.8 Å²	83.8	10%	0.103	43%	0.432	C	S	.	.			trans	-106.5	133.4	179.1	-63.6	159	0	0	0	109.7	L560 A564 P774 I837	L560-I772 HydrophobicContact CB-CD1 4.03Å; L560-I772 HydrophobicContact CB-CG2 4.2Å; L560-I772 HydrophobicContact CD2-CD1 3.69Å; L560-I772 HydrophobicContact CD2-CG1 4.12Å; L560-I772 HydrophobicContact CG-CD1 3.89Å; A564-I772 HydrophobicContact CB-CG2 4.41Å; I772-P774 WeakPolarHBondContact O-CD 3.23Å; I772-I837 PolarHBondContact N-O 3.29Å
773	N	81.1	Confident	77.7	Confident	124 Å²	124	80.1 Å²	80.1	66%	0.663	42%	0.419	S	S	*	.			trans	-75.2	122.3	171.9	-70.7	-32.1	0	0	0	110	I775 G776	N773-I775 PolarHBondContact O-N 3.18Å; N773-G776 PolarHBondContact O-N 2.82Å
774	P	74.6	Confident	78.3	Confident	44 Å²	44	84 Å²	84	29%	0.286	44%	0.438	S	S	.	.	S	Bend	trans	-66.1	-36.9	-175.9	23.9	-32.3	0	0	0	112.4	S561 A564 C565 L568 I772	S561-P774 PolarHBondContact OG-O 3.34Å; A564-P774 HydrophobicContact CB-CB 4.37Å; C565-P774 PolarHBondContact SG-O 3.3Å; L568-P774 HydrophobicContact CD1-CB 4.03Å; L568-P774 HydrophobicContact CD1-CG 4.4Å; I772-P774 WeakPolarHBondContact O-CD 3.23Å
775	I	73.3	Confident	79	Confident	126 Å²	126	83.4 Å²	83.4	65%	0.646	44%	0.439	S	S	*	.	S	Bend	trans	-73.4	-30.9	-178.3	-64.4	165.4	0	0	0	111.4	N773	N773-I775 PolarHBondContact O-N 3.18Å
776	G	73.1	Confident	79.8	Confident	36 Å²	36	77.8 Å²	77.8	37%	0.371	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.1	-160.1	169.4	0	0	0	0	0	115.9	N773 N778	N773-G776 PolarHBondContact O-N 2.82Å; G776-N778 PolarHBondContact O-N 3.09Å
777	P	74.3	Confident	81	Confident	116 Å²	116	74 Å²	74	75%	0.753	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	3.9	169.5	33.9	-35.1	0	0	0	113	S558	S558-P777 WeakPolarHBondContact OG-CD 3.46Å; S558-P777 WeakPolarHBondContact OG-CG 3.39Å
778	N	82.3	Confident	82.1	Confident	15 Å²	15	74.2 Å²	74.2	8%	0.08	40%	0.397	C	S	.	.	S	Bend	trans	-80.3	148.3	-176.2	-70.8	-19	0	0	0	110.9	S558 S561 L562 G776 T782	S558-N778 WeakPolarHBondContact CB-OD1 3.28Å; S558-N778 PolarHBondContact N-OD1 3.44Å; S558-N778 PolarHBondContact O-ND2 3.25Å; S558-N778 VanDerWaalsContact O-ND2 3.09Å; S558-N778 PolarHBondContact OG-ND2 2.91Å; S558-N778 PolarHBondContact OG-OD1 3.32Å; S561-N778 PolarHBondContact OG-ND2 3.43Å; L562-N778 PolarHBondContact N-ND2 2.82Å; G776-N778 PolarHBondContact O-N 3.09Å; N778-T782 HydrophobicContact CB-CG2 4.45Å
779	P	84.8	Confident	83	Confident	52 Å²	52	73.9 Å²	73.9	34%	0.338	40%	0.401	S	S	.	.			trans	-68.1	145	176.3	27.4	-32.7	0	0	0	111.2	W781 T782	P779-W781 HydrophobicContact CB-CG 4.49Å; P779-W781 VanDerWaalsContact CB-NE1 3.34Å; P779-W781 HydrophobicContact CG-CD2 4.37Å; P779-W781 HydrophobicContact CG-CZ2 3.74Å; P779-W781 VanDerWaalsContact CG-NE1 3.27Å; P779-W781 PolarHBondContact O-N 3.13Å; P779-T782 HydrophobicContact CG-CG2 3.89Å; P779-T782 WeakPolarHBondContact O-CB 3.5Å; P779-T782 WeakPolarHBondContact O-CG2 3.48Å; P779-T782 PolarHBondContact O-N 2.94Å; P779-T782 PolarHBondContact O-OG1 2.73Å
780	W	83.8	Confident	83.7	Confident	194 Å²	194	71.6 Å²	71.6	74%	0.735	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-29.3	-171	69.8	-87.4	0	0	0	114.9	T782 V783 I784	W780-T782 PolarHBondContact O-N 2.93Å; W780-V783 WeakPolarHBondContact O-CB 3.37Å; W780-V783 PolarHBondContact O-N 3.23Å; W780-V783 VanDerWaalsContact O-N 3.17Å; W780-I784 HydrophobicContact CE3-CD1 4.31Å; W780-I784 HydrophobicContact CZ3-CD1 3.75Å
781	W	85.8	Confident	84.1	Confident	137 Å²	137	72.7 Å²	72.7	52%	0.519	39%	0.388	S	S	.	.	H	α-helix	trans	-63.3	-22.9	178.1	61.5	-102.4	0	0	0	112.9	P779 V783 I784 A785	P779-W781 HydrophobicContact CB-CG 4.49Å; P779-W781 VanDerWaalsContact CB-NE1 3.34Å; P779-W781 HydrophobicContact CG-CD2 4.37Å; P779-W781 HydrophobicContact CG-CZ2 3.74Å; P779-W781 VanDerWaalsContact CG-NE1 3.27Å; P779-W781 PolarHBondContact O-N 3.13Å; W781-V783 PolarHBondContact O-N 3.32Å; W781-I784 PolarHBondContact O-N 3.33Å; W781-A785 HydrophobicContact CE3-CB 4.25Å; W781-A785 HydrophobicContact CZ3-CB 4.42Å; W781-A785 PolarHBondContact O-N 2.94Å
782	T	84	Confident	84.2	Confident	5 Å²	5	69.4 Å²	69.4	3%	0.031	37%	0.372	C	S	.	.	H	α-helix	trans	-63.7	-28.8	176.7	58.8	0	0	0	0	112.5	L557 N778 P779 W780 I784 A785 A786	L557-T782 HydrophobicContact CD1-CG2 4.25Å; L557-T782 HydrophobicContact CD2-CG2 4.08Å; N778-T782 HydrophobicContact CB-CG2 4.45Å; P779-T782 HydrophobicContact CG-CG2 3.89Å; P779-T782 WeakPolarHBondContact O-CB 3.5Å; P779-T782 WeakPolarHBondContact O-CG2 3.48Å; P779-T782 PolarHBondContact O-N 2.94Å; P779-T782 PolarHBondContact O-OG1 2.73Å; W780-T782 PolarHBondContact O-N 2.93Å; T782-I784 VanDerWaalsContact C-N 3.32Å; T782-I784 PolarHBondContact O-N 3.43Å; T782-A785 PolarHBondContact O-N 3.01Å; T782-A786 VanDerWaalsContact O-CB 3.29Å; T782-A786 WeakPolarHBondContact O-CB 3.4Å; T782-A786 PolarHBondContact O-N 2.97Å
783	V	85.6	Confident	84.4	Confident	44 Å²	44	68.6 Å²	68.6	27%	0.267	37%	0.368	S	S	.	.	H	α-helix	trans	-65.3	-37	176.6	-178.6	0	0	0	0	111.2	W569 W780 W781	W569-V783 PolarHBondContact NE1-O 2.89Å; W780-V783 WeakPolarHBondContact O-CB 3.37Å; W780-V783 PolarHBondContact O-N 3.23Å; W780-V783 VanDerWaalsContact O-N 3.17Å; W781-V783 PolarHBondContact O-N 3.32Å
784	I	88.8	Confident	84.9	Confident	101 Å²	101	63 Å²	63	52%	0.518	34%	0.338	S	S	.	.	H	α-helix	trans	-78.7	-42.9	178.1	-60	174.4	0	0	0	110	W780 W781 T782 A786 I787	W780-I784 HydrophobicContact CE3-CD1 4.31Å; W780-I784 HydrophobicContact CZ3-CD1 3.75Å; W781-I784 PolarHBondContact O-N 3.33Å; T782-I784 VanDerWaalsContact C-N 3.32Å; T782-I784 PolarHBondContact O-N 3.43Å; I784-A786 PolarHBondContact O-N 3.42Å; I784-I787 WeakPolarHBondContact O-CB 3.42Å; I784-I787 WeakPolarHBondContact O-CG1 3.36Å; I784-I787 PolarHBondContact O-N 3.34Å
785	A	87.8	Confident	85.5	Confident	45 Å²	45	63.2 Å²	63.2	37%	0.372	34%	0.336	S	S	.	.	H	α-helix	trans	-61.6	-29.5	177.1	0	0	0	0	0	112.8	W781 T782 I787 I788 P789	W781-A785 HydrophobicContact CE3-CB 4.25Å; W781-A785 HydrophobicContact CZ3-CB 4.42Å; W781-A785 PolarHBondContact O-N 2.94Å; T782-A785 PolarHBondContact O-N 3.01Å; A785-I787 PolarHBondContact O-N 3.17Å; A785-I787 VanDerWaalsContact O-N 3.14Å; A785-I788 PolarHBondContact O-N 2.92Å; A785-P789 VanDerWaalsContact O-CD 3.3Å; A785-P789 WeakPolarHBondContact O-CD 3.44Å
786	A	89	Confident	86.1	Confident	2 Å²	2	57.4 Å²	57.4	2%	0.017	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-18	177.4	0	0	0	0	0	114.3	L562 C565 I566 T782 I784 I788 P789 A790	L562-A786 HydrophobicContact CD1-CB 4.42Å; C565-A786 HydrophobicContact CB-CB 4.28Å; I566-A786 HydrophobicContact CG1-CB 3.78Å; T782-A786 VanDerWaalsContact O-CB 3.29Å; T782-A786 WeakPolarHBondContact O-CB 3.4Å; T782-A786 PolarHBondContact O-N 2.97Å; I784-A786 PolarHBondContact O-N 3.42Å; A786-I788 VanDerWaalsContact C-N 3.28Å; A786-I788 PolarHBondContact O-N 2.97Å; A786-P789 WeakPolarHBondContact O-CD 3.45Å; A786-A790 WeakPolarHBondContact O-CB 3.09Å; A786-A790 PolarHBondContact O-N 3.38Å
787	I	91	Very high	86.8	Confident	62 Å²	62	55.8 Å²	55.8	32%	0.318	29%	0.289	S	S	.	.	H	α-helix	trans	-60.9	-36.5	177.9	-65.5	171.5	0	0	0	111.6	W569 I784 A785 A790 L791	W569-I787 HydrophobicContact CD2-CD1 4.46Å; W569-I787 HydrophobicContact CD2-CG1 3.76Å; W569-I787 HydrophobicContact CE3-CG1 4.18Å; W569-I787 HydrophobicContact CG-CG1 4.16Å; W569-I787 HydrophobicContact CH2-CD1 3.98Å; W569-I787 HydrophobicContact CH2-CG1 4.33Å; W569-I787 HydrophobicContact CZ2-CD1 3.78Å; W569-I787 HydrophobicContact CZ2-CG1 3.92Å; W569-I787 HydrophobicContact CZ3-CD1 4.38Å; W569-I787 HydrophobicContact CZ3-CG1 4.44Å; I784-I787 WeakPolarHBondContact O-CB 3.42Å; I784-I787 WeakPolarHBondContact O-CG1 3.36Å; I784-I787 PolarHBondContact O-N 3.34Å; A785-I787 PolarHBondContact O-N 3.17Å; A785-I787 VanDerWaalsContact O-N 3.14Å; I787-A790 PolarHBondContact O-N 3.2Å; I787-L791 WeakPolarHBondContact O-CB 3.28Å; I787-L791 PolarHBondContact O-N 3.49Å
788	I	89.3	Confident	87.5	Confident	137 Å²	137	51.1 Å²	51.1	70%	0.703	26%	0.257	S	S	*	.	H	α-helix	trans	-68	-54.2	-176.9	-62.3	167.2	0	0	0	111	A785 A786 A790 L791 L792	A785-I788 PolarHBondContact O-N 2.92Å; A786-I788 VanDerWaalsContact C-N 3.28Å; A786-I788 PolarHBondContact O-N 2.97Å; I788-A790 PolarHBondContact O-N 2.97Å; I788-L791 PolarHBondContact O-N 2.8Å; I788-L792 PolarHBondContact O-N 3.35Å
789	P	88.5	Confident	87.7	Confident	43 Å²	43	50.9 Å²	50.9	28%	0.279	26%	0.256	S	S	.	.	H	α-helix	trans	-59.3	-35.3	171.6	-23.5	32.3	0	0	0	113.2	F544 I566 A785 A786 L792 C793	F544-P789 HydrophobicContact CE2-CB 4.35Å; F544-P789 HydrophobicContact CZ-CB 4.08Å; I566-P789 HydrophobicContact CD1-CB 4.04Å; I566-P789 HydrophobicContact CD1-CG 4.46Å; I566-P789 HydrophobicContact CG1-CB 4.35Å; I566-P789 HydrophobicContact CG2-CB 4.49Å; A785-P789 VanDerWaalsContact O-CD 3.3Å; A785-P789 WeakPolarHBondContact O-CD 3.44Å; A786-P789 WeakPolarHBondContact O-CD 3.45Å; P789-L792 PolarHBondContact O-N 3.41Å; P789-C793 WeakPolarHBondContact O-CB 3.5Å; P789-C793 PolarHBondContact O-N 3.2Å
790	A	91.7	Very high	87.7	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-64.7	-40	178.2	0	0	0	0	0	112.3	I566 W569 T570 L573 A786 I787 I788 L792 C793 T794	I566-A790 HydrophobicContact CG2-CB 4.23Å; W569-A790 HydrophobicContact CB-CB 3.51Å; T570-A790 HydrophobicContact CG2-CB 3.77Å; T570-A790 VanDerWaalsContact CG2-O 3.27Å; T570-A790 WeakPolarHBondContact CG2-O 3.38Å; L573-A790 HydrophobicContact CD1-CB 4.49Å; A786-A790 WeakPolarHBondContact O-CB 3.09Å; A786-A790 PolarHBondContact O-N 3.38Å; I787-A790 PolarHBondContact O-N 3.2Å; I788-A790 PolarHBondContact O-N 2.97Å; A790-L792 VanDerWaalsContact C-N 3.32Å; A790-L792 PolarHBondContact O-N 3.25Å; A790-C793 PolarHBondContact O-N 3.25Å; A790-T794 WeakPolarHBondContact O-CB 3.21Å; A790-T794 PolarHBondContact O-N 2.88Å; A790-T794 PolarHBondContact O-OG1 3.41Å
791	L	89.5	Confident	87.9	Confident	96 Å²	96	39.6 Å²	39.6	50%	0.503	21%	0.207	S	C	.	.	H	α-helix	trans	-61.4	-43.4	176	-175	147.6	0	0	0	111.2	L573 I787 I788 T794 I795	L573-L791 HydrophobicContact CD1-CB 4.42Å; I787-L791 WeakPolarHBondContact O-CB 3.28Å; I787-L791 PolarHBondContact O-N 3.49Å; I788-L791 PolarHBondContact O-N 2.8Å; L791-T794 WeakPolarHBondContact O-CB 3.33Å; L791-T794 PolarHBondContact O-N 2.97Å; L791-I795 HydrophobicContact CD2-CD1 3.7Å; L791-I795 WeakPolarHBondContact O-CG1 3.43Å; L791-I795 PolarHBondContact O-N 3.48Å; L791-I795 VanDerWaalsContact O-N 3.11Å
792	L	86.4	Confident	88	Confident	59 Å²	59	33.2 Å²	33.2	31%	0.309	18%	0.183	S	C	.	.	H	α-helix	trans	-63.4	-48	177	-166.6	151.5	0	0	0	111.6	F544 I788 P789 A790 T794 I795 L796 I976	F544-L792 HydrophobicContact CD2-CD2 4.44Å; I788-L792 PolarHBondContact O-N 3.35Å; P789-L792 PolarHBondContact O-N 3.41Å; A790-L792 VanDerWaalsContact C-N 3.32Å; A790-L792 PolarHBondContact O-N 3.25Å; L792-T794 VanDerWaalsContact C-N 3.28Å; L792-T794 PolarHBondContact O-N 3.48Å; L792-I795 PolarHBondContact O-N 3.49Å; L792-L796 PolarHBondContact O-N 3.01Å; L792-I976 HydrophobicContact CD1-CG2 3.43Å; L792-I976 VanDerWaalsContact CD1-CG2 3.43Å; L792-I976 HydrophobicContact CD2-CG2 3.24Å; L792-I976 HydrophobicContact CG-CG2 3.95Å
793	C	88.1	Confident	88.1	Confident	3 Å²	3	33 Å²	33	2%	0.02	18%	0.182	C	C	.	.	H	α-helix	trans	-61.9	-37.4	178.6	-176.3	0	0	0	0	111.6	F544 T570 P789 A790 I795 L796 I797 W842	F544-C793 HydrophobicContact CE2-CB 4.3Å; F544-C793 HydrophobicContact CZ-CB 4.12Å; T570-C793 HydrophobicContact CG2-CB 3.62Å; P789-C793 WeakPolarHBondContact O-CB 3.5Å; P789-C793 PolarHBondContact O-N 3.2Å; A790-C793 PolarHBondContact O-N 3.25Å; C793-I795 PolarHBondContact O-N 2.98Å; C793-L796 WeakPolarHBondContact O-CB 3.23Å; C793-L796 PolarHBondContact O-N 3.18Å; C793-I797 WeakPolarHBondContact O-CD1 3.37Å; C793-I797 WeakPolarHBondContact O-CG1 3.36Å; C793-I797 PolarHBondContact O-N 3.41Å; C793-I797 VanDerWaalsContact SG-CD1 3.52Å; C793-W842 VanDerWaalsContact SG-CZ3 3.58Å
794	T	90.6	Very high	88.1	Confident	6 Å²	6	31 Å²	31	4%	0.037	17%	0.17	C	C	.	.	H	α-helix	trans	-60.2	-46.3	174.4	-57.8	0	0	0	0	111.5	L573 L577 A790 L791 L792 L796 I797 F798	L573-T794 HydrophobicContact CB-CG2 3.84Å; L577-T794 HydrophobicContact CD1-CG2 3.7Å; A790-T794 WeakPolarHBondContact O-CB 3.21Å; A790-T794 PolarHBondContact O-N 2.88Å; A790-T794 PolarHBondContact O-OG1 3.41Å; L791-T794 WeakPolarHBondContact O-CB 3.33Å; L791-T794 PolarHBondContact O-N 2.97Å; L792-T794 VanDerWaalsContact C-N 3.28Å; L792-T794 PolarHBondContact O-N 3.48Å; T794-L796 VanDerWaalsContact C-N 3.31Å; T794-L796 PolarHBondContact O-N 3.45Å; T794-I797 PolarHBondContact O-N 3.05Å; T794-F798 WeakPolarHBondContact O-CB 3.02Å; T794-F798 PolarHBondContact O-N 3.29Å
795	I	87.8	Confident	88	Confident	49 Å²	49	26.2 Å²	26.2	25%	0.251	15%	0.145	S	C	.	.	H	α-helix	trans	-62.2	-42.1	177.5	-65.3	168.9	0	0	0	110.3	L791 L792 C793 F798 M799 P979 M980	L791-I795 HydrophobicContact CD2-CD1 3.7Å; L791-I795 WeakPolarHBondContact O-CG1 3.43Å; L791-I795 PolarHBondContact O-N 3.48Å; L791-I795 VanDerWaalsContact O-N 3.11Å; L792-I795 PolarHBondContact O-N 3.49Å; C793-I795 PolarHBondContact O-N 2.98Å; I795-F798 PolarHBondContact O-N 2.99Å; I795-M799 HydrophobicContact CG2-CG 4.31Å; I795-M799 WeakPolarHBondContact O-CB 3.45Å; I795-M799 VanDerWaalsContact O-CG 3.24Å; I795-M799 WeakPolarHBondContact O-CG 3.45Å; I795-M799 PolarHBondContact O-N 2.93Å; I795-P979 HydrophobicContact CG2-CB 3.92Å; I795-M980 HydrophobicContact CD1-SD 4.29Å; I795-M980 HydrophobicContact CG2-SD 4.41Å
796	L	85.9	Confident	87.8	Confident	4 Å²	4	24.7 Å²	24.7	2%	0.021	13%	0.131	C	C	.	.	H	α-helix	trans	-59.9	-52.8	178.1	-172.2	153.3	0	0	0	112	P540 V541 L792 C793 T794 F798 M799 D800 P979	P540-L796 HydrophobicContact CB-CD1 3.79Å; P540-L796 HydrophobicContact CB-CD2 4.27Å; P540-L796 HydrophobicContact CB-CG 4.3Å; V541-L796 HydrophobicContact CG2-CD2 3.78Å; L792-L796 PolarHBondContact O-N 3.01Å; C793-L796 WeakPolarHBondContact O-CB 3.23Å; C793-L796 PolarHBondContact O-N 3.18Å; T794-L796 VanDerWaalsContact C-N 3.31Å; T794-L796 PolarHBondContact O-N 3.45Å; L796-F798 VanDerWaalsContact C-N 3.32Å; L796-F798 PolarHBondContact O-N 3.21Å; L796-M799 PolarHBondContact O-N 3.46Å; L796-D800 PolarHBondContact O-N 3.37Å; L796-P979 VanDerWaalsContact CA-CG 3.5Å; L796-P979 HydrophobicContact CB-CG 3.66Å; L796-P979 HydrophobicContact CD1-CG 4.13Å; L796-P979 HydrophobicContact CG-CG 3.76Å
797	I	88.6	Confident	87.6	Confident	1 Å²	1	25 Å²	25	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-64.4	-39.9	-179.2	-66.4	157	0	0	0	110.9	C793 T794 Q801 V828 L832 V844	C793-I797 WeakPolarHBondContact O-CD1 3.37Å; C793-I797 WeakPolarHBondContact O-CG1 3.36Å; C793-I797 PolarHBondContact O-N 3.41Å; C793-I797 VanDerWaalsContact SG-CD1 3.52Å; T794-I797 PolarHBondContact O-N 3.05Å; I797-Q801 VanDerWaalsContact O-CB 3.23Å; I797-Q801 WeakPolarHBondContact O-CB 3.38Å; I797-Q801 PolarHBondContact O-N 3.44Å; I797-V828 HydrophobicContact CG2-CG1 3.97Å; I797-L832 HydrophobicContact CD1-CD1 3.22Å; I797-L832 HydrophobicContact CG1-CD1 4.41Å; I797-V844 HydrophobicContact CB-CG2 4.49Å; I797-V844 HydrophobicContact CG1-CG2 3.95Å; I797-V844 HydrophobicContact CG2-CG1 4.46Å; I797-V844 HydrophobicContact CG2-CG2 4.21Å
798	F	89	Confident	87.3	Confident	19 Å²	19	22.1 Å²	22.1	8%	0.083	12%	0.118	C	C	.	.	H	α-helix	trans	-61.2	-47.2	177.1	177.8	-96.5	0	0	0	111.8	L577 A582 T794 I795 L796 Q802 L825	L577-F798 HydrophobicContact CD1-CB 4.44Å; L577-F798 HydrophobicContact CD1-CD2 4Å; L577-F798 HydrophobicContact CD1-CG 4.3Å; A582-F798 HydrophobicContact CB-CE2 4.33Å; A582-F798 HydrophobicContact CB-CZ 4.45Å; T794-F798 WeakPolarHBondContact O-CB 3.02Å; T794-F798 PolarHBondContact O-N 3.29Å; I795-F798 PolarHBondContact O-N 2.99Å; L796-F798 VanDerWaalsContact C-N 3.32Å; L796-F798 PolarHBondContact O-N 3.21Å; F798-Q802 HydrophobicContact CD2-CG 4.1Å; F798-Q802 HydrophobicContact CE1-CG 4.33Å; F798-Q802 HydrophobicContact CE2-CG 3.83Å; F798-Q802 HydrophobicContact CG-CG 4.47Å; F798-Q802 HydrophobicContact CZ-CG 3.96Å; F798-Q802 WeakPolarHBondContact O-CB 3.46Å; F798-Q802 VanDerWaalsContact O-CG 3.24Å; F798-Q802 WeakPolarHBondContact O-CG 3.45Å; F798-Q802 PolarHBondContact O-N 3.11Å; F798-L825 HydrophobicContact CD2-CD1 4.22Å; F798-L825 HydrophobicContact CD2-CD2 3.74Å; F798-L825 HydrophobicContact CE2-CD2 3.88Å
799	M	84.9	Confident	87	Confident	9 Å²	9	16.8 Å²	16.8	4%	0.044	9%	0.09	C	C	.	.	H	α-helix	trans	-66.2	-47.9	-179.5	-68.4	-65.7	-79.6	0	0	111.6	I795 L796 Q801 Q802 I803 P979 V982 L983	I795-M799 HydrophobicContact CG2-CG 4.31Å; I795-M799 WeakPolarHBondContact O-CB 3.45Å; I795-M799 VanDerWaalsContact O-CG 3.24Å; I795-M799 WeakPolarHBondContact O-CG 3.45Å; I795-M799 PolarHBondContact O-N 2.93Å; L796-M799 PolarHBondContact O-N 3.46Å; M799-Q801 PolarHBondContact O-N 2.86Å; M799-Q802 PolarHBondContact O-N 3.11Å; M799-I803 HydrophobicContact CB-CD1 4.39Å; M799-I803 HydrophobicContact CE-CD1 4.38Å; M799-I803 WeakPolarHBondContact O-CB 3.44Å; M799-I803 WeakPolarHBondContact O-CD1 3.46Å; M799-I803 WeakPolarHBondContact O-CG1 3.49Å; M799-I803 PolarHBondContact O-N 3.22Å; M799-P979 HydrophobicContact CB-CB 4.24Å; M799-P979 HydrophobicContact CG-CB 4.02Å; M799-V982 HydrophobicContact CE-CB 3.89Å; M799-V982 HydrophobicContact CE-CG1 3.76Å; M799-L983 HydrophobicContact CE-CD2 3.56Å; M799-L983 HydrophobicContact CE-CG 3.61Å; M799-L983 HydrophobicContact SD-CD2 3.87Å; M799-L983 HydrophobicContact SD-CG 4.16Å
800	D	84.7	Confident	86.5	Confident	10 Å²	10	16.6 Å²	16.6	5%	0.053	8%	0.084	C	C	.	.	H	α-helix	trans	-61.2	-44	179.5	-84	4.8	0	0	0	111.5	L796 T804 V844	L796-D800 PolarHBondContact O-N 3.37Å; D800-T804 WeakPolarHBondContact O-CB 3.33Å; D800-T804 PolarHBondContact O-N 3.49Å; D800-T804 PolarHBondContact O-OG1 2.97Å; D800-V844 HydrophobicContact CB-CG1 3.64Å
801	Q	89.4	Confident	85.5	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-66.2	-47.8	179.4	-174.8	63.6	31.8	0	0	112.2	Y524 I797 M799 T804 A805 V828	Y524-Q801 PolarHBondContact OH-NE2 3.39Å; I797-Q801 VanDerWaalsContact O-CB 3.23Å; I797-Q801 WeakPolarHBondContact O-CB 3.38Å; I797-Q801 PolarHBondContact O-N 3.44Å; M799-Q801 PolarHBondContact O-N 2.86Å; Q801-T804 PolarHBondContact O-N 2.97Å; Q801-A805 WeakPolarHBondContact O-CB 3.36Å; Q801-A805 PolarHBondContact O-N 3.32Å; Q801-V828 HydrophobicContact CG-CG2 4.47Å
802	Q	87.5	Confident	84.7	Confident	2 Å²	2	23 Å²	23	1%	0.009	11%	0.109	C	C	.	.	H	α-helix	trans	-72.8	-40	-174.2	-67	-59.4	-21.7	0	0	112.4	S583 V586 F798 M799 T804 A805 V806	S583-Q802 PolarHBondContact OG-NE2 3.19Å; V586-Q802 HydrophobicContact CG2-CB 3.69Å; V586-Q802 HydrophobicContact CG2-CG 3.8Å; F798-Q802 HydrophobicContact CD2-CG 4.1Å; F798-Q802 HydrophobicContact CE1-CG 4.33Å; F798-Q802 HydrophobicContact CE2-CG 3.83Å; F798-Q802 HydrophobicContact CG-CG 4.47Å; F798-Q802 HydrophobicContact CZ-CG 3.96Å; F798-Q802 WeakPolarHBondContact O-CB 3.46Å; F798-Q802 VanDerWaalsContact O-CG 3.24Å; F798-Q802 WeakPolarHBondContact O-CG 3.45Å; F798-Q802 PolarHBondContact O-N 3.11Å; M799-Q802 PolarHBondContact O-N 3.11Å; Q802-T804 VanDerWaalsContact C-N 3.31Å; Q802-T804 PolarHBondContact O-N 3.11Å; Q802-A805 PolarHBondContact O-N 3.01Å; Q802-V806 WeakPolarHBondContact O-CG2 3.29Å; Q802-V806 PolarHBondContact O-N 3.29Å
803	I	85.2	Confident	84.3	Confident	2 Å²	2	21.8 Å²	21.8	1%	0.01	10%	0.102	C	C	.	.	H	α-helix	trans	-62	-44.1	175.6	-65	164.2	0	0	0	109.8	I589 F597 M799 A805 V806 I807 V982	I589-I803 HydrophobicContact CD1-CG1 3.95Å; F597-I803 HydrophobicContact CB-CG2 4.4Å; F597-I803 HydrophobicContact CD1-CB 4.39Å; F597-I803 HydrophobicContact CD1-CD1 4.48Å; F597-I803 HydrophobicContact CD1-CG2 3.39Å; F597-I803 HydrophobicContact CD2-CD1 4.37Å; F597-I803 HydrophobicContact CE1-CB 4.35Å; F597-I803 HydrophobicContact CE1-CD1 4.47Å; F597-I803 HydrophobicContact CE1-CG2 3.77Å; F597-I803 HydrophobicContact CE2-CD1 4.36Å; F597-I803 HydrophobicContact CG-CD1 4.41Å; F597-I803 HydrophobicContact CG-CG2 4.03Å; F597-I803 HydrophobicContact CZ-CD1 4.41Å; M799-I803 HydrophobicContact CB-CD1 4.39Å; M799-I803 HydrophobicContact CE-CD1 4.38Å; M799-I803 WeakPolarHBondContact O-CB 3.44Å; M799-I803 WeakPolarHBondContact O-CD1 3.46Å; M799-I803 WeakPolarHBondContact O-CG1 3.49Å; M799-I803 PolarHBondContact O-N 3.22Å; I803-A805 VanDerWaalsContact C-N 3.34Å; I803-A805 PolarHBondContact O-N 3.48Å; I803-V806 PolarHBondContact O-N 2.83Å; I803-I807 HydrophobicContact CG2-CD1 3.78Å; I803-I807 HydrophobicContact CG2-CG1 4.41Å; I803-I807 VanDerWaalsContact O-CG1 3.28Å; I803-I807 WeakPolarHBondContact O-CG1 3.37Å; I803-I807 PolarHBondContact O-N 3.34Å; I803-V982 HydrophobicContact CD1-CG1 3.79Å
804	T	86.7	Confident	83.8	Confident	2 Å²	2	26.8 Å²	26.8	1%	0.012	12%	0.123	C	C	.	.	H	α-helix	trans	-62	-42.3	177.1	-53.6	0	0	0	0	112	T533 D800 Q801 Q802 V806 I807 I808 A845 T847	T533-T804 HydrophobicContact CG2-CG2 4.15Å; D800-T804 WeakPolarHBondContact O-CB 3.33Å; D800-T804 PolarHBondContact O-N 3.49Å; D800-T804 PolarHBondContact O-OG1 2.97Å; Q801-T804 PolarHBondContact O-N 2.97Å; Q802-T804 VanDerWaalsContact C-N 3.31Å; Q802-T804 PolarHBondContact O-N 3.11Å; T804-V806 VanDerWaalsContact C-N 3.34Å; T804-V806 PolarHBondContact O-N 3Å; T804-I807 PolarHBondContact O-N 3.44Å; T804-I808 HydrophobicContact CG2-CD1 3.86Å; T804-I808 WeakPolarHBondContact O-CD1 3.42Å; T804-I808 WeakPolarHBondContact O-CG1 3.46Å; T804-I808 PolarHBondContact O-N 3.14Å; T804-I808 VanDerWaalsContact O-N 3.14Å; T804-A845 HydrophobicContact CG2-CB 3.75Å; T804-T847 HydrophobicContact CG2-CG2 3.99Å; T804-T847 WeakPolarHBondContact OG1-CG2 3.44Å
805	A	86.2	Confident	83.3	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-62.4	-39.2	177.5	0	0	0	0	0	112.3	Q801 Q802 I803 N809 Y821	Q801-A805 WeakPolarHBondContact O-CB 3.36Å; Q801-A805 PolarHBondContact O-N 3.32Å; Q802-A805 PolarHBondContact O-N 3.01Å; I803-A805 VanDerWaalsContact C-N 3.34Å; I803-A805 PolarHBondContact O-N 3.48Å; A805-N809 VanDerWaalsContact O-CB 3.26Å; A805-N809 WeakPolarHBondContact O-CB 3.49Å; A805-N809 PolarHBondContact O-N 3.44Å; A805-N809 PolarHBondContact O-ND2 3.29Å; A805-Y821 HydrophobicContact CB-CD1 3.71Å; A805-Y821 HydrophobicContact CB-CE1 3.78Å
806	V	83.4	Confident	82.7	Confident	12 Å²	12	34.5 Å²	34.5	7%	0.073	16%	0.156	C	C	.	.	H	α-helix	trans	-65.3	-45.4	175.8	174	0	0	0	0	111.6	V586 Q802 I803 T804 I808 N809 R810 Y821	V586-V806 HydrophobicContact CG1-CG2 3.06Å; Q802-V806 WeakPolarHBondContact O-CG2 3.29Å; Q802-V806 PolarHBondContact O-N 3.29Å; I803-V806 PolarHBondContact O-N 2.83Å; T804-V806 VanDerWaalsContact C-N 3.34Å; T804-V806 PolarHBondContact O-N 3Å; V806-I808 VanDerWaalsContact C-N 3.28Å; V806-I808 PolarHBondContact O-N 3.24Å; V806-N809 CarbonylContact O-C 3.54Å; V806-N809 PolarHBondContact O-N 3.15Å; V806-R810 PolarHBondContact O-N 3.19Å; V806-Y821 HydrophobicContact CG2-CE1 4.17Å
807	I	84.6	Confident	82.5	Confident	9 Å²	9	35.5 Å²	35.5	5%	0.046	16%	0.16	C	C	.	.	H	α-helix	trans	-57.5	-44.5	-179.5	-68.1	164.5	0	0	0	110.9	E594 A598 I803 T804 R810 T847 I851	E594-I807 HydrophobicContact CG-CD1 4.21Å; E594-I807 HydrophobicContact CG-CG1 3.38Å; E594-I807 WeakPolarHBondContact OE1-CA 3.46Å; E594-I807 WeakPolarHBondContact OE1-CG1 3.43Å; A598-I807 HydrophobicContact CB-CD1 4.29Å; I803-I807 HydrophobicContact CG2-CD1 3.78Å; I803-I807 HydrophobicContact CG2-CG1 4.41Å; I803-I807 VanDerWaalsContact O-CG1 3.28Å; I803-I807 WeakPolarHBondContact O-CG1 3.37Å; I803-I807 PolarHBondContact O-N 3.34Å; T804-I807 PolarHBondContact O-N 3.44Å; I807-R810 WeakPolarHBondContact O-CB 3.43Å; I807-T847 HydrophobicContact CD1-CG2 4.12Å; I807-I851 HydrophobicContact CG2-CD1 3.8Å; I807-I851 HydrophobicContact CG2-CG1 3.83Å
808	I	85.1	Confident	81.5	Confident	2 Å²	2	36.3 Å²	36.3	1%	0.01	17%	0.169	C	C	.	.	H	α-helix	trans	-70.6	-40.2	-179.9	-64.3	163	0	0	0	110.8	Q530 L532 T533 T804 V806 R810 H813 L815 S850 V854	Q530-I808 HydrophobicContact CG-CG2 3.76Å; L532-I808 HydrophobicContact CB-CG2 4.14Å; T533-I808 HydrophobicContact CG2-CD1 4.02Å; T533-I808 WeakPolarHBondContact OG1-CD1 3.43Å; T804-I808 HydrophobicContact CG2-CD1 3.86Å; T804-I808 WeakPolarHBondContact O-CD1 3.42Å; T804-I808 WeakPolarHBondContact O-CG1 3.46Å; T804-I808 PolarHBondContact O-N 3.14Å; T804-I808 VanDerWaalsContact O-N 3.14Å; V806-I808 VanDerWaalsContact C-N 3.28Å; V806-I808 PolarHBondContact O-N 3.24Å; I808-R810 PolarHBondContact O-N 3.24Å; I808-R810 VanDerWaalsContact O-N 3.09Å; I808-H813 PolarHBondContact O-CD2 3.04Å; I808-L815 WeakPolarHBondContact O-CD1 3.49Å; I808-S850 VanDerWaalsContact CD1-CB 3.47Å; I808-V854 HydrophobicContact CG2-CG2 3.93Å
809	N	83.1	Confident	81	Confident	24 Å²	24	35.8 Å²	35.8	13%	0.128	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	19.3	-177.1	-65.8	-32.7	0	0	0	113.7	Q530 A805 V806 K811 C819	Q530-N809 PolarHBondContact NE2-OD1 3.47Å; A805-N809 VanDerWaalsContact O-CB 3.26Å; A805-N809 WeakPolarHBondContact O-CB 3.49Å; A805-N809 PolarHBondContact O-N 3.44Å; A805-N809 PolarHBondContact O-ND2 3.29Å; V806-N809 CarbonylContact O-C 3.54Å; V806-N809 PolarHBondContact O-N 3.15Å; N809-K811 PolarHBondContact O-N 3.28Å; N809-C819 HydrophobicContact CB-CB 4.42Å; N809-C819 WeakPolarHBondContact ND2-CB 3.44Å
810	R	78	Confident	81	Confident	40 Å²	40	35.3 Å²	35.3	15%	0.151	17%	0.165	C	C	.	.			trans	-61.1	134.2	178.6	-166.8	170.2	171.4	-174.6	-16.9	110.7	E595 V806 I807 I808 E812 H813	E595-R810 IonicContact OE1-NH2 3.94Å; V806-R810 PolarHBondContact O-N 3.19Å; I807-R810 WeakPolarHBondContact O-CB 3.43Å; I808-R810 PolarHBondContact O-N 3.24Å; I808-R810 VanDerWaalsContact O-N 3.09Å; R810-E812 HydrophobicContact CG-CB 4.03Å; R810-E812 HydrophobicContact CG-CG 4.12Å; R810-E812 IonicContact CZ-OE1 2.78Å; R810-E812 IonicContact CZ-OE2 3.81Å; R810-E812 IonicContact NE-OE1 3.9Å; R810-E812 PolarHBondContact NE-OE1 3.46Å; R810-E812 IonicContact NE-OE2 3.44Å; R810-E812 PolarHBondContact NE-OE2 2.86Å; R810-E812 VanDerWaalsContact NE-OE2 3.16Å; R810-E812 IonicContact NH2-OE1 3.78Å; R810-E812 PolarHBondContact NH2-OE1 2.92Å; R810-E812 IonicContact NH2-OE2 3.51Å; R810-E812 PolarHBondContact NH2-OE2 2.67Å; R810-E812 PolarHBondContact O-N 2.97Å; R810-E812 VanDerWaalsContact O-N 3.08Å; R810-H813 WeakPolarHBondContact O-CB 3.42Å; R810-H813 PolarHBondContact O-N 3.44Å
811	K	71.3	Confident	81.1	Confident	157 Å²	157	35.7 Å²	35.7	68%	0.683	17%	0.166	S	C	*	.	G	3₁₀ helix	trans	-59.1	-25.1	178.6	-67.5	178.7	-178.5	170.4	0	113.1	N809 H813 K814	N809-K811 PolarHBondContact O-N 3.28Å; K811-H813 PolarHBondContact O-N 2.91Å; K811-K814 PolarHBondContact O-N 3.46Å
812	E	72.6	Confident	81.1	Confident	72 Å²	72	36 Å²	36	34%	0.336	17%	0.167	S	C	.	.	G	3₁₀ helix	trans	-61.8	-29.3	175.5	-67.8	179.8	-151.5	0	0	113.4	R591 R810 K814 F872 L1007	R591-E812 IonicContact CZ-OE1 2.78Å; R591-E812 IonicContact NH1-OE1 2.98Å; R591-E812 IonicContact NH2-OE1 3.71Å; R591-E812 PolarHBondContact NH2-OE1 2.93Å; R810-E812 HydrophobicContact CG-CB 4.03Å; R810-E812 HydrophobicContact CG-CG 4.12Å; R810-E812 IonicContact CZ-OE1 2.78Å; R810-E812 IonicContact CZ-OE2 3.81Å; R810-E812 IonicContact NE-OE1 3.9Å; R810-E812 PolarHBondContact NE-OE1 3.46Å; R810-E812 IonicContact NE-OE2 3.44Å; R810-E812 PolarHBondContact NE-OE2 2.86Å; R810-E812 VanDerWaalsContact NE-OE2 3.16Å; R810-E812 IonicContact NH2-OE1 3.78Å; R810-E812 PolarHBondContact NH2-OE1 2.92Å; R810-E812 IonicContact NH2-OE2 3.51Å; R810-E812 PolarHBondContact NH2-OE2 2.67Å; R810-E812 PolarHBondContact O-N 2.97Å; R810-E812 VanDerWaalsContact O-N 3.08Å; E812-K814 PolarHBondContact O-N 2.99Å; E812-F872 VanDerWaalsContact O-CE1 3.24Å; E812-F872 WeakPolarHBondContact O-CE1 3.35Å; E812-L1007 HydrophobicContact CG-CD1 4.11Å; E812-L1007 WeakPolarHBondContact OE1-CD1 3.26Å
813	H	77.6	Confident	81.3	Confident	35 Å²	35	37.2 Å²	37.2	16%	0.162	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-73.4	-6.4	176.8	-71.2	-42.4	0	0	0	112.9	I808 R810 K811 L815 F872 I875	I808-H813 PolarHBondContact O-CD2 3.04Å; R810-H813 WeakPolarHBondContact O-CB 3.42Å; R810-H813 PolarHBondContact O-N 3.44Å; K811-H813 PolarHBondContact O-N 2.91Å; H813-L815 HydrophobicContact CB-CD2 4.45Å; H813-L815 HydrophobicContact CB-CG 4.03Å; H813-L815 PolarHBondContact O-N 2.98Å; H813-L815 VanDerWaalsContact O-N 3.17Å; H813-F872 WeakPolarHBondContact O-CZ 3.31Å; H813-I875 HydrophobicContact CB-CD1 3.39Å; H813-I875 WeakPolarHBondContact ND1-CD1 3.5Å
814	K	77.7	Confident	81.6	Confident	108 Å²	108	37.1 Å²	37.1	47%	0.47	17%	0.173	S	C	.	.			trans	47.6	41.8	179	-60.5	-178.9	-176	175.8	0	112.5	K811 E812 F872	K811-K814 PolarHBondContact O-N 3.46Å; E812-K814 PolarHBondContact O-N 2.99Å; K814-F872 HydrophobicContact CB-CE1 4.27Å; K814-F872 HydrophobicContact CD-CD1 4.09Å; K814-F872 HydrophobicContact CD-CE1 4.2Å; K814-F872 HydrophobicContact CG-CD1 4.47Å; K814-F872 HydrophobicContact CG-CE1 4.14Å; K814-F872 PolarHBondContact NZ-O 3.44Å
815	L	80.2	Confident	81.8	Confident	40 Å²	40	37 Å²	37	21%	0.209	17%	0.173	C	C	.	.			trans	-62.2	136.4	175.8	-66.4	176	0	0	0	109.8	L532 I808 H813 I875 E877	L532-L815 HydrophobicContact CD1-CD2 4.07Å; I808-L815 WeakPolarHBondContact O-CD1 3.49Å; H813-L815 HydrophobicContact CB-CD2 4.45Å; H813-L815 HydrophobicContact CB-CG 4.03Å; H813-L815 PolarHBondContact O-N 2.98Å; H813-L815 VanDerWaalsContact O-N 3.17Å; L815-I875 HydrophobicContact CD2-CB 4.07Å; L815-I875 HydrophobicContact CD2-CG2 4.22Å; L815-E877 WeakPolarHBondContact CB-OE1 3.31Å; L815-E877 HydrophobicContact CD2-CG 3.8Å; L815-E877 WeakPolarHBondContact CD2-OE1 3.47Å
816	K	75.1	Confident	82.1	Confident	176 Å²	176	38.5 Å²	38.5	77%	0.765	18%	0.18	S	C	*	.			trans	-99.7	-32.3	-172.6	-68.6	-176.8	-179.4	178.1	0	111.8	E877	K816-E877 PolarHBondContact N-OE2 3.26Å
817	K	81.4	Confident	82.5	Confident	26 Å²	26	38.7 Å²	38.7	11%	0.113	18%	0.181	C	C	.	.	S	Bend	trans	-88	138.8	179.8	-60.1	168.6	-169.6	174.4	0	108.3	W465 S468 D469 D472 E877	W465-K817 HydrophobicContact CB-CD 4.11Å; W465-K817 HydrophobicContact CB-CG 4.28Å; W465-K817 HydrophobicContact CD2-CG 3.96Å; W465-K817 HydrophobicContact CE3-CD 4.45Å; W465-K817 HydrophobicContact CE3-CG 4.1Å; W465-K817 HydrophobicContact CG-CD 4.4Å; W465-K817 HydrophobicContact CG-CG 4.04Å; S468-K817 PolarHBondContact OG-NZ 3.27Å; D469-K817 WeakPolarHBondContact OD1-CD 3.25Å; D469-K817 WeakPolarHBondContact OD1-CE 3Å; D469-K817 IonicContact OD1-NZ 3.11Å; D469-K817 PolarHBondContact OD1-NZ 3.28Å; D472-K817 IonicContact OD2-NZ 3.64Å; D472-K817 PolarHBondContact OD2-NZ 2.97Å; K817-E877 WeakPolarHBondContact CB-OE2 3.44Å; K817-E877 HydrophobicContact CD-CB 3.78Å; K817-E877 WeakPolarHBondContact CG-OE2 3.31Å; K817-E877 PolarHBondContact N-OE2 3.46Å; K817-E877 PolarHBondContact NZ-O 2.99Å
818	G	68.6	Low	82.9	Confident	18 Å²	18	38.4 Å²	38.4	19%	0.186	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-63.4	154.5	-176.8	0	0	0	0	0	113.1	K462	K462-G818 WeakPolarHBondContact CE-O 3.48Å; K462-G818 PolarHBondContact NZ-O 3.4Å
819	C	77.7	Confident	83.3	Confident	7 Å²	7	38.4 Å²	38.4	5%	0.047	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-79.8	171.9	-179.9	71.7	0	0	0	0	112.2	E444 N809 Y821	E444-C819 PolarHBondContact OE1-N 3.33Å; E444-C819 PolarHBondContact OE2-SG 3.04Å; N809-C819 HydrophobicContact CB-CB 4.42Å; N809-C819 WeakPolarHBondContact ND2-CB 3.44Å; C819-Y821 HydrophobicContact CB-CE2 4.09Å; C819-Y821 WeakPolarHBondContact SG-CE2 3.5Å
820	G	84.9	Confident	83.8	Confident	0 Å²	0	41 Å²	41	0%	0	19%	0.192	C	C	.	.			trans	-154.8	78.9	178.4	0	0	0	0	0	112.6	D458 K462 D824	D458-G820 WeakPolarHBondContact OD2-CA 3.41Å; K462-G820 VanDerWaalsContact NZ-N 3.18Å; G820-D824 PolarHBondContact O-N 2.98Å
821	Y	87.4	Confident	84.6	Confident	18 Å²	18	40.2 Å²	40.2	7%	0.071	19%	0.191	C	C	.	.	H	α-helix	trans	-70.4	-36.2	-174.6	-62.7	-79.1	0	0	0	113.5	L445 D458 A805 V806 C819 L825	L445-Y821 HydrophobicContact CD1-CD2 4.49Å; L445-Y821 HydrophobicContact CD1-CE2 3.86Å; L445-Y821 HydrophobicContact CD2-CD2 4.24Å; L445-Y821 HydrophobicContact CD2-CE2 4.19Å; L445-Y821 HydrophobicContact CG-CD2 4.22Å; L445-Y821 HydrophobicContact CG-CE2 4.07Å; D458-Y821 PolarHBondContact OD2-N 3.15Å; A805-Y821 HydrophobicContact CB-CD1 3.71Å; A805-Y821 HydrophobicContact CB-CE1 3.78Å; V806-Y821 HydrophobicContact CG2-CE1 4.17Å; C819-Y821 HydrophobicContact CB-CE2 4.09Å; C819-Y821 WeakPolarHBondContact SG-CE2 3.5Å; Y821-L825 PolarHBondContact O-N 3.21Å
822	H	89.6	Confident	85.6	Confident	7 Å²	7	33 Å²	33	3%	0.032	16%	0.16	C	C	.	.	H	α-helix	trans	-75.9	-38.4	-178.4	-61.1	88.2	0	0	0	110.7	L455 D458 V578 D581 S583 L825 L826	L455-H822 HydrophobicContact CB-CB 4.33Å; L455-H822 HydrophobicContact CD1-CB 4.35Å; D458-H822 WeakPolarHBondContact OD2-CB 3.24Å; D458-H822 IonicContact OD2-CG 3.96Å; D458-H822 PolarHBondContact OD2-N 3.11Å; D458-H822 IonicContact OD2-ND1 3.87Å; D458-H822 PolarHBondContact OD2-ND1 2.9Å; V578-H822 HydrophobicContact CG1-CB 4.42Å; D581-H822 IonicContact OD1-NE2 2.7Å; S583-H822 WeakPolarHBondContact CB-NE2 3.31Å; H822-L825 PolarHBondContact O-N 3.23Å; H822-L826 WeakPolarHBondContact O-CB 3.45Å; H822-L826 PolarHBondContact O-N 3.27Å
823	L	90.3	Very high	86.6	Confident	26 Å²	26	30 Å²	30	14%	0.136	15%	0.148	C	C	.	.	H	α-helix	trans	-64.5	-41.3	177.2	-175.2	60.8	0	0	0	111.5	L455 D458 I459 L826 M827	L455-L823 HydrophobicContact CD1-CB 4.14Å; L455-L823 HydrophobicContact CD1-CD1 4.01Å; D458-L823 HydrophobicContact CB-CB 4.36Å; I459-L823 HydrophobicContact CD1-CD1 4.46Å; I459-L823 HydrophobicContact CG1-CD1 4.13Å; I459-L823 HydrophobicContact CG1-CD2 4.36Å; L823-L826 PolarHBondContact O-N 3.07Å; L823-M827 WeakPolarHBondContact O-CB 3.18Å; L823-M827 PolarHBondContact O-N 2.7Å
824	D	91.3	Very high	87.3	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-62.1	-47.2	175.7	-71.6	-16.6	0	0	0	111.7	Y524 A528 G529 Q530 G820 L826 M827 V828	Y524-D824 HydrophobicContact CE2-CB 4.48Å; Y524-D824 PolarHBondContact OH-OD1 3.49Å; A528-D824 WeakPolarHBondContact CB-OD1 3.08Å; G529-D824 WeakPolarHBondContact CA-OD1 3.5Å; G529-D824 PolarHBondContact N-OD1 3.5Å; Q530-D824 WeakPolarHBondContact CB-OD2 3.46Å; Q530-D824 PolarHBondContact N-OD1 2.78Å; Q530-D824 PolarHBondContact N-OD2 3.48Å; Q530-D824 VanDerWaalsContact N-OD2 3.14Å; G820-D824 PolarHBondContact O-N 2.98Å; D824-L826 PolarHBondContact O-N 3.24Å; D824-M827 PolarHBondContact O-N 3.05Å; D824-V828 WeakPolarHBondContact O-CG2 3.33Å; D824-V828 PolarHBondContact O-N 3.48Å; D824-V828 VanDerWaalsContact O-N 3.09Å
825	L	90.9	Very high	87.9	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-64.4	-40.6	179.1	-177	63.4	0	0	0	112.2	L577 V578 F798 Y821 H822 V828 A829	L577-L825 HydrophobicContact CB-CD2 4.47Å; V578-L825 HydrophobicContact CG2-CB 3.96Å; V578-L825 HydrophobicContact CG2-CD2 3.66Å; V578-L825 HydrophobicContact CG2-CG 3.7Å; F798-L825 HydrophobicContact CD2-CD1 4.22Å; F798-L825 HydrophobicContact CD2-CD2 3.74Å; F798-L825 HydrophobicContact CE2-CD2 3.88Å; Y821-L825 PolarHBondContact O-N 3.21Å; H822-L825 PolarHBondContact O-N 3.23Å; L825-V828 PolarHBondContact O-N 2.98Å; L825-A829 WeakPolarHBondContact O-CB 3.24Å; L825-A829 PolarHBondContact O-N 2.69Å
826	L	92.7	Very high	88.5	Confident	30 Å²	30	23.8 Å²	23.8	16%	0.157	12%	0.123	C	C	.	.	H	α-helix	trans	-61.8	-45.2	176.1	-179.6	67.6	0	0	0	111.2	L455 I575 V578 H822 L823 D824 V828 A829 I830	L455-L826 HydrophobicContact CD1-CB 4.42Å; L455-L826 HydrophobicContact CD1-CD2 3.83Å; L455-L826 HydrophobicContact CD2-CD2 3.65Å; L455-L826 HydrophobicContact CG-CD2 4.39Å; I575-L826 HydrophobicContact CG1-CD1 4.3Å; V578-L826 HydrophobicContact CG1-CB 4.36Å; V578-L826 HydrophobicContact CG2-CB 4.25Å; H822-L826 WeakPolarHBondContact O-CB 3.45Å; H822-L826 PolarHBondContact O-N 3.27Å; L823-L826 PolarHBondContact O-N 3.07Å; D824-L826 PolarHBondContact O-N 3.24Å; L826-V828 VanDerWaalsContact C-N 3.33Å; L826-V828 PolarHBondContact O-N 3.4Å; L826-A829 WeakPolarHBondContact O-CB 3.46Å; L826-A829 PolarHBondContact O-N 2.66Å; L826-I830 HydrophobicContact CD1-CD1 4.28Å; L826-I830 HydrophobicContact CD1-CG1 4.48Å; L826-I830 HydrophobicContact CG-CD1 4.01Å; L826-I830 WeakPolarHBondContact O-CG1 3.34Å; L826-I830 PolarHBondContact O-N 3.42Å
827	M	92.8	Very high	89.3	Confident	17 Å²	17	18.8 Å²	18.8	8%	0.084	10%	0.104	C	C	.	.	H	α-helix	trans	-64.6	-40.9	-177.7	-168.2	56.6	-162.5	0	0	111.6	A523 Y524 F527 L823 D824 I830 M831	A523-M827 VanDerWaalsContact C-CE 3.47Å; A523-M827 HydrophobicContact CB-CE 3.39Å; A523-M827 WeakPolarHBondContact O-CE 3.44Å; Y524-M827 HydrophobicContact CD2-CB 4.32Å; Y524-M827 HydrophobicContact CD2-CG 4.15Å; F527-M827 HydrophobicContact CB-CE 4.32Å; F527-M827 HydrophobicContact CB-CG 4.39Å; F527-M827 HydrophobicContact CB-SD 3.86Å; F527-M827 HydrophobicContact CD2-CE 4.02Å; F527-M827 HydrophobicContact CD2-SD 4.47Å; L823-M827 WeakPolarHBondContact O-CB 3.18Å; L823-M827 PolarHBondContact O-N 2.7Å; D824-M827 PolarHBondContact O-N 3.05Å; M827-I830 PolarHBondContact O-N 3.3Å; M827-M831 HydrophobicContact CE-CE 3.78Å; M827-M831 HydrophobicContact CE-CG 3.76Å; M827-M831 HydrophobicContact CE-SD 3.94Å; M827-M831 WeakPolarHBondContact O-CB 3.17Å; M827-M831 WeakPolarHBondContact O-CG 3.18Å; M827-M831 PolarHBondContact O-N 2.73Å
828	V	92.6	Very high	89.6	Confident	3 Å²	3	19.3 Å²	19.3	2%	0.018	11%	0.107	C	C	.	.	H	α-helix	trans	-62.6	-41.7	173.2	173.6	0	0	0	0	111.2	Y524 L535 I797 Q801 D824 L825 L826 I830 M831 L832	Y524-V828 HydrophobicContact CD2-CG2 4.1Å; Y524-V828 HydrophobicContact CE2-CG2 3.86Å; L535-V828 HydrophobicContact CD2-CG2 4.11Å; I797-V828 HydrophobicContact CG2-CG1 3.97Å; Q801-V828 HydrophobicContact CG-CG2 4.47Å; D824-V828 WeakPolarHBondContact O-CG2 3.33Å; D824-V828 PolarHBondContact O-N 3.48Å; D824-V828 VanDerWaalsContact O-N 3.09Å; L825-V828 PolarHBondContact O-N 2.98Å; L826-V828 VanDerWaalsContact C-N 3.33Å; L826-V828 PolarHBondContact O-N 3.4Å; V828-I830 PolarHBondContact O-N 3.23Å; V828-M831 PolarHBondContact O-N 2.8Å; V828-L832 VanDerWaalsContact O-CB 3.26Å; V828-L832 WeakPolarHBondContact O-CB 3.43Å; V828-L832 PolarHBondContact O-N 3.14Å
829	A	93.8	Very high	90.4	Very high	1 Å²	1	18.5 Å²	18.5	1%	0.008	10%	0.099	C	C	.	.	H	α-helix	trans	-61.6	-44.3	178.5	0	0	0	0	0	112.8	A571 C574 I575 L825 L826 L832 G833	A571-A829 WeakPolarHBondContact CB-O 3.36Å; C574-A829 HydrophobicContact CB-CB 3.52Å; I575-A829 HydrophobicContact CG1-CB 4.2Å; L825-A829 WeakPolarHBondContact O-CB 3.24Å; L825-A829 PolarHBondContact O-N 2.69Å; L826-A829 WeakPolarHBondContact O-CB 3.46Å; L826-A829 PolarHBondContact O-N 2.66Å; A829-L832 PolarHBondContact O-N 2.83Å; A829-G833 PolarHBondContact O-N 3.44Å; A829-G833 VanDerWaalsContact O-N 3.12Å
830	I	94.1	Very high	91	Very high	79 Å²	79	18.1 Å²	18.1	41%	0.405	10%	0.096	S	C	.	.	H	α-helix	trans	-64.1	-47.6	177.7	-63.7	168.7	0	0	0	110	L826 M827 V828 L832 G833 V834	L826-I830 HydrophobicContact CD1-CD1 4.28Å; L826-I830 HydrophobicContact CD1-CG1 4.48Å; L826-I830 HydrophobicContact CG-CD1 4.01Å; L826-I830 WeakPolarHBondContact O-CG1 3.34Å; L826-I830 PolarHBondContact O-N 3.42Å; M827-I830 PolarHBondContact O-N 3.3Å; V828-I830 PolarHBondContact O-N 3.23Å; I830-L832 VanDerWaalsContact C-N 3.31Å; I830-L832 PolarHBondContact O-N 3.3Å; I830-G833 PolarHBondContact O-N 3.19Å; I830-V834 WeakPolarHBondContact O-CG2 3.35Å; I830-V834 PolarHBondContact O-N 2.91Å; I830-V834 VanDerWaalsContact O-N 3.09Å
831	M	93.4	Very high	91.3	Very high	24 Å²	24	18.3 Å²	18.3	12%	0.118	10%	0.097	C	C	.	.	H	α-helix	trans	-64.7	-34.7	179.1	-71	-56.4	95.2	0	0	112.9	T520 A523 M827 V828 V834 C835	T520-M831 HydrophobicContact CG2-CB 4.07Å; A523-M831 HydrophobicContact CB-CE 4.25Å; A523-M831 HydrophobicContact CB-CG 4.21Å; A523-M831 HydrophobicContact CB-SD 3.38Å; A523-M831 WeakPolarHBondContact CB-SD 3.22Å; M827-M831 HydrophobicContact CE-CE 3.78Å; M827-M831 HydrophobicContact CE-CG 3.76Å; M827-M831 HydrophobicContact CE-SD 3.94Å; M827-M831 WeakPolarHBondContact O-CB 3.17Å; M827-M831 WeakPolarHBondContact O-CG 3.18Å; M827-M831 PolarHBondContact O-N 2.73Å; V828-M831 PolarHBondContact O-N 2.8Å; M831-V834 HydrophobicContact CE-CG2 4.18Å; M831-V834 PolarHBondContact O-N 3.25Å; M831-C835 WeakPolarHBondContact O-CB 3.41Å; M831-C835 PolarHBondContact O-N 3.31Å; M831-C835 PolarHBondContact O-SG 2.83Å; M831-C835 VanDerWaalsContact O-SG 3.42Å
832	L	92.4	Very high	91.4	Very high	6 Å²	6	17.5 Å²	17.5	3%	0.031	9%	0.094	C	C	.	.	H	α-helix	trans	-62.3	-44.6	173.7	-172.2	152.5	0	0	0	111.5	G567 T570 A571 I797 V828 A829 I830 V834 C835 S836 W842	G567-L832 WeakPolarHBondContact O-CD2 3.21Å; T570-L832 WeakPolarHBondContact OG1-CD2 3.38Å; A571-L832 HydrophobicContact CB-CD2 4.15Å; I797-L832 HydrophobicContact CD1-CD1 3.22Å; I797-L832 HydrophobicContact CG1-CD1 4.41Å; V828-L832 VanDerWaalsContact O-CB 3.26Å; V828-L832 WeakPolarHBondContact O-CB 3.43Å; V828-L832 PolarHBondContact O-N 3.14Å; A829-L832 PolarHBondContact O-N 2.83Å; I830-L832 VanDerWaalsContact C-N 3.31Å; I830-L832 PolarHBondContact O-N 3.3Å; L832-V834 VanDerWaalsContact C-N 3.34Å; L832-V834 PolarHBondContact O-N 2.95Å; L832-C835 PolarHBondContact O-N 3.15Å; L832-S836 WeakPolarHBondContact O-CB 3.36Å; L832-S836 PolarHBondContact O-N 3.02Å; L832-S836 PolarHBondContact O-OG 3.21Å; L832-W842 HydrophobicContact CD1-CG 4.36Å; L832-W842 HydrophobicContact CG-CG 4.24Å
833	G	93.3	Very high	91.5	Very high	9 Å²	9	17.7 Å²	17.7	9%	0.093	10%	0.095	C	C	.	.	H	α-helix	trans	-59	-45.7	175.7	0	0	0	0	0	112	A829 I830 S836 I837	A829-G833 PolarHBondContact O-N 3.44Å; A829-G833 VanDerWaalsContact O-N 3.12Å; I830-G833 PolarHBondContact O-N 3.19Å; G833-S836 PolarHBondContact O-N 3.11Å; G833-I837 PolarHBondContact O-N 3.18Å; G833-I837 VanDerWaalsContact O-N 3.11Å
834	V	92.9	Very high	91.5	Very high	51 Å²	51	16.5 Å²	16.5	31%	0.309	9%	0.089	S	C	.	.	H	α-helix	trans	-62.1	-49.1	176.7	175.8	0	0	0	0	111.4	M519 I830 M831 L832 S836 I837 M838	M519-V834 HydrophobicContact CE-CG1 3.84Å; M519-V834 HydrophobicContact SD-CG1 4.35Å; I830-V834 WeakPolarHBondContact O-CG2 3.35Å; I830-V834 PolarHBondContact O-N 2.91Å; I830-V834 VanDerWaalsContact O-N 3.09Å; M831-V834 HydrophobicContact CE-CG2 4.18Å; M831-V834 PolarHBondContact O-N 3.25Å; L832-V834 VanDerWaalsContact C-N 3.34Å; L832-V834 PolarHBondContact O-N 2.95Å; V834-S836 PolarHBondContact O-N 3.25Å; V834-I837 PolarHBondContact O-N 3.44Å; V834-M838 HydrophobicContact CG1-SD 3.81Å; V834-M838 WeakPolarHBondContact O-CG 3.37Å; V834-M838 PolarHBondContact O-N 2.98Å
835	C	91.3	Very high	91.4	Very high	1 Å²	1	16.6 Å²	16.6	1%	0.007	9%	0.09	C	C	.	.	H	α-helix	trans	-59.4	-34.5	176.3	-75.8	0	0	0	0	112.5	T520 M831 L832 M838 G839 L840	T520-C835 WeakPolarHBondContact CG2-SG 3.17Å; M831-C835 WeakPolarHBondContact O-CB 3.41Å; M831-C835 PolarHBondContact O-N 3.31Å; M831-C835 PolarHBondContact O-SG 2.83Å; M831-C835 VanDerWaalsContact O-SG 3.42Å; L832-C835 PolarHBondContact O-N 3.15Å; C835-M838 PolarHBondContact O-N 3.1Å; C835-G839 PolarHBondContact O-N 3.12Å; C835-L840 HydrophobicContact CB-CB 4.03Å; C835-L840 PolarHBondContact O-N 3.19Å
836	S	92.1	Very high	91.3	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-70.1	-40.6	-179.8	-57.8	0	0	0	0	112.6	G567 L832 G833 V834 M838 G839 W842	G567-S836 VanDerWaalsContact CA-OG 3.29Å; G567-S836 WeakPolarHBondContact CA-OG 2.79Å; L832-S836 WeakPolarHBondContact O-CB 3.36Å; L832-S836 PolarHBondContact O-N 3.02Å; L832-S836 PolarHBondContact O-OG 3.21Å; G833-S836 PolarHBondContact O-N 3.11Å; V834-S836 PolarHBondContact O-N 3.25Å; S836-M838 VanDerWaalsContact C-N 3.33Å; S836-G839 PolarHBondContact O-N 2.89Å; S836-W842 PolarHBondContact OG-NE1 3.43Å
837	I	91	Very high	91	Very high	70 Å²	70	16.1 Å²	16.1	36%	0.359	9%	0.089	S	C	.	.	H	α-helix	trans	-67.4	-37.2	174.6	-67.8	161	0	0	0	110.7	L568 I771 I772 G833 V834 G839	L568-I837 HydrophobicContact CD2-CD1 4.14Å; L568-I837 HydrophobicContact CD2-CG1 4.15Å; I771-I837 HydrophobicContact CG2-CG2 4.16Å; I772-I837 PolarHBondContact N-O 3.29Å; G833-I837 PolarHBondContact O-N 3.18Å; G833-I837 VanDerWaalsContact O-N 3.11Å; V834-I837 PolarHBondContact O-N 3.44Å; I837-G839 VanDerWaalsContact C-N 3.33Å
838	M	88.6	Confident	90.7	Very high	38 Å²	38	15.4 Å²	15.4	19%	0.187	9%	0.086	C	C	.	.	H	α-helix	trans	-82.4	-8.1	-178.9	-65.6	-179.4	70.9	0	0	114.3	F515 M519 W770 V834 C835 S836 L840	F515-M838 HydrophobicContact CE1-CE 3.57Å; F515-M838 HydrophobicContact CZ-CE 4.14Å; M519-M838 HydrophobicContact CE-CE 4.39Å; M519-M838 HydrophobicContact CE-SD 3.68Å; M519-M838 HydrophobicContact SD-CE 4.17Å; M519-M838 HydrophobicContact SD-SD 3.81Å; W770-M838 CarbonylContact O-C 3.58Å; W770-M838 WeakPolarHBondContact O-CA 3.24Å; W770-M838 VanDerWaalsContact O-O 3.05Å; V834-M838 HydrophobicContact CG1-SD 3.81Å; V834-M838 WeakPolarHBondContact O-CG 3.37Å; V834-M838 PolarHBondContact O-N 2.98Å; C835-M838 PolarHBondContact O-N 3.1Å; S836-M838 VanDerWaalsContact C-N 3.33Å; M838-L840 VanDerWaalsContact C-N 3.32Å; M838-L840 HydrophobicContact CB-CD1 3.86Å; M838-L840 HydrophobicContact CB-CG 3.83Å; M838-L840 HydrophobicContact CE-CD1 4.22Å; M838-L840 PolarHBondContact O-N 3.12Å; M838-L840 HydrophobicContact SD-CD1 4.26Å
839	G	86.5	Confident	90.4	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.3	28	-177.5	0	0	0	0	0	114.7	C835 S836 I837	C835-G839 PolarHBondContact O-N 3.12Å; S836-G839 PolarHBondContact O-N 2.89Å; I837-G839 VanDerWaalsContact C-N 3.33Å
840	L	89.6	Confident	90.2	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.087	C	C	.	.	P	Polyproline II helix	trans	-91.3	154.3	176.7	-55.4	173.9	0	0	0	109.7	E512 F515 M519 R563 W770 C835 M838	E512-L840 HydrophobicContact CB-CD2 3.96Å; E512-L840 HydrophobicContact CG-CD2 4.38Å; F515-L840 HydrophobicContact CD1-CD1 3.96Å; F515-L840 HydrophobicContact CD1-CD2 3.92Å; F515-L840 HydrophobicContact CE1-CD1 4.19Å; M519-L840 HydrophobicContact CE-CD1 3.43Å; M519-L840 VanDerWaalsContact CE-CD1 3.43Å; R563-L840 PolarHBondContact NH2-O 2.84Å; W770-L840 HydrophobicContact CE3-CD2 4.39Å; W770-L840 HydrophobicContact CZ3-CD2 3.93Å; C835-L840 HydrophobicContact CB-CB 4.03Å; C835-L840 PolarHBondContact O-N 3.19Å; M838-L840 VanDerWaalsContact C-N 3.32Å; M838-L840 HydrophobicContact CB-CD1 3.86Å; M838-L840 HydrophobicContact CB-CG 3.83Å; M838-L840 HydrophobicContact CE-CD1 4.22Å; M838-L840 PolarHBondContact O-N 3.12Å; M838-L840 HydrophobicContact SD-CD1 4.26Å
841	P	90.1	Very high	89.8	Confident	4 Å²	4	13.1 Å²	13.1	3%	0.026	7%	0.074	C	C	.	.	P	Polyproline II helix	trans	-61	153.1	172.5	21.8	-27.5	0	0	0	111.5	L500 F843	L500-P841 HydrophobicContact CD2-CB 4.15Å; P841-F843 HydrophobicContact CB-CE2 4.32Å; P841-F843 HydrophobicContact CB-CZ 4.44Å; P841-F843 HydrophobicContact CG-CE2 3.79Å; P841-F843 HydrophobicContact CG-CZ 3.8Å; P841-F843 VanDerWaalsContact O-CD2 3.23Å; P841-F843 WeakPolarHBondContact O-CD2 3.35Å; P841-F843 VanDerWaalsContact O-CE2 3.24Å; P841-F843 WeakPolarHBondContact O-CE2 3.35Å
842	W	91.3	Very high	89.3	Confident	1 Å²	1	12.6 Å²	12.6	0%	0.004	7%	0.072	C	C	.	.	P	Polyproline II helix	trans	-83	131.2	177	-56.6	-39.7	0	0	0	110.4	V541 F544 E545 R563 I566 C793 L832 S836	V541-W842 HydrophobicContact CG1-CB 4.23Å; V541-W842 HydrophobicContact CG1-CE3 4.29Å; F544-W842 HydrophobicContact CD1-CH2 4.44Å; F544-W842 AromaticContact CD1-CZ3 3.7Å; F544-W842 HydrophobicContact CD1-CZ3 3.7Å; F544-W842 AromaticContact CE1-CH2 3.82Å; F544-W842 HydrophobicContact CE1-CH2 3.82Å; F544-W842 AromaticContact CE1-CZ3 3.49Å; F544-W842 HydrophobicContact CE1-CZ3 3.49Å; F544-W842 VanDerWaalsContact CE1-CZ3 3.49Å; E545-W842 WeakPolarHBondContact OE1-CZ3 3.18Å; R563-W842 HydrophobicContact CG-CZ2 3.96Å; I566-W842 HydrophobicContact CB-CH2 4.48Å; I566-W842 HydrophobicContact CG2-CH2 3.87Å; I566-W842 HydrophobicContact CG2-CZ2 4.5Å; C793-W842 VanDerWaalsContact SG-CZ3 3.58Å; L832-W842 HydrophobicContact CD1-CG 4.36Å; L832-W842 HydrophobicContact CG-CG 4.24Å; S836-W842 PolarHBondContact OG-NE1 3.43Å
843	F	90.9	Very high	89.1	Confident	10 Å²	10	12.3 Å²	12.3	4%	0.044	7%	0.07	C	C	.	.			trans	-108.9	135.8	-179.8	-68.3	-85.2	0	0	0	110.3	S513 A517 T520 L535 P841	S513-F843 WeakPolarHBondContact O-CZ 3.26Å; A517-F843 HydrophobicContact CB-CD1 4.26Å; A517-F843 HydrophobicContact CB-CE1 3.62Å; A517-F843 HydrophobicContact CB-CZ 3.78Å; A517-F843 VanDerWaalsContact N-CE2 3.29Å; A517-F843 VanDerWaalsContact N-CZ 3.29Å; T520-F843 HydrophobicContact CG2-CD2 4.08Å; L535-F843 HydrophobicContact CB-CB 4.32Å; P841-F843 HydrophobicContact CB-CE2 4.32Å; P841-F843 HydrophobicContact CB-CZ 4.44Å; P841-F843 HydrophobicContact CG-CE2 3.79Å; P841-F843 HydrophobicContact CG-CZ 3.8Å; P841-F843 VanDerWaalsContact O-CD2 3.23Å; P841-F843 WeakPolarHBondContact O-CD2 3.35Å; P841-F843 VanDerWaalsContact O-CE2 3.24Å; P841-F843 WeakPolarHBondContact O-CE2 3.35Å
844	V	89.8	Confident	88.8	Confident	1 Å²	1	12 Å²	12	1%	0.006	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	162.8	-180	-172.8	0	0	0	0	108.6	L535 G536 T538 V541 I797 D800 A846	L535-V844 CarbonylContact C-O 3.35Å; L535-V844 WeakPolarHBondContact CA-O 3.19Å; G536-V844 PolarHBondContact N-O 3.01Å; G536-V844 PolarHBondContact O-N 3.26Å; T538-V844 HydrophobicContact CG2-CB 4.43Å; V541-V844 HydrophobicContact CG2-CG2 4.17Å; I797-V844 HydrophobicContact CB-CG2 4.49Å; I797-V844 HydrophobicContact CG1-CG2 3.95Å; I797-V844 HydrophobicContact CG2-CG1 4.46Å; I797-V844 HydrophobicContact CG2-CG2 4.21Å; D800-V844 HydrophobicContact CB-CG1 3.64Å; V844-A846 PolarHBondContact O-N 3.05Å
845	A	90.1	Very high	88.3	Confident	3 Å²	3	12.5 Å²	12.5	3%	0.025	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	125.7	175.1	0	0	0	0	0	112.2	T533 L535 T804	T533-A845 HydrophobicContact CG2-CB 3.37Å; L535-A845 HydrophobicContact CD2-CB 4.44Å; T804-A845 HydrophobicContact CG2-CB 3.75Å
846	A	88.8	Confident	87.9	Confident	9 Å²	9	13.1 Å²	13.1	7%	0.074	7%	0.072	C	C	.	.			trans	-96.1	115.1	176.5	0	0	0	0	0	110.2	I534 V844 L849 S850	I534-A846 PolarHBondContact O-N 2.91Å; V844-A846 PolarHBondContact O-N 3.05Å; A846-L849 HydrophobicContact CB-CB 4.12Å; A846-L849 HydrophobicContact CB-CD1 3.58Å; A846-L849 HydrophobicContact CB-CG 4.48Å; A846-S850 VanDerWaalsContact O-CB 3.3Å; A846-S850 WeakPolarHBondContact O-CB 3.48Å; A846-S850 PolarHBondContact O-N 3.36Å; A846-S850 PolarHBondContact O-OG 3.49Å
847	T	86.4	Confident	87.6	Confident	12 Å²	12	13.1 Å²	13.1	7%	0.074	7%	0.072	C	C	.	.	H	α-helix	trans	-60.2	-55	-174.1	49.2	0	0	0	0	113.5	F597 I601 T804 I807 L849 S850 I851	F597-T847 HydrophobicContact CE1-CG2 3.94Å; I601-T847 WeakPolarHBondContact CG2-OG1 3.41Å; T804-T847 HydrophobicContact CG2-CG2 3.99Å; T804-T847 WeakPolarHBondContact OG1-CG2 3.44Å; I807-T847 HydrophobicContact CD1-CG2 4.12Å; T847-L849 PolarHBondContact O-N 3.31Å; T847-S850 PolarHBondContact O-N 2.97Å; T847-I851 VanDerWaalsContact O-CG1 3.28Å; T847-I851 WeakPolarHBondContact O-CG1 3.32Å; T847-I851 PolarHBondContact O-N 3.37Å
848	V	85.6	Confident	87.2	Confident	2 Å²	2	13.7 Å²	13.7	1%	0.012	7%	0.072	C	C	.	.	H	α-helix	trans	-63.2	-43.3	-174.8	176.8	0	0	0	0	111.5	I601 F605 S850 I851 T852 M914	I601-V848 HydrophobicContact CG2-CG2 3.69Å; F605-V848 HydrophobicContact CD2-CG2 4.01Å; F605-V848 HydrophobicContact CE2-CB 4.46Å; F605-V848 HydrophobicContact CE2-CG2 4.14Å; F605-V848 HydrophobicContact CG-CG2 4.37Å; F605-V848 HydrophobicContact CZ-CB 4.47Å; V848-S850 VanDerWaalsContact C-N 3.35Å; V848-I851 PolarHBondContact O-N 3.31Å; V848-T852 VanDerWaalsContact O-CB 3.27Å; V848-T852 WeakPolarHBondContact O-CB 3.49Å; V848-T852 PolarHBondContact O-N 3.31Å; V848-T852 PolarHBondContact O-OG1 3.23Å; V848-M914 HydrophobicContact CG1-CB 4.41Å
849	L	86.5	Confident	86.5	Confident	11 Å²	11	14 Å²	14	6%	0.058	7%	0.074	C	C	.	.	H	α-helix	trans	-63.5	-41.6	177.1	-74.9	132.1	0	0	0	111.2	C489 I534 A846 T847 T852 H853	C489-L849 HydrophobicContact CB-CD2 4.24Å; C489-L849 WeakPolarHBondContact SG-CD2 3.14Å; I534-L849 HydrophobicContact CB-CB 4.42Å; I534-L849 HydrophobicContact CG2-CB 4.46Å; A846-L849 HydrophobicContact CB-CB 4.12Å; A846-L849 HydrophobicContact CB-CD1 3.58Å; A846-L849 HydrophobicContact CB-CG 4.48Å; T847-L849 PolarHBondContact O-N 3.31Å; L849-T852 PolarHBondContact O-N 2.9Å; L849-H853 WeakPolarHBondContact O-CB 3.4Å; L849-H853 PolarHBondContact O-N 2.9Å
850	S	89.1	Confident	85.7	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-69.5	-41.3	178.3	-54.7	0	0	0	0	112.8	I534 I808 A846 T847 V848 T852 H853 V854	I534-S850 PolarHBondContact N-OG 3.32Å; I808-S850 VanDerWaalsContact CD1-CB 3.47Å; A846-S850 VanDerWaalsContact O-CB 3.3Å; A846-S850 WeakPolarHBondContact O-CB 3.48Å; A846-S850 PolarHBondContact O-N 3.36Å; A846-S850 PolarHBondContact O-OG 3.49Å; T847-S850 PolarHBondContact O-N 2.97Å; V848-S850 VanDerWaalsContact C-N 3.35Å; S850-T852 VanDerWaalsContact C-N 3.3Å; S850-T852 PolarHBondContact O-N 3.27Å; S850-H853 WeakPolarHBondContact O-CB 3.43Å; S850-H853 PolarHBondContact O-N 3.4Å; S850-V854 VanDerWaalsContact O-CG2 3.29Å; S850-V854 WeakPolarHBondContact O-CG2 3.41Å; S850-V854 PolarHBondContact O-N 3.37Å
851	I	86.3	Confident	84.3	Confident	23 Å²	23	17.9 Å²	17.9	12%	0.118	9%	0.094	C	C	.	.	H	α-helix	trans	-62	-42.3	174.3	-66.6	164.4	0	0	0	110.3	I807 T847 V848 H853 V854 N855	I807-I851 HydrophobicContact CG2-CD1 3.8Å; I807-I851 HydrophobicContact CG2-CG1 3.83Å; T847-I851 VanDerWaalsContact O-CG1 3.28Å; T847-I851 WeakPolarHBondContact O-CG1 3.32Å; T847-I851 PolarHBondContact O-N 3.37Å; V848-I851 PolarHBondContact O-N 3.31Å; I851-H853 VanDerWaalsContact C-N 3.3Å; I851-H853 PolarHBondContact O-N 2.97Å; I851-V854 PolarHBondContact O-N 3.26Å; I851-N855 WeakPolarHBondContact O-CB 3.5Å; I851-N855 VanDerWaalsContact O-CG 3.31Å; I851-N855 PolarHBondContact O-N 2.68Å; I851-N855 PolarHBondContact O-ND2 3.02Å
852	T	83.3	Confident	82.6	Confident	13 Å²	13	26.4 Å²	26.4	8%	0.08	13%	0.134	C	C	.	.	H	α-helix	trans	-63.3	-39	177.6	-60.4	0	0	0	0	111.4	F484 L485 V848 L849 S850 N855 S856 M914	F484-T852 HydrophobicContact CE1-CG2 3.41Å; F484-T852 VanDerWaalsContact CE1-CG2 3.41Å; F484-T852 HydrophobicContact CZ-CG2 3.39Å; L485-T852 HydrophobicContact CD2-CG2 4.34Å; V848-T852 VanDerWaalsContact O-CB 3.27Å; V848-T852 WeakPolarHBondContact O-CB 3.49Å; V848-T852 PolarHBondContact O-N 3.31Å; V848-T852 PolarHBondContact O-OG1 3.23Å; L849-T852 PolarHBondContact O-N 2.9Å; S850-T852 VanDerWaalsContact C-N 3.3Å; S850-T852 PolarHBondContact O-N 3.27Å; T852-N855 PolarHBondContact O-N 3.49Å; T852-S856 PolarHBondContact O-N 3.31Å; T852-M914 HydrophobicContact CG2-CG 4.39Å; T852-M914 HydrophobicContact CG2-SD 4.24Å
853	H	87.6	Confident	80.4	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61.8	-48	173.5	-178.4	-152.8	0	0	0	112.2	L485 L532 I534 L849 S850 I851 N855 S856 L857 T881	L485-H853 HydrophobicContact CD1-CB 3.75Å; L485-H853 WeakPolarHBondContact CD1-CD2 3.16Å; L485-H853 HydrophobicContact CD2-CB 4.05Å; L532-H853 PolarHBondContact O-ND1 2.95Å; I534-H853 HydrophobicContact CD1-CB 3.78Å; I534-H853 HydrophobicContact CG1-CB 4.38Å; L849-H853 WeakPolarHBondContact O-CB 3.4Å; L849-H853 PolarHBondContact O-N 2.9Å; S850-H853 WeakPolarHBondContact O-CB 3.43Å; S850-H853 PolarHBondContact O-N 3.4Å; I851-H853 VanDerWaalsContact C-N 3.3Å; I851-H853 PolarHBondContact O-N 2.97Å; H853-N855 PolarHBondContact O-N 2.94Å; H853-S856 PolarHBondContact O-N 3.49Å; H853-S856 PolarHBondContact O-OG 2.9Å; H853-L857 WeakPolarHBondContact NE2-CD1 3.43Å; H853-L857 PolarHBondContact O-N 2.86Å; H853-T881 PolarHBondContact CE1-OG1 3.08Å; H853-T881 PolarHBondContact NE2-OG1 2.83Å
854	V	87.3	Confident	78.3	Confident	2 Å²	2	32.4 Å²	32.4	1%	0.012	18%	0.176	C	C	.	.	H	α-helix	trans	-59.2	-45.7	176	173.3	0	0	0	0	111.5	L532 I808 S850 I851 S856 L857 K858 I875	L532-V854 HydrophobicContact CB-CG2 4.1Å; L532-V854 HydrophobicContact CD1-CG2 4.2Å; I808-V854 HydrophobicContact CG2-CG2 3.93Å; S850-V854 VanDerWaalsContact O-CG2 3.29Å; S850-V854 WeakPolarHBondContact O-CG2 3.41Å; S850-V854 PolarHBondContact O-N 3.37Å; I851-V854 PolarHBondContact O-N 3.26Å; V854-S856 VanDerWaalsContact C-N 3.27Å; V854-S856 PolarHBondContact O-N 2.97Å; V854-L857 PolarHBondContact O-N 3.05Å; V854-L857 VanDerWaalsContact O-N 3.09Å; V854-K858 PolarHBondContact O-N 3.32Å; V854-I875 HydrophobicContact CG1-CD1 3.31Å; V854-I875 HydrophobicContact CG1-CG1 4.13Å; V854-I875 HydrophobicContact CG1-CG2 4.47Å
855	N	82.6	Confident	76.4	Confident	63 Å²	63	33 Å²	33	34%	0.337	18%	0.182	S	C	.	.	H	α-helix	trans	-64.1	-31.2	179.2	-76.4	-19.9	0	0	0	112.7	I851 T852 H853 L857 K858	I851-N855 WeakPolarHBondContact O-CB 3.5Å; I851-N855 VanDerWaalsContact O-CG 3.31Å; I851-N855 PolarHBondContact O-N 2.68Å; I851-N855 PolarHBondContact O-ND2 3.02Å; T852-N855 PolarHBondContact O-N 3.49Å; H853-N855 PolarHBondContact O-N 2.94Å; N855-L857 VanDerWaalsContact C-N 3.29Å; N855-L857 PolarHBondContact O-N 3.46Å; N855-K858 WeakPolarHBondContact O-CB 3.45Å
856	S	82.9	Confident	74.3	Confident	13 Å²	13	34.3 Å²	34.3	9%	0.091	19%	0.19	C	C	.	.	H	α-helix	trans	-70.4	-24.9	175.3	80	0	0	0	0	113.2	Q477 S481 T852 H853 V854	Q477-S856 PolarHBondContact NE2-O 3.17Å; S481-S856 WeakPolarHBondContact CB-OG 3.09Å; S481-S856 WeakPolarHBondContact OG-CB 3.26Å; S481-S856 PolarHBondContact OG-O 3.28Å; S481-S856 PolarHBondContact OG-OG 3.05Å; T852-S856 PolarHBondContact O-N 3.31Å; H853-S856 PolarHBondContact O-N 3.49Å; H853-S856 PolarHBondContact O-OG 2.9Å; V854-S856 VanDerWaalsContact C-N 3.27Å; V854-S856 PolarHBondContact O-N 2.97Å
857	L	85.1	Confident	72.5	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100	10.4	-177.3	-66.8	169	0	0	0	113.6	L532 H853 V854 N855 L859 I875 R876	L532-L857 HydrophobicContact CD2-CD1 3.57Å; H853-L857 WeakPolarHBondContact NE2-CD1 3.43Å; H853-L857 PolarHBondContact O-N 2.86Å; V854-L857 PolarHBondContact O-N 3.05Å; V854-L857 VanDerWaalsContact O-N 3.09Å; N855-L857 VanDerWaalsContact C-N 3.29Å; N855-L857 PolarHBondContact O-N 3.46Å; L857-L859 PolarHBondContact O-N 2.83Å; L857-I875 HydrophobicContact CB-CG2 3.99Å; L857-R876 PolarHBondContact O-N 3.07Å; L857-R876 VanDerWaalsContact O-N 3.07Å
858	K	83.4	Confident	70.9	Confident	82 Å²	82	37.3 Å²	37.3	36%	0.357	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	124.7	177	167.1	152.4	-174.4	-165.9	0	110.7	Q477 V854 N855 F872 I875	Q477-K858 PolarHBondContact NE2-O 3.31Å; V854-K858 PolarHBondContact O-N 3.32Å; N855-K858 WeakPolarHBondContact O-CB 3.45Å; K858-F872 HydrophobicContact CB-CE2 4.21Å; K858-F872 HydrophobicContact CD-CD2 3.81Å; K858-F872 HydrophobicContact CD-CE2 3.7Å; K858-F872 HydrophobicContact CG-CD2 3.68Å; K858-F872 HydrophobicContact CG-CE2 3.49Å; K858-F872 VanDerWaalsContact CG-CE2 3.49Å; K858-I875 HydrophobicContact CB-CG1 4.49Å
859	L	72.8	Confident	69.4	Low	44 Å²	44	43.6 Å²	43.6	23%	0.23	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	126.1	172.4	-64	176.9	0	0	0	111.2	Q477 L857 F872 L873 G874 R876	Q477-L859 VanDerWaalsContact OE1-CD2 3.28Å; L857-L859 PolarHBondContact O-N 2.83Å; L859-F872 WeakPolarHBondContact O-CD2 3.36Å; L859-L873 PolarHBondContact O-N 3.34Å; L859-L873 VanDerWaalsContact O-N 3.08Å; L859-G874 WeakPolarHBondContact CB-O 3.43Å; L859-G874 PolarHBondContact N-O 2.9Å; L859-R876 HydrophobicContact CD1-CG 3.49Å; L859-R876 VanDerWaalsContact CD1-CG 3.49Å; L859-R876 HydrophobicContact CD2-CG 4.09Å; L859-R876 HydrophobicContact CG-CG 3.8Å
860	E	70.9	Confident	68	Low	61 Å²	61	46 Å²	46	29%	0.285	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	147.6	169.6	-76	163.9	-149.9	0	0	108.5	K716 E862 P870	K716-E860 WeakPolarHBondContact CE-OE2 3.31Å; K716-E860 IonicContact NZ-OE1 2.81Å; K716-E860 PolarHBondContact NZ-OE1 3.35Å; K716-E860 IonicContact NZ-OE2 2.7Å; K716-E860 PolarHBondContact NZ-OE2 3.42Å; E860-E862 PolarHBondContact O-N 3.11Å; E860-P870 HydrophobicContact CB-CB 4.22Å
861	S	59.9	Low	66.7	Low	21 Å²	21	49.3 Å²	49.3	15%	0.147	27%	0.272	C	S	.	.			trans	-64.6	128.7	-178.6	59.1	0	0	0	0	112.1	S864 K871	S861-S864 PolarHBondContact OG-OG 3.02Å; S861-K871 PolarHBondContact N-O 3.23Å; S861-K871 PolarHBondContact OG-N 2.79Å; S861-K871 PolarHBondContact OG-O 3.45Å
862	E	53.5	Low	66.1	Low	183 Å²	183	50.1 Å²	50.1	86%	0.855	28%	0.275	S	S	*	.	S	Bend	trans	-79.9	-28.2	177.1	-65.3	-173.2	173.4	0	0	113	E860	E860-E862 PolarHBondContact O-N 3.11Å
863	C	45.4	Very low	65.4	Low	104 Å²	104	53.5 Å²	53.5	70%	0.703	29%	0.292	S	S	*	.			trans	-110.4	92.8	177.2	-67.6	0	0	0	0	109.4
864	S	47.8	Very low	65	Low	33 Å²	33	53.7 Å²	53.7	23%	0.231	29%	0.294	C	S	.	.			trans	-99.2	138.7	157.9	-68.2	0	0	0	0	107.2	S861 E868	S861-S864 PolarHBondContact OG-OG 3.02Å; S864-E868 WeakPolarHBondContact CB-O 3.42Å; S864-E868 PolarHBondContact OG-O 3.19Å
865	A	49.8	Very low	64.9	Low	15 Å²	15	54.2 Å²	54.2	12%	0.124	30%	0.297	C	S	.	.			trans	-52.9	152.4	165.4	0	0	0	0	0	108.9	L140 G867 E868	L140-A865 HydrophobicContact CD2-CB 4.25Å; A865-G867 PolarHBondContact O-N 3.38Å; A865-E868 PolarHBondContact O-N 3.35Å; A865-E868 VanDerWaalsContact O-N 3.11Å
866	P	45.6	Very low	65	Low	30 Å²	30	54.7 Å²	54.7	20%	0.195	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.7	131.2	174.1	-24	33.6	0	0	0	110	E144 P156 K293	E144-P866 VanDerWaalsContact OE1-CB 3.31Å; E144-P866 WeakPolarHBondContact OE1-CB 3.25Å; P156-P866 HydrophobicContact CG-CB 3.86Å; P156-P866 VanDerWaalsContact CG-O 3.28Å; P156-P866 WeakPolarHBondContact CG-O 3.11Å; K293-P866 HydrophobicContact CD-CG 3.93Å
867	G	51.3	Low	65.1	Low	42 Å²	42	54.7 Å²	54.7	43%	0.433	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	93	-18.2	177.7	0	0	0	0	0	116.4	P156 P409 A865	P156-G867 VanDerWaalsContact CG-CA 3.42Å; P409-G867 WeakPolarHBondContact CG-O 3.43Å; A865-G867 PolarHBondContact O-N 3.38Å
868	E	51.3	Low	65.2	Low	42 Å²	42	54.9 Å²	54.9	20%	0.196	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-89.9	128	-178.9	-176.8	175.5	-163.2	0	0	111.7	S864 A865 K871	S864-E868 WeakPolarHBondContact CB-O 3.42Å; S864-E868 PolarHBondContact OG-O 3.19Å; A865-E868 PolarHBondContact O-N 3.35Å; A865-E868 VanDerWaalsContact O-N 3.11Å; E868-K871 WeakPolarHBondContact OE1-CD 3.2Å; E868-K871 WeakPolarHBondContact OE1-CE 3.47Å; E868-K871 IonicContact OE1-NZ 2.8Å; E868-K871 PolarHBondContact OE1-NZ 3Å
869	Q	54.2	Low	65.6	Low	133 Å²	133	51.5 Å²	51.5	62%	0.621	28%	0.278	S	S	*	.	P	Polyproline II helix	trans	-65.2	148.5	175	-68.3	-69.8	-20.7	0	0	110.6	K871	Q869-K871 PolarHBondContact O-N 3.41Å; Q869-K871 VanDerWaalsContact O-N 3.17Å
870	P	58.5	Low	66.4	Low	61 Å²	61	50.8 Å²	50.8	40%	0.396	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-60.9	122.2	-177.7	24.2	-33.2	0	0	0	111	E860	E860-P870 HydrophobicContact CB-CB 4.22Å
871	K	60.3	Low	67.3	Low	70 Å²	70	48 Å²	48	30%	0.304	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-78.7	134.4	177.1	-79.6	175.5	168.2	160.7	0	109.8	S861 E868 Q869 L873	S861-K871 PolarHBondContact N-O 3.23Å; S861-K871 PolarHBondContact OG-N 2.79Å; S861-K871 PolarHBondContact OG-O 3.45Å; E868-K871 WeakPolarHBondContact OE1-CD 3.2Å; E868-K871 WeakPolarHBondContact OE1-CE 3.47Å; E868-K871 IonicContact OE1-NZ 2.8Å; E868-K871 PolarHBondContact OE1-NZ 3Å; Q869-K871 PolarHBondContact O-N 3.41Å; Q869-K871 VanDerWaalsContact O-N 3.17Å; K871-L873 PolarHBondContact O-N 3.16Å
872	F	73.5	Confident	68.7	Low	41 Å²	41	47.1 Å²	47.1	18%	0.18	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	109.4	171.7	175.3	-116.2	0	0	0	110.1	E812 H813 K814 K858 L859 G874 I875	E812-F872 VanDerWaalsContact O-CE1 3.24Å; E812-F872 WeakPolarHBondContact O-CE1 3.35Å; H813-F872 WeakPolarHBondContact O-CZ 3.31Å; K814-F872 HydrophobicContact CB-CE1 4.27Å; K814-F872 HydrophobicContact CD-CD1 4.09Å; K814-F872 HydrophobicContact CD-CE1 4.2Å; K814-F872 HydrophobicContact CG-CD1 4.47Å; K814-F872 HydrophobicContact CG-CE1 4.14Å; K814-F872 PolarHBondContact NZ-O 3.44Å; K858-F872 HydrophobicContact CB-CE2 4.21Å; K858-F872 HydrophobicContact CD-CD2 3.81Å; K858-F872 HydrophobicContact CD-CE2 3.7Å; K858-F872 HydrophobicContact CG-CD2 3.68Å; K858-F872 HydrophobicContact CG-CE2 3.49Å; K858-F872 VanDerWaalsContact CG-CE2 3.49Å; L859-F872 WeakPolarHBondContact O-CD2 3.36Å; F872-G874 VanDerWaalsContact CE2-O 3.27Å; F872-G874 WeakPolarHBondContact CE2-O 3.2Å; F872-I875 HydrophobicContact CE2-CG1 4.22Å; F872-I875 HydrophobicContact CZ-CD1 3.98Å; F872-I875 HydrophobicContact CZ-CG1 3.99Å
873	L	68.6	Low	70.6	Confident	83 Å²	83	39.7 Å²	39.7	44%	0.435	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	-28.6	-176.6	-72.2	171.4	0	0	0	112.6	L859 K871	L859-L873 PolarHBondContact O-N 3.34Å; L859-L873 VanDerWaalsContact O-N 3.08Å; K871-L873 PolarHBondContact O-N 3.16Å
874	G	79.9	Confident	72.8	Confident	4 Å²	4	38.3 Å²	38.3	4%	0.041	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	143.2	-171.3	-179	0	0	0	0	0	112	L859 F872	L859-G874 WeakPolarHBondContact CB-O 3.43Å; L859-G874 PolarHBondContact N-O 2.9Å; F872-G874 VanDerWaalsContact CE2-O 3.27Å; F872-G874 WeakPolarHBondContact CE2-O 3.2Å
875	I	85.4	Confident	74.9	Confident	14 Å²	14	36.7 Å²	36.7	7%	0.072	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	144.1	177.1	-75.6	144.1	0	0	0	110.2	L532 H813 L815 V854 L857 K858 F872 E877	L532-I875 HydrophobicContact CD1-CG2 4.14Å; H813-I875 HydrophobicContact CB-CD1 3.39Å; H813-I875 WeakPolarHBondContact ND1-CD1 3.5Å; L815-I875 HydrophobicContact CD2-CB 4.07Å; L815-I875 HydrophobicContact CD2-CG2 4.22Å; V854-I875 HydrophobicContact CG1-CD1 3.31Å; V854-I875 HydrophobicContact CG1-CG1 4.13Å; V854-I875 HydrophobicContact CG1-CG2 4.47Å; L857-I875 HydrophobicContact CB-CG2 3.99Å; K858-I875 HydrophobicContact CB-CG1 4.49Å; F872-I875 HydrophobicContact CE2-CG1 4.22Å; F872-I875 HydrophobicContact CZ-CD1 3.98Å; F872-I875 HydrophobicContact CZ-CG1 3.99Å; I875-E877 PolarHBondContact O-N 3.28Å
876	R	84.9	Confident	76.9	Confident	72 Å²	72	36.2 Å²	36.2	27%	0.272	19%	0.191	S	C	.	.			trans	-74.4	112	170.2	-71.4	-169.4	174.1	141	11.5	109.9	S475 L857 L859	S475-R876 PolarHBondContact OG-NH1 3.21Å; L857-R876 PolarHBondContact O-N 3.07Å; L857-R876 VanDerWaalsContact O-N 3.07Å; L859-R876 HydrophobicContact CD1-CG 3.49Å; L859-R876 VanDerWaalsContact CD1-CG 3.49Å; L859-R876 HydrophobicContact CD2-CG 4.09Å; L859-R876 HydrophobicContact CG-CG 3.8Å
877	E	85	Confident	79.1	Confident	14 Å²	14	37.4 Å²	37.4	7%	0.065	20%	0.198	C	C	.	.			trans	-88	112.7	174.2	-67.7	171.9	129.8	0	0	109.6	L532 L815 K816 K817 I875	L532-E877 HydrophobicContact CD1-CG 4.29Å; L815-E877 WeakPolarHBondContact CB-OE1 3.31Å; L815-E877 HydrophobicContact CD2-CG 3.8Å; L815-E877 WeakPolarHBondContact CD2-OE1 3.47Å; K816-E877 PolarHBondContact N-OE2 3.26Å; K817-E877 WeakPolarHBondContact CB-OE2 3.44Å; K817-E877 HydrophobicContact CD-CB 3.78Å; K817-E877 WeakPolarHBondContact CG-OE2 3.31Å; K817-E877 PolarHBondContact N-OE2 3.46Å; K817-E877 PolarHBondContact NZ-O 2.99Å; I875-E877 PolarHBondContact O-N 3.28Å
878	Q	88.1	Confident	80.8	Confident	4 Å²	4	37.5 Å²	37.5	2%	0.019	19%	0.188	C	C	.	.			trans	-147.9	160.2	-179.1	53.5	66.6	50.3	0	0	111	D469 A473 T881	D469-Q878 WeakPolarHBondContact O-CB 3.21Å; A473-Q878 HydrophobicContact CB-CB 4.21Å; Q878-T881 PolarHBondContact NE2-OG1 2.8Å; Q878-T881 PolarHBondContact OE1-OG1 3.27Å
879	R	89.8	Confident	82.6	Confident	11 Å²	11	35.6 Å²	35.6	4%	0.042	18%	0.179	C	C	.	.	S	Bend	trans	-102.6	-19.9	-178.2	-67.1	178.7	179.3	-92.4	-4.5	113.7	D469 S525 L526 A528 A531 L883	D469-R879 HydrophobicContact CB-CB 4.47Å; D469-R879 HydrophobicContact CB-CG 3.98Å; D469-R879 WeakPolarHBondContact OD2-CD 3.44Å; D469-R879 IonicContact OD2-CZ 3.9Å; D469-R879 IonicContact OD2-NE 3Å; D469-R879 PolarHBondContact OD2-NE 3.15Å; D469-R879 IonicContact OD2-NH2 3.73Å; S525-R879 PolarHBondContact O-NH1 3.25Å; L526-R879 PolarHBondContact O-NH1 3.16Å; A528-R879 PolarHBondContact O-NH1 2.93Å; A528-R879 PolarHBondContact O-NH2 3.08Å; A531-R879 HydrophobicContact CB-CB 4.31Å; A531-R879 HydrophobicContact CB-CG 3.61Å; R879-L883 PolarHBondContact O-N 3.24Å; R879-L883 VanDerWaalsContact O-N 3.15Å
880	V	90.6	Very high	84.1	Confident	29 Å²	29	30.5 Å²	30.5	18%	0.176	16%	0.162	C	C	.	.	H	α-helix	trans	-72.3	-39.4	-166.2	178	0	0	0	0	112	Y470 A473 G882 L883 M884	Y470-V880 HydrophobicContact CD1-CG2 3.5Å; Y470-V880 VanDerWaalsContact CD1-CG2 3.5Å; Y470-V880 HydrophobicContact CE1-CG2 3.92Å; Y470-V880 HydrophobicContact CG-CG2 4.32Å; A473-V880 HydrophobicContact CB-CB 3.55Å; A473-V880 HydrophobicContact CB-CG1 4.2Å; A473-V880 HydrophobicContact CB-CG2 3.48Å; A473-V880 VanDerWaalsContact CB-CG2 3.48Å; V880-G882 PolarHBondContact O-N 3.38Å; V880-L883 PolarHBondContact O-N 2.87Å; V880-M884 HydrophobicContact CG1-CE 4.12Å; V880-M884 HydrophobicContact CG1-CG 3.93Å; V880-M884 WeakPolarHBondContact O-CB 3.43Å; V880-M884 WeakPolarHBondContact O-CG 3.42Å; V880-M884 PolarHBondContact O-N 2.94Å
881	T	90.8	Very high	85.3	Confident	2 Å²	2	30.2 Å²	30.2	1%	0.012	16%	0.161	C	C	.	.	H	α-helix	trans	-62.1	-46.1	179.1	60.6	0	0	0	0	110.9	C478 F482 H853 Q878 L883 M884 I885	C478-T881 HydrophobicContact CB-CG2 3.94Å; F482-T881 HydrophobicContact CB-CG2 4.41Å; H853-T881 PolarHBondContact CE1-OG1 3.08Å; H853-T881 PolarHBondContact NE2-OG1 2.83Å; Q878-T881 PolarHBondContact NE2-OG1 2.8Å; Q878-T881 PolarHBondContact OE1-OG1 3.27Å; T881-L883 PolarHBondContact O-N 3.28Å; T881-M884 PolarHBondContact O-N 2.91Å; T881-I885 VanDerWaalsContact O-CD1 3.28Å; T881-I885 WeakPolarHBondContact O-CD1 3.36Å; T881-I885 WeakPolarHBondContact O-CG1 3.28Å; T881-I885 PolarHBondContact O-N 2.93Å
882	G	89.5	Confident	86.3	Confident	2 Å²	2	26.9 Å²	26.9	2%	0.021	15%	0.147	C	C	.	.	H	α-helix	trans	-57.5	-50	175.8	0	0	0	0	0	110.9	S525 V880 M884 I885 F886	S525-G882 VanDerWaalsContact OG-C 3.31Å; V880-G882 PolarHBondContact O-N 3.38Å; G882-M884 PolarHBondContact O-N 2.83Å; G882-I885 PolarHBondContact O-N 2.73Å; G882-F886 WeakPolarHBondContact O-CD2 3.48Å; G882-F886 PolarHBondContact O-N 2.91Å
883	L	92.4	Very high	86.4	Confident	28 Å²	28	25.4 Å²	25.4	15%	0.147	14%	0.141	C	C	.	.	H	α-helix	trans	-56.1	-48.7	176	-175.3	69.7	0	0	0	111.9	I522 S525 L526 R879 V880 T881 I885 F886 V887	I522-L883 HydrophobicContact CB-CD1 4.48Å; I522-L883 HydrophobicContact CG1-CD1 4.48Å; I522-L883 HydrophobicContact CG2-CD1 3.94Å; S525-L883 PolarHBondContact OG-N 3.47Å; L526-L883 HydrophobicContact CD1-CD1 4.48Å; L526-L883 HydrophobicContact CD2-CD1 4.02Å; L526-L883 HydrophobicContact CD2-CD2 4.32Å; L526-L883 HydrophobicContact CG-CD1 4.02Å; R879-L883 PolarHBondContact O-N 3.24Å; R879-L883 VanDerWaalsContact O-N 3.15Å; V880-L883 PolarHBondContact O-N 2.87Å; T881-L883 PolarHBondContact O-N 3.28Å; L883-I885 PolarHBondContact O-N 3.2Å; L883-F886 PolarHBondContact O-N 2.96Å; L883-V887 HydrophobicContact CD1-CG2 4.49Å; L883-V887 HydrophobicContact CG-CG2 4.44Å; L883-V887 WeakPolarHBondContact O-CB 3.38Å; L883-V887 VanDerWaalsContact O-CG2 3.24Å; L883-V887 WeakPolarHBondContact O-CG2 3.38Å; L883-V887 PolarHBondContact O-N 3.37Å
884	M	91.4	Very high	86.8	Confident	74 Å²	74	30.1 Å²	30.1	37%	0.365	16%	0.158	S	C	.	.	H	α-helix	trans	-66.2	-38.3	-178.1	-69.6	-61.3	158.3	0	0	112.4	F482 V880 T881 G882 F886 V887 L888	F482-M884 HydrophobicContact CB-CB 4.42Å; F482-M884 HydrophobicContact CD1-CB 4.48Å; F482-M884 HydrophobicContact CD2-CB 4.38Å; F482-M884 HydrophobicContact CG-CB 4.22Å; V880-M884 HydrophobicContact CG1-CE 4.12Å; V880-M884 HydrophobicContact CG1-CG 3.93Å; V880-M884 WeakPolarHBondContact O-CB 3.43Å; V880-M884 WeakPolarHBondContact O-CG 3.42Å; V880-M884 PolarHBondContact O-N 2.94Å; T881-M884 PolarHBondContact O-N 2.91Å; G882-M884 PolarHBondContact O-N 2.83Å; M884-F886 PolarHBondContact O-N 3.42Å; M884-V887 PolarHBondContact O-N 2.93Å; M884-L888 VanDerWaalsContact O-CB 3.27Å; M884-L888 WeakPolarHBondContact O-CB 3.38Å; M884-L888 WeakPolarHBondContact O-CD1 3.37Å; M884-L888 VanDerWaalsContact O-CG 3.27Å; M884-L888 WeakPolarHBondContact O-CG 3.47Å; M884-L888 PolarHBondContact O-N 3.15Å
885	I	91.6	Very high	86.6	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58	-49.3	175.6	-68.7	155.4	0	0	0	110.3	F482 L485 C489 I534 T881 G882 L883 L888 M889	F482-I885 HydrophobicContact CB-CG1 4Å; L485-I885 HydrophobicContact CB-CD1 3.43Å; L485-I885 VanDerWaalsContact CB-CD1 3.43Å; L485-I885 HydrophobicContact CB-CG1 3.95Å; L485-I885 HydrophobicContact CD1-CD1 3.79Å; L485-I885 HydrophobicContact CG-CD1 4.24Å; C489-I885 HydrophobicContact CB-CG2 4.24Å; I534-I885 HydrophobicContact CD1-CD1 4.34Å; T881-I885 VanDerWaalsContact O-CD1 3.28Å; T881-I885 WeakPolarHBondContact O-CD1 3.36Å; T881-I885 WeakPolarHBondContact O-CG1 3.28Å; T881-I885 PolarHBondContact O-N 2.93Å; G882-I885 PolarHBondContact O-N 2.73Å; L883-I885 PolarHBondContact O-N 3.2Å; I885-L888 PolarHBondContact O-N 3.26Å; I885-M889 WeakPolarHBondContact O-CB 3.38Å; I885-M889 PolarHBondContact O-N 2.9Å
886	F	92.2	Very high	86	Confident	4 Å²	4	33.1 Å²	33.1	2%	0.018	17%	0.173	C	C	.	.	H	α-helix	trans	-76.3	-29.5	-176.5	-68	-65	0	0	0	113.6	A517 S518 G521 I522 I534 G882 L883 M884 M889 G890	A517-F886 VanDerWaalsContact O-CD1 3.25Å; A517-F886 WeakPolarHBondContact O-CD1 3.27Å; S518-F886 WeakPolarHBondContact CB-O 3.27Å; S518-F886 PolarHBondContact OG-O 3.09Å; G521-F886 VanDerWaalsContact CA-CG 3.45Å; G521-F886 WeakPolarHBondContact O-CD2 3.45Å; I522-F886 HydrophobicContact CG1-CB 3.84Å; I534-F886 HydrophobicContact CG2-CE1 4.5Å; I534-F886 HydrophobicContact CG2-CE2 4.4Å; I534-F886 HydrophobicContact CG2-CZ 3.72Å; G882-F886 WeakPolarHBondContact O-CD2 3.48Å; G882-F886 PolarHBondContact O-N 2.91Å; L883-F886 PolarHBondContact O-N 2.96Å; M884-F886 PolarHBondContact O-N 3.42Å; F886-M889 WeakPolarHBondContact O-CB 3.4Å; F886-M889 PolarHBondContact O-N 3.27Å; F886-G890 PolarHBondContact O-N 2.71Å; F886-G890 VanDerWaalsContact O-N 3.08Å
887	V	91.4	Very high	85.6	Confident	56 Å²	56	33 Å²	33	34%	0.339	19%	0.187	S	C	.	.	H	α-helix	trans	-64.9	-48.1	168.8	170.1	0	0	0	0	110.4	I522 L883 M884 M889 G890 C891	I522-V887 HydrophobicContact CD1-CG2 3.89Å; I522-V887 HydrophobicContact CG1-CG2 4.02Å; L883-V887 HydrophobicContact CD1-CG2 4.49Å; L883-V887 HydrophobicContact CG-CG2 4.44Å; L883-V887 WeakPolarHBondContact O-CB 3.38Å; L883-V887 VanDerWaalsContact O-CG2 3.24Å; L883-V887 WeakPolarHBondContact O-CG2 3.38Å; L883-V887 PolarHBondContact O-N 3.37Å; M884-V887 PolarHBondContact O-N 2.93Å; V887-M889 PolarHBondContact O-N 3.04Å; V887-G890 PolarHBondContact O-N 3.38Å; V887-G890 VanDerWaalsContact O-N 3.13Å; V887-C891 PolarHBondContact O-N 3.49Å; V887-C891 PolarHBondContact O-SG 3.03Å; V887-C891 VanDerWaalsContact O-SG 3.35Å
888	L	88.3	Confident	85.2	Confident	44 Å²	44	37.9 Å²	37.9	23%	0.23	21%	0.213	C	C	.	.	H	α-helix	trans	-60.6	-35.3	175	-76.9	161.7	0	0	0	111.9	F482 Y486 M884 I885 C891 S892	F482-L888 HydrophobicContact CD2-CD1 3.59Å; F482-L888 HydrophobicContact CE2-CD1 3.61Å; Y486-L888 HydrophobicContact CD2-CB 3.65Å; Y486-L888 HydrophobicContact CE2-CB 3.91Å; Y486-L888 HydrophobicContact CG-CB 4.3Å; M884-L888 VanDerWaalsContact O-CB 3.27Å; M884-L888 WeakPolarHBondContact O-CB 3.38Å; M884-L888 WeakPolarHBondContact O-CD1 3.37Å; M884-L888 VanDerWaalsContact O-CG 3.27Å; M884-L888 WeakPolarHBondContact O-CG 3.47Å; M884-L888 PolarHBondContact O-N 3.15Å; I885-L888 PolarHBondContact O-N 3.26Å; L888-C891 CarbonylContact O-C 3.59Å; L888-C891 PolarHBondContact O-N 3.26Å; L888-S892 WeakPolarHBondContact O-CB 3.34Å; L888-S892 PolarHBondContact O-N 2.94Å
889	M	87.4	Confident	84.6	Confident	1 Å²	1	38 Å²	38	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-61.8	-44.5	173.8	-158.9	64.5	70.6	0	0	112	Y486 C489 M490 L514 I885 F886 V887 S892	Y486-M889 HydrophobicContact CD2-CE 4.28Å; Y486-M889 HydrophobicContact CE2-SD 4.31Å; C489-M889 HydrophobicContact CB-CE 3.63Å; M490-M889 VanDerWaalsContact CA-CE 3.49Å; M490-M889 HydrophobicContact CB-CE 3.79Å; M490-M889 HydrophobicContact CB-SD 3.75Å; M490-M889 HydrophobicContact CG-SD 3.84Å; L514-M889 HydrophobicContact CD1-CG 3.54Å; L514-M889 HydrophobicContact CD1-SD 3.56Å; L514-M889 VanDerWaalsContact CD1-SD 3.56Å; L514-M889 HydrophobicContact CG-CG 4.45Å; I885-M889 WeakPolarHBondContact O-CB 3.38Å; I885-M889 PolarHBondContact O-N 2.9Å; F886-M889 WeakPolarHBondContact O-CB 3.4Å; F886-M889 PolarHBondContact O-N 3.27Å; V887-M889 PolarHBondContact O-N 3.04Å; M889-S892 VanDerWaalsContact O-CB 3.31Å; M889-S892 WeakPolarHBondContact O-CB 3.25Å; M889-S892 PolarHBondContact O-N 3.37Å; M889-S892 PolarHBondContact O-OG 3.43Å
890	G	85.6	Confident	84.2	Confident	26 Å²	26	42.1 Å²	42.1	27%	0.268	23%	0.232	S	C	.	.	H	α-helix	trans	-65.3	-41.3	174.8	0	0	0	0	0	112.3	S518 F886 V887 S892	S518-G890 WeakPolarHBondContact OG-CA 3.16Å; S518-G890 PolarHBondContact OG-N 3.48Å; F886-G890 PolarHBondContact O-N 2.71Å; F886-G890 VanDerWaalsContact O-N 3.08Å; V887-G890 PolarHBondContact O-N 3.38Å; V887-G890 VanDerWaalsContact O-N 3.13Å; G890-S892 PolarHBondContact O-N 3.09Å
891	C	84	Confident	83.9	Confident	56 Å²	56	45.5 Å²	45.5	38%	0.378	24%	0.244	S	C	.	.	H	α-helix	trans	-69.9	-15.9	176.8	-65.9	0	0	0	0	113.7	V887 L888 V893 F894 M895	V887-C891 PolarHBondContact O-N 3.49Å; V887-C891 PolarHBondContact O-SG 3.03Å; V887-C891 VanDerWaalsContact O-SG 3.35Å; L888-C891 CarbonylContact O-C 3.59Å; L888-C891 PolarHBondContact O-N 3.26Å; C891-V893 PolarHBondContact O-N 3.46Å; C891-F894 WeakPolarHBondContact O-CB 3.39Å; C891-F894 PolarHBondContact O-N 3.08Å; C891-M895 PolarHBondContact O-N 3.44Å
892	S	81.5	Confident	83.6	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-24.8	-175.1	73.3	0	0	0	0	113.9	Y486 L888 M889 G890 F894 M895 T896 L899	Y486-S892 VanDerWaalsContact OH-CB 3.23Å; Y486-S892 WeakPolarHBondContact OH-CB 3.49Å; L888-S892 WeakPolarHBondContact O-CB 3.34Å; L888-S892 PolarHBondContact O-N 2.94Å; M889-S892 VanDerWaalsContact O-CB 3.31Å; M889-S892 WeakPolarHBondContact O-CB 3.25Å; M889-S892 PolarHBondContact O-N 3.37Å; M889-S892 PolarHBondContact O-OG 3.43Å; G890-S892 PolarHBondContact O-N 3.09Å; S892-F894 VanDerWaalsContact C-N 3.26Å; S892-F894 PolarHBondContact O-N 3.48Å; S892-M895 CarbonylContact O-C 3.57Å; S892-M895 PolarHBondContact O-N 2.87Å; S892-T896 PolarHBondContact O-N 3.4Å; S892-T896 VanDerWaalsContact O-N 3.14Å; S892-L899 WeakPolarHBondContact O-CD1 3.39Å
893	V	76.7	Confident	83.6	Confident	10 Å²	10	46.4 Å²	46.4	6%	0.061	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-37.7	172.6	-177.3	0	0	0	0	111	I511 L514 F761 C891 T896	I511-V893 HydrophobicContact CD1-CG2 4.07Å; L514-V893 HydrophobicContact CD2-CG2 3.5Å; L514-V893 VanDerWaalsContact CD2-CG2 3.5Å; F761-V893 HydrophobicContact CD2-CG2 4.31Å; C891-V893 PolarHBondContact O-N 3.46Å; V893-T896 WeakPolarHBondContact O-CB 3.5Å; V893-T896 WeakPolarHBondContact O-CG2 3.39Å; V893-T896 PolarHBondContact O-OG1 3.3Å
894	F	77.1	Confident	83.2	Confident	181 Å²	181	46.5 Å²	46.5	79%	0.794	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-28.3	174.5	-58.6	-69.3	0	0	0	112.3	C891 S892 T896	C891-F894 WeakPolarHBondContact O-CB 3.39Å; C891-F894 PolarHBondContact O-N 3.08Å; S892-F894 VanDerWaalsContact C-N 3.26Å; S892-F894 PolarHBondContact O-N 3.48Å; F894-T896 VanDerWaalsContact C-N 3.28Å; F894-T896 PolarHBondContact O-N 3.34Å
895	M	74.4	Confident	83.1	Confident	63 Å²	63	43 Å²	43	31%	0.31	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	14.1	176.8	-55.5	-163.6	-26.7	0	0	114	Y486 C891 S892 A897 I898 L899	Y486-M895 HydrophobicContact CE1-CE 4.33Å; C891-M895 PolarHBondContact O-N 3.44Å; S892-M895 CarbonylContact O-C 3.57Å; S892-M895 PolarHBondContact O-N 2.87Å; M895-A897 PolarHBondContact O-N 3.36Å; M895-I898 PolarHBondContact O-N 3.2Å; M895-L899 HydrophobicContact CB-CD1 3.96Å; M895-L899 HydrophobicContact CE-CD1 4.46Å; M895-L899 WeakPolarHBondContact O-CD1 3.15Å; M895-L899 PolarHBondContact O-N 2.87Å
896	T	73.8	Confident	83	Confident	19 Å²	19	43 Å²	43	12%	0.117	23%	0.231	C	C	.	.	H	α-helix	trans	-52.5	-31.9	-179.2	43.4	0	0	0	0	113.3	V757 S892 V893 F894 I898 L899 K900	V757-T896 HydrophobicContact CB-CG2 3.83Å; V757-T896 HydrophobicContact CG1-CG2 3.52Å; S892-T896 PolarHBondContact O-N 3.4Å; S892-T896 VanDerWaalsContact O-N 3.14Å; V893-T896 WeakPolarHBondContact O-CB 3.5Å; V893-T896 WeakPolarHBondContact O-CG2 3.39Å; V893-T896 PolarHBondContact O-OG1 3.3Å; F894-T896 VanDerWaalsContact C-N 3.28Å; F894-T896 PolarHBondContact O-N 3.34Å; T896-I898 VanDerWaalsContact C-N 3.31Å; T896-I898 PolarHBondContact O-N 2.91Å; T896-L899 PolarHBondContact O-N 3.36Å; T896-K900 WeakPolarHBondContact O-CB 3.36Å; T896-K900 VanDerWaalsContact O-CG 3.26Å; T896-K900 WeakPolarHBondContact O-CG 3.33Å; T896-K900 PolarHBondContact O-N 2.68Å; T896-K900 VanDerWaalsContact O-N 3.1Å
897	A	75.1	Confident	82.6	Confident	69 Å²	69	43.2 Å²	43.2	57%	0.57	23%	0.232	S	C	*	.	H	α-helix	trans	-60.6	-37.2	176.4	0	0	0	0	0	113.2	M895 F901	M895-A897 PolarHBondContact O-N 3.36Å; A897-F901 WeakPolarHBondContact O-CD2 3.23Å; A897-F901 WeakPolarHBondContact O-CE2 3.41Å
898	I	77.8	Confident	82.4	Confident	117 Å²	117	42 Å²	42	60%	0.6	22%	0.222	S	C	*	.	H	α-helix	trans	-82.6	-40.7	-179.9	-59.7	173.5	0	0	0	110	M895 T896 K900 F901	M895-I898 PolarHBondContact O-N 3.2Å; T896-I898 VanDerWaalsContact C-N 3.31Å; T896-I898 PolarHBondContact O-N 2.91Å; I898-K900 VanDerWaalsContact C-N 3.32Å; I898-K900 PolarHBondContact O-N 3.44Å; I898-F901 PolarHBondContact O-N 2.83Å
899	L	76.2	Confident	82.5	Confident	5 Å²	5	39.9 Å²	39.9	3%	0.026	21%	0.211	C	C	.	.	H	α-helix	trans	-69.6	-28.1	-174.5	-71.7	155.4	0	0	0	113.4	Y486 M490 V757 S892 M895 T896 F901 I902	Y486-L899 HydrophobicContact CE1-CD2 4.45Å; Y486-L899 WeakPolarHBondContact OH-CD1 3.34Å; M490-L899 HydrophobicContact CE-CB 4.16Å; M490-L899 HydrophobicContact CE-CD1 3.6Å; M490-L899 HydrophobicContact CE-CD2 3.61Å; M490-L899 HydrophobicContact CE-CG 3.95Å; M490-L899 HydrophobicContact SD-CD1 4.23Å; M490-L899 HydrophobicContact SD-CD2 3.43Å; M490-L899 WeakPolarHBondContact SD-CD2 3.19Å; M490-L899 HydrophobicContact SD-CG 4.35Å; V757-L899 HydrophobicContact CG2-CB 4.25Å; S892-L899 WeakPolarHBondContact O-CD1 3.39Å; M895-L899 HydrophobicContact CB-CD1 3.96Å; M895-L899 HydrophobicContact CE-CD1 4.46Å; M895-L899 WeakPolarHBondContact O-CD1 3.15Å; M895-L899 PolarHBondContact O-N 2.87Å; T896-L899 PolarHBondContact O-N 3.36Å; L899-F901 PolarHBondContact O-N 3.31Å; L899-I902 HydrophobicContact CD2-CD1 3.87Å; L899-I902 PolarHBondContact O-N 2.74Å; L899-I902 VanDerWaalsContact O-N 3.1Å
900	K	80.4	Confident	82.4	Confident	99 Å²	99	40 Å²	40	43%	0.43	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-16.6	173.4	-80.5	177.4	-178.7	-173.4	0	113.7	K754 T896 I898 I902	K754-K900 WeakPolarHBondContact CB-O 3.24Å; K754-K900 VanDerWaalsContact CD-O 3.25Å; K754-K900 WeakPolarHBondContact CD-O 2.88Å; T896-K900 WeakPolarHBondContact O-CB 3.36Å; T896-K900 VanDerWaalsContact O-CG 3.26Å; T896-K900 WeakPolarHBondContact O-CG 3.33Å; T896-K900 PolarHBondContact O-N 2.68Å; T896-K900 VanDerWaalsContact O-N 3.1Å; I898-K900 VanDerWaalsContact C-N 3.32Å; I898-K900 PolarHBondContact O-N 3.44Å; K900-I902 VanDerWaalsContact C-N 3.35Å
901	F	83.9	Confident	82.4	Confident	100 Å²	100	39.3 Å²	39.3	44%	0.439	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-9.8	176.2	-66.2	-70.3	0	0	0	113.4	V742 A897 I898 L899 P903	V742-F901 HydrophobicContact CG1-CB 4.36Å; A897-F901 WeakPolarHBondContact O-CD2 3.23Å; A897-F901 WeakPolarHBondContact O-CE2 3.41Å; I898-F901 PolarHBondContact O-N 2.83Å; L899-F901 PolarHBondContact O-N 3.31Å; F901-P903 VanDerWaalsContact O-CD 3.31Å; F901-P903 WeakPolarHBondContact O-CD 3.43Å
902	I	85.8	Confident	82.6	Confident	22 Å²	22	37.4 Å²	37.4	11%	0.113	19%	0.187	C	C	.	.	S	Bend	trans	-81.8	117.9	-177.7	-55.3	179.5	0	0	0	109.8	V742 L755 L899 K900 L907	V742-I902 HydrophobicContact CG2-CB 4.46Å; V742-I902 HydrophobicContact CG2-CG1 4.21Å; V742-I902 HydrophobicContact CG2-CG2 4.36Å; L755-I902 PolarHBondContact N-O 3.49Å; L899-I902 HydrophobicContact CD2-CD1 3.87Å; L899-I902 PolarHBondContact O-N 2.74Å; L899-I902 VanDerWaalsContact O-N 3.1Å; K900-I902 VanDerWaalsContact C-N 3.35Å; I902-L907 HydrophobicContact CG2-CD1 4.05Å; I902-L907 HydrophobicContact CG2-CD2 4.03Å; I902-L907 HydrophobicContact CG2-CG 3.93Å
903	P	87.4	Confident	82.9	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-76.9	137.6	177.7	33.7	-35.4	0	0	0	110.4	L701 D745 F901 P905 V906	L701-P903 HydrophobicContact CD1-CB 4.32Å; L701-P903 HydrophobicContact CD1-CG 4.2Å; D745-P903 HydrophobicContact CB-CG 4.23Å; F901-P903 VanDerWaalsContact O-CD 3.31Å; F901-P903 WeakPolarHBondContact O-CD 3.43Å; P903-P905 VanDerWaalsContact C-CD 3.41Å; P903-V906 HydrophobicContact CG-CB 4.09Å; P903-V906 HydrophobicContact CG-CG2 3.57Å; P903-V906 PolarHBondContact O-N 3Å
904	M	84.5	Confident	83.3	Confident	30 Å²	30	37.9 Å²	37.9	15%	0.148	19%	0.188	C	C	.	.	H	α-helix	trans	-57.5	-39	179.4	-67.2	-70.5	-149.1	0	0	113.9	P753 L755 V906 L907 Y908	P753-M904 WeakPolarHBondContact O-CB 3.47Å; P753-M904 WeakPolarHBondContact O-CG 3.28Å; P753-M904 PolarHBondContact O-N 3.48Å; L755-M904 HydrophobicContact CB-SD 4.39Å; L755-M904 HydrophobicContact CD1-CE 3.58Å; L755-M904 HydrophobicContact CD1-SD 3.62Å; M904-V906 VanDerWaalsContact C-N 3.26Å; M904-V906 PolarHBondContact O-N 3.47Å; M904-L907 WeakPolarHBondContact O-CB 3.29Å; M904-L907 PolarHBondContact O-N 3.48Å; M904-L907 HydrophobicContact SD-CD1 4.33Å; M904-Y908 HydrophobicContact CB-CE2 4.25Å; M904-Y908 PolarHBondContact O-N 2.87Å
905	P	89.3	Confident	83.7	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-60.9	-31.6	179.9	-25.1	35.6	0	0	0	113.9	L616 S698 L701 P753 P903 Y908 G909	L616-P905 HydrophobicContact CD2-CG 4.04Å; S698-P905 WeakPolarHBondContact O-CB 3.47Å; L701-P905 HydrophobicContact CB-CB 4.24Å; P753-P905 HydrophobicContact CG-CG 4.12Å; P903-P905 VanDerWaalsContact C-CD 3.41Å; P905-Y908 PolarHBondContact O-N 3.47Å; P905-G909 PolarHBondContact O-N 3.46Å
906	V	89.4	Confident	84.4	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-65.5	-43.9	173.9	171.6	0	0	0	0	110.1	L701 T705 I738 M741 P903 M904 Y908 G909 V910	L701-V906 HydrophobicContact CB-CG2 4.06Å; L701-V906 HydrophobicContact CD1-CG2 4.42Å; L701-V906 HydrophobicContact CD2-CG2 4.12Å; L701-V906 HydrophobicContact CG-CG2 4.44Å; T705-V906 HydrophobicContact CG2-CG1 4Å; T705-V906 WeakPolarHBondContact CG2-O 3.48Å; I738-V906 HydrophobicContact CB-CG1 4.49Å; I738-V906 HydrophobicContact CG1-CG1 4.26Å; I738-V906 HydrophobicContact CG2-CG1 4.39Å; M741-V906 HydrophobicContact CB-CG1 4.09Å; M741-V906 HydrophobicContact CB-CG2 3.64Å; M741-V906 HydrophobicContact CG-CG2 4.45Å; P903-V906 HydrophobicContact CG-CB 4.09Å; P903-V906 HydrophobicContact CG-CG2 3.57Å; P903-V906 PolarHBondContact O-N 3Å; M904-V906 VanDerWaalsContact C-N 3.26Å; M904-V906 PolarHBondContact O-N 3.47Å; V906-Y908 VanDerWaalsContact C-N 3.31Å; V906-Y908 PolarHBondContact O-N 2.95Å; V906-G909 PolarHBondContact O-N 3.24Å; V906-G909 VanDerWaalsContact O-N 3.14Å; V906-V910 WeakPolarHBondContact O-CG2 3.31Å; V906-V910 PolarHBondContact O-N 3.5Å
907	L	85.1	Confident	84.9	Confident	9 Å²	9	29.1 Å²	29.1	5%	0.047	15%	0.154	C	C	.	.	H	α-helix	trans	-63.9	-37.3	177	-62.2	172.9	0	0	0	111.9	L755 I902 M904 V910 F911	L755-L907 HydrophobicContact CD1-CD1 4.35Å; L755-L907 HydrophobicContact CD2-CD1 4.45Å; I902-L907 HydrophobicContact CG2-CD1 4.05Å; I902-L907 HydrophobicContact CG2-CD2 4.03Å; I902-L907 HydrophobicContact CG2-CG 3.93Å; M904-L907 WeakPolarHBondContact O-CB 3.29Å; M904-L907 PolarHBondContact O-N 3.48Å; M904-L907 HydrophobicContact SD-CD1 4.33Å; L907-V910 PolarHBondContact O-N 3.21Å; L907-F911 WeakPolarHBondContact O-CG 3.33Å; L907-F911 PolarHBondContact O-N 2.79Å
908	Y	87.3	Confident	85.2	Confident	31 Å²	31	26.1 Å²	26.1	12%	0.122	13%	0.129	C	C	.	.	H	α-helix	trans	-65.2	-37.8	173.1	-58.6	-21.4	0	0	0	112	K612 F702 M904 P905 V906 V910 F911 L912	K612-Y908 HydrophobicContact CB-CD1 4.48Å; K612-Y908 HydrophobicContact CB-CD2 4.13Å; K612-Y908 HydrophobicContact CB-CE1 4.19Å; K612-Y908 HydrophobicContact CB-CE2 3.8Å; K612-Y908 HydrophobicContact CB-CG 4.47Å; K612-Y908 HydrophobicContact CD-CD1 4.15Å; K612-Y908 HydrophobicContact CD-CE1 3.59Å; K612-Y908 HydrophobicContact CG-CE1 4.47Å; F702-Y908 WeakPolarHBondContact CE2-O 3.23Å; M904-Y908 HydrophobicContact CB-CE2 4.25Å; M904-Y908 PolarHBondContact O-N 2.87Å; P905-Y908 PolarHBondContact O-N 3.47Å; V906-Y908 VanDerWaalsContact C-N 3.31Å; V906-Y908 PolarHBondContact O-N 2.95Å; Y908-V910 VanDerWaalsContact C-N 3.33Å; Y908-V910 PolarHBondContact O-N 3.4Å; Y908-F911 HydrophobicContact CD1-CD2 4.07Å; Y908-F911 HydrophobicContact CD1-CE2 4.31Å; Y908-F911 WeakPolarHBondContact O-CB 3.27Å; Y908-F911 PolarHBondContact O-N 2.9Å; Y908-L912 PolarHBondContact O-N 3.03Å
909	G	88.9	Confident	85.5	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-63	-38.4	173.2	0	0	0	0	0	112.6	F702 P905 V906 L912 Y913	F702-G909 VanDerWaalsContact CD2-N 3.32Å; P905-G909 PolarHBondContact O-N 3.46Å; V906-G909 PolarHBondContact O-N 3.24Å; V906-G909 VanDerWaalsContact O-N 3.14Å; G909-L912 PolarHBondContact O-N 3.04Å; G909-Y913 PolarHBondContact O-N 2.72Å
910	V	86.2	Confident	85.5	Confident	3 Å²	3	27.3 Å²	27.3	2%	0.018	13%	0.133	C	C	.	.	H	α-helix	trans	-67.3	-37.2	172.1	177.1	0	0	0	0	111.6	T705 V734 I738 V906 L907 Y908 Y913 M914	T705-V910 HydrophobicContact CG2-CG2 3.66Å; V734-V910 HydrophobicContact CG1-CG1 3.74Å; V734-V910 HydrophobicContact CG1-CG2 4.02Å; I738-V910 HydrophobicContact CD1-CG2 4.01Å; I738-V910 HydrophobicContact CG1-CG2 3.78Å; V906-V910 WeakPolarHBondContact O-CG2 3.31Å; V906-V910 PolarHBondContact O-N 3.5Å; L907-V910 PolarHBondContact O-N 3.21Å; Y908-V910 VanDerWaalsContact C-N 3.33Å; Y908-V910 PolarHBondContact O-N 3.4Å; V910-Y913 WeakPolarHBondContact O-CB 3.47Å; V910-Y913 PolarHBondContact O-N 2.61Å; V910-M914 HydrophobicContact CG1-CE 4.24Å; V910-M914 HydrophobicContact CG1-CG 4.44Å; V910-M914 WeakPolarHBondContact O-CG 3.48Å; V910-M914 PolarHBondContact O-N 3.11Å
911	F	84.8	Confident	85	Confident	11 Å²	11	24.9 Å²	24.9	5%	0.048	14%	0.135	C	C	.	.	H	α-helix	trans	-61.4	-45.3	173.4	-72.2	-13.2	0	0	0	112.6	S491 P492 A609 L907 Y908 Y913 M914 G915	S491-F911 WeakPolarHBondContact OG-CE2 3.32Å; S491-F911 WeakPolarHBondContact OG-CZ 3.23Å; P492-F911 HydrophobicContact CB-CZ 4.39Å; P492-F911 VanDerWaalsContact CD-CZ 3.44Å; P492-F911 HydrophobicContact CG-CE1 3.62Å; P492-F911 HydrophobicContact CG-CZ 3.51Å; A609-F911 HydrophobicContact CB-CB 4.13Å; L907-F911 WeakPolarHBondContact O-CG 3.33Å; L907-F911 PolarHBondContact O-N 2.79Å; Y908-F911 HydrophobicContact CD1-CD2 4.07Å; Y908-F911 HydrophobicContact CD1-CE2 4.31Å; Y908-F911 WeakPolarHBondContact O-CB 3.27Å; Y908-F911 PolarHBondContact O-N 2.9Å; F911-Y913 VanDerWaalsContact C-N 3.3Å; F911-Y913 PolarHBondContact O-N 2.85Å; F911-M914 HydrophobicContact CD1-CE 3.47Å; F911-M914 VanDerWaalsContact CD1-CE 3.47Å; F911-M914 HydrophobicContact CE1-CE 3.97Å; F911-M914 PolarHBondContact O-N 3.49Å; F911-G915 PolarHBondContact O-N 3.41Å
912	L	88.4	Confident	85	Confident	17 Å²	17	20.6 Å²	20.6	9%	0.089	12%	0.117	C	C	.	.	H	α-helix	trans	-59.3	-44.6	174.4	-177.3	67.2	0	0	0	110.7	I606 A609 F702 F706 Y908 G909 G915 V916	I606-L912 HydrophobicContact CB-CD1 4.42Å; I606-L912 HydrophobicContact CG1-CD1 4.32Å; I606-L912 HydrophobicContact CG2-CD1 3.86Å; A609-L912 HydrophobicContact CB-CB 4.34Å; F702-L912 HydrophobicContact CE1-CD2 3.79Å; F702-L912 HydrophobicContact CE2-CB 4.39Å; F702-L912 HydrophobicContact CZ-CB 4.06Å; F702-L912 HydrophobicContact CZ-CD2 3.68Å; F702-L912 HydrophobicContact CZ-CG 4.38Å; F706-L912 HydrophobicContact CB-CD2 4.27Å; F706-L912 HydrophobicContact CD1-CD2 4.37Å; F706-L912 HydrophobicContact CD2-CB 4.34Å; F706-L912 HydrophobicContact CD2-CD2 3.88Å; F706-L912 HydrophobicContact CD2-CG 3.9Å; F706-L912 HydrophobicContact CE2-CD2 4.32Å; F706-L912 HydrophobicContact CE2-CG 4.16Å; F706-L912 HydrophobicContact CG-CD2 3.91Å; F706-L912 HydrophobicContact CG-CG 4.43Å; Y908-L912 PolarHBondContact O-N 3.03Å; G909-L912 PolarHBondContact O-N 3.04Å; L912-G915 PolarHBondContact O-N 3.14Å; L912-V916 HydrophobicContact CD1-CG2 4.35Å; L912-V916 WeakPolarHBondContact O-CG2 3.05Å; L912-V916 PolarHBondContact O-N 3.31Å
913	Y	88.3	Confident	84.8	Confident	18 Å²	18	21 Å²	21	7%	0.071	12%	0.118	C	C	.	.	H	α-helix	trans	-59.6	-47.9	176.5	170	-99.4	0	0	0	112.6	K713 V734 G909 V910 F911 G915 V916 S917	K713-Y913 WeakPolarHBondContact CD-OH 2.86Å; K713-Y913 WeakPolarHBondContact CG-OH 3.45Å; V734-Y913 HydrophobicContact CG2-CD1 3.93Å; V734-Y913 HydrophobicContact CG2-CE1 3.43Å; V734-Y913 VanDerWaalsContact CG2-CE1 3.43Å; G909-Y913 PolarHBondContact O-N 2.72Å; V910-Y913 WeakPolarHBondContact O-CB 3.47Å; V910-Y913 PolarHBondContact O-N 2.61Å; F911-Y913 VanDerWaalsContact C-N 3.3Å; F911-Y913 PolarHBondContact O-N 2.85Å; Y913-G915 VanDerWaalsContact C-N 3.34Å; Y913-G915 PolarHBondContact O-N 3.38Å; Y913-V916 PolarHBondContact O-N 3.41Å; Y913-S917 VanDerWaalsContact O-CB 3.25Å; Y913-S917 WeakPolarHBondContact O-CB 3.21Å; Y913-S917 PolarHBondContact O-N 3.5Å
914	M	85.2	Confident	84.8	Confident	2 Å²	2	21.2 Å²	21.2	1%	0.01	12%	0.119	C	C	.	.	H	α-helix	trans	-61.9	-42.8	178.5	-72.9	-169.2	-65.6	0	0	111.7	F484 A488 V848 T852 V910 F911 S918	F484-M914 HydrophobicContact CZ-SD 4.4Å; A488-M914 HydrophobicContact CB-CE 3.95Å; A488-M914 HydrophobicContact CB-SD 3.61Å; V848-M914 HydrophobicContact CG1-CB 4.41Å; T852-M914 HydrophobicContact CG2-CG 4.39Å; T852-M914 HydrophobicContact CG2-SD 4.24Å; V910-M914 HydrophobicContact CG1-CE 4.24Å; V910-M914 HydrophobicContact CG1-CG 4.44Å; V910-M914 WeakPolarHBondContact O-CG 3.48Å; V910-M914 PolarHBondContact O-N 3.11Å; F911-M914 HydrophobicContact CD1-CE 3.47Å; F911-M914 VanDerWaalsContact CD1-CE 3.47Å; F911-M914 HydrophobicContact CE1-CE 3.97Å; F911-M914 PolarHBondContact O-N 3.49Å; M914-S918 WeakPolarHBondContact O-CB 3.37Å; M914-S918 PolarHBondContact O-N 2.77Å; M914-S918 PolarHBondContact O-OG 3.42Å
915	G	86	Confident	84.9	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-56.7	-57.8	173.8	0	0	0	0	0	111.2	F911 L912 Y913 S917 S918 L919	F911-G915 PolarHBondContact O-N 3.41Å; L912-G915 PolarHBondContact O-N 3.14Å; Y913-G915 VanDerWaalsContact C-N 3.34Å; Y913-G915 PolarHBondContact O-N 3.38Å; G915-S917 PolarHBondContact O-N 3.26Å; G915-S918 PolarHBondContact O-N 3.01Å; G915-S918 VanDerWaalsContact O-N 3.16Å; G915-S918 PolarHBondContact O-OG 2.98Å; G915-L919 WeakPolarHBondContact O-CD1 3.46Å; G915-L919 PolarHBondContact O-N 3.17Å
916	V	87.6	Confident	84.6	Confident	45 Å²	45	24.5 Å²	24.5	27%	0.273	14%	0.135	S	C	.	.	H	α-helix	trans	-62.3	-41.6	-178	174.8	0	0	0	0	112.6	I606 F706 L912 Y913 S918 L919	I606-V916 HydrophobicContact CD1-CG2 3.92Å; I606-V916 HydrophobicContact CG1-CG2 4.29Å; F706-V916 HydrophobicContact CE2-CB 4.16Å; F706-V916 HydrophobicContact CE2-CG1 4.43Å; F706-V916 HydrophobicContact CE2-CG2 4.07Å; F706-V916 HydrophobicContact CZ-CG1 4.47Å; F706-V916 HydrophobicContact CZ-CG2 4.4Å; L912-V916 HydrophobicContact CD1-CG2 4.35Å; L912-V916 WeakPolarHBondContact O-CG2 3.05Å; L912-V916 PolarHBondContact O-N 3.31Å; Y913-V916 PolarHBondContact O-N 3.41Å; V916-S918 VanDerWaalsContact C-N 3.27Å; V916-S918 PolarHBondContact O-N 3Å; V916-L919 PolarHBondContact O-N 2.72Å
917	S	84.3	Confident	84.5	Confident	33 Å²	33	24.6 Å²	24.6	23%	0.231	14%	0.135	C	C	.	.	H	α-helix	trans	-65.2	-31	178.6	-175.4	0	0	0	0	112.3	Y913 G915 Q920	Y913-S917 VanDerWaalsContact O-CB 3.25Å; Y913-S917 WeakPolarHBondContact O-CB 3.21Å; Y913-S917 PolarHBondContact O-N 3.5Å; G915-S917 PolarHBondContact O-N 3.26Å; S917-Q920 PolarHBondContact O-N 3.43Å
918	S	83.1	Confident	84.5	Confident	7 Å²	7	27.1 Å²	27.1	5%	0.049	15%	0.148	C	C	.	.	H	α-helix	trans	-76.1	-20.8	176.6	61.5	0	0	0	0	114	C602 M914 G915 V916 Q920	C602-S918 PolarHBondContact SG-OG 3.39Å; M914-S918 WeakPolarHBondContact O-CB 3.37Å; M914-S918 PolarHBondContact O-N 2.77Å; M914-S918 PolarHBondContact O-OG 3.42Å; G915-S918 PolarHBondContact O-N 3.01Å; G915-S918 VanDerWaalsContact O-N 3.16Å; G915-S918 PolarHBondContact O-OG 2.98Å; V916-S918 VanDerWaalsContact C-N 3.27Å; V916-S918 PolarHBondContact O-N 3Å; S918-Q920 VanDerWaalsContact C-N 3.33Å
919	L	82.9	Confident	84.4	Confident	16 Å²	16	30.5 Å²	30.5	8%	0.084	16%	0.164	C	C	.	.	H	α-helix	trans	-70.7	-30.6	169.3	-82.9	81.2	0	0	0	111.9	C602 I606 G915 V916 G921 I922 F925	C602-L919 HydrophobicContact CB-CD1 3.27Å; C602-L919 HydrophobicContact CB-CG 4.17Å; I606-L919 HydrophobicContact CD1-CD1 3.71Å; G915-L919 WeakPolarHBondContact O-CD1 3.46Å; G915-L919 PolarHBondContact O-N 3.17Å; V916-L919 PolarHBondContact O-N 2.72Å; L919-G921 PolarHBondContact O-N 3.22Å; L919-I922 PolarHBondContact O-N 3.39Å; L919-F925 HydrophobicContact CB-CD1 4.07Å; L919-F925 HydrophobicContact CB-CE1 4.25Å; L919-F925 HydrophobicContact CB-CG 4.37Å; L919-F925 HydrophobicContact CD2-CD1 4.44Å; L919-F925 HydrophobicContact CD2-CD2 3.89Å; L919-F925 HydrophobicContact CD2-CE1 4.3Å; L919-F925 HydrophobicContact CD2-CE2 3.78Å; L919-F925 HydrophobicContact CD2-CG 4.24Å; L919-F925 HydrophobicContact CD2-CZ 3.99Å
920	Q	75.7	Confident	84.2	Confident	131 Å²	131	31 Å²	31	61%	0.612	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.6	93.9	179.5	-64.2	-177.7	-5.7	0	0	109.9	S917 S918	S917-Q920 PolarHBondContact O-N 3.43Å; S918-Q920 VanDerWaalsContact C-N 3.33Å
921	G	71.8	Confident	84.1	Confident	47 Å²	47	38.5 Å²	38.5	49%	0.485	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	134.2	-6.2	-178.8	0	0	0	0	0	114.8	L919	L919-G921 PolarHBondContact O-N 3.22Å
922	I	82.9	Confident	84	Confident	11 Å²	11	41.5 Å²	41.5	6%	0.056	23%	0.232	C	C	.	.			trans	-86.6	124.2	172.5	-55.4	178.3	0	0	0	108.7	E595 A598 L919 F924 F925 D926	E595-I922 HydrophobicContact CB-CG2 3.76Å; E595-I922 HydrophobicContact CG-CG2 3.89Å; A598-I922 HydrophobicContact CB-CD1 3.98Å; L919-I922 PolarHBondContact O-N 3.39Å; I922-F924 VanDerWaalsContact C-N 3.29Å; I922-F924 HydrophobicContact CG2-CB 3.95Å; I922-F924 PolarHBondContact O-N 3.23Å; I922-F925 PolarHBondContact O-N 3.07Å; I922-F925 VanDerWaalsContact O-N 3.09Å; I922-D926 PolarHBondContact O-N 2.76Å
923	Q	82.5	Confident	83.8	Confident	31 Å²	31	44.4 Å²	44.4	15%	0.145	25%	0.247	C	C	.	.	H	α-helix	trans	-64	-35.1	-178.2	-66.9	-170.1	-17.2	0	0	112.3	R591 E595 F925 D926 R927	R591-Q923 VanDerWaalsContact NH2-CG 3.31Å; E595-Q923 WeakPolarHBondContact OE1-CB 3.35Å; E595-Q923 PolarHBondContact OE1-N 3.01Å; E595-Q923 WeakPolarHBondContact OE2-CB 3.49Å; Q923-F925 VanDerWaalsContact C-N 3.26Å; Q923-F925 PolarHBondContact O-N 2.66Å; Q923-D926 PolarHBondContact O-N 3.49Å; Q923-R927 WeakPolarHBondContact O-CB 3.24Å; Q923-R927 WeakPolarHBondContact O-CG 3.47Å; Q923-R927 PolarHBondContact O-N 2.86Å
924	F	86.6	Confident	83.5	Confident	4 Å²	4	47.4 Å²	47.4	2%	0.018	27%	0.268	C	S	.	.	H	α-helix	trans	-50	-45.8	171.5	173	-114	0	0	0	112.8	E595 I922 R927 L928 Q959 L960 L963	E595-F924 HydrophobicContact CB-CB 4.27Å; E595-F924 PolarHBondContact OE2-N 3.47Å; I922-F924 VanDerWaalsContact C-N 3.29Å; I922-F924 HydrophobicContact CG2-CB 3.95Å; I922-F924 PolarHBondContact O-N 3.23Å; F924-R927 PolarHBondContact O-N 3.46Å; F924-L928 WeakPolarHBondContact O-CB 3.44Å; F924-L928 PolarHBondContact O-N 3.48Å; F924-Q959 HydrophobicContact CD2-CB 4.04Å; F924-Q959 HydrophobicContact CD2-CG 3.69Å; F924-Q959 HydrophobicContact CE2-CB 3.78Å; F924-Q959 HydrophobicContact CE2-CG 3.74Å; F924-Q959 HydrophobicContact CG-CG 4.41Å; F924-L960 HydrophobicContact CE2-CB 4.47Å; F924-L960 HydrophobicContact CZ-CB 4.28Å; F924-L960 HydrophobicContact CZ-CD1 4.14Å; F924-L963 HydrophobicContact CE1-CD2 3.79Å; F924-L963 HydrophobicContact CZ-CD2 4.11Å
925	F	86.1	Confident	83	Confident	58 Å²	58	51 Å²	51	25%	0.254	30%	0.298	S	S	.	.	H	α-helix	trans	-71	-37.2	-179.8	-170.1	-118.5	0	0	0	112	L919 I922 Q923 R927 L928 K929	L919-F925 HydrophobicContact CB-CD1 4.07Å; L919-F925 HydrophobicContact CB-CE1 4.25Å; L919-F925 HydrophobicContact CB-CG 4.37Å; L919-F925 HydrophobicContact CD2-CD1 4.44Å; L919-F925 HydrophobicContact CD2-CD2 3.89Å; L919-F925 HydrophobicContact CD2-CE1 4.3Å; L919-F925 HydrophobicContact CD2-CE2 3.78Å; L919-F925 HydrophobicContact CD2-CG 4.24Å; L919-F925 HydrophobicContact CD2-CZ 3.99Å; I922-F925 PolarHBondContact O-N 3.07Å; I922-F925 VanDerWaalsContact O-N 3.09Å; Q923-F925 VanDerWaalsContact C-N 3.26Å; Q923-F925 PolarHBondContact O-N 2.66Å; F925-R927 VanDerWaalsContact C-N 3.34Å; F925-L928 HydrophobicContact CD2-CD2 4.29Å; F925-L928 WeakPolarHBondContact O-CB 3.36Å; F925-L928 PolarHBondContact O-N 3.32Å; F925-K929 VanDerWaalsContact CD1-CE 3.49Å; F925-K929 HydrophobicContact CE1-CD 4.38Å; F925-K929 WeakPolarHBondContact O-CG 3.22Å; F925-K929 PolarHBondContact O-N 2.94Å
926	D	83.7	Confident	82.6	Confident	41 Å²	41	60.7 Å²	60.7	22%	0.219	34%	0.34	C	S	.	.	H	α-helix	trans	-64.6	-39.5	173.8	-67.7	-26.9	0	0	0	111.6	I922 Q923 L928 K929 L930 F941	I922-D926 PolarHBondContact O-N 2.76Å; Q923-D926 PolarHBondContact O-N 3.49Å; D926-L928 VanDerWaalsContact C-N 3.34Å; D926-K929 WeakPolarHBondContact O-CB 3.28Å; D926-K929 PolarHBondContact O-N 3.44Å; D926-K929 IonicContact OD1-NZ 2.68Å; D926-L930 WeakPolarHBondContact O-CG 3.37Å; D926-L930 PolarHBondContact O-N 2.97Å; D926-L930 VanDerWaalsContact O-N 3.13Å; D926-F941 HydrophobicContact CB-CZ 4.21Å
927	R	86.5	Confident	81.9	Confident	2 Å²	2	64.9 Å²	64.9	1%	0.008	36%	0.357	C	S	.	.	H	α-helix	trans	-69.4	-31.2	173.6	-60.4	167.5	-167.1	-178.3	6.4	112.5	Q923 F924 F925 L930 Y943 T956 L1004	Q923-R927 WeakPolarHBondContact O-CB 3.24Å; Q923-R927 WeakPolarHBondContact O-CG 3.47Å; Q923-R927 PolarHBondContact O-N 2.86Å; F924-R927 PolarHBondContact O-N 3.46Å; F925-R927 VanDerWaalsContact C-N 3.34Å; R927-L930 WeakPolarHBondContact O-CB 3.35Å; R927-L930 PolarHBondContact O-N 2.9Å; R927-Y943 HydrophobicContact CG-CE2 4.33Å; R927-T956 HydrophobicContact CB-CG2 3.37Å; R927-T956 HydrophobicContact CG-CG2 4.27Å; R927-L1004 PolarHBondContact NH1-O 3.36Å; R927-L1004 PolarHBondContact NH2-O 2.97Å
928	L	86.4	Confident	81.3	Confident	61 Å²	61	65.3 Å²	65.3	32%	0.319	36%	0.355	S	S	.	.	H	α-helix	trans	-66.5	-41.7	172.5	-171.9	65.2	0	0	0	110.9	F924 F925 D926 L930 F931 L960	F924-L928 WeakPolarHBondContact O-CB 3.44Å; F924-L928 PolarHBondContact O-N 3.48Å; F925-L928 HydrophobicContact CD2-CD2 4.29Å; F925-L928 WeakPolarHBondContact O-CB 3.36Å; F925-L928 PolarHBondContact O-N 3.32Å; D926-L928 VanDerWaalsContact C-N 3.34Å; L928-L930 VanDerWaalsContact C-N 3.26Å; L928-L930 PolarHBondContact O-N 3.33Å; L928-F931 VanDerWaalsContact O-CB 3.25Å; L928-F931 WeakPolarHBondContact O-CB 3.44Å; L928-F931 PolarHBondContact O-N 2.83Å; L928-L960 HydrophobicContact CD1-CD2 4.39Å
929	K	85.3	Confident	80.7	Confident	103 Å²	103	67.5 Å²	67.5	45%	0.448	37%	0.369	S	S	.	.	H	α-helix	trans	-60.7	-34.1	173.1	-71.1	176	-171.3	162.4	0	112.7	F925 D926 F931 G932 M933	F925-K929 VanDerWaalsContact CD1-CE 3.49Å; F925-K929 HydrophobicContact CE1-CD 4.38Å; F925-K929 WeakPolarHBondContact O-CG 3.22Å; F925-K929 PolarHBondContact O-N 2.94Å; D926-K929 WeakPolarHBondContact O-CB 3.28Å; D926-K929 PolarHBondContact O-N 3.44Å; D926-K929 IonicContact OD1-NZ 2.68Å; K929-F931 PolarHBondContact O-N 3.49Å; K929-F931 VanDerWaalsContact O-N 3.16Å; K929-G932 PolarHBondContact O-N 3.4Å; K929-M933 PolarHBondContact O-N 3.36Å
930	L	84.1	Confident	79.5	Confident	10 Å²	10	74.7 Å²	74.7	5%	0.052	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-23.7	175	-68.1	175.7	0	0	0	112.9	D926 R927 L928 G932 M933 Q938 P939 F941 Y943 L944	D926-L930 WeakPolarHBondContact O-CG 3.37Å; D926-L930 PolarHBondContact O-N 2.97Å; D926-L930 VanDerWaalsContact O-N 3.13Å; R927-L930 WeakPolarHBondContact O-CB 3.35Å; R927-L930 PolarHBondContact O-N 2.9Å; L928-L930 VanDerWaalsContact C-N 3.26Å; L928-L930 PolarHBondContact O-N 3.33Å; L930-G932 VanDerWaalsContact C-N 3.31Å; L930-M933 HydrophobicContact CD2-SD 4.47Å; L930-M933 PolarHBondContact O-N 3.03Å; L930-Q938 HydrophobicContact CD2-CG 3.83Å; L930-P939 HydrophobicContact CD2-CG 4.44Å; L930-F941 HydrophobicContact CD1-CD2 4.16Å; L930-F941 HydrophobicContact CD1-CE2 4.3Å; L930-F941 HydrophobicContact CD2-CD2 4.44Å; L930-F941 HydrophobicContact CD2-CE2 4.18Å; L930-F941 HydrophobicContact CG-CE2 4.41Å; L930-Y943 HydrophobicContact CD1-CE2 4.37Å; L930-L944 HydrophobicContact CD1-CD1 4.29Å; L930-L944 HydrophobicContact CD1-CD2 4.27Å
931	F	84.7	Confident	79.1	Confident	161 Å²	161	71.6 Å²	71.6	71%	0.706	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-32.9	174.7	-166.6	-94.8	0	0	0	112.4	L928 K929 H953	L928-F931 VanDerWaalsContact O-CB 3.25Å; L928-F931 WeakPolarHBondContact O-CB 3.44Å; L928-F931 PolarHBondContact O-N 2.83Å; K929-F931 PolarHBondContact O-N 3.49Å; K929-F931 VanDerWaalsContact O-N 3.16Å; F931-H953 AromaticContact CD2-ND1 3.92Å
932	G	83.1	Confident	78.6	Confident	73 Å²	73	73.3 Å²	73.3	75%	0.753	39%	0.39	S	S	*	.	S	Bend	trans	-94	-0.1	178.1	0	0	0	0	0	114.2	K929 L930	K929-G932 PolarHBondContact O-N 3.4Å; L930-G932 VanDerWaalsContact C-N 3.31Å
933	M	82.8	Confident	77.9	Confident	79 Å²	79	73.5 Å²	73.5	39%	0.389	39%	0.39	S	S	.	.	S	Bend	trans	-101.6	129	-175.5	-162.5	173.5	-157.4	0	0	110.8	K929 L930 H937 P939	K929-M933 PolarHBondContact O-N 3.36Å; L930-M933 HydrophobicContact CD2-SD 4.47Å; L930-M933 PolarHBondContact O-N 3.03Å; M933-H937 HydrophobicContact CE-CB 3.8Å; M933-H937 WeakPolarHBondContact CE-O 3.28Å; M933-H937 HydrophobicContact CG-CB 4.48Å; M933-P939 WeakPolarHBondContact SD-CD 3.32Å
934	P	83.3	Confident	77.2	Confident	80 Å²	80	73.7 Å²	73.7	52%	0.519	39%	0.392	S	S	.	.			trans	-66.7	143.6	175.1	27.6	-33.9	0	0	0	110.6	K936 H937	P934-K936 PolarHBondContact O-N 3.45Å; P934-H937 HydrophobicContact CG-CB 4.39Å; P934-H937 PolarHBondContact O-N 2.91Å
935	A	73.4	Confident	76.2	Confident	78 Å²	78	84.1 Å²	84.1	65%	0.645	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-54.4	-26.9	-175.4	0	0	0	0	0	114.1	Q938	A935-Q938 WeakPolarHBondContact O-CB 3.37Å
936	K	77.4	Confident	75.3	Confident	203 Å²	203	84.9 Å²	84.9	88%	0.883	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-69.7	-29.2	179.6	-125.5	-178.9	-176.9	-176	0	114.1	P934	P934-K936 PolarHBondContact O-N 3.45Å
937	H	74.5	Confident	74.9	Confident	133 Å²	133	83 Å²	83	62%	0.616	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-101.4	6.5	-177.7	-65.7	85.3	0	0	0	112.2	M933 P934	M933-H937 HydrophobicContact CE-CB 3.8Å; M933-H937 WeakPolarHBondContact CE-O 3.28Å; M933-H937 HydrophobicContact CG-CB 4.48Å; P934-H937 HydrophobicContact CG-CB 4.39Å; P934-H937 PolarHBondContact O-N 2.91Å
938	Q	71	Confident	74.5	Confident	43 Å²	43	86.4 Å²	86.4	20%	0.201	45%	0.448	C	S	.	.			trans	-64.2	128.1	-171.8	-175	159.3	17.9	0	0	111.2	L930 A935 L944 L949	L930-Q938 HydrophobicContact CD2-CG 3.83Å; A935-Q938 WeakPolarHBondContact O-CB 3.37Å; Q938-L944 HydrophobicContact CG-CD1 3.76Å; Q938-L949 VanDerWaalsContact NE2-CD2 3.25Å
939	P	70.6	Confident	74.2	Confident	52 Å²	52	86.7 Å²	86.7	34%	0.338	45%	0.449	S	S	.	.			trans	-69	149.4	176.4	28.4	-36.6	0	0	0	111.4	L930 M933 F941 L944	L930-P939 HydrophobicContact CD2-CG 4.44Å; M933-P939 WeakPolarHBondContact SD-CD 3.32Å; P939-F941 HydrophobicContact CB-CE2 4.36Å; P939-F941 HydrophobicContact CB-CZ 4.43Å; P939-F941 HydrophobicContact CG-CD2 3.91Å; P939-F941 HydrophobicContact CG-CE2 3.42Å; P939-F941 VanDerWaalsContact CG-CE2 3.42Å; P939-F941 HydrophobicContact CG-CZ 3.78Å; P939-F941 PolarHBondContact O-N 3.33Å; P939-L944 WeakPolarHBondContact O-CD1 3.31Å
940	D	57	Low	74	Confident	168 Å²	168	92.4 Å²	92.4	90%	0.898	47%	0.468	S	S	*	.			trans	-72.2	68.4	-179.9	-68.6	-31.1	0	0	0	112.9
941	F	67.4	Low	74	Confident	65 Å²	65	95.4 Å²	95.4	29%	0.285	48%	0.48	S	S	.	.			trans	-73.8	135	169.5	-61.1	-58.7	0	0	0	110.9	D926 L930 P939 Y943 L944	D926-F941 HydrophobicContact CB-CZ 4.21Å; L930-F941 HydrophobicContact CD1-CD2 4.16Å; L930-F941 HydrophobicContact CD1-CE2 4.3Å; L930-F941 HydrophobicContact CD2-CD2 4.44Å; L930-F941 HydrophobicContact CD2-CE2 4.18Å; L930-F941 HydrophobicContact CG-CE2 4.41Å; P939-F941 HydrophobicContact CB-CE2 4.36Å; P939-F941 HydrophobicContact CB-CZ 4.43Å; P939-F941 HydrophobicContact CG-CD2 3.91Å; P939-F941 HydrophobicContact CG-CE2 3.42Å; P939-F941 VanDerWaalsContact CG-CE2 3.42Å; P939-F941 HydrophobicContact CG-CZ 3.78Å; P939-F941 PolarHBondContact O-N 3.33Å; F941-Y943 HydrophobicContact CB-CD1 3.95Å; F941-Y943 HydrophobicContact CB-CE1 3.49Å; F941-Y943 VanDerWaalsContact CB-CE1 3.49Å; F941-Y943 HydrophobicContact CB-CE2 4.11Å; F941-Y943 HydrophobicContact CB-CG 4.44Å; F941-Y943 HydrophobicContact CD1-CE1 4.41Å; F941-Y943 HydrophobicContact CD2-CE1 4.37Å; F941-Y943 AromaticContact CD2-CZ 3.82Å; F941-Y943 VanDerWaalsContact CD2-OH 3.23Å; F941-Y943 WeakPolarHBondContact CD2-OH 3.44Å; F941-Y943 AromaticContact CG-CE1 3.89Å; F941-Y943 HydrophobicContact CG-CE1 3.89Å; F941-Y943 AromaticContact CG-CZ 3.79Å; F941-Y943 PolarHBondContact O-N 2.97Å; F941-Y943 VanDerWaalsContact O-N 3.1Å; F941-L944 HydrophobicContact CB-CD1 3.77Å; F941-L944 HydrophobicContact CB-CG 4.1Å; F941-L944 HydrophobicContact CD2-CD1 3.79Å; F941-L944 HydrophobicContact CG-CD1 4.25Å; F941-L944 WeakPolarHBondContact O-CB 3.4Å; F941-L944 PolarHBondContact O-N 3.41Å
942	I	62	Low	74	Confident	84 Å²	84	87.8 Å²	87.8	43%	0.431	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-34.1	-176.1	-66.4	165.9	0	0	0	113.1	H946	I942-H946 PolarHBondContact O-CD2 2.89Å
943	Y	68.3	Low	74.2	Confident	14 Å²	14	86.9 Å²	86.9	6%	0.055	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-25.1	-179.8	56.6	-98.6	0	0	0	113.3	R927 L930 F941 R945 H946 V947 V952	R927-Y943 HydrophobicContact CG-CE2 4.33Å; L930-Y943 HydrophobicContact CD1-CE2 4.37Å; F941-Y943 HydrophobicContact CB-CD1 3.95Å; F941-Y943 HydrophobicContact CB-CE1 3.49Å; F941-Y943 VanDerWaalsContact CB-CE1 3.49Å; F941-Y943 HydrophobicContact CB-CE2 4.11Å; F941-Y943 HydrophobicContact CB-CG 4.44Å; F941-Y943 HydrophobicContact CD1-CE1 4.41Å; F941-Y943 HydrophobicContact CD2-CE1 4.37Å; F941-Y943 AromaticContact CD2-CZ 3.82Å; F941-Y943 VanDerWaalsContact CD2-OH 3.23Å; F941-Y943 WeakPolarHBondContact CD2-OH 3.44Å; F941-Y943 AromaticContact CG-CE1 3.89Å; F941-Y943 HydrophobicContact CG-CE1 3.89Å; F941-Y943 AromaticContact CG-CZ 3.79Å; F941-Y943 PolarHBondContact O-N 2.97Å; F941-Y943 VanDerWaalsContact O-N 3.1Å; Y943-R945 PolarHBondContact O-N 3.36Å; Y943-H946 PolarHBondContact O-N 2.96Å; Y943-V947 PolarHBondContact O-N 3.29Å; Y943-V952 HydrophobicContact CE2-CG1 4.42Å
944	L	67.7	Low	74.5	Confident	36 Å²	36	87.2 Å²	87.2	19%	0.188	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-24.6	177.9	-69.5	167.7	0	0	0	112.5	L930 Q938 P939 F941 H946 L949	L930-L944 HydrophobicContact CD1-CD1 4.29Å; L930-L944 HydrophobicContact CD1-CD2 4.27Å; Q938-L944 HydrophobicContact CG-CD1 3.76Å; P939-L944 WeakPolarHBondContact O-CD1 3.31Å; F941-L944 HydrophobicContact CB-CD1 3.77Å; F941-L944 HydrophobicContact CB-CG 4.1Å; F941-L944 HydrophobicContact CD2-CD1 3.79Å; F941-L944 HydrophobicContact CG-CD1 4.25Å; F941-L944 WeakPolarHBondContact O-CB 3.4Å; F941-L944 PolarHBondContact O-N 3.41Å; L944-H946 VanDerWaalsContact C-N 3.31Å; L944-L949 HydrophobicContact CD2-CD2 3.44Å; L944-L949 VanDerWaalsContact CD2-CD2 3.44Å
945	R	66	Low	74.7	Confident	223 Å²	223	83.4 Å²	83.4	84%	0.842	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-25.5	175.6	-168.4	171.8	-176.9	168.3	2.2	113	Y943	Y943-R945 PolarHBondContact O-N 3.36Å
946	H	66.5	Low	75.5	Confident	73 Å²	73	80 Å²	80	34%	0.338	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.2	-21.2	-171.9	-64.9	-63.1	0	0	0	113.8	I942 Y943 L944 W1003	I942-H946 PolarHBondContact O-CD2 2.89Å; Y943-H946 PolarHBondContact O-N 2.96Å; L944-H946 VanDerWaalsContact C-N 3.31Å; H946-W1003 HydrophobicContact CB-CD2 4.05Å; H946-W1003 HydrophobicContact CB-CG 4.19Å; H946-W1003 HydrophobicContact CB-CZ2 4.46Å; H946-W1003 AromaticContact CD2-CE2 3.95Å; H946-W1003 AromaticContact CD2-CE3 3.86Å; H946-W1003 AromaticContact CD2-CH2 3.69Å; H946-W1003 AromaticContact CD2-CZ2 3.79Å; H946-W1003 AromaticContact CD2-CZ3 3.71Å; H946-W1003 AromaticContact CG-CE2 3.88Å; H946-W1003 AromaticContact CG-CZ2 3.93Å; H946-W1003 AromaticContact NE2-CH2 3.73Å
947	V	74.8	Confident	76.1	Confident	2 Å²	2	75 Å²	75	1%	0.012	36%	0.355	C	S	.	.	S	Bend	trans	-123.3	129.1	-178.2	-175.1	0	0	0	0	109.8	Y943 K951 V952 E1000 W1003	Y943-V947 PolarHBondContact O-N 3.29Å; V947-K951 HydrophobicContact CG1-CB 3.99Å; V947-V952 HydrophobicContact CB-CG2 4.2Å; V947-V952 HydrophobicContact CG1-CG2 3.89Å; V947-E1000 HydrophobicContact CG2-CB 4.36Å; V947-W1003 HydrophobicContact CG2-CB 3.95Å; V947-W1003 HydrophobicContact CG2-CG 4.36Å
948	P	79.1	Confident	76.8	Confident	74 Å²	74	71.1 Å²	71.1	48%	0.481	34%	0.338	S	S	.	.			trans	-65.6	143.5	179.3	27.3	-34.9	0	0	0	111.7	R950 K951 V952	P948-R950 VanDerWaalsContact C-N 3.28Å; P948-R950 PolarHBondContact O-N 3.32Å; P948-R950 VanDerWaalsContact O-N 3.14Å; P948-K951 HydrophobicContact CG-CB 4.26Å; P948-K951 HydrophobicContact CG-CD 4.02Å; P948-K951 HydrophobicContact CG-CG 4.05Å; P948-K951 PolarHBondContact O-N 3.41Å; P948-V952 PolarHBondContact O-N 2.88Å
949	L	78.4	Confident	77.7	Confident	66 Å²	66	69.1 Å²	69.1	35%	0.346	33%	0.329	S	S	.	.	H	α-helix	trans	-51.2	-41	-175.9	-71.7	168.6	0	0	0	114.1	Q938 L944 K951 V952 H953	Q938-L949 VanDerWaalsContact NE2-CD2 3.25Å; L944-L949 HydrophobicContact CD2-CD2 3.44Å; L944-L949 VanDerWaalsContact CD2-CD2 3.44Å; L949-K951 PolarHBondContact O-N 3.01Å; L949-V952 WeakPolarHBondContact O-CB 3.42Å; L949-V952 PolarHBondContact O-N 3.09Å; L949-V952 VanDerWaalsContact O-N 3.09Å; L949-H953 PolarHBondContact O-CD2 3.14Å; L949-H953 PolarHBondContact O-N 2.98Å
950	R	82.9	Confident	78.6	Confident	223 Å²	223	69.4 Å²	69.4	84%	0.842	33%	0.327	S	S	*	.	H	α-helix	trans	-57.8	-38	179.5	-68.6	-173.3	178.1	175.4	-0.2	112.6	P948 L954	P948-R950 VanDerWaalsContact C-N 3.28Å; P948-R950 PolarHBondContact O-N 3.32Å; P948-R950 VanDerWaalsContact O-N 3.14Å; R950-L954 WeakPolarHBondContact O-CB 3.45Å; R950-L954 PolarHBondContact O-N 3.08Å
951	K	83.3	Confident	80.2	Confident	73 Å²	73	65.6 Å²	65.6	32%	0.317	31%	0.31	S	S	.	.	H	α-helix	trans	-75.2	-35.2	178.1	-72.5	-167.6	175.6	-173.3	0	111.9	V947 P948 L949 L954 F955 F996 E1000	V947-K951 HydrophobicContact CG1-CB 3.99Å; P948-K951 HydrophobicContact CG-CB 4.26Å; P948-K951 HydrophobicContact CG-CD 4.02Å; P948-K951 HydrophobicContact CG-CG 4.05Å; P948-K951 PolarHBondContact O-N 3.41Å; L949-K951 PolarHBondContact O-N 3.01Å; K951-L954 PolarHBondContact O-N 3.41Å; K951-F955 WeakPolarHBondContact O-CB 3.33Å; K951-F955 PolarHBondContact O-N 3.46Å; K951-F996 HydrophobicContact CB-CE1 4.1Å; K951-E1000 WeakPolarHBondContact CD-OE1 3.41Å; K951-E1000 WeakPolarHBondContact CD-OE2 3.41Å; K951-E1000 IonicContact NZ-OE1 2.66Å; K951-E1000 PolarHBondContact NZ-OE1 3.13Å; K951-E1000 IonicContact NZ-OE2 2.76Å; K951-E1000 PolarHBondContact NZ-OE2 3.16Å
952	V	84.7	Confident	81.1	Confident	2 Å²	2	63.3 Å²	63.3	1%	0.012	30%	0.302	C	S	.	.	H	α-helix	trans	-62.6	-45.6	172.6	-176.6	0	0	0	0	110.4	Y943 V947 P948 L949 F955 T956 L1004	Y943-V952 HydrophobicContact CE2-CG1 4.42Å; V947-V952 HydrophobicContact CB-CG2 4.2Å; V947-V952 HydrophobicContact CG1-CG2 3.89Å; P948-V952 PolarHBondContact O-N 2.88Å; L949-V952 WeakPolarHBondContact O-CB 3.42Å; L949-V952 PolarHBondContact O-N 3.09Å; L949-V952 VanDerWaalsContact O-N 3.09Å; V952-F955 WeakPolarHBondContact O-CB 3.26Å; V952-F955 PolarHBondContact O-N 2.95Å; V952-T956 WeakPolarHBondContact O-CG2 3.39Å; V952-T956 PolarHBondContact O-N 3.44Å; V952-T956 PolarHBondContact O-OG1 3.3Å; V952-L1004 HydrophobicContact CG2-CD2 4.36Å
953	H	87.3	Confident	82.4	Confident	53 Å²	53	59.7 Å²	59.7	25%	0.245	28%	0.284	C	S	.	.	H	α-helix	trans	-65.6	-38.2	176.9	-66.8	-54.4	0	0	0	113	F931 L949 F955 T956 L957	F931-H953 AromaticContact CD2-ND1 3.92Å; L949-H953 PolarHBondContact O-CD2 3.14Å; L949-H953 PolarHBondContact O-N 2.98Å; H953-F955 VanDerWaalsContact C-N 3.35Å; H953-T956 WeakPolarHBondContact CA-OG1 3.29Å; H953-T956 PolarHBondContact O-N 3.03Å; H953-T956 PolarHBondContact O-OG1 3.25Å; H953-L957 VanDerWaalsContact O-CB 3.31Å; H953-L957 WeakPolarHBondContact O-CB 3.37Å; H953-L957 PolarHBondContact O-N 2.99Å
954	L	88.1	Confident	83.4	Confident	86 Å²	86	62.9 Å²	62.9	45%	0.45	30%	0.304	S	S	.	.	H	α-helix	trans	-62.2	-44.2	174	-178.2	63.2	0	0	0	111.2	R950 K951 L957 I958 F996	R950-L954 WeakPolarHBondContact O-CB 3.45Å; R950-L954 PolarHBondContact O-N 3.08Å; K951-L954 PolarHBondContact O-N 3.41Å; L954-L957 PolarHBondContact O-N 3.33Å; L954-I958 HydrophobicContact CD1-CD1 4.45Å; L954-I958 HydrophobicContact CG-CD1 4.21Å; L954-I958 WeakPolarHBondContact O-CG1 3.31Å; L954-I958 PolarHBondContact O-N 2.92Å; L954-F996 HydrophobicContact CB-CZ 4.37Å; L954-F996 HydrophobicContact CD2-CZ 4.02Å; L954-F996 HydrophobicContact CG-CZ 4.13Å
955	F	88.6	Confident	84.3	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-60.1	-47.2	176.3	-179.7	-83.6	0	0	0	111.7	F592 K951 V952 H953 L957 I958 Q959 M992 F996 L1001 L1004 D1005	F592-F955 HydrophobicContact CB-CZ 4.43Å; F592-F955 AromaticContact CD2-CE1 3.86Å; F592-F955 HydrophobicContact CD2-CE1 3.86Å; F592-F955 HydrophobicContact CD2-CE2 4.08Å; F592-F955 AromaticContact CD2-CZ 3.45Å; F592-F955 HydrophobicContact CD2-CZ 3.45Å; F592-F955 VanDerWaalsContact CD2-CZ 3.45Å; F592-F955 HydrophobicContact CE2-CE1 4.31Å; F592-F955 HydrophobicContact CE2-CZ 4.14Å; F592-F955 HydrophobicContact CG-CZ 4.37Å; K951-F955 WeakPolarHBondContact O-CB 3.33Å; K951-F955 PolarHBondContact O-N 3.46Å; V952-F955 WeakPolarHBondContact O-CB 3.26Å; V952-F955 PolarHBondContact O-N 2.95Å; H953-F955 VanDerWaalsContact C-N 3.35Å; F955-L957 VanDerWaalsContact C-N 3.33Å; F955-L957 PolarHBondContact O-N 3.03Å; F955-I958 PolarHBondContact O-N 3.41Å; F955-Q959 PolarHBondContact O-N 2.83Å; F955-M992 HydrophobicContact CD2-CE 3.91Å; F955-M992 HydrophobicContact CD2-SD 3.61Å; F955-M992 HydrophobicContact CE2-CE 3.41Å; F955-M992 VanDerWaalsContact CE2-CE 3.41Å; F955-M992 HydrophobicContact CE2-SD 3.79Å; F955-M992 HydrophobicContact CZ-CE 4.3Å; F955-F996 HydrophobicContact CB-CE1 4.43Å; F955-F996 HydrophobicContact CB-CZ 4.1Å; F955-L1001 HydrophobicContact CD2-CD1 4.17Å; F955-L1001 HydrophobicContact CE2-CD1 4.02Å; F955-L1004 HydrophobicContact CB-CD1 4.14Å; F955-L1004 HydrophobicContact CD2-CB 4.45Å; F955-L1004 HydrophobicContact CD2-CD1 3.79Å; F955-L1004 HydrophobicContact CE2-CB 4.11Å; F955-L1004 HydrophobicContact CE2-CD1 4.28Å; F955-L1004 HydrophobicContact CG-CD1 3.93Å; F955-L1004 HydrophobicContact CZ-CB 4.19Å; F955-D1005 WeakPolarHBondContact CZ-OD1 3.12Å
956	T	89.3	Confident	85.2	Confident	7 Å²	7	55.7 Å²	55.7	4%	0.043	28%	0.282	C	S	.	.	H	α-helix	trans	-66.4	-34.8	178.8	54.6	0	0	0	0	112.5	R927 V952 H953 Q959 L960	R927-T956 HydrophobicContact CB-CG2 3.37Å; R927-T956 HydrophobicContact CG-CG2 4.27Å; V952-T956 WeakPolarHBondContact O-CG2 3.39Å; V952-T956 PolarHBondContact O-N 3.44Å; V952-T956 PolarHBondContact O-OG1 3.3Å; H953-T956 WeakPolarHBondContact CA-OG1 3.29Å; H953-T956 PolarHBondContact O-N 3.03Å; H953-T956 PolarHBondContact O-OG1 3.25Å; T956-Q959 PolarHBondContact O-N 3.26Å; T956-L960 VanDerWaalsContact O-CB 3.29Å; T956-L960 WeakPolarHBondContact O-CB 3.45Å; T956-L960 PolarHBondContact O-N 3.04Å
957	L	90.3	Very high	86.2	Confident	99 Å²	99	55.9 Å²	55.9	52%	0.518	28%	0.28	S	S	.	.	H	α-helix	trans	-65.7	-42	176.9	-174	71.6	0	0	0	111.4	H953 L954 F955 Q959 L960 T961	H953-L957 VanDerWaalsContact O-CB 3.31Å; H953-L957 WeakPolarHBondContact O-CB 3.37Å; H953-L957 PolarHBondContact O-N 2.99Å; L954-L957 PolarHBondContact O-N 3.33Å; F955-L957 VanDerWaalsContact C-N 3.33Å; F955-L957 PolarHBondContact O-N 3.03Å; L957-Q959 VanDerWaalsContact C-N 3.35Å; L957-L960 PolarHBondContact O-N 3.37Å; L957-T961 WeakPolarHBondContact O-CB 3.35Å; L957-T961 PolarHBondContact O-N 3Å; L957-T961 PolarHBondContact O-OG1 2.82Å
958	I	89.2	Confident	86.8	Confident	51 Å²	51	60 Å²	60	26%	0.262	31%	0.305	S	S	.	.	H	α-helix	trans	-61.8	-46	174.6	-67.2	165.6	0	0	0	109.8	L954 F955 L960 T961 C962 F996	L954-I958 HydrophobicContact CD1-CD1 4.45Å; L954-I958 HydrophobicContact CG-CD1 4.21Å; L954-I958 WeakPolarHBondContact O-CG1 3.31Å; L954-I958 PolarHBondContact O-N 2.92Å; F955-I958 PolarHBondContact O-N 3.41Å; I958-L960 PolarHBondContact O-N 3.39Å; I958-T961 PolarHBondContact O-N 2.01Å; I958-C962 PolarHBondContact O-N 2.84Å; I958-C962 PolarHBondContact O-SG 3.42Å; I958-F996 HydrophobicContact CD1-CE2 4.18Å
959	Q	89.6	Confident	87	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-61.4	-44.1	177.5	-163.3	170.2	-4.4	0	0	112.3	F592 A596 F924 F955 T956 L957 C962 L963	F592-Q959 HydrophobicContact CD2-CB 4.33Å; F592-Q959 HydrophobicContact CD2-CG 4.03Å; F592-Q959 HydrophobicContact CE2-CB 3.52Å; F592-Q959 HydrophobicContact CE2-CG 3.57Å; F592-Q959 HydrophobicContact CZ-CB 4.08Å; F592-Q959 HydrophobicContact CZ-CG 4.06Å; F592-Q959 PolarHBondContact O-NE2 3.1Å; A596-Q959 HydrophobicContact CB-CG 4.28Å; F924-Q959 HydrophobicContact CD2-CB 4.04Å; F924-Q959 HydrophobicContact CD2-CG 3.69Å; F924-Q959 HydrophobicContact CE2-CB 3.78Å; F924-Q959 HydrophobicContact CE2-CG 3.74Å; F924-Q959 HydrophobicContact CG-CG 4.41Å; F955-Q959 PolarHBondContact O-N 2.83Å; T956-Q959 PolarHBondContact O-N 3.26Å; L957-Q959 VanDerWaalsContact C-N 3.35Å; Q959-C962 WeakPolarHBondContact O-CB 3.25Å; Q959-C962 PolarHBondContact O-N 2.95Å; Q959-L963 WeakPolarHBondContact O-CB 3.37Å; Q959-L963 PolarHBondContact O-N 3.45Å
960	L	90.4	Very high	87	Confident	58 Å²	58	58.2 Å²	58.2	30%	0.304	29%	0.289	S	S	.	.	H	α-helix	trans	-64.3	-42.7	177.7	-178.2	66.5	0	0	0	111.5	F924 L928 T956 L957 I958 C962 L963 V964	F924-L960 HydrophobicContact CE2-CB 4.47Å; F924-L960 HydrophobicContact CZ-CB 4.28Å; F924-L960 HydrophobicContact CZ-CD1 4.14Å; L928-L960 HydrophobicContact CD1-CD2 4.39Å; T956-L960 VanDerWaalsContact O-CB 3.29Å; T956-L960 WeakPolarHBondContact O-CB 3.45Å; T956-L960 PolarHBondContact O-N 3.04Å; L957-L960 PolarHBondContact O-N 3.37Å; I958-L960 PolarHBondContact O-N 3.39Å; L960-C962 VanDerWaalsContact C-N 3.31Å; L960-C962 PolarHBondContact O-N 3.02Å; L960-L963 HydrophobicContact CD1-CD2 4.42Å; L960-L963 WeakPolarHBondContact O-CB 3.1Å; L960-L963 PolarHBondContact O-N 2.91Å; L960-V964 WeakPolarHBondContact O-CG2 3.46Å; L960-V964 PolarHBondContact O-N 3.17Å
961	T	90.1	Very high	87	Confident	87 Å²	87	51.6 Å²	51.6	53%	0.534	28%	0.281	S	S	.	.	H	α-helix	trans	-60.5	-43.8	176	-56.5	0	0	0	0	111	L957 I958 V964 L965	L957-T961 WeakPolarHBondContact O-CB 3.35Å; L957-T961 PolarHBondContact O-N 3Å; L957-T961 PolarHBondContact O-OG1 2.82Å; I958-T961 PolarHBondContact O-N 2.01Å; T961-V964 PolarHBondContact O-N 3.23Å; T961-L965 PolarHBondContact O-N 3.18Å
962	C	87.6	Confident	86.9	Confident	17 Å²	17	50.6 Å²	50.6	12%	0.115	28%	0.283	C	S	.	.	H	α-helix	trans	-59.9	-47.4	174.1	-67	0	0	0	0	110.9	I958 Q959 L960 V964 L965 L966 L985	I958-C962 PolarHBondContact O-N 2.84Å; I958-C962 PolarHBondContact O-SG 3.42Å; Q959-C962 WeakPolarHBondContact O-CB 3.25Å; Q959-C962 PolarHBondContact O-N 2.95Å; L960-C962 VanDerWaalsContact C-N 3.31Å; L960-C962 PolarHBondContact O-N 3.02Å; C962-V964 PolarHBondContact O-N 3.47Å; C962-L965 WeakPolarHBondContact O-CB 3.23Å; C962-L965 PolarHBondContact O-N 3.46Å; C962-L965 VanDerWaalsContact O-N 3.15Å; C962-L966 WeakPolarHBondContact O-CG 3.5Å; C962-L966 PolarHBondContact O-N 3.33Å; C962-L985 HydrophobicContact CB-CD2 3.7Å
963	L	88.2	Confident	86.4	Confident	9 Å²	9	55.9 Å²	55.9	5%	0.047	32%	0.318	C	S	.	.	H	α-helix	trans	-58.1	-44.6	179	-172.5	73.7	0	0	0	112.7	A596 S599 L600 I603 F924 Q959 L960 L965 L966 W967	A596-L963 VanDerWaalsContact O-CD1 3.31Å; A596-L963 WeakPolarHBondContact O-CD1 3.47Å; S599-L963 WeakPolarHBondContact OG-CD1 3.25Å; L600-L963 HydrophobicContact CB-CD1 3.57Å; L600-L963 HydrophobicContact CD1-CD1 3.81Å; L600-L963 HydrophobicContact CD1-CG 4.35Å; L600-L963 HydrophobicContact CG-CD1 4.26Å; I603-L963 HydrophobicContact CD1-CD2 3.85Å; F924-L963 HydrophobicContact CE1-CD2 3.79Å; F924-L963 HydrophobicContact CZ-CD2 4.11Å; Q959-L963 WeakPolarHBondContact O-CB 3.37Å; Q959-L963 PolarHBondContact O-N 3.45Å; L960-L963 HydrophobicContact CD1-CD2 4.42Å; L960-L963 WeakPolarHBondContact O-CB 3.1Å; L960-L963 PolarHBondContact O-N 2.91Å; L963-L965 VanDerWaalsContact C-N 3.33Å; L963-L965 PolarHBondContact O-N 2.02Å; L963-L966 WeakPolarHBondContact O-CB 3.45Å; L963-L966 PolarHBondContact O-N 3.34Å; L963-W967 PolarHBondContact O-N 3.49Å
964	V	89.9	Confident	85.9	Confident	81 Å²	81	55.5 Å²	55.5	49%	0.491	32%	0.324	S	S	.	.	H	α-helix	trans	-62.3	-41.4	176.4	171.8	0	0	0	0	110.8	L960 T961 C962 L966 W967 V968	L960-V964 WeakPolarHBondContact O-CG2 3.46Å; L960-V964 PolarHBondContact O-N 3.17Å; T961-V964 PolarHBondContact O-N 3.23Å; C962-V964 PolarHBondContact O-N 3.47Å; V964-L966 VanDerWaalsContact C-N 3.35Å; V964-L966 PolarHBondContact O-N 2.89Å; V964-W967 WeakPolarHBondContact O-CB 3.28Å; V964-W967 PolarHBondContact O-N 3.2Å; V964-V968 WeakPolarHBondContact O-CG2 2.99Å; V964-V968 PolarHBondContact O-N 2.99Å
965	L	87.1	Confident	85.1	Confident	105 Å²	105	52 Å²	52	55%	0.55	31%	0.307	S	S	.	.	H	α-helix	trans	-61.2	-43.4	175.3	-174.8	68.6	0	0	0	111.6	T961 C962 L963 W967 V968 I969	T961-L965 PolarHBondContact O-N 3.18Å; C962-L965 WeakPolarHBondContact O-CB 3.23Å; C962-L965 PolarHBondContact O-N 3.46Å; C962-L965 VanDerWaalsContact O-N 3.15Å; L963-L965 VanDerWaalsContact C-N 3.33Å; L963-L965 PolarHBondContact O-N 2.02Å; L965-W967 VanDerWaalsContact C-N 3.29Å; L965-W967 PolarHBondContact O-N 3.14Å; L965-V968 PolarHBondContact O-N 3.28Å; L965-I969 HydrophobicContact CD1-CD1 4.17Å; L965-I969 HydrophobicContact CG-CD1 4Å; L965-I969 WeakPolarHBondContact O-CG1 3.2Å; L965-I969 PolarHBondContact O-N 2.55Å; L965-I969 VanDerWaalsContact O-N 3.12Å
966	L	84.4	Confident	84.4	Confident	2 Å²	2	54.1 Å²	54.1	1%	0.01	32%	0.318	C	S	.	.	H	α-helix	trans	-60.7	-40.2	175.2	-55.5	174.9	0	0	0	111.6	L600 C962 L963 V964 K970 M981 L985	L600-L966 HydrophobicContact CD1-CB 4.12Å; L600-L966 HydrophobicContact CD2-CB 3.83Å; L600-L966 HydrophobicContact CD2-CD1 3.99Å; C962-L966 WeakPolarHBondContact O-CG 3.5Å; C962-L966 PolarHBondContact O-N 3.33Å; L963-L966 WeakPolarHBondContact O-CB 3.45Å; L963-L966 PolarHBondContact O-N 3.34Å; V964-L966 VanDerWaalsContact C-N 3.35Å; V964-L966 PolarHBondContact O-N 2.89Å; L966-K970 WeakPolarHBondContact O-CB 2.94Å; L966-K970 PolarHBondContact O-N 3.35Å; L966-M981 HydrophobicContact CB-CE 3.91Å; L966-M981 HydrophobicContact CB-SD 4.4Å; L966-M981 HydrophobicContact CD2-CE 3.26Å; L966-M981 HydrophobicContact CD2-CG 3.48Å; L966-M981 VanDerWaalsContact CD2-CG 3.48Å; L966-M981 HydrophobicContact CD2-SD 3.37Å; L966-M981 WeakPolarHBondContact CD2-SD 3.29Å; L966-M981 HydrophobicContact CG-CE 4.15Å; L966-M981 HydrophobicContact CG-SD 4.42Å; L966-L985 HydrophobicContact CD1-CD1 3.73Å; L966-L985 HydrophobicContact CD2-CD1 3.96Å; L966-L985 HydrophobicContact CD2-CD2 4.23Å; L966-L985 HydrophobicContact CD2-CG 4.17Å; L966-L985 HydrophobicContact CG-CD1 4.38Å
967	W	86.6	Confident	83.8	Confident	78 Å²	78	57.6 Å²	57.6	30%	0.295	34%	0.339	S	S	.	.	H	α-helix	trans	-63.2	-49.4	179.3	-178.1	-87.8	0	0	0	112.1	L600 I603 I604 Y607 L963 V964 L965 I969 K970 A971	L600-W967 HydrophobicContact CD1-CB 4.27Å; L600-W967 HydrophobicContact CD1-CE3 4.06Å; I603-W967 HydrophobicContact CB-CZ3 4.28Å; I603-W967 HydrophobicContact CG2-CE3 4.12Å; I603-W967 HydrophobicContact CG2-CH2 4.1Å; I603-W967 HydrophobicContact CG2-CZ3 3.57Å; I604-W967 HydrophobicContact CB-CZ3 4.28Å; I604-W967 HydrophobicContact CG1-CE3 4.1Å; I604-W967 HydrophobicContact CG1-CH2 4.35Å; I604-W967 HydrophobicContact CG1-CZ3 3.52Å; Y607-W967 HydrophobicContact CD1-CH2 4.04Å; Y607-W967 HydrophobicContact CD1-CZ2 4.19Å; Y607-W967 HydrophobicContact CD2-CH2 4.26Å; Y607-W967 HydrophobicContact CD2-CZ2 4.06Å; Y607-W967 HydrophobicContact CE2-CZ2 4.5Å; Y607-W967 AromaticContact CG-CH2 3.7Å; Y607-W967 HydrophobicContact CG-CH2 3.7Å; Y607-W967 AromaticContact CG-CZ2 3.9Å; Y607-W967 HydrophobicContact CG-CZ2 3.9Å; L963-W967 PolarHBondContact O-N 3.49Å; V964-W967 WeakPolarHBondContact O-CB 3.28Å; V964-W967 PolarHBondContact O-N 3.2Å; L965-W967 VanDerWaalsContact C-N 3.29Å; L965-W967 PolarHBondContact O-N 3.14Å; W967-I969 VanDerWaalsContact C-N 3.31Å; W967-I969 PolarHBondContact O-N 3.35Å; W967-K970 WeakPolarHBondContact O-CB 3.1Å; W967-K970 PolarHBondContact O-N 3.37Å; W967-A971 PolarHBondContact O-N 3.11Å
968	V	87.7	Confident	82.9	Confident	88 Å²	88	53.1 Å²	53.1	53%	0.533	32%	0.316	S	S	.	.	H	α-helix	trans	-60	-42.9	179.1	172.1	0	0	0	0	111	V964 L965 K970 A971 S972	V964-V968 WeakPolarHBondContact O-CG2 2.99Å; V964-V968 PolarHBondContact O-N 2.99Å; L965-V968 PolarHBondContact O-N 3.28Å; V968-K970 VanDerWaalsContact C-N 3.34Å; V968-A971 PolarHBondContact O-N 3.37Å; V968-S972 PolarHBondContact O-N 2.72Å
969	I	83.2	Confident	82.1	Confident	48 Å²	48	50.9 Å²	50.9	25%	0.246	31%	0.305	C	S	.	.	H	α-helix	trans	-68.2	-36.9	179.1	-69	167.9	0	0	0	111.1	L965 W967 S972 M981	L965-I969 HydrophobicContact CD1-CD1 4.17Å; L965-I969 HydrophobicContact CG-CD1 4Å; L965-I969 WeakPolarHBondContact O-CG1 3.2Å; L965-I969 PolarHBondContact O-N 2.55Å; L965-I969 VanDerWaalsContact O-N 3.12Å; W967-I969 VanDerWaalsContact C-N 3.31Å; W967-I969 PolarHBondContact O-N 3.35Å; I969-S972 WeakPolarHBondContact O-CB 2.96Å; I969-S972 PolarHBondContact O-N 2.87Å; I969-M981 HydrophobicContact CB-CE 4.38Å; I969-M981 HydrophobicContact CB-SD 3.83Å; I969-M981 HydrophobicContact CD1-CG 4.49Å; I969-M981 HydrophobicContact CD1-SD 3.34Å; I969-M981 WeakPolarHBondContact CD1-SD 3.47Å; I969-M981 HydrophobicContact CG1-SD 4.16Å; I969-M981 HydrophobicContact CG2-CE 4.2Å; I969-M981 HydrophobicContact CG2-SD 3.83Å
970	K	79.5	Confident	81.6	Confident	55 Å²	55	55.7 Å²	55.7	24%	0.239	33%	0.328	C	S	.	.	H	α-helix	trans	-64.5	-38.7	175.3	-178.8	-178.6	174	90.7	0	112.5	I604 L966 W967 V968 S972	I604-K970 HydrophobicContact CD1-CD 3.29Å; I604-K970 HydrophobicContact CG1-CD 3.79Å; L966-K970 WeakPolarHBondContact O-CB 2.94Å; L966-K970 PolarHBondContact O-N 3.35Å; W967-K970 WeakPolarHBondContact O-CB 3.1Å; W967-K970 PolarHBondContact O-N 3.37Å; V968-K970 VanDerWaalsContact C-N 3.34Å; K970-S972 PolarHBondContact O-N 3.35Å
971	A	81.1	Confident	81	Confident	84 Å²	84	53.9 Å²	53.9	69%	0.694	32%	0.319	S	S	*	.	H	α-helix	trans	-69.1	-20.5	177	0	0	0	0	0	112.6	W967 V968	W967-A971 PolarHBondContact O-N 3.11Å; V968-A971 PolarHBondContact O-N 3.37Å
972	S	82.6	Confident	80.3	Confident	51 Å²	51	50 Å²	50	36%	0.357	30%	0.295	S	S	.	.	S	Bend	trans	-82	153.7	178	175.3	0	0	0	0	112.2	V968 I969 K970 A974 A975	V968-S972 PolarHBondContact O-N 2.72Å; I969-S972 WeakPolarHBondContact O-CB 2.96Å; I969-S972 PolarHBondContact O-N 2.87Å; K970-S972 PolarHBondContact O-N 3.35Å; S972-A974 PolarHBondContact O-N 2.87Å; S972-A974 PolarHBondContact OG-N 3.47Å; S972-A975 WeakPolarHBondContact O-CB 3.3Å; S972-A975 PolarHBondContact O-N 3.02Å
973	P	74.2	Confident	79.8	Confident	113 Å²	113	53 Å²	53	73%	0.734	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-56.8	-12.9	167.7	23.8	-35.4	0	0	0	113.9	A975	P973-A975 PolarHBondContact O-N 3.09Å
974	A	76.5	Confident	79.5	Confident	45 Å²	45	55 Å²	55	37%	0.372	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-71.1	2.8	170.6	0	0	0	0	0	114.5	S972 I976 V977	S972-A974 PolarHBondContact O-N 2.87Å; S972-A974 PolarHBondContact OG-N 3.47Å; A974-I976 PolarHBondContact O-N 3.16Å; A974-V977 PolarHBondContact O-N 3.42Å
975	A	71.4	Confident	78.9	Confident	12 Å²	12	51.5 Å²	51.5	10%	0.099	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-53.5	-19.3	178.9	0	0	0	0	0	114.8	V543 S972 P973 V977 F978	V543-A975 HydrophobicContact CG1-CB 4.35Å; S972-A975 WeakPolarHBondContact O-CB 3.3Å; S972-A975 PolarHBondContact O-N 3.02Å; P973-A975 PolarHBondContact O-N 3.09Å; A975-V977 PolarHBondContact O-N 2.94Å; A975-F978 WeakPolarHBondContact O-CB 3.45Å; A975-F978 PolarHBondContact O-N 3.32Å; A975-F978 VanDerWaalsContact O-N 3.16Å
976	I	73.3	Confident	78.4	Confident	45 Å²	45	48.2 Å²	48.2	23%	0.231	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-61.8	-31.7	174.1	-58.3	166	0	0	0	112	I547 L792 A974 F978 P979	I547-I976 HydrophobicContact CB-CD1 4.49Å; I547-I976 HydrophobicContact CD1-CD1 3.23Å; I547-I976 HydrophobicContact CD1-CG1 3.62Å; I547-I976 HydrophobicContact CG1-CD1 4.4Å; I547-I976 HydrophobicContact CG2-CD1 4.15Å; L792-I976 HydrophobicContact CD1-CG2 3.43Å; L792-I976 VanDerWaalsContact CD1-CG2 3.43Å; L792-I976 HydrophobicContact CD2-CG2 3.24Å; L792-I976 HydrophobicContact CG-CG2 3.95Å; A974-I976 PolarHBondContact O-N 3.16Å; I976-F978 PolarHBondContact O-N 3.42Å; I976-P979 WeakPolarHBondContact O-CD 3.36Å
977	V	77.4	Confident	78.3	Confident	81 Å²	81	54.9 Å²	54.9	49%	0.491	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-79.6	-0.3	-179.1	-171.2	0	0	0	0	111.8	A974 A975 P979 M980 M981	A974-V977 PolarHBondContact O-N 3.42Å; A975-V977 PolarHBondContact O-N 2.94Å; V977-P979 VanDerWaalsContact C-CD 3.48Å; V977-M980 HydrophobicContact CG1-CB 3.96Å; V977-M980 WeakPolarHBondContact O-CB 3.41Å; V977-M980 PolarHBondContact O-N 3.01Å; V977-M981 PolarHBondContact O-N 3.34Å; V977-M981 VanDerWaalsContact O-N 3.14Å
978	F	71.5	Confident	78.1	Confident	4 Å²	4	53.7 Å²	53.7	2%	0.018	32%	0.32	C	S	.	.	H	α-helix	trans	-50.1	-43.6	-175.7	177.9	-99.4	0	0	0	114.9	P540 F597 L600 A975 I976 M980 M981 V982	P540-F978 HydrophobicContact CG-CD1 4.41Å; F597-F978 HydrophobicContact CD2-CZ 4.26Å; F597-F978 AromaticContact CE2-CE1 3.68Å; F597-F978 HydrophobicContact CE2-CE1 3.68Å; F597-F978 AromaticContact CE2-CZ 3.7Å; F597-F978 HydrophobicContact CE2-CZ 3.7Å; F597-F978 HydrophobicContact CZ-CE1 4.46Å; L600-F978 HydrophobicContact CD2-CE2 3.6Å; L600-F978 HydrophobicContact CD2-CZ 3.82Å; A975-F978 WeakPolarHBondContact O-CB 3.45Å; A975-F978 PolarHBondContact O-N 3.32Å; A975-F978 VanDerWaalsContact O-N 3.16Å; I976-F978 PolarHBondContact O-N 3.42Å; F978-M980 PolarHBondContact O-N 3.43Å; F978-M981 HydrophobicContact CB-CE 4.49Å; F978-M981 HydrophobicContact CD2-CE 3.35Å; F978-M981 HydrophobicContact CE2-CE 3.84Å; F978-M981 HydrophobicContact CG-CE 4.22Å; F978-M981 WeakPolarHBondContact O-CB 3.42Å; F978-M981 PolarHBondContact O-N 3.48Å; F978-V982 HydrophobicContact CZ-CG2 4.5Å; F978-V982 PolarHBondContact O-N 3.09Å; F978-V982 VanDerWaalsContact O-N 3.16Å
979	P	72.1	Confident	77.8	Confident	5 Å²	5	50.8 Å²	50.8	3%	0.032	30%	0.299	C	S	.	.	H	α-helix	trans	-66	-37.9	177.1	-22.2	35	0	0	0	114.1	I795 L796 M799 I976 V977 M981 V982 L983	I795-P979 HydrophobicContact CG2-CB 3.92Å; L796-P979 VanDerWaalsContact CA-CG 3.5Å; L796-P979 HydrophobicContact CB-CG 3.66Å; L796-P979 HydrophobicContact CD1-CG 4.13Å; L796-P979 HydrophobicContact CG-CG 3.76Å; M799-P979 HydrophobicContact CB-CB 4.24Å; M799-P979 HydrophobicContact CG-CB 4.02Å; I976-P979 WeakPolarHBondContact O-CD 3.36Å; V977-P979 VanDerWaalsContact C-CD 3.48Å; P979-M981 PolarHBondContact O-N 3.12Å; P979-V982 PolarHBondContact O-N 3.36Å; P979-L983 PolarHBondContact O-N 2.98Å
980	M	78.6	Confident	77.6	Confident	102 Å²	102	55.7 Å²	55.7	50%	0.502	32%	0.319	S	S	.	.	H	α-helix	trans	-65.2	-31.6	176.1	-69.6	-62.9	-65.4	0	0	111.5	I795 V977 F978 L983 A984	I795-M980 HydrophobicContact CD1-SD 4.29Å; I795-M980 HydrophobicContact CG2-SD 4.41Å; V977-M980 HydrophobicContact CG1-CB 3.96Å; V977-M980 WeakPolarHBondContact O-CB 3.41Å; V977-M980 PolarHBondContact O-N 3.01Å; F978-M980 PolarHBondContact O-N 3.43Å; M980-L983 WeakPolarHBondContact O-CB 3.48Å; M980-L983 PolarHBondContact O-N 3.26Å; M980-L983 HydrophobicContact SD-CD1 4.16Å; M980-A984 PolarHBondContact O-N 2.92Å
981	M	77.1	Confident	77.7	Confident	20 Å²	20	56.2 Å²	56.2	10%	0.099	33%	0.327	C	S	.	.	H	α-helix	trans	-72.8	-34.6	176.3	177.6	-173.3	61.2	0	0	112.3	L966 I969 V977 F978 P979 L983 A984 L985	L966-M981 HydrophobicContact CB-CE 3.91Å; L966-M981 HydrophobicContact CB-SD 4.4Å; L966-M981 HydrophobicContact CD2-CE 3.26Å; L966-M981 HydrophobicContact CD2-CG 3.48Å; L966-M981 VanDerWaalsContact CD2-CG 3.48Å; L966-M981 HydrophobicContact CD2-SD 3.37Å; L966-M981 WeakPolarHBondContact CD2-SD 3.29Å; L966-M981 HydrophobicContact CG-CE 4.15Å; L966-M981 HydrophobicContact CG-SD 4.42Å; I969-M981 HydrophobicContact CB-CE 4.38Å; I969-M981 HydrophobicContact CB-SD 3.83Å; I969-M981 HydrophobicContact CD1-CG 4.49Å; I969-M981 HydrophobicContact CD1-SD 3.34Å; I969-M981 WeakPolarHBondContact CD1-SD 3.47Å; I969-M981 HydrophobicContact CG1-SD 4.16Å; I969-M981 HydrophobicContact CG2-CE 4.2Å; I969-M981 HydrophobicContact CG2-SD 3.83Å; V977-M981 PolarHBondContact O-N 3.34Å; V977-M981 VanDerWaalsContact O-N 3.14Å; F978-M981 HydrophobicContact CB-CE 4.49Å; F978-M981 HydrophobicContact CD2-CE 3.35Å; F978-M981 HydrophobicContact CE2-CE 3.84Å; F978-M981 HydrophobicContact CG-CE 4.22Å; F978-M981 WeakPolarHBondContact O-CB 3.42Å; F978-M981 PolarHBondContact O-N 3.48Å; P979-M981 PolarHBondContact O-N 3.12Å; M981-L983 VanDerWaalsContact C-N 3.29Å; M981-L983 PolarHBondContact O-N 3.41Å; M981-A984 WeakPolarHBondContact O-CA 3.15Å; M981-A984 VanDerWaalsContact O-CB 3.26Å; M981-A984 WeakPolarHBondContact O-CB 3.45Å; M981-A984 PolarHBondContact O-N 3.46Å; M981-L985 PolarHBondContact O-N 3.31Å; M981-L985 VanDerWaalsContact O-N 3.08Å
982	V	75.3	Confident	77.6	Confident	6 Å²	6	52.7 Å²	52.7	4%	0.036	30%	0.296	C	S	.	.	H	α-helix	trans	-63.7	-37.8	171.7	179.2	0	0	0	0	110.8	F597 M799 I803 F978 P979 A984 L985 V986	F597-V982 HydrophobicContact CD2-CG2 4.1Å; F597-V982 HydrophobicContact CE2-CG2 4.31Å; M799-V982 HydrophobicContact CE-CB 3.89Å; M799-V982 HydrophobicContact CE-CG1 3.76Å; I803-V982 HydrophobicContact CD1-CG1 3.79Å; F978-V982 HydrophobicContact CZ-CG2 4.5Å; F978-V982 PolarHBondContact O-N 3.09Å; F978-V982 VanDerWaalsContact O-N 3.16Å; P979-V982 PolarHBondContact O-N 3.36Å; V982-A984 VanDerWaalsContact C-N 3.27Å; V982-A984 PolarHBondContact O-N 2.89Å; V982-L985 WeakPolarHBondContact O-CB 3.39Å; V982-L985 PolarHBondContact O-N 3.39Å; V982-L985 VanDerWaalsContact O-N 3.11Å; V982-V986 PolarHBondContact O-N 3.25Å
983	L	77.4	Confident	77.4	Confident	80 Å²	80	53.8 Å²	53.8	42%	0.419	30%	0.298	S	S	.	.	H	α-helix	trans	-61.3	-36.6	169.6	-67.9	172.1	0	0	0	112	M799 P979 M980 M981 L985 V986 F987	M799-L983 HydrophobicContact CE-CD2 3.56Å; M799-L983 HydrophobicContact CE-CG 3.61Å; M799-L983 HydrophobicContact SD-CD2 3.87Å; M799-L983 HydrophobicContact SD-CG 4.16Å; P979-L983 PolarHBondContact O-N 2.98Å; M980-L983 WeakPolarHBondContact O-CB 3.48Å; M980-L983 PolarHBondContact O-N 3.26Å; M980-L983 HydrophobicContact SD-CD1 4.16Å; M981-L983 VanDerWaalsContact C-N 3.29Å; M981-L983 PolarHBondContact O-N 3.41Å; L983-L985 VanDerWaalsContact C-N 3.26Å; L983-L985 PolarHBondContact O-N 3.19Å; L983-V986 WeakPolarHBondContact O-CB 3.32Å; L983-V986 PolarHBondContact O-N 3.1Å; L983-V986 VanDerWaalsContact O-N 3.12Å; L983-F987 PolarHBondContact O-N 3.28Å
984	A	81.6	Confident	77.6	Confident	49 Å²	49	55.7 Å²	55.7	41%	0.405	30%	0.301	S	S	.	.	H	α-helix	trans	-63.1	-30.7	174.4	0	0	0	0	0	112.5	M980 M981 V982 V986 F987 V988	M980-A984 PolarHBondContact O-N 2.92Å; M981-A984 WeakPolarHBondContact O-CA 3.15Å; M981-A984 VanDerWaalsContact O-CB 3.26Å; M981-A984 WeakPolarHBondContact O-CB 3.45Å; M981-A984 PolarHBondContact O-N 3.46Å; V982-A984 VanDerWaalsContact C-N 3.27Å; V982-A984 PolarHBondContact O-N 2.89Å; A984-V986 VanDerWaalsContact C-N 3.29Å; A984-V986 PolarHBondContact O-N 2.96Å; A984-F987 WeakPolarHBondContact O-CA 3.34Å; A984-F987 WeakPolarHBondContact O-CB 3.44Å; A984-F987 PolarHBondContact O-N 3.49Å; A984-F987 VanDerWaalsContact O-N 3.09Å; A984-V988 WeakPolarHBondContact O-CG2 3.44Å; A984-V988 PolarHBondContact O-N 2.87Å
985	L	77.3	Confident	77.7	Confident	8 Å²	8	58 Å²	58	4%	0.042	31%	0.313	C	S	.	.	H	α-helix	trans	-64.4	-33.4	173	-64.4	175	0	0	0	112.8	T593 C962 L966 M981 V982 L983 F987 V988 R989	T593-L985 HydrophobicContact CG2-CB 3.87Å; C962-L985 HydrophobicContact CB-CD2 3.7Å; L966-L985 HydrophobicContact CD1-CD1 3.73Å; L966-L985 HydrophobicContact CD2-CD1 3.96Å; L966-L985 HydrophobicContact CD2-CD2 4.23Å; L966-L985 HydrophobicContact CD2-CG 4.17Å; L966-L985 HydrophobicContact CG-CD1 4.38Å; M981-L985 PolarHBondContact O-N 3.31Å; M981-L985 VanDerWaalsContact O-N 3.08Å; V982-L985 WeakPolarHBondContact O-CB 3.39Å; V982-L985 PolarHBondContact O-N 3.39Å; V982-L985 VanDerWaalsContact O-N 3.11Å; L983-L985 VanDerWaalsContact C-N 3.26Å; L983-L985 PolarHBondContact O-N 3.19Å; L985-F987 VanDerWaalsContact C-N 3.26Å; L985-F987 PolarHBondContact O-N 3.05Å; L985-V988 PolarHBondContact O-N 3.32Å; L985-R989 WeakPolarHBondContact O-CB 3.42Å; L985-R989 PolarHBondContact O-N 3.32Å
986	V	77.4	Confident	78	Confident	36 Å²	36	58 Å²	58	22%	0.218	31%	0.311	C	S	.	.	H	α-helix	trans	-64.5	-37.3	173.1	-179.3	0	0	0	0	110	Y588 T593 V982 L983 A984 R989 K990	Y588-V986 WeakPolarHBondContact O-CG1 3.43Å; T593-V986 HydrophobicContact CG2-CG2 4.04Å; V982-V986 PolarHBondContact O-N 3.25Å; L983-V986 WeakPolarHBondContact O-CB 3.32Å; L983-V986 PolarHBondContact O-N 3.1Å; L983-V986 VanDerWaalsContact O-N 3.12Å; A984-V986 VanDerWaalsContact C-N 3.29Å; A984-V986 PolarHBondContact O-N 2.96Å; V986-R989 WeakPolarHBondContact O-CB 3.47Å; V986-R989 PolarHBondContact O-N 3.34Å; V986-K990 PolarHBondContact O-N 3.16Å
987	F	82.1	Confident	78.1	Confident	143 Å²	143	59 Å²	59	63%	0.627	32%	0.322	S	S	*	.	H	α-helix	trans	-67.4	-45.7	173.5	-174.4	-97.1	0	0	0	112	L983 A984 L985 R989 K990 V991	L983-F987 PolarHBondContact O-N 3.28Å; A984-F987 WeakPolarHBondContact O-CA 3.34Å; A984-F987 WeakPolarHBondContact O-CB 3.44Å; A984-F987 PolarHBondContact O-N 3.49Å; A984-F987 VanDerWaalsContact O-N 3.09Å; L985-F987 VanDerWaalsContact C-N 3.26Å; L985-F987 PolarHBondContact O-N 3.05Å; F987-R989 PolarHBondContact O-N 3.23Å; F987-K990 WeakPolarHBondContact O-CA 3.46Å; F987-K990 WeakPolarHBondContact O-CB 3.44Å; F987-K990 PolarHBondContact O-N 3.25Å; F987-V991 HydrophobicContact CD1-CG2 3.94Å; F987-V991 HydrophobicContact CE1-CG2 3.56Å; F987-V991 HydrophobicContact CZ-CG2 4.01Å; F987-V991 WeakPolarHBondContact O-CG2 3.47Å; F987-V991 PolarHBondContact O-N 3.25Å
988	V	82.9	Confident	77.8	Confident	53 Å²	53	63.5 Å²	63.5	32%	0.321	34%	0.335	S	S	.	.	H	α-helix	trans	-56.6	-40.9	173.6	173.9	0	0	0	0	110.6	A984 L985 K990 V991 M992	A984-V988 WeakPolarHBondContact O-CG2 3.44Å; A984-V988 PolarHBondContact O-N 2.87Å; L985-V988 PolarHBondContact O-N 3.32Å; V988-K990 VanDerWaalsContact C-N 3.33Å; V988-K990 PolarHBondContact O-N 3.16Å; V988-V991 PolarHBondContact O-N 3.07Å; V988-M992 PolarHBondContact O-N 3.38Å
989	R	82.1	Confident	77.7	Confident	27 Å²	27	68.4 Å²	68.4	10%	0.102	35%	0.353	C	S	.	.	H	α-helix	trans	-60.4	-42.2	174.3	175.8	58.5	-170.9	76.2	5.1	111.7	T590 F592 L985 V986 F987 M992 D993 D1005	T590-R989 HydrophobicContact CG2-CG 4.19Å; F592-R989 HydrophobicContact CD1-CB 4.16Å; L985-R989 WeakPolarHBondContact O-CB 3.42Å; L985-R989 PolarHBondContact O-N 3.32Å; V986-R989 WeakPolarHBondContact O-CB 3.47Å; V986-R989 PolarHBondContact O-N 3.34Å; F987-R989 PolarHBondContact O-N 3.23Å; R989-M992 VanDerWaalsContact O-CB 3.29Å; R989-M992 WeakPolarHBondContact O-CB 3.47Å; R989-M992 PolarHBondContact O-N 3.39Å; R989-D993 IonicContact CZ-OD1 2.85Å; R989-D993 IonicContact NH1-OD1 2.72Å; R989-D993 PolarHBondContact NH1-OD1 3.42Å; R989-D1005 IonicContact CZ-OD2 2.74Å; R989-D1005 IonicContact NE-OD2 2.79Å; R989-D1005 PolarHBondContact NE-OD2 3.18Å; R989-D1005 IonicContact NH2-OD2 3.85Å; R989-D1005 PolarHBondContact NH2-OD2 2.68Å
990	K	78.6	Confident	77.8	Confident	150 Å²	150	69.6 Å²	69.6	65%	0.652	36%	0.359	S	S	*	.	H	α-helix	trans	-68.1	-35.1	177.2	-167.2	161	-176.8	164	0	112.6	V986 F987 V988 M992 D993	V986-K990 PolarHBondContact O-N 3.16Å; F987-K990 WeakPolarHBondContact O-CA 3.46Å; F987-K990 WeakPolarHBondContact O-CB 3.44Å; F987-K990 PolarHBondContact O-N 3.25Å; V988-K990 VanDerWaalsContact C-N 3.33Å; V988-K990 PolarHBondContact O-N 3.16Å; K990-M992 PolarHBondContact O-N 3.14Å; K990-D993 WeakPolarHBondContact O-CB 3.37Å; K990-D993 PolarHBondContact O-N 3.03Å
991	V	82.2	Confident	77.5	Confident	67 Å²	67	64.9 Å²	64.9	41%	0.406	34%	0.335	S	S	.	.	H	α-helix	trans	-64.3	-31.8	173	173.2	0	0	0	0	111.3	F987 V988 D993 L994	F987-V991 HydrophobicContact CD1-CG2 3.94Å; F987-V991 HydrophobicContact CE1-CG2 3.56Å; F987-V991 HydrophobicContact CZ-CG2 4.01Å; F987-V991 WeakPolarHBondContact O-CG2 3.47Å; F987-V991 PolarHBondContact O-N 3.25Å; V988-V991 PolarHBondContact O-N 3.07Å; V991-D993 PolarHBondContact O-N 3.08Å; V991-D993 VanDerWaalsContact O-N 3.15Å; V991-L994 HydrophobicContact CG1-CD1 4.46Å; V991-L994 WeakPolarHBondContact O-CB 3.37Å; V991-L994 WeakPolarHBondContact O-CG 3.42Å; V991-L994 PolarHBondContact O-N 3.46Å
992	M	79.1	Confident	77.1	Confident	9 Å²	9	65.8 Å²	65.8	4%	0.044	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-63.3	-17.7	177.3	-168.9	166.1	49	0	0	113.9	F592 F955 V988 R989 K990 L994 C995 F996 L1001	F592-M992 HydrophobicContact CD2-CE 4.23Å; F592-M992 HydrophobicContact CE2-CE 4.28Å; F592-M992 HydrophobicContact CG-CE 4.5Å; F955-M992 HydrophobicContact CD2-CE 3.91Å; F955-M992 HydrophobicContact CD2-SD 3.61Å; F955-M992 HydrophobicContact CE2-CE 3.41Å; F955-M992 VanDerWaalsContact CE2-CE 3.41Å; F955-M992 HydrophobicContact CE2-SD 3.79Å; F955-M992 HydrophobicContact CZ-CE 4.3Å; V988-M992 PolarHBondContact O-N 3.38Å; R989-M992 VanDerWaalsContact O-CB 3.29Å; R989-M992 WeakPolarHBondContact O-CB 3.47Å; R989-M992 PolarHBondContact O-N 3.39Å; K990-M992 PolarHBondContact O-N 3.14Å; M992-L994 PolarHBondContact O-N 2.82Å; M992-L994 VanDerWaalsContact O-N 3.16Å; M992-C995 PolarHBondContact O-N 3.34Å; M992-C995 VanDerWaalsContact O-N 3.13Å; M992-F996 HydrophobicContact CG-CD2 3.36Å; M992-F996 HydrophobicContact CG-CE2 3.67Å; M992-F996 HydrophobicContact CG-CG 4.44Å; M992-F996 PolarHBondContact O-N 2.87Å; M992-F996 HydrophobicContact SD-CD2 4.01Å; M992-F996 HydrophobicContact SD-CE2 3.83Å; M992-L1001 HydrophobicContact CE-CD1 4.01Å; M992-L1001 HydrophobicContact CG-CD1 4.2Å; M992-L1001 HydrophobicContact SD-CD1 4.19Å
993	D	77.4	Confident	76.9	Confident	75 Å²	75	67.3 Å²	67.3	40%	0.401	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-64.1	-14.9	172.2	-66.2	-15.5	0	0	0	112.7	R989 K990 V991 L1001	R989-D993 IonicContact CZ-OD1 2.85Å; R989-D993 IonicContact NH1-OD1 2.72Å; R989-D993 PolarHBondContact NH1-OD1 3.42Å; K990-D993 WeakPolarHBondContact O-CB 3.37Å; K990-D993 PolarHBondContact O-N 3.03Å; V991-D993 PolarHBondContact O-N 3.08Å; V991-D993 VanDerWaalsContact O-N 3.15Å; D993-L1001 WeakPolarHBondContact OD1-CD2 3.42Å
994	L	78.3	Confident	76.7	Confident	153 Å²	153	63.5 Å²	63.5	80%	0.801	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-80	-30.8	174.2	-62.6	173.5	0	0	0	112.9	V991 M992	V991-L994 HydrophobicContact CG1-CD1 4.46Å; V991-L994 WeakPolarHBondContact O-CB 3.37Å; V991-L994 WeakPolarHBondContact O-CG 3.42Å; V991-L994 PolarHBondContact O-N 3.46Å; M992-L994 PolarHBondContact O-N 2.82Å; M992-L994 VanDerWaalsContact O-N 3.16Å
995	C	78.1	Confident	76.1	Confident	94 Å²	94	61.6 Å²	61.6	64%	0.635	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-24	-174.3	-63.1	0	0	0	0	113.4	M992	M992-C995 PolarHBondContact O-N 3.34Å; M992-C995 VanDerWaalsContact O-N 3.13Å
996	F	78.8	Confident	75.2	Confident	10 Å²	10	64.3 Å²	64.3	4%	0.044	33%	0.327	C	S	.	.	S	Bend	trans	-122.4	147.1	-175	-67.5	-93.1	0	0	0	111.8	K951 L954 F955 I958 M992 L1001	K951-F996 HydrophobicContact CB-CE1 4.1Å; L954-F996 HydrophobicContact CB-CZ 4.37Å; L954-F996 HydrophobicContact CD2-CZ 4.02Å; L954-F996 HydrophobicContact CG-CZ 4.13Å; F955-F996 HydrophobicContact CB-CE1 4.43Å; F955-F996 HydrophobicContact CB-CZ 4.1Å; I958-F996 HydrophobicContact CD1-CE2 4.18Å; M992-F996 HydrophobicContact CG-CD2 3.36Å; M992-F996 HydrophobicContact CG-CE2 3.67Å; M992-F996 HydrophobicContact CG-CG 4.44Å; M992-F996 PolarHBondContact O-N 2.87Å; M992-F996 HydrophobicContact SD-CD2 4.01Å; M992-F996 HydrophobicContact SD-CE2 3.83Å; F996-L1001 HydrophobicContact CB-CD1 3.66Å; F996-L1001 HydrophobicContact CB-CD2 4.3Å; F996-L1001 HydrophobicContact CB-CG 4.44Å; F996-L1001 HydrophobicContact CD1-CD1 4.41Å; F996-L1001 HydrophobicContact CD2-CD1 4.14Å; F996-L1001 HydrophobicContact CG-CD1 3.84Å
997	S	75.6	Confident	73.8	Confident	66 Å²	66	66.9 Å²	66.9	46%	0.462	34%	0.339	S	S	.	.			trans	-66.9	141.9	170.6	178.5	0	0	0	0	109.9	R999 E1000 L1001	S997-R999 PolarHBondContact O-N 3.23Å; S997-E1000 PolarHBondContact N-OE2 3.03Å; S997-E1000 PolarHBondContact O-N 3.04Å; S997-L1001 PolarHBondContact O-N 3.44Å; S997-L1001 VanDerWaalsContact O-N 3.11Å
998	K	70.6	Confident	71.3	Confident	176 Å²	176	62.5 Å²	62.5	77%	0.765	32%	0.321	S	S	*	.	H	α-helix	trans	-49.1	-31.6	174.2	-67.5	-176.7	179.5	178.5	0	112.8	S1002	K998-S1002 WeakPolarHBondContact O-CB 3.29Å; K998-S1002 PolarHBondContact O-N 3.15Å; K998-S1002 VanDerWaalsContact O-N 3.07Å
999	R	69.4	Low	69.1	Low	107 Å²	107	62.8 Å²	62.8	40%	0.404	32%	0.323	S	S	.	.	H	α-helix	trans	-71.3	-42.8	176.7	-169.1	-177	-168	-176.2	-0.2	113	S997 L1001 S1002 W1003	S997-R999 PolarHBondContact O-N 3.23Å; R999-L1001 VanDerWaalsContact C-N 3.32Å; R999-S1002 PolarHBondContact O-N 3.43Å; R999-S1002 PolarHBondContact O-OG 2.84Å; R999-W1003 PolarHBondContact O-N 3.4Å
1000	E	74.5	Confident	66.8	Low	31 Å²	31	68.2 Å²	68.2	15%	0.145	35%	0.35	C	S	.	.	H	α-helix	trans	-67.9	-40	-179.3	-65.7	175.2	154.7	0	0	110.4	V947 K951 S997 W1003 L1004	V947-E1000 HydrophobicContact CG2-CB 4.36Å; K951-E1000 WeakPolarHBondContact CD-OE1 3.41Å; K951-E1000 WeakPolarHBondContact CD-OE2 3.41Å; K951-E1000 IonicContact NZ-OE1 2.66Å; K951-E1000 PolarHBondContact NZ-OE1 3.13Å; K951-E1000 IonicContact NZ-OE2 2.76Å; K951-E1000 PolarHBondContact NZ-OE2 3.16Å; S997-E1000 PolarHBondContact N-OE2 3.03Å; S997-E1000 PolarHBondContact O-N 3.04Å; E1000-W1003 PolarHBondContact O-N 3.12Å; E1000-L1004 WeakPolarHBondContact O-CG 3.26Å; E1000-L1004 PolarHBondContact O-N 3.23Å
1001	L	72.3	Confident	64.6	Low	3 Å²	3	65 Å²	65	2%	0.016	35%	0.346	C	S	.	.	H	α-helix	trans	-67.6	-35.8	177.3	-128.1	52	0	0	0	112.3	F955 M992 D993 F996 S997 R999 W1003 L1004 D1005	F955-L1001 HydrophobicContact CD2-CD1 4.17Å; F955-L1001 HydrophobicContact CE2-CD1 4.02Å; M992-L1001 HydrophobicContact CE-CD1 4.01Å; M992-L1001 HydrophobicContact CG-CD1 4.2Å; M992-L1001 HydrophobicContact SD-CD1 4.19Å; D993-L1001 WeakPolarHBondContact OD1-CD2 3.42Å; F996-L1001 HydrophobicContact CB-CD1 3.66Å; F996-L1001 HydrophobicContact CB-CD2 4.3Å; F996-L1001 HydrophobicContact CB-CG 4.44Å; F996-L1001 HydrophobicContact CD1-CD1 4.41Å; F996-L1001 HydrophobicContact CD2-CD1 4.14Å; F996-L1001 HydrophobicContact CG-CD1 3.84Å; S997-L1001 PolarHBondContact O-N 3.44Å; S997-L1001 VanDerWaalsContact O-N 3.11Å; R999-L1001 VanDerWaalsContact C-N 3.32Å; L1001-W1003 VanDerWaalsContact C-N 3.3Å; L1001-W1003 PolarHBondContact O-N 2.99Å; L1001-L1004 PolarHBondContact O-N 2.92Å; L1001-D1005 WeakPolarHBondContact O-CB 3.35Å; L1001-D1005 PolarHBondContact O-N 2.94Å
1002	S	69.3	Low	62.4	Low	39 Å²	39	67.9 Å²	67.9	27%	0.273	35%	0.354	S	S	.	.	H	α-helix	trans	-63.8	-34.9	173.1	70.4	0	0	0	0	112.1	K998 R999 L1004 D1006	K998-S1002 WeakPolarHBondContact O-CB 3.29Å; K998-S1002 PolarHBondContact O-N 3.15Å; K998-S1002 VanDerWaalsContact O-N 3.07Å; R999-S1002 PolarHBondContact O-N 3.43Å; R999-S1002 PolarHBondContact O-OG 2.84Å; S1002-L1004 VanDerWaalsContact C-N 3.33Å; S1002-D1006 CarbonylContact O-C 3.41Å; S1002-D1006 WeakPolarHBondContact O-CA 3.38Å; S1002-D1006 WeakPolarHBondContact O-CB 3.48Å; S1002-D1006 PolarHBondContact O-N 3.38Å
1003	W	70.6	Confident	60.6	Low	37 Å²	37	69.5 Å²	69.5	14%	0.14	36%	0.36	C	S	.	.	H	α-helix	trans	-71.6	-27.6	175	-67.6	111.9	0	0	0	113.5	H946 V947 R999 E1000 L1001 K1013	H946-W1003 HydrophobicContact CB-CD2 4.05Å; H946-W1003 HydrophobicContact CB-CG 4.19Å; H946-W1003 HydrophobicContact CB-CZ2 4.46Å; H946-W1003 AromaticContact CD2-CE2 3.95Å; H946-W1003 AromaticContact CD2-CE3 3.86Å; H946-W1003 AromaticContact CD2-CH2 3.69Å; H946-W1003 AromaticContact CD2-CZ2 3.79Å; H946-W1003 AromaticContact CD2-CZ3 3.71Å; H946-W1003 AromaticContact CG-CE2 3.88Å; H946-W1003 AromaticContact CG-CZ2 3.93Å; H946-W1003 AromaticContact NE2-CH2 3.73Å; V947-W1003 HydrophobicContact CG2-CB 3.95Å; V947-W1003 HydrophobicContact CG2-CG 4.36Å; R999-W1003 PolarHBondContact O-N 3.4Å; E1000-W1003 PolarHBondContact O-N 3.12Å; L1001-W1003 VanDerWaalsContact C-N 3.3Å; L1001-W1003 PolarHBondContact O-N 2.99Å; W1003-K1013 HydrophobicContact CH2-CD 3.8Å; W1003-K1013 HydrophobicContact CH2-CG 3.82Å; W1003-K1013 HydrophobicContact CZ3-CD 3.62Å; W1003-K1013 HydrophobicContact CZ3-CG 4.06Å; W1003-K1013 VanDerWaalsContact CZ3-NZ 3.35Å
1004	L	73	Confident	58.8	Low	1 Å²	1	69.2 Å²	69.2	1%	0.005	36%	0.355	C	S	.	.	H	α-helix	trans	-90.2	-26.4	-178.4	-68.5	170.4	0	0	0	113	R927 V952 F955 E1000 L1001 S1002	R927-L1004 PolarHBondContact NH1-O 3.36Å; R927-L1004 PolarHBondContact NH2-O 2.97Å; V952-L1004 HydrophobicContact CG2-CD2 4.36Å; F955-L1004 HydrophobicContact CB-CD1 4.14Å; F955-L1004 HydrophobicContact CD2-CB 4.45Å; F955-L1004 HydrophobicContact CD2-CD1 3.79Å; F955-L1004 HydrophobicContact CE2-CB 4.11Å; F955-L1004 HydrophobicContact CE2-CD1 4.28Å; F955-L1004 HydrophobicContact CG-CD1 3.93Å; F955-L1004 HydrophobicContact CZ-CB 4.19Å; E1000-L1004 WeakPolarHBondContact O-CG 3.26Å; E1000-L1004 PolarHBondContact O-N 3.23Å; L1001-L1004 PolarHBondContact O-N 2.92Å; S1002-L1004 VanDerWaalsContact C-N 3.33Å
1005	D	69.5	Low	57	Low	9 Å²	9	69.6 Å²	69.6	5%	0.048	35%	0.351	C	S	.	.	H	α-helix	trans	-111.1	-38.8	-177.9	-68.6	-36.6	0	0	0	113.9	R591 F592 F955 R989 L1001	R591-D1005 VanDerWaalsContact CB-O 3.23Å; R591-D1005 WeakPolarHBondContact CB-O 3.39Å; R591-D1005 WeakPolarHBondContact CD-O 3.47Å; F592-D1005 WeakPolarHBondContact CB-OD1 3.34Å; F955-D1005 WeakPolarHBondContact CZ-OD1 3.12Å; R989-D1005 IonicContact CZ-OD2 2.74Å; R989-D1005 IonicContact NE-OD2 2.79Å; R989-D1005 PolarHBondContact NE-OD2 3.18Å; R989-D1005 IonicContact NH2-OD2 3.85Å; R989-D1005 PolarHBondContact NH2-OD2 2.68Å; L1001-D1005 WeakPolarHBondContact O-CB 3.35Å; L1001-D1005 PolarHBondContact O-N 2.94Å
1006	D	57.6	Low	55.3	Low	65 Å²	65	70.3 Å²	70.3	35%	0.348	35%	0.347	S	S	.	.			trans	-95.7	118.6	179.3	-80.9	-37.1	0	0	0	110.5	S1002 M1008	S1002-D1006 CarbonylContact O-C 3.41Å; S1002-D1006 WeakPolarHBondContact O-CA 3.38Å; S1002-D1006 WeakPolarHBondContact O-CB 3.48Å; S1002-D1006 PolarHBondContact O-N 3.38Å; D1006-M1008 PolarHBondContact O-N 2.99Å; D1006-M1008 VanDerWaalsContact O-N 3.11Å
1007	L	48.6	Very low	53.6	Low	90 Å²	90	71.9 Å²	71.9	47%	0.471	36%	0.356	S	S	.	.			trans	-77.1	89.9	148.2	-93.5	159.7	0	0	0	107.2	R591 E812	R591-L1007 VanDerWaalsContact NH1-CG 3.32Å; E812-L1007 HydrophobicContact CG-CD1 4.11Å; E812-L1007 WeakPolarHBondContact OE1-CD1 3.26Å
1008	M	30.1	Very low	52	Low	51 Å²	51	71.4 Å²	71.4	25%	0.251	35%	0.349	S	S	.	.			trans	-52.4	129.1	156.3	-80.4	178	75.9	0	0	107.6	D1006 E1010 K1012 K1013 L1016	D1006-M1008 PolarHBondContact O-N 2.99Å; D1006-M1008 VanDerWaalsContact O-N 3.11Å; M1008-E1010 PolarHBondContact O-N 3.18Å; M1008-K1012 HydrophobicContact CE-CB 3.93Å; M1008-K1012 WeakPolarHBondContact CE-O 3.37Å; M1008-K1013 HydrophobicContact CB-CB 4.22Å; M1008-K1013 VanDerWaalsContact CE-CA 3.47Å; M1008-K1013 HydrophobicContact CE-CB 4.36Å; M1008-L1016 HydrophobicContact CE-CB 3.77Å; M1008-L1016 HydrophobicContact CE-CD1 4.49Å; M1008-L1016 HydrophobicContact CE-CD2 4.27Å; M1008-L1016 HydrophobicContact CE-CG 4.4Å; M1008-L1016 HydrophobicContact SD-CD2 4.42Å
1009	P	35.8	Very low	51	Low	58 Å²	58	65.8 Å²	65.8	38%	0.377	34%	0.335	S	S	.	.			trans	-55.8	136.3	167.5	22.5	-29.2	0	0	0	107.6	S1011 K1012 K1013	P1009-S1011 PolarHBondContact O-N 3.22Å; P1009-K1012 HydrophobicContact CG-CB 4.09Å; P1009-K1012 HydrophobicContact CG-CD 4.08Å; P1009-K1012 HydrophobicContact CG-CG 4Å; P1009-K1012 PolarHBondContact O-N 3.39Å; P1009-K1013 PolarHBondContact O-N 3.35Å; P1009-K1013 VanDerWaalsContact O-N 3.11Å
1010	E	33.9	Very low	49.9	Very low	141 Å²	141	64.8 Å²	64.8	66%	0.659	33%	0.334	S	S	*	.	H	α-helix	trans	-50.1	-28.9	-174.2	-67.1	176.3	155.6	0	0	112.7	M1008 K1013 K1014	M1008-E1010 PolarHBondContact O-N 3.18Å; E1010-K1013 PolarHBondContact O-N 2.95Å; E1010-K1014 PolarHBondContact O-N 2.99Å; E1010-K1014 VanDerWaalsContact O-N 3.16Å
1011	S	32.2	Very low	48.6	Very low	83 Å²	83	70 Å²	70	58%	0.58	36%	0.356	S	S	*	.	H	α-helix	trans	-68.3	-35.8	175	58.6	0	0	0	0	114.9	P1009	P1009-S1011 PolarHBondContact O-N 3.22Å
1012	K	36.9	Very low	47.4	Very low	128 Å²	128	76.4 Å²	76.4	56%	0.557	38%	0.383	S	S	*	.	H	α-helix	trans	-81.3	-30.9	174.1	-71.9	-170.2	177.6	-168.2	0	111.5	M1008 P1009 K1014 K1015 L1016	M1008-K1012 HydrophobicContact CE-CB 3.93Å; M1008-K1012 WeakPolarHBondContact CE-O 3.37Å; P1009-K1012 HydrophobicContact CG-CB 4.09Å; P1009-K1012 HydrophobicContact CG-CD 4.08Å; P1009-K1012 HydrophobicContact CG-CG 4Å; P1009-K1012 PolarHBondContact O-N 3.39Å; K1012-K1014 VanDerWaalsContact C-N 3.34Å; K1012-K1015 PolarHBondContact O-N 3.19Å; K1012-L1016 PolarHBondContact O-N 3.47Å
1013	K	40.9	Very low	46.6	Very low	42 Å²	42	76.9 Å²	76.9	18%	0.183	39%	0.39	C	S	.	.	H	α-helix	trans	-58.8	-46.3	175	-178	-176	160.9	163.1	0	110.8	W1003 M1008 P1009 E1010 K1015 L1016 D1017	W1003-K1013 HydrophobicContact CH2-CD 3.8Å; W1003-K1013 HydrophobicContact CH2-CG 3.82Å; W1003-K1013 HydrophobicContact CZ3-CD 3.62Å; W1003-K1013 HydrophobicContact CZ3-CG 4.06Å; W1003-K1013 VanDerWaalsContact CZ3-NZ 3.35Å; M1008-K1013 HydrophobicContact CB-CB 4.22Å; M1008-K1013 VanDerWaalsContact CE-CA 3.47Å; M1008-K1013 HydrophobicContact CE-CB 4.36Å; P1009-K1013 PolarHBondContact O-N 3.35Å; P1009-K1013 VanDerWaalsContact O-N 3.11Å; E1010-K1013 PolarHBondContact O-N 2.95Å; K1013-K1015 PolarHBondContact O-N 2.98Å; K1013-L1016 PolarHBondContact O-N 3.24Å; K1013-D1017 WeakPolarHBondContact O-CB 2.97Å; K1013-D1017 PolarHBondContact O-N 3.45Å
1014	K	39.5	Very low	45.7	Very low	69 Å²	69	81 Å²	81	30%	0.3	41%	0.409	S	S	.	.	H	α-helix	trans	-58.8	-46.6	175.6	-135.4	178.7	-171.6	-175.6	0	111.7	S415 K418 E1010 K1012 L1016 D1017 D1018	S415-K1014 PolarHBondContact O-NZ 3.41Å; S415-K1014 PolarHBondContact OG-NZ 2.95Å; S415-K1014 VanDerWaalsContact OG-NZ 3.12Å; K418-K1014 HydrophobicContact CD-CD 4.47Å; K418-K1014 VanDerWaalsContact CE-CE 3.44Å; E1010-K1014 PolarHBondContact O-N 2.99Å; E1010-K1014 VanDerWaalsContact O-N 3.16Å; K1012-K1014 VanDerWaalsContact C-N 3.34Å; K1014-L1016 PolarHBondContact O-N 2.97Å; K1014-D1017 PolarHBondContact O-N 3.12Å; K1014-D1018 VanDerWaalsContact O-CB 3.3Å; K1014-D1018 WeakPolarHBondContact O-CB 3.37Å; K1014-D1018 PolarHBondContact O-N 3.15Å; K1014-D1018 VanDerWaalsContact O-OD2 3.08Å
1015	K	40.1	Very low	44.6	Very low	161 Å²	161	86.4 Å²	86.4	70%	0.7	43%	0.434	S	S	*	.	H	α-helix	trans	-64.4	-37.5	-179.7	-69.8	-175.1	178.2	-168.5	0	113.5	K1012 K1013 A1019	K1012-K1015 PolarHBondContact O-N 3.19Å; K1013-K1015 PolarHBondContact O-N 2.98Å; K1015-A1019 WeakPolarHBondContact O-CB 3.34Å; K1015-A1019 PolarHBondContact O-N 3.17Å; K1015-A1019 VanDerWaalsContact O-N 3.08Å
1016	L	42.7	Very low	43.9	Very low	109 Å²	109	92.3 Å²	92.3	57%	0.571	46%	0.462	S	S	*	.	H	α-helix	trans	-77.4	-37.5	-179.8	-153	100.9	0	0	0	112.1	M1008 K1012 K1013 K1014 K1020	M1008-L1016 HydrophobicContact CE-CB 3.77Å; M1008-L1016 HydrophobicContact CE-CD1 4.49Å; M1008-L1016 HydrophobicContact CE-CD2 4.27Å; M1008-L1016 HydrophobicContact CE-CG 4.4Å; M1008-L1016 HydrophobicContact SD-CD2 4.42Å; K1012-L1016 PolarHBondContact O-N 3.47Å; K1013-L1016 PolarHBondContact O-N 3.24Å; K1014-L1016 PolarHBondContact O-N 2.97Å; L1016-K1020 WeakPolarHBondContact O-CB 3.43Å; L1016-K1020 PolarHBondContact O-N 2.99Å
1017	D	42.4	Very low	43.8	Very low	43 Å²	43	94 Å²	94	23%	0.23	47%	0.468	C	S	.	.	H	α-helix	trans	-68.1	-37.6	174.6	-76.1	-29.7	0	0	0	111.3	K1013 K1014 K1020 K1021	K1013-D1017 WeakPolarHBondContact O-CB 2.97Å; K1013-D1017 PolarHBondContact O-N 3.45Å; K1014-D1017 PolarHBondContact O-N 3.12Å; D1017-K1020 PolarHBondContact O-N 2.79Å; D1017-K1021 PolarHBondContact O-N 3.49Å
1018	D	42.4	Very low	43.9	Very low	56 Å²	56	95.6 Å²	95.6	30%	0.299	47%	0.472	S	S	.	.	H	α-helix	trans	-67.6	-41.6	174.7	-68	-23.1	0	0	0	111.8	K418 K1014 K1020 K1021 K1022	K418-D1018 WeakPolarHBondContact CE-OD2 3.34Å; K418-D1018 IonicContact NZ-OD1 2.78Å; K418-D1018 PolarHBondContact NZ-OD1 3.43Å; K418-D1018 IonicContact NZ-OD2 3.65Å; K418-D1018 PolarHBondContact NZ-OD2 2.9Å; K1014-D1018 VanDerWaalsContact O-CB 3.3Å; K1014-D1018 WeakPolarHBondContact O-CB 3.37Å; K1014-D1018 PolarHBondContact O-N 3.15Å; K1014-D1018 VanDerWaalsContact O-OD2 3.08Å; D1018-K1020 VanDerWaalsContact C-N 3.28Å; D1018-K1020 PolarHBondContact O-N 3.04Å; D1018-K1021 PolarHBondContact O-N 3.42Å; D1018-K1022 WeakPolarHBondContact O-CG 3.34Å; D1018-K1022 PolarHBondContact O-N 3.35Å; D1018-K1022 VanDerWaalsContact O-N 3.08Å
1019	A	48.8	Very low	44.8	Very low	58 Å²	58	95.5 Å²	95.5	48%	0.479	48%	0.479	S	S	.	.	H	α-helix	trans	-64.2	-34.8	174.6	0	0	0	0	0	112.1	K1015 A1023	K1015-A1019 WeakPolarHBondContact O-CB 3.34Å; K1015-A1019 PolarHBondContact O-N 3.17Å; K1015-A1019 VanDerWaalsContact O-N 3.08Å; A1019-A1023 WeakPolarHBondContact O-CB 3.44Å; A1019-A1023 PolarHBondContact O-N 3.44Å
1020	K	47.1	Very low	45.6	Very low	87 Å²	87	99 Å²	99	38%	0.378	49%	0.491	S	S	.	.	H	α-helix	trans	-77.7	-33.2	179.8	-169	168.9	-173.9	166	0	113.3	L1016 D1017 D1018 K1024	L1016-K1020 WeakPolarHBondContact O-CB 3.43Å; L1016-K1020 PolarHBondContact O-N 2.99Å; D1017-K1020 PolarHBondContact O-N 2.79Å; D1018-K1020 VanDerWaalsContact C-N 3.28Å; D1018-K1020 PolarHBondContact O-N 3.04Å; K1020-K1024 PolarHBondContact O-N 3.5Å; K1020-K1024 VanDerWaalsContact O-N 3.1Å
1021	K	48.1	Very low	46.3	Very low	139 Å²	139	97.5 Å²	97.5	60%	0.604	48%	0.482	S	S	*	.	H	α-helix	trans	-63.8	-47.1	170	-84.5	-169.4	168.8	-157.6	0	110.6	D1017 D1018 A1023 K1024 E1025	D1017-K1021 PolarHBondContact O-N 3.49Å; D1018-K1021 PolarHBondContact O-N 3.42Å; K1021-A1023 PolarHBondContact O-N 2.98Å; K1021-K1024 PolarHBondContact O-N 3.43Å; K1021-K1024 VanDerWaalsContact O-N 3.12Å; K1021-E1025 WeakPolarHBondContact O-CB 3.47Å; K1021-E1025 WeakPolarHBondContact O-CG 3.4Å; K1021-E1025 PolarHBondContact O-N 2.94Å
1022	K	45.8	Very low	46.9	Very low	138 Å²	138	100.9 Å²	100.9	60%	0.6	49%	0.491	S	S	*	.	H	α-helix	trans	-57.7	-44.7	174.8	-73.7	-175.4	176.6	-164.8	0	113.1	D1018 K1024 E1025 E1026	D1018-K1022 WeakPolarHBondContact O-CG 3.34Å; D1018-K1022 PolarHBondContact O-N 3.35Å; D1018-K1022 VanDerWaalsContact O-N 3.08Å; K1022-K1024 VanDerWaalsContact C-N 3.32Å; K1022-K1024 PolarHBondContact O-N 3.15Å; K1022-E1025 PolarHBondContact O-N 2.88Å; K1022-E1026 WeakPolarHBondContact O-CB 3.38Å; K1022-E1026 PolarHBondContact O-N 3.05Å
1023	A	52.6	Low	47.2	Very low	50 Å²	50	101.3 Å²	101.3	41%	0.413	50%	0.498	S	S	.	.	H	α-helix	trans	-65.5	-33.5	177.3	0	0	0	0	0	113.2	A1019 K1021 E1027	A1019-A1023 WeakPolarHBondContact O-CB 3.44Å; A1019-A1023 PolarHBondContact O-N 3.44Å; K1021-A1023 PolarHBondContact O-N 2.98Å; A1023-E1027 WeakPolarHBondContact O-CB 3.49Å; A1023-E1027 PolarHBondContact O-N 3.08Å
1024	K	51.2	Low	47.3	Very low	123 Å²	123	107.2 Å²	107.2	54%	0.535	53%	0.526	S	S	.	.	H	α-helix	trans	-72.1	-40.6	174.3	-94.8	-171.4	162.1	-147.6	0	112.4	K1020 K1021 K1022 E1026 E1027 E1028	K1020-K1024 PolarHBondContact O-N 3.5Å; K1020-K1024 VanDerWaalsContact O-N 3.1Å; K1021-K1024 PolarHBondContact O-N 3.43Å; K1021-K1024 VanDerWaalsContact O-N 3.12Å; K1022-K1024 VanDerWaalsContact C-N 3.32Å; K1022-K1024 PolarHBondContact O-N 3.15Å; K1024-E1026 VanDerWaalsContact C-N 3.34Å; K1024-E1027 PolarHBondContact O-N 3.04Å; K1024-E1028 WeakPolarHBondContact O-CB 3.33Å; K1024-E1028 WeakPolarHBondContact O-CG 3.41Å; K1024-E1028 PolarHBondContact O-N 3.28Å
1025	E	50.7	Low	47.5	Very low	114 Å²	114	111 Å²	111	53%	0.533	55%	0.549	S	S	.	.	H	α-helix	trans	-65.7	-38	175.7	-74.1	162.4	-166.1	0	0	110.8	K1021 K1022 A1029	K1021-E1025 WeakPolarHBondContact O-CB 3.47Å; K1021-E1025 WeakPolarHBondContact O-CG 3.4Å; K1021-E1025 PolarHBondContact O-N 2.94Å; K1022-E1025 PolarHBondContact O-N 2.88Å; E1025-A1029 WeakPolarHBondContact O-CB 3.42Å; E1025-A1029 PolarHBondContact O-N 3.41Å
1026	E	55.4	Low	47.1	Very low	134 Å²	134	106.9 Å²	106.9	63%	0.626	55%	0.552	S	S	*	*	H	α-helix	trans	-65.1	-43.7	170.8	-83	175.3	160.2	0	0	111.9	K1022 K1024 E1028 A1029 E1030	K1022-E1026 WeakPolarHBondContact O-CB 3.38Å; K1022-E1026 PolarHBondContact O-N 3.05Å; K1024-E1026 VanDerWaalsContact C-N 3.34Å; E1026-E1028 VanDerWaalsContact C-N 3.34Å; E1026-E1028 PolarHBondContact O-N 3.03Å; E1026-A1029 PolarHBondContact O-N 3.44Å; E1026-E1030 WeakPolarHBondContact O-CB 3.36Å; E1026-E1030 WeakPolarHBondContact O-CG 3.42Å; E1026-E1030 PolarHBondContact O-N 3.1Å
1027	E	54.5	Low	46.5	Very low	101 Å²	101	104.3 Å²	104.3	47%	0.472	55%	0.552	S	S	.	*	H	α-helix	trans	-68.3	-31.8	178.5	-158.1	-168.2	153.5	0	0	112.4	A1023 K1024 K1031	A1023-E1027 WeakPolarHBondContact O-CB 3.49Å; A1023-E1027 PolarHBondContact O-N 3.08Å; K1024-E1027 PolarHBondContact O-N 3.04Å; E1027-K1031 WeakPolarHBondContact O-CB 3.23Å; E1027-K1031 WeakPolarHBondContact O-CD 3.43Å; E1027-K1031 VanDerWaalsContact O-CG 3.24Å; E1027-K1031 WeakPolarHBondContact O-CG 3.47Å; E1027-K1031 PolarHBondContact O-N 3.19Å; E1027-K1031 IonicContact OE1-NZ 3.94Å; E1027-K1031 PolarHBondContact OE1-NZ 3.32Å
1028	E	51	Low	45.9	Very low	123 Å²	123	109.8 Å²	109.8	58%	0.575	58%	0.581	S	S	*	*	H	α-helix	trans	-76	-36.3	173.2	-77.2	176.9	-176.4	0	0	111.9	K1024 E1026 K1031 M1032	K1024-E1028 WeakPolarHBondContact O-CB 3.33Å; K1024-E1028 WeakPolarHBondContact O-CG 3.41Å; K1024-E1028 PolarHBondContact O-N 3.28Å; E1026-E1028 VanDerWaalsContact C-N 3.34Å; E1026-E1028 PolarHBondContact O-N 3.03Å; E1028-K1031 PolarHBondContact O-N 3.46Å; E1028-M1032 WeakPolarHBondContact O-CG 3.36Å; E1028-M1032 PolarHBondContact O-N 3.27Å
1029	A	49.1	Very low	45.3	Very low	48 Å²	48	117 Å²	117	40%	0.397	61%	0.609	S	S	.	*	H	α-helix	trans	-68.3	-39.7	173.6	0	0	0	0	0	112.4	E1025 E1026 M1032 L1033	E1025-A1029 WeakPolarHBondContact O-CB 3.42Å; E1025-A1029 PolarHBondContact O-N 3.41Å; E1026-A1029 PolarHBondContact O-N 3.44Å; A1029-M1032 PolarHBondContact O-N 2.9Å; A1029-L1033 WeakPolarHBondContact O-CB 3.3Å; A1029-L1033 WeakPolarHBondContact O-CD1 3.35Å; A1029-L1033 WeakPolarHBondContact O-CG 3.49Å; A1029-L1033 PolarHBondContact O-N 3.03Å
1030	E	52.4	Low	44.2	Very low	131 Å²	131	123.4 Å²	123.4	61%	0.612	63%	0.627	S	S	*	*	H	α-helix	trans	-64.4	-41.4	173.4	-80.9	-175.3	158	0	0	111.6	E1026 M1032 L1033 E1034	E1026-E1030 WeakPolarHBondContact O-CB 3.36Å; E1026-E1030 WeakPolarHBondContact O-CG 3.42Å; E1026-E1030 PolarHBondContact O-N 3.1Å; E1030-M1032 VanDerWaalsContact C-N 3.32Å; E1030-M1032 PolarHBondContact O-N 3.06Å; E1030-L1033 PolarHBondContact O-N 3.21Å; E1030-E1034 PolarHBondContact O-N 3.17Å
1031	K	49.7	Very low	43.6	Very low	110 Å²	110	124.6 Å²	124.6	48%	0.478	64%	0.644	S	S	.	*	H	α-helix	trans	-66.3	-32	174.5	-75.4	170.6	-170.4	160.7	0	113	E1027 E1028 I1035	E1027-K1031 WeakPolarHBondContact O-CB 3.23Å; E1027-K1031 WeakPolarHBondContact O-CD 3.43Å; E1027-K1031 VanDerWaalsContact O-CG 3.24Å; E1027-K1031 WeakPolarHBondContact O-CG 3.47Å; E1027-K1031 PolarHBondContact O-N 3.19Å; E1027-K1031 IonicContact OE1-NZ 3.94Å; E1027-K1031 PolarHBondContact OE1-NZ 3.32Å; E1028-K1031 PolarHBondContact O-N 3.46Å; K1031-I1035 WeakPolarHBondContact O-CD1 3.14Å; K1031-I1035 WeakPolarHBondContact O-CG1 3.14Å
1032	M	43.8	Very low	42.4	Very low	155 Å²	155	124.8 Å²	124.8	76%	0.764	65%	0.65	S	S	*	*	H	α-helix	trans	-73.9	-30.5	172.7	-79.1	-168.1	170.7	0	0	112.7	E1028 A1029 E1030	E1028-M1032 WeakPolarHBondContact O-CG 3.36Å; E1028-M1032 PolarHBondContact O-N 3.27Å; A1029-M1032 PolarHBondContact O-N 2.9Å; E1030-M1032 VanDerWaalsContact C-N 3.32Å; E1030-M1032 PolarHBondContact O-N 3.06Å
1033	L	44.1	Very low	41.4	Very low	137 Å²	137	126.3 Å²	126.3	72%	0.717	66%	0.66	S	S	*	*	H	α-helix	trans	-75.1	-32.9	176.2	-82.9	157.7	0	0	0	112.9	A1029 E1030 I1035 G1036	A1029-L1033 WeakPolarHBondContact O-CB 3.3Å; A1029-L1033 WeakPolarHBondContact O-CD1 3.35Å; A1029-L1033 WeakPolarHBondContact O-CG 3.49Å; A1029-L1033 PolarHBondContact O-N 3.03Å; E1030-L1033 PolarHBondContact O-N 3.21Å; L1033-I1035 VanDerWaalsContact C-N 3.33Å; L1033-I1035 PolarHBondContact O-N 3.02Å; L1033-G1036 PolarHBondContact O-N 3.26Å
1034	E	41.9	Very low	40.1	Very low	165 Å²	165	129.1 Å²	129.1	77%	0.771	68%	0.676	S	S	*	*	H	α-helix	trans	-72.2	-21.7	175.6	-76.9	-167.3	157.1	0	0	113.8	E1030 G1036	E1030-E1034 PolarHBondContact O-N 3.17Å; E1034-G1036 VanDerWaalsContact C-N 3.34Å
1035	I	43.2	Very low	38.8	Very low	150 Å²	150	133 Å²	133	77%	0.769	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	-13.8	178.5	-65.5	168.9	0	0	0	112	K1031 L1033	K1031-I1035 WeakPolarHBondContact O-CD1 3.14Å; K1031-I1035 WeakPolarHBondContact O-CG1 3.14Å; L1033-I1035 VanDerWaalsContact C-N 3.33Å; L1033-I1035 PolarHBondContact O-N 3.02Å
1036	G	32.9	Very low	37.5	Very low	74 Å²	74	135.1 Å²	135.1	76%	0.763	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-0.7	-174.5	0	0	0	0	0	116.5	L1033 E1034	L1033-G1036 PolarHBondContact O-N 3.26Å; E1034-G1036 VanDerWaalsContact C-N 3.34Å
1037	G	30.6	Very low	36	Very low	55 Å²	55	135.5 Å²	135.5	57%	0.567	70%	0.701	S	S	*	*			trans	-142.4	91.1	-173.2	0	0	0	0	0	113.6
1038	D	29.1	Very low	34.7	Very low	158 Å²	158	137.6 Å²	137.6	85%	0.845	71%	0.714	S	S	*	*			trans	-145.5	123.1	156.2	-110.8	-14.6	0	0	0	112.6
1039	K	28.8	Very low	33.4	Very low	206 Å²	206	136.5 Å²	136.5	90%	0.896	72%	0.72	S	S	*	*			trans	-98.2	112.6	160.3	-85.7	-177.3	177	177.2	0	107.9
1040	F	26.1	Very low	32.2	Very low	194 Å²	194	139.8 Å²	139.8	85%	0.851	74%	0.74	S	S	*	*			trans	-49.2	161.1	165.3	-80	-82.6	0	0	0	113.2
1041	P	34	Very low	31.1	Very low	112 Å²	112	139.4 Å²	139.4	73%	0.727	75%	0.749	S	S	*	*			cis	-157.2	171.3	43.5	40.8	-17.6	0	0	0	121.2
1042	L	24.4	Very low	29.9	Very low	142 Å²	142	137.5 Å²	137.5	74%	0.743	76%	0.761	S	S	*	*				114.7	124.3	129.8	-132.8	87	0	0	0	121.4
1043	E	24.4	Very low	28.9	Very low	171 Å²	171	139.9 Å²	139.9	80%	0.799	77%	0.767	S	S	*	*			trans	71.3	109.9	150.6	-90.7	176.8	170.6	0	0	121.8
1044	S	24	Very low	28	Very low	109 Å²	109	139.3 Å²	139.3	76%	0.762	77%	0.774	S	S	*	*				165.7	111.9	81.2	-143.4	0	0	0	0	114
1045	R	24.7	Very low	27.1	Very low	203 Å²	203	137.9 Å²	137.9	77%	0.766	78%	0.776	S	S	*	*				58.9	115.3	129.9	-142.3	172.6	-158.7	-167.8	4.3	124.1
1046	K	23.8	Very low	26.1	Very low	159 Å²	159	135.4 Å²	135.4	69%	0.691	77%	0.773	S	S	*	*			trans	69.8	139.8	137.9	-75.2	178.4	-175.7	-176	0	118.3
1047	L	24.4	Very low	25.6	Very low	143 Å²	143	138.1 Å²	138.1	75%	0.749	78%	0.778	S	S	*	*			cis	-174	158.3	42.3	-130.9	156.1	0	0	0	111.4
1048	L	27	Very low	25.2	Very low	145 Å²	145	146.4 Å²	146.4	76%	0.759	79%	0.792	S	S	*	*			trans	94.3	82.7	161.2	-80.2	125.4	0	0	0	122.3
1049	S	22.2	Very low	25.1	Very low	99 Å²	99	144.8 Å²	144.8	69%	0.692	79%	0.792	S	S	*	*				54.2	112.4	116.7	67.1	0	0	0	0	124.7
1050	S	23.9	Very low	24.8	Very low	117 Å²	117	142 Å²	142	82%	0.818	79%	0.787	S	S	*	*				81.2	158.2	124.7	-122.9	0	0	0	0	121.6
1051	P	30.8	Very low	25.1	Very low	123 Å²	123	138.3 Å²	138.3	80%	0.799	78%	0.782	S	S	*	*				-135.4	170.3	-96.7	37	-16.1	0	0	0	115.1
1052	G	23.1	Very low	25	Very low	70 Å²	70	137.8 Å²	137.8	72%	0.722	78%	0.781	S	S	*	*			trans	122.6	102.1	148.4	0	0	0	0	0	117
1053	K	24.1	Very low	25.4	Very low	205 Å²	205	140.1 Å²	140.1	89%	0.891	79%	0.789	S	S	*	*				169.6	118.7	123.9	-93.4	171.5	-176.9	179.4	0	109.5
1054	S	23.8	Very low	26.2	Very low	125 Å²	125	137.7 Å²	137.7	87%	0.874	78%	0.78	S	S	*	*			trans	-64.6	126.8	168.7	40.5	0	0	0	0	110.2
1055	V	24.5	Very low	26.7	Very low	135 Å²	135	136.8 Å²	136.8	82%	0.818	77%	0.766	S	S	*	*			trans	-127.1	113.2	161.6	177.2	0	0	0	0	106.7	C1057	V1055-C1057 PolarHBondContact O-N 3.2Å
1056	S	22.5	Very low	27.6	Very low	99 Å²	99	131.9 Å²	131.9	69%	0.692	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-60.9	127.8	170.8	58.8	0	0	0	0	109.7	R1058	S1056-R1058 PolarHBondContact O-N 2.63Å
1057	C	21.3	Very low	28.6	Very low	130 Å²	130	127.3 Å²	127.3	88%	0.878	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-67.3	116.1	166.6	-154	0	0	0	0	108	V1055	V1055-C1057 PolarHBondContact O-N 3.2Å
1058	R	22.8	Very low	29.6	Very low	229 Å²	229	125.2 Å²	125.2	86%	0.864	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-75.5	122.7	169.7	-82.2	178.3	169.9	175.3	-4.6	107.7	S1056	S1056-R1058 PolarHBondContact O-N 2.63Å
1059	C	25.5	Very low	30.5	Very low	125 Å²	125	122.6 Å²	122.6	85%	0.845	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-68.1	137.2	160.2	-64.6	0	0	0	0	109.2
1060	D	24.3	Very low	31.6	Very low	147 Å²	147	120 Å²	120	79%	0.786	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-62.5	140.3	171	-80.3	-43.7	0	0	0	110.7	S1062	D1060-S1062 PolarHBondContact O-N 2.98Å
1061	P	30.8	Very low	32.6	Very low	116 Å²	116	117.6 Å²	117.6	75%	0.753	68%	0.675	S	S	*	*	S	Bend	trans	-94.8	20.3	-172.6	35.4	-30.1	0	0	0	114.4
1062	S	33.4	Very low	33.2	Very low	101 Å²	101	117.7 Å²	117.7	71%	0.706	66%	0.663	S	S	*	*			trans	-103.8	10.5	-163.3	57.6	0	0	0	0	117.4	D1060	D1060-S1062 PolarHBondContact O-N 2.98Å
1063	E	33.2	Very low	34.5	Very low	191 Å²	191	117.2 Å²	117.2	89%	0.893	65%	0.646	S	S	*	*			trans	-132.2	87.2	171.7	-70.8	-174.2	171.3	0	0	110
1064	I	40.9	Very low	35.1	Very low	121 Å²	121	113.2 Å²	113.2	62%	0.621	64%	0.639	S	S	*	*			trans	-99.2	110.6	169.6	-58.8	171.3	0	0	0	106.3	I1066 E1069	I1064-I1066 PolarHBondContact O-N 3.33Å; I1064-I1066 VanDerWaalsContact O-N 3.12Å; I1064-E1069 HydrophobicContact CG2-CB 4.33Å; I1064-E1069 HydrophobicContact CG2-CG 3.96Å
1065	N	34.6	Very low	36	Very low	89 Å²	89	111.8 Å²	111.8	48%	0.476	63%	0.625	S	S	.	*			trans	-71.2	101.9	170.2	-173.1	2.3	0	0	0	108.3	S1067 D1068 E1069	N1065-S1067 PolarHBondContact O-N 3.31Å; N1065-S1067 PolarHBondContact OD1-N 3.45Å; N1065-D1068 HydrophobicContact CB-CB 4.21Å; N1065-D1068 VanDerWaalsContact ND2-CG 3.29Å; N1065-D1068 PolarHBondContact ND2-OD2 3.15Å; N1065-D1068 PolarHBondContact O-N 3.43Å; N1065-E1069 PolarHBondContact O-N 2.93Å; N1065-E1069 VanDerWaalsContact O-N 3.15Å
1066	I	43	Very low	36.9	Very low	101 Å²	101	110 Å²	110	52%	0.518	60%	0.603	S	S	.	*	H	α-helix	trans	-59.7	-39.2	-174.3	-64.3	172.8	0	0	0	110	I1064 D1068 E1069 M1070	I1064-I1066 PolarHBondContact O-N 3.33Å; I1064-I1066 VanDerWaalsContact O-N 3.12Å; I1066-D1068 VanDerWaalsContact C-N 3.27Å; I1066-D1068 PolarHBondContact O-N 2.85Å; I1066-E1069 PolarHBondContact O-N 3.19Å; I1066-M1070 HydrophobicContact CG2-SD 3.99Å; I1066-M1070 WeakPolarHBondContact O-CB 3.38Å; I1066-M1070 PolarHBondContact O-N 3.01Å
1067	S	44.8	Very low	37.7	Very low	62 Å²	62	110.9 Å²	110.9	43%	0.434	60%	0.595	S	S	.	*	H	α-helix	trans	-66.6	-24.8	-178.7	-59	0	0	0	0	113.6	D391 N1065 P1071	D391-S1067 PolarHBondContact OD1-OG 3.2Å; N1065-S1067 PolarHBondContact O-N 3.31Å; N1065-S1067 PolarHBondContact OD1-N 3.45Å; S1067-P1071 WeakPolarHBondContact O-CD 3.31Å
1068	D	46.2	Very low	38.8	Very low	99 Å²	99	107.6 Å²	107.6	53%	0.529	58%	0.577	S	S	.	*	H	α-helix	trans	-89.3	-30.4	175.5	-76.2	-23.9	0	0	0	113.5	N1065 I1066 K1072	N1065-D1068 HydrophobicContact CB-CB 4.21Å; N1065-D1068 VanDerWaalsContact ND2-CG 3.29Å; N1065-D1068 PolarHBondContact ND2-OD2 3.15Å; N1065-D1068 PolarHBondContact O-N 3.43Å; I1066-D1068 VanDerWaalsContact C-N 3.27Å; I1066-D1068 PolarHBondContact O-N 2.85Å; D1068-K1072 VanDerWaalsContact O-CE 3.22Å; D1068-K1072 WeakPolarHBondContact O-CE 3.37Å
1069	E	45.7	Very low	39.6	Very low	91 Å²	91	102.2 Å²	102.2	43%	0.425	57%	0.565	S	S	.	*	H	α-helix	trans	-86.7	-29.9	179.3	-83.1	-62.4	132	0	0	112.9	I1064 N1065 I1066 K1072 T1073	I1064-E1069 HydrophobicContact CG2-CB 4.33Å; I1064-E1069 HydrophobicContact CG2-CG 3.96Å; N1065-E1069 PolarHBondContact O-N 2.93Å; N1065-E1069 VanDerWaalsContact O-N 3.15Å; I1066-E1069 PolarHBondContact O-N 3.19Å; E1069-K1072 WeakPolarHBondContact O-CA 3.49Å; E1069-K1072 VanDerWaalsContact O-CB 3.26Å; E1069-K1072 WeakPolarHBondContact O-CB 3.44Å; E1069-K1072 PolarHBondContact O-N 3.35Å; E1069-K1072 IonicContact OE1-NZ 3.3Å; E1069-K1072 PolarHBondContact OE1-NZ 3.12Å; E1069-T1073 PolarHBondContact O-N 3.08Å
1070	M	45.1	Very low	40.1	Very low	45 Å²	45	98.7 Å²	98.7	22%	0.222	54%	0.541	C	S	.	.	G	3₁₀ helix	trans	-61.4	-41.7	-177.5	-166.5	151.2	-169.6	0	0	115	F167 I1066 K1072 T1073 W1076	F167-M1070 HydrophobicContact CD2-CE 4.28Å; F167-M1070 HydrophobicContact CE1-CE 3.84Å; F167-M1070 HydrophobicContact CE2-CE 3.31Å; F167-M1070 HydrophobicContact CZ-CE 3.05Å; F167-M1070 HydrophobicContact CZ-SD 3.94Å; I1066-M1070 HydrophobicContact CG2-SD 3.99Å; I1066-M1070 WeakPolarHBondContact O-CB 3.38Å; I1066-M1070 PolarHBondContact O-N 3.01Å; M1070-K1072 PolarHBondContact O-N 2.93Å; M1070-K1072 VanDerWaalsContact O-N 3.15Å; M1070-T1073 PolarHBondContact O-N 3.35Å; M1070-T1073 VanDerWaalsContact O-N 3.09Å; M1070-T1073 PolarHBondContact O-OG1 3.3Å; M1070-W1076 VanDerWaalsContact CG-CD1 3.42Å; M1070-W1076 HydrophobicContact CG-CG 4.35Å; M1070-W1076 VanDerWaalsContact O-CB 3.31Å; M1070-W1076 WeakPolarHBondContact O-CB 3.32Å
1071	P	45.4	Very low	40.7	Very low	66 Å²	66	98 Å²	98	43%	0.429	54%	0.535	S	S	.	.	G	3₁₀ helix	trans	-65.8	-14.2	172.6	24.5	-33.3	0	0	0	113.6	S1067	S1067-P1071 WeakPolarHBondContact O-CD 3.31Å
1072	K	42.4	Very low	41	Very low	124 Å²	124	98.6 Å²	98.6	54%	0.539	53%	0.532	S	S	.	.	G	3₁₀ helix	trans	-85.6	-15.9	175.9	-52.7	177.1	-168.7	161.7	0	112.4	D1068 E1069 M1070	D1068-K1072 VanDerWaalsContact O-CE 3.22Å; D1068-K1072 WeakPolarHBondContact O-CE 3.37Å; E1069-K1072 WeakPolarHBondContact O-CA 3.49Å; E1069-K1072 VanDerWaalsContact O-CB 3.26Å; E1069-K1072 WeakPolarHBondContact O-CB 3.44Å; E1069-K1072 PolarHBondContact O-N 3.35Å; E1069-K1072 IonicContact OE1-NZ 3.3Å; E1069-K1072 PolarHBondContact OE1-NZ 3.12Å; M1070-K1072 PolarHBondContact O-N 2.93Å; M1070-K1072 VanDerWaalsContact O-N 3.15Å
1073	T	50.8	Low	41.2	Very low	61 Å²	61	97.7 Å²	97.7	37%	0.374	53%	0.526	S	S	.	.	S	Bend	trans	-72.1	143.5	179.3	68.3	0	0	0	0	111.9	E1069 M1070 V1075 W1076 K1077	E1069-T1073 PolarHBondContact O-N 3.08Å; M1070-T1073 PolarHBondContact O-N 3.35Å; M1070-T1073 VanDerWaalsContact O-N 3.09Å; M1070-T1073 PolarHBondContact O-OG1 3.3Å; T1073-V1075 PolarHBondContact O-N 2.87Å; T1073-W1076 PolarHBondContact O-N 3.01Å; T1073-K1077 PolarHBondContact O-N 3.29Å
1074	T	37.3	Very low	41	Very low	120 Å²	120	90.6 Å²	90.6	74%	0.736	50%	0.504	S	S	*	.	H	α-helix	trans	-62.4	-28.5	-179.4	41.3	0	0	0	0	113.1	A1078	T1074-A1078 WeakPolarHBondContact O-CB 3.48Å; T1074-A1078 PolarHBondContact O-N 2.97Å
1075	V	42.6	Very low	40.6	Very low	96 Å²	96	89.6 Å²	89.6	58%	0.582	50%	0.5	S	S	*	.	H	α-helix	trans	-68.3	-43.7	177.5	-179.2	0	0	0	0	111.3	T1073 A1078 L1079	T1073-V1075 PolarHBondContact O-N 2.87Å; V1075-A1078 PolarHBondContact O-N 3.24Å; V1075-L1079 HydrophobicContact CG1-CD1 4.17Å; V1075-L1079 PolarHBondContact O-N 3.26Å
1076	W	42	Very low	40.6	Very low	96 Å²	96	88.9 Å²	88.9	36%	0.364	51%	0.506	S	S	.	.	H	α-helix	trans	-67.9	-36	177.3	-127.6	95.5	0	0	0	112.2	M1070 T1073 L1079 S1080	M1070-W1076 VanDerWaalsContact CG-CD1 3.42Å; M1070-W1076 HydrophobicContact CG-CG 4.35Å; M1070-W1076 VanDerWaalsContact O-CB 3.31Å; M1070-W1076 WeakPolarHBondContact O-CB 3.32Å; T1073-W1076 PolarHBondContact O-N 3.01Å; W1076-L1079 PolarHBondContact O-N 2.87Å; W1076-S1080 WeakPolarHBondContact O-CB 3.49Å; W1076-S1080 PolarHBondContact O-N 3.37Å; W1076-S1080 PolarHBondContact O-OG 3.15Å
1077	K	40.4	Very low	40.2	Very low	118 Å²	118	92.5 Å²	92.5	51%	0.513	52%	0.518	S	S	.	.	H	α-helix	trans	-64.9	-38.4	171.3	-75.1	-179.2	178.1	174.2	0	112.5	T1073 S1080 M1081	T1073-K1077 PolarHBondContact O-N 3.29Å; K1077-S1080 PolarHBondContact O-OG 2.99Å; K1077-M1081 VanDerWaalsContact O-CB 3.28Å; K1077-M1081 WeakPolarHBondContact O-CB 3.41Å; K1077-M1081 WeakPolarHBondContact O-CG 3.37Å; K1077-M1081 PolarHBondContact O-N 3.3Å
1078	A	43.2	Very low	39.6	Very low	61 Å²	61	96.7 Å²	96.7	50%	0.504	53%	0.531	S	S	.	.	H	α-helix	trans	-66.9	-40.3	176.7	0	0	0	0	0	112.2	T1074 V1075 N1082	T1074-A1078 WeakPolarHBondContact O-CB 3.48Å; T1074-A1078 PolarHBondContact O-N 2.97Å; V1075-A1078 PolarHBondContact O-N 3.24Å; A1078-N1082 PolarHBondContact O-N 2.97Å
1079	L	39.9	Very low	38.9	Very low	116 Å²	116	100.4 Å²	100.4	61%	0.607	54%	0.542	S	S	*	.	H	α-helix	trans	-71.2	-38.5	177	-72.8	165.2	0	0	0	112.5	V1075 W1076 N1082	V1075-L1079 HydrophobicContact CG1-CD1 4.17Å; V1075-L1079 PolarHBondContact O-N 3.26Å; W1076-L1079 PolarHBondContact O-N 2.87Å; L1079-N1082 PolarHBondContact O-N 3.4Å
1080	S	36.9	Very low	38.2	Very low	51 Å²	51	100.6 Å²	100.6	36%	0.357	55%	0.554	S	S	.	*	H	α-helix	trans	-71.4	-37.3	177.2	76.8	0	0	0	0	112.7	W1076 K1077 N1082 S1083 G1084	W1076-S1080 WeakPolarHBondContact O-CB 3.49Å; W1076-S1080 PolarHBondContact O-N 3.37Å; W1076-S1080 PolarHBondContact O-OG 3.15Å; K1077-S1080 PolarHBondContact O-OG 2.99Å; S1080-N1082 VanDerWaalsContact C-N 3.28Å; S1080-N1082 PolarHBondContact O-N 3.18Å; S1080-S1083 PolarHBondContact O-N 3.48Å; S1080-S1083 VanDerWaalsContact O-N 3.15Å; S1080-S1083 PolarHBondContact O-OG 3.09Å; S1080-G1084 PolarHBondContact O-N 2.9Å
1081	M	36.9	Very low	37.7	Very low	133 Å²	133	105.4 Å²	105.4	66%	0.655	58%	0.579	S	S	*	*	H	α-helix	trans	-64.7	-30.8	175.9	-75.1	-177.7	85.9	0	0	112.7	K1077 S1083 G1084 N1085	K1077-M1081 VanDerWaalsContact O-CB 3.28Å; K1077-M1081 WeakPolarHBondContact O-CB 3.41Å; K1077-M1081 WeakPolarHBondContact O-CG 3.37Å; K1077-M1081 PolarHBondContact O-N 3.3Å; M1081-S1083 VanDerWaalsContact C-N 3.32Å; M1081-S1083 PolarHBondContact O-N 3.14Å; M1081-G1084 PolarHBondContact O-N 3.45Å; M1081-N1085 PolarHBondContact O-N 3.33Å
1082	N	36.4	Very low	37.3	Very low	128 Å²	128	111.1 Å²	111.1	68%	0.684	60%	0.598	S	S	*	*	H	α-helix	trans	-71	-27.2	175.5	-120.1	9.6	0	0	0	112.8	A1078 L1079 S1080	A1078-N1082 PolarHBondContact O-N 2.97Å; L1079-N1082 PolarHBondContact O-N 3.4Å; S1080-N1082 VanDerWaalsContact C-N 3.28Å; S1080-N1082 PolarHBondContact O-N 3.18Å
1083	S	37.1	Very low	36.9	Very low	83 Å²	83	116.2 Å²	116.2	58%	0.58	63%	0.631	S	S	*	*	H	α-helix	trans	-76.7	-30.2	175.6	79.3	0	0	0	0	113.4	S1080 M1081	S1080-S1083 PolarHBondContact O-N 3.48Å; S1080-S1083 VanDerWaalsContact O-N 3.15Å; S1080-S1083 PolarHBondContact O-OG 3.09Å; M1081-S1083 VanDerWaalsContact C-N 3.32Å; M1081-S1083 PolarHBondContact O-N 3.14Å
1084	G	30.6	Very low	36.2	Very low	42 Å²	42	119 Å²	119	43%	0.433	64%	0.644	S	S	.	*	H	α-helix	trans	-73.6	-37.4	179.8	0	0	0	0	0	113.6	S1080 M1081 A1086 K1087	S1080-G1084 PolarHBondContact O-N 2.9Å; M1081-G1084 PolarHBondContact O-N 3.45Å; G1084-A1086 PolarHBondContact O-N 3.47Å; G1084-K1087 PolarHBondContact O-N 3.36Å
1085	N	32.3	Very low	36.1	Very low	100 Å²	100	118.9 Å²	118.9	54%	0.535	64%	0.639	S	S	.	*	H	α-helix	trans	-70.2	-15.1	-177.7	-86.4	-14.7	0	0	0	114.5	M1081	M1081-N1085 PolarHBondContact O-N 3.33Å
1086	A	33.2	Very low	35.8	Very low	74 Å²	74	120.2 Å²	120.2	61%	0.612	64%	0.642	S	S	*	*	H	α-helix	trans	-77.9	-28.9	176	0	0	0	0	0	112.6	G1084	G1084-A1086 PolarHBondContact O-N 3.47Å
1087	K	34.5	Very low	35.4	Very low	176 Å²	176	121.6 Å²	121.6	77%	0.765	66%	0.659	S	S	*	*	H	α-helix	trans	-79.7	-33.3	179.4	-83.9	-178.1	175.4	176.5	0	113.1	G1084 S1090	G1084-K1087 PolarHBondContact O-N 3.36Å; K1087-S1090 PolarHBondContact O-OG 3.08Å
1088	E	32.4	Very low	35.1	Very low	151 Å²	151	121.9 Å²	121.9	71%	0.706	67%	0.668	S	S	*	*	H	α-helix	trans	-75.5	-23.4	-179.3	-98.5	179.7	169.1	0	0	114.4	S1090	E1088-S1090 VanDerWaalsContact C-N 3.29Å; E1088-S1090 PolarHBondContact O-N 3.44Å
1089	K	31.2	Very low	34.6	Very low	177 Å²	177	125.9 Å²	125.9	77%	0.77	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-8.1	176.7	-83.5	-176.2	176.4	178.6	0	114.9
1090	S	31.7	Very low	34.2	Very low	94 Å²	94	126.6 Å²	126.6	66%	0.657	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-4.4	178.2	69.6	0	0	0	0	114.5	K1087 E1088	K1087-S1090 PolarHBondContact O-OG 3.08Å; E1088-S1090 VanDerWaalsContact C-N 3.29Å; E1088-S1090 PolarHBondContact O-N 3.44Å
1091	L	33.9	Very low	34	Very low	146 Å²	146	132.5 Å²	132.5	76%	0.764	71%	0.709	S	S	*	*	S	Bend	trans	-105.1	2.1	178.9	-99.7	151.7	0	0	0	114
1092	F	37.8	Very low	33.7	Very low	186 Å²	186	132.4 Å²	132.4	82%	0.816	71%	0.714	S	S	*	*			trans	-139	72.5	167.3	-83.6	-82.3	0	0	0	110
1093	N	34.1	Very low	33.5	Very low	232 Å²	232	132.8 Å²	132.8	100%	1.241	72%	0.716	S	S	*	*			trans	-166.5	0	142.9	-103.6	-8.2	0	0	0	109.9

Retrieved 1,093 of 1,093 residues in 4641.5 ms (Link to these results)

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